NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
522557 |
2lc1   |
17586 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 GLY 1 1HT GLY 1 -4.847 -11.403 -7.820
2 H2 GLY 1 2HT GLY 1 -5.801 -11.219 -6.425
3 H3 GLY 1 3HT GLY 1 -5.890 -10.078 -7.648
4 HA2 GLY 1 1HA GLY 1 -6.862 -11.704 -9.125
5 HA3 GLY 1 2HA GLY 1 -6.767 -12.882 -7.817
6 H HIS 2 H HIS 2 -9.213 -12.478 -8.773
7 HA HIS 2 HA HIS 2 -10.428 -10.527 -6.977
8 HB2 HIS 2 2HB HIS 2 -12.418 -10.553 -8.476
9 HB3 HIS 2 1HB HIS 2 -10.961 -9.986 -9.266
10 HD1 HIS 2 1HD HIS 2 -13.786 -12.093 -9.910
11 HD2 HIS 2 2HD HIS 2 -9.742 -12.223 -10.852
12 HE1 HIS 2 1HE HIS 2 -13.587 -13.610 -11.890
13 H GLY 3 H GLY 3 -12.866 -11.281 -6.524
14 HA2 GLY 3 2HA GLY 3 -14.221 -13.017 -5.683
15 HA3 GLY 3 1HA GLY 3 -12.844 -14.112 -5.795
16 H SER 4 H SER 4 -10.920 -13.205 -4.485
17 HA SER 4 HA SER 4 -11.795 -12.215 -1.876
18 HB2 SER 4 2HB SER 4 -9.834 -14.481 -2.344
19 HB3 SER 4 1HB SER 4 -10.355 -13.842 -0.784
20 HG SER 4 HG SER 4 -11.405 -15.834 -1.631
21 H ALA 5 H ALA 5 -10.248 -10.849 -0.932
22 HA ALA 5 HA ALA 5 -7.880 -10.267 -2.571
23 HB1 ALA 5 1HB ALA 5 -9.469 -8.419 -2.569
24 HB2 ALA 5 2HB ALA 5 -8.010 -7.979 -1.678
25 HB3 ALA 5 3HB ALA 5 -9.481 -8.420 -0.808
26 H GLY 6 H GLY 6 -6.021 -9.546 -1.356
27 HA2 GLY 6 2HA GLY 6 -5.826 -10.916 1.211
28 HA3 GLY 6 1HA GLY 6 -4.481 -10.340 0.229
29 H THR 7 H THR 7 -3.477 -9.141 1.794
30 HA THR 7 HA THR 7 -4.688 -7.388 3.586
31 HB THR 7 HB THR 7 -1.935 -7.221 2.342
32 HG1 THR 7 1HG THR 7 -2.911 -8.723 4.553
33 HG21 THR 7 3HG2 THR 7 -1.302 -6.196 4.491
34 HG22 THR 7 1HG2 THR 7 -2.986 -6.274 5.023
35 HG23 THR 7 2HG2 THR 7 -2.526 -5.256 3.646
36 H SER 8 H SER 8 -5.833 -5.648 3.047
37 HA SER 8 HA SER 8 -5.204 -4.257 0.547
38 HB2 SER 8 2HB SER 8 -7.611 -3.944 2.338
39 HB3 SER 8 1HB SER 8 -7.436 -3.409 0.667
40 HG SER 8 HG SER 8 -6.965 -6.097 1.080
41 H VAL 9 H VAL 9 -3.924 -2.516 0.792
42 HA VAL 9 HA VAL 9 -3.873 -1.215 3.413
43 HB VAL 9 HB VAL 9 -1.956 -0.812 1.106
44 HG11 VAL 9 1HG1 VAL 9 -0.507 0.231 2.801
45 HG12 VAL 9 2HG1 VAL 9 -1.764 -0.004 4.012
46 HG13 VAL 9 3HG1 VAL 9 -2.046 1.078 2.647
47 HG21 VAL 9 3HG2 VAL 9 -1.650 -2.544 3.561
48 HG22 VAL 9 1HG2 VAL 9 -0.371 -2.191 2.399
49 HG23 VAL 9 2HG2 VAL 9 -1.795 -3.094 1.894
50 H THR 10 H THR 10 -5.146 0.389 3.625
51 HA THR 10 HA THR 10 -5.917 1.976 1.296
52 HB THR 10 HB THR 10 -7.335 1.803 3.966
53 HG1 THR 10 1HG THR 10 -7.969 -0.055 3.370
54 HG21 THR 10 3HG2 THR 10 -9.242 2.641 2.666
55 HG22 THR 10 1HG2 THR 10 -8.246 2.658 1.211
56 HG23 THR 10 2HG2 THR 10 -7.869 3.738 2.552
57 H LEU 11 H LEU 11 -5.166 3.957 1.265
58 HA LEU 11 HA LEU 11 -3.838 5.083 3.585
59 HB2 LEU 11 2HB LEU 11 -4.171 6.232 0.830
60 HB3 LEU 11 1HB LEU 11 -3.024 6.726 2.054
61 HG LEU 11 HG LEU 11 -3.076 4.135 0.651
62 HD11 LEU 11 1HD1 LEU 11 -2.453 6.002 -0.843
63 HD12 LEU 11 2HD1 LEU 11 -1.036 5.001 -0.538
64 HD13 LEU 11 3HD1 LEU 11 -1.231 6.534 0.311
65 HD21 LEU 11 3HD2 LEU 11 -0.814 3.773 1.599
66 HD22 LEU 11 1HD2 LEU 11 -2.060 3.903 2.838
67 HD23 LEU 11 2HD2 LEU 11 -0.980 5.266 2.511
68 H GLN 12 H GLN 12 -5.086 6.143 4.857
69 HA GLN 12 HA GLN 12 -7.443 7.505 3.811
70 HB2 GLN 12 2HB GLN 12 -7.775 6.234 5.895
71 HB3 GLN 12 1HB GLN 12 -6.540 7.207 6.681
72 HG2 GLN 12 2HG GLN 12 -7.838 9.183 6.501
73 HG3 GLN 12 1HG GLN 12 -9.014 8.382 5.472
74 HE21 GLN 12 1HE2 GLN 12 -10.623 8.917 6.751
75 HE22 GLN 12 2HE2 GLN 12 -10.929 8.194 8.299
76 H LEU 13 H LEU 13 -7.317 9.483 3.240
77 HA LEU 13 HA LEU 13 -4.908 10.975 4.007
78 HB2 LEU 13 2HB LEU 13 -4.792 10.309 1.721
79 HB3 LEU 13 1HB LEU 13 -6.432 10.840 1.422
80 HG LEU 13 HG LEU 13 -5.700 13.151 1.866
81 HD11 LEU 13 1HD1 LEU 13 -3.714 12.757 3.163
82 HD12 LEU 13 2HD1 LEU 13 -3.313 13.681 1.716
83 HD13 LEU 13 3HD1 LEU 13 -2.929 11.963 1.794
84 HD21 LEU 13 3HD2 LEU 13 -4.605 13.461 -0.315
85 HD22 LEU 13 1HD2 LEU 13 -5.991 12.373 -0.386
86 HD23 LEU 13 2HD2 LEU 13 -4.354 11.713 -0.413
87 H ASP 14 H ASP 14 -5.268 12.929 4.938
88 HA ASP 14 HA ASP 14 -8.010 13.816 4.974
89 HB2 ASP 14 2HB ASP 14 -6.880 13.959 7.126
90 HB3 ASP 14 1HB ASP 14 -5.583 14.919 6.410
91 H ASP 15 H ASP 15 -8.420 14.511 3.104
92 HA ASP 15 HA ASP 15 -6.762 16.434 1.763
93 HB2 ASP 15 2HB ASP 15 -8.567 16.356 0.053
94 HB3 ASP 15 1HB ASP 15 -8.013 14.737 0.485
95 H GLY 16 H GLY 16 -9.077 16.309 4.131
96 HA2 GLY 16 2HA GLY 16 -9.647 18.577 5.074
97 HA3 GLY 16 1HA GLY 16 -10.393 18.839 3.490
98 H SER 17 H SER 17 -11.275 16.250 3.021
99 HA SER 17 HA SER 17 -13.408 16.068 4.993
100 HB2 SER 17 2HB SER 17 -14.593 14.677 3.258
101 HB3 SER 17 1HB SER 17 -14.242 16.315 2.721
102 HG SER 17 HG SER 17 -12.311 15.325 1.650
103 H GLY 18 H GLY 18 -11.195 13.938 3.162
104 HA2 GLY 18 2HA GLY 18 -9.937 12.362 4.556
105 HA3 GLY 18 1HA GLY 18 -11.491 11.963 5.304
106 H ARG 19 H ARG 19 -9.565 11.733 2.447
107 HA ARG 19 HA ARG 19 -11.582 9.970 1.222
108 HB2 ARG 19 2HB ARG 19 -9.127 11.201 -0.027
109 HB3 ARG 19 1HB ARG 19 -10.278 10.142 -0.821
110 HG2 ARG 19 2HG ARG 19 -10.866 12.920 0.237
111 HG3 ARG 19 1HG ARG 19 -10.563 12.514 -1.446
112 HD2 ARG 19 2HD ARG 19 -12.912 12.735 -1.202
113 HD3 ARG 19 1HD ARG 19 -12.589 11.012 -1.335
114 HE ARG 19 HE ARG 19 -12.640 11.637 1.369
115 HH11 ARG 19 1HH1 ARG 19 -14.937 11.705 -1.332
116 HH12 ARG 19 2HH1 ARG 19 -16.287 11.376 -0.335
117 HH21 ARG 19 1HH2 ARG 19 -14.534 11.222 2.707
118 HH22 ARG 19 2HH2 ARG 19 -16.058 11.120 1.942
119 H THR 20 H THR 20 -10.605 8.064 0.036
120 HA THR 20 HA THR 20 -8.291 7.069 1.480
121 HB THR 20 HB THR 20 -9.459 4.804 1.424
122 HG1 THR 20 1HG THR 20 -11.478 4.702 0.832
123 HG21 THR 20 3HG2 THR 20 -10.773 5.282 3.463
124 HG22 THR 20 1HG2 THR 20 -10.662 7.004 3.088
125 HG23 THR 20 2HG2 THR 20 -9.202 6.093 3.491
126 H TYR 21 H TYR 21 -6.862 5.963 0.285
127 HA TYR 21 HA TYR 21 -7.552 5.276 -2.488
128 HB2 TYR 21 2HB TYR 21 -6.232 7.385 -2.455
129 HB3 TYR 21 1HB TYR 21 -4.994 6.569 -1.511
130 HD1 TYR 21 2HD TYR 21 -6.586 6.750 -4.834
131 HD2 TYR 21 1HD TYR 21 -3.342 5.190 -2.570
132 HE1 TYR 21 2HE TYR 21 -5.437 6.108 -6.921
133 HE2 TYR 21 1HE TYR 21 -2.185 4.556 -4.647
134 HH TYR 21 HH TYR 21 -3.014 5.777 -7.589
135 H GLN 22 H GLN 22 -7.099 3.169 -2.812
136 HA GLN 22 HA GLN 22 -5.505 1.853 -0.761
137 HB2 GLN 22 2HB GLN 22 -7.744 0.921 -1.458
138 HB3 GLN 22 1HB GLN 22 -7.033 0.553 -3.024
139 HG2 GLN 22 2HG GLN 22 -5.409 -0.913 -1.949
140 HG3 GLN 22 1HG GLN 22 -6.112 -0.544 -0.376
141 HE21 GLN 22 1HE2 GLN 22 -6.433 -2.295 -3.303
142 HE22 GLN 22 2HE2 GLN 22 -7.820 -3.212 -2.829
143 H LEU 23 H LEU 23 -3.624 0.855 -1.166
144 HA LEU 23 HA LEU 23 -2.038 1.821 -3.292
145 HB2 LEU 23 2HB LEU 23 -1.585 -0.450 -1.382
146 HB3 LEU 23 1HB LEU 23 -0.386 0.112 -2.519
147 HG LEU 23 HG LEU 23 -1.563 1.730 -0.260
148 HD11 LEU 23 1HD1 LEU 23 0.639 1.521 0.732
149 HD12 LEU 23 2HD1 LEU 23 1.172 0.523 -0.617
150 HD13 LEU 23 3HD1 LEU 23 -0.072 -0.072 0.481
151 HD21 LEU 23 3HD2 LEU 23 0.591 2.380 -2.274
152 HD22 LEU 23 1HD2 LEU 23 0.227 3.330 -0.832
153 HD23 LEU 23 2HD2 LEU 23 -0.977 3.172 -2.105
154 H ARG 24 H ARG 24 -1.607 1.068 -5.229
155 HA ARG 24 HA ARG 24 -2.966 -1.296 -6.196
156 HB2 ARG 24 2HB ARG 24 -0.919 0.402 -7.629
157 HB3 ARG 24 1HB ARG 24 -2.132 -0.646 -8.341
158 HG2 ARG 24 2HG ARG 24 -3.889 0.897 -7.633
159 HG3 ARG 24 1HG ARG 24 -2.673 1.947 -6.896
160 HD2 ARG 24 2HD ARG 24 -1.568 2.079 -9.144
161 HD3 ARG 24 1HD ARG 24 -2.968 1.238 -9.796
162 HE ARG 24 HE ARG 24 -3.280 3.761 -8.369
163 HH11 ARG 24 1HH1 ARG 24 -3.698 1.839 -11.327
164 HH12 ARG 24 2HH1 ARG 24 -4.490 3.066 -12.200
165 HH21 ARG 24 1HH2 ARG 24 -4.314 5.511 -9.641
166 HH22 ARG 24 2HH2 ARG 24 -4.821 5.182 -11.227
167 H GLU 25 H GLU 25 -1.676 -3.070 -7.171
168 HA GLU 25 HA GLU 25 0.650 -3.575 -5.597
169 HB2 GLU 25 2HB GLU 25 0.768 -5.773 -6.873
170 HB3 GLU 25 1HB GLU 25 -0.682 -5.530 -5.927
171 HG2 GLU 25 2HG GLU 25 -0.549 -5.037 -8.891
172 HG3 GLU 25 1HG GLU 25 -0.978 -6.594 -8.185
173 H GLY 26 H GLY 26 2.546 -3.006 -6.050
174 HA2 GLY 26 2HA GLY 26 4.316 -2.955 -7.832
175 HA3 GLY 26 1HA GLY 26 3.139 -1.974 -8.729
176 H SER 27 H SER 27 4.839 -0.204 -8.527
177 HA SER 27 HA SER 27 4.623 0.777 -5.828
178 HB2 SER 27 2HB SER 27 6.627 2.197 -6.315
179 HB3 SER 27 1HB SER 27 6.909 0.463 -6.333
180 HG SER 27 HG SER 27 7.384 2.197 -8.253
181 H ASN 28 H ASN 28 3.841 2.605 -5.316
182 HA ASN 28 HA ASN 28 2.278 3.999 -7.362
183 HB2 ASN 28 2HB ASN 28 1.921 3.818 -4.344
184 HB3 ASN 28 1HB ASN 28 0.859 4.691 -5.441
185 HD21 ASN 28 1HD2 ASN 28 1.926 1.520 -4.407
186 HD22 ASN 28 2HD2 ASN 28 0.629 0.615 -5.083
187 H ILE 29 H ILE 29 3.326 5.770 -7.973
188 HA ILE 29 HA ILE 29 5.116 7.114 -6.102
189 HB ILE 29 HB ILE 29 4.730 7.552 -9.080
190 HG12 ILE 29 2HG1 ILE 29 6.935 6.134 -7.564
191 HG13 ILE 29 1HG1 ILE 29 5.684 5.351 -8.520
192 HG21 ILE 29 1HG2 ILE 29 6.786 8.869 -8.962
193 HG22 ILE 29 2HG2 ILE 29 6.843 8.651 -7.213
194 HG23 ILE 29 3HG2 ILE 29 5.531 9.577 -7.944
195 HD11 ILE 29 3HD1 ILE 29 6.555 6.432 -10.526
196 HD12 ILE 29 1HD1 ILE 29 7.780 5.446 -9.724
197 HD13 ILE 29 2HD1 ILE 29 7.817 7.200 -9.556
198 H ILE 30 H ILE 30 4.492 8.832 -5.056
199 HA ILE 30 HA ILE 30 2.110 10.289 -5.906
200 HB ILE 30 HB ILE 30 3.404 9.981 -3.166
201 HG12 ILE 30 2HG1 ILE 30 0.699 9.048 -4.153
202 HG13 ILE 30 1HG1 ILE 30 2.109 8.014 -3.966
203 HG21 ILE 30 1HG2 ILE 30 2.621 12.181 -3.256
204 HG22 ILE 30 2HG2 ILE 30 1.475 11.248 -2.286
205 HG23 ILE 30 3HG2 ILE 30 1.088 11.692 -3.946
206 HD11 ILE 30 3HD1 ILE 30 2.087 8.436 -1.564
207 HD12 ILE 30 1HD1 ILE 30 0.551 7.768 -2.114
208 HD13 ILE 30 2HD1 ILE 30 0.685 9.491 -1.756
209 H GLY 31 H GLY 31 2.358 12.348 -6.542
210 HA2 GLY 31 2HA GLY 31 3.831 14.324 -5.408
211 HA3 GLY 31 1HA GLY 31 4.927 13.591 -6.587
212 H ARG 32 H ARG 32 4.601 15.965 -7.295
213 HA ARG 32 HA ARG 32 2.255 16.009 -9.084
214 HB2 ARG 32 2HB ARG 32 4.036 18.316 -8.302
215 HB3 ARG 32 1HB ARG 32 2.591 18.411 -9.296
216 HG2 ARG 32 2HG ARG 32 1.284 17.590 -7.345
217 HG3 ARG 32 1HG ARG 32 2.760 17.682 -6.400
218 HD2 ARG 32 2HD ARG 32 1.459 19.690 -6.047
219 HD3 ARG 32 1HD ARG 32 2.958 20.067 -6.885
220 HE ARG 32 HE ARG 32 1.638 20.188 -8.958
221 HH11 ARG 32 1HH1 ARG 32 -0.095 20.500 -5.888
222 HH12 ARG 32 2HH1 ARG 32 -1.348 21.446 -6.537
223 HH21 ARG 32 1HH2 ARG 32 -0.112 21.523 -9.831
224 HH22 ARG 32 2HH2 ARG 32 -1.348 22.055 -8.782
225 H GLY 33 H GLY 33 2.849 15.032 -10.875
226 HA2 GLY 33 2HA GLY 33 4.437 16.308 -12.722
227 HA3 GLY 33 1HA GLY 33 5.394 15.032 -11.946
228 H GLN 34 H GLN 34 4.824 14.900 -14.593
229 HA GLN 34 HA GLN 34 2.624 13.050 -14.999
230 HB2 GLN 34 2HB GLN 34 3.540 12.816 -17.287
231 HB3 GLN 34 1HB GLN 34 3.372 14.512 -16.848
232 HG2 GLN 34 2HG GLN 34 5.751 14.673 -16.419
233 HG3 GLN 34 1HG GLN 34 5.939 12.950 -16.705
234 HE21 GLN 34 1HE2 GLN 34 5.435 16.048 -18.152
235 HE22 GLN 34 2HE2 GLN 34 5.747 15.535 -19.770
236 H ASP 35 H ASP 35 5.707 13.076 -13.883
237 HA ASP 35 HA ASP 35 6.553 10.374 -14.434
238 HB2 ASP 35 2HB ASP 35 8.070 12.356 -14.348
239 HB3 ASP 35 1HB ASP 35 7.672 12.548 -12.655
240 H ALA 36 H ALA 36 4.413 11.809 -12.392
241 HA ALA 36 HA ALA 36 4.727 9.852 -10.220
242 HB1 ALA 36 1HB ALA 36 3.309 11.348 -8.902
243 HB2 ALA 36 2HB ALA 36 3.196 12.450 -10.276
244 HB3 ALA 36 3HB ALA 36 4.749 12.187 -9.482
245 H GLN 37 H GLN 37 2.884 8.672 -9.591
246 HA GLN 37 HA GLN 37 0.986 8.260 -11.754
247 HB2 GLN 37 2HB GLN 37 1.632 6.650 -9.293
248 HB3 GLN 37 1HB GLN 37 0.433 6.202 -10.494
249 HG2 GLN 37 2HG GLN 37 3.399 6.485 -10.927
250 HG3 GLN 37 1HG GLN 37 2.480 4.983 -10.875
251 HE21 GLN 37 1HE2 GLN 37 4.146 6.087 -12.997
252 HE22 GLN 37 2HE2 GLN 37 3.112 6.202 -14.373
253 H PHE 38 H PHE 38 1.173 9.226 -8.425
254 HA PHE 38 HA PHE 38 -1.699 9.819 -8.441
255 HB2 PHE 38 2HB PHE 38 -1.091 8.060 -6.808
256 HB3 PHE 38 1HB PHE 38 0.140 9.112 -6.139
257 HD1 PHE 38 2HD PHE 38 -3.464 8.474 -6.384
258 HD2 PHE 38 1HD PHE 38 -0.446 10.872 -4.626
259 HE1 PHE 38 2HE PHE 38 -5.087 9.305 -4.728
260 HE2 PHE 38 1HE PHE 38 -1.987 11.683 -2.979
261 HZ PHE 38 HZ PHE 38 -4.367 10.919 -3.008
262 H ARG 39 H ARG 39 -2.121 11.928 -8.271
263 HA ARG 39 HA ARG 39 0.195 13.653 -7.842
264 HB2 ARG 39 2HB ARG 39 -2.192 13.994 -9.633
265 HB3 ARG 39 1HB ARG 39 -1.279 15.389 -9.103
266 HG2 ARG 39 2HG ARG 39 -0.517 14.750 -11.289
267 HG3 ARG 39 1HG ARG 39 0.756 14.406 -10.130
268 HD2 ARG 39 2HD ARG 39 0.634 12.591 -11.696
269 HD3 ARG 39 1HD ARG 39 0.039 12.017 -10.146
270 HE ARG 39 HE ARG 39 -2.249 12.610 -11.237
271 HH11 ARG 39 1HH1 ARG 39 0.537 10.968 -12.778
272 HH12 ARG 39 2HH1 ARG 39 -0.393 10.197 -13.952
273 HH21 ARG 39 1HH2 ARG 39 -3.537 11.503 -12.895
274 HH22 ARG 39 2HH2 ARG 39 -2.730 10.544 -14.049
275 H LEU 40 H LEU 40 0.222 15.104 -6.329
276 HA LEU 40 HA LEU 40 -1.972 15.095 -4.487
277 HB2 LEU 40 2HB LEU 40 0.802 16.206 -4.301
278 HB3 LEU 40 1HB LEU 40 -0.413 16.591 -3.099
279 HG LEU 40 HG LEU 40 0.608 13.820 -3.743
280 HD11 LEU 40 1HD1 LEU 40 1.049 15.604 -1.355
281 HD12 LEU 40 2HD1 LEU 40 2.257 15.169 -2.566
282 HD13 LEU 40 3HD1 LEU 40 1.584 13.934 -1.508
283 HD21 LEU 40 3HD2 LEU 40 -1.729 13.771 -3.027
284 HD22 LEU 40 1HD2 LEU 40 -1.321 14.763 -1.625
285 HD23 LEU 40 2HD2 LEU 40 -0.668 13.133 -1.773
286 HA PRO 41 HA PRO 41 -3.821 18.874 -5.739
287 HB2 PRO 41 2HB PRO 41 -4.651 19.356 -2.974
288 HB3 PRO 41 1HB PRO 41 -5.640 18.982 -4.384
289 HG2 PRO 41 2HG PRO 41 -5.294 17.209 -2.403
290 HG3 PRO 41 1HG PRO 41 -5.414 16.701 -4.097
291 HD2 PRO 41 2HD PRO 41 -2.974 17.039 -2.397
292 HD3 PRO 41 1HD PRO 41 -3.410 15.720 -3.500
293 H ASP 42 H ASP 42 -1.704 19.097 -2.856
294 HA ASP 42 HA ASP 42 -1.739 22.026 -3.114
295 HB2 ASP 42 2HB ASP 42 -1.892 20.693 -0.822
296 HB3 ASP 42 1HB ASP 42 -0.148 20.563 -1.026
297 H THR 43 H THR 43 0.734 22.807 -2.441
298 HA THR 43 HA THR 43 2.345 21.526 -4.500
299 HB THR 43 HB THR 43 1.408 23.672 -5.310
300 HG1 THR 43 1HG THR 43 3.212 23.970 -6.384
301 HG21 THR 43 3HG2 THR 43 2.280 25.804 -4.395
302 HG22 THR 43 1HG2 THR 43 3.086 24.902 -3.113
303 HG23 THR 43 2HG2 THR 43 1.324 24.915 -3.205
304 H GLY 44 H GLY 44 4.706 22.425 -4.263
305 HA2 GLY 44 2HA GLY 44 6.572 22.626 -2.780
306 HA3 GLY 44 1HA GLY 44 5.494 22.253 -1.429
307 H VAL 45 H VAL 45 4.521 20.328 -3.612
308 HA VAL 45 HA VAL 45 5.888 17.968 -2.652
309 HB VAL 45 HB VAL 45 3.523 18.350 -4.529
310 HG11 VAL 45 1HG1 VAL 45 4.695 16.242 -4.887
311 HG12 VAL 45 2HG1 VAL 45 3.072 16.021 -4.254
312 HG13 VAL 45 3HG1 VAL 45 4.470 15.833 -3.184
313 HG21 VAL 45 3HG2 VAL 45 2.155 17.642 -2.669
314 HG22 VAL 45 1HG2 VAL 45 3.029 19.130 -2.287
315 HG23 VAL 45 2HG2 VAL 45 3.581 17.584 -1.626
316 H SER 46 H SER 46 7.441 17.000 -3.867
317 HA SER 46 HA SER 46 8.288 18.133 -6.355
318 HB2 SER 46 2HB SER 46 9.157 15.584 -4.988
319 HB3 SER 46 1HB SER 46 10.063 16.518 -6.183
320 HG SER 46 HG SER 46 9.724 18.293 -4.495
321 H ARG 47 H ARG 47 8.693 16.549 -8.280
322 HA ARG 47 HA ARG 47 6.328 15.374 -9.205
323 HB2 ARG 47 2HB ARG 47 7.719 14.235 -10.948
324 HB3 ARG 47 1HB ARG 47 8.045 15.951 -10.810
325 HG2 ARG 47 2HG ARG 47 10.067 15.555 -9.624
326 HG3 ARG 47 1HG ARG 47 9.690 13.827 -9.509
327 HD2 ARG 47 2HD ARG 47 9.932 13.595 -11.904
328 HD3 ARG 47 1HD ARG 47 10.218 15.326 -12.070
329 HE ARG 47 HE ARG 47 12.218 14.911 -10.594
330 HH11 ARG 47 1HH1 ARG 47 11.000 12.149 -12.446
331 HH12 ARG 47 2HH1 ARG 47 12.544 11.646 -12.941
332 HH21 ARG 47 1HH2 ARG 47 14.353 14.089 -11.173
333 HH22 ARG 47 2HH2 ARG 47 14.477 12.740 -12.185
334 H ARG 48 H ARG 48 9.128 13.876 -7.752
335 HA ARG 48 HA ARG 48 7.450 11.611 -7.016
336 HB2 ARG 48 2HB ARG 48 10.456 11.679 -7.474
337 HB3 ARG 48 1HB ARG 48 9.556 10.290 -6.885
338 HG2 ARG 48 2HG ARG 48 8.375 10.121 -8.980
339 HG3 ARG 48 1HG ARG 48 9.174 11.560 -9.596
340 HD2 ARG 48 2HD ARG 48 10.255 9.613 -10.496
341 HD3 ARG 48 1HD ARG 48 11.348 10.391 -9.358
342 HE ARG 48 HE ARG 48 10.240 8.561 -7.791
343 HH11 ARG 48 1HH1 ARG 48 11.431 8.211 -11.102
344 HH12 ARG 48 2HH1 ARG 48 11.930 6.605 -10.896
345 HH21 ARG 48 1HH2 ARG 48 10.905 6.355 -7.526
346 HH22 ARG 48 2HH2 ARG 48 11.612 5.524 -8.845
347 H HIS 49 H HIS 49 6.824 12.398 -5.177
348 HA HIS 49 HA HIS 49 8.742 13.716 -3.413
349 HB2 HIS 49 2HB HIS 49 6.689 14.959 -3.862
350 HB3 HIS 49 1HB HIS 49 5.701 13.604 -3.358
351 HD2 HIS 49 2HD HIS 49 5.811 13.077 -0.542
352 HE1 HIS 49 1HE HIS 49 7.122 16.980 0.370
353 HE2 HIS 49 2HE HIS 49 6.640 14.636 1.252
354 H LEU 50 H LEU 50 6.645 10.972 -3.743
355 HA LEU 50 HA LEU 50 8.136 9.538 -1.840
356 HB2 LEU 50 2HB LEU 50 6.857 10.721 -0.244
357 HB3 LEU 50 1HB LEU 50 5.358 10.521 -1.088
358 HG LEU 50 HG LEU 50 6.799 8.123 0.024
359 HD11 LEU 50 1HD1 LEU 50 6.666 9.828 1.823
360 HD12 LEU 50 2HD1 LEU 50 5.570 8.489 2.136
361 HD13 LEU 50 3HD1 LEU 50 4.942 10.013 1.504
362 HD21 LEU 50 3HD2 LEU 50 3.877 8.817 -0.326
363 HD22 LEU 50 1HD2 LEU 50 4.511 7.287 0.276
364 HD23 LEU 50 2HD2 LEU 50 4.822 7.777 -1.392
365 H GLU 51 H GLU 51 7.776 7.365 -2.044
366 HA GLU 51 HA GLU 51 5.703 6.545 -3.915
367 HB2 GLU 51 2HB GLU 51 7.357 5.023 -5.025
368 HB3 GLU 51 1HB GLU 51 7.545 6.727 -5.388
369 HG2 GLU 51 2HG GLU 51 9.368 6.854 -3.759
370 HG3 GLU 51 1HG GLU 51 9.148 5.149 -3.393
371 H ILE 52 H ILE 52 4.940 4.549 -3.618
372 HA ILE 52 HA ILE 52 5.987 3.081 -1.291
373 HB ILE 52 HB ILE 52 3.082 3.328 -2.102
374 HG12 ILE 52 2HG1 ILE 52 4.484 4.516 0.306
375 HG13 ILE 52 1HG1 ILE 52 4.027 5.429 -1.127
376 HG21 ILE 52 1HG2 ILE 52 4.403 2.023 0.275
377 HG22 ILE 52 2HG2 ILE 52 3.671 1.206 -1.100
378 HG23 ILE 52 3HG2 ILE 52 2.656 2.143 0.010
379 HD11 ILE 52 3HD1 ILE 52 1.683 4.984 -0.681
380 HD12 ILE 52 1HD1 ILE 52 2.449 5.753 0.706
381 HD13 ILE 52 2HD1 ILE 52 2.116 4.017 0.727
382 H ARG 53 H ARG 53 6.748 1.180 -1.988
383 HA ARG 53 HA ARG 53 5.566 -0.020 -4.378
384 HB2 ARG 53 2HB ARG 53 8.076 -0.037 -4.104
385 HB3 ARG 53 1HB ARG 53 7.855 -1.136 -2.746
386 HG2 ARG 53 2HG ARG 53 6.659 -2.694 -4.285
387 HG3 ARG 53 1HG ARG 53 7.123 -1.644 -5.620
388 HD2 ARG 53 2HD ARG 53 8.687 -3.426 -5.528
389 HD3 ARG 53 1HD ARG 53 9.508 -1.985 -4.933
390 HE ARG 53 HE ARG 53 8.313 -3.550 -2.854
391 HH11 ARG 53 1HH1 ARG 53 11.234 -3.134 -4.821
392 HH12 ARG 53 2HH1 ARG 53 12.230 -4.024 -3.769
393 HH21 ARG 53 1HH2 ARG 53 9.676 -4.834 -1.450
394 HH22 ARG 53 2HH2 ARG 53 11.314 -5.041 -1.833
395 H TRP 54 H TRP 54 3.880 -1.197 -4.082
396 HA TRP 54 HA TRP 54 3.612 -2.505 -1.539
397 HB2 TRP 54 2HB TRP 54 1.754 -1.095 -1.965
398 HB3 TRP 54 1HB TRP 54 1.612 -1.678 -3.622
399 HD1 TRP 54 HD TRP 54 -0.510 -3.174 -3.824
400 HE1 TRP 54 1HE TRP 54 -1.695 -4.919 -2.341
401 HE3 TRP 54 3HE TRP 54 2.462 -2.941 0.303
402 HZ2 TRP 54 2HZ TRP 54 -1.418 -6.048 0.205
403 HZ3 TRP 54 3HZ TRP 54 1.959 -4.366 2.213
404 HH2 TRP 54 HH TRP 54 0.043 -5.905 2.180
405 H ASP 55 H ASP 55 3.798 -4.609 -1.412
406 HA ASP 55 HA ASP 55 3.436 -6.295 -3.750
407 HB2 ASP 55 2HB ASP 55 5.888 -5.936 -3.494
408 HB3 ASP 55 1HB ASP 55 5.784 -6.434 -1.812
409 H GLY 56 H GLY 56 3.350 -8.669 -2.849
410 HA2 GLY 56 2HA GLY 56 1.126 -8.634 -1.034
411 HA3 GLY 56 1HA GLY 56 1.808 -10.051 -1.797
412 H GLN 57 H GLN 57 2.889 -7.666 0.575
413 HA GLN 57 HA GLN 57 2.779 -9.405 2.782
414 HB2 GLN 57 2HB GLN 57 4.862 -10.346 1.699
415 HB3 GLN 57 1HB GLN 57 5.603 -8.760 1.899
416 HG2 GLN 57 2HG GLN 57 6.355 -10.177 3.676
417 HG3 GLN 57 1HG GLN 57 5.271 -8.953 4.337
418 HE21 GLN 57 1HE2 GLN 57 5.735 -12.286 3.684
419 HE22 GLN 57 2HE2 GLN 57 4.371 -12.882 4.553
420 H VAL 58 H VAL 58 5.016 -6.795 1.754
421 HA VAL 58 HA VAL 58 3.750 -5.118 3.773
422 HB VAL 58 HB VAL 58 5.939 -4.132 4.408
423 HG11 VAL 58 1HG1 VAL 58 5.725 -7.084 4.929
424 HG12 VAL 58 2HG1 VAL 58 4.953 -5.794 5.855
425 HG13 VAL 58 3HG1 VAL 58 6.712 -5.948 5.847
426 HG21 VAL 58 3HG2 VAL 58 8.015 -5.331 3.892
427 HG22 VAL 58 1HG2 VAL 58 7.230 -4.715 2.437
428 HG23 VAL 58 2HG2 VAL 58 7.114 -6.427 2.846
429 H ALA 59 H ALA 59 4.065 -2.898 3.495
430 HA ALA 59 HA ALA 59 4.368 -2.143 0.695
431 HB1 ALA 59 1HB ALA 59 3.107 -0.629 2.960
432 HB2 ALA 59 2HB ALA 59 2.217 -1.604 1.799
433 HB3 ALA 59 3HB ALA 59 3.089 -0.164 1.261
434 H LEU 60 H LEU 60 6.170 -1.374 0.201
435 HA LEU 60 HA LEU 60 8.058 -0.368 2.127
436 HB2 LEU 60 2HB LEU 60 8.749 -1.877 0.326
437 HB3 LEU 60 1HB LEU 60 8.156 -0.746 -0.863
438 HG LEU 60 HG LEU 60 10.467 -0.017 0.942
439 HD11 LEU 60 1HD1 LEU 60 10.990 -2.159 -0.107
440 HD12 LEU 60 2HD1 LEU 60 11.946 -0.858 -0.825
441 HD13 LEU 60 3HD1 LEU 60 10.537 -1.502 -1.677
442 HD21 LEU 60 3HD2 LEU 60 11.072 1.405 -0.967
443 HD22 LEU 60 1HD2 LEU 60 9.434 1.765 -0.411
444 HD23 LEU 60 2HD2 LEU 60 9.674 0.792 -1.857
445 H LEU 61 H LEU 61 7.980 1.654 2.774
446 HA LEU 61 HA LEU 61 6.737 3.711 1.109
447 HB2 LEU 61 2HB LEU 61 5.790 3.263 3.310
448 HB3 LEU 61 1HB LEU 61 7.309 3.499 4.099
449 HG LEU 61 HG LEU 61 5.734 5.331 4.509
450 HD11 LEU 61 1HD1 LEU 61 8.051 5.992 4.539
451 HD12 LEU 61 2HD1 LEU 61 7.047 7.291 3.895
452 HD13 LEU 61 3HD1 LEU 61 8.009 6.297 2.804
453 HD21 LEU 61 3HD2 LEU 61 4.477 5.102 2.427
454 HD22 LEU 61 1HD2 LEU 61 5.803 5.868 1.560
455 HD23 LEU 61 2HD2 LEU 61 4.899 6.764 2.797
456 H ALA 62 H ALA 62 8.138 5.019 0.063
457 HA ALA 62 HA ALA 62 10.707 5.571 1.350
458 HB1 ALA 62 1HB ALA 62 11.742 5.653 -0.861
459 HB2 ALA 62 2HB ALA 62 10.207 5.191 -1.600
460 HB3 ALA 62 3HB ALA 62 11.050 4.067 -0.531
461 H ASP 63 H ASP 63 10.953 7.613 1.786
462 HA ASP 63 HA ASP 63 9.167 9.623 0.657
463 HB2 ASP 63 2HB ASP 63 9.517 9.649 3.079
464 HB3 ASP 63 1HB ASP 63 11.257 9.746 2.850
465 H LEU 64 H LEU 64 9.799 10.971 -0.942
466 HA LEU 64 HA LEU 64 12.650 10.896 -1.685
467 HB2 LEU 64 2HB LEU 64 10.754 9.710 -3.095
468 HB3 LEU 64 1HB LEU 64 10.382 11.328 -3.606
469 HG LEU 64 HG LEU 64 11.618 10.301 -5.294
470 HD11 LEU 64 1HD1 LEU 64 12.240 12.592 -5.019
471 HD12 LEU 64 2HD1 LEU 64 13.641 11.658 -5.543
472 HD13 LEU 64 3HD1 LEU 64 13.493 12.157 -3.856
473 HD21 LEU 64 3HD2 LEU 64 13.853 9.314 -4.987
474 HD22 LEU 64 1HD2 LEU 64 12.602 8.475 -4.071
475 HD23 LEU 64 2HD2 LEU 64 13.710 9.574 -3.249
476 H ASN 65 H ASN 65 12.620 12.769 -0.181
477 HA ASN 65 HA ASN 65 12.798 15.223 -1.444
478 HB2 ASN 65 2HB ASN 65 10.223 15.069 -1.330
479 HB3 ASN 65 1HB ASN 65 10.391 15.056 0.421
480 HD21 ASN 65 1HD2 ASN 65 10.526 16.979 -2.449
481 HD22 ASN 65 2HD2 ASN 65 10.747 18.484 -1.657
482 H SER 66 H SER 66 13.679 16.715 0.138
483 HA SER 66 HA SER 66 14.220 15.345 2.642
484 HB2 SER 66 2HB SER 66 15.935 17.378 1.221
485 HB3 SER 66 1HB SER 66 16.315 16.635 2.779
486 HG SER 66 HG SER 66 16.236 14.599 1.743
487 H THR 67 H THR 67 13.608 18.655 1.398
488 HA THR 67 HA THR 67 13.586 19.759 4.031
489 HB THR 67 HB THR 67 14.269 21.106 2.029
490 HG1 THR 67 1HG THR 67 12.181 22.114 3.693
491 HG21 THR 67 3HG2 THR 67 11.296 21.184 1.411
492 HG22 THR 67 1HG2 THR 67 12.519 20.389 0.432
493 HG23 THR 67 2HG2 THR 67 12.530 22.140 0.596
494 H ASN 68 H ASN 68 11.053 18.670 1.861
495 HA ASN 68 HA ASN 68 9.013 19.494 3.820
496 HB2 ASN 68 2HB ASN 68 9.004 20.692 1.596
497 HB3 ASN 68 1HB ASN 68 8.770 19.135 0.815
498 HD21 ASN 68 1HD2 ASN 68 6.854 19.791 -0.077
499 HD22 ASN 68 2HD2 ASN 68 5.401 19.958 0.842
500 H GLY 69 H GLY 69 10.749 17.180 3.561
501 HA2 GLY 69 2HA GLY 69 9.549 14.964 2.367
502 HA3 GLY 69 1HA GLY 69 10.770 14.917 3.624
503 H THR 70 H THR 70 8.892 13.076 3.448
504 HA THR 70 HA THR 70 6.597 13.649 5.054
505 HB THR 70 HB THR 70 7.599 11.033 3.965
506 HG1 THR 70 1HG THR 70 7.479 12.268 2.244
507 HG21 THR 70 3HG2 THR 70 5.209 10.490 3.935
508 HG22 THR 70 1HG2 THR 70 4.843 12.060 4.644
509 HG23 THR 70 2HG2 THR 70 5.765 10.875 5.565
510 H THR 71 H THR 71 6.221 12.910 7.093
511 HA THR 71 HA THR 71 8.395 11.558 8.510
512 HB THR 71 HB THR 71 7.058 12.404 10.541
513 HG1 THR 71 1HG THR 71 6.244 14.444 8.771
514 HG21 THR 71 3HG2 THR 71 9.232 13.192 10.006
515 HG22 THR 71 1HG2 THR 71 8.225 14.566 10.477
516 HG23 THR 71 2HG2 THR 71 8.589 14.272 8.758
517 H VAL 72 H VAL 72 7.946 9.719 9.611
518 HA VAL 72 HA VAL 72 5.207 8.718 9.430
519 HB VAL 72 HB VAL 72 6.141 6.391 9.432
520 HG11 VAL 72 1HG1 VAL 72 7.116 6.383 7.208
521 HG12 VAL 72 2HG1 VAL 72 7.370 8.127 7.312
522 HG13 VAL 72 3HG1 VAL 72 5.734 7.479 7.288
523 HG21 VAL 72 3HG2 VAL 72 8.191 6.865 10.699
524 HG22 VAL 72 1HG2 VAL 72 8.817 7.784 9.334
525 HG23 VAL 72 2HG2 VAL 72 8.557 6.042 9.182
526 H ASN 73 H ASN 73 4.262 8.536 11.237
527 HA ASN 73 HA ASN 73 3.750 8.658 13.427
528 HB2 ASN 73 2HB ASN 73 5.805 6.718 13.254
529 HB3 ASN 73 1HB ASN 73 6.167 7.704 14.669
530 HD21 ASN 73 1HD2 ASN 73 3.908 5.616 13.165
531 HD22 ASN 73 2HD2 ASN 73 2.984 5.212 14.570
532 H ASN 74 H ASN 74 5.255 10.710 12.036
533 HA ASN 74 HA ASN 74 5.892 12.808 12.354
534 HB2 ASN 74 2HB ASN 74 5.707 12.219 15.312
535 HB3 ASN 74 1HB ASN 74 6.279 13.763 14.701
536 HD21 ASN 74 1HD2 ASN 74 3.559 11.717 15.200
537 HD22 ASN 74 2HD2 ASN 74 2.345 12.856 14.767
538 H ALA 75 H ALA 75 7.700 10.235 12.634
539 HA ALA 75 HA ALA 75 10.135 11.701 13.279
540 HB1 ALA 75 1HB ALA 75 9.690 8.744 12.838
541 HB2 ALA 75 2HB ALA 75 9.816 9.541 14.404
542 HB3 ALA 75 3HB ALA 75 11.209 9.493 13.324
543 HA PRO 76 HA PRO 76 10.800 12.038 8.855
544 HB2 PRO 76 2HB PRO 76 13.351 13.012 8.985
545 HB3 PRO 76 1HB PRO 76 11.915 14.010 9.236
546 HG2 PRO 76 2HG PRO 76 13.773 12.822 11.250
547 HG3 PRO 76 1HG PRO 76 12.968 14.398 11.258
548 HD2 PRO 76 2HD PRO 76 12.124 12.260 12.724
549 HD3 PRO 76 1HD PRO 76 11.040 13.541 12.149
550 H VAL 77 H VAL 77 11.374 10.461 7.498
551 HA VAL 77 HA VAL 77 13.776 8.889 7.976
552 HB VAL 77 HB VAL 77 12.606 6.771 7.465
553 HG11 VAL 77 1HG1 VAL 77 11.442 6.408 9.598
554 HG12 VAL 77 2HG1 VAL 77 11.450 8.148 9.884
555 HG13 VAL 77 3HG1 VAL 77 12.970 7.262 9.811
556 HG21 VAL 77 3HG2 VAL 77 10.724 7.576 6.210
557 HG22 VAL 77 1HG2 VAL 77 10.107 8.442 7.619
558 HG23 VAL 77 2HG2 VAL 77 10.124 6.686 7.614
559 H GLN 78 H GLN 78 14.269 7.620 6.011
560 HA GLN 78 HA GLN 78 13.296 8.976 3.580
561 HB2 GLN 78 2HB GLN 78 15.616 7.090 3.952
562 HB3 GLN 78 1HB GLN 78 15.262 8.044 2.523
563 HG2 GLN 78 2HG GLN 78 15.776 10.072 3.682
564 HG3 GLN 78 1HG GLN 78 15.976 9.204 5.202
565 HE21 GLN 78 1HE2 GLN 78 17.376 6.934 3.912
566 HE22 GLN 78 2HE2 GLN 78 18.938 7.534 3.521
567 H GLU 79 H GLU 79 13.621 6.009 5.304
568 HA GLU 79 HA GLU 79 12.052 4.559 3.361
569 HB2 GLU 79 2HB GLU 79 13.565 2.612 3.715
570 HB3 GLU 79 1HB GLU 79 14.338 3.962 2.909
571 HG2 GLU 79 2HG GLU 79 14.677 3.188 5.827
572 HG3 GLU 79 1HG GLU 79 15.825 2.843 4.543
573 H TRP 80 H TRP 80 10.451 3.429 4.251
574 HA TRP 80 HA TRP 80 10.504 2.515 6.980
575 HB2 TRP 80 2HB TRP 80 9.743 4.786 7.300
576 HB3 TRP 80 1HB TRP 80 8.474 4.680 6.104
577 HD1 TRP 80 HD TRP 80 6.222 3.558 6.852
578 HE1 TRP 80 1HE TRP 80 5.317 2.939 9.187
579 HE3 TRP 80 3HE TRP 80 10.551 3.891 9.529
580 HZ2 TRP 80 2HZ TRP 80 6.288 2.642 11.758
581 HZ3 TRP 80 3HZ TRP 80 10.470 3.426 11.941
582 HH2 TRP 80 HH TRP 80 8.380 2.825 13.028
583 H GLN 81 H GLN 81 8.824 0.937 7.308
584 HA GLN 81 HA GLN 81 7.442 0.320 4.835
585 HB2 GLN 81 2HB GLN 81 7.469 -2.089 5.431
586 HB3 GLN 81 1HB GLN 81 9.083 -1.433 5.265
587 HG2 GLN 81 2HG GLN 81 9.334 -2.726 7.115
588 HG3 GLN 81 1HG GLN 81 8.900 -1.188 7.863
589 HE21 GLN 81 1HE2 GLN 81 8.103 -2.199 9.697
590 HE22 GLN 81 2HE2 GLN 81 6.623 -3.076 9.689
591 H LEU 82 H LEU 82 5.358 0.253 4.848
592 HA LEU 82 HA LEU 82 4.031 1.742 6.809
593 HB2 LEU 82 2HB LEU 82 2.733 -0.070 4.802
594 HB3 LEU 82 1HB LEU 82 1.970 1.197 5.728
595 HG LEU 82 HG LEU 82 4.013 1.555 3.554
596 HD11 LEU 82 1HD1 LEU 82 1.141 2.434 3.806
597 HD12 LEU 82 2HD1 LEU 82 1.750 1.150 2.763
598 HD13 LEU 82 3HD1 LEU 82 2.224 2.823 2.473
599 HD21 LEU 82 3HD2 LEU 82 3.659 3.982 3.993
600 HD22 LEU 82 1HD2 LEU 82 4.524 3.117 5.272
601 HD23 LEU 82 2HD2 LEU 82 2.822 3.503 5.472
602 H ALA 83 H ALA 83 2.494 1.330 8.306
603 HA ALA 83 HA ALA 83 1.938 -1.409 9.051
604 HB1 ALA 83 1HB ALA 83 3.834 -0.739 10.435
605 HB2 ALA 83 2HB ALA 83 2.369 -0.843 11.419
606 HB3 ALA 83 3HB ALA 83 2.983 0.730 10.905
607 H ASP 84 H ASP 84 -0.055 -1.562 10.090
608 HA ASP 84 HA ASP 84 -1.968 0.379 9.376
609 HB2 ASP 84 2HB ASP 84 -2.603 -1.958 9.593
610 HB3 ASP 84 1HB ASP 84 -2.207 -1.941 11.303
611 H GLY 85 H GLY 85 -2.541 2.128 10.294
612 HA2 GLY 85 2HA GLY 85 -3.273 3.474 11.985
613 HA3 GLY 85 1HA GLY 85 -2.530 2.411 13.164
614 H ASP 86 H ASP 86 -0.391 3.170 10.613
615 HA ASP 86 HA ASP 86 1.112 4.820 12.462
616 HB2 ASP 86 2HB ASP 86 2.069 3.039 10.666
617 HB3 ASP 86 1HB ASP 86 2.102 4.485 9.654
618 H VAL 87 H VAL 87 2.032 6.891 11.697
619 HA VAL 87 HA VAL 87 -0.129 8.396 10.364
620 HB VAL 87 HB VAL 87 1.746 9.409 12.521
621 HG11 VAL 87 1HG1 VAL 87 0.285 11.376 12.586
622 HG12 VAL 87 2HG1 VAL 87 -0.668 10.709 11.261
623 HG13 VAL 87 3HG1 VAL 87 1.014 11.162 10.991
624 HG21 VAL 87 3HG2 VAL 87 -1.173 8.677 12.721
625 HG22 VAL 87 1HG2 VAL 87 -0.203 9.419 13.993
626 HG23 VAL 87 2HG2 VAL 87 0.172 7.787 13.433
627 H ILE 88 H ILE 88 0.533 9.047 8.441
628 HA ILE 88 HA ILE 88 3.371 9.580 8.076
629 HB ILE 88 HB ILE 88 1.209 8.662 6.179
630 HG12 ILE 88 2HG1 ILE 88 3.726 7.358 7.199
631 HG13 ILE 88 1HG1 ILE 88 2.074 6.945 7.624
632 HG21 ILE 88 1HG2 ILE 88 4.078 9.314 5.532
633 HG22 ILE 88 2HG2 ILE 88 2.667 10.226 4.995
634 HG23 ILE 88 3HG2 ILE 88 2.919 8.572 4.429
635 HD11 ILE 88 3HD1 ILE 88 1.668 6.223 5.342
636 HD12 ILE 88 1HD1 ILE 88 3.024 5.367 6.077
637 HD13 ILE 88 2HD1 ILE 88 3.323 6.661 4.914
638 H ARG 89 H ARG 89 3.827 11.722 7.895
639 HA ARG 89 HA ARG 89 1.674 13.455 6.897
640 HB2 ARG 89 2HB ARG 89 3.728 14.183 8.972
641 HB3 ARG 89 1HB ARG 89 2.484 15.245 8.332
642 HG2 ARG 89 2HG ARG 89 0.800 13.676 9.194
643 HG3 ARG 89 1HG ARG 89 2.096 12.783 9.997
644 HD2 ARG 89 2HD ARG 89 1.156 14.286 11.603
645 HD3 ARG 89 1HD ARG 89 2.736 14.925 11.135
646 HE ARG 89 HE ARG 89 0.174 15.929 10.052
647 HH11 ARG 89 1HH1 ARG 89 3.438 16.641 11.255
648 HH12 ARG 89 2HH1 ARG 89 3.261 18.320 11.015
649 HH21 ARG 89 1HH2 ARG 89 -0.036 18.086 9.735
650 HH22 ARG 89 2HH2 ARG 89 1.225 19.198 10.097
651 H LEU 90 H LEU 90 2.102 14.485 5.182
652 HA LEU 90 HA LEU 90 4.830 15.247 4.618
653 HB2 LEU 90 2HB LEU 90 4.383 14.936 2.151
654 HB3 LEU 90 1HB LEU 90 4.584 13.468 3.062
655 HG LEU 90 HG LEU 90 1.851 14.507 2.251
656 HD11 LEU 90 1HD1 LEU 90 3.232 14.165 0.251
657 HD12 LEU 90 2HD1 LEU 90 2.001 12.908 0.397
658 HD13 LEU 90 3HD1 LEU 90 3.675 12.560 0.830
659 HD21 LEU 90 3HD2 LEU 90 1.202 12.176 2.563
660 HD22 LEU 90 1HD2 LEU 90 1.912 12.815 4.046
661 HD23 LEU 90 2HD2 LEU 90 2.858 11.755 2.999
662 H GLY 91 H GLY 91 4.915 17.000 2.974
663 HA2 GLY 91 2HA GLY 91 3.974 19.301 4.020
664 HA3 GLY 91 1HA GLY 91 4.380 19.132 2.330
665 H HIS 92 H HIS 92 1.988 19.624 4.635
666 HA HIS 92 HA HIS 92 -0.081 20.424 4.617
667 HB2 HIS 92 2HB HIS 92 0.248 20.680 1.619
668 HB3 HIS 92 1HB HIS 92 -1.089 21.353 2.545
669 HD1 HIS 92 1HD HIS 92 1.138 22.987 0.853
670 HD2 HIS 92 2HD HIS 92 0.893 22.554 4.978
671 HE1 HIS 92 1HE HIS 92 2.456 24.904 1.857
672 H SER 93 H SER 93 0.557 17.463 3.881
673 HA SER 93 HA SER 93 -2.240 16.773 3.774
674 HB2 SER 93 2HB SER 93 -0.274 15.693 1.771
675 HB3 SER 93 1HB SER 93 -1.930 15.136 1.965
676 HG SER 93 HG SER 93 -1.978 17.753 1.783
677 H GLU 94 H GLU 94 -2.477 15.498 5.427
678 HA GLU 94 HA GLU 94 -0.365 13.576 5.962
679 HB2 GLU 94 2HB GLU 94 -1.231 13.536 8.344
680 HB3 GLU 94 1HB GLU 94 -0.370 14.974 7.828
681 HG2 GLU 94 2HG GLU 94 -2.608 16.033 7.438
682 HG3 GLU 94 1HG GLU 94 -3.315 14.630 8.248
683 H ILE 95 H ILE 95 -0.831 11.494 6.530
684 HA ILE 95 HA ILE 95 -3.474 10.568 5.813
685 HB ILE 95 HB ILE 95 -2.460 10.668 3.702
686 HG12 ILE 95 2HG1 ILE 95 -3.456 8.347 4.212
687 HG13 ILE 95 1HG1 ILE 95 -2.417 8.497 2.801
688 HG21 ILE 95 1HG2 ILE 95 0.058 9.494 4.774
689 HG22 ILE 95 2HG2 ILE 95 -0.236 11.153 4.267
690 HG23 ILE 95 3HG2 ILE 95 -0.259 9.849 3.077
691 HD11 ILE 95 3HD1 ILE 95 -2.021 6.419 4.042
692 HD12 ILE 95 1HD1 ILE 95 -1.596 7.355 5.472
693 HD13 ILE 95 2HD1 ILE 95 -0.584 7.446 4.030
694 H ILE 96 H ILE 96 -4.044 8.617 6.652
695 HA ILE 96 HA ILE 96 -2.211 7.391 8.608
696 HB ILE 96 HB ILE 96 -5.250 7.349 8.549
697 HG12 ILE 96 2HG1 ILE 96 -4.391 9.557 9.121
698 HG13 ILE 96 1HG1 ILE 96 -5.189 8.808 10.505
699 HG21 ILE 96 1HG2 ILE 96 -3.349 6.288 10.644
700 HG22 ILE 96 2HG2 ILE 96 -4.358 5.328 9.559
701 HG23 ILE 96 3HG2 ILE 96 -5.107 6.342 10.791
702 HD11 ILE 96 3HD1 ILE 96 -3.190 9.989 11.189
703 HD12 ILE 96 1HD1 ILE 96 -2.222 9.062 10.043
704 HD13 ILE 96 2HD1 ILE 96 -2.973 8.254 11.422
705 H VAL 97 H VAL 97 -1.777 5.312 8.325
706 HA VAL 97 HA VAL 97 -2.784 4.050 5.900
707 HB VAL 97 HB VAL 97 -0.448 3.375 7.699
708 HG11 VAL 97 1HG1 VAL 97 -1.508 1.283 6.964
709 HG12 VAL 97 2HG1 VAL 97 0.061 1.520 6.189
710 HG13 VAL 97 3HG1 VAL 97 -1.430 1.830 5.287
711 HG21 VAL 97 3HG2 VAL 97 -0.683 4.096 4.806
712 HG22 VAL 97 1HG2 VAL 97 0.820 3.798 5.674
713 HG23 VAL 97 2HG2 VAL 97 -0.187 5.193 6.100
714 H ARG 98 H ARG 98 -4.264 2.555 5.878
715 HA ARG 98 HA ARG 98 -4.822 1.068 8.342
716 HB2 ARG 98 2HB ARG 98 -6.633 1.902 6.087
717 HB3 ARG 98 1HB ARG 98 -7.102 0.781 7.355
718 HG2 ARG 98 2HG ARG 98 -6.100 3.504 8.043
719 HG3 ARG 98 1HG ARG 98 -7.765 3.276 7.514
720 HD2 ARG 98 2HD ARG 98 -7.659 3.254 9.942
721 HD3 ARG 98 1HD ARG 98 -8.086 1.652 9.343
722 HE ARG 98 HE ARG 98 -5.776 1.006 9.927
723 HH11 ARG 98 1HH1 ARG 98 -6.892 4.096 11.270
724 HH12 ARG 98 2HH1 ARG 98 -6.230 3.821 12.810
725 HH21 ARG 98 1HH2 ARG 98 -4.928 0.619 12.088
726 HH22 ARG 98 2HH2 ARG 98 -5.102 1.820 13.292
727 H MET 99 H MET 99 -4.497 -1.000 8.204
728 HA MET 99 HA MET 99 -4.163 -2.170 5.524
729 HB2 MET 99 2HB MET 99 -2.759 -3.046 8.063
730 HB3 MET 99 1HB MET 99 -2.642 -3.816 6.504
731 HG2 MET 99 2HG MET 99 -1.620 -1.917 5.524
732 HG3 MET 99 1HG MET 99 -1.821 -0.982 7.003
733 HE1 MET 99 3HE MET 99 -0.724 -4.789 6.767
734 HE2 MET 99 1HE MET 99 1.029 -4.629 6.690
735 HE3 MET 99 2HE MET 99 0.032 -4.059 5.351
736 H HIS 100 H HIS 100 -5.679 -3.424 5.035
737 HA HIS 100 HA HIS 100 -7.190 -4.744 7.178
738 HB2 HIS 100 2HB HIS 100 -8.092 -4.385 4.315
739 HB3 HIS 100 1HB HIS 100 -9.081 -4.796 5.707
740 HD1 HIS 100 1HD HIS 100 -9.561 -2.709 7.411
741 HD2 HIS 100 2HD HIS 100 -7.827 -1.791 3.763
742 HE1 HIS 100 1HE HIS 100 -9.823 -0.235 7.132
Start of MODEL 2
1 H1 GLY 1 1HT GLY 1 1.524 -8.843 -9.098
2 H2 GLY 1 2HT GLY 1 -0.142 -8.993 -8.803
3 H3 GLY 1 3HT GLY 1 0.548 -9.831 -10.080
4 HA2 GLY 1 1HA GLY 1 1.816 -11.172 -8.550
5 HA3 GLY 1 2HA GLY 1 1.083 -10.287 -7.222
6 H HIS 2 H HIS 2 -0.241 -11.766 -6.297
7 HA HIS 2 HA HIS 2 -1.761 -13.533 -7.956
8 HB2 HIS 2 2HB HIS 2 -1.895 -13.084 -4.952
9 HB3 HIS 2 1HB HIS 2 -2.729 -14.363 -5.822
10 HD1 HIS 2 1HD HIS 2 -1.303 -16.495 -6.420
11 HD2 HIS 2 2HD HIS 2 0.879 -13.417 -4.665
12 HE1 HIS 2 1HE HIS 2 0.925 -17.457 -5.845
13 H GLY 3 H GLY 3 -3.780 -13.218 -8.611
14 HA2 GLY 3 2HA GLY 3 -5.034 -10.656 -8.132
15 HA3 GLY 3 1HA GLY 3 -5.635 -11.934 -9.185
16 H SER 4 H SER 4 -5.070 -11.307 -5.762
17 HA SER 4 HA SER 4 -7.727 -12.228 -5.112
18 HB2 SER 4 2HB SER 4 -5.247 -13.554 -3.970
19 HB3 SER 4 1HB SER 4 -6.910 -13.887 -3.487
20 HG SER 4 HG SER 4 -6.885 -14.091 -6.054
21 H ALA 5 H ALA 5 -8.249 -11.694 -2.855
22 HA ALA 5 HA ALA 5 -6.908 -9.259 -2.066
23 HB1 ALA 5 1HB ALA 5 -9.362 -9.304 -2.203
24 HB2 ALA 5 2HB ALA 5 -8.811 -8.947 -0.568
25 HB3 ALA 5 3HB ALA 5 -9.404 -10.557 -0.962
26 H GLY 6 H GLY 6 -6.436 -8.895 0.187
27 HA2 GLY 6 2HA GLY 6 -6.123 -10.998 2.038
28 HA3 GLY 6 1HA GLY 6 -4.587 -10.649 1.239
29 H THR 7 H THR 7 -4.042 -8.316 1.113
30 HA THR 7 HA THR 7 -5.083 -6.758 3.322
31 HB THR 7 HB THR 7 -2.128 -7.146 2.712
32 HG1 THR 7 1HG THR 7 -3.758 -7.956 4.898
33 HG21 THR 7 3HG2 THR 7 -3.494 -5.464 4.838
34 HG22 THR 7 1HG2 THR 7 -2.649 -4.850 3.419
35 HG23 THR 7 2HG2 THR 7 -1.752 -5.693 4.681
36 H SER 8 H SER 8 -5.591 -4.842 2.601
37 HA SER 8 HA SER 8 -4.208 -3.792 0.241
38 HB2 SER 8 2HB SER 8 -7.119 -3.434 1.008
39 HB3 SER 8 1HB SER 8 -6.324 -2.674 -0.376
40 HG SER 8 HG SER 8 -5.824 -4.858 -1.074
41 H VAL 9 H VAL 9 -3.187 -1.961 0.602
42 HA VAL 9 HA VAL 9 -3.540 -0.609 3.161
43 HB VAL 9 HB VAL 9 -1.573 -0.028 0.938
44 HG11 VAL 9 1HG1 VAL 9 -1.608 0.785 3.842
45 HG12 VAL 9 2HG1 VAL 9 -1.877 1.837 2.452
46 HG13 VAL 9 3HG1 VAL 9 -0.289 1.110 2.719
47 HG21 VAL 9 3HG2 VAL 9 -1.179 -1.744 3.391
48 HG22 VAL 9 1HG2 VAL 9 0.096 -1.245 2.279
49 HG23 VAL 9 2HG2 VAL 9 -1.208 -2.288 1.716
50 H THR 10 H THR 10 -4.710 1.123 3.318
51 HA THR 10 HA THR 10 -5.491 2.524 0.882
52 HB THR 10 HB THR 10 -7.062 2.229 3.459
53 HG1 THR 10 1HG THR 10 -8.389 0.868 2.005
54 HG21 THR 10 3HG2 THR 10 -7.577 4.232 2.130
55 HG22 THR 10 1HG2 THR 10 -8.921 3.089 2.103
56 HG23 THR 10 2HG2 THR 10 -7.845 3.218 0.712
57 H LEU 11 H LEU 11 -4.778 4.540 0.824
58 HA LEU 11 HA LEU 11 -3.711 5.812 3.212
59 HB2 LEU 11 2HB LEU 11 -3.863 6.868 0.399
60 HB3 LEU 11 1HB LEU 11 -2.893 7.495 1.715
61 HG LEU 11 HG LEU 11 -2.586 4.875 0.390
62 HD11 LEU 11 1HD1 LEU 11 -0.873 7.383 0.267
63 HD12 LEU 11 2HD1 LEU 11 -1.915 6.802 -1.021
64 HD13 LEU 11 3HD1 LEU 11 -0.487 5.869 -0.553
65 HD21 LEU 11 3HD2 LEU 11 -0.431 4.722 1.640
66 HD22 LEU 11 1HD2 LEU 11 -1.856 4.714 2.681
67 HD23 LEU 11 2HD2 LEU 11 -0.889 6.182 2.517
68 H GLN 12 H GLN 12 -4.831 7.145 4.293
69 HA GLN 12 HA GLN 12 -7.407 8.125 3.212
70 HB2 GLN 12 2HB GLN 12 -7.131 6.630 5.388
71 HB3 GLN 12 1HB GLN 12 -6.703 8.159 6.119
72 HG2 GLN 12 2HG GLN 12 -9.329 7.586 4.759
73 HG3 GLN 12 1HG GLN 12 -9.049 7.548 6.489
74 HE21 GLN 12 1HE2 GLN 12 -8.731 9.494 7.564
75 HE22 GLN 12 2HE2 GLN 12 -9.256 10.993 6.871
76 H LEU 13 H LEU 13 -7.446 10.173 2.692
77 HA LEU 13 HA LEU 13 -5.612 12.127 3.921
78 HB2 LEU 13 2HB LEU 13 -5.215 11.868 1.547
79 HB3 LEU 13 1HB LEU 13 -6.931 12.016 1.211
80 HG LEU 13 HG LEU 13 -6.749 14.315 2.248
81 HD11 LEU 13 1HD1 LEU 13 -4.607 14.148 3.277
82 HD12 LEU 13 2HD1 LEU 13 -4.591 15.436 2.075
83 HD13 LEU 13 3HD1 LEU 13 -3.828 13.884 1.716
84 HD21 LEU 13 3HD2 LEU 13 -5.508 13.706 -0.429
85 HD22 LEU 13 1HD2 LEU 13 -6.006 15.321 0.109
86 HD23 LEU 13 2HD2 LEU 13 -7.203 14.044 -0.038
87 H ASP 14 H ASP 14 -6.697 13.704 5.109
88 HA ASP 14 HA ASP 14 -9.568 13.562 5.020
89 HB2 ASP 14 2HB ASP 14 -8.382 13.807 7.226
90 HB3 ASP 14 1HB ASP 14 -7.889 15.423 6.717
91 H ASP 15 H ASP 15 -10.182 14.332 3.297
92 HA ASP 15 HA ASP 15 -9.408 16.992 2.509
93 HB2 ASP 15 2HB ASP 15 -9.089 15.280 0.823
94 HB3 ASP 15 1HB ASP 15 -10.739 14.725 1.027
95 H GLY 16 H GLY 16 -11.105 16.628 4.716
96 HA2 GLY 16 2HA GLY 16 -12.964 17.982 5.318
97 HA3 GLY 16 1HA GLY 16 -13.644 17.701 3.715
98 H SER 17 H SER 17 -13.652 15.123 3.330
99 HA SER 17 HA SER 17 -15.122 14.060 5.629
100 HB2 SER 17 2HB SER 17 -16.465 14.443 3.512
101 HB3 SER 17 1HB SER 17 -15.431 13.268 2.708
102 HG SER 17 HG SER 17 -16.434 12.273 5.028
103 H GLY 18 H GLY 18 -13.202 13.000 2.791
104 HA2 GLY 18 2HA GLY 18 -11.050 11.969 3.912
105 HA3 GLY 18 1HA GLY 18 -12.245 10.748 4.319
106 H ARG 19 H ARG 19 -10.051 11.797 2.056
107 HA ARG 19 HA ARG 19 -11.261 10.211 -0.090
108 HB2 ARG 19 2HB ARG 19 -8.763 11.896 -0.098
109 HB3 ARG 19 1HB ARG 19 -9.297 10.842 -1.406
110 HG2 ARG 19 2HG ARG 19 -11.337 12.211 -1.599
111 HG3 ARG 19 1HG ARG 19 -10.699 13.301 -0.363
112 HD2 ARG 19 2HD ARG 19 -8.702 13.638 -1.811
113 HD3 ARG 19 1HD ARG 19 -9.499 12.681 -3.055
114 HE ARG 19 HE ARG 19 -10.860 15.044 -2.000
115 HH11 ARG 19 1HH1 ARG 19 -9.315 13.479 -4.803
116 HH12 ARG 19 2HH1 ARG 19 -9.575 14.796 -5.846
117 HH21 ARG 19 1HH2 ARG 19 -11.265 16.807 -3.461
118 HH22 ARG 19 2HH2 ARG 19 -10.709 16.717 -5.071
119 H THR 20 H THR 20 -10.300 8.358 -0.793
120 HA THR 20 HA THR 20 -8.053 7.477 0.816
121 HB THR 20 HB THR 20 -9.093 5.192 0.876
122 HG1 THR 20 1HG THR 20 -11.269 6.697 -0.141
123 HG21 THR 20 3HG2 THR 20 -10.505 7.483 2.190
124 HG22 THR 20 1HG2 THR 20 -9.126 6.604 2.833
125 HG23 THR 20 2HG2 THR 20 -10.705 5.797 2.709
126 H TYR 21 H TYR 21 -6.487 6.462 -0.221
127 HA TYR 21 HA TYR 21 -6.976 5.704 -3.006
128 HB2 TYR 21 2HB TYR 21 -5.523 7.675 -2.943
129 HB3 TYR 21 1HB TYR 21 -4.449 6.872 -1.804
130 HD1 TYR 21 1HD TYR 21 -5.892 6.341 -5.212
131 HD2 TYR 21 2HD TYR 21 -2.527 5.858 -2.657
132 HE1 TYR 21 1HE TYR 21 -4.594 5.450 -7.088
133 HE2 TYR 21 2HE TYR 21 -1.219 4.967 -4.539
134 HH TYR 21 HH TYR 21 -1.508 3.954 -6.683
135 H GLN 22 H GLN 22 -7.057 3.580 -3.031
136 HA GLN 22 HA GLN 22 -5.589 2.022 -1.129
137 HB2 GLN 22 2HB GLN 22 -7.771 1.229 -1.956
138 HB3 GLN 22 1HB GLN 22 -7.118 1.148 -3.589
139 HG2 GLN 22 2HG GLN 22 -5.445 -0.506 -2.778
140 HG3 GLN 22 1HG GLN 22 -6.260 -0.502 -1.219
141 HE21 GLN 22 1HE2 GLN 22 -5.824 -2.624 -3.114
142 HE22 GLN 22 2HE2 GLN 22 -7.364 -3.261 -3.541
143 H LEU 23 H LEU 23 -3.649 1.275 -1.371
144 HA LEU 23 HA LEU 23 -2.118 1.841 -3.728
145 HB2 LEU 23 2HB LEU 23 -1.471 0.275 -1.238
146 HB3 LEU 23 1HB LEU 23 -0.330 0.610 -2.519
147 HG LEU 23 HG LEU 23 -1.639 2.718 -0.788
148 HD11 LEU 23 1HD1 LEU 23 0.584 2.894 0.227
149 HD12 LEU 23 2HD1 LEU 23 1.110 1.503 -0.735
150 HD13 LEU 23 3HD1 LEU 23 -0.131 1.303 0.493
151 HD21 LEU 23 3HD2 LEU 23 0.630 2.871 -2.769
152 HD22 LEU 23 1HD2 LEU 23 0.055 4.190 -1.757
153 HD23 LEU 23 2HD2 LEU 23 -0.991 3.525 -3.013
154 H ARG 24 H ARG 24 -2.017 0.556 -5.395
155 HA ARG 24 HA ARG 24 -2.737 -2.235 -5.035
156 HB2 ARG 24 2HB ARG 24 -2.559 -0.544 -7.509
157 HB3 ARG 24 1HB ARG 24 -2.674 -2.297 -7.568
158 HG2 ARG 24 2HG ARG 24 -4.796 -2.041 -6.189
159 HG3 ARG 24 1HG ARG 24 -4.704 -0.320 -6.587
160 HD2 ARG 24 2HD ARG 24 -6.131 -1.546 -8.154
161 HD3 ARG 24 1HD ARG 24 -4.722 -0.848 -8.957
162 HE ARG 24 HE ARG 24 -3.820 -3.304 -8.423
163 HH11 ARG 24 1HH1 ARG 24 -6.963 -2.363 -9.789
164 HH12 ARG 24 2HH1 ARG 24 -7.078 -3.763 -10.750
165 HH21 ARG 24 1HH2 ARG 24 -3.978 -5.134 -9.714
166 HH22 ARG 24 2HH2 ARG 24 -5.317 -5.378 -10.759
167 H GLU 25 H GLU 25 -1.459 -3.677 -6.616
168 HA GLU 25 HA GLU 25 1.069 -3.772 -5.462
169 HB2 GLU 25 2HB GLU 25 1.494 -5.699 -6.997
170 HB3 GLU 25 1HB GLU 25 0.043 -5.848 -6.033
171 HG2 GLU 25 2HG GLU 25 0.023 -4.957 -8.916
172 HG3 GLU 25 1HG GLU 25 -0.091 -6.642 -8.434
173 H GLY 26 H GLY 26 3.034 -3.229 -6.115
174 HA2 GLY 26 2HA GLY 26 4.569 -2.681 -7.933
175 HA3 GLY 26 1HA GLY 26 3.254 -1.736 -8.643
176 H SER 27 H SER 27 5.251 -0.151 -8.355
177 HA SER 27 HA SER 27 5.084 0.906 -5.685
178 HB2 SER 27 2HB SER 27 6.966 2.341 -6.352
179 HB3 SER 27 1HB SER 27 7.306 0.622 -6.492
180 HG SER 27 HG SER 27 7.480 2.425 -8.463
181 H ASN 28 H ASN 28 4.319 2.816 -5.211
182 HA ASN 28 HA ASN 28 2.835 4.166 -7.337
183 HB2 ASN 28 2HB ASN 28 2.120 3.811 -4.408
184 HB3 ASN 28 1HB ASN 28 1.251 4.876 -5.507
185 HD21 ASN 28 1HD2 ASN 28 1.940 1.542 -4.690
186 HD22 ASN 28 2HD2 ASN 28 0.697 0.823 -5.618
187 H ILE 29 H ILE 29 3.811 5.934 -7.845
188 HA ILE 29 HA ILE 29 5.552 7.329 -5.994
189 HB ILE 29 HB ILE 29 4.746 8.031 -8.829
190 HG12 ILE 29 2HG1 ILE 29 5.910 5.877 -8.797
191 HG13 ILE 29 1HG1 ILE 29 6.905 7.113 -9.556
192 HG21 ILE 29 1HG2 ILE 29 6.734 9.475 -8.854
193 HG22 ILE 29 2HG2 ILE 29 7.039 9.069 -7.164
194 HG23 ILE 29 3HG2 ILE 29 5.587 9.966 -7.605
195 HD11 ILE 29 3HD1 ILE 29 7.205 6.024 -6.771
196 HD12 ILE 29 1HD1 ILE 29 8.187 7.315 -7.472
197 HD13 ILE 29 2HD1 ILE 29 8.241 5.692 -8.159
198 H ILE 30 H ILE 30 4.859 8.978 -4.779
199 HA ILE 30 HA ILE 30 2.248 10.131 -5.381
200 HB ILE 30 HB ILE 30 3.698 9.970 -2.710
201 HG12 ILE 30 2HG1 ILE 30 1.306 8.407 -3.732
202 HG13 ILE 30 1HG1 ILE 30 2.923 7.770 -3.509
203 HG21 ILE 30 1HG2 ILE 30 2.325 11.929 -2.817
204 HG22 ILE 30 2HG2 ILE 30 1.565 10.735 -1.759
205 HG23 ILE 30 3HG2 ILE 30 0.958 10.986 -3.397
206 HD11 ILE 30 3HD1 ILE 30 1.439 7.118 -1.697
207 HD12 ILE 30 1HD1 ILE 30 1.138 8.815 -1.324
208 HD13 ILE 30 2HD1 ILE 30 2.754 8.138 -1.110
209 H GLY 31 H GLY 31 2.153 12.190 -5.873
210 HA2 GLY 31 2HA GLY 31 3.184 14.414 -4.901
211 HA3 GLY 31 1HA GLY 31 4.538 13.843 -5.894
212 H ARG 32 H ARG 32 4.029 15.925 -7.140
213 HA ARG 32 HA ARG 32 2.061 15.099 -9.122
214 HB2 ARG 32 2HB ARG 32 2.443 17.940 -8.204
215 HB3 ARG 32 1HB ARG 32 1.540 17.479 -9.641
216 HG2 ARG 32 2HG ARG 32 0.225 15.968 -7.989
217 HG3 ARG 32 1HG ARG 32 0.894 17.047 -6.775
218 HD2 ARG 32 2HD ARG 32 -0.692 17.923 -9.174
219 HD3 ARG 32 1HD ARG 32 -1.324 17.746 -7.538
220 HE ARG 32 HE ARG 32 0.862 19.483 -7.473
221 HH11 ARG 32 1HH1 ARG 32 -2.438 19.376 -8.750
222 HH12 ARG 32 2HH1 ARG 32 -2.723 21.044 -8.605
223 HH21 ARG 32 1HH2 ARG 32 0.516 21.757 -7.294
224 HH22 ARG 32 2HH2 ARG 32 -0.978 22.469 -7.752
225 H GLY 33 H GLY 33 3.177 14.370 -10.640
226 HA2 GLY 33 2HA GLY 33 4.377 16.129 -12.455
227 HA3 GLY 33 1HA GLY 33 5.533 15.020 -11.689
228 H GLN 34 H GLN 34 5.406 14.442 -14.176
229 HA GLN 34 HA GLN 34 3.179 12.798 -14.893
230 HB2 GLN 34 2HB GLN 34 4.393 12.301 -16.943
231 HB3 GLN 34 1HB GLN 34 4.469 14.019 -16.616
232 HG2 GLN 34 2HG GLN 34 6.733 12.167 -15.894
233 HG3 GLN 34 1HG GLN 34 6.562 12.828 -17.509
234 HE21 GLN 34 1HE2 GLN 34 8.472 13.918 -17.395
235 HE22 GLN 34 2HE2 GLN 34 8.732 15.306 -16.402
236 H ASP 35 H ASP 35 5.825 12.384 -13.020
237 HA ASP 35 HA ASP 35 6.393 9.588 -13.454
238 HB2 ASP 35 2HB ASP 35 7.130 11.159 -11.011
239 HB3 ASP 35 1HB ASP 35 8.036 9.897 -11.833
240 H ALA 36 H ALA 36 4.213 11.513 -11.656
241 HA ALA 36 HA ALA 36 4.050 9.775 -9.398
242 HB1 ALA 36 1HB ALA 36 2.434 12.217 -10.048
243 HB2 ALA 36 2HB ALA 36 3.952 12.171 -9.146
244 HB3 ALA 36 3HB ALA 36 2.515 11.386 -8.490
245 H GLN 37 H GLN 37 2.642 8.301 -8.971
246 HA GLN 37 HA GLN 37 0.683 7.512 -10.956
247 HB2 GLN 37 2HB GLN 37 1.564 6.228 -8.363
248 HB3 GLN 37 1HB GLN 37 0.467 5.517 -9.535
249 HG2 GLN 37 2HG GLN 37 3.364 6.197 -10.020
250 HG3 GLN 37 1HG GLN 37 2.724 4.585 -9.709
251 HE21 GLN 37 1HE2 GLN 37 1.495 3.587 -11.296
252 HE22 GLN 37 2HE2 GLN 37 1.556 4.089 -12.950
253 H PHE 38 H PHE 38 0.973 8.974 -7.857
254 HA PHE 38 HA PHE 38 -1.908 9.383 -7.764
255 HB2 PHE 38 2HB PHE 38 -1.416 7.694 -6.092
256 HB3 PHE 38 1HB PHE 38 -0.055 8.625 -5.493
257 HD1 PHE 38 1HD PHE 38 -3.703 9.309 -6.106
258 HD2 PHE 38 2HD PHE 38 -0.406 9.483 -3.429
259 HE1 PHE 38 1HE PHE 38 -5.148 10.303 -4.385
260 HE2 PHE 38 2HE PHE 38 -1.800 10.469 -1.730
261 HZ PHE 38 HZ PHE 38 -4.206 10.896 -2.184
262 H ARG 39 H ARG 39 -2.267 11.463 -7.937
263 HA ARG 39 HA ARG 39 -0.062 13.293 -7.405
264 HB2 ARG 39 2HB ARG 39 -2.557 13.604 -9.076
265 HB3 ARG 39 1HB ARG 39 -1.565 14.973 -8.631
266 HG2 ARG 39 2HG ARG 39 -1.003 14.332 -10.862
267 HG3 ARG 39 1HG ARG 39 0.346 13.892 -9.824
268 HD2 ARG 39 2HD ARG 39 -0.103 12.148 -11.459
269 HD3 ARG 39 1HD ARG 39 -0.416 11.567 -9.826
270 HE ARG 39 HE ARG 39 -2.801 12.550 -10.874
271 HH11 ARG 39 1HH1 ARG 39 -0.550 9.918 -11.604
272 HH12 ARG 39 2HH1 ARG 39 -1.763 8.815 -12.091
273 HH21 ARG 39 1HH2 ARG 39 -4.454 11.052 -11.577
274 HH22 ARG 39 2HH2 ARG 39 -4.057 9.477 -12.065
275 H LEU 40 H LEU 40 -0.043 14.158 -5.478
276 HA LEU 40 HA LEU 40 -2.373 14.397 -3.887
277 HB2 LEU 40 2HB LEU 40 0.419 15.418 -3.552
278 HB3 LEU 40 1HB LEU 40 -0.846 15.908 -2.441
279 HG LEU 40 HG LEU 40 0.052 13.065 -2.921
280 HD11 LEU 40 1HD1 LEU 40 0.995 13.264 -0.679
281 HD12 LEU 40 2HD1 LEU 40 0.522 14.966 -0.637
282 HD13 LEU 40 3HD1 LEU 40 1.740 14.414 -1.791
283 HD21 LEU 40 3HD2 LEU 40 -1.879 14.254 -0.925
284 HD22 LEU 40 1HD2 LEU 40 -1.311 12.587 -0.929
285 HD23 LEU 40 2HD2 LEU 40 -2.292 13.176 -2.260
286 HA PRO 41 HA PRO 41 -3.761 18.236 -5.731
287 HB2 PRO 41 2HB PRO 41 -5.604 18.495 -3.482
288 HB3 PRO 41 1HB PRO 41 -5.965 18.172 -5.178
289 HG2 PRO 41 2HG PRO 41 -6.309 16.304 -3.264
290 HG3 PRO 41 1HG PRO 41 -5.811 15.885 -4.911
291 HD2 PRO 41 2HD PRO 41 -4.137 16.160 -2.443
292 HD3 PRO 41 1HD PRO 41 -4.123 14.896 -3.692
293 H ASP 42 H ASP 42 -1.461 18.531 -4.052
294 HA ASP 42 HA ASP 42 -2.090 20.992 -2.528
295 HB2 ASP 42 2HB ASP 42 -0.979 19.054 -1.193
296 HB3 ASP 42 1HB ASP 42 0.341 19.352 -2.358
297 H THR 43 H THR 43 -0.647 22.696 -2.810
298 HA THR 43 HA THR 43 0.715 22.668 -5.352
299 HB THR 43 HB THR 43 0.103 24.858 -3.434
300 HG1 THR 43 1HG THR 43 -1.832 24.258 -4.167
301 HG21 THR 43 3HG2 THR 43 0.942 24.961 -6.344
302 HG22 THR 43 1HG2 THR 43 1.913 25.458 -4.961
303 HG23 THR 43 2HG2 THR 43 0.465 26.369 -5.394
304 H GLY 44 H GLY 44 2.875 22.289 -5.293
305 HA2 GLY 44 2HA GLY 44 5.047 23.107 -4.508
306 HA3 GLY 44 1HA GLY 44 4.366 23.123 -2.890
307 H VAL 45 H VAL 45 3.013 20.461 -3.769
308 HA VAL 45 HA VAL 45 5.114 18.799 -2.821
309 HB VAL 45 HB VAL 45 2.814 18.147 -2.279
310 HG11 VAL 45 1HG1 VAL 45 1.254 17.282 -3.959
311 HG12 VAL 45 2HG1 VAL 45 2.407 17.693 -5.230
312 HG13 VAL 45 3HG1 VAL 45 1.667 18.969 -4.268
313 HG21 VAL 45 3HG2 VAL 45 2.865 15.769 -2.945
314 HG22 VAL 45 1HG2 VAL 45 4.421 16.356 -2.353
315 HG23 VAL 45 2HG2 VAL 45 4.160 16.153 -4.081
316 H SER 46 H SER 46 6.642 17.886 -3.863
317 HA SER 46 HA SER 46 7.217 18.510 -6.516
318 HB2 SER 46 2HB SER 46 8.462 16.464 -4.702
319 HB3 SER 46 1HB SER 46 9.226 17.276 -6.077
320 HG SER 46 HG SER 46 8.279 19.195 -4.668
321 H ARG 47 H ARG 47 7.830 16.867 -8.183
322 HA ARG 47 HA ARG 47 5.696 15.321 -9.114
323 HB2 ARG 47 2HB ARG 47 8.602 14.809 -9.707
324 HB3 ARG 47 1HB ARG 47 7.252 14.321 -10.670
325 HG2 ARG 47 2HG ARG 47 6.850 16.449 -11.506
326 HG3 ARG 47 1HG ARG 47 7.681 17.233 -10.177
327 HD2 ARG 47 2HD ARG 47 8.946 17.315 -12.304
328 HD3 ARG 47 1HD ARG 47 9.820 16.509 -11.011
329 HE ARG 47 HE ARG 47 8.525 14.508 -12.430
330 HH11 ARG 47 1HH1 ARG 47 10.911 16.987 -13.211
331 HH12 ARG 47 2HH1 ARG 47 11.735 16.018 -14.356
332 HH21 ARG 47 1HH2 ARG 47 9.635 13.198 -13.894
333 HH22 ARG 47 2HH2 ARG 47 10.990 13.783 -14.759
334 H ARG 48 H ARG 48 8.649 14.325 -7.546
335 HA ARG 48 HA ARG 48 7.391 11.796 -6.739
336 HB2 ARG 48 2HB ARG 48 10.337 12.362 -7.135
337 HB3 ARG 48 1HB ARG 48 9.606 10.816 -6.742
338 HG2 ARG 48 2HG ARG 48 8.617 10.660 -8.889
339 HG3 ARG 48 1HG ARG 48 9.112 12.293 -9.314
340 HD2 ARG 48 2HD ARG 48 11.506 11.490 -8.940
341 HD3 ARG 48 1HD ARG 48 10.832 9.859 -8.864
342 HE ARG 48 HE ARG 48 9.969 11.244 -11.166
343 HH11 ARG 48 1HH1 ARG 48 12.774 9.447 -9.934
344 HH12 ARG 48 2HH1 ARG 48 13.363 9.100 -11.499
345 HH21 ARG 48 1HH2 ARG 48 10.748 10.771 -13.184
346 HH22 ARG 48 2HH2 ARG 48 12.189 9.871 -13.416
347 H HIS 49 H HIS 49 6.765 12.402 -4.758
348 HA HIS 49 HA HIS 49 8.728 13.776 -3.078
349 HB2 HIS 49 2HB HIS 49 6.654 15.007 -3.146
350 HB3 HIS 49 1HB HIS 49 5.680 13.602 -2.776
351 HD2 HIS 49 2HD HIS 49 5.803 12.764 -0.078
352 HE1 HIS 49 1HE HIS 49 7.620 16.318 1.275
353 HE2 HIS 49 2HE HIS 49 6.935 13.955 1.864
354 H LEU 50 H LEU 50 6.803 10.908 -3.408
355 HA LEU 50 HA LEU 50 8.543 9.514 -1.645
356 HB2 LEU 50 2HB LEU 50 7.127 10.654 -0.028
357 HB3 LEU 50 1HB LEU 50 5.687 10.101 -0.824
358 HG LEU 50 HG LEU 50 7.570 8.106 0.414
359 HD11 LEU 50 1HD1 LEU 50 7.124 9.893 2.082
360 HD12 LEU 50 2HD1 LEU 50 6.350 8.377 2.517
361 HD13 LEU 50 3HD1 LEU 50 5.394 9.682 1.816
362 HD21 LEU 50 3HD2 LEU 50 5.475 6.880 0.740
363 HD22 LEU 50 1HD2 LEU 50 5.688 7.318 -0.956
364 HD23 LEU 50 2HD2 LEU 50 4.572 8.231 0.062
365 H GLU 51 H GLU 51 8.259 7.255 -1.849
366 HA GLU 51 HA GLU 51 6.292 6.451 -3.849
367 HB2 GLU 51 2HB GLU 51 7.958 4.907 -4.817
368 HB3 GLU 51 1HB GLU 51 8.372 6.593 -5.054
369 HG2 GLU 51 2HG GLU 51 9.977 6.438 -3.203
370 HG3 GLU 51 1HG GLU 51 9.518 4.754 -2.973
371 H ILE 52 H ILE 52 5.292 4.609 -3.427
372 HA ILE 52 HA ILE 52 6.281 3.055 -1.137
373 HB ILE 52 HB ILE 52 3.404 3.371 -2.032
374 HG12 ILE 52 2HG1 ILE 52 4.769 4.322 0.502
375 HG13 ILE 52 1HG1 ILE 52 4.371 5.358 -0.861
376 HG21 ILE 52 1HG2 ILE 52 3.869 1.169 -1.216
377 HG22 ILE 52 2HG2 ILE 52 2.913 2.032 0.011
378 HG23 ILE 52 3HG2 ILE 52 4.657 1.809 0.222
379 HD11 ILE 52 3HD1 ILE 52 2.762 5.593 0.942
380 HD12 ILE 52 1HD1 ILE 52 2.405 3.869 0.861
381 HD13 ILE 52 2HD1 ILE 52 1.998 4.915 -0.497
382 H ARG 53 H ARG 53 7.059 1.175 -1.770
383 HA ARG 53 HA ARG 53 6.056 0.049 -4.260
384 HB2 ARG 53 2HB ARG 53 8.568 0.309 -3.827
385 HB3 ARG 53 1HB ARG 53 8.399 -0.907 -2.575
386 HG2 ARG 53 2HG ARG 53 7.636 -1.464 -5.436
387 HG3 ARG 53 1HG ARG 53 9.289 -1.640 -4.865
388 HD2 ARG 53 2HD ARG 53 6.885 -3.075 -3.736
389 HD3 ARG 53 1HD ARG 53 8.045 -3.763 -4.879
390 HE ARG 53 HE ARG 53 9.506 -2.809 -2.760
391 HH11 ARG 53 1HH1 ARG 53 7.160 -5.385 -3.352
392 HH12 ARG 53 2HH1 ARG 53 7.612 -6.328 -2.018
393 HH21 ARG 53 1HH2 ARG 53 10.202 -4.116 -0.970
394 HH22 ARG 53 2HH2 ARG 53 9.428 -5.597 -0.625
395 H TRP 54 H TRP 54 4.330 -1.088 -4.000
396 HA TRP 54 HA TRP 54 3.967 -2.562 -1.527
397 HB2 TRP 54 2HB TRP 54 2.294 -0.845 -1.717
398 HB3 TRP 54 1HB TRP 54 1.998 -1.222 -3.401
399 HD1 TRP 54 HD TRP 54 -0.267 -2.363 -3.722
400 HE1 TRP 54 1HE TRP 54 -1.793 -3.934 -2.364
401 HE3 TRP 54 3HE TRP 54 2.630 -2.941 0.384
402 HZ2 TRP 54 2HZ TRP 54 -1.751 -5.256 0.105
403 HZ3 TRP 54 3HZ TRP 54 1.854 -4.364 2.195
404 HH2 TRP 54 HH TRP 54 -0.311 -5.515 2.073
405 H ASP 55 H ASP 55 3.215 -4.664 -1.691
406 HA ASP 55 HA ASP 55 2.677 -5.880 -4.242
407 HB2 ASP 55 2HB ASP 55 5.216 -6.045 -3.731
408 HB3 ASP 55 1HB ASP 55 4.752 -7.056 -2.371
409 H GLY 56 H GLY 56 1.846 -8.168 -3.602
410 HA2 GLY 56 2HA GLY 56 -0.078 -7.717 -1.520
411 HA3 GLY 56 1HA GLY 56 0.052 -9.158 -2.502
412 H GLN 57 H GLN 57 2.502 -7.796 -0.440
413 HA GLN 57 HA GLN 57 2.152 -9.908 1.526
414 HB2 GLN 57 2HB GLN 57 4.721 -9.368 0.039
415 HB3 GLN 57 1HB GLN 57 4.698 -10.160 1.604
416 HG2 GLN 57 2HG GLN 57 3.359 -11.972 0.699
417 HG3 GLN 57 1HG GLN 57 3.285 -11.159 -0.863
418 HE21 GLN 57 1HE2 GLN 57 4.238 -12.951 -1.861
419 HE22 GLN 57 2HE2 GLN 57 5.922 -13.265 -1.726
420 H VAL 58 H VAL 58 4.555 -7.323 0.878
421 HA VAL 58 HA VAL 58 3.773 -6.115 3.415
422 HB VAL 58 HB VAL 58 6.140 -5.619 3.939
423 HG11 VAL 58 1HG1 VAL 58 6.819 -7.865 4.633
424 HG12 VAL 58 2HG1 VAL 58 5.570 -8.555 3.593
425 HG13 VAL 58 3HG1 VAL 58 5.116 -7.554 4.971
426 HG21 VAL 58 3HG2 VAL 58 6.762 -7.426 1.601
427 HG22 VAL 58 1HG2 VAL 58 7.945 -6.803 2.754
428 HG23 VAL 58 2HG2 VAL 58 7.074 -5.694 1.691
429 H ALA 59 H ALA 59 4.486 -3.877 3.622
430 HA ALA 59 HA ALA 59 4.434 -2.508 1.026
431 HB1 ALA 59 1HB ALA 59 3.415 -1.644 3.713
432 HB2 ALA 59 2HB ALA 59 2.419 -2.144 2.347
433 HB3 ALA 59 3HB ALA 59 3.380 -0.663 2.247
434 H LEU 60 H LEU 60 6.260 -1.591 0.525
435 HA LEU 60 HA LEU 60 8.031 -0.777 2.692
436 HB2 LEU 60 2HB LEU 60 8.842 -2.597 1.264
437 HB3 LEU 60 1HB LEU 60 8.617 -1.608 -0.152
438 HG LEU 60 HG LEU 60 10.537 -0.749 1.990
439 HD11 LEU 60 1HD1 LEU 60 11.067 -3.067 1.453
440 HD12 LEU 60 2HD1 LEU 60 12.277 -1.980 0.766
441 HD13 LEU 60 3HD1 LEU 60 11.024 -2.684 -0.264
442 HD21 LEU 60 3HD2 LEU 60 9.987 0.824 0.183
443 HD22 LEU 60 1HD2 LEU 60 10.434 -0.393 -1.008
444 HD23 LEU 60 2HD2 LEU 60 11.670 0.288 0.057
445 H LEU 61 H LEU 61 8.105 1.347 2.987
446 HA LEU 61 HA LEU 61 7.308 3.070 0.779
447 HB2 LEU 61 2HB LEU 61 5.877 3.239 2.751
448 HB3 LEU 61 1HB LEU 61 7.254 3.454 3.762
449 HG LEU 61 HG LEU 61 6.850 5.547 1.648
450 HD11 LEU 61 1HD1 LEU 61 5.333 5.408 4.232
451 HD12 LEU 61 2HD1 LEU 61 4.633 5.249 2.611
452 HD13 LEU 61 3HD1 LEU 61 5.356 6.776 3.120
453 HD21 LEU 61 3HD2 LEU 61 8.807 5.605 3.158
454 HD22 LEU 61 1HD2 LEU 61 7.718 5.692 4.543
455 HD23 LEU 61 2HD2 LEU 61 7.763 7.010 3.372
456 H ALA 62 H ALA 62 8.574 4.729 0.152
457 HA ALA 62 HA ALA 62 11.069 5.182 1.568
458 HB1 ALA 62 1HB ALA 62 12.312 5.231 -0.524
459 HB2 ALA 62 2HB ALA 62 10.857 4.790 -1.414
460 HB3 ALA 62 3HB ALA 62 11.577 3.647 -0.279
461 H ASP 63 H ASP 63 11.431 7.225 1.852
462 HA ASP 63 HA ASP 63 9.613 9.214 0.784
463 HB2 ASP 63 2HB ASP 63 10.119 9.446 3.108
464 HB3 ASP 63 1HB ASP 63 11.841 9.259 2.824
465 H LEU 64 H LEU 64 10.202 10.861 -0.634
466 HA LEU 64 HA LEU 64 12.922 10.700 -1.751
467 HB2 LEU 64 2HB LEU 64 11.002 9.474 -3.027
468 HB3 LEU 64 1HB LEU 64 10.414 11.070 -3.389
469 HG LEU 64 HG LEU 64 11.495 10.230 -5.288
470 HD11 LEU 64 1HD1 LEU 64 11.919 12.567 -5.006
471 HD12 LEU 64 2HD1 LEU 64 13.309 11.796 -5.770
472 HD13 LEU 64 3HD1 LEU 64 13.368 12.227 -4.060
473 HD21 LEU 64 3HD2 LEU 64 13.908 9.642 -3.584
474 HD22 LEU 64 1HD2 LEU 64 13.849 9.480 -5.339
475 HD23 LEU 64 2HD2 LEU 64 12.821 8.469 -4.324
476 H ASN 65 H ASN 65 13.033 12.671 -0.217
477 HA ASN 65 HA ASN 65 12.849 15.057 -1.696
478 HB2 ASN 65 2HB ASN 65 10.360 14.687 -1.103
479 HB3 ASN 65 1HB ASN 65 10.822 14.981 0.567
480 HD21 ASN 65 1HD2 ASN 65 9.020 16.482 -1.147
481 HD22 ASN 65 2HD2 ASN 65 9.648 18.089 -1.235
482 H SER 66 H SER 66 14.524 16.176 -0.911
483 HA SER 66 HA SER 66 15.494 15.561 1.747
484 HB2 SER 66 2HB SER 66 16.649 17.422 -0.342
485 HB3 SER 66 1HB SER 66 17.484 16.742 1.056
486 HG SER 66 HG SER 66 16.858 14.623 0.031
487 H THR 67 H THR 67 13.593 17.930 0.189
488 HA THR 67 HA THR 67 14.247 20.116 1.973
489 HB THR 67 HB THR 67 12.186 19.932 -0.232
490 HG1 THR 67 1HG THR 67 13.814 20.920 -1.493
491 HG21 THR 67 3HG2 THR 67 12.388 22.380 -0.291
492 HG22 THR 67 1HG2 THR 67 13.553 22.330 1.033
493 HG23 THR 67 2HG2 THR 67 11.881 21.842 1.308
494 H ASN 68 H ASN 68 11.406 18.201 1.076
495 HA ASN 68 HA ASN 68 9.942 19.197 3.438
496 HB2 ASN 68 2HB ASN 68 8.846 18.059 0.857
497 HB3 ASN 68 1HB ASN 68 7.880 18.679 2.186
498 HD21 ASN 68 1HD2 ASN 68 7.864 20.973 2.531
499 HD22 ASN 68 2HD2 ASN 68 8.291 22.040 1.262
500 H GLY 69 H GLY 69 11.826 17.007 3.417
501 HA2 GLY 69 2HA GLY 69 11.051 14.440 2.978
502 HA3 GLY 69 1HA GLY 69 12.084 14.926 4.306
503 H THR 70 H THR 70 9.775 12.997 3.724
504 HA THR 70 HA THR 70 7.596 13.744 5.360
505 HB THR 70 HB THR 70 8.296 11.065 4.185
506 HG1 THR 70 1HG THR 70 8.411 12.320 2.524
507 HG21 THR 70 3HG2 THR 70 5.830 10.884 3.985
508 HG22 THR 70 1HG2 THR 70 5.671 12.414 4.844
509 HG23 THR 70 2HG2 THR 70 6.365 11.017 5.658
510 H THR 71 H THR 71 6.854 12.694 7.215
511 HA THR 71 HA THR 71 8.844 11.286 8.845
512 HB THR 71 HB THR 71 7.571 12.193 10.796
513 HG1 THR 71 1HG THR 71 6.265 13.603 8.723
514 HG21 THR 71 3HG2 THR 71 9.653 13.129 10.217
515 HG22 THR 71 1HG2 THR 71 8.558 14.421 10.703
516 HG23 THR 71 2HG2 THR 71 8.916 14.164 8.974
517 H VAL 72 H VAL 72 8.124 9.546 9.955
518 HA VAL 72 HA VAL 72 5.370 8.728 9.457
519 HB VAL 72 HB VAL 72 6.188 6.374 9.666
520 HG11 VAL 72 1HG1 VAL 72 5.891 7.392 7.447
521 HG12 VAL 72 2HG1 VAL 72 7.274 6.295 7.437
522 HG13 VAL 72 3HG1 VAL 72 7.526 8.040 7.531
523 HG21 VAL 72 3HG2 VAL 72 8.904 7.689 9.606
524 HG22 VAL 72 1HG2 VAL 72 8.617 5.949 9.469
525 HG23 VAL 72 2HG2 VAL 72 8.212 6.805 10.961
526 H ASN 73 H ASN 73 4.185 8.740 11.180
527 HA ASN 73 HA ASN 73 3.498 8.928 13.280
528 HB2 ASN 73 2HB ASN 73 5.830 7.039 13.761
529 HB3 ASN 73 1HB ASN 73 4.651 7.442 15.009
530 HD21 ASN 73 1HD2 ASN 73 5.285 4.905 13.493
531 HD22 ASN 73 2HD2 ASN 73 3.770 4.365 12.871
532 H ASN 74 H ASN 74 5.356 10.762 12.127
533 HA ASN 74 HA ASN 74 6.092 12.740 12.537
534 HB2 ASN 74 2HB ASN 74 5.736 12.111 15.436
535 HB3 ASN 74 1HB ASN 74 6.633 13.543 14.942
536 HD21 ASN 74 1HD2 ASN 74 5.149 14.918 15.785
537 HD22 ASN 74 2HD2 ASN 74 3.592 15.191 15.087
538 H ALA 75 H ALA 75 7.712 10.003 12.996
539 HA ALA 75 HA ALA 75 10.235 11.217 13.707
540 HB1 ALA 75 1HB ALA 75 9.532 8.377 12.955
541 HB2 ALA 75 2HB ALA 75 9.707 9.008 14.596
542 HB3 ALA 75 3HB ALA 75 11.106 8.927 13.528
543 HA PRO 76 HA PRO 76 11.032 11.987 9.301
544 HB2 PRO 76 2HB PRO 76 13.773 12.534 10.169
545 HB3 PRO 76 1HB PRO 76 12.608 13.627 9.416
546 HG2 PRO 76 2HG PRO 76 13.340 13.896 11.986
547 HG3 PRO 76 1HG PRO 76 11.694 14.257 11.439
548 HD2 PRO 76 2HD PRO 76 12.731 11.825 12.844
549 HD3 PRO 76 1HD PRO 76 11.228 12.748 13.098
550 H VAL 77 H VAL 77 11.479 10.460 7.842
551 HA VAL 77 HA VAL 77 13.758 8.725 8.301
552 HB VAL 77 HB VAL 77 12.473 6.743 7.525
553 HG11 VAL 77 1HG1 VAL 77 11.258 6.295 9.605
554 HG12 VAL 77 2HG1 VAL 77 11.383 7.999 10.036
555 HG13 VAL 77 3HG1 VAL 77 12.840 7.014 9.905
556 HG21 VAL 77 3HG2 VAL 77 10.688 7.848 6.329
557 HG22 VAL 77 1HG2 VAL 77 10.085 8.561 7.826
558 HG23 VAL 77 2HG2 VAL 77 10.000 6.817 7.585
559 H GLN 78 H GLN 78 14.299 7.514 6.339
560 HA GLN 78 HA GLN 78 13.681 9.013 3.889
561 HB2 GLN 78 2HB GLN 78 15.737 8.037 2.974
562 HB3 GLN 78 1HB GLN 78 16.069 8.836 4.502
563 HG2 GLN 78 2HG GLN 78 15.952 6.569 5.598
564 HG3 GLN 78 1HG GLN 78 15.850 5.885 3.986
565 HE21 GLN 78 1HE2 GLN 78 17.641 5.906 2.686
566 HE22 GLN 78 2HE2 GLN 78 19.220 6.251 3.273
567 H GLU 79 H GLU 79 13.038 6.169 5.577
568 HA GLU 79 HA GLU 79 11.462 5.061 3.502
569 HB2 GLU 79 2HB GLU 79 12.618 2.900 3.396
570 HB3 GLU 79 1HB GLU 79 13.677 4.185 2.841
571 HG2 GLU 79 2HG GLU 79 14.752 4.194 5.084
572 HG3 GLU 79 1HG GLU 79 13.760 2.803 5.516
573 H TRP 80 H TRP 80 10.165 3.299 4.374
574 HA TRP 80 HA TRP 80 10.349 2.675 7.146
575 HB2 TRP 80 2HB TRP 80 9.404 4.845 7.421
576 HB3 TRP 80 1HB TRP 80 8.144 4.578 6.235
577 HD1 TRP 80 HD TRP 80 5.901 3.600 7.142
578 HE1 TRP 80 1HE TRP 80 5.033 2.954 9.488
579 HE3 TRP 80 3HE TRP 80 10.330 3.726 9.691
580 HZ2 TRP 80 2HZ TRP 80 6.095 2.574 12.054
581 HZ3 TRP 80 3HZ TRP 80 10.309 3.212 12.091
582 HH2 TRP 80 HH TRP 80 8.225 2.656 13.243
583 H GLN 81 H GLN 81 9.167 0.897 7.594
584 HA GLN 81 HA GLN 81 7.704 -0.248 5.358
585 HB2 GLN 81 2HB GLN 81 7.654 -2.354 6.705
586 HB3 GLN 81 1HB GLN 81 9.280 -1.788 6.379
587 HG2 GLN 81 2HG GLN 81 9.358 -0.849 8.674
588 HG3 GLN 81 1HG GLN 81 7.767 -1.545 8.967
589 HE21 GLN 81 1HE2 GLN 81 11.133 -2.202 8.479
590 HE22 GLN 81 2HE2 GLN 81 11.083 -3.837 9.022
591 H LEU 82 H LEU 82 5.671 0.251 5.184
592 HA LEU 82 HA LEU 82 4.172 1.681 7.029
593 HB2 LEU 82 2HB LEU 82 3.123 -0.120 4.871
594 HB3 LEU 82 1HB LEU 82 2.205 1.096 5.715
595 HG LEU 82 HG LEU 82 4.507 1.574 3.839
596 HD11 LEU 82 1HD1 LEU 82 1.587 2.302 3.650
597 HD12 LEU 82 2HD1 LEU 82 2.360 0.985 2.776
598 HD13 LEU 82 3HD1 LEU 82 2.839 2.653 2.462
599 HD21 LEU 82 3HD2 LEU 82 3.906 3.955 4.184
600 HD22 LEU 82 1HD2 LEU 82 4.639 3.173 5.589
601 HD23 LEU 82 2HD2 LEU 82 2.901 3.438 5.538
602 H ALA 83 H ALA 83 2.935 1.212 8.711
603 HA ALA 83 HA ALA 83 2.013 -1.523 9.039
604 HB1 ALA 83 1HB ALA 83 2.099 -1.133 11.462
605 HB2 ALA 83 2HB ALA 83 2.820 0.454 11.174
606 HB3 ALA 83 3HB ALA 83 3.697 -1.012 10.729
607 H ASP 84 H ASP 84 0.035 -1.530 10.366
608 HA ASP 84 HA ASP 84 -1.849 0.228 9.154
609 HB2 ASP 84 2HB ASP 84 -2.479 -2.061 9.634
610 HB3 ASP 84 1HB ASP 84 -2.173 -1.813 11.348
611 H GLY 85 H GLY 85 -2.417 2.160 9.811
612 HA2 GLY 85 2HA GLY 85 -3.320 3.618 11.340
613 HA3 GLY 85 1HA GLY 85 -2.616 2.691 12.652
614 H ASP 86 H ASP 86 -0.411 3.319 10.105
615 HA ASP 86 HA ASP 86 1.106 5.011 11.851
616 HB2 ASP 86 2HB ASP 86 1.647 4.078 9.045
617 HB3 ASP 86 1HB ASP 86 2.675 5.258 9.846
618 H VAL 87 H VAL 87 1.514 7.070 11.814
619 HA VAL 87 HA VAL 87 -0.268 8.715 10.135
620 HB VAL 87 HB VAL 87 1.498 9.649 12.413
621 HG11 VAL 87 1HG1 VAL 87 0.754 11.395 10.920
622 HG12 VAL 87 2HG1 VAL 87 -0.002 11.558 12.506
623 HG13 VAL 87 3HG1 VAL 87 -0.927 10.909 11.149
624 HG21 VAL 87 3HG2 VAL 87 0.002 7.975 13.306
625 HG22 VAL 87 1HG2 VAL 87 -1.374 8.767 12.539
626 HG23 VAL 87 2HG2 VAL 87 -0.505 9.576 13.850
627 H ILE 88 H ILE 88 0.670 9.329 8.284
628 HA ILE 88 HA ILE 88 3.544 9.722 8.456
629 HB ILE 88 HB ILE 88 1.874 8.865 6.078
630 HG12 ILE 88 2HG1 ILE 88 3.892 7.433 7.819
631 HG13 ILE 88 1HG1 ILE 88 2.172 7.120 7.714
632 HG21 ILE 88 1HG2 ILE 88 4.856 9.304 6.275
633 HG22 ILE 88 2HG2 ILE 88 3.729 10.302 5.356
634 HG23 ILE 88 3HG2 ILE 88 4.006 8.625 4.887
635 HD11 ILE 88 3HD1 ILE 88 2.449 6.364 5.418
636 HD12 ILE 88 1HD1 ILE 88 3.452 5.435 6.533
637 HD13 ILE 88 2HD1 ILE 88 4.175 6.691 5.528
638 H ARG 89 H ARG 89 3.995 11.753 8.605
639 HA ARG 89 HA ARG 89 2.205 13.677 7.336
640 HB2 ARG 89 2HB ARG 89 4.075 14.062 9.678
641 HB3 ARG 89 1HB ARG 89 3.095 15.331 8.956
642 HG2 ARG 89 2HG ARG 89 1.062 14.018 9.534
643 HG3 ARG 89 1HG ARG 89 2.106 12.856 10.344
644 HD2 ARG 89 2HD ARG 89 1.102 14.398 11.929
645 HD3 ARG 89 1HD ARG 89 2.855 14.586 11.885
646 HE ARG 89 HE ARG 89 2.288 16.497 10.277
647 HH11 ARG 89 1HH1 ARG 89 0.096 15.608 12.938
648 HH12 ARG 89 2HH1 ARG 89 -0.347 17.210 13.274
649 HH21 ARG 89 1HH2 ARG 89 1.672 18.682 10.765
650 HH22 ARG 89 2HH2 ARG 89 0.576 19.017 12.020
651 H LEU 90 H LEU 90 2.942 15.039 5.913
652 HA LEU 90 HA LEU 90 5.769 14.933 5.234
653 HB2 LEU 90 2HB LEU 90 5.165 15.023 2.843
654 HB3 LEU 90 1HB LEU 90 4.663 13.531 3.582
655 HG LEU 90 HG LEU 90 2.696 15.782 3.159
656 HD11 LEU 90 1HD1 LEU 90 3.767 15.284 1.008
657 HD12 LEU 90 2HD1 LEU 90 2.104 14.700 1.048
658 HD13 LEU 90 3HD1 LEU 90 3.440 13.568 1.250
659 HD21 LEU 90 3HD2 LEU 90 1.087 13.944 3.143
660 HD22 LEU 90 1HD2 LEU 90 2.040 13.912 4.626
661 HD23 LEU 90 2HD2 LEU 90 2.394 12.774 3.326
662 H GLY 91 H GLY 91 6.394 16.822 3.923
663 HA2 GLY 91 2HA GLY 91 5.632 19.239 4.997
664 HA3 GLY 91 1HA GLY 91 6.300 19.063 3.379
665 H HIS 92 H HIS 92 3.852 20.380 4.936
666 HA HIS 92 HA HIS 92 2.054 21.483 4.208
667 HB2 HIS 92 2HB HIS 92 2.365 19.988 1.614
668 HB3 HIS 92 1HB HIS 92 1.095 21.156 1.908
669 HD1 HIS 92 1HD HIS 92 2.471 22.032 -0.331
670 HD2 HIS 92 2HD HIS 92 4.224 22.613 3.379
671 HE1 HIS 92 1HE HIS 92 4.166 23.890 -0.644
672 H SER 93 H SER 93 2.000 17.991 4.302
673 HA SER 93 HA SER 93 -0.809 18.159 5.037
674 HB2 SER 93 2HB SER 93 -0.757 18.002 2.520
675 HB3 SER 93 1HB SER 93 0.009 16.428 2.690
676 HG SER 93 HG SER 93 -2.609 17.176 3.034
677 H GLU 94 H GLU 94 -1.558 15.570 5.084
678 HA GLU 94 HA GLU 94 0.518 13.882 6.143
679 HB2 GLU 94 2HB GLU 94 -0.697 13.340 8.209
680 HB3 GLU 94 1HB GLU 94 -0.217 15.028 8.178
681 HG2 GLU 94 2HG GLU 94 -2.483 15.686 7.624
682 HG3 GLU 94 1HG GLU 94 -2.955 13.988 7.533
683 H ILE 95 H ILE 95 -0.052 11.714 6.065
684 HA ILE 95 HA ILE 95 -2.628 11.153 4.854
685 HB ILE 95 HB ILE 95 -0.780 11.232 3.126
686 HG12 ILE 95 2HG1 ILE 95 -1.298 8.993 2.096
687 HG13 ILE 95 1HG1 ILE 95 -2.190 8.612 3.567
688 HG21 ILE 95 1HG2 ILE 95 0.838 9.409 2.981
689 HG22 ILE 95 2HG2 ILE 95 0.303 8.826 4.557
690 HG23 ILE 95 3HG2 ILE 95 1.075 10.406 4.419
691 HD11 ILE 95 3HD1 ILE 95 -3.668 9.399 1.786
692 HD12 ILE 95 1HD1 ILE 95 -2.767 10.908 1.712
693 HD13 ILE 95 2HD1 ILE 95 -3.682 10.495 3.161
694 H ILE 96 H ILE 96 -3.604 9.359 5.706
695 HA ILE 96 HA ILE 96 -2.211 8.072 7.952
696 HB ILE 96 HB ILE 96 -5.163 8.010 7.243
697 HG12 ILE 96 2HG1 ILE 96 -3.781 9.741 9.313
698 HG13 ILE 96 1HG1 ILE 96 -4.322 10.316 7.744
699 HG21 ILE 96 1HG2 ILE 96 -5.459 7.248 9.566
700 HG22 ILE 96 2HG2 ILE 96 -3.711 7.271 9.794
701 HG23 ILE 96 3HG2 ILE 96 -4.432 6.144 8.649
702 HD11 ILE 96 3HD1 ILE 96 -6.626 9.796 8.351
703 HD12 ILE 96 1HD1 ILE 96 -5.888 10.912 9.502
704 HD13 ILE 96 2HD1 ILE 96 -6.076 9.208 9.919
705 H VAL 97 H VAL 97 -1.691 5.961 7.848
706 HA VAL 97 HA VAL 97 -2.465 4.513 5.433
707 HB VAL 97 HB VAL 97 -0.177 4.076 7.373
708 HG11 VAL 97 1HG1 VAL 97 -0.919 2.478 4.928
709 HG12 VAL 97 2HG1 VAL 97 -1.055 1.928 6.600
710 HG13 VAL 97 3HG1 VAL 97 0.536 2.263 5.908
711 HG21 VAL 97 3HG2 VAL 97 0.122 5.908 5.806
712 HG22 VAL 97 1HG2 VAL 97 -0.250 4.817 4.470
713 HG23 VAL 97 2HG2 VAL 97 1.203 4.558 5.439
714 H ARG 98 H ARG 98 -4.025 3.213 5.530
715 HA ARG 98 HA ARG 98 -4.553 1.801 8.048
716 HB2 ARG 98 2HB ARG 98 -6.200 3.464 6.542
717 HB3 ARG 98 1HB ARG 98 -6.650 1.854 6.017
718 HG2 ARG 98 2HG ARG 98 -6.616 2.893 8.796
719 HG3 ARG 98 1HG ARG 98 -8.076 2.611 7.832
720 HD2 ARG 98 2HD ARG 98 -7.311 0.177 7.712
721 HD3 ARG 98 1HD ARG 98 -6.131 0.607 8.948
722 HE ARG 98 HE ARG 98 -8.815 1.299 9.628
723 HH11 ARG 98 1HH1 ARG 98 -6.273 -1.134 9.911
724 HH12 ARG 98 2HH1 ARG 98 -7.116 -2.119 11.010
725 HH21 ARG 98 1HH2 ARG 98 -9.948 0.028 11.188
726 HH22 ARG 98 2HH2 ARG 98 -9.267 -1.414 11.816
727 H MET 99 H MET 99 -4.243 -0.401 7.895
728 HA MET 99 HA MET 99 -4.087 -1.398 5.148
729 HB2 MET 99 2HB MET 99 -2.601 -2.518 7.519
730 HB3 MET 99 1HB MET 99 -2.579 -3.180 5.895
731 HG2 MET 99 2HG MET 99 -1.701 -0.886 5.190
732 HG3 MET 99 1HG MET 99 -1.366 -0.640 6.900
733 HE1 MET 99 3HE MET 99 -0.631 -3.795 7.664
734 HE2 MET 99 1HE MET 99 0.175 -2.370 8.328
735 HE3 MET 99 2HE MET 99 1.123 -3.661 7.587
736 H HIS 100 H HIS 100 -5.698 -2.469 4.621
737 HA HIS 100 HA HIS 100 -7.257 -3.849 6.636
738 HB2 HIS 100 2HB HIS 100 -7.844 -3.140 3.744
739 HB3 HIS 100 1HB HIS 100 -8.914 -4.129 4.728
740 HD1 HIS 100 1HD HIS 100 -10.841 -2.746 5.590
741 HD2 HIS 100 2HD HIS 100 -7.337 -0.523 5.254
742 HE1 HIS 100 1HE HIS 100 -11.389 -0.450 6.423
Start of MODEL 3
1 H1 GLY 1 1HT GLY 1 -6.036 -16.854 -9.608
2 H2 GLY 1 2HT GLY 1 -4.618 -16.000 -9.337
3 H3 GLY 1 3HT GLY 1 -5.966 -15.196 -9.966
4 HA2 GLY 1 1HA GLY 1 -5.641 -14.713 -7.620
5 HA3 GLY 1 2HA GLY 1 -7.137 -15.608 -7.891
6 H HIS 2 H HIS 2 -6.162 -15.721 -5.416
7 HA HIS 2 HA HIS 2 -5.443 -18.528 -5.302
8 HB2 HIS 2 2HB HIS 2 -3.683 -18.182 -3.557
9 HB3 HIS 2 1HB HIS 2 -3.236 -17.562 -5.128
10 HD1 HIS 2 1HD HIS 2 -1.943 -15.439 -4.866
11 HD2 HIS 2 2HD HIS 2 -4.867 -15.851 -1.936
12 HE1 HIS 2 1HE HIS 2 -1.724 -13.434 -3.368
13 H GLY 3 H GLY 3 -7.668 -16.581 -4.634
14 HA2 GLY 3 2HA GLY 3 -9.380 -17.575 -3.158
15 HA3 GLY 3 1HA GLY 3 -8.134 -17.587 -1.911
16 H SER 4 H SER 4 -10.373 -16.320 -1.263
17 HA SER 4 HA SER 4 -10.210 -13.557 -1.982
18 HB2 SER 4 2HB SER 4 -11.939 -14.893 0.119
19 HB3 SER 4 1HB SER 4 -12.155 -13.267 -0.534
20 HG SER 4 HG SER 4 -12.486 -15.758 -1.795
21 H ALA 5 H ALA 5 -8.026 -13.425 -1.322
22 HA ALA 5 HA ALA 5 -7.762 -12.367 1.351
23 HB1 ALA 5 1HB ALA 5 -5.932 -14.493 0.228
24 HB2 ALA 5 2HB ALA 5 -7.030 -14.689 1.595
25 HB3 ALA 5 3HB ALA 5 -5.654 -13.590 1.716
26 H GLY 6 H GLY 6 -6.795 -10.488 1.133
27 HA2 GLY 6 2HA GLY 6 -4.589 -10.032 -0.545
28 HA3 GLY 6 1HA GLY 6 -6.063 -9.375 -1.265
29 H THR 7 H THR 7 -3.755 -9.144 1.287
30 HA THR 7 HA THR 7 -4.888 -7.317 2.983
31 HB THR 7 HB THR 7 -2.009 -7.354 2.074
32 HG1 THR 7 1HG THR 7 -3.369 -9.006 3.969
33 HG21 THR 7 3HG2 THR 7 -1.562 -6.706 4.412
34 HG22 THR 7 1HG2 THR 7 -3.293 -6.703 4.745
35 HG23 THR 7 2HG2 THR 7 -2.613 -5.529 3.622
36 H SER 8 H SER 8 -5.691 -5.411 2.535
37 HA SER 8 HA SER 8 -4.663 -3.939 0.234
38 HB2 SER 8 2HB SER 8 -7.314 -3.742 1.644
39 HB3 SER 8 1HB SER 8 -6.836 -2.836 0.205
40 HG SER 8 HG SER 8 -6.684 -5.639 0.255
41 H VAL 9 H VAL 9 -3.407 -2.371 0.744
42 HA VAL 9 HA VAL 9 -3.569 -1.183 3.396
43 HB VAL 9 HB VAL 9 -1.593 -0.615 1.165
44 HG11 VAL 9 1HG1 VAL 9 -1.504 0.016 4.117
45 HG12 VAL 9 2HG1 VAL 9 -1.753 1.178 2.812
46 HG13 VAL 9 3HG1 VAL 9 -0.207 0.342 2.970
47 HG21 VAL 9 3HG2 VAL 9 -1.292 -2.471 3.528
48 HG22 VAL 9 1HG2 VAL 9 -0.006 -2.036 2.401
49 HG23 VAL 9 2HG2 VAL 9 -1.409 -2.941 1.834
50 H THR 10 H THR 10 -4.805 0.474 3.635
51 HA THR 10 HA THR 10 -5.662 1.950 1.257
52 HB THR 10 HB THR 10 -7.156 1.587 3.870
53 HG1 THR 10 1HG THR 10 -7.858 -0.241 3.081
54 HG21 THR 10 3HG2 THR 10 -9.088 2.379 2.564
55 HG22 THR 10 1HG2 THR 10 -8.056 2.563 1.146
56 HG23 THR 10 2HG2 THR 10 -7.798 3.581 2.564
57 H LEU 11 H LEU 11 -5.024 3.994 1.226
58 HA LEU 11 HA LEU 11 -4.087 5.124 3.715
59 HB2 LEU 11 2HB LEU 11 -2.971 6.862 2.338
60 HB3 LEU 11 1HB LEU 11 -2.440 5.247 1.976
61 HG LEU 11 HG LEU 11 -4.100 5.404 -0.016
62 HD11 LEU 11 1HD1 LEU 11 -5.186 7.507 0.582
63 HD12 LEU 11 2HD1 LEU 11 -4.336 7.658 -0.963
64 HD13 LEU 11 3HD1 LEU 11 -3.635 8.339 0.483
65 HD21 LEU 11 3HD2 LEU 11 -1.517 6.946 0.028
66 HD22 LEU 11 1HD2 LEU 11 -2.333 6.362 -1.422
67 HD23 LEU 11 2HD2 LEU 11 -1.705 5.214 -0.239
68 H GLN 12 H GLN 12 -5.076 6.617 4.728
69 HA GLN 12 HA GLN 12 -7.571 7.666 3.586
70 HB2 GLN 12 2HB GLN 12 -7.555 6.352 5.783
71 HB3 GLN 12 1HB GLN 12 -6.740 7.743 6.472
72 HG2 GLN 12 2HG GLN 12 -8.664 9.152 5.684
73 HG3 GLN 12 1HG GLN 12 -9.501 7.652 5.294
74 HE21 GLN 12 1HE2 GLN 12 -8.361 9.715 7.742
75 HE22 GLN 12 2HE2 GLN 12 -9.155 8.975 9.079
76 H LEU 13 H LEU 13 -7.548 9.673 3.016
77 HA LEU 13 HA LEU 13 -5.336 11.429 3.783
78 HB2 LEU 13 2HB LEU 13 -5.518 11.016 1.412
79 HB3 LEU 13 1HB LEU 13 -7.225 11.399 1.437
80 HG LEU 13 HG LEU 13 -6.644 13.706 2.077
81 HD11 LEU 13 1HD1 LEU 13 -4.467 13.374 3.029
82 HD12 LEU 13 2HD1 LEU 13 -4.353 14.507 1.684
83 HD13 LEU 13 3HD1 LEU 13 -3.823 12.834 1.478
84 HD21 LEU 13 3HD2 LEU 13 -5.922 14.395 -0.170
85 HD22 LEU 13 1HD2 LEU 13 -7.196 13.175 -0.201
86 HD23 LEU 13 2HD2 LEU 13 -5.523 12.715 -0.537
87 H ASP 14 H ASP 14 -5.853 12.958 5.235
88 HA ASP 14 HA ASP 14 -8.667 13.583 5.360
89 HB2 ASP 14 2HB ASP 14 -7.779 12.898 7.523
90 HB3 ASP 14 1HB ASP 14 -6.582 14.196 7.449
91 H ASP 15 H ASP 15 -9.045 14.914 3.988
92 HA ASP 15 HA ASP 15 -7.498 17.345 3.700
93 HB2 ASP 15 2HB ASP 15 -8.795 17.605 1.654
94 HB3 ASP 15 1HB ASP 15 -8.102 15.986 1.719
95 H GLY 16 H GLY 16 -9.783 16.235 5.700
96 HA2 GLY 16 2HA GLY 16 -11.090 17.687 7.057
97 HA3 GLY 16 1HA GLY 16 -11.399 18.677 5.627
98 H SER 17 H SER 17 -11.594 16.072 4.090
99 HA SER 17 HA SER 17 -14.410 15.573 4.694
100 HB2 SER 17 2HB SER 17 -12.896 14.731 2.224
101 HB3 SER 17 1HB SER 17 -14.632 14.980 2.416
102 HG SER 17 HG SER 17 -12.594 16.757 1.931
103 H GLY 18 H GLY 18 -11.433 13.936 3.624
104 HA2 GLY 18 2HA GLY 18 -10.498 12.077 4.785
105 HA3 GLY 18 1HA GLY 18 -12.107 11.662 5.362
106 H ARG 19 H ARG 19 -9.987 11.682 2.623
107 HA ARG 19 HA ARG 19 -11.827 9.899 1.172
108 HB2 ARG 19 2HB ARG 19 -9.396 11.394 0.242
109 HB3 ARG 19 1HB ARG 19 -10.256 10.184 -0.700
110 HG2 ARG 19 2HG ARG 19 -11.452 12.774 0.327
111 HG3 ARG 19 1HG ARG 19 -10.828 12.543 -1.305
112 HD2 ARG 19 2HD ARG 19 -13.174 12.296 -1.465
113 HD3 ARG 19 1HD ARG 19 -12.515 10.672 -1.550
114 HE ARG 19 HE ARG 19 -13.489 11.693 1.021
115 HH11 ARG 19 1HH1 ARG 19 -13.825 9.334 -1.625
116 HH12 ARG 19 2HH1 ARG 19 -15.114 8.511 -0.896
117 HH21 ARG 19 1HH2 ARG 19 -15.208 10.517 2.032
118 HH22 ARG 19 2HH2 ARG 19 -15.919 9.180 1.261
119 H THR 20 H THR 20 -10.806 8.048 0.027
120 HA THR 20 HA THR 20 -8.423 7.104 1.380
121 HB THR 20 HB THR 20 -9.556 4.800 1.379
122 HG1 THR 20 1HG THR 20 -11.937 5.189 1.728
123 HG21 THR 20 3HG2 THR 20 -10.649 5.238 3.556
124 HG22 THR 20 1HG2 THR 20 -10.587 6.967 3.194
125 HG23 THR 20 2HG2 THR 20 -9.090 6.062 3.427
126 H TYR 21 H TYR 21 -7.224 5.636 0.212
127 HA TYR 21 HA TYR 21 -8.046 4.966 -2.508
128 HB2 TYR 21 2HB TYR 21 -6.680 7.015 -2.730
129 HB3 TYR 21 1HB TYR 21 -5.422 6.270 -1.759
130 HD1 TYR 21 2HD TYR 21 -7.144 6.085 -5.049
131 HD2 TYR 21 1HD TYR 21 -3.749 4.924 -2.759
132 HE1 TYR 21 2HE TYR 21 -6.042 5.266 -7.097
133 HE2 TYR 21 1HE TYR 21 -2.641 4.115 -4.800
134 HH TYR 21 HH TYR 21 -3.657 4.898 -7.872
135 H GLN 22 H GLN 22 -7.530 2.929 -2.984
136 HA GLN 22 HA GLN 22 -6.207 1.314 -0.975
137 HB2 GLN 22 2HB GLN 22 -8.248 0.470 -2.060
138 HB3 GLN 22 1HB GLN 22 -7.459 0.563 -3.628
139 HG2 GLN 22 2HG GLN 22 -5.750 -1.065 -2.754
140 HG3 GLN 22 1HG GLN 22 -6.777 -1.268 -1.340
141 HE21 GLN 22 1HE2 GLN 22 -7.096 -3.442 -1.785
142 HE22 GLN 22 2HE2 GLN 22 -8.107 -3.983 -3.055
143 H LEU 23 H LEU 23 -4.075 0.888 -1.074
144 HA LEU 23 HA LEU 23 -2.519 1.569 -3.351
145 HB2 LEU 23 2HB LEU 23 -1.871 -0.099 -0.932
146 HB3 LEU 23 1HB LEU 23 -0.707 0.321 -2.171
147 HG LEU 23 HG LEU 23 -2.102 2.250 -0.313
148 HD11 LEU 23 1HD1 LEU 23 -0.422 0.948 0.816
149 HD12 LEU 23 2HD1 LEU 23 0.218 2.569 0.530
150 HD13 LEU 23 3HD1 LEU 23 0.704 1.215 -0.501
151 HD21 LEU 23 3HD2 LEU 23 -0.043 2.681 -2.449
152 HD22 LEU 23 1HD2 LEU 23 -0.540 3.903 -1.284
153 HD23 LEU 23 2HD2 LEU 23 -1.701 3.298 -2.465
154 H ARG 24 H ARG 24 -2.089 0.429 -5.012
155 HA ARG 24 HA ARG 24 -3.149 -2.290 -5.155
156 HB2 ARG 24 2HB ARG 24 -2.865 -2.059 -7.601
157 HB3 ARG 24 1HB ARG 24 -3.891 -0.813 -6.905
158 HG2 ARG 24 2HG ARG 24 -2.037 0.769 -7.003
159 HG3 ARG 24 1HG ARG 24 -1.012 -0.484 -7.705
160 HD2 ARG 24 2HD ARG 24 -1.950 1.041 -9.363
161 HD3 ARG 24 1HD ARG 24 -2.429 -0.630 -9.644
162 HE ARG 24 HE ARG 24 -4.534 0.002 -8.426
163 HH11 ARG 24 1HH1 ARG 24 -2.799 2.389 -10.425
164 HH12 ARG 24 2HH1 ARG 24 -4.207 3.315 -10.719
165 HH21 ARG 24 1HH2 ARG 24 -6.412 1.266 -8.875
166 HH22 ARG 24 2HH2 ARG 24 -6.284 2.675 -9.832
167 H GLU 25 H GLU 25 -1.765 -3.769 -6.569
168 HA GLU 25 HA GLU 25 0.735 -3.835 -5.185
169 HB2 GLU 25 2HB GLU 25 1.148 -6.016 -6.332
170 HB3 GLU 25 1HB GLU 25 -0.306 -5.958 -5.360
171 HG2 GLU 25 2HG GLU 25 -1.639 -5.693 -7.406
172 HG3 GLU 25 1HG GLU 25 -0.158 -5.790 -8.363
173 H GLY 26 H GLY 26 2.662 -3.453 -5.790
174 HA2 GLY 26 2HA GLY 26 4.290 -3.163 -7.605
175 HA3 GLY 26 1HA GLY 26 3.016 -2.302 -8.481
176 H SER 27 H SER 27 4.962 -0.640 -8.298
177 HA SER 27 HA SER 27 4.557 0.718 -5.782
178 HB2 SER 27 2HB SER 27 6.670 1.949 -6.381
179 HB3 SER 27 1HB SER 27 6.852 0.217 -6.109
180 HG SER 27 HG SER 27 7.958 0.784 -7.947
181 H ASN 28 H ASN 28 3.988 2.834 -5.687
182 HA ASN 28 HA ASN 28 3.190 4.058 -8.219
183 HB2 ASN 28 2HB ASN 28 1.409 5.288 -6.966
184 HB3 ASN 28 1HB ASN 28 1.130 3.552 -7.037
185 HD21 ASN 28 1HD2 ASN 28 1.210 2.392 -5.174
186 HD22 ASN 28 2HD2 ASN 28 1.221 3.110 -3.613
187 H ILE 29 H ILE 29 3.635 6.150 -8.512
188 HA ILE 29 HA ILE 29 5.658 7.227 -6.695
189 HB ILE 29 HB ILE 29 5.010 7.985 -9.559
190 HG12 ILE 29 2HG1 ILE 29 7.377 6.455 -8.439
191 HG13 ILE 29 1HG1 ILE 29 6.041 5.752 -9.337
192 HG21 ILE 29 1HG2 ILE 29 7.280 8.917 -7.774
193 HG22 ILE 29 2HG2 ILE 29 5.905 9.889 -8.274
194 HG23 ILE 29 3HG2 ILE 29 7.074 9.335 -9.476
195 HD11 ILE 29 3HD1 ILE 29 8.027 7.751 -10.405
196 HD12 ILE 29 1HD1 ILE 29 6.695 7.038 -11.313
197 HD13 ILE 29 2HD1 ILE 29 8.010 6.018 -10.737
198 H ILE 30 H ILE 30 5.161 8.875 -5.481
199 HA ILE 30 HA ILE 30 2.649 10.283 -5.893
200 HB ILE 30 HB ILE 30 4.231 9.567 -3.415
201 HG12 ILE 30 2HG1 ILE 30 1.388 8.984 -4.247
202 HG13 ILE 30 1HG1 ILE 30 2.729 7.844 -4.261
203 HG21 ILE 30 1HG2 ILE 30 1.945 11.494 -3.516
204 HG22 ILE 30 2HG2 ILE 30 3.617 11.830 -3.071
205 HG23 ILE 30 3HG2 ILE 30 2.627 10.783 -2.054
206 HD11 ILE 30 3HD1 ILE 30 1.215 7.502 -2.387
207 HD12 ILE 30 1HD1 ILE 30 1.530 9.142 -1.826
208 HD13 ILE 30 2HD1 ILE 30 2.828 7.939 -1.837
209 H GLY 31 H GLY 31 2.836 12.282 -6.581
210 HA2 GLY 31 2HA GLY 31 4.040 14.427 -5.532
211 HA3 GLY 31 1HA GLY 31 5.326 13.758 -6.569
212 H ARG 32 H ARG 32 4.795 16.027 -7.508
213 HA ARG 32 HA ARG 32 2.476 15.689 -9.252
214 HB2 ARG 32 2HB ARG 32 3.831 18.221 -8.363
215 HB3 ARG 32 1HB ARG 32 2.697 18.171 -9.703
216 HG2 ARG 32 2HG ARG 32 1.118 17.039 -7.973
217 HG3 ARG 32 1HG ARG 32 2.232 17.707 -6.807
218 HD2 ARG 32 2HD ARG 32 1.840 19.922 -7.400
219 HD3 ARG 32 1HD ARG 32 1.113 19.490 -8.943
220 HE ARG 32 HE ARG 32 -0.334 18.495 -6.689
221 HH11 ARG 32 1HH1 ARG 32 0.101 21.408 -8.678
222 HH12 ARG 32 2HH1 ARG 32 -1.474 21.957 -8.411
223 HH21 ARG 32 1HH2 ARG 32 -2.446 19.235 -6.393
224 HH22 ARG 32 2HH2 ARG 32 -2.979 20.717 -7.071
225 H GLY 33 H GLY 33 2.982 14.836 -11.044
226 HA2 GLY 33 2HA GLY 33 4.672 16.112 -12.880
227 HA3 GLY 33 1HA GLY 33 5.458 14.686 -12.205
228 H GLN 34 H GLN 34 5.245 14.220 -14.577
229 HA GLN 34 HA GLN 34 2.651 13.114 -15.250
230 HB2 GLN 34 2HB GLN 34 3.596 12.756 -17.545
231 HB3 GLN 34 1HB GLN 34 3.560 14.430 -17.042
232 HG2 GLN 34 2HG GLN 34 6.032 12.688 -16.991
233 HG3 GLN 34 1HG GLN 34 5.601 13.766 -18.313
234 HE21 GLN 34 1HE2 GLN 34 5.730 16.043 -17.952
235 HE22 GLN 34 2HE2 GLN 34 6.649 16.674 -16.658
236 H ASP 35 H ASP 35 5.861 12.118 -14.368
237 HA ASP 35 HA ASP 35 5.346 9.352 -15.010
238 HB2 ASP 35 2HB ASP 35 7.541 8.906 -13.999
239 HB3 ASP 35 1HB ASP 35 7.659 10.241 -15.133
240 H ALA 36 H ALA 36 4.838 11.523 -12.500
241 HA ALA 36 HA ALA 36 4.547 9.735 -10.344
242 HB1 ALA 36 1HB ALA 36 3.319 11.557 -9.269
243 HB2 ALA 36 2HB ALA 36 3.252 12.418 -10.807
244 HB3 ALA 36 3HB ALA 36 4.804 12.139 -10.016
245 H GLN 37 H GLN 37 2.794 8.626 -9.657
246 HA GLN 37 HA GLN 37 0.652 8.243 -11.608
247 HB2 GLN 37 2HB GLN 37 1.705 6.572 -9.341
248 HB3 GLN 37 1HB GLN 37 0.242 6.170 -10.227
249 HG2 GLN 37 2HG GLN 37 1.497 5.946 -12.276
250 HG3 GLN 37 1HG GLN 37 2.965 6.493 -11.469
251 HE21 GLN 37 1HE2 GLN 37 4.149 5.048 -10.266
252 HE22 GLN 37 2HE2 GLN 37 3.734 3.384 -10.151
253 H PHE 38 H PHE 38 1.343 9.364 -8.445
254 HA PHE 38 HA PHE 38 -1.463 10.035 -8.032
255 HB2 PHE 38 2HB PHE 38 -0.901 8.180 -6.538
256 HB3 PHE 38 1HB PHE 38 0.559 9.010 -6.028
257 HD1 PHE 38 1HD PHE 38 0.366 11.022 -4.548
258 HD2 PHE 38 2HD PHE 38 -3.015 8.643 -5.549
259 HE1 PHE 38 1HE PHE 38 -0.813 11.963 -2.663
260 HE2 PHE 38 2HE PHE 38 -4.247 9.611 -3.645
261 HZ PHE 38 HZ PHE 38 -3.154 11.277 -2.192
262 H ARG 39 H ARG 39 -1.635 12.174 -7.842
263 HA ARG 39 HA ARG 39 0.720 13.647 -7.051
264 HB2 ARG 39 2HB ARG 39 -0.490 15.546 -8.437
265 HB3 ARG 39 1HB ARG 39 0.627 14.391 -9.161
266 HG2 ARG 39 2HG ARG 39 -2.288 13.819 -9.190
267 HG3 ARG 39 1HG ARG 39 -1.637 15.005 -10.323
268 HD2 ARG 39 2HD ARG 39 0.005 13.296 -11.095
269 HD3 ARG 39 1HD ARG 39 -0.758 12.122 -10.026
270 HE ARG 39 HE ARG 39 -2.829 12.655 -11.367
271 HH11 ARG 39 1HH1 ARG 39 0.455 12.686 -12.802
272 HH12 ARG 39 2HH1 ARG 39 -0.092 12.318 -14.366
273 HH21 ARG 39 1HH2 ARG 39 -3.530 12.128 -13.550
274 HH22 ARG 39 2HH2 ARG 39 -2.382 11.971 -14.797
275 H LEU 40 H LEU 40 0.555 15.126 -5.565
276 HA LEU 40 HA LEU 40 -1.716 14.958 -3.868
277 HB2 LEU 40 2HB LEU 40 0.762 16.643 -3.680
278 HB3 LEU 40 1HB LEU 40 -0.525 16.725 -2.504
279 HG LEU 40 HG LEU 40 -0.128 14.230 -2.157
280 HD11 LEU 40 1HD1 LEU 40 2.419 14.921 -3.563
281 HD12 LEU 40 2HD1 LEU 40 1.174 13.803 -4.116
282 HD13 LEU 40 3HD1 LEU 40 2.103 13.443 -2.655
283 HD21 LEU 40 3HD2 LEU 40 1.988 16.213 -1.375
284 HD22 LEU 40 1HD2 LEU 40 1.673 14.650 -0.607
285 HD23 LEU 40 2HD2 LEU 40 0.446 15.926 -0.557
286 HA PRO 41 HA PRO 41 -3.955 18.457 -5.291
287 HB2 PRO 41 2HB PRO 41 -5.557 18.807 -3.191
288 HB3 PRO 41 1HB PRO 41 -5.658 17.354 -4.206
289 HG2 PRO 41 2HG PRO 41 -4.327 17.717 -1.554
290 HG3 PRO 41 1HG PRO 41 -5.378 16.403 -2.123
291 HD2 PRO 41 2HD PRO 41 -2.674 16.244 -2.087
292 HD3 PRO 41 1HD PRO 41 -3.707 15.366 -3.236
293 H ASP 42 H ASP 42 -1.320 19.009 -3.751
294 HA ASP 42 HA ASP 42 -2.048 21.743 -3.062
295 HB2 ASP 42 2HB ASP 42 -1.656 20.098 -0.969
296 HB3 ASP 42 1HB ASP 42 0.029 20.457 -1.386
297 H THR 43 H THR 43 0.252 22.874 -2.597
298 HA THR 43 HA THR 43 1.681 22.366 -5.088
299 HB THR 43 HB THR 43 1.642 24.924 -3.463
300 HG1 THR 43 1HG THR 43 -0.398 24.921 -3.954
301 HG21 THR 43 3HG2 THR 43 2.100 24.367 -6.397
302 HG22 THR 43 1HG2 THR 43 3.351 24.758 -5.214
303 HG23 THR 43 2HG2 THR 43 2.127 25.958 -5.633
304 H GLY 44 H GLY 44 4.128 23.099 -4.894
305 HA2 GLY 44 2HA GLY 44 6.100 23.406 -3.677
306 HA3 GLY 44 1HA GLY 44 5.231 23.016 -2.200
307 H VAL 45 H VAL 45 4.417 20.828 -4.456
308 HA VAL 45 HA VAL 45 6.174 18.826 -3.270
309 HB VAL 45 HB VAL 45 3.779 18.383 -5.084
310 HG11 VAL 45 1HG1 VAL 45 5.171 16.497 -3.224
311 HG12 VAL 45 2HG1 VAL 45 5.336 16.538 -4.977
312 HG13 VAL 45 3HG1 VAL 45 3.778 16.148 -4.251
313 HG21 VAL 45 3HG2 VAL 45 3.065 19.567 -3.070
314 HG22 VAL 45 1HG2 VAL 45 3.873 18.361 -2.069
315 HG23 VAL 45 2HG2 VAL 45 2.489 17.899 -3.061
316 H SER 46 H SER 46 7.736 17.863 -4.421
317 HA SER 46 HA SER 46 8.514 18.789 -6.975
318 HB2 SER 46 2HB SER 46 9.410 16.327 -5.475
319 HB3 SER 46 1HB SER 46 10.329 17.276 -6.644
320 HG SER 46 HG SER 46 10.520 18.899 -5.245
321 H ARG 47 H ARG 47 9.063 16.921 -8.696
322 HA ARG 47 HA ARG 47 6.582 15.797 -9.473
323 HB2 ARG 47 2HB ARG 47 7.785 14.681 -11.325
324 HB3 ARG 47 1HB ARG 47 8.143 16.390 -11.227
325 HG2 ARG 47 2HG ARG 47 10.284 15.831 -10.127
326 HG3 ARG 47 1HG ARG 47 9.895 14.119 -10.319
327 HD2 ARG 47 2HD ARG 47 10.136 16.113 -12.554
328 HD3 ARG 47 1HD ARG 47 11.408 14.977 -12.091
329 HE ARG 47 HE ARG 47 9.039 13.539 -12.642
330 HH11 ARG 47 1HH1 ARG 47 11.439 15.442 -14.457
331 HH12 ARG 47 2HH1 ARG 47 11.210 14.549 -15.887
332 HH21 ARG 47 1HH2 ARG 47 8.777 12.417 -14.488
333 HH22 ARG 47 2HH2 ARG 47 9.683 12.718 -15.934
334 H ARG 48 H ARG 48 9.344 14.534 -7.829
335 HA ARG 48 HA ARG 48 7.742 12.196 -7.162
336 HB2 ARG 48 2HB ARG 48 10.734 12.353 -7.565
337 HB3 ARG 48 1HB ARG 48 9.904 10.983 -6.849
338 HG2 ARG 48 2HG ARG 48 8.677 10.646 -8.932
339 HG3 ARG 48 1HG ARG 48 9.541 11.999 -9.663
340 HD2 ARG 48 2HD ARG 48 11.647 10.837 -9.351
341 HD3 ARG 48 1HD ARG 48 10.811 9.518 -8.531
342 HE ARG 48 HE ARG 48 9.737 9.981 -11.110
343 HH11 ARG 48 1HH1 ARG 48 12.501 8.451 -9.477
344 HH12 ARG 48 2HH1 ARG 48 12.755 7.292 -10.694
345 HH21 ARG 48 1HH2 ARG 48 10.081 8.511 -12.736
346 HH22 ARG 48 2HH2 ARG 48 11.322 7.331 -12.673
347 H HIS 49 H HIS 49 7.106 12.547 -5.223
348 HA HIS 49 HA HIS 49 8.876 13.916 -3.320
349 HB2 HIS 49 2HB HIS 49 6.837 15.120 -3.404
350 HB3 HIS 49 1HB HIS 49 5.830 13.692 -3.398
351 HD2 HIS 49 2HD HIS 49 5.377 12.576 -0.833
352 HE1 HIS 49 1HE HIS 49 7.283 15.693 1.282
353 HE2 HIS 49 2HE HIS 49 6.373 13.363 1.412
354 H LEU 50 H LEU 50 7.056 11.025 -3.949
355 HA LEU 50 HA LEU 50 8.560 9.559 -2.055
356 HB2 LEU 50 2HB LEU 50 7.044 10.755 -0.551
357 HB3 LEU 50 1HB LEU 50 5.671 10.273 -1.501
358 HG LEU 50 HG LEU 50 7.286 8.138 -0.160
359 HD11 LEU 50 1HD1 LEU 50 5.198 9.900 1.147
360 HD12 LEU 50 2HD1 LEU 50 6.920 9.932 1.519
361 HD13 LEU 50 3HD1 LEU 50 5.974 8.493 1.876
362 HD21 LEU 50 3HD2 LEU 50 4.349 8.583 -0.643
363 HD22 LEU 50 1HD2 LEU 50 5.081 7.120 0.011
364 HD23 LEU 50 2HD2 LEU 50 5.404 7.599 -1.658
365 H GLU 51 H GLU 51 7.975 7.328 -2.221
366 HA GLU 51 HA GLU 51 5.977 6.635 -4.228
367 HB2 GLU 51 2HB GLU 51 7.500 4.980 -5.275
368 HB3 GLU 51 1HB GLU 51 8.001 6.636 -5.551
369 HG2 GLU 51 2HG GLU 51 9.680 6.417 -3.802
370 HG3 GLU 51 1HG GLU 51 9.137 4.776 -3.488
371 H ILE 52 H ILE 52 4.925 4.813 -3.815
372 HA ILE 52 HA ILE 52 5.741 3.373 -1.388
373 HB ILE 52 HB ILE 52 2.941 3.611 -2.525
374 HG12 ILE 52 2HG1 ILE 52 4.129 4.870 -0.037
375 HG13 ILE 52 1HG1 ILE 52 3.746 5.731 -1.520
376 HG21 ILE 52 1HG2 ILE 52 3.990 2.336 0.004
377 HG22 ILE 52 2HG2 ILE 52 3.325 1.500 -1.400
378 HG23 ILE 52 3HG2 ILE 52 2.284 2.524 -0.405
379 HD11 ILE 52 3HD1 ILE 52 1.766 4.341 0.275
380 HD12 ILE 52 1HD1 ILE 52 1.383 5.213 -1.209
381 HD13 ILE 52 2HD1 ILE 52 2.045 6.081 0.179
382 H ARG 53 H ARG 53 6.584 1.493 -1.888
383 HA ARG 53 HA ARG 53 5.558 0.125 -4.244
384 HB2 ARG 53 2HB ARG 53 7.965 0.151 -4.225
385 HB3 ARG 53 1HB ARG 53 8.013 -0.453 -2.571
386 HG2 ARG 53 2HG ARG 53 6.904 -2.532 -3.357
387 HG3 ARG 53 1HG ARG 53 7.029 -1.921 -5.002
388 HD2 ARG 53 2HD ARG 53 9.378 -2.043 -4.967
389 HD3 ARG 53 1HD ARG 53 9.417 -2.263 -3.214
390 HE ARG 53 HE ARG 53 7.933 -4.316 -4.478
391 HH11 ARG 53 1HH1 ARG 53 11.287 -3.282 -3.990
392 HH12 ARG 53 2HH1 ARG 53 11.901 -4.850 -3.896
393 HH21 ARG 53 1HH2 ARG 53 8.763 -6.500 -4.290
394 HH22 ARG 53 2HH2 ARG 53 10.434 -6.714 -4.049
395 H TRP 54 H TRP 54 3.837 -0.962 -3.819
396 HA TRP 54 HA TRP 54 3.722 -2.310 -1.288
397 HB2 TRP 54 2HB TRP 54 1.744 -1.041 -1.656
398 HB3 TRP 54 1HB TRP 54 1.631 -1.588 -3.327
399 HD1 TRP 54 HD TRP 54 -0.416 -3.106 -3.538
400 HE1 TRP 54 1HE TRP 54 -1.495 -5.013 -2.187
401 HE3 TRP 54 3HE TRP 54 2.604 -3.020 0.558
402 HZ2 TRP 54 2HZ TRP 54 -1.112 -6.314 0.269
403 HZ3 TRP 54 3HZ TRP 54 2.185 -4.623 2.371
404 HH2 TRP 54 HH TRP 54 0.359 -6.234 2.236
405 H ASP 55 H ASP 55 4.597 -4.168 -1.311
406 HA ASP 55 HA ASP 55 4.546 -5.848 -3.713
407 HB2 ASP 55 2HB ASP 55 6.744 -5.305 -2.527
408 HB3 ASP 55 1HB ASP 55 6.132 -6.196 -1.143
409 H GLY 56 H GLY 56 4.288 -8.335 -2.900
410 HA2 GLY 56 2HA GLY 56 1.666 -8.256 -1.665
411 HA3 GLY 56 1HA GLY 56 2.399 -9.656 -2.409
412 H GLN 57 H GLN 57 3.369 -7.533 0.237
413 HA GLN 57 HA GLN 57 2.727 -9.276 2.331
414 HB2 GLN 57 2HB GLN 57 4.702 -10.554 1.420
415 HB3 GLN 57 1HB GLN 57 5.701 -9.149 1.762
416 HG2 GLN 57 2HG GLN 57 5.974 -10.774 3.518
417 HG3 GLN 57 1HG GLN 57 5.140 -9.354 4.150
418 HE21 GLN 57 1HE2 GLN 57 4.222 -10.489 5.857
419 HE22 GLN 57 2HE2 GLN 57 2.988 -11.659 5.646
420 H VAL 58 H VAL 58 5.429 -7.006 1.596
421 HA VAL 58 HA VAL 58 4.380 -5.412 3.817
422 HB VAL 58 HB VAL 58 6.642 -4.521 4.232
423 HG11 VAL 58 1HG1 VAL 58 6.485 -7.524 4.351
424 HG12 VAL 58 2HG1 VAL 58 5.865 -6.393 5.553
425 HG13 VAL 58 3HG1 VAL 58 7.602 -6.516 5.272
426 HG21 VAL 58 3HG2 VAL 58 8.614 -5.582 3.237
427 HG22 VAL 58 1HG2 VAL 58 7.607 -4.827 2.000
428 HG23 VAL 58 2HG2 VAL 58 7.571 -6.579 2.228
429 H ALA 59 H ALA 59 4.449 -3.201 3.719
430 HA ALA 59 HA ALA 59 4.350 -2.127 0.997
431 HB1 ALA 59 1HB ALA 59 2.328 -1.820 2.329
432 HB2 ALA 59 2HB ALA 59 3.101 -0.255 2.041
433 HB3 ALA 59 3HB ALA 59 3.283 -1.070 3.600
434 H LEU 60 H LEU 60 6.243 -1.450 0.431
435 HA LEU 60 HA LEU 60 8.116 -0.370 2.337
436 HB2 LEU 60 2HB LEU 60 8.719 -2.024 0.570
437 HB3 LEU 60 1HB LEU 60 8.332 -0.836 -0.642
438 HG LEU 60 HG LEU 60 10.582 -0.491 1.358
439 HD11 LEU 60 1HD1 LEU 60 12.050 -1.217 -0.472
440 HD12 LEU 60 2HD1 LEU 60 10.618 -1.575 -1.445
441 HD13 LEU 60 3HD1 LEU 60 10.931 -2.493 0.022
442 HD21 LEU 60 3HD2 LEU 60 10.016 0.814 -1.304
443 HD22 LEU 60 1HD2 LEU 60 11.418 1.139 -0.277
444 HD23 LEU 60 2HD2 LEU 60 9.795 1.575 0.270
445 H LEU 61 H LEU 61 7.986 1.680 2.856
446 HA LEU 61 HA LEU 61 6.858 3.627 1.011
447 HB2 LEU 61 2HB LEU 61 5.844 3.343 3.206
448 HB3 LEU 61 1HB LEU 61 7.337 3.631 4.027
449 HG LEU 61 HG LEU 61 5.780 5.499 4.241
450 HD11 LEU 61 1HD1 LEU 61 8.081 6.320 2.499
451 HD12 LEU 61 2HD1 LEU 61 8.100 6.136 4.251
452 HD13 LEU 61 3HD1 LEU 61 7.109 7.392 3.509
453 HD21 LEU 61 3HD2 LEU 61 5.034 6.796 2.337
454 HD22 LEU 61 1HD2 LEU 61 4.515 5.118 2.219
455 HD23 LEU 61 2HD2 LEU 61 5.878 5.687 1.251
456 H ALA 62 H ALA 62 8.296 4.839 -0.080
457 HA ALA 62 HA ALA 62 10.884 5.391 1.174
458 HB1 ALA 62 1HB ALA 62 10.396 4.829 -1.756
459 HB2 ALA 62 2HB ALA 62 11.123 3.706 -0.610
460 HB3 ALA 62 3HB ALA 62 11.950 5.207 -1.012
461 H ASP 63 H ASP 63 11.338 7.471 1.305
462 HA ASP 63 HA ASP 63 9.513 9.421 0.077
463 HB2 ASP 63 2HB ASP 63 9.808 9.554 2.518
464 HB3 ASP 63 1HB ASP 63 11.547 9.669 2.274
465 H LEU 64 H LEU 64 10.182 10.942 -1.308
466 HA LEU 64 HA LEU 64 13.060 11.127 -1.974
467 HB2 LEU 64 2HB LEU 64 10.663 11.462 -3.806
468 HB3 LEU 64 1HB LEU 64 12.281 11.924 -4.237
469 HG LEU 64 HG LEU 64 11.641 9.975 -5.359
470 HD11 LEU 64 1HD1 LEU 64 13.967 10.090 -4.774
471 HD12 LEU 64 2HD1 LEU 64 13.444 8.407 -4.710
472 HD13 LEU 64 3HD1 LEU 64 13.661 9.320 -3.217
473 HD21 LEU 64 3HD2 LEU 64 9.942 9.055 -3.944
474 HD22 LEU 64 1HD2 LEU 64 11.124 8.680 -2.687
475 HD23 LEU 64 2HD2 LEU 64 11.176 7.826 -4.227
476 H ASN 65 H ASN 65 12.809 12.808 -0.130
477 HA ASN 65 HA ASN 65 12.661 15.379 -1.364
478 HB2 ASN 65 2HB ASN 65 10.225 14.742 -0.769
479 HB3 ASN 65 1HB ASN 65 10.724 14.820 0.910
480 HD21 ASN 65 1HD2 ASN 65 8.810 16.338 -0.761
481 HD22 ASN 65 2HD2 ASN 65 9.160 18.001 -0.521
482 H SER 66 H SER 66 13.529 16.961 0.090
483 HA SER 66 HA SER 66 15.118 15.686 2.188
484 HB2 SER 66 2HB SER 66 16.411 16.627 0.283
485 HB3 SER 66 1HB SER 66 15.735 18.212 0.633
486 HG SER 66 HG SER 66 17.736 16.832 1.832
487 H THR 67 H THR 67 13.353 18.668 1.373
488 HA THR 67 HA THR 67 13.573 19.550 4.124
489 HB THR 67 HB THR 67 12.317 20.928 1.745
490 HG1 THR 67 1HG THR 67 14.872 21.086 2.972
491 HG21 THR 67 3HG2 THR 67 12.593 22.966 3.110
492 HG22 THR 67 1HG2 THR 67 13.231 21.989 4.434
493 HG23 THR 67 2HG2 THR 67 11.552 21.803 3.935
494 H ASN 68 H ASN 68 11.077 18.374 1.952
495 HA ASN 68 HA ASN 68 9.117 18.728 4.117
496 HB2 ASN 68 2HB ASN 68 8.732 18.287 1.152
497 HB3 ASN 68 1HB ASN 68 7.417 18.279 2.318
498 HD21 ASN 68 1HD2 ASN 68 6.697 20.209 3.157
499 HD22 ASN 68 2HD2 ASN 68 7.204 21.736 2.550
500 H GLY 69 H GLY 69 11.189 16.732 3.946
501 HA2 GLY 69 2HA GLY 69 10.510 14.218 3.068
502 HA3 GLY 69 1HA GLY 69 11.473 14.529 4.502
503 H THR 70 H THR 70 9.134 12.783 3.551
504 HA THR 70 HA THR 70 6.901 13.321 5.091
505 HB THR 70 HB THR 70 7.907 10.728 3.937
506 HG1 THR 70 1HG THR 70 7.786 12.054 2.320
507 HG21 THR 70 3HG2 THR 70 5.526 10.125 3.831
508 HG22 THR 70 1HG2 THR 70 5.113 11.634 4.645
509 HG23 THR 70 2HG2 THR 70 6.044 10.404 5.497
510 H THR 71 H THR 71 6.316 12.823 7.102
511 HA THR 71 HA THR 71 8.245 11.441 8.817
512 HB THR 71 HB THR 71 6.675 12.425 10.628
513 HG1 THR 71 1HG THR 71 6.204 14.311 8.603
514 HG21 THR 71 3HG2 THR 71 8.467 14.243 9.025
515 HG22 THR 71 1HG2 THR 71 8.950 13.137 10.321
516 HG23 THR 71 2HG2 THR 71 7.901 14.509 10.687
517 H VAL 72 H VAL 72 7.635 9.690 9.901
518 HA VAL 72 HA VAL 72 4.893 8.777 9.543
519 HB VAL 72 HB VAL 72 5.803 6.456 9.473
520 HG11 VAL 72 1HG1 VAL 72 5.278 7.576 7.358
521 HG12 VAL 72 2HG1 VAL 72 6.697 6.543 7.164
522 HG13 VAL 72 3HG1 VAL 72 6.892 8.288 7.331
523 HG21 VAL 72 3HG2 VAL 72 8.449 7.872 9.291
524 HG22 VAL 72 1HG2 VAL 72 8.216 6.142 9.009
525 HG23 VAL 72 2HG2 VAL 72 7.906 6.832 10.604
526 H ASN 73 H ASN 73 3.908 8.596 11.405
527 HA ASN 73 HA ASN 73 3.471 8.598 13.558
528 HB2 ASN 73 2HB ASN 73 5.780 6.634 13.572
529 HB3 ASN 73 1HB ASN 73 4.829 6.975 15.021
530 HD21 ASN 73 1HD2 ASN 73 5.074 4.492 13.410
531 HD22 ASN 73 2HD2 ASN 73 3.473 4.080 12.922
532 H ASN 74 H ASN 74 5.081 10.607 12.487
533 HA ASN 74 HA ASN 74 5.756 12.564 13.095
534 HB2 ASN 74 2HB ASN 74 4.600 12.388 15.273
535 HB3 ASN 74 1HB ASN 74 5.994 11.583 15.967
536 HD21 ASN 74 1HD2 ASN 74 7.687 12.833 16.691
537 HD22 ASN 74 2HD2 ASN 74 7.669 14.560 16.699
538 H ALA 75 H ALA 75 7.556 9.898 12.980
539 HA ALA 75 HA ALA 75 10.089 11.245 13.520
540 HB1 ALA 75 1HB ALA 75 11.095 9.011 13.254
541 HB2 ALA 75 2HB ALA 75 9.504 8.351 12.869
542 HB3 ALA 75 3HB ALA 75 9.820 9.007 14.475
543 HA PRO 76 HA PRO 76 10.253 11.722 9.018
544 HB2 PRO 76 2HB PRO 76 12.769 13.080 9.262
545 HB3 PRO 76 1HB PRO 76 11.188 13.791 8.936
546 HG2 PRO 76 2HG PRO 76 12.633 14.189 11.253
547 HG3 PRO 76 1HG PRO 76 10.882 14.392 11.109
548 HD2 PRO 76 2HD PRO 76 12.433 12.097 12.238
549 HD3 PRO 76 1HD PRO 76 10.896 12.817 12.773
550 H VAL 77 H VAL 77 10.950 10.163 7.747
551 HA VAL 77 HA VAL 77 13.673 9.254 7.869
552 HB VAL 77 HB VAL 77 13.017 6.855 7.810
553 HG11 VAL 77 1HG1 VAL 77 12.081 8.221 10.322
554 HG12 VAL 77 2HG1 VAL 77 13.736 7.743 9.950
555 HG13 VAL 77 3HG1 VAL 77 12.489 6.513 10.177
556 HG21 VAL 77 3HG2 VAL 77 10.757 6.189 8.579
557 HG22 VAL 77 1HG2 VAL 77 10.766 7.023 7.018
558 HG23 VAL 77 2HG2 VAL 77 10.287 7.890 8.471
559 H GLN 78 H GLN 78 14.234 8.302 5.864
560 HA GLN 78 HA GLN 78 12.316 9.003 3.834
561 HB2 GLN 78 2HB GLN 78 15.257 8.377 3.592
562 HB3 GLN 78 1HB GLN 78 14.215 8.771 2.234
563 HG2 GLN 78 2HG GLN 78 13.774 10.956 3.118
564 HG3 GLN 78 1HG GLN 78 14.647 10.582 4.596
565 HE21 GLN 78 1HE2 GLN 78 16.047 12.328 4.283
566 HE22 GLN 78 2HE2 GLN 78 17.285 12.293 3.081
567 H GLU 79 H GLU 79 12.946 6.363 5.551
568 HA GLU 79 HA GLU 79 11.725 4.640 3.592
569 HB2 GLU 79 2HB GLU 79 13.335 2.787 4.054
570 HB3 GLU 79 1HB GLU 79 14.038 4.130 3.171
571 HG2 GLU 79 2HG GLU 79 15.089 4.943 5.199
572 HG3 GLU 79 1HG GLU 79 14.338 3.647 6.127
573 H TRP 80 H TRP 80 10.223 3.406 4.492
574 HA TRP 80 HA TRP 80 10.284 2.518 7.226
575 HB2 TRP 80 2HB TRP 80 9.534 4.784 7.583
576 HB3 TRP 80 1HB TRP 80 8.299 4.706 6.348
577 HD1 TRP 80 HD TRP 80 5.994 3.595 7.045
578 HE1 TRP 80 1HE TRP 80 4.951 3.085 9.344
579 HE3 TRP 80 3HE TRP 80 10.200 3.957 9.928
580 HZ2 TRP 80 2HZ TRP 80 5.803 2.882 12.013
581 HZ3 TRP 80 3HZ TRP 80 9.988 3.600 12.355
582 HH2 TRP 80 HH TRP 80 7.828 3.077 13.366
583 H GLN 81 H GLN 81 8.614 0.917 7.517
584 HA GLN 81 HA GLN 81 7.258 0.380 5.004
585 HB2 GLN 81 2HB GLN 81 7.114 -2.014 5.510
586 HB3 GLN 81 1HB GLN 81 8.778 -1.488 5.550
587 HG2 GLN 81 2HG GLN 81 8.817 -2.795 7.388
588 HG3 GLN 81 1HG GLN 81 8.203 -1.328 8.146
589 HE21 GLN 81 1HE2 GLN 81 6.079 -1.287 8.860
590 HE22 GLN 81 2HE2 GLN 81 5.104 -2.704 8.964
591 H LEU 82 H LEU 82 5.229 0.507 4.908
592 HA LEU 82 HA LEU 82 3.829 1.880 6.949
593 HB2 LEU 82 2HB LEU 82 2.615 0.484 4.573
594 HB3 LEU 82 1HB LEU 82 1.926 1.749 5.551
595 HG LEU 82 HG LEU 82 4.310 2.069 3.765
596 HD11 LEU 82 1HD1 LEU 82 2.814 3.446 2.408
597 HD12 LEU 82 2HD1 LEU 82 1.472 3.037 3.475
598 HD13 LEU 82 3HD1 LEU 82 2.247 1.781 2.513
599 HD21 LEU 82 3HD2 LEU 82 4.496 3.534 5.643
600 HD22 LEU 82 1HD2 LEU 82 2.806 4.022 5.490
601 HD23 LEU 82 2HD2 LEU 82 3.961 4.472 4.247
602 H ALA 83 H ALA 83 2.420 1.256 8.490
603 HA ALA 83 HA ALA 83 1.290 -1.425 8.390
604 HB1 ALA 83 1HB ALA 83 2.409 -0.094 10.861
605 HB2 ALA 83 2HB ALA 83 3.144 -1.461 10.016
606 HB3 ALA 83 3HB ALA 83 1.585 -1.650 10.813
607 H ASP 84 H ASP 84 -0.592 -1.508 10.015
608 HA ASP 84 HA ASP 84 -2.400 0.586 9.267
609 HB2 ASP 84 2HB ASP 84 -3.159 -1.760 9.496
610 HB3 ASP 84 1HB ASP 84 -2.796 -1.699 11.215
611 H GLY 85 H GLY 85 -2.610 2.430 10.264
612 HA2 GLY 85 2HA GLY 85 -3.241 3.645 12.221
613 HA3 GLY 85 1HA GLY 85 -2.333 2.489 13.185
614 H ASP 86 H ASP 86 -0.593 3.346 10.406
615 HA ASP 86 HA ASP 86 1.189 4.899 12.028
616 HB2 ASP 86 2HB ASP 86 1.314 4.087 9.122
617 HB3 ASP 86 1HB ASP 86 2.482 5.186 9.837
618 H VAL 87 H VAL 87 1.289 6.933 12.238
619 HA VAL 87 HA VAL 87 -0.609 8.599 10.737
620 HB VAL 87 HB VAL 87 1.150 9.447 13.059
621 HG11 VAL 87 1HG1 VAL 87 -0.517 11.204 13.353
622 HG12 VAL 87 2HG1 VAL 87 -1.389 10.601 11.943
623 HG13 VAL 87 3HG1 VAL 87 0.237 11.259 11.761
624 HG21 VAL 87 3HG2 VAL 87 -1.665 8.358 13.174
625 HG22 VAL 87 1HG2 VAL 87 -0.793 9.071 14.533
626 HG23 VAL 87 2HG2 VAL 87 -0.217 7.569 13.803
627 H ILE 88 H ILE 88 0.187 9.506 8.951
628 HA ILE 88 HA ILE 88 3.069 9.961 8.935
629 HB ILE 88 HB ILE 88 1.261 9.021 6.709
630 HG12 ILE 88 2HG1 ILE 88 3.451 7.621 8.262
631 HG13 ILE 88 1HG1 ILE 88 1.730 7.303 8.351
632 HG21 ILE 88 1HG2 ILE 88 4.232 9.532 6.665
633 HG22 ILE 88 2HG2 ILE 88 3.006 10.468 5.815
634 HG23 ILE 88 3HG2 ILE 88 3.301 8.787 5.363
635 HD11 ILE 88 3HD1 ILE 88 2.858 5.606 7.046
636 HD12 ILE 88 1HD1 ILE 88 3.486 6.842 5.956
637 HD13 ILE 88 2HD1 ILE 88 1.754 6.541 6.034
638 H ARG 89 H ARG 89 3.764 11.924 8.114
639 HA ARG 89 HA ARG 89 1.733 13.789 7.071
640 HB2 ARG 89 2HB ARG 89 4.128 14.431 8.811
641 HB3 ARG 89 1HB ARG 89 3.247 15.641 7.914
642 HG2 ARG 89 2HG ARG 89 2.608 15.709 10.229
643 HG3 ARG 89 1HG ARG 89 1.254 15.150 9.256
644 HD2 ARG 89 2HD ARG 89 1.556 12.903 9.988
645 HD3 ARG 89 1HD ARG 89 3.105 13.290 10.735
646 HE ARG 89 HE ARG 89 2.049 14.102 12.530
647 HH11 ARG 89 1HH1 ARG 89 -0.396 13.585 10.046
648 HH12 ARG 89 2HH1 ARG 89 -1.732 13.945 11.026
649 HH21 ARG 89 1HH2 ARG 89 0.261 14.531 13.945
650 HH22 ARG 89 2HH2 ARG 89 -1.336 14.471 13.352
651 H LEU 90 H LEU 90 2.234 14.720 5.191
652 HA LEU 90 HA LEU 90 4.905 14.356 4.135
653 HB2 LEU 90 2HB LEU 90 4.152 13.541 1.983
654 HB3 LEU 90 1HB LEU 90 3.584 12.460 3.223
655 HG LEU 90 HG LEU 90 1.856 14.506 1.807
656 HD11 LEU 90 1HD1 LEU 90 2.683 12.795 0.282
657 HD12 LEU 90 2HD1 LEU 90 0.956 12.589 0.588
658 HD13 LEU 90 3HD1 LEU 90 2.126 11.533 1.381
659 HD21 LEU 90 3HD2 LEU 90 0.996 13.879 4.021
660 HD22 LEU 90 1HD2 LEU 90 1.125 12.174 3.590
661 HD23 LEU 90 2HD2 LEU 90 -0.014 13.215 2.739
662 H GLY 91 H GLY 91 5.158 15.675 2.107
663 HA2 GLY 91 2HA GLY 91 5.182 18.300 2.559
664 HA3 GLY 91 1HA GLY 91 4.943 17.665 0.953
665 H HIS 92 H HIS 92 3.550 19.232 3.648
666 HA HIS 92 HA HIS 92 1.868 20.669 3.941
667 HB2 HIS 92 2HB HIS 92 1.434 20.430 0.965
668 HB3 HIS 92 1HB HIS 92 0.530 21.530 1.998
669 HD1 HIS 92 1HD HIS 92 2.865 22.018 -0.390
670 HD2 HIS 92 2HD HIS 92 2.952 22.836 3.687
671 HE1 HIS 92 1HE HIS 92 4.598 23.785 -0.071
672 H SER 93 H SER 93 1.367 17.600 3.833
673 HA SER 93 HA SER 93 -1.435 17.898 4.479
674 HB2 SER 93 2HB SER 93 -1.435 17.495 2.004
675 HB3 SER 93 1HB SER 93 -0.573 15.988 2.271
676 HG SER 93 HG SER 93 -2.388 15.068 2.715
677 H GLU 94 H GLU 94 -2.238 15.440 4.981
678 HA GLU 94 HA GLU 94 -0.092 13.909 6.119
679 HB2 GLU 94 2HB GLU 94 -1.299 13.626 8.272
680 HB3 GLU 94 1HB GLU 94 -0.710 15.255 8.008
681 HG2 GLU 94 2HG GLU 94 -2.996 15.930 7.344
682 HG3 GLU 94 1HG GLU 94 -3.552 14.301 7.732
683 H ILE 95 H ILE 95 -0.712 11.715 6.617
684 HA ILE 95 HA ILE 95 -3.113 10.842 5.255
685 HB ILE 95 HB ILE 95 -1.228 10.964 3.573
686 HG12 ILE 95 2HG1 ILE 95 -1.445 8.559 2.772
687 HG13 ILE 95 1HG1 ILE 95 -2.432 8.299 4.210
688 HG21 ILE 95 1HG2 ILE 95 0.579 9.363 3.608
689 HG22 ILE 95 2HG2 ILE 95 0.017 8.761 5.161
690 HG23 ILE 95 3HG2 ILE 95 0.635 10.414 5.032
691 HD11 ILE 95 3HD1 ILE 95 -2.976 10.241 1.990
692 HD12 ILE 95 1HD1 ILE 95 -3.908 10.093 3.482
693 HD13 ILE 95 2HD1 ILE 95 -3.852 8.746 2.371
694 H ILE 96 H ILE 96 -3.891 8.912 6.144
695 HA ILE 96 HA ILE 96 -2.287 7.765 8.330
696 HB ILE 96 HB ILE 96 -5.320 7.810 8.057
697 HG12 ILE 96 2HG1 ILE 96 -3.538 9.348 9.967
698 HG13 ILE 96 1HG1 ILE 96 -4.354 10.037 8.568
699 HG21 ILE 96 1HG2 ILE 96 -5.326 6.914 10.352
700 HG22 ILE 96 2HG2 ILE 96 -3.565 6.836 10.325
701 HG23 ILE 96 3HG2 ILE 96 -4.507 5.822 9.234
702 HD11 ILE 96 3HD1 ILE 96 -5.685 8.842 10.990
703 HD12 ILE 96 1HD1 ILE 96 -6.515 9.520 9.589
704 HD13 ILE 96 2HD1 ILE 96 -5.534 10.561 10.619
705 H VAL 97 H VAL 97 -1.723 5.686 8.044
706 HA VAL 97 HA VAL 97 -2.770 4.346 5.692
707 HB VAL 97 HB VAL 97 -0.368 3.771 7.426
708 HG11 VAL 97 1HG1 VAL 97 -1.300 2.282 4.961
709 HG12 VAL 97 2HG1 VAL 97 -1.453 1.692 6.609
710 HG13 VAL 97 3HG1 VAL 97 0.144 1.930 5.921
711 HG21 VAL 97 3HG2 VAL 97 -0.689 4.607 4.556
712 HG22 VAL 97 1HG2 VAL 97 0.844 4.312 5.375
713 HG23 VAL 97 2HG2 VAL 97 -0.189 5.654 5.884
714 H ARG 98 H ARG 98 -4.163 2.728 5.754
715 HA ARG 98 HA ARG 98 -4.475 1.271 8.261
716 HB2 ARG 98 2HB ARG 98 -6.527 1.726 6.105
717 HB3 ARG 98 1HB ARG 98 -6.776 0.874 7.626
718 HG2 ARG 98 2HG ARG 98 -6.272 3.751 7.142
719 HG3 ARG 98 1HG ARG 98 -7.787 3.061 7.749
720 HD2 ARG 98 2HD ARG 98 -5.113 3.356 9.130
721 HD3 ARG 98 1HD ARG 98 -6.627 4.115 9.587
722 HE ARG 98 HE ARG 98 -5.979 1.257 9.876
723 HH11 ARG 98 1HH1 ARG 98 -7.978 4.015 10.833
724 HH12 ARG 98 2HH1 ARG 98 -8.393 3.351 12.349
725 HH21 ARG 98 1HH2 ARG 98 -6.487 0.401 11.958
726 HH22 ARG 98 2HH2 ARG 98 -7.602 1.239 12.976
727 H MET 99 H MET 99 -4.852 -0.884 8.022
728 HA MET 99 HA MET 99 -4.192 -2.035 5.383
729 HB2 MET 99 2HB MET 99 -3.036 -3.050 7.994
730 HB3 MET 99 1HB MET 99 -2.882 -3.839 6.445
731 HG2 MET 99 2HG MET 99 -1.658 -1.908 5.577
732 HG3 MET 99 1HG MET 99 -1.775 -1.135 7.157
733 HE1 MET 99 3HE MET 99 0.699 -4.951 6.278
734 HE2 MET 99 1HE MET 99 -0.156 -4.020 5.048
735 HE3 MET 99 2HE MET 99 -1.062 -4.955 6.241
736 H HIS 100 H HIS 100 -5.668 -3.299 4.700
737 HA HIS 100 HA HIS 100 -7.486 -4.599 6.602
738 HB2 HIS 100 2HB HIS 100 -7.869 -3.847 3.687
739 HB3 HIS 100 1HB HIS 100 -9.056 -4.693 4.666
740 HD1 HIS 100 1HD HIS 100 -10.861 -3.149 5.375
741 HD2 HIS 100 2HD HIS 100 -7.214 -1.197 5.073
742 HE1 HIS 100 1HE HIS 100 -11.318 -0.741 5.900
Start of MODEL 4
1 H1 GLY 1 1HT GLY 1 0.559 -10.139 -5.876
2 H2 GLY 1 2HT GLY 1 1.276 -8.671 -5.501
3 H3 GLY 1 3HT GLY 1 -0.051 -8.720 -6.561
4 HA2 GLY 1 1HA GLY 1 -0.085 -9.348 -3.673
5 HA3 GLY 1 2HA GLY 1 -0.800 -7.942 -4.464
6 H HIS 2 H HIS 2 -0.987 -11.397 -4.012
7 HA HIS 2 HA HIS 2 -3.485 -11.492 -5.508
8 HB2 HIS 2 2HB HIS 2 -3.350 -13.959 -5.246
9 HB3 HIS 2 1HB HIS 2 -1.960 -13.269 -6.061
10 HD1 HIS 2 1HD HIS 2 0.336 -13.732 -5.003
11 HD2 HIS 2 2HD HIS 2 -2.850 -14.896 -2.606
12 HE1 HIS 2 1HE HIS 2 1.328 -15.076 -3.129
13 H GLY 3 H GLY 3 -2.582 -10.885 -2.456
14 HA2 GLY 3 2HA GLY 3 -5.029 -11.987 -1.309
15 HA3 GLY 3 1HA GLY 3 -3.652 -11.346 -0.407
16 H SER 4 H SER 4 -6.599 -10.617 -1.966
17 HA SER 4 HA SER 4 -6.111 -7.809 -1.999
18 HB2 SER 4 2HB SER 4 -8.646 -9.362 -2.532
19 HB3 SER 4 1HB SER 4 -8.397 -7.646 -2.869
20 HG SER 4 HG SER 4 -6.506 -8.422 -4.097
21 H ALA 5 H ALA 5 -7.812 -10.085 0.058
22 HA ALA 5 HA ALA 5 -8.239 -7.888 1.942
23 HB1 ALA 5 1HB ALA 5 -9.854 -10.419 1.635
24 HB2 ALA 5 2HB ALA 5 -10.376 -8.811 1.135
25 HB3 ALA 5 3HB ALA 5 -10.133 -9.171 2.845
26 H GLY 6 H GLY 6 -6.768 -8.016 3.477
27 HA2 GLY 6 2HA GLY 6 -6.368 -9.819 5.363
28 HA3 GLY 6 1HA GLY 6 -5.447 -10.532 4.030
29 H THR 7 H THR 7 -4.281 -8.655 2.784
30 HA THR 7 HA THR 7 -3.314 -6.595 4.555
31 HB THR 7 HB THR 7 -1.405 -8.261 2.888
32 HG1 THR 7 1HG THR 7 -2.453 -9.104 4.994
33 HG21 THR 7 3HG2 THR 7 -0.997 -5.834 3.381
34 HG22 THR 7 1HG2 THR 7 0.301 -6.928 3.913
35 HG23 THR 7 2HG2 THR 7 -0.861 -6.284 5.076
36 H SER 8 H SER 8 -3.825 -4.846 3.465
37 HA SER 8 HA SER 8 -2.727 -4.370 0.893
38 HB2 SER 8 2HB SER 8 -4.932 -3.613 -0.051
39 HB3 SER 8 1HB SER 8 -4.863 -5.356 0.200
40 HG SER 8 HG SER 8 -6.030 -5.030 2.178
41 H VAL 9 H VAL 9 -2.483 -2.095 0.639
42 HA VAL 9 HA VAL 9 -2.984 -0.740 3.171
43 HB VAL 9 HB VAL 9 -0.841 -0.174 1.114
44 HG11 VAL 9 1HG1 VAL 9 -1.427 1.154 3.758
45 HG12 VAL 9 2HG1 VAL 9 -1.595 1.899 2.166
46 HG13 VAL 9 3HG1 VAL 9 0.005 1.461 2.774
47 HG21 VAL 9 3HG2 VAL 9 -0.685 -1.271 3.919
48 HG22 VAL 9 1HG2 VAL 9 0.699 -0.855 2.907
49 HG23 VAL 9 2HG2 VAL 9 -0.385 -2.161 2.425
50 H THR 10 H THR 10 -4.215 0.902 3.268
51 HA THR 10 HA THR 10 -5.150 2.181 0.809
52 HB THR 10 HB THR 10 -6.710 1.704 3.365
53 HG1 THR 10 1HG THR 10 -7.584 -0.003 2.470
54 HG21 THR 10 3HG2 THR 10 -7.601 2.595 0.616
55 HG22 THR 10 1HG2 THR 10 -7.473 3.626 2.043
56 HG23 THR 10 2HG2 THR 10 -8.659 2.317 2.000
57 H LEU 11 H LEU 11 -4.928 4.362 0.848
58 HA LEU 11 HA LEU 11 -3.873 5.521 3.279
59 HB2 LEU 11 2HB LEU 11 -3.230 7.465 1.871
60 HB3 LEU 11 1HB LEU 11 -2.518 5.965 1.343
61 HG LEU 11 HG LEU 11 -4.459 5.958 -0.404
62 HD11 LEU 11 1HD1 LEU 11 -4.355 8.890 0.261
63 HD12 LEU 11 2HD1 LEU 11 -5.741 7.820 0.484
64 HD13 LEU 11 3HD1 LEU 11 -5.155 8.190 -1.138
65 HD21 LEU 11 3HD2 LEU 11 -3.065 7.251 -1.962
66 HD22 LEU 11 1HD2 LEU 11 -2.115 6.136 -0.978
67 HD23 LEU 11 2HD2 LEU 11 -2.129 7.859 -0.597
68 H GLN 12 H GLN 12 -4.834 7.033 4.423
69 HA GLN 12 HA GLN 12 -7.623 7.630 3.746
70 HB2 GLN 12 2HB GLN 12 -7.396 6.109 5.607
71 HB3 GLN 12 1HB GLN 12 -6.277 7.188 6.380
72 HG2 GLN 12 2HG GLN 12 -7.912 8.759 6.922
73 HG3 GLN 12 1HG GLN 12 -9.077 8.062 5.795
74 HE21 GLN 12 1HE2 GLN 12 -10.164 6.309 6.341
75 HE22 GLN 12 2HE2 GLN 12 -10.256 5.667 7.944
76 H LEU 13 H LEU 13 -8.139 9.681 3.558
77 HA LEU 13 HA LEU 13 -6.373 11.748 4.665
78 HB2 LEU 13 2HB LEU 13 -5.942 11.522 2.262
79 HB3 LEU 13 1HB LEU 13 -7.657 11.642 1.928
80 HG LEU 13 HG LEU 13 -7.626 13.881 2.898
81 HD11 LEU 13 1HD1 LEU 13 -5.451 15.065 3.040
82 HD12 LEU 13 2HD1 LEU 13 -4.632 13.519 2.805
83 HD13 LEU 13 3HD1 LEU 13 -5.625 13.784 4.239
84 HD21 LEU 13 3HD2 LEU 13 -7.624 13.618 0.509
85 HD22 LEU 13 1HD2 LEU 13 -5.869 13.432 0.495
86 HD23 LEU 13 2HD2 LEU 13 -6.593 14.978 0.936
87 H ASP 14 H ASP 14 -7.576 13.345 5.723
88 HA ASP 14 HA ASP 14 -10.426 13.206 5.170
89 HB2 ASP 14 2HB ASP 14 -10.142 12.229 7.341
90 HB3 ASP 14 1HB ASP 14 -9.200 13.618 7.888
91 H ASP 15 H ASP 15 -10.644 14.839 3.867
92 HA ASP 15 HA ASP 15 -9.748 17.479 4.238
93 HB2 ASP 15 2HB ASP 15 -12.408 16.588 3.084
94 HB3 ASP 15 1HB ASP 15 -11.557 18.084 2.746
95 H GLY 16 H GLY 16 -12.566 15.700 5.012
96 HA2 GLY 16 2HA GLY 16 -13.409 16.406 7.427
97 HA3 GLY 16 1HA GLY 16 -14.014 17.736 6.421
98 H SER 17 H SER 17 -13.547 14.287 5.903
99 HA SER 17 HA SER 17 -16.264 13.742 5.280
100 HB2 SER 17 2HB SER 17 -15.628 15.123 3.289
101 HB3 SER 17 1HB SER 17 -14.321 13.995 2.957
102 HG SER 17 HG SER 17 -16.761 13.885 2.101
103 H GLY 18 H GLY 18 -12.910 12.898 4.364
104 HA2 GLY 18 2HA GLY 18 -11.791 11.014 5.281
105 HA3 GLY 18 1HA GLY 18 -13.360 10.260 5.532
106 H ARG 19 H ARG 19 -10.849 10.930 3.274
107 HA ARG 19 HA ARG 19 -12.165 9.414 1.114
108 HB2 ARG 19 2HB ARG 19 -9.434 10.629 1.138
109 HB3 ARG 19 1HB ARG 19 -10.338 10.001 -0.220
110 HG2 ARG 19 2HG ARG 19 -11.886 11.940 0.016
111 HG3 ARG 19 1HG ARG 19 -10.859 12.545 1.326
112 HD2 ARG 19 2HD ARG 19 -8.932 12.299 -0.356
113 HD3 ARG 19 1HD ARG 19 -10.192 12.196 -1.572
114 HE ARG 19 HE ARG 19 -10.373 14.471 0.199
115 HH11 ARG 19 1HH1 ARG 19 -9.132 13.318 -2.952
116 HH12 ARG 19 2HH1 ARG 19 -8.916 14.905 -3.561
117 HH21 ARG 19 1HH2 ARG 19 -10.017 16.559 -0.653
118 HH22 ARG 19 2HH2 ARG 19 -9.434 16.781 -2.255
119 H THR 20 H THR 20 -11.174 7.538 0.356
120 HA THR 20 HA THR 20 -8.679 6.722 1.550
121 HB THR 20 HB THR 20 -9.532 4.367 1.853
122 HG1 THR 20 1HG THR 20 -12.049 5.675 1.642
123 HG21 THR 20 3HG2 THR 20 -9.165 5.794 3.768
124 HG22 THR 20 1HG2 THR 20 -10.626 4.827 4.052
125 HG23 THR 20 2HG2 THR 20 -10.739 6.531 3.534
126 H TYR 21 H TYR 21 -7.375 5.787 0.136
127 HA TYR 21 HA TYR 21 -8.446 4.785 -2.407
128 HB2 TYR 21 2HB TYR 21 -7.622 7.134 -2.748
129 HB3 TYR 21 1HB TYR 21 -6.067 6.651 -2.088
130 HD1 TYR 21 2HD TYR 21 -8.334 6.361 -4.975
131 HD2 TYR 21 1HD TYR 21 -4.448 5.470 -3.466
132 HE1 TYR 21 2HE TYR 21 -7.578 5.814 -7.252
133 HE2 TYR 21 1HE TYR 21 -3.686 4.933 -5.742
134 HH TYR 21 HH TYR 21 -5.473 5.745 -8.508
135 H GLN 22 H GLN 22 -7.369 2.943 -3.033
136 HA GLN 22 HA GLN 22 -5.454 2.036 -1.038
137 HB2 GLN 22 2HB GLN 22 -7.551 0.748 -1.278
138 HB3 GLN 22 1HB GLN 22 -7.101 0.383 -2.936
139 HG2 GLN 22 2HG GLN 22 -5.258 -0.925 -2.232
140 HG3 GLN 22 1HG GLN 22 -5.424 -0.373 -0.568
141 HE21 GLN 22 1HE2 GLN 22 -7.102 -1.098 0.640
142 HE22 GLN 22 2HE2 GLN 22 -7.971 -2.547 0.271
143 H LEU 23 H LEU 23 -3.565 1.101 -1.567
144 HA LEU 23 HA LEU 23 -2.357 2.055 -3.991
145 HB2 LEU 23 2HB LEU 23 -1.321 0.359 -1.739
146 HB3 LEU 23 1HB LEU 23 -0.340 0.962 -3.060
147 HG LEU 23 HG LEU 23 -1.804 2.770 -1.132
148 HD11 LEU 23 1HD1 LEU 23 1.011 1.754 -1.118
149 HD12 LEU 23 2HD1 LEU 23 -0.238 1.419 0.087
150 HD13 LEU 23 3HD1 LEU 23 0.401 3.057 -0.095
151 HD21 LEU 23 3HD2 LEU 23 -1.164 3.773 -3.304
152 HD22 LEU 23 1HD2 LEU 23 0.502 3.263 -3.014
153 HD23 LEU 23 2HD2 LEU 23 -0.243 4.446 -1.953
154 H ARG 24 H ARG 24 -1.746 0.892 -5.688
155 HA ARG 24 HA ARG 24 -2.719 -1.856 -5.886
156 HB2 ARG 24 2HB ARG 24 -1.865 0.179 -7.967
157 HB3 ARG 24 1HB ARG 24 -2.058 -1.512 -8.366
158 HG2 ARG 24 2HG ARG 24 -4.012 -0.120 -9.010
159 HG3 ARG 24 1HG ARG 24 -4.434 -1.415 -7.899
160 HD2 ARG 24 2HD ARG 24 -4.622 0.110 -6.082
161 HD3 ARG 24 1HD ARG 24 -3.880 1.402 -7.016
162 HE ARG 24 HE ARG 24 -5.934 1.227 -8.459
163 HH11 ARG 24 1HH1 ARG 24 -6.268 0.105 -5.117
164 HH12 ARG 24 2HH1 ARG 24 -7.767 0.898 -4.891
165 HH21 ARG 24 1HH2 ARG 24 -8.010 2.197 -8.123
166 HH22 ARG 24 2HH2 ARG 24 -8.777 2.097 -6.613
167 H GLU 25 H GLU 25 -1.211 -3.442 -6.867
168 HA GLU 25 HA GLU 25 1.239 -3.338 -5.457
169 HB2 GLU 25 2HB GLU 25 1.833 -5.437 -6.571
170 HB3 GLU 25 1HB GLU 25 0.228 -5.482 -5.867
171 HG2 GLU 25 2HG GLU 25 -0.783 -5.258 -8.022
172 HG3 GLU 25 1HG GLU 25 0.795 -4.991 -8.777
173 H GLY 26 H GLY 26 3.315 -3.225 -6.121
174 HA2 GLY 26 2HA GLY 26 4.962 -2.789 -7.818
175 HA3 GLY 26 1HA GLY 26 3.720 -1.895 -8.709
176 H SER 27 H SER 27 5.596 -0.213 -8.445
177 HA SER 27 HA SER 27 5.266 0.957 -5.837
178 HB2 SER 27 2HB SER 27 7.172 2.395 -6.406
179 HB3 SER 27 1HB SER 27 7.528 0.675 -6.502
180 HG SER 27 HG SER 27 8.329 1.288 -8.346
181 H ASN 28 H ASN 28 4.213 2.693 -5.435
182 HA ASN 28 HA ASN 28 2.831 3.966 -7.679
183 HB2 ASN 28 2HB ASN 28 2.043 3.923 -4.732
184 HB3 ASN 28 1HB ASN 28 1.144 4.716 -6.009
185 HD21 ASN 28 1HD2 ASN 28 2.562 1.450 -6.134
186 HD22 ASN 28 2HD2 ASN 28 1.065 0.611 -6.207
187 H ILE 29 H ILE 29 3.702 5.807 -8.204
188 HA ILE 29 HA ILE 29 5.466 7.130 -6.334
189 HB ILE 29 HB ILE 29 4.911 7.616 -9.275
190 HG12 ILE 29 2HG1 ILE 29 7.282 6.315 -7.910
191 HG13 ILE 29 1HG1 ILE 29 6.014 5.466 -8.783
192 HG21 ILE 29 1HG2 ILE 29 7.032 8.838 -7.494
193 HG22 ILE 29 2HG2 ILE 29 5.631 9.663 -8.185
194 HG23 ILE 29 3HG2 ILE 29 6.896 9.041 -9.246
195 HD11 ILE 29 3HD1 ILE 29 8.008 5.662 -10.130
196 HD12 ILE 29 1HD1 ILE 29 7.984 7.418 -9.955
197 HD13 ILE 29 2HD1 ILE 29 6.698 6.603 -10.841
198 H ILE 30 H ILE 30 5.020 9.009 -5.376
199 HA ILE 30 HA ILE 30 2.472 10.283 -6.000
200 HB ILE 30 HB ILE 30 3.899 10.067 -3.322
201 HG12 ILE 30 2HG1 ILE 30 1.330 8.783 -4.300
202 HG13 ILE 30 1HG1 ILE 30 2.850 7.958 -4.007
203 HG21 ILE 30 1HG2 ILE 30 1.329 11.444 -4.033
204 HG22 ILE 30 2HG2 ILE 30 2.814 12.177 -3.433
205 HG23 ILE 30 3HG2 ILE 30 1.872 11.112 -2.388
206 HD11 ILE 30 3HD1 ILE 30 1.159 9.309 -1.917
207 HD12 ILE 30 1HD1 ILE 30 2.681 8.464 -1.631
208 HD13 ILE 30 2HD1 ILE 30 1.275 7.573 -2.207
209 H GLY 31 H GLY 31 2.531 12.384 -6.484
210 HA2 GLY 31 2HA GLY 31 3.981 14.450 -5.557
211 HA3 GLY 31 1HA GLY 31 5.042 13.751 -6.785
212 H ARG 32 H ARG 32 4.609 15.913 -7.900
213 HA ARG 32 HA ARG 32 2.146 15.490 -9.511
214 HB2 ARG 32 2HB ARG 32 3.550 18.157 -9.270
215 HB3 ARG 32 1HB ARG 32 1.930 17.835 -9.852
216 HG2 ARG 32 2HG ARG 32 1.281 17.243 -7.532
217 HG3 ARG 32 1HG ARG 32 2.889 17.745 -7.009
218 HD2 ARG 32 2HD ARG 32 1.480 19.613 -6.637
219 HD3 ARG 32 1HD ARG 32 2.390 19.985 -8.100
220 HE ARG 32 HE ARG 32 -0.114 18.706 -8.601
221 HH11 ARG 32 1HH1 ARG 32 1.413 21.857 -8.117
222 HH12 ARG 32 2HH1 ARG 32 0.137 22.751 -8.787
223 HH21 ARG 32 1HH2 ARG 32 -1.862 19.891 -9.497
224 HH22 ARG 32 2HH2 ARG 32 -1.801 21.597 -9.619
225 H GLY 33 H GLY 33 3.046 14.378 -11.204
226 HA2 GLY 33 2HA GLY 33 4.375 15.780 -13.152
227 HA3 GLY 33 1HA GLY 33 5.578 14.860 -12.271
228 H GLN 34 H GLN 34 5.435 14.241 -14.670
229 HA GLN 34 HA GLN 34 3.593 12.504 -15.727
230 HB2 GLN 34 2HB GLN 34 5.537 11.623 -17.071
231 HB3 GLN 34 1HB GLN 34 5.286 13.360 -17.124
232 HG2 GLN 34 2HG GLN 34 7.090 13.653 -15.462
233 HG3 GLN 34 1HG GLN 34 7.340 11.914 -15.456
234 HE21 GLN 34 1HE2 GLN 34 8.379 10.979 -17.139
235 HE22 GLN 34 2HE2 GLN 34 9.188 11.869 -18.382
236 H ASP 35 H ASP 35 6.248 11.703 -13.542
237 HA ASP 35 HA ASP 35 6.105 8.881 -13.844
238 HB2 ASP 35 2HB ASP 35 7.195 10.428 -11.491
239 HB3 ASP 35 1HB ASP 35 7.565 8.767 -11.918
240 H ALA 36 H ALA 36 4.592 11.163 -11.725
241 HA ALA 36 HA ALA 36 3.900 9.321 -9.670
242 HB1 ALA 36 1HB ALA 36 2.865 12.092 -10.187
243 HB2 ALA 36 2HB ALA 36 4.289 11.685 -9.233
244 HB3 ALA 36 3HB ALA 36 2.689 11.173 -8.694
245 H GLN 37 H GLN 37 2.333 7.840 -9.758
246 HA GLN 37 HA GLN 37 0.185 8.040 -11.623
247 HB2 GLN 37 2HB GLN 37 0.550 6.173 -9.262
248 HB3 GLN 37 1HB GLN 37 -0.752 6.072 -10.427
249 HG2 GLN 37 2HG GLN 37 0.637 4.463 -11.239
250 HG3 GLN 37 1HG GLN 37 1.254 5.850 -12.130
251 HE21 GLN 37 1HE2 GLN 37 2.528 3.387 -11.418
252 HE22 GLN 37 2HE2 GLN 37 3.938 3.775 -10.499
253 H PHE 38 H PHE 38 0.737 8.694 -8.258
254 HA PHE 38 HA PHE 38 -1.997 9.677 -8.035
255 HB2 PHE 38 2HB PHE 38 -1.403 7.994 -6.348
256 HB3 PHE 38 1HB PHE 38 0.004 8.939 -5.886
257 HD1 PHE 38 1HD PHE 38 -3.706 9.395 -6.206
258 HD2 PHE 38 2HD PHE 38 -0.168 10.172 -3.983
259 HE1 PHE 38 1HE PHE 38 -5.038 10.534 -4.476
260 HE2 PHE 38 2HE PHE 38 -1.456 11.304 -2.275
261 HZ PHE 38 HZ PHE 38 -3.910 11.500 -2.498
262 H ARG 39 H ARG 39 -2.122 11.689 -8.493
263 HA ARG 39 HA ARG 39 0.176 13.454 -8.330
264 HB2 ARG 39 2HB ARG 39 -2.635 13.995 -9.295
265 HB3 ARG 39 1HB ARG 39 -1.237 15.033 -9.514
266 HG2 ARG 39 2HG ARG 39 -1.520 12.277 -10.680
267 HG3 ARG 39 1HG ARG 39 -1.858 13.788 -11.535
268 HD2 ARG 39 2HD ARG 39 0.446 14.459 -11.322
269 HD3 ARG 39 1HD ARG 39 0.789 13.052 -10.318
270 HE ARG 39 HE ARG 39 0.717 11.689 -12.128
271 HH11 ARG 39 1HH1 ARG 39 -0.024 14.997 -13.137
272 HH12 ARG 39 2HH1 ARG 39 0.179 14.704 -14.794
273 HH21 ARG 39 1HH2 ARG 39 1.048 11.284 -14.405
274 HH22 ARG 39 2HH2 ARG 39 0.819 12.517 -15.548
275 H LEU 40 H LEU 40 0.501 14.587 -6.569
276 HA LEU 40 HA LEU 40 -1.601 14.950 -4.670
277 HB2 LEU 40 2HB LEU 40 1.234 15.928 -4.739
278 HB3 LEU 40 1HB LEU 40 0.108 16.497 -3.526
279 HG LEU 40 HG LEU 40 0.971 13.635 -3.918
280 HD11 LEU 40 1HD1 LEU 40 1.601 15.663 -1.793
281 HD12 LEU 40 2HD1 LEU 40 2.731 15.012 -2.991
282 HD13 LEU 40 3HD1 LEU 40 2.058 13.960 -1.746
283 HD21 LEU 40 3HD2 LEU 40 -0.832 14.903 -1.856
284 HD22 LEU 40 1HD2 LEU 40 -0.222 13.250 -1.799
285 HD23 LEU 40 2HD2 LEU 40 -1.309 13.732 -3.090
286 HA PRO 41 HA PRO 41 -2.770 18.816 -6.589
287 HB2 PRO 41 2HB PRO 41 -4.774 19.240 -4.600
288 HB3 PRO 41 1HB PRO 41 -4.997 18.588 -6.224
289 HG2 PRO 41 2HG PRO 41 -5.371 17.165 -3.868
290 HG3 PRO 41 1HG PRO 41 -5.107 16.446 -5.457
291 HD2 PRO 41 2HD PRO 41 -3.186 16.875 -3.226
292 HD3 PRO 41 1HD PRO 41 -3.310 15.523 -4.372
293 H ASP 42 H ASP 42 -1.329 18.335 -3.734
294 HA ASP 42 HA ASP 42 -1.658 20.974 -2.577
295 HB2 ASP 42 2HB ASP 42 -0.107 18.576 -1.585
296 HB3 ASP 42 1HB ASP 42 -0.282 20.091 -0.711
297 H THR 43 H THR 43 0.654 21.637 -1.484
298 HA THR 43 HA THR 43 2.522 21.755 -3.711
299 HB THR 43 HB THR 43 1.317 23.910 -3.565
300 HG1 THR 43 1HG THR 43 3.252 25.242 -3.190
301 HG21 THR 43 3HG2 THR 43 0.753 23.883 -1.184
302 HG22 THR 43 1HG2 THR 43 1.593 25.372 -1.616
303 HG23 THR 43 2HG2 THR 43 2.454 24.084 -0.771
304 H GLY 44 H GLY 44 4.724 22.660 -2.820
305 HA2 GLY 44 2HA GLY 44 6.491 22.385 -1.300
306 HA3 GLY 44 1HA GLY 44 5.387 21.557 -0.202
307 H VAL 45 H VAL 45 5.098 20.568 -3.311
308 HA VAL 45 HA VAL 45 6.447 18.034 -2.713
309 HB VAL 45 HB VAL 45 4.016 17.883 -2.660
310 HG11 VAL 45 1HG1 VAL 45 4.062 18.897 -5.483
311 HG12 VAL 45 2HG1 VAL 45 3.402 19.715 -4.067
312 HG13 VAL 45 3HG1 VAL 45 2.649 18.233 -4.661
313 HG21 VAL 45 3HG2 VAL 45 5.110 15.896 -3.422
314 HG22 VAL 45 1HG2 VAL 45 5.220 16.539 -5.067
315 HG23 VAL 45 2HG2 VAL 45 3.650 16.146 -4.385
316 H SER 46 H SER 46 7.682 17.070 -4.327
317 HA SER 46 HA SER 46 8.436 18.637 -6.626
318 HB2 SER 46 2HB SER 46 10.064 16.617 -6.706
319 HB3 SER 46 1HB SER 46 10.242 17.773 -5.378
320 HG SER 46 HG SER 46 10.109 15.352 -4.885
321 H ARG 47 H ARG 47 9.042 16.588 -8.512
322 HA ARG 47 HA ARG 47 6.353 15.801 -9.182
323 HB2 ARG 47 2HB ARG 47 7.051 15.150 -11.309
324 HB3 ARG 47 1HB ARG 47 8.001 16.573 -10.993
325 HG2 ARG 47 2HG ARG 47 9.937 15.104 -10.579
326 HG3 ARG 47 1HG ARG 47 8.907 13.691 -10.862
327 HD2 ARG 47 2HD ARG 47 8.359 14.905 -13.104
328 HD3 ARG 47 1HD ARG 47 9.866 15.758 -12.807
329 HE ARG 47 HE ARG 47 9.619 12.832 -12.990
330 HH11 ARG 47 1HH1 ARG 47 11.450 15.780 -13.696
331 HH12 ARG 47 2HH1 ARG 47 12.638 14.989 -14.622
332 HH21 ARG 47 1HH2 ARG 47 11.193 11.762 -14.273
333 HH22 ARG 47 2HH2 ARG 47 12.497 12.637 -14.951
334 H ARG 48 H ARG 48 9.243 14.318 -8.089
335 HA ARG 48 HA ARG 48 7.644 12.016 -7.325
336 HB2 ARG 48 2HB ARG 48 10.583 12.035 -8.100
337 HB3 ARG 48 1HB ARG 48 9.784 10.684 -7.312
338 HG2 ARG 48 2HG ARG 48 8.219 10.603 -9.274
339 HG3 ARG 48 1HG ARG 48 9.272 11.772 -10.064
340 HD2 ARG 48 2HD ARG 48 10.203 9.125 -8.997
341 HD3 ARG 48 1HD ARG 48 9.730 9.384 -10.676
342 HE ARG 48 HE ARG 48 11.595 11.239 -10.352
343 HH11 ARG 48 1HH1 ARG 48 11.637 7.839 -9.316
344 HH12 ARG 48 2HH1 ARG 48 13.302 7.650 -9.620
345 HH21 ARG 48 1HH2 ARG 48 13.869 10.934 -10.747
346 HH22 ARG 48 2HH2 ARG 48 14.585 9.411 -10.421
347 H HIS 49 H HIS 49 7.163 12.531 -5.380
348 HA HIS 49 HA HIS 49 9.131 13.853 -3.654
349 HB2 HIS 49 2HB HIS 49 7.012 15.008 -3.872
350 HB3 HIS 49 1HB HIS 49 6.124 13.551 -3.472
351 HD2 HIS 49 2HD HIS 49 6.172 12.843 -0.732
352 HE1 HIS 49 1HE HIS 49 7.505 16.634 0.526
353 HE2 HIS 49 2HE HIS 49 6.890 14.302 1.252
354 H LEU 50 H LEU 50 7.124 11.021 -4.010
355 HA LEU 50 HA LEU 50 8.691 9.603 -2.129
356 HB2 LEU 50 2HB LEU 50 7.292 10.866 -0.604
357 HB3 LEU 50 1HB LEU 50 5.855 10.419 -1.477
358 HG LEU 50 HG LEU 50 7.464 8.261 -0.152
359 HD11 LEU 50 1HD1 LEU 50 5.457 10.093 1.195
360 HD12 LEU 50 2HD1 LEU 50 7.191 10.089 1.513
361 HD13 LEU 50 3HD1 LEU 50 6.221 8.680 1.923
362 HD21 LEU 50 3HD2 LEU 50 4.516 8.745 -0.588
363 HD22 LEU 50 1HD2 LEU 50 5.231 7.290 0.107
364 HD23 LEU 50 2HD2 LEU 50 5.542 7.710 -1.579
365 H GLU 51 H GLU 51 8.320 7.399 -2.313
366 HA GLU 51 HA GLU 51 6.292 6.579 -4.252
367 HB2 GLU 51 2HB GLU 51 7.894 4.822 -5.061
368 HB3 GLU 51 1HB GLU 51 8.288 6.453 -5.563
369 HG2 GLU 51 2HG GLU 51 10.057 6.585 -3.954
370 HG3 GLU 51 1HG GLU 51 9.507 5.110 -3.170
371 H ILE 52 H ILE 52 5.236 4.794 -3.739
372 HA ILE 52 HA ILE 52 6.120 3.394 -1.324
373 HB ILE 52 HB ILE 52 3.312 3.574 -2.434
374 HG12 ILE 52 2HG1 ILE 52 4.518 4.791 0.070
375 HG13 ILE 52 1HG1 ILE 52 4.127 5.682 -1.394
376 HG21 ILE 52 1HG2 ILE 52 4.437 2.260 0.036
377 HG22 ILE 52 2HG2 ILE 52 3.790 1.459 -1.392
378 HG23 ILE 52 3HG2 ILE 52 2.713 2.396 -0.336
379 HD11 ILE 52 3HD1 ILE 52 1.760 5.168 -1.064
380 HD12 ILE 52 1HD1 ILE 52 2.448 6.009 0.325
381 HD13 ILE 52 2HD1 ILE 52 2.167 4.269 0.399
382 H ARG 53 H ARG 53 7.010 1.534 -1.806
383 HA ARG 53 HA ARG 53 6.228 0.210 -4.290
384 HB2 ARG 53 2HB ARG 53 8.421 -0.549 -2.344
385 HB3 ARG 53 1HB ARG 53 8.134 -1.266 -3.917
386 HG2 ARG 53 2HG ARG 53 8.616 0.933 -4.948
387 HG3 ARG 53 1HG ARG 53 9.023 1.543 -3.347
388 HD2 ARG 53 2HD ARG 53 10.776 -0.139 -3.140
389 HD3 ARG 53 1HD ARG 53 10.340 -0.779 -4.725
390 HE ARG 53 HE ARG 53 11.029 2.007 -4.722
391 HH11 ARG 53 1HH1 ARG 53 12.245 -1.303 -5.036
392 HH12 ARG 53 2HH1 ARG 53 13.666 -0.880 -5.852
393 HH21 ARG 53 1HH2 ARG 53 12.974 2.630 -5.843
394 HH22 ARG 53 2HH2 ARG 53 14.096 1.460 -6.345
395 H TRP 54 H TRP 54 4.491 -0.965 -4.105
396 HA TRP 54 HA TRP 54 4.016 -2.240 -1.562
397 HB2 TRP 54 2HB TRP 54 2.242 -0.738 -2.109
398 HB3 TRP 54 1HB TRP 54 2.122 -1.367 -3.746
399 HD1 TRP 54 HD TRP 54 -0.053 -2.743 -3.974
400 HE1 TRP 54 1HE TRP 54 -1.397 -4.407 -2.475
401 HE3 TRP 54 3HE TRP 54 2.766 -2.541 0.234
402 HZ2 TRP 54 2HZ TRP 54 -1.237 -5.478 0.104
403 HZ3 TRP 54 3HZ TRP 54 2.116 -3.907 2.169
404 HH2 TRP 54 HH TRP 54 0.178 -5.328 2.097
405 H ASP 55 H ASP 55 4.076 -4.322 -1.361
406 HA ASP 55 HA ASP 55 3.797 -6.070 -3.686
407 HB2 ASP 55 2HB ASP 55 6.220 -5.918 -2.942
408 HB3 ASP 55 1HB ASP 55 5.717 -6.481 -1.353
409 H GLY 56 H GLY 56 3.114 -8.325 -2.775
410 HA2 GLY 56 2HA GLY 56 0.757 -7.777 -1.258
411 HA3 GLY 56 1HA GLY 56 1.244 -9.319 -1.925
412 H GLN 57 H GLN 57 2.685 -7.213 0.554
413 HA GLN 57 HA GLN 57 1.791 -8.683 2.772
414 HB2 GLN 57 2HB GLN 57 3.704 -10.184 1.604
415 HB3 GLN 57 1HB GLN 57 4.742 -9.106 2.522
416 HG2 GLN 57 2HG GLN 57 2.639 -10.966 3.627
417 HG3 GLN 57 1HG GLN 57 4.381 -11.139 3.763
418 HE21 GLN 57 1HE2 GLN 57 1.561 -9.544 4.938
419 HE22 GLN 57 2HE2 GLN 57 2.277 -8.782 6.299
420 H VAL 58 H VAL 58 4.837 -7.055 1.771
421 HA VAL 58 HA VAL 58 4.368 -5.217 3.993
422 HB VAL 58 HB VAL 58 6.824 -4.766 4.023
423 HG11 VAL 58 1HG1 VAL 58 6.021 -7.635 4.479
424 HG12 VAL 58 2HG1 VAL 58 5.851 -6.307 5.623
425 HG13 VAL 58 3HG1 VAL 58 7.456 -6.858 5.144
426 HG21 VAL 58 3HG2 VAL 58 7.375 -5.467 1.739
427 HG22 VAL 58 1HG2 VAL 58 6.978 -7.136 2.150
428 HG23 VAL 58 2HG2 VAL 58 8.355 -6.340 2.915
429 H ALA 59 H ALA 59 4.443 -3.105 3.724
430 HA ALA 59 HA ALA 59 4.594 -2.108 0.977
431 HB1 ALA 59 1HB ALA 59 3.355 -0.195 1.807
432 HB2 ALA 59 2HB ALA 59 3.413 -0.884 3.436
433 HB3 ALA 59 3HB ALA 59 2.503 -1.702 2.167
434 H LEU 60 H LEU 60 6.399 -1.238 0.456
435 HA LEU 60 HA LEU 60 8.201 -0.222 2.479
436 HB2 LEU 60 2HB LEU 60 8.945 -1.838 0.760
437 HB3 LEU 60 1HB LEU 60 8.506 -0.701 -0.480
438 HG LEU 60 HG LEU 60 10.739 -0.225 1.521
439 HD11 LEU 60 1HD1 LEU 60 11.192 -2.189 0.224
440 HD12 LEU 60 2HD1 LEU 60 12.220 -0.872 -0.360
441 HD13 LEU 60 3HD1 LEU 60 10.786 -1.353 -1.266
442 HD21 LEU 60 3HD2 LEU 60 10.127 1.062 -1.151
443 HD22 LEU 60 1HD2 LEU 60 11.511 1.435 -0.118
444 HD23 LEU 60 2HD2 LEU 60 9.874 1.812 0.424
445 H LEU 61 H LEU 61 7.848 1.778 3.012
446 HA LEU 61 HA LEU 61 6.833 3.750 1.134
447 HB2 LEU 61 2HB LEU 61 5.805 3.486 3.314
448 HB3 LEU 61 1HB LEU 61 7.301 3.707 4.148
449 HG LEU 61 HG LEU 61 5.761 5.624 4.363
450 HD11 LEU 61 1HD1 LEU 61 8.201 6.386 2.780
451 HD12 LEU 61 2HD1 LEU 61 8.110 6.164 4.525
452 HD13 LEU 61 3HD1 LEU 61 7.218 7.476 3.758
453 HD21 LEU 61 3HD2 LEU 61 6.076 5.940 1.403
454 HD22 LEU 61 1HD2 LEU 61 5.186 7.019 2.475
455 HD23 LEU 61 2HD2 LEU 61 4.624 5.366 2.224
456 H ALA 62 H ALA 62 8.333 4.970 0.068
457 HA ALA 62 HA ALA 62 10.850 5.484 1.452
458 HB1 ALA 62 1HB ALA 62 11.242 3.776 -0.260
459 HB2 ALA 62 2HB ALA 62 12.052 5.288 -0.660
460 HB3 ALA 62 3HB ALA 62 10.554 4.846 -1.480
461 H ASP 63 H ASP 63 11.166 7.509 1.704
462 HA ASP 63 HA ASP 63 9.561 9.467 0.288
463 HB2 ASP 63 2HB ASP 63 9.769 9.794 2.661
464 HB3 ASP 63 1HB ASP 63 11.518 9.668 2.593
465 H LEU 64 H LEU 64 10.376 10.985 -1.165
466 HA LEU 64 HA LEU 64 13.127 10.454 -2.092
467 HB2 LEU 64 2HB LEU 64 11.088 9.525 -3.414
468 HB3 LEU 64 1HB LEU 64 10.756 11.182 -3.817
469 HG LEU 64 HG LEU 64 11.739 10.098 -5.674
470 HD11 LEU 64 1HD1 LEU 64 13.728 11.389 -6.187
471 HD12 LEU 64 2HD1 LEU 64 13.807 11.922 -4.505
472 HD13 LEU 64 3HD1 LEU 64 12.423 12.362 -5.513
473 HD21 LEU 64 3HD2 LEU 64 14.041 9.304 -3.905
474 HD22 LEU 64 1HD2 LEU 64 13.969 9.082 -5.655
475 HD23 LEU 64 2HD2 LEU 64 12.819 8.244 -4.617
476 H ASN 65 H ASN 65 13.465 12.355 -0.534
477 HA ASN 65 HA ASN 65 14.464 14.502 -1.747
478 HB2 ASN 65 2HB ASN 65 13.033 16.429 -1.475
479 HB3 ASN 65 1HB ASN 65 12.147 15.258 -2.422
480 HD21 ASN 65 1HD2 ASN 65 11.319 13.672 -0.042
481 HD22 ASN 65 2HD2 ASN 65 10.135 14.609 0.738
482 H SER 66 H SER 66 15.377 15.982 -0.275
483 HA SER 66 HA SER 66 15.094 15.067 2.491
484 HB2 SER 66 2HB SER 66 17.363 14.980 1.442
485 HB3 SER 66 1HB SER 66 17.316 16.729 1.267
486 HG SER 66 HG SER 66 16.883 15.612 3.799
487 H THR 67 H THR 67 14.172 17.549 0.438
488 HA THR 67 HA THR 67 14.378 19.800 2.126
489 HB THR 67 HB THR 67 12.496 19.413 -0.192
490 HG1 THR 67 1HG THR 67 15.328 19.766 -0.113
491 HG21 THR 67 3HG2 THR 67 14.031 21.801 0.856
492 HG22 THR 67 1HG2 THR 67 12.303 21.523 1.071
493 HG23 THR 67 2HG2 THR 67 12.955 21.807 -0.542
494 H ASN 68 H ASN 68 11.429 18.037 0.970
495 HA ASN 68 HA ASN 68 9.978 19.047 3.307
496 HB2 ASN 68 2HB ASN 68 9.240 19.720 0.958
497 HB3 ASN 68 1HB ASN 68 8.888 18.031 0.651
498 HD21 ASN 68 1HD2 ASN 68 7.862 20.942 2.204
499 HD22 ASN 68 2HD2 ASN 68 6.285 20.394 2.667
500 H GLY 69 H GLY 69 11.792 16.823 3.237
501 HA2 GLY 69 2HA GLY 69 10.979 14.277 2.791
502 HA3 GLY 69 1HA GLY 69 11.987 14.717 4.158
503 H THR 70 H THR 70 9.446 13.081 3.348
504 HA THR 70 HA THR 70 7.352 13.927 5.005
505 HB THR 70 HB THR 70 7.771 11.223 3.738
506 HG1 THR 70 1HG THR 70 8.112 12.586 2.109
507 HG21 THR 70 3HG2 THR 70 5.312 12.898 4.254
508 HG22 THR 70 1HG2 THR 70 5.803 11.487 5.189
509 HG23 THR 70 2HG2 THR 70 5.343 11.306 3.496
510 H THR 71 H THR 71 6.633 13.119 6.934
511 HA THR 71 HA THR 71 8.495 11.483 8.476
512 HB THR 71 HB THR 71 7.100 12.358 10.409
513 HG1 THR 71 1HG THR 71 6.403 14.356 8.507
514 HG21 THR 71 3HG2 THR 71 8.825 14.229 8.811
515 HG22 THR 71 1HG2 THR 71 9.318 13.077 10.052
516 HG23 THR 71 2HG2 THR 71 8.338 14.483 10.502
517 H VAL 72 H VAL 72 7.823 9.644 9.449
518 HA VAL 72 HA VAL 72 5.032 8.828 9.055
519 HB VAL 72 HB VAL 72 5.857 6.471 9.120
520 HG11 VAL 72 1HG1 VAL 72 6.979 6.452 6.931
521 HG12 VAL 72 2HG1 VAL 72 7.280 8.187 7.079
522 HG13 VAL 72 3HG1 VAL 72 5.633 7.593 6.941
523 HG21 VAL 72 3HG2 VAL 72 8.293 6.026 8.965
524 HG22 VAL 72 1HG2 VAL 72 7.865 6.828 10.482
525 HG23 VAL 72 2HG2 VAL 72 8.595 7.757 9.181
526 H ASN 73 H ASN 73 3.911 8.523 10.880
527 HA ASN 73 HA ASN 73 3.370 8.806 13.054
528 HB2 ASN 73 2HB ASN 73 5.977 7.300 13.526
529 HB3 ASN 73 1HB ASN 73 4.965 7.879 14.834
530 HD21 ASN 73 1HD2 ASN 73 3.778 6.321 11.790
531 HD22 ASN 73 2HD2 ASN 73 3.178 4.965 12.630
532 H ASN 74 H ASN 74 4.991 10.779 11.628
533 HA ASN 74 HA ASN 74 5.799 12.810 11.846
534 HB2 ASN 74 2HB ASN 74 4.279 13.074 13.848
535 HB3 ASN 74 1HB ASN 74 5.624 12.587 14.876
536 HD21 ASN 74 1HD2 ASN 74 5.556 14.583 15.941
537 HD22 ASN 74 2HD2 ASN 74 6.136 16.035 15.209
538 H ALA 75 H ALA 75 7.451 10.230 12.218
539 HA ALA 75 HA ALA 75 9.938 11.547 13.036
540 HB1 ALA 75 1HB ALA 75 10.875 9.270 13.191
541 HB2 ALA 75 2HB ALA 75 9.332 8.603 12.662
542 HB3 ALA 75 3HB ALA 75 9.448 9.438 14.211
543 HA PRO 76 HA PRO 76 10.643 11.650 8.611
544 HB2 PRO 76 2HB PRO 76 13.039 12.908 8.636
545 HB3 PRO 76 1HB PRO 76 11.516 13.759 8.925
546 HG2 PRO 76 2HG PRO 76 13.589 12.864 10.859
547 HG3 PRO 76 1HG PRO 76 12.575 14.316 10.891
548 HD2 PRO 76 2HD PRO 76 12.129 12.020 12.390
549 HD3 PRO 76 1HD PRO 76 10.900 13.241 12.008
550 H VAL 77 H VAL 77 11.353 10.058 7.387
551 HA VAL 77 HA VAL 77 13.795 8.632 8.129
552 HB VAL 77 HB VAL 77 12.706 6.460 7.606
553 HG11 VAL 77 1HG1 VAL 77 12.889 7.101 9.934
554 HG12 VAL 77 2HG1 VAL 77 11.391 6.212 9.660
555 HG13 VAL 77 3HG1 VAL 77 11.357 7.967 9.837
556 HG21 VAL 77 3HG2 VAL 77 10.173 8.092 7.516
557 HG22 VAL 77 1HG2 VAL 77 10.240 6.333 7.594
558 HG23 VAL 77 2HG2 VAL 77 10.898 7.176 6.189
559 H GLN 78 H GLN 78 14.447 7.177 6.329
560 HA GLN 78 HA GLN 78 14.036 8.468 3.757
561 HB2 GLN 78 2HB GLN 78 15.842 6.209 4.636
562 HB3 GLN 78 1HB GLN 78 15.791 6.853 3.002
563 HG2 GLN 78 2HG GLN 78 16.503 8.445 5.453
564 HG3 GLN 78 1HG GLN 78 17.670 7.735 4.335
565 HE21 GLN 78 1HE2 GLN 78 17.170 10.567 5.007
566 HE22 GLN 78 2HE2 GLN 78 16.793 11.311 3.497
567 H GLU 79 H GLU 79 13.704 5.301 5.317
568 HA GLU 79 HA GLU 79 11.466 4.767 3.611
569 HB2 GLU 79 2HB GLU 79 12.226 2.446 3.180
570 HB3 GLU 79 1HB GLU 79 13.229 3.659 2.405
571 HG2 GLU 79 2HG GLU 79 14.894 3.390 4.167
572 HG3 GLU 79 1HG GLU 79 13.880 2.168 4.930
573 H TRP 80 H TRP 80 10.092 3.194 4.423
574 HA TRP 80 HA TRP 80 10.321 2.314 7.159
575 HB2 TRP 80 2HB TRP 80 9.689 4.480 7.683
576 HB3 TRP 80 1HB TRP 80 8.661 4.701 6.290
577 HD1 TRP 80 HD TRP 80 6.163 4.077 6.547
578 HE1 TRP 80 1HE TRP 80 4.698 3.684 8.558
579 HE3 TRP 80 3HE TRP 80 9.830 3.258 9.978
580 HZ2 TRP 80 2HZ TRP 80 5.038 3.024 11.325
581 HZ3 TRP 80 3HZ TRP 80 9.199 2.766 12.273
582 HH2 TRP 80 HH TRP 80 6.839 2.640 12.952
583 H GLN 81 H GLN 81 8.653 0.754 7.572
584 HA GLN 81 HA GLN 81 7.188 0.058 5.162
585 HB2 GLN 81 2HB GLN 81 7.888 -1.603 7.585
586 HB3 GLN 81 1HB GLN 81 6.779 -2.144 6.329
587 HG2 GLN 81 2HG GLN 81 8.513 -2.008 4.666
588 HG3 GLN 81 1HG GLN 81 9.628 -1.326 5.844
589 HE21 GLN 81 1HE2 GLN 81 11.089 -2.973 5.496
590 HE22 GLN 81 2HE2 GLN 81 10.838 -4.562 6.129
591 H LEU 82 H LEU 82 5.234 0.550 5.010
592 HA LEU 82 HA LEU 82 3.779 2.118 6.804
593 HB2 LEU 82 2HB LEU 82 2.633 0.352 4.653
594 HB3 LEU 82 1HB LEU 82 1.853 1.718 5.397
595 HG LEU 82 HG LEU 82 4.306 1.870 3.656
596 HD11 LEU 82 1HD1 LEU 82 2.864 3.003 2.093
597 HD12 LEU 82 2HD1 LEU 82 1.504 2.856 3.197
598 HD13 LEU 82 3HD1 LEU 82 2.189 1.410 2.447
599 HD21 LEU 82 3HD2 LEU 82 2.689 3.970 5.030
600 HD22 LEU 82 1HD2 LEU 82 3.962 4.275 3.857
601 HD23 LEU 82 2HD2 LEU 82 4.360 3.520 5.399
602 H ALA 83 H ALA 83 2.159 1.705 8.272
603 HA ALA 83 HA ALA 83 1.254 -1.007 8.754
604 HB1 ALA 83 1HB ALA 83 3.211 -0.783 10.219
605 HB2 ALA 83 2HB ALA 83 1.724 -0.771 11.172
606 HB3 ALA 83 3HB ALA 83 2.574 0.736 10.846
607 H ASP 84 H ASP 84 -0.738 -0.959 9.995
608 HA ASP 84 HA ASP 84 -2.352 1.256 9.221
609 HB2 ASP 84 2HB ASP 84 -3.152 -1.142 9.570
610 HB3 ASP 84 1HB ASP 84 -3.102 -0.804 11.294
611 H GLY 85 H GLY 85 -2.764 3.053 10.230
612 HA2 GLY 85 2HA GLY 85 -3.294 4.328 12.169
613 HA3 GLY 85 1HA GLY 85 -2.301 3.233 13.124
614 H ASP 86 H ASP 86 -0.514 3.653 10.488
615 HA ASP 86 HA ASP 86 1.229 5.518 11.751
616 HB2 ASP 86 2HB ASP 86 2.314 3.816 10.476
617 HB3 ASP 86 1HB ASP 86 1.331 4.147 9.055
618 H VAL 87 H VAL 87 1.353 7.528 11.536
619 HA VAL 87 HA VAL 87 -0.443 8.896 9.673
620 HB VAL 87 HB VAL 87 1.064 9.980 12.059
621 HG11 VAL 87 1HG1 VAL 87 0.625 11.677 10.390
622 HG12 VAL 87 2HG1 VAL 87 -0.386 11.965 11.808
623 HG13 VAL 87 3HG1 VAL 87 -1.087 11.252 10.349
624 HG21 VAL 87 3HG2 VAL 87 -1.854 9.258 11.805
625 HG22 VAL 87 1HG2 VAL 87 -1.113 10.057 13.199
626 HG23 VAL 87 2HG2 VAL 87 -0.632 8.414 12.757
627 H ILE 88 H ILE 88 0.530 9.419 7.882
628 HA ILE 88 HA ILE 88 3.388 9.946 7.938
629 HB ILE 88 HB ILE 88 1.538 9.215 5.656
630 HG12 ILE 88 2HG1 ILE 88 3.677 7.684 7.126
631 HG13 ILE 88 1HG1 ILE 88 1.956 7.361 7.100
632 HG21 ILE 88 1HG2 ILE 88 3.289 10.705 4.877
633 HG22 ILE 88 2HG2 ILE 88 3.540 9.069 4.266
634 HG23 ILE 88 3HG2 ILE 88 4.513 9.669 5.613
635 HD11 ILE 88 3HD1 ILE 88 3.800 7.138 4.742
636 HD12 ILE 88 1HD1 ILE 88 2.076 6.762 4.755
637 HD13 ILE 88 2HD1 ILE 88 3.200 5.801 5.722
638 H ARG 89 H ARG 89 4.018 11.973 7.625
639 HA ARG 89 HA ARG 89 2.035 13.872 6.600
640 HB2 ARG 89 2HB ARG 89 2.089 14.001 9.042
641 HB3 ARG 89 1HB ARG 89 3.821 14.282 8.992
642 HG2 ARG 89 2HG ARG 89 3.411 16.361 7.728
643 HG3 ARG 89 1HG ARG 89 1.677 16.094 7.910
644 HD2 ARG 89 2HD ARG 89 2.460 17.655 9.574
645 HD3 ARG 89 1HD ARG 89 1.947 16.158 10.348
646 HE ARG 89 HE ARG 89 4.325 15.566 10.486
647 HH11 ARG 89 1HH1 ARG 89 3.436 18.988 10.210
648 HH12 ARG 89 2HH1 ARG 89 4.869 19.565 10.926
649 HH21 ARG 89 1HH2 ARG 89 6.247 16.378 11.573
650 HH22 ARG 89 2HH2 ARG 89 6.499 18.054 11.705
651 H LEU 90 H LEU 90 2.774 14.964 4.975
652 HA LEU 90 HA LEU 90 5.644 15.450 4.746
653 HB2 LEU 90 2HB LEU 90 5.206 16.181 2.416
654 HB3 LEU 90 1HB LEU 90 4.702 14.528 2.658
655 HG LEU 90 HG LEU 90 2.661 16.739 2.786
656 HD11 LEU 90 1HD1 LEU 90 2.319 16.470 0.375
657 HD12 LEU 90 2HD1 LEU 90 3.710 15.389 0.291
658 HD13 LEU 90 3HD1 LEU 90 3.936 17.087 0.709
659 HD21 LEU 90 3HD2 LEU 90 1.202 14.965 1.943
660 HD22 LEU 90 1HD2 LEU 90 2.006 14.446 3.423
661 HD23 LEU 90 2HD2 LEU 90 2.572 13.858 1.862
662 H GLY 91 H GLY 91 6.074 17.814 3.998
663 HA2 GLY 91 2HA GLY 91 4.758 19.377 6.033
664 HA3 GLY 91 1HA GLY 91 6.017 19.939 4.936
665 H HIS 92 H HIS 92 2.669 19.263 5.297
666 HA HIS 92 HA HIS 92 1.463 21.483 4.333
667 HB2 HIS 92 2HB HIS 92 2.541 20.889 2.073
668 HB3 HIS 92 1HB HIS 92 1.508 19.464 2.060
669 HD1 HIS 92 1HD HIS 92 -1.186 20.010 2.028
670 HD2 HIS 92 2HD HIS 92 1.392 23.162 1.190
671 HE1 HIS 92 1HE HIS 92 -2.594 21.798 0.985
672 H SER 93 H SER 93 1.307 17.983 3.825
673 HA SER 93 HA SER 93 -1.415 17.890 5.008
674 HB2 SER 93 2HB SER 93 -0.578 16.573 2.413
675 HB3 SER 93 1HB SER 93 -2.148 16.434 3.198
676 HG SER 93 HG SER 93 -1.852 18.005 1.389
677 H GLU 94 H GLU 94 -2.060 16.014 5.770
678 HA GLU 94 HA GLU 94 0.009 14.057 6.383
679 HB2 GLU 94 2HB GLU 94 -1.278 13.727 8.535
680 HB3 GLU 94 1HB GLU 94 -0.441 15.261 8.406
681 HG2 GLU 94 2HG GLU 94 -3.290 15.055 7.612
682 HG3 GLU 94 1HG GLU 94 -2.900 15.216 9.343
683 H ILE 95 H ILE 95 -0.636 11.912 6.345
684 HA ILE 95 HA ILE 95 -3.305 11.288 5.312
685 HB ILE 95 HB ILE 95 -1.588 11.486 3.445
686 HG12 ILE 95 2HG1 ILE 95 -1.980 9.171 2.457
687 HG13 ILE 95 1HG1 ILE 95 -2.860 8.812 3.942
688 HG21 ILE 95 1HG2 ILE 95 -0.281 9.139 4.752
689 HG22 ILE 95 2HG2 ILE 95 0.385 10.765 4.600
690 HG23 ILE 95 3HG2 ILE 95 0.120 9.778 3.158
691 HD11 ILE 95 3HD1 ILE 95 -3.494 10.989 1.971
692 HD12 ILE 95 1HD1 ILE 95 -4.345 10.693 3.487
693 HD13 ILE 95 2HD1 ILE 95 -4.380 9.479 2.221
694 H ILE 96 H ILE 96 -4.003 9.113 6.051
695 HA ILE 96 HA ILE 96 -2.214 8.009 8.109
696 HB ILE 96 HB ILE 96 -5.251 7.814 7.976
697 HG12 ILE 96 2HG1 ILE 96 -3.522 9.456 9.845
698 HG13 ILE 96 1HG1 ILE 96 -4.435 10.108 8.491
699 HG21 ILE 96 1HG2 ILE 96 -4.228 5.883 9.076
700 HG22 ILE 96 2HG2 ILE 96 -5.082 6.888 10.246
701 HG23 ILE 96 3HG2 ILE 96 -3.323 6.958 10.143
702 HD11 ILE 96 3HD1 ILE 96 -5.575 10.488 10.603
703 HD12 ILE 96 1HD1 ILE 96 -5.598 8.754 10.923
704 HD13 ILE 96 2HD1 ILE 96 -6.518 9.414 9.571
705 H VAL 97 H VAL 97 -1.722 5.882 8.013
706 HA VAL 97 HA VAL 97 -2.390 4.462 5.578
707 HB VAL 97 HB VAL 97 -0.510 3.791 7.845
708 HG11 VAL 97 1HG1 VAL 97 -1.425 1.789 6.667
709 HG12 VAL 97 2HG1 VAL 97 0.309 1.994 6.521
710 HG13 VAL 97 3HG1 VAL 97 -0.745 2.430 5.161
711 HG21 VAL 97 3HG2 VAL 97 1.218 4.351 6.288
712 HG22 VAL 97 1HG2 VAL 97 0.117 5.716 6.472
713 HG23 VAL 97 2HG2 VAL 97 0.019 4.684 5.034
714 H ARG 98 H ARG 98 -3.902 2.954 5.438
715 HA ARG 98 HA ARG 98 -4.753 1.550 7.860
716 HB2 ARG 98 2HB ARG 98 -6.348 2.299 5.406
717 HB3 ARG 98 1HB ARG 98 -6.929 1.262 6.700
718 HG2 ARG 98 2HG ARG 98 -6.058 4.105 7.024
719 HG3 ARG 98 1HG ARG 98 -7.747 3.595 6.868
720 HD2 ARG 98 2HD ARG 98 -7.513 2.271 8.910
721 HD3 ARG 98 1HD ARG 98 -5.820 2.739 9.035
722 HE ARG 98 HE ARG 98 -7.738 4.894 8.975
723 HH11 ARG 98 1HH1 ARG 98 -5.762 2.699 11.039
724 HH12 ARG 98 2HH1 ARG 98 -5.799 3.787 12.343
725 HH21 ARG 98 1HH2 ARG 98 -7.731 6.300 10.806
726 HH22 ARG 98 2HH2 ARG 98 -6.927 5.863 12.232
727 H MET 99 H MET 99 -5.024 -0.594 7.680
728 HA MET 99 HA MET 99 -4.073 -1.845 5.192
729 HB2 MET 99 2HB MET 99 -3.487 -2.716 8.031
730 HB3 MET 99 1HB MET 99 -3.078 -3.655 6.600
731 HG2 MET 99 2HG MET 99 -1.588 -1.893 5.840
732 HG3 MET 99 1HG MET 99 -2.037 -0.898 7.220
733 HE1 MET 99 3HE MET 99 -1.318 -4.814 7.158
734 HE2 MET 99 1HE MET 99 0.407 -4.808 7.513
735 HE3 MET 99 2HE MET 99 -0.182 -4.123 5.998
736 H HIS 100 H HIS 100 -5.405 -3.232 4.325
737 HA HIS 100 HA HIS 100 -7.747 -4.050 5.907
738 HB2 HIS 100 2HB HIS 100 -7.551 -3.523 2.923
739 HB3 HIS 100 1HB HIS 100 -8.979 -4.139 3.734
740 HD1 HIS 100 1HD HIS 100 -10.606 -2.195 3.492
741 HD2 HIS 100 2HD HIS 100 -6.865 -0.976 4.823
742 HE1 HIS 100 1HE HIS 100 -10.794 0.266 3.933
Start of MODEL 5
1 H1 GLY 1 1HT GLY 1 -5.943 -6.747 -8.348
2 H2 GLY 1 2HT GLY 1 -4.279 -6.515 -7.948
3 H3 GLY 1 3HT GLY 1 -5.466 -6.578 -6.743
4 HA2 GLY 1 1HA GLY 1 -4.917 -8.827 -8.505
5 HA3 GLY 1 2HA GLY 1 -4.147 -8.595 -6.941
6 H HIS 2 H HIS 2 -5.804 -10.734 -7.653
7 HA HIS 2 HA HIS 2 -7.793 -10.477 -5.622
8 HB2 HIS 2 2HB HIS 2 -9.543 -11.575 -7.154
9 HB3 HIS 2 1HB HIS 2 -9.214 -9.872 -7.427
10 HD1 HIS 2 1HD HIS 2 -8.803 -13.255 -9.045
11 HD2 HIS 2 2HD HIS 2 -8.124 -9.248 -9.904
12 HE1 HIS 2 1HE HIS 2 -8.308 -13.144 -11.505
13 H GLY 3 H GLY 3 -6.700 -11.882 -4.393
14 HA2 GLY 3 2HA GLY 3 -7.140 -14.582 -4.741
15 HA3 GLY 3 1HA GLY 3 -5.542 -14.245 -5.387
16 H SER 4 H SER 4 -3.984 -14.610 -4.006
17 HA SER 4 HA SER 4 -4.552 -14.957 -1.244
18 HB2 SER 4 2HB SER 4 -1.897 -15.120 -2.669
19 HB3 SER 4 1HB SER 4 -2.336 -15.859 -1.129
20 HG SER 4 HG SER 4 -2.481 -16.981 -3.418
21 H ALA 5 H ALA 5 -5.161 -12.686 -0.944
22 HA ALA 5 HA ALA 5 -3.219 -11.317 0.538
23 HB1 ALA 5 1HB ALA 5 -4.028 -9.909 -2.007
24 HB2 ALA 5 2HB ALA 5 -2.426 -10.582 -1.696
25 HB3 ALA 5 3HB ALA 5 -3.024 -9.234 -0.724
26 H GLY 6 H GLY 6 -4.668 -11.186 2.140
27 HA2 GLY 6 2HA GLY 6 -7.228 -9.861 1.607
28 HA3 GLY 6 1HA GLY 6 -6.812 -10.768 3.061
29 H THR 7 H THR 7 -5.105 -8.271 1.305
30 HA THR 7 HA THR 7 -5.178 -6.542 3.649
31 HB THR 7 HB THR 7 -2.675 -7.286 2.124
32 HG1 THR 7 1HG THR 7 -2.882 -7.858 4.816
33 HG21 THR 7 3HG2 THR 7 -1.526 -6.039 3.917
34 HG22 THR 7 1HG2 THR 7 -3.091 -5.604 4.609
35 HG23 THR 7 2HG2 THR 7 -2.633 -5.008 3.011
36 H SER 8 H SER 8 -6.029 -4.725 2.877
37 HA SER 8 HA SER 8 -5.069 -3.712 0.282
38 HB2 SER 8 2HB SER 8 -7.569 -2.915 1.779
39 HB3 SER 8 1HB SER 8 -7.128 -2.466 0.142
40 HG SER 8 HG SER 8 -7.751 -5.043 1.089
41 H VAL 9 H VAL 9 -3.553 -2.131 0.620
42 HA VAL 9 HA VAL 9 -3.742 -0.715 3.132
43 HB VAL 9 HB VAL 9 -1.550 -1.654 2.832
44 HG11 VAL 9 1HG1 VAL 9 -1.507 -0.310 0.172
45 HG12 VAL 9 2HG1 VAL 9 -1.510 -2.049 0.495
46 HG13 VAL 9 3HG1 VAL 9 -0.105 -1.069 0.927
47 HG21 VAL 9 3HG2 VAL 9 -1.433 1.302 2.249
48 HG22 VAL 9 1HG2 VAL 9 -0.092 0.334 2.858
49 HG23 VAL 9 2HG2 VAL 9 -1.542 0.551 3.839
50 H THR 10 H THR 10 -4.528 1.164 3.235
51 HA THR 10 HA THR 10 -5.021 2.599 0.737
52 HB THR 10 HB THR 10 -6.943 2.256 3.045
53 HG1 THR 10 1HG THR 10 -7.879 0.705 1.890
54 HG21 THR 10 3HG2 THR 10 -7.324 3.388 0.268
55 HG22 THR 10 1HG2 THR 10 -7.272 4.317 1.767
56 HG23 THR 10 2HG2 THR 10 -8.590 3.173 1.480
57 H LEU 11 H LEU 11 -4.650 4.690 0.790
58 HA LEU 11 HA LEU 11 -3.515 5.894 3.158
59 HB2 LEU 11 2HB LEU 11 -4.056 7.134 0.466
60 HB3 LEU 11 1HB LEU 11 -2.986 7.745 1.708
61 HG LEU 11 HG LEU 11 -2.649 5.257 0.136
62 HD11 LEU 11 1HD1 LEU 11 -1.071 7.849 0.064
63 HD12 LEU 11 2HD1 LEU 11 -2.265 7.365 -1.124
64 HD13 LEU 11 3HD1 LEU 11 -0.768 6.438 -0.960
65 HD21 LEU 11 3HD2 LEU 11 -0.386 5.114 1.130
66 HD22 LEU 11 1HD2 LEU 11 -1.670 4.954 2.325
67 HD23 LEU 11 2HD2 LEU 11 -0.785 6.475 2.174
68 H GLN 12 H GLN 12 -4.594 7.130 4.433
69 HA GLN 12 HA GLN 12 -7.403 7.796 3.782
70 HB2 GLN 12 2HB GLN 12 -6.824 6.216 5.699
71 HB3 GLN 12 1HB GLN 12 -6.172 7.622 6.495
72 HG2 GLN 12 2HG GLN 12 -8.407 8.723 6.238
73 HG3 GLN 12 1HG GLN 12 -9.026 7.149 5.735
74 HE21 GLN 12 1HE2 GLN 12 -7.805 9.028 8.307
75 HE22 GLN 12 2HE2 GLN 12 -8.202 7.952 9.591
76 H LEU 13 H LEU 13 -7.909 9.878 3.641
77 HA LEU 13 HA LEU 13 -6.449 11.875 5.193
78 HB2 LEU 13 2HB LEU 13 -5.566 12.078 2.971
79 HB3 LEU 13 1HB LEU 13 -7.162 11.943 2.262
80 HG LEU 13 HG LEU 13 -7.757 14.087 3.349
81 HD11 LEU 13 1HD1 LEU 13 -6.141 14.176 5.099
82 HD12 LEU 13 2HD1 LEU 13 -5.979 15.596 4.068
83 HD13 LEU 13 3HD1 LEU 13 -4.813 14.269 3.938
84 HD21 LEU 13 3HD2 LEU 13 -6.591 15.494 1.720
85 HD22 LEU 13 1HD2 LEU 13 -7.219 14.002 1.024
86 HD23 LEU 13 2HD2 LEU 13 -5.489 14.154 1.369
87 H ASP 14 H ASP 14 -7.922 13.140 6.301
88 HA ASP 14 HA ASP 14 -10.721 12.753 5.593
89 HB2 ASP 14 2HB ASP 14 -10.073 12.602 8.016
90 HB3 ASP 14 1HB ASP 14 -9.550 14.281 7.935
91 H ASP 15 H ASP 15 -11.077 13.828 3.899
92 HA ASP 15 HA ASP 15 -10.687 16.657 4.140
93 HB2 ASP 15 2HB ASP 15 -9.205 15.976 2.380
94 HB3 ASP 15 1HB ASP 15 -10.440 14.957 1.651
95 H GLY 16 H GLY 16 -12.670 16.725 5.071
96 HA2 GLY 16 2HA GLY 16 -14.895 17.460 4.733
97 HA3 GLY 16 1HA GLY 16 -14.923 16.588 3.208
98 H SER 17 H SER 17 -14.714 14.225 3.376
99 HA SER 17 HA SER 17 -16.129 13.233 5.751
100 HB2 SER 17 2HB SER 17 -17.582 13.384 3.707
101 HB3 SER 17 1HB SER 17 -16.482 12.277 2.894
102 HG SER 17 HG SER 17 -17.549 10.722 3.780
103 H GLY 18 H GLY 18 -13.807 12.642 3.155
104 HA2 GLY 18 2HA GLY 18 -11.796 11.546 4.321
105 HA3 GLY 18 1HA GLY 18 -12.946 10.221 4.495
106 H ARG 19 H ARG 19 -10.584 11.451 2.661
107 HA ARG 19 HA ARG 19 -11.518 10.178 0.185
108 HB2 ARG 19 2HB ARG 19 -9.047 11.792 0.743
109 HB3 ARG 19 1HB ARG 19 -9.473 11.025 -0.777
110 HG2 ARG 19 2HG ARG 19 -11.427 12.547 -0.934
111 HG3 ARG 19 1HG ARG 19 -10.913 13.324 0.570
112 HD2 ARG 19 2HD ARG 19 -8.706 13.740 -0.512
113 HD3 ARG 19 1HD ARG 19 -9.400 13.156 -2.015
114 HE ARG 19 HE ARG 19 -10.695 15.427 -0.671
115 HH11 ARG 19 1HH1 ARG 19 -8.914 14.256 -3.509
116 HH12 ARG 19 2HH1 ARG 19 -8.866 15.776 -4.263
117 HH21 ARG 19 1HH2 ARG 19 -10.611 17.449 -1.640
118 HH22 ARG 19 2HH2 ARG 19 -9.861 17.707 -3.145
119 H THR 20 H THR 20 -10.382 8.435 -0.570
120 HA THR 20 HA THR 20 -8.158 7.502 1.024
121 HB THR 20 HB THR 20 -9.158 5.171 1.119
122 HG1 THR 20 1HG THR 20 -11.366 6.658 0.231
123 HG21 THR 20 3HG2 THR 20 -8.950 6.511 3.128
124 HG22 THR 20 1HG2 THR 20 -10.521 5.699 3.171
125 HG23 THR 20 2HG2 THR 20 -10.388 7.412 2.704
126 H TYR 21 H TYR 21 -6.652 6.540 -0.097
127 HA TYR 21 HA TYR 21 -7.248 5.741 -2.860
128 HB2 TYR 21 2HB TYR 21 -5.951 7.777 -2.978
129 HB3 TYR 21 1HB TYR 21 -4.793 7.169 -1.798
130 HD1 TYR 21 2HD TYR 21 -6.108 6.502 -5.230
131 HD2 TYR 21 1HD TYR 21 -2.849 6.085 -2.535
132 HE1 TYR 21 2HE TYR 21 -4.706 5.614 -7.054
133 HE2 TYR 21 1HE TYR 21 -1.452 5.206 -4.345
134 HH TYR 21 HH TYR 21 -1.694 4.109 -6.431
135 H GLN 22 H GLN 22 -7.145 3.617 -2.939
136 HA GLN 22 HA GLN 22 -5.405 2.209 -1.129
137 HB2 GLN 22 2HB GLN 22 -7.632 1.255 -1.563
138 HB3 GLN 22 1HB GLN 22 -7.239 1.118 -3.276
139 HG2 GLN 22 2HG GLN 22 -5.471 -0.459 -2.775
140 HG3 GLN 22 1HG GLN 22 -5.775 -0.285 -1.054
141 HE21 GLN 22 1HE2 GLN 22 -5.819 -2.607 -2.767
142 HE22 GLN 22 2HE2 GLN 22 -7.365 -3.333 -2.569
143 H LEU 23 H LEU 23 -3.573 1.365 -1.567
144 HA LEU 23 HA LEU 23 -2.147 2.134 -3.917
145 HB2 LEU 23 2HB LEU 23 -1.496 0.296 -1.658
146 HB3 LEU 23 1HB LEU 23 -0.329 0.804 -2.837
147 HG LEU 23 HG LEU 23 -1.734 2.602 -0.842
148 HD11 LEU 23 1HD1 LEU 23 -0.091 1.159 0.197
149 HD12 LEU 23 2HD1 LEU 23 0.492 2.824 0.136
150 HD13 LEU 23 3HD1 LEU 23 1.094 1.630 -1.016
151 HD21 LEU 23 3HD2 LEU 23 0.433 3.239 -2.840
152 HD22 LEU 23 1HD2 LEU 23 -0.193 4.332 -1.606
153 HD23 LEU 23 2HD2 LEU 23 -1.246 3.789 -2.912
154 H ARG 24 H ARG 24 -1.656 0.907 -5.632
155 HA ARG 24 HA ARG 24 -2.721 -1.812 -5.655
156 HB2 ARG 24 2HB ARG 24 -2.020 -0.001 -7.958
157 HB3 ARG 24 1HB ARG 24 -2.467 -1.693 -8.142
158 HG2 ARG 24 2HG ARG 24 -4.626 -1.183 -7.068
159 HG3 ARG 24 1HG ARG 24 -4.173 0.522 -7.053
160 HD2 ARG 24 2HD ARG 24 -5.556 0.055 -8.937
161 HD3 ARG 24 1HD ARG 24 -3.926 0.444 -9.498
162 HE ARG 24 HE ARG 24 -4.378 -2.349 -9.172
163 HH11 ARG 24 1HH1 ARG 24 -4.707 0.350 -11.447
164 HH12 ARG 24 2HH1 ARG 24 -4.954 -0.644 -12.813
165 HH21 ARG 24 1HH2 ARG 24 -4.730 -3.701 -11.067
166 HH22 ARG 24 2HH2 ARG 24 -4.940 -2.999 -12.589
167 H GLU 25 H GLU 25 -1.433 -3.244 -7.146
168 HA GLU 25 HA GLU 25 0.978 -3.633 -5.754
169 HB2 GLU 25 2HB GLU 25 1.387 -5.477 -7.512
170 HB3 GLU 25 1HB GLU 25 0.048 -5.651 -6.399
171 HG2 GLU 25 2HG GLU 25 -0.356 -4.494 -9.136
172 HG3 GLU 25 1HG GLU 25 -0.311 -6.236 -8.896
173 H GLY 26 H GLY 26 2.835 -2.807 -5.955
174 HA2 GLY 26 2HA GLY 26 4.727 -2.544 -7.569
175 HA3 GLY 26 1HA GLY 26 3.589 -1.573 -8.507
176 H SER 27 H SER 27 5.507 -0.033 -8.016
177 HA SER 27 HA SER 27 5.072 1.097 -5.398
178 HB2 SER 27 2HB SER 27 7.109 2.437 -5.804
179 HB3 SER 27 1HB SER 27 7.369 0.701 -5.869
180 HG SER 27 HG SER 27 7.723 0.761 -7.983
181 H ASN 28 H ASN 28 3.925 2.727 -5.047
182 HA ASN 28 HA ASN 28 2.774 4.113 -7.356
183 HB2 ASN 28 2HB ASN 28 1.792 4.021 -4.468
184 HB3 ASN 28 1HB ASN 28 1.014 4.907 -5.758
185 HD21 ASN 28 1HD2 ASN 28 2.303 1.591 -5.993
186 HD22 ASN 28 2HD2 ASN 28 0.798 0.815 -6.197
187 H ILE 29 H ILE 29 3.831 5.863 -7.816
188 HA ILE 29 HA ILE 29 5.403 7.240 -5.816
189 HB ILE 29 HB ILE 29 4.999 7.927 -8.739
190 HG12 ILE 29 2HG1 ILE 29 7.229 6.332 -7.444
191 HG13 ILE 29 1HG1 ILE 29 5.945 5.666 -8.447
192 HG21 ILE 29 1HG2 ILE 29 7.107 9.187 -8.474
193 HG22 ILE 29 2HG2 ILE 29 7.127 8.779 -6.760
194 HG23 ILE 29 3HG2 ILE 29 5.841 9.799 -7.407
195 HD11 ILE 29 3HD1 ILE 29 8.008 5.885 -9.702
196 HD12 ILE 29 1HD1 ILE 29 8.069 7.607 -9.324
197 HD13 ILE 29 2HD1 ILE 29 6.778 6.974 -10.341
198 H ILE 30 H ILE 30 4.778 9.029 -4.806
199 HA ILE 30 HA ILE 30 2.269 10.293 -5.606
200 HB ILE 30 HB ILE 30 3.607 10.256 -2.864
201 HG12 ILE 30 2HG1 ILE 30 1.120 8.808 -3.821
202 HG13 ILE 30 1HG1 ILE 30 2.679 8.056 -3.527
203 HG21 ILE 30 1HG2 ILE 30 1.493 11.233 -2.071
204 HG22 ILE 30 2HG2 ILE 30 1.027 11.487 -3.763
205 HG23 ILE 30 3HG2 ILE 30 2.445 12.284 -3.110
206 HD11 ILE 30 3HD1 ILE 30 2.513 8.645 -1.163
207 HD12 ILE 30 1HD1 ILE 30 1.145 7.665 -1.694
208 HD13 ILE 30 2HD1 ILE 30 0.951 9.403 -1.470
209 H GLY 31 H GLY 31 2.315 12.358 -6.181
210 HA2 GLY 31 2HA GLY 31 3.547 14.519 -5.273
211 HA3 GLY 31 1HA GLY 31 4.816 13.816 -6.305
212 H ARG 32 H ARG 32 4.364 15.972 -7.364
213 HA ARG 32 HA ARG 32 2.134 15.533 -9.230
214 HB2 ARG 32 2HB ARG 32 3.191 18.184 -8.226
215 HB3 ARG 32 1HB ARG 32 1.954 17.984 -9.458
216 HG2 ARG 32 2HG ARG 32 0.504 16.880 -7.804
217 HG3 ARG 32 1HG ARG 32 1.771 17.047 -6.628
218 HD2 ARG 32 2HD ARG 32 0.091 18.795 -6.339
219 HD3 ARG 32 1HD ARG 32 1.684 19.440 -6.697
220 HE ARG 32 HE ARG 32 0.331 19.264 -9.105
221 HH11 ARG 32 1HH1 ARG 32 -0.074 20.942 -6.026
222 HH12 ARG 32 2HH1 ARG 32 -0.805 22.324 -6.687
223 HH21 ARG 32 1HH2 ARG 32 -0.703 21.122 -10.034
224 HH22 ARG 32 2HH2 ARG 32 -1.178 22.434 -9.043
225 H GLY 33 H GLY 33 3.039 14.775 -10.908
226 HA2 GLY 33 2HA GLY 33 4.591 16.189 -12.668
227 HA3 GLY 33 1HA GLY 33 5.659 15.104 -11.763
228 H GLN 34 H GLN 34 4.982 14.834 -14.529
229 HA GLN 34 HA GLN 34 2.880 12.965 -14.871
230 HB2 GLN 34 2HB GLN 34 3.715 12.629 -17.120
231 HB3 GLN 34 1HB GLN 34 3.718 14.338 -16.718
232 HG2 GLN 34 2HG GLN 34 6.134 14.204 -16.279
233 HG3 GLN 34 1HG GLN 34 6.107 12.507 -16.747
234 HE21 GLN 34 1HE2 GLN 34 7.407 12.703 -18.473
235 HE22 GLN 34 2HE2 GLN 34 7.005 13.571 -19.904
236 H ASP 35 H ASP 35 6.002 12.558 -13.677
237 HA ASP 35 HA ASP 35 6.214 9.739 -14.380
238 HB2 ASP 35 2HB ASP 35 8.189 11.347 -14.383
239 HB3 ASP 35 1HB ASP 35 8.054 11.395 -12.635
240 H ALA 36 H ALA 36 4.561 11.472 -12.154
241 HA ALA 36 HA ALA 36 4.906 9.569 -9.973
242 HB1 ALA 36 1HB ALA 36 3.388 12.180 -10.054
243 HB2 ALA 36 2HB ALA 36 4.992 11.946 -9.362
244 HB3 ALA 36 3HB ALA 36 3.594 11.158 -8.632
245 H GLN 37 H GLN 37 2.990 8.592 -9.050
246 HA GLN 37 HA GLN 37 1.117 7.908 -11.157
247 HB2 GLN 37 2HB GLN 37 1.769 6.576 -8.532
248 HB3 GLN 37 1HB GLN 37 0.609 5.971 -9.700
249 HG2 GLN 37 2HG GLN 37 3.578 6.291 -10.109
250 HG3 GLN 37 1HG GLN 37 2.700 4.776 -9.912
251 HE21 GLN 37 1HE2 GLN 37 1.409 4.028 -11.619
252 HE22 GLN 37 2HE2 GLN 37 1.614 4.643 -13.220
253 H PHE 38 H PHE 38 1.188 8.880 -7.766
254 HA PHE 38 HA PHE 38 -1.652 9.544 -7.967
255 HB2 PHE 38 2HB PHE 38 -1.213 7.915 -6.222
256 HB3 PHE 38 1HB PHE 38 0.076 8.918 -5.568
257 HD1 PHE 38 2HD PHE 38 -3.596 9.146 -6.320
258 HD2 PHE 38 1HD PHE 38 -0.395 10.156 -3.703
259 HE1 PHE 38 2HE PHE 38 -5.185 10.186 -4.757
260 HE2 PHE 38 1HE PHE 38 -1.911 11.167 -2.169
261 HZ PHE 38 HZ PHE 38 -4.361 11.205 -2.665
262 H ARG 39 H ARG 39 -2.088 11.584 -8.139
263 HA ARG 39 HA ARG 39 0.057 13.519 -7.750
264 HB2 ARG 39 2HB ARG 39 -2.643 13.975 -9.015
265 HB3 ARG 39 1HB ARG 39 -1.193 14.948 -9.194
266 HG2 ARG 39 2HG ARG 39 -1.560 12.148 -10.235
267 HG3 ARG 39 1HG ARG 39 -1.677 13.622 -11.194
268 HD2 ARG 39 2HD ARG 39 0.668 14.084 -10.818
269 HD3 ARG 39 1HD ARG 39 0.783 12.731 -9.696
270 HE ARG 39 HE ARG 39 0.798 11.253 -11.446
271 HH11 ARG 39 1HH1 ARG 39 0.349 14.520 -12.718
272 HH12 ARG 39 2HH1 ARG 39 0.548 14.082 -14.336
273 HH21 ARG 39 1HH2 ARG 39 1.120 10.631 -13.622
274 HH22 ARG 39 2HH2 ARG 39 1.008 11.773 -14.883
275 H LEU 40 H LEU 40 0.028 14.735 -5.993
276 HA LEU 40 HA LEU 40 -2.258 14.737 -4.257
277 HB2 LEU 40 2HB LEU 40 0.397 16.126 -4.088
278 HB3 LEU 40 1HB LEU 40 -0.874 16.403 -2.912
279 HG LEU 40 HG LEU 40 0.527 13.781 -3.442
280 HD11 LEU 40 1HD1 LEU 40 1.460 14.112 -1.245
281 HD12 LEU 40 2HD1 LEU 40 0.586 15.637 -1.078
282 HD13 LEU 40 3HD1 LEU 40 1.877 15.485 -2.272
283 HD21 LEU 40 3HD2 LEU 40 -1.786 13.400 -2.784
284 HD22 LEU 40 1HD2 LEU 40 -1.598 14.515 -1.426
285 HD23 LEU 40 2HD2 LEU 40 -0.694 13.003 -1.461
286 HA PRO 41 HA PRO 41 -4.037 18.307 -6.036
287 HB2 PRO 41 2HB PRO 41 -5.975 18.787 -4.279
288 HB3 PRO 41 1HB PRO 41 -5.960 17.325 -5.273
289 HG2 PRO 41 2HG PRO 41 -5.197 17.661 -2.401
290 HG3 PRO 41 1HG PRO 41 -6.091 16.341 -3.180
291 HD2 PRO 41 2HD PRO 41 -3.380 16.286 -2.568
292 HD3 PRO 41 1HD PRO 41 -4.162 15.249 -3.767
293 H ASP 42 H ASP 42 -1.966 18.614 -3.484
294 HA ASP 42 HA ASP 42 -2.620 21.473 -3.090
295 HB2 ASP 42 2HB ASP 42 -2.442 19.733 -1.046
296 HB3 ASP 42 1HB ASP 42 -0.721 20.047 -1.270
297 H THR 43 H THR 43 -0.364 22.668 -2.532
298 HA THR 43 HA THR 43 1.391 21.892 -4.725
299 HB THR 43 HB THR 43 0.948 24.696 -3.642
300 HG1 THR 43 1HG THR 43 -0.947 24.362 -4.551
301 HG21 THR 43 3HG2 THR 43 3.016 24.332 -4.907
302 HG22 THR 43 1HG2 THR 43 1.899 25.374 -5.799
303 HG23 THR 43 2HG2 THR 43 2.073 23.669 -6.244
304 H GLY 44 H GLY 44 3.681 22.390 -4.339
305 HA2 GLY 44 2HA GLY 44 5.406 23.166 -2.772
306 HA3 GLY 44 1HA GLY 44 4.371 22.580 -1.470
307 H VAL 45 H VAL 45 3.645 20.334 -3.184
308 HA VAL 45 HA VAL 45 5.698 18.531 -2.342
309 HB VAL 45 HB VAL 45 3.347 17.826 -2.205
310 HG11 VAL 45 1HG1 VAL 45 2.000 17.389 -4.182
311 HG12 VAL 45 2HG1 VAL 45 3.261 18.111 -5.187
312 HG13 VAL 45 3HG1 VAL 45 2.403 19.097 -4.006
313 HG21 VAL 45 3HG2 VAL 45 4.938 16.043 -2.523
314 HG22 VAL 45 1HG2 VAL 45 4.879 16.267 -4.271
315 HG23 VAL 45 2HG2 VAL 45 3.461 15.672 -3.423
316 H SER 46 H SER 46 7.241 17.583 -3.592
317 HA SER 46 HA SER 46 8.035 18.862 -5.975
318 HB2 SER 46 2HB SER 46 9.011 16.254 -4.803
319 HB3 SER 46 1HB SER 46 9.903 17.367 -5.849
320 HG SER 46 HG SER 46 9.963 18.866 -4.224
321 H ARG 47 H ARG 47 8.750 17.261 -7.910
322 HA ARG 47 HA ARG 47 6.343 16.283 -8.997
323 HB2 ARG 47 2HB ARG 47 7.726 15.350 -10.871
324 HB3 ARG 47 1HB ARG 47 7.899 17.067 -10.589
325 HG2 ARG 47 2HG ARG 47 10.027 16.674 -9.482
326 HG3 ARG 47 1HG ARG 47 9.825 14.932 -9.713
327 HD2 ARG 47 2HD ARG 47 11.289 15.871 -11.422
328 HD3 ARG 47 1HD ARG 47 9.784 15.236 -12.097
329 HE ARG 47 HE ARG 47 9.027 17.643 -12.075
330 HH11 ARG 47 1HH1 ARG 47 12.471 16.879 -12.404
331 HH12 ARG 47 2HH1 ARG 47 12.772 18.206 -13.430
332 HH21 ARG 47 1HH2 ARG 47 9.472 19.418 -13.501
333 HH22 ARG 47 2HH2 ARG 47 11.064 19.668 -14.047
334 H ARG 48 H ARG 48 9.042 14.621 -7.528
335 HA ARG 48 HA ARG 48 7.179 12.447 -7.002
336 HB2 ARG 48 2HB ARG 48 10.127 12.140 -7.586
337 HB3 ARG 48 1HB ARG 48 9.040 10.859 -7.087
338 HG2 ARG 48 2HG ARG 48 7.762 11.162 -9.163
339 HG3 ARG 48 1HG ARG 48 8.935 12.377 -9.671
340 HD2 ARG 48 2HD ARG 48 9.499 9.497 -9.046
341 HD3 ARG 48 1HD ARG 48 9.467 10.238 -10.646
342 HE ARG 48 HE ARG 48 11.310 11.367 -8.720
343 HH11 ARG 48 1HH1 ARG 48 10.833 9.350 -11.570
344 HH12 ARG 48 2HH1 ARG 48 12.496 9.161 -11.882
345 HH21 ARG 48 1HH2 ARG 48 13.563 11.201 -9.162
346 HH22 ARG 48 2HH2 ARG 48 14.101 10.263 -10.483
347 H HIS 49 H HIS 49 6.885 12.470 -4.971
348 HA HIS 49 HA HIS 49 8.868 13.815 -3.287
349 HB2 HIS 49 2HB HIS 49 6.640 14.837 -3.409
350 HB3 HIS 49 1HB HIS 49 5.916 13.339 -2.850
351 HD2 HIS 49 2HD HIS 49 6.730 12.655 -0.157
352 HE1 HIS 49 1HE HIS 49 7.349 16.698 0.813
353 HE2 HIS 49 2HE HIS 49 7.453 14.274 1.618
354 H LEU 50 H LEU 50 6.866 10.958 -3.610
355 HA LEU 50 HA LEU 50 8.612 9.463 -1.951
356 HB2 LEU 50 2HB LEU 50 7.460 10.539 -0.201
357 HB3 LEU 50 1HB LEU 50 5.903 10.394 -0.943
358 HG LEU 50 HG LEU 50 7.394 7.963 0.064
359 HD11 LEU 50 1HD1 LEU 50 7.288 9.676 1.852
360 HD12 LEU 50 2HD1 LEU 50 6.268 8.287 2.194
361 HD13 LEU 50 3HD1 LEU 50 5.544 9.788 1.612
362 HD21 LEU 50 3HD2 LEU 50 5.130 7.107 0.350
363 HD22 LEU 50 1HD2 LEU 50 5.389 7.620 -1.318
364 HD23 LEU 50 2HD2 LEU 50 4.466 8.638 -0.209
365 H GLU 51 H GLU 51 8.096 7.210 -2.082
366 HA GLU 51 HA GLU 51 5.995 6.519 -3.960
367 HB2 GLU 51 2HB GLU 51 7.600 4.950 -5.118
368 HB3 GLU 51 1HB GLU 51 7.849 6.650 -5.454
369 HG2 GLU 51 2HG GLU 51 9.672 6.631 -3.732
370 HG3 GLU 51 1HG GLU 51 9.431 4.899 -3.577
371 H ILE 52 H ILE 52 4.861 4.902 -3.217
372 HA ILE 52 HA ILE 52 6.016 3.362 -1.009
373 HB ILE 52 HB ILE 52 3.119 3.438 -1.898
374 HG12 ILE 52 2HG1 ILE 52 4.458 4.787 0.460
375 HG13 ILE 52 1HG1 ILE 52 3.932 5.612 -1.001
376 HG21 ILE 52 1HG2 ILE 52 2.729 2.312 0.279
377 HG22 ILE 52 2HG2 ILE 52 4.479 2.282 0.547
378 HG23 ILE 52 3HG2 ILE 52 3.781 1.376 -0.793
379 HD11 ILE 52 3HD1 ILE 52 2.371 5.939 0.832
380 HD12 ILE 52 1HD1 ILE 52 2.151 4.195 0.971
381 HD13 ILE 52 2HD1 ILE 52 1.618 5.041 -0.484
382 H ARG 53 H ARG 53 6.755 1.440 -1.427
383 HA ARG 53 HA ARG 53 6.115 0.196 -3.986
384 HB2 ARG 53 2HB ARG 53 8.098 -0.797 -1.931
385 HB3 ARG 53 1HB ARG 53 8.052 -1.155 -3.647
386 HG2 ARG 53 2HG ARG 53 8.543 1.195 -4.117
387 HG3 ARG 53 1HG ARG 53 8.729 1.479 -2.391
388 HD2 ARG 53 2HD ARG 53 10.516 -0.350 -2.430
389 HD3 ARG 53 1HD ARG 53 10.452 -0.242 -4.185
390 HE ARG 53 HE ARG 53 11.760 1.532 -2.401
391 HH11 ARG 53 1HH1 ARG 53 10.230 1.455 -5.607
392 HH12 ARG 53 2HH1 ARG 53 10.821 2.998 -6.044
393 HH21 ARG 53 1HH2 ARG 53 12.642 3.532 -3.068
394 HH22 ARG 53 2HH2 ARG 53 12.220 4.202 -4.580
395 H TRP 54 H TRP 54 4.347 -0.915 -3.889
396 HA TRP 54 HA TRP 54 3.751 -2.315 -1.426
397 HB2 TRP 54 2HB TRP 54 1.949 -0.842 -1.975
398 HB3 TRP 54 1HB TRP 54 1.937 -1.368 -3.651
399 HD1 TRP 54 HD TRP 54 -0.165 -2.693 -4.119
400 HE1 TRP 54 1HE TRP 54 -1.624 -4.424 -2.876
401 HE3 TRP 54 3HE TRP 54 2.359 -2.880 0.292
402 HZ2 TRP 54 2HZ TRP 54 -1.696 -5.692 -0.380
403 HZ3 TRP 54 3HZ TRP 54 1.543 -4.373 2.061
404 HH2 TRP 54 HH TRP 54 -0.448 -5.755 1.733
405 H ASP 55 H ASP 55 4.119 -4.303 -1.330
406 HA ASP 55 HA ASP 55 4.078 -5.959 -3.746
407 HB2 ASP 55 2HB ASP 55 6.362 -5.569 -2.686
408 HB3 ASP 55 1HB ASP 55 5.741 -6.368 -1.247
409 H GLY 56 H GLY 56 3.434 -8.244 -3.163
410 HA2 GLY 56 2HA GLY 56 1.111 -8.169 -1.450
411 HA3 GLY 56 1HA GLY 56 1.671 -9.552 -2.382
412 H GLN 57 H GLN 57 3.417 -7.714 -0.029
413 HA GLN 57 HA GLN 57 3.399 -9.891 1.908
414 HB2 GLN 57 2HB GLN 57 5.901 -8.564 0.808
415 HB3 GLN 57 1HB GLN 57 5.886 -9.564 2.251
416 HG2 GLN 57 2HG GLN 57 5.207 -11.497 0.953
417 HG3 GLN 57 1HG GLN 57 5.089 -10.507 -0.498
418 HE21 GLN 57 1HE2 GLN 57 7.505 -9.036 0.005
419 HE22 GLN 57 2HE2 GLN 57 8.832 -10.088 -0.272
420 H VAL 58 H VAL 58 5.087 -6.746 1.480
421 HA VAL 58 HA VAL 58 3.563 -5.667 3.704
422 HB VAL 58 HB VAL 58 5.580 -4.622 4.703
423 HG11 VAL 58 1HG1 VAL 58 5.723 -7.625 4.616
424 HG12 VAL 58 2HG1 VAL 58 4.755 -6.650 5.720
425 HG13 VAL 58 3HG1 VAL 58 6.515 -6.594 5.806
426 HG21 VAL 58 3HG2 VAL 58 7.131 -6.388 2.812
427 HG22 VAL 58 1HG2 VAL 58 7.833 -5.450 4.129
428 HG23 VAL 58 2HG2 VAL 58 7.064 -4.625 2.773
429 H ALA 59 H ALA 59 3.718 -3.324 3.818
430 HA ALA 59 HA ALA 59 3.976 -2.175 1.148
431 HB1 ALA 59 1HB ALA 59 1.822 -1.850 2.267
432 HB2 ALA 59 2HB ALA 59 2.656 -0.306 2.062
433 HB3 ALA 59 3HB ALA 59 2.640 -1.109 3.637
434 H LEU 60 H LEU 60 5.874 -1.446 0.745
435 HA LEU 60 HA LEU 60 7.566 -0.507 2.879
436 HB2 LEU 60 2HB LEU 60 8.443 -2.134 1.375
437 HB3 LEU 60 1HB LEU 60 8.019 -1.158 -0.007
438 HG LEU 60 HG LEU 60 9.744 0.474 0.628
439 HD11 LEU 60 1HD1 LEU 60 10.367 -1.499 2.824
440 HD12 LEU 60 2HD1 LEU 60 9.685 0.111 3.047
441 HD13 LEU 60 3HD1 LEU 60 11.323 -0.070 2.415
442 HD21 LEU 60 3HD2 LEU 60 10.132 -1.470 -0.829
443 HD22 LEU 60 1HD2 LEU 60 10.759 -2.345 0.547
444 HD23 LEU 60 2HD2 LEU 60 11.608 -0.900 -0.030
445 H LEU 61 H LEU 61 7.478 1.511 3.370
446 HA LEU 61 HA LEU 61 6.546 3.559 1.551
447 HB2 LEU 61 2HB LEU 61 5.724 3.391 3.828
448 HB3 LEU 61 1HB LEU 61 7.314 3.525 4.502
449 HG LEU 61 HG LEU 61 5.944 5.534 4.841
450 HD11 LEU 61 1HD1 LEU 61 8.174 6.122 2.917
451 HD12 LEU 61 2HD1 LEU 61 8.314 5.949 4.666
452 HD13 LEU 61 3HD1 LEU 61 7.392 7.288 3.985
453 HD21 LEU 61 3HD2 LEU 61 4.531 5.232 2.863
454 HD22 LEU 61 1HD2 LEU 61 5.861 5.789 1.858
455 HD23 LEU 61 2HD2 LEU 61 5.117 6.883 3.038
456 H ALA 62 H ALA 62 8.014 4.651 0.330
457 HA ALA 62 HA ALA 62 10.713 4.939 1.398
458 HB1 ALA 62 1HB ALA 62 9.931 4.384 -1.458
459 HB2 ALA 62 2HB ALA 62 10.715 3.244 -0.359
460 HB3 ALA 62 3HB ALA 62 11.566 4.697 -0.882
461 H ASP 63 H ASP 63 11.275 6.973 1.572
462 HA ASP 63 HA ASP 63 9.598 9.059 0.444
463 HB2 ASP 63 2HB ASP 63 10.239 9.322 2.749
464 HB3 ASP 63 1HB ASP 63 11.932 9.070 2.368
465 H LEU 64 H LEU 64 10.373 10.672 -1.018
466 HA LEU 64 HA LEU 64 12.982 10.115 -2.257
467 HB2 LEU 64 2HB LEU 64 10.890 9.141 -3.455
468 HB3 LEU 64 1HB LEU 64 10.436 10.788 -3.760
469 HG LEU 64 HG LEU 64 11.320 9.805 -5.731
470 HD11 LEU 64 1HD1 LEU 64 13.352 11.744 -4.679
471 HD12 LEU 64 2HD1 LEU 64 11.859 12.122 -5.544
472 HD13 LEU 64 3HD1 LEU 64 13.164 11.268 -6.367
473 HD21 LEU 64 3HD2 LEU 64 13.814 9.171 -4.174
474 HD22 LEU 64 1HD2 LEU 64 13.627 8.981 -5.917
475 HD23 LEU 64 2HD2 LEU 64 12.630 8.030 -4.818
476 H ASN 65 H ASN 65 13.471 12.024 -0.754
477 HA ASN 65 HA ASN 65 13.348 14.464 -2.178
478 HB2 ASN 65 2HB ASN 65 10.977 14.064 -0.967
479 HB3 ASN 65 1HB ASN 65 11.868 14.771 0.380
480 HD21 ASN 65 1HD2 ASN 65 10.555 15.245 -2.698
481 HD22 ASN 65 2HD2 ASN 65 10.698 16.951 -2.809
482 H SER 66 H SER 66 14.446 16.183 -0.960
483 HA SER 66 HA SER 66 16.171 15.005 1.084
484 HB2 SER 66 2HB SER 66 16.667 17.434 -0.638
485 HB3 SER 66 1HB SER 66 17.827 16.596 0.393
486 HG SER 66 HG SER 66 17.234 14.688 -0.980
487 H THR 67 H THR 67 14.617 18.151 0.248
488 HA THR 67 HA THR 67 14.987 18.934 2.999
489 HB THR 67 HB THR 67 15.564 20.541 1.170
490 HG1 THR 67 1HG THR 67 15.089 21.265 3.242
491 HG21 THR 67 3HG2 THR 67 12.567 20.724 0.798
492 HG22 THR 67 1HG2 THR 67 13.710 20.086 -0.379
493 HG23 THR 67 2HG2 THR 67 13.753 21.795 0.053
494 H ASN 68 H ASN 68 12.440 17.751 0.999
495 HA ASN 68 HA ASN 68 10.426 18.605 2.957
496 HB2 ASN 68 2HB ASN 68 10.054 17.521 0.142
497 HB3 ASN 68 1HB ASN 68 8.771 18.020 1.238
498 HD21 ASN 68 1HD2 ASN 68 9.512 18.956 -1.440
499 HD22 ASN 68 2HD2 ASN 68 9.750 20.650 -1.296
500 H GLY 69 H GLY 69 12.365 16.480 3.312
501 HA2 GLY 69 2HA GLY 69 11.580 13.895 2.772
502 HA3 GLY 69 1HA GLY 69 12.478 14.368 4.199
503 H THR 70 H THR 70 10.014 12.654 3.320
504 HA THR 70 HA THR 70 7.866 13.567 4.904
505 HB THR 70 HB THR 70 8.379 10.812 3.790
506 HG1 THR 70 1HG THR 70 8.559 12.107 2.098
507 HG21 THR 70 3HG2 THR 70 5.916 10.743 3.648
508 HG22 THR 70 1HG2 THR 70 5.828 12.324 4.423
509 HG23 THR 70 2HG2 THR 70 6.461 10.941 5.316
510 H THR 71 H THR 71 7.090 12.732 6.827
511 HA THR 71 HA THR 71 9.022 11.246 8.448
512 HB THR 71 HB THR 71 7.832 12.271 10.396
513 HG1 THR 71 1HG THR 71 6.605 13.788 8.320
514 HG21 THR 71 3HG2 THR 71 8.897 14.443 10.198
515 HG22 THR 71 1HG2 THR 71 9.097 14.175 8.453
516 HG23 THR 71 2HG2 THR 71 9.928 13.122 9.617
517 H VAL 72 H VAL 72 8.269 9.591 9.681
518 HA VAL 72 HA VAL 72 5.510 8.796 9.207
519 HB VAL 72 HB VAL 72 6.268 6.458 9.642
520 HG11 VAL 72 1HG1 VAL 72 6.028 7.246 7.358
521 HG12 VAL 72 2HG1 VAL 72 7.416 6.156 7.462
522 HG13 VAL 72 3HG1 VAL 72 7.662 7.904 7.392
523 HG21 VAL 72 3HG2 VAL 72 8.283 6.946 10.938
524 HG22 VAL 72 1HG2 VAL 72 9.019 7.697 9.525
525 HG23 VAL 72 2HG2 VAL 72 8.695 5.963 9.528
526 H ASN 73 H ASN 73 4.320 9.024 10.862
527 HA ASN 73 HA ASN 73 3.546 9.398 12.928
528 HB2 ASN 73 2HB ASN 73 5.826 7.541 13.700
529 HB3 ASN 73 1HB ASN 73 4.593 8.083 14.840
530 HD21 ASN 73 1HD2 ASN 73 5.231 5.391 13.818
531 HD22 ASN 73 2HD2 ASN 73 3.781 4.771 13.113
532 H ASN 74 H ASN 74 5.532 11.037 11.681
533 HA ASN 74 HA ASN 74 6.323 13.034 11.923
534 HB2 ASN 74 2HB ASN 74 5.857 12.761 14.890
535 HB3 ASN 74 1HB ASN 74 6.617 14.186 14.192
536 HD21 ASN 74 1HD2 ASN 74 5.357 15.594 12.941
537 HD22 ASN 74 2HD2 ASN 74 3.632 15.511 12.963
538 H ALA 75 H ALA 75 7.831 10.341 12.536
539 HA ALA 75 HA ALA 75 10.386 11.538 13.292
540 HB1 ALA 75 1HB ALA 75 11.166 9.198 13.422
541 HB2 ALA 75 2HB ALA 75 9.576 8.650 12.893
542 HB3 ALA 75 3HB ALA 75 9.757 9.474 14.444
543 HA PRO 76 HA PRO 76 11.310 11.653 8.899
544 HB2 PRO 76 2HB PRO 76 13.856 12.553 9.086
545 HB3 PRO 76 1HB PRO 76 12.466 13.606 9.366
546 HG2 PRO 76 2HG PRO 76 14.248 12.249 11.343
547 HG3 PRO 76 1HG PRO 76 13.576 13.890 11.382
548 HD2 PRO 76 2HD PRO 76 12.542 11.800 12.810
549 HD3 PRO 76 1HD PRO 76 11.578 13.179 12.250
550 H VAL 77 H VAL 77 11.813 9.965 7.648
551 HA VAL 77 HA VAL 77 14.135 8.293 8.247
552 HB VAL 77 HB VAL 77 12.849 6.219 7.837
553 HG11 VAL 77 1HG1 VAL 77 13.159 6.892 10.164
554 HG12 VAL 77 2HG1 VAL 77 11.621 6.059 9.944
555 HG13 VAL 77 3HG1 VAL 77 11.660 7.815 10.105
556 HG21 VAL 77 3HG2 VAL 77 10.368 6.277 7.876
557 HG22 VAL 77 1HG2 VAL 77 11.066 7.086 6.466
558 HG23 VAL 77 2HG2 VAL 77 10.453 8.041 7.807
559 H GLN 78 H GLN 78 14.747 7.008 6.338
560 HA GLN 78 HA GLN 78 13.988 8.337 3.890
561 HB2 GLN 78 2HB GLN 78 15.821 7.170 2.816
562 HB3 GLN 78 1HB GLN 78 16.390 7.871 4.310
563 HG2 GLN 78 2HG GLN 78 15.765 4.954 3.829
564 HG3 GLN 78 1HG GLN 78 17.365 5.676 3.875
565 HE21 GLN 78 1HE2 GLN 78 16.367 3.519 5.435
566 HE22 GLN 78 2HE2 GLN 78 16.469 3.993 7.092
567 H GLU 79 H GLU 79 13.370 5.361 5.534
568 HA GLU 79 HA GLU 79 11.308 4.730 3.671
569 HB2 GLU 79 2HB GLU 79 12.045 2.463 3.194
570 HB3 GLU 79 1HB GLU 79 13.273 3.592 2.645
571 HG2 GLU 79 2HG GLU 79 14.584 3.122 4.657
572 HG3 GLU 79 1HG GLU 79 13.354 1.970 5.174
573 H TRP 80 H TRP 80 9.956 2.999 4.551
574 HA TRP 80 HA TRP 80 10.271 2.267 7.329
575 HB2 TRP 80 2HB TRP 80 9.487 4.523 7.569
576 HB3 TRP 80 1HB TRP 80 8.186 4.305 6.424
577 HD1 TRP 80 HD TRP 80 5.946 3.301 7.382
578 HE1 TRP 80 1HE TRP 80 5.073 2.916 9.775
579 HE3 TRP 80 3HE TRP 80 10.356 3.758 9.905
580 HZ2 TRP 80 2HZ TRP 80 6.126 2.829 12.380
581 HZ3 TRP 80 3HZ TRP 80 10.335 3.523 12.355
582 HH2 TRP 80 HH TRP 80 8.253 3.071 13.558
583 H GLN 81 H GLN 81 8.749 0.648 7.871
584 HA GLN 81 HA GLN 81 7.310 -0.454 5.566
585 HB2 GLN 81 2HB GLN 81 7.920 -1.745 8.246
586 HB3 GLN 81 1HB GLN 81 7.143 -2.534 6.882
587 HG2 GLN 81 2HG GLN 81 9.173 -2.265 5.558
588 HG3 GLN 81 1HG GLN 81 9.953 -1.465 6.920
589 HE21 GLN 81 1HE2 GLN 81 11.562 -2.956 7.108
590 HE22 GLN 81 2HE2 GLN 81 11.291 -4.560 7.682
591 H LEU 82 H LEU 82 5.363 0.315 5.432
592 HA LEU 82 HA LEU 82 3.981 1.798 7.347
593 HB2 LEU 82 2HB LEU 82 2.895 0.281 5.005
594 HB3 LEU 82 1HB LEU 82 2.012 1.466 5.943
595 HG LEU 82 HG LEU 82 4.462 1.998 4.280
596 HD11 LEU 82 1HD1 LEU 82 2.453 1.577 2.936
597 HD12 LEU 82 2HD1 LEU 82 2.967 3.261 2.849
598 HD13 LEU 82 3HD1 LEU 82 1.588 2.818 3.849
599 HD21 LEU 82 3HD2 LEU 82 2.751 3.797 5.973
600 HD22 LEU 82 1HD2 LEU 82 3.906 4.376 4.767
601 HD23 LEU 82 2HD2 LEU 82 4.467 3.444 6.144
602 H ALA 83 H ALA 83 2.427 1.382 8.794
603 HA ALA 83 HA ALA 83 1.333 -1.303 8.951
604 HB1 ALA 83 1HB ALA 83 2.959 -1.106 10.744
605 HB2 ALA 83 2HB ALA 83 1.321 -1.064 11.408
606 HB3 ALA 83 3HB ALA 83 2.242 0.428 11.243
607 H ASP 84 H ASP 84 -0.717 -1.256 10.163
608 HA ASP 84 HA ASP 84 -2.411 0.789 9.134
609 HB2 ASP 84 2HB ASP 84 -3.210 -1.517 9.441
610 HB3 ASP 84 1HB ASP 84 -2.986 -1.367 11.176
611 H GLY 85 H GLY 85 -2.432 2.744 9.933
612 HA2 GLY 85 2HA GLY 85 -3.264 4.112 11.748
613 HA3 GLY 85 1HA GLY 85 -2.429 3.037 12.856
614 H ASP 86 H ASP 86 -0.406 3.549 10.199
615 HA ASP 86 HA ASP 86 1.192 5.313 11.834
616 HB2 ASP 86 2HB ASP 86 1.761 3.968 9.202
617 HB3 ASP 86 1HB ASP 86 2.818 5.228 9.822
618 H VAL 87 H VAL 87 1.741 7.355 11.464
619 HA VAL 87 HA VAL 87 -0.006 8.780 9.583
620 HB VAL 87 HB VAL 87 1.701 9.959 11.811
621 HG11 VAL 87 1HG1 VAL 87 1.204 11.548 10.055
622 HG12 VAL 87 2HG1 VAL 87 0.323 11.951 11.530
623 HG13 VAL 87 3HG1 VAL 87 -0.517 11.185 10.182
624 HG21 VAL 87 3HG2 VAL 87 -0.392 10.184 13.084
625 HG22 VAL 87 1HG2 VAL 87 -0.019 8.492 12.758
626 HG23 VAL 87 2HG2 VAL 87 -1.255 9.317 11.814
627 H ILE 88 H ILE 88 0.905 9.161 7.720
628 HA ILE 88 HA ILE 88 3.774 9.543 7.617
629 HB ILE 88 HB ILE 88 1.713 8.700 5.578
630 HG12 ILE 88 2HG1 ILE 88 3.361 6.965 4.998
631 HG13 ILE 88 1HG1 ILE 88 4.520 7.676 6.098
632 HG21 ILE 88 1HG2 ILE 88 2.784 10.546 4.444
633 HG22 ILE 88 2HG2 ILE 88 3.273 9.016 3.715
634 HG23 ILE 88 3HG2 ILE 88 4.373 9.867 4.804
635 HD11 ILE 88 3HD1 ILE 88 3.089 7.059 7.988
636 HD12 ILE 88 1HD1 ILE 88 3.501 5.647 7.012
637 HD13 ILE 88 2HD1 ILE 88 1.909 6.374 6.868
638 H ARG 89 H ARG 89 4.376 11.604 7.786
639 HA ARG 89 HA ARG 89 2.501 13.622 6.827
640 HB2 ARG 89 2HB ARG 89 2.569 13.784 9.212
641 HB3 ARG 89 1HB ARG 89 4.324 13.746 9.221
642 HG2 ARG 89 2HG ARG 89 4.451 15.932 8.253
643 HG3 ARG 89 1HG ARG 89 2.718 15.964 7.961
644 HD2 ARG 89 2HD ARG 89 2.263 16.028 10.311
645 HD3 ARG 89 1HD ARG 89 3.967 15.774 10.694
646 HE ARG 89 HE ARG 89 4.386 17.944 9.644
647 HH11 ARG 89 1HH1 ARG 89 1.050 17.350 10.748
648 HH12 ARG 89 2HH1 ARG 89 0.763 18.978 11.124
649 HH21 ARG 89 1HH2 ARG 89 3.955 20.152 10.156
650 HH22 ARG 89 2HH2 ARG 89 2.466 20.618 10.813
651 H LEU 90 H LEU 90 3.062 14.772 5.280
652 HA LEU 90 HA LEU 90 5.855 15.333 4.799
653 HB2 LEU 90 2HB LEU 90 5.329 15.351 2.363
654 HB3 LEU 90 1HB LEU 90 5.260 13.768 3.079
655 HG LEU 90 HG LEU 90 2.728 15.348 2.603
656 HD11 LEU 90 1HD1 LEU 90 4.158 13.505 0.682
657 HD12 LEU 90 2HD1 LEU 90 3.952 15.245 0.477
658 HD13 LEU 90 3HD1 LEU 90 2.546 14.181 0.464
659 HD21 LEU 90 3HD2 LEU 90 2.598 13.334 4.011
660 HD22 LEU 90 1HD2 LEU 90 3.331 12.386 2.716
661 HD23 LEU 90 2HD2 LEU 90 1.742 13.116 2.486
662 H GLY 91 H GLY 91 6.065 17.340 3.514
663 HA2 GLY 91 2HA GLY 91 4.894 19.494 4.749
664 HA3 GLY 91 1HA GLY 91 5.621 19.563 3.152
665 H HIS 92 H HIS 92 2.943 20.199 4.836
666 HA HIS 92 HA HIS 92 1.016 21.172 4.255
667 HB2 HIS 92 2HB HIS 92 1.582 20.259 1.452
668 HB3 HIS 92 1HB HIS 92 0.055 20.997 1.903
669 HD1 HIS 92 1HD HIS 92 0.551 22.965 0.317
670 HD2 HIS 92 2HD HIS 92 3.327 22.492 3.358
671 HE1 HIS 92 1HE HIS 92 1.922 25.054 0.323
672 H SER 93 H SER 93 1.527 17.828 3.992
673 HA SER 93 HA SER 93 -1.270 17.483 4.654
674 HB2 SER 93 2HB SER 93 -0.072 16.090 2.251
675 HB3 SER 93 1HB SER 93 -1.653 15.745 2.948
676 HG SER 93 HG SER 93 -1.390 18.371 2.505
677 H GLU 94 H GLU 94 -1.443 16.087 6.249
678 HA GLU 94 HA GLU 94 0.502 13.933 6.351
679 HB2 GLU 94 2HB GLU 94 -0.193 13.684 8.790
680 HB3 GLU 94 1HB GLU 94 0.770 15.093 8.401
681 HG2 GLU 94 2HG GLU 94 -1.237 16.470 8.432
682 HG3 GLU 94 1HG GLU 94 -2.210 15.043 8.794
683 H ILE 95 H ILE 95 -0.157 11.930 6.295
684 HA ILE 95 HA ILE 95 -3.016 11.495 5.954
685 HB ILE 95 HB ILE 95 -2.248 11.645 3.755
686 HG12 ILE 95 2HG1 ILE 95 -3.430 9.393 4.223
687 HG13 ILE 95 1HG1 ILE 95 -2.594 9.580 2.688
688 HG21 ILE 95 1HG2 ILE 95 -0.229 10.648 2.811
689 HG22 ILE 95 2HG2 ILE 95 0.223 10.114 4.433
690 HG23 ILE 95 3HG2 ILE 95 0.078 11.835 4.084
691 HD11 ILE 95 3HD1 ILE 95 -0.705 8.288 3.576
692 HD12 ILE 95 1HD1 ILE 95 -2.212 7.369 3.659
693 HD13 ILE 95 2HD1 ILE 95 -1.551 8.120 5.111
694 H ILE 96 H ILE 96 -3.798 9.444 6.583
695 HA ILE 96 HA ILE 96 -1.958 8.050 8.390
696 HB ILE 96 HB ILE 96 -5.000 8.065 8.370
697 HG12 ILE 96 2HG1 ILE 96 -3.070 9.375 10.306
698 HG13 ILE 96 1HG1 ILE 96 -3.989 10.219 9.068
699 HG21 ILE 96 1HG2 ILE 96 -4.093 5.955 9.223
700 HG22 ILE 96 2HG2 ILE 96 -4.822 6.888 10.531
701 HG23 ILE 96 3HG2 ILE 96 -3.067 6.841 10.354
702 HD11 ILE 96 3HD1 ILE 96 -5.004 10.485 11.252
703 HD12 ILE 96 1HD1 ILE 96 -5.132 8.733 11.421
704 HD13 ILE 96 2HD1 ILE 96 -6.064 9.565 10.180
705 H VAL 97 H VAL 97 -1.406 6.049 7.877
706 HA VAL 97 HA VAL 97 -2.502 4.886 5.465
707 HB VAL 97 HB VAL 97 -0.179 4.105 7.241
708 HG11 VAL 97 1HG1 VAL 97 0.369 2.435 5.511
709 HG12 VAL 97 2HG1 VAL 97 -1.154 2.798 4.695
710 HG13 VAL 97 3HG1 VAL 97 -1.161 2.085 6.310
711 HG21 VAL 97 3HG2 VAL 97 -0.331 5.144 4.426
712 HG22 VAL 97 1HG2 VAL 97 1.148 4.753 5.299
713 HG23 VAL 97 2HG2 VAL 97 0.122 6.087 5.842
714 H ARG 98 H ARG 98 -3.983 3.304 5.435
715 HA ARG 98 HA ARG 98 -4.431 1.859 7.931
716 HB2 ARG 98 2HB ARG 98 -6.403 2.397 5.719
717 HB3 ARG 98 1HB ARG 98 -6.709 1.481 7.179
718 HG2 ARG 98 2HG ARG 98 -6.131 4.389 6.938
719 HG3 ARG 98 1HG ARG 98 -7.696 3.680 7.354
720 HD2 ARG 98 2HD ARG 98 -5.161 3.831 8.987
721 HD3 ARG 98 1HD ARG 98 -6.738 4.510 9.367
722 HE ARG 98 HE ARG 98 -5.968 1.672 9.520
723 HH11 ARG 98 1HH1 ARG 98 -8.471 4.116 10.258
724 HH12 ARG 98 2HH1 ARG 98 -9.032 3.233 11.607
725 HH21 ARG 98 1HH2 ARG 98 -6.731 0.598 11.388
726 HH22 ARG 98 2HH2 ARG 98 -8.089 1.225 12.242
727 H MET 99 H MET 99 -4.817 -0.257 7.748
728 HA MET 99 HA MET 99 -4.314 -1.513 5.153
729 HB2 MET 99 2HB MET 99 -3.208 -2.499 7.790
730 HB3 MET 99 1HB MET 99 -3.124 -3.360 6.274
731 HG2 MET 99 2HG MET 99 -1.774 -1.644 5.289
732 HG3 MET 99 1HG MET 99 -1.868 -0.674 6.756
733 HE1 MET 99 3HE MET 99 -1.391 -4.610 6.466
734 HE2 MET 99 1HE MET 99 0.365 -4.728 6.477
735 HE3 MET 99 2HE MET 99 -0.453 -3.963 5.119
736 H HIS 100 H HIS 100 -6.047 -2.286 4.635
737 HA HIS 100 HA HIS 100 -8.021 -3.162 6.586
738 HB2 HIS 100 2HB HIS 100 -8.272 -2.880 3.576
739 HB3 HIS 100 1HB HIS 100 -9.582 -3.213 4.692
740 HD1 HIS 100 1HD HIS 100 -10.795 -1.181 5.614
741 HD2 HIS 100 2HD HIS 100 -7.157 -0.224 3.861
742 HE1 HIS 100 1HE HIS 100 -10.699 1.341 5.513
Start of MODEL 6
1 H1 GLY 1 1HT GLY 1 3.341 -12.590 -6.007
2 H2 GLY 1 2HT GLY 1 2.407 -11.213 -6.352
3 H3 GLY 1 3HT GLY 1 1.998 -12.711 -7.028
4 HA2 GLY 1 1HA GLY 1 1.444 -13.564 -4.889
5 HA3 GLY 1 2HA GLY 1 1.939 -12.027 -4.185
6 H HIS 2 H HIS 2 -0.649 -13.345 -4.114
7 HA HIS 2 HA HIS 2 -2.240 -11.085 -4.625
8 HB2 HIS 2 2HB HIS 2 -3.862 -12.171 -6.184
9 HB3 HIS 2 1HB HIS 2 -2.296 -11.918 -6.935
10 HD1 HIS 2 1HD HIS 2 -1.096 -14.018 -7.822
11 HD2 HIS 2 2HD HIS 2 -4.508 -14.886 -5.630
12 HE1 HIS 2 1HE HIS 2 -1.532 -16.455 -8.165
13 H GLY 3 H GLY 3 -4.290 -11.320 -3.660
14 HA2 GLY 3 2HA GLY 3 -5.100 -13.761 -2.479
15 HA3 GLY 3 1HA GLY 3 -4.371 -12.669 -1.303
16 H SER 4 H SER 4 -7.157 -13.626 -1.819
17 HA SER 4 HA SER 4 -8.574 -11.196 -2.422
18 HB2 SER 4 2HB SER 4 -9.572 -13.876 -1.445
19 HB3 SER 4 1HB SER 4 -10.554 -12.583 -2.138
20 HG SER 4 HG SER 4 -10.206 -13.682 -3.867
21 H ALA 5 H ALA 5 -7.393 -12.970 0.277
22 HA ALA 5 HA ALA 5 -8.321 -10.895 2.068
23 HB1 ALA 5 1HB ALA 5 -9.968 -12.711 2.317
24 HB2 ALA 5 2HB ALA 5 -8.969 -12.558 3.762
25 HB3 ALA 5 3HB ALA 5 -8.656 -13.854 2.612
26 H GLY 6 H GLY 6 -6.908 -10.598 3.759
27 HA2 GLY 6 2HA GLY 6 -4.965 -11.942 4.861
28 HA3 GLY 6 1HA GLY 6 -4.266 -11.691 3.259
29 H THR 7 H THR 7 -4.086 -9.446 2.522
30 HA THR 7 HA THR 7 -4.207 -7.472 4.594
31 HB THR 7 HB THR 7 -1.570 -8.179 3.283
32 HG1 THR 7 1HG THR 7 -2.794 -8.874 5.538
33 HG21 THR 7 3HG2 THR 7 -2.214 -5.917 5.206
34 HG22 THR 7 1HG2 THR 7 -1.876 -5.733 3.486
35 HG23 THR 7 2HG2 THR 7 -0.618 -6.321 4.574
36 H SER 8 H SER 8 -5.273 -5.890 3.683
37 HA SER 8 HA SER 8 -4.394 -4.996 1.046
38 HB2 SER 8 2HB SER 8 -6.735 -4.114 0.746
39 HB3 SER 8 1HB SER 8 -6.669 -5.870 0.840
40 HG SER 8 HG SER 8 -7.119 -5.384 3.240
41 H VAL 9 H VAL 9 -3.794 -2.829 0.962
42 HA VAL 9 HA VAL 9 -4.092 -1.432 3.504
43 HB VAL 9 HB VAL 9 -1.787 -2.098 3.264
44 HG11 VAL 9 1HG1 VAL 9 -1.646 -2.489 0.937
45 HG12 VAL 9 2HG1 VAL 9 -0.392 -1.331 1.399
46 HG13 VAL 9 3HG1 VAL 9 -1.870 -0.776 0.594
47 HG21 VAL 9 3HG2 VAL 9 -2.087 0.837 2.648
48 HG22 VAL 9 1HG2 VAL 9 -0.639 0.074 3.307
49 HG23 VAL 9 2HG2 VAL 9 -2.136 0.088 4.243
50 H THR 10 H THR 10 -4.901 0.446 3.530
51 HA THR 10 HA THR 10 -5.366 1.912 1.041
52 HB THR 10 HB THR 10 -7.384 1.316 3.228
53 HG1 THR 10 1HG THR 10 -6.609 -0.080 1.149
54 HG21 THR 10 3HG2 THR 10 -7.698 2.778 0.590
55 HG22 THR 10 1HG2 THR 10 -7.695 3.531 2.186
56 HG23 THR 10 2HG2 THR 10 -8.993 2.425 1.736
57 H LEU 11 H LEU 11 -4.823 3.979 1.271
58 HA LEU 11 HA LEU 11 -4.134 4.819 3.954
59 HB2 LEU 11 2HB LEU 11 -2.919 6.686 2.905
60 HB3 LEU 11 1HB LEU 11 -2.343 5.138 2.348
61 HG LEU 11 HG LEU 11 -3.823 5.611 0.262
62 HD11 LEU 11 1HD1 LEU 11 -4.043 8.014 -0.266
63 HD12 LEU 11 2HD1 LEU 11 -3.566 8.389 1.389
64 HD13 LEU 11 3HD1 LEU 11 -5.060 7.506 1.084
65 HD21 LEU 11 3HD2 LEU 11 -1.989 6.842 -0.790
66 HD22 LEU 11 1HD2 LEU 11 -1.399 5.532 0.231
67 HD23 LEU 11 2HD2 LEU 11 -1.321 7.196 0.805
68 H GLN 12 H GLN 12 -4.894 6.763 4.788
69 HA GLN 12 HA GLN 12 -7.405 7.576 3.512
70 HB2 GLN 12 2HB GLN 12 -7.756 6.071 5.493
71 HB3 GLN 12 1HB GLN 12 -7.016 7.314 6.485
72 HG2 GLN 12 2HG GLN 12 -8.731 8.915 5.772
73 HG3 GLN 12 1HG GLN 12 -9.513 7.644 4.845
74 HE21 GLN 12 1HE2 GLN 12 -8.850 8.930 7.909
75 HE22 GLN 12 2HE2 GLN 12 -9.965 7.966 8.812
76 H LEU 13 H LEU 13 -7.588 9.640 3.279
77 HA LEU 13 HA LEU 13 -5.496 11.458 4.149
78 HB2 LEU 13 2HB LEU 13 -6.207 11.610 1.856
79 HB3 LEU 13 1HB LEU 13 -7.887 11.711 2.338
80 HG LEU 13 HG LEU 13 -7.379 13.863 3.427
81 HD11 LEU 13 1HD1 LEU 13 -5.365 15.095 2.749
82 HD12 LEU 13 2HD1 LEU 13 -4.734 13.621 2.009
83 HD13 LEU 13 3HD1 LEU 13 -5.025 13.689 3.753
84 HD21 LEU 13 3HD2 LEU 13 -6.921 13.682 0.456
85 HD22 LEU 13 1HD2 LEU 13 -7.325 15.163 1.334
86 HD23 LEU 13 2HD2 LEU 13 -8.464 13.821 1.310
87 H ASP 14 H ASP 14 -5.701 12.716 5.886
88 HA ASP 14 HA ASP 14 -8.283 12.695 7.194
89 HB2 ASP 14 2HB ASP 14 -6.270 12.226 8.560
90 HB3 ASP 14 1HB ASP 14 -5.594 13.778 8.076
91 H ASP 15 H ASP 15 -9.457 14.017 6.054
92 HA ASP 15 HA ASP 15 -8.691 16.726 6.221
93 HB2 ASP 15 2HB ASP 15 -7.812 16.139 4.028
94 HB3 ASP 15 1HB ASP 15 -9.370 15.487 3.541
95 H GLY 16 H GLY 16 -10.433 16.516 7.751
96 HA2 GLY 16 2HA GLY 16 -12.542 17.266 8.307
97 HA3 GLY 16 1HA GLY 16 -12.983 17.231 6.608
98 H SER 17 H SER 17 -13.009 14.882 5.736
99 HA SER 17 HA SER 17 -14.840 13.427 7.485
100 HB2 SER 17 2HB SER 17 -15.449 12.334 5.282
101 HB3 SER 17 1HB SER 17 -15.797 14.064 5.418
102 HG SER 17 HG SER 17 -14.722 13.376 3.440
103 H GLY 18 H GLY 18 -12.139 12.937 5.313
104 HA2 GLY 18 2HA GLY 18 -10.333 11.400 5.867
105 HA3 GLY 18 1HA GLY 18 -11.523 10.411 6.709
106 H ARG 19 H ARG 19 -10.184 11.262 3.658
107 HA ARG 19 HA ARG 19 -12.048 9.492 2.246
108 HB2 ARG 19 2HB ARG 19 -9.920 11.317 1.208
109 HB3 ARG 19 1HB ARG 19 -10.881 10.212 0.227
110 HG2 ARG 19 2HG ARG 19 -12.926 11.423 1.030
111 HG3 ARG 19 1HG ARG 19 -11.878 12.547 1.888
112 HD2 ARG 19 2HD ARG 19 -10.846 13.168 -0.255
113 HD3 ARG 19 1HD ARG 19 -11.975 12.097 -1.088
114 HE ARG 19 HE ARG 19 -12.528 14.636 0.192
115 HH11 ARG 19 1HH1 ARG 19 -13.894 11.780 -1.404
116 HH12 ARG 19 2HH1 ARG 19 -15.343 12.553 -1.857
117 HH21 ARG 19 1HH2 ARG 19 -14.532 15.700 -0.462
118 HH22 ARG 19 2HH2 ARG 19 -15.711 14.827 -1.316
119 H THR 20 H THR 20 -11.146 7.885 0.727
120 HA THR 20 HA THR 20 -8.640 6.893 1.829
121 HB THR 20 HB THR 20 -9.575 4.619 1.356
122 HG1 THR 20 1HG THR 20 -12.136 5.267 1.730
123 HG21 THR 20 3HG2 THR 20 -9.357 5.514 3.612
124 HG22 THR 20 1HG2 THR 20 -10.852 4.578 3.479
125 HG23 THR 20 2HG2 THR 20 -10.901 6.347 3.434
126 H TYR 21 H TYR 21 -7.282 5.894 0.538
127 HA TYR 21 HA TYR 21 -7.890 5.535 -2.307
128 HB2 TYR 21 2HB TYR 21 -6.574 7.639 -2.086
129 HB3 TYR 21 1HB TYR 21 -5.334 6.750 -1.213
130 HD1 TYR 21 2HD TYR 21 -7.038 6.932 -4.513
131 HD2 TYR 21 1HD TYR 21 -3.531 5.780 -2.402
132 HE1 TYR 21 2HE TYR 21 -5.903 6.506 -6.650
133 HE2 TYR 21 1HE TYR 21 -2.383 5.349 -4.545
134 HH TYR 21 HH TYR 21 -2.964 4.842 -6.876
135 H GLN 22 H GLN 22 -7.605 3.474 -2.740
136 HA GLN 22 HA GLN 22 -6.165 1.798 -0.884
137 HB2 GLN 22 2HB GLN 22 -8.360 1.092 -1.761
138 HB3 GLN 22 1HB GLN 22 -7.714 1.098 -3.392
139 HG2 GLN 22 2HG GLN 22 -6.211 -0.736 -2.809
140 HG3 GLN 22 1HG GLN 22 -6.812 -0.708 -1.152
141 HE21 GLN 22 1HE2 GLN 22 -7.510 -2.861 -1.315
142 HE22 GLN 22 2HE2 GLN 22 -8.919 -3.293 -2.193
143 H LEU 23 H LEU 23 -4.278 0.733 -1.310
144 HA LEU 23 HA LEU 23 -2.725 1.811 -3.492
145 HB2 LEU 23 2HB LEU 23 -2.068 -0.024 -1.215
146 HB3 LEU 23 1HB LEU 23 -0.887 0.467 -2.401
147 HG LEU 23 HG LEU 23 -2.339 2.311 -0.488
148 HD11 LEU 23 1HD1 LEU 23 0.484 1.282 -0.528
149 HD12 LEU 23 2HD1 LEU 23 -0.750 0.964 0.695
150 HD13 LEU 23 3HD1 LEU 23 -0.089 2.590 0.506
151 HD21 LEU 23 3HD2 LEU 23 -1.809 3.464 -2.574
152 HD22 LEU 23 1HD2 LEU 23 -0.144 2.882 -2.484
153 HD23 LEU 23 2HD2 LEU 23 -0.746 4.014 -1.281
154 H ARG 24 H ARG 24 -1.937 0.645 -5.185
155 HA ARG 24 HA ARG 24 -3.279 -1.917 -5.599
156 HB2 ARG 24 2HB ARG 24 -2.068 -0.015 -7.609
157 HB3 ARG 24 1HB ARG 24 -2.726 -1.591 -7.999
158 HG2 ARG 24 2HG ARG 24 -4.224 0.791 -6.944
159 HG3 ARG 24 1HG ARG 24 -4.319 0.097 -8.561
160 HD2 ARG 24 2HD ARG 24 -5.248 -1.151 -5.972
161 HD3 ARG 24 1HD ARG 24 -6.236 -0.593 -7.316
162 HE ARG 24 HE ARG 24 -4.361 -2.725 -7.968
163 HH11 ARG 24 1HH1 ARG 24 -7.693 -1.888 -7.084
164 HH12 ARG 24 2HH1 ARG 24 -8.285 -3.450 -7.422
165 HH21 ARG 24 1HH2 ARG 24 -5.180 -4.827 -8.370
166 HH22 ARG 24 2HH2 ARG 24 -6.866 -5.120 -8.220
167 H GLU 25 H GLU 25 -2.071 -3.424 -6.939
168 HA GLU 25 HA GLU 25 0.361 -4.036 -5.632
169 HB2 GLU 25 2HB GLU 25 0.370 -6.047 -7.135
170 HB3 GLU 25 1HB GLU 25 -1.081 -5.878 -6.182
171 HG2 GLU 25 2HG GLU 25 -0.878 -5.092 -9.097
172 HG3 GLU 25 1HG GLU 25 -1.458 -6.656 -8.537
173 H GLY 26 H GLY 26 2.203 -3.173 -6.070
174 HA2 GLY 26 2HA GLY 26 3.902 -3.054 -7.921
175 HA3 GLY 26 1HA GLY 26 2.678 -2.070 -8.735
176 H SER 27 H SER 27 4.718 -0.581 -8.499
177 HA SER 27 HA SER 27 4.460 0.730 -5.906
178 HB2 SER 27 2HB SER 27 6.640 1.813 -6.390
179 HB3 SER 27 1HB SER 27 6.728 0.053 -6.339
180 HG SER 27 HG SER 27 6.191 0.808 -8.839
181 H ASN 28 H ASN 28 4.105 2.925 -5.775
182 HA ASN 28 HA ASN 28 3.393 4.238 -8.289
183 HB2 ASN 28 2HB ASN 28 1.614 5.498 -7.063
184 HB3 ASN 28 1HB ASN 28 1.290 3.774 -7.152
185 HD21 ASN 28 1HD2 ASN 28 1.224 2.593 -5.269
186 HD22 ASN 28 2HD2 ASN 28 1.267 3.318 -3.705
187 H ILE 29 H ILE 29 4.165 6.203 -8.592
188 HA ILE 29 HA ILE 29 6.007 7.260 -6.564
189 HB ILE 29 HB ILE 29 5.659 8.100 -9.461
190 HG12 ILE 29 2HG1 ILE 29 6.511 5.795 -9.354
191 HG13 ILE 29 1HG1 ILE 29 7.742 6.897 -9.951
192 HG21 ILE 29 1HG2 ILE 29 7.808 9.248 -9.192
193 HG22 ILE 29 2HG2 ILE 29 7.836 8.779 -7.493
194 HG23 ILE 29 3HG2 ILE 29 6.583 9.873 -8.083
195 HD11 ILE 29 3HD1 ILE 29 8.801 6.883 -7.742
196 HD12 ILE 29 1HD1 ILE 29 8.686 5.267 -8.439
197 HD13 ILE 29 2HD1 ILE 29 7.565 5.760 -7.171
198 H ILE 30 H ILE 30 5.286 8.886 -5.344
199 HA ILE 30 HA ILE 30 2.945 10.385 -6.214
200 HB ILE 30 HB ILE 30 4.129 10.082 -3.428
201 HG12 ILE 30 2HG1 ILE 30 1.646 8.839 -4.661
202 HG13 ILE 30 1HG1 ILE 30 3.127 8.002 -4.239
203 HG21 ILE 30 1HG2 ILE 30 2.056 11.153 -2.650
204 HG22 ILE 30 2HG2 ILE 30 1.646 11.520 -4.333
205 HG23 ILE 30 3HG2 ILE 30 3.087 12.211 -3.606
206 HD11 ILE 30 3HD1 ILE 30 1.374 7.619 -2.599
207 HD12 ILE 30 1HD1 ILE 30 1.278 9.352 -2.290
208 HD13 ILE 30 2HD1 ILE 30 2.749 8.464 -1.887
209 H GLY 31 H GLY 31 3.164 12.415 -6.771
210 HA2 GLY 31 2HA GLY 31 4.450 14.451 -5.570
211 HA3 GLY 31 1HA GLY 31 5.679 13.780 -6.656
212 H ARG 32 H ARG 32 5.159 16.172 -7.416
213 HA ARG 32 HA ARG 32 3.102 15.771 -9.433
214 HB2 ARG 32 2HB ARG 32 3.930 18.407 -8.220
215 HB3 ARG 32 1HB ARG 32 2.967 18.277 -9.683
216 HG2 ARG 32 2HG ARG 32 1.468 16.735 -8.161
217 HG3 ARG 32 1HG ARG 32 2.246 17.645 -6.879
218 HD2 ARG 32 2HD ARG 32 0.850 18.958 -9.208
219 HD3 ARG 32 1HD ARG 32 0.058 18.592 -7.686
220 HE ARG 32 HE ARG 32 1.386 20.201 -6.621
221 HH11 ARG 32 1HH1 ARG 32 1.943 20.148 -10.123
222 HH12 ARG 32 2HH1 ARG 32 2.390 21.777 -10.224
223 HH21 ARG 32 1HH2 ARG 32 1.984 22.498 -6.789
224 HH22 ARG 32 2HH2 ARG 32 2.375 23.154 -8.297
225 H GLY 33 H GLY 33 3.909 15.103 -11.126
226 HA2 GLY 33 2HA GLY 33 5.381 16.653 -12.841
227 HA3 GLY 33 1HA GLY 33 6.469 15.480 -12.075
228 H GLN 34 H GLN 34 6.056 15.116 -14.716
229 HA GLN 34 HA GLN 34 3.887 13.204 -15.036
230 HB2 GLN 34 2HB GLN 34 4.634 13.008 -17.355
231 HB3 GLN 34 1HB GLN 34 4.465 14.698 -16.914
232 HG2 GLN 34 2HG GLN 34 6.878 14.866 -16.615
233 HG3 GLN 34 1HG GLN 34 7.043 13.163 -17.042
234 HE21 GLN 34 1HE2 GLN 34 8.324 13.603 -18.778
235 HE22 GLN 34 2HE2 GLN 34 7.700 14.316 -20.232
236 H ASP 35 H ASP 35 7.074 13.336 -14.126
237 HA ASP 35 HA ASP 35 7.859 10.623 -14.591
238 HB2 ASP 35 2HB ASP 35 9.531 12.355 -14.416
239 HB3 ASP 35 1HB ASP 35 8.918 12.858 -12.855
240 H ALA 36 H ALA 36 5.815 12.174 -12.481
241 HA ALA 36 HA ALA 36 5.910 10.095 -10.439
242 HB1 ALA 36 1HB ALA 36 4.359 11.550 -9.207
243 HB2 ALA 36 2HB ALA 36 4.359 12.686 -10.556
244 HB3 ALA 36 3HB ALA 36 5.838 12.408 -9.635
245 H GLN 37 H GLN 37 3.820 9.125 -9.850
246 HA GLN 37 HA GLN 37 2.219 8.670 -12.251
247 HB2 GLN 37 2HB GLN 37 2.757 6.961 -9.832
248 HB3 GLN 37 1HB GLN 37 1.680 6.522 -11.146
249 HG2 GLN 37 2HG GLN 37 3.492 6.475 -12.713
250 HG3 GLN 37 1HG GLN 37 4.596 7.147 -11.519
251 HE21 GLN 37 1HE2 GLN 37 5.992 5.467 -11.714
252 HE22 GLN 37 2HE2 GLN 37 5.679 3.881 -11.108
253 H PHE 38 H PHE 38 2.101 9.280 -8.787
254 HA PHE 38 HA PHE 38 -0.732 9.948 -9.056
255 HB2 PHE 38 2HB PHE 38 -0.427 8.056 -7.534
256 HB3 PHE 38 1HB PHE 38 0.815 8.930 -6.656
257 HD1 PHE 38 2HD PHE 38 -2.812 9.021 -7.495
258 HD2 PHE 38 1HD PHE 38 0.243 10.233 -4.808
259 HE1 PHE 38 2HE PHE 38 -4.516 9.863 -5.928
260 HE2 PHE 38 1HE PHE 38 -1.397 11.059 -3.258
261 HZ PHE 38 HZ PHE 38 -3.821 10.891 -3.797
262 H ARG 39 H ARG 39 -1.000 12.040 -9.054
263 HA ARG 39 HA ARG 39 1.125 13.694 -7.960
264 HB2 ARG 39 2HB ARG 39 -1.134 14.360 -9.851
265 HB3 ARG 39 1HB ARG 39 -0.004 15.547 -9.225
266 HG2 ARG 39 2HG ARG 39 1.843 14.271 -10.298
267 HG3 ARG 39 1HG ARG 39 0.640 13.188 -10.988
268 HD2 ARG 39 2HD ARG 39 0.700 16.171 -11.450
269 HD3 ARG 39 1HD ARG 39 1.413 14.987 -12.540
270 HE ARG 39 HE ARG 39 -0.967 14.060 -12.604
271 HH11 ARG 39 1HH1 ARG 39 -0.295 17.539 -12.260
272 HH12 ARG 39 2HH1 ARG 39 -1.650 18.026 -13.159
273 HH21 ARG 39 1HH2 ARG 39 -2.824 14.764 -13.846
274 HH22 ARG 39 2HH2 ARG 39 -3.112 16.413 -14.084
275 H LEU 40 H LEU 40 0.874 14.608 -6.061
276 HA LEU 40 HA LEU 40 -1.622 14.624 -4.704
277 HB2 LEU 40 2HB LEU 40 0.947 16.103 -4.163
278 HB3 LEU 40 1HB LEU 40 -0.459 16.227 -3.134
279 HG LEU 40 HG LEU 40 1.169 13.736 -3.624
280 HD11 LEU 40 1HD1 LEU 40 1.781 14.043 -1.279
281 HD12 LEU 40 2HD1 LEU 40 0.852 15.549 -1.255
282 HD13 LEU 40 3HD1 LEU 40 2.291 15.415 -2.271
283 HD21 LEU 40 3HD2 LEU 40 -1.196 13.205 -3.239
284 HD22 LEU 40 1HD2 LEU 40 -1.188 14.220 -1.796
285 HD23 LEU 40 2HD2 LEU 40 -0.209 12.759 -1.848
286 HA PRO 41 HA PRO 41 -2.919 18.277 -6.807
287 HB2 PRO 41 2HB PRO 41 -5.263 18.671 -5.505
288 HB3 PRO 41 1HB PRO 41 -5.030 17.384 -6.690
289 HG2 PRO 41 2HG PRO 41 -5.240 17.222 -3.753
290 HG3 PRO 41 1HG PRO 41 -5.573 15.983 -4.970
291 HD2 PRO 41 2HD PRO 41 -3.240 16.260 -3.355
292 HD3 PRO 41 1HD PRO 41 -3.495 15.078 -4.636
293 H ASP 42 H ASP 42 -1.054 18.683 -4.626
294 HA ASP 42 HA ASP 42 -2.105 21.211 -3.535
295 HB2 ASP 42 2HB ASP 42 -1.809 19.120 -1.895
296 HB3 ASP 42 1HB ASP 42 -0.132 19.678 -1.937
297 H THR 43 H THR 43 0.073 22.198 -2.324
298 HA THR 43 HA THR 43 1.872 22.678 -4.577
299 HB THR 43 HB THR 43 1.069 24.510 -2.300
300 HG1 THR 43 1HG THR 43 -0.708 24.200 -3.533
301 HG21 THR 43 3HG2 THR 43 1.995 26.287 -3.692
302 HG22 THR 43 1HG2 THR 43 2.419 25.107 -4.935
303 HG23 THR 43 2HG2 THR 43 3.225 25.061 -3.366
304 H GLY 44 H GLY 44 4.136 22.891 -4.046
305 HA2 GLY 44 2HA GLY 44 5.984 23.010 -2.581
306 HA3 GLY 44 1HA GLY 44 4.960 22.419 -1.276
307 H VAL 45 H VAL 45 4.238 20.622 -3.835
308 HA VAL 45 HA VAL 45 5.872 18.412 -2.879
309 HB VAL 45 HB VAL 45 3.641 18.295 -4.934
310 HG11 VAL 45 1HG1 VAL 45 5.082 16.396 -4.947
311 HG12 VAL 45 2HG1 VAL 45 3.482 15.975 -4.327
312 HG13 VAL 45 3HG1 VAL 45 4.837 16.166 -3.215
313 HG21 VAL 45 3HG2 VAL 45 2.760 19.261 -2.870
314 HG22 VAL 45 1HG2 VAL 45 3.443 17.912 -1.958
315 HG23 VAL 45 2HG2 VAL 45 2.148 17.620 -3.125
316 H SER 46 H SER 46 7.548 17.719 -3.988
317 HA SER 46 HA SER 46 8.354 19.011 -6.430
318 HB2 SER 46 2HB SER 46 9.600 16.722 -4.893
319 HB3 SER 46 1HB SER 46 10.385 17.668 -6.157
320 HG SER 46 HG SER 46 9.445 19.403 -4.411
321 H ARG 47 H ARG 47 9.336 17.365 -8.212
322 HA ARG 47 HA ARG 47 7.187 15.961 -9.334
323 HB2 ARG 47 2HB ARG 47 9.044 14.793 -10.789
324 HB3 ARG 47 1HB ARG 47 8.705 16.502 -10.997
325 HG2 ARG 47 2HG ARG 47 10.621 17.118 -9.774
326 HG3 ARG 47 1HG ARG 47 10.862 15.453 -9.229
327 HD2 ARG 47 2HD ARG 47 10.955 16.225 -12.125
328 HD3 ARG 47 1HD ARG 47 12.384 16.321 -11.093
329 HE ARG 47 HE ARG 47 10.877 13.821 -11.550
330 HH11 ARG 47 1HH1 ARG 47 13.998 15.533 -11.369
331 HH12 ARG 47 2HH1 ARG 47 14.913 14.101 -11.386
332 HH21 ARG 47 1HH2 ARG 47 12.121 11.936 -11.584
333 HH22 ARG 47 2HH2 ARG 47 13.830 11.970 -11.482
334 H ARG 48 H ARG 48 10.016 14.581 -7.665
335 HA ARG 48 HA ARG 48 8.212 12.389 -7.021
336 HB2 ARG 48 2HB ARG 48 11.239 12.401 -7.138
337 HB3 ARG 48 1HB ARG 48 10.295 11.102 -6.427
338 HG2 ARG 48 2HG ARG 48 9.172 10.831 -8.628
339 HG3 ARG 48 1HG ARG 48 10.328 11.972 -9.305
340 HD2 ARG 48 2HD ARG 48 12.165 10.475 -8.603
341 HD3 ARG 48 1HD ARG 48 10.968 9.334 -7.977
342 HE ARG 48 HE ARG 48 10.774 10.173 -10.739
343 HH11 ARG 48 1HH1 ARG 48 11.578 7.541 -8.490
344 HH12 ARG 48 2HH1 ARG 48 11.624 6.343 -9.696
345 HH21 ARG 48 1HH2 ARG 48 10.804 8.574 -12.353
346 HH22 ARG 48 2HH2 ARG 48 11.154 6.936 -12.006
347 H HIS 49 H HIS 49 7.429 12.619 -5.128
348 HA HIS 49 HA HIS 49 9.008 14.090 -3.164
349 HB2 HIS 49 2HB HIS 49 6.882 15.128 -3.645
350 HB3 HIS 49 1HB HIS 49 5.969 13.679 -3.341
351 HD2 HIS 49 2HD HIS 49 6.168 12.918 -0.461
352 HE1 HIS 49 1HE HIS 49 6.599 16.984 0.598
353 HE2 HIS 49 2HE HIS 49 6.513 14.586 1.441
354 H LEU 50 H LEU 50 7.098 11.181 -3.733
355 HA LEU 50 HA LEU 50 8.587 9.697 -1.830
356 HB2 LEU 50 2HB LEU 50 7.185 10.923 -0.304
357 HB3 LEU 50 1HB LEU 50 5.765 10.621 -1.259
358 HG LEU 50 HG LEU 50 7.146 8.313 0.092
359 HD11 LEU 50 1HD1 LEU 50 6.908 10.102 1.776
360 HD12 LEU 50 2HD1 LEU 50 5.792 8.774 2.080
361 HD13 LEU 50 3HD1 LEU 50 5.207 10.267 1.346
362 HD21 LEU 50 3HD2 LEU 50 4.263 9.000 -0.481
363 HD22 LEU 50 1HD2 LEU 50 4.849 7.481 0.195
364 HD23 LEU 50 2HD2 LEU 50 5.262 7.928 -1.463
365 H GLU 51 H GLU 51 7.883 7.408 -1.936
366 HA GLU 51 HA GLU 51 5.980 6.801 -4.044
367 HB2 GLU 51 2HB GLU 51 7.456 5.044 -4.931
368 HB3 GLU 51 1HB GLU 51 8.130 6.646 -5.170
369 HG2 GLU 51 2HG GLU 51 9.663 6.312 -3.345
370 HG3 GLU 51 1HG GLU 51 8.901 4.769 -2.959
371 H ILE 52 H ILE 52 5.037 4.807 -3.818
372 HA ILE 52 HA ILE 52 5.574 3.432 -1.285
373 HB ILE 52 HB ILE 52 2.866 3.801 -2.610
374 HG12 ILE 52 2HG1 ILE 52 3.916 4.883 0.023
375 HG13 ILE 52 1HG1 ILE 52 3.685 5.828 -1.442
376 HG21 ILE 52 1HG2 ILE 52 1.988 2.639 -0.623
377 HG22 ILE 52 2HG2 ILE 52 3.645 2.347 -0.078
378 HG23 ILE 52 3HG2 ILE 52 3.070 1.617 -1.577
379 HD11 ILE 52 3HD1 ILE 52 1.879 6.190 0.142
380 HD12 ILE 52 1HD1 ILE 52 1.519 4.462 0.145
381 HD13 ILE 52 2HD1 ILE 52 1.279 5.410 -1.322
382 H ARG 53 H ARG 53 6.218 1.455 -1.605
383 HA ARG 53 HA ARG 53 5.590 0.186 -4.178
384 HB2 ARG 53 2HB ARG 53 7.815 -0.513 -2.249
385 HB3 ARG 53 1HB ARG 53 7.495 -1.308 -3.776
386 HG2 ARG 53 2HG ARG 53 7.913 0.873 -4.910
387 HG3 ARG 53 1HG ARG 53 8.404 1.517 -3.347
388 HD2 ARG 53 2HD ARG 53 10.170 -0.116 -3.184
389 HD3 ARG 53 1HD ARG 53 9.638 -0.872 -4.687
390 HE ARG 53 HE ARG 53 10.377 1.941 -4.739
391 HH11 ARG 53 1HH1 ARG 53 11.268 -1.387 -5.515
392 HH12 ARG 53 2HH1 ARG 53 12.442 -0.952 -6.653
393 HH21 ARG 53 1HH2 ARG 53 11.952 2.538 -6.264
394 HH22 ARG 53 2HH2 ARG 53 12.832 1.352 -7.128
395 H TRP 54 H TRP 54 3.872 -1.046 -4.003
396 HA TRP 54 HA TRP 54 3.541 -2.500 -1.524
397 HB2 TRP 54 2HB TRP 54 1.716 -0.978 -1.859
398 HB3 TRP 54 1HB TRP 54 1.506 -1.495 -3.522
399 HD1 TRP 54 HD TRP 54 -0.630 -2.872 -3.770
400 HE1 TRP 54 1HE TRP 54 -1.948 -4.560 -2.334
401 HE3 TRP 54 3HE TRP 54 2.335 -2.946 0.375
402 HZ2 TRP 54 2HZ TRP 54 -1.757 -5.773 0.191
403 HZ3 TRP 54 3HZ TRP 54 1.704 -4.396 2.247
404 HH2 TRP 54 HH TRP 54 -0.298 -5.778 2.156
405 H ASP 55 H ASP 55 3.410 -4.635 -1.550
406 HA ASP 55 HA ASP 55 3.010 -6.122 -4.008
407 HB2 ASP 55 2HB ASP 55 5.569 -5.862 -3.460
408 HB3 ASP 55 1HB ASP 55 5.223 -6.877 -2.065
409 H GLY 56 H GLY 56 3.003 -8.630 -2.923
410 HA2 GLY 56 2HA GLY 56 0.703 -8.345 -1.165
411 HA3 GLY 56 1HA GLY 56 1.262 -9.829 -1.913
412 H GLN 57 H GLN 57 2.979 -7.572 0.158
413 HA GLN 57 HA GLN 57 3.015 -9.516 2.296
414 HB2 GLN 57 2HB GLN 57 5.014 -10.108 1.037
415 HB3 GLN 57 1HB GLN 57 5.557 -8.442 1.039
416 HG2 GLN 57 2HG GLN 57 6.796 -9.783 2.644
417 HG3 GLN 57 1HG GLN 57 5.860 -8.528 3.452
418 HE21 GLN 57 1HE2 GLN 57 6.251 -11.911 2.922
419 HE22 GLN 57 2HE2 GLN 57 5.160 -12.428 4.156
420 H VAL 58 H VAL 58 4.915 -6.546 1.667
421 HA VAL 58 HA VAL 58 3.441 -5.248 3.830
422 HB VAL 58 HB VAL 58 5.572 -4.245 4.702
423 HG11 VAL 58 1HG1 VAL 58 5.384 -7.250 4.886
424 HG12 VAL 58 2HG1 VAL 58 4.564 -6.077 5.909
425 HG13 VAL 58 3HG1 VAL 58 6.318 -6.220 5.967
426 HG21 VAL 58 3HG2 VAL 58 6.901 -6.338 2.972
427 HG22 VAL 58 1HG2 VAL 58 7.714 -5.348 4.185
428 HG23 VAL 58 2HG2 VAL 58 7.004 -4.590 2.758
429 H ALA 59 H ALA 59 3.687 -2.922 3.833
430 HA ALA 59 HA ALA 59 3.944 -1.948 1.092
431 HB1 ALA 59 1HB ALA 59 1.799 -1.540 2.187
432 HB2 ALA 59 2HB ALA 59 2.635 -0.025 1.840
433 HB3 ALA 59 3HB ALA 59 2.624 -0.678 3.482
434 H LEU 60 H LEU 60 5.753 -1.103 0.569
435 HA LEU 60 HA LEU 60 7.555 -0.085 2.589
436 HB2 LEU 60 2HB LEU 60 8.300 -1.710 0.876
437 HB3 LEU 60 1HB LEU 60 7.872 -0.572 -0.370
438 HG LEU 60 HG LEU 60 10.089 -0.069 1.644
439 HD11 LEU 60 1HD1 LEU 60 11.616 -0.792 -0.135
440 HD12 LEU 60 2HD1 LEU 60 10.225 -1.251 -1.127
441 HD13 LEU 60 3HD1 LEU 60 10.550 -2.098 0.382
442 HD21 LEU 60 3HD2 LEU 60 9.243 1.929 0.461
443 HD22 LEU 60 1HD2 LEU 60 9.523 1.120 -1.080
444 HD23 LEU 60 2HD2 LEU 60 10.890 1.526 -0.037
445 H LEU 61 H LEU 61 7.748 1.973 2.976
446 HA LEU 61 HA LEU 61 6.532 3.958 1.201
447 HB2 LEU 61 2HB LEU 61 5.558 3.637 3.421
448 HB3 LEU 61 1HB LEU 61 7.077 3.903 4.201
449 HG LEU 61 HG LEU 61 5.541 5.786 4.480
450 HD11 LEU 61 1HD1 LEU 61 7.865 6.403 4.434
451 HD12 LEU 61 2HD1 LEU 61 6.866 7.672 3.727
452 HD13 LEU 61 3HD1 LEU 61 7.801 6.601 2.683
453 HD21 LEU 61 3HD2 LEU 61 4.742 7.110 2.622
454 HD22 LEU 61 1HD2 LEU 61 4.218 5.437 2.476
455 HD23 LEU 61 2HD2 LEU 61 5.554 6.027 1.486
456 H ALA 62 H ALA 62 8.041 5.211 0.153
457 HA ALA 62 HA ALA 62 10.584 5.651 1.522
458 HB1 ALA 62 1HB ALA 62 10.308 5.037 -1.417
459 HB2 ALA 62 2HB ALA 62 10.908 3.921 -0.192
460 HB3 ALA 62 3HB ALA 62 11.808 5.393 -0.559
461 H ASP 63 H ASP 63 11.045 7.657 1.699
462 HA ASP 63 HA ASP 63 9.536 9.717 0.277
463 HB2 ASP 63 2HB ASP 63 9.733 10.009 2.686
464 HB3 ASP 63 1HB ASP 63 11.463 9.760 2.604
465 H LEU 64 H LEU 64 10.323 10.402 -1.590
466 HA LEU 64 HA LEU 64 13.217 10.113 -2.192
467 HB2 LEU 64 2HB LEU 64 11.004 10.855 -4.102
468 HB3 LEU 64 1HB LEU 64 12.591 10.240 -4.499
469 HG LEU 64 HG LEU 64 10.299 8.690 -3.318
470 HD11 LEU 64 1HD1 LEU 64 9.931 9.245 -5.619
471 HD12 LEU 64 2HD1 LEU 64 10.332 7.532 -5.482
472 HD13 LEU 64 3HD1 LEU 64 11.546 8.679 -6.045
473 HD21 LEU 64 3HD2 LEU 64 13.037 7.752 -4.168
474 HD22 LEU 64 1HD2 LEU 64 11.711 6.711 -3.656
475 HD23 LEU 64 2HD2 LEU 64 12.441 7.835 -2.509
476 H ASN 65 H ASN 65 13.566 12.057 -0.831
477 HA ASN 65 HA ASN 65 13.050 14.566 -2.066
478 HB2 ASN 65 2HB ASN 65 10.793 14.003 -1.599
479 HB3 ASN 65 1HB ASN 65 11.196 13.436 -0.004
480 HD21 ASN 65 1HD2 ASN 65 9.619 14.511 0.709
481 HD22 ASN 65 2HD2 ASN 65 9.559 16.201 1.005
482 H SER 66 H SER 66 14.244 16.052 -1.055
483 HA SER 66 HA SER 66 15.652 15.227 1.377
484 HB2 SER 66 2HB SER 66 16.452 17.345 -0.628
485 HB3 SER 66 1HB SER 66 17.454 16.628 0.636
486 HG SER 66 HG SER 66 17.263 14.642 -0.426
487 H THR 67 H THR 67 14.302 18.085 -0.270
488 HA THR 67 HA THR 67 14.654 19.900 1.810
489 HB THR 67 HB THR 67 12.598 20.104 -0.371
490 HG1 THR 67 1HG THR 67 15.347 20.766 -0.691
491 HG21 THR 67 3HG2 THR 67 12.719 21.947 1.246
492 HG22 THR 67 1HG2 THR 67 13.315 22.471 -0.331
493 HG23 THR 67 2HG2 THR 67 14.452 22.093 0.967
494 H ASN 68 H ASN 68 11.785 18.058 0.807
495 HA ASN 68 HA ASN 68 10.221 19.352 2.952
496 HB2 ASN 68 2HB ASN 68 9.150 17.866 0.531
497 HB3 ASN 68 1HB ASN 68 8.237 18.843 1.665
498 HD21 ASN 68 1HD2 ASN 68 10.226 18.788 -1.120
499 HD22 ASN 68 2HD2 ASN 68 10.070 20.457 -1.533
500 H GLY 69 H GLY 69 12.018 17.121 3.401
501 HA2 GLY 69 2HA GLY 69 11.197 14.552 3.042
502 HA3 GLY 69 1HA GLY 69 12.081 15.072 4.459
503 H THR 70 H THR 70 9.616 13.372 3.493
504 HA THR 70 HA THR 70 7.355 14.137 4.974
505 HB THR 70 HB THR 70 8.166 11.496 3.768
506 HG1 THR 70 1HG THR 70 8.205 12.769 2.133
507 HG21 THR 70 3HG2 THR 70 6.211 11.295 5.244
508 HG22 THR 70 1HG2 THR 70 5.745 11.093 3.555
509 HG23 THR 70 2HG2 THR 70 5.425 12.618 4.390
510 H THR 71 H THR 71 6.454 13.180 6.875
511 HA THR 71 HA THR 71 8.375 11.749 8.545
512 HB THR 71 HB THR 71 7.007 12.581 10.454
513 HG1 THR 71 1HG THR 71 5.965 14.720 9.347
514 HG21 THR 71 3HG2 THR 71 9.068 13.613 9.872
515 HG22 THR 71 1HG2 THR 71 7.898 14.840 10.379
516 HG23 THR 71 2HG2 THR 71 8.259 14.616 8.649
517 H VAL 72 H VAL 72 7.747 10.000 9.655
518 HA VAL 72 HA VAL 72 5.078 8.972 9.114
519 HB VAL 72 HB VAL 72 6.005 6.701 9.386
520 HG11 VAL 72 1HG1 VAL 72 7.502 8.337 7.341
521 HG12 VAL 72 2HG1 VAL 72 5.896 7.652 7.126
522 HG13 VAL 72 3HG1 VAL 72 7.299 6.588 7.282
523 HG21 VAL 72 3HG2 VAL 72 8.466 6.355 9.406
524 HG22 VAL 72 1HG2 VAL 72 7.878 7.178 10.855
525 HG23 VAL 72 2HG2 VAL 72 8.668 8.103 9.588
526 H ASN 73 H ASN 73 3.868 9.011 10.811
527 HA ASN 73 HA ASN 73 3.126 9.214 12.900
528 HB2 ASN 73 2HB ASN 73 5.511 7.431 13.445
529 HB3 ASN 73 1HB ASN 73 4.330 7.839 14.690
530 HD21 ASN 73 1HD2 ASN 73 5.036 5.284 13.353
531 HD22 ASN 73 2HD2 ASN 73 3.550 4.654 12.738
532 H ASN 74 H ASN 74 4.789 11.211 11.836
533 HA ASN 74 HA ASN 74 5.372 13.294 12.401
534 HB2 ASN 74 2HB ASN 74 4.014 13.017 14.510
535 HB3 ASN 74 1HB ASN 74 5.470 12.473 15.324
536 HD21 ASN 74 1HD2 ASN 74 5.368 14.159 16.799
537 HD22 ASN 74 2HD2 ASN 74 5.740 15.783 16.387
538 H ALA 75 H ALA 75 7.236 10.627 12.688
539 HA ALA 75 HA ALA 75 9.663 12.141 13.342
540 HB1 ALA 75 1HB ALA 75 10.741 9.951 13.611
541 HB2 ALA 75 2HB ALA 75 9.244 9.158 13.124
542 HB3 ALA 75 3HB ALA 75 9.303 10.077 14.629
543 HA PRO 76 HA PRO 76 10.442 12.072 8.931
544 HB2 PRO 76 2HB PRO 76 12.806 13.333 8.917
545 HB3 PRO 76 1HB PRO 76 11.309 14.191 9.296
546 HG2 PRO 76 2HG PRO 76 13.407 13.137 11.152
547 HG3 PRO 76 1HG PRO 76 12.546 14.682 11.214
548 HD2 PRO 76 2HD PRO 76 11.885 12.503 12.747
549 HD3 PRO 76 1HD PRO 76 10.727 13.758 12.270
550 H VAL 77 H VAL 77 11.077 10.441 7.746
551 HA VAL 77 HA VAL 77 13.678 9.180 8.132
552 HB VAL 77 HB VAL 77 12.728 6.920 7.850
553 HG11 VAL 77 1HG1 VAL 77 11.688 6.573 10.034
554 HG12 VAL 77 2HG1 VAL 77 11.483 8.314 10.208
555 HG13 VAL 77 3HG1 VAL 77 13.104 7.619 10.136
556 HG21 VAL 77 3HG2 VAL 77 10.070 8.312 7.976
557 HG22 VAL 77 1HG2 VAL 77 10.281 6.561 8.087
558 HG23 VAL 77 2HG2 VAL 77 10.748 7.416 6.616
559 H GLN 78 H GLN 78 13.989 7.670 6.101
560 HA GLN 78 HA GLN 78 12.478 8.864 3.944
561 HB2 GLN 78 2HB GLN 78 15.354 8.016 3.797
562 HB3 GLN 78 1HB GLN 78 14.384 8.458 2.401
563 HG2 GLN 78 2HG GLN 78 13.909 10.621 3.628
564 HG3 GLN 78 1HG GLN 78 15.248 10.175 4.679
565 HE21 GLN 78 1HE2 GLN 78 14.315 11.128 1.524
566 HE22 GLN 78 2HE2 GLN 78 15.893 11.459 0.910
567 H GLU 79 H GLU 79 13.295 5.914 5.409
568 HA GLU 79 HA GLU 79 11.473 4.742 3.513
569 HB2 GLU 79 2HB GLU 79 12.745 2.613 3.430
570 HB3 GLU 79 1HB GLU 79 13.582 3.945 2.658
571 HG2 GLU 79 2HG GLU 79 15.090 4.134 4.519
572 HG3 GLU 79 1HG GLU 79 14.170 2.933 5.428
573 H TRP 80 H TRP 80 9.982 3.533 4.372
574 HA TRP 80 HA TRP 80 10.206 2.622 7.130
575 HB2 TRP 80 2HB TRP 80 9.427 4.889 7.344
576 HB3 TRP 80 1HB TRP 80 8.147 4.682 6.177
577 HD1 TRP 80 HD TRP 80 5.885 3.678 7.076
578 HE1 TRP 80 1HE TRP 80 4.987 3.237 9.472
579 HE3 TRP 80 3HE TRP 80 10.270 4.051 9.651
580 HZ2 TRP 80 2HZ TRP 80 6.019 3.104 12.059
581 HZ3 TRP 80 3HZ TRP 80 10.221 3.758 12.085
582 HH2 TRP 80 HH TRP 80 8.116 3.298 13.252
583 H GLN 81 H GLN 81 8.666 1.015 7.567
584 HA GLN 81 HA GLN 81 7.150 0.168 5.229
585 HB2 GLN 81 2HB GLN 81 6.959 -2.078 6.354
586 HB3 GLN 81 1HB GLN 81 8.584 -1.641 5.862
587 HG2 GLN 81 2HG GLN 81 9.174 -1.114 8.128
588 HG3 GLN 81 1HG GLN 81 7.515 -1.398 8.662
589 HE21 GLN 81 1HE2 GLN 81 10.430 -2.879 7.509
590 HE22 GLN 81 2HE2 GLN 81 10.006 -4.488 7.952
591 H LEU 82 H LEU 82 5.198 0.680 5.231
592 HA LEU 82 HA LEU 82 3.885 2.075 7.257
593 HB2 LEU 82 2HB LEU 82 2.630 0.570 4.980
594 HB3 LEU 82 1HB LEU 82 1.905 1.835 5.945
595 HG LEU 82 HG LEU 82 4.271 2.221 4.134
596 HD11 LEU 82 1HD1 LEU 82 2.708 3.467 2.704
597 HD12 LEU 82 2HD1 LEU 82 1.372 2.981 3.753
598 HD13 LEU 82 3HD1 LEU 82 2.264 1.767 2.842
599 HD21 LEU 82 3HD2 LEU 82 4.333 3.772 5.947
600 HD22 LEU 82 1HD2 LEU 82 2.621 4.141 5.765
601 HD23 LEU 82 2HD2 LEU 82 3.756 4.621 4.516
602 H ALA 83 H ALA 83 2.233 1.576 8.641
603 HA ALA 83 HA ALA 83 1.386 -1.189 8.888
604 HB1 ALA 83 1HB ALA 83 3.201 -0.844 10.503
605 HB2 ALA 83 2HB ALA 83 1.645 -1.046 11.309
606 HB3 ALA 83 3HB ALA 83 2.343 0.559 11.136
607 H ASP 84 H ASP 84 -0.533 -1.261 10.376
608 HA ASP 84 HA ASP 84 -2.453 0.648 9.491
609 HB2 ASP 84 2HB ASP 84 -3.008 -1.729 9.899
610 HB3 ASP 84 1HB ASP 84 -2.720 -1.487 11.612
611 H GLY 85 H GLY 85 -2.672 2.561 10.289
612 HA2 GLY 85 2HA GLY 85 -3.363 3.978 12.078
613 HA3 GLY 85 1HA GLY 85 -2.495 2.932 13.195
614 H ASP 86 H ASP 86 -0.754 3.571 10.331
615 HA ASP 86 HA ASP 86 0.971 5.346 11.840
616 HB2 ASP 86 2HB ASP 86 1.341 3.930 9.212
617 HB3 ASP 86 1HB ASP 86 2.404 5.247 9.694
618 H VAL 87 H VAL 87 1.320 7.374 11.471
619 HA VAL 87 HA VAL 87 -0.500 8.701 9.578
620 HB VAL 87 HB VAL 87 1.051 9.913 11.885
621 HG11 VAL 87 1HG1 VAL 87 -0.373 11.872 11.552
622 HG12 VAL 87 2HG1 VAL 87 -1.117 11.086 10.159
623 HG13 VAL 87 3HG1 VAL 87 0.592 11.518 10.116
624 HG21 VAL 87 3HG2 VAL 87 -1.870 9.192 11.699
625 HG22 VAL 87 1HG2 VAL 87 -1.108 10.066 13.030
626 HG23 VAL 87 2HG2 VAL 87 -0.658 8.391 12.695
627 H ILE 88 H ILE 88 0.401 9.189 7.733
628 HA ILE 88 HA ILE 88 3.255 9.784 7.742
629 HB ILE 88 HB ILE 88 1.480 8.759 5.486
630 HG12 ILE 88 2HG1 ILE 88 3.241 6.964 5.319
631 HG13 ILE 88 1HG1 ILE 88 4.001 7.651 6.740
632 HG21 ILE 88 1HG2 ILE 88 2.897 10.507 4.572
633 HG22 ILE 88 2HG2 ILE 88 3.381 8.920 3.964
634 HG23 ILE 88 3HG2 ILE 88 4.327 9.709 5.229
635 HD11 ILE 88 3HD1 ILE 88 1.264 6.428 6.618
636 HD12 ILE 88 1HD1 ILE 88 2.028 7.098 8.057
637 HD13 ILE 88 2HD1 ILE 88 2.716 5.672 7.279
638 H ARG 89 H ARG 89 3.672 11.877 7.694
639 HA ARG 89 HA ARG 89 1.608 13.649 6.639
640 HB2 ARG 89 2HB ARG 89 3.920 14.198 8.483
641 HB3 ARG 89 1HB ARG 89 2.924 15.457 7.770
642 HG2 ARG 89 2HG ARG 89 0.971 14.502 8.855
643 HG3 ARG 89 1HG ARG 89 1.997 13.279 9.603
644 HD2 ARG 89 2HD ARG 89 3.224 14.940 10.827
645 HD3 ARG 89 1HD ARG 89 2.421 16.237 9.939
646 HE ARG 89 HE ARG 89 0.342 15.381 10.956
647 HH11 ARG 89 1HH1 ARG 89 3.464 15.301 12.703
648 HH12 ARG 89 2HH1 ARG 89 2.747 15.211 14.245
649 HH21 ARG 89 1HH2 ARG 89 -0.598 15.309 13.140
650 HH22 ARG 89 2HH2 ARG 89 0.404 15.244 14.508
651 H LEU 90 H LEU 90 1.890 13.995 4.663
652 HA LEU 90 HA LEU 90 4.553 14.701 3.771
653 HB2 LEU 90 2HB LEU 90 4.098 13.912 1.473
654 HB3 LEU 90 1HB LEU 90 4.068 12.615 2.629
655 HG LEU 90 HG LEU 90 1.574 13.851 1.432
656 HD11 LEU 90 1HD1 LEU 90 3.069 12.839 -0.267
657 HD12 LEU 90 2HD1 LEU 90 1.562 11.945 -0.069
658 HD13 LEU 90 3HD1 LEU 90 3.051 11.332 0.651
659 HD21 LEU 90 3HD2 LEU 90 1.247 12.607 3.556
660 HD22 LEU 90 1HD2 LEU 90 2.039 11.208 2.830
661 HD23 LEU 90 2HD2 LEU 90 0.507 11.790 2.179
662 H GLY 91 H GLY 91 4.528 16.110 1.798
663 HA2 GLY 91 2HA GLY 91 4.010 18.630 2.282
664 HA3 GLY 91 1HA GLY 91 3.793 18.020 0.659
665 H HIS 92 H HIS 92 2.275 18.957 3.613
666 HA HIS 92 HA HIS 92 0.282 19.816 4.231
667 HB2 HIS 92 2HB HIS 92 0.993 21.333 2.310
668 HB3 HIS 92 1HB HIS 92 -0.160 20.460 1.310
669 HD1 HIS 92 1HD HIS 92 -2.345 21.634 1.150
670 HD2 HIS 92 2HD HIS 92 -0.370 22.508 4.689
671 HE1 HIS 92 1HE HIS 92 -3.790 23.322 2.365
672 H SER 93 H SER 93 0.466 17.004 3.226
673 HA SER 93 HA SER 93 -2.407 16.463 3.035
674 HB2 SER 93 2HB SER 93 -0.267 15.013 1.471
675 HB3 SER 93 1HB SER 93 -2.008 14.779 1.351
676 HG SER 93 HG SER 93 -0.550 17.108 0.630
677 H GLU 94 H GLU 94 -2.788 15.307 4.875
678 HA GLU 94 HA GLU 94 -0.615 13.568 5.833
679 HB2 GLU 94 2HB GLU 94 -2.892 14.725 7.415
680 HB3 GLU 94 1HB GLU 94 -1.532 13.773 8.008
681 HG2 GLU 94 2HG GLU 94 0.018 15.523 7.444
682 HG3 GLU 94 1HG GLU 94 -1.278 16.460 6.717
683 H ILE 95 H ILE 95 -0.999 11.417 5.753
684 HA ILE 95 HA ILE 95 -3.765 10.641 5.682
685 HB ILE 95 HB ILE 95 -3.288 8.842 4.179
686 HG12 ILE 95 2HG1 ILE 95 -1.265 8.821 2.751
687 HG13 ILE 95 1HG1 ILE 95 -0.437 9.879 3.915
688 HG21 ILE 95 1HG2 ILE 95 -2.800 10.162 2.073
689 HG22 ILE 95 2HG2 ILE 95 -2.588 11.556 3.134
690 HG23 ILE 95 3HG2 ILE 95 -4.132 10.703 3.077
691 HD11 ILE 95 3HD1 ILE 95 -0.698 8.089 5.565
692 HD12 ILE 95 1HD1 ILE 95 0.181 7.519 4.145
693 HD13 ILE 95 2HD1 ILE 95 -1.533 7.107 4.375
694 H ILE 96 H ILE 96 -4.312 8.724 6.617
695 HA ILE 96 HA ILE 96 -2.326 7.614 8.467
696 HB ILE 96 HB ILE 96 -5.368 7.479 8.614
697 HG12 ILE 96 2HG1 ILE 96 -3.441 9.131 10.274
698 HG13 ILE 96 1HG1 ILE 96 -4.492 9.765 9.019
699 HG21 ILE 96 1HG2 ILE 96 -4.271 5.546 9.644
700 HG22 ILE 96 2HG2 ILE 96 -4.996 6.576 10.881
701 HG23 ILE 96 3HG2 ILE 96 -3.256 6.622 10.605
702 HD11 ILE 96 3HD1 ILE 96 -5.378 10.189 11.241
703 HD12 ILE 96 1HD1 ILE 96 -5.395 8.459 11.577
704 HD13 ILE 96 2HD1 ILE 96 -6.447 9.125 10.325
705 H VAL 97 H VAL 97 -1.664 5.651 7.932
706 HA VAL 97 HA VAL 97 -2.862 4.304 5.688
707 HB VAL 97 HB VAL 97 -0.424 3.683 7.360
708 HG11 VAL 97 1HG1 VAL 97 0.032 1.868 5.724
709 HG12 VAL 97 2HG1 VAL 97 -1.570 2.134 5.028
710 HG13 VAL 97 3HG1 VAL 97 -1.408 1.575 6.694
711 HG21 VAL 97 3HG2 VAL 97 -0.786 4.437 4.476
712 HG22 VAL 97 1HG2 VAL 97 0.745 4.194 5.306
713 HG23 VAL 97 2HG2 VAL 97 -0.313 5.537 5.765
714 H ARG 98 H ARG 98 -4.318 2.732 5.747
715 HA ARG 98 HA ARG 98 -4.656 1.337 8.273
716 HB2 ARG 98 2HB ARG 98 -6.694 1.957 6.161
717 HB3 ARG 98 1HB ARG 98 -7.003 1.020 7.630
718 HG2 ARG 98 2HG ARG 98 -6.365 3.896 7.281
719 HG3 ARG 98 1HG ARG 98 -7.887 3.236 7.911
720 HD2 ARG 98 2HD ARG 98 -5.165 3.415 9.209
721 HD3 ARG 98 1HD ARG 98 -6.659 4.159 9.756
722 HE ARG 98 HE ARG 98 -5.950 1.307 9.942
723 HH11 ARG 98 1HH1 ARG 98 -8.049 3.962 10.952
724 HH12 ARG 98 2HH1 ARG 98 -8.556 3.211 12.388
725 HH21 ARG 98 1HH2 ARG 98 -6.555 0.301 11.910
726 HH22 ARG 98 2HH2 ARG 98 -7.706 1.025 12.938
727 H MET 99 H MET 99 -4.880 -0.706 8.213
728 HA MET 99 HA MET 99 -4.420 -2.110 5.658
729 HB2 MET 99 2HB MET 99 -3.233 -2.820 8.347
730 HB3 MET 99 1HB MET 99 -3.149 -3.816 6.914
731 HG2 MET 99 2HG MET 99 -1.803 -2.230 5.763
732 HG3 MET 99 1HG MET 99 -2.024 -1.037 7.043
733 HE1 MET 99 3HE MET 99 0.263 -4.992 7.765
734 HE2 MET 99 1HE MET 99 -0.497 -4.605 6.221
735 HE3 MET 99 2HE MET 99 -1.486 -4.869 7.658
736 H HIS 100 H HIS 100 -5.922 -3.445 5.197
737 HA HIS 100 HA HIS 100 -7.754 -4.335 7.301
738 HB2 HIS 100 2HB HIS 100 -8.320 -4.129 4.324
739 HB3 HIS 100 1HB HIS 100 -9.480 -4.423 5.612
740 HD1 HIS 100 1HD HIS 100 -10.265 -2.278 7.003
741 HD2 HIS 100 2HD HIS 100 -7.621 -1.490 3.889
742 HE1 HIS 100 1HE HIS 100 -10.335 0.208 6.623
Start of MODEL 7
1 H1 GLY 1 1HT GLY 1 -0.948 -6.888 -10.932
2 H2 GLY 1 2HT GLY 1 -1.858 -6.752 -9.477
3 H3 GLY 1 3HT GLY 1 -2.490 -7.555 -10.787
4 HA2 GLY 1 1HA GLY 1 -0.894 -9.294 -10.646
5 HA3 GLY 1 2HA GLY 1 -0.110 -8.449 -9.314
6 H HIS 2 H HIS 2 -1.378 -11.165 -9.287
7 HA HIS 2 HA HIS 2 -3.407 -10.539 -7.348
8 HB2 HIS 2 2HB HIS 2 -4.420 -11.521 -9.358
9 HB3 HIS 2 1HB HIS 2 -3.288 -12.859 -9.315
10 HD1 HIS 2 1HD HIS 2 -6.537 -11.686 -7.836
11 HD2 HIS 2 2HD HIS 2 -3.776 -14.715 -7.455
12 HE1 HIS 2 1HE HIS 2 -7.684 -13.430 -6.448
13 H GLY 3 H GLY 3 -1.146 -10.371 -6.351
14 HA2 GLY 3 2HA GLY 3 -0.297 -12.950 -5.284
15 HA3 GLY 3 1HA GLY 3 0.511 -11.396 -5.031
16 H SER 4 H SER 4 -0.444 -9.874 -3.645
17 HA SER 4 HA SER 4 -1.868 -11.108 -1.488
18 HB2 SER 4 2HB SER 4 -0.939 -8.307 -1.916
19 HB3 SER 4 1HB SER 4 -1.620 -8.944 -0.416
20 HG SER 4 HG SER 4 0.345 -10.570 -1.206
21 H ALA 5 H ALA 5 -3.834 -11.535 -2.417
22 HA ALA 5 HA ALA 5 -5.397 -9.156 -2.993
23 HB1 ALA 5 1HB ALA 5 -5.821 -11.929 -4.074
24 HB2 ALA 5 2HB ALA 5 -5.066 -10.574 -4.916
25 HB3 ALA 5 3HB ALA 5 -6.783 -10.487 -4.478
26 H GLY 6 H GLY 6 -5.796 -8.887 -0.914
27 HA2 GLY 6 2HA GLY 6 -8.060 -9.757 0.265
28 HA3 GLY 6 1HA GLY 6 -6.820 -10.895 0.818
29 H THR 7 H THR 7 -4.639 -9.607 1.205
30 HA THR 7 HA THR 7 -5.030 -7.774 3.323
31 HB THR 7 HB THR 7 -2.592 -8.248 1.585
32 HG1 THR 7 1HG THR 7 -2.037 -9.823 2.998
33 HG21 THR 7 3HG2 THR 7 -2.392 -6.258 2.972
34 HG22 THR 7 1HG2 THR 7 -1.321 -7.520 3.575
35 HG23 THR 7 2HG2 THR 7 -2.841 -7.180 4.408
36 H SER 8 H SER 8 -5.785 -5.731 2.939
37 HA SER 8 HA SER 8 -4.985 -4.468 0.413
38 HB2 SER 8 2HB SER 8 -7.487 -3.940 1.991
39 HB3 SER 8 1HB SER 8 -7.124 -3.483 0.324
40 HG SER 8 HG SER 8 -7.326 -6.143 1.266
41 H VAL 9 H VAL 9 -3.544 -2.899 0.866
42 HA VAL 9 HA VAL 9 -3.813 -1.456 3.390
43 HB VAL 9 HB VAL 9 -1.551 -2.280 2.986
44 HG11 VAL 9 1HG1 VAL 9 -1.672 -0.826 0.384
45 HG12 VAL 9 2HG1 VAL 9 -1.601 -2.576 0.611
46 HG13 VAL 9 3HG1 VAL 9 -0.216 -1.567 1.049
47 HG21 VAL 9 3HG2 VAL 9 -1.675 -0.107 4.068
48 HG22 VAL 9 1HG2 VAL 9 -1.683 0.695 2.498
49 HG23 VAL 9 2HG2 VAL 9 -0.251 -0.182 3.031
50 H THR 10 H THR 10 -4.547 0.482 3.485
51 HA THR 10 HA THR 10 -5.224 1.853 0.999
52 HB THR 10 HB THR 10 -7.030 1.402 3.383
53 HG1 THR 10 1HG THR 10 -6.368 -0.157 1.332
54 HG21 THR 10 3HG2 THR 10 -7.527 3.459 2.108
55 HG22 THR 10 1HG2 THR 10 -8.793 2.252 1.885
56 HG23 THR 10 2HG2 THR 10 -7.592 2.519 0.618
57 H LEU 11 H LEU 11 -4.918 3.995 1.137
58 HA LEU 11 HA LEU 11 -4.108 4.971 3.723
59 HB2 LEU 11 2HB LEU 11 -2.993 6.831 2.463
60 HB3 LEU 11 1HB LEU 11 -2.317 5.246 2.221
61 HG LEU 11 HG LEU 11 -3.708 5.226 0.051
62 HD11 LEU 11 1HD1 LEU 11 -5.058 7.211 0.454
63 HD12 LEU 11 2HD1 LEU 11 -4.049 7.414 -0.988
64 HD13 LEU 11 3HD1 LEU 11 -3.593 8.195 0.508
65 HD21 LEU 11 3HD2 LEU 11 -1.882 6.325 -1.168
66 HD22 LEU 11 1HD2 LEU 11 -1.297 5.260 0.109
67 HD23 LEU 11 2HD2 LEU 11 -1.304 7.007 0.351
68 H GLN 12 H GLN 12 -5.072 6.496 4.689
69 HA GLN 12 HA GLN 12 -7.673 7.402 3.638
70 HB2 GLN 12 2HB GLN 12 -7.422 5.900 5.737
71 HB3 GLN 12 1HB GLN 12 -6.751 7.313 6.513
72 HG2 GLN 12 2HG GLN 12 -9.544 7.106 5.401
73 HG3 GLN 12 1HG GLN 12 -9.107 6.902 7.086
74 HE21 GLN 12 1HE2 GLN 12 -8.462 8.728 8.248
75 HE22 GLN 12 2HE2 GLN 12 -8.887 10.325 7.730
76 H LEU 13 H LEU 13 -7.626 9.443 3.025
77 HA LEU 13 HA LEU 13 -5.508 11.249 3.954
78 HB2 LEU 13 2HB LEU 13 -5.526 10.859 1.582
79 HB3 LEU 13 1HB LEU 13 -7.242 11.191 1.495
80 HG LEU 13 HG LEU 13 -6.772 13.513 2.164
81 HD11 LEU 13 1HD1 LEU 13 -4.481 14.389 1.920
82 HD12 LEU 13 2HD1 LEU 13 -3.886 12.737 1.735
83 HD13 LEU 13 3HD1 LEU 13 -4.630 13.245 3.253
84 HD21 LEU 13 3HD2 LEU 13 -5.922 14.224 -0.035
85 HD22 LEU 13 1HD2 LEU 13 -7.150 12.965 -0.152
86 HD23 LEU 13 2HD2 LEU 13 -5.448 12.557 -0.368
87 H ASP 14 H ASP 14 -6.121 12.702 5.433
88 HA ASP 14 HA ASP 14 -8.933 13.427 5.448
89 HB2 ASP 14 2HB ASP 14 -7.908 12.928 7.657
90 HB3 ASP 14 1HB ASP 14 -6.778 14.262 7.404
91 H ASP 15 H ASP 15 -9.251 14.683 3.871
92 HA ASP 15 HA ASP 15 -7.486 16.943 3.345
93 HB2 ASP 15 2HB ASP 15 -8.622 17.039 1.201
94 HB3 ASP 15 1HB ASP 15 -8.133 15.372 1.507
95 H GLY 16 H GLY 16 -10.317 16.076 4.892
96 HA2 GLY 16 2HA GLY 16 -11.496 17.960 6.032
97 HA3 GLY 16 1HA GLY 16 -11.645 18.650 4.414
98 H SER 17 H SER 17 -11.853 15.669 3.531
99 HA SER 17 HA SER 17 -14.626 15.317 4.359
100 HB2 SER 17 2HB SER 17 -15.056 14.276 2.127
101 HB3 SER 17 1HB SER 17 -14.607 15.973 2.020
102 HG SER 17 HG SER 17 -12.351 15.016 1.675
103 H GLY 18 H GLY 18 -11.587 13.737 3.579
104 HA2 GLY 18 2HA GLY 18 -10.753 11.919 4.851
105 HA3 GLY 18 1HA GLY 18 -12.402 11.569 5.366
106 H ARG 19 H ARG 19 -10.034 11.105 2.952
107 HA ARG 19 HA ARG 19 -11.940 9.528 1.327
108 HB2 ARG 19 2HB ARG 19 -9.355 10.750 0.441
109 HB3 ARG 19 1HB ARG 19 -10.583 9.942 -0.535
110 HG2 ARG 19 2HG ARG 19 -12.151 11.729 -0.084
111 HG3 ARG 19 1HG ARG 19 -11.001 12.498 1.007
112 HD2 ARG 19 2HD ARG 19 -9.443 12.665 -0.943
113 HD3 ARG 19 1HD ARG 19 -10.799 12.158 -1.959
114 HE ARG 19 HE ARG 19 -11.107 14.464 -0.194
115 HH11 ARG 19 1HH1 ARG 19 -10.855 13.242 -3.506
116 HH12 ARG 19 2HH1 ARG 19 -11.417 14.678 -4.210
117 HH21 ARG 19 1HH2 ARG 19 -11.775 16.365 -1.085
118 HH22 ARG 19 2HH2 ARG 19 -11.961 16.568 -2.774
119 H THR 20 H THR 20 -11.006 7.653 0.270
120 HA THR 20 HA THR 20 -8.678 6.614 1.660
121 HB THR 20 HB THR 20 -9.799 4.369 1.695
122 HG1 THR 20 1HG THR 20 -12.118 5.929 1.096
123 HG21 THR 20 3HG2 THR 20 -9.713 5.713 3.708
124 HG22 THR 20 1HG2 THR 20 -11.277 4.885 3.631
125 HG23 THR 20 2HG2 THR 20 -11.146 6.600 3.190
126 H TYR 21 H TYR 21 -7.285 5.619 0.393
127 HA TYR 21 HA TYR 21 -8.089 4.830 -2.304
128 HB2 TYR 21 2HB TYR 21 -7.065 6.941 -2.693
129 HB3 TYR 21 1HB TYR 21 -5.778 6.605 -1.550
130 HD1 TYR 21 2HD TYR 21 -7.141 5.458 -4.831
131 HD2 TYR 21 1HD TYR 21 -3.734 5.814 -2.317
132 HE1 TYR 21 2HE TYR 21 -5.703 4.686 -6.664
133 HE2 TYR 21 1HE TYR 21 -2.290 5.049 -4.139
134 HH TYR 21 HH TYR 21 -2.468 3.762 -6.135
135 H GLN 22 H GLN 22 -7.595 2.826 -2.640
136 HA GLN 22 HA GLN 22 -5.832 1.439 -0.830
137 HB2 GLN 22 2HB GLN 22 -8.007 0.488 -1.505
138 HB3 GLN 22 1HB GLN 22 -7.436 0.405 -3.164
139 HG2 GLN 22 2HG GLN 22 -5.686 -1.164 -2.473
140 HG3 GLN 22 1HG GLN 22 -6.278 -1.083 -0.814
141 HE21 GLN 22 1HE2 GLN 22 -6.098 -3.401 -2.589
142 HE22 GLN 22 2HE2 GLN 22 -7.706 -3.983 -2.715
143 H LEU 23 H LEU 23 -3.896 0.683 -1.307
144 HA LEU 23 HA LEU 23 -2.507 1.704 -3.591
145 HB2 LEU 23 2HB LEU 23 -1.788 -0.151 -1.391
146 HB3 LEU 23 1HB LEU 23 -0.630 0.318 -2.588
147 HG LEU 23 HG LEU 23 -1.985 2.117 -0.559
148 HD11 LEU 23 1HD1 LEU 23 0.863 1.219 -0.874
149 HD12 LEU 23 2HD1 LEU 23 -0.260 0.686 0.373
150 HD13 LEU 23 3HD1 LEU 23 0.274 2.369 0.328
151 HD21 LEU 23 3HD2 LEU 23 -0.484 3.880 -1.400
152 HD22 LEU 23 1HD2 LEU 23 -1.637 3.354 -2.627
153 HD23 LEU 23 2HD2 LEU 23 0.033 2.801 -2.693
154 H ARG 24 H ARG 24 -2.067 0.655 -5.402
155 HA ARG 24 HA ARG 24 -2.831 -2.149 -5.486
156 HB2 ARG 24 2HB ARG 24 -2.385 -0.259 -7.801
157 HB3 ARG 24 1HB ARG 24 -2.824 -1.953 -7.942
158 HG2 ARG 24 2HG ARG 24 -4.491 0.326 -6.918
159 HG3 ARG 24 1HG ARG 24 -4.804 -0.717 -8.301
160 HD2 ARG 24 2HD ARG 24 -4.986 -1.420 -5.367
161 HD3 ARG 24 1HD ARG 24 -6.286 -1.361 -6.548
162 HE ARG 24 HE ARG 24 -4.157 -3.328 -6.980
163 HH11 ARG 24 1HH1 ARG 24 -7.499 -2.728 -6.000
164 HH12 ARG 24 2HH1 ARG 24 -7.908 -4.376 -5.928
165 HH21 ARG 24 1HH2 ARG 24 -4.688 -5.500 -6.897
166 HH22 ARG 24 2HH2 ARG 24 -6.267 -6.023 -6.504
167 H GLU 25 H GLU 25 -1.505 -3.531 -6.681
168 HA GLU 25 HA GLU 25 1.010 -3.844 -5.692
169 HB2 GLU 25 2HB GLU 25 0.231 -4.849 -8.427
170 HB3 GLU 25 1HB GLU 25 1.337 -5.575 -7.274
171 HG2 GLU 25 2HG GLU 25 -0.590 -6.919 -7.233
172 HG3 GLU 25 1HG GLU 25 -0.687 -5.935 -5.770
173 H GLY 26 H GLY 26 2.916 -2.979 -6.036
174 HA2 GLY 26 2HA GLY 26 4.654 -2.322 -7.634
175 HA3 GLY 26 1HA GLY 26 3.393 -1.462 -8.523
176 H SER 27 H SER 27 5.213 0.275 -8.020
177 HA SER 27 HA SER 27 4.603 1.272 -5.390
178 HB2 SER 27 2HB SER 27 6.509 2.819 -5.658
179 HB3 SER 27 1HB SER 27 6.972 1.137 -5.867
180 HG SER 27 HG SER 27 7.713 2.859 -7.374
181 H ASN 28 H ASN 28 3.352 2.808 -4.982
182 HA ASN 28 HA ASN 28 2.107 4.154 -7.257
183 HB2 ASN 28 2HB ASN 28 1.244 4.064 -4.327
184 HB3 ASN 28 1HB ASN 28 0.382 4.923 -5.586
185 HD21 ASN 28 1HD2 ASN 28 1.788 1.708 -5.977
186 HD22 ASN 28 2HD2 ASN 28 0.328 0.832 -6.106
187 H ILE 29 H ILE 29 3.043 5.925 -7.804
188 HA ILE 29 HA ILE 29 4.831 7.246 -5.945
189 HB ILE 29 HB ILE 29 4.398 7.807 -8.892
190 HG12 ILE 29 2HG1 ILE 29 6.525 6.088 -7.579
191 HG13 ILE 29 1HG1 ILE 29 5.117 5.457 -8.419
192 HG21 ILE 29 1HG2 ILE 29 6.622 8.868 -8.755
193 HG22 ILE 29 2HG2 ILE 29 6.674 8.530 -7.024
194 HG23 ILE 29 3HG2 ILE 29 5.473 9.647 -7.666
195 HD11 ILE 29 3HD1 ILE 29 5.910 6.454 -10.495
196 HD12 ILE 29 1HD1 ILE 29 7.112 5.365 -9.802
197 HD13 ILE 29 2HD1 ILE 29 7.308 7.115 -9.649
198 H ILE 30 H ILE 30 4.430 9.109 -4.996
199 HA ILE 30 HA ILE 30 2.060 10.637 -5.769
200 HB ILE 30 HB ILE 30 3.561 10.584 -3.111
201 HG12 ILE 30 2HG1 ILE 30 0.836 9.450 -3.822
202 HG13 ILE 30 1HG1 ILE 30 2.286 8.506 -3.550
203 HG21 ILE 30 1HG2 ILE 30 2.689 12.743 -3.436
204 HG22 ILE 30 2HG2 ILE 30 1.654 11.915 -2.267
205 HG23 ILE 30 3HG2 ILE 30 1.133 12.116 -3.945
206 HD11 ILE 30 3HD1 ILE 30 0.899 10.227 -1.505
207 HD12 ILE 30 1HD1 ILE 30 2.350 9.263 -1.226
208 HD13 ILE 30 2HD1 ILE 30 0.824 8.468 -1.613
209 H GLY 31 H GLY 31 2.350 12.666 -6.460
210 HA2 GLY 31 2HA GLY 31 3.993 14.658 -5.801
211 HA3 GLY 31 1HA GLY 31 5.026 13.702 -6.883
212 H ARG 32 H ARG 32 4.579 16.100 -7.892
213 HA ARG 32 HA ARG 32 2.225 15.689 -9.629
214 HB2 ARG 32 2HB ARG 32 3.633 18.269 -8.964
215 HB3 ARG 32 1HB ARG 32 2.244 18.115 -10.036
216 HG2 ARG 32 2HG ARG 32 0.962 17.256 -8.051
217 HG3 ARG 32 1HG ARG 32 2.367 17.645 -7.085
218 HD2 ARG 32 2HD ARG 32 0.714 19.453 -6.993
219 HD3 ARG 32 1HD ARG 32 2.244 19.978 -7.685
220 HE ARG 32 HE ARG 32 1.250 20.064 -9.802
221 HH11 ARG 32 1HH1 ARG 32 -1.157 19.254 -7.305
222 HH12 ARG 32 2HH1 ARG 32 -2.468 19.949 -8.141
223 HH21 ARG 32 1HH2 ARG 32 -0.596 21.037 -10.938
224 HH22 ARG 32 2HH2 ARG 32 -2.150 20.964 -10.246
225 H GLY 33 H GLY 33 2.998 14.695 -11.366
226 HA2 GLY 33 2HA GLY 33 4.425 16.064 -13.282
227 HA3 GLY 33 1HA GLY 33 5.544 15.000 -12.433
228 H GLN 34 H GLN 34 5.346 14.377 -14.881
229 HA GLN 34 HA GLN 34 3.226 12.606 -15.614
230 HB2 GLN 34 2HB GLN 34 6.055 12.758 -16.677
231 HB3 GLN 34 1HB GLN 34 4.677 12.020 -17.474
232 HG2 GLN 34 2HG GLN 34 3.631 14.185 -17.748
233 HG3 GLN 34 1HG GLN 34 4.941 14.952 -16.859
234 HE21 GLN 34 1HE2 GLN 34 5.501 16.253 -18.573
235 HE22 GLN 34 2HE2 GLN 34 6.297 15.670 -19.971
236 H ASP 35 H ASP 35 6.149 12.408 -13.871
237 HA ASP 35 HA ASP 35 6.490 9.541 -13.929
238 HB2 ASP 35 2HB ASP 35 7.841 11.703 -12.310
239 HB3 ASP 35 1HB ASP 35 8.256 9.999 -12.225
240 H ALA 36 H ALA 36 4.145 11.207 -12.514
241 HA ALA 36 HA ALA 36 4.216 9.547 -10.111
242 HB1 ALA 36 1HB ALA 36 3.203 11.336 -8.840
243 HB2 ALA 36 2HB ALA 36 3.220 12.375 -10.264
244 HB3 ALA 36 3HB ALA 36 4.739 11.855 -9.534
245 H GLN 37 H GLN 37 2.202 9.017 -9.225
246 HA GLN 37 HA GLN 37 0.084 8.703 -11.213
247 HB2 GLN 37 2HB GLN 37 0.823 7.243 -8.688
248 HB3 GLN 37 1HB GLN 37 -0.753 7.049 -9.435
249 HG2 GLN 37 2HG GLN 37 1.841 6.526 -10.862
250 HG3 GLN 37 1HG GLN 37 0.924 5.287 -10.006
251 HE21 GLN 37 1HE2 GLN 37 -1.055 4.670 -10.794
252 HE22 GLN 37 2HE2 GLN 37 -1.568 4.957 -12.407
253 H PHE 38 H PHE 38 0.542 9.420 -7.773
254 HA PHE 38 HA PHE 38 -2.076 10.711 -7.786
255 HB2 PHE 38 2HB PHE 38 -1.831 8.956 -6.117
256 HB3 PHE 38 1HB PHE 38 -0.356 9.693 -5.518
257 HD1 PHE 38 1HD PHE 38 -3.979 10.485 -5.995
258 HD2 PHE 38 2HD PHE 38 -0.472 11.035 -3.656
259 HE1 PHE 38 1HE PHE 38 -5.285 11.724 -4.311
260 HE2 PHE 38 2HE PHE 38 -1.708 12.240 -2.009
261 HZ PHE 38 HZ PHE 38 -4.159 12.618 -2.302
262 H ARG 39 H ARG 39 -1.934 12.781 -8.224
263 HA ARG 39 HA ARG 39 0.448 14.169 -7.378
264 HB2 ARG 39 2HB ARG 39 -0.308 16.005 -8.904
265 HB3 ARG 39 1HB ARG 39 0.094 14.493 -9.695
266 HG2 ARG 39 2HG ARG 39 -2.312 14.015 -9.898
267 HG3 ARG 39 1HG ARG 39 -2.659 15.580 -9.149
268 HD2 ARG 39 2HD ARG 39 -1.467 16.717 -10.953
269 HD3 ARG 39 1HD ARG 39 -1.083 15.161 -11.685
270 HE ARG 39 HE ARG 39 -3.869 15.532 -11.323
271 HH11 ARG 39 1HH1 ARG 39 -1.165 16.391 -13.436
272 HH12 ARG 39 2HH1 ARG 39 -2.103 16.575 -14.841
273 HH21 ARG 39 1HH2 ARG 39 -5.215 15.864 -13.264
274 HH22 ARG 39 2HH2 ARG 39 -4.444 16.271 -14.733
275 H LEU 40 H LEU 40 0.510 15.286 -5.680
276 HA LEU 40 HA LEU 40 -1.717 15.773 -4.046
277 HB2 LEU 40 2HB LEU 40 1.049 16.953 -3.976
278 HB3 LEU 40 1HB LEU 40 -0.159 17.243 -2.739
279 HG LEU 40 HG LEU 40 1.115 14.589 -3.410
280 HD11 LEU 40 1HD1 LEU 40 2.612 16.166 -2.297
281 HD12 LEU 40 2HD1 LEU 40 2.154 14.845 -1.217
282 HD13 LEU 40 3HD1 LEU 40 1.395 16.431 -1.047
283 HD21 LEU 40 3HD2 LEU 40 -0.825 15.340 -1.229
284 HD22 LEU 40 1HD2 LEU 40 -0.037 13.779 -1.422
285 HD23 LEU 40 2HD2 LEU 40 -1.197 14.329 -2.630
286 HA PRO 41 HA PRO 41 -2.862 19.675 -5.852
287 HB2 PRO 41 2HB PRO 41 -4.995 20.190 -4.334
288 HB3 PRO 41 1HB PRO 41 -4.980 18.849 -5.485
289 HG2 PRO 41 2HG PRO 41 -4.799 18.790 -2.526
290 HG3 PRO 41 1HG PRO 41 -5.436 17.568 -3.636
291 HD2 PRO 41 2HD PRO 41 -2.857 17.649 -2.413
292 HD3 PRO 41 1HD PRO 41 -3.453 16.475 -3.597
293 H ASP 42 H ASP 42 -0.975 19.497 -3.363
294 HA ASP 42 HA ASP 42 -1.562 22.171 -2.268
295 HB2 ASP 42 2HB ASP 42 -1.195 19.973 -0.767
296 HB3 ASP 42 1HB ASP 42 0.497 20.399 -1.043
297 H THR 43 H THR 43 0.928 22.906 -1.394
298 HA THR 43 HA THR 43 2.341 23.249 -3.935
299 HB THR 43 HB THR 43 2.254 25.105 -1.543
300 HG1 THR 43 1HG THR 43 0.269 25.324 -2.255
301 HG21 THR 43 3HG2 THR 43 4.173 25.407 -3.039
302 HG22 THR 43 1HG2 THR 43 3.065 26.776 -3.156
303 HG23 THR 43 2HG2 THR 43 3.084 25.539 -4.421
304 H GLY 44 H GLY 44 4.679 23.075 -3.844
305 HA2 GLY 44 2HA GLY 44 6.704 23.049 -2.582
306 HA3 GLY 44 1HA GLY 44 5.818 22.351 -1.229
307 H VAL 45 H VAL 45 4.372 20.632 -3.047
308 HA VAL 45 HA VAL 45 5.968 18.341 -2.896
309 HB VAL 45 HB VAL 45 3.572 18.134 -2.813
310 HG11 VAL 45 1HG1 VAL 45 2.915 20.000 -4.188
311 HG12 VAL 45 2HG1 VAL 45 2.127 18.536 -4.771
312 HG13 VAL 45 3HG1 VAL 45 3.521 19.191 -5.629
313 HG21 VAL 45 3HG2 VAL 45 3.152 16.364 -4.491
314 HG22 VAL 45 1HG2 VAL 45 4.711 16.188 -3.679
315 HG23 VAL 45 2HG2 VAL 45 4.638 16.836 -5.317
316 H SER 46 H SER 46 7.291 17.353 -4.233
317 HA SER 46 HA SER 46 8.350 18.687 -6.536
318 HB2 SER 46 2HB SER 46 8.997 15.947 -5.442
319 HB3 SER 46 1HB SER 46 10.054 17.073 -6.303
320 HG SER 46 HG SER 46 9.687 18.521 -4.525
321 H ARG 47 H ARG 47 8.951 16.655 -8.367
322 HA ARG 47 HA ARG 47 6.320 16.037 -9.387
323 HB2 ARG 47 2HB ARG 47 7.385 15.059 -11.348
324 HB3 ARG 47 1HB ARG 47 8.029 16.655 -11.021
325 HG2 ARG 47 2HG ARG 47 10.072 15.751 -10.261
326 HG3 ARG 47 1HG ARG 47 9.420 14.109 -10.217
327 HD2 ARG 47 2HD ARG 47 9.090 14.290 -12.689
328 HD3 ARG 47 1HD ARG 47 9.939 15.831 -12.638
329 HE ARG 47 HE ARG 47 11.542 13.954 -11.388
330 HH11 ARG 47 1HH1 ARG 47 10.266 14.529 -14.655
331 HH12 ARG 47 2HH1 ARG 47 11.574 13.781 -15.442
332 HH21 ARG 47 1HH2 ARG 47 13.313 12.909 -12.475
333 HH22 ARG 47 2HH2 ARG 47 13.334 12.846 -14.180
334 H ARG 48 H ARG 48 8.936 14.375 -7.934
335 HA ARG 48 HA ARG 48 7.115 12.186 -7.374
336 HB2 ARG 48 2HB ARG 48 10.126 11.957 -7.819
337 HB3 ARG 48 1HB ARG 48 9.040 10.642 -7.399
338 HG2 ARG 48 2HG ARG 48 7.937 10.838 -9.553
339 HG3 ARG 48 1HG ARG 48 8.989 12.163 -10.020
340 HD2 ARG 48 2HD ARG 48 9.997 10.316 -11.034
341 HD3 ARG 48 1HD ARG 48 10.899 10.456 -9.532
342 HE ARG 48 HE ARG 48 8.604 8.687 -9.530
343 HH11 ARG 48 1HH1 ARG 48 12.152 8.975 -9.582
344 HH12 ARG 48 2HH1 ARG 48 12.437 7.322 -9.344
345 HH21 ARG 48 1HH2 ARG 48 9.044 6.331 -9.172
346 HH22 ARG 48 2HH2 ARG 48 10.647 5.810 -9.103
347 H HIS 49 H HIS 49 6.751 12.337 -5.308
348 HA HIS 49 HA HIS 49 8.595 13.889 -3.625
349 HB2 HIS 49 2HB HIS 49 6.289 14.734 -3.854
350 HB3 HIS 49 1HB HIS 49 5.648 13.212 -3.281
351 HD2 HIS 49 2HD HIS 49 6.942 12.752 -0.488
352 HE1 HIS 49 1HE HIS 49 6.081 16.808 0.292
353 HE2 HIS 49 2HE HIS 49 7.114 14.640 1.185
354 H LEU 50 H LEU 50 6.689 10.950 -3.828
355 HA LEU 50 HA LEU 50 8.501 9.456 -2.278
356 HB2 LEU 50 2HB LEU 50 7.556 10.576 -0.406
357 HB3 LEU 50 1HB LEU 50 5.934 10.456 -1.022
358 HG LEU 50 HG LEU 50 7.382 7.937 -0.263
359 HD11 LEU 50 1HD1 LEU 50 6.004 9.858 1.633
360 HD12 LEU 50 2HD1 LEU 50 7.735 9.530 1.604
361 HD13 LEU 50 3HD1 LEU 50 6.602 8.253 2.047
362 HD21 LEU 50 3HD2 LEU 50 4.515 8.872 -0.036
363 HD22 LEU 50 1HD2 LEU 50 5.111 7.261 0.369
364 HD23 LEU 50 2HD2 LEU 50 5.163 7.826 -1.299
365 H GLU 51 H GLU 51 7.950 7.226 -2.383
366 HA GLU 51 HA GLU 51 5.542 6.674 -3.883
367 HB2 GLU 51 2HB GLU 51 6.697 5.004 -5.270
368 HB3 GLU 51 1HB GLU 51 7.320 6.614 -5.560
369 HG2 GLU 51 2HG GLU 51 9.254 6.081 -4.126
370 HG3 GLU 51 1HG GLU 51 8.615 4.457 -3.905
371 H ILE 52 H ILE 52 4.458 5.004 -3.168
372 HA ILE 52 HA ILE 52 5.663 3.533 -0.945
373 HB ILE 52 HB ILE 52 2.735 3.589 -1.751
374 HG12 ILE 52 2HG1 ILE 52 4.106 5.093 0.499
375 HG13 ILE 52 1HG1 ILE 52 3.536 5.826 -0.994
376 HG21 ILE 52 1HG2 ILE 52 4.159 2.601 0.726
377 HG22 ILE 52 2HG2 ILE 52 3.447 1.600 -0.538
378 HG23 ILE 52 3HG2 ILE 52 2.409 2.598 0.486
379 HD11 ILE 52 3HD1 ILE 52 2.001 6.216 0.853
380 HD12 ILE 52 1HD1 ILE 52 1.812 4.478 1.081
381 HD13 ILE 52 2HD1 ILE 52 1.241 5.245 -0.405
382 H ARG 53 H ARG 53 6.497 1.688 -1.543
383 HA ARG 53 HA ARG 53 5.505 0.499 -3.990
384 HB2 ARG 53 2HB ARG 53 7.953 0.774 -3.791
385 HB3 ARG 53 1HB ARG 53 7.944 -0.295 -2.393
386 HG2 ARG 53 2HG ARG 53 7.168 -2.128 -3.714
387 HG3 ARG 53 1HG ARG 53 6.963 -1.090 -5.120
388 HD2 ARG 53 2HD ARG 53 9.416 -0.664 -5.065
389 HD3 ARG 53 1HD ARG 53 9.537 -1.864 -3.777
390 HE ARG 53 HE ARG 53 8.798 -3.529 -5.271
391 HH11 ARG 53 1HH1 ARG 53 9.718 -0.474 -6.822
392 HH12 ARG 53 2HH1 ARG 53 9.803 -1.113 -8.378
393 HH21 ARG 53 1HH2 ARG 53 8.876 -4.425 -7.471
394 HH22 ARG 53 2HH2 ARG 53 9.323 -3.412 -8.754
395 H TRP 54 H TRP 54 3.856 -0.678 -3.760
396 HA TRP 54 HA TRP 54 3.672 -2.311 -1.408
397 HB2 TRP 54 2HB TRP 54 1.679 -1.071 -1.771
398 HB3 TRP 54 1HB TRP 54 1.667 -1.465 -3.489
399 HD1 TRP 54 HD TRP 54 -0.163 -3.148 -4.012
400 HE1 TRP 54 1HE TRP 54 -1.237 -5.177 -2.863
401 HE3 TRP 54 3HE TRP 54 2.430 -3.059 0.365
402 HZ2 TRP 54 2HZ TRP 54 -1.017 -6.563 -0.407
403 HZ3 TRP 54 3HZ TRP 54 1.956 -4.753 2.065
404 HH2 TRP 54 HH TRP 54 0.254 -6.477 1.691
405 H ASP 55 H ASP 55 4.473 -4.190 -1.543
406 HA ASP 55 HA ASP 55 4.385 -5.654 -4.084
407 HB2 ASP 55 2HB ASP 55 6.694 -4.908 -3.273
408 HB3 ASP 55 1HB ASP 55 6.449 -5.949 -1.877
409 H GLY 56 H GLY 56 4.424 -8.148 -3.490
410 HA2 GLY 56 2HA GLY 56 2.199 -8.470 -1.678
411 HA3 GLY 56 1HA GLY 56 2.892 -9.733 -2.677
412 H GLN 57 H GLN 57 4.347 -7.659 -0.288
413 HA GLN 57 HA GLN 57 5.022 -9.927 1.439
414 HB2 GLN 57 2HB GLN 57 6.981 -7.868 0.397
415 HB3 GLN 57 1HB GLN 57 7.326 -8.992 1.700
416 HG2 GLN 57 2HG GLN 57 7.145 -10.863 0.195
417 HG3 GLN 57 1HG GLN 57 6.630 -9.801 -1.114
418 HE21 GLN 57 1HE2 GLN 57 8.123 -8.556 -2.153
419 HE22 GLN 57 2HE2 GLN 57 9.827 -8.724 -1.952
420 H VAL 58 H VAL 58 5.730 -6.457 1.138
421 HA VAL 58 HA VAL 58 4.171 -5.768 3.443
422 HB VAL 58 HB VAL 58 6.072 -4.454 4.465
423 HG11 VAL 58 1HG1 VAL 58 6.490 -7.436 4.452
424 HG12 VAL 58 2HG1 VAL 58 5.421 -6.527 5.521
425 HG13 VAL 58 3HG1 VAL 58 7.168 -6.312 5.630
426 HG21 VAL 58 3HG2 VAL 58 7.577 -4.370 2.554
427 HG22 VAL 58 1HG2 VAL 58 7.810 -6.117 2.634
428 HG23 VAL 58 2HG2 VAL 58 8.397 -5.088 3.941
429 H ALA 59 H ALA 59 3.987 -3.422 3.577
430 HA ALA 59 HA ALA 59 4.201 -2.197 0.961
431 HB1 ALA 59 1HB ALA 59 2.077 -2.000 2.206
432 HB2 ALA 59 2HB ALA 59 2.809 -0.431 1.885
433 HB3 ALA 59 3HB ALA 59 2.933 -1.151 3.494
434 H LEU 60 H LEU 60 6.012 -1.349 0.505
435 HA LEU 60 HA LEU 60 7.833 -0.434 2.559
436 HB2 LEU 60 2HB LEU 60 8.500 -1.983 0.725
437 HB3 LEU 60 1HB LEU 60 8.150 -0.731 -0.431
438 HG LEU 60 HG LEU 60 10.338 -0.495 1.653
439 HD11 LEU 60 1HD1 LEU 60 10.739 -2.427 0.255
440 HD12 LEU 60 2HD1 LEU 60 11.858 -1.124 -0.160
441 HD13 LEU 60 3HD1 LEU 60 10.461 -1.459 -1.191
442 HD21 LEU 60 3HD2 LEU 60 9.590 1.623 0.629
443 HD22 LEU 60 1HD2 LEU 60 9.882 0.937 -0.967
444 HD23 LEU 60 2HD2 LEU 60 11.235 1.203 0.139
445 H LEU 61 H LEU 61 7.731 1.601 3.182
446 HA LEU 61 HA LEU 61 6.701 3.671 1.397
447 HB2 LEU 61 2HB LEU 61 5.720 3.388 3.622
448 HB3 LEU 61 1HB LEU 61 7.252 3.560 4.399
449 HG LEU 61 HG LEU 61 5.807 5.502 4.732
450 HD11 LEU 61 1HD1 LEU 61 8.126 6.251 2.982
451 HD12 LEU 61 2HD1 LEU 61 8.168 5.986 4.724
452 HD13 LEU 61 3HD1 LEU 61 7.249 7.337 4.062
453 HD21 LEU 61 3HD2 LEU 61 4.477 5.324 2.730
454 HD22 LEU 61 1HD2 LEU 61 5.858 5.812 1.750
455 HD23 LEU 61 2HD2 LEU 61 5.135 6.951 2.896
456 H ALA 62 H ALA 62 8.171 4.967 0.354
457 HA ALA 62 HA ALA 62 10.749 5.430 1.628
458 HB1 ALA 62 1HB ALA 62 11.938 5.036 -0.463
459 HB2 ALA 62 2HB ALA 62 10.430 4.561 -1.243
460 HB3 ALA 62 3HB ALA 62 11.094 3.580 0.062
461 H ASP 63 H ASP 63 11.200 7.509 1.666
462 HA ASP 63 HA ASP 63 9.672 9.442 0.225
463 HB2 ASP 63 2HB ASP 63 11.939 9.599 2.185
464 HB3 ASP 63 1HB ASP 63 11.619 10.991 1.152
465 H LEU 64 H LEU 64 10.241 10.619 -1.482
466 HA LEU 64 HA LEU 64 12.794 9.980 -2.727
467 HB2 LEU 64 2HB LEU 64 10.943 8.662 -3.706
468 HB3 LEU 64 1HB LEU 64 10.078 10.143 -4.030
469 HG LEU 64 HG LEU 64 11.651 10.773 -5.727
470 HD11 LEU 64 1HD1 LEU 64 13.128 8.256 -4.924
471 HD12 LEU 64 2HD1 LEU 64 13.705 9.909 -4.692
472 HD13 LEU 64 3HD1 LEU 64 13.513 9.259 -6.321
473 HD21 LEU 64 3HD2 LEU 64 10.945 7.870 -5.950
474 HD22 LEU 64 1HD2 LEU 64 11.250 8.977 -7.279
475 HD23 LEU 64 2HD2 LEU 64 9.833 9.202 -6.243
476 H ASN 65 H ASN 65 13.361 11.973 -1.671
477 HA ASN 65 HA ASN 65 13.143 14.316 -3.165
478 HB2 ASN 65 2HB ASN 65 11.702 15.688 -1.727
479 HB3 ASN 65 1HB ASN 65 10.770 14.299 -2.275
480 HD21 ASN 65 1HD2 ASN 65 10.002 12.858 -0.762
481 HD22 ASN 65 2HD2 ASN 65 10.212 13.023 0.936
482 H SER 66 H SER 66 14.001 16.172 -1.691
483 HA SER 66 HA SER 66 15.878 15.001 0.217
484 HB2 SER 66 2HB SER 66 17.054 17.198 -0.190
485 HB3 SER 66 1HB SER 66 16.976 16.086 -1.562
486 HG SER 66 HG SER 66 16.409 18.335 -1.980
487 H THR 67 H THR 67 13.940 17.958 -0.210
488 HA THR 67 HA THR 67 14.275 18.620 2.593
489 HB THR 67 HB THR 67 14.608 20.432 1.052
490 HG1 THR 67 1HG THR 67 12.213 20.750 2.560
491 HG21 THR 67 3HG2 THR 67 11.747 20.017 0.159
492 HG22 THR 67 1HG2 THR 67 13.191 19.702 -0.803
493 HG23 THR 67 2HG2 THR 67 12.783 21.354 -0.339
494 H ASN 68 H ASN 68 11.763 17.338 0.628
495 HA ASN 68 HA ASN 68 9.572 18.214 2.342
496 HB2 ASN 68 2HB ASN 68 9.725 16.649 -0.216
497 HB3 ASN 68 1HB ASN 68 8.228 16.828 0.681
498 HD21 ASN 68 1HD2 ASN 68 8.984 17.733 -2.002
499 HD22 ASN 68 2HD2 ASN 68 8.668 19.429 -1.984
500 H GLY 69 H GLY 69 11.586 16.417 3.351
501 HA2 GLY 69 2HA GLY 69 11.141 13.744 3.416
502 HA3 GLY 69 1HA GLY 69 11.777 14.660 4.766
503 H THR 70 H THR 70 9.618 12.524 3.938
504 HA THR 70 HA THR 70 7.274 13.354 5.162
505 HB THR 70 HB THR 70 8.436 10.811 4.065
506 HG1 THR 70 1HG THR 70 8.020 11.892 2.538
507 HG21 THR 70 3HG2 THR 70 6.187 9.812 4.194
508 HG22 THR 70 1HG2 THR 70 5.592 11.234 5.049
509 HG23 THR 70 2HG2 THR 70 6.769 10.171 5.822
510 H THR 71 H THR 71 6.344 12.635 7.085
511 HA THR 71 HA THR 71 8.180 11.661 9.134
512 HB THR 71 HB THR 71 6.413 12.667 10.680
513 HG1 THR 71 1HG THR 71 5.885 14.407 8.548
514 HG21 THR 71 3HG2 THR 71 8.571 13.582 10.500
515 HG22 THR 71 1HG2 THR 71 7.405 14.902 10.552
516 HG23 THR 71 2HG2 THR 71 8.166 14.443 9.006
517 H VAL 72 H VAL 72 7.549 9.974 10.297
518 HA VAL 72 HA VAL 72 4.915 8.882 9.744
519 HB VAL 72 HB VAL 72 5.879 6.590 9.980
520 HG11 VAL 72 1HG1 VAL 72 5.586 7.522 7.738
521 HG12 VAL 72 2HG1 VAL 72 7.030 6.510 7.804
522 HG13 VAL 72 3HG1 VAL 72 7.177 8.269 7.845
523 HG21 VAL 72 3HG2 VAL 72 8.332 6.298 9.848
524 HG22 VAL 72 1HG2 VAL 72 7.844 7.145 11.322
525 HG23 VAL 72 2HG2 VAL 72 8.515 8.053 9.974
526 H ASN 73 H ASN 73 3.740 8.864 11.455
527 HA ASN 73 HA ASN 73 3.050 9.086 13.535
528 HB2 ASN 73 2HB ASN 73 5.396 7.223 13.986
529 HB3 ASN 73 1HB ASN 73 4.279 7.652 15.284
530 HD21 ASN 73 1HD2 ASN 73 4.838 5.087 13.804
531 HD22 ASN 73 2HD2 ASN 73 3.303 4.536 13.241
532 H ASN 74 H ASN 74 4.541 11.121 12.484
533 HA ASN 74 HA ASN 74 5.054 13.164 13.025
534 HB2 ASN 74 2HB ASN 74 3.875 12.898 15.210
535 HB3 ASN 74 1HB ASN 74 5.363 12.309 15.923
536 HD21 ASN 74 1HD2 ASN 74 5.033 15.083 13.703
537 HD22 ASN 74 2HD2 ASN 74 5.574 16.251 14.840
538 H ALA 75 H ALA 75 7.059 10.545 13.345
539 HA ALA 75 HA ALA 75 9.465 12.068 13.936
540 HB1 ALA 75 1HB ALA 75 9.090 9.121 13.404
541 HB2 ALA 75 2HB ALA 75 9.172 9.880 14.993
542 HB3 ALA 75 3HB ALA 75 10.585 9.892 13.934
543 HA PRO 76 HA PRO 76 10.074 12.611 9.475
544 HB2 PRO 76 2HB PRO 76 12.733 13.602 10.240
545 HB3 PRO 76 1HB PRO 76 11.419 14.441 9.414
546 HG2 PRO 76 2HG PRO 76 12.114 15.024 11.943
547 HG3 PRO 76 1HG PRO 76 10.440 15.128 11.374
548 HD2 PRO 76 2HD PRO 76 11.751 13.003 13.018
549 HD3 PRO 76 1HD PRO 76 10.129 13.719 13.148
550 H VAL 77 H VAL 77 10.673 11.065 8.128
551 HA VAL 77 HA VAL 77 13.186 9.619 8.559
552 HB VAL 77 HB VAL 77 12.098 7.509 7.854
553 HG11 VAL 77 1HG1 VAL 77 12.368 7.885 10.232
554 HG12 VAL 77 2HG1 VAL 77 10.872 7.005 9.917
555 HG13 VAL 77 3HG1 VAL 77 10.822 8.728 10.292
556 HG21 VAL 77 3HG2 VAL 77 9.632 7.330 7.838
557 HG22 VAL 77 1HG2 VAL 77 10.238 8.421 6.588
558 HG23 VAL 77 2HG2 VAL 77 9.524 9.074 8.061
559 H GLN 78 H GLN 78 13.489 8.209 6.414
560 HA GLN 78 HA GLN 78 12.350 9.657 4.150
561 HB2 GLN 78 2HB GLN 78 15.135 8.501 4.323
562 HB3 GLN 78 1HB GLN 78 14.433 9.229 2.887
563 HG2 GLN 78 2HG GLN 78 14.181 11.332 4.217
564 HG3 GLN 78 1HG GLN 78 15.123 10.561 5.476
565 HE21 GLN 78 1HE2 GLN 78 16.777 12.047 5.304
566 HE22 GLN 78 2HE2 GLN 78 17.890 12.045 3.989
567 H GLU 79 H GLU 79 12.092 6.975 5.804
568 HA GLU 79 HA GLU 79 10.956 5.433 3.781
569 HB2 GLU 79 2HB GLU 79 12.480 3.506 3.793
570 HB3 GLU 79 1HB GLU 79 13.313 4.934 3.205
571 HG2 GLU 79 2HG GLU 79 14.271 5.228 5.474
572 HG3 GLU 79 1HG GLU 79 13.556 3.679 5.919
573 H TRP 80 H TRP 80 9.936 3.574 4.709
574 HA TRP 80 HA TRP 80 10.148 2.959 7.480
575 HB2 TRP 80 2HB TRP 80 9.057 5.102 7.712
576 HB3 TRP 80 1HB TRP 80 7.795 4.702 6.570
577 HD1 TRP 80 HD TRP 80 5.684 3.546 7.547
578 HE1 TRP 80 1HE TRP 80 4.914 2.952 9.911
579 HE3 TRP 80 3HE TRP 80 10.118 4.210 9.988
580 HZ2 TRP 80 2HZ TRP 80 6.051 2.803 12.499
581 HZ3 TRP 80 3HZ TRP 80 10.187 3.829 12.418
582 HH2 TRP 80 HH TRP 80 8.188 3.141 13.642
583 H GLN 81 H GLN 81 8.846 1.145 7.951
584 HA GLN 81 HA GLN 81 7.534 0.012 5.589
585 HB2 GLN 81 2HB GLN 81 8.459 -1.452 8.085
586 HB3 GLN 81 1HB GLN 81 7.690 -2.198 6.691
587 HG2 GLN 81 2HG GLN 81 9.599 -1.421 5.296
588 HG3 GLN 81 1HG GLN 81 10.378 -0.857 6.769
589 HE21 GLN 81 1HE2 GLN 81 11.276 -2.838 4.885
590 HE22 GLN 81 2HE2 GLN 81 11.503 -4.296 5.773
591 H LEU 82 H LEU 82 5.515 0.297 5.519
592 HA LEU 82 HA LEU 82 3.995 1.596 7.447
593 HB2 LEU 82 2HB LEU 82 2.965 -0.100 5.206
594 HB3 LEU 82 1HB LEU 82 2.088 1.122 6.093
595 HG LEU 82 HG LEU 82 4.380 1.580 4.198
596 HD11 LEU 82 1HD1 LEU 82 2.724 2.796 2.891
597 HD12 LEU 82 2HD1 LEU 82 1.483 2.394 4.076
598 HD13 LEU 82 3HD1 LEU 82 2.235 1.117 3.125
599 HD21 LEU 82 3HD2 LEU 82 2.895 3.478 5.984
600 HD22 LEU 82 1HD2 LEU 82 3.905 3.981 4.622
601 HD23 LEU 82 2HD2 LEU 82 4.621 3.107 5.964
602 H ALA 83 H ALA 83 2.604 1.002 9.000
603 HA ALA 83 HA ALA 83 1.646 -1.737 9.071
604 HB1 ALA 83 1HB ALA 83 1.763 -1.680 11.536
605 HB2 ALA 83 2HB ALA 83 2.557 -0.108 11.459
606 HB3 ALA 83 3HB ALA 83 3.368 -1.539 10.819
607 H ASP 84 H ASP 84 -0.373 -1.806 10.322
608 HA ASP 84 HA ASP 84 -2.181 0.162 9.414
609 HB2 ASP 84 2HB ASP 84 -2.862 -2.158 9.803
610 HB3 ASP 84 1HB ASP 84 -2.530 -1.984 11.516
611 H GLY 85 H GLY 85 -2.671 2.072 10.253
612 HA2 GLY 85 2HA GLY 85 -3.444 3.415 12.049
613 HA3 GLY 85 1HA GLY 85 -2.521 2.419 13.161
614 H ASP 86 H ASP 86 -0.529 3.041 10.564
615 HA ASP 86 HA ASP 86 0.977 4.899 12.120
616 HB2 ASP 86 2HB ASP 86 1.454 3.765 9.363
617 HB3 ASP 86 1HB ASP 86 2.474 5.037 10.022
618 H VAL 87 H VAL 87 1.081 6.970 12.078
619 HA VAL 87 HA VAL 87 -0.695 8.455 10.280
620 HB VAL 87 HB VAL 87 0.909 9.506 12.637
621 HG11 VAL 87 1HG1 VAL 87 -1.474 10.647 11.203
622 HG12 VAL 87 2HG1 VAL 87 0.195 11.195 11.065
623 HG13 VAL 87 3HG1 VAL 87 -0.666 11.357 12.599
624 HG21 VAL 87 3HG2 VAL 87 -1.150 9.373 13.971
625 HG22 VAL 87 1HG2 VAL 87 -0.620 7.774 13.448
626 HG23 VAL 87 2HG2 VAL 87 -1.964 8.571 12.627
627 H ILE 88 H ILE 88 0.221 9.282 8.491
628 HA ILE 88 HA ILE 88 3.097 9.773 8.681
629 HB ILE 88 HB ILE 88 1.524 8.596 6.389
630 HG12 ILE 88 2HG1 ILE 88 3.661 7.465 8.203
631 HG13 ILE 88 1HG1 ILE 88 1.974 7.005 8.127
632 HG21 ILE 88 1HG2 ILE 88 4.449 9.322 6.474
633 HG22 ILE 88 2HG2 ILE 88 3.204 10.113 5.504
634 HG23 ILE 88 3HG2 ILE 88 3.646 8.436 5.174
635 HD11 ILE 88 3HD1 ILE 88 3.986 6.598 5.945
636 HD12 ILE 88 1HD1 ILE 88 2.288 6.129 5.889
637 HD13 ILE 88 2HD1 ILE 88 3.378 5.362 7.047
638 H ARG 89 H ARG 89 3.746 11.729 7.984
639 HA ARG 89 HA ARG 89 1.827 13.241 6.378
640 HB2 ARG 89 2HB ARG 89 3.633 14.469 8.462
641 HB3 ARG 89 1HB ARG 89 2.595 15.354 7.360
642 HG2 ARG 89 2HG ARG 89 0.682 14.109 8.405
643 HG3 ARG 89 1HG ARG 89 1.820 13.601 9.647
644 HD2 ARG 89 2HD ARG 89 0.775 15.576 10.511
645 HD3 ARG 89 1HD ARG 89 2.381 16.055 9.979
646 HE ARG 89 HE ARG 89 -0.143 16.620 8.593
647 HH11 ARG 89 1HH1 ARG 89 3.279 17.420 9.176
648 HH12 ARG 89 2HH1 ARG 89 3.280 18.760 8.156
649 HH21 ARG 89 1HH2 ARG 89 -0.134 18.523 7.220
650 HH22 ARG 89 2HH2 ARG 89 1.291 19.444 7.056
651 H LEU 90 H LEU 90 2.529 13.800 4.603
652 HA LEU 90 HA LEU 90 5.400 13.877 4.187
653 HB2 LEU 90 2HB LEU 90 4.981 13.675 1.749
654 HB3 LEU 90 1HB LEU 90 4.406 12.288 2.627
655 HG LEU 90 HG LEU 90 2.562 14.472 1.620
656 HD11 LEU 90 1HD1 LEU 90 3.779 13.496 -0.252
657 HD12 LEU 90 2HD1 LEU 90 2.101 12.941 -0.253
658 HD13 LEU 90 3HD1 LEU 90 3.383 11.876 0.315
659 HD21 LEU 90 3HD2 LEU 90 0.872 12.665 1.755
660 HD22 LEU 90 1HD2 LEU 90 1.550 13.017 3.339
661 HD23 LEU 90 2HD2 LEU 90 2.083 11.597 2.456
662 H GLY 91 H GLY 91 6.064 15.663 2.670
663 HA2 GLY 91 2HA GLY 91 5.600 18.094 3.828
664 HA3 GLY 91 1HA GLY 91 6.133 17.918 2.168
665 H HIS 92 H HIS 92 3.642 18.797 4.270
666 HA HIS 92 HA HIS 92 1.853 20.109 4.026
667 HB2 HIS 92 2HB HIS 92 2.593 20.066 1.128
668 HB3 HIS 92 1HB HIS 92 1.081 20.789 1.655
669 HD1 HIS 92 1HD HIS 92 1.678 23.143 1.142
670 HD2 HIS 92 2HD HIS 92 4.465 21.304 3.577
671 HE1 HIS 92 1HE HIS 92 3.236 24.993 1.949
672 H SER 93 H SER 93 1.803 17.022 3.690
673 HA SER 93 HA SER 93 -1.093 17.038 3.546
674 HB2 SER 93 2HB SER 93 0.554 15.290 1.700
675 HB3 SER 93 1HB SER 93 -1.176 15.095 1.978
676 HG SER 93 HG SER 93 -0.455 17.646 1.381
677 H GLU 94 H GLU 94 -2.070 15.444 4.803
678 HA GLU 94 HA GLU 94 -0.210 13.594 6.063
679 HB2 GLU 94 2HB GLU 94 -1.543 13.725 8.140
680 HB3 GLU 94 1HB GLU 94 -0.761 15.229 7.690
681 HG2 GLU 94 2HG GLU 94 -2.998 15.907 6.713
682 HG3 GLU 94 1HG GLU 94 -3.658 14.539 7.617
683 H ILE 95 H ILE 95 -0.811 11.548 6.455
684 HA ILE 95 HA ILE 95 -3.269 10.672 5.202
685 HB ILE 95 HB ILE 95 -1.405 10.812 3.518
686 HG12 ILE 95 2HG1 ILE 95 -1.626 8.441 2.703
687 HG13 ILE 95 1HG1 ILE 95 -2.574 8.136 4.162
688 HG21 ILE 95 1HG2 ILE 95 0.493 10.286 4.901
689 HG22 ILE 95 2HG2 ILE 95 0.395 9.178 3.531
690 HG23 ILE 95 3HG2 ILE 95 -0.114 8.645 5.136
691 HD11 ILE 95 3HD1 ILE 95 -3.203 10.102 1.984
692 HD12 ILE 95 1HD1 ILE 95 -4.089 9.944 3.501
693 HD13 ILE 95 2HD1 ILE 95 -4.062 8.607 2.379
694 H ILE 96 H ILE 96 -4.026 8.768 6.147
695 HA ILE 96 HA ILE 96 -2.391 7.618 8.316
696 HB ILE 96 HB ILE 96 -5.395 7.406 7.908
697 HG12 ILE 96 2HG1 ILE 96 -4.751 9.682 8.470
698 HG13 ILE 96 1HG1 ILE 96 -5.640 8.928 9.799
699 HG21 ILE 96 1HG2 ILE 96 -4.506 5.489 9.095
700 HG22 ILE 96 2HG2 ILE 96 -5.450 6.496 10.194
701 HG23 ILE 96 3HG2 ILE 96 -3.688 6.550 10.242
702 HD11 ILE 96 3HD1 ILE 96 -2.662 9.360 9.633
703 HD12 ILE 96 1HD1 ILE 96 -3.509 8.563 10.962
704 HD13 ILE 96 2HD1 ILE 96 -3.800 10.270 10.620
705 H VAL 97 H VAL 97 -1.857 5.534 8.168
706 HA VAL 97 HA VAL 97 -2.656 4.166 5.723
707 HB VAL 97 HB VAL 97 -0.375 3.598 7.633
708 HG11 VAL 97 1HG1 VAL 97 -1.154 2.171 5.086
709 HG12 VAL 97 2HG1 VAL 97 -1.262 1.515 6.723
710 HG13 VAL 97 3HG1 VAL 97 0.318 1.889 6.023
711 HG21 VAL 97 3HG2 VAL 97 1.004 4.216 5.703
712 HG22 VAL 97 1HG2 VAL 97 -0.062 5.538 6.194
713 HG23 VAL 97 2HG2 VAL 97 -0.461 4.554 4.784
714 H ARG 98 H ARG 98 -4.121 2.653 5.723
715 HA ARG 98 HA ARG 98 -4.708 1.207 8.208
716 HB2 ARG 98 2HB ARG 98 -6.557 1.984 5.942
717 HB3 ARG 98 1HB ARG 98 -7.005 1.019 7.342
718 HG2 ARG 98 2HG ARG 98 -5.937 3.791 7.545
719 HG3 ARG 98 1HG ARG 98 -7.674 3.459 7.408
720 HD2 ARG 98 2HD ARG 98 -5.886 2.302 9.551
721 HD3 ARG 98 1HD ARG 98 -6.775 3.809 9.747
722 HE ARG 98 HE ARG 98 -8.769 2.249 9.118
723 HH11 ARG 98 1HH1 ARG 98 -6.045 1.110 11.082
724 HH12 ARG 98 2HH1 ARG 98 -7.047 0.373 12.242
725 HH21 ARG 98 1HH2 ARG 98 -10.085 1.199 10.693
726 HH22 ARG 98 2HH2 ARG 98 -9.373 0.420 12.040
727 H MET 99 H MET 99 -4.599 -0.858 8.110
728 HA MET 99 HA MET 99 -4.274 -2.040 5.443
729 HB2 MET 99 2HB MET 99 -2.940 -2.996 7.992
730 HB3 MET 99 1HB MET 99 -2.901 -3.834 6.456
731 HG2 MET 99 2HG MET 99 -1.752 -1.921 5.433
732 HG3 MET 99 1HG MET 99 -1.737 -1.110 6.998
733 HE1 MET 99 3HE MET 99 0.595 -4.995 6.058
734 HE2 MET 99 1HE MET 99 -0.417 -4.151 4.890
735 HE3 MET 99 2HE MET 99 -1.153 -4.975 6.265
736 H HIS 100 H HIS 100 -5.823 -3.229 4.893
737 HA HIS 100 HA HIS 100 -7.556 -4.405 6.939
738 HB2 HIS 100 2HB HIS 100 -8.188 -3.724 4.050
739 HB3 HIS 100 1HB HIS 100 -9.327 -4.280 5.264
740 HD1 HIS 100 1HD HIS 100 -10.319 -2.481 6.824
741 HD2 HIS 100 2HD HIS 100 -7.402 -1.035 4.251
742 HE1 HIS 100 1HE HIS 100 -10.454 0.044 6.941
Start of MODEL 8
1 H1 GLY 1 1HT GLY 1 -12.831 -3.248 -10.438
2 H2 GLY 1 2HT GLY 1 -11.647 -3.924 -11.412
3 H3 GLY 1 3HT GLY 1 -12.030 -2.275 -11.569
4 HA2 GLY 1 1HA GLY 1 -9.984 -2.476 -10.378
5 HA3 GLY 1 2HA GLY 1 -11.249 -1.889 -9.304
6 H HIS 2 H HIS 2 -8.741 -3.942 -9.527
7 HA HIS 2 HA HIS 2 -9.583 -6.382 -8.527
8 HB2 HIS 2 2HB HIS 2 -6.937 -4.977 -8.216
9 HB3 HIS 2 1HB HIS 2 -7.231 -6.664 -7.832
10 HD1 HIS 2 1HD HIS 2 -6.529 -4.377 -10.698
11 HD2 HIS 2 2HD HIS 2 -7.651 -8.319 -10.049
12 HE1 HIS 2 1HE HIS 2 -6.103 -5.581 -12.863
13 H GLY 3 H GLY 3 -10.314 -6.969 -6.649
14 HA2 GLY 3 2HA GLY 3 -9.990 -5.189 -4.361
15 HA3 GLY 3 1HA GLY 3 -11.187 -6.477 -4.511
16 H SER 4 H SER 4 -7.712 -5.903 -4.274
17 HA SER 4 HA SER 4 -6.946 -8.518 -3.631
18 HB2 SER 4 2HB SER 4 -5.695 -5.986 -2.616
19 HB3 SER 4 1HB SER 4 -4.929 -7.563 -2.850
20 HG SER 4 HG SER 4 -5.377 -7.342 -5.093
21 H ALA 5 H ALA 5 -7.352 -9.645 -1.885
22 HA ALA 5 HA ALA 5 -8.504 -8.301 0.442
23 HB1 ALA 5 1HB ALA 5 -9.535 -10.466 0.893
24 HB2 ALA 5 2HB ALA 5 -8.717 -11.113 -0.545
25 HB3 ALA 5 3HB ALA 5 -9.937 -9.850 -0.720
26 H GLY 6 H GLY 6 -8.178 -10.032 2.422
27 HA2 GLY 6 2HA GLY 6 -6.689 -11.199 3.769
28 HA3 GLY 6 1HA GLY 6 -5.476 -11.094 2.496
29 H THR 7 H THR 7 -5.012 -8.724 1.990
30 HA THR 7 HA THR 7 -5.008 -7.025 4.331
31 HB THR 7 HB THR 7 -2.540 -7.803 2.758
32 HG1 THR 7 1HG THR 7 -3.597 -8.859 4.843
33 HG21 THR 7 3HG2 THR 7 -1.308 -6.232 4.226
34 HG22 THR 7 1HG2 THR 7 -2.841 -5.686 4.915
35 HG23 THR 7 2HG2 THR 7 -2.477 -5.413 3.202
36 H SER 8 H SER 8 -6.081 -5.358 3.523
37 HA SER 8 HA SER 8 -5.302 -4.367 0.868
38 HB2 SER 8 2HB SER 8 -7.707 -3.634 2.534
39 HB3 SER 8 1HB SER 8 -7.418 -3.225 0.850
40 HG SER 8 HG SER 8 -7.466 -5.608 0.464
41 H VAL 9 H VAL 9 -3.804 -2.763 1.095
42 HA VAL 9 HA VAL 9 -3.784 -1.287 3.584
43 HB VAL 9 HB VAL 9 -1.895 -1.027 1.223
44 HG11 VAL 9 1HG1 VAL 9 -1.972 0.970 2.647
45 HG12 VAL 9 2HG1 VAL 9 -0.430 0.133 2.835
46 HG13 VAL 9 3HG1 VAL 9 -1.681 -0.033 4.068
47 HG21 VAL 9 3HG2 VAL 9 -1.754 -3.248 2.204
48 HG22 VAL 9 1HG2 VAL 9 -1.554 -2.545 3.807
49 HG23 VAL 9 2HG2 VAL 9 -0.308 -2.314 2.582
50 H THR 10 H THR 10 -5.081 0.286 3.733
51 HA THR 10 HA THR 10 -5.821 1.781 1.340
52 HB THR 10 HB THR 10 -7.401 1.434 3.900
53 HG1 THR 10 1HG THR 10 -7.059 -0.523 2.755
54 HG21 THR 10 3HG2 THR 10 -8.204 2.366 1.124
55 HG22 THR 10 1HG2 THR 10 -7.978 3.415 2.523
56 HG23 THR 10 2HG2 THR 10 -9.280 2.226 2.515
57 H LEU 11 H LEU 11 -5.087 3.752 1.355
58 HA LEU 11 HA LEU 11 -4.085 4.820 3.824
59 HB2 LEU 11 2HB LEU 11 -3.036 6.563 2.467
60 HB3 LEU 11 1HB LEU 11 -2.622 4.978 1.889
61 HG LEU 11 HG LEU 11 -4.436 5.408 0.097
62 HD11 LEU 11 1HD1 LEU 11 -4.715 7.768 -0.534
63 HD12 LEU 11 2HD1 LEU 11 -3.873 8.253 0.937
64 HD13 LEU 11 3HD1 LEU 11 -5.424 7.420 1.044
65 HD21 LEU 11 3HD2 LEU 11 -1.805 6.873 0.119
66 HD22 LEU 11 1HD2 LEU 11 -2.769 6.555 -1.323
67 HD23 LEU 11 2HD2 LEU 11 -2.091 5.212 -0.408
68 H GLN 12 H GLN 12 -5.039 6.301 4.960
69 HA GLN 12 HA GLN 12 -7.619 7.335 4.015
70 HB2 GLN 12 2HB GLN 12 -7.461 5.801 6.068
71 HB3 GLN 12 1HB GLN 12 -6.564 7.079 6.851
72 HG2 GLN 12 2HG GLN 12 -9.433 7.249 5.924
73 HG3 GLN 12 1HG GLN 12 -8.908 6.971 7.576
74 HE21 GLN 12 1HE2 GLN 12 -7.919 8.688 8.685
75 HE22 GLN 12 2HE2 GLN 12 -8.161 10.326 8.184
76 H LEU 13 H LEU 13 -7.342 9.387 3.331
77 HA LEU 13 HA LEU 13 -5.291 11.064 4.584
78 HB2 LEU 13 2HB LEU 13 -4.558 10.414 2.391
79 HB3 LEU 13 1HB LEU 13 -6.118 10.775 1.699
80 HG LEU 13 HG LEU 13 -5.752 13.150 2.167
81 HD11 LEU 13 1HD1 LEU 13 -3.525 13.960 2.719
82 HD12 LEU 13 2HD1 LEU 13 -2.942 12.309 2.876
83 HD13 LEU 13 3HD1 LEU 13 -4.145 12.934 4.008
84 HD21 LEU 13 3HD2 LEU 13 -5.270 12.251 -0.027
85 HD22 LEU 13 1HD2 LEU 13 -3.634 11.832 0.479
86 HD23 LEU 13 2HD2 LEU 13 -4.117 13.525 0.372
87 H ASP 14 H ASP 14 -6.277 12.718 5.631
88 HA ASP 14 HA ASP 14 -8.644 13.763 4.315
89 HB2 ASP 14 2HB ASP 14 -9.484 12.505 6.204
90 HB3 ASP 14 1HB ASP 14 -8.454 13.426 7.305
91 H ASP 15 H ASP 15 -7.949 15.445 3.461
92 HA ASP 15 HA ASP 15 -6.445 17.532 4.800
93 HB2 ASP 15 2HB ASP 15 -8.161 17.970 2.366
94 HB3 ASP 15 1HB ASP 15 -6.585 18.647 2.740
95 H GLY 16 H GLY 16 -9.534 16.902 3.495
96 HA2 GLY 16 2HA GLY 16 -11.260 17.624 5.467
97 HA3 GLY 16 1HA GLY 16 -11.068 19.041 4.403
98 H SER 17 H SER 17 -10.939 15.600 3.923
99 HA SER 17 HA SER 17 -12.587 15.916 1.492
100 HB2 SER 17 2HB SER 17 -10.010 14.357 1.527
101 HB3 SER 17 1HB SER 17 -10.965 14.852 0.131
102 HG SER 17 HG SER 17 -8.910 16.090 1.068
103 H GLY 18 H GLY 18 -10.946 13.686 3.760
104 HA2 GLY 18 2HA GLY 18 -11.493 11.617 4.472
105 HA3 GLY 18 1HA GLY 18 -13.097 11.833 3.763
106 H ARG 19 H ARG 19 -9.788 11.693 2.499
107 HA ARG 19 HA ARG 19 -10.680 10.220 0.185
108 HB2 ARG 19 2HB ARG 19 -8.079 11.396 1.058
109 HB3 ARG 19 1HB ARG 19 -8.190 10.255 -0.272
110 HG2 ARG 19 2HG ARG 19 -9.587 11.817 -1.505
111 HG3 ARG 19 1HG ARG 19 -9.598 12.922 -0.124
112 HD2 ARG 19 2HD ARG 19 -7.273 13.332 -0.304
113 HD3 ARG 19 1HD ARG 19 -7.091 11.973 -1.419
114 HE ARG 19 HE ARG 19 -8.231 13.265 -3.084
115 HH11 ARG 19 1HH1 ARG 19 -7.089 15.286 -0.296
116 HH12 ARG 19 2HH1 ARG 19 -6.902 16.639 -1.264
117 HH21 ARG 19 1HH2 ARG 19 -7.859 15.184 -4.336
118 HH22 ARG 19 2HH2 ARG 19 -7.359 16.622 -3.579
119 H THR 20 H THR 20 -10.064 8.208 -0.270
120 HA THR 20 HA THR 20 -8.345 6.737 1.508
121 HB THR 20 HB THR 20 -10.030 4.825 1.593
122 HG1 THR 20 1HG THR 20 -11.492 6.509 0.188
123 HG21 THR 20 3HG2 THR 20 -9.460 6.045 3.593
124 HG22 THR 20 1HG2 THR 20 -11.205 5.752 3.603
125 HG23 THR 20 2HG2 THR 20 -10.560 7.343 3.153
126 H TYR 21 H TYR 21 -7.197 5.288 0.430
127 HA TYR 21 HA TYR 21 -8.051 4.416 -2.220
128 HB2 TYR 21 2HB TYR 21 -6.878 6.427 -2.761
129 HB3 TYR 21 1HB TYR 21 -5.584 6.058 -1.640
130 HD1 TYR 21 2HD TYR 21 -7.120 4.919 -4.848
131 HD2 TYR 21 1HD TYR 21 -3.649 5.004 -2.396
132 HE1 TYR 21 2HE TYR 21 -5.785 3.979 -6.698
133 HE2 TYR 21 1HE TYR 21 -2.313 4.079 -4.228
134 HH TYR 21 HH TYR 21 -2.524 2.902 -6.188
135 H GLN 22 H GLN 22 -7.589 2.336 -2.480
136 HA GLN 22 HA GLN 22 -5.803 1.078 -0.573
137 HB2 GLN 22 2HB GLN 22 -7.986 0.004 -0.993
138 HB3 GLN 22 1HB GLN 22 -7.580 -0.152 -2.698
139 HG2 GLN 22 2HG GLN 22 -5.691 -1.613 -2.095
140 HG3 GLN 22 1HG GLN 22 -6.140 -1.471 -0.404
141 HE21 GLN 22 1HE2 GLN 22 -5.955 -3.814 -2.096
142 HE22 GLN 22 2HE2 GLN 22 -7.520 -4.561 -2.016
143 H LEU 23 H LEU 23 -3.859 0.511 -1.048
144 HA LEU 23 HA LEU 23 -2.505 1.478 -3.276
145 HB2 LEU 23 2HB LEU 23 -1.729 -0.627 -1.300
146 HB3 LEU 23 1HB LEU 23 -0.625 0.021 -2.482
147 HG LEU 23 HG LEU 23 -1.949 1.550 -0.237
148 HD11 LEU 23 1HD1 LEU 23 -0.186 0.028 0.476
149 HD12 LEU 23 2HD1 LEU 23 0.297 1.711 0.653
150 HD13 LEU 23 3HD1 LEU 23 0.915 0.754 -0.694
151 HD21 LEU 23 3HD2 LEU 23 0.017 2.481 -2.336
152 HD22 LEU 23 1HD2 LEU 23 -0.484 3.409 -0.924
153 HD23 LEU 23 2HD2 LEU 23 -1.660 3.006 -2.169
154 H ARG 24 H ARG 24 -1.679 0.650 -5.048
155 HA ARG 24 HA ARG 24 -2.735 -1.900 -6.040
156 HB2 ARG 24 2HB ARG 24 -1.454 0.465 -7.432
157 HB3 ARG 24 1HB ARG 24 -1.858 -1.047 -8.224
158 HG2 ARG 24 2HG ARG 24 -3.921 0.656 -6.844
159 HG3 ARG 24 1HG ARG 24 -3.481 0.873 -8.537
160 HD2 ARG 24 2HD ARG 24 -5.458 -0.510 -8.383
161 HD3 ARG 24 1HD ARG 24 -4.108 -1.475 -8.967
162 HE ARG 24 HE ARG 24 -4.848 -1.515 -6.141
163 HH11 ARG 24 1HH1 ARG 24 -4.558 -3.289 -9.209
164 HH12 ARG 24 2HH1 ARG 24 -4.718 -4.818 -8.479
165 HH21 ARG 24 1HH2 ARG 24 -5.150 -3.539 -5.199
166 HH22 ARG 24 2HH2 ARG 24 -5.113 -4.986 -6.114
167 H GLU 25 H GLU 25 -1.223 -3.388 -7.004
168 HA GLU 25 HA GLU 25 1.209 -3.408 -5.545
169 HB2 GLU 25 2HB GLU 25 1.753 -5.553 -6.747
170 HB3 GLU 25 1HB GLU 25 0.268 -5.573 -5.825
171 HG2 GLU 25 2HG GLU 25 0.428 -5.220 -8.811
172 HG3 GLU 25 1HG GLU 25 0.147 -6.755 -7.994
173 H GLY 26 H GLY 26 3.125 -3.006 -6.023
174 HA2 GLY 26 2HA GLY 26 4.898 -2.492 -7.637
175 HA3 GLY 26 1HA GLY 26 3.655 -1.680 -8.604
176 H SER 27 H SER 27 5.494 0.042 -8.068
177 HA SER 27 HA SER 27 4.822 1.143 -5.507
178 HB2 SER 27 2HB SER 27 6.623 2.803 -5.968
179 HB3 SER 27 1HB SER 27 7.135 1.117 -5.990
180 HG SER 27 HG SER 27 8.022 1.932 -7.753
181 H ASN 28 H ASN 28 3.737 2.851 -5.084
182 HA ASN 28 HA ASN 28 2.265 4.024 -7.327
183 HB2 ASN 28 2HB ASN 28 1.545 4.054 -4.347
184 HB3 ASN 28 1HB ASN 28 0.570 4.741 -5.629
185 HD21 ASN 28 1HD2 ASN 28 2.152 1.548 -5.610
186 HD22 ASN 28 2HD2 ASN 28 0.732 0.604 -5.650
187 H ILE 29 H ILE 29 3.174 5.814 -7.940
188 HA ILE 29 HA ILE 29 5.028 7.173 -6.189
189 HB ILE 29 HB ILE 29 4.333 7.701 -9.090
190 HG12 ILE 29 2HG1 ILE 29 6.711 6.280 -7.861
191 HG13 ILE 29 1HG1 ILE 29 5.376 5.493 -8.693
192 HG21 ILE 29 1HG2 ILE 29 5.220 9.701 -7.979
193 HG22 ILE 29 2HG2 ILE 29 6.353 9.048 -9.157
194 HG23 ILE 29 3HG2 ILE 29 6.623 8.775 -7.433
195 HD11 ILE 29 3HD1 ILE 29 7.361 7.400 -9.916
196 HD12 ILE 29 1HD1 ILE 29 6.007 6.646 -10.759
197 HD13 ILE 29 2HD1 ILE 29 7.316 5.647 -10.130
198 H ILE 30 H ILE 30 4.554 8.887 -5.037
199 HA ILE 30 HA ILE 30 2.169 10.420 -5.704
200 HB ILE 30 HB ILE 30 3.620 10.148 -3.035
201 HG12 ILE 30 2HG1 ILE 30 0.899 9.119 -3.900
202 HG13 ILE 30 1HG1 ILE 30 2.332 8.131 -3.673
203 HG21 ILE 30 1HG2 ILE 30 1.641 11.394 -2.157
204 HG22 ILE 30 2HG2 ILE 30 1.295 11.843 -3.845
205 HG23 ILE 30 3HG2 ILE 30 2.809 12.307 -3.098
206 HD11 ILE 30 3HD1 ILE 30 2.327 8.692 -1.293
207 HD12 ILE 30 1HD1 ILE 30 0.811 7.949 -1.793
208 HD13 ILE 30 2HD1 ILE 30 0.893 9.689 -1.534
209 H GLY 31 H GLY 31 2.442 12.449 -6.318
210 HA2 GLY 31 2HA GLY 31 4.099 14.369 -5.440
211 HA3 GLY 31 1HA GLY 31 5.084 13.511 -6.639
212 H ARG 32 H ARG 32 4.810 15.876 -7.367
213 HA ARG 32 HA ARG 32 2.369 16.067 -8.983
214 HB2 ARG 32 2HB ARG 32 4.307 18.237 -8.157
215 HB3 ARG 32 1HB ARG 32 2.841 18.470 -9.101
216 HG2 ARG 32 2HG ARG 32 1.498 17.707 -7.198
217 HG3 ARG 32 1HG ARG 32 2.966 17.451 -6.289
218 HD2 ARG 32 2HD ARG 32 1.915 19.577 -5.677
219 HD3 ARG 32 1HD ARG 32 3.520 19.795 -6.361
220 HE ARG 32 HE ARG 32 2.510 20.574 -8.378
221 HH11 ARG 32 1HH1 ARG 32 0.213 20.227 -5.705
222 HH12 ARG 32 2HH1 ARG 32 -0.823 21.461 -6.256
223 HH21 ARG 32 1HH2 ARG 32 1.085 22.286 -9.112
224 HH22 ARG 32 2HH2 ARG 32 -0.326 22.645 -8.231
225 H GLY 33 H GLY 33 2.825 15.169 -10.876
226 HA2 GLY 33 2HA GLY 33 4.544 16.365 -12.685
227 HA3 GLY 33 1HA GLY 33 5.334 14.930 -12.024
228 H GLN 34 H GLN 34 4.983 14.580 -14.486
229 HA GLN 34 HA GLN 34 2.319 13.534 -14.990
230 HB2 GLN 34 2HB GLN 34 4.663 13.741 -16.880
231 HB3 GLN 34 1HB GLN 34 3.018 13.314 -17.316
232 HG2 GLN 34 2HG GLN 34 3.927 15.975 -16.228
233 HG3 GLN 34 1HG GLN 34 3.540 15.622 -17.906
234 HE21 GLN 34 1HE2 GLN 34 1.984 17.158 -17.993
235 HE22 GLN 34 2HE2 GLN 34 0.446 17.018 -17.227
236 H ASP 35 H ASP 35 5.464 12.453 -14.156
237 HA ASP 35 HA ASP 35 4.947 9.706 -14.944
238 HB2 ASP 35 2HB ASP 35 7.256 9.300 -14.200
239 HB3 ASP 35 1HB ASP 35 7.189 10.632 -15.344
240 H ALA 36 H ALA 36 4.242 11.686 -12.490
241 HA ALA 36 HA ALA 36 4.380 9.807 -10.290
242 HB1 ALA 36 1HB ALA 36 4.538 12.222 -9.873
243 HB2 ALA 36 2HB ALA 36 3.137 11.523 -9.059
244 HB3 ALA 36 3HB ALA 36 2.923 12.442 -10.547
245 H GLN 37 H GLN 37 2.311 9.218 -9.142
246 HA GLN 37 HA GLN 37 0.292 8.525 -11.127
247 HB2 GLN 37 2HB GLN 37 1.057 7.237 -8.515
248 HB3 GLN 37 1HB GLN 37 -0.310 6.745 -9.501
249 HG2 GLN 37 2HG GLN 37 2.596 6.649 -10.291
250 HG3 GLN 37 1HG GLN 37 1.585 5.270 -9.858
251 HE21 GLN 37 1HE2 GLN 37 3.031 5.815 -12.349
252 HE22 GLN 37 2HE2 GLN 37 1.833 5.802 -13.575
253 H PHE 38 H PHE 38 0.754 9.415 -7.765
254 HA PHE 38 HA PHE 38 -1.974 10.462 -7.712
255 HB2 PHE 38 2HB PHE 38 -1.590 8.651 -6.128
256 HB3 PHE 38 1HB PHE 38 -0.161 9.462 -5.515
257 HD1 PHE 38 1HD PHE 38 -3.855 9.820 -5.801
258 HD2 PHE 38 2HD PHE 38 -0.326 10.844 -3.682
259 HE1 PHE 38 1HE PHE 38 -5.214 10.855 -4.027
260 HE2 PHE 38 2HE PHE 38 -1.622 11.870 -1.935
261 HZ PHE 38 HZ PHE 38 -4.110 11.893 -2.082
262 H ARG 39 H ARG 39 -2.075 12.583 -7.793
263 HA ARG 39 HA ARG 39 0.373 14.096 -7.351
264 HB2 ARG 39 2HB ARG 39 -2.165 14.800 -8.827
265 HB3 ARG 39 1HB ARG 39 -0.938 15.988 -8.445
266 HG2 ARG 39 2HG ARG 39 -0.630 15.327 -10.720
267 HG3 ARG 39 1HG ARG 39 0.691 14.644 -9.789
268 HD2 ARG 39 2HD ARG 39 -0.399 12.460 -9.813
269 HD3 ARG 39 1HD ARG 39 -1.781 13.137 -10.674
270 HE ARG 39 HE ARG 39 0.687 13.598 -12.039
271 HH11 ARG 39 1HH1 ARG 39 -1.720 11.027 -11.534
272 HH12 ARG 39 2HH1 ARG 39 -1.485 10.332 -13.068
273 HH21 ARG 39 1HH2 ARG 39 1.000 12.628 -14.116
274 HH22 ARG 39 2HH2 ARG 39 0.110 11.261 -14.577
275 H LEU 40 H LEU 40 0.643 15.396 -5.692
276 HA LEU 40 HA LEU 40 -1.401 15.541 -3.710
277 HB2 LEU 40 2HB LEU 40 1.408 16.607 -3.795
278 HB3 LEU 40 1HB LEU 40 0.337 16.901 -2.444
279 HG LEU 40 HG LEU 40 1.333 14.209 -3.372
280 HD11 LEU 40 1HD1 LEU 40 2.516 14.194 -1.234
281 HD12 LEU 40 2HD1 LEU 40 1.939 15.831 -0.910
282 HD13 LEU 40 3HD1 LEU 40 3.038 15.534 -2.257
283 HD21 LEU 40 3HD2 LEU 40 0.246 13.357 -1.329
284 HD22 LEU 40 1HD2 LEU 40 -0.923 14.007 -2.477
285 HD23 LEU 40 2HD2 LEU 40 -0.459 14.949 -1.062
286 HA PRO 41 HA PRO 41 -3.270 19.329 -5.013
287 HB2 PRO 41 2HB PRO 41 -3.838 19.757 -2.139
288 HB3 PRO 41 1HB PRO 41 -4.956 19.668 -3.505
289 HG2 PRO 41 2HG PRO 41 -4.772 17.663 -1.770
290 HG3 PRO 41 1HG PRO 41 -4.968 17.347 -3.503
291 HD2 PRO 41 2HD PRO 41 -2.505 17.191 -1.815
292 HD3 PRO 41 1HD PRO 41 -3.084 16.104 -3.092
293 H ASP 42 H ASP 42 -0.888 19.419 -2.377
294 HA ASP 42 HA ASP 42 -0.747 22.339 -2.631
295 HB2 ASP 42 2HB ASP 42 -0.748 21.134 -0.315
296 HB3 ASP 42 1HB ASP 42 0.891 20.660 -0.804
297 H THR 43 H THR 43 1.622 23.158 -2.545
298 HA THR 43 HA THR 43 2.979 21.636 -4.599
299 HB THR 43 HB THR 43 2.073 23.788 -5.273
300 HG1 THR 43 1HG THR 43 3.936 24.437 -6.369
301 HG21 THR 43 3HG2 THR 43 2.307 25.037 -3.194
302 HG22 THR 43 1HG2 THR 43 3.110 25.893 -4.513
303 HG23 THR 43 2HG2 THR 43 4.063 24.974 -3.347
304 H GLY 44 H GLY 44 5.466 22.697 -4.549
305 HA2 GLY 44 2HA GLY 44 7.462 22.739 -3.246
306 HA3 GLY 44 1HA GLY 44 6.502 22.340 -1.817
307 H VAL 45 H VAL 45 5.254 20.478 -3.845
308 HA VAL 45 HA VAL 45 6.678 18.093 -3.109
309 HB VAL 45 HB VAL 45 4.088 18.543 -4.661
310 HG11 VAL 45 1HG1 VAL 45 3.613 16.226 -4.315
311 HG12 VAL 45 2HG1 VAL 45 5.141 16.012 -3.471
312 HG13 VAL 45 3HG1 VAL 45 5.133 16.399 -5.197
313 HG21 VAL 45 3HG2 VAL 45 2.972 17.871 -2.624
314 HG22 VAL 45 1HG2 VAL 45 3.950 19.319 -2.364
315 HG23 VAL 45 2HG2 VAL 45 4.526 17.744 -1.796
316 H SER 46 H SER 46 8.016 17.053 -4.476
317 HA SER 46 HA SER 46 8.714 18.181 -7.019
318 HB2 SER 46 2HB SER 46 9.616 15.615 -5.689
319 HB3 SER 46 1HB SER 46 10.453 16.493 -6.973
320 HG SER 46 HG SER 46 10.239 18.295 -5.310
321 H ARG 47 H ARG 47 9.104 16.220 -8.799
322 HA ARG 47 HA ARG 47 6.504 15.358 -9.530
323 HB2 ARG 47 2HB ARG 47 7.571 14.024 -11.335
324 HB3 ARG 47 1HB ARG 47 8.129 15.684 -11.308
325 HG2 ARG 47 2HG ARG 47 10.217 15.053 -10.348
326 HG3 ARG 47 1HG ARG 47 9.651 13.407 -10.069
327 HD2 ARG 47 2HD ARG 47 9.511 13.034 -12.469
328 HD3 ARG 47 1HD ARG 47 10.008 14.697 -12.771
329 HE ARG 47 HE ARG 47 12.100 14.092 -11.585
330 HH11 ARG 47 1HH1 ARG 47 10.223 11.461 -13.127
331 HH12 ARG 47 2HH1 ARG 47 11.576 10.611 -13.670
332 HH21 ARG 47 1HH2 ARG 47 13.996 12.841 -12.290
333 HH22 ARG 47 2HH2 ARG 47 13.788 11.389 -13.135
334 H ARG 48 H ARG 48 9.219 13.745 -8.060
335 HA ARG 48 HA ARG 48 7.372 11.693 -7.145
336 HB2 ARG 48 2HB ARG 48 10.352 11.421 -7.665
337 HB3 ARG 48 1HB ARG 48 9.312 10.165 -7.006
338 HG2 ARG 48 2HG ARG 48 8.024 10.140 -9.054
339 HG3 ARG 48 1HG ARG 48 9.045 11.376 -9.758
340 HD2 ARG 48 2HD ARG 48 10.978 9.804 -9.440
341 HD3 ARG 48 1HD ARG 48 9.808 8.579 -8.948
342 HE ARG 48 HE ARG 48 9.219 9.873 -11.465
343 HH11 ARG 48 1HH1 ARG 48 10.795 7.038 -10.022
344 HH12 ARG 48 2HH1 ARG 48 10.795 6.178 -11.485
345 HH21 ARG 48 1HH2 ARG 48 9.209 8.715 -13.346
346 HH22 ARG 48 2HH2 ARG 48 9.873 7.130 -13.439
347 H HIS 49 H HIS 49 6.884 12.340 -5.268
348 HA HIS 49 HA HIS 49 8.844 13.701 -3.572
349 HB2 HIS 49 2HB HIS 49 6.837 14.946 -3.889
350 HB3 HIS 49 1HB HIS 49 5.805 13.582 -3.528
351 HD2 HIS 49 2HD HIS 49 5.966 12.826 -0.689
352 HE1 HIS 49 1HE HIS 49 6.880 16.784 0.413
353 HE2 HIS 49 2HE HIS 49 6.600 14.406 1.199
354 H LEU 50 H LEU 50 6.798 10.910 -3.868
355 HA LEU 50 HA LEU 50 8.332 9.512 -1.963
356 HB2 LEU 50 2HB LEU 50 6.973 10.760 -0.414
357 HB3 LEU 50 1HB LEU 50 5.513 10.366 -1.276
358 HG LEU 50 HG LEU 50 7.090 8.135 -0.035
359 HD11 LEU 50 1HD1 LEU 50 5.927 8.520 2.065
360 HD12 LEU 50 2HD1 LEU 50 5.174 9.969 1.407
361 HD13 LEU 50 3HD1 LEU 50 6.917 9.922 1.670
362 HD21 LEU 50 3HD2 LEU 50 4.853 7.212 0.263
363 HD22 LEU 50 1HD2 LEU 50 5.107 7.678 -1.420
364 HD23 LEU 50 2HD2 LEU 50 4.147 8.704 -0.349
365 H GLU 51 H GLU 51 8.013 7.367 -2.156
366 HA GLU 51 HA GLU 51 5.931 6.510 -4.025
367 HB2 GLU 51 2HB GLU 51 7.491 4.814 -4.960
368 HB3 GLU 51 1HB GLU 51 7.939 6.460 -5.356
369 HG2 GLU 51 2HG GLU 51 9.624 6.380 -3.530
370 HG3 GLU 51 1HG GLU 51 9.149 4.711 -3.231
371 H ILE 52 H ILE 52 4.777 4.873 -3.375
372 HA ILE 52 HA ILE 52 5.719 3.382 -1.028
373 HB ILE 52 HB ILE 52 2.886 3.571 -2.111
374 HG12 ILE 52 2HG1 ILE 52 4.083 4.854 0.358
375 HG13 ILE 52 1HG1 ILE 52 3.678 5.708 -1.124
376 HG21 ILE 52 1HG2 ILE 52 2.281 2.449 -0.004
377 HG22 ILE 52 2HG2 ILE 52 3.996 2.336 0.408
378 HG23 ILE 52 3HG2 ILE 52 3.372 1.477 -0.999
379 HD11 ILE 52 3HD1 ILE 52 1.733 4.303 0.698
380 HD12 ILE 52 1HD1 ILE 52 1.315 5.159 -0.785
381 HD13 ILE 52 2HD1 ILE 52 1.981 6.046 0.584
382 H ARG 53 H ARG 53 6.593 1.524 -1.606
383 HA ARG 53 HA ARG 53 5.779 0.317 -4.136
384 HB2 ARG 53 2HB ARG 53 8.242 0.561 -3.292
385 HB3 ARG 53 1HB ARG 53 7.841 -0.842 -2.309
386 HG2 ARG 53 2HG ARG 53 7.166 -2.035 -4.351
387 HG3 ARG 53 1HG ARG 53 7.775 -0.683 -5.305
388 HD2 ARG 53 2HD ARG 53 9.940 -1.062 -3.904
389 HD3 ARG 53 1HD ARG 53 9.251 -2.659 -3.638
390 HE ARG 53 HE ARG 53 9.952 -1.491 -6.219
391 HH11 ARG 53 1HH1 ARG 53 8.909 -4.422 -4.481
392 HH12 ARG 53 2HH1 ARG 53 9.743 -5.469 -5.516
393 HH21 ARG 53 1HH2 ARG 53 11.059 -2.946 -7.644
394 HH22 ARG 53 2HH2 ARG 53 11.002 -4.623 -7.343
395 H TRP 54 H TRP 54 4.024 -0.841 -3.960
396 HA TRP 54 HA TRP 54 3.651 -2.266 -1.490
397 HB2 TRP 54 2HB TRP 54 1.770 -0.897 -1.959
398 HB3 TRP 54 1HB TRP 54 1.713 -1.419 -3.637
399 HD1 TRP 54 HD TRP 54 -0.313 -2.974 -4.030
400 HE1 TRP 54 1HE TRP 54 -1.584 -4.765 -2.702
401 HE3 TRP 54 3HE TRP 54 2.328 -2.800 0.327
402 HZ2 TRP 54 2HZ TRP 54 -1.491 -5.958 -0.161
403 HZ3 TRP 54 3HZ TRP 54 1.689 -4.297 2.151
404 HH2 TRP 54 HH TRP 54 -0.192 -5.853 1.917
405 H ASP 55 H ASP 55 4.235 -4.184 -1.443
406 HA ASP 55 HA ASP 55 3.987 -5.925 -3.798
407 HB2 ASP 55 2HB ASP 55 6.041 -5.785 -1.616
408 HB3 ASP 55 1HB ASP 55 5.650 -7.346 -2.313
409 H GLY 56 H GLY 56 3.484 -8.166 -3.130
410 HA2 GLY 56 2HA GLY 56 1.400 -8.144 -1.128
411 HA3 GLY 56 1HA GLY 56 1.904 -9.538 -2.080
412 H GLN 57 H GLN 57 3.426 -7.391 0.193
413 HA GLN 57 HA GLN 57 4.289 -9.559 1.970
414 HB2 GLN 57 2HB GLN 57 6.154 -7.492 0.745
415 HB3 GLN 57 1HB GLN 57 6.586 -8.627 2.007
416 HG2 GLN 57 2HG GLN 57 6.386 -10.468 0.488
417 HG3 GLN 57 1HG GLN 57 5.736 -9.409 -0.765
418 HE21 GLN 57 1HE2 GLN 57 8.565 -10.305 1.010
419 HE22 GLN 57 2HE2 GLN 57 9.712 -9.584 -0.053
420 H VAL 58 H VAL 58 5.118 -6.143 1.413
421 HA VAL 58 HA VAL 58 3.665 -5.174 3.698
422 HB VAL 58 HB VAL 58 5.656 -3.961 4.606
423 HG11 VAL 58 1HG1 VAL 58 5.991 -6.946 4.654
424 HG12 VAL 58 2HG1 VAL 58 4.980 -5.984 5.730
425 HG13 VAL 58 3HG1 VAL 58 6.736 -5.810 5.779
426 HG21 VAL 58 3HG2 VAL 58 7.081 -3.974 2.636
427 HG22 VAL 58 1HG2 VAL 58 7.263 -5.723 2.757
428 HG23 VAL 58 2HG2 VAL 58 7.931 -4.679 4.010
429 H ALA 59 H ALA 59 3.668 -2.795 3.640
430 HA ALA 59 HA ALA 59 3.989 -1.832 0.912
431 HB1 ALA 59 1HB ALA 59 2.705 0.125 1.694
432 HB2 ALA 59 2HB ALA 59 2.656 -0.581 3.320
433 HB3 ALA 59 3HB ALA 59 1.841 -1.383 1.987
434 H LEU 60 H LEU 60 5.912 -1.187 0.479
435 HA LEU 60 HA LEU 60 7.722 -0.260 2.515
436 HB2 LEU 60 2HB LEU 60 8.384 -1.806 0.720
437 HB3 LEU 60 1HB LEU 60 7.995 -0.564 -0.447
438 HG LEU 60 HG LEU 60 9.828 0.824 0.439
439 HD11 LEU 60 1HD1 LEU 60 10.415 -1.608 2.119
440 HD12 LEU 60 2HD1 LEU 60 9.885 -0.037 2.717
441 HD13 LEU 60 3HD1 LEU 60 11.468 -0.202 1.949
442 HD21 LEU 60 3HD2 LEU 60 10.574 -1.966 -0.404
443 HD22 LEU 60 1HD2 LEU 60 11.624 -0.546 -0.520
444 HD23 LEU 60 2HD2 LEU 60 10.130 -0.643 -1.471
445 H LEU 61 H LEU 61 7.859 1.791 3.059
446 HA LEU 61 HA LEU 61 6.730 3.858 1.331
447 HB2 LEU 61 2HB LEU 61 5.890 3.532 3.618
448 HB3 LEU 61 1HB LEU 61 7.460 3.822 4.288
449 HG LEU 61 HG LEU 61 5.931 5.695 4.639
450 HD11 LEU 61 1HD1 LEU 61 8.241 6.319 4.452
451 HD12 LEU 61 2HD1 LEU 61 7.204 7.571 3.773
452 HD13 LEU 61 3HD1 LEU 61 8.084 6.481 2.702
453 HD21 LEU 61 3HD2 LEU 61 4.990 6.977 2.853
454 HD22 LEU 61 1HD2 LEU 61 4.510 5.294 2.695
455 HD23 LEU 61 2HD2 LEU 61 5.778 5.947 1.651
456 H ALA 62 H ALA 62 8.187 4.969 0.144
457 HA ALA 62 HA ALA 62 10.792 5.507 1.355
458 HB1 ALA 62 1HB ALA 62 11.027 3.821 -0.429
459 HB2 ALA 62 2HB ALA 62 11.837 5.331 -0.829
460 HB3 ALA 62 3HB ALA 62 10.279 4.944 -1.569
461 H ASP 63 H ASP 63 11.202 7.556 1.527
462 HA ASP 63 HA ASP 63 9.382 9.515 0.316
463 HB2 ASP 63 2HB ASP 63 9.558 9.716 2.696
464 HB3 ASP 63 1HB ASP 63 11.312 9.660 2.633
465 H LEU 64 H LEU 64 10.030 11.051 -1.067
466 HA LEU 64 HA LEU 64 12.912 11.307 -1.697
467 HB2 LEU 64 2HB LEU 64 10.549 11.585 -3.574
468 HB3 LEU 64 1HB LEU 64 12.174 12.038 -3.977
469 HG LEU 64 HG LEU 64 11.590 10.099 -5.107
470 HD11 LEU 64 1HD1 LEU 64 13.468 9.386 -2.872
471 HD12 LEU 64 2HD1 LEU 64 13.870 10.152 -4.412
472 HD13 LEU 64 3HD1 LEU 64 13.298 8.485 -4.379
473 HD21 LEU 64 3HD2 LEU 64 9.787 9.235 -3.802
474 HD22 LEU 64 1HD2 LEU 64 10.881 8.791 -2.484
475 HD23 LEU 64 2HD2 LEU 64 10.984 7.971 -4.050
476 H ASN 65 H ASN 65 12.670 13.138 0.079
477 HA ASN 65 HA ASN 65 12.612 15.614 -1.280
478 HB2 ASN 65 2HB ASN 65 10.085 15.115 -1.045
479 HB3 ASN 65 1HB ASN 65 10.303 15.362 0.679
480 HD21 ASN 65 1HD2 ASN 65 8.730 16.816 -1.343
481 HD22 ASN 65 2HD2 ASN 65 9.213 18.469 -1.238
482 H SER 66 H SER 66 13.659 17.165 -0.125
483 HA SER 66 HA SER 66 14.699 16.327 2.450
484 HB2 SER 66 2HB SER 66 16.333 18.214 1.986
485 HB3 SER 66 1HB SER 66 16.378 16.853 0.862
486 HG SER 66 HG SER 66 15.826 18.126 -0.680
487 H THR 67 H THR 67 12.894 18.979 0.965
488 HA THR 67 HA THR 67 12.901 20.405 3.475
489 HB THR 67 HB THR 67 13.306 21.856 1.642
490 HG1 THR 67 1HG THR 67 11.680 23.346 1.822
491 HG21 THR 67 3HG2 THR 67 10.775 20.832 0.341
492 HG22 THR 67 1HG2 THR 67 12.422 20.478 -0.182
493 HG23 THR 67 2HG2 THR 67 11.801 22.123 -0.287
494 H ASN 68 H ASN 68 10.523 18.842 1.383
495 HA ASN 68 HA ASN 68 8.472 19.289 3.465
496 HB2 ASN 68 2HB ASN 68 8.146 18.522 0.539
497 HB3 ASN 68 1HB ASN 68 6.818 18.711 1.677
498 HD21 ASN 68 1HD2 ASN 68 6.138 20.834 2.230
499 HD22 ASN 68 2HD2 ASN 68 6.712 22.196 1.377
500 H GLY 69 H GLY 69 10.615 17.371 3.533
501 HA2 GLY 69 2HA GLY 69 10.110 14.765 2.784
502 HA3 GLY 69 1HA GLY 69 11.041 15.237 4.190
503 H THR 70 H THR 70 9.073 13.107 3.517
504 HA THR 70 HA THR 70 6.718 13.492 4.999
505 HB THR 70 HB THR 70 8.041 10.993 3.999
506 HG1 THR 70 1HG THR 70 7.776 12.157 2.281
507 HG21 THR 70 3HG2 THR 70 5.155 11.609 4.677
508 HG22 THR 70 1HG2 THR 70 6.223 10.540 5.582
509 HG23 THR 70 2HG2 THR 70 5.732 10.111 3.942
510 H THR 71 H THR 71 6.212 12.965 7.041
511 HA THR 71 HA THR 71 8.234 11.675 8.692
512 HB THR 71 HB THR 71 6.752 12.498 10.578
513 HG1 THR 71 1HG THR 71 5.812 14.563 9.016
514 HG21 THR 71 3HG2 THR 71 8.866 13.477 9.997
515 HG22 THR 71 1HG2 THR 71 7.734 14.720 10.545
516 HG23 THR 71 2HG2 THR 71 8.085 14.527 8.812
517 H VAL 72 H VAL 72 7.779 9.857 9.724
518 HA VAL 72 HA VAL 72 5.126 8.735 9.326
519 HB VAL 72 HB VAL 72 6.169 6.508 9.380
520 HG11 VAL 72 1HG1 VAL 72 5.774 7.586 7.195
521 HG12 VAL 72 2HG1 VAL 72 7.208 6.562 7.127
522 HG13 VAL 72 3HG1 VAL 72 7.375 8.313 7.268
523 HG21 VAL 72 3HG2 VAL 72 8.631 6.280 9.081
524 HG22 VAL 72 1HG2 VAL 72 8.188 6.994 10.635
525 HG23 VAL 72 2HG2 VAL 72 8.774 8.024 9.336
526 H ASN 73 H ASN 73 4.090 8.633 11.118
527 HA ASN 73 HA ASN 73 3.551 8.705 13.286
528 HB2 ASN 73 2HB ASN 73 5.957 6.873 13.477
529 HB3 ASN 73 1HB ASN 73 4.913 7.212 14.857
530 HD21 ASN 73 1HD2 ASN 73 5.401 4.711 13.389
531 HD22 ASN 73 2HD2 ASN 73 3.848 4.158 12.866
532 H ASN 74 H ASN 74 5.121 10.718 12.190
533 HA ASN 74 HA ASN 74 5.718 12.718 12.767
534 HB2 ASN 74 2HB ASN 74 4.738 12.670 14.968
535 HB3 ASN 74 1HB ASN 74 6.072 11.715 15.596
536 HD21 ASN 74 1HD2 ASN 74 5.103 14.850 14.478
537 HD22 ASN 74 2HD2 ASN 74 6.385 15.738 15.206
538 H ALA 75 H ALA 75 7.713 10.079 12.755
539 HA ALA 75 HA ALA 75 10.143 11.674 13.044
540 HB1 ALA 75 1HB ALA 75 11.336 9.550 12.897
541 HB2 ALA 75 2HB ALA 75 9.821 8.708 12.573
542 HB3 ALA 75 3HB ALA 75 10.087 9.481 14.137
543 HA PRO 76 HA PRO 76 10.148 12.013 8.508
544 HB2 PRO 76 2HB PRO 76 12.424 13.518 8.367
545 HB3 PRO 76 1HB PRO 76 10.836 14.216 8.700
546 HG2 PRO 76 2HG PRO 76 13.056 13.565 10.583
547 HG3 PRO 76 1HG PRO 76 11.940 14.941 10.598
548 HD2 PRO 76 2HD PRO 76 11.688 12.780 12.232
549 HD3 PRO 76 1HD PRO 76 10.309 13.752 11.700
550 H VAL 77 H VAL 77 10.913 10.461 7.279
551 HA VAL 77 HA VAL 77 13.602 9.395 7.796
552 HB VAL 77 HB VAL 77 12.835 7.071 7.538
553 HG11 VAL 77 1HG1 VAL 77 13.096 7.900 9.806
554 HG12 VAL 77 2HG1 VAL 77 11.754 6.757 9.717
555 HG13 VAL 77 3HG1 VAL 77 11.434 8.489 9.798
556 HG21 VAL 77 3HG2 VAL 77 10.425 6.538 7.710
557 HG22 VAL 77 1HG2 VAL 77 10.839 7.410 6.229
558 HG23 VAL 77 2HG2 VAL 77 10.070 8.261 7.567
559 H GLN 78 H GLN 78 14.094 7.727 6.019
560 HA GLN 78 HA GLN 78 13.265 8.875 3.453
561 HB2 GLN 78 2HB GLN 78 15.605 7.083 4.102
562 HB3 GLN 78 1HB GLN 78 15.264 7.801 2.537
563 HG2 GLN 78 2HG GLN 78 15.610 10.010 3.435
564 HG3 GLN 78 1HG GLN 78 15.871 9.341 5.047
565 HE21 GLN 78 1HE2 GLN 78 17.625 10.940 3.426
566 HE22 GLN 78 2HE2 GLN 78 19.071 10.018 3.218
567 H GLU 79 H GLU 79 13.384 5.930 5.376
568 HA GLU 79 HA GLU 79 11.548 4.711 3.515
569 HB2 GLU 79 2HB GLU 79 12.753 2.558 3.596
570 HB3 GLU 79 1HB GLU 79 13.667 3.814 2.783
571 HG2 GLU 79 2HG GLU 79 15.030 4.122 4.783
572 HG3 GLU 79 1HG GLU 79 14.097 2.870 5.608
573 H TRP 80 H TRP 80 10.212 3.210 4.447
574 HA TRP 80 HA TRP 80 10.399 2.449 7.205
575 HB2 TRP 80 2HB TRP 80 9.623 4.717 7.433
576 HB3 TRP 80 1HB TRP 80 8.328 4.484 6.270
577 HD1 TRP 80 HD TRP 80 6.129 3.273 7.215
578 HE1 TRP 80 1HE TRP 80 5.259 2.897 9.614
579 HE3 TRP 80 3HE TRP 80 10.444 4.200 9.773
580 HZ2 TRP 80 2HZ TRP 80 6.281 3.009 12.232
581 HZ3 TRP 80 3HZ TRP 80 10.412 4.052 12.221
582 HH2 TRP 80 HH TRP 80 8.366 3.467 13.424
583 H GLN 81 H GLN 81 8.847 0.817 7.587
584 HA GLN 81 HA GLN 81 7.359 0.101 5.191
585 HB2 GLN 81 2HB GLN 81 7.241 -2.247 6.093
586 HB3 GLN 81 1HB GLN 81 8.848 -1.695 5.656
587 HG2 GLN 81 2HG GLN 81 9.327 -1.291 8.021
588 HG3 GLN 81 1HG GLN 81 7.729 -1.913 8.436
589 HE21 GLN 81 1HE2 GLN 81 10.870 -2.714 7.177
590 HE22 GLN 81 2HE2 GLN 81 10.747 -4.413 7.418
591 H LEU 82 H LEU 82 5.441 0.661 5.190
592 HA LEU 82 HA LEU 82 4.049 1.837 7.299
593 HB2 LEU 82 2HB LEU 82 2.882 0.572 4.840
594 HB3 LEU 82 1HB LEU 82 2.107 1.748 5.873
595 HG LEU 82 HG LEU 82 4.544 2.258 4.193
596 HD11 LEU 82 1HD1 LEU 82 2.553 1.931 2.828
597 HD12 LEU 82 2HD1 LEU 82 3.041 3.624 2.819
598 HD13 LEU 82 3HD1 LEU 82 1.673 3.105 3.801
599 HD21 LEU 82 3HD2 LEU 82 4.508 3.637 6.182
600 HD22 LEU 82 1HD2 LEU 82 2.841 4.102 5.853
601 HD23 LEU 82 2HD2 LEU 82 4.122 4.607 4.761
602 H ALA 83 H ALA 83 3.150 0.970 9.005
603 HA ALA 83 HA ALA 83 2.003 -1.706 8.793
604 HB1 ALA 83 1HB ALA 83 2.952 -0.156 11.208
605 HB2 ALA 83 2HB ALA 83 3.750 -1.563 10.494
606 HB3 ALA 83 3HB ALA 83 2.173 -1.732 11.261
607 H ASP 84 H ASP 84 0.048 -1.890 10.205
608 HA ASP 84 HA ASP 84 -1.858 0.048 9.431
609 HB2 ASP 84 2HB ASP 84 -2.485 -2.267 9.718
610 HB3 ASP 84 1HB ASP 84 -2.033 -2.215 11.416
611 H GLY 85 H GLY 85 -2.423 1.857 10.370
612 HA2 GLY 85 2HA GLY 85 -3.113 3.128 12.233
613 HA3 GLY 85 1HA GLY 85 -2.060 2.158 13.250
614 H ASP 86 H ASP 86 -0.235 2.807 10.620
615 HA ASP 86 HA ASP 86 1.305 4.740 12.071
616 HB2 ASP 86 2HB ASP 86 1.711 3.562 9.312
617 HB3 ASP 86 1HB ASP 86 2.754 4.812 9.962
618 H VAL 87 H VAL 87 1.643 6.830 11.724
619 HA VAL 87 HA VAL 87 -0.300 8.200 9.987
620 HB VAL 87 HB VAL 87 1.305 9.397 12.273
621 HG11 VAL 87 1HG1 VAL 87 0.614 11.035 10.617
622 HG12 VAL 87 2HG1 VAL 87 -0.287 11.254 12.119
623 HG13 VAL 87 3HG1 VAL 87 -1.055 10.480 10.737
624 HG21 VAL 87 3HG2 VAL 87 -1.576 8.470 12.252
625 HG22 VAL 87 1HG2 VAL 87 -0.781 9.315 13.580
626 HG23 VAL 87 2HG2 VAL 87 -0.249 7.699 13.118
627 H ILE 88 H ILE 88 0.441 8.977 8.179
628 HA ILE 88 HA ILE 88 3.299 9.540 7.909
629 HB ILE 88 HB ILE 88 1.241 8.486 5.949
630 HG12 ILE 88 2HG1 ILE 88 3.013 6.768 5.457
631 HG13 ILE 88 1HG1 ILE 88 3.968 7.473 6.748
632 HG21 ILE 88 1HG2 ILE 88 2.338 10.252 4.758
633 HG22 ILE 88 2HG2 ILE 88 2.844 8.687 4.118
634 HG23 ILE 88 3HG2 ILE 88 3.920 9.597 5.179
635 HD11 ILE 88 3HD1 ILE 88 2.856 5.441 7.467
636 HD12 ILE 88 1HD1 ILE 88 1.291 6.141 7.052
637 HD13 ILE 88 2HD1 ILE 88 2.247 6.841 8.351
638 H ARG 89 H ARG 89 3.743 11.680 7.614
639 HA ARG 89 HA ARG 89 1.643 13.309 6.349
640 HB2 ARG 89 2HB ARG 89 1.991 13.996 8.726
641 HB3 ARG 89 1HB ARG 89 3.678 14.338 8.351
642 HG2 ARG 89 2HG ARG 89 2.878 15.977 6.634
643 HG3 ARG 89 1HG ARG 89 1.247 15.730 7.241
644 HD2 ARG 89 2HD ARG 89 3.595 16.754 8.828
645 HD3 ARG 89 1HD ARG 89 2.297 17.740 8.171
646 HE ARG 89 HE ARG 89 1.040 15.913 9.752
647 HH11 ARG 89 1HH1 ARG 89 3.633 18.267 10.253
648 HH12 ARG 89 2HH1 ARG 89 3.318 18.542 11.884
649 HH21 ARG 89 1HH2 ARG 89 0.522 16.291 11.986
650 HH22 ARG 89 2HH2 ARG 89 1.451 17.349 12.930
651 H LEU 90 H LEU 90 2.172 13.922 4.440
652 HA LEU 90 HA LEU 90 4.973 14.466 3.776
653 HB2 LEU 90 2HB LEU 90 4.736 13.461 1.587
654 HB3 LEU 90 1HB LEU 90 4.359 12.264 2.791
655 HG LEU 90 HG LEU 90 2.283 13.729 1.135
656 HD11 LEU 90 1HD1 LEU 90 3.461 10.982 0.789
657 HD12 LEU 90 2HD1 LEU 90 3.717 12.367 -0.275
658 HD13 LEU 90 3HD1 LEU 90 2.113 11.648 -0.125
659 HD21 LEU 90 3HD2 LEU 90 0.788 11.925 1.849
660 HD22 LEU 90 1HD2 LEU 90 1.383 12.829 3.238
661 HD23 LEU 90 2HD2 LEU 90 2.070 11.252 2.852
662 H GLY 91 H GLY 91 5.255 16.244 2.480
663 HA2 GLY 91 2HA GLY 91 4.522 18.574 2.551
664 HA3 GLY 91 1HA GLY 91 4.276 17.943 0.943
665 H HIS 92 H HIS 92 2.793 18.838 3.938
666 HA HIS 92 HA HIS 92 0.844 19.886 4.475
667 HB2 HIS 92 2HB HIS 92 1.062 21.068 2.298
668 HB3 HIS 92 1HB HIS 92 0.202 19.767 1.513
669 HD1 HIS 92 1HD HIS 92 -0.314 23.018 3.129
670 HD2 HIS 92 2HD HIS 92 -2.616 19.672 2.277
671 HE1 HIS 92 1HE HIS 92 -2.706 23.776 3.218
672 H SER 93 H SER 93 0.859 16.852 2.953
673 HA SER 93 HA SER 93 -1.958 16.310 3.429
674 HB2 SER 93 2HB SER 93 0.142 14.548 2.182
675 HB3 SER 93 1HB SER 93 -1.607 14.379 2.055
676 HG SER 93 HG SER 93 0.110 16.250 0.893
677 H GLU 94 H GLU 94 -2.591 15.031 5.152
678 HA GLU 94 HA GLU 94 -0.532 13.386 6.377
679 HB2 GLU 94 2HB GLU 94 -1.488 13.822 8.619
680 HB3 GLU 94 1HB GLU 94 -0.785 15.241 7.869
681 HG2 GLU 94 2HG GLU 94 -3.124 15.858 7.173
682 HG3 GLU 94 1HG GLU 94 -3.674 14.584 8.261
683 H ILE 95 H ILE 95 -0.930 11.395 6.437
684 HA ILE 95 HA ILE 95 -3.645 10.460 6.023
685 HB ILE 95 HB ILE 95 -2.854 10.515 3.863
686 HG12 ILE 95 2HG1 ILE 95 -3.569 8.125 4.527
687 HG13 ILE 95 1HG1 ILE 95 -2.726 8.369 2.998
688 HG21 ILE 95 1HG2 ILE 95 -0.637 11.210 4.189
689 HG22 ILE 95 2HG2 ILE 95 -0.634 9.853 3.062
690 HG23 ILE 95 3HG2 ILE 95 -0.154 9.607 4.739
691 HD11 ILE 95 3HD1 ILE 95 -1.961 6.337 4.199
692 HD12 ILE 95 1HD1 ILE 95 -1.458 7.354 5.547
693 HD13 ILE 95 2HD1 ILE 95 -0.660 7.508 3.982
694 H ILE 96 H ILE 96 -4.165 8.567 6.898
695 HA ILE 96 HA ILE 96 -2.200 7.298 8.675
696 HB ILE 96 HB ILE 96 -5.247 7.297 8.807
697 HG12 ILE 96 2HG1 ILE 96 -4.844 8.256 11.147
698 HG13 ILE 96 1HG1 ILE 96 -3.172 8.488 10.665
699 HG21 ILE 96 1HG2 ILE 96 -3.344 5.794 10.592
700 HG22 ILE 96 2HG2 ILE 96 -4.471 5.100 9.431
701 HG23 ILE 96 3HG2 ILE 96 -5.082 5.950 10.852
702 HD11 ILE 96 3HD1 ILE 96 -5.587 9.778 9.406
703 HD12 ILE 96 1HD1 ILE 96 -3.913 10.015 8.900
704 HD13 ILE 96 2HD1 ILE 96 -4.433 10.546 10.499
705 H VAL 97 H VAL 97 -1.681 5.200 8.313
706 HA VAL 97 HA VAL 97 -2.783 3.949 5.940
707 HB VAL 97 HB VAL 97 -0.389 3.263 7.670
708 HG11 VAL 97 1HG1 VAL 97 0.093 1.446 6.081
709 HG12 VAL 97 2HG1 VAL 97 -1.423 1.789 5.242
710 HG13 VAL 97 3HG1 VAL 97 -1.451 1.180 6.897
711 HG21 VAL 97 3HG2 VAL 97 -0.658 4.038 4.788
712 HG22 VAL 97 1HG2 VAL 97 0.851 3.780 5.659
713 HG23 VAL 97 2HG2 VAL 97 -0.208 5.139 6.088
714 H ARG 98 H ARG 98 -4.284 2.469 5.984
715 HA ARG 98 HA ARG 98 -4.766 1.021 8.475
716 HB2 ARG 98 2HB ARG 98 -6.646 2.187 6.452
717 HB3 ARG 98 1HB ARG 98 -7.143 0.856 7.489
718 HG2 ARG 98 2HG ARG 98 -6.001 3.404 8.580
719 HG3 ARG 98 1HG ARG 98 -7.729 3.172 8.273
720 HD2 ARG 98 2HD ARG 98 -6.070 1.327 10.004
721 HD3 ARG 98 1HD ARG 98 -7.026 2.678 10.616
722 HE ARG 98 HE ARG 98 -8.976 1.597 9.614
723 HH11 ARG 98 1HH1 ARG 98 -6.188 -0.564 10.342
724 HH12 ARG 98 2HH1 ARG 98 -7.199 -1.890 10.621
725 HH21 ARG 98 1HH2 ARG 98 -10.248 -0.286 9.961
726 HH22 ARG 98 2HH2 ARG 98 -9.507 -1.774 10.356
727 H MET 99 H MET 99 -4.681 -1.071 8.376
728 HA MET 99 HA MET 99 -4.640 -2.318 5.727
729 HB2 MET 99 2HB MET 99 -3.570 -3.357 8.342
730 HB3 MET 99 1HB MET 99 -3.667 -4.309 6.880
731 HG2 MET 99 2HG MET 99 -2.181 -2.683 5.760
732 HG3 MET 99 1HG MET 99 -1.997 -1.848 7.302
733 HE1 MET 99 3HE MET 99 1.442 -3.716 6.753
734 HE2 MET 99 1HE MET 99 0.664 -2.147 6.977
735 HE3 MET 99 2HE MET 99 0.406 -3.055 5.488
736 H HIS 100 H HIS 100 -6.420 -3.058 5.194
737 HA HIS 100 HA HIS 100 -8.334 -3.972 7.187
738 HB2 HIS 100 2HB HIS 100 -8.636 -3.327 4.244
739 HB3 HIS 100 1HB HIS 100 -9.918 -4.036 5.211
740 HD1 HIS 100 1HD HIS 100 -11.306 -2.435 6.609
741 HD2 HIS 100 2HD HIS 100 -7.922 -0.658 4.993
742 HE1 HIS 100 1HE HIS 100 -11.564 0.049 6.994
Start of MODEL 9
1 H1 GLY 1 1HT GLY 1 -1.533 -8.987 -8.655
2 H2 GLY 1 2HT GLY 1 -2.092 -10.479 -8.060
3 H3 GLY 1 3HT GLY 1 -3.086 -9.117 -8.029
4 HA2 GLY 1 1HA GLY 1 -3.230 -9.067 -10.378
5 HA3 GLY 1 2HA GLY 1 -2.159 -10.468 -10.463
6 H HIS 2 H HIS 2 -4.925 -10.149 -11.393
7 HA HIS 2 HA HIS 2 -6.805 -11.259 -11.581
8 HB2 HIS 2 2HB HIS 2 -5.276 -13.254 -11.544
9 HB3 HIS 2 1HB HIS 2 -5.617 -13.415 -9.825
10 HD1 HIS 2 1HD HIS 2 -7.605 -14.864 -9.274
11 HD2 HIS 2 2HD HIS 2 -7.667 -13.374 -13.131
12 HE1 HIS 2 1HE HIS 2 -9.606 -15.929 -10.384
13 H GLY 3 H GLY 3 -5.958 -12.109 -8.268
14 HA2 GLY 3 2HA GLY 3 -8.644 -11.248 -7.497
15 HA3 GLY 3 1HA GLY 3 -7.617 -12.357 -6.594
16 H SER 4 H SER 4 -8.817 -10.289 -5.388
17 HA SER 4 HA SER 4 -6.960 -8.098 -5.144
18 HB2 SER 4 2HB SER 4 -9.414 -8.748 -3.501
19 HB3 SER 4 1HB SER 4 -8.609 -7.185 -3.654
20 HG SER 4 HG SER 4 -9.132 -7.892 -6.080
21 H ALA 5 H ALA 5 -5.588 -7.831 -3.420
22 HA ALA 5 HA ALA 5 -4.788 -10.076 -1.893
23 HB1 ALA 5 1HB ALA 5 -4.218 -7.136 -1.517
24 HB2 ALA 5 2HB ALA 5 -3.259 -8.260 -2.477
25 HB3 ALA 5 3HB ALA 5 -3.361 -8.457 -0.724
26 H GLY 6 H GLY 6 -5.359 -10.617 0.183
27 HA2 GLY 6 2HA GLY 6 -7.848 -9.792 1.189
28 HA3 GLY 6 1HA GLY 6 -6.640 -10.656 2.127
29 H THR 7 H THR 7 -4.606 -9.007 2.383
30 HA THR 7 HA THR 7 -5.589 -6.960 4.092
31 HB THR 7 HB THR 7 -2.807 -7.630 3.115
32 HG1 THR 7 1HG THR 7 -3.848 -9.159 4.446
33 HG21 THR 7 3HG2 THR 7 -2.887 -5.279 3.751
34 HG22 THR 7 1HG2 THR 7 -1.994 -6.190 4.967
35 HG23 THR 7 2HG2 THR 7 -3.658 -5.681 5.291
36 H SER 8 H SER 8 -6.347 -5.136 3.367
37 HA SER 8 HA SER 8 -5.425 -4.103 0.791
38 HB2 SER 8 2HB SER 8 -7.709 -3.177 2.513
39 HB3 SER 8 1HB SER 8 -7.421 -2.794 0.819
40 HG SER 8 HG SER 8 -7.705 -5.470 1.634
41 H VAL 9 H VAL 9 -3.777 -2.647 0.986
42 HA VAL 9 HA VAL 9 -3.613 -1.081 3.441
43 HB VAL 9 HB VAL 9 -1.757 -0.923 1.041
44 HG11 VAL 9 1HG1 VAL 9 -0.162 0.009 2.674
45 HG12 VAL 9 2HG1 VAL 9 -1.392 -0.120 3.929
46 HG13 VAL 9 3HG1 VAL 9 -1.638 0.969 2.566
47 HG21 VAL 9 3HG2 VAL 9 -0.222 -2.414 2.268
48 HG22 VAL 9 1HG2 VAL 9 -1.732 -3.218 1.845
49 HG23 VAL 9 2HG2 VAL 9 -1.463 -2.663 3.493
50 H THR 10 H THR 10 -4.454 0.844 3.536
51 HA THR 10 HA THR 10 -5.215 2.180 1.065
52 HB THR 10 HB THR 10 -7.010 1.603 3.436
53 HG1 THR 10 1HG THR 10 -6.431 0.276 1.156
54 HG21 THR 10 3HG2 THR 10 -7.626 2.914 0.776
55 HG22 THR 10 1HG2 THR 10 -7.492 3.757 2.321
56 HG23 THR 10 2HG2 THR 10 -8.785 2.586 2.069
57 H LEU 11 H LEU 11 -4.771 4.272 1.189
58 HA LEU 11 HA LEU 11 -4.077 5.317 3.793
59 HB2 LEU 11 2HB LEU 11 -3.204 7.327 2.586
60 HB3 LEU 11 1HB LEU 11 -2.345 5.845 2.263
61 HG LEU 11 HG LEU 11 -4.423 6.821 0.316
62 HD11 LEU 11 1HD1 LEU 11 -2.637 8.058 -0.849
63 HD12 LEU 11 2HD1 LEU 11 -1.523 7.694 0.469
64 HD13 LEU 11 3HD1 LEU 11 -2.922 8.732 0.753
65 HD21 LEU 11 3HD2 LEU 11 -2.892 5.721 -1.263
66 HD22 LEU 11 1HD2 LEU 11 -3.472 4.599 -0.028
67 HD23 LEU 11 2HD2 LEU 11 -1.849 5.275 0.082
68 H GLN 12 H GLN 12 -5.236 6.650 4.856
69 HA GLN 12 HA GLN 12 -7.877 7.333 3.800
70 HB2 GLN 12 2HB GLN 12 -7.261 6.050 6.044
71 HB3 GLN 12 1HB GLN 12 -6.967 7.659 6.628
72 HG2 GLN 12 2HG GLN 12 -9.622 6.868 5.450
73 HG3 GLN 12 1HG GLN 12 -9.245 6.712 7.157
74 HE21 GLN 12 1HE2 GLN 12 -9.935 8.911 4.556
75 HE22 GLN 12 2HE2 GLN 12 -10.175 10.294 5.573
76 H LEU 13 H LEU 13 -7.877 9.288 2.896
77 HA LEU 13 HA LEU 13 -6.131 11.370 3.928
78 HB2 LEU 13 2HB LEU 13 -5.880 10.907 1.578
79 HB3 LEU 13 1HB LEU 13 -7.609 11.023 1.325
80 HG LEU 13 HG LEU 13 -7.513 13.391 1.897
81 HD11 LEU 13 1HD1 LEU 13 -5.338 14.558 1.913
82 HD12 LEU 13 2HD1 LEU 13 -4.518 12.995 1.904
83 HD13 LEU 13 3HD1 LEU 13 -5.532 13.458 3.274
84 HD21 LEU 13 3HD2 LEU 13 -7.491 12.722 -0.415
85 HD22 LEU 13 1HD2 LEU 13 -5.735 12.537 -0.383
86 HD23 LEU 13 2HD2 LEU 13 -6.462 14.136 -0.201
87 H ASP 14 H ASP 14 -7.107 12.706 5.346
88 HA ASP 14 HA ASP 14 -9.982 13.082 5.096
89 HB2 ASP 14 2HB ASP 14 -9.060 12.583 7.364
90 HB3 ASP 14 1HB ASP 14 -8.070 14.031 7.245
91 H ASP 15 H ASP 15 -10.202 14.340 3.497
92 HA ASP 15 HA ASP 15 -9.178 16.974 3.866
93 HB2 ASP 15 2HB ASP 15 -7.557 15.921 2.367
94 HB3 ASP 15 1HB ASP 15 -8.862 15.509 1.252
95 H GLY 16 H GLY 16 -11.371 17.242 4.415
96 HA2 GLY 16 2HA GLY 16 -13.218 18.514 3.518
97 HA3 GLY 16 1HA GLY 16 -13.138 17.505 2.077
98 H SER 17 H SER 17 -13.305 15.063 2.711
99 HA SER 17 HA SER 17 -15.542 14.822 4.622
100 HB2 SER 17 2HB SER 17 -15.374 13.434 1.951
101 HB3 SER 17 1HB SER 17 -16.692 13.336 3.121
102 HG SER 17 HG SER 17 -16.874 15.623 2.897
103 H GLY 18 H GLY 18 -12.913 13.127 2.987
104 HA2 GLY 18 2HA GLY 18 -11.580 11.681 4.499
105 HA3 GLY 18 1HA GLY 18 -13.128 11.015 5.013
106 H ARG 19 H ARG 19 -10.848 11.231 2.414
107 HA ARG 19 HA ARG 19 -12.313 9.184 0.932
108 HB2 ARG 19 2HB ARG 19 -10.234 11.185 0.110
109 HB3 ARG 19 1HB ARG 19 -10.557 9.739 -0.842
110 HG2 ARG 19 2HG ARG 19 -12.809 10.406 -1.240
111 HG3 ARG 19 1HG ARG 19 -12.684 11.736 -0.087
112 HD2 ARG 19 2HD ARG 19 -11.011 11.515 -2.584
113 HD3 ARG 19 1HD ARG 19 -12.542 12.389 -2.509
114 HE ARG 19 HE ARG 19 -11.389 13.618 -0.603
115 HH11 ARG 19 1HH1 ARG 19 -9.655 12.493 -3.495
116 HH12 ARG 19 2HH1 ARG 19 -8.558 13.787 -3.501
117 HH21 ARG 19 1HH2 ARG 19 -9.849 15.465 -0.661
118 HH22 ARG 19 2HH2 ARG 19 -8.670 15.476 -1.862
119 H THR 20 H THR 20 -10.857 7.619 -0.234
120 HA THR 20 HA THR 20 -8.625 6.763 1.429
121 HB THR 20 HB THR 20 -9.611 4.423 1.291
122 HG1 THR 20 1HG THR 20 -11.556 5.818 0.011
123 HG21 THR 20 3HG2 THR 20 -9.569 5.670 3.399
124 HG22 THR 20 1HG2 THR 20 -11.072 4.746 3.269
125 HG23 THR 20 2HG2 THR 20 -11.063 6.488 2.945
126 H TYR 21 H TYR 21 -7.069 5.731 0.242
127 HA TYR 21 HA TYR 21 -7.714 5.007 -2.536
128 HB2 TYR 21 2HB TYR 21 -6.373 7.120 -2.421
129 HB3 TYR 21 1HB TYR 21 -5.137 6.254 -1.530
130 HD1 TYR 21 2HD TYR 21 -3.733 4.562 -2.691
131 HD2 TYR 21 1HD TYR 21 -6.552 6.931 -4.810
132 HE1 TYR 21 2HE TYR 21 -2.586 4.019 -4.798
133 HE2 TYR 21 1HE TYR 21 -5.414 6.395 -6.931
134 HH TYR 21 HH TYR 21 -3.040 3.949 -7.154
135 H GLN 22 H GLN 22 -7.388 2.917 -2.832
136 HA GLN 22 HA GLN 22 -5.868 1.409 -0.885
137 HB2 GLN 22 2HB GLN 22 -8.143 0.661 -1.785
138 HB3 GLN 22 1HB GLN 22 -7.371 0.401 -3.333
139 HG2 GLN 22 2HG GLN 22 -6.497 -1.047 -0.836
140 HG3 GLN 22 1HG GLN 22 -7.788 -1.649 -1.859
141 HE21 GLN 22 1HE2 GLN 22 -5.308 -2.937 -1.215
142 HE22 GLN 22 2HE2 GLN 22 -4.447 -3.153 -2.695
143 H LEU 23 H LEU 23 -3.868 0.820 -1.189
144 HA LEU 23 HA LEU 23 -2.372 1.797 -3.401
145 HB2 LEU 23 2HB LEU 23 -1.720 0.007 -1.098
146 HB3 LEU 23 1HB LEU 23 -0.520 0.447 -2.276
147 HG LEU 23 HG LEU 23 -1.989 2.347 -0.434
148 HD11 LEU 23 1HD1 LEU 23 0.853 1.374 -0.469
149 HD12 LEU 23 2HD1 LEU 23 -0.382 0.936 0.709
150 HD13 LEU 23 3HD1 LEU 23 0.201 2.600 0.620
151 HD21 LEU 23 3HD2 LEU 23 -0.399 4.023 -1.249
152 HD22 LEU 23 1HD2 LEU 23 -1.425 3.428 -2.554
153 HD23 LEU 23 2HD2 LEU 23 0.238 2.855 -2.400
154 H ARG 24 H ARG 24 -2.130 0.857 -5.284
155 HA ARG 24 HA ARG 24 -2.936 -1.889 -5.626
156 HB2 ARG 24 2HB ARG 24 -1.783 0.097 -7.588
157 HB3 ARG 24 1HB ARG 24 -2.307 -1.523 -7.996
158 HG2 ARG 24 2HG ARG 24 -4.035 0.734 -7.010
159 HG3 ARG 24 1HG ARG 24 -3.975 0.081 -8.646
160 HD2 ARG 24 2HD ARG 24 -4.665 -2.141 -7.624
161 HD3 ARG 24 1HD ARG 24 -5.022 -1.235 -6.151
162 HE ARG 24 HE ARG 24 -6.223 -0.535 -8.721
163 HH11 ARG 24 1HH1 ARG 24 -6.685 -1.299 -5.278
164 HH12 ARG 24 2HH1 ARG 24 -8.368 -1.133 -5.343
165 HH21 ARG 24 1HH2 ARG 24 -8.486 -0.333 -8.793
166 HH22 ARG 24 2HH2 ARG 24 -9.431 -0.555 -7.377
167 H GLU 25 H GLU 25 -1.578 -3.509 -6.305
168 HA GLU 25 HA GLU 25 0.962 -3.590 -5.219
169 HB2 GLU 25 2HB GLU 25 1.207 -5.660 -6.709
170 HB3 GLU 25 1HB GLU 25 -0.110 -5.653 -5.547
171 HG2 GLU 25 2HG GLU 25 -1.638 -4.941 -7.387
172 HG3 GLU 25 1HG GLU 25 -0.291 -5.150 -8.503
173 H GLY 26 H GLY 26 2.810 -2.928 -5.832
174 HA2 GLY 26 2HA GLY 26 4.433 -2.529 -7.675
175 HA3 GLY 26 1HA GLY 26 3.107 -1.662 -8.473
176 H SER 27 H SER 27 4.701 0.216 -8.309
177 HA SER 27 HA SER 27 4.588 1.187 -5.591
178 HB2 SER 27 2HB SER 27 6.327 2.823 -6.183
179 HB3 SER 27 1HB SER 27 6.832 1.166 -6.467
180 HG SER 27 HG SER 27 7.374 2.634 -8.160
181 H ASN 28 H ASN 28 3.616 2.901 -4.993
182 HA ASN 28 HA ASN 28 1.978 4.312 -6.973
183 HB2 ASN 28 2HB ASN 28 1.461 3.884 -4.003
184 HB3 ASN 28 1HB ASN 28 0.393 4.728 -5.117
185 HD21 ASN 28 1HD2 ASN 28 1.626 1.611 -4.132
186 HD22 ASN 28 2HD2 ASN 28 0.488 0.650 -4.988
187 H ILE 29 H ILE 29 2.868 6.173 -7.373
188 HA ILE 29 HA ILE 29 4.641 7.391 -5.380
189 HB ILE 29 HB ILE 29 4.415 7.944 -8.345
190 HG12 ILE 29 2HG1 ILE 29 6.403 6.184 -6.876
191 HG13 ILE 29 1HG1 ILE 29 5.119 5.635 -7.936
192 HG21 ILE 29 1HG2 ILE 29 5.392 9.809 -7.085
193 HG22 ILE 29 2HG2 ILE 29 6.628 9.031 -8.070
194 HG23 ILE 29 3HG2 ILE 29 6.554 8.716 -6.336
195 HD11 ILE 29 3HD1 ILE 29 7.493 7.290 -8.752
196 HD12 ILE 29 1HD1 ILE 29 6.202 6.744 -9.822
197 HD13 ILE 29 2HD1 ILE 29 7.259 5.566 -9.050
198 H ILE 30 H ILE 30 4.253 9.387 -4.593
199 HA ILE 30 HA ILE 30 1.870 10.797 -5.557
200 HB ILE 30 HB ILE 30 3.020 10.783 -2.724
201 HG12 ILE 30 2HG1 ILE 30 0.422 9.613 -3.772
202 HG13 ILE 30 1HG1 ILE 30 1.847 8.682 -3.348
203 HG21 ILE 30 1HG2 ILE 30 1.002 12.066 -2.125
204 HG22 ILE 30 2HG2 ILE 30 0.683 12.282 -3.856
205 HG23 ILE 30 3HG2 ILE 30 2.151 12.925 -3.141
206 HD11 ILE 30 3HD1 ILE 30 0.174 8.598 -1.588
207 HD12 ILE 30 1HD1 ILE 30 0.213 10.357 -1.452
208 HD13 ILE 30 2HD1 ILE 30 1.638 9.405 -1.027
209 H GLY 31 H GLY 31 2.111 12.838 -6.179
210 HA2 GLY 31 2HA GLY 31 3.442 14.939 -5.360
211 HA3 GLY 31 1HA GLY 31 4.756 14.080 -6.203
212 H ARG 32 H ARG 32 4.505 16.262 -7.374
213 HA ARG 32 HA ARG 32 2.333 15.965 -9.316
214 HB2 ARG 32 2HB ARG 32 3.884 18.425 -8.546
215 HB3 ARG 32 1HB ARG 32 2.797 18.346 -9.921
216 HG2 ARG 32 2HG ARG 32 1.006 17.635 -8.225
217 HG3 ARG 32 1HG ARG 32 2.163 18.128 -7.021
218 HD2 ARG 32 2HD ARG 32 2.226 20.355 -7.683
219 HD3 ARG 32 1HD ARG 32 1.483 20.011 -9.241
220 HE ARG 32 HE ARG 32 -0.298 19.312 -7.210
221 HH11 ARG 32 1HH1 ARG 32 1.186 22.254 -8.470
222 HH12 ARG 32 2HH1 ARG 32 -0.207 23.210 -8.284
223 HH21 ARG 32 1HH2 ARG 32 -2.222 20.585 -7.034
224 HH22 ARG 32 2HH2 ARG 32 -2.212 22.243 -7.444
225 H GLY 33 H GLY 33 3.017 14.835 -10.883
226 HA2 GLY 33 2HA GLY 33 4.783 15.782 -12.753
227 HA3 GLY 33 1HA GLY 33 5.631 14.611 -11.743
228 H GLN 34 H GLN 34 5.072 14.196 -14.427
229 HA GLN 34 HA GLN 34 2.804 12.482 -14.667
230 HB2 GLN 34 2HB GLN 34 3.838 11.748 -16.798
231 HB3 GLN 34 1HB GLN 34 3.703 13.491 -16.670
232 HG2 GLN 34 2HG GLN 34 6.084 13.624 -16.095
233 HG3 GLN 34 1HG GLN 34 6.208 11.871 -16.237
234 HE21 GLN 34 1HE2 GLN 34 7.759 12.088 -17.888
235 HE22 GLN 34 2HE2 GLN 34 7.291 12.546 -19.480
236 H ASP 35 H ASP 35 5.857 12.202 -13.371
237 HA ASP 35 HA ASP 35 6.389 9.410 -13.531
238 HB2 ASP 35 2HB ASP 35 7.247 11.372 -11.399
239 HB3 ASP 35 1HB ASP 35 7.996 9.826 -11.761
240 H ALA 36 H ALA 36 4.460 11.454 -11.525
241 HA ALA 36 HA ALA 36 4.218 9.507 -9.414
242 HB1 ALA 36 1HB ALA 36 2.983 12.234 -9.703
243 HB2 ALA 36 2HB ALA 36 4.464 11.858 -8.825
244 HB3 ALA 36 3HB ALA 36 2.919 11.217 -8.265
245 H GLN 37 H GLN 37 2.162 8.738 -8.721
246 HA GLN 37 HA GLN 37 0.364 8.232 -10.942
247 HB2 GLN 37 2HB GLN 37 0.468 7.072 -8.146
248 HB3 GLN 37 1HB GLN 37 -0.581 6.536 -9.446
249 HG2 GLN 37 2HG GLN 37 2.428 6.361 -9.414
250 HG3 GLN 37 1HG GLN 37 1.310 5.025 -9.146
251 HE21 GLN 37 1HE2 GLN 37 0.206 4.163 -10.909
252 HE22 GLN 37 2HE2 GLN 37 0.651 4.536 -12.532
253 H PHE 38 H PHE 38 0.434 9.414 -7.631
254 HA PHE 38 HA PHE 38 -2.209 10.613 -7.995
255 HB2 PHE 38 2HB PHE 38 -2.222 8.960 -6.230
256 HB3 PHE 38 1HB PHE 38 -0.780 9.655 -5.512
257 HD1 PHE 38 1HD PHE 38 -4.349 10.434 -6.277
258 HD2 PHE 38 2HD PHE 38 -0.973 11.239 -3.817
259 HE1 PHE 38 1HE PHE 38 -5.749 11.799 -4.778
260 HE2 PHE 38 2HE PHE 38 -2.304 12.562 -2.348
261 HZ PHE 38 HZ PHE 38 -4.740 12.876 -2.801
262 H ARG 39 H ARG 39 -2.134 12.722 -8.285
263 HA ARG 39 HA ARG 39 0.238 14.146 -7.402
264 HB2 ARG 39 2HB ARG 39 -1.945 14.978 -9.334
265 HB3 ARG 39 1HB ARG 39 -0.646 16.037 -8.824
266 HG2 ARG 39 2HG ARG 39 -0.017 15.221 -10.957
267 HG3 ARG 39 1HG ARG 39 0.954 14.313 -9.802
268 HD2 ARG 39 2HD ARG 39 -0.704 12.473 -9.948
269 HD3 ARG 39 1HD ARG 39 -1.542 13.373 -11.206
270 HE ARG 39 HE ARG 39 1.229 12.399 -11.457
271 HH11 ARG 39 1HH1 ARG 39 -1.876 13.149 -12.991
272 HH12 ARG 39 2HH1 ARG 39 -1.516 12.289 -14.417
273 HH21 ARG 39 1HH2 ARG 39 1.664 11.179 -13.367
274 HH22 ARG 39 2HH2 ARG 39 0.512 11.124 -14.632
275 H LEU 40 H LEU 40 0.177 15.721 -5.903
276 HA LEU 40 HA LEU 40 -2.191 15.854 -4.280
277 HB2 LEU 40 2HB LEU 40 0.522 17.125 -3.991
278 HB3 LEU 40 1HB LEU 40 -0.791 17.441 -2.874
279 HG LEU 40 HG LEU 40 0.497 14.743 -3.340
280 HD11 LEU 40 1HD1 LEU 40 1.977 16.371 -2.220
281 HD12 LEU 40 2HD1 LEU 40 1.472 15.078 -1.134
282 HD13 LEU 40 3HD1 LEU 40 0.716 16.667 -1.022
283 HD21 LEU 40 3HD2 LEU 40 -1.535 15.662 -1.300
284 HD22 LEU 40 1HD2 LEU 40 -0.778 14.072 -1.366
285 HD23 LEU 40 2HD2 LEU 40 -1.856 14.589 -2.663
286 HA PRO 41 HA PRO 41 -3.566 19.745 -6.040
287 HB2 PRO 41 2HB PRO 41 -5.142 20.300 -3.674
288 HB3 PRO 41 1HB PRO 41 -5.699 19.764 -5.259
289 HG2 PRO 41 2HG PRO 41 -5.822 18.216 -3.031
290 HG3 PRO 41 1HG PRO 41 -5.674 17.554 -4.667
291 HD2 PRO 41 2HD PRO 41 -3.555 17.943 -2.581
292 HD3 PRO 41 1HD PRO 41 -3.831 16.579 -3.691
293 H ASP 42 H ASP 42 -1.344 19.553 -3.793
294 HA ASP 42 HA ASP 42 -1.337 22.418 -3.184
295 HB2 ASP 42 2HB ASP 42 -0.409 20.103 -1.528
296 HB3 ASP 42 1HB ASP 42 0.385 21.664 -1.359
297 H THR 43 H THR 43 0.619 23.503 -3.243
298 HA THR 43 HA THR 43 2.505 22.451 -5.186
299 HB THR 43 HB THR 43 2.253 25.220 -3.952
300 HG1 THR 43 1HG THR 43 0.611 25.408 -5.216
301 HG21 THR 43 3HG2 THR 43 3.591 25.969 -5.879
302 HG22 THR 43 1HG2 THR 43 3.717 24.300 -6.439
303 HG23 THR 43 2HG2 THR 43 4.469 24.778 -4.917
304 H GLY 44 H GLY 44 4.802 22.463 -4.620
305 HA2 GLY 44 2HA GLY 44 6.535 22.954 -2.970
306 HA3 GLY 44 1HA GLY 44 5.342 22.613 -1.720
307 H VAL 45 H VAL 45 4.584 20.540 -3.916
308 HA VAL 45 HA VAL 45 6.197 18.420 -2.758
309 HB VAL 45 HB VAL 45 3.733 18.222 -2.598
310 HG11 VAL 45 1HG1 VAL 45 3.777 18.157 -5.594
311 HG12 VAL 45 2HG1 VAL 45 3.016 19.377 -4.567
312 HG13 VAL 45 3HG1 VAL 45 2.387 17.729 -4.602
313 HG21 VAL 45 3HG2 VAL 45 5.018 16.184 -2.629
314 HG22 VAL 45 1HG2 VAL 45 4.999 16.172 -4.391
315 HG23 VAL 45 2HG2 VAL 45 3.501 15.941 -3.496
316 H SER 46 H SER 46 7.484 17.144 -4.053
317 HA SER 46 HA SER 46 8.235 18.268 -6.585
318 HB2 SER 46 2HB SER 46 9.264 15.821 -5.149
319 HB3 SER 46 1HB SER 46 10.027 16.635 -6.516
320 HG SER 46 HG SER 46 9.648 18.518 -4.797
321 H ARG 47 H ARG 47 8.754 16.602 -8.381
322 HA ARG 47 HA ARG 47 6.408 15.425 -9.366
323 HB2 ARG 47 2HB ARG 47 7.975 14.288 -11.048
324 HB3 ARG 47 1HB ARG 47 7.980 16.042 -11.006
325 HG2 ARG 47 2HG ARG 47 10.014 15.972 -9.627
326 HG3 ARG 47 1HG ARG 47 10.009 14.214 -9.740
327 HD2 ARG 47 2HD ARG 47 10.047 15.991 -12.157
328 HD3 ARG 47 1HD ARG 47 11.524 15.509 -11.351
329 HE ARG 47 HE ARG 47 9.612 13.555 -12.496
330 HH11 ARG 47 1HH1 ARG 47 12.957 14.673 -11.939
331 HH12 ARG 47 2HH1 ARG 47 13.649 13.479 -12.917
332 HH21 ARG 47 1HH2 ARG 47 10.610 11.860 -13.759
333 HH22 ARG 47 2HH2 ARG 47 12.308 11.859 -13.967
334 H ARG 48 H ARG 48 9.061 14.047 -7.616
335 HA ARG 48 HA ARG 48 7.380 11.728 -7.064
336 HB2 ARG 48 2HB ARG 48 10.404 11.670 -7.417
337 HB3 ARG 48 1HB ARG 48 9.385 10.303 -7.003
338 HG2 ARG 48 2HG ARG 48 8.319 10.428 -9.192
339 HG3 ARG 48 1HG ARG 48 9.340 11.803 -9.609
340 HD2 ARG 48 2HD ARG 48 10.267 9.824 -10.602
341 HD3 ARG 48 1HD ARG 48 11.328 10.356 -9.301
342 HE ARG 48 HE ARG 48 10.193 8.593 -7.926
343 HH11 ARG 48 1HH1 ARG 48 10.487 8.226 -11.479
344 HH12 ARG 48 2HH1 ARG 48 10.425 6.535 -11.392
345 HH21 ARG 48 1HH2 ARG 48 10.157 6.244 -7.900
346 HH22 ARG 48 2HH2 ARG 48 10.213 5.411 -9.398
347 H HIS 49 H HIS 49 6.778 12.486 -5.102
348 HA HIS 49 HA HIS 49 8.824 13.639 -3.359
349 HB2 HIS 49 2HB HIS 49 6.766 14.932 -3.525
350 HB3 HIS 49 1HB HIS 49 5.808 13.527 -3.074
351 HD2 HIS 49 2HD HIS 49 5.858 12.855 -0.348
352 HE1 HIS 49 1HE HIS 49 7.942 16.311 0.848
353 HE2 HIS 49 2HE HIS 49 7.183 14.000 1.497
354 H LEU 50 H LEU 50 6.573 11.007 -3.602
355 HA LEU 50 HA LEU 50 8.212 9.492 -1.852
356 HB2 LEU 50 2HB LEU 50 7.012 10.682 -0.176
357 HB3 LEU 50 1HB LEU 50 5.487 10.428 -0.968
358 HG LEU 50 HG LEU 50 6.998 8.056 0.087
359 HD11 LEU 50 1HD1 LEU 50 6.966 9.758 1.882
360 HD12 LEU 50 2HD1 LEU 50 5.910 8.400 2.255
361 HD13 LEU 50 3HD1 LEU 50 5.223 9.922 1.678
362 HD21 LEU 50 3HD2 LEU 50 4.722 7.218 0.455
363 HD22 LEU 50 1HD2 LEU 50 4.954 7.710 -1.224
364 HD23 LEU 50 2HD2 LEU 50 4.061 8.749 -0.112
365 H GLU 51 H GLU 51 7.887 7.380 -2.068
366 HA GLU 51 HA GLU 51 5.737 6.570 -3.838
367 HB2 GLU 51 2HB GLU 51 7.383 5.065 -5.014
368 HB3 GLU 51 1HB GLU 51 7.508 6.785 -5.352
369 HG2 GLU 51 2HG GLU 51 9.423 7.005 -3.998
370 HG3 GLU 51 1HG GLU 51 9.233 5.383 -3.346
371 H ILE 52 H ILE 52 4.703 4.928 -3.132
372 HA ILE 52 HA ILE 52 5.907 3.299 -1.018
373 HB ILE 52 HB ILE 52 3.011 3.475 -1.886
374 HG12 ILE 52 2HG1 ILE 52 4.348 4.620 0.579
375 HG13 ILE 52 1HG1 ILE 52 3.857 5.562 -0.822
376 HG21 ILE 52 1HG2 ILE 52 2.596 2.205 0.203
377 HG22 ILE 52 2HG2 ILE 52 4.346 2.088 0.442
378 HG23 ILE 52 3HG2 ILE 52 3.598 1.329 -0.962
379 HD11 ILE 52 3HD1 ILE 52 2.274 5.774 1.010
380 HD12 ILE 52 1HD1 ILE 52 2.016 4.030 1.003
381 HD13 ILE 52 2HD1 ILE 52 1.527 5.000 -0.387
382 H ARG 53 H ARG 53 6.817 1.520 -1.806
383 HA ARG 53 HA ARG 53 5.702 0.349 -4.230
384 HB2 ARG 53 2HB ARG 53 8.296 0.628 -3.639
385 HB3 ARG 53 1HB ARG 53 8.018 -0.858 -2.747
386 HG2 ARG 53 2HG ARG 53 7.515 -0.488 -5.700
387 HG3 ARG 53 1HG ARG 53 8.933 -1.240 -4.996
388 HD2 ARG 53 2HD ARG 53 7.614 -3.047 -4.139
389 HD3 ARG 53 1HD ARG 53 6.121 -2.226 -4.583
390 HE ARG 53 HE ARG 53 6.999 -2.397 -6.925
391 HH11 ARG 53 1HH1 ARG 53 7.852 -4.839 -4.489
392 HH12 ARG 53 2HH1 ARG 53 7.838 -6.125 -5.589
393 HH21 ARG 53 1HH2 ARG 53 7.108 -4.192 -8.474
394 HH22 ARG 53 2HH2 ARG 53 7.516 -5.737 -7.882
395 H TRP 54 H TRP 54 4.015 -0.824 -3.835
396 HA TRP 54 HA TRP 54 3.952 -2.329 -1.377
397 HB2 TRP 54 2HB TRP 54 2.100 -0.855 -1.446
398 HB3 TRP 54 1HB TRP 54 1.786 -1.205 -3.140
399 HD1 TRP 54 HD TRP 54 -0.448 -2.457 -3.319
400 HE1 TRP 54 1HE TRP 54 -1.687 -4.284 -2.008
401 HE3 TRP 54 3HE TRP 54 2.889 -3.157 0.461
402 HZ2 TRP 54 2HZ TRP 54 -1.291 -5.852 0.297
403 HZ3 TRP 54 3HZ TRP 54 2.415 -4.827 2.168
404 HH2 TRP 54 HH TRP 54 0.347 -6.165 2.102
405 H ASP 55 H ASP 55 4.629 -4.292 -1.700
406 HA ASP 55 HA ASP 55 3.963 -5.677 -4.216
407 HB2 ASP 55 2HB ASP 55 6.392 -5.575 -3.478
408 HB3 ASP 55 1HB ASP 55 5.935 -6.495 -2.048
409 H GLY 56 H GLY 56 3.236 -7.975 -3.832
410 HA2 GLY 56 2HA GLY 56 1.257 -8.004 -1.753
411 HA3 GLY 56 1HA GLY 56 1.575 -9.297 -2.906
412 H GLN 57 H GLN 57 3.216 -7.675 -0.266
413 HA GLN 57 HA GLN 57 3.472 -9.830 1.468
414 HB2 GLN 57 2HB GLN 57 4.969 -10.808 -0.218
415 HB3 GLN 57 1HB GLN 57 5.939 -9.346 -0.225
416 HG2 GLN 57 2HG GLN 57 6.977 -11.179 1.045
417 HG3 GLN 57 1HG GLN 57 6.662 -9.762 2.040
418 HE21 GLN 57 1HE2 GLN 57 6.695 -10.926 3.899
419 HE22 GLN 57 2HE2 GLN 57 5.443 -12.024 4.363
420 H VAL 58 H VAL 58 5.255 -6.964 0.245
421 HA VAL 58 HA VAL 58 5.308 -6.002 3.002
422 HB VAL 58 HB VAL 58 7.583 -5.007 2.616
423 HG11 VAL 58 1HG1 VAL 58 7.436 -8.011 2.546
424 HG12 VAL 58 2HG1 VAL 58 7.295 -6.999 3.982
425 HG13 VAL 58 3HG1 VAL 58 8.816 -7.060 3.093
426 HG21 VAL 58 3HG2 VAL 58 7.659 -5.126 0.185
427 HG22 VAL 58 1HG2 VAL 58 7.620 -6.889 0.253
428 HG23 VAL 58 2HG2 VAL 58 9.016 -6.016 0.884
429 H ALA 59 H ALA 59 5.176 -3.869 3.340
430 HA ALA 59 HA ALA 59 4.505 -2.207 1.015
431 HB1 ALA 59 1HB ALA 59 2.706 -2.447 2.665
432 HB2 ALA 59 2HB ALA 59 3.306 -0.791 2.605
433 HB3 ALA 59 3HB ALA 59 3.794 -1.862 3.923
434 H LEU 60 H LEU 60 6.268 -1.289 0.379
435 HA LEU 60 HA LEU 60 8.277 -0.411 2.271
436 HB2 LEU 60 2HB LEU 60 8.895 -1.781 0.356
437 HB3 LEU 60 1HB LEU 60 8.218 -0.581 -0.719
438 HG LEU 60 HG LEU 60 9.962 1.011 -0.011
439 HD11 LEU 60 1HD1 LEU 60 11.879 0.177 1.270
440 HD12 LEU 60 2HD1 LEU 60 11.029 -1.353 1.522
441 HD13 LEU 60 3HD1 LEU 60 10.388 0.135 2.213
442 HD21 LEU 60 3HD2 LEU 60 10.924 -1.652 -1.010
443 HD22 LEU 60 1HD2 LEU 60 11.779 -0.115 -1.205
444 HD23 LEU 60 2HD2 LEU 60 10.204 -0.372 -1.977
445 H LEU 61 H LEU 61 7.965 1.564 3.056
446 HA LEU 61 HA LEU 61 6.786 3.654 1.408
447 HB2 LEU 61 2HB LEU 61 5.908 3.229 3.658
448 HB3 LEU 61 1HB LEU 61 7.456 3.482 4.384
449 HG LEU 61 HG LEU 61 5.881 5.329 4.792
450 HD11 LEU 61 1HD1 LEU 61 8.210 5.955 4.778
451 HD12 LEU 61 2HD1 LEU 61 7.216 7.257 4.125
452 HD13 LEU 61 3HD1 LEU 61 8.150 6.230 3.039
453 HD21 LEU 61 3HD2 LEU 61 5.929 5.805 1.830
454 HD22 LEU 61 1HD2 LEU 61 5.069 6.754 3.037
455 HD23 LEU 61 2HD2 LEU 61 4.587 5.086 2.723
456 H ALA 62 H ALA 62 8.192 4.844 0.249
457 HA ALA 62 HA ALA 62 10.818 5.362 1.428
458 HB1 ALA 62 1HB ALA 62 10.207 4.900 -1.486
459 HB2 ALA 62 2HB ALA 62 11.020 3.762 -0.417
460 HB3 ALA 62 3HB ALA 62 11.783 5.307 -0.813
461 H ASP 63 H ASP 63 11.141 7.385 1.804
462 HA ASP 63 HA ASP 63 9.473 9.485 0.702
463 HB2 ASP 63 2HB ASP 63 10.053 9.725 3.011
464 HB3 ASP 63 1HB ASP 63 11.753 9.413 2.687
465 H LEU 64 H LEU 64 10.066 10.875 -0.905
466 HA LEU 64 HA LEU 64 12.811 10.672 -1.938
467 HB2 LEU 64 2HB LEU 64 10.844 9.511 -3.232
468 HB3 LEU 64 1HB LEU 64 10.368 11.137 -3.636
469 HG LEU 64 HG LEU 64 11.464 10.233 -5.491
470 HD11 LEU 64 1HD1 LEU 64 12.063 12.525 -5.161
471 HD12 LEU 64 2HD1 LEU 64 13.417 11.650 -5.882
472 HD13 LEU 64 3HD1 LEU 64 13.443 12.063 -4.167
473 HD21 LEU 64 3HD2 LEU 64 13.738 9.298 -5.453
474 HD22 LEU 64 1HD2 LEU 64 12.594 8.382 -4.473
475 HD23 LEU 64 2HD2 LEU 64 13.752 9.465 -3.697
476 H ASN 65 H ASN 65 13.004 12.618 -0.434
477 HA ASN 65 HA ASN 65 12.792 15.004 -1.945
478 HB2 ASN 65 2HB ASN 65 10.409 14.659 -0.924
479 HB3 ASN 65 1HB ASN 65 11.175 15.050 0.612
480 HD21 ASN 65 1HD2 ASN 65 10.149 16.218 -2.411
481 HD22 ASN 65 2HD2 ASN 65 10.389 17.900 -2.137
482 H SER 66 H SER 66 13.752 16.825 -0.641
483 HA SER 66 HA SER 66 15.525 15.665 1.345
484 HB2 SER 66 2HB SER 66 15.980 18.108 -0.373
485 HB3 SER 66 1HB SER 66 17.131 17.387 0.750
486 HG SER 66 HG SER 66 16.914 15.437 -0.490
487 H THR 67 H THR 67 13.750 18.722 0.661
488 HA THR 67 HA THR 67 14.256 19.537 3.403
489 HB THR 67 HB THR 67 14.559 21.199 1.580
490 HG1 THR 67 1HG THR 67 13.641 22.863 2.635
491 HG21 THR 67 3HG2 THR 67 11.549 21.036 1.284
492 HG22 THR 67 1HG2 THR 67 12.732 20.501 0.091
493 HG23 THR 67 2HG2 THR 67 12.598 22.214 0.491
494 H ASN 68 H ASN 68 11.650 18.248 1.546
495 HA ASN 68 HA ASN 68 9.780 18.733 3.734
496 HB2 ASN 68 2HB ASN 68 9.328 18.091 0.820
497 HB3 ASN 68 1HB ASN 68 8.064 17.899 2.036
498 HD21 ASN 68 1HD2 ASN 68 8.212 19.707 -0.278
499 HD22 ASN 68 2HD2 ASN 68 8.046 21.267 0.384
500 H GLY 69 H GLY 69 11.912 16.845 3.766
501 HA2 GLY 69 2HA GLY 69 11.438 14.214 3.184
502 HA3 GLY 69 1HA GLY 69 12.280 14.758 4.630
503 H THR 70 H THR 70 9.846 12.986 3.518
504 HA THR 70 HA THR 70 7.644 13.575 5.059
505 HB THR 70 HB THR 70 8.516 10.932 3.907
506 HG1 THR 70 1HG THR 70 8.510 12.285 2.268
507 HG21 THR 70 3HG2 THR 70 6.108 10.472 3.791
508 HG22 THR 70 1HG2 THR 70 5.773 12.027 4.554
509 HG23 THR 70 2HG2 THR 70 6.611 10.762 5.454
510 H THR 71 H THR 71 6.972 13.045 7.004
511 HA THR 71 HA THR 71 8.837 11.732 8.834
512 HB THR 71 HB THR 71 6.482 13.001 9.981
513 HG1 THR 71 1HG THR 71 8.089 14.473 8.127
514 HG21 THR 71 3HG2 THR 71 9.423 13.661 10.088
515 HG22 THR 71 1HG2 THR 71 8.575 12.578 11.185
516 HG23 THR 71 2HG2 THR 71 8.191 14.303 11.175
517 H VAL 72 H VAL 72 8.102 9.844 9.897
518 HA VAL 72 HA VAL 72 5.376 8.952 9.296
519 HB VAL 72 HB VAL 72 6.227 6.586 9.331
520 HG11 VAL 72 1HG1 VAL 72 7.344 6.603 7.159
521 HG12 VAL 72 2HG1 VAL 72 7.611 8.339 7.309
522 HG13 VAL 72 3HG1 VAL 72 5.972 7.711 7.178
523 HG21 VAL 72 3HG2 VAL 72 8.216 6.949 10.704
524 HG22 VAL 72 1HG2 VAL 72 8.946 7.887 9.402
525 HG23 VAL 72 2HG2 VAL 72 8.633 6.164 9.182
526 H ASN 73 H ASN 73 4.153 8.725 11.038
527 HA ASN 73 HA ASN 73 3.489 8.775 13.145
528 HB2 ASN 73 2HB ASN 73 5.881 6.935 13.453
529 HB3 ASN 73 1HB ASN 73 4.797 7.281 14.802
530 HD21 ASN 73 1HD2 ASN 73 5.345 4.818 13.159
531 HD22 ASN 73 2HD2 ASN 73 3.793 4.261 12.646
532 H ASN 74 H ASN 74 5.073 10.730 12.108
533 HA ASN 74 HA ASN 74 6.055 12.607 12.449
534 HB2 ASN 74 2HB ASN 74 5.062 12.228 15.259
535 HB3 ASN 74 1HB ASN 74 5.983 13.665 14.812
536 HD21 ASN 74 1HD2 ASN 74 3.178 13.562 15.620
537 HD22 ASN 74 2HD2 ASN 74 2.289 14.182 14.280
538 H ALA 75 H ALA 75 7.644 10.206 12.585
539 HA ALA 75 HA ALA 75 10.069 11.448 13.675
540 HB1 ALA 75 1HB ALA 75 9.509 9.302 14.746
541 HB2 ALA 75 2HB ALA 75 10.987 9.178 13.797
542 HB3 ALA 75 3HB ALA 75 9.477 8.524 13.163
543 HA PRO 76 HA PRO 76 10.916 11.758 9.271
544 HB2 PRO 76 2HB PRO 76 13.380 12.848 9.407
545 HB3 PRO 76 1HB PRO 76 11.903 13.759 9.765
546 HG2 PRO 76 2HG PRO 76 13.861 12.518 11.659
547 HG3 PRO 76 1HG PRO 76 13.060 14.096 11.758
548 HD2 PRO 76 2HD PRO 76 12.230 11.885 13.150
549 HD3 PRO 76 1HD PRO 76 11.149 13.202 12.653
550 H VAL 77 H VAL 77 11.616 10.291 7.864
551 HA VAL 77 HA VAL 77 13.980 8.659 8.463
552 HB VAL 77 HB VAL 77 12.829 6.587 7.806
553 HG11 VAL 77 1HG1 VAL 77 11.404 7.953 10.077
554 HG12 VAL 77 2HG1 VAL 77 12.922 7.066 10.177
555 HG13 VAL 77 3HG1 VAL 77 11.430 6.217 9.768
556 HG21 VAL 77 3HG2 VAL 77 11.128 7.455 6.343
557 HG22 VAL 77 1HG2 VAL 77 10.345 8.292 7.687
558 HG23 VAL 77 2HG2 VAL 77 10.351 6.534 7.632
559 H GLN 78 H GLN 78 14.384 7.221 6.477
560 HA GLN 78 HA GLN 78 13.841 8.724 4.005
561 HB2 GLN 78 2HB GLN 78 15.924 6.616 4.592
562 HB3 GLN 78 1HB GLN 78 15.697 7.406 3.041
563 HG2 GLN 78 2HG GLN 78 16.246 9.549 4.070
564 HG3 GLN 78 1HG GLN 78 16.506 8.728 5.606
565 HE21 GLN 78 1HE2 GLN 78 17.689 9.154 2.382
566 HE22 GLN 78 2HE2 GLN 78 19.262 8.533 2.663
567 H GLU 79 H GLU 79 13.727 5.583 5.550
568 HA GLU 79 HA GLU 79 11.683 4.791 3.728
569 HB2 GLU 79 2HB GLU 79 12.759 2.440 3.647
570 HB3 GLU 79 1HB GLU 79 13.383 3.685 2.584
571 HG2 GLU 79 2HG GLU 79 15.206 2.396 3.487
572 HG3 GLU 79 1HG GLU 79 15.256 4.031 4.141
573 H TRP 80 H TRP 80 10.299 3.225 4.514
574 HA TRP 80 HA TRP 80 10.506 2.468 7.288
575 HB2 TRP 80 2HB TRP 80 9.649 4.695 7.494
576 HB3 TRP 80 1HB TRP 80 8.430 4.465 6.263
577 HD1 TRP 80 HD TRP 80 6.131 3.421 7.059
578 HE1 TRP 80 1HE TRP 80 5.106 3.040 9.387
579 HE3 TRP 80 3HE TRP 80 10.347 3.979 9.885
580 HZ2 TRP 80 2HZ TRP 80 5.975 3.012 12.062
581 HZ3 TRP 80 3HZ TRP 80 10.151 3.773 12.332
582 HH2 TRP 80 HH TRP 80 8.010 3.301 13.388
583 H GLN 81 H GLN 81 8.989 0.818 7.764
584 HA GLN 81 HA GLN 81 7.628 -0.231 5.406
585 HB2 GLN 81 2HB GLN 81 7.510 -2.411 6.487
586 HB3 GLN 81 1HB GLN 81 9.170 -1.885 6.467
587 HG2 GLN 81 2HG GLN 81 7.315 -1.751 8.807
588 HG3 GLN 81 1HG GLN 81 8.510 -3.026 8.554
589 HE21 GLN 81 1HE2 GLN 81 7.901 0.202 9.573
590 HE22 GLN 81 2HE2 GLN 81 9.476 0.528 10.215
591 H LEU 82 H LEU 82 5.631 0.186 5.239
592 HA LEU 82 HA LEU 82 4.142 1.679 7.062
593 HB2 LEU 82 2HB LEU 82 3.146 -0.109 4.859
594 HB3 LEU 82 1HB LEU 82 2.161 1.036 5.738
595 HG LEU 82 HG LEU 82 4.479 1.692 3.932
596 HD11 LEU 82 1HD1 LEU 82 2.762 2.726 2.544
597 HD12 LEU 82 2HD1 LEU 82 1.516 2.184 3.662
598 HD13 LEU 82 3HD1 LEU 82 2.448 1.004 2.743
599 HD21 LEU 82 3HD2 LEU 82 3.730 4.030 4.311
600 HD22 LEU 82 1HD2 LEU 82 4.422 3.256 5.739
601 HD23 LEU 82 2HD2 LEU 82 2.683 3.415 5.596
602 H ALA 83 H ALA 83 2.840 1.222 8.695
603 HA ALA 83 HA ALA 83 1.935 -1.524 9.067
604 HB1 ALA 83 1HB ALA 83 2.762 0.464 11.184
605 HB2 ALA 83 2HB ALA 83 3.626 -1.015 10.751
606 HB3 ALA 83 3HB ALA 83 2.030 -1.110 11.491
607 H ASP 84 H ASP 84 -0.023 -1.429 10.538
608 HA ASP 84 HA ASP 84 -1.845 0.406 9.308
609 HB2 ASP 84 2HB ASP 84 -2.574 -1.852 9.596
610 HB3 ASP 84 1HB ASP 84 -2.240 -1.796 11.320
611 H GLY 85 H GLY 85 -2.437 2.276 10.088
612 HA2 GLY 85 2HA GLY 85 -3.273 3.663 11.806
613 HA3 GLY 85 1HA GLY 85 -2.379 2.707 12.980
614 H ASP 86 H ASP 86 -0.432 3.289 10.328
615 HA ASP 86 HA ASP 86 1.224 5.044 11.854
616 HB2 ASP 86 2HB ASP 86 1.491 4.013 9.031
617 HB3 ASP 86 1HB ASP 86 2.590 5.214 9.676
618 H VAL 87 H VAL 87 1.530 7.119 11.769
619 HA VAL 87 HA VAL 87 -0.319 8.703 10.094
620 HB VAL 87 HB VAL 87 1.365 9.681 12.426
621 HG11 VAL 87 1HG1 VAL 87 -0.176 11.587 12.444
622 HG12 VAL 87 2HG1 VAL 87 -0.999 10.925 11.034
623 HG13 VAL 87 3HG1 VAL 87 0.686 11.439 10.911
624 HG21 VAL 87 3HG2 VAL 87 -0.664 9.593 13.792
625 HG22 VAL 87 1HG2 VAL 87 -0.189 7.990 13.232
626 HG23 VAL 87 2HG2 VAL 87 -1.533 8.829 12.457
627 H ILE 88 H ILE 88 0.583 9.434 8.270
628 HA ILE 88 HA ILE 88 3.465 9.878 8.395
629 HB ILE 88 HB ILE 88 1.820 8.830 6.083
630 HG12 ILE 88 2HG1 ILE 88 4.011 7.607 7.784
631 HG13 ILE 88 1HG1 ILE 88 2.313 7.179 7.793
632 HG21 ILE 88 1HG2 ILE 88 3.914 8.694 4.817
633 HG22 ILE 88 2HG2 ILE 88 4.754 9.516 6.137
634 HG23 ILE 88 3HG2 ILE 88 3.505 10.363 5.224
635 HD11 ILE 88 3HD1 ILE 88 2.525 6.353 5.498
636 HD12 ILE 88 1HD1 ILE 88 3.613 5.513 6.604
637 HD13 ILE 88 2HD1 ILE 88 4.239 6.757 5.527
638 H ARG 89 H ARG 89 4.163 11.800 8.050
639 HA ARG 89 HA ARG 89 2.312 13.827 7.009
640 HB2 ARG 89 2HB ARG 89 3.120 14.149 9.338
641 HB3 ARG 89 1HB ARG 89 4.771 14.165 8.739
642 HG2 ARG 89 2HG ARG 89 4.230 16.162 7.391
643 HG3 ARG 89 1HG ARG 89 2.617 16.175 8.107
644 HD2 ARG 89 2HD ARG 89 3.996 17.738 9.287
645 HD3 ARG 89 1HD ARG 89 3.661 16.359 10.336
646 HE ARG 89 HE ARG 89 6.048 15.801 9.055
647 HH11 ARG 89 1HH1 ARG 89 4.913 18.217 11.395
648 HH12 ARG 89 2HH1 ARG 89 6.458 18.521 12.037
649 HH21 ARG 89 1HH2 ARG 89 8.135 16.229 9.925
650 HH22 ARG 89 2HH2 ARG 89 8.351 17.332 11.201
651 H LEU 90 H LEU 90 2.717 14.232 4.977
652 HA LEU 90 HA LEU 90 5.477 14.215 4.047
653 HB2 LEU 90 2HB LEU 90 4.708 13.729 1.781
654 HB3 LEU 90 1HB LEU 90 4.230 12.464 2.881
655 HG LEU 90 HG LEU 90 2.290 14.605 2.000
656 HD11 LEU 90 1HD1 LEU 90 2.863 11.944 0.694
657 HD12 LEU 90 2HD1 LEU 90 3.243 13.528 0.022
658 HD13 LEU 90 3HD1 LEU 90 1.559 13.052 0.257
659 HD21 LEU 90 3HD2 LEU 90 0.631 12.876 2.525
660 HD22 LEU 90 1HD2 LEU 90 1.632 13.225 3.932
661 HD23 LEU 90 2HD2 LEU 90 1.922 11.766 2.989
662 H GLY 91 H GLY 91 5.803 15.730 2.179
663 HA2 GLY 91 2HA GLY 91 5.533 18.335 2.992
664 HA3 GLY 91 1HA GLY 91 5.764 17.857 1.322
665 H HIS 92 H HIS 92 3.716 19.229 3.577
666 HA HIS 92 HA HIS 92 1.876 20.429 3.479
667 HB2 HIS 92 2HB HIS 92 1.928 19.877 0.518
668 HB3 HIS 92 1HB HIS 92 0.715 20.897 1.289
669 HD1 HIS 92 1HD HIS 92 1.430 23.262 1.943
670 HD2 HIS 92 2HD HIS 92 4.539 20.931 0.499
671 HE1 HIS 92 1HE HIS 92 3.381 24.827 1.612
672 H SER 93 H SER 93 1.805 17.304 3.649
673 HA SER 93 HA SER 93 -1.066 17.326 3.959
674 HB2 SER 93 2HB SER 93 -0.680 16.718 1.549
675 HB3 SER 93 1HB SER 93 0.201 15.301 2.101
676 HG SER 93 HG SER 93 -2.489 15.792 2.000
677 H GLU 94 H GLU 94 -1.825 15.639 5.313
678 HA GLU 94 HA GLU 94 0.192 13.839 6.270
679 HB2 GLU 94 2HB GLU 94 -0.910 13.997 8.606
680 HB3 GLU 94 1HB GLU 94 0.177 15.275 8.111
681 HG2 GLU 94 2HG GLU 94 -1.569 16.393 9.164
682 HG3 GLU 94 1HG GLU 94 -1.942 16.558 7.456
683 H ILE 95 H ILE 95 -0.354 11.776 6.445
684 HA ILE 95 HA ILE 95 -3.075 11.142 5.551
685 HB ILE 95 HB ILE 95 -1.345 11.131 3.737
686 HG12 ILE 95 2HG1 ILE 95 -1.872 8.852 2.870
687 HG13 ILE 95 1HG1 ILE 95 -2.686 8.528 4.402
688 HG21 ILE 95 1HG2 ILE 95 0.275 9.308 3.601
689 HG22 ILE 95 2HG2 ILE 95 -0.171 8.810 5.234
690 HG23 ILE 95 3HG2 ILE 95 0.583 10.382 4.968
691 HD11 ILE 95 3HD1 ILE 95 -4.268 9.189 2.694
692 HD12 ILE 95 1HD1 ILE 95 -3.392 10.700 2.445
693 HD13 ILE 95 2HD1 ILE 95 -4.200 10.386 3.980
694 H ILE 96 H ILE 96 -3.927 9.103 6.300
695 HA ILE 96 HA ILE 96 -2.367 7.906 8.467
696 HB ILE 96 HB ILE 96 -5.387 7.808 8.030
697 HG12 ILE 96 2HG1 ILE 96 -5.446 9.050 10.296
698 HG13 ILE 96 1HG1 ILE 96 -3.753 9.412 10.015
699 HG21 ILE 96 1HG2 ILE 96 -4.590 5.778 9.064
700 HG22 ILE 96 2HG2 ILE 96 -5.510 6.729 10.232
701 HG23 ILE 96 3HG2 ILE 96 -3.748 6.708 10.304
702 HD11 ILE 96 3HD1 ILE 96 -5.180 11.282 9.402
703 HD12 ILE 96 1HD1 ILE 96 -6.061 10.260 8.267
704 HD13 ILE 96 2HD1 ILE 96 -4.362 10.634 7.979
705 H VAL 97 H VAL 97 -1.607 5.923 8.046
706 HA VAL 97 HA VAL 97 -2.555 4.573 5.659
707 HB VAL 97 HB VAL 97 -0.192 4.014 7.474
708 HG11 VAL 97 1HG1 VAL 97 -1.017 2.623 4.921
709 HG12 VAL 97 2HG1 VAL 97 -1.063 1.928 6.542
710 HG13 VAL 97 3HG1 VAL 97 0.488 2.347 5.808
711 HG21 VAL 97 3HG2 VAL 97 0.024 5.989 6.065
712 HG22 VAL 97 1HG2 VAL 97 -0.379 5.013 4.650
713 HG23 VAL 97 2HG2 VAL 97 1.114 4.701 5.541
714 H ARG 98 H ARG 98 -3.971 3.020 5.727
715 HA ARG 98 HA ARG 98 -4.382 1.578 8.234
716 HB2 ARG 98 2HB ARG 98 -6.326 2.643 6.207
717 HB3 ARG 98 1HB ARG 98 -6.754 1.308 7.269
718 HG2 ARG 98 2HG ARG 98 -5.699 3.888 8.356
719 HG3 ARG 98 1HG ARG 98 -7.413 3.669 7.988
720 HD2 ARG 98 2HD ARG 98 -5.877 1.751 9.737
721 HD3 ARG 98 1HD ARG 98 -6.698 3.177 10.375
722 HE ARG 98 HE ARG 98 -8.766 2.274 9.475
723 HH11 ARG 98 1HH1 ARG 98 -6.145 -0.129 9.927
724 HH12 ARG 98 2HH1 ARG 98 -7.244 -1.410 10.070
725 HH21 ARG 98 1HH2 ARG 98 -10.185 0.464 9.700
726 HH22 ARG 98 2HH2 ARG 98 -9.517 -1.092 9.944
727 H MET 99 H MET 99 -4.525 -0.530 8.137
728 HA MET 99 HA MET 99 -4.464 -1.750 5.491
729 HB2 MET 99 2HB MET 99 -3.025 -2.770 7.952
730 HB3 MET 99 1HB MET 99 -3.197 -3.647 6.452
731 HG2 MET 99 2HG MET 99 -1.994 -1.827 5.285
732 HG3 MET 99 1HG MET 99 -1.703 -1.076 6.851
733 HE1 MET 99 3HE MET 99 0.893 -1.085 6.192
734 HE2 MET 99 1HE MET 99 0.547 -1.936 4.685
735 HE3 MET 99 2HE MET 99 1.790 -2.545 5.775
736 H HIS 100 H HIS 100 -6.176 -2.695 5.130
737 HA HIS 100 HA HIS 100 -7.864 -3.620 7.329
738 HB2 HIS 100 2HB HIS 100 -8.592 -3.256 4.397
739 HB3 HIS 100 1HB HIS 100 -9.695 -3.525 5.736
740 HD1 HIS 100 1HD HIS 100 -10.406 -1.424 7.099
741 HD2 HIS 100 2HD HIS 100 -7.590 -0.641 4.155
742 HE1 HIS 100 1HE HIS 100 -10.326 1.085 6.848
Start of MODEL 10
1 H1 GLY 1 1HT GLY 1 -5.697 -4.857 -5.596
2 H2 GLY 1 2HT GLY 1 -4.487 -6.026 -5.694
3 H3 GLY 1 3HT GLY 1 -4.432 -4.684 -6.701
4 HA2 GLY 1 1HA GLY 1 -2.870 -4.405 -4.885
5 HA3 GLY 1 2HA GLY 1 -4.184 -3.242 -4.745
6 H HIS 2 H HIS 2 -3.166 -6.474 -3.687
7 HA HIS 2 HA HIS 2 -4.346 -5.923 -1.101
8 HB2 HIS 2 2HB HIS 2 -5.244 -8.257 -1.018
9 HB3 HIS 2 1HB HIS 2 -6.081 -7.209 -2.152
10 HD1 HIS 2 1HD HIS 2 -3.424 -10.026 -2.258
11 HD2 HIS 2 2HD HIS 2 -6.345 -8.247 -4.626
12 HE1 HIS 2 1HE HIS 2 -3.615 -11.433 -4.311
13 H GLY 3 H GLY 3 -3.678 -7.712 0.427
14 HA2 GLY 3 2HA GLY 3 -0.925 -8.536 -0.193
15 HA3 GLY 3 1HA GLY 3 -1.389 -7.990 1.405
16 H SER 4 H SER 4 -0.288 -10.210 1.672
17 HA SER 4 HA SER 4 -1.200 -12.607 0.843
18 HB2 SER 4 2HB SER 4 -0.044 -12.009 3.545
19 HB3 SER 4 1HB SER 4 0.136 -13.482 2.584
20 HG SER 4 HG SER 4 1.265 -12.298 1.039
21 H ALA 5 H ALA 5 -2.298 -10.886 3.805
22 HA ALA 5 HA ALA 5 -3.998 -13.159 4.488
23 HB1 ALA 5 1HB ALA 5 -2.584 -12.171 6.217
24 HB2 ALA 5 2HB ALA 5 -4.294 -12.033 6.627
25 HB3 ALA 5 3HB ALA 5 -3.417 -10.632 6.017
26 H GLY 6 H GLY 6 -4.529 -10.913 2.345
27 HA2 GLY 6 2HA GLY 6 -6.661 -10.213 1.544
28 HA3 GLY 6 1HA GLY 6 -7.315 -10.479 3.156
29 H THR 7 H THR 7 -4.374 -9.068 3.214
30 HA THR 7 HA THR 7 -4.910 -6.798 4.590
31 HB THR 7 HB THR 7 -2.683 -7.270 2.657
32 HG1 THR 7 1HG THR 7 -2.855 -8.173 5.355
33 HG21 THR 7 3HG2 THR 7 -1.349 -6.044 4.339
34 HG22 THR 7 1HG2 THR 7 -2.815 -5.767 5.286
35 HG23 THR 7 2HG2 THR 7 -2.647 -5.073 3.665
36 H SER 8 H SER 8 -6.119 -5.135 3.867
37 HA SER 8 HA SER 8 -5.584 -4.103 1.164
38 HB2 SER 8 2HB SER 8 -7.964 -3.566 2.942
39 HB3 SER 8 1HB SER 8 -7.796 -3.169 1.229
40 HG SER 8 HG SER 8 -7.630 -5.811 2.204
41 H VAL 9 H VAL 9 -4.239 -2.379 1.282
42 HA VAL 9 HA VAL 9 -4.026 -0.937 3.812
43 HB VAL 9 HB VAL 9 -2.353 -0.536 1.321
44 HG11 VAL 9 1HG1 VAL 9 -0.746 0.485 2.892
45 HG12 VAL 9 2HG1 VAL 9 -1.910 0.255 4.200
46 HG13 VAL 9 3HG1 VAL 9 -2.294 1.329 2.860
47 HG21 VAL 9 3HG2 VAL 9 -1.793 -2.316 3.700
48 HG22 VAL 9 1HG2 VAL 9 -0.627 -1.921 2.434
49 HG23 VAL 9 2HG2 VAL 9 -2.081 -2.834 2.044
50 H THR 10 H THR 10 -5.132 0.806 4.102
51 HA THR 10 HA THR 10 -6.191 2.196 1.776
52 HB THR 10 HB THR 10 -7.527 1.756 4.452
53 HG1 THR 10 1HG THR 10 -7.295 -0.149 3.175
54 HG21 THR 10 3HG2 THR 10 -8.229 3.787 3.247
55 HG22 THR 10 1HG2 THR 10 -9.515 2.583 3.292
56 HG23 THR 10 2HG2 THR 10 -8.574 2.807 1.819
57 H LEU 11 H LEU 11 -5.694 4.215 1.709
58 HA LEU 11 HA LEU 11 -4.339 5.582 3.877
59 HB2 LEU 11 2HB LEU 11 -5.039 6.478 1.090
60 HB3 LEU 11 1HB LEU 11 -3.930 7.269 2.192
61 HG LEU 11 HG LEU 11 -3.589 4.562 1.032
62 HD11 LEU 11 1HD1 LEU 11 -3.379 6.303 -0.690
63 HD12 LEU 11 2HD1 LEU 11 -1.789 5.624 -0.348
64 HD13 LEU 11 3HD1 LEU 11 -2.241 7.191 0.325
65 HD21 LEU 11 3HD2 LEU 11 -1.251 4.741 1.867
66 HD22 LEU 11 1HD2 LEU 11 -2.463 4.726 3.149
67 HD23 LEU 11 2HD2 LEU 11 -1.700 6.243 2.675
68 H GLN 12 H GLN 12 -5.436 6.769 5.178
69 HA GLN 12 HA GLN 12 -8.194 7.585 4.501
70 HB2 GLN 12 2HB GLN 12 -7.540 6.143 6.594
71 HB3 GLN 12 1HB GLN 12 -6.996 7.662 7.261
72 HG2 GLN 12 2HG GLN 12 -9.826 7.101 6.383
73 HG3 GLN 12 1HG GLN 12 -9.247 7.020 8.039
74 HE21 GLN 12 1HE2 GLN 12 -8.772 8.952 9.110
75 HE22 GLN 12 2HE2 GLN 12 -9.349 10.470 8.524
76 H LEU 13 H LEU 13 -8.364 9.640 3.844
77 HA LEU 13 HA LEU 13 -6.642 11.716 4.980
78 HB2 LEU 13 2HB LEU 13 -6.108 11.421 2.652
79 HB3 LEU 13 1HB LEU 13 -7.803 11.422 2.214
80 HG LEU 13 HG LEU 13 -7.962 13.758 2.912
81 HD11 LEU 13 1HD1 LEU 13 -6.165 13.884 4.506
82 HD12 LEU 13 2HD1 LEU 13 -5.914 15.084 3.240
83 HD13 LEU 13 3HD1 LEU 13 -4.969 13.592 3.241
84 HD21 LEU 13 3HD2 LEU 13 -5.886 13.177 0.806
85 HD22 LEU 13 1HD2 LEU 13 -6.748 14.706 0.992
86 HD23 LEU 13 2HD2 LEU 13 -7.639 13.241 0.589
87 H ASP 14 H ASP 14 -7.867 12.792 6.392
88 HA ASP 14 HA ASP 14 -10.709 13.100 5.844
89 HB2 ASP 14 2HB ASP 14 -10.023 12.265 8.084
90 HB3 ASP 14 1HB ASP 14 -9.150 13.767 8.348
91 H ASP 15 H ASP 15 -10.816 14.733 4.389
92 HA ASP 15 HA ASP 15 -9.544 17.236 5.151
93 HB2 ASP 15 2HB ASP 15 -10.087 18.101 2.973
94 HB3 ASP 15 1HB ASP 15 -9.523 16.437 2.766
95 H GLY 16 H GLY 16 -12.002 15.699 6.180
96 HA2 GLY 16 2HA GLY 16 -13.453 17.461 7.462
97 HA3 GLY 16 1HA GLY 16 -14.142 17.604 5.844
98 H SER 17 H SER 17 -13.857 14.955 5.047
99 HA SER 17 HA SER 17 -15.885 13.759 6.829
100 HB2 SER 17 2HB SER 17 -15.574 13.298 3.860
101 HB3 SER 17 1HB SER 17 -16.836 12.633 4.893
102 HG SER 17 HG SER 17 -17.854 14.402 4.784
103 H GLY 18 H GLY 18 -13.267 12.739 4.634
104 HA2 GLY 18 2HA GLY 18 -11.636 11.204 5.735
105 HA3 GLY 18 1HA GLY 18 -13.053 10.313 6.275
106 H ARG 19 H ARG 19 -11.195 11.263 3.468
107 HA ARG 19 HA ARG 19 -12.591 9.318 1.814
108 HB2 ARG 19 2HB ARG 19 -10.522 11.403 1.219
109 HB3 ARG 19 1HB ARG 19 -10.871 10.079 0.111
110 HG2 ARG 19 2HG ARG 19 -12.858 12.126 1.084
111 HG3 ARG 19 1HG ARG 19 -12.067 12.130 -0.496
112 HD2 ARG 19 2HD ARG 19 -13.056 9.832 -0.862
113 HD3 ARG 19 1HD ARG 19 -14.004 10.103 0.598
114 HE ARG 19 HE ARG 19 -14.186 12.074 -1.507
115 HH11 ARG 19 1HH1 ARG 19 -15.722 9.385 0.217
116 HH12 ARG 19 2HH1 ARG 19 -17.237 9.583 -0.517
117 HH21 ARG 19 1HH2 ARG 19 -16.271 12.338 -2.543
118 HH22 ARG 19 2HH2 ARG 19 -17.549 11.291 -2.158
119 H THR 20 H THR 20 -11.496 7.631 0.766
120 HA THR 20 HA THR 20 -9.037 6.872 2.085
121 HB THR 20 HB THR 20 -10.024 4.550 2.179
122 HG1 THR 20 1HG THR 20 -12.134 4.289 1.841
123 HG21 THR 20 3HG2 THR 20 -11.289 5.010 4.274
124 HG22 THR 20 1HG2 THR 20 -11.294 6.720 3.838
125 HG23 THR 20 2HG2 THR 20 -9.768 5.910 4.196
126 H TYR 21 H TYR 21 -7.661 5.660 0.836
127 HA TYR 21 HA TYR 21 -8.542 4.797 -1.825
128 HB2 TYR 21 2HB TYR 21 -7.369 6.949 -2.175
129 HB3 TYR 21 1HB TYR 21 -5.985 6.352 -1.261
130 HD1 TYR 21 1HD TYR 21 -7.920 5.877 -4.389
131 HD2 TYR 21 2HD TYR 21 -4.296 5.027 -2.320
132 HE1 TYR 21 1HE TYR 21 -6.966 4.939 -6.452
133 HE2 TYR 21 2HE TYR 21 -3.336 4.094 -4.380
134 HH TYR 21 HH TYR 21 -4.434 2.965 -6.463
135 H GLN 22 H GLN 22 -7.878 2.734 -2.239
136 HA GLN 22 HA GLN 22 -6.142 1.526 -0.242
137 HB2 GLN 22 2HB GLN 22 -8.299 0.427 -0.775
138 HB3 GLN 22 1HB GLN 22 -7.791 0.264 -2.447
139 HG2 GLN 22 2HG GLN 22 -6.037 -1.264 -1.812
140 HG3 GLN 22 1HG GLN 22 -6.396 -1.021 -0.103
141 HE21 GLN 22 1HE2 GLN 22 -6.440 -3.471 -1.755
142 HE22 GLN 22 2HE2 GLN 22 -8.027 -4.108 -1.551
143 H LEU 23 H LEU 23 -4.161 0.804 -0.687
144 HA LEU 23 HA LEU 23 -2.764 1.851 -2.886
145 HB2 LEU 23 2HB LEU 23 -1.987 -0.340 -0.986
146 HB3 LEU 23 1HB LEU 23 -0.911 0.281 -2.215
147 HG LEU 23 HG LEU 23 -2.031 1.817 0.133
148 HD11 LEU 23 1HD1 LEU 23 0.288 1.874 0.866
149 HD12 LEU 23 2HD1 LEU 23 0.762 0.909 -0.532
150 HD13 LEU 23 3HD1 LEU 23 -0.287 0.215 0.707
151 HD21 LEU 23 3HD2 LEU 23 -1.801 3.315 -1.782
152 HD22 LEU 23 1HD2 LEU 23 -0.161 2.716 -2.068
153 HD23 LEU 23 2HD2 LEU 23 -0.523 3.622 -0.607
154 H ARG 24 H ARG 24 -2.012 1.052 -4.718
155 HA ARG 24 HA ARG 24 -3.446 -1.276 -5.699
156 HB2 ARG 24 2HB ARG 24 -2.866 -0.436 -7.964
157 HB3 ARG 24 1HB ARG 24 -3.803 0.707 -7.025
158 HG2 ARG 24 2HG ARG 24 -1.668 1.914 -6.506
159 HG3 ARG 24 1HG ARG 24 -0.854 0.835 -7.646
160 HD2 ARG 24 2HD ARG 24 -2.346 1.584 -9.429
161 HD3 ARG 24 1HD ARG 24 -3.190 2.631 -8.296
162 HE ARG 24 HE ARG 24 -0.374 2.985 -9.103
163 HH11 ARG 24 1HH1 ARG 24 -3.457 4.459 -7.999
164 HH12 ARG 24 2HH1 ARG 24 -2.986 6.021 -8.500
165 HH21 ARG 24 1HH2 ARG 24 0.176 5.165 -9.715
166 HH22 ARG 24 2HH2 ARG 24 -0.944 6.441 -9.479
167 H GLU 25 H GLU 25 -2.173 -2.501 -7.382
168 HA GLU 25 HA GLU 25 0.086 -3.593 -6.052
169 HB2 GLU 25 2HB GLU 25 0.128 -5.149 -8.101
170 HB3 GLU 25 1HB GLU 25 -1.267 -5.235 -7.047
171 HG2 GLU 25 2HG GLU 25 -1.243 -3.647 -9.614
172 HG3 GLU 25 1HG GLU 25 -1.708 -5.343 -9.541
173 H GLY 26 H GLY 26 2.151 -3.069 -6.347
174 HA2 GLY 26 2HA GLY 26 3.981 -2.620 -7.907
175 HA3 GLY 26 1HA GLY 26 2.863 -1.599 -8.799
176 H SER 27 H SER 27 4.625 -0.021 -8.474
177 HA SER 27 HA SER 27 4.408 1.132 -5.827
178 HB2 SER 27 2HB SER 27 6.576 0.592 -6.237
179 HB3 SER 27 1HB SER 27 6.626 1.322 -7.863
180 HG SER 27 HG SER 27 6.261 2.654 -5.361
181 H ASN 28 H ASN 28 3.906 3.229 -5.553
182 HA ASN 28 HA ASN 28 3.067 4.673 -7.941
183 HB2 ASN 28 2HB ASN 28 1.319 5.786 -6.594
184 HB3 ASN 28 1HB ASN 28 1.051 4.048 -6.717
185 HD21 ASN 28 1HD2 ASN 28 1.459 2.782 -4.821
186 HD22 ASN 28 2HD2 ASN 28 1.375 3.515 -3.264
187 H ILE 29 H ILE 29 4.200 6.285 -8.337
188 HA ILE 29 HA ILE 29 5.879 7.485 -6.296
189 HB ILE 29 HB ILE 29 5.722 7.968 -9.285
190 HG12 ILE 29 2HG1 ILE 29 7.766 6.440 -7.656
191 HG13 ILE 29 1HG1 ILE 29 6.509 5.707 -8.644
192 HG21 ILE 29 1HG2 ILE 29 7.845 9.150 -9.034
193 HG22 ILE 29 2HG2 ILE 29 7.751 8.972 -7.278
194 HG23 ILE 29 3HG2 ILE 29 6.554 9.945 -8.140
195 HD11 ILE 29 3HD1 ILE 29 8.758 7.433 -9.633
196 HD12 ILE 29 1HD1 ILE 29 7.500 6.702 -10.624
197 HD13 ILE 29 2HD1 ILE 29 8.648 5.673 -9.771
198 H ILE 30 H ILE 30 5.029 9.049 -5.178
199 HA ILE 30 HA ILE 30 2.795 10.574 -6.189
200 HB ILE 30 HB ILE 30 4.053 10.524 -3.418
201 HG12 ILE 30 2HG1 ILE 30 1.468 9.284 -4.404
202 HG13 ILE 30 1HG1 ILE 30 2.946 8.397 -4.063
203 HG21 ILE 30 1HG2 ILE 30 3.071 12.646 -3.762
204 HG22 ILE 30 2HG2 ILE 30 2.011 11.709 -2.701
205 HG23 ILE 30 3HG2 ILE 30 1.599 11.936 -4.399
206 HD11 ILE 30 3HD1 ILE 30 2.777 9.058 -1.711
207 HD12 ILE 30 1HD1 ILE 30 1.343 8.188 -2.254
208 HD13 ILE 30 2HD1 ILE 30 1.296 9.943 -2.072
209 H GLY 31 H GLY 31 3.022 12.517 -6.979
210 HA2 GLY 31 2HA GLY 31 4.328 14.649 -5.954
211 HA3 GLY 31 1HA GLY 31 5.523 13.898 -7.025
212 H ARG 32 H ARG 32 4.875 16.316 -7.729
213 HA ARG 32 HA ARG 32 2.839 15.889 -9.790
214 HB2 ARG 32 2HB ARG 32 3.821 18.531 -8.690
215 HB3 ARG 32 1HB ARG 32 2.670 18.344 -10.002
216 HG2 ARG 32 2HG ARG 32 1.230 17.067 -8.301
217 HG3 ARG 32 1HG ARG 32 2.324 17.721 -7.099
218 HD2 ARG 32 2HD ARG 32 0.696 19.374 -9.040
219 HD3 ARG 32 1HD ARG 32 0.347 19.149 -7.331
220 HE ARG 32 HE ARG 32 2.735 20.174 -7.122
221 HH11 ARG 32 1HH1 ARG 32 0.215 21.214 -9.403
222 HH12 ARG 32 2HH1 ARG 32 0.715 22.834 -9.428
223 HH21 ARG 32 1HH2 ARG 32 3.416 22.371 -7.187
224 HH22 ARG 32 2HH2 ARG 32 2.612 23.520 -8.165
225 H GLY 33 H GLY 33 3.792 15.219 -11.509
226 HA2 GLY 33 2HA GLY 33 5.450 16.806 -13.019
227 HA3 GLY 33 1HA GLY 33 6.455 15.638 -12.154
228 H GLN 34 H GLN 34 6.497 15.387 -14.746
229 HA GLN 34 HA GLN 34 4.411 13.626 -15.691
230 HB2 GLN 34 2HB GLN 34 7.031 14.450 -16.944
231 HB3 GLN 34 1HB GLN 34 5.790 13.504 -17.749
232 HG2 GLN 34 2HG GLN 34 4.237 15.370 -17.588
233 HG3 GLN 34 1HG GLN 34 5.452 16.315 -16.727
234 HE21 GLN 34 1HE2 GLN 34 5.447 17.903 -18.303
235 HE22 GLN 34 2HE2 GLN 34 6.192 17.683 -19.844
236 H ASP 35 H ASP 35 7.323 13.328 -14.005
237 HA ASP 35 HA ASP 35 7.785 10.554 -14.801
238 HB2 ASP 35 2HB ASP 35 9.650 12.276 -14.529
239 HB3 ASP 35 1HB ASP 35 9.342 12.217 -12.800
240 H ALA 36 H ALA 36 5.672 11.954 -12.915
241 HA ALA 36 HA ALA 36 5.906 10.147 -10.628
242 HB1 ALA 36 1HB ALA 36 4.280 11.615 -9.540
243 HB2 ALA 36 2HB ALA 36 4.185 12.596 -11.002
244 HB3 ALA 36 3HB ALA 36 5.689 12.525 -10.083
245 H GLN 37 H GLN 37 3.844 9.183 -9.870
246 HA GLN 37 HA GLN 37 2.213 8.343 -12.147
247 HB2 GLN 37 2HB GLN 37 2.716 6.979 -9.504
248 HB3 GLN 37 1HB GLN 37 1.785 6.349 -10.848
249 HG2 GLN 37 2HG GLN 37 4.758 6.849 -10.780
250 HG3 GLN 37 1HG GLN 37 3.951 5.284 -10.779
251 HE21 GLN 37 1HE2 GLN 37 5.927 6.394 -12.625
252 HE22 GLN 37 2HE2 GLN 37 5.196 6.351 -14.169
253 H PHE 38 H PHE 38 2.154 9.081 -8.690
254 HA PHE 38 HA PHE 38 -0.714 9.620 -8.845
255 HB2 PHE 38 2HB PHE 38 -0.037 7.866 -7.234
256 HB3 PHE 38 1HB PHE 38 1.070 8.989 -6.471
257 HD1 PHE 38 2HD PHE 38 0.161 10.862 -5.097
258 HD2 PHE 38 1HD PHE 38 -2.379 7.872 -6.749
259 HE1 PHE 38 2HE PHE 38 -1.523 11.481 -3.528
260 HE2 PHE 38 1HE PHE 38 -4.140 8.510 -5.155
261 HZ PHE 38 HZ PHE 38 -3.732 10.320 -3.530
262 H ARG 39 H ARG 39 -1.245 11.726 -8.684
263 HA ARG 39 HA ARG 39 0.934 13.560 -8.020
264 HB2 ARG 39 2HB ARG 39 -1.452 14.042 -9.797
265 HB3 ARG 39 1HB ARG 39 -0.074 15.112 -9.554
266 HG2 ARG 39 2HG ARG 39 1.406 13.433 -10.552
267 HG3 ARG 39 1HG ARG 39 0.021 12.372 -10.802
268 HD2 ARG 39 2HD ARG 39 -0.981 14.183 -12.207
269 HD3 ARG 39 1HD ARG 39 0.554 15.040 -12.065
270 HE ARG 39 HE ARG 39 0.521 12.309 -13.085
271 HH11 ARG 39 1HH1 ARG 39 1.123 15.735 -13.670
272 HH12 ARG 39 2HH1 ARG 39 1.828 15.516 -15.204
273 HH21 ARG 39 1HH2 ARG 39 1.536 11.985 -15.161
274 HH22 ARG 39 2HH2 ARG 39 2.069 13.317 -16.070
275 H LEU 40 H LEU 40 0.631 14.992 -6.448
276 HA LEU 40 HA LEU 40 -1.776 14.837 -4.893
277 HB2 LEU 40 2HB LEU 40 0.751 16.443 -4.532
278 HB3 LEU 40 1HB LEU 40 -0.623 16.601 -3.462
279 HG LEU 40 HG LEU 40 1.059 14.124 -3.859
280 HD11 LEU 40 1HD1 LEU 40 0.746 15.999 -1.522
281 HD12 LEU 40 2HD1 LEU 40 2.163 15.855 -2.565
282 HD13 LEU 40 3HD1 LEU 40 1.690 14.510 -1.528
283 HD21 LEU 40 3HD2 LEU 40 -0.271 13.163 -2.035
284 HD22 LEU 40 1HD2 LEU 40 -1.275 13.524 -3.440
285 HD23 LEU 40 2HD2 LEU 40 -1.307 14.592 -2.040
286 HA PRO 41 HA PRO 41 -3.809 18.247 -6.691
287 HB2 PRO 41 2HB PRO 41 -5.493 18.949 -4.716
288 HB3 PRO 41 1HB PRO 41 -5.669 17.440 -5.617
289 HG2 PRO 41 2HG PRO 41 -4.470 17.898 -2.913
290 HG3 PRO 41 1HG PRO 41 -5.547 16.598 -3.449
291 HD2 PRO 41 2HD PRO 41 -2.836 16.297 -3.228
292 HD3 PRO 41 1HD PRO 41 -3.811 15.378 -4.374
293 H ASP 42 H ASP 42 -1.496 18.796 -4.289
294 HA ASP 42 HA ASP 42 -1.856 21.665 -4.689
295 HB2 ASP 42 2HB ASP 42 -2.709 20.704 -2.318
296 HB3 ASP 42 1HB ASP 42 -0.987 20.934 -1.978
297 H THR 43 H THR 43 0.123 22.685 -3.179
298 HA THR 43 HA THR 43 2.449 21.836 -4.699
299 HB THR 43 HB THR 43 2.026 24.378 -3.083
300 HG1 THR 43 1HG THR 43 0.469 24.619 -4.504
301 HG21 THR 43 3HG2 THR 43 4.339 23.988 -3.814
302 HG22 THR 43 1HG2 THR 43 3.633 25.334 -4.703
303 HG23 THR 43 2HG2 THR 43 3.789 23.753 -5.475
304 H GLY 44 H GLY 44 4.611 22.299 -3.265
305 HA2 GLY 44 2HA GLY 44 5.619 22.225 -1.097
306 HA3 GLY 44 1HA GLY 44 4.187 21.386 -0.500
307 H VAL 45 H VAL 45 4.167 19.977 -3.032
308 HA VAL 45 HA VAL 45 5.820 17.732 -2.264
309 HB VAL 45 HB VAL 45 3.404 17.466 -2.714
310 HG11 VAL 45 1HG1 VAL 45 2.514 17.574 -4.981
311 HG12 VAL 45 2HG1 VAL 45 4.051 18.236 -5.538
312 HG13 VAL 45 3HG1 VAL 45 3.064 19.144 -4.392
313 HG21 VAL 45 3HG2 VAL 45 4.806 15.535 -3.028
314 HG22 VAL 45 1HG2 VAL 45 5.161 16.039 -4.681
315 HG23 VAL 45 2HG2 VAL 45 3.522 15.544 -4.240
316 H SER 46 H SER 46 7.347 16.840 -3.700
317 HA SER 46 HA SER 46 8.421 18.639 -5.706
318 HB2 SER 46 2HB SER 46 9.373 15.885 -4.859
319 HB3 SER 46 1HB SER 46 10.283 17.140 -5.714
320 HG SER 46 HG SER 46 10.106 18.443 -3.889
321 H ARG 47 H ARG 47 9.343 17.063 -7.757
322 HA ARG 47 HA ARG 47 6.960 16.175 -9.092
323 HB2 ARG 47 2HB ARG 47 8.469 15.468 -10.973
324 HB3 ARG 47 1HB ARG 47 8.709 17.140 -10.511
325 HG2 ARG 47 2HG ARG 47 10.734 16.553 -9.333
326 HG3 ARG 47 1HG ARG 47 10.464 14.840 -9.671
327 HD2 ARG 47 2HD ARG 47 10.731 15.239 -12.033
328 HD3 ARG 47 1HD ARG 47 10.865 16.976 -11.765
329 HE ARG 47 HE ARG 47 12.781 15.287 -10.398
330 HH11 ARG 47 1HH1 ARG 47 12.149 17.307 -13.250
331 HH12 ARG 47 2HH1 ARG 47 13.773 17.671 -13.556
332 HH21 ARG 47 1HH2 ARG 47 15.027 15.789 -10.798
333 HH22 ARG 47 2HH2 ARG 47 15.461 16.757 -12.131
334 H ARG 48 H ARG 48 9.761 14.647 -7.726
335 HA ARG 48 HA ARG 48 8.146 12.260 -7.303
336 HB2 ARG 48 2HB ARG 48 11.128 12.526 -7.721
337 HB3 ARG 48 1HB ARG 48 10.394 11.148 -6.929
338 HG2 ARG 48 2HG ARG 48 9.088 10.749 -9.029
339 HG3 ARG 48 1HG ARG 48 10.064 12.008 -9.791
340 HD2 ARG 48 2HD ARG 48 10.920 9.643 -10.131
341 HD3 ARG 48 1HD ARG 48 12.076 10.792 -9.443
342 HE ARG 48 HE ARG 48 11.414 9.865 -7.255
343 HH11 ARG 48 1HH1 ARG 48 11.328 7.736 -10.127
344 HH12 ARG 48 2HH1 ARG 48 11.514 6.329 -9.206
345 HH21 ARG 48 1HH2 ARG 48 11.658 7.913 -6.064
346 HH22 ARG 48 2HH2 ARG 48 11.630 6.419 -6.821
347 H HIS 49 H HIS 49 7.401 12.657 -5.354
348 HA HIS 49 HA HIS 49 9.171 13.957 -3.437
349 HB2 HIS 49 2HB HIS 49 6.940 14.909 -3.855
350 HB3 HIS 49 1HB HIS 49 6.210 13.400 -3.335
351 HD2 HIS 49 2HD HIS 49 6.385 12.884 -0.576
352 HE1 HIS 49 1HE HIS 49 7.373 16.880 0.371
353 HE2 HIS 49 2HE HIS 49 7.068 14.495 1.247
354 H LEU 50 H LEU 50 7.123 11.105 -3.867
355 HA LEU 50 HA LEU 50 8.811 9.593 -2.152
356 HB2 LEU 50 2HB LEU 50 7.564 10.659 -0.431
357 HB3 LEU 50 1HB LEU 50 6.053 10.453 -1.269
358 HG LEU 50 HG LEU 50 7.515 8.001 -0.330
359 HD11 LEU 50 1HD1 LEU 50 7.530 9.585 1.551
360 HD12 LEU 50 2HD1 LEU 50 6.444 8.227 1.824
361 HD13 LEU 50 3HD1 LEU 50 5.790 9.800 1.362
362 HD21 LEU 50 3HD2 LEU 50 5.246 7.195 -0.038
363 HD22 LEU 50 1HD2 LEU 50 5.460 7.822 -1.672
364 HD23 LEU 50 2HD2 LEU 50 4.603 8.781 -0.458
365 H GLU 51 H GLU 51 8.403 7.383 -2.355
366 HA GLU 51 HA GLU 51 6.274 6.678 -4.262
367 HB2 GLU 51 2HB GLU 51 7.721 4.912 -5.227
368 HB3 GLU 51 1HB GLU 51 8.330 6.527 -5.533
369 HG2 GLU 51 2HG GLU 51 10.068 6.267 -3.932
370 HG3 GLU 51 1HG GLU 51 9.322 4.800 -3.295
371 H ILE 52 H ILE 52 4.937 5.245 -3.582
372 HA ILE 52 HA ILE 52 5.663 3.601 -1.264
373 HB ILE 52 HB ILE 52 2.943 4.042 -2.537
374 HG12 ILE 52 2HG1 ILE 52 4.043 5.083 0.088
375 HG13 ILE 52 1HG1 ILE 52 3.786 6.042 -1.362
376 HG21 ILE 52 1HG2 ILE 52 2.054 2.843 -0.577
377 HG22 ILE 52 2HG2 ILE 52 3.706 2.555 -0.021
378 HG23 ILE 52 3HG2 ILE 52 3.147 1.839 -1.533
379 HD11 ILE 52 3HD1 ILE 52 1.382 5.647 -1.198
380 HD12 ILE 52 1HD1 ILE 52 2.017 6.400 0.264
381 HD13 ILE 52 2HD1 ILE 52 1.640 4.677 0.251
382 H ARG 53 H ARG 53 6.358 1.657 -1.736
383 HA ARG 53 HA ARG 53 5.532 0.498 -4.289
384 HB2 ARG 53 2HB ARG 53 7.940 0.902 -3.994
385 HB3 ARG 53 1HB ARG 53 7.955 -0.162 -2.601
386 HG2 ARG 53 2HG ARG 53 7.505 -2.058 -3.962
387 HG3 ARG 53 1HG ARG 53 7.168 -1.048 -5.366
388 HD2 ARG 53 2HD ARG 53 9.814 -1.428 -3.982
389 HD3 ARG 53 1HD ARG 53 9.355 -1.965 -5.601
390 HE ARG 53 HE ARG 53 9.522 0.883 -4.853
391 HH11 ARG 53 1HH1 ARG 53 10.328 -1.693 -7.150
392 HH12 ARG 53 2HH1 ARG 53 11.028 -0.629 -8.275
393 HH21 ARG 53 1HH2 ARG 53 10.461 2.289 -6.364
394 HH22 ARG 53 2HH2 ARG 53 11.100 1.713 -7.841
395 H TRP 54 H TRP 54 3.938 -0.864 -4.113
396 HA TRP 54 HA TRP 54 3.680 -2.310 -1.620
397 HB2 TRP 54 2HB TRP 54 1.757 -0.903 -2.031
398 HB3 TRP 54 1HB TRP 54 1.606 -1.498 -3.677
399 HD1 TRP 54 HD TRP 54 -0.342 -3.186 -3.931
400 HE1 TRP 54 1HE TRP 54 -1.527 -4.905 -2.358
401 HE3 TRP 54 3HE TRP 54 2.386 -2.539 0.327
402 HZ2 TRP 54 2HZ TRP 54 -1.338 -5.824 0.242
403 HZ3 TRP 54 3HZ TRP 54 1.832 -3.872 2.300
404 HH2 TRP 54 HH TRP 54 -0.000 -5.486 2.266
405 H ASP 55 H ASP 55 3.726 -4.396 -1.599
406 HA ASP 55 HA ASP 55 3.425 -6.012 -3.975
407 HB2 ASP 55 2HB ASP 55 5.888 -5.553 -3.748
408 HB3 ASP 55 1HB ASP 55 5.829 -6.171 -2.106
409 H GLY 56 H GLY 56 3.280 -8.370 -3.108
410 HA2 GLY 56 2HA GLY 56 1.351 -8.312 -1.002
411 HA3 GLY 56 1HA GLY 56 1.903 -9.738 -1.864
412 H GLN 57 H GLN 57 3.129 -7.362 0.414
413 HA GLN 57 HA GLN 57 3.716 -9.345 2.399
414 HB2 GLN 57 2HB GLN 57 5.736 -9.448 0.890
415 HB3 GLN 57 1HB GLN 57 6.039 -7.756 1.245
416 HG2 GLN 57 2HG GLN 57 6.348 -8.302 3.600
417 HG3 GLN 57 1HG GLN 57 6.021 -9.999 3.252
418 HE21 GLN 57 1HE2 GLN 57 8.352 -7.437 3.067
419 HE22 GLN 57 2HE2 GLN 57 9.649 -8.397 2.498
420 H VAL 58 H VAL 58 5.175 -6.149 1.740
421 HA VAL 58 HA VAL 58 3.511 -4.894 3.755
422 HB VAL 58 HB VAL 58 5.479 -3.755 4.786
423 HG11 VAL 58 1HG1 VAL 58 5.542 -6.747 5.043
424 HG12 VAL 58 2HG1 VAL 58 4.529 -5.634 5.968
425 HG13 VAL 58 3HG1 VAL 58 6.283 -5.611 6.169
426 HG21 VAL 58 3HG2 VAL 58 7.731 -4.654 4.478
427 HG22 VAL 58 1HG2 VAL 58 7.076 -4.030 2.964
428 HG23 VAL 58 2HG2 VAL 58 7.120 -5.769 3.250
429 H ALA 59 H ALA 59 3.726 -2.531 3.630
430 HA ALA 59 HA ALA 59 4.163 -1.753 0.866
431 HB1 ALA 59 1HB ALA 59 2.934 -0.199 3.138
432 HB2 ALA 59 2HB ALA 59 2.034 -1.115 1.933
433 HB3 ALA 59 3HB ALA 59 2.977 0.296 1.447
434 H LEU 60 H LEU 60 6.006 -1.058 0.315
435 HA LEU 60 HA LEU 60 7.930 -0.172 2.241
436 HB2 LEU 60 2HB LEU 60 8.561 -1.714 0.509
437 HB3 LEU 60 1HB LEU 60 7.994 -0.618 -0.725
438 HG LEU 60 HG LEU 60 9.814 0.951 -0.126
439 HD11 LEU 60 1HD1 LEU 60 10.689 -1.288 1.688
440 HD12 LEU 60 2HD1 LEU 60 10.101 0.296 2.200
441 HD13 LEU 60 3HD1 LEU 60 11.627 0.163 1.317
442 HD21 LEU 60 3HD2 LEU 60 10.024 -0.700 -1.905
443 HD22 LEU 60 1HD2 LEU 60 10.694 -1.852 -0.762
444 HD23 LEU 60 2HD2 LEU 60 11.588 -0.370 -1.141
445 H LEU 61 H LEU 61 7.766 1.817 2.885
446 HA LEU 61 HA LEU 61 6.801 3.945 1.162
447 HB2 LEU 61 2HB LEU 61 5.893 3.549 3.414
448 HB3 LEU 61 1HB LEU 61 7.445 3.770 4.141
449 HG LEU 61 HG LEU 61 5.989 5.657 4.565
450 HD11 LEU 61 1HD1 LEU 61 7.273 7.549 3.776
451 HD12 LEU 61 2HD1 LEU 61 8.108 6.505 2.622
452 HD13 LEU 61 3HD1 LEU 61 8.310 6.244 4.352
453 HD21 LEU 61 3HD2 LEU 61 4.500 5.385 2.668
454 HD22 LEU 61 1HD2 LEU 61 5.760 5.968 1.586
455 HD23 LEU 61 2HD2 LEU 61 5.056 7.047 2.801
456 H ALA 62 H ALA 62 8.430 4.816 -0.087
457 HA ALA 62 HA ALA 62 11.000 5.289 1.245
458 HB1 ALA 62 1HB ALA 62 10.561 4.647 -1.676
459 HB2 ALA 62 2HB ALA 62 11.231 3.547 -0.474
460 HB3 ALA 62 3HB ALA 62 12.113 5.006 -0.920
461 H ASP 63 H ASP 63 11.427 7.336 1.476
462 HA ASP 63 HA ASP 63 9.779 9.291 0.072
463 HB2 ASP 63 2HB ASP 63 9.798 9.374 2.500
464 HB3 ASP 63 1HB ASP 63 11.551 9.519 2.503
465 H LEU 64 H LEU 64 10.588 10.926 -1.148
466 HA LEU 64 HA LEU 64 13.409 10.716 -1.910
467 HB2 LEU 64 2HB LEU 64 11.052 11.869 -3.412
468 HB3 LEU 64 1HB LEU 64 12.699 12.183 -3.889
469 HG LEU 64 HG LEU 64 11.764 10.524 -5.317
470 HD11 LEU 64 1HD1 LEU 64 14.081 10.260 -4.838
471 HD12 LEU 64 2HD1 LEU 64 13.313 8.702 -5.104
472 HD13 LEU 64 3HD1 LEU 64 13.718 9.212 -3.460
473 HD21 LEU 64 3HD2 LEU 64 10.995 8.322 -4.509
474 HD22 LEU 64 1HD2 LEU 64 9.989 9.654 -3.941
475 HD23 LEU 64 2HD2 LEU 64 11.156 8.903 -2.851
476 H ASN 65 H ASN 65 14.536 11.958 -0.621
477 HA ASN 65 HA ASN 65 15.503 13.746 0.305
478 HB2 ASN 65 2HB ASN 65 13.753 15.386 -1.554
479 HB3 ASN 65 1HB ASN 65 15.020 16.058 -0.543
480 HD21 ASN 65 1HD2 ASN 65 14.681 16.011 -3.446
481 HD22 ASN 65 2HD2 ASN 65 16.133 15.291 -4.058
482 H SER 66 H SER 66 14.759 13.269 2.300
483 HA SER 66 HA SER 66 12.203 13.784 3.240
484 HB2 SER 66 2HB SER 66 14.733 13.291 4.778
485 HB3 SER 66 1HB SER 66 13.078 13.039 5.349
486 HG SER 66 HG SER 66 12.900 11.697 3.359
487 H THR 67 H THR 67 14.819 15.950 2.899
488 HA THR 67 HA THR 67 14.484 17.745 4.990
489 HB THR 67 HB THR 67 16.318 17.985 3.371
490 HG1 THR 67 1HG THR 67 16.353 20.140 3.407
491 HG21 THR 67 3HG2 THR 67 15.108 17.338 1.308
492 HG22 THR 67 1HG2 THR 67 15.925 18.885 1.085
493 HG23 THR 67 2HG2 THR 67 14.182 18.817 1.368
494 H ASN 68 H ASN 68 12.654 17.397 2.038
495 HA ASN 68 HA ASN 68 10.635 19.297 3.011
496 HB2 ASN 68 2HB ASN 68 11.762 20.238 1.085
497 HB3 ASN 68 1HB ASN 68 11.672 18.718 0.222
498 HD21 ASN 68 1HD2 ASN 68 9.875 18.229 -0.874
499 HD22 ASN 68 2HD2 ASN 68 8.519 19.299 -1.077
500 H GLY 69 H GLY 69 11.392 16.240 2.794
501 HA2 GLY 69 2HA GLY 69 9.296 15.136 1.209
502 HA3 GLY 69 1HA GLY 69 10.531 14.258 2.084
503 H THR 70 H THR 70 9.502 12.864 3.199
504 HA THR 70 HA THR 70 6.940 13.587 4.412
505 HB THR 70 HB THR 70 7.932 10.913 3.491
506 HG1 THR 70 1HG THR 70 7.823 12.037 1.730
507 HG21 THR 70 3HG2 THR 70 6.074 10.809 5.088
508 HG22 THR 70 1HG2 THR 70 5.528 10.364 3.473
509 HG23 THR 70 2HG2 THR 70 5.161 11.966 4.122
510 H THR 71 H THR 71 6.391 12.723 6.384
511 HA THR 71 HA THR 71 8.541 11.611 8.019
512 HB THR 71 HB THR 71 7.148 12.666 9.897
513 HG1 THR 71 1HG THR 71 6.327 14.294 7.708
514 HG21 THR 71 3HG2 THR 71 8.313 14.794 9.663
515 HG22 THR 71 1HG2 THR 71 8.703 14.376 7.980
516 HG23 THR 71 2HG2 THR 71 9.333 13.385 9.312
517 H VAL 72 H VAL 72 8.019 9.840 9.221
518 HA VAL 72 HA VAL 72 5.260 8.881 9.072
519 HB VAL 72 HB VAL 72 6.160 6.565 9.422
520 HG11 VAL 72 1HG1 VAL 72 5.956 7.339 7.139
521 HG12 VAL 72 2HG1 VAL 72 7.340 6.262 7.319
522 HG13 VAL 72 3HG1 VAL 72 7.583 8.009 7.210
523 HG21 VAL 72 3HG2 VAL 72 8.590 6.172 9.405
524 HG22 VAL 72 1HG2 VAL 72 8.113 7.166 10.786
525 HG23 VAL 72 2HG2 VAL 72 8.858 7.921 9.383
526 H ASN 73 H ASN 73 4.236 8.845 10.907
527 HA ASN 73 HA ASN 73 3.688 9.316 13.058
528 HB2 ASN 73 2HB ASN 73 6.472 8.258 13.709
529 HB3 ASN 73 1HB ASN 73 5.215 8.561 14.904
530 HD21 ASN 73 1HD2 ASN 73 6.347 6.498 12.409
531 HD22 ASN 73 2HD2 ASN 73 5.176 5.255 12.554
532 H ASN 74 H ASN 74 5.097 11.182 11.310
533 HA ASN 74 HA ASN 74 5.686 13.314 11.217
534 HB2 ASN 74 2HB ASN 74 4.022 13.548 13.165
535 HB3 ASN 74 1HB ASN 74 5.414 13.544 14.237
536 HD21 ASN 74 1HD2 ASN 74 6.544 15.444 14.510
537 HD22 ASN 74 2HD2 ASN 74 6.148 16.909 13.698
538 H ALA 75 H ALA 75 7.553 11.038 11.866
539 HA ALA 75 HA ALA 75 9.904 12.672 12.515
540 HB1 ALA 75 1HB ALA 75 10.983 10.568 13.230
541 HB2 ALA 75 2HB ALA 75 9.503 9.685 12.857
542 HB3 ALA 75 3HB ALA 75 9.514 10.870 14.160
543 HA PRO 76 HA PRO 76 10.822 11.920 8.196
544 HB2 PRO 76 2HB PRO 76 13.376 12.837 8.148
545 HB3 PRO 76 1HB PRO 76 11.974 13.910 8.234
546 HG2 PRO 76 2HG PRO 76 13.790 12.986 10.422
547 HG3 PRO 76 1HG PRO 76 13.119 14.603 10.140
548 HD2 PRO 76 2HD PRO 76 12.104 12.871 11.976
549 HD3 PRO 76 1HD PRO 76 11.106 14.070 11.129
550 H VAL 77 H VAL 77 11.612 10.241 7.013
551 HA VAL 77 HA VAL 77 13.790 8.598 8.034
552 HB VAL 77 HB VAL 77 12.513 6.502 7.561
553 HG11 VAL 77 1HG1 VAL 77 11.286 8.219 9.707
554 HG12 VAL 77 2HG1 VAL 77 12.730 7.222 9.863
555 HG13 VAL 77 3HG1 VAL 77 11.157 6.464 9.599
556 HG21 VAL 77 3HG2 VAL 77 10.030 6.619 7.463
557 HG22 VAL 77 1HG2 VAL 77 10.824 7.354 6.066
558 HG23 VAL 77 2HG2 VAL 77 10.162 8.370 7.340
559 H GLN 78 H GLN 78 14.563 7.107 6.344
560 HA GLN 78 HA GLN 78 14.330 8.328 3.716
561 HB2 GLN 78 2HB GLN 78 15.995 5.982 4.673
562 HB3 GLN 78 1HB GLN 78 16.087 6.698 3.070
563 HG2 GLN 78 2HG GLN 78 16.748 8.091 5.661
564 HG3 GLN 78 1HG GLN 78 17.913 7.446 4.507
565 HE21 GLN 78 1HE2 GLN 78 15.612 9.967 5.157
566 HE22 GLN 78 2HE2 GLN 78 16.047 11.000 3.877
567 H GLU 79 H GLU 79 13.749 5.243 5.278
568 HA GLU 79 HA GLU 79 11.570 4.742 3.479
569 HB2 GLU 79 2HB GLU 79 12.271 2.416 3.063
570 HB3 GLU 79 1HB GLU 79 13.403 3.566 2.374
571 HG2 GLU 79 2HG GLU 79 14.920 3.196 4.246
572 HG3 GLU 79 1HG GLU 79 13.774 2.051 4.946
573 H TRP 80 H TRP 80 10.098 3.265 4.339
574 HA TRP 80 HA TRP 80 10.426 2.369 7.073
575 HB2 TRP 80 2HB TRP 80 9.739 4.645 7.360
576 HB3 TRP 80 1HB TRP 80 8.377 4.507 6.269
577 HD1 TRP 80 HD TRP 80 6.194 3.313 7.273
578 HE1 TRP 80 1HE TRP 80 5.420 3.038 9.711
579 HE3 TRP 80 3HE TRP 80 10.642 4.133 9.631
580 HZ2 TRP 80 2HZ TRP 80 6.537 3.143 12.271
581 HZ3 TRP 80 3HZ TRP 80 10.695 4.045 12.085
582 HH2 TRP 80 HH TRP 80 8.675 3.566 13.370
583 H GLN 81 H GLN 81 8.927 0.776 7.531
584 HA GLN 81 HA GLN 81 7.424 -0.151 5.204
585 HB2 GLN 81 2HB GLN 81 8.220 -1.663 7.707
586 HB3 GLN 81 1HB GLN 81 7.308 -2.342 6.365
587 HG2 GLN 81 2HG GLN 81 9.220 -1.917 4.877
588 HG3 GLN 81 1HG GLN 81 10.133 -1.308 6.252
589 HE21 GLN 81 1HE2 GLN 81 11.694 -2.864 5.994
590 HE22 GLN 81 2HE2 GLN 81 11.446 -4.516 6.430
591 H LEU 82 H LEU 82 5.499 0.594 5.181
592 HA LEU 82 HA LEU 82 4.148 1.833 7.289
593 HB2 LEU 82 2HB LEU 82 2.849 0.530 4.911
594 HB3 LEU 82 1HB LEU 82 2.176 1.743 5.974
595 HG LEU 82 HG LEU 82 4.500 2.206 4.117
596 HD11 LEU 82 1HD1 LEU 82 1.627 3.107 3.943
597 HD12 LEU 82 2HD1 LEU 82 2.407 1.924 2.896
598 HD13 LEU 82 3HD1 LEU 82 2.926 3.607 2.864
599 HD21 LEU 82 3HD2 LEU 82 4.622 3.574 6.111
600 HD22 LEU 82 1HD2 LEU 82 2.943 4.063 5.890
601 HD23 LEU 82 2HD2 LEU 82 4.160 4.554 4.719
602 H ALA 83 H ALA 83 2.435 1.251 8.562
603 HA ALA 83 HA ALA 83 1.554 -1.474 8.660
604 HB1 ALA 83 1HB ALA 83 3.500 -1.501 10.146
605 HB2 ALA 83 2HB ALA 83 2.012 -1.595 11.101
606 HB3 ALA 83 3HB ALA 83 2.884 -0.072 10.974
607 H ASP 84 H ASP 84 -0.258 -1.591 10.193
608 HA ASP 84 HA ASP 84 -2.149 0.411 9.631
609 HB2 ASP 84 2HB ASP 84 -2.811 -1.893 10.125
610 HB3 ASP 84 1HB ASP 84 -2.274 -1.690 11.789
611 H GLY 85 H GLY 85 -2.312 2.335 10.425
612 HA2 GLY 85 2HA GLY 85 -2.931 3.732 12.213
613 HA3 GLY 85 1HA GLY 85 -2.073 2.665 13.308
614 H ASP 86 H ASP 86 -0.319 3.416 10.435
615 HA ASP 86 HA ASP 86 1.370 5.135 12.072
616 HB2 ASP 86 2HB ASP 86 2.181 3.209 10.379
617 HB3 ASP 86 1HB ASP 86 2.074 4.540 9.225
618 H VAL 87 H VAL 87 1.950 7.232 11.405
619 HA VAL 87 HA VAL 87 -0.116 8.486 9.722
620 HB VAL 87 HB VAL 87 1.496 9.808 11.930
621 HG11 VAL 87 1HG1 VAL 87 0.816 11.378 10.201
622 HG12 VAL 87 2HG1 VAL 87 -0.088 11.667 11.686
623 HG13 VAL 87 3HG1 VAL 87 -0.855 10.832 10.337
624 HG21 VAL 87 3HG2 VAL 87 -0.583 9.823 13.232
625 HG22 VAL 87 1HG2 VAL 87 -0.061 8.177 12.873
626 HG23 VAL 87 2HG2 VAL 87 -1.386 8.901 11.960
627 H ILE 88 H ILE 88 0.645 9.032 7.840
628 HA ILE 88 HA ILE 88 3.496 9.585 7.578
629 HB ILE 88 HB ILE 88 1.449 8.439 5.660
630 HG12 ILE 88 2HG1 ILE 88 3.191 6.698 5.269
631 HG13 ILE 88 1HG1 ILE 88 4.208 7.497 6.449
632 HG21 ILE 88 1HG2 ILE 88 2.547 10.159 4.381
633 HG22 ILE 88 2HG2 ILE 88 3.043 8.563 3.817
634 HG23 ILE 88 3HG2 ILE 88 4.125 9.516 4.833
635 HD11 ILE 88 3HD1 ILE 88 2.581 6.974 8.192
636 HD12 ILE 88 1HD1 ILE 88 3.141 5.520 7.367
637 HD13 ILE 88 2HD1 ILE 88 1.553 6.186 6.994
638 H ARG 89 H ARG 89 3.978 11.700 7.270
639 HA ARG 89 HA ARG 89 1.882 13.290 6.019
640 HB2 ARG 89 2HB ARG 89 2.028 13.811 8.429
641 HB3 ARG 89 1HB ARG 89 3.703 14.298 8.200
642 HG2 ARG 89 2HG ARG 89 3.084 16.115 6.812
643 HG3 ARG 89 1HG ARG 89 1.416 15.563 6.718
644 HD2 ARG 89 2HD ARG 89 1.255 15.926 9.186
645 HD3 ARG 89 1HD ARG 89 2.860 16.657 9.123
646 HE ARG 89 HE ARG 89 1.593 18.040 7.256
647 HH11 ARG 89 1HH1 ARG 89 0.674 17.350 10.624
648 HH12 ARG 89 2HH1 ARG 89 -0.374 18.696 10.708
649 HH21 ARG 89 1HH2 ARG 89 0.201 19.852 7.431
650 HH22 ARG 89 2HH2 ARG 89 -0.640 20.133 8.905
651 H LEU 90 H LEU 90 2.373 14.053 4.230
652 HA LEU 90 HA LEU 90 5.121 14.729 3.623
653 HB2 LEU 90 2HB LEU 90 4.660 14.213 1.229
654 HB3 LEU 90 1HB LEU 90 4.626 12.807 2.252
655 HG LEU 90 HG LEU 90 2.109 14.173 1.259
656 HD11 LEU 90 1HD1 LEU 90 3.494 13.451 -0.633
657 HD12 LEU 90 2HD1 LEU 90 2.063 12.433 -0.462
658 HD13 LEU 90 3HD1 LEU 90 3.632 11.845 0.082
659 HD21 LEU 90 3HD2 LEU 90 1.090 11.997 1.729
660 HD22 LEU 90 1HD2 LEU 90 1.828 12.653 3.191
661 HD23 LEU 90 2HD2 LEU 90 2.641 11.375 2.287
662 H GLY 91 H GLY 91 5.218 16.384 1.810
663 HA2 GLY 91 2HA GLY 91 4.392 18.827 2.639
664 HA3 GLY 91 1HA GLY 91 4.644 18.457 0.947
665 H HIS 92 H HIS 92 2.473 19.421 3.293
666 HA HIS 92 HA HIS 92 0.398 20.141 3.356
667 HB2 HIS 92 2HB HIS 92 0.638 19.994 0.376
668 HB3 HIS 92 1HB HIS 92 -0.903 20.395 1.123
669 HD1 HIS 92 1HD HIS 92 -1.250 22.812 1.583
670 HD2 HIS 92 2HD HIS 92 2.777 21.840 1.265
671 HE1 HIS 92 1HE HIS 92 -0.009 24.985 1.694
672 H SER 93 H SER 93 0.995 17.019 2.717
673 HA SER 93 HA SER 93 -1.864 16.392 2.886
674 HB2 SER 93 2HB SER 93 0.160 14.796 1.349
675 HB3 SER 93 1HB SER 93 -1.579 14.540 1.400
676 HG SER 93 HG SER 93 -0.299 16.859 0.391
677 H GLU 94 H GLU 94 -2.144 15.566 4.841
678 HA GLU 94 HA GLU 94 -0.144 13.706 5.856
679 HB2 GLU 94 2HB GLU 94 -1.257 14.006 8.074
680 HB3 GLU 94 1HB GLU 94 -0.569 15.491 7.443
681 HG2 GLU 94 2HG GLU 94 -2.812 16.183 6.709
682 HG3 GLU 94 1HG GLU 94 -3.470 14.712 7.430
683 H ILE 95 H ILE 95 -0.677 11.603 6.141
684 HA ILE 95 HA ILE 95 -3.416 10.888 5.474
685 HB ILE 95 HB ILE 95 -1.900 10.878 3.454
686 HG12 ILE 95 2HG1 ILE 95 -2.515 8.569 2.701
687 HG13 ILE 95 1HG1 ILE 95 -3.209 8.318 4.307
688 HG21 ILE 95 1HG2 ILE 95 -0.328 9.047 3.132
689 HG22 ILE 95 2HG2 ILE 95 -0.560 8.570 4.812
690 HG23 ILE 95 3HG2 ILE 95 0.158 10.136 4.435
691 HD11 ILE 95 3HD1 ILE 95 -4.004 10.436 2.329
692 HD12 ILE 95 1HD1 ILE 95 -4.688 10.236 3.939
693 HD13 ILE 95 2HD1 ILE 95 -4.921 8.984 2.728
694 H ILE 96 H ILE 96 -4.148 9.076 6.559
695 HA ILE 96 HA ILE 96 -2.278 7.884 8.474
696 HB ILE 96 HB ILE 96 -5.322 7.809 8.441
697 HG12 ILE 96 2HG1 ILE 96 -3.437 9.338 10.255
698 HG13 ILE 96 1HG1 ILE 96 -4.401 10.042 8.965
699 HG21 ILE 96 1HG2 ILE 96 -4.373 5.804 9.471
700 HG22 ILE 96 2HG2 ILE 96 -5.135 6.825 10.692
701 HG23 ILE 96 3HG2 ILE 96 -3.377 6.806 10.529
702 HD11 ILE 96 3HD1 ILE 96 -5.409 10.437 11.135
703 HD12 ILE 96 1HD1 ILE 96 -5.467 8.701 11.444
704 HD13 ILE 96 2HD1 ILE 96 -6.443 9.401 10.152
705 H VAL 97 H VAL 97 -1.678 5.826 8.182
706 HA VAL 97 HA VAL 97 -2.821 4.439 5.905
707 HB VAL 97 HB VAL 97 -0.279 3.957 7.484
708 HG11 VAL 97 1HG1 VAL 97 -1.371 2.447 5.103
709 HG12 VAL 97 2HG1 VAL 97 -1.221 1.820 6.745
710 HG13 VAL 97 3HG1 VAL 97 0.226 2.218 5.819
711 HG21 VAL 97 3HG2 VAL 97 -0.769 4.781 4.641
712 HG22 VAL 97 1HG2 VAL 97 0.807 4.586 5.404
713 HG23 VAL 97 2HG2 VAL 97 -0.291 5.873 5.941
714 H ARG 98 H ARG 98 -4.367 3.080 6.256
715 HA ARG 98 HA ARG 98 -4.354 1.528 8.732
716 HB2 ARG 98 2HB ARG 98 -6.609 2.423 6.944
717 HB3 ARG 98 1HB ARG 98 -6.801 1.107 8.091
718 HG2 ARG 98 2HG ARG 98 -5.982 3.906 8.820
719 HG3 ARG 98 1HG ARG 98 -7.631 3.274 8.935
720 HD2 ARG 98 2HD ARG 98 -6.843 1.543 10.480
721 HD3 ARG 98 1HD ARG 98 -5.210 2.178 10.372
722 HE ARG 98 HE ARG 98 -7.075 4.145 11.188
723 HH11 ARG 98 1HH1 ARG 98 -5.191 1.330 12.386
724 HH12 ARG 98 2HH1 ARG 98 -5.120 1.916 13.967
725 HH21 ARG 98 1HH2 ARG 98 -6.950 4.900 13.409
726 HH22 ARG 98 2HH2 ARG 98 -6.136 3.951 14.572
727 H MET 99 H MET 99 -4.120 -0.542 8.599
728 HA MET 99 HA MET 99 -4.148 -1.682 5.901
729 HB2 MET 99 2HB MET 99 -2.466 -2.559 8.249
730 HB3 MET 99 1HB MET 99 -2.566 -3.413 6.720
731 HG2 MET 99 2HG MET 99 -1.677 -1.462 5.555
732 HG3 MET 99 1HG MET 99 -1.535 -0.610 7.086
733 HE1 MET 99 3HE MET 99 1.010 -4.325 5.995
734 HE2 MET 99 1HE MET 99 -0.199 -3.629 4.923
735 HE3 MET 99 2HE MET 99 -0.700 -4.453 6.400
736 H HIS 100 H HIS 100 -5.834 -2.697 5.630
737 HA HIS 100 HA HIS 100 -7.217 -3.849 7.910
738 HB2 HIS 100 2HB HIS 100 -8.210 -3.333 5.093
739 HB3 HIS 100 1HB HIS 100 -9.174 -3.909 6.447
740 HD1 HIS 100 1HD HIS 100 -9.759 -2.128 8.305
741 HD2 HIS 100 2HD HIS 100 -7.777 -0.624 4.988
742 HE1 HIS 100 1HE HIS 100 -9.969 0.382 8.434
Start of MODEL 11
1 H1 GLY 1 1HT GLY 1 3.709 -15.572 -3.262
2 H2 GLY 1 2HT GLY 1 2.490 -15.052 -2.194
3 H3 GLY 1 3HT GLY 1 3.644 -13.967 -2.723
4 HA2 GLY 1 1HA GLY 1 2.796 -14.050 -4.942
5 HA3 GLY 1 2HA GLY 1 1.621 -15.264 -4.431
6 H HIS 2 H HIS 2 1.206 -12.506 -5.510
7 HA HIS 2 HA HIS 2 -0.255 -11.546 -3.211
8 HB2 HIS 2 2HB HIS 2 0.310 -9.175 -3.803
9 HB3 HIS 2 1HB HIS 2 1.547 -10.166 -3.050
10 HD1 HIS 2 1HD HIS 2 0.728 -8.437 -6.338
11 HD2 HIS 2 2HD HIS 2 3.820 -10.572 -4.553
12 HE1 HIS 2 1HE HIS 2 2.739 -8.146 -7.818
13 H GLY 3 H GLY 3 -1.983 -10.492 -3.408
14 HA2 GLY 3 2HA GLY 3 -3.099 -9.509 -5.793
15 HA3 GLY 3 1HA GLY 3 -3.883 -10.989 -5.195
16 H SER 4 H SER 4 -5.218 -8.474 -5.022
17 HA SER 4 HA SER 4 -4.737 -7.691 -2.295
18 HB2 SER 4 2HB SER 4 -6.740 -6.585 -4.266
19 HB3 SER 4 1HB SER 4 -6.315 -5.884 -2.704
20 HG SER 4 HG SER 4 -4.437 -6.378 -4.773
21 H ALA 5 H ALA 5 -5.248 -9.813 -1.595
22 HA ALA 5 HA ALA 5 -7.825 -9.924 -0.408
23 HB1 ALA 5 1HB ALA 5 -7.017 -12.122 -2.332
24 HB2 ALA 5 2HB ALA 5 -8.356 -10.998 -2.554
25 HB3 ALA 5 3HB ALA 5 -8.407 -12.179 -1.245
26 H GLY 6 H GLY 6 -6.925 -10.036 1.532
27 HA2 GLY 6 2HA GLY 6 -6.159 -11.900 3.077
28 HA3 GLY 6 1HA GLY 6 -4.724 -11.916 2.037
29 H THR 7 H THR 7 -4.327 -9.391 1.491
30 HA THR 7 HA THR 7 -4.545 -7.773 3.870
31 HB THR 7 HB THR 7 -1.934 -8.294 2.398
32 HG1 THR 7 1HG THR 7 -3.115 -9.452 4.472
33 HG21 THR 7 3HG2 THR 7 -2.127 -5.945 3.093
34 HG22 THR 7 1HG2 THR 7 -0.925 -6.781 4.076
35 HG23 THR 7 2HG2 THR 7 -2.530 -6.448 4.733
36 H SER 8 H SER 8 -5.622 -6.080 3.106
37 HA SER 8 HA SER 8 -4.818 -4.948 0.524
38 HB2 SER 8 2HB SER 8 -7.486 -4.746 1.939
39 HB3 SER 8 1HB SER 8 -7.096 -4.020 0.383
40 HG SER 8 HG SER 8 -7.057 -6.795 0.958
41 H VAL 9 H VAL 9 -3.700 -3.144 0.829
42 HA VAL 9 HA VAL 9 -3.990 -1.823 3.393
43 HB VAL 9 HB VAL 9 -1.696 -2.417 2.854
44 HG11 VAL 9 1HG1 VAL 9 -2.077 -0.817 0.383
45 HG12 VAL 9 2HG1 VAL 9 -1.816 -2.563 0.480
46 HG13 VAL 9 3HG1 VAL 9 -0.523 -1.442 0.933
47 HG21 VAL 9 3HG2 VAL 9 -1.961 -0.346 4.081
48 HG22 VAL 9 1HG2 VAL 9 -2.109 0.556 2.572
49 HG23 VAL 9 2HG2 VAL 9 -0.585 -0.229 2.982
50 H THR 10 H THR 10 -4.835 0.071 3.620
51 HA THR 10 HA THR 10 -5.767 1.462 1.221
52 HB THR 10 HB THR 10 -7.324 0.973 3.772
53 HG1 THR 10 1HG THR 10 -6.828 -0.636 1.820
54 HG21 THR 10 3HG2 THR 10 -8.168 2.146 1.107
55 HG22 THR 10 1HG2 THR 10 -7.922 3.063 2.590
56 HG23 THR 10 2HG2 THR 10 -9.224 1.876 2.495
57 H LEU 11 H LEU 11 -5.369 3.564 1.285
58 HA LEU 11 HA LEU 11 -4.160 4.607 3.692
59 HB2 LEU 11 2HB LEU 11 -3.379 6.449 2.298
60 HB3 LEU 11 1HB LEU 11 -2.907 4.914 1.623
61 HG LEU 11 HG LEU 11 -4.979 5.286 0.068
62 HD11 LEU 11 1HD1 LEU 11 -5.884 7.250 1.179
63 HD12 LEU 11 2HD1 LEU 11 -5.399 7.642 -0.470
64 HD13 LEU 11 3HD1 LEU 11 -4.384 8.127 0.885
65 HD21 LEU 11 3HD2 LEU 11 -2.705 5.169 -0.724
66 HD22 LEU 11 1HD2 LEU 11 -2.416 6.836 -0.225
67 HD23 LEU 11 2HD2 LEU 11 -3.550 6.491 -1.530
68 H GLN 12 H GLN 12 -5.123 6.040 4.970
69 HA GLN 12 HA GLN 12 -7.732 7.068 4.140
70 HB2 GLN 12 2HB GLN 12 -7.548 5.679 6.302
71 HB3 GLN 12 1HB GLN 12 -6.541 6.973 6.937
72 HG2 GLN 12 2HG GLN 12 -9.339 7.459 5.998
73 HG3 GLN 12 1HG GLN 12 -8.983 6.892 7.622
74 HE21 GLN 12 1HE2 GLN 12 -10.188 9.298 6.692
75 HE22 GLN 12 2HE2 GLN 12 -9.289 10.635 7.323
76 H LEU 13 H LEU 13 -7.546 8.996 3.318
77 HA LEU 13 HA LEU 13 -5.272 10.649 4.085
78 HB2 LEU 13 2HB LEU 13 -5.333 10.126 1.759
79 HB3 LEU 13 1HB LEU 13 -7.019 10.579 1.644
80 HG LEU 13 HG LEU 13 -6.394 12.893 2.146
81 HD11 LEU 13 1HD1 LEU 13 -4.058 13.596 1.922
82 HD12 LEU 13 2HD1 LEU 13 -3.561 11.902 1.866
83 HD13 LEU 13 3HD1 LEU 13 -4.324 12.562 3.321
84 HD21 LEU 13 3HD2 LEU 13 -6.749 12.209 -0.139
85 HD22 LEU 13 1HD2 LEU 13 -5.074 11.674 -0.275
86 HD23 LEU 13 2HD2 LEU 13 -5.444 13.391 -0.071
87 H ASP 14 H ASP 14 -5.690 12.321 5.370
88 HA ASP 14 HA ASP 14 -8.426 13.274 5.617
89 HB2 ASP 14 2HB ASP 14 -6.892 12.888 7.631
90 HB3 ASP 14 1HB ASP 14 -5.907 14.215 7.038
91 H ASP 15 H ASP 15 -8.814 14.371 3.812
92 HA ASP 15 HA ASP 15 -6.888 16.411 2.907
93 HB2 ASP 15 2HB ASP 15 -7.721 16.057 0.663
94 HB3 ASP 15 1HB ASP 15 -7.286 14.497 1.341
95 H GLY 16 H GLY 16 -9.824 15.987 4.390
96 HA2 GLY 16 2HA GLY 16 -11.186 17.977 4.831
97 HA3 GLY 16 1HA GLY 16 -11.004 18.367 3.123
98 H SER 17 H SER 17 -11.178 15.324 2.671
99 HA SER 17 HA SER 17 -14.099 15.173 2.743
100 HB2 SER 17 2HB SER 17 -12.239 13.548 1.005
101 HB3 SER 17 1HB SER 17 -13.965 13.823 0.785
102 HG SER 17 HG SER 17 -11.780 15.445 0.247
103 H GLY 18 H GLY 18 -11.072 13.390 3.131
104 HA2 GLY 18 2HA GLY 18 -10.596 11.805 4.798
105 HA3 GLY 18 1HA GLY 18 -12.327 11.653 5.125
106 H ARG 19 H ARG 19 -9.969 11.158 2.629
107 HA ARG 19 HA ARG 19 -11.782 9.336 1.245
108 HB2 ARG 19 2HB ARG 19 -9.016 10.153 0.473
109 HB3 ARG 19 1HB ARG 19 -10.242 9.335 -0.487
110 HG2 ARG 19 2HG ARG 19 -11.609 11.359 -0.469
111 HG3 ARG 19 1HG ARG 19 -10.412 12.161 0.554
112 HD2 ARG 19 2HD ARG 19 -8.732 11.745 -1.237
113 HD3 ARG 19 1HD ARG 19 -10.051 11.164 -2.248
114 HE ARG 19 HE ARG 19 -10.145 13.859 -1.095
115 HH11 ARG 19 1HH1 ARG 19 -10.036 11.777 -3.994
116 HH12 ARG 19 2HH1 ARG 19 -10.319 13.062 -5.067
117 HH21 ARG 19 1HH2 ARG 19 -10.549 15.593 -2.589
118 HH22 ARG 19 2HH2 ARG 19 -10.637 15.278 -4.255
119 H THR 20 H THR 20 -11.172 7.259 0.736
120 HA THR 20 HA THR 20 -8.752 6.295 2.006
121 HB THR 20 HB THR 20 -9.922 4.144 2.466
122 HG1 THR 20 1HG THR 20 -12.362 5.535 2.221
123 HG21 THR 20 3HG2 THR 20 -9.626 5.738 4.259
124 HG22 THR 20 1HG2 THR 20 -11.214 4.968 4.438
125 HG23 THR 20 2HG2 THR 20 -11.068 6.601 3.739
126 H TYR 21 H TYR 21 -7.546 5.118 0.693
127 HA TYR 21 HA TYR 21 -8.739 4.249 -1.826
128 HB2 TYR 21 2HB TYR 21 -7.684 6.414 -2.296
129 HB3 TYR 21 1HB TYR 21 -6.170 5.846 -1.609
130 HD1 TYR 21 2HD TYR 21 -8.571 5.273 -4.374
131 HD2 TYR 21 1HD TYR 21 -4.596 4.712 -2.968
132 HE1 TYR 21 2HE TYR 21 -7.909 4.452 -6.590
133 HE2 TYR 21 1HE TYR 21 -3.921 3.889 -5.187
134 HH TYR 21 HH TYR 21 -5.850 4.279 -7.924
135 H GLN 22 H GLN 22 -8.255 2.259 -2.251
136 HA GLN 22 HA GLN 22 -6.329 0.896 -0.627
137 HB2 GLN 22 2HB GLN 22 -8.497 -0.148 -1.106
138 HB3 GLN 22 1HB GLN 22 -8.141 -0.113 -2.824
139 HG2 GLN 22 2HG GLN 22 -6.349 -1.678 -2.537
140 HG3 GLN 22 1HG GLN 22 -6.531 -1.623 -0.787
141 HE21 GLN 22 1HE2 GLN 22 -6.715 -3.824 -2.680
142 HE22 GLN 22 2HE2 GLN 22 -8.260 -4.556 -2.398
143 H LEU 23 H LEU 23 -4.359 0.570 -1.148
144 HA LEU 23 HA LEU 23 -3.162 1.769 -3.408
145 HB2 LEU 23 2HB LEU 23 -2.225 -0.048 -1.279
146 HB3 LEU 23 1HB LEU 23 -1.119 0.479 -2.501
147 HG LEU 23 HG LEU 23 -2.618 2.311 -0.589
148 HD11 LEU 23 1HD1 LEU 23 -0.453 2.630 0.479
149 HD12 LEU 23 2HD1 LEU 23 0.258 1.428 -0.602
150 HD13 LEU 23 3HD1 LEU 23 -0.964 0.946 0.571
151 HD21 LEU 23 3HD2 LEU 23 -0.410 2.878 -2.564
152 HD22 LEU 23 1HD2 LEU 23 -1.048 4.028 -1.396
153 HD23 LEU 23 2HD2 LEU 23 -2.082 3.430 -2.691
154 H ARG 24 H ARG 24 -2.405 0.949 -5.230
155 HA ARG 24 HA ARG 24 -3.205 -1.743 -5.981
156 HB2 ARG 24 2HB ARG 24 -1.657 0.245 -7.644
157 HB3 ARG 24 1HB ARG 24 -2.623 -1.110 -8.200
158 HG2 ARG 24 2HG ARG 24 -3.667 1.429 -6.953
159 HG3 ARG 24 1HG ARG 24 -3.708 1.024 -8.666
160 HD2 ARG 24 2HD ARG 24 -5.224 -0.832 -8.204
161 HD3 ARG 24 1HD ARG 24 -5.129 -0.495 -6.471
162 HE ARG 24 HE ARG 24 -5.875 1.824 -7.815
163 HH11 ARG 24 1HH1 ARG 24 -7.330 -1.320 -6.986
164 HH12 ARG 24 2HH1 ARG 24 -8.919 -0.681 -6.923
165 HH21 ARG 24 1HH2 ARG 24 -8.066 2.608 -7.784
166 HH22 ARG 24 2HH2 ARG 24 -9.347 1.543 -7.400
167 H GLU 25 H GLU 25 -1.591 -3.230 -6.763
168 HA GLU 25 HA GLU 25 0.781 -3.158 -5.185
169 HB2 GLU 25 2HB GLU 25 1.392 -5.262 -6.431
170 HB3 GLU 25 1HB GLU 25 -0.096 -5.321 -5.503
171 HG2 GLU 25 2HG GLU 25 -1.397 -5.077 -7.515
172 HG3 GLU 25 1HG GLU 25 0.071 -4.869 -8.471
173 H GLY 26 H GLY 26 2.749 -2.749 -5.592
174 HA2 GLY 26 2HA GLY 26 4.532 -2.350 -7.227
175 HA3 GLY 26 1HA GLY 26 3.326 -1.457 -8.171
176 H SER 27 H SER 27 4.974 0.343 -7.816
177 HA SER 27 HA SER 27 4.456 1.390 -5.169
178 HB2 SER 27 2HB SER 27 6.436 2.867 -5.501
179 HB3 SER 27 1HB SER 27 6.814 1.150 -5.501
180 HG SER 27 HG SER 27 6.243 2.158 -8.003
181 H ASN 28 H ASN 28 3.425 3.138 -4.871
182 HA ASN 28 HA ASN 28 2.239 4.420 -7.214
183 HB2 ASN 28 2HB ASN 28 1.424 4.495 -4.281
184 HB3 ASN 28 1HB ASN 28 0.540 5.253 -5.602
185 HD21 ASN 28 1HD2 ASN 28 1.414 2.206 -4.105
186 HD22 ASN 28 2HD2 ASN 28 0.268 1.222 -4.928
187 H ILE 29 H ILE 29 3.247 6.169 -7.850
188 HA ILE 29 HA ILE 29 5.111 7.543 -6.104
189 HB ILE 29 HB ILE 29 4.438 8.152 -8.994
190 HG12 ILE 29 2HG1 ILE 29 5.260 5.842 -8.820
191 HG13 ILE 29 1HG1 ILE 29 6.441 6.871 -9.609
192 HG21 ILE 29 1HG2 ILE 29 5.545 9.996 -7.853
193 HG22 ILE 29 2HG2 ILE 29 6.612 9.271 -9.053
194 HG23 ILE 29 3HG2 ILE 29 6.847 8.917 -7.342
195 HD11 ILE 29 3HD1 ILE 29 7.720 6.981 -7.523
196 HD12 ILE 29 1HD1 ILE 29 7.514 5.325 -8.098
197 HD13 ILE 29 2HD1 ILE 29 6.536 5.918 -6.759
198 H ILE 30 H ILE 30 4.640 9.303 -5.024
199 HA ILE 30 HA ILE 30 2.241 10.841 -5.723
200 HB ILE 30 HB ILE 30 3.667 10.512 -3.055
201 HG12 ILE 30 2HG1 ILE 30 0.942 9.550 -3.976
202 HG13 ILE 30 1HG1 ILE 30 2.355 8.547 -3.710
203 HG21 ILE 30 1HG2 ILE 30 1.818 11.806 -2.081
204 HG22 ILE 30 2HG2 ILE 30 1.299 12.225 -3.722
205 HG23 ILE 30 3HG2 ILE 30 2.878 12.726 -3.140
206 HD11 ILE 30 3HD1 ILE 30 2.305 9.081 -1.334
207 HD12 ILE 30 1HD1 ILE 30 0.781 8.377 -1.868
208 HD13 ILE 30 2HD1 ILE 30 0.902 10.116 -1.592
209 H GLY 31 H GLY 31 2.455 12.999 -6.149
210 HA2 GLY 31 2HA GLY 31 3.968 14.945 -5.194
211 HA3 GLY 31 1HA GLY 31 5.123 14.175 -6.305
212 H ARG 32 H ARG 32 5.039 16.293 -7.373
213 HA ARG 32 HA ARG 32 2.671 16.365 -9.124
214 HB2 ARG 32 2HB ARG 32 4.347 18.697 -8.208
215 HB3 ARG 32 1HB ARG 32 3.151 18.773 -9.485
216 HG2 ARG 32 2HG ARG 32 1.500 17.993 -7.642
217 HG3 ARG 32 1HG ARG 32 2.779 18.472 -6.545
218 HD2 ARG 32 2HD ARG 32 2.890 20.687 -7.370
219 HD3 ARG 32 1HD ARG 32 1.832 20.314 -8.720
220 HE ARG 32 HE ARG 32 0.883 20.276 -5.936
221 HH11 ARG 32 1HH1 ARG 32 0.513 21.296 -9.323
222 HH12 ARG 32 2HH1 ARG 32 -0.864 22.246 -9.025
223 HH21 ARG 32 1HH2 ARG 32 -1.073 21.605 -5.572
224 HH22 ARG 32 2HH2 ARG 32 -1.781 22.419 -6.888
225 H GLY 33 H GLY 33 3.375 15.409 -10.930
226 HA2 GLY 33 2HA GLY 33 5.129 16.711 -12.591
227 HA3 GLY 33 1HA GLY 33 6.032 15.444 -11.766
228 H GLN 34 H GLN 34 6.088 15.009 -14.173
229 HA GLN 34 HA GLN 34 3.872 13.646 -15.358
230 HB2 GLN 34 2HB GLN 34 5.478 13.136 -17.128
231 HB3 GLN 34 1HB GLN 34 5.652 14.813 -16.639
232 HG2 GLN 34 2HG GLN 34 7.553 14.062 -15.151
233 HG3 GLN 34 1HG GLN 34 7.448 12.504 -15.955
234 HE21 GLN 34 1HE2 GLN 34 9.646 14.298 -15.865
235 HE22 GLN 34 2HE2 GLN 34 10.016 14.738 -17.486
236 H ASP 35 H ASP 35 6.468 12.885 -13.272
237 HA ASP 35 HA ASP 35 6.559 10.035 -13.654
238 HB2 ASP 35 2HB ASP 35 7.650 11.774 -11.442
239 HB3 ASP 35 1HB ASP 35 8.018 10.077 -11.679
240 H ALA 36 H ALA 36 4.633 12.221 -11.913
241 HA ALA 36 HA ALA 36 4.163 10.535 -9.629
242 HB1 ALA 36 1HB ALA 36 2.802 13.090 -10.444
243 HB2 ALA 36 2HB ALA 36 4.210 12.964 -9.389
244 HB3 ALA 36 3HB ALA 36 2.661 12.284 -8.884
245 H GLN 37 H GLN 37 2.500 9.261 -9.246
246 HA GLN 37 HA GLN 37 0.609 8.750 -11.398
247 HB2 GLN 37 2HB GLN 37 1.203 7.244 -8.845
248 HB3 GLN 37 1HB GLN 37 0.138 6.707 -10.130
249 HG2 GLN 37 2HG GLN 37 3.122 7.104 -10.349
250 HG3 GLN 37 1HG GLN 37 2.293 5.560 -10.203
251 HE21 GLN 37 1HE2 GLN 37 1.107 4.811 -11.974
252 HE22 GLN 37 2HE2 GLN 37 1.398 5.375 -13.571
253 H PHE 38 H PHE 38 0.965 10.032 -8.238
254 HA PHE 38 HA PHE 38 -1.845 10.792 -8.163
255 HB2 PHE 38 2HB PHE 38 -1.621 8.988 -6.551
256 HB3 PHE 38 1HB PHE 38 -0.167 9.714 -5.882
257 HD1 PHE 38 2HD PHE 38 -3.827 10.311 -6.301
258 HD2 PHE 38 1HD PHE 38 -0.313 11.147 -4.056
259 HE1 PHE 38 2HE PHE 38 -5.177 11.486 -4.608
260 HE2 PHE 38 1HE PHE 38 -1.611 12.290 -2.387
261 HZ PHE 38 HZ PHE 38 -4.079 12.485 -2.640
262 H ARG 39 H ARG 39 -1.977 12.919 -8.150
263 HA ARG 39 HA ARG 39 0.403 14.431 -7.464
264 HB2 ARG 39 2HB ARG 39 -2.059 15.253 -8.998
265 HB3 ARG 39 1HB ARG 39 -0.695 16.304 -8.648
266 HG2 ARG 39 2HG ARG 39 0.776 14.782 -9.906
267 HG3 ARG 39 1HG ARG 39 -0.631 13.793 -10.305
268 HD2 ARG 39 2HD ARG 39 -1.639 15.682 -11.462
269 HD3 ARG 39 1HD ARG 39 -0.257 16.693 -11.027
270 HE ARG 39 HE ARG 39 0.323 14.277 -12.503
271 HH11 ARG 39 1HH1 ARG 39 -0.269 17.759 -12.712
272 HH12 ARG 39 2HH1 ARG 39 0.558 17.928 -14.204
273 HH21 ARG 39 1HH2 ARG 39 1.407 14.524 -14.549
274 HH22 ARG 39 2HH2 ARG 39 1.479 16.057 -15.291
275 H LEU 40 H LEU 40 0.526 15.704 -5.822
276 HA LEU 40 HA LEU 40 -1.547 15.679 -3.862
277 HB2 LEU 40 2HB LEU 40 1.128 17.043 -3.922
278 HB3 LEU 40 1HB LEU 40 0.017 17.187 -2.571
279 HG LEU 40 HG LEU 40 1.284 14.624 -3.533
280 HD11 LEU 40 1HD1 LEU 40 2.571 14.759 -1.497
281 HD12 LEU 40 2HD1 LEU 40 1.781 16.269 -1.059
282 HD13 LEU 40 3HD1 LEU 40 2.849 16.213 -2.459
283 HD21 LEU 40 3HD2 LEU 40 -0.924 14.266 -2.551
284 HD22 LEU 40 1HD2 LEU 40 -0.458 15.216 -1.142
285 HD23 LEU 40 2HD2 LEU 40 0.343 13.682 -1.482
286 HA PRO 41 HA PRO 41 -3.448 19.510 -5.062
287 HB2 PRO 41 2HB PRO 41 -4.540 19.850 -2.392
288 HB3 PRO 41 1HB PRO 41 -5.367 19.373 -3.870
289 HG2 PRO 41 2HG PRO 41 -4.984 17.667 -1.795
290 HG3 PRO 41 1HG PRO 41 -5.078 17.130 -3.480
291 HD2 PRO 41 2HD PRO 41 -2.664 17.583 -1.772
292 HD3 PRO 41 1HD PRO 41 -3.038 16.249 -2.887
293 H ASP 42 H ASP 42 -0.783 19.486 -3.185
294 HA ASP 42 HA ASP 42 -0.933 22.405 -2.746
295 HB2 ASP 42 2HB ASP 42 -0.755 20.883 -0.590
296 HB3 ASP 42 1HB ASP 42 0.886 20.627 -1.207
297 H THR 43 H THR 43 1.272 23.337 -2.795
298 HA THR 43 HA THR 43 2.736 22.090 -4.987
299 HB THR 43 HB THR 43 2.577 24.999 -4.226
300 HG1 THR 43 1HG THR 43 0.526 24.410 -4.797
301 HG21 THR 43 3HG2 THR 43 4.456 24.454 -5.691
302 HG22 THR 43 1HG2 THR 43 3.246 25.355 -6.602
303 HG23 THR 43 2HG2 THR 43 3.374 23.604 -6.796
304 H GLY 44 H GLY 44 5.201 23.002 -4.931
305 HA2 GLY 44 2HA GLY 44 7.105 23.476 -3.671
306 HA3 GLY 44 1HA GLY 44 6.178 23.215 -2.192
307 H VAL 45 H VAL 45 5.412 20.989 -4.404
308 HA VAL 45 HA VAL 45 6.902 18.889 -3.029
309 HB VAL 45 HB VAL 45 4.437 18.663 -4.816
310 HG11 VAL 45 1HG1 VAL 45 4.177 16.478 -3.921
311 HG12 VAL 45 2HG1 VAL 45 5.615 16.678 -2.921
312 HG13 VAL 45 3HG1 VAL 45 5.759 16.638 -4.680
313 HG21 VAL 45 3HG2 VAL 45 4.588 18.699 -1.805
314 HG22 VAL 45 1HG2 VAL 45 3.143 18.401 -2.771
315 HG23 VAL 45 2HG2 VAL 45 3.929 19.979 -2.822
316 H SER 46 H SER 46 8.100 17.392 -4.281
317 HA SER 46 HA SER 46 9.099 18.394 -6.747
318 HB2 SER 46 2HB SER 46 9.693 15.791 -5.322
319 HB3 SER 46 1HB SER 46 10.686 16.607 -6.540
320 HG SER 46 HG SER 46 11.590 17.360 -4.787
321 H ARG 47 H ARG 47 9.412 16.650 -8.573
322 HA ARG 47 HA ARG 47 6.870 15.891 -9.559
323 HB2 ARG 47 2HB ARG 47 8.090 14.802 -11.415
324 HB3 ARG 47 1HB ARG 47 8.659 16.434 -11.111
325 HG2 ARG 47 2HG ARG 47 10.594 15.564 -9.960
326 HG3 ARG 47 1HG ARG 47 10.011 13.914 -10.164
327 HD2 ARG 47 2HD ARG 47 11.667 14.316 -11.818
328 HD3 ARG 47 1HD ARG 47 10.089 14.284 -12.603
329 HE ARG 47 HE ARG 47 10.259 16.825 -12.426
330 HH11 ARG 47 1HH1 ARG 47 13.032 14.679 -12.974
331 HH12 ARG 47 2HH1 ARG 47 13.946 15.862 -13.785
332 HH21 ARG 47 1HH2 ARG 47 11.520 18.410 -13.543
333 HH22 ARG 47 2HH2 ARG 47 13.089 18.029 -14.104
334 H ARG 48 H ARG 48 9.306 14.236 -7.847
335 HA ARG 48 HA ARG 48 7.503 11.999 -7.321
336 HB2 ARG 48 2HB ARG 48 10.514 11.865 -7.695
337 HB3 ARG 48 1HB ARG 48 9.472 10.544 -7.197
338 HG2 ARG 48 2HG ARG 48 8.472 10.404 -9.323
339 HG3 ARG 48 1HG ARG 48 9.209 11.922 -9.835
340 HD2 ARG 48 2HD ARG 48 10.660 9.364 -9.187
341 HD3 ARG 48 1HD ARG 48 10.395 10.037 -10.798
342 HE ARG 48 HE ARG 48 12.034 11.281 -8.693
343 HH11 ARG 48 1HH1 ARG 48 11.294 10.900 -12.176
344 HH12 ARG 48 2HH1 ARG 48 12.727 11.673 -12.657
345 HH21 ARG 48 1HH2 ARG 48 13.906 12.363 -9.387
346 HH22 ARG 48 2HH2 ARG 48 14.257 12.533 -11.049
347 H HIS 49 H HIS 49 7.039 12.382 -5.288
348 HA HIS 49 HA HIS 49 9.000 13.691 -3.571
349 HB2 HIS 49 2HB HIS 49 7.046 15.008 -3.727
350 HB3 HIS 49 1HB HIS 49 5.959 13.660 -3.526
351 HD2 HIS 49 2HD HIS 49 5.813 12.710 -0.817
352 HE1 HIS 49 1HE HIS 49 7.426 16.253 0.774
353 HE2 HIS 49 2HE HIS 49 6.701 13.897 1.257
354 H LEU 50 H LEU 50 6.873 10.930 -3.899
355 HA LEU 50 HA LEU 50 8.420 9.486 -2.013
356 HB2 LEU 50 2HB LEU 50 7.117 10.808 -0.469
357 HB3 LEU 50 1HB LEU 50 5.636 10.407 -1.296
358 HG LEU 50 HG LEU 50 7.202 8.211 0.037
359 HD11 LEU 50 1HD1 LEU 50 5.994 8.686 2.097
360 HD12 LEU 50 2HD1 LEU 50 5.272 10.114 1.359
361 HD13 LEU 50 3HD1 LEU 50 7.009 10.059 1.662
362 HD21 LEU 50 3HD2 LEU 50 4.963 7.311 0.355
363 HD22 LEU 50 1HD2 LEU 50 5.239 7.687 -1.344
364 HD23 LEU 50 2HD2 LEU 50 4.263 8.767 -0.348
365 H GLU 51 H GLU 51 7.964 7.300 -2.077
366 HA GLU 51 HA GLU 51 5.924 6.518 -4.001
367 HB2 GLU 51 2HB GLU 51 7.380 4.643 -4.707
368 HB3 GLU 51 1HB GLU 51 8.012 6.216 -5.153
369 HG2 GLU 51 2HG GLU 51 9.625 6.096 -3.335
370 HG3 GLU 51 1HG GLU 51 8.902 4.583 -2.792
371 H ILE 52 H ILE 52 4.472 5.310 -3.128
372 HA ILE 52 HA ILE 52 5.155 3.801 -0.722
373 HB ILE 52 HB ILE 52 2.440 4.070 -2.062
374 HG12 ILE 52 2HG1 ILE 52 3.497 5.501 0.398
375 HG13 ILE 52 1HG1 ILE 52 3.245 6.242 -1.174
376 HG21 ILE 52 1HG2 ILE 52 1.604 3.158 0.067
377 HG22 ILE 52 2HG2 ILE 52 3.273 2.985 0.627
378 HG23 ILE 52 3HG2 ILE 52 2.707 2.054 -0.761
379 HD11 ILE 52 3HD1 ILE 52 1.099 5.061 0.580
380 HD12 ILE 52 1HD1 ILE 52 0.846 5.830 -0.986
381 HD13 ILE 52 2HD1 ILE 52 1.446 6.779 0.371
382 H ARG 53 H ARG 53 6.129 1.955 -1.267
383 HA ARG 53 HA ARG 53 5.211 0.613 -3.669
384 HB2 ARG 53 2HB ARG 53 7.622 0.766 -3.530
385 HB3 ARG 53 1HB ARG 53 7.613 0.036 -1.930
386 HG2 ARG 53 2HG ARG 53 6.754 -2.048 -2.860
387 HG3 ARG 53 1HG ARG 53 6.716 -1.325 -4.465
388 HD2 ARG 53 2HD ARG 53 9.103 -1.135 -4.494
389 HD3 ARG 53 1HD ARG 53 9.213 -1.653 -2.813
390 HE ARG 53 HE ARG 53 7.958 -3.722 -3.942
391 HH11 ARG 53 1HH1 ARG 53 10.839 -1.999 -5.086
392 HH12 ARG 53 2HH1 ARG 53 11.603 -3.412 -5.637
393 HH21 ARG 53 1HH2 ARG 53 8.986 -5.622 -4.698
394 HH22 ARG 53 2HH2 ARG 53 10.528 -5.542 -5.430
395 H TRP 54 H TRP 54 3.552 -0.495 -3.402
396 HA TRP 54 HA TRP 54 3.292 -1.997 -0.980
397 HB2 TRP 54 2HB TRP 54 1.270 -0.854 -1.472
398 HB3 TRP 54 1HB TRP 54 1.406 -1.247 -3.192
399 HD1 TRP 54 HD TRP 54 -0.502 -2.909 -3.771
400 HE1 TRP 54 1HE TRP 54 -1.496 -5.028 -2.733
401 HE3 TRP 54 3HE TRP 54 2.046 -2.935 0.652
402 HZ2 TRP 54 2HZ TRP 54 -1.226 -6.546 -0.367
403 HZ3 TRP 54 3HZ TRP 54 1.618 -4.739 2.246
404 HH2 TRP 54 HH TRP 54 -0.001 -6.503 1.759
405 H ASP 55 H ASP 55 4.318 -3.823 -1.049
406 HA ASP 55 HA ASP 55 4.416 -5.267 -3.589
407 HB2 ASP 55 2HB ASP 55 6.598 -4.550 -2.314
408 HB3 ASP 55 1HB ASP 55 6.191 -5.872 -1.220
409 H GLY 56 H GLY 56 4.840 -7.807 -2.580
410 HA2 GLY 56 2HA GLY 56 2.070 -8.183 -1.765
411 HA3 GLY 56 1HA GLY 56 3.112 -9.419 -2.419
412 H GLN 57 H GLN 57 3.115 -7.291 0.376
413 HA GLN 57 HA GLN 57 2.497 -9.188 2.298
414 HB2 GLN 57 2HB GLN 57 4.736 -10.166 1.734
415 HB3 GLN 57 1HB GLN 57 5.482 -8.656 2.243
416 HG2 GLN 57 2HG GLN 57 4.650 -8.971 4.496
417 HG3 GLN 57 1HG GLN 57 3.814 -10.434 4.001
418 HE21 GLN 57 1HE2 GLN 57 6.891 -9.002 4.713
419 HE22 GLN 57 2HE2 GLN 57 7.741 -10.494 4.802
420 H VAL 58 H VAL 58 4.951 -6.591 2.093
421 HA VAL 58 HA VAL 58 3.418 -5.197 4.160
422 HB VAL 58 HB VAL 58 5.491 -4.183 4.983
423 HG11 VAL 58 1HG1 VAL 58 5.707 -7.180 4.888
424 HG12 VAL 58 2HG1 VAL 58 4.756 -6.240 6.035
425 HG13 VAL 58 3HG1 VAL 58 6.518 -6.124 6.043
426 HG21 VAL 58 3HG2 VAL 58 6.826 -4.167 2.950
427 HG22 VAL 58 1HG2 VAL 58 6.898 -5.928 2.961
428 HG23 VAL 58 2HG2 VAL 58 7.706 -5.004 4.228
429 H ALA 59 H ALA 59 3.528 -2.897 4.070
430 HA ALA 59 HA ALA 59 3.769 -1.968 1.326
431 HB1 ALA 59 1HB ALA 59 1.593 -1.588 2.412
432 HB2 ALA 59 2HB ALA 59 2.389 -0.068 2.032
433 HB3 ALA 59 3HB ALA 59 2.386 -0.671 3.690
434 H LEU 60 H LEU 60 5.586 -1.160 0.867
435 HA LEU 60 HA LEU 60 7.414 -0.261 2.906
436 HB2 LEU 60 2HB LEU 60 8.114 -1.845 1.226
437 HB3 LEU 60 1HB LEU 60 7.663 -0.735 -0.046
438 HG LEU 60 HG LEU 60 9.455 0.801 0.742
439 HD11 LEU 60 1HD1 LEU 60 9.605 0.045 3.051
440 HD12 LEU 60 2HD1 LEU 60 11.168 -0.089 2.246
441 HD13 LEU 60 3HD1 LEU 60 10.178 -1.529 2.507
442 HD21 LEU 60 3HD2 LEU 60 11.263 -0.565 -0.199
443 HD22 LEU 60 1HD2 LEU 60 9.754 -0.699 -1.105
444 HD23 LEU 60 2HD2 LEU 60 10.237 -1.997 -0.017
445 H LEU 61 H LEU 61 7.662 1.802 3.338
446 HA LEU 61 HA LEU 61 6.565 3.823 1.534
447 HB2 LEU 61 2HB LEU 61 5.681 3.631 3.780
448 HB3 LEU 61 1HB LEU 61 7.234 3.836 4.511
449 HG LEU 61 HG LEU 61 5.829 5.819 4.771
450 HD11 LEU 61 1HD1 LEU 61 8.174 6.329 4.573
451 HD12 LEU 61 2HD1 LEU 61 7.196 7.606 3.857
452 HD13 LEU 61 3HD1 LEU 61 8.023 6.440 2.821
453 HD21 LEU 61 3HD2 LEU 61 5.001 7.102 2.894
454 HD22 LEU 61 1HD2 LEU 61 4.378 5.456 2.864
455 HD23 LEU 61 2HD2 LEU 61 5.683 5.920 1.773
456 H ALA 62 H ALA 62 8.050 4.986 0.413
457 HA ALA 62 HA ALA 62 10.652 5.389 1.653
458 HB1 ALA 62 1HB ALA 62 10.250 4.698 -1.256
459 HB2 ALA 62 2HB ALA 62 10.884 3.606 -0.023
460 HB3 ALA 62 3HB ALA 62 11.785 5.055 -0.461
461 H ASP 63 H ASP 63 11.199 7.399 1.727
462 HA ASP 63 HA ASP 63 9.499 9.408 0.489
463 HB2 ASP 63 2HB ASP 63 10.018 9.720 2.831
464 HB3 ASP 63 1HB ASP 63 11.739 9.569 2.516
465 H LEU 64 H LEU 64 10.190 10.816 -1.083
466 HA LEU 64 HA LEU 64 12.942 10.477 -1.981
467 HB2 LEU 64 2HB LEU 64 11.415 9.016 -3.299
468 HB3 LEU 64 1HB LEU 64 10.444 10.413 -3.687
469 HG LEU 64 HG LEU 64 12.117 11.304 -5.103
470 HD11 LEU 64 1HD1 LEU 64 13.849 8.973 -4.193
471 HD12 LEU 64 2HD1 LEU 64 14.119 10.671 -3.789
472 HD13 LEU 64 3HD1 LEU 64 14.279 10.126 -5.454
473 HD21 LEU 64 3HD2 LEU 64 11.897 8.339 -5.557
474 HD22 LEU 64 1HD2 LEU 64 12.249 9.557 -6.780
475 HD23 LEU 64 2HD2 LEU 64 10.671 9.530 -5.981
476 H ASN 65 H ASN 65 13.016 12.514 -0.730
477 HA ASN 65 HA ASN 65 12.898 14.800 -2.390
478 HB2 ASN 65 2HB ASN 65 10.431 14.465 -1.685
479 HB3 ASN 65 1HB ASN 65 10.960 14.811 -0.050
480 HD21 ASN 65 1HD2 ASN 65 9.108 16.164 -1.831
481 HD22 ASN 65 2HD2 ASN 65 9.623 17.797 -1.997
482 H SER 66 H SER 66 14.175 16.399 -1.421
483 HA SER 66 HA SER 66 15.566 15.368 0.916
484 HB2 SER 66 2HB SER 66 16.864 15.943 -1.129
485 HB3 SER 66 1HB SER 66 16.372 17.620 -0.942
486 HG SER 66 HG SER 66 18.458 16.598 -0.002
487 H THR 67 H THR 67 13.997 18.358 -0.216
488 HA THR 67 HA THR 67 14.458 19.521 2.398
489 HB THR 67 HB THR 67 14.919 20.885 0.433
490 HG1 THR 67 1HG THR 67 14.336 22.596 1.474
491 HG21 THR 67 3HG2 THR 67 11.962 20.735 -0.127
492 HG22 THR 67 1HG2 THR 67 13.247 20.050 -1.118
493 HG23 THR 67 2HG2 THR 67 13.094 21.800 -0.957
494 H ASN 68 H ASN 68 12.026 17.746 0.984
495 HA ASN 68 HA ASN 68 10.053 18.787 2.946
496 HB2 ASN 68 2HB ASN 68 9.438 17.542 0.256
497 HB3 ASN 68 1HB ASN 68 8.250 18.023 1.455
498 HD21 ASN 68 1HD2 ASN 68 10.507 19.105 -0.939
499 HD22 ASN 68 2HD2 ASN 68 9.910 20.724 -1.017
500 H GLY 69 H GLY 69 12.056 16.665 3.275
501 HA2 GLY 69 2HA GLY 69 11.345 14.055 2.910
502 HA3 GLY 69 1HA GLY 69 12.203 14.618 4.329
503 H THR 70 H THR 70 9.612 12.999 3.256
504 HA THR 70 HA THR 70 7.443 13.816 4.809
505 HB THR 70 HB THR 70 8.001 11.095 3.634
506 HG1 THR 70 1HG THR 70 8.205 12.447 2.014
507 HG21 THR 70 3HG2 THR 70 6.066 11.075 5.101
508 HG22 THR 70 1HG2 THR 70 5.508 11.014 3.434
509 HG23 THR 70 2HG2 THR 70 5.416 12.523 4.356
510 H THR 71 H THR 71 6.518 12.948 6.613
511 HA THR 71 HA THR 71 8.382 11.571 8.391
512 HB THR 71 HB THR 71 6.999 12.574 10.223
513 HG1 THR 71 1HG THR 71 5.662 13.619 8.001
514 HG21 THR 71 3HG2 THR 71 8.090 14.722 10.067
515 HG22 THR 71 1HG2 THR 71 8.347 14.452 8.327
516 HG23 THR 71 2HG2 THR 71 9.139 13.394 9.501
517 H VAL 72 H VAL 72 7.816 9.801 9.432
518 HA VAL 72 HA VAL 72 5.058 8.866 9.242
519 HB VAL 72 HB VAL 72 6.005 6.494 9.438
520 HG11 VAL 72 1HG1 VAL 72 7.093 8.091 7.131
521 HG12 VAL 72 2HG1 VAL 72 5.464 7.437 7.265
522 HG13 VAL 72 3HG1 VAL 72 6.849 6.341 7.162
523 HG21 VAL 72 3HG2 VAL 72 8.626 7.946 9.057
524 HG22 VAL 72 1HG2 VAL 72 8.407 6.191 9.063
525 HG23 VAL 72 2HG2 VAL 72 8.113 7.136 10.530
526 H ASN 73 H ASN 73 4.137 8.793 11.098
527 HA ASN 73 HA ASN 73 3.700 9.018 13.334
528 HB2 ASN 73 2HB ASN 73 6.427 7.714 13.722
529 HB3 ASN 73 1HB ASN 73 5.201 7.890 14.972
530 HD21 ASN 73 1HD2 ASN 73 6.157 6.244 12.137
531 HD22 ASN 73 2HD2 ASN 73 4.975 5.011 12.122
532 H ASN 74 H ASN 74 5.143 10.991 11.763
533 HA ASN 74 HA ASN 74 5.744 13.122 11.964
534 HB2 ASN 74 2HB ASN 74 4.404 13.314 14.006
535 HB3 ASN 74 1HB ASN 74 5.694 12.646 14.975
536 HD21 ASN 74 1HD2 ASN 74 7.305 14.000 15.686
537 HD22 ASN 74 2HD2 ASN 74 7.277 15.711 15.446
538 H ALA 75 H ALA 75 7.629 10.580 12.335
539 HA ALA 75 HA ALA 75 10.082 12.148 12.692
540 HB1 ALA 75 1HB ALA 75 9.876 10.159 14.132
541 HB2 ALA 75 2HB ALA 75 11.210 9.981 12.986
542 HB3 ALA 75 3HB ALA 75 9.688 9.145 12.702
543 HA PRO 76 HA PRO 76 10.417 11.811 8.216
544 HB2 PRO 76 2HB PRO 76 12.812 13.078 7.949
545 HB3 PRO 76 1HB PRO 76 11.293 13.942 8.193
546 HG2 PRO 76 2HG PRO 76 13.465 13.350 10.134
547 HG3 PRO 76 1HG PRO 76 12.404 14.763 10.017
548 HD2 PRO 76 2HD PRO 76 12.091 12.708 11.836
549 HD3 PRO 76 1HD PRO 76 10.804 13.810 11.319
550 H VAL 77 H VAL 77 11.163 10.216 7.012
551 HA VAL 77 HA VAL 77 13.597 8.777 7.847
552 HB VAL 77 HB VAL 77 12.480 6.606 7.428
553 HG11 VAL 77 1HG1 VAL 77 11.124 6.503 9.465
554 HG12 VAL 77 2HG1 VAL 77 11.071 8.265 9.515
555 HG13 VAL 77 3HG1 VAL 77 12.605 7.428 9.725
556 HG21 VAL 77 3HG2 VAL 77 10.744 7.297 5.897
557 HG22 VAL 77 1HG2 VAL 77 9.988 8.285 7.146
558 HG23 VAL 77 2HG2 VAL 77 9.991 6.536 7.298
559 H GLN 78 H GLN 78 14.552 7.514 6.157
560 HA GLN 78 HA GLN 78 14.017 8.504 3.516
561 HB2 GLN 78 2HB GLN 78 15.958 7.225 2.783
562 HB3 GLN 78 1HB GLN 78 16.365 8.079 4.253
563 HG2 GLN 78 2HG GLN 78 15.759 5.124 4.010
564 HG3 GLN 78 1HG GLN 78 17.351 5.839 4.187
565 HE21 GLN 78 1HE2 GLN 78 16.024 3.857 5.861
566 HE22 GLN 78 2HE2 GLN 78 15.971 4.535 7.443
567 H GLU 79 H GLU 79 13.542 5.522 5.324
568 HA GLU 79 HA GLU 79 11.408 4.826 3.590
569 HB2 GLU 79 2HB GLU 79 12.161 2.550 3.124
570 HB3 GLU 79 1HB GLU 79 13.278 3.711 2.434
571 HG2 GLU 79 2HG GLU 79 14.837 3.313 4.259
572 HG3 GLU 79 1HG GLU 79 13.694 2.191 4.996
573 H TRP 80 H TRP 80 10.122 3.161 4.519
574 HA TRP 80 HA TRP 80 10.553 2.393 7.259
575 HB2 TRP 80 2HB TRP 80 9.911 4.613 7.588
576 HB3 TRP 80 1HB TRP 80 8.552 4.562 6.477
577 HD1 TRP 80 HD TRP 80 6.342 3.341 7.457
578 HE1 TRP 80 1HE TRP 80 5.526 3.184 9.894
579 HE3 TRP 80 3HE TRP 80 10.745 4.290 9.859
580 HZ2 TRP 80 2HZ TRP 80 6.593 3.406 12.456
581 HZ3 TRP 80 3HZ TRP 80 10.747 4.319 12.318
582 HH2 TRP 80 HH TRP 80 8.690 3.892 13.576
583 H GLN 81 H GLN 81 9.052 0.736 7.784
584 HA GLN 81 HA GLN 81 7.385 0.025 5.514
585 HB2 GLN 81 2HB GLN 81 7.227 -2.275 6.327
586 HB3 GLN 81 1HB GLN 81 8.904 -1.809 6.169
587 HG2 GLN 81 2HG GLN 81 9.079 -1.573 8.581
588 HG3 GLN 81 1HG GLN 81 7.364 -1.968 8.755
589 HE21 GLN 81 1HE2 GLN 81 9.597 -3.368 9.887
590 HE22 GLN 81 2HE2 GLN 81 9.578 -4.970 9.259
591 H LEU 82 H LEU 82 5.474 0.530 5.540
592 HA LEU 82 HA LEU 82 4.137 1.836 7.624
593 HB2 LEU 82 2HB LEU 82 2.942 0.436 5.257
594 HB3 LEU 82 1HB LEU 82 2.236 1.708 6.244
595 HG LEU 82 HG LEU 82 4.708 2.086 4.588
596 HD11 LEU 82 1HD1 LEU 82 1.840 2.802 3.947
597 HD12 LEU 82 2HD1 LEU 82 2.861 1.649 3.089
598 HD13 LEU 82 3HD1 LEU 82 3.255 3.363 3.061
599 HD21 LEU 82 3HD2 LEU 82 2.862 3.935 6.018
600 HD22 LEU 82 1HD2 LEU 82 4.179 4.460 4.974
601 HD23 LEU 82 2HD2 LEU 82 4.535 3.573 6.457
602 H ALA 83 H ALA 83 2.501 1.182 8.952
603 HA ALA 83 HA ALA 83 1.744 -1.628 9.019
604 HB1 ALA 83 1HB ALA 83 2.536 0.089 11.387
605 HB2 ALA 83 2HB ALA 83 3.410 -1.326 10.794
606 HB3 ALA 83 3HB ALA 83 1.803 -1.511 11.498
607 H ASP 84 H ASP 84 -0.315 -1.768 10.385
608 HA ASP 84 HA ASP 84 -2.145 0.169 9.404
609 HB2 ASP 84 2HB ASP 84 -2.840 -2.172 9.827
610 HB3 ASP 84 1HB ASP 84 -2.579 -1.920 11.551
611 H GLY 85 H GLY 85 -2.565 2.035 10.177
612 HA2 GLY 85 2HA GLY 85 -3.144 3.617 11.782
613 HA3 GLY 85 1HA GLY 85 -2.506 2.568 13.036
614 H ASP 86 H ASP 86 -0.492 3.051 10.273
615 HA ASP 86 HA ASP 86 1.367 4.572 11.919
616 HB2 ASP 86 2HB ASP 86 1.969 2.757 9.936
617 HB3 ASP 86 1HB ASP 86 1.950 4.264 9.008
618 H VAL 87 H VAL 87 2.224 6.645 11.151
619 HA VAL 87 HA VAL 87 -0.008 8.177 9.962
620 HB VAL 87 HB VAL 87 1.990 9.198 11.984
621 HG11 VAL 87 1HG1 VAL 87 1.106 10.935 10.567
622 HG12 VAL 87 2HG1 VAL 87 0.438 11.088 12.197
623 HG13 VAL 87 3HG1 VAL 87 -0.543 10.407 10.901
624 HG21 VAL 87 3HG2 VAL 87 -0.865 8.341 12.431
625 HG22 VAL 87 1HG2 VAL 87 0.168 9.126 13.623
626 HG23 VAL 87 2HG2 VAL 87 0.571 7.513 13.026
627 H ILE 88 H ILE 88 0.577 8.832 8.001
628 HA ILE 88 HA ILE 88 3.379 9.489 7.552
629 HB ILE 88 HB ILE 88 1.197 8.558 5.655
630 HG12 ILE 88 2HG1 ILE 88 2.785 6.778 5.027
631 HG13 ILE 88 1HG1 ILE 88 3.961 7.409 6.153
632 HG21 ILE 88 1HG2 ILE 88 2.355 10.372 4.536
633 HG22 ILE 88 2HG2 ILE 88 2.779 8.834 3.778
634 HG23 ILE 88 3HG2 ILE 88 3.913 9.622 4.874
635 HD11 ILE 88 3HD1 ILE 88 1.324 6.073 6.786
636 HD12 ILE 88 1HD1 ILE 88 2.334 6.874 7.988
637 HD13 ILE 88 2HD1 ILE 88 2.956 5.483 7.137
638 H ARG 89 H ARG 89 3.753 11.603 7.567
639 HA ARG 89 HA ARG 89 1.556 13.356 6.717
640 HB2 ARG 89 2HB ARG 89 2.030 13.247 9.254
641 HB3 ARG 89 1HB ARG 89 3.502 14.130 8.871
642 HG2 ARG 89 2HG ARG 89 2.213 15.925 7.902
643 HG3 ARG 89 1HG ARG 89 0.730 15.019 8.166
644 HD2 ARG 89 2HD ARG 89 1.482 15.040 10.657
645 HD3 ARG 89 1HD ARG 89 2.495 16.390 10.145
646 HE ARG 89 HE ARG 89 -0.421 16.342 9.722
647 HH11 ARG 89 1HH1 ARG 89 2.441 18.159 10.725
648 HH12 ARG 89 2HH1 ARG 89 1.527 19.529 11.196
649 HH21 ARG 89 1HH2 ARG 89 -1.588 18.106 10.343
650 HH22 ARG 89 2HH2 ARG 89 -0.834 19.523 10.966
651 H LEU 90 H LEU 90 1.978 14.651 5.232
652 HA LEU 90 HA LEU 90 4.608 15.701 4.792
653 HB2 LEU 90 2HB LEU 90 4.346 15.370 2.321
654 HB3 LEU 90 1HB LEU 90 4.618 13.884 3.181
655 HG LEU 90 HG LEU 90 1.874 14.757 2.213
656 HD11 LEU 90 1HD1 LEU 90 3.871 12.895 0.929
657 HD12 LEU 90 2HD1 LEU 90 3.467 14.508 0.354
658 HD13 LEU 90 3HD1 LEU 90 2.241 13.234 0.342
659 HD21 LEU 90 3HD2 LEU 90 1.332 12.381 2.445
660 HD22 LEU 90 1HD2 LEU 90 1.877 13.043 3.987
661 HD23 LEU 90 2HD2 LEU 90 2.968 12.055 3.020
662 H GLY 91 H GLY 91 4.389 17.605 3.278
663 HA2 GLY 91 2HA GLY 91 2.716 19.508 4.283
664 HA3 GLY 91 1HA GLY 91 3.369 19.571 2.657
665 H HIS 92 H HIS 92 0.628 19.713 4.424
666 HA HIS 92 HA HIS 92 -1.506 20.079 3.882
667 HB2 HIS 92 2HB HIS 92 -0.847 20.970 1.716
668 HB3 HIS 92 1HB HIS 92 -0.685 19.354 1.060
669 HD1 HIS 92 1HD HIS 92 -3.155 22.084 1.569
670 HD2 HIS 92 2HD HIS 92 -3.180 18.067 0.509
671 HE1 HIS 92 1HE HIS 92 -5.409 21.640 0.538
672 H SER 93 H SER 93 -0.090 17.023 3.045
673 HA SER 93 HA SER 93 -2.753 15.823 3.288
674 HB2 SER 93 2HB SER 93 -0.367 14.754 1.816
675 HB3 SER 93 1HB SER 93 -1.986 14.060 1.830
676 HG SER 93 HG SER 93 -1.706 16.715 1.109
677 H GLU 94 H GLU 94 -2.977 14.875 5.171
678 HA GLU 94 HA GLU 94 -0.727 13.299 6.079
679 HB2 GLU 94 2HB GLU 94 -1.510 13.555 8.434
680 HB3 GLU 94 1HB GLU 94 -1.035 15.056 7.666
681 HG2 GLU 94 2HG GLU 94 -3.351 15.651 7.349
682 HG3 GLU 94 1HG GLU 94 -3.840 14.159 8.165
683 H ILE 95 H ILE 95 -0.954 11.268 6.198
684 HA ILE 95 HA ILE 95 -3.618 10.223 5.778
685 HB ILE 95 HB ILE 95 -2.827 10.385 3.616
686 HG12 ILE 95 2HG1 ILE 95 -3.570 7.994 4.168
687 HG13 ILE 95 1HG1 ILE 95 -2.678 8.249 2.676
688 HG21 ILE 95 1HG2 ILE 95 -0.629 9.761 2.768
689 HG22 ILE 95 2HG2 ILE 95 -0.116 9.460 4.429
690 HG23 ILE 95 3HG2 ILE 95 -0.618 11.079 3.939
691 HD11 ILE 95 3HD1 ILE 95 -1.982 6.190 3.826
692 HD12 ILE 95 1HD1 ILE 95 -1.534 7.147 5.237
693 HD13 ILE 95 2HD1 ILE 95 -0.654 7.348 3.727
694 H ILE 96 H ILE 96 -4.113 8.398 6.688
695 HA ILE 96 HA ILE 96 -2.145 7.130 8.472
696 HB ILE 96 HB ILE 96 -5.177 6.978 8.534
697 HG12 ILE 96 2HG1 ILE 96 -4.345 9.205 9.102
698 HG13 ILE 96 1HG1 ILE 96 -5.105 8.418 10.496
699 HG21 ILE 96 1HG2 ILE 96 -4.168 4.977 9.462
700 HG22 ILE 96 2HG2 ILE 96 -4.913 5.939 10.741
701 HG23 ILE 96 3HG2 ILE 96 -3.163 5.954 10.533
702 HD11 ILE 96 3HD1 ILE 96 -3.120 9.642 11.151
703 HD12 ILE 96 1HD1 ILE 96 -2.150 8.751 9.979
704 HD13 ILE 96 2HD1 ILE 96 -2.857 7.912 11.362
705 H VAL 97 H VAL 97 -1.561 5.164 8.001
706 HA VAL 97 HA VAL 97 -2.676 3.864 5.645
707 HB VAL 97 HB VAL 97 -0.223 3.271 7.316
708 HG11 VAL 97 1HG1 VAL 97 0.307 1.508 5.666
709 HG12 VAL 97 2HG1 VAL 97 -1.279 1.753 4.924
710 HG13 VAL 97 3HG1 VAL 97 -1.160 1.153 6.581
711 HG21 VAL 97 3HG2 VAL 97 -0.204 5.172 5.747
712 HG22 VAL 97 1HG2 VAL 97 -0.569 4.055 4.442
713 HG23 VAL 97 2HG2 VAL 97 0.961 3.917 5.327
714 H ARG 98 H ARG 98 -4.155 2.283 5.715
715 HA ARG 98 HA ARG 98 -4.436 0.809 8.221
716 HB2 ARG 98 2HB ARG 98 -6.522 1.333 6.107
717 HB3 ARG 98 1HB ARG 98 -6.751 0.439 7.596
718 HG2 ARG 98 2HG ARG 98 -6.138 3.334 7.295
719 HG3 ARG 98 1HG ARG 98 -7.695 2.658 7.806
720 HD2 ARG 98 2HD ARG 98 -5.057 2.683 9.278
721 HD3 ARG 98 1HD ARG 98 -6.553 3.471 9.755
722 HE ARG 98 HE ARG 98 -5.936 0.609 9.894
723 HH11 ARG 98 1HH1 ARG 98 -8.192 3.243 10.613
724 HH12 ARG 98 2HH1 ARG 98 -8.980 2.385 11.848
725 HH21 ARG 98 1HH2 ARG 98 -6.982 -0.511 11.578
726 HH22 ARG 98 2HH2 ARG 98 -8.296 0.217 12.421
727 H MET 99 H MET 99 -4.808 -1.317 8.062
728 HA MET 99 HA MET 99 -4.368 -2.553 5.435
729 HB2 MET 99 2HB MET 99 -2.975 -3.359 7.981
730 HB3 MET 99 1HB MET 99 -3.000 -4.345 6.534
731 HG2 MET 99 2HG MET 99 -1.869 -2.558 5.296
732 HG3 MET 99 1HG MET 99 -1.809 -1.596 6.772
733 HE1 MET 99 3HE MET 99 0.677 -2.389 4.900
734 HE2 MET 99 1HE MET 99 1.904 -2.721 6.125
735 HE3 MET 99 2HE MET 99 0.814 -1.348 6.319
736 H HIS 100 H HIS 100 -5.923 -3.745 4.940
737 HA HIS 100 HA HIS 100 -7.616 -4.898 7.019
738 HB2 HIS 100 2HB HIS 100 -8.208 -4.362 4.084
739 HB3 HIS 100 1HB HIS 100 -9.347 -5.027 5.246
740 HD1 HIS 100 1HD HIS 100 -10.747 -3.311 6.537
741 HD2 HIS 100 2HD HIS 100 -7.476 -1.612 4.618
742 HE1 HIS 100 1HE HIS 100 -11.003 -0.830 6.792
Start of MODEL 12
1 H1 GLY 1 1HT GLY 1 -7.372 -9.584 -9.512
2 H2 GLY 1 2HT GLY 1 -7.529 -11.242 -9.838
3 H3 GLY 1 3HT GLY 1 -6.023 -10.576 -9.454
4 HA2 GLY 1 1HA GLY 1 -6.939 -11.744 -7.546
5 HA3 GLY 1 2HA GLY 1 -6.716 -10.018 -7.260
6 H HIS 2 H HIS 2 -8.972 -12.592 -7.535
7 HA HIS 2 HA HIS 2 -11.217 -10.744 -7.506
8 HB2 HIS 2 2HB HIS 2 -11.132 -13.753 -7.776
9 HB3 HIS 2 1HB HIS 2 -12.628 -12.835 -7.636
10 HD1 HIS 2 1HD HIS 2 -13.562 -11.886 -9.783
11 HD2 HIS 2 2HD HIS 2 -9.618 -13.113 -10.135
12 HE1 HIS 2 1HE HIS 2 -12.983 -11.664 -12.226
13 H GLY 3 H GLY 3 -11.427 -9.869 -5.614
14 HA2 GLY 3 2HA GLY 3 -12.437 -9.847 -3.513
15 HA3 GLY 3 1HA GLY 3 -12.253 -11.594 -3.435
16 H SER 4 H SER 4 -11.657 -10.318 -1.231
17 HA SER 4 HA SER 4 -8.975 -9.466 -1.013
18 HB2 SER 4 2HB SER 4 -10.861 -10.491 1.099
19 HB3 SER 4 1HB SER 4 -9.403 -9.538 1.371
20 HG SER 4 HG SER 4 -10.585 -7.846 1.110
21 H ALA 5 H ALA 5 -7.292 -10.811 -1.132
22 HA ALA 5 HA ALA 5 -7.517 -13.476 0.063
23 HB1 ALA 5 1HB ALA 5 -6.349 -14.453 -1.851
24 HB2 ALA 5 2HB ALA 5 -6.366 -12.875 -2.651
25 HB3 ALA 5 3HB ALA 5 -7.884 -13.716 -2.323
26 H GLY 6 H GLY 6 -6.297 -10.733 0.478
27 HA2 GLY 6 2HA GLY 6 -3.977 -11.552 1.782
28 HA3 GLY 6 1HA GLY 6 -3.575 -10.722 0.273
29 H THR 7 H THR 7 -2.679 -9.137 1.808
30 HA THR 7 HA THR 7 -4.536 -7.570 3.307
31 HB THR 7 HB THR 7 -1.636 -7.071 2.597
32 HG1 THR 7 1HG THR 7 -2.656 -7.971 5.073
33 HG21 THR 7 3HG2 THR 7 -1.660 -5.536 4.536
34 HG22 THR 7 1HG2 THR 7 -3.387 -5.838 4.743
35 HG23 THR 7 2HG2 THR 7 -2.805 -5.022 3.295
36 H SER 8 H SER 8 -5.582 -5.844 2.659
37 HA SER 8 HA SER 8 -4.865 -4.661 0.077
38 HB2 SER 8 2HB SER 8 -7.508 -4.501 1.553
39 HB3 SER 8 1HB SER 8 -7.191 -3.933 -0.085
40 HG SER 8 HG SER 8 -7.360 -6.549 0.902
41 H VAL 9 H VAL 9 -3.868 -2.746 0.281
42 HA VAL 9 HA VAL 9 -4.009 -1.378 2.894
43 HB VAL 9 HB VAL 9 -1.974 -0.925 0.692
44 HG11 VAL 9 1HG1 VAL 9 -0.641 0.106 2.504
45 HG12 VAL 9 2HG1 VAL 9 -2.003 -0.123 3.599
46 HG13 VAL 9 3HG1 VAL 9 -2.165 0.944 2.209
47 HG21 VAL 9 3HG2 VAL 9 -0.421 -2.260 2.081
48 HG22 VAL 9 1HG2 VAL 9 -1.768 -3.202 1.439
49 HG23 VAL 9 2HG2 VAL 9 -1.783 -2.699 3.120
50 H THR 10 H THR 10 -4.786 0.598 3.082
51 HA THR 10 HA THR 10 -5.507 2.050 0.663
52 HB THR 10 HB THR 10 -7.380 1.518 2.993
53 HG1 THR 10 1HG THR 10 -6.751 0.069 0.846
54 HG21 THR 10 3HG2 THR 10 -7.861 2.822 0.301
55 HG22 THR 10 1HG2 THR 10 -7.768 3.667 1.845
56 HG23 THR 10 2HG2 THR 10 -9.086 2.535 1.536
57 H LEU 11 H LEU 11 -4.943 4.133 0.865
58 HA LEU 11 HA LEU 11 -4.141 4.982 3.512
59 HB2 LEU 11 2HB LEU 11 -2.932 6.809 2.408
60 HB3 LEU 11 1HB LEU 11 -2.373 5.236 1.889
61 HG LEU 11 HG LEU 11 -3.842 5.707 -0.213
62 HD11 LEU 11 1HD1 LEU 11 -3.534 8.510 0.860
63 HD12 LEU 11 2HD1 LEU 11 -5.051 7.653 0.592
64 HD13 LEU 11 3HD1 LEU 11 -4.030 8.099 -0.777
65 HD21 LEU 11 3HD2 LEU 11 -1.317 7.254 0.335
66 HD22 LEU 11 1HD2 LEU 11 -1.982 6.914 -1.263
67 HD23 LEU 11 2HD2 LEU 11 -1.426 5.592 -0.235
68 H GLN 12 H GLN 12 -4.973 6.696 4.513
69 HA GLN 12 HA GLN 12 -7.403 7.814 3.303
70 HB2 GLN 12 2HB GLN 12 -7.717 6.500 5.395
71 HB3 GLN 12 1HB GLN 12 -6.651 7.635 6.216
72 HG2 GLN 12 2HG GLN 12 -8.337 9.410 5.283
73 HG3 GLN 12 1HG GLN 12 -9.427 8.024 5.229
74 HE21 GLN 12 1HE2 GLN 12 -7.589 10.119 7.176
75 HE22 GLN 12 2HE2 GLN 12 -8.282 9.737 8.700
76 H LEU 13 H LEU 13 -6.879 9.705 2.488
77 HA LEU 13 HA LEU 13 -4.946 11.451 3.846
78 HB2 LEU 13 2HB LEU 13 -4.400 11.013 1.536
79 HB3 LEU 13 1HB LEU 13 -6.035 11.399 1.033
80 HG LEU 13 HG LEU 13 -5.629 13.705 1.906
81 HD11 LEU 13 1HD1 LEU 13 -3.715 13.335 3.290
82 HD12 LEU 13 2HD1 LEU 13 -3.298 14.484 2.016
83 HD13 LEU 13 3HD1 LEU 13 -2.758 12.808 1.904
84 HD21 LEU 13 3HD2 LEU 13 -5.705 13.200 -0.442
85 HD22 LEU 13 1HD2 LEU 13 -3.990 12.777 -0.444
86 HD23 LEU 13 2HD2 LEU 13 -4.489 14.440 -0.125
87 H ASP 14 H ASP 14 -5.806 13.214 4.898
88 HA ASP 14 HA ASP 14 -8.601 13.654 4.292
89 HB2 ASP 14 2HB ASP 14 -8.184 13.445 6.688
90 HB3 ASP 14 1HB ASP 14 -7.058 14.812 6.616
91 H ASP 15 H ASP 15 -8.768 14.738 2.633
92 HA ASP 15 HA ASP 15 -7.186 17.092 2.159
93 HB2 ASP 15 2HB ASP 15 -7.637 15.543 0.317
94 HB3 ASP 15 1HB ASP 15 -9.365 15.722 0.552
95 H GLY 16 H GLY 16 -9.726 16.419 4.051
96 HA2 GLY 16 2HA GLY 16 -11.013 18.145 5.122
97 HA3 GLY 16 1HA GLY 16 -11.190 18.920 3.544
98 H SER 17 H SER 17 -11.464 15.602 4.581
99 HA SER 17 HA SER 17 -14.204 15.203 4.153
100 HB2 SER 17 2HB SER 17 -13.818 15.871 1.826
101 HB3 SER 17 1HB SER 17 -12.525 14.690 1.672
102 HG SER 17 HG SER 17 -15.320 14.207 1.957
103 H GLY 18 H GLY 18 -10.935 13.933 4.352
104 HA2 GLY 18 2HA GLY 18 -10.132 11.887 4.950
105 HA3 GLY 18 1HA GLY 18 -11.766 11.469 5.450
106 H ARG 19 H ARG 19 -9.737 11.826 2.559
107 HA ARG 19 HA ARG 19 -11.509 10.119 0.989
108 HB2 ARG 19 2HB ARG 19 -9.025 11.676 0.292
109 HB3 ARG 19 1HB ARG 19 -9.811 10.532 -0.784
110 HG2 ARG 19 2HG ARG 19 -11.850 11.920 -0.740
111 HG3 ARG 19 1HG ARG 19 -11.034 13.062 0.329
112 HD2 ARG 19 2HD ARG 19 -9.366 13.521 -1.368
113 HD3 ARG 19 1HD ARG 19 -10.081 12.319 -2.437
114 HE ARG 19 HE ARG 19 -12.136 13.902 -2.139
115 HH11 ARG 19 1HH1 ARG 19 -8.737 14.848 -2.630
116 HH12 ARG 19 2HH1 ARG 19 -9.105 16.297 -3.422
117 HH21 ARG 19 1HH2 ARG 19 -12.621 15.876 -3.323
118 HH22 ARG 19 2HH2 ARG 19 -11.341 16.902 -3.809
119 H THR 20 H THR 20 -10.683 8.233 -0.094
120 HA THR 20 HA THR 20 -8.334 7.140 1.206
121 HB THR 20 HB THR 20 -9.524 4.918 1.250
122 HG1 THR 20 1HG THR 20 -11.832 5.067 1.306
123 HG21 THR 20 3HG2 THR 20 -10.550 7.180 2.927
124 HG22 THR 20 1HG2 THR 20 -9.150 6.178 3.285
125 HG23 THR 20 2HG2 THR 20 -10.776 5.472 3.349
126 H TYR 21 H TYR 21 -6.978 6.147 -0.044
127 HA TYR 21 HA TYR 21 -7.754 5.431 -2.787
128 HB2 TYR 21 2HB TYR 21 -6.419 7.418 -3.027
129 HB3 TYR 21 1HB TYR 21 -5.262 6.859 -1.832
130 HD1 TYR 21 2HD TYR 21 -6.545 6.077 -5.261
131 HD2 TYR 21 1HD TYR 21 -3.299 5.789 -2.521
132 HE1 TYR 21 2HE TYR 21 -5.103 5.175 -7.049
133 HE2 TYR 21 1HE TYR 21 -1.861 4.893 -4.299
134 HH TYR 21 HH TYR 21 -2.049 3.758 -6.410
135 H GLN 22 H GLN 22 -7.311 3.373 -3.263
136 HA GLN 22 HA GLN 22 -5.944 1.827 -1.236
137 HB2 GLN 22 2HB GLN 22 -8.099 1.026 -2.239
138 HB3 GLN 22 1HB GLN 22 -7.262 0.844 -3.772
139 HG2 GLN 22 2HG GLN 22 -5.751 -0.788 -2.761
140 HG3 GLN 22 1HG GLN 22 -6.582 -0.614 -1.221
141 HE21 GLN 22 1HE2 GLN 22 -6.214 -2.987 -2.750
142 HE22 GLN 22 2HE2 GLN 22 -7.790 -3.573 -3.148
143 H LEU 23 H LEU 23 -4.019 0.933 -1.462
144 HA LEU 23 HA LEU 23 -2.352 1.853 -3.629
145 HB2 LEU 23 2HB LEU 23 -1.793 0.103 -1.249
146 HB3 LEU 23 1HB LEU 23 -0.583 0.572 -2.418
147 HG LEU 23 HG LEU 23 -2.082 2.446 -0.577
148 HD11 LEU 23 1HD1 LEU 23 0.742 1.439 -0.573
149 HD12 LEU 23 2HD1 LEU 23 -0.519 1.011 0.576
150 HD13 LEU 23 3HD1 LEU 23 0.096 2.671 0.518
151 HD21 LEU 23 3HD2 LEU 23 -0.442 4.117 -1.356
152 HD22 LEU 23 1HD2 LEU 23 -1.483 3.552 -2.665
153 HD23 LEU 23 2HD2 LEU 23 0.169 2.949 -2.524
154 H ARG 24 H ARG 24 -2.130 0.755 -5.414
155 HA ARG 24 HA ARG 24 -2.947 -2.012 -5.404
156 HB2 ARG 24 2HB ARG 24 -2.251 -0.187 -7.707
157 HB3 ARG 24 1HB ARG 24 -2.719 -1.876 -7.884
158 HG2 ARG 24 2HG ARG 24 -4.858 -1.329 -6.734
159 HG3 ARG 24 1HG ARG 24 -4.389 0.367 -6.783
160 HD2 ARG 24 2HD ARG 24 -4.317 0.280 -9.219
161 HD3 ARG 24 1HD ARG 24 -4.739 -1.435 -9.170
162 HE ARG 24 HE ARG 24 -6.504 0.545 -7.958
163 HH11 ARG 24 1HH1 ARG 24 -6.034 -1.990 -10.404
164 HH12 ARG 24 2HH1 ARG 24 -7.689 -2.040 -10.822
165 HH21 ARG 24 1HH2 ARG 24 -8.718 0.412 -8.521
166 HH22 ARG 24 2HH2 ARG 24 -9.239 -0.690 -9.731
167 H GLU 25 H GLU 25 -1.656 -3.593 -6.375
168 HA GLU 25 HA GLU 25 0.862 -3.779 -5.269
169 HB2 GLU 25 2HB GLU 25 1.083 -5.772 -6.810
170 HB3 GLU 25 1HB GLU 25 -0.311 -5.764 -5.735
171 HG2 GLU 25 2HG GLU 25 -1.690 -4.916 -7.603
172 HG3 GLU 25 1HG GLU 25 -0.291 -5.063 -8.658
173 H GLY 26 H GLY 26 2.788 -3.330 -5.880
174 HA2 GLY 26 2HA GLY 26 4.439 -2.965 -7.659
175 HA3 GLY 26 1HA GLY 26 3.180 -2.038 -8.493
176 H SER 27 H SER 27 4.797 -0.245 -8.316
177 HA SER 27 HA SER 27 4.624 0.781 -5.621
178 HB2 SER 27 2HB SER 27 6.515 2.277 -6.222
179 HB3 SER 27 1HB SER 27 6.902 0.563 -6.242
180 HG SER 27 HG SER 27 7.348 2.198 -8.160
181 H ASN 28 H ASN 28 3.701 2.556 -5.169
182 HA ASN 28 HA ASN 28 2.144 3.850 -7.279
183 HB2 ASN 28 2HB ASN 28 1.780 3.813 -4.259
184 HB3 ASN 28 1HB ASN 28 0.735 4.682 -5.384
185 HD21 ASN 28 1HD2 ASN 28 1.719 1.535 -4.233
186 HD22 ASN 28 2HD2 ASN 28 0.434 0.626 -4.925
187 H ILE 29 H ILE 29 3.072 5.589 -8.021
188 HA ILE 29 HA ILE 29 5.089 6.974 -6.471
189 HB ILE 29 HB ILE 29 4.053 7.597 -9.248
190 HG12 ILE 29 2HG1 ILE 29 4.972 5.334 -9.191
191 HG13 ILE 29 1HG1 ILE 29 6.013 6.418 -10.099
192 HG21 ILE 29 1HG2 ILE 29 6.172 8.816 -9.533
193 HG22 ILE 29 2HG2 ILE 29 6.609 8.442 -7.867
194 HG23 ILE 29 3HG2 ILE 29 5.227 9.482 -8.197
195 HD11 ILE 29 3HD1 ILE 29 7.306 4.889 -8.732
196 HD12 ILE 29 1HD1 ILE 29 6.480 5.457 -7.280
197 HD13 ILE 29 2HD1 ILE 29 7.531 6.550 -8.182
198 H ILE 30 H ILE 30 4.663 8.660 -5.270
199 HA ILE 30 HA ILE 30 2.145 10.064 -5.673
200 HB ILE 30 HB ILE 30 3.715 9.587 -3.102
201 HG12 ILE 30 2HG1 ILE 30 1.015 8.517 -3.977
202 HG13 ILE 30 1HG1 ILE 30 2.510 7.594 -3.945
203 HG21 ILE 30 1HG2 ILE 30 2.780 11.701 -2.954
204 HG22 ILE 30 2HG2 ILE 30 1.748 10.623 -2.007
205 HG23 ILE 30 3HG2 ILE 30 1.252 11.172 -3.614
206 HD11 ILE 30 3HD1 ILE 30 1.144 8.813 -1.560
207 HD12 ILE 30 1HD1 ILE 30 2.608 7.833 -1.529
208 HD13 ILE 30 2HD1 ILE 30 1.080 7.114 -2.034
209 H GLY 31 H GLY 31 2.231 12.180 -6.015
210 HA2 GLY 31 2HA GLY 31 3.591 14.234 -5.160
211 HA3 GLY 31 1HA GLY 31 4.832 13.505 -6.194
212 H ARG 32 H ARG 32 4.647 15.529 -7.425
213 HA ARG 32 HA ARG 32 2.342 15.315 -9.245
214 HB2 ARG 32 2HB ARG 32 3.819 17.847 -8.506
215 HB3 ARG 32 1HB ARG 32 2.518 17.732 -9.670
216 HG2 ARG 32 2HG ARG 32 1.029 16.996 -7.765
217 HG3 ARG 32 1HG ARG 32 2.364 17.384 -6.695
218 HD2 ARG 32 2HD ARG 32 2.444 19.670 -7.572
219 HD3 ARG 32 1HD ARG 32 1.070 19.321 -8.608
220 HE ARG 32 HE ARG 32 0.658 18.930 -5.763
221 HH11 ARG 32 1HH1 ARG 32 0.172 21.033 -8.577
222 HH12 ARG 32 2HH1 ARG 32 -0.903 22.078 -7.786
223 HH21 ARG 32 1HH2 ARG 32 -0.773 20.420 -4.660
224 HH22 ARG 32 2HH2 ARG 32 -1.456 21.714 -5.542
225 H GLY 33 H GLY 33 3.109 14.370 -10.989
226 HA2 GLY 33 2HA GLY 33 5.146 15.536 -12.548
227 HA3 GLY 33 1HA GLY 33 5.737 14.103 -11.708
228 H GLN 34 H GLN 34 5.842 13.782 -14.223
229 HA GLN 34 HA GLN 34 3.492 13.118 -15.574
230 HB2 GLN 34 2HB GLN 34 4.972 12.023 -17.230
231 HB3 GLN 34 1HB GLN 34 5.432 13.674 -16.837
232 HG2 GLN 34 2HG GLN 34 7.226 12.824 -15.403
233 HG3 GLN 34 1HG GLN 34 6.746 11.174 -15.786
234 HE21 GLN 34 1HE2 GLN 34 9.277 12.537 -16.275
235 HE22 GLN 34 2HE2 GLN 34 9.543 12.433 -17.973
236 H ASP 35 H ASP 35 5.792 11.007 -13.870
237 HA ASP 35 HA ASP 35 4.099 8.727 -14.465
238 HB2 ASP 35 2HB ASP 35 5.930 7.385 -13.553
239 HB3 ASP 35 1HB ASP 35 6.501 8.479 -14.803
240 H ALA 36 H ALA 36 4.074 11.045 -12.258
241 HA ALA 36 HA ALA 36 3.682 9.568 -9.855
242 HB1 ALA 36 1HB ALA 36 4.280 11.945 -9.791
243 HB2 ALA 36 2HB ALA 36 2.751 11.657 -8.962
244 HB3 ALA 36 3HB ALA 36 2.757 12.352 -10.583
245 H GLN 37 H GLN 37 1.972 8.470 -9.293
246 HA GLN 37 HA GLN 37 -0.275 8.314 -11.117
247 HB2 GLN 37 2HB GLN 37 0.395 6.687 -8.662
248 HB3 GLN 37 1HB GLN 37 -0.820 6.302 -9.871
249 HG2 GLN 37 2HG GLN 37 2.153 6.429 -10.354
250 HG3 GLN 37 1HG GLN 37 1.208 4.956 -10.145
251 HE21 GLN 37 1HE2 GLN 37 2.830 5.943 -12.390
252 HE22 GLN 37 2HE2 GLN 37 1.769 5.927 -13.755
253 H PHE 38 H PHE 38 0.522 9.152 -7.822
254 HA PHE 38 HA PHE 38 -2.220 10.071 -7.427
255 HB2 PHE 38 2HB PHE 38 -1.704 8.159 -6.007
256 HB3 PHE 38 1HB PHE 38 -0.251 8.958 -5.430
257 HD1 PHE 38 1HD PHE 38 -3.959 9.374 -5.535
258 HD2 PHE 38 2HD PHE 38 -0.331 10.140 -3.467
259 HE1 PHE 38 1HE PHE 38 -5.228 10.293 -3.636
260 HE2 PHE 38 2HE PHE 38 -1.529 11.046 -1.608
261 HZ PHE 38 HZ PHE 38 -4.031 11.138 -1.657
262 H ARG 39 H ARG 39 -2.276 12.155 -7.536
263 HA ARG 39 HA ARG 39 0.112 13.715 -7.054
264 HB2 ARG 39 2HB ARG 39 -2.481 14.303 -8.429
265 HB3 ARG 39 1HB ARG 39 -1.487 15.630 -7.855
266 HG2 ARG 39 2HG ARG 39 -1.053 15.225 -10.189
267 HG3 ARG 39 1HG ARG 39 0.368 14.821 -9.241
268 HD2 ARG 39 2HD ARG 39 0.091 13.152 -10.937
269 HD3 ARG 39 1HD ARG 39 -0.297 12.427 -9.382
270 HE ARG 39 HE ARG 39 -2.685 12.833 -10.014
271 HH11 ARG 39 1HH1 ARG 39 -0.193 12.318 -12.464
272 HH12 ARG 39 2HH1 ARG 39 -1.265 11.709 -13.637
273 HH21 ARG 39 1HH2 ARG 39 -4.155 11.975 -11.630
274 HH22 ARG 39 2HH2 ARG 39 -3.566 11.507 -13.154
275 H LEU 40 H LEU 40 0.405 15.070 -5.484
276 HA LEU 40 HA LEU 40 -1.411 14.891 -3.262
277 HB2 LEU 40 2HB LEU 40 1.379 15.946 -3.535
278 HB3 LEU 40 1HB LEU 40 0.451 16.104 -2.056
279 HG LEU 40 HG LEU 40 1.076 13.456 -3.350
280 HD11 LEU 40 1HD1 LEU 40 2.460 14.927 -1.131
281 HD12 LEU 40 2HD1 LEU 40 3.158 14.472 -2.694
282 HD13 LEU 40 3HD1 LEU 40 2.724 13.232 -1.517
283 HD21 LEU 40 3HD2 LEU 40 0.458 12.577 -1.143
284 HD22 LEU 40 1HD2 LEU 40 -0.886 13.436 -1.893
285 HD23 LEU 40 2HD2 LEU 40 0.047 14.205 -0.611
286 HA PRO 41 HA PRO 41 -3.157 18.943 -3.937
287 HB2 PRO 41 2HB PRO 41 -3.706 19.055 -1.057
288 HB3 PRO 41 1HB PRO 41 -4.842 18.979 -2.404
289 HG2 PRO 41 2HG PRO 41 -4.474 16.900 -0.726
290 HG3 PRO 41 1HG PRO 41 -4.849 16.670 -2.441
291 HD2 PRO 41 2HD PRO 41 -2.225 16.452 -1.033
292 HD3 PRO 41 1HD PRO 41 -2.925 15.439 -2.313
293 H ASP 42 H ASP 42 -0.765 18.324 -1.540
294 HA ASP 42 HA ASP 42 -0.254 21.025 -0.709
295 HB2 ASP 42 2HB ASP 42 0.405 18.919 0.613
296 HB3 ASP 42 1HB ASP 42 1.615 18.703 -0.663
297 H THR 43 H THR 43 1.896 22.033 -1.109
298 HA THR 43 HA THR 43 2.890 21.438 -3.759
299 HB THR 43 HB THR 43 1.289 23.259 -3.892
300 HG1 THR 43 1HG THR 43 2.937 23.340 -5.370
301 HG21 THR 43 3HG2 THR 43 1.533 24.277 -1.710
302 HG22 THR 43 1HG2 THR 43 1.819 25.501 -2.950
303 HG23 THR 43 2HG2 THR 43 3.181 24.779 -2.095
304 H GLY 44 H GLY 44 5.129 22.191 -4.077
305 HA2 GLY 44 2HA GLY 44 7.278 22.581 -3.123
306 HA3 GLY 44 1HA GLY 44 6.576 22.347 -1.512
307 H VAL 45 H VAL 45 5.338 20.335 -3.684
308 HA VAL 45 HA VAL 45 6.553 17.956 -2.593
309 HB VAL 45 HB VAL 45 4.115 18.107 -2.700
310 HG11 VAL 45 1HG1 VAL 45 3.853 19.669 -4.518
311 HG12 VAL 45 2HG1 VAL 45 2.890 18.226 -4.801
312 HG13 VAL 45 3HG1 VAL 45 4.413 18.455 -5.670
313 HG21 VAL 45 3HG2 VAL 45 5.153 16.167 -4.749
314 HG22 VAL 45 1HG2 VAL 45 3.564 16.100 -3.991
315 HG23 VAL 45 2HG2 VAL 45 5.018 15.895 -3.007
316 H SER 46 H SER 46 7.721 16.499 -3.883
317 HA SER 46 HA SER 46 9.046 17.584 -6.167
318 HB2 SER 46 2HB SER 46 9.103 14.753 -5.155
319 HB3 SER 46 1HB SER 46 10.354 15.611 -6.037
320 HG SER 46 HG SER 46 10.511 15.313 -3.669
321 H ARG 47 H ARG 47 9.178 16.233 -8.248
322 HA ARG 47 HA ARG 47 6.621 15.492 -9.216
323 HB2 ARG 47 2HB ARG 47 7.849 14.509 -11.197
324 HB3 ARG 47 1HB ARG 47 8.174 16.199 -10.895
325 HG2 ARG 47 2HG ARG 47 10.293 15.519 -9.788
326 HG3 ARG 47 1HG ARG 47 9.947 13.851 -10.257
327 HD2 ARG 47 2HD ARG 47 10.011 14.436 -12.571
328 HD3 ARG 47 1HD ARG 47 10.164 16.152 -12.191
329 HE ARG 47 HE ARG 47 12.233 14.382 -11.183
330 HH11 ARG 47 1HH1 ARG 47 11.296 16.581 -13.803
331 HH12 ARG 47 2HH1 ARG 47 12.893 16.993 -14.194
332 HH21 ARG 47 1HH2 ARG 47 14.383 14.908 -11.755
333 HH22 ARG 47 2HH2 ARG 47 14.730 15.989 -13.031
334 H ARG 48 H ARG 48 9.283 13.716 -7.952
335 HA ARG 48 HA ARG 48 7.422 11.564 -7.347
336 HB2 ARG 48 2HB ARG 48 10.399 11.420 -7.904
337 HB3 ARG 48 1HB ARG 48 9.480 10.123 -7.167
338 HG2 ARG 48 2HG ARG 48 8.140 9.916 -9.182
339 HG3 ARG 48 1HG ARG 48 9.073 11.210 -9.941
340 HD2 ARG 48 2HD ARG 48 11.097 9.923 -9.747
341 HD3 ARG 48 1HD ARG 48 10.254 8.673 -8.841
342 HE ARG 48 HE ARG 48 8.903 8.819 -11.193
343 HH11 ARG 48 1HH1 ARG 48 12.308 8.317 -10.347
344 HH12 ARG 48 2HH1 ARG 48 12.622 7.270 -11.639
345 HH21 ARG 48 1HH2 ARG 48 9.328 7.417 -12.944
346 HH22 ARG 48 2HH2 ARG 48 10.885 6.751 -13.197
347 H HIS 49 H HIS 49 6.882 12.088 -5.363
348 HA HIS 49 HA HIS 49 8.784 13.473 -3.620
349 HB2 HIS 49 2HB HIS 49 6.674 14.620 -3.873
350 HB3 HIS 49 1HB HIS 49 5.771 13.156 -3.548
351 HD2 HIS 49 2HD HIS 49 5.756 12.371 -0.799
352 HE1 HIS 49 1HE HIS 49 6.807 16.207 0.599
353 HE2 HIS 49 2HE HIS 49 6.369 13.801 1.218
354 H LEU 50 H LEU 50 6.891 10.612 -4.017
355 HA LEU 50 HA LEU 50 8.462 9.231 -2.153
356 HB2 LEU 50 2HB LEU 50 7.154 10.481 -0.574
357 HB3 LEU 50 1HB LEU 50 5.663 10.080 -1.378
358 HG LEU 50 HG LEU 50 7.292 7.863 -0.213
359 HD11 LEU 50 1HD1 LEU 50 5.459 9.739 1.302
360 HD12 LEU 50 2HD1 LEU 50 7.213 9.671 1.487
361 HD13 LEU 50 3HD1 LEU 50 6.224 8.289 1.950
362 HD21 LEU 50 3HD2 LEU 50 4.349 8.469 -0.398
363 HD22 LEU 50 1HD2 LEU 50 5.055 6.969 0.195
364 HD23 LEU 50 2HD2 LEU 50 5.250 7.422 -1.498
365 H GLU 51 H GLU 51 8.219 7.114 -2.429
366 HA GLU 51 HA GLU 51 6.050 6.255 -4.195
367 HB2 GLU 51 2HB GLU 51 7.610 4.472 -5.067
368 HB3 GLU 51 1HB GLU 51 7.921 6.103 -5.627
369 HG2 GLU 51 2HG GLU 51 9.833 6.299 -4.259
370 HG3 GLU 51 1HG GLU 51 9.357 4.904 -3.300
371 H ILE 52 H ILE 52 4.825 4.776 -3.398
372 HA ILE 52 HA ILE 52 5.845 3.238 -1.127
373 HB ILE 52 HB ILE 52 2.970 3.528 -2.053
374 HG12 ILE 52 2HG1 ILE 52 4.355 4.663 0.392
375 HG13 ILE 52 1HG1 ILE 52 3.866 5.587 -1.022
376 HG21 ILE 52 1HG2 ILE 52 4.175 2.129 0.330
377 HG22 ILE 52 2HG2 ILE 52 3.413 1.373 -1.066
378 HG23 ILE 52 3HG2 ILE 52 2.441 2.345 0.058
379 HD11 ILE 52 3HD1 ILE 52 1.522 5.087 -0.538
380 HD12 ILE 52 1HD1 ILE 52 2.306 5.891 0.820
381 HD13 ILE 52 2HD1 ILE 52 2.014 4.153 0.874
382 H ARG 53 H ARG 53 6.657 1.386 -1.711
383 HA ARG 53 HA ARG 53 5.566 0.087 -4.062
384 HB2 ARG 53 2HB ARG 53 7.980 0.019 -3.987
385 HB3 ARG 53 1HB ARG 53 7.953 -0.670 -2.364
386 HG2 ARG 53 2HG ARG 53 6.822 -2.668 -3.244
387 HG3 ARG 53 1HG ARG 53 6.900 -1.980 -4.861
388 HD2 ARG 53 2HD ARG 53 9.261 -2.109 -4.872
389 HD3 ARG 53 1HD ARG 53 9.311 -2.564 -3.161
390 HE ARG 53 HE ARG 53 7.723 -4.414 -4.453
391 HH11 ARG 53 1HH1 ARG 53 11.109 -3.405 -4.703
392 HH12 ARG 53 2HH1 ARG 53 11.697 -4.953 -5.080
393 HH21 ARG 53 1HH2 ARG 53 8.507 -6.538 -4.929
394 HH22 ARG 53 2HH2 ARG 53 10.164 -6.798 -5.241
395 H TRP 54 H TRP 54 3.871 -1.004 -3.770
396 HA TRP 54 HA TRP 54 3.538 -2.388 -1.267
397 HB2 TRP 54 2HB TRP 54 1.671 -0.966 -1.757
398 HB3 TRP 54 1HB TRP 54 1.580 -1.581 -3.409
399 HD1 TRP 54 HD TRP 54 -0.565 -2.983 -3.569
400 HE1 TRP 54 1HE TRP 54 -1.685 -4.829 -2.165
401 HE3 TRP 54 3HE TRP 54 2.554 -2.967 0.468
402 HZ2 TRP 54 2HZ TRP 54 -1.299 -6.111 0.313
403 HZ3 TRP 54 3HZ TRP 54 2.132 -4.512 2.300
404 HH2 TRP 54 HH TRP 54 0.237 -6.067 2.239
405 H ASP 55 H ASP 55 4.277 -4.322 -1.312
406 HA ASP 55 HA ASP 55 3.891 -5.924 -3.747
407 HB2 ASP 55 2HB ASP 55 6.334 -5.373 -2.824
408 HB3 ASP 55 1HB ASP 55 5.936 -6.619 -1.647
409 H GLY 56 H GLY 56 3.892 -8.397 -2.830
410 HA2 GLY 56 2HA GLY 56 1.529 -8.336 -1.125
411 HA3 GLY 56 1HA GLY 56 2.163 -9.754 -1.936
412 H GLN 57 H GLN 57 3.941 -7.628 0.137
413 HA GLN 57 HA GLN 57 4.154 -9.688 2.216
414 HB2 GLN 57 2HB GLN 57 6.506 -8.262 0.945
415 HB3 GLN 57 1HB GLN 57 6.604 -9.307 2.353
416 HG2 GLN 57 2HG GLN 57 5.954 -11.219 1.028
417 HG3 GLN 57 1HG GLN 57 5.695 -10.188 -0.379
418 HE21 GLN 57 1HE2 GLN 57 8.041 -11.711 1.651
419 HE22 GLN 57 2HE2 GLN 57 9.397 -11.446 0.618
420 H VAL 58 H VAL 58 5.546 -6.480 1.422
421 HA VAL 58 HA VAL 58 4.313 -5.335 3.788
422 HB VAL 58 HB VAL 58 6.437 -4.122 4.341
423 HG11 VAL 58 1HG1 VAL 58 5.809 -6.057 5.665
424 HG12 VAL 58 2HG1 VAL 58 7.561 -5.953 5.494
425 HG13 VAL 58 3HG1 VAL 58 6.650 -7.118 4.533
426 HG21 VAL 58 3HG2 VAL 58 7.709 -6.085 2.430
427 HG22 VAL 58 1HG2 VAL 58 8.579 -4.987 3.502
428 HG23 VAL 58 2HG2 VAL 58 7.580 -4.342 2.199
429 H ALA 59 H ALA 59 4.323 -3.004 3.708
430 HA ALA 59 HA ALA 59 4.437 -1.941 0.963
431 HB1 ALA 59 1HB ALA 59 3.022 -0.827 3.389
432 HB2 ALA 59 2HB ALA 59 2.229 -1.756 2.124
433 HB3 ALA 59 3HB ALA 59 2.945 -0.185 1.747
434 H LEU 60 H LEU 60 6.103 -1.106 0.496
435 HA LEU 60 HA LEU 60 7.836 -0.033 2.517
436 HB2 LEU 60 2HB LEU 60 8.157 -0.921 -0.263
437 HB3 LEU 60 1HB LEU 60 9.343 0.161 0.448
438 HG LEU 60 HG LEU 60 8.468 -2.210 1.921
439 HD11 LEU 60 1HD1 LEU 60 10.328 -3.523 0.836
440 HD12 LEU 60 2HD1 LEU 60 10.655 -2.147 -0.218
441 HD13 LEU 60 3HD1 LEU 60 9.137 -3.033 -0.368
442 HD21 LEU 60 3HD2 LEU 60 11.067 -0.706 1.785
443 HD22 LEU 60 1HD2 LEU 60 10.777 -2.114 2.803
444 HD23 LEU 60 2HD2 LEU 60 9.858 -0.635 3.068
445 H LEU 61 H LEU 61 8.003 1.799 2.944
446 HA LEU 61 HA LEU 61 6.816 3.933 1.307
447 HB2 LEU 61 2HB LEU 61 5.949 3.548 3.557
448 HB3 LEU 61 1HB LEU 61 7.500 3.786 4.279
449 HG LEU 61 HG LEU 61 6.017 5.656 4.702
450 HD11 LEU 61 1HD1 LEU 61 8.324 6.302 4.486
451 HD12 LEU 61 2HD1 LEU 61 7.256 7.575 3.892
452 HD13 LEU 61 3HD1 LEU 61 8.114 6.538 2.752
453 HD21 LEU 61 3HD2 LEU 61 4.543 5.339 2.793
454 HD22 LEU 61 1HD2 LEU 61 5.803 5.970 1.738
455 HD23 LEU 61 2HD2 LEU 61 5.048 7.016 2.959
456 H ALA 62 H ALA 62 8.367 4.765 0.001
457 HA ALA 62 HA ALA 62 10.935 5.401 1.258
458 HB1 ALA 62 1HB ALA 62 11.968 5.200 -0.955
459 HB2 ALA 62 2HB ALA 62 10.406 4.774 -1.645
460 HB3 ALA 62 3HB ALA 62 11.179 3.694 -0.490
461 H ASP 63 H ASP 63 11.170 7.462 1.588
462 HA ASP 63 HA ASP 63 9.463 9.402 0.265
463 HB2 ASP 63 2HB ASP 63 9.720 9.703 2.633
464 HB3 ASP 63 1HB ASP 63 11.473 9.618 2.507
465 H LEU 64 H LEU 64 10.109 10.802 -1.237
466 HA LEU 64 HA LEU 64 12.982 10.918 -1.906
467 HB2 LEU 64 2HB LEU 64 10.720 11.243 -3.882
468 HB3 LEU 64 1HB LEU 64 12.416 11.013 -4.230
469 HG LEU 64 HG LEU 64 10.483 8.946 -3.211
470 HD11 LEU 64 1HD1 LEU 64 10.045 9.450 -5.441
471 HD12 LEU 64 2HD1 LEU 64 10.863 7.884 -5.394
472 HD13 LEU 64 3HD1 LEU 64 11.746 9.332 -5.893
473 HD21 LEU 64 3HD2 LEU 64 13.400 8.629 -3.951
474 HD22 LEU 64 1HD2 LEU 64 12.296 7.312 -3.551
475 HD23 LEU 64 2HD2 LEU 64 12.726 8.507 -2.326
476 H ASN 65 H ASN 65 12.681 12.872 -0.287
477 HA ASN 65 HA ASN 65 12.495 15.246 -1.861
478 HB2 ASN 65 2HB ASN 65 10.044 14.694 -1.388
479 HB3 ASN 65 1HB ASN 65 10.392 14.960 0.313
480 HD21 ASN 65 1HD2 ASN 65 8.544 16.353 -1.393
481 HD22 ASN 65 2HD2 ASN 65 9.017 18.019 -1.423
482 H SER 66 H SER 66 14.028 16.529 -1.021
483 HA SER 66 HA SER 66 14.894 16.048 1.710
484 HB2 SER 66 2HB SER 66 16.127 17.748 -0.464
485 HB3 SER 66 1HB SER 66 16.879 17.323 1.080
486 HG SER 66 HG SER 66 16.161 15.072 0.170
487 H THR 67 H THR 67 12.923 18.196 0.035
488 HA THR 67 HA THR 67 13.334 20.494 1.759
489 HB THR 67 HB THR 67 11.515 19.896 -0.565
490 HG1 THR 67 1HG THR 67 14.008 20.878 -0.353
491 HG21 THR 67 3HG2 THR 67 11.704 22.484 1.015
492 HG22 THR 67 1HG2 THR 67 10.294 21.432 0.842
493 HG23 THR 67 2HG2 THR 67 10.894 22.320 -0.552
494 H ASN 68 H ASN 68 10.728 18.297 0.888
495 HA ASN 68 HA ASN 68 9.237 19.111 3.291
496 HB2 ASN 68 2HB ASN 68 8.392 20.038 1.121
497 HB3 ASN 68 1HB ASN 68 8.151 18.397 0.557
498 HD21 ASN 68 1HD2 ASN 68 6.067 19.010 0.200
499 HD22 ASN 68 2HD2 ASN 68 4.839 19.088 1.394
500 H GLY 69 H GLY 69 11.131 16.969 2.915
501 HA2 GLY 69 2HA GLY 69 10.324 14.441 2.366
502 HA3 GLY 69 1HA GLY 69 11.414 14.841 3.682
503 H THR 70 H THR 70 9.129 13.000 3.105
504 HA THR 70 HA THR 70 6.897 13.629 4.662
505 HB THR 70 HB THR 70 7.826 10.938 3.684
506 HG1 THR 70 1HG THR 70 7.903 12.193 1.946
507 HG21 THR 70 3HG2 THR 70 5.840 10.921 5.152
508 HG22 THR 70 1HG2 THR 70 5.424 10.493 3.493
509 HG23 THR 70 2HG2 THR 70 5.071 12.113 4.106
510 H THR 71 H THR 71 6.249 12.938 6.591
511 HA THR 71 HA THR 71 8.201 11.706 8.372
512 HB THR 71 HB THR 71 6.550 12.637 10.140
513 HG1 THR 71 1HG THR 71 5.948 14.255 7.889
514 HG21 THR 71 3HG2 THR 71 8.777 13.437 9.886
515 HG22 THR 71 1HG2 THR 71 7.689 14.806 10.132
516 HG23 THR 71 2HG2 THR 71 8.311 14.441 8.506
517 H VAL 72 H VAL 72 7.638 9.916 9.504
518 HA VAL 72 HA VAL 72 4.950 8.832 9.097
519 HB VAL 72 HB VAL 72 5.997 6.524 9.287
520 HG11 VAL 72 1HG1 VAL 72 7.066 8.245 7.061
521 HG12 VAL 72 2HG1 VAL 72 5.500 7.431 7.100
522 HG13 VAL 72 3HG1 VAL 72 6.986 6.481 7.048
523 HG21 VAL 72 3HG2 VAL 72 8.428 6.337 8.996
524 HG22 VAL 72 1HG2 VAL 72 8.024 7.199 10.484
525 HG23 VAL 72 2HG2 VAL 72 8.560 8.099 9.073
526 H ASN 73 H ASN 73 3.890 8.690 10.892
527 HA ASN 73 HA ASN 73 3.325 8.828 13.082
528 HB2 ASN 73 2HB ASN 73 5.621 7.011 13.047
529 HB3 ASN 73 1HB ASN 73 5.491 7.864 14.578
530 HD21 ASN 73 1HD2 ASN 73 3.833 5.633 12.372
531 HD22 ASN 73 2HD2 ASN 73 2.753 5.037 13.567
532 H ASN 74 H ASN 74 4.803 10.888 11.712
533 HA ASN 74 HA ASN 74 5.391 13.020 11.993
534 HB2 ASN 74 2HB ASN 74 4.044 13.037 14.128
535 HB3 ASN 74 1HB ASN 74 5.502 12.591 15.003
536 HD21 ASN 74 1HD2 ASN 74 5.658 14.405 16.210
537 HD22 ASN 74 2HD2 ASN 74 5.983 15.974 15.570
538 H ALA 75 H ALA 75 7.254 10.458 12.436
539 HA ALA 75 HA ALA 75 9.661 11.937 13.128
540 HB1 ALA 75 1HB ALA 75 10.748 9.727 13.162
541 HB2 ALA 75 2HB ALA 75 9.243 8.982 12.625
542 HB3 ALA 75 3HB ALA 75 9.324 9.755 14.207
543 HA PRO 76 HA PRO 76 10.353 12.367 8.713
544 HB2 PRO 76 2HB PRO 76 12.807 13.540 8.873
545 HB3 PRO 76 1HB PRO 76 11.307 14.429 9.159
546 HG2 PRO 76 2HG PRO 76 13.247 13.302 11.130
547 HG3 PRO 76 1HG PRO 76 12.361 14.834 11.184
548 HD2 PRO 76 2HD PRO 76 11.624 12.624 12.605
549 HD3 PRO 76 1HD PRO 76 10.471 13.850 12.048
550 H VAL 77 H VAL 77 11.038 10.800 7.397
551 HA VAL 77 HA VAL 77 13.494 9.352 8.059
552 HB VAL 77 HB VAL 77 12.455 7.203 7.431
553 HG11 VAL 77 1HG1 VAL 77 12.594 7.728 9.795
554 HG12 VAL 77 2HG1 VAL 77 11.124 6.815 9.453
555 HG13 VAL 77 3HG1 VAL 77 11.039 8.555 9.720
556 HG21 VAL 77 3HG2 VAL 77 10.669 7.996 6.004
557 HG22 VAL 77 1HG2 VAL 77 9.878 8.772 7.378
558 HG23 VAL 77 2HG2 VAL 77 9.989 7.013 7.304
559 H GLN 78 H GLN 78 14.244 8.089 6.204
560 HA GLN 78 HA GLN 78 13.531 9.381 3.683
561 HB2 GLN 78 2HB GLN 78 15.639 8.342 2.805
562 HB3 GLN 78 1HB GLN 78 15.910 9.455 4.131
563 HG2 GLN 78 2HG GLN 78 16.167 7.608 5.667
564 HG3 GLN 78 1HG GLN 78 15.803 6.464 4.382
565 HE21 GLN 78 1HE2 GLN 78 18.130 6.687 6.066
566 HE22 GLN 78 2HE2 GLN 78 19.481 6.857 5.010
567 H GLU 79 H GLU 79 13.389 6.366 5.405
568 HA GLU 79 HA GLU 79 11.552 5.305 3.547
569 HB2 GLU 79 2HB GLU 79 12.801 3.167 3.154
570 HB3 GLU 79 1HB GLU 79 13.501 4.562 2.353
571 HG2 GLU 79 2HG GLU 79 15.142 4.703 4.244
572 HG3 GLU 79 1HG GLU 79 14.496 3.171 4.818
573 H TRP 80 H TRP 80 10.421 3.499 4.375
574 HA TRP 80 HA TRP 80 10.755 2.650 7.100
575 HB2 TRP 80 2HB TRP 80 10.025 4.876 7.492
576 HB3 TRP 80 1HB TRP 80 8.715 4.804 6.336
577 HD1 TRP 80 HD TRP 80 6.493 3.516 7.176
578 HE1 TRP 80 1HE TRP 80 5.574 3.248 9.569
579 HE3 TRP 80 3HE TRP 80 10.780 4.431 9.799
580 HZ2 TRP 80 2HZ TRP 80 6.531 3.407 12.187
581 HZ3 TRP 80 3HZ TRP 80 10.684 4.366 12.256
582 HH2 TRP 80 HH TRP 80 8.587 3.863 13.418
583 H GLN 81 H GLN 81 9.178 0.987 7.526
584 HA GLN 81 HA GLN 81 7.620 0.367 5.159
585 HB2 GLN 81 2HB GLN 81 7.557 -2.026 5.804
586 HB3 GLN 81 1HB GLN 81 9.195 -1.451 5.604
587 HG2 GLN 81 2HG GLN 81 9.362 -2.775 7.469
588 HG3 GLN 81 1HG GLN 81 9.125 -1.170 8.170
589 HE21 GLN 81 1HE2 GLN 81 8.300 -2.028 10.079
590 HE22 GLN 81 2HE2 GLN 81 6.730 -2.720 10.170
591 H LEU 82 H LEU 82 5.607 0.532 5.170
592 HA LEU 82 HA LEU 82 4.240 1.881 7.256
593 HB2 LEU 82 2HB LEU 82 3.048 0.444 4.916
594 HB3 LEU 82 1HB LEU 82 2.305 1.667 5.930
595 HG LEU 82 HG LEU 82 4.681 2.162 4.160
596 HD11 LEU 82 1HD1 LEU 82 1.771 2.867 3.767
597 HD12 LEU 82 2HD1 LEU 82 2.685 1.685 2.836
598 HD13 LEU 82 3HD1 LEU 82 3.106 3.395 2.745
599 HD21 LEU 82 3HD2 LEU 82 4.607 3.617 6.080
600 HD22 LEU 82 1HD2 LEU 82 2.904 3.958 5.769
601 HD23 LEU 82 2HD2 LEU 82 4.130 4.511 4.634
602 H ALA 83 H ALA 83 2.558 1.256 8.554
603 HA ALA 83 HA ALA 83 1.708 -1.521 8.598
604 HB1 ALA 83 1HB ALA 83 2.492 0.134 11.016
605 HB2 ALA 83 2HB ALA 83 3.343 -1.294 10.421
606 HB3 ALA 83 3HB ALA 83 1.717 -1.449 11.081
607 H ASP 84 H ASP 84 -0.426 -1.613 9.844
608 HA ASP 84 HA ASP 84 -2.155 0.436 8.887
609 HB2 ASP 84 2HB ASP 84 -3.002 -1.846 9.129
610 HB3 ASP 84 1HB ASP 84 -2.701 -1.798 10.860
611 H GLY 85 H GLY 85 -2.547 2.286 9.740
612 HA2 GLY 85 2HA GLY 85 -3.240 3.681 11.517
613 HA3 GLY 85 1HA GLY 85 -2.440 2.589 12.643
614 H ASP 86 H ASP 86 -0.474 3.111 9.953
615 HA ASP 86 HA ASP 86 1.271 4.756 11.568
616 HB2 ASP 86 2HB ASP 86 1.802 2.937 9.526
617 HB3 ASP 86 1HB ASP 86 2.014 4.502 8.734
618 H VAL 87 H VAL 87 1.604 6.849 11.317
619 HA VAL 87 HA VAL 87 -0.342 8.233 9.610
620 HB VAL 87 HB VAL 87 1.272 9.365 11.919
621 HG11 VAL 87 1HG1 VAL 87 -0.262 11.265 11.793
622 HG12 VAL 87 2HG1 VAL 87 -1.053 10.543 10.392
623 HG13 VAL 87 3HG1 VAL 87 0.630 11.063 10.285
624 HG21 VAL 87 3HG2 VAL 87 -0.843 9.324 13.183
625 HG22 VAL 87 1HG2 VAL 87 -0.324 7.703 12.713
626 HG23 VAL 87 2HG2 VAL 87 -1.621 8.506 11.829
627 H ILE 88 H ILE 88 0.423 8.873 7.768
628 HA ILE 88 HA ILE 88 3.247 9.522 7.522
629 HB ILE 88 HB ILE 88 1.143 8.573 5.557
630 HG12 ILE 88 2HG1 ILE 88 2.834 6.947 4.868
631 HG13 ILE 88 1HG1 ILE 88 4.017 7.692 5.917
632 HG21 ILE 88 1HG2 ILE 88 2.089 10.520 4.463
633 HG22 ILE 88 2HG2 ILE 88 2.603 9.039 3.653
634 HG23 ILE 88 3HG2 ILE 88 3.714 9.892 4.725
635 HD11 ILE 88 3HD1 ILE 88 1.533 6.194 6.770
636 HD12 ILE 88 1HD1 ILE 88 2.674 6.963 7.869
637 HD13 ILE 88 2HD1 ILE 88 3.192 5.612 6.873
638 H ARG 89 H ARG 89 3.776 11.662 7.153
639 HA ARG 89 HA ARG 89 1.561 13.451 6.476
640 HB2 ARG 89 2HB ARG 89 1.892 13.330 8.953
641 HB3 ARG 89 1HB ARG 89 3.515 13.962 8.712
642 HG2 ARG 89 2HG ARG 89 2.402 15.935 7.561
643 HG3 ARG 89 1HG ARG 89 0.889 15.336 8.234
644 HD2 ARG 89 2HD ARG 89 1.753 16.980 9.726
645 HD3 ARG 89 1HD ARG 89 1.974 15.402 10.486
646 HE ARG 89 HE ARG 89 4.306 15.802 9.172
647 HH11 ARG 89 1HH1 ARG 89 2.521 17.597 11.663
648 HH12 ARG 89 2HH1 ARG 89 3.884 18.444 12.204
649 HH21 ARG 89 1HH2 ARG 89 6.193 17.065 9.907
650 HH22 ARG 89 2HH2 ARG 89 5.982 18.124 11.218
651 H LEU 90 H LEU 90 2.153 15.261 5.447
652 HA LEU 90 HA LEU 90 4.915 15.981 5.108
653 HB2 LEU 90 2HB LEU 90 4.656 16.470 2.732
654 HB3 LEU 90 1HB LEU 90 4.343 14.774 2.997
655 HG LEU 90 HG LEU 90 2.099 16.758 2.745
656 HD11 LEU 90 1HD1 LEU 90 3.521 15.256 0.560
657 HD12 LEU 90 2HD1 LEU 90 3.543 17.005 0.799
658 HD13 LEU 90 3HD1 LEU 90 2.035 16.193 0.370
659 HD21 LEU 90 3HD2 LEU 90 1.544 14.514 3.589
660 HD22 LEU 90 1HD2 LEU 90 2.314 13.792 2.174
661 HD23 LEU 90 2HD2 LEU 90 0.864 14.777 1.983
662 H GLY 91 H GLY 91 4.865 18.319 4.179
663 HA2 GLY 91 2HA GLY 91 3.972 20.011 6.071
664 HA3 GLY 91 1HA GLY 91 4.112 20.508 4.399
665 H HIS 92 H HIS 92 2.073 19.933 7.048
666 HA HIS 92 HA HIS 92 -0.088 20.291 7.547
667 HB2 HIS 92 2HB HIS 92 0.195 22.050 5.146
668 HB3 HIS 92 1HB HIS 92 -1.372 21.875 5.927
669 HD1 HIS 92 1HD HIS 92 -1.674 24.024 7.158
670 HD2 HIS 92 2HD HIS 92 2.154 22.493 7.616
671 HE1 HIS 92 1HE HIS 92 -0.524 25.526 8.813
672 H SER 93 H SER 93 0.604 18.043 5.598
673 HA SER 93 HA SER 93 -2.179 17.501 4.905
674 HB2 SER 93 2HB SER 93 0.185 16.666 3.238
675 HB3 SER 93 1HB SER 93 -1.517 16.544 2.807
676 HG SER 93 HG SER 93 -0.042 18.930 3.203
677 H GLU 94 H GLU 94 -2.762 15.768 6.145
678 HA GLU 94 HA GLU 94 -0.677 13.822 6.735
679 HB2 GLU 94 2HB GLU 94 -1.813 13.369 8.890
680 HB3 GLU 94 1HB GLU 94 -1.179 15.000 8.757
681 HG2 GLU 94 2HG GLU 94 -3.476 15.769 8.193
682 HG3 GLU 94 1HG GLU 94 -4.051 14.136 8.528
683 H ILE 95 H ILE 95 -1.063 11.723 6.613
684 HA ILE 95 HA ILE 95 -3.655 10.826 5.739
685 HB ILE 95 HB ILE 95 -2.742 11.092 3.638
686 HG12 ILE 95 2HG1 ILE 95 -3.317 8.607 4.015
687 HG13 ILE 95 1HG1 ILE 95 -2.366 9.007 2.594
688 HG21 ILE 95 1HG2 ILE 95 -0.633 11.937 4.165
689 HG22 ILE 95 2HG2 ILE 95 -0.440 10.692 2.929
690 HG23 ILE 95 3HG2 ILE 95 -0.038 10.339 4.610
691 HD11 ILE 95 3HD1 ILE 95 -1.249 7.920 5.173
692 HD12 ILE 95 1HD1 ILE 95 -0.342 8.216 3.697
693 HD13 ILE 95 2HD1 ILE 95 -1.576 6.947 3.752
694 H ILE 96 H ILE 96 -4.203 8.861 6.405
695 HA ILE 96 HA ILE 96 -2.315 7.520 8.223
696 HB ILE 96 HB ILE 96 -5.362 7.469 8.267
697 HG12 ILE 96 2HG1 ILE 96 -5.027 8.378 10.639
698 HG13 ILE 96 1HG1 ILE 96 -3.362 8.686 10.191
699 HG21 ILE 96 1HG2 ILE 96 -3.455 5.992 10.073
700 HG22 ILE 96 2HG2 ILE 96 -4.528 5.286 8.866
701 HG23 ILE 96 3HG2 ILE 96 -5.204 6.088 10.285
702 HD11 ILE 96 3HD1 ILE 96 -4.704 10.705 10.055
703 HD12 ILE 96 1HD1 ILE 96 -5.803 9.919 8.920
704 HD13 ILE 96 2HD1 ILE 96 -4.135 10.236 8.451
705 H VAL 97 H VAL 97 -1.630 5.568 7.642
706 HA VAL 97 HA VAL 97 -2.726 4.343 5.267
707 HB VAL 97 HB VAL 97 -0.336 3.665 7.007
708 HG11 VAL 97 1HG1 VAL 97 0.254 1.973 5.312
709 HG12 VAL 97 2HG1 VAL 97 -1.274 2.278 4.483
710 HG13 VAL 97 3HG1 VAL 97 -1.272 1.587 6.110
711 HG21 VAL 97 3HG2 VAL 97 -0.576 4.621 4.175
712 HG22 VAL 97 1HG2 VAL 97 0.934 4.339 5.038
713 HG23 VAL 97 2HG2 VAL 97 -0.160 5.633 5.555
714 H ARG 98 H ARG 98 -4.187 2.733 5.257
715 HA ARG 98 HA ARG 98 -4.569 1.233 7.734
716 HB2 ARG 98 2HB ARG 98 -6.556 1.874 5.553
717 HB3 ARG 98 1HB ARG 98 -6.859 0.826 6.926
718 HG2 ARG 98 2HG ARG 98 -6.220 3.743 7.043
719 HG3 ARG 98 1HG ARG 98 -7.837 3.053 7.233
720 HD2 ARG 98 2HD ARG 98 -5.438 2.767 9.049
721 HD3 ARG 98 1HD ARG 98 -6.969 3.554 9.414
722 HE ARG 98 HE ARG 98 -6.371 0.719 9.363
723 HH11 ARG 98 1HH1 ARG 98 -8.925 3.204 9.635
724 HH12 ARG 98 2HH1 ARG 98 -10.000 2.223 10.488
725 HH21 ARG 98 1HH2 ARG 98 -7.898 -0.649 10.516
726 HH22 ARG 98 2HH2 ARG 98 -9.421 -0.059 10.960
727 H MET 99 H MET 99 -4.786 -0.884 7.577
728 HA MET 99 HA MET 99 -4.319 -2.115 4.957
729 HB2 MET 99 2HB MET 99 -2.913 -2.936 7.510
730 HB3 MET 99 1HB MET 99 -2.895 -3.827 6.008
731 HG2 MET 99 2HG MET 99 -1.821 -1.880 4.913
732 HG3 MET 99 1HG MET 99 -1.730 -1.113 6.492
733 HE1 MET 99 3HE MET 99 1.953 -2.257 5.614
734 HE2 MET 99 1HE MET 99 0.909 -0.874 5.925
735 HE3 MET 99 2HE MET 99 0.714 -1.809 4.444
736 H HIS 100 H HIS 100 -5.688 -3.607 4.519
737 HA HIS 100 HA HIS 100 -7.288 -4.723 6.690
738 HB2 HIS 100 2HB HIS 100 -7.910 -4.518 3.725
739 HB3 HIS 100 1HB HIS 100 -8.986 -5.159 4.957
740 HD1 HIS 100 1HD HIS 100 -10.280 -3.423 6.406
741 HD2 HIS 100 2HD HIS 100 -7.683 -1.720 3.651
742 HE1 HIS 100 1HE HIS 100 -10.839 -0.972 6.342
Start of MODEL 13
1 H1 GLY 1 1HT GLY 1 -9.345 -19.660 -4.763
2 H2 GLY 1 2HT GLY 1 -9.102 -19.460 -6.400
3 H3 GLY 1 3HT GLY 1 -10.535 -20.167 -5.851
4 HA2 GLY 1 1HA GLY 1 -10.902 -17.921 -6.562
5 HA3 GLY 1 2HA GLY 1 -11.149 -18.067 -4.823
6 H HIS 2 H HIS 2 -10.271 -16.495 -3.713
7 HA HIS 2 HA HIS 2 -8.013 -15.029 -4.887
8 HB2 HIS 2 2HB HIS 2 -9.976 -14.165 -2.746
9 HB3 HIS 2 1HB HIS 2 -8.650 -13.183 -3.357
10 HD1 HIS 2 1HD HIS 2 -9.098 -11.859 -5.516
11 HD2 HIS 2 2HD HIS 2 -12.102 -14.583 -4.595
12 HE1 HIS 2 1HE HIS 2 -10.995 -11.355 -7.074
13 H GLY 3 H GLY 3 -9.079 -16.863 -2.147
14 HA2 GLY 3 2HA GLY 3 -7.853 -17.877 -0.485
15 HA3 GLY 3 1HA GLY 3 -6.391 -17.223 -1.213
16 H SER 4 H SER 4 -5.677 -16.725 0.974
17 HA SER 4 HA SER 4 -7.133 -14.627 2.325
18 HB2 SER 4 2HB SER 4 -4.476 -15.894 3.063
19 HB3 SER 4 1HB SER 4 -5.553 -14.967 4.112
20 HG SER 4 HG SER 4 -7.089 -16.781 3.262
21 H ALA 5 H ALA 5 -6.943 -13.054 0.752
22 HA ALA 5 HA ALA 5 -4.409 -11.623 0.674
23 HB1 ALA 5 1HB ALA 5 -4.263 -13.149 -1.233
24 HB2 ALA 5 2HB ALA 5 -4.465 -11.487 -1.791
25 HB3 ALA 5 3HB ALA 5 -5.835 -12.597 -1.810
26 H GLY 6 H GLY 6 -6.884 -11.159 1.938
27 HA2 GLY 6 2HA GLY 6 -8.404 -9.342 0.272
28 HA3 GLY 6 1HA GLY 6 -8.773 -9.823 1.921
29 H THR 7 H THR 7 -5.768 -9.180 2.422
30 HA THR 7 HA THR 7 -6.121 -6.753 3.706
31 HB THR 7 HB THR 7 -3.555 -7.989 2.686
32 HG1 THR 7 1HG THR 7 -4.675 -8.101 5.280
33 HG21 THR 7 3HG2 THR 7 -3.218 -5.648 3.285
34 HG22 THR 7 1HG2 THR 7 -2.454 -6.693 4.481
35 HG23 THR 7 2HG2 THR 7 -3.995 -5.905 4.849
36 H SER 8 H SER 8 -6.555 -4.896 2.813
37 HA SER 8 HA SER 8 -5.106 -4.078 0.390
38 HB2 SER 8 2HB SER 8 -7.688 -2.979 1.524
39 HB3 SER 8 1HB SER 8 -6.972 -2.610 -0.047
40 HG SER 8 HG SER 8 -7.527 -5.252 0.624
41 H VAL 9 H VAL 9 -3.801 -2.253 0.650
42 HA VAL 9 HA VAL 9 -3.969 -1.035 3.279
43 HB VAL 9 HB VAL 9 -1.746 -1.909 2.926
44 HG11 VAL 9 1HG1 VAL 9 -0.327 -1.220 1.057
45 HG12 VAL 9 2HG1 VAL 9 -1.739 -0.395 0.363
46 HG13 VAL 9 3HG1 VAL 9 -1.752 -2.150 0.574
47 HG21 VAL 9 3HG2 VAL 9 -0.347 0.109 3.067
48 HG22 VAL 9 1HG2 VAL 9 -1.807 0.237 4.051
49 HG23 VAL 9 2HG2 VAL 9 -1.711 1.074 2.504
50 H THR 10 H THR 10 -4.859 0.799 3.457
51 HA THR 10 HA THR 10 -5.319 2.321 1.027
52 HB THR 10 HB THR 10 -7.359 1.628 3.159
53 HG1 THR 10 1HG THR 10 -8.180 0.224 1.617
54 HG21 THR 10 3HG2 THR 10 -8.978 2.649 1.630
55 HG22 THR 10 1HG2 THR 10 -7.675 3.075 0.516
56 HG23 THR 10 2HG2 THR 10 -7.752 3.826 2.109
57 H LEU 11 H LEU 11 -5.198 4.391 1.206
58 HA LEU 11 HA LEU 11 -4.043 5.560 3.581
59 HB2 LEU 11 2HB LEU 11 -4.633 6.749 0.893
60 HB3 LEU 11 1HB LEU 11 -3.578 7.402 2.130
61 HG LEU 11 HG LEU 11 -3.184 4.875 0.649
62 HD11 LEU 11 1HD1 LEU 11 -1.312 6.106 -0.500
63 HD12 LEU 11 2HD1 LEU 11 -1.799 7.564 0.362
64 HD13 LEU 11 3HD1 LEU 11 -2.890 6.828 -0.811
65 HD21 LEU 11 3HD2 LEU 11 -0.875 4.913 1.600
66 HD22 LEU 11 1HD2 LEU 11 -2.138 4.738 2.817
67 HD23 LEU 11 2HD2 LEU 11 -1.351 6.299 2.581
68 H GLN 12 H GLN 12 -5.203 6.666 4.907
69 HA GLN 12 HA GLN 12 -7.904 7.592 4.150
70 HB2 GLN 12 2HB GLN 12 -7.393 5.997 6.192
71 HB3 GLN 12 1HB GLN 12 -6.848 7.462 6.959
72 HG2 GLN 12 2HG GLN 12 -9.647 7.060 5.903
73 HG3 GLN 12 1HG GLN 12 -9.163 6.825 7.572
74 HE21 GLN 12 1HE2 GLN 12 -8.745 8.635 8.836
75 HE22 GLN 12 2HE2 GLN 12 -9.209 10.228 8.360
76 H LEU 13 H LEU 13 -7.945 9.653 3.629
77 HA LEU 13 HA LEU 13 -6.129 11.544 4.928
78 HB2 LEU 13 2HB LEU 13 -5.615 11.303 2.558
79 HB3 LEU 13 1HB LEU 13 -7.300 11.541 2.152
80 HG LEU 13 HG LEU 13 -7.183 13.798 3.047
81 HD11 LEU 13 1HD1 LEU 13 -4.967 14.853 3.415
82 HD12 LEU 13 2HD1 LEU 13 -4.222 13.257 3.285
83 HD13 LEU 13 3HD1 LEU 13 -5.348 13.604 4.599
84 HD21 LEU 13 3HD2 LEU 13 -6.961 13.445 0.676
85 HD22 LEU 13 1HD2 LEU 13 -5.222 13.182 0.840
86 HD23 LEU 13 2HD2 LEU 13 -5.912 14.772 1.174
87 H ASP 14 H ASP 14 -7.382 12.647 6.375
88 HA ASP 14 HA ASP 14 -10.103 13.041 5.534
89 HB2 ASP 14 2HB ASP 14 -9.853 12.218 7.836
90 HB3 ASP 14 1HB ASP 14 -8.930 13.670 8.243
91 H ASP 15 H ASP 15 -10.135 14.475 4.177
92 HA ASP 15 HA ASP 15 -8.870 17.038 4.630
93 HB2 ASP 15 2HB ASP 15 -8.655 15.913 2.409
94 HB3 ASP 15 1HB ASP 15 -10.398 15.946 2.227
95 H GLY 16 H GLY 16 -11.019 16.077 6.265
96 HA2 GLY 16 2HA GLY 16 -13.017 16.728 7.158
97 HA3 GLY 16 1HA GLY 16 -13.058 18.058 5.986
98 H SER 17 H SER 17 -12.870 14.599 5.702
99 HA SER 17 HA SER 17 -15.394 14.303 4.330
100 HB2 SER 17 2HB SER 17 -12.884 14.054 2.665
101 HB3 SER 17 1HB SER 17 -14.517 13.673 2.131
102 HG SER 17 HG SER 17 -14.554 16.100 3.124
103 H GLY 18 H GLY 18 -12.305 12.955 5.418
104 HA2 GLY 18 2HA GLY 18 -11.632 10.844 5.857
105 HA3 GLY 18 1HA GLY 18 -13.335 10.389 5.845
106 H ARG 19 H ARG 19 -10.759 11.295 3.555
107 HA ARG 19 HA ARG 19 -12.076 9.773 1.452
108 HB2 ARG 19 2HB ARG 19 -9.588 11.449 1.469
109 HB3 ARG 19 1HB ARG 19 -10.189 10.541 0.093
110 HG2 ARG 19 2HG ARG 19 -12.256 11.941 0.171
111 HG3 ARG 19 1HG ARG 19 -11.513 12.878 1.473
112 HD2 ARG 19 2HD ARG 19 -9.654 13.450 -0.007
113 HD3 ARG 19 1HD ARG 19 -10.403 12.531 -1.307
114 HE ARG 19 HE ARG 19 -11.783 14.837 -0.104
115 HH11 ARG 19 1HH1 ARG 19 -10.581 13.177 -2.999
116 HH12 ARG 19 2HH1 ARG 19 -11.042 14.423 -4.057
117 HH21 ARG 19 1HH2 ARG 19 -12.436 16.483 -1.519
118 HH22 ARG 19 2HH2 ARG 19 -12.164 16.359 -3.203
119 H THR 20 H THR 20 -11.057 8.046 0.396
120 HA THR 20 HA THR 20 -8.682 7.055 1.696
121 HB THR 20 HB THR 20 -9.664 4.716 1.641
122 HG1 THR 20 1HG THR 20 -11.895 6.208 0.908
123 HG21 THR 20 3HG2 THR 20 -9.291 5.880 3.711
124 HG22 THR 20 1HG2 THR 20 -10.848 5.040 3.821
125 HG23 THR 20 2HG2 THR 20 -10.774 6.791 3.490
126 H TYR 21 H TYR 21 -7.225 6.183 0.400
127 HA TYR 21 HA TYR 21 -7.947 5.642 -2.404
128 HB2 TYR 21 2HB TYR 21 -6.824 7.860 -2.172
129 HB3 TYR 21 1HB TYR 21 -5.485 7.079 -1.355
130 HD1 TYR 21 1HD TYR 21 -7.187 7.520 -4.593
131 HD2 TYR 21 2HD TYR 21 -3.763 5.955 -2.614
132 HE1 TYR 21 1HE TYR 21 -6.047 7.277 -6.766
133 HE2 TYR 21 2HE TYR 21 -2.617 5.700 -4.775
134 HH TYR 21 HH TYR 21 -3.102 5.537 -7.061
135 H GLN 22 H GLN 22 -7.248 3.642 -2.993
136 HA GLN 22 HA GLN 22 -5.722 2.203 -0.974
137 HB2 GLN 22 2HB GLN 22 -7.901 1.307 -1.823
138 HB3 GLN 22 1HB GLN 22 -7.147 1.117 -3.398
139 HG2 GLN 22 2HG GLN 22 -5.491 -0.405 -2.385
140 HG3 GLN 22 1HG GLN 22 -6.342 -0.268 -0.849
141 HE21 GLN 22 1HE2 GLN 22 -5.854 -2.591 -2.459
142 HE22 GLN 22 2HE2 GLN 22 -7.403 -3.259 -2.837
143 H LEU 23 H LEU 23 -3.805 1.259 -1.379
144 HA LEU 23 HA LEU 23 -2.277 2.214 -3.634
145 HB2 LEU 23 2HB LEU 23 -1.669 0.324 -1.402
146 HB3 LEU 23 1HB LEU 23 -0.482 0.789 -2.578
147 HG LEU 23 HG LEU 23 -1.833 2.652 -0.608
148 HD11 LEU 23 1HD1 LEU 23 0.932 1.491 -0.713
149 HD12 LEU 23 2HD1 LEU 23 -0.313 1.135 0.485
150 HD13 LEU 23 3HD1 LEU 23 0.407 2.744 0.413
151 HD21 LEU 23 3HD2 LEU 23 -0.186 4.298 -1.349
152 HD22 LEU 23 1HD2 LEU 23 -1.213 3.802 -2.694
153 HD23 LEU 23 2HD2 LEU 23 0.427 3.163 -2.545
154 H ARG 24 H ARG 24 -1.606 1.004 -5.365
155 HA ARG 24 HA ARG 24 -2.911 -1.589 -5.629
156 HB2 ARG 24 2HB ARG 24 -1.607 0.143 -7.732
157 HB3 ARG 24 1HB ARG 24 -2.258 -1.455 -8.037
158 HG2 ARG 24 2HG ARG 24 -3.756 1.026 -7.249
159 HG3 ARG 24 1HG ARG 24 -3.838 0.156 -8.778
160 HD2 ARG 24 2HD ARG 24 -4.843 -0.772 -6.083
161 HD3 ARG 24 1HD ARG 24 -5.803 -0.344 -7.487
162 HE ARG 24 HE ARG 24 -3.963 -2.604 -7.796
163 HH11 ARG 24 1HH1 ARG 24 -7.314 -1.517 -7.460
164 HH12 ARG 24 2HH1 ARG 24 -7.995 -3.063 -7.593
165 HH21 ARG 24 1HH2 ARG 24 -4.836 -4.713 -7.988
166 HH22 ARG 24 2HH2 ARG 24 -6.517 -4.964 -7.981
167 H GLU 25 H GLU 25 -1.629 -3.162 -6.969
168 HA GLU 25 HA GLU 25 0.659 -3.810 -5.412
169 HB2 GLU 25 2HB GLU 25 0.662 -5.914 -6.820
170 HB3 GLU 25 1HB GLU 25 -0.800 -5.638 -5.900
171 HG2 GLU 25 2HG GLU 25 -0.536 -4.993 -8.844
172 HG3 GLU 25 1HG GLU 25 -1.114 -6.540 -8.239
173 H GLY 26 H GLY 26 2.553 -3.105 -5.791
174 HA2 GLY 26 2HA GLY 26 4.379 -3.141 -7.521
175 HA3 GLY 26 1HA GLY 26 3.261 -2.149 -8.471
176 H SER 27 H SER 27 4.924 -0.456 -8.330
177 HA SER 27 HA SER 27 4.931 0.675 -5.667
178 HB2 SER 27 2HB SER 27 6.828 2.062 -6.352
179 HB3 SER 27 1HB SER 27 7.152 0.346 -6.524
180 HG SER 27 HG SER 27 6.119 1.178 -8.832
181 H ASN 28 H ASN 28 4.070 2.494 -5.204
182 HA ASN 28 HA ASN 28 2.422 3.836 -7.238
183 HB2 ASN 28 2HB ASN 28 2.125 3.726 -4.209
184 HB3 ASN 28 1HB ASN 28 1.008 4.504 -5.319
185 HD21 ASN 28 1HD2 ASN 28 2.190 1.409 -4.131
186 HD22 ASN 28 2HD2 ASN 28 0.920 0.447 -4.776
187 H ILE 29 H ILE 29 3.359 5.689 -7.881
188 HA ILE 29 HA ILE 29 5.260 7.049 -6.101
189 HB ILE 29 HB ILE 29 4.719 7.555 -9.045
190 HG12 ILE 29 2HG1 ILE 29 6.992 6.011 -7.761
191 HG13 ILE 29 1HG1 ILE 29 5.631 5.281 -8.601
192 HG21 ILE 29 1HG2 ILE 29 6.972 8.491 -7.260
193 HG22 ILE 29 2HG2 ILE 29 5.666 9.493 -7.894
194 HG23 ILE 29 3HG2 ILE 29 6.849 8.783 -8.994
195 HD11 ILE 29 3HD1 ILE 29 6.343 6.371 -10.675
196 HD12 ILE 29 1HD1 ILE 29 7.611 5.343 -10.003
197 HD13 ILE 29 2HD1 ILE 29 7.704 7.097 -9.821
198 H ILE 30 H ILE 30 4.767 8.897 -5.126
199 HA ILE 30 HA ILE 30 2.352 10.354 -5.931
200 HB ILE 30 HB ILE 30 3.464 9.939 -3.121
201 HG12 ILE 30 2HG1 ILE 30 0.911 8.868 -4.363
202 HG13 ILE 30 1HG1 ILE 30 2.360 7.926 -4.057
203 HG21 ILE 30 1HG2 ILE 30 1.369 11.042 -2.381
204 HG22 ILE 30 2HG2 ILE 30 1.135 11.565 -4.064
205 HG23 ILE 30 3HG2 ILE 30 2.550 12.076 -3.171
206 HD11 ILE 30 3HD1 ILE 30 2.097 8.291 -1.660
207 HD12 ILE 30 1HD1 ILE 30 0.664 7.537 -2.360
208 HD13 ILE 30 2HD1 ILE 30 0.650 9.257 -1.965
209 H GLY 31 H GLY 31 2.518 12.568 -6.014
210 HA2 GLY 31 2HA GLY 31 3.998 14.445 -4.836
211 HA3 GLY 31 1HA GLY 31 5.170 13.768 -5.997
212 H ARG 32 H ARG 32 5.215 15.734 -7.014
213 HA ARG 32 HA ARG 32 2.807 16.250 -8.609
214 HB2 ARG 32 2HB ARG 32 4.533 18.199 -7.111
215 HB3 ARG 32 1HB ARG 32 3.449 18.688 -8.407
216 HG2 ARG 32 2HG ARG 32 2.479 17.069 -6.140
217 HG3 ARG 32 1HG ARG 32 2.608 18.790 -5.912
218 HD2 ARG 32 2HD ARG 32 0.985 17.249 -7.961
219 HD3 ARG 32 1HD ARG 32 0.358 18.241 -6.646
220 HE ARG 32 HE ARG 32 1.473 20.150 -7.901
221 HH11 ARG 32 1HH1 ARG 32 -0.044 17.387 -9.453
222 HH12 ARG 32 2HH1 ARG 32 -0.319 18.179 -10.934
223 HH21 ARG 32 1HH2 ARG 32 1.075 21.259 -9.977
224 HH22 ARG 32 2HH2 ARG 32 0.358 20.381 -11.250
225 H GLY 33 H GLY 33 3.500 15.520 -10.488
226 HA2 GLY 33 2HA GLY 33 5.167 17.035 -12.045
227 HA3 GLY 33 1HA GLY 33 6.103 15.660 -11.444
228 H GLN 34 H GLN 34 5.648 15.839 -14.064
229 HA GLN 34 HA GLN 34 3.362 14.322 -14.891
230 HB2 GLN 34 2HB GLN 34 4.449 14.295 -17.087
231 HB3 GLN 34 1HB GLN 34 4.529 15.903 -16.386
232 HG2 GLN 34 2HG GLN 34 6.866 15.405 -15.666
233 HG3 GLN 34 1HG GLN 34 6.750 13.882 -16.537
234 HE21 GLN 34 1HE2 GLN 34 6.954 17.313 -16.803
235 HE22 GLN 34 2HE2 GLN 34 7.341 17.356 -18.486
236 H ASP 35 H ASP 35 6.253 13.584 -13.429
237 HA ASP 35 HA ASP 35 6.506 10.887 -14.516
238 HB2 ASP 35 2HB ASP 35 8.504 12.344 -14.183
239 HB3 ASP 35 1HB ASP 35 8.198 12.311 -12.455
240 H ALA 36 H ALA 36 4.858 12.396 -12.032
241 HA ALA 36 HA ALA 36 4.961 10.141 -10.158
242 HB1 ALA 36 1HB ALA 36 3.439 12.751 -10.014
243 HB2 ALA 36 2HB ALA 36 4.990 12.427 -9.238
244 HB3 ALA 36 3HB ALA 36 3.546 11.546 -8.730
245 H GLN 37 H GLN 37 3.105 8.944 -9.625
246 HA GLN 37 HA GLN 37 1.281 8.622 -11.852
247 HB2 GLN 37 2HB GLN 37 1.500 7.116 -9.249
248 HB3 GLN 37 1HB GLN 37 0.563 6.638 -10.653
249 HG2 GLN 37 2HG GLN 37 2.574 6.276 -11.927
250 HG3 GLN 37 1HG GLN 37 3.560 6.899 -10.605
251 HE21 GLN 37 1HE2 GLN 37 3.716 4.321 -11.829
252 HE22 GLN 37 2HE2 GLN 37 3.427 3.176 -10.568
253 H PHE 38 H PHE 38 1.203 9.204 -8.371
254 HA PHE 38 HA PHE 38 -1.517 10.203 -8.652
255 HB2 PHE 38 2HB PHE 38 -1.330 8.397 -7.043
256 HB3 PHE 38 1HB PHE 38 0.010 9.201 -6.243
257 HD1 PHE 38 1HD PHE 38 -3.597 9.709 -7.074
258 HD2 PHE 38 2HD PHE 38 -0.409 10.477 -4.371
259 HE1 PHE 38 1HE PHE 38 -5.172 10.773 -5.507
260 HE2 PHE 38 2HE PHE 38 -1.919 11.517 -2.822
261 HZ PHE 38 HZ PHE 38 -4.346 11.688 -3.368
262 H ARG 39 H ARG 39 -1.580 12.275 -8.908
263 HA ARG 39 HA ARG 39 0.553 13.904 -7.855
264 HB2 ARG 39 2HB ARG 39 -1.612 14.486 -9.877
265 HB3 ARG 39 1HB ARG 39 -0.668 15.769 -9.149
266 HG2 ARG 39 2HG ARG 39 0.334 15.290 -11.248
267 HG3 ARG 39 1HG ARG 39 1.398 14.626 -10.022
268 HD2 ARG 39 2HD ARG 39 1.287 13.020 -11.765
269 HD3 ARG 39 1HD ARG 39 0.297 12.386 -10.454
270 HE ARG 39 HE ARG 39 -1.493 13.692 -11.992
271 HH11 ARG 39 1HH1 ARG 39 0.890 11.171 -12.718
272 HH12 ARG 39 2HH1 ARG 39 0.032 10.549 -14.041
273 HH21 ARG 39 1HH2 ARG 39 -2.642 12.844 -13.816
274 HH22 ARG 39 2HH2 ARG 39 -1.974 11.548 -14.727
275 H LEU 40 H LEU 40 0.418 14.943 -6.106
276 HA LEU 40 HA LEU 40 -1.806 14.857 -4.395
277 HB2 LEU 40 2HB LEU 40 0.728 16.473 -4.286
278 HB3 LEU 40 1HB LEU 40 -0.486 16.549 -3.026
279 HG LEU 40 HG LEU 40 1.042 14.066 -3.818
280 HD11 LEU 40 1HD1 LEU 40 2.215 14.380 -1.712
281 HD12 LEU 40 2HD1 LEU 40 1.302 15.855 -1.405
282 HD13 LEU 40 3HD1 LEU 40 2.434 15.788 -2.754
283 HD21 LEU 40 3HD2 LEU 40 0.082 13.126 -1.778
284 HD22 LEU 40 1HD2 LEU 40 -1.186 13.581 -2.912
285 HD23 LEU 40 2HD2 LEU 40 -0.841 14.606 -1.520
286 HA PRO 41 HA PRO 41 -3.915 18.672 -5.481
287 HB2 PRO 41 2HB PRO 41 -5.080 18.951 -2.884
288 HB3 PRO 41 1HB PRO 41 -5.801 18.190 -4.304
289 HG2 PRO 41 2HG PRO 41 -5.091 16.852 -1.993
290 HG3 PRO 41 1HG PRO 41 -5.269 16.091 -3.581
291 HD2 PRO 41 2HD PRO 41 -2.795 16.993 -2.175
292 HD3 PRO 41 1HD PRO 41 -3.087 15.521 -3.124
293 H ASP 42 H ASP 42 -1.186 18.908 -4.148
294 HA ASP 42 HA ASP 42 -1.381 21.718 -3.319
295 HB2 ASP 42 2HB ASP 42 -1.144 20.231 -1.261
296 HB3 ASP 42 1HB ASP 42 0.320 19.635 -2.069
297 H THR 43 H THR 43 0.628 22.805 -3.816
298 HA THR 43 HA THR 43 2.339 21.185 -5.507
299 HB THR 43 HB THR 43 0.871 22.676 -6.753
300 HG1 THR 43 1HG THR 43 3.312 23.844 -7.375
301 HG21 THR 43 3HG2 THR 43 0.721 24.595 -5.314
302 HG22 THR 43 1HG2 THR 43 1.409 25.120 -6.850
303 HG23 THR 43 2HG2 THR 43 2.456 24.886 -5.447
304 H GLY 44 H GLY 44 4.527 22.175 -5.764
305 HA2 GLY 44 2HA GLY 44 6.263 23.461 -4.646
306 HA3 GLY 44 1HA GLY 44 5.362 23.244 -3.147
307 H VAL 45 H VAL 45 4.682 20.593 -4.294
308 HA VAL 45 HA VAL 45 6.597 18.975 -2.916
309 HB VAL 45 HB VAL 45 4.255 18.194 -4.695
310 HG11 VAL 45 1HG1 VAL 45 5.667 16.616 -2.576
311 HG12 VAL 45 2HG1 VAL 45 5.772 16.370 -4.320
312 HG13 VAL 45 3HG1 VAL 45 4.246 16.102 -3.486
313 HG21 VAL 45 3HG2 VAL 45 3.502 19.643 -2.898
314 HG22 VAL 45 1HG2 VAL 45 4.307 18.615 -1.712
315 HG23 VAL 45 2HG2 VAL 45 2.946 17.988 -2.644
316 H SER 46 H SER 46 7.955 17.375 -3.948
317 HA SER 46 HA SER 46 9.035 18.214 -6.464
318 HB2 SER 46 2HB SER 46 9.660 15.805 -4.749
319 HB3 SER 46 1HB SER 46 10.663 16.446 -6.053
320 HG SER 46 HG SER 46 9.906 18.233 -4.047
321 H ARG 47 H ARG 47 9.384 16.608 -8.315
322 HA ARG 47 HA ARG 47 6.914 15.570 -9.152
323 HB2 ARG 47 2HB ARG 47 8.075 14.514 -11.084
324 HB3 ARG 47 1HB ARG 47 8.479 16.208 -10.883
325 HG2 ARG 47 2HG ARG 47 10.641 15.672 -10.060
326 HG3 ARG 47 1HG ARG 47 10.226 13.959 -9.922
327 HD2 ARG 47 2HD ARG 47 10.022 13.794 -12.337
328 HD3 ARG 47 1HD ARG 47 10.335 15.520 -12.503
329 HE ARG 47 HE ARG 47 12.554 15.176 -11.995
330 HH11 ARG 47 1HH1 ARG 47 10.840 11.974 -11.956
331 HH12 ARG 47 2HH1 ARG 47 12.299 11.141 -12.068
332 HH21 ARG 47 1HH2 ARG 47 14.470 13.875 -12.150
333 HH22 ARG 47 2HH2 ARG 47 14.342 12.165 -12.128
334 H ARG 48 H ARG 48 9.697 13.950 -7.800
335 HA ARG 48 HA ARG 48 7.817 11.874 -7.090
336 HB2 ARG 48 2HB ARG 48 10.778 11.516 -7.631
337 HB3 ARG 48 1HB ARG 48 9.742 10.286 -6.919
338 HG2 ARG 48 2HG ARG 48 8.322 10.553 -9.037
339 HG3 ARG 48 1HG ARG 48 9.734 11.370 -9.702
340 HD2 ARG 48 2HD ARG 48 9.674 8.600 -8.550
341 HD3 ARG 48 1HD ARG 48 9.678 8.981 -10.273
342 HE ARG 48 HE ARG 48 11.866 9.498 -8.382
343 HH11 ARG 48 1HH1 ARG 48 10.815 9.189 -11.727
344 HH12 ARG 48 2HH1 ARG 48 12.290 8.550 -12.302
345 HH21 ARG 48 1HH2 ARG 48 13.934 8.689 -9.150
346 HH22 ARG 48 2HH2 ARG 48 14.122 8.300 -10.806
347 H HIS 49 H HIS 49 7.311 12.218 -5.215
348 HA HIS 49 HA HIS 49 9.165 13.548 -3.379
349 HB2 HIS 49 2HB HIS 49 7.111 14.772 -3.708
350 HB3 HIS 49 1HB HIS 49 6.138 13.346 -3.408
351 HD2 HIS 49 2HD HIS 49 5.987 12.578 -0.679
352 HE1 HIS 49 1HE HIS 49 7.382 16.287 0.748
353 HE2 HIS 49 2HE HIS 49 6.785 13.899 1.334
354 H LEU 50 H LEU 50 7.105 10.780 -3.885
355 HA LEU 50 HA LEU 50 8.558 9.261 -2.018
356 HB2 LEU 50 2HB LEU 50 7.241 10.513 -0.443
357 HB3 LEU 50 1HB LEU 50 5.780 10.213 -1.343
358 HG LEU 50 HG LEU 50 7.222 7.865 -0.201
359 HD11 LEU 50 1HD1 LEU 50 7.190 9.607 1.578
360 HD12 LEU 50 2HD1 LEU 50 6.123 8.260 1.945
361 HD13 LEU 50 3HD1 LEU 50 5.450 9.778 1.342
362 HD21 LEU 50 3HD2 LEU 50 5.191 7.573 -1.548
363 HD22 LEU 50 1HD2 LEU 50 4.312 8.643 -0.453
364 HD23 LEU 50 2HD2 LEU 50 4.922 7.095 0.132
365 H GLU 51 H GLU 51 8.100 7.126 -2.263
366 HA GLU 51 HA GLU 51 5.907 6.415 -4.027
367 HB2 GLU 51 2HB GLU 51 7.315 4.828 -5.256
368 HB3 GLU 51 1HB GLU 51 7.866 6.477 -5.490
369 HG2 GLU 51 2HG GLU 51 9.656 6.138 -3.924
370 HG3 GLU 51 1HG GLU 51 9.046 4.543 -3.534
371 H ILE 52 H ILE 52 5.046 4.488 -3.579
372 HA ILE 52 HA ILE 52 6.119 3.131 -1.205
373 HB ILE 52 HB ILE 52 3.233 3.330 -2.098
374 HG12 ILE 52 2HG1 ILE 52 4.612 4.451 0.355
375 HG13 ILE 52 1HG1 ILE 52 4.161 5.390 -1.063
376 HG21 ILE 52 1HG2 ILE 52 3.719 1.184 -1.163
377 HG22 ILE 52 2HG2 ILE 52 2.751 2.110 0.003
378 HG23 ILE 52 3HG2 ILE 52 4.495 1.913 0.239
379 HD11 ILE 52 3HD1 ILE 52 1.811 4.925 -0.624
380 HD12 ILE 52 1HD1 ILE 52 2.582 5.701 0.759
381 HD13 ILE 52 2HD1 ILE 52 2.260 3.968 0.788
382 H ARG 53 H ARG 53 6.895 1.198 -1.638
383 HA ARG 53 HA ARG 53 5.988 -0.137 -4.077
384 HB2 ARG 53 2HB ARG 53 8.217 -1.001 -2.193
385 HB3 ARG 53 1HB ARG 53 7.770 -1.817 -3.671
386 HG2 ARG 53 2HG ARG 53 9.651 -0.633 -4.300
387 HG3 ARG 53 1HG ARG 53 8.344 0.438 -4.799
388 HD2 ARG 53 2HD ARG 53 8.614 1.718 -2.729
389 HD3 ARG 53 1HD ARG 53 9.929 0.649 -2.250
390 HE ARG 53 HE ARG 53 9.998 2.401 -4.624
391 HH11 ARG 53 1HH1 ARG 53 11.736 0.740 -2.022
392 HH12 ARG 53 2HH1 ARG 53 13.137 1.689 -2.138
393 HH21 ARG 53 1HH2 ARG 53 11.915 3.695 -4.805
394 HH22 ARG 53 2HH2 ARG 53 13.262 3.411 -3.810
395 H TRP 54 H TRP 54 4.233 -1.214 -3.838
396 HA TRP 54 HA TRP 54 3.812 -2.532 -1.303
397 HB2 TRP 54 2HB TRP 54 2.015 -1.009 -1.684
398 HB3 TRP 54 1HB TRP 54 1.857 -1.503 -3.365
399 HD1 TRP 54 HD TRP 54 -0.258 -2.899 -3.724
400 HE1 TRP 54 1HE TRP 54 -1.650 -4.600 -2.355
401 HE3 TRP 54 3HE TRP 54 2.445 -2.920 0.576
402 HZ2 TRP 54 2HZ TRP 54 -1.601 -5.785 0.180
403 HZ3 TRP 54 3HZ TRP 54 1.741 -4.324 2.412
404 HH2 TRP 54 HH TRP 54 -0.262 -5.752 2.242
405 H ASP 55 H ASP 55 4.094 -4.585 -1.296
406 HA ASP 55 HA ASP 55 3.577 -6.169 -3.713
407 HB2 ASP 55 2HB ASP 55 6.092 -5.836 -2.961
408 HB3 ASP 55 1HB ASP 55 5.659 -6.911 -1.640
409 H GLY 56 H GLY 56 3.516 -8.631 -2.581
410 HA2 GLY 56 2HA GLY 56 1.191 -8.302 -0.868
411 HA3 GLY 56 1HA GLY 56 1.753 -9.826 -1.532
412 H GLN 57 H GLN 57 3.129 -7.367 0.590
413 HA GLN 57 HA GLN 57 3.417 -9.267 2.770
414 HB2 GLN 57 2HB GLN 57 5.495 -9.560 1.510
415 HB3 GLN 57 1HB GLN 57 5.785 -7.832 1.536
416 HG2 GLN 57 2HG GLN 57 5.908 -8.004 4.039
417 HG3 GLN 57 1HG GLN 57 5.866 -9.754 3.844
418 HE21 GLN 57 1HE2 GLN 57 7.948 -8.067 4.928
419 HE22 GLN 57 2HE2 GLN 57 9.361 -8.363 4.018
420 H VAL 58 H VAL 58 5.011 -6.154 2.085
421 HA VAL 58 HA VAL 58 3.258 -4.795 3.969
422 HB VAL 58 HB VAL 58 5.211 -3.617 5.004
423 HG11 VAL 58 1HG1 VAL 58 5.199 -6.597 5.418
424 HG12 VAL 58 2HG1 VAL 58 4.181 -5.413 6.238
425 HG13 VAL 58 3HG1 VAL 58 5.922 -5.418 6.510
426 HG21 VAL 58 3HG2 VAL 58 6.876 -4.000 3.268
427 HG22 VAL 58 1HG2 VAL 58 6.862 -5.730 3.612
428 HG23 VAL 58 2HG2 VAL 58 7.464 -4.596 4.822
429 H ALA 59 H ALA 59 3.438 -2.451 3.734
430 HA ALA 59 HA ALA 59 4.047 -1.795 0.971
431 HB1 ALA 59 1HB ALA 59 1.851 -1.122 1.805
432 HB2 ALA 59 2HB ALA 59 2.824 0.300 1.429
433 HB3 ALA 59 3HB ALA 59 2.608 -0.212 3.105
434 H LEU 60 H LEU 60 6.002 -1.281 0.615
435 HA LEU 60 HA LEU 60 7.666 -0.271 2.728
436 HB2 LEU 60 2HB LEU 60 8.273 -2.050 1.005
437 HB3 LEU 60 1HB LEU 60 8.368 -0.752 -0.156
438 HG LEU 60 HG LEU 60 10.114 -0.911 2.305
439 HD11 LEU 60 1HD1 LEU 60 11.839 -1.720 0.725
440 HD12 LEU 60 2HD1 LEU 60 10.556 -1.843 -0.504
441 HD13 LEU 60 3HD1 LEU 60 10.479 -2.828 0.946
442 HD21 LEU 60 3HD2 LEU 60 11.533 0.669 1.075
443 HD22 LEU 60 1HD2 LEU 60 9.909 1.327 1.308
444 HD23 LEU 60 2HD2 LEU 60 10.371 0.667 -0.258
445 H LEU 61 H LEU 61 7.733 1.736 3.136
446 HA LEU 61 HA LEU 61 6.759 3.774 1.327
447 HB2 LEU 61 2HB LEU 61 5.945 3.494 3.614
448 HB3 LEU 61 1HB LEU 61 7.521 3.716 4.277
449 HG LEU 61 HG LEU 61 6.104 5.639 4.673
450 HD11 LEU 61 1HD1 LEU 61 8.416 6.212 4.362
451 HD12 LEU 61 2HD1 LEU 61 7.368 7.490 3.745
452 HD13 LEU 61 3HD1 LEU 61 8.165 6.386 2.625
453 HD21 LEU 61 3HD2 LEU 61 5.801 5.908 1.703
454 HD22 LEU 61 1HD2 LEU 61 5.082 6.941 2.936
455 HD23 LEU 61 2HD2 LEU 61 4.577 5.257 2.790
456 H ALA 62 H ALA 62 8.254 4.802 0.073
457 HA ALA 62 HA ALA 62 10.921 5.239 1.192
458 HB1 ALA 62 1HB ALA 62 10.216 4.663 -1.684
459 HB2 ALA 62 2HB ALA 62 11.025 3.547 -0.583
460 HB3 ALA 62 3HB ALA 62 11.829 5.037 -1.079
461 H ASP 63 H ASP 63 11.318 7.278 1.424
462 HA ASP 63 HA ASP 63 9.609 9.278 0.145
463 HB2 ASP 63 2HB ASP 63 9.655 9.508 2.504
464 HB3 ASP 63 1HB ASP 63 11.399 9.306 2.562
465 H LEU 64 H LEU 64 10.334 10.667 -1.312
466 HA LEU 64 HA LEU 64 13.233 10.778 -1.903
467 HB2 LEU 64 2HB LEU 64 10.892 11.146 -3.789
468 HB3 LEU 64 1HB LEU 64 12.550 11.449 -4.207
469 HG LEU 64 HG LEU 64 11.812 9.528 -5.239
470 HD11 LEU 64 1HD1 LEU 64 13.384 7.793 -4.403
471 HD12 LEU 64 2HD1 LEU 64 13.599 8.744 -2.933
472 HD13 LEU 64 3HD1 LEU 64 14.104 9.400 -4.491
473 HD21 LEU 64 3HD2 LEU 64 9.942 8.845 -3.963
474 HD22 LEU 64 1HD2 LEU 64 10.959 8.436 -2.570
475 HD23 LEU 64 2HD2 LEU 64 11.073 7.499 -4.062
476 H ASN 65 H ASN 65 13.080 12.590 -0.197
477 HA ASN 65 HA ASN 65 13.087 15.084 -1.506
478 HB2 ASN 65 2HB ASN 65 10.563 14.628 -1.269
479 HB3 ASN 65 1HB ASN 65 10.790 14.771 0.460
480 HD21 ASN 65 1HD2 ASN 65 9.193 16.312 -1.358
481 HD22 ASN 65 2HD2 ASN 65 9.702 17.958 -1.248
482 H SER 66 H SER 66 14.174 16.511 -0.251
483 HA SER 66 HA SER 66 14.925 15.509 2.389
484 HB2 SER 66 2HB SER 66 16.409 17.379 0.546
485 HB3 SER 66 1HB SER 66 17.012 16.761 2.090
486 HG SER 66 HG SER 66 17.348 15.676 -0.216
487 H THR 67 H THR 67 14.263 18.493 0.593
488 HA THR 67 HA THR 67 14.179 20.307 2.707
489 HB THR 67 HB THR 67 12.798 20.199 0.045
490 HG1 THR 67 1HG THR 67 15.290 20.706 0.681
491 HG21 THR 67 3HG2 THR 67 12.883 22.560 1.952
492 HG22 THR 67 1HG2 THR 67 11.451 21.679 1.405
493 HG23 THR 67 2HG2 THR 67 12.370 22.644 0.259
494 H ASN 68 H ASN 68 11.609 18.382 1.242
495 HA ASN 68 HA ASN 68 9.754 19.296 3.337
496 HB2 ASN 68 2HB ASN 68 9.454 20.350 1.096
497 HB3 ASN 68 1HB ASN 68 9.225 18.758 0.410
498 HD21 ASN 68 1HD2 ASN 68 7.350 19.661 -0.372
499 HD22 ASN 68 2HD2 ASN 68 5.891 19.757 0.554
500 H GLY 69 H GLY 69 11.512 17.021 3.223
501 HA2 GLY 69 2HA GLY 69 10.556 14.581 2.383
502 HA3 GLY 69 1HA GLY 69 11.588 14.838 3.774
503 H THR 70 H THR 70 9.451 12.975 3.163
504 HA THR 70 HA THR 70 7.146 13.568 4.697
505 HB THR 70 HB THR 70 8.195 10.970 3.606
506 HG1 THR 70 1HG THR 70 8.062 12.155 1.916
507 HG21 THR 70 3HG2 THR 70 5.396 11.880 4.283
508 HG22 THR 70 1HG2 THR 70 6.342 10.695 5.179
509 HG23 THR 70 2HG2 THR 70 5.818 10.341 3.531
510 H THR 71 H THR 71 6.592 12.831 6.710
511 HA THR 71 HA THR 71 8.673 11.513 8.293
512 HB THR 71 HB THR 71 7.291 12.393 10.235
513 HG1 THR 71 1HG THR 71 6.367 14.518 8.814
514 HG21 THR 71 3HG2 THR 71 9.411 13.312 9.652
515 HG22 THR 71 1HG2 THR 71 8.310 14.606 10.118
516 HG23 THR 71 2HG2 THR 71 8.677 14.334 8.400
517 H VAL 72 H VAL 72 8.101 9.801 9.611
518 HA VAL 72 HA VAL 72 5.427 8.707 9.169
519 HB VAL 72 HB VAL 72 6.357 6.444 9.583
520 HG11 VAL 72 1HG1 VAL 72 7.655 6.204 7.510
521 HG12 VAL 72 2HG1 VAL 72 7.802 7.962 7.425
522 HG13 VAL 72 3HG1 VAL 72 6.220 7.203 7.291
523 HG21 VAL 72 3HG2 VAL 72 8.238 7.054 11.022
524 HG22 VAL 72 1HG2 VAL 72 9.030 7.847 9.664
525 HG23 VAL 72 2HG2 VAL 72 8.800 6.096 9.650
526 H ASN 73 H ASN 73 4.210 8.814 10.846
527 HA ASN 73 HA ASN 73 3.450 9.156 12.898
528 HB2 ASN 73 2HB ASN 73 5.834 7.409 13.581
529 HB3 ASN 73 1HB ASN 73 4.667 7.917 14.801
530 HD21 ASN 73 1HD2 ASN 73 5.291 5.214 13.681
531 HD22 ASN 73 2HD2 ASN 73 3.798 4.611 13.080
532 H ASN 74 H ASN 74 5.139 11.040 11.687
533 HA ASN 74 HA ASN 74 5.740 13.132 11.999
534 HB2 ASN 74 2HB ASN 74 4.169 13.171 13.972
535 HB3 ASN 74 1HB ASN 74 5.518 12.748 15.011
536 HD21 ASN 74 1HD2 ASN 74 5.298 14.636 16.221
537 HD22 ASN 74 2HD2 ASN 74 5.719 16.190 15.614
538 H ALA 75 H ALA 75 7.527 10.618 12.377
539 HA ALA 75 HA ALA 75 9.925 12.062 13.249
540 HB1 ALA 75 1HB ALA 75 9.448 9.089 12.968
541 HB2 ALA 75 2HB ALA 75 9.508 9.992 14.483
542 HB3 ALA 75 3HB ALA 75 10.956 9.838 13.490
543 HA PRO 76 HA PRO 76 10.913 12.157 8.881
544 HB2 PRO 76 2HB PRO 76 13.443 13.130 9.104
545 HB3 PRO 76 1HB PRO 76 12.007 14.143 9.293
546 HG2 PRO 76 2HG PRO 76 13.772 12.946 11.384
547 HG3 PRO 76 1HG PRO 76 13.012 14.544 11.335
548 HD2 PRO 76 2HD PRO 76 12.042 12.463 12.806
549 HD3 PRO 76 1HD PRO 76 11.023 13.760 12.156
550 H VAL 77 H VAL 77 11.466 10.525 7.656
551 HA VAL 77 HA VAL 77 13.854 8.961 8.208
552 HB VAL 77 HB VAL 77 12.675 6.834 7.730
553 HG11 VAL 77 1HG1 VAL 77 13.013 7.383 10.054
554 HG12 VAL 77 2HG1 VAL 77 11.477 6.538 9.845
555 HG13 VAL 77 3HG1 VAL 77 11.498 8.282 10.085
556 HG21 VAL 77 3HG2 VAL 77 10.170 8.499 7.836
557 HG22 VAL 77 1HG2 VAL 77 10.213 6.736 7.772
558 HG23 VAL 77 2HG2 VAL 77 10.833 7.685 6.420
559 H GLN 78 H GLN 78 13.911 7.313 6.212
560 HA GLN 78 HA GLN 78 12.993 8.767 3.858
561 HB2 GLN 78 2HB GLN 78 15.025 8.065 2.640
562 HB3 GLN 78 1HB GLN 78 15.356 9.131 3.993
563 HG2 GLN 78 2HG GLN 78 16.073 7.224 5.327
564 HG3 GLN 78 1HG GLN 78 15.732 6.149 3.967
565 HE21 GLN 78 1HE2 GLN 78 18.246 6.679 5.360
566 HE22 GLN 78 2HE2 GLN 78 19.334 7.208 4.139
567 H GLU 79 H GLU 79 13.445 5.695 5.432
568 HA GLU 79 HA GLU 79 11.613 4.569 3.508
569 HB2 GLU 79 2HB GLU 79 12.921 2.442 3.431
570 HB3 GLU 79 1HB GLU 79 13.736 3.793 2.657
571 HG2 GLU 79 2HG GLU 79 15.154 4.060 4.630
572 HG3 GLU 79 1HG GLU 79 14.328 2.709 5.402
573 H TRP 80 H TRP 80 10.135 3.287 4.413
574 HA TRP 80 HA TRP 80 10.448 2.358 7.153
575 HB2 TRP 80 2HB TRP 80 9.663 4.641 7.420
576 HB3 TRP 80 1HB TRP 80 8.322 4.390 6.325
577 HD1 TRP 80 HD TRP 80 6.160 3.244 7.345
578 HE1 TRP 80 1HE TRP 80 5.383 2.810 9.755
579 HE3 TRP 80 3HE TRP 80 10.613 3.969 9.727
580 HZ2 TRP 80 2HZ TRP 80 6.527 2.815 12.341
581 HZ3 TRP 80 3HZ TRP 80 10.681 3.749 12.175
582 HH2 TRP 80 HH TRP 80 8.669 3.190 13.445
583 H GLN 81 H GLN 81 8.892 0.768 7.655
584 HA GLN 81 HA GLN 81 7.541 -0.325 5.296
585 HB2 GLN 81 2HB GLN 81 8.035 -1.650 7.979
586 HB3 GLN 81 1HB GLN 81 7.345 -2.422 6.566
587 HG2 GLN 81 2HG GLN 81 9.566 -3.205 6.718
588 HG3 GLN 81 1HG GLN 81 9.568 -2.009 5.428
589 HE21 GLN 81 1HE2 GLN 81 11.737 -1.702 5.653
590 HE22 GLN 81 2HE2 GLN 81 12.463 -0.838 6.948
591 H LEU 82 H LEU 82 5.560 0.501 5.189
592 HA LEU 82 HA LEU 82 4.192 1.721 7.297
593 HB2 LEU 82 2HB LEU 82 2.968 0.445 4.875
594 HB3 LEU 82 1HB LEU 82 2.226 1.617 5.939
595 HG LEU 82 HG LEU 82 4.581 2.145 4.146
596 HD11 LEU 82 1HD1 LEU 82 3.025 3.587 2.916
597 HD12 LEU 82 2HD1 LEU 82 1.704 3.029 3.943
598 HD13 LEU 82 3HD1 LEU 82 2.527 1.899 2.876
599 HD21 LEU 82 3HD2 LEU 82 4.692 3.464 6.155
600 HD22 LEU 82 1HD2 LEU 82 3.013 3.955 5.954
601 HD23 LEU 82 2HD2 LEU 82 4.225 4.480 4.792
602 H ALA 83 H ALA 83 2.858 1.065 8.814
603 HA ALA 83 HA ALA 83 1.786 -1.643 8.673
604 HB1 ALA 83 1HB ALA 83 2.728 -0.167 11.139
605 HB2 ALA 83 2HB ALA 83 3.531 -1.555 10.402
606 HB3 ALA 83 3HB ALA 83 1.935 -1.741 11.128
607 H ASP 84 H ASP 84 -0.207 -1.781 9.965
608 HA ASP 84 HA ASP 84 -2.036 0.232 9.201
609 HB2 ASP 84 2HB ASP 84 -2.723 -2.087 9.482
610 HB3 ASP 84 1HB ASP 84 -2.319 -2.019 11.193
611 H GLY 85 H GLY 85 -2.248 2.154 10.087
612 HA2 GLY 85 2HA GLY 85 -3.049 3.368 12.010
613 HA3 GLY 85 1HA GLY 85 -2.031 2.349 13.010
614 H ASP 86 H ASP 86 -0.191 3.086 10.361
615 HA ASP 86 HA ASP 86 1.287 5.011 11.926
616 HB2 ASP 86 2HB ASP 86 1.894 3.758 9.239
617 HB3 ASP 86 1HB ASP 86 2.883 5.035 9.924
618 H VAL 87 H VAL 87 1.672 7.097 11.513
619 HA VAL 87 HA VAL 87 -0.152 8.397 9.596
620 HB VAL 87 HB VAL 87 1.396 9.700 11.872
621 HG11 VAL 87 1HG1 VAL 87 -0.847 10.763 10.160
622 HG12 VAL 87 2HG1 VAL 87 0.850 11.235 10.072
623 HG13 VAL 87 3HG1 VAL 87 -0.092 11.606 11.515
624 HG21 VAL 87 3HG2 VAL 87 -1.520 8.895 11.788
625 HG22 VAL 87 1HG2 VAL 87 -0.740 9.804 13.080
626 HG23 VAL 87 2HG2 VAL 87 -0.270 8.134 12.768
627 H ILE 88 H ILE 88 0.752 8.916 7.757
628 HA ILE 88 HA ILE 88 3.638 9.409 7.718
629 HB ILE 88 HB ILE 88 1.761 8.244 5.648
630 HG12 ILE 88 2HG1 ILE 88 3.549 6.530 5.424
631 HG13 ILE 88 1HG1 ILE 88 4.449 7.365 6.677
632 HG21 ILE 88 1HG2 ILE 88 3.486 8.362 3.931
633 HG22 ILE 88 2HG2 ILE 88 4.489 9.324 5.017
634 HG23 ILE 88 3HG2 ILE 88 2.952 9.965 4.440
635 HD11 ILE 88 3HD1 ILE 88 3.345 5.409 7.552
636 HD12 ILE 88 1HD1 ILE 88 1.783 6.018 7.000
637 HD13 ILE 88 2HD1 ILE 88 2.666 6.873 8.262
638 H ARG 89 H ARG 89 4.115 11.538 7.559
639 HA ARG 89 HA ARG 89 2.080 13.139 6.241
640 HB2 ARG 89 2HB ARG 89 2.322 13.812 8.569
641 HB3 ARG 89 1HB ARG 89 4.033 14.135 8.308
642 HG2 ARG 89 2HG ARG 89 3.557 15.923 6.805
643 HG3 ARG 89 1HG ARG 89 1.841 15.526 6.785
644 HD2 ARG 89 2HD ARG 89 1.673 16.124 9.140
645 HD3 ARG 89 1HD ARG 89 3.401 16.470 9.170
646 HE ARG 89 HE ARG 89 2.781 18.153 7.341
647 HH11 ARG 89 1HH1 ARG 89 0.570 17.360 10.029
648 HH12 ARG 89 2HH1 ARG 89 -0.002 18.949 10.155
649 HH21 ARG 89 1HH2 ARG 89 1.894 20.297 7.517
650 HH22 ARG 89 2HH2 ARG 89 0.744 20.659 8.713
651 H LEU 90 H LEU 90 2.425 13.602 4.407
652 HA LEU 90 HA LEU 90 5.091 14.313 3.506
653 HB2 LEU 90 2HB LEU 90 4.472 13.606 1.247
654 HB3 LEU 90 1HB LEU 90 4.339 12.271 2.355
655 HG LEU 90 HG LEU 90 1.931 13.829 1.371
656 HD11 LEU 90 1HD1 LEU 90 3.186 12.877 -0.509
657 HD12 LEU 90 2HD1 LEU 90 1.651 12.040 -0.262
658 HD13 LEU 90 3HD1 LEU 90 3.159 11.300 0.278
659 HD21 LEU 90 3HD2 LEU 90 1.523 12.448 3.377
660 HD22 LEU 90 1HD2 LEU 90 2.236 11.056 2.554
661 HD23 LEU 90 2HD2 LEU 90 0.737 11.763 1.963
662 H GLY 91 H GLY 91 4.936 15.897 1.651
663 HA2 GLY 91 2HA GLY 91 4.388 18.370 2.300
664 HA3 GLY 91 1HA GLY 91 4.048 17.837 0.674
665 H HIS 92 H HIS 92 2.781 18.889 3.677
666 HA HIS 92 HA HIS 92 0.927 19.975 4.260
667 HB2 HIS 92 2HB HIS 92 0.725 20.953 2.032
668 HB3 HIS 92 1HB HIS 92 -0.030 19.494 1.420
669 HD1 HIS 92 1HD HIS 92 -0.823 22.747 3.018
670 HD2 HIS 92 2HD HIS 92 -2.746 19.128 2.326
671 HE1 HIS 92 1HE HIS 92 -3.265 23.177 3.374
672 H SER 93 H SER 93 0.684 16.758 3.050
673 HA SER 93 HA SER 93 -1.883 16.491 4.455
674 HB2 SER 93 2HB SER 93 -0.893 14.863 2.144
675 HB3 SER 93 1HB SER 93 -2.480 14.754 2.904
676 HG SER 93 HG SER 93 -1.919 17.268 2.311
677 H GLU 94 H GLU 94 -1.742 15.415 6.264
678 HA GLU 94 HA GLU 94 0.189 13.278 6.463
679 HB2 GLU 94 2HB GLU 94 -0.602 13.174 8.900
680 HB3 GLU 94 1HB GLU 94 0.342 14.569 8.418
681 HG2 GLU 94 2HG GLU 94 -1.669 15.904 8.273
682 HG3 GLU 94 1HG GLU 94 -2.645 14.496 8.701
683 H ILE 95 H ILE 95 -0.306 11.381 6.017
684 HA ILE 95 HA ILE 95 -3.113 10.759 5.552
685 HB ILE 95 HB ILE 95 -1.418 10.765 3.649
686 HG12 ILE 95 2HG1 ILE 95 -2.129 8.564 2.717
687 HG13 ILE 95 1HG1 ILE 95 -2.970 8.274 4.242
688 HG21 ILE 95 1HG2 ILE 95 -0.391 8.280 4.978
689 HG22 ILE 95 2HG2 ILE 95 0.487 9.792 4.736
690 HG23 ILE 95 3HG2 ILE 95 0.014 8.813 3.345
691 HD11 ILE 95 3HD1 ILE 95 -4.490 9.152 2.569
692 HD12 ILE 95 1HD1 ILE 95 -3.442 10.550 2.344
693 HD13 ILE 95 2HD1 ILE 95 -4.272 10.304 3.881
694 H ILE 96 H ILE 96 -4.004 8.930 6.503
695 HA ILE 96 HA ILE 96 -2.319 7.596 8.475
696 HB ILE 96 HB ILE 96 -5.346 7.606 8.188
697 HG12 ILE 96 2HG1 ILE 96 -3.602 9.016 10.228
698 HG13 ILE 96 1HG1 ILE 96 -4.416 9.801 8.879
699 HG21 ILE 96 1HG2 ILE 96 -5.354 6.550 10.413
700 HG22 ILE 96 2HG2 ILE 96 -3.590 6.473 10.368
701 HG23 ILE 96 3HG2 ILE 96 -4.542 5.547 9.209
702 HD11 ILE 96 3HD1 ILE 96 -6.578 9.192 9.831
703 HD12 ILE 96 1HD1 ILE 96 -5.618 10.128 10.978
704 HD13 ILE 96 2HD1 ILE 96 -5.767 8.379 11.167
705 H VAL 97 H VAL 97 -1.600 5.655 7.966
706 HA VAL 97 HA VAL 97 -2.648 4.314 5.629
707 HB VAL 97 HB VAL 97 -0.286 3.700 7.426
708 HG11 VAL 97 1HG1 VAL 97 -1.214 1.626 6.526
709 HG12 VAL 97 2HG1 VAL 97 0.322 2.006 5.739
710 HG13 VAL 97 3HG1 VAL 97 -1.203 2.314 4.903
711 HG21 VAL 97 3HG2 VAL 97 -0.447 4.612 4.578
712 HG22 VAL 97 1HG2 VAL 97 1.026 4.345 5.509
713 HG23 VAL 97 2HG2 VAL 97 -0.080 5.662 5.954
714 H ARG 98 H ARG 98 -4.266 2.909 5.806
715 HA ARG 98 HA ARG 98 -4.375 1.327 8.245
716 HB2 ARG 98 2HB ARG 98 -6.659 2.239 6.501
717 HB3 ARG 98 1HB ARG 98 -6.791 1.105 7.831
718 HG2 ARG 98 2HG ARG 98 -6.037 3.997 7.976
719 HG3 ARG 98 1HG ARG 98 -7.562 3.291 8.529
720 HD2 ARG 98 2HD ARG 98 -4.792 2.980 9.695
721 HD3 ARG 98 1HD ARG 98 -6.204 3.689 10.461
722 HE ARG 98 HE ARG 98 -5.631 0.845 10.070
723 HH11 ARG 98 1HH1 ARG 98 -7.904 3.240 11.337
724 HH12 ARG 98 2HH1 ARG 98 -8.595 2.162 12.452
725 HH21 ARG 98 1HH2 ARG 98 -6.507 -0.556 11.585
726 HH22 ARG 98 2HH2 ARG 98 -7.815 -0.083 12.584
727 H MET 99 H MET 99 -4.944 -0.743 7.997
728 HA MET 99 HA MET 99 -4.741 -1.775 5.262
729 HB2 MET 99 2HB MET 99 -3.719 -3.032 7.812
730 HB3 MET 99 1HB MET 99 -3.831 -3.887 6.280
731 HG2 MET 99 2HG MET 99 -2.296 -2.268 5.271
732 HG3 MET 99 1HG MET 99 -2.168 -1.439 6.820
733 HE1 MET 99 3HE MET 99 0.474 -1.642 6.622
734 HE2 MET 99 1HE MET 99 0.323 -2.522 5.104
735 HE3 MET 99 2HE MET 99 1.324 -3.172 6.404
736 H HIS 100 H HIS 100 -6.429 -2.686 4.607
737 HA HIS 100 HA HIS 100 -8.562 -3.361 6.477
738 HB2 HIS 100 2HB HIS 100 -8.622 -2.803 3.492
739 HB3 HIS 100 1HB HIS 100 -10.024 -3.151 4.491
740 HD1 HIS 100 1HD HIS 100 -11.266 -1.090 5.144
741 HD2 HIS 100 2HD HIS 100 -7.247 -0.317 4.492
742 HE1 HIS 100 1HE HIS 100 -10.978 1.410 5.396
Start of MODEL 14
1 H1 GLY 1 1HT GLY 1 -10.101 -17.629 -12.510
2 H2 GLY 1 2HT GLY 1 -8.805 -17.156 -11.514
3 H3 GLY 1 3HT GLY 1 -9.594 -16.003 -12.431
4 HA2 GLY 1 1HA GLY 1 -11.618 -16.379 -11.138
5 HA3 GLY 1 2HA GLY 1 -10.713 -17.534 -10.164
6 H HIS 2 H HIS 2 -10.662 -16.417 -8.224
7 HA HIS 2 HA HIS 2 -9.165 -13.922 -8.308
8 HB2 HIS 2 2HB HIS 2 -10.647 -12.816 -6.740
9 HB3 HIS 2 1HB HIS 2 -11.588 -13.342 -8.121
10 HD1 HIS 2 1HD HIS 2 -12.027 -12.987 -4.710
11 HD2 HIS 2 2HD HIS 2 -12.694 -16.173 -7.282
12 HE1 HIS 2 1HE HIS 2 -13.729 -14.470 -3.572
13 H GLY 3 H GLY 3 -8.438 -13.320 -6.044
14 HA2 GLY 3 2HA GLY 3 -7.773 -15.786 -4.600
15 HA3 GLY 3 1HA GLY 3 -6.656 -14.438 -4.795
16 H SER 4 H SER 4 -7.333 -15.441 -2.305
17 HA SER 4 HA SER 4 -9.345 -13.811 -1.116
18 HB2 SER 4 2HB SER 4 -7.068 -15.312 0.123
19 HB3 SER 4 1HB SER 4 -8.524 -14.743 0.946
20 HG SER 4 HG SER 4 -9.677 -16.070 -0.654
21 H ALA 5 H ALA 5 -8.953 -11.688 -1.230
22 HA ALA 5 HA ALA 5 -6.364 -10.802 -0.261
23 HB1 ALA 5 1HB ALA 5 -7.874 -9.568 -2.550
24 HB2 ALA 5 2HB ALA 5 -6.464 -10.618 -2.679
25 HB3 ALA 5 3HB ALA 5 -6.310 -9.030 -1.908
26 H GLY 6 H GLY 6 -7.432 -10.710 1.693
27 HA2 GLY 6 2HA GLY 6 -9.442 -8.654 2.071
28 HA3 GLY 6 1HA GLY 6 -8.744 -9.685 3.326
29 H THR 7 H THR 7 -6.060 -9.213 2.416
30 HA THR 7 HA THR 7 -5.340 -7.017 3.996
31 HB THR 7 HB THR 7 -3.704 -8.340 1.821
32 HG1 THR 7 1HG THR 7 -3.890 -9.139 4.544
33 HG21 THR 7 3HG2 THR 7 -2.718 -6.324 2.860
34 HG22 THR 7 1HG2 THR 7 -1.810 -7.774 3.286
35 HG23 THR 7 2HG2 THR 7 -2.918 -7.053 4.451
36 H SER 8 H SER 8 -5.691 -4.964 3.408
37 HA SER 8 HA SER 8 -4.869 -4.127 0.748
38 HB2 SER 8 2HB SER 8 -7.555 -3.388 1.949
39 HB3 SER 8 1HB SER 8 -6.891 -2.755 0.442
40 HG SER 8 HG SER 8 -6.752 -5.390 0.382
41 H VAL 9 H VAL 9 -3.720 -2.299 0.830
42 HA VAL 9 HA VAL 9 -3.645 -0.909 3.390
43 HB VAL 9 HB VAL 9 -1.735 -0.689 1.044
44 HG11 VAL 9 1HG1 VAL 9 -0.254 0.438 2.651
45 HG12 VAL 9 2HG1 VAL 9 -1.507 0.299 3.883
46 HG13 VAL 9 3HG1 VAL 9 -1.782 1.303 2.456
47 HG21 VAL 9 3HG2 VAL 9 -1.426 -2.229 3.618
48 HG22 VAL 9 1HG2 VAL 9 -0.168 -2.004 2.403
49 HG23 VAL 9 2HG2 VAL 9 -1.625 -2.915 2.008
50 H THR 10 H THR 10 -4.860 0.776 3.491
51 HA THR 10 HA THR 10 -5.486 2.221 1.038
52 HB THR 10 HB THR 10 -7.211 1.836 3.497
53 HG1 THR 10 1HG THR 10 -8.007 0.156 2.525
54 HG21 THR 10 3HG2 THR 10 -7.625 3.949 2.300
55 HG22 THR 10 1HG2 THR 10 -8.979 2.832 2.125
56 HG23 THR 10 2HG2 THR 10 -7.836 3.047 0.799
57 H LEU 11 H LEU 11 -4.940 4.270 1.047
58 HA LEU 11 HA LEU 11 -3.852 5.511 3.427
59 HB2 LEU 11 2HB LEU 11 -4.200 6.580 0.630
60 HB3 LEU 11 1HB LEU 11 -3.259 7.317 1.907
61 HG LEU 11 HG LEU 11 -2.730 4.694 0.637
62 HD11 LEU 11 1HD1 LEU 11 -1.305 7.362 0.339
63 HD12 LEU 11 2HD1 LEU 11 -2.280 6.573 -0.894
64 HD13 LEU 11 3HD1 LEU 11 -0.753 5.853 -0.384
65 HD21 LEU 11 3HD2 LEU 11 -1.920 4.693 2.907
66 HD22 LEU 11 1HD2 LEU 11 -1.104 6.238 2.659
67 HD23 LEU 11 2HD2 LEU 11 -0.541 4.798 1.814
68 H GLN 12 H GLN 12 -5.002 6.733 4.643
69 HA GLN 12 HA GLN 12 -7.693 7.568 3.730
70 HB2 GLN 12 2HB GLN 12 -7.211 5.861 5.702
71 HB3 GLN 12 1HB GLN 12 -6.926 7.315 6.615
72 HG2 GLN 12 2HG GLN 12 -9.519 6.609 5.234
73 HG3 GLN 12 1HG GLN 12 -9.190 6.469 6.952
74 HE21 GLN 12 1HE2 GLN 12 -9.938 8.600 4.343
75 HE22 GLN 12 2HE2 GLN 12 -10.191 10.000 5.315
76 H LEU 13 H LEU 13 -7.863 9.756 3.465
77 HA LEU 13 HA LEU 13 -6.463 11.572 5.307
78 HB2 LEU 13 2HB LEU 13 -5.967 13.106 3.530
79 HB3 LEU 13 1HB LEU 13 -5.400 11.543 2.994
80 HG LEU 13 HG LEU 13 -7.917 11.626 1.958
81 HD11 LEU 13 1HD1 LEU 13 -8.196 13.788 0.851
82 HD12 LEU 13 2HD1 LEU 13 -6.842 14.424 1.783
83 HD13 LEU 13 3HD1 LEU 13 -8.308 13.899 2.607
84 HD21 LEU 13 3HD2 LEU 13 -5.351 12.552 0.657
85 HD22 LEU 13 1HD2 LEU 13 -6.808 12.057 -0.206
86 HD23 LEU 13 2HD2 LEU 13 -5.923 10.886 0.772
87 H ASP 14 H ASP 14 -7.758 13.470 5.805
88 HA ASP 14 HA ASP 14 -10.525 12.883 5.208
89 HB2 ASP 14 2HB ASP 14 -10.137 13.084 7.602
90 HB3 ASP 14 1HB ASP 14 -9.510 14.721 7.372
91 H ASP 15 H ASP 15 -11.497 13.848 3.861
92 HA ASP 15 HA ASP 15 -10.463 16.333 2.774
93 HB2 ASP 15 2HB ASP 15 -10.632 14.566 1.207
94 HB3 ASP 15 1HB ASP 15 -12.284 14.189 1.673
95 H GLY 16 H GLY 16 -12.693 15.251 4.930
96 HA2 GLY 16 2HA GLY 16 -14.330 16.725 5.898
97 HA3 GLY 16 1HA GLY 16 -14.741 17.255 4.258
98 H SER 17 H SER 17 -13.993 14.036 5.232
99 HA SER 17 HA SER 17 -16.336 12.762 5.611
100 HB2 SER 17 2HB SER 17 -17.088 13.606 3.346
101 HB3 SER 17 1HB SER 17 -15.687 12.814 2.626
102 HG SER 17 HG SER 17 -16.847 11.090 2.534
103 H GLY 18 H GLY 18 -13.657 12.565 3.309
104 HA2 GLY 18 2HA GLY 18 -11.622 11.480 4.329
105 HA3 GLY 18 1HA GLY 18 -12.731 10.198 4.787
106 H ARG 19 H ARG 19 -10.731 11.493 2.351
107 HA ARG 19 HA ARG 19 -11.803 9.704 0.319
108 HB2 ARG 19 2HB ARG 19 -9.299 11.403 0.163
109 HB3 ARG 19 1HB ARG 19 -10.034 10.478 -1.137
110 HG2 ARG 19 2HG ARG 19 -12.043 11.976 -0.903
111 HG3 ARG 19 1HG ARG 19 -11.094 12.957 0.205
112 HD2 ARG 19 2HD ARG 19 -10.700 12.497 -2.741
113 HD3 ARG 19 1HD ARG 19 -10.900 14.022 -1.892
114 HE ARG 19 HE ARG 19 -8.491 12.353 -1.930
115 HH11 ARG 19 1HH1 ARG 19 -9.901 15.590 -1.133
116 HH12 ARG 19 2HH1 ARG 19 -8.400 16.346 -1.308
117 HH21 ARG 19 1HH2 ARG 19 -6.474 13.539 -2.109
118 HH22 ARG 19 2HH2 ARG 19 -6.450 15.212 -1.839
119 H THR 20 H THR 20 -10.346 8.177 -0.680
120 HA THR 20 HA THR 20 -8.293 7.179 1.115
121 HB THR 20 HB THR 20 -9.210 4.884 0.805
122 HG1 THR 20 1HG THR 20 -11.022 6.313 -0.682
123 HG21 THR 20 3HG2 THR 20 -11.033 5.114 2.488
124 HG22 THR 20 1HG2 THR 20 -11.006 6.857 2.203
125 HG23 THR 20 2HG2 THR 20 -9.597 6.062 2.906
126 H TYR 21 H TYR 21 -6.598 6.318 0.019
127 HA TYR 21 HA TYR 21 -6.971 5.813 -2.852
128 HB2 TYR 21 2HB TYR 21 -5.478 7.781 -2.341
129 HB3 TYR 21 1HB TYR 21 -4.410 6.684 -1.483
130 HD1 TYR 21 1HD TYR 21 -5.868 7.385 -4.806
131 HD2 TYR 21 2HD TYR 21 -2.721 5.493 -2.682
132 HE1 TYR 21 1HE TYR 21 -4.692 7.009 -6.926
133 HE2 TYR 21 2HE TYR 21 -1.521 5.099 -4.803
134 HH TYR 21 HH TYR 21 -2.427 6.649 -7.708
135 H GLN 22 H GLN 22 -6.805 3.759 -3.276
136 HA GLN 22 HA GLN 22 -5.667 2.013 -1.233
137 HB2 GLN 22 2HB GLN 22 -7.929 1.521 -2.149
138 HB3 GLN 22 1HB GLN 22 -7.212 1.306 -3.736
139 HG2 GLN 22 2HG GLN 22 -5.877 -0.577 -2.844
140 HG3 GLN 22 1HG GLN 22 -6.686 -0.375 -1.290
141 HE21 GLN 22 1HE2 GLN 22 -7.620 -2.407 -1.348
142 HE22 GLN 22 2HE2 GLN 22 -8.910 -2.784 -2.431
143 H LEU 23 H LEU 23 -3.804 0.989 -1.531
144 HA LEU 23 HA LEU 23 -2.207 1.741 -3.788
145 HB2 LEU 23 2HB LEU 23 -1.644 -0.192 -1.554
146 HB3 LEU 23 1HB LEU 23 -0.472 0.376 -2.721
147 HG LEU 23 HG LEU 23 -1.866 2.072 -0.653
148 HD11 LEU 23 1HD1 LEU 23 -0.236 0.559 0.299
149 HD12 LEU 23 2HD1 LEU 23 0.356 2.219 0.348
150 HD13 LEU 23 3HD1 LEU 23 0.962 1.094 -0.875
151 HD21 LEU 23 3HD2 LEU 23 -1.393 3.372 -2.660
152 HD22 LEU 23 1HD2 LEU 23 0.270 2.780 -2.671
153 HD23 LEU 23 2HD2 LEU 23 -0.288 3.823 -1.364
154 H ARG 24 H ARG 24 -2.165 0.724 -5.630
155 HA ARG 24 HA ARG 24 -3.300 -1.925 -5.882
156 HB2 ARG 24 2HB ARG 24 -2.989 -1.600 -8.287
157 HB3 ARG 24 1HB ARG 24 -3.790 -0.200 -7.585
158 HG2 ARG 24 2HG ARG 24 -1.597 0.942 -7.520
159 HG3 ARG 24 1HG ARG 24 -0.906 -0.441 -8.363
160 HD2 ARG 24 2HD ARG 24 -1.431 1.341 -9.914
161 HD3 ARG 24 1HD ARG 24 -2.441 -0.067 -10.222
162 HE ARG 24 HE ARG 24 -4.269 1.119 -9.703
163 HH11 ARG 24 1HH1 ARG 24 -1.509 2.931 -8.366
164 HH12 ARG 24 2HH1 ARG 24 -2.408 4.330 -8.031
165 HH21 ARG 24 1HH2 ARG 24 -5.474 3.052 -9.270
166 HH22 ARG 24 2HH2 ARG 24 -4.718 4.430 -8.629
167 H GLU 25 H GLU 25 -1.945 -3.498 -7.283
168 HA GLU 25 HA GLU 25 0.388 -4.067 -5.752
169 HB2 GLU 25 2HB GLU 25 -0.450 -5.318 -8.368
170 HB3 GLU 25 1HB GLU 25 0.611 -6.023 -7.163
171 HG2 GLU 25 2HG GLU 25 -2.367 -5.572 -6.938
172 HG3 GLU 25 1HG GLU 25 -1.532 -7.110 -7.077
173 H GLY 26 H GLY 26 2.397 -3.339 -6.071
174 HA2 GLY 26 2HA GLY 26 4.192 -3.032 -7.745
175 HA3 GLY 26 1HA GLY 26 3.011 -2.117 -8.679
176 H SER 27 H SER 27 4.680 -0.353 -8.480
177 HA SER 27 HA SER 27 4.583 0.775 -5.823
178 HB2 SER 27 2HB SER 27 6.448 2.216 -6.565
179 HB3 SER 27 1HB SER 27 6.816 0.497 -6.593
180 HG SER 27 HG SER 27 7.299 0.724 -8.601
181 H ASN 28 H ASN 28 3.953 2.770 -5.392
182 HA ASN 28 HA ASN 28 2.320 4.116 -7.427
183 HB2 ASN 28 2HB ASN 28 1.711 3.734 -4.464
184 HB3 ASN 28 1HB ASN 28 0.734 4.670 -5.587
185 HD21 ASN 28 1HD2 ASN 28 1.701 1.457 -4.617
186 HD22 ASN 28 2HD2 ASN 28 0.490 0.585 -5.459
187 H ILE 29 H ILE 29 3.193 6.046 -7.769
188 HA ILE 29 HA ILE 29 5.048 7.129 -5.792
189 HB ILE 29 HB ILE 29 4.631 7.826 -8.711
190 HG12 ILE 29 2HG1 ILE 29 6.857 6.299 -7.337
191 HG13 ILE 29 1HG1 ILE 29 5.586 5.588 -8.317
192 HG21 ILE 29 1HG2 ILE 29 6.781 8.799 -6.815
193 HG22 ILE 29 2HG2 ILE 29 5.446 9.766 -7.439
194 HG23 ILE 29 3HG2 ILE 29 6.676 9.153 -8.542
195 HD11 ILE 29 3HD1 ILE 29 6.436 6.785 -10.270
196 HD12 ILE 29 1HD1 ILE 29 7.667 5.748 -9.545
197 HD13 ILE 29 2HD1 ILE 29 7.708 7.491 -9.273
198 H ILE 30 H ILE 30 4.709 8.982 -4.749
199 HA ILE 30 HA ILE 30 2.280 10.521 -5.305
200 HB ILE 30 HB ILE 30 3.882 10.180 -2.732
201 HG12 ILE 30 2HG1 ILE 30 1.022 9.431 -3.381
202 HG13 ILE 30 1HG1 ILE 30 2.365 8.299 -3.254
203 HG21 ILE 30 1HG2 ILE 30 3.265 12.445 -2.795
204 HG22 ILE 30 2HG2 ILE 30 2.235 11.616 -1.628
205 HG23 ILE 30 3HG2 ILE 30 1.607 12.052 -3.218
206 HD11 ILE 30 3HD1 ILE 30 1.211 9.990 -1.043
207 HD12 ILE 30 1HD1 ILE 30 2.563 8.873 -0.869
208 HD13 ILE 30 2HD1 ILE 30 0.964 8.259 -1.278
209 H GLY 31 H GLY 31 2.533 12.612 -5.900
210 HA2 GLY 31 2HA GLY 31 4.269 14.491 -5.074
211 HA3 GLY 31 1HA GLY 31 5.176 13.659 -6.344
212 H ARG 32 H ARG 32 5.066 15.777 -7.399
213 HA ARG 32 HA ARG 32 2.519 15.944 -8.889
214 HB2 ARG 32 2HB ARG 32 4.449 18.206 -8.393
215 HB3 ARG 32 1HB ARG 32 2.903 18.311 -9.213
216 HG2 ARG 32 2HG ARG 32 1.789 17.768 -7.087
217 HG3 ARG 32 1HG ARG 32 3.362 17.721 -6.315
218 HD2 ARG 32 2HD ARG 32 2.132 20.115 -7.680
219 HD3 ARG 32 1HD ARG 32 2.351 19.902 -5.943
220 HE ARG 32 HE ARG 32 4.858 19.637 -7.120
221 HH11 ARG 32 1HH1 ARG 32 2.477 22.166 -6.523
222 HH12 ARG 32 2HH1 ARG 32 3.558 23.450 -6.752
223 HH21 ARG 32 1HH2 ARG 32 6.403 21.426 -7.411
224 HH22 ARG 32 2HH2 ARG 32 5.837 23.011 -7.291
225 H GLY 33 H GLY 33 3.022 14.884 -10.723
226 HA2 GLY 33 2HA GLY 33 4.665 16.021 -12.619
227 HA3 GLY 33 1HA GLY 33 5.549 14.702 -11.845
228 H GLN 34 H GLN 34 5.242 14.057 -14.224
229 HA GLN 34 HA GLN 34 2.641 12.879 -14.760
230 HB2 GLN 34 2HB GLN 34 5.192 12.809 -16.371
231 HB3 GLN 34 1HB GLN 34 3.605 12.291 -16.922
232 HG2 GLN 34 2HG GLN 34 2.798 14.598 -16.725
233 HG3 GLN 34 1HG GLN 34 4.398 15.104 -16.186
234 HE21 GLN 34 1HE2 GLN 34 4.701 16.477 -17.919
235 HE22 GLN 34 2HE2 GLN 34 5.014 15.876 -19.509
236 H ASP 35 H ASP 35 5.615 12.076 -13.395
237 HA ASP 35 HA ASP 35 5.370 9.217 -13.883
238 HB2 ASP 35 2HB ASP 35 7.576 10.460 -13.881
239 HB3 ASP 35 1HB ASP 35 7.398 10.646 -12.142
240 H ALA 36 H ALA 36 4.073 11.384 -11.809
241 HA ALA 36 HA ALA 36 4.018 9.723 -9.450
242 HB1 ALA 36 1HB ALA 36 2.627 11.491 -8.486
243 HB2 ALA 36 2HB ALA 36 2.536 12.285 -10.060
244 HB3 ALA 36 3HB ALA 36 4.082 12.160 -9.224
245 H GLN 37 H GLN 37 2.225 8.644 -8.643
246 HA GLN 37 HA GLN 37 0.090 8.017 -10.556
247 HB2 GLN 37 2HB GLN 37 1.239 6.546 -8.191
248 HB3 GLN 37 1HB GLN 37 -0.239 6.056 -8.996
249 HG2 GLN 37 2HG GLN 37 2.476 6.250 -10.290
250 HG3 GLN 37 1HG GLN 37 1.713 4.761 -9.733
251 HE21 GLN 37 1HE2 GLN 37 1.683 7.264 -12.167
252 HE22 GLN 37 2HE2 GLN 37 0.622 6.443 -13.231
253 H PHE 38 H PHE 38 0.841 9.659 -7.759
254 HA PHE 38 HA PHE 38 -1.951 10.171 -7.138
255 HB2 PHE 38 2HB PHE 38 -1.118 8.495 -5.525
256 HB3 PHE 38 1HB PHE 38 0.269 9.514 -5.190
257 HD1 PHE 38 1HD PHE 38 -0.081 11.648 -3.933
258 HD2 PHE 38 2HD PHE 38 -3.189 8.805 -4.432
259 HE1 PHE 38 1HE PHE 38 -1.204 12.598 -2.033
260 HE2 PHE 38 2HE PHE 38 -4.386 9.786 -2.519
261 HZ PHE 38 HZ PHE 38 -3.405 11.688 -1.300
262 H ARG 39 H ARG 39 -2.179 12.310 -7.190
263 HA ARG 39 HA ARG 39 0.262 13.882 -7.414
264 HB2 ARG 39 2HB ARG 39 -1.246 13.902 -9.337
265 HB3 ARG 39 1HB ARG 39 -2.549 14.481 -8.314
266 HG2 ARG 39 2HG ARG 39 -1.360 16.554 -7.923
267 HG3 ARG 39 1HG ARG 39 0.007 15.969 -8.873
268 HD2 ARG 39 2HD ARG 39 -1.461 15.795 -10.832
269 HD3 ARG 39 1HD ARG 39 -2.794 16.454 -9.878
270 HE ARG 39 HE ARG 39 -1.073 18.359 -9.537
271 HH11 ARG 39 1HH1 ARG 39 -1.925 16.690 -12.544
272 HH12 ARG 39 2HH1 ARG 39 -1.377 17.928 -13.562
273 HH21 ARG 39 1HH2 ARG 39 -0.315 20.080 -10.930
274 HH22 ARG 39 2HH2 ARG 39 -0.429 19.912 -12.614
275 H LEU 40 H LEU 40 0.755 15.343 -5.975
276 HA LEU 40 HA LEU 40 -1.138 15.940 -3.868
277 HB2 LEU 40 2HB LEU 40 1.778 16.614 -4.177
278 HB3 LEU 40 1HB LEU 40 0.790 17.271 -2.889
279 HG LEU 40 HG LEU 40 1.421 14.347 -3.318
280 HD11 LEU 40 1HD1 LEU 40 2.693 14.584 -1.270
281 HD12 LEU 40 2HD1 LEU 40 2.301 16.304 -1.215
282 HD13 LEU 40 3HD1 LEU 40 3.316 15.668 -2.513
283 HD21 LEU 40 3HD2 LEU 40 0.326 14.034 -1.140
284 HD22 LEU 40 1HD2 LEU 40 -0.804 14.645 -2.349
285 HD23 LEU 40 2HD2 LEU 40 -0.138 15.735 -1.136
286 HA PRO 41 HA PRO 41 -1.961 19.853 -5.821
287 HB2 PRO 41 2HB PRO 41 -3.824 20.725 -4.141
288 HB3 PRO 41 1HB PRO 41 -4.114 19.287 -5.119
289 HG2 PRO 41 2HG PRO 41 -3.444 19.492 -2.229
290 HG3 PRO 41 1HG PRO 41 -4.489 18.333 -3.068
291 HD2 PRO 41 2HD PRO 41 -1.788 17.919 -2.301
292 HD3 PRO 41 1HD PRO 41 -2.736 16.875 -3.362
293 H ASP 42 H ASP 42 0.052 19.461 -3.419
294 HA ASP 42 HA ASP 42 -0.119 22.109 -2.216
295 HB2 ASP 42 2HB ASP 42 0.327 19.851 -0.919
296 HB3 ASP 42 1HB ASP 42 1.982 20.132 -1.477
297 H THR 43 H THR 43 2.523 22.677 -1.669
298 HA THR 43 HA THR 43 3.455 23.172 -4.391
299 HB THR 43 HB THR 43 2.568 25.204 -3.413
300 HG1 THR 43 1HG THR 43 5.228 25.829 -3.078
301 HG21 THR 43 3HG2 THR 43 3.558 26.222 -1.385
302 HG22 THR 43 1HG2 THR 43 4.515 24.761 -1.146
303 HG23 THR 43 2HG2 THR 43 2.755 24.687 -1.049
304 H GLY 44 H GLY 44 5.758 23.297 -4.732
305 HA2 GLY 44 2HA GLY 44 7.995 22.894 -4.331
306 HA3 GLY 44 1HA GLY 44 7.635 22.744 -2.622
307 H VAL 45 H VAL 45 5.678 20.809 -4.456
308 HA VAL 45 HA VAL 45 7.072 18.437 -3.542
309 HB VAL 45 HB VAL 45 4.421 18.653 -4.984
310 HG11 VAL 45 1HG1 VAL 45 5.545 16.386 -3.389
311 HG12 VAL 45 2HG1 VAL 45 5.523 16.481 -5.149
312 HG13 VAL 45 3HG1 VAL 45 4.003 16.427 -4.251
313 HG21 VAL 45 3HG2 VAL 45 4.982 18.388 -2.051
314 HG22 VAL 45 1HG2 VAL 45 3.390 18.319 -2.814
315 HG23 VAL 45 2HG2 VAL 45 4.328 19.820 -2.864
316 H SER 46 H SER 46 8.541 17.618 -4.792
317 HA SER 46 HA SER 46 9.024 18.187 -7.480
318 HB2 SER 46 2HB SER 46 9.926 15.829 -5.823
319 HB3 SER 46 1HB SER 46 10.761 16.540 -7.206
320 HG SER 46 HG SER 46 11.738 17.463 -5.563
321 H ARG 47 H ARG 47 9.300 16.152 -9.104
322 HA ARG 47 HA ARG 47 6.698 15.181 -9.652
323 HB2 ARG 47 2HB ARG 47 7.704 13.801 -11.419
324 HB3 ARG 47 1HB ARG 47 8.320 15.444 -11.476
325 HG2 ARG 47 2HG ARG 47 10.399 14.736 -10.467
326 HG3 ARG 47 1HG ARG 47 9.759 13.115 -10.222
327 HD2 ARG 47 2HD ARG 47 9.574 12.842 -12.651
328 HD3 ARG 47 1HD ARG 47 10.257 14.453 -12.878
329 HE ARG 47 HE ARG 47 12.258 13.683 -11.829
330 HH11 ARG 47 1HH1 ARG 47 10.081 11.218 -13.147
331 HH12 ARG 47 2HH1 ARG 47 11.221 9.968 -13.175
332 HH21 ARG 47 1HH2 ARG 47 13.901 11.951 -11.893
333 HH22 ARG 47 2HH2 ARG 47 13.492 10.423 -12.476
334 H ARG 48 H ARG 48 9.430 13.837 -8.024
335 HA ARG 48 HA ARG 48 7.745 11.670 -7.071
336 HB2 ARG 48 2HB ARG 48 10.665 11.747 -7.758
337 HB3 ARG 48 1HB ARG 48 10.067 10.619 -6.554
338 HG2 ARG 48 2HG ARG 48 8.677 9.548 -8.138
339 HG3 ARG 48 1HG ARG 48 9.016 10.749 -9.382
340 HD2 ARG 48 2HD ARG 48 10.273 8.583 -9.616
341 HD3 ARG 48 1HD ARG 48 11.316 10.010 -9.501
342 HE ARG 48 HE ARG 48 12.021 9.324 -7.453
343 HH11 ARG 48 1HH1 ARG 48 9.648 6.970 -8.718
344 HH12 ARG 48 2HH1 ARG 48 10.075 5.753 -7.600
345 HH21 ARG 48 1HH2 ARG 48 12.681 7.563 -6.052
346 HH22 ARG 48 2HH2 ARG 48 11.838 6.082 -6.098
347 H HIS 49 H HIS 49 7.107 12.302 -5.202
348 HA HIS 49 HA HIS 49 8.960 13.730 -3.449
349 HB2 HIS 49 2HB HIS 49 7.000 14.997 -3.641
350 HB3 HIS 49 1HB HIS 49 5.902 13.651 -3.539
351 HD2 HIS 49 2HD HIS 49 5.788 12.568 -0.799
352 HE1 HIS 49 1HE HIS 49 6.955 16.257 0.867
353 HE2 HIS 49 2HE HIS 49 6.462 13.816 1.314
354 H LEU 50 H LEU 50 7.043 10.879 -3.868
355 HA LEU 50 HA LEU 50 8.598 9.450 -2.000
356 HB2 LEU 50 2HB LEU 50 7.184 10.654 -0.428
357 HB3 LEU 50 1HB LEU 50 5.754 10.201 -1.311
358 HG LEU 50 HG LEU 50 7.384 7.994 -0.154
359 HD11 LEU 50 1HD1 LEU 50 7.276 9.750 1.608
360 HD12 LEU 50 2HD1 LEU 50 6.307 8.342 2.015
361 HD13 LEU 50 3HD1 LEU 50 5.526 9.808 1.410
362 HD21 LEU 50 3HD2 LEU 50 4.441 8.590 -0.315
363 HD22 LEU 50 1HD2 LEU 50 5.158 7.070 0.209
364 HD23 LEU 50 2HD2 LEU 50 5.339 7.597 -1.468
365 H GLU 51 H GLU 51 8.154 7.232 -2.191
366 HA GLU 51 HA GLU 51 6.021 6.529 -4.049
367 HB2 GLU 51 2HB GLU 51 7.414 4.896 -5.201
368 HB3 GLU 51 1HB GLU 51 8.038 6.515 -5.424
369 HG2 GLU 51 2HG GLU 51 9.732 6.067 -3.700
370 HG3 GLU 51 1HG GLU 51 9.083 4.444 -3.508
371 H ILE 52 H ILE 52 4.982 4.718 -3.607
372 HA ILE 52 HA ILE 52 5.922 3.208 -1.278
373 HB ILE 52 HB ILE 52 3.075 3.538 -2.264
374 HG12 ILE 52 2HG1 ILE 52 4.382 4.627 0.246
375 HG13 ILE 52 1HG1 ILE 52 4.006 5.583 -1.182
376 HG21 ILE 52 1HG2 ILE 52 3.498 1.386 -1.314
377 HG22 ILE 52 2HG2 ILE 52 2.509 2.332 -0.179
378 HG23 ILE 52 3HG2 ILE 52 4.238 2.103 0.116
379 HD11 ILE 52 3HD1 ILE 52 2.359 5.901 0.583
380 HD12 ILE 52 1HD1 ILE 52 2.000 4.174 0.573
381 HD13 ILE 52 2HD1 ILE 52 1.629 5.160 -0.842
382 H ARG 53 H ARG 53 6.700 1.348 -1.899
383 HA ARG 53 HA ARG 53 5.661 0.120 -4.323
384 HB2 ARG 53 2HB ARG 53 8.058 0.117 -4.283
385 HB3 ARG 53 1HB ARG 53 8.096 -0.549 -2.658
386 HG2 ARG 53 2HG ARG 53 7.117 -2.631 -3.488
387 HG3 ARG 53 1HG ARG 53 7.063 -1.944 -5.107
388 HD2 ARG 53 2HD ARG 53 9.444 -1.880 -5.229
389 HD3 ARG 53 1HD ARG 53 9.591 -2.321 -3.526
390 HE ARG 53 HE ARG 53 8.478 -4.432 -4.139
391 HH11 ARG 53 1HH1 ARG 53 10.267 -2.691 -6.663
392 HH12 ARG 53 2HH1 ARG 53 10.640 -4.095 -7.548
393 HH21 ARG 53 1HH2 ARG 53 8.975 -6.295 -5.326
394 HH22 ARG 53 2HH2 ARG 53 9.873 -6.235 -6.768
395 H TRP 54 H TRP 54 3.959 -1.093 -4.085
396 HA TRP 54 HA TRP 54 3.616 -2.388 -1.544
397 HB2 TRP 54 2HB TRP 54 1.718 -1.038 -1.983
398 HB3 TRP 54 1HB TRP 54 1.637 -1.551 -3.664
399 HD1 TRP 54 HD TRP 54 -0.282 -3.137 -4.106
400 HE1 TRP 54 1HE TRP 54 -1.558 -4.932 -2.840
401 HE3 TRP 54 3HE TRP 54 2.211 -2.815 0.290
402 HZ2 TRP 54 2HZ TRP 54 -1.524 -6.072 -0.189
403 HZ3 TRP 54 3HZ TRP 54 1.577 -4.244 2.133
404 HH2 TRP 54 HH TRP 54 -0.279 -5.872 1.916
405 H ASP 55 H ASP 55 4.395 -4.306 -1.496
406 HA ASP 55 HA ASP 55 3.870 -6.135 -3.718
407 HB2 ASP 55 2HB ASP 55 5.931 -6.282 -1.491
408 HB3 ASP 55 1HB ASP 55 5.557 -7.640 -2.538
409 H GLY 56 H GLY 56 3.287 -8.374 -2.906
410 HA2 GLY 56 2HA GLY 56 1.000 -8.064 -1.231
411 HA3 GLY 56 1HA GLY 56 1.562 -9.569 -1.935
412 H GLN 57 H GLN 57 2.468 -7.284 0.599
413 HA GLN 57 HA GLN 57 2.209 -9.173 2.711
414 HB2 GLN 57 2HB GLN 57 4.391 -9.954 1.815
415 HB3 GLN 57 1HB GLN 57 5.041 -8.336 2.008
416 HG2 GLN 57 2HG GLN 57 4.561 -8.533 4.461
417 HG3 GLN 57 1HG GLN 57 4.164 -10.224 4.177
418 HE21 GLN 57 1HE2 GLN 57 6.304 -9.004 5.767
419 HE22 GLN 57 2HE2 GLN 57 7.764 -9.668 5.144
420 H VAL 58 H VAL 58 4.466 -6.475 2.134
421 HA VAL 58 HA VAL 58 2.939 -4.785 3.930
422 HB VAL 58 HB VAL 58 5.088 -3.912 4.920
423 HG11 VAL 58 1HG1 VAL 58 5.438 -5.725 6.522
424 HG12 VAL 58 2HG1 VAL 58 4.526 -6.818 5.478
425 HG13 VAL 58 3HG1 VAL 58 3.728 -5.432 6.218
426 HG21 VAL 58 3HG2 VAL 58 6.652 -4.702 3.216
427 HG22 VAL 58 1HG2 VAL 58 6.312 -6.375 3.662
428 HG23 VAL 58 2HG2 VAL 58 7.118 -5.301 4.806
429 H ALA 59 H ALA 59 3.564 -2.508 3.639
430 HA ALA 59 HA ALA 59 4.181 -2.116 0.823
431 HB1 ALA 59 1HB ALA 59 3.068 0.046 1.045
432 HB2 ALA 59 2HB ALA 59 2.822 -0.271 2.765
433 HB3 ALA 59 3HB ALA 59 2.005 -1.261 1.570
434 H LEU 60 H LEU 60 5.982 -1.392 0.307
435 HA LEU 60 HA LEU 60 7.929 -0.484 2.230
436 HB2 LEU 60 2HB LEU 60 8.537 -2.003 0.456
437 HB3 LEU 60 1HB LEU 60 7.980 -0.861 -0.745
438 HG LEU 60 HG LEU 60 9.810 0.668 -0.074
439 HD11 LEU 60 1HD1 LEU 60 11.634 -0.216 1.306
440 HD12 LEU 60 2HD1 LEU 60 10.667 -1.664 1.626
441 HD13 LEU 60 3HD1 LEU 60 10.120 -0.095 2.209
442 HD21 LEU 60 3HD2 LEU 60 10.587 -2.112 -0.903
443 HD22 LEU 60 1HD2 LEU 60 11.576 -0.664 -1.131
444 HD23 LEU 60 2HD2 LEU 60 10.017 -0.824 -1.954
445 H LEU 61 H LEU 61 8.360 1.603 2.678
446 HA LEU 61 HA LEU 61 7.093 3.668 1.036
447 HB2 LEU 61 2HB LEU 61 6.206 3.282 3.285
448 HB3 LEU 61 1HB LEU 61 7.756 3.547 4.005
449 HG LEU 61 HG LEU 61 6.221 5.399 4.387
450 HD11 LEU 61 1HD1 LEU 61 8.397 6.277 2.511
451 HD12 LEU 61 2HD1 LEU 61 8.543 6.037 4.254
452 HD13 LEU 61 3HD1 LEU 61 7.506 7.314 3.626
453 HD21 LEU 61 3HD2 LEU 61 5.318 6.744 2.616
454 HD22 LEU 61 1HD2 LEU 61 4.837 5.064 2.420
455 HD23 LEU 61 2HD2 LEU 61 6.124 5.730 1.412
456 H ALA 62 H ALA 62 8.535 4.841 -0.105
457 HA ALA 62 HA ALA 62 11.168 5.364 1.080
458 HB1 ALA 62 1HB ALA 62 12.117 5.359 -1.188
459 HB2 ALA 62 2HB ALA 62 10.541 4.926 -1.847
460 HB3 ALA 62 3HB ALA 62 11.397 3.797 -0.799
461 H ASP 63 H ASP 63 11.561 7.455 1.342
462 HA ASP 63 HA ASP 63 9.659 9.403 0.266
463 HB2 ASP 63 2HB ASP 63 9.926 9.560 2.630
464 HB3 ASP 63 1HB ASP 63 11.675 9.484 2.506
465 H LEU 64 H LEU 64 10.201 10.907 -1.219
466 HA LEU 64 HA LEU 64 13.063 11.249 -1.896
467 HB2 LEU 64 2HB LEU 64 10.681 11.492 -3.759
468 HB3 LEU 64 1HB LEU 64 12.315 11.905 -4.167
469 HG LEU 64 HG LEU 64 11.769 9.980 -5.269
470 HD11 LEU 64 1HD1 LEU 64 13.989 9.953 -4.437
471 HD12 LEU 64 2HD1 LEU 64 13.347 8.316 -4.484
472 HD13 LEU 64 3HD1 LEU 64 13.476 9.168 -2.937
473 HD21 LEU 64 3HD2 LEU 64 10.808 8.739 -2.696
474 HD22 LEU 64 1HD2 LEU 64 11.015 7.890 -4.238
475 HD23 LEU 64 2HD2 LEU 64 9.858 9.202 -4.124
476 H ASN 65 H ASN 65 12.784 13.044 -0.142
477 HA ASN 65 HA ASN 65 12.567 15.541 -1.482
478 HB2 ASN 65 2HB ASN 65 10.099 14.955 -1.138
479 HB3 ASN 65 1HB ASN 65 10.389 15.071 0.590
480 HD21 ASN 65 1HD2 ASN 65 8.625 16.602 -1.150
481 HD22 ASN 65 2HD2 ASN 65 9.060 18.264 -0.973
482 H SER 66 H SER 66 13.765 17.003 -0.409
483 HA SER 66 HA SER 66 14.848 16.180 2.171
484 HB2 SER 66 2HB SER 66 15.793 18.372 0.326
485 HB3 SER 66 1HB SER 66 16.688 17.615 1.646
486 HG SER 66 HG SER 66 16.763 15.704 0.483
487 H THR 67 H THR 67 13.056 18.796 0.631
488 HA THR 67 HA THR 67 13.323 20.482 2.971
489 HB THR 67 HB THR 67 13.593 21.586 0.817
490 HG1 THR 67 1HG THR 67 12.702 22.887 2.343
491 HG21 THR 67 3HG2 THR 67 12.182 20.108 -0.551
492 HG22 THR 67 1HG2 THR 67 11.762 21.804 -0.803
493 HG23 THR 67 2HG2 THR 67 10.746 20.780 0.212
494 H ASN 68 H ASN 68 10.867 18.543 1.441
495 HA ASN 68 HA ASN 68 9.084 19.153 3.694
496 HB2 ASN 68 2HB ASN 68 8.312 18.663 0.811
497 HB3 ASN 68 1HB ASN 68 7.159 18.566 2.136
498 HD21 ASN 68 1HD2 ASN 68 6.641 20.463 3.261
499 HD22 ASN 68 2HD2 ASN 68 6.898 22.021 2.587
500 H GLY 69 H GLY 69 11.111 17.218 3.489
501 HA2 GLY 69 2HA GLY 69 10.570 14.642 2.766
502 HA3 GLY 69 1HA GLY 69 11.492 15.072 4.192
503 H THR 70 H THR 70 9.390 13.024 3.365
504 HA THR 70 HA THR 70 7.108 13.481 4.956
505 HB THR 70 HB THR 70 8.149 10.966 3.693
506 HG1 THR 70 1HG THR 70 8.034 12.260 2.071
507 HG21 THR 70 3HG2 THR 70 5.397 11.888 4.518
508 HG22 THR 70 1HG2 THR 70 6.322 10.570 5.212
509 HG23 THR 70 2HG2 THR 70 5.713 10.437 3.559
510 H THR 71 H THR 71 6.629 12.753 6.962
511 HA THR 71 HA THR 71 8.696 11.294 8.420
512 HB THR 71 HB THR 71 7.535 12.229 10.432
513 HG1 THR 71 1HG THR 71 6.490 14.280 8.889
514 HG21 THR 71 3HG2 THR 71 9.559 13.155 9.706
515 HG22 THR 71 1HG2 THR 71 8.488 14.456 10.215
516 HG23 THR 71 2HG2 THR 71 8.750 14.152 8.476
517 H VAL 72 H VAL 72 8.093 9.521 9.598
518 HA VAL 72 HA VAL 72 5.332 8.617 9.252
519 HB VAL 72 HB VAL 72 6.224 6.276 9.458
520 HG11 VAL 72 1HG1 VAL 72 7.571 7.939 7.345
521 HG12 VAL 72 2HG1 VAL 72 5.947 7.262 7.249
522 HG13 VAL 72 3HG1 VAL 72 7.350 6.189 7.287
523 HG21 VAL 72 3HG2 VAL 72 8.910 7.665 9.460
524 HG22 VAL 72 1HG2 VAL 72 8.660 5.918 9.370
525 HG23 VAL 72 2HG2 VAL 72 8.200 6.810 10.825
526 H ASN 73 H ASN 73 4.201 8.478 11.019
527 HA ASN 73 HA ASN 73 3.559 8.905 13.091
528 HB2 ASN 73 2HB ASN 73 6.120 7.462 13.758
529 HB3 ASN 73 1HB ASN 73 5.200 8.223 15.039
530 HD21 ASN 73 1HD2 ASN 73 4.020 6.402 12.172
531 HD22 ASN 73 2HD2 ASN 73 3.306 5.187 13.137
532 H ASN 74 H ASN 74 5.190 10.779 11.558
533 HA ASN 74 HA ASN 74 5.840 12.841 11.635
534 HB2 ASN 74 2HB ASN 74 4.210 13.237 13.507
535 HB3 ASN 74 1HB ASN 74 5.476 12.852 14.663
536 HD21 ASN 74 1HD2 ASN 74 6.914 14.462 15.243
537 HD22 ASN 74 2HD2 ASN 74 6.840 16.068 14.602
538 H ALA 75 H ALA 75 7.536 10.339 12.458
539 HA ALA 75 HA ALA 75 9.932 11.719 13.344
540 HB1 ALA 75 1HB ALA 75 9.392 9.598 14.446
541 HB2 ALA 75 2HB ALA 75 10.894 9.445 13.531
542 HB3 ALA 75 3HB ALA 75 9.395 8.775 12.888
543 HA PRO 76 HA PRO 76 11.059 12.065 8.993
544 HB2 PRO 76 2HB PRO 76 13.730 12.786 10.034
545 HB3 PRO 76 1HB PRO 76 12.616 13.724 9.029
546 HG2 PRO 76 2HG PRO 76 13.003 14.367 11.596
547 HG3 PRO 76 1HG PRO 76 11.408 14.494 10.834
548 HD2 PRO 76 2HD PRO 76 12.487 12.336 12.608
549 HD3 PRO 76 1HD PRO 76 10.917 13.180 12.646
550 H VAL 77 H VAL 77 11.625 10.537 7.662
551 HA VAL 77 HA VAL 77 13.912 8.805 8.166
552 HB VAL 77 HB VAL 77 12.617 6.787 7.510
553 HG11 VAL 77 1HG1 VAL 77 11.414 6.396 9.608
554 HG12 VAL 77 2HG1 VAL 77 11.521 8.117 9.982
555 HG13 VAL 77 3HG1 VAL 77 12.989 7.144 9.878
556 HG21 VAL 77 3HG2 VAL 77 10.809 7.811 6.288
557 HG22 VAL 77 1HG2 VAL 77 10.213 8.590 7.755
558 HG23 VAL 77 2HG2 VAL 77 10.141 6.838 7.601
559 H GLN 78 H GLN 78 14.584 7.745 6.200
560 HA GLN 78 HA GLN 78 13.568 9.098 3.815
561 HB2 GLN 78 2HB GLN 78 15.651 8.385 2.690
562 HB3 GLN 78 1HB GLN 78 15.985 9.337 4.123
563 HG2 GLN 78 2HG GLN 78 16.426 7.217 5.352
564 HG3 GLN 78 1HG GLN 78 16.233 6.357 3.823
565 HE21 GLN 78 1HE2 GLN 78 18.176 8.551 5.634
566 HE22 GLN 78 2HE2 GLN 78 19.605 8.442 4.686
567 H GLU 79 H GLU 79 13.634 6.129 5.471
568 HA GLU 79 HA GLU 79 11.964 4.996 3.462
569 HB2 GLU 79 2HB GLU 79 13.206 2.764 3.619
570 HB3 GLU 79 1HB GLU 79 13.951 4.023 2.658
571 HG2 GLU 79 2HG GLU 79 15.668 2.909 3.863
572 HG3 GLU 79 1HG GLU 79 15.472 4.500 4.574
573 H TRP 80 H TRP 80 10.601 3.368 4.224
574 HA TRP 80 HA TRP 80 10.619 2.637 6.978
575 HB2 TRP 80 2HB TRP 80 9.721 4.903 7.169
576 HB3 TRP 80 1HB TRP 80 8.444 4.607 6.026
577 HD1 TRP 80 HD TRP 80 6.253 3.646 6.940
578 HE1 TRP 80 1HE TRP 80 5.450 3.017 9.313
579 HE3 TRP 80 3HE TRP 80 10.722 3.756 9.384
580 HZ2 TRP 80 2HZ TRP 80 6.545 2.592 11.814
581 HZ3 TRP 80 3HZ TRP 80 10.747 3.231 11.778
582 HH2 TRP 80 HH TRP 80 8.675 2.678 12.964
583 H GLN 81 H GLN 81 9.080 1.030 7.388
584 HA GLN 81 HA GLN 81 7.807 0.008 4.976
585 HB2 GLN 81 2HB GLN 81 7.785 -2.208 6.157
586 HB3 GLN 81 1HB GLN 81 9.393 -1.613 5.784
587 HG2 GLN 81 2HG GLN 81 9.638 -0.869 8.109
588 HG3 GLN 81 1HG GLN 81 8.037 -1.519 8.470
589 HE21 GLN 81 1HE2 GLN 81 11.329 -2.261 7.768
590 HE22 GLN 81 2HE2 GLN 81 11.225 -3.951 8.121
591 H LEU 82 H LEU 82 5.756 0.357 4.892
592 HA LEU 82 HA LEU 82 4.366 1.737 6.865
593 HB2 LEU 82 2HB LEU 82 3.168 0.122 4.640
594 HB3 LEU 82 1HB LEU 82 2.351 1.332 5.607
595 HG LEU 82 HG LEU 82 4.528 1.790 3.583
596 HD11 LEU 82 1HD1 LEU 82 2.281 1.611 2.646
597 HD12 LEU 82 2HD1 LEU 82 2.882 3.261 2.549
598 HD13 LEU 82 3HD1 LEU 82 1.707 2.825 3.784
599 HD21 LEU 82 3HD2 LEU 82 5.054 3.146 5.439
600 HD22 LEU 82 1HD2 LEU 82 3.360 3.610 5.619
601 HD23 LEU 82 2HD2 LEU 82 4.280 4.167 4.219
602 H ALA 83 H ALA 83 3.176 1.253 8.488
603 HA ALA 83 HA ALA 83 2.368 -1.507 8.956
604 HB1 ALA 83 1HB ALA 83 3.339 0.545 10.958
605 HB2 ALA 83 2HB ALA 83 4.212 -0.907 10.470
606 HB3 ALA 83 3HB ALA 83 2.695 -1.047 11.360
607 H ASP 84 H ASP 84 0.388 -1.639 10.134
608 HA ASP 84 HA ASP 84 -1.511 0.236 9.220
609 HB2 ASP 84 2HB ASP 84 -2.145 -2.077 9.611
610 HB3 ASP 84 1HB ASP 84 -1.796 -1.901 11.325
611 H GLY 85 H GLY 85 -2.210 2.043 10.050
612 HA2 GLY 85 2HA GLY 85 -2.913 3.488 11.711
613 HA3 GLY 85 1HA GLY 85 -2.142 2.458 12.909
614 H ASP 86 H ASP 86 -0.201 3.251 10.206
615 HA ASP 86 HA ASP 86 1.471 4.895 11.895
616 HB2 ASP 86 2HB ASP 86 2.228 3.236 9.978
617 HB3 ASP 86 1HB ASP 86 1.933 4.631 8.936
618 H VAL 87 H VAL 87 1.667 7.075 11.790
619 HA VAL 87 HA VAL 87 -0.257 8.479 10.069
620 HB VAL 87 HB VAL 87 1.361 9.635 12.358
621 HG11 VAL 87 1HG1 VAL 87 -1.055 10.699 10.909
622 HG12 VAL 87 2HG1 VAL 87 0.605 11.282 10.775
623 HG13 VAL 87 3HG1 VAL 87 -0.269 11.457 12.299
624 HG21 VAL 87 3HG2 VAL 87 -0.677 9.484 13.720
625 HG22 VAL 87 1HG2 VAL 87 -0.105 7.892 13.225
626 HG23 VAL 87 2HG2 VAL 87 -1.485 8.625 12.408
627 H ILE 88 H ILE 88 0.611 9.127 8.237
628 HA ILE 88 HA ILE 88 3.471 9.595 8.254
629 HB ILE 88 HB ILE 88 1.625 8.730 6.027
630 HG12 ILE 88 2HG1 ILE 88 3.863 7.376 7.522
631 HG13 ILE 88 1HG1 ILE 88 2.151 7.011 7.628
632 HG21 ILE 88 1HG2 ILE 88 3.350 10.234 5.148
633 HG22 ILE 88 2HG2 ILE 88 3.634 8.567 4.635
634 HG23 ILE 88 3HG2 ILE 88 4.591 9.265 5.939
635 HD11 ILE 88 3HD1 ILE 88 2.152 6.253 5.338
636 HD12 ILE 88 1HD1 ILE 88 3.349 5.406 6.317
637 HD13 ILE 88 2HD1 ILE 88 3.865 6.674 5.199
638 H ARG 89 H ARG 89 4.059 11.603 8.042
639 HA ARG 89 HA ARG 89 2.100 13.513 7.020
640 HB2 ARG 89 2HB ARG 89 4.198 13.906 9.155
641 HB3 ARG 89 1HB ARG 89 3.170 15.187 8.513
642 HG2 ARG 89 2HG ARG 89 1.212 14.131 9.309
643 HG3 ARG 89 1HG ARG 89 2.099 12.680 9.746
644 HD2 ARG 89 2HD ARG 89 1.573 13.961 11.729
645 HD3 ARG 89 1HD ARG 89 3.312 13.949 11.464
646 HE ARG 89 HE ARG 89 2.786 16.250 10.382
647 HH11 ARG 89 1HH1 ARG 89 1.132 14.918 13.262
648 HH12 ARG 89 2HH1 ARG 89 0.968 16.440 13.991
649 HH21 ARG 89 1HH2 ARG 89 2.517 18.303 11.446
650 HH22 ARG 89 2HH2 ARG 89 1.752 18.387 12.982
651 H LEU 90 H LEU 90 2.573 13.980 5.134
652 HA LEU 90 HA LEU 90 5.329 14.512 4.383
653 HB2 LEU 90 2HB LEU 90 4.542 14.222 1.986
654 HB3 LEU 90 1HB LEU 90 4.675 12.763 2.915
655 HG LEU 90 HG LEU 90 2.016 14.126 2.424
656 HD11 LEU 90 1HD1 LEU 90 1.733 12.593 0.561
657 HD12 LEU 90 2HD1 LEU 90 3.324 11.899 0.868
658 HD13 LEU 90 3HD1 LEU 90 3.190 13.561 0.301
659 HD21 LEU 90 3HD2 LEU 90 1.132 11.902 2.871
660 HD22 LEU 90 1HD2 LEU 90 2.107 12.447 4.238
661 HD23 LEU 90 2HD2 LEU 90 2.766 11.277 3.094
662 H GLY 91 H GLY 91 5.511 16.212 2.663
663 HA2 GLY 91 2HA GLY 91 5.196 18.688 3.478
664 HA3 GLY 91 1HA GLY 91 4.986 18.306 1.787
665 H HIS 92 H HIS 92 3.470 19.052 4.773
666 HA HIS 92 HA HIS 92 1.556 19.981 5.448
667 HB2 HIS 92 2HB HIS 92 2.255 21.716 3.837
668 HB3 HIS 92 1HB HIS 92 1.364 20.904 2.566
669 HD1 HIS 92 1HD HIS 92 -0.510 22.368 2.044
670 HD2 HIS 92 2HD HIS 92 0.098 22.067 6.129
671 HE1 HIS 92 1HE HIS 92 -2.406 23.677 3.142
672 H SER 93 H SER 93 1.534 17.264 4.006
673 HA SER 93 HA SER 93 -1.384 17.004 3.840
674 HB2 SER 93 2HB SER 93 0.605 15.579 2.084
675 HB3 SER 93 1HB SER 93 -1.151 15.572 1.930
676 HG SER 93 HG SER 93 0.607 17.772 1.534
677 H GLU 94 H GLU 94 -1.868 15.688 5.533
678 HA GLU 94 HA GLU 94 0.075 13.604 6.123
679 HB2 GLU 94 2HB GLU 94 -0.955 13.457 8.389
680 HB3 GLU 94 1HB GLU 94 -0.168 14.982 8.029
681 HG2 GLU 94 2HG GLU 94 -2.332 16.007 7.610
682 HG3 GLU 94 1HG GLU 94 -3.125 14.473 7.987
683 H ILE 95 H ILE 95 -0.448 11.531 6.248
684 HA ILE 95 HA ILE 95 -3.127 10.825 5.328
685 HB ILE 95 HB ILE 95 -1.405 10.933 3.467
686 HG12 ILE 95 2HG1 ILE 95 -1.906 8.677 2.528
687 HG13 ILE 95 1HG1 ILE 95 -2.679 8.275 4.064
688 HG21 ILE 95 1HG2 ILE 95 0.242 9.141 3.259
689 HG22 ILE 95 2HG2 ILE 95 -0.179 8.585 4.876
690 HG23 ILE 95 3HG2 ILE 95 0.550 10.177 4.654
691 HD11 ILE 95 3HD1 ILE 95 -3.478 10.535 2.253
692 HD12 ILE 95 1HD1 ILE 95 -4.262 10.065 3.756
693 HD13 ILE 95 2HD1 ILE 95 -4.303 8.982 2.367
694 H ILE 96 H ILE 96 -3.851 8.813 6.151
695 HA ILE 96 HA ILE 96 -2.095 7.617 8.172
696 HB ILE 96 HB ILE 96 -5.131 7.598 8.008
697 HG12 ILE 96 2HG1 ILE 96 -3.290 8.950 10.000
698 HG13 ILE 96 1HG1 ILE 96 -4.162 9.765 8.709
699 HG21 ILE 96 1HG2 ILE 96 -4.263 5.508 8.950
700 HG22 ILE 96 2HG2 ILE 96 -5.077 6.471 10.182
701 HG23 ILE 96 3HG2 ILE 96 -3.314 6.427 10.119
702 HD11 ILE 96 3HD1 ILE 96 -5.255 10.043 10.876
703 HD12 ILE 96 1HD1 ILE 96 -5.413 8.294 11.019
704 HD13 ILE 96 2HD1 ILE 96 -6.275 9.157 9.744
705 H VAL 97 H VAL 97 -1.566 5.534 7.932
706 HA VAL 97 HA VAL 97 -2.494 4.166 5.547
707 HB VAL 97 HB VAL 97 -0.269 3.530 7.510
708 HG11 VAL 97 1HG1 VAL 97 -1.269 1.456 6.645
709 HG12 VAL 97 2HG1 VAL 97 0.355 1.708 6.002
710 HG13 VAL 97 3HG1 VAL 97 -1.058 2.052 4.995
711 HG21 VAL 97 3HG2 VAL 97 -0.260 4.342 4.624
712 HG22 VAL 97 1HG2 VAL 97 1.167 4.002 5.601
713 HG23 VAL 97 2HG2 VAL 97 0.136 5.391 5.987
714 H ARG 98 H ARG 98 -4.220 2.944 5.700
715 HA ARG 98 HA ARG 98 -4.703 1.531 8.212
716 HB2 ARG 98 2HB ARG 98 -6.656 2.572 6.165
717 HB3 ARG 98 1HB ARG 98 -7.097 1.539 7.518
718 HG2 ARG 98 2HG ARG 98 -5.746 4.192 7.805
719 HG3 ARG 98 1HG ARG 98 -7.501 3.971 7.910
720 HD2 ARG 98 2HD ARG 98 -5.490 2.547 9.675
721 HD3 ARG 98 1HD ARG 98 -6.301 4.042 10.108
722 HE ARG 98 HE ARG 98 -8.410 2.765 9.784
723 HH11 ARG 98 1HH1 ARG 98 -5.484 0.830 10.566
724 HH12 ARG 98 2HH1 ARG 98 -6.342 -0.166 11.617
725 HH21 ARG 98 1HH2 ARG 98 -9.498 1.287 11.168
726 HH22 ARG 98 2HH2 ARG 98 -8.620 0.047 11.960
727 H MET 99 H MET 99 -4.507 -0.482 8.152
728 HA MET 99 HA MET 99 -4.550 -1.829 5.563
729 HB2 MET 99 2HB MET 99 -3.344 -2.713 8.180
730 HB3 MET 99 1HB MET 99 -3.460 -3.737 6.761
731 HG2 MET 99 2HG MET 99 -2.114 -2.078 5.523
732 HG3 MET 99 1HG MET 99 -1.919 -1.179 7.026
733 HE1 MET 99 3HE MET 99 1.599 -2.815 6.440
734 HE2 MET 99 1HE MET 99 0.716 -1.305 6.665
735 HE3 MET 99 2HE MET 99 0.483 -2.252 5.195
736 H HIS 100 H HIS 100 -6.058 -3.032 5.048
737 HA HIS 100 HA HIS 100 -8.285 -3.536 6.755
738 HB2 HIS 100 2HB HIS 100 -7.692 -4.345 3.903
739 HB3 HIS 100 1HB HIS 100 -9.197 -4.731 4.725
740 HD1 HIS 100 1HD HIS 100 -10.864 -3.240 3.547
741 HD2 HIS 100 2HD HIS 100 -7.411 -1.208 4.639
742 HE1 HIS 100 1HE HIS 100 -11.273 -0.826 2.999
Start of MODEL 15
1 H1 GLY 1 1HT GLY 1 -7.375 -17.869 -5.362
2 H2 GLY 1 2HT GLY 1 -8.017 -17.685 -6.894
3 H3 GLY 1 3HT GLY 1 -8.923 -18.484 -5.704
4 HA2 GLY 1 1HA GLY 1 -9.799 -16.316 -6.037
5 HA3 GLY 1 2HA GLY 1 -9.045 -16.415 -4.451
6 H HIS 2 H HIS 2 -8.772 -14.167 -4.439
7 HA HIS 2 HA HIS 2 -6.551 -13.213 -6.104
8 HB2 HIS 2 2HB HIS 2 -8.973 -11.665 -5.147
9 HB3 HIS 2 1HB HIS 2 -7.575 -10.947 -5.936
10 HD1 HIS 2 1HD HIS 2 -10.852 -11.601 -6.796
11 HD2 HIS 2 2HD HIS 2 -7.251 -12.720 -8.499
12 HE1 HIS 2 1HE HIS 2 -11.346 -12.023 -9.220
13 H GLY 3 H GLY 3 -4.977 -12.078 -5.000
14 HA2 GLY 3 2HA GLY 3 -4.867 -12.406 -2.159
15 HA3 GLY 3 1HA GLY 3 -3.674 -11.600 -3.176
16 H SER 4 H SER 4 -6.011 -10.009 -4.300
17 HA SER 4 HA SER 4 -5.838 -7.657 -2.857
18 HB2 SER 4 2HB SER 4 -8.210 -8.561 -4.497
19 HB3 SER 4 1HB SER 4 -7.688 -6.902 -4.204
20 HG SER 4 HG SER 4 -5.627 -7.741 -5.194
21 H ALA 5 H ALA 5 -8.186 -10.298 -2.625
22 HA ALA 5 HA ALA 5 -9.443 -8.982 -0.352
23 HB1 ALA 5 1HB ALA 5 -10.974 -9.874 -2.049
24 HB2 ALA 5 2HB ALA 5 -11.150 -10.762 -0.535
25 HB3 ALA 5 3HB ALA 5 -10.247 -11.468 -1.875
26 H GLY 6 H GLY 6 -8.300 -9.304 1.402
27 HA2 GLY 6 2HA GLY 6 -8.072 -11.381 2.970
28 HA3 GLY 6 1HA GLY 6 -6.841 -11.796 1.772
29 H THR 7 H THR 7 -6.123 -9.089 1.211
30 HA THR 7 HA THR 7 -5.269 -7.971 3.733
31 HB THR 7 HB THR 7 -3.317 -8.536 1.473
32 HG1 THR 7 1HG THR 7 -4.187 -10.084 3.448
33 HG21 THR 7 3HG2 THR 7 -1.621 -7.711 3.061
34 HG22 THR 7 1HG2 THR 7 -2.879 -7.407 4.259
35 HG23 THR 7 2HG2 THR 7 -2.841 -6.474 2.767
36 H SER 8 H SER 8 -5.962 -5.948 3.597
37 HA SER 8 HA SER 8 -5.659 -4.576 1.015
38 HB2 SER 8 2HB SER 8 -7.821 -4.003 3.073
39 HB3 SER 8 1HB SER 8 -7.636 -3.300 1.477
40 HG SER 8 HG SER 8 -8.271 -5.998 2.085
41 H VAL 9 H VAL 9 -4.844 -2.403 1.176
42 HA VAL 9 HA VAL 9 -4.381 -1.492 3.828
43 HB VAL 9 HB VAL 9 -2.268 -2.521 3.323
44 HG11 VAL 9 1HG1 VAL 9 -0.940 -1.987 1.334
45 HG12 VAL 9 2HG1 VAL 9 -2.319 -1.035 0.762
46 HG13 VAL 9 3HG1 VAL 9 -2.479 -2.781 0.943
47 HG21 VAL 9 3HG2 VAL 9 -0.714 -0.609 3.314
48 HG22 VAL 9 1HG2 VAL 9 -2.075 -0.359 4.409
49 HG23 VAL 9 2HG2 VAL 9 -2.044 0.446 2.839
50 H THR 10 H THR 10 -5.123 0.357 4.019
51 HA THR 10 HA THR 10 -5.952 1.794 1.612
52 HB THR 10 HB THR 10 -7.287 1.591 4.311
53 HG1 THR 10 1HG THR 10 -8.188 -0.113 3.580
54 HG21 THR 10 3HG2 THR 10 -8.272 2.744 1.691
55 HG22 THR 10 1HG2 THR 10 -7.807 3.682 3.112
56 HG23 THR 10 2HG2 THR 10 -9.208 2.609 3.178
57 H LEU 11 H LEU 11 -5.298 3.804 1.487
58 HA LEU 11 HA LEU 11 -4.144 5.005 3.853
59 HB2 LEU 11 2HB LEU 11 -3.138 6.681 2.300
60 HB3 LEU 11 1HB LEU 11 -2.607 5.048 2.027
61 HG LEU 11 HG LEU 11 -4.335 5.013 0.127
62 HD11 LEU 11 1HD1 LEU 11 -4.813 7.133 -0.958
63 HD12 LEU 11 2HD1 LEU 11 -4.017 8.000 0.332
64 HD13 LEU 11 3HD1 LEU 11 -5.509 7.104 0.666
65 HD21 LEU 11 3HD2 LEU 11 -1.843 6.681 -0.054
66 HD22 LEU 11 1HD2 LEU 11 -2.702 5.997 -1.434
67 HD23 LEU 11 2HD2 LEU 11 -1.969 4.932 -0.239
68 H GLN 12 H GLN 12 -5.016 6.646 4.809
69 HA GLN 12 HA GLN 12 -7.609 7.571 3.844
70 HB2 GLN 12 2HB GLN 12 -6.290 7.752 6.516
71 HB3 GLN 12 1HB GLN 12 -7.802 8.542 6.114
72 HG2 GLN 12 2HG GLN 12 -8.681 6.263 5.528
73 HG3 GLN 12 1HG GLN 12 -7.215 5.622 6.273
74 HE21 GLN 12 1HE2 GLN 12 -10.053 7.490 6.787
75 HE22 GLN 12 2HE2 GLN 12 -10.132 7.285 8.505
76 H LEU 13 H LEU 13 -7.824 9.447 3.007
77 HA LEU 13 HA LEU 13 -5.741 11.479 3.392
78 HB2 LEU 13 2HB LEU 13 -5.321 10.378 1.302
79 HB3 LEU 13 1HB LEU 13 -7.007 10.502 0.849
80 HG LEU 13 HG LEU 13 -6.710 12.985 0.951
81 HD11 LEU 13 1HD1 LEU 13 -4.634 13.107 2.186
82 HD12 LEU 13 2HD1 LEU 13 -4.440 13.865 0.606
83 HD13 LEU 13 3HD1 LEU 13 -3.786 12.254 0.896
84 HD21 LEU 13 3HD2 LEU 13 -5.223 11.422 -1.147
85 HD22 LEU 13 1HD2 LEU 13 -5.772 13.089 -1.318
86 HD23 LEU 13 2HD2 LEU 13 -6.950 11.792 -1.129
87 H ASP 14 H ASP 14 -6.892 13.105 4.408
88 HA ASP 14 HA ASP 14 -9.589 13.470 3.466
89 HB2 ASP 14 2HB ASP 14 -9.306 13.695 5.892
90 HB3 ASP 14 1HB ASP 14 -8.162 15.014 5.643
91 H ASP 15 H ASP 15 -9.607 14.209 1.656
92 HA ASP 15 HA ASP 15 -7.915 16.412 0.874
93 HB2 ASP 15 2HB ASP 15 -8.093 14.448 -0.615
94 HB3 ASP 15 1HB ASP 15 -9.824 14.677 -0.734
95 H GLY 16 H GLY 16 -10.539 16.248 2.628
96 HA2 GLY 16 2HA GLY 16 -11.702 18.354 3.024
97 HA3 GLY 16 1HA GLY 16 -11.978 18.440 1.289
98 H SER 17 H SER 17 -12.268 15.370 1.582
99 HA SER 17 HA SER 17 -14.994 15.335 2.671
100 HB2 SER 17 2HB SER 17 -14.198 14.152 0.014
101 HB3 SER 17 1HB SER 17 -15.818 14.173 0.710
102 HG SER 17 HG SER 17 -14.335 16.187 -0.477
103 H GLY 18 H GLY 18 -12.124 14.167 3.285
104 HA2 GLY 18 2HA GLY 18 -11.180 12.240 4.053
105 HA3 GLY 18 1HA GLY 18 -12.801 11.858 4.585
106 H ARG 19 H ARG 19 -10.457 11.421 1.996
107 HA ARG 19 HA ARG 19 -12.160 9.347 0.857
108 HB2 ARG 19 2HB ARG 19 -9.781 10.789 -0.277
109 HB3 ARG 19 1HB ARG 19 -10.358 9.252 -0.908
110 HG2 ARG 19 2HG ARG 19 -12.551 10.301 -1.353
111 HG3 ARG 19 1HG ARG 19 -11.893 11.844 -0.804
112 HD2 ARG 19 2HD ARG 19 -10.293 11.880 -2.580
113 HD3 ARG 19 1HD ARG 19 -10.691 10.227 -3.052
114 HE ARG 19 HE ARG 19 -12.955 11.909 -3.143
115 HH11 ARG 19 1HH1 ARG 19 -9.990 11.270 -4.992
116 HH12 ARG 19 2HH1 ARG 19 -10.704 11.569 -6.505
117 HH21 ARG 19 1HH2 ARG 19 -13.916 12.367 -5.241
118 HH22 ARG 19 2HH2 ARG 19 -12.943 12.234 -6.645
119 H THR 20 H THR 20 -11.488 7.304 0.645
120 HA THR 20 HA THR 20 -9.000 6.589 1.976
121 HB THR 20 HB THR 20 -10.122 4.525 2.722
122 HG1 THR 20 1HG THR 20 -12.456 5.788 1.599
123 HG21 THR 20 3HG2 THR 20 -10.084 6.498 4.192
124 HG22 THR 20 1HG2 THR 20 -11.552 5.536 4.463
125 HG23 THR 20 2HG2 THR 20 -11.606 7.019 3.497
126 H TYR 21 H TYR 21 -7.734 5.194 0.825
127 HA TYR 21 HA TYR 21 -8.795 4.180 -1.717
128 HB2 TYR 21 2HB TYR 21 -7.840 6.261 -2.343
129 HB3 TYR 21 1HB TYR 21 -6.433 5.997 -1.332
130 HD1 TYR 21 1HD TYR 21 -8.109 4.810 -4.449
131 HD2 TYR 21 2HD TYR 21 -4.471 5.080 -2.248
132 HE1 TYR 21 1HE TYR 21 -6.852 4.025 -6.421
133 HE2 TYR 21 2HE TYR 21 -3.219 4.300 -4.200
134 HH TYR 21 HH TYR 21 -3.660 2.974 -6.212
135 H GLN 22 H GLN 22 -8.157 2.160 -2.163
136 HA GLN 22 HA GLN 22 -6.293 0.790 -0.444
137 HB2 GLN 22 2HB GLN 22 -7.860 -0.064 -2.863
138 HB3 GLN 22 1HB GLN 22 -6.551 -1.054 -2.262
139 HG2 GLN 22 2HG GLN 22 -8.613 -1.916 -1.443
140 HG3 GLN 22 1HG GLN 22 -7.693 -1.195 -0.120
141 HE21 GLN 22 1HE2 GLN 22 -8.556 0.415 1.010
142 HE22 GLN 22 2HE2 GLN 22 -10.120 1.090 0.715
143 H LEU 23 H LEU 23 -4.287 0.354 -0.821
144 HA LEU 23 HA LEU 23 -2.863 1.658 -2.907
145 HB2 LEU 23 2HB LEU 23 -2.164 -0.436 -0.944
146 HB3 LEU 23 1HB LEU 23 -0.995 0.024 -2.114
147 HG LEU 23 HG LEU 23 -2.199 1.822 0.014
148 HD11 LEU 23 1HD1 LEU 23 0.589 0.755 -0.377
149 HD12 LEU 23 2HD1 LEU 23 -0.560 0.223 0.851
150 HD13 LEU 23 3HD1 LEU 23 0.077 1.871 0.891
151 HD21 LEU 23 3HD2 LEU 23 -0.538 3.487 -0.774
152 HD22 LEU 23 1HD2 LEU 23 -1.782 3.140 -1.979
153 HD23 LEU 23 2HD2 LEU 23 -0.178 2.432 -2.136
154 H ARG 24 H ARG 24 -2.109 0.901 -4.787
155 HA ARG 24 HA ARG 24 -3.050 -1.752 -5.504
156 HB2 ARG 24 2HB ARG 24 -2.387 0.565 -7.332
157 HB3 ARG 24 1HB ARG 24 -2.877 -1.038 -7.865
158 HG2 ARG 24 2HG ARG 24 -4.533 0.998 -6.387
159 HG3 ARG 24 1HG ARG 24 -4.800 0.338 -8.000
160 HD2 ARG 24 2HD ARG 24 -5.058 -1.113 -5.358
161 HD3 ARG 24 1HD ARG 24 -6.352 -0.687 -6.466
162 HE ARG 24 HE ARG 24 -5.249 -2.245 -8.074
163 HH11 ARG 24 1HH1 ARG 24 -4.792 -2.733 -4.554
164 HH12 ARG 24 2HH1 ARG 24 -4.622 -4.415 -4.708
165 HH21 ARG 24 1HH2 ARG 24 -4.928 -4.555 -8.214
166 HH22 ARG 24 2HH2 ARG 24 -4.681 -5.465 -6.791
167 H GLU 25 H GLU 25 -1.712 -3.062 -6.778
168 HA GLU 25 HA GLU 25 0.835 -3.309 -5.650
169 HB2 GLU 25 2HB GLU 25 1.152 -5.131 -7.266
170 HB3 GLU 25 1HB GLU 25 -0.370 -5.241 -6.401
171 HG2 GLU 25 2HG GLU 25 -1.550 -4.361 -8.340
172 HG3 GLU 25 1HG GLU 25 -0.022 -4.204 -9.203
173 H GLY 26 H GLY 26 2.791 -2.817 -6.281
174 HA2 GLY 26 2HA GLY 26 4.385 -2.152 -7.980
175 HA3 GLY 26 1HA GLY 26 3.081 -1.230 -8.745
176 H SER 27 H SER 27 4.663 0.630 -8.426
177 HA SER 27 HA SER 27 4.421 1.395 -5.671
178 HB2 SER 27 2HB SER 27 6.264 3.043 -6.139
179 HB3 SER 27 1HB SER 27 6.705 1.343 -6.243
180 HG SER 27 HG SER 27 7.544 2.446 -8.013
181 H ASN 28 H ASN 28 3.435 3.049 -5.023
182 HA ASN 28 HA ASN 28 1.811 4.559 -6.932
183 HB2 ASN 28 2HB ASN 28 1.524 4.169 -3.921
184 HB3 ASN 28 1HB ASN 28 0.410 5.076 -4.936
185 HD21 ASN 28 1HD2 ASN 28 1.590 1.894 -4.099
186 HD22 ASN 28 2HD2 ASN 28 0.327 0.985 -4.822
187 H ILE 29 H ILE 29 2.802 6.354 -7.417
188 HA ILE 29 HA ILE 29 4.723 7.482 -5.540
189 HB ILE 29 HB ILE 29 4.285 8.024 -8.474
190 HG12 ILE 29 2HG1 ILE 29 6.407 6.402 -7.047
191 HG13 ILE 29 1HG1 ILE 29 5.117 5.775 -8.059
192 HG21 ILE 29 1HG2 ILE 29 6.370 9.247 -8.418
193 HG22 ILE 29 2HG2 ILE 29 6.560 8.934 -6.693
194 HG23 ILE 29 3HG2 ILE 29 5.245 9.968 -7.264
195 HD11 ILE 29 3HD1 ILE 29 7.209 5.768 -9.253
196 HD12 ILE 29 1HD1 ILE 29 7.412 7.496 -8.958
197 HD13 ILE 29 2HD1 ILE 29 6.103 6.932 -9.986
198 H ILE 30 H ILE 30 4.391 9.307 -4.552
199 HA ILE 30 HA ILE 30 2.062 10.927 -5.204
200 HB ILE 30 HB ILE 30 3.791 10.827 -2.705
201 HG12 ILE 30 2HG1 ILE 30 0.956 9.847 -3.189
202 HG13 ILE 30 1HG1 ILE 30 2.377 8.856 -2.925
203 HG21 ILE 30 1HG2 ILE 30 3.039 13.063 -2.979
204 HG22 ILE 30 2HG2 ILE 30 2.088 12.324 -1.691
205 HG23 ILE 30 3HG2 ILE 30 1.392 12.540 -3.301
206 HD11 ILE 30 3HD1 ILE 30 1.130 10.721 -0.915
207 HD12 ILE 30 1HD1 ILE 30 2.567 9.734 -0.647
208 HD13 ILE 30 2HD1 ILE 30 1.008 8.962 -0.931
209 H GLY 31 H GLY 31 2.432 12.737 -6.253
210 HA2 GLY 31 2HA GLY 31 4.117 14.749 -5.702
211 HA3 GLY 31 1HA GLY 31 5.065 13.707 -6.788
212 H ARG 32 H ARG 32 4.765 15.881 -7.966
213 HA ARG 32 HA ARG 32 2.232 15.707 -9.453
214 HB2 ARG 32 2HB ARG 32 3.969 18.125 -8.914
215 HB3 ARG 32 1HB ARG 32 2.515 18.125 -9.905
216 HG2 ARG 32 2HG ARG 32 1.175 17.485 -7.941
217 HG3 ARG 32 1HG ARG 32 2.636 17.402 -6.998
218 HD2 ARG 32 2HD ARG 32 1.418 19.492 -6.593
219 HD3 ARG 32 1HD ARG 32 3.040 19.754 -7.215
220 HE ARG 32 HE ARG 32 1.458 19.806 -9.418
221 HH11 ARG 32 1HH1 ARG 32 1.318 21.532 -6.298
222 HH12 ARG 32 2HH1 ARG 32 0.789 22.985 -6.969
223 HH21 ARG 32 1HH2 ARG 32 0.733 21.848 -10.329
224 HH22 ARG 32 2HH2 ARG 32 0.474 23.183 -9.297
225 H GLY 33 H GLY 33 2.687 14.582 -11.218
226 HA2 GLY 33 2HA GLY 33 4.122 15.661 -13.295
227 HA3 GLY 33 1HA GLY 33 5.167 14.485 -12.497
228 H GLN 34 H GLN 34 4.624 13.861 -14.945
229 HA GLN 34 HA GLN 34 2.276 12.200 -15.196
230 HB2 GLN 34 2HB GLN 34 4.730 12.498 -16.938
231 HB3 GLN 34 1HB GLN 34 3.351 11.490 -17.347
232 HG2 GLN 34 2HG GLN 34 1.924 13.425 -17.483
233 HG3 GLN 34 1HG GLN 34 3.230 14.466 -16.920
234 HE21 GLN 34 1HE2 GLN 34 1.679 14.507 -19.426
235 HE22 GLN 34 2HE2 GLN 34 2.859 14.444 -20.678
236 H ASP 35 H ASP 35 5.422 11.914 -13.980
237 HA ASP 35 HA ASP 35 5.626 9.031 -14.226
238 HB2 ASP 35 2HB ASP 35 7.643 10.486 -14.281
239 HB3 ASP 35 1HB ASP 35 7.308 10.984 -12.632
240 H ALA 36 H ALA 36 4.383 11.297 -12.027
241 HA ALA 36 HA ALA 36 4.275 9.552 -9.727
242 HB1 ALA 36 1HB ALA 36 3.094 11.392 -8.677
243 HB2 ALA 36 2HB ALA 36 3.005 12.234 -10.221
244 HB3 ALA 36 3HB ALA 36 4.569 11.962 -9.455
245 H GLN 37 H GLN 37 2.207 9.091 -8.674
246 HA GLN 37 HA GLN 37 0.155 8.415 -10.631
247 HB2 GLN 37 2HB GLN 37 0.776 7.332 -7.881
248 HB3 GLN 37 1HB GLN 37 -0.626 6.875 -8.834
249 HG2 GLN 37 2HG GLN 37 2.252 6.420 -9.600
250 HG3 GLN 37 1HG GLN 37 1.155 5.203 -8.958
251 HE21 GLN 37 1HE2 GLN 37 2.571 5.267 -11.470
252 HE22 GLN 37 2HE2 GLN 37 1.393 5.142 -12.710
253 H PHE 38 H PHE 38 0.569 9.444 -7.273
254 HA PHE 38 HA PHE 38 -2.039 10.757 -7.384
255 HB2 PHE 38 2HB PHE 38 -1.902 9.205 -5.540
256 HB3 PHE 38 1HB PHE 38 -0.342 9.844 -5.048
257 HD1 PHE 38 2HD PHE 38 -3.908 10.870 -5.448
258 HD2 PHE 38 1HD PHE 38 -0.228 11.466 -3.409
259 HE1 PHE 38 2HE PHE 38 -5.000 12.454 -3.919
260 HE2 PHE 38 1HE PHE 38 -1.284 13.016 -1.897
261 HZ PHE 38 HZ PHE 38 -3.689 13.541 -2.135
262 H ARG 39 H ARG 39 -2.167 12.882 -7.288
263 HA ARG 39 HA ARG 39 0.364 14.340 -7.139
264 HB2 ARG 39 2HB ARG 39 -2.222 15.060 -8.512
265 HB3 ARG 39 1HB ARG 39 -0.754 16.028 -8.500
266 HG2 ARG 39 2HG ARG 39 0.434 14.342 -9.739
267 HG3 ARG 39 1HG ARG 39 -0.940 13.249 -9.627
268 HD2 ARG 39 2HD ARG 39 -0.923 15.906 -11.051
269 HD3 ARG 39 1HD ARG 39 -0.794 14.324 -11.819
270 HE ARG 39 HE ARG 39 -3.151 14.968 -10.191
271 HH11 ARG 39 1HH1 ARG 39 -1.777 14.182 -13.359
272 HH12 ARG 39 2HH1 ARG 39 -3.288 13.893 -14.085
273 HH21 ARG 39 1HH2 ARG 39 -5.202 14.637 -11.200
274 HH22 ARG 39 2HH2 ARG 39 -5.281 14.234 -12.862
275 H LEU 40 H LEU 40 0.603 15.794 -5.590
276 HA LEU 40 HA LEU 40 -1.475 16.182 -3.653
277 HB2 LEU 40 2HB LEU 40 1.323 17.245 -3.881
278 HB3 LEU 40 1HB LEU 40 0.227 17.781 -2.620
279 HG LEU 40 HG LEU 40 1.214 14.952 -3.015
280 HD11 LEU 40 1HD1 LEU 40 2.487 15.384 -0.989
281 HD12 LEU 40 2HD1 LEU 40 1.880 17.042 -0.960
282 HD13 LEU 40 3HD1 LEU 40 2.948 16.516 -2.267
283 HD21 LEU 40 3HD2 LEU 40 0.183 14.542 -0.840
284 HD22 LEU 40 1HD2 LEU 40 -1.028 15.057 -2.012
285 HD23 LEU 40 2HD2 LEU 40 -0.431 16.193 -0.807
286 HA PRO 41 HA PRO 41 -2.892 19.998 -5.467
287 HB2 PRO 41 2HB PRO 41 -4.701 20.654 -3.625
288 HB3 PRO 41 1HB PRO 41 -4.916 19.192 -4.595
289 HG2 PRO 41 2HG PRO 41 -3.996 19.470 -1.765
290 HG3 PRO 41 1HG PRO 41 -5.024 18.226 -2.492
291 HD2 PRO 41 2HD PRO 41 -2.280 18.010 -1.983
292 HD3 PRO 41 1HD PRO 41 -3.213 16.940 -3.034
293 H ASP 42 H ASP 42 -0.470 19.991 -3.755
294 HA ASP 42 HA ASP 42 -0.609 22.696 -2.625
295 HB2 ASP 42 2HB ASP 42 -0.851 20.780 -0.856
296 HB3 ASP 42 1HB ASP 42 0.827 20.433 -1.286
297 H THR 43 H THR 43 1.945 23.076 -1.930
298 HA THR 43 HA THR 43 3.463 22.348 -4.313
299 HB THR 43 HB THR 43 2.742 24.720 -4.234
300 HG1 THR 43 1HG THR 43 4.688 25.609 -4.736
301 HG21 THR 43 3HG2 THR 43 2.705 25.096 -1.852
302 HG22 THR 43 1HG2 THR 43 3.781 26.272 -2.605
303 HG23 THR 43 2HG2 THR 43 4.455 24.884 -1.754
304 H GLY 44 H GLY 44 5.959 22.902 -3.663
305 HA2 GLY 44 2HA GLY 44 7.751 22.447 -2.194
306 HA3 GLY 44 1HA GLY 44 6.581 22.026 -0.947
307 H VAL 45 H VAL 45 5.882 20.676 -3.843
308 HA VAL 45 HA VAL 45 6.941 18.062 -3.043
309 HB VAL 45 HB VAL 45 4.538 18.169 -2.719
310 HG11 VAL 45 1HG1 VAL 45 4.327 19.058 -5.574
311 HG12 VAL 45 2HG1 VAL 45 3.978 20.014 -4.134
312 HG13 VAL 45 3HG1 VAL 45 2.970 18.626 -4.538
313 HG21 VAL 45 3HG2 VAL 45 5.287 16.582 -5.162
314 HG22 VAL 45 1HG2 VAL 45 3.732 16.434 -4.324
315 HG23 VAL 45 2HG2 VAL 45 5.211 16.052 -3.471
316 H SER 46 H SER 46 8.031 16.932 -4.587
317 HA SER 46 HA SER 46 8.645 18.216 -7.118
318 HB2 SER 46 2HB SER 46 9.685 15.624 -5.934
319 HB3 SER 46 1HB SER 46 10.427 16.602 -7.206
320 HG SER 46 HG SER 46 11.285 16.837 -5.020
321 H ARG 47 H ARG 47 9.046 15.902 -8.796
322 HA ARG 47 HA ARG 47 6.296 15.142 -9.203
323 HB2 ARG 47 2HB ARG 47 7.008 13.865 -11.183
324 HB3 ARG 47 1HB ARG 47 7.664 15.488 -11.231
325 HG2 ARG 47 2HG ARG 47 9.832 14.678 -10.642
326 HG3 ARG 47 1HG ARG 47 9.205 13.041 -10.391
327 HD2 ARG 47 2HD ARG 47 8.564 12.939 -12.738
328 HD3 ARG 47 1HD ARG 47 9.165 14.581 -12.985
329 HE ARG 47 HE ARG 47 11.275 13.213 -11.982
330 HH11 ARG 47 1HH1 ARG 47 9.141 12.673 -14.771
331 HH12 ARG 47 2HH1 ARG 47 10.357 11.980 -15.742
332 HH21 ARG 47 1HH2 ARG 47 12.932 12.271 -13.318
333 HH22 ARG 47 2HH2 ARG 47 12.571 11.789 -14.911
334 H ARG 48 H ARG 48 9.149 13.792 -7.871
335 HA ARG 48 HA ARG 48 7.485 11.686 -6.765
336 HB2 ARG 48 2HB ARG 48 10.441 11.619 -7.380
337 HB3 ARG 48 1HB ARG 48 9.639 10.464 -6.334
338 HG2 ARG 48 2HG ARG 48 8.205 9.834 -8.240
339 HG3 ARG 48 1HG ARG 48 9.186 10.847 -9.294
340 HD2 ARG 48 2HD ARG 48 11.171 9.546 -8.613
341 HD3 ARG 48 1HD ARG 48 10.140 8.534 -7.605
342 HE ARG 48 HE ARG 48 9.455 8.721 -10.417
343 HH11 ARG 48 1HH1 ARG 48 10.692 6.680 -7.746
344 HH12 ARG 48 2HH1 ARG 48 10.898 5.324 -8.736
345 HH21 ARG 48 1HH2 ARG 48 9.677 6.847 -11.700
346 HH22 ARG 48 2HH2 ARG 48 10.303 5.397 -11.049
347 H HIS 49 H HIS 49 6.972 12.408 -4.935
348 HA HIS 49 HA HIS 49 8.924 13.850 -3.282
349 HB2 HIS 49 2HB HIS 49 6.853 15.028 -3.610
350 HB3 HIS 49 1HB HIS 49 5.904 13.627 -3.117
351 HD2 HIS 49 2HD HIS 49 6.133 13.039 -0.302
352 HE1 HIS 49 1HE HIS 49 7.326 16.964 0.639
353 HE2 HIS 49 2HE HIS 49 6.919 14.632 1.518
354 H LEU 50 H LEU 50 6.817 11.116 -3.525
355 HA LEU 50 HA LEU 50 8.371 9.604 -1.747
356 HB2 LEU 50 2HB LEU 50 7.170 10.876 -0.075
357 HB3 LEU 50 1HB LEU 50 5.639 10.572 -0.843
358 HG LEU 50 HG LEU 50 7.211 8.250 0.220
359 HD11 LEU 50 1HD1 LEU 50 6.159 8.613 2.410
360 HD12 LEU 50 2HD1 LEU 50 5.439 10.110 1.822
361 HD13 LEU 50 3HD1 LEU 50 7.190 9.980 1.998
362 HD21 LEU 50 3HD2 LEU 50 4.270 8.907 0.100
363 HD22 LEU 50 1HD2 LEU 50 4.962 7.374 0.615
364 HD23 LEU 50 2HD2 LEU 50 5.130 7.896 -1.060
365 H GLU 51 H GLU 51 7.947 7.487 -2.061
366 HA GLU 51 HA GLU 51 5.722 6.834 -3.803
367 HB2 GLU 51 2HB GLU 51 7.312 5.187 -4.937
368 HB3 GLU 51 1HB GLU 51 7.437 6.880 -5.374
369 HG2 GLU 51 2HG GLU 51 9.350 7.075 -3.791
370 HG3 GLU 51 1HG GLU 51 9.222 5.352 -3.491
371 H ILE 52 H ILE 52 4.602 5.185 -3.227
372 HA ILE 52 HA ILE 52 5.591 3.541 -1.011
373 HB ILE 52 HB ILE 52 2.759 3.936 -2.012
374 HG12 ILE 52 2HG1 ILE 52 4.060 4.920 0.540
375 HG13 ILE 52 1HG1 ILE 52 3.702 5.924 -0.860
376 HG21 ILE 52 1HG2 ILE 52 3.117 1.729 -1.113
377 HG22 ILE 52 2HG2 ILE 52 2.095 2.663 -0.013
378 HG23 ILE 52 3HG2 ILE 52 3.805 2.400 0.365
379 HD11 ILE 52 3HD1 ILE 52 1.685 4.493 0.858
380 HD12 ILE 52 1HD1 ILE 52 1.315 5.512 -0.534
381 HD13 ILE 52 2HD1 ILE 52 2.054 6.218 0.905
382 H ARG 53 H ARG 53 6.448 1.719 -1.760
383 HA ARG 53 HA ARG 53 5.354 0.573 -4.196
384 HB2 ARG 53 2HB ARG 53 7.759 0.556 -4.195
385 HB3 ARG 53 1HB ARG 53 7.817 -0.210 -2.611
386 HG2 ARG 53 2HG ARG 53 6.740 -2.212 -3.553
387 HG3 ARG 53 1HG ARG 53 6.733 -1.448 -5.136
388 HD2 ARG 53 2HD ARG 53 9.125 -1.462 -5.204
389 HD3 ARG 53 1HD ARG 53 9.213 -2.029 -3.532
390 HE ARG 53 HE ARG 53 7.932 -4.032 -4.436
391 HH11 ARG 53 1HH1 ARG 53 10.332 -2.293 -6.416
392 HH12 ARG 53 2HH1 ARG 53 10.741 -3.675 -7.317
393 HH21 ARG 53 1HH2 ARG 53 8.474 -5.852 -5.660
394 HH22 ARG 53 2HH2 ARG 53 9.637 -5.758 -6.908
395 H TRP 54 H TRP 54 3.680 -0.589 -3.963
396 HA TRP 54 HA TRP 54 3.410 -2.107 -1.549
397 HB2 TRP 54 2HB TRP 54 1.454 -0.831 -2.047
398 HB3 TRP 54 1HB TRP 54 1.468 -1.364 -3.728
399 HD1 TRP 54 HD TRP 54 -0.501 -3.005 -4.090
400 HE1 TRP 54 1HE TRP 54 -1.610 -4.937 -2.770
401 HE3 TRP 54 3HE TRP 54 2.218 -2.751 0.224
402 HZ2 TRP 54 2HZ TRP 54 -1.373 -6.168 -0.272
403 HZ3 TRP 54 3HZ TRP 54 1.714 -4.343 2.029
404 HH2 TRP 54 HH TRP 54 -0.045 -6.012 1.788
405 H ASP 55 H ASP 55 4.307 -3.921 -1.604
406 HA ASP 55 HA ASP 55 4.343 -5.529 -4.062
407 HB2 ASP 55 2HB ASP 55 6.567 -4.670 -3.060
408 HB3 ASP 55 1HB ASP 55 6.222 -5.703 -1.683
409 H GLY 56 H GLY 56 3.888 -7.831 -3.605
410 HA2 GLY 56 2HA GLY 56 1.867 -8.117 -1.586
411 HA3 GLY 56 1HA GLY 56 2.407 -9.361 -2.698
412 H GLN 57 H GLN 57 3.795 -7.498 -0.093
413 HA GLN 57 HA GLN 57 4.383 -9.791 1.536
414 HB2 GLN 57 2HB GLN 57 6.258 -9.768 -0.144
415 HB3 GLN 57 1HB GLN 57 6.670 -8.151 0.400
416 HG2 GLN 57 2HG GLN 57 7.201 -9.020 2.612
417 HG3 GLN 57 1HG GLN 57 6.741 -10.643 2.096
418 HE21 GLN 57 1HE2 GLN 57 9.169 -8.174 1.942
419 HE22 GLN 57 2HE2 GLN 57 10.352 -9.117 1.137
420 H VAL 58 H VAL 58 5.502 -6.454 0.895
421 HA VAL 58 HA VAL 58 4.402 -5.565 3.416
422 HB VAL 58 HB VAL 58 6.494 -4.298 3.976
423 HG11 VAL 58 1HG1 VAL 58 6.032 -6.348 5.169
424 HG12 VAL 58 2HG1 VAL 58 7.768 -6.166 4.908
425 HG13 VAL 58 3HG1 VAL 58 6.839 -7.287 3.915
426 HG21 VAL 58 3HG2 VAL 58 7.773 -6.032 1.858
427 HG22 VAL 58 1HG2 VAL 58 8.637 -4.973 2.972
428 HG23 VAL 58 2HG2 VAL 58 7.544 -4.288 1.769
429 H ALA 59 H ALA 59 4.209 -3.278 3.500
430 HA ALA 59 HA ALA 59 4.060 -2.026 0.878
431 HB1 ALA 59 1HB ALA 59 2.062 -1.865 2.268
432 HB2 ALA 59 2HB ALA 59 2.787 -0.265 2.103
433 HB3 ALA 59 3HB ALA 59 3.022 -1.204 3.587
434 H LEU 60 H LEU 60 5.932 -1.252 0.325
435 HA LEU 60 HA LEU 60 7.826 -0.339 2.297
436 HB2 LEU 60 2HB LEU 60 8.494 -1.863 0.496
437 HB3 LEU 60 1HB LEU 60 8.000 -0.696 -0.696
438 HG LEU 60 HG LEU 60 10.286 -0.154 1.221
439 HD11 LEU 60 1HD1 LEU 60 11.768 -0.923 -0.584
440 HD12 LEU 60 2HD1 LEU 60 10.347 -1.436 -1.503
441 HD13 LEU 60 3HD1 LEU 60 10.743 -2.228 0.021
442 HD21 LEU 60 3HD2 LEU 60 11.007 1.380 -0.559
443 HD22 LEU 60 1HD2 LEU 60 9.378 1.782 -0.002
444 HD23 LEU 60 2HD2 LEU 60 9.597 0.916 -1.518
445 H LEU 61 H LEU 61 7.853 1.659 2.931
446 HA LEU 61 HA LEU 61 6.676 3.756 1.292
447 HB2 LEU 61 2HB LEU 61 5.829 3.400 3.532
448 HB3 LEU 61 1HB LEU 61 7.388 3.537 4.251
449 HG LEU 61 HG LEU 61 5.965 5.476 4.708
450 HD11 LEU 61 1HD1 LEU 61 8.196 6.291 2.874
451 HD12 LEU 61 2HD1 LEU 61 8.313 5.983 4.607
452 HD13 LEU 61 3HD1 LEU 61 7.354 7.339 4.017
453 HD21 LEU 61 3HD2 LEU 61 5.899 5.906 1.746
454 HD22 LEU 61 1HD2 LEU 61 5.174 6.952 2.963
455 HD23 LEU 61 2HD2 LEU 61 4.560 5.314 2.730
456 H ALA 62 H ALA 62 8.111 4.918 0.104
457 HA ALA 62 HA ALA 62 10.749 5.385 1.271
458 HB1 ALA 62 1HB ALA 62 10.942 3.770 -0.555
459 HB2 ALA 62 2HB ALA 62 11.710 5.302 -0.982
460 HB3 ALA 62 3HB ALA 62 10.125 4.890 -1.641
461 H ASP 63 H ASP 63 11.068 7.400 1.606
462 HA ASP 63 HA ASP 63 9.415 9.492 0.458
463 HB2 ASP 63 2HB ASP 63 9.841 9.679 2.814
464 HB3 ASP 63 1HB ASP 63 11.562 9.417 2.556
465 H LEU 64 H LEU 64 10.151 11.008 -0.962
466 HA LEU 64 HA LEU 64 12.940 10.791 -1.871
467 HB2 LEU 64 2HB LEU 64 11.056 9.602 -3.252
468 HB3 LEU 64 1HB LEU 64 10.565 11.214 -3.680
469 HG LEU 64 HG LEU 64 11.730 10.315 -5.479
470 HD11 LEU 64 1HD1 LEU 64 13.671 11.767 -5.819
471 HD12 LEU 64 2HD1 LEU 64 13.601 12.216 -4.112
472 HD13 LEU 64 3HD1 LEU 64 12.257 12.610 -5.184
473 HD21 LEU 64 3HD2 LEU 64 14.038 9.437 -5.368
474 HD22 LEU 64 1HD2 LEU 64 12.882 8.491 -4.432
475 HD23 LEU 64 2HD2 LEU 64 13.980 9.598 -3.611
476 H ASN 65 H ASN 65 12.926 12.782 -0.294
477 HA ASN 65 HA ASN 65 12.739 15.130 -1.903
478 HB2 ASN 65 2HB ASN 65 10.332 14.689 -0.976
479 HB3 ASN 65 1HB ASN 65 11.009 15.232 0.559
480 HD21 ASN 65 1HD2 ASN 65 10.105 16.124 -2.615
481 HD22 ASN 65 2HD2 ASN 65 10.225 17.840 -2.417
482 H SER 66 H SER 66 13.806 16.901 -0.942
483 HA SER 66 HA SER 66 15.476 16.096 1.328
484 HB2 SER 66 2HB SER 66 16.001 18.189 -0.791
485 HB3 SER 66 1HB SER 66 17.142 17.604 0.422
486 HG SER 66 HG SER 66 16.845 15.512 -0.487
487 H THR 67 H THR 67 13.307 18.561 0.147
488 HA THR 67 HA THR 67 13.869 20.421 2.304
489 HB THR 67 HB THR 67 12.052 20.405 -0.081
490 HG1 THR 67 1HG THR 67 14.535 21.482 0.502
491 HG21 THR 67 3HG2 THR 67 10.826 21.661 1.533
492 HG22 THR 67 1HG2 THR 67 11.549 22.816 0.428
493 HG23 THR 67 2HG2 THR 67 12.256 22.582 2.040
494 H ASN 68 H ASN 68 11.076 18.703 1.081
495 HA ASN 68 HA ASN 68 9.548 19.365 3.477
496 HB2 ASN 68 2HB ASN 68 8.875 20.310 1.308
497 HB3 ASN 68 1HB ASN 68 8.772 18.697 0.637
498 HD21 ASN 68 1HD2 ASN 68 6.777 19.267 0.057
499 HD22 ASN 68 2HD2 ASN 68 5.393 19.231 1.114
500 H GLY 69 H GLY 69 11.471 17.230 3.161
501 HA2 GLY 69 2HA GLY 69 10.674 14.677 2.643
502 HA3 GLY 69 1HA GLY 69 11.747 15.112 3.962
503 H THR 70 H THR 70 9.588 13.116 3.561
504 HA THR 70 HA THR 70 7.406 13.867 5.243
505 HB THR 70 HB THR 70 8.085 11.205 4.023
506 HG1 THR 70 1HG THR 70 8.174 12.512 2.351
507 HG21 THR 70 3HG2 THR 70 6.209 11.167 5.544
508 HG22 THR 70 1HG2 THR 70 5.616 11.032 3.895
509 HG23 THR 70 2HG2 THR 70 5.489 12.569 4.767
510 H THR 71 H THR 71 6.772 12.690 7.135
511 HA THR 71 HA THR 71 8.923 11.285 8.558
512 HB THR 71 HB THR 71 7.709 12.008 10.634
513 HG1 THR 71 1HG THR 71 6.456 13.889 8.923
514 HG21 THR 71 3HG2 THR 71 8.788 14.183 8.864
515 HG22 THR 71 1HG2 THR 71 9.708 13.106 9.922
516 HG23 THR 71 2HG2 THR 71 8.583 14.278 10.628
517 H VAL 72 H VAL 72 8.268 9.517 9.841
518 HA VAL 72 HA VAL 72 5.570 8.532 9.301
519 HB VAL 72 HB VAL 72 6.438 6.229 9.630
520 HG11 VAL 72 1HG1 VAL 72 6.289 7.125 7.355
521 HG12 VAL 72 2HG1 VAL 72 7.694 6.064 7.490
522 HG13 VAL 72 3HG1 VAL 72 7.899 7.816 7.515
523 HG21 VAL 72 3HG2 VAL 72 8.359 6.695 11.026
524 HG22 VAL 72 1HG2 VAL 72 9.125 7.589 9.717
525 HG23 VAL 72 2HG2 VAL 72 8.895 5.841 9.574
526 H ASN 73 H ASN 73 4.350 8.617 10.974
527 HA ASN 73 HA ASN 73 3.587 8.836 13.072
528 HB2 ASN 73 2HB ASN 73 6.002 7.092 13.672
529 HB3 ASN 73 1HB ASN 73 4.799 7.505 14.893
530 HD21 ASN 73 1HD2 ASN 73 5.542 4.898 13.617
531 HD22 ASN 73 2HD2 ASN 73 4.062 4.265 12.991
532 H ASN 74 H ASN 74 5.366 10.686 11.868
533 HA ASN 74 HA ASN 74 6.110 12.698 12.158
534 HB2 ASN 74 2HB ASN 74 4.426 12.965 13.984
535 HB3 ASN 74 1HB ASN 74 5.617 12.413 15.149
536 HD21 ASN 74 1HD2 ASN 74 5.365 14.356 16.279
537 HD22 ASN 74 2HD2 ASN 74 6.078 15.829 15.762
538 H ALA 75 H ALA 75 7.730 10.134 12.606
539 HA ALA 75 HA ALA 75 10.141 11.382 13.672
540 HB1 ALA 75 1HB ALA 75 11.053 9.112 13.720
541 HB2 ALA 75 2HB ALA 75 9.578 8.502 12.978
542 HB3 ALA 75 3HB ALA 75 9.527 9.184 14.605
543 HA PRO 76 HA PRO 76 11.170 11.845 9.293
544 HB2 PRO 76 2HB PRO 76 13.790 12.788 10.128
545 HB3 PRO 76 1HB PRO 76 12.482 13.702 9.377
546 HG2 PRO 76 2HG PRO 76 13.270 14.073 11.958
547 HG3 PRO 76 1HG PRO 76 11.615 14.369 11.396
548 HD2 PRO 76 2HD PRO 76 12.728 12.032 12.896
549 HD3 PRO 76 1HD PRO 76 11.168 12.871 13.069
550 H VAL 77 H VAL 77 11.753 10.315 8.015
551 HA VAL 77 HA VAL 77 14.289 8.991 8.104
552 HB VAL 77 HB VAL 77 13.333 6.708 7.948
553 HG11 VAL 77 1HG1 VAL 77 14.008 7.353 10.193
554 HG12 VAL 77 2HG1 VAL 77 12.620 6.267 10.241
555 HG13 VAL 77 3HG1 VAL 77 12.391 7.991 10.504
556 HG21 VAL 77 3HG2 VAL 77 10.699 8.040 8.487
557 HG22 VAL 77 1HG2 VAL 77 10.932 6.284 8.513
558 HG23 VAL 77 2HG2 VAL 77 11.185 7.189 7.022
559 H GLN 78 H GLN 78 14.341 7.668 5.970
560 HA GLN 78 HA GLN 78 12.411 8.890 4.193
561 HB2 GLN 78 2HB GLN 78 15.206 8.034 3.500
562 HB3 GLN 78 1HB GLN 78 14.009 8.517 2.308
563 HG2 GLN 78 2HG GLN 78 13.832 10.679 3.654
564 HG3 GLN 78 1HG GLN 78 15.343 10.171 4.407
565 HE21 GLN 78 1HE2 GLN 78 13.815 11.241 1.525
566 HE22 GLN 78 2HE2 GLN 78 15.255 11.550 0.612
567 H GLU 79 H GLU 79 13.121 5.983 5.565
568 HA GLU 79 HA GLU 79 11.278 4.799 3.753
569 HB2 GLU 79 2HB GLU 79 12.698 2.774 3.348
570 HB3 GLU 79 1HB GLU 79 13.177 4.238 2.510
571 HG2 GLU 79 2HG GLU 79 14.815 4.552 4.455
572 HG3 GLU 79 1HG GLU 79 14.509 2.840 4.781
573 H TRP 80 H TRP 80 10.164 3.108 4.471
574 HA TRP 80 HA TRP 80 10.485 2.060 7.130
575 HB2 TRP 80 2HB TRP 80 9.826 4.288 7.649
576 HB3 TRP 80 1HB TRP 80 8.527 4.276 6.466
577 HD1 TRP 80 HD TRP 80 6.257 3.116 7.272
578 HE1 TRP 80 1HE TRP 80 5.313 2.618 9.618
579 HE3 TRP 80 3HE TRP 80 10.565 3.595 9.956
580 HZ2 TRP 80 2HZ TRP 80 6.291 2.500 12.267
581 HZ3 TRP 80 3HZ TRP 80 10.472 3.293 12.392
582 HH2 TRP 80 HH TRP 80 8.368 2.764 13.516
583 H GLN 81 H GLN 81 8.889 0.421 7.441
584 HA GLN 81 HA GLN 81 7.341 -0.174 5.033
585 HB2 GLN 81 2HB GLN 81 7.063 -2.489 5.940
586 HB3 GLN 81 1HB GLN 81 8.734 -2.058 5.636
587 HG2 GLN 81 2HG GLN 81 9.043 -1.665 8.045
588 HG3 GLN 81 1HG GLN 81 7.364 -2.134 8.312
589 HE21 GLN 81 1HE2 GLN 81 10.519 -3.222 7.439
590 HE22 GLN 81 2HE2 GLN 81 10.199 -4.914 7.585
591 H LEU 82 H LEU 82 5.354 0.322 5.011
592 HA LEU 82 HA LEU 82 4.035 1.604 7.142
593 HB2 LEU 82 2HB LEU 82 2.735 0.365 4.733
594 HB3 LEU 82 1HB LEU 82 2.087 1.593 5.796
595 HG LEU 82 HG LEU 82 4.460 1.972 3.999
596 HD11 LEU 82 1HD1 LEU 82 1.622 2.964 3.755
597 HD12 LEU 82 2HD1 LEU 82 2.382 1.747 2.732
598 HD13 LEU 82 3HD1 LEU 82 2.962 3.411 2.703
599 HD21 LEU 82 3HD2 LEU 82 4.606 3.335 5.975
600 HD22 LEU 82 1HD2 LEU 82 2.930 3.848 5.774
601 HD23 LEU 82 2HD2 LEU 82 4.141 4.335 4.598
602 H ALA 83 H ALA 83 2.905 0.880 8.799
603 HA ALA 83 HA ALA 83 1.604 -1.723 8.555
604 HB1 ALA 83 1HB ALA 83 3.517 -1.813 10.126
605 HB2 ALA 83 2HB ALA 83 1.966 -2.082 10.915
606 HB3 ALA 83 3HB ALA 83 2.762 -0.519 11.066
607 H ASP 84 H ASP 84 -0.248 -1.839 10.126
608 HA ASP 84 HA ASP 84 -2.094 0.214 9.617
609 HB2 ASP 84 2HB ASP 84 -2.889 -2.024 10.138
610 HB3 ASP 84 1HB ASP 84 -2.151 -1.945 11.735
611 H GLY 85 H GLY 85 -2.292 2.147 10.487
612 HA2 GLY 85 2HA GLY 85 -2.768 3.449 12.417
613 HA3 GLY 85 1HA GLY 85 -1.666 2.439 13.334
614 H ASP 86 H ASP 86 -0.012 2.919 10.584
615 HA ASP 86 HA ASP 86 1.630 4.864 11.873
616 HB2 ASP 86 2HB ASP 86 1.895 3.536 9.178
617 HB3 ASP 86 1HB ASP 86 3.015 4.769 9.743
618 H VAL 87 H VAL 87 1.895 6.897 11.521
619 HA VAL 87 HA VAL 87 0.037 8.210 9.640
620 HB VAL 87 HB VAL 87 1.584 9.494 11.922
621 HG11 VAL 87 1HG1 VAL 87 1.015 11.052 10.159
622 HG12 VAL 87 2HG1 VAL 87 0.071 11.387 11.610
623 HG13 VAL 87 3HG1 VAL 87 -0.678 10.563 10.242
624 HG21 VAL 87 3HG2 VAL 87 -0.557 9.559 13.137
625 HG22 VAL 87 1HG2 VAL 87 -0.043 7.901 12.816
626 HG23 VAL 87 2HG2 VAL 87 -1.314 8.636 11.840
627 H ILE 88 H ILE 88 0.981 8.681 7.785
628 HA ILE 88 HA ILE 88 3.814 9.314 7.822
629 HB ILE 88 HB ILE 88 1.937 8.469 5.592
630 HG12 ILE 88 2HG1 ILE 88 3.646 6.693 5.198
631 HG13 ILE 88 1HG1 ILE 88 4.527 7.286 6.592
632 HG21 ILE 88 1HG2 ILE 88 4.742 9.465 5.216
633 HG22 ILE 88 2HG2 ILE 88 3.260 10.269 4.692
634 HG23 ILE 88 3HG2 ILE 88 3.733 8.730 3.967
635 HD11 ILE 88 3HD1 ILE 88 2.579 6.712 8.004
636 HD12 ILE 88 1HD1 ILE 88 3.271 5.317 7.172
637 HD13 ILE 88 2HD1 ILE 88 1.783 6.053 6.577
638 H ARG 89 H ARG 89 4.312 11.375 7.873
639 HA ARG 89 HA ARG 89 2.154 13.265 7.231
640 HB2 ARG 89 2HB ARG 89 2.770 12.826 9.670
641 HB3 ARG 89 1HB ARG 89 4.253 13.701 9.333
642 HG2 ARG 89 2HG ARG 89 3.044 15.700 8.862
643 HG3 ARG 89 1HG ARG 89 1.504 14.843 8.927
644 HD2 ARG 89 2HD ARG 89 2.155 14.223 11.330
645 HD3 ARG 89 1HD ARG 89 3.390 15.468 11.185
646 HE ARG 89 HE ARG 89 1.759 17.095 11.117
647 HH11 ARG 89 1HH1 ARG 89 0.298 13.848 11.482
648 HH12 ARG 89 2HH1 ARG 89 -1.271 14.467 11.733
649 HH21 ARG 89 1HH2 ARG 89 -0.434 17.867 11.574
650 HH22 ARG 89 2HH2 ARG 89 -1.686 16.727 11.819
651 H LEU 90 H LEU 90 2.568 14.477 5.609
652 HA LEU 90 HA LEU 90 5.259 15.425 5.080
653 HB2 LEU 90 2HB LEU 90 4.746 15.378 2.639
654 HB3 LEU 90 1HB LEU 90 4.898 13.791 3.329
655 HG LEU 90 HG LEU 90 2.234 15.088 2.710
656 HD11 LEU 90 1HD1 LEU 90 3.600 14.843 0.686
657 HD12 LEU 90 2HD1 LEU 90 2.233 13.724 0.685
658 HD13 LEU 90 3HD1 LEU 90 3.853 13.139 1.067
659 HD21 LEU 90 3HD2 LEU 90 3.006 12.194 3.171
660 HD22 LEU 90 1HD2 LEU 90 1.391 12.782 2.777
661 HD23 LEU 90 2HD2 LEU 90 2.133 13.213 4.317
662 H GLY 91 H GLY 91 5.168 17.449 3.666
663 HA2 GLY 91 2HA GLY 91 4.017 19.495 5.033
664 HA3 GLY 91 1HA GLY 91 4.424 19.577 3.333
665 H HIS 92 H HIS 92 2.039 19.864 5.582
666 HA HIS 92 HA HIS 92 -0.146 20.401 5.569
667 HB2 HIS 92 2HB HIS 92 0.237 20.704 2.588
668 HB3 HIS 92 1HB HIS 92 -1.237 21.129 3.443
669 HD1 HIS 92 1HD HIS 92 1.547 22.735 2.055
670 HD2 HIS 92 2HD HIS 92 -0.456 23.062 5.682
671 HE1 HIS 92 1HE HIS 92 2.183 24.986 3.011
672 H SER 93 H SER 93 0.800 17.487 4.688
673 HA SER 93 HA SER 93 -1.951 16.588 4.310
674 HB2 SER 93 2HB SER 93 0.346 15.598 2.606
675 HB3 SER 93 1HB SER 93 -1.346 15.122 2.487
676 HG SER 93 HG SER 93 -0.227 17.667 2.008
677 H GLU 94 H GLU 94 -2.367 14.997 5.748
678 HA GLU 94 HA GLU 94 -0.113 13.332 6.544
679 HB2 GLU 94 2HB GLU 94 -1.192 13.041 8.754
680 HB3 GLU 94 1HB GLU 94 -0.758 14.710 8.429
681 HG2 GLU 94 2HG GLU 94 -3.170 15.067 7.756
682 HG3 GLU 94 1HG GLU 94 -3.491 13.463 8.409
683 H ILE 95 H ILE 95 -0.260 11.327 6.057
684 HA ILE 95 HA ILE 95 -2.886 10.397 5.193
685 HB ILE 95 HB ILE 95 -1.113 10.617 3.394
686 HG12 ILE 95 2HG1 ILE 95 -1.440 8.250 2.482
687 HG13 ILE 95 1HG1 ILE 95 -2.412 7.995 3.936
688 HG21 ILE 95 1HG2 ILE 95 0.610 8.951 3.168
689 HG22 ILE 95 2HG2 ILE 95 0.167 8.300 4.745
690 HG23 ILE 95 3HG2 ILE 95 0.828 9.941 4.618
691 HD11 ILE 95 3HD1 ILE 95 -2.869 10.046 1.792
692 HD12 ILE 95 1HD1 ILE 95 -3.777 9.936 3.302
693 HD13 ILE 95 2HD1 ILE 95 -3.845 8.616 2.157
694 H ILE 96 H ILE 96 -3.740 8.786 6.272
695 HA ILE 96 HA ILE 96 -2.082 7.446 8.288
696 HB ILE 96 HB ILE 96 -5.118 7.760 8.198
697 HG12 ILE 96 2HG1 ILE 96 -4.762 8.927 10.436
698 HG13 ILE 96 1HG1 ILE 96 -3.044 8.918 10.083
699 HG21 ILE 96 1HG2 ILE 96 -5.217 6.625 10.370
700 HG22 ILE 96 2HG2 ILE 96 -3.489 6.281 10.256
701 HG23 ILE 96 3HG2 ILE 96 -4.606 5.574 9.093
702 HD11 ILE 96 3HD1 ILE 96 -5.175 10.322 8.476
703 HD12 ILE 96 1HD1 ILE 96 -3.449 10.325 8.124
704 HD13 ILE 96 2HD1 ILE 96 -4.049 11.084 9.599
705 H VAL 97 H VAL 97 -1.662 5.342 8.153
706 HA VAL 97 HA VAL 97 -2.759 3.923 5.877
707 HB VAL 97 HB VAL 97 -0.375 3.327 7.647
708 HG11 VAL 97 1HG1 VAL 97 -1.374 1.807 5.237
709 HG12 VAL 97 2HG1 VAL 97 -1.454 1.249 6.907
710 HG13 VAL 97 3HG1 VAL 97 0.114 1.472 6.133
711 HG21 VAL 97 3HG2 VAL 97 0.890 3.789 5.627
712 HG22 VAL 97 1HG2 VAL 97 -0.113 5.175 6.066
713 HG23 VAL 97 2HG2 VAL 97 -0.609 4.101 4.753
714 H ARG 98 H ARG 98 -4.244 2.501 6.047
715 HA ARG 98 HA ARG 98 -4.840 1.196 8.617
716 HB2 ARG 98 2HB ARG 98 -6.554 1.790 6.209
717 HB3 ARG 98 1HB ARG 98 -7.098 0.852 7.597
718 HG2 ARG 98 2HG ARG 98 -6.075 3.627 7.780
719 HG3 ARG 98 1HG ARG 98 -7.800 3.294 7.497
720 HD2 ARG 98 2HD ARG 98 -7.785 2.000 9.607
721 HD3 ARG 98 1HD ARG 98 -6.096 2.463 9.853
722 HE ARG 98 HE ARG 98 -7.521 4.798 9.486
723 HH11 ARG 98 1HH1 ARG 98 -7.670 2.148 11.791
724 HH12 ARG 98 2HH1 ARG 98 -8.066 3.132 13.132
725 HH21 ARG 98 1HH2 ARG 98 -8.094 6.151 11.271
726 HH22 ARG 98 2HH2 ARG 98 -8.315 5.485 12.820
727 H MET 99 H MET 99 -4.229 -0.831 8.618
728 HA MET 99 HA MET 99 -4.144 -2.240 6.032
729 HB2 MET 99 2HB MET 99 -2.515 -2.900 8.501
730 HB3 MET 99 1HB MET 99 -2.677 -3.967 7.126
731 HG2 MET 99 2HG MET 99 -1.679 -2.300 5.680
732 HG3 MET 99 1HG MET 99 -1.507 -1.199 7.050
733 HE1 MET 99 3HE MET 99 -0.395 -4.639 5.476
734 HE2 MET 99 1HE MET 99 -0.958 -5.132 7.074
735 HE3 MET 99 2HE MET 99 0.755 -5.223 6.676
736 H HIS 100 H HIS 100 -5.503 -3.688 5.622
737 HA HIS 100 HA HIS 100 -7.217 -4.653 7.787
738 HB2 HIS 100 2HB HIS 100 -7.784 -4.711 4.820
739 HB3 HIS 100 1HB HIS 100 -8.919 -4.990 6.116
740 HD1 HIS 100 1HD HIS 100 -10.215 -2.906 6.996
741 HD2 HIS 100 2HD HIS 100 -7.021 -1.959 4.504
742 HE1 HIS 100 1HE HIS 100 -10.393 -0.450 6.523
Start of MODEL 16
1 H1 GLY 1 1HT GLY 1 -2.925 -14.251 3.659
2 H2 GLY 1 2HT GLY 1 -4.059 -14.659 2.493
3 H3 GLY 1 3HT GLY 1 -2.957 -13.423 2.194
4 HA2 GLY 1 1HA GLY 1 -1.137 -14.998 2.279
5 HA3 GLY 1 2HA GLY 1 -2.323 -16.275 2.511
6 H HIS 2 H HIS 2 -3.296 -17.139 0.736
7 HA HIS 2 HA HIS 2 -2.807 -15.773 -1.806
8 HB2 HIS 2 2HB HIS 2 -2.554 -18.743 -1.271
9 HB3 HIS 2 1HB HIS 2 -2.473 -18.009 -2.869
10 HD1 HIS 2 1HD HIS 2 -0.252 -16.616 -3.409
11 HD2 HIS 2 2HD HIS 2 -0.301 -18.553 0.264
12 HE1 HIS 2 1HE HIS 2 2.095 -16.536 -2.557
13 H GLY 3 H GLY 3 -4.198 -17.107 -3.547
14 HA2 GLY 3 2HA GLY 3 -6.305 -17.856 -4.203
15 HA3 GLY 3 1HA GLY 3 -6.822 -17.810 -2.521
16 H SER 4 H SER 4 -6.650 -15.482 -1.626
17 HA SER 4 HA SER 4 -7.294 -13.402 -3.493
18 HB2 SER 4 2HB SER 4 -9.265 -14.242 -1.334
19 HB3 SER 4 1HB SER 4 -9.413 -12.813 -2.361
20 HG SER 4 HG SER 4 -8.957 -14.944 -3.865
21 H ALA 5 H ALA 5 -6.544 -11.502 -2.704
22 HA ALA 5 HA ALA 5 -4.956 -11.642 -0.320
23 HB1 ALA 5 1HB ALA 5 -4.114 -10.542 -2.330
24 HB2 ALA 5 2HB ALA 5 -4.174 -9.423 -0.966
25 HB3 ALA 5 3HB ALA 5 -5.411 -9.354 -2.224
26 H GLY 6 H GLY 6 -6.068 -11.576 1.523
27 HA2 GLY 6 2HA GLY 6 -8.291 -9.791 1.938
28 HA3 GLY 6 1HA GLY 6 -7.540 -10.828 3.149
29 H THR 7 H THR 7 -4.876 -9.832 2.501
30 HA THR 7 HA THR 7 -4.654 -7.670 4.279
31 HB THR 7 HB THR 7 -2.712 -8.619 2.157
32 HG1 THR 7 1HG THR 7 -3.122 -9.457 4.840
33 HG21 THR 7 3HG2 THR 7 -0.990 -7.735 3.688
34 HG22 THR 7 1HG2 THR 7 -2.255 -7.165 4.780
35 HG23 THR 7 2HG2 THR 7 -2.091 -6.465 3.164
36 H SER 8 H SER 8 -5.288 -5.669 3.827
37 HA SER 8 HA SER 8 -4.750 -4.598 1.157
38 HB2 SER 8 2HB SER 8 -7.291 -4.111 2.730
39 HB3 SER 8 1HB SER 8 -6.899 -3.449 1.143
40 HG SER 8 HG SER 8 -6.592 -6.083 1.080
41 H VAL 9 H VAL 9 -3.904 -2.557 1.184
42 HA VAL 9 HA VAL 9 -3.671 -1.275 3.811
43 HB VAL 9 HB VAL 9 -2.054 -0.688 1.328
44 HG11 VAL 9 1HG1 VAL 9 -1.624 -0.004 4.225
45 HG12 VAL 9 2HG1 VAL 9 -2.142 1.109 2.960
46 HG13 VAL 9 3HG1 VAL 9 -0.524 0.407 2.911
47 HG21 VAL 9 3HG2 VAL 9 -1.598 -2.977 1.958
48 HG22 VAL 9 1HG2 VAL 9 -1.314 -2.493 3.627
49 HG23 VAL 9 2HG2 VAL 9 -0.214 -1.962 2.357
50 H THR 10 H THR 10 -5.116 0.155 4.035
51 HA THR 10 HA THR 10 -6.146 1.572 1.713
52 HB THR 10 HB THR 10 -7.434 1.077 4.408
53 HG1 THR 10 1HG THR 10 -8.154 -0.692 3.582
54 HG21 THR 10 3HG2 THR 10 -8.176 3.137 3.296
55 HG22 THR 10 1HG2 THR 10 -9.458 1.927 3.338
56 HG23 THR 10 2HG2 THR 10 -8.560 2.211 1.844
57 H LEU 11 H LEU 11 -5.521 3.606 1.634
58 HA LEU 11 HA LEU 11 -4.322 4.846 3.942
59 HB2 LEU 11 2HB LEU 11 -4.871 6.034 1.243
60 HB3 LEU 11 1HB LEU 11 -3.770 6.615 2.472
61 HG LEU 11 HG LEU 11 -3.527 4.163 0.863
62 HD11 LEU 11 1HD1 LEU 11 -1.848 6.702 0.877
63 HD12 LEU 11 2HD1 LEU 11 -3.082 6.345 -0.308
64 HD13 LEU 11 3HD1 LEU 11 -1.626 5.347 -0.231
65 HD21 LEU 11 3HD2 LEU 11 -1.644 5.277 2.943
66 HD22 LEU 11 1HD2 LEU 11 -1.246 3.946 1.855
67 HD23 LEU 11 2HD2 LEU 11 -2.550 3.764 3.026
68 H GLN 12 H GLN 12 -5.360 6.147 5.123
69 HA GLN 12 HA GLN 12 -8.119 6.878 4.399
70 HB2 GLN 12 2HB GLN 12 -7.531 5.718 6.656
71 HB3 GLN 12 1HB GLN 12 -6.895 7.286 7.105
72 HG2 GLN 12 2HG GLN 12 -9.119 8.280 6.525
73 HG3 GLN 12 1HG GLN 12 -9.729 6.635 6.377
74 HE21 GLN 12 1HE2 GLN 12 -8.645 9.080 8.459
75 HE22 GLN 12 2HE2 GLN 12 -9.106 8.348 9.963
76 H LEU 13 H LEU 13 -8.394 8.840 3.700
77 HA LEU 13 HA LEU 13 -6.214 10.740 3.844
78 HB2 LEU 13 2HB LEU 13 -7.174 10.175 1.671
79 HB3 LEU 13 1HB LEU 13 -8.764 10.634 2.241
80 HG LEU 13 HG LEU 13 -7.882 12.910 2.597
81 HD11 LEU 13 1HD1 LEU 13 -5.856 13.565 1.310
82 HD12 LEU 13 2HD1 LEU 13 -5.538 11.853 1.018
83 HD13 LEU 13 3HD1 LEU 13 -5.521 12.488 2.662
84 HD21 LEU 13 3HD2 LEU 13 -7.916 11.826 -0.217
85 HD22 LEU 13 1HD2 LEU 13 -8.019 13.537 0.209
86 HD23 LEU 13 2HD2 LEU 13 -9.283 12.429 0.728
87 H ASP 14 H ASP 14 -6.313 12.388 5.221
88 HA ASP 14 HA ASP 14 -8.907 12.873 6.406
89 HB2 ASP 14 2HB ASP 14 -7.005 12.632 7.976
90 HB3 ASP 14 1HB ASP 14 -6.229 14.019 7.215
91 H ASP 15 H ASP 15 -9.944 13.983 5.000
92 HA ASP 15 HA ASP 15 -8.769 16.516 4.133
93 HB2 ASP 15 2HB ASP 15 -9.960 16.333 2.048
94 HB3 ASP 15 1HB ASP 15 -9.069 14.838 2.299
95 H GLY 16 H GLY 16 -11.220 14.930 5.848
96 HA2 GLY 16 2HA GLY 16 -12.699 16.343 7.169
97 HA3 GLY 16 1HA GLY 16 -12.989 17.272 5.699
98 H SER 17 H SER 17 -13.004 14.861 4.015
99 HA SER 17 HA SER 17 -15.741 14.077 4.542
100 HB2 SER 17 2HB SER 17 -15.041 14.807 2.250
101 HB3 SER 17 1HB SER 17 -13.910 13.463 2.193
102 HG SER 17 HG SER 17 -16.695 13.169 2.579
103 H GLY 18 H GLY 18 -12.473 12.819 4.365
104 HA2 GLY 18 2HA GLY 18 -11.623 11.031 5.595
105 HA3 GLY 18 1HA GLY 18 -13.267 10.581 6.050
106 H ARG 19 H ARG 19 -11.431 10.984 3.086
107 HA ARG 19 HA ARG 19 -12.866 8.740 1.923
108 HB2 ARG 19 2HB ARG 19 -10.793 10.565 0.743
109 HB3 ARG 19 1HB ARG 19 -11.618 9.262 -0.106
110 HG2 ARG 19 2HG ARG 19 -12.930 11.727 1.087
111 HG3 ARG 19 1HG ARG 19 -12.561 11.508 -0.620
112 HD2 ARG 19 2HD ARG 19 -14.906 11.052 -0.292
113 HD3 ARG 19 1HD ARG 19 -14.089 9.532 -0.629
114 HE ARG 19 HE ARG 19 -14.494 10.231 2.159
115 HH11 ARG 19 1HH1 ARG 19 -15.665 8.416 -0.610
116 HH12 ARG 19 2HH1 ARG 19 -16.549 7.274 0.272
117 HH21 ARG 19 1HH2 ARG 19 -15.691 8.646 3.458
118 HH22 ARG 19 2HH2 ARG 19 -16.560 7.411 2.680
119 H THR 20 H THR 20 -11.621 7.063 0.761
120 HA THR 20 HA THR 20 -9.100 6.562 2.119
121 HB THR 20 HB THR 20 -9.768 4.122 2.103
122 HG1 THR 20 1HG THR 20 -11.781 3.573 1.580
123 HG21 THR 20 3HG2 THR 20 -11.456 6.029 3.716
124 HG22 THR 20 1HG2 THR 20 -9.865 5.431 4.172
125 HG23 THR 20 2HG2 THR 20 -11.239 4.318 4.104
126 H TYR 21 H TYR 21 -7.527 5.642 0.897
127 HA TYR 21 HA TYR 21 -8.190 4.965 -1.877
128 HB2 TYR 21 2HB TYR 21 -7.021 7.096 -1.949
129 HB3 TYR 21 1HB TYR 21 -5.753 6.477 -0.894
130 HD1 TYR 21 1HD TYR 21 -7.273 6.038 -4.261
131 HD2 TYR 21 2HD TYR 21 -3.870 5.378 -1.805
132 HE1 TYR 21 1HE TYR 21 -5.987 5.293 -6.232
133 HE2 TYR 21 2HE TYR 21 -2.583 4.643 -3.752
134 HH TYR 21 HH TYR 21 -3.618 5.148 -6.892
135 H GLN 22 H GLN 22 -7.908 2.855 -2.045
136 HA GLN 22 HA GLN 22 -6.024 1.546 -0.289
137 HB2 GLN 22 2HB GLN 22 -8.130 0.386 -0.776
138 HB3 GLN 22 1HB GLN 22 -7.747 0.393 -2.492
139 HG2 GLN 22 2HG GLN 22 -5.878 -1.092 -2.134
140 HG3 GLN 22 1HG GLN 22 -6.107 -1.014 -0.390
141 HE21 GLN 22 1HE2 GLN 22 -6.121 -3.300 -2.238
142 HE22 GLN 22 2HE2 GLN 22 -7.637 -4.076 -1.998
143 H LEU 23 H LEU 23 -4.066 0.895 -0.768
144 HA LEU 23 HA LEU 23 -2.672 2.072 -2.883
145 HB2 LEU 23 2HB LEU 23 -1.942 -0.248 -1.127
146 HB3 LEU 23 1HB LEU 23 -0.847 0.448 -2.291
147 HG LEU 23 HG LEU 23 -1.973 1.817 0.149
148 HD11 LEU 23 1HD1 LEU 23 -0.251 0.169 0.633
149 HD12 LEU 23 2HD1 LEU 23 0.364 1.804 0.875
150 HD13 LEU 23 3HD1 LEU 23 0.798 0.901 -0.578
151 HD21 LEU 23 3HD2 LEU 23 -0.110 2.834 -1.993
152 HD22 LEU 23 1HD2 LEU 23 -0.432 3.643 -0.462
153 HD23 LEU 23 2HD2 LEU 23 -1.730 3.438 -1.632
154 H ARG 24 H ARG 24 -2.276 1.502 -4.862
155 HA ARG 24 HA ARG 24 -3.459 -0.891 -5.921
156 HB2 ARG 24 2HB ARG 24 -1.653 1.116 -7.273
157 HB3 ARG 24 1HB ARG 24 -2.589 -0.167 -8.035
158 HG2 ARG 24 2HG ARG 24 -3.735 2.217 -6.577
159 HG3 ARG 24 1HG ARG 24 -3.647 2.026 -8.327
160 HD2 ARG 24 2HD ARG 24 -5.196 0.267 -6.422
161 HD3 ARG 24 1HD ARG 24 -5.868 1.495 -7.492
162 HE ARG 24 HE ARG 24 -4.399 -0.233 -9.055
163 HH11 ARG 24 1HH1 ARG 24 -7.300 -0.390 -7.031
164 HH12 ARG 24 2HH1 ARG 24 -8.064 -1.578 -7.964
165 HH21 ARG 24 1HH2 ARG 24 -5.453 -1.870 -10.356
166 HH22 ARG 24 2HH2 ARG 24 -6.986 -2.449 -9.905
167 H GLU 25 H GLU 25 -2.336 -2.593 -6.739
168 HA GLU 25 HA GLU 25 0.123 -3.114 -5.409
169 HB2 GLU 25 2HB GLU 25 0.003 -5.324 -6.513
170 HB3 GLU 25 1HB GLU 25 -1.461 -4.914 -5.640
171 HG2 GLU 25 2HG GLU 25 -2.432 -4.197 -7.838
172 HG3 GLU 25 1HG GLU 25 -1.007 -4.915 -8.597
173 H GLY 26 H GLY 26 1.928 -2.487 -5.982
174 HA2 GLY 26 2HA GLY 26 3.574 -2.612 -7.893
175 HA3 GLY 26 1HA GLY 26 2.399 -1.560 -8.702
176 H SER 27 H SER 27 4.137 0.085 -8.649
177 HA SER 27 HA SER 27 4.323 1.157 -5.961
178 HB2 SER 27 2HB SER 27 6.295 2.420 -6.793
179 HB3 SER 27 1HB SER 27 6.475 0.672 -6.741
180 HG SER 27 HG SER 27 5.521 1.737 -9.143
181 H ASN 28 H ASN 28 3.727 3.179 -5.502
182 HA ASN 28 HA ASN 28 2.636 4.764 -7.689
183 HB2 ASN 28 2HB ASN 28 0.933 5.656 -6.105
184 HB3 ASN 28 1HB ASN 28 0.720 3.941 -6.439
185 HD21 ASN 28 1HD2 ASN 28 1.196 2.455 -4.762
186 HD22 ASN 28 2HD2 ASN 28 1.284 2.983 -3.119
187 H ILE 29 H ILE 29 3.580 6.570 -7.938
188 HA ILE 29 HA ILE 29 5.324 7.606 -5.835
189 HB ILE 29 HB ILE 29 5.143 8.359 -8.769
190 HG12 ILE 29 2HG1 ILE 29 7.172 6.588 -7.365
191 HG13 ILE 29 1HG1 ILE 29 5.895 6.024 -8.431
192 HG21 ILE 29 1HG2 ILE 29 7.280 9.471 -8.402
193 HG22 ILE 29 2HG2 ILE 29 7.225 9.042 -6.692
194 HG23 ILE 29 3HG2 ILE 29 6.029 10.155 -7.360
195 HD11 ILE 29 3HD1 ILE 29 8.199 7.798 -9.209
196 HD12 ILE 29 1HD1 ILE 29 6.924 7.231 -10.285
197 HD13 ILE 29 2HD1 ILE 29 8.043 6.076 -9.556
198 H ILE 30 H ILE 30 4.595 9.264 -4.697
199 HA ILE 30 HA ILE 30 2.328 10.788 -5.711
200 HB ILE 30 HB ILE 30 3.453 10.688 -2.869
201 HG12 ILE 30 2HG1 ILE 30 0.860 9.557 -3.945
202 HG13 ILE 30 1HG1 ILE 30 2.291 8.589 -3.609
203 HG21 ILE 30 1HG2 ILE 30 1.114 12.185 -3.968
204 HG22 ILE 30 2HG2 ILE 30 2.561 12.831 -3.199
205 HG23 ILE 30 3HG2 ILE 30 1.406 11.888 -2.257
206 HD11 ILE 30 3HD1 ILE 30 2.112 9.198 -1.243
207 HD12 ILE 30 1HD1 ILE 30 0.639 8.425 -1.831
208 HD13 ILE 30 2HD1 ILE 30 0.690 10.174 -1.606
209 H GLY 31 H GLY 31 2.604 12.790 -6.403
210 HA2 GLY 31 2HA GLY 31 3.962 14.809 -5.294
211 HA3 GLY 31 1HA GLY 31 5.176 14.036 -6.320
212 H ARG 32 H ARG 32 4.883 16.342 -7.263
213 HA ARG 32 HA ARG 32 2.998 15.944 -9.457
214 HB2 ARG 32 2HB ARG 32 3.684 18.619 -8.226
215 HB3 ARG 32 1HB ARG 32 2.808 18.415 -9.733
216 HG2 ARG 32 2HG ARG 32 1.242 16.944 -8.207
217 HG3 ARG 32 1HG ARG 32 1.926 17.963 -6.942
218 HD2 ARG 32 2HD ARG 32 0.565 18.947 -9.448
219 HD3 ARG 32 1HD ARG 32 -0.163 18.859 -7.857
220 HE ARG 32 HE ARG 32 1.288 20.568 -7.127
221 HH11 ARG 32 1HH1 ARG 32 1.380 20.010 -10.649
222 HH12 ARG 32 2HH1 ARG 32 1.665 21.619 -11.058
223 HH21 ARG 32 1HH2 ARG 32 1.670 22.914 -7.740
224 HH22 ARG 32 2HH2 ARG 32 1.837 23.270 -9.392
225 H GLY 33 H GLY 33 4.099 15.358 -11.065
226 HA2 GLY 33 2HA GLY 33 5.807 16.997 -12.436
227 HA3 GLY 33 1HA GLY 33 6.814 15.905 -11.494
228 H GLN 34 H GLN 34 7.150 15.641 -13.999
229 HA GLN 34 HA GLN 34 5.475 14.138 -15.634
230 HB2 GLN 34 2HB GLN 34 7.543 13.463 -16.824
231 HB3 GLN 34 1HB GLN 34 7.499 15.186 -16.469
232 HG2 GLN 34 2HG GLN 34 9.019 14.910 -14.628
233 HG3 GLN 34 1HG GLN 34 8.929 13.165 -14.775
234 HE21 GLN 34 1HE2 GLN 34 11.061 12.980 -14.940
235 HE22 GLN 34 2HE2 GLN 34 11.969 13.392 -16.350
236 H ASP 35 H ASP 35 7.510 13.058 -13.010
237 HA ASP 35 HA ASP 35 7.331 10.259 -13.822
238 HB2 ASP 35 2HB ASP 35 8.877 11.540 -11.570
239 HB3 ASP 35 1HB ASP 35 8.968 9.850 -12.039
240 H ALA 36 H ALA 36 5.371 12.232 -12.169
241 HA ALA 36 HA ALA 36 5.015 10.608 -9.805
242 HB1 ALA 36 1HB ALA 36 3.399 12.284 -9.132
243 HB2 ALA 36 2HB ALA 36 3.528 13.057 -10.714
244 HB3 ALA 36 3HB ALA 36 4.922 13.021 -9.632
245 H GLN 37 H GLN 37 3.108 9.601 -9.221
246 HA GLN 37 HA GLN 37 1.464 8.651 -11.453
247 HB2 GLN 37 2HB GLN 37 2.105 7.478 -8.741
248 HB3 GLN 37 1HB GLN 37 1.004 6.764 -9.905
249 HG2 GLN 37 2HG GLN 37 3.924 7.273 -10.437
250 HG3 GLN 37 1HG GLN 37 3.276 5.739 -9.853
251 HE21 GLN 37 1HE2 GLN 37 2.078 4.474 -11.224
252 HE22 GLN 37 2HE2 GLN 37 2.041 4.733 -12.927
253 H PHE 38 H PHE 38 1.353 9.310 -7.974
254 HA PHE 38 HA PHE 38 -1.461 10.088 -8.148
255 HB2 PHE 38 2HB PHE 38 -0.869 8.317 -6.529
256 HB3 PHE 38 1HB PHE 38 0.352 9.361 -5.832
257 HD1 PHE 38 1HD PHE 38 -0.511 11.536 -4.669
258 HD2 PHE 38 2HD PHE 38 -3.025 8.250 -5.671
259 HE1 PHE 38 1HE PHE 38 -2.025 12.239 -2.982
260 HE2 PHE 38 2HE PHE 38 -4.640 8.990 -3.962
261 HZ PHE 38 HZ PHE 38 -4.159 10.992 -2.603
262 H ARG 39 H ARG 39 -1.715 12.235 -8.258
263 HA ARG 39 HA ARG 39 0.569 13.866 -7.463
264 HB2 ARG 39 2HB ARG 39 -1.611 14.457 -9.441
265 HB3 ARG 39 1HB ARG 39 -0.248 15.507 -9.058
266 HG2 ARG 39 2HG ARG 39 1.289 13.758 -9.869
267 HG3 ARG 39 1HG ARG 39 -0.102 12.770 -10.307
268 HD2 ARG 39 2HD ARG 39 0.555 15.490 -11.385
269 HD3 ARG 39 1HD ARG 39 0.813 13.956 -12.228
270 HE ARG 39 HE ARG 39 -1.875 14.682 -11.376
271 HH11 ARG 39 1HH1 ARG 39 0.409 14.161 -14.044
272 HH12 ARG 39 2HH1 ARG 39 -0.764 14.349 -15.256
273 HH21 ARG 39 1HH2 ARG 39 -3.479 14.954 -13.074
274 HH22 ARG 39 2HH2 ARG 39 -2.997 14.807 -14.697
275 H LEU 40 H LEU 40 0.371 15.183 -5.838
276 HA LEU 40 HA LEU 40 -2.117 15.518 -4.466
277 HB2 LEU 40 2HB LEU 40 0.604 16.755 -4.067
278 HB3 LEU 40 1HB LEU 40 -0.771 17.163 -3.070
279 HG LEU 40 HG LEU 40 0.531 14.446 -3.269
280 HD11 LEU 40 1HD1 LEU 40 1.881 16.063 -2.068
281 HD12 LEU 40 2HD1 LEU 40 1.170 14.906 -0.941
282 HD13 LEU 40 3HD1 LEU 40 0.491 16.526 -1.094
283 HD21 LEU 40 3HD2 LEU 40 -1.741 15.405 -1.527
284 HD22 LEU 40 1HD2 LEU 40 -0.965 13.825 -1.435
285 HD23 LEU 40 2HD2 LEU 40 -1.888 14.273 -2.869
286 HA PRO 41 HA PRO 41 -3.326 19.166 -6.619
287 HB2 PRO 41 2HB PRO 41 -5.130 20.174 -4.893
288 HB3 PRO 41 1HB PRO 41 -5.419 18.690 -5.809
289 HG2 PRO 41 2HG PRO 41 -4.634 19.035 -2.956
290 HG3 PRO 41 1HG PRO 41 -5.724 17.848 -3.682
291 HD2 PRO 41 2HD PRO 41 -3.077 17.333 -2.987
292 HD3 PRO 41 1HD PRO 41 -3.992 16.397 -4.160
293 H ASP 42 H ASP 42 -1.125 19.372 -4.299
294 HA ASP 42 HA ASP 42 -1.333 22.305 -4.027
295 HB2 ASP 42 2HB ASP 42 -1.488 20.812 -1.883
296 HB3 ASP 42 1HB ASP 42 0.244 20.595 -2.116
297 H THR 43 H THR 43 1.207 22.990 -3.279
298 HA THR 43 HA THR 43 2.870 21.987 -5.433
299 HB THR 43 HB THR 43 2.404 24.899 -4.711
300 HG1 THR 43 1HG THR 43 0.690 24.406 -5.838
301 HG21 THR 43 3HG2 THR 43 3.952 23.637 -6.979
302 HG22 THR 43 1HG2 THR 43 4.657 24.427 -5.567
303 HG23 THR 43 2HG2 THR 43 3.710 25.372 -6.730
304 H GLY 44 H GLY 44 5.161 22.223 -4.974
305 HA2 GLY 44 2HA GLY 44 6.928 22.894 -3.448
306 HA3 GLY 44 1HA GLY 44 5.784 22.676 -2.120
307 H VAL 45 H VAL 45 4.737 20.464 -3.758
308 HA VAL 45 HA VAL 45 6.190 18.277 -2.583
309 HB VAL 45 HB VAL 45 3.898 18.229 -4.571
310 HG11 VAL 45 1HG1 VAL 45 5.060 16.121 -4.275
311 HG12 VAL 45 2HG1 VAL 45 3.406 16.049 -3.654
312 HG13 VAL 45 3HG1 VAL 45 4.768 16.191 -2.538
313 HG21 VAL 45 3HG2 VAL 45 2.391 18.067 -2.678
314 HG22 VAL 45 1HG2 VAL 45 3.283 19.591 -2.660
315 HG23 VAL 45 2HG2 VAL 45 3.759 18.283 -1.571
316 H SER 46 H SER 46 7.715 17.147 -3.636
317 HA SER 46 HA SER 46 8.795 18.114 -6.053
318 HB2 SER 46 2HB SER 46 9.422 15.550 -4.586
319 HB3 SER 46 1HB SER 46 10.468 16.428 -5.715
320 HG SER 46 HG SER 46 10.577 16.760 -3.237
321 H ARG 47 H ARG 47 9.327 16.666 -7.949
322 HA ARG 47 HA ARG 47 6.992 15.661 -9.155
323 HB2 ARG 47 2HB ARG 47 8.397 14.952 -11.026
324 HB3 ARG 47 1HB ARG 47 8.954 16.523 -10.461
325 HG2 ARG 47 2HG ARG 47 10.754 15.338 -9.257
326 HG3 ARG 47 1HG ARG 47 10.202 13.829 -9.991
327 HD2 ARG 47 2HD ARG 47 10.472 15.075 -12.217
328 HD3 ARG 47 1HD ARG 47 11.420 16.242 -11.295
329 HE ARG 47 HE ARG 47 12.194 13.670 -12.159
330 HH11 ARG 47 1HH1 ARG 47 12.813 15.992 -9.470
331 HH12 ARG 47 2HH1 ARG 47 14.357 15.366 -9.162
332 HH21 ARG 47 1HH2 ARG 47 14.300 12.869 -11.664
333 HH22 ARG 47 2HH2 ARG 47 15.223 13.552 -10.401
334 H ARG 48 H ARG 48 9.648 14.082 -7.565
335 HA ARG 48 HA ARG 48 7.904 11.798 -7.072
336 HB2 ARG 48 2HB ARG 48 10.949 11.770 -7.322
337 HB3 ARG 48 1HB ARG 48 9.971 10.400 -6.819
338 HG2 ARG 48 2HG ARG 48 8.938 10.336 -9.036
339 HG3 ARG 48 1HG ARG 48 9.917 11.702 -9.537
340 HD2 ARG 48 2HD ARG 48 10.948 9.703 -10.369
341 HD3 ARG 48 1HD ARG 48 11.951 10.322 -9.064
342 HE ARG 48 HE ARG 48 10.637 8.538 -7.677
343 HH11 ARG 48 1HH1 ARG 48 11.747 8.132 -11.038
344 HH12 ARG 48 2HH1 ARG 48 11.896 6.451 -10.909
345 HH21 ARG 48 1HH2 ARG 48 10.888 6.224 -7.536
346 HH22 ARG 48 2HH2 ARG 48 11.388 5.326 -8.899
347 H HIS 49 H HIS 49 7.177 12.631 -5.192
348 HA HIS 49 HA HIS 49 9.083 13.825 -3.345
349 HB2 HIS 49 2HB HIS 49 6.959 14.975 -3.717
350 HB3 HIS 49 1HB HIS 49 6.068 13.527 -3.281
351 HD2 HIS 49 2HD HIS 49 6.115 12.902 -0.524
352 HE1 HIS 49 1HE HIS 49 7.383 16.765 0.590
353 HE2 HIS 49 2HE HIS 49 6.925 14.376 1.357
354 H LEU 50 H LEU 50 7.009 11.082 -3.737
355 HA LEU 50 HA LEU 50 8.507 9.548 -1.891
356 HB2 LEU 50 2HB LEU 50 7.199 10.724 -0.279
357 HB3 LEU 50 1HB LEU 50 5.739 10.524 -1.202
358 HG LEU 50 HG LEU 50 7.108 8.107 -0.029
359 HD11 LEU 50 1HD1 LEU 50 6.903 9.791 1.756
360 HD12 LEU 50 2HD1 LEU 50 5.788 8.450 1.995
361 HD13 LEU 50 3HD1 LEU 50 5.198 9.987 1.359
362 HD21 LEU 50 3HD2 LEU 50 5.207 7.777 -1.550
363 HD22 LEU 50 1HD2 LEU 50 4.215 8.830 -0.537
364 HD23 LEU 50 2HD2 LEU 50 4.800 7.294 0.098
365 H GLU 51 H GLU 51 8.008 7.395 -2.113
366 HA GLU 51 HA GLU 51 5.938 6.724 -4.032
367 HB2 GLU 51 2HB GLU 51 7.563 5.220 -5.214
368 HB3 GLU 51 1HB GLU 51 7.771 6.943 -5.474
369 HG2 GLU 51 2HG GLU 51 9.560 6.888 -3.710
370 HG3 GLU 51 1HG GLU 51 9.410 5.131 -3.740
371 H ILE 52 H ILE 52 4.807 5.140 -3.455
372 HA ILE 52 HA ILE 52 5.740 3.409 -1.292
373 HB ILE 52 HB ILE 52 2.953 3.839 -2.401
374 HG12 ILE 52 2HG1 ILE 52 4.154 4.689 0.244
375 HG13 ILE 52 1HG1 ILE 52 3.836 5.759 -1.116
376 HG21 ILE 52 1HG2 ILE 52 3.887 2.181 -0.064
377 HG22 ILE 52 2HG2 ILE 52 3.288 1.590 -1.615
378 HG23 ILE 52 3HG2 ILE 52 2.199 2.463 -0.524
379 HD11 ILE 52 3HD1 ILE 52 1.440 5.312 -0.889
380 HD12 ILE 52 1HD1 ILE 52 2.126 5.970 0.595
381 HD13 ILE 52 2HD1 ILE 52 1.770 4.247 0.478
382 H ARG 53 H ARG 53 6.372 1.473 -1.826
383 HA ARG 53 HA ARG 53 5.529 0.423 -4.429
384 HB2 ARG 53 2HB ARG 53 7.953 -0.373 -2.774
385 HB3 ARG 53 1HB ARG 53 7.560 -0.948 -4.388
386 HG2 ARG 53 2HG ARG 53 7.812 1.309 -5.274
387 HG3 ARG 53 1HG ARG 53 8.195 1.901 -3.662
388 HD2 ARG 53 2HD ARG 53 10.183 0.450 -3.625
389 HD3 ARG 53 1HD ARG 53 9.788 -0.105 -5.253
390 HE ARG 53 HE ARG 53 9.989 2.739 -5.158
391 HH11 ARG 53 1HH1 ARG 53 12.026 -0.172 -5.336
392 HH12 ARG 53 2HH1 ARG 53 13.339 0.667 -6.009
393 HH21 ARG 53 1HH2 ARG 53 11.725 3.815 -6.058
394 HH22 ARG 53 2HH2 ARG 53 13.191 3.001 -6.450
395 H TRP 54 H TRP 54 3.864 -0.870 -4.200
396 HA TRP 54 HA TRP 54 3.633 -2.321 -1.705
397 HB2 TRP 54 2HB TRP 54 1.848 -0.774 -1.818
398 HB3 TRP 54 1HB TRP 54 1.513 -1.161 -3.499
399 HD1 TRP 54 HD TRP 54 -0.726 -2.401 -3.696
400 HE1 TRP 54 1HE TRP 54 -2.026 -4.155 -2.326
401 HE3 TRP 54 3HE TRP 54 2.501 -2.956 0.209
402 HZ2 TRP 54 2HZ TRP 54 -1.724 -5.587 0.070
403 HZ3 TRP 54 3HZ TRP 54 1.942 -4.518 1.990
404 HH2 TRP 54 HH TRP 54 -0.138 -5.824 1.936
405 H ASP 55 H ASP 55 3.821 -4.373 -1.741
406 HA ASP 55 HA ASP 55 2.797 -5.953 -3.940
407 HB2 ASP 55 2HB ASP 55 5.542 -6.225 -2.675
408 HB3 ASP 55 1HB ASP 55 4.746 -7.591 -3.445
409 H GLY 56 H GLY 56 2.335 -8.172 -3.163
410 HA2 GLY 56 2HA GLY 56 0.719 -7.907 -0.856
411 HA3 GLY 56 1HA GLY 56 0.932 -9.354 -1.815
412 H GLN 57 H GLN 57 2.714 -7.389 0.479
413 HA GLN 57 HA GLN 57 2.928 -9.471 2.392
414 HB2 GLN 57 2HB GLN 57 4.775 -10.063 0.747
415 HB3 GLN 57 1HB GLN 57 5.527 -8.528 1.142
416 HG2 GLN 57 2HG GLN 57 6.580 -10.348 2.350
417 HG3 GLN 57 1HG GLN 57 5.772 -9.245 3.464
418 HE21 GLN 57 1HE2 GLN 57 3.998 -9.969 4.649
419 HE22 GLN 57 2HE2 GLN 57 3.546 -11.623 4.698
420 H VAL 58 H VAL 58 4.967 -6.683 1.488
421 HA VAL 58 HA VAL 58 3.839 -5.213 3.740
422 HB VAL 58 HB VAL 58 6.092 -4.295 4.337
423 HG11 VAL 58 1HG1 VAL 58 5.811 -7.274 4.665
424 HG12 VAL 58 2HG1 VAL 58 5.119 -6.032 5.707
425 HG13 VAL 58 3HG1 VAL 58 6.868 -6.233 5.622
426 HG21 VAL 58 3HG2 VAL 58 7.265 -4.806 2.251
427 HG22 VAL 58 1HG2 VAL 58 7.154 -6.531 2.601
428 HG23 VAL 58 2HG2 VAL 58 8.121 -5.476 3.637
429 H ALA 59 H ALA 59 3.978 -2.959 3.564
430 HA ALA 59 HA ALA 59 4.239 -2.069 0.801
431 HB1 ALA 59 1HB ALA 59 2.937 -0.123 1.488
432 HB2 ALA 59 2HB ALA 59 2.931 -0.711 3.157
433 HB3 ALA 59 3HB ALA 59 2.092 -1.613 1.903
434 H LEU 60 H LEU 60 6.041 -1.260 0.276
435 HA LEU 60 HA LEU 60 7.925 -0.298 2.234
436 HB2 LEU 60 2HB LEU 60 8.493 -1.835 0.336
437 HB3 LEU 60 1HB LEU 60 8.096 -0.551 -0.772
438 HG LEU 60 HG LEU 60 10.382 -0.372 1.213
439 HD11 LEU 60 1HD1 LEU 60 10.723 -2.259 -0.264
440 HD12 LEU 60 2HD1 LEU 60 11.814 -0.940 -0.707
441 HD13 LEU 60 3HD1 LEU 60 10.359 -1.252 -1.663
442 HD21 LEU 60 3HD2 LEU 60 11.210 1.354 -0.322
443 HD22 LEU 60 1HD2 LEU 60 9.611 1.779 0.304
444 HD23 LEU 60 2HD2 LEU 60 9.772 1.138 -1.329
445 H LEU 61 H LEU 61 7.915 1.750 2.834
446 HA LEU 61 HA LEU 61 6.716 3.794 1.130
447 HB2 LEU 61 2HB LEU 61 5.895 3.437 3.442
448 HB3 LEU 61 1HB LEU 61 7.473 3.771 4.081
449 HG LEU 61 HG LEU 61 5.897 5.600 4.456
450 HD11 LEU 61 1HD1 LEU 61 8.199 6.270 4.222
451 HD12 LEU 61 2HD1 LEU 61 7.120 7.507 3.582
452 HD13 LEU 61 3HD1 LEU 61 7.995 6.441 2.479
453 HD21 LEU 61 3HD2 LEU 61 4.478 5.141 2.515
454 HD22 LEU 61 1HD2 LEU 61 5.702 5.847 1.473
455 HD23 LEU 61 2HD2 LEU 61 4.869 6.844 2.680
456 H ALA 62 H ALA 62 8.270 4.655 -0.170
457 HA ALA 62 HA ALA 62 10.863 5.157 1.075
458 HB1 ALA 62 1HB ALA 62 11.839 5.102 -1.151
459 HB2 ALA 62 2HB ALA 62 10.247 4.808 -1.859
460 HB3 ALA 62 3HB ALA 62 10.987 3.597 -0.810
461 H ASP 63 H ASP 63 11.027 7.148 1.669
462 HA ASP 63 HA ASP 63 9.487 9.271 0.471
463 HB2 ASP 63 2HB ASP 63 9.732 9.377 2.840
464 HB3 ASP 63 1HB ASP 63 11.464 9.107 2.750
465 H LEU 64 H LEU 64 10.317 10.817 -0.899
466 HA LEU 64 HA LEU 64 13.074 10.311 -1.746
467 HB2 LEU 64 2HB LEU 64 11.141 9.991 -3.402
468 HB3 LEU 64 1HB LEU 64 10.906 11.715 -3.324
469 HG LEU 64 HG LEU 64 12.070 11.042 -5.363
470 HD11 LEU 64 1HD1 LEU 64 13.977 12.539 -5.322
471 HD12 LEU 64 2HD1 LEU 64 13.883 12.610 -3.559
472 HD13 LEU 64 3HD1 LEU 64 12.560 13.243 -4.538
473 HD21 LEU 64 3HD2 LEU 64 14.242 10.030 -3.551
474 HD22 LEU 64 1HD2 LEU 64 14.330 10.142 -5.309
475 HD23 LEU 64 2HD2 LEU 64 13.160 9.058 -4.549
476 H ASN 65 H ASN 65 14.312 11.619 -0.685
477 HA ASN 65 HA ASN 65 15.364 13.447 0.032
478 HB2 ASN 65 2HB ASN 65 15.072 14.457 -2.176
479 HB3 ASN 65 1HB ASN 65 13.454 14.994 -1.746
480 HD21 ASN 65 1HD2 ASN 65 16.845 15.436 -1.159
481 HD22 ASN 65 2HD2 ASN 65 16.759 17.023 -0.509
482 H SER 66 H SER 66 14.924 13.156 2.075
483 HA SER 66 HA SER 66 12.473 13.723 3.318
484 HB2 SER 66 2HB SER 66 15.179 13.419 4.584
485 HB3 SER 66 1HB SER 66 13.606 13.119 5.333
486 HG SER 66 HG SER 66 13.345 11.614 3.453
487 H THR 67 H THR 67 15.163 15.672 2.517
488 HA THR 67 HA THR 67 15.252 17.794 4.213
489 HB THR 67 HB THR 67 15.322 17.574 1.234
490 HG1 THR 67 1HG THR 67 17.424 18.180 2.988
491 HG21 THR 67 3HG2 THR 67 14.648 19.852 1.532
492 HG22 THR 67 1HG2 THR 67 16.361 19.867 1.142
493 HG23 THR 67 2HG2 THR 67 15.835 20.118 2.815
494 H ASN 68 H ASN 68 13.009 17.423 1.511
495 HA ASN 68 HA ASN 68 11.151 19.352 2.726
496 HB2 ASN 68 2HB ASN 68 12.354 20.204 0.738
497 HB3 ASN 68 1HB ASN 68 11.867 18.784 -0.162
498 HD21 ASN 68 1HD2 ASN 68 11.000 19.983 -1.664
499 HD22 ASN 68 2HD2 ASN 68 9.463 20.785 -1.542
500 H GLY 69 H GLY 69 11.479 16.494 3.078
501 HA2 GLY 69 2HA GLY 69 9.555 15.252 1.294
502 HA3 GLY 69 1HA GLY 69 10.718 14.420 2.295
503 H THR 70 H THR 70 9.458 13.074 3.242
504 HA THR 70 HA THR 70 6.895 13.910 4.357
505 HB THR 70 HB THR 70 7.930 11.167 3.753
506 HG1 THR 70 1HG THR 70 8.104 12.130 1.898
507 HG21 THR 70 3HG2 THR 70 5.167 12.374 3.951
508 HG22 THR 70 1HG2 THR 70 5.897 11.250 5.088
509 HG23 THR 70 2HG2 THR 70 5.507 10.718 3.447
510 H THR 71 H THR 71 6.260 13.089 6.384
511 HA THR 71 HA THR 71 8.356 12.015 8.108
512 HB THR 71 HB THR 71 6.828 12.971 9.942
513 HG1 THR 71 1HG THR 71 6.060 14.602 7.749
514 HG21 THR 71 3HG2 THR 71 8.357 14.775 8.122
515 HG22 THR 71 1HG2 THR 71 9.012 13.796 9.439
516 HG23 THR 71 2HG2 THR 71 7.903 15.146 9.803
517 H VAL 72 H VAL 72 7.842 10.226 9.266
518 HA VAL 72 HA VAL 72 5.164 9.151 8.860
519 HB VAL 72 HB VAL 72 6.157 6.885 9.145
520 HG11 VAL 72 1HG1 VAL 72 7.476 8.504 6.961
521 HG12 VAL 72 2HG1 VAL 72 5.853 7.842 6.895
522 HG13 VAL 72 3HG1 VAL 72 7.246 6.753 6.946
523 HG21 VAL 72 3HG2 VAL 72 8.614 6.622 8.984
524 HG22 VAL 72 1HG2 VAL 72 8.114 7.469 10.453
525 HG23 VAL 72 2HG2 VAL 72 8.774 8.383 9.107
526 H ASN 73 H ASN 73 4.037 9.207 10.564
527 HA ASN 73 HA ASN 73 3.342 9.455 12.672
528 HB2 ASN 73 2HB ASN 73 5.818 7.795 13.276
529 HB3 ASN 73 1HB ASN 73 4.594 8.181 14.488
530 HD21 ASN 73 1HD2 ASN 73 5.437 5.597 13.362
531 HD22 ASN 73 2HD2 ASN 73 4.010 4.858 12.728
532 H ASN 74 H ASN 74 4.978 11.327 11.406
533 HA ASN 74 HA ASN 74 5.609 13.428 11.666
534 HB2 ASN 74 2HB ASN 74 4.347 13.254 13.973
535 HB3 ASN 74 1HB ASN 74 5.965 13.244 14.651
536 HD21 ASN 74 1HD2 ASN 74 3.891 15.182 14.989
537 HD22 ASN 74 2HD2 ASN 74 4.502 16.697 14.448
538 H ALA 75 H ALA 75 7.413 10.796 12.216
539 HA ALA 75 HA ALA 75 9.878 12.234 12.805
540 HB1 ALA 75 1HB ALA 75 10.895 9.998 12.974
541 HB2 ALA 75 2HB ALA 75 9.360 9.272 12.495
542 HB3 ALA 75 3HB ALA 75 9.483 10.143 14.023
543 HA PRO 76 HA PRO 76 10.510 12.208 8.318
544 HB2 PRO 76 2HB PRO 76 13.060 13.507 8.733
545 HB3 PRO 76 1HB PRO 76 11.580 14.205 8.077
546 HG2 PRO 76 2HG PRO 76 12.679 14.884 10.506
547 HG3 PRO 76 1HG PRO 76 10.975 15.101 10.085
548 HD2 PRO 76 2HD PRO 76 12.267 12.985 11.751
549 HD3 PRO 76 1HD PRO 76 10.673 13.763 11.911
550 H VAL 77 H VAL 77 11.278 10.547 7.237
551 HA VAL 77 HA VAL 77 13.902 9.461 7.845
552 HB VAL 77 HB VAL 77 13.095 7.127 7.743
553 HG11 VAL 77 1HG1 VAL 77 11.751 8.694 9.940
554 HG12 VAL 77 2HG1 VAL 77 13.390 8.043 9.963
555 HG13 VAL 77 3HG1 VAL 77 12.004 6.952 9.946
556 HG21 VAL 77 3HG2 VAL 77 10.667 6.651 7.991
557 HG22 VAL 77 1HG2 VAL 77 11.095 7.406 6.448
558 HG23 VAL 77 2HG2 VAL 77 10.365 8.373 7.725
559 H GLN 78 H GLN 78 14.608 8.057 6.055
560 HA GLN 78 HA GLN 78 13.650 9.178 3.576
561 HB2 GLN 78 2HB GLN 78 15.649 8.307 2.551
562 HB3 GLN 78 1HB GLN 78 16.077 9.106 4.046
563 HG2 GLN 78 2HG GLN 78 15.926 6.127 3.587
564 HG3 GLN 78 1HG GLN 78 17.394 7.083 3.688
565 HE21 GLN 78 1HE2 GLN 78 16.639 4.808 5.202
566 HE22 GLN 78 2HE2 GLN 78 16.609 5.269 6.866
567 H GLU 79 H GLU 79 13.219 6.312 5.340
568 HA GLU 79 HA GLU 79 11.388 5.326 3.437
569 HB2 GLU 79 2HB GLU 79 12.408 3.095 3.108
570 HB3 GLU 79 1HB GLU 79 13.360 4.373 2.381
571 HG2 GLU 79 2HG GLU 79 14.898 4.287 4.286
572 HG3 GLU 79 1HG GLU 79 13.942 2.974 4.976
573 H TRP 80 H TRP 80 10.130 3.606 4.286
574 HA TRP 80 HA TRP 80 10.430 2.923 7.080
575 HB2 TRP 80 2HB TRP 80 9.476 5.143 7.178
576 HB3 TRP 80 1HB TRP 80 8.207 4.729 6.045
577 HD1 TRP 80 HD TRP 80 6.075 3.561 7.069
578 HE1 TRP 80 1HE TRP 80 5.229 3.228 9.487
579 HE3 TRP 80 3HE TRP 80 10.369 4.657 9.565
580 HZ2 TRP 80 2HZ TRP 80 6.253 3.432 12.078
581 HZ3 TRP 80 3HZ TRP 80 10.353 4.577 12.028
582 HH2 TRP 80 HH TRP 80 8.328 3.973 13.251
583 H GLN 81 H GLN 81 9.075 1.212 7.583
584 HA GLN 81 HA GLN 81 7.702 -0.021 5.316
585 HB2 GLN 81 2HB GLN 81 8.617 -1.241 7.950
586 HB3 GLN 81 1HB GLN 81 7.642 -2.094 6.768
587 HG2 GLN 81 2HG GLN 81 9.888 -2.823 6.510
588 HG3 GLN 81 1HG GLN 81 9.508 -1.807 5.128
589 HE21 GLN 81 1HE2 GLN 81 11.625 -1.305 4.682
590 HE22 GLN 81 2HE2 GLN 81 12.602 -0.324 5.690
591 H LEU 82 H LEU 82 5.705 0.547 5.199
592 HA LEU 82 HA LEU 82 4.202 1.857 7.165
593 HB2 LEU 82 2HB LEU 82 3.197 0.291 4.807
594 HB3 LEU 82 1HB LEU 82 2.277 1.444 5.742
595 HG LEU 82 HG LEU 82 4.661 2.072 4.024
596 HD11 LEU 82 1HD1 LEU 82 1.732 2.697 3.650
597 HD12 LEU 82 2HD1 LEU 82 2.675 1.535 2.720
598 HD13 LEU 82 3HD1 LEU 82 3.049 3.252 2.618
599 HD21 LEU 82 3HD2 LEU 82 4.037 4.421 4.487
600 HD22 LEU 82 1HD2 LEU 82 4.588 3.545 5.913
601 HD23 LEU 82 2HD2 LEU 82 2.875 3.829 5.676
602 H ALA 83 H ALA 83 2.631 1.216 8.560
603 HA ALA 83 HA ALA 83 1.617 -1.472 8.521
604 HB1 ALA 83 1HB ALA 83 2.019 -1.762 10.928
605 HB2 ALA 83 2HB ALA 83 2.925 -0.246 10.950
606 HB3 ALA 83 3HB ALA 83 3.540 -1.627 10.042
607 H ASP 84 H ASP 84 -0.186 -1.521 10.290
608 HA ASP 84 HA ASP 84 -1.980 0.563 9.608
609 HB2 ASP 84 2HB ASP 84 -2.748 -1.731 10.164
610 HB3 ASP 84 1HB ASP 84 -2.265 -1.459 11.834
611 H GLY 85 H GLY 85 -2.324 2.433 10.493
612 HA2 GLY 85 2HA GLY 85 -2.771 3.832 12.367
613 HA3 GLY 85 1HA GLY 85 -1.709 2.817 13.333
614 H ASP 86 H ASP 86 -0.169 3.347 10.442
615 HA ASP 86 HA ASP 86 1.500 5.336 11.722
616 HB2 ASP 86 2HB ASP 86 1.866 3.861 9.101
617 HB3 ASP 86 1HB ASP 86 2.955 5.120 9.659
618 H VAL 87 H VAL 87 1.692 7.360 11.229
619 HA VAL 87 HA VAL 87 -0.226 8.461 9.281
620 HB VAL 87 HB VAL 87 1.291 9.963 11.439
621 HG11 VAL 87 1HG1 VAL 87 0.652 11.364 9.563
622 HG12 VAL 87 2HG1 VAL 87 -0.303 11.772 10.986
623 HG13 VAL 87 3HG1 VAL 87 -1.020 10.816 9.692
624 HG21 VAL 87 3HG2 VAL 87 -0.281 8.370 12.436
625 HG22 VAL 87 1HG2 VAL 87 -1.577 9.014 11.429
626 HG23 VAL 87 2HG2 VAL 87 -0.834 10.029 12.669
627 H ILE 88 H ILE 88 0.597 8.937 7.400
628 HA ILE 88 HA ILE 88 3.419 9.644 7.223
629 HB ILE 88 HB ILE 88 1.455 8.527 5.186
630 HG12 ILE 88 2HG1 ILE 88 3.184 6.779 4.819
631 HG13 ILE 88 1HG1 ILE 88 4.180 7.514 6.053
632 HG21 ILE 88 1HG2 ILE 88 3.140 8.728 3.434
633 HG22 ILE 88 2HG2 ILE 88 4.184 9.595 4.558
634 HG23 ILE 88 3HG2 ILE 88 2.647 10.305 4.058
635 HD11 ILE 88 3HD1 ILE 88 3.065 5.526 6.883
636 HD12 ILE 88 1HD1 ILE 88 1.497 6.208 6.453
637 HD13 ILE 88 2HD1 ILE 88 2.464 6.956 7.722
638 H ARG 89 H ARG 89 3.715 11.809 7.300
639 HA ARG 89 HA ARG 89 1.606 13.412 6.090
640 HB2 ARG 89 2HB ARG 89 1.775 13.823 8.487
641 HB3 ARG 89 1HB ARG 89 3.492 14.166 8.322
642 HG2 ARG 89 2HG ARG 89 2.991 16.114 6.949
643 HG3 ARG 89 1HG ARG 89 1.265 15.774 7.089
644 HD2 ARG 89 2HD ARG 89 2.067 17.535 8.634
645 HD3 ARG 89 1HD ARG 89 1.328 16.162 9.456
646 HE ARG 89 HE ARG 89 3.413 15.460 10.174
647 HH11 ARG 89 1HH1 ARG 89 3.673 18.519 8.363
648 HH12 ARG 89 2HH1 ARG 89 5.157 18.957 9.053
649 HH21 ARG 89 1HH2 ARG 89 5.473 16.092 11.120
650 HH22 ARG 89 2HH2 ARG 89 6.209 17.535 10.609
651 H LEU 90 H LEU 90 2.061 14.398 4.394
652 HA LEU 90 HA LEU 90 4.809 14.993 3.743
653 HB2 LEU 90 2HB LEU 90 4.310 14.583 1.344
654 HB3 LEU 90 1HB LEU 90 4.257 13.138 2.306
655 HG LEU 90 HG LEU 90 1.799 14.608 1.309
656 HD11 LEU 90 1HD1 LEU 90 3.156 13.759 -0.530
657 HD12 LEU 90 2HD1 LEU 90 1.688 12.799 -0.338
658 HD13 LEU 90 3HD1 LEU 90 3.232 12.178 0.246
659 HD21 LEU 90 3HD2 LEU 90 2.147 11.819 2.447
660 HD22 LEU 90 1HD2 LEU 90 0.646 12.494 1.812
661 HD23 LEU 90 2HD2 LEU 90 1.363 13.165 3.271
662 H GLY 91 H GLY 91 4.905 16.724 2.001
663 HA2 GLY 91 2HA GLY 91 4.200 19.111 3.001
664 HA3 GLY 91 1HA GLY 91 4.393 18.847 1.284
665 H HIS 92 H HIS 92 2.271 19.471 3.863
666 HA HIS 92 HA HIS 92 0.290 20.446 4.024
667 HB2 HIS 92 2HB HIS 92 0.333 20.638 0.996
668 HB3 HIS 92 1HB HIS 92 -0.854 21.418 2.033
669 HD1 HIS 92 1HD HIS 92 1.301 22.909 0.101
670 HD2 HIS 92 2HD HIS 92 1.481 22.483 4.238
671 HE1 HIS 92 1HE HIS 92 2.789 24.744 0.934
672 H SER 93 H SER 93 0.604 17.434 3.489
673 HA SER 93 HA SER 93 -2.249 16.914 3.643
674 HB2 SER 93 2HB SER 93 -0.555 15.619 1.492
675 HB3 SER 93 1HB SER 93 -2.212 15.170 1.891
676 HG SER 93 HG SER 93 -2.015 17.794 1.560
677 H GLU 94 H GLU 94 -2.678 15.213 5.030
678 HA GLU 94 HA GLU 94 -0.420 13.451 5.610
679 HB2 GLU 94 2HB GLU 94 -1.205 13.249 7.932
680 HB3 GLU 94 1HB GLU 94 -0.792 14.906 7.531
681 HG2 GLU 94 2HG GLU 94 -3.237 15.321 7.165
682 HG3 GLU 94 1HG GLU 94 -3.527 13.712 7.817
683 H ILE 95 H ILE 95 -0.772 11.328 5.666
684 HA ILE 95 HA ILE 95 -3.490 10.451 5.074
685 HB ILE 95 HB ILE 95 -2.040 10.579 3.029
686 HG12 ILE 95 2HG1 ILE 95 -2.401 8.180 2.290
687 HG13 ILE 95 1HG1 ILE 95 -3.013 7.906 3.922
688 HG21 ILE 95 1HG2 ILE 95 -0.260 8.971 2.658
689 HG22 ILE 95 2HG2 ILE 95 -0.416 8.425 4.323
690 HG23 ILE 95 3HG2 ILE 95 0.115 10.077 3.983
691 HD11 ILE 95 3HD1 ILE 95 -4.814 8.334 2.337
692 HD12 ILE 95 1HD1 ILE 95 -4.115 9.913 1.976
693 HD13 ILE 95 2HD1 ILE 95 -4.716 9.546 3.599
694 H ILE 96 H ILE 96 -4.098 8.565 6.158
695 HA ILE 96 HA ILE 96 -2.113 7.560 8.082
696 HB ILE 96 HB ILE 96 -5.144 7.403 8.231
697 HG12 ILE 96 2HG1 ILE 96 -3.233 9.163 9.794
698 HG13 ILE 96 1HG1 ILE 96 -4.253 9.718 8.476
699 HG21 ILE 96 1HG2 ILE 96 -4.040 5.549 9.387
700 HG22 ILE 96 2HG2 ILE 96 -4.776 6.650 10.547
701 HG23 ILE 96 3HG2 ILE 96 -3.033 6.688 10.282
702 HD11 ILE 96 3HD1 ILE 96 -5.213 8.573 11.089
703 HD12 ILE 96 1HD1 ILE 96 -6.237 9.165 9.784
704 HD13 ILE 96 2HD1 ILE 96 -5.187 10.282 10.659
705 H VAL 97 H VAL 97 -1.462 5.514 7.871
706 HA VAL 97 HA VAL 97 -2.625 3.936 5.761
707 HB VAL 97 HB VAL 97 -0.148 3.552 7.459
708 HG11 VAL 97 1HG1 VAL 97 -1.160 1.347 7.016
709 HG12 VAL 97 2HG1 VAL 97 0.326 1.560 6.092
710 HG13 VAL 97 3HG1 VAL 97 -1.246 1.742 5.301
711 HG21 VAL 97 3HG2 VAL 97 -0.604 3.935 4.529
712 HG22 VAL 97 1HG2 VAL 97 0.965 3.829 5.321
713 HG23 VAL 97 2HG2 VAL 97 -0.108 5.207 5.644
714 H ARG 98 H ARG 98 -4.168 2.579 6.052
715 HA ARG 98 HA ARG 98 -4.497 1.291 8.658
716 HB2 ARG 98 2HB ARG 98 -6.526 1.858 6.484
717 HB3 ARG 98 1HB ARG 98 -6.853 1.040 8.006
718 HG2 ARG 98 2HG ARG 98 -5.766 3.804 7.861
719 HG3 ARG 98 1HG ARG 98 -7.513 3.490 7.875
720 HD2 ARG 98 2HD ARG 98 -5.528 2.618 9.987
721 HD3 ARG 98 1HD ARG 98 -6.568 4.036 10.109
722 HE ARG 98 HE ARG 98 -8.195 1.862 9.564
723 HH11 ARG 98 1HH1 ARG 98 -6.056 2.846 12.210
724 HH12 ARG 98 2HH1 ARG 98 -6.976 2.131 13.434
725 HH21 ARG 98 1HH2 ARG 98 -9.487 0.903 11.208
726 HH22 ARG 98 2HH2 ARG 98 -9.015 0.971 12.842
727 H MET 99 H MET 99 -4.219 -0.747 8.677
728 HA MET 99 HA MET 99 -4.159 -2.135 6.102
729 HB2 MET 99 2HB MET 99 -2.327 -2.650 8.437
730 HB3 MET 99 1HB MET 99 -2.565 -3.804 7.140
731 HG2 MET 99 2HG MET 99 -1.838 -2.038 5.546
732 HG3 MET 99 1HG MET 99 -1.419 -1.045 6.939
733 HE1 MET 99 3HE MET 99 2.039 -2.290 5.487
734 HE2 MET 99 1HE MET 99 1.050 -0.879 5.859
735 HE3 MET 99 2HE MET 99 0.577 -1.966 4.555
736 H HIS 100 H HIS 100 -5.243 -3.795 5.807
737 HA HIS 100 HA HIS 100 -7.010 -4.683 7.930
738 HB2 HIS 100 2HB HIS 100 -7.099 -5.179 4.942
739 HB3 HIS 100 1HB HIS 100 -8.325 -5.684 6.100
740 HD1 HIS 100 1HD HIS 100 -9.990 -3.884 6.901
741 HD2 HIS 100 2HD HIS 100 -7.030 -2.426 4.391
742 HE1 HIS 100 1HE HIS 100 -10.692 -1.544 6.271
Start of MODEL 17
1 H1 GLY 1 1HT GLY 1 -11.942 -17.619 -6.384
2 H2 GLY 1 2HT GLY 1 -12.462 -18.753 -5.228
3 H3 GLY 1 3HT GLY 1 -10.989 -17.961 -5.050
4 HA2 GLY 1 1HA GLY 1 -13.581 -16.569 -5.024
5 HA3 GLY 1 2HA GLY 1 -12.656 -17.024 -3.592
6 H HIS 2 H HIS 2 -12.653 -14.718 -3.160
7 HA HIS 2 HA HIS 2 -11.124 -12.993 -4.874
8 HB2 HIS 2 2HB HIS 2 -11.995 -12.563 -1.991
9 HB3 HIS 2 1HB HIS 2 -11.354 -11.337 -3.059
10 HD1 HIS 2 1HD HIS 2 -14.522 -12.577 -1.843
11 HD2 HIS 2 2HD HIS 2 -13.138 -10.990 -5.432
12 HE1 HIS 2 1HE HIS 2 -16.546 -11.760 -3.068
13 H GLY 3 H GLY 3 -10.667 -14.206 -1.565
14 HA2 GLY 3 2HA GLY 3 -8.222 -15.310 -1.766
15 HA3 GLY 3 1HA GLY 3 -7.887 -13.590 -1.603
16 H SER 4 H SER 4 -7.666 -16.099 0.165
17 HA SER 4 HA SER 4 -9.198 -15.266 2.465
18 HB2 SER 4 2HB SER 4 -7.157 -17.476 2.142
19 HB3 SER 4 1HB SER 4 -8.260 -17.272 3.504
20 HG SER 4 HG SER 4 -9.905 -17.875 2.322
21 H ALA 5 H ALA 5 -6.182 -14.722 1.044
22 HA ALA 5 HA ALA 5 -5.308 -13.218 3.369
23 HB1 ALA 5 1HB ALA 5 -3.535 -14.972 1.664
24 HB2 ALA 5 2HB ALA 5 -4.001 -15.292 3.336
25 HB3 ALA 5 3HB ALA 5 -2.983 -13.900 2.955
26 H GLY 6 H GLY 6 -5.972 -11.370 2.468
27 HA2 GLY 6 2HA GLY 6 -4.405 -10.426 0.198
28 HA3 GLY 6 1HA GLY 6 -6.159 -10.250 0.186
29 H THR 7 H THR 7 -3.234 -9.413 1.932
30 HA THR 7 HA THR 7 -4.271 -7.668 3.828
31 HB THR 7 HB THR 7 -1.659 -7.444 2.313
32 HG1 THR 7 1HG THR 7 -2.546 -9.200 4.291
33 HG21 THR 7 3HG2 THR 7 -2.429 -6.481 5.088
34 HG22 THR 7 1HG2 THR 7 -2.146 -5.475 3.666
35 HG23 THR 7 2HG2 THR 7 -0.817 -6.384 4.381
36 H SER 8 H SER 8 -5.536 -5.939 3.389
37 HA SER 8 HA SER 8 -5.030 -4.522 0.892
38 HB2 SER 8 2HB SER 8 -7.392 -4.337 2.749
39 HB3 SER 8 1HB SER 8 -7.275 -3.693 1.112
40 HG SER 8 HG SER 8 -6.884 -6.439 1.604
41 H VAL 9 H VAL 9 -3.786 -2.796 1.129
42 HA VAL 9 HA VAL 9 -3.729 -1.438 3.731
43 HB VAL 9 HB VAL 9 -1.862 -1.019 1.391
44 HG11 VAL 9 1HG1 VAL 9 -1.931 0.816 2.980
45 HG12 VAL 9 2HG1 VAL 9 -0.384 -0.024 3.088
46 HG13 VAL 9 3HG1 VAL 9 -1.625 -0.298 4.312
47 HG21 VAL 9 3HG2 VAL 9 -0.229 -2.417 2.591
48 HG22 VAL 9 1HG2 VAL 9 -1.655 -3.329 2.102
49 HG23 VAL 9 2HG2 VAL 9 -1.467 -2.824 3.778
50 H THR 10 H THR 10 -4.993 0.218 3.874
51 HA THR 10 HA THR 10 -5.616 1.724 1.459
52 HB THR 10 HB THR 10 -7.390 1.256 3.866
53 HG1 THR 10 1HG THR 10 -6.710 -0.387 2.000
54 HG21 THR 10 3HG2 THR 10 -7.960 2.387 1.107
55 HG22 THR 10 1HG2 THR 10 -7.837 3.333 2.588
56 HG23 THR 10 2HG2 THR 10 -9.146 2.166 2.393
57 H LEU 11 H LEU 11 -4.749 3.632 1.549
58 HA LEU 11 HA LEU 11 -3.992 4.704 4.107
59 HB2 LEU 11 2HB LEU 11 -2.764 6.384 2.846
60 HB3 LEU 11 1HB LEU 11 -2.317 4.781 2.324
61 HG LEU 11 HG LEU 11 -3.933 5.279 0.334
62 HD11 LEU 11 1HD1 LEU 11 -3.347 8.095 1.270
63 HD12 LEU 11 2HD1 LEU 11 -4.933 7.331 1.196
64 HD13 LEU 11 3HD1 LEU 11 -4.041 7.664 -0.287
65 HD21 LEU 11 3HD2 LEU 11 -1.274 6.660 0.637
66 HD22 LEU 11 1HD2 LEU 11 -2.089 6.351 -0.895
67 HD23 LEU 11 2HD2 LEU 11 -1.545 5.001 0.101
68 H GLN 12 H GLN 12 -4.925 6.427 5.030
69 HA GLN 12 HA GLN 12 -7.330 7.414 3.682
70 HB2 GLN 12 2HB GLN 12 -7.727 6.257 5.833
71 HB3 GLN 12 1HB GLN 12 -6.679 7.422 6.626
72 HG2 GLN 12 2HG GLN 12 -8.184 9.215 6.123
73 HG3 GLN 12 1HG GLN 12 -9.195 8.145 5.156
74 HE21 GLN 12 1HE2 GLN 12 -10.955 8.517 6.346
75 HE22 GLN 12 2HE2 GLN 12 -11.171 7.898 7.956
76 H LEU 13 H LEU 13 -7.446 9.478 3.173
77 HA LEU 13 HA LEU 13 -5.320 11.227 4.109
78 HB2 LEU 13 2HB LEU 13 -4.528 10.331 2.047
79 HB3 LEU 13 1HB LEU 13 -6.070 10.616 1.266
80 HG LEU 13 HG LEU 13 -5.713 13.028 1.592
81 HD11 LEU 13 1HD1 LEU 13 -4.074 13.002 3.379
82 HD12 LEU 13 2HD1 LEU 13 -3.418 13.847 1.978
83 HD13 LEU 13 3HD1 LEU 13 -2.907 12.196 2.328
84 HD21 LEU 13 3HD2 LEU 13 -3.696 11.555 -0.083
85 HD22 LEU 13 1HD2 LEU 13 -4.130 13.255 -0.279
86 HD23 LEU 13 2HD2 LEU 13 -5.340 11.999 -0.543
87 H ASP 14 H ASP 14 -6.368 12.836 5.009
88 HA ASP 14 HA ASP 14 -8.785 13.805 3.735
89 HB2 ASP 14 2HB ASP 14 -9.016 13.467 6.131
90 HB3 ASP 14 1HB ASP 14 -7.608 14.488 6.432
91 H ASP 15 H ASP 15 -8.231 14.999 2.133
92 HA ASP 15 HA ASP 15 -6.088 16.962 2.398
93 HB2 ASP 15 2HB ASP 15 -6.188 15.478 0.393
94 HB3 ASP 15 1HB ASP 15 -7.761 16.153 0.003
95 H GLY 16 H GLY 16 -8.997 16.911 3.493
96 HA2 GLY 16 2HA GLY 16 -10.081 18.947 4.174
97 HA3 GLY 16 1HA GLY 16 -9.776 19.585 2.558
98 H SER 17 H SER 17 -10.910 16.385 3.506
99 HA SER 17 HA SER 17 -13.592 16.749 2.801
100 HB2 SER 17 2HB SER 17 -12.646 16.997 0.504
101 HB3 SER 17 1HB SER 17 -11.872 15.424 0.672
102 HG SER 17 HG SER 17 -14.624 16.041 0.522
103 H GLY 18 H GLY 18 -11.057 14.292 2.311
104 HA2 GLY 18 2HA GLY 18 -10.809 12.561 4.034
105 HA3 GLY 18 1HA GLY 18 -12.569 12.529 4.117
106 H ARG 19 H ARG 19 -9.777 11.562 2.332
107 HA ARG 19 HA ARG 19 -11.502 9.853 0.662
108 HB2 ARG 19 2HB ARG 19 -8.925 11.217 -0.084
109 HB3 ARG 19 1HB ARG 19 -9.703 9.933 -1.000
110 HG2 ARG 19 2HG ARG 19 -11.075 12.543 -0.386
111 HG3 ARG 19 1HG ARG 19 -10.066 12.311 -1.814
112 HD2 ARG 19 2HD ARG 19 -12.367 11.970 -2.431
113 HD3 ARG 19 1HD ARG 19 -11.533 10.426 -2.482
114 HE ARG 19 HE ARG 19 -12.902 10.944 0.003
115 HH11 ARG 19 1HH1 ARG 19 -13.242 9.607 -3.284
116 HH12 ARG 19 2HH1 ARG 19 -14.592 8.653 -2.889
117 HH21 ARG 19 1HH2 ARG 19 -14.763 9.598 0.521
118 HH22 ARG 19 2HH2 ARG 19 -15.443 8.622 -0.699
119 H THR 20 H THR 20 -10.361 7.894 -0.119
120 HA THR 20 HA THR 20 -8.160 7.045 1.576
121 HB THR 20 HB THR 20 -9.247 4.759 1.700
122 HG1 THR 20 1HG THR 20 -11.652 4.937 1.517
123 HG21 THR 20 3HG2 THR 20 -10.675 7.055 3.009
124 HG22 THR 20 1HG2 THR 20 -9.282 6.197 3.654
125 HG23 THR 20 2HG2 THR 20 -10.846 5.370 3.528
126 H TYR 21 H TYR 21 -6.800 5.539 0.551
127 HA TYR 21 HA TYR 21 -7.437 4.823 -2.218
128 HB2 TYR 21 2HB TYR 21 -6.079 6.902 -2.300
129 HB3 TYR 21 1HB TYR 21 -4.848 6.120 -1.333
130 HD1 TYR 21 2HD TYR 21 -6.566 5.920 -4.616
131 HD2 TYR 21 1HD TYR 21 -3.075 4.966 -2.392
132 HE1 TYR 21 2HE TYR 21 -5.417 5.262 -6.708
133 HE2 TYR 21 1HE TYR 21 -1.914 4.310 -4.472
134 HH TYR 21 HH TYR 21 -2.460 3.578 -6.823
135 H GLN 22 H GLN 22 -7.217 2.740 -2.359
136 HA GLN 22 HA GLN 22 -5.599 1.293 -0.442
137 HB2 GLN 22 2HB GLN 22 -7.845 0.438 -1.091
138 HB3 GLN 22 1HB GLN 22 -7.281 0.268 -2.744
139 HG2 GLN 22 2HG GLN 22 -5.676 -1.411 -2.054
140 HG3 GLN 22 1HG GLN 22 -6.146 -1.198 -0.371
141 HE21 GLN 22 1HE2 GLN 22 -6.236 -3.550 -2.130
142 HE22 GLN 22 2HE2 GLN 22 -7.869 -4.098 -2.070
143 H LEU 23 H LEU 23 -3.707 0.412 -0.851
144 HA LEU 23 HA LEU 23 -2.199 1.412 -3.033
145 HB2 LEU 23 2HB LEU 23 -1.511 -0.760 -1.070
146 HB3 LEU 23 1HB LEU 23 -0.391 -0.010 -2.183
147 HG LEU 23 HG LEU 23 -1.762 1.321 0.149
148 HD11 LEU 23 1HD1 LEU 23 0.023 -0.172 0.795
149 HD12 LEU 23 2HD1 LEU 23 0.518 1.507 1.022
150 HD13 LEU 23 3HD1 LEU 23 1.105 0.589 -0.366
151 HD21 LEU 23 3HD2 LEU 23 0.166 2.458 -1.876
152 HD22 LEU 23 1HD2 LEU 23 -0.358 3.262 -0.398
153 HD23 LEU 23 2HD2 LEU 23 -1.527 2.917 -1.667
154 H ARG 24 H ARG 24 -1.782 0.589 -4.914
155 HA ARG 24 HA ARG 24 -2.957 -1.947 -5.693
156 HB2 ARG 24 2HB ARG 24 -1.436 0.118 -7.300
157 HB3 ARG 24 1HB ARG 24 -2.311 -1.277 -7.917
158 HG2 ARG 24 2HG ARG 24 -3.623 0.975 -6.417
159 HG3 ARG 24 1HG ARG 24 -3.500 0.920 -8.173
160 HD2 ARG 24 2HD ARG 24 -4.829 -1.176 -6.456
161 HD3 ARG 24 1HD ARG 24 -5.667 0.108 -7.320
162 HE ARG 24 HE ARG 24 -4.042 -1.350 -9.097
163 HH11 ARG 24 1HH1 ARG 24 -7.057 -1.619 -7.295
164 HH12 ARG 24 2HH1 ARG 24 -7.783 -2.724 -8.351
165 HH21 ARG 24 1HH2 ARG 24 -5.059 -2.878 -10.618
166 HH22 ARG 24 2HH2 ARG 24 -6.625 -3.437 -10.289
167 H GLU 25 H GLU 25 -1.626 -3.593 -6.586
168 HA GLU 25 HA GLU 25 0.921 -3.693 -5.300
169 HB2 GLU 25 2HB GLU 25 1.215 -5.958 -6.365
170 HB3 GLU 25 1HB GLU 25 -0.194 -5.788 -5.336
171 HG2 GLU 25 2HG GLU 25 -1.600 -5.566 -7.334
172 HG3 GLU 25 1HG GLU 25 -0.159 -5.740 -8.336
173 H GLY 26 H GLY 26 2.686 -3.051 -5.865
174 HA2 GLY 26 2HA GLY 26 4.344 -3.023 -7.798
175 HA3 GLY 26 1HA GLY 26 3.087 -2.048 -8.583
176 H SER 27 H SER 27 4.978 -0.402 -8.449
177 HA SER 27 HA SER 27 4.799 0.764 -5.799
178 HB2 SER 27 2HB SER 27 6.832 2.041 -6.352
179 HB3 SER 27 1HB SER 27 7.066 0.300 -6.374
180 HG SER 27 HG SER 27 6.322 1.318 -8.821
181 H ASN 28 H ASN 28 3.897 2.654 -5.498
182 HA ASN 28 HA ASN 28 2.909 4.013 -7.896
183 HB2 ASN 28 2HB ASN 28 1.039 4.883 -6.488
184 HB3 ASN 28 1HB ASN 28 1.013 3.132 -6.667
185 HD21 ASN 28 1HD2 ASN 28 1.441 1.852 -4.832
186 HD22 ASN 28 2HD2 ASN 28 1.411 2.530 -3.242
187 H ILE 29 H ILE 29 3.458 6.021 -8.216
188 HA ILE 29 HA ILE 29 5.122 7.304 -6.190
189 HB ILE 29 HB ILE 29 4.785 7.997 -9.130
190 HG12 ILE 29 2HG1 ILE 29 7.086 6.637 -7.697
191 HG13 ILE 29 1HG1 ILE 29 5.944 5.843 -8.774
192 HG21 ILE 29 1HG2 ILE 29 6.708 9.482 -8.807
193 HG22 ILE 29 2HG2 ILE 29 6.739 9.078 -7.092
194 HG23 ILE 29 3HG2 ILE 29 5.363 9.953 -7.765
195 HD11 ILE 29 3HD1 ILE 29 6.767 7.212 -10.633
196 HD12 ILE 29 1HD1 ILE 29 8.060 6.273 -9.888
197 HD13 ILE 29 2HD1 ILE 29 7.908 7.995 -9.542
198 H ILE 30 H ILE 30 4.371 8.949 -5.090
199 HA ILE 30 HA ILE 30 1.881 10.203 -5.951
200 HB ILE 30 HB ILE 30 3.069 10.006 -3.143
201 HG12 ILE 30 2HG1 ILE 30 0.683 8.572 -4.355
202 HG13 ILE 30 1HG1 ILE 30 2.240 7.841 -4.005
203 HG21 ILE 30 1HG2 ILE 30 0.453 11.145 -4.079
204 HG22 ILE 30 2HG2 ILE 30 1.813 12.039 -3.408
205 HG23 ILE 30 3HG2 ILE 30 0.921 10.899 -2.397
206 HD11 ILE 30 3HD1 ILE 30 0.352 9.010 -1.969
207 HD12 ILE 30 1HD1 ILE 30 1.902 8.245 -1.621
208 HD13 ILE 30 2HD1 ILE 30 0.585 7.294 -2.303
209 H GLY 31 H GLY 31 1.879 12.348 -6.300
210 HA2 GLY 31 2HA GLY 31 2.979 14.446 -5.258
211 HA3 GLY 31 1HA GLY 31 4.407 13.805 -6.107
212 H ARG 32 H ARG 32 4.166 15.936 -7.178
213 HA ARG 32 HA ARG 32 2.158 15.623 -9.270
214 HB2 ARG 32 2HB ARG 32 3.186 18.172 -8.066
215 HB3 ARG 32 1HB ARG 32 2.291 18.109 -9.577
216 HG2 ARG 32 2HG ARG 32 0.468 16.914 -8.253
217 HG3 ARG 32 1HG ARG 32 1.378 17.369 -6.841
218 HD2 ARG 32 2HD ARG 32 0.590 19.461 -8.839
219 HD3 ARG 32 1HD ARG 32 -0.475 18.981 -7.519
220 HE ARG 32 HE ARG 32 1.027 19.814 -5.982
221 HH11 ARG 32 1HH1 ARG 32 2.094 20.589 -9.316
222 HH12 ARG 32 2HH1 ARG 32 3.182 21.778 -8.814
223 HH21 ARG 32 1HH2 ARG 32 2.433 21.468 -5.382
224 HH22 ARG 32 2HH2 ARG 32 3.411 22.321 -6.523
225 H GLY 33 H GLY 33 3.085 14.836 -10.911
226 HA2 GLY 33 2HA GLY 33 4.990 16.281 -12.334
227 HA3 GLY 33 1HA GLY 33 5.727 14.894 -11.535
228 H GLN 34 H GLN 34 5.870 14.743 -14.055
229 HA GLN 34 HA GLN 34 3.618 13.538 -15.361
230 HB2 GLN 34 2HB GLN 34 5.228 13.165 -17.197
231 HB3 GLN 34 1HB GLN 34 5.283 14.819 -16.606
232 HG2 GLN 34 2HG GLN 34 7.265 14.076 -15.178
233 HG3 GLN 34 1HG GLN 34 7.271 12.616 -16.152
234 HE21 GLN 34 1HE2 GLN 34 7.854 16.007 -16.107
235 HE22 GLN 34 2HE2 GLN 34 8.687 16.091 -17.619
236 H ASP 35 H ASP 35 6.121 12.474 -13.347
237 HA ASP 35 HA ASP 35 6.059 9.667 -14.122
238 HB2 ASP 35 2HB ASP 35 7.381 10.904 -11.715
239 HB3 ASP 35 1HB ASP 35 7.754 9.365 -12.477
240 H ALA 36 H ALA 36 4.768 11.832 -11.800
241 HA ALA 36 HA ALA 36 4.127 9.999 -9.769
242 HB1 ALA 36 1HB ALA 36 2.747 11.786 -8.883
243 HB2 ALA 36 2HB ALA 36 2.919 12.674 -10.398
244 HB3 ALA 36 3HB ALA 36 4.329 12.385 -9.378
245 H GLN 37 H GLN 37 2.268 8.968 -9.322
246 HA GLN 37 HA GLN 37 0.499 8.512 -11.585
247 HB2 GLN 37 2HB GLN 37 0.742 7.095 -8.923
248 HB3 GLN 37 1HB GLN 37 -0.209 6.573 -10.301
249 HG2 GLN 37 2HG GLN 37 2.798 6.780 -10.240
250 HG3 GLN 37 1HG GLN 37 1.872 5.293 -10.058
251 HE21 GLN 37 1HE2 GLN 37 3.048 7.695 -12.287
252 HE22 GLN 37 2HE2 GLN 37 2.551 6.886 -13.713
253 H PHE 38 H PHE 38 0.505 9.271 -8.155
254 HA PHE 38 HA PHE 38 -2.222 10.297 -8.362
255 HB2 PHE 38 2HB PHE 38 -2.070 8.473 -6.804
256 HB3 PHE 38 1HB PHE 38 -0.641 9.159 -6.057
257 HD1 PHE 38 1HD PHE 38 -4.085 10.520 -6.802
258 HD2 PHE 38 2HD PHE 38 -1.052 9.727 -3.918
259 HE1 PHE 38 1HE PHE 38 -5.485 11.497 -5.047
260 HE2 PHE 38 2HE PHE 38 -2.411 10.698 -2.187
261 HZ PHE 38 HZ PHE 38 -4.657 11.597 -2.727
262 H ARG 39 H ARG 39 -2.305 12.391 -8.506
263 HA ARG 39 HA ARG 39 -0.009 13.984 -7.731
264 HB2 ARG 39 2HB ARG 39 -2.461 14.668 -9.341
265 HB3 ARG 39 1HB ARG 39 -1.320 15.879 -8.813
266 HG2 ARG 39 2HG ARG 39 -0.841 15.369 -11.088
267 HG3 ARG 39 1HG ARG 39 0.442 14.655 -10.122
268 HD2 ARG 39 2HD ARG 39 -0.550 12.465 -10.358
269 HD3 ARG 39 1HD ARG 39 -1.951 13.160 -11.178
270 HE ARG 39 HE ARG 39 0.390 13.874 -12.544
271 HH11 ARG 39 1HH1 ARG 39 -1.571 10.960 -11.963
272 HH12 ARG 39 2HH1 ARG 39 -1.234 10.308 -13.504
273 HH21 ARG 39 1HH2 ARG 39 0.810 12.926 -14.641
274 HH22 ARG 39 2HH2 ARG 39 0.125 11.412 -15.023
275 H LEU 40 H LEU 40 0.072 14.724 -5.755
276 HA LEU 40 HA LEU 40 -2.311 15.217 -4.272
277 HB2 LEU 40 2HB LEU 40 0.586 15.523 -3.629
278 HB3 LEU 40 1HB LEU 40 -0.628 16.200 -2.561
279 HG LEU 40 HG LEU 40 -0.325 13.285 -3.278
280 HD11 LEU 40 1HD1 LEU 40 0.153 14.811 -0.745
281 HD12 LEU 40 2HD1 LEU 40 1.413 14.152 -1.798
282 HD13 LEU 40 3HD1 LEU 40 0.314 13.065 -0.938
283 HD21 LEU 40 3HD2 LEU 40 -2.020 12.956 -1.519
284 HD22 LEU 40 1HD2 LEU 40 -2.663 13.829 -2.907
285 HD23 LEU 40 2HD2 LEU 40 -2.243 14.699 -1.434
286 HA PRO 41 HA PRO 41 -2.785 19.317 -5.847
287 HB2 PRO 41 2HB PRO 41 -4.695 19.827 -3.711
288 HB3 PRO 41 1HB PRO 41 -4.966 19.675 -5.445
289 HG2 PRO 41 2HG PRO 41 -5.794 17.823 -3.639
290 HG3 PRO 41 1HG PRO 41 -5.386 17.437 -5.317
291 HD2 PRO 41 2HD PRO 41 -3.807 16.997 -2.827
292 HD3 PRO 41 1HD PRO 41 -3.954 15.999 -4.287
293 H ASP 42 H ASP 42 -1.106 18.818 -3.038
294 HA ASP 42 HA ASP 42 -1.275 21.609 -2.145
295 HB2 ASP 42 2HB ASP 42 -0.959 19.527 -0.530
296 HB3 ASP 42 1HB ASP 42 0.731 19.689 -1.044
297 H THR 43 H THR 43 1.109 22.520 -1.525
298 HA THR 43 HA THR 43 2.553 22.491 -4.043
299 HB THR 43 HB THR 43 2.267 24.759 -2.056
300 HG1 THR 43 1HG THR 43 0.855 24.121 -4.453
301 HG21 THR 43 3HG2 THR 43 3.306 24.716 -4.896
302 HG22 THR 43 1HG2 THR 43 4.292 24.866 -3.440
303 HG23 THR 43 2HG2 THR 43 3.154 26.148 -3.874
304 H GLY 44 H GLY 44 4.819 22.322 -3.895
305 HA2 GLY 44 2HA GLY 44 6.856 22.405 -2.611
306 HA3 GLY 44 1HA GLY 44 5.915 21.942 -1.190
307 H VAL 45 H VAL 45 4.441 20.247 -3.177
308 HA VAL 45 HA VAL 45 5.765 17.776 -2.643
309 HB VAL 45 HB VAL 45 3.382 18.341 -4.442
310 HG11 VAL 45 1HG1 VAL 45 4.327 16.164 -4.829
311 HG12 VAL 45 2HG1 VAL 45 2.767 16.037 -4.002
312 HG13 VAL 45 3HG1 VAL 45 4.265 15.809 -3.100
313 HG21 VAL 45 3HG2 VAL 45 3.431 17.631 -1.521
314 HG22 VAL 45 1HG2 VAL 45 1.985 17.744 -2.529
315 HG23 VAL 45 2HG2 VAL 45 2.957 19.188 -2.211
316 H SER 46 H SER 46 7.255 16.880 -3.881
317 HA SER 46 HA SER 46 8.186 18.134 -6.272
318 HB2 SER 46 2HB SER 46 9.006 15.569 -4.909
319 HB3 SER 46 1HB SER 46 9.935 16.405 -6.149
320 HG SER 46 HG SER 46 9.566 18.260 -4.506
321 H ARG 47 H ARG 47 8.763 16.696 -8.227
322 HA ARG 47 HA ARG 47 6.438 15.668 -9.446
323 HB2 ARG 47 2HB ARG 47 7.906 14.823 -11.251
324 HB3 ARG 47 1HB ARG 47 8.234 16.494 -10.833
325 HG2 ARG 47 2HG ARG 47 10.184 15.703 -9.488
326 HG3 ARG 47 1HG ARG 47 9.847 14.068 -10.039
327 HD2 ARG 47 2HD ARG 47 10.414 16.391 -11.846
328 HD3 ARG 47 1HD ARG 47 11.635 15.230 -11.320
329 HE ARG 47 HE ARG 47 9.560 13.772 -12.517
330 HH11 ARG 47 1HH1 ARG 47 11.918 16.196 -13.555
331 HH12 ARG 47 2HH1 ARG 47 11.967 15.601 -15.156
332 HH21 ARG 47 1HH2 ARG 47 9.688 12.993 -14.582
333 HH22 ARG 47 2HH2 ARG 47 10.689 13.739 -15.781
334 H ARG 48 H ARG 48 8.934 14.184 -7.675
335 HA ARG 48 HA ARG 48 7.294 11.820 -7.322
336 HB2 ARG 48 2HB ARG 48 10.337 11.851 -7.546
337 HB3 ARG 48 1HB ARG 48 9.351 10.447 -7.176
338 HG2 ARG 48 2HG ARG 48 8.354 10.587 -9.430
339 HG3 ARG 48 1HG ARG 48 9.409 11.948 -9.785
340 HD2 ARG 48 2HD ARG 48 11.364 10.507 -9.386
341 HD3 ARG 48 1HD ARG 48 10.285 9.147 -9.090
342 HE ARG 48 HE ARG 48 10.005 10.530 -11.626
343 HH11 ARG 48 1HH1 ARG 48 11.291 7.690 -9.954
344 HH12 ARG 48 2HH1 ARG 48 11.492 6.773 -11.362
345 HH21 ARG 48 1HH2 ARG 48 10.215 9.237 -13.574
346 HH22 ARG 48 2HH2 ARG 48 10.852 7.664 -13.469
347 H HIS 49 H HIS 49 6.619 12.415 -5.360
348 HA HIS 49 HA HIS 49 8.480 13.791 -3.573
349 HB2 HIS 49 2HB HIS 49 6.367 14.935 -3.855
350 HB3 HIS 49 1HB HIS 49 5.453 13.489 -3.485
351 HD2 HIS 49 2HD HIS 49 5.654 12.705 -0.692
352 HE1 HIS 49 1HE HIS 49 6.606 16.621 0.540
353 HE2 HIS 49 2HE HIS 49 6.317 14.207 1.249
354 H LEU 50 H LEU 50 6.494 10.953 -3.870
355 HA LEU 50 HA LEU 50 8.142 9.574 -2.043
356 HB2 LEU 50 2HB LEU 50 6.797 10.747 -0.431
357 HB3 LEU 50 1HB LEU 50 5.328 10.359 -1.282
358 HG LEU 50 HG LEU 50 6.943 8.121 -0.118
359 HD11 LEU 50 1HD1 LEU 50 5.035 9.923 1.395
360 HD12 LEU 50 2HD1 LEU 50 6.782 9.873 1.631
361 HD13 LEU 50 3HD1 LEU 50 5.803 8.464 2.020
362 HD21 LEU 50 3HD2 LEU 50 3.982 8.665 -0.394
363 HD22 LEU 50 1HD2 LEU 50 4.706 7.177 0.213
364 HD23 LEU 50 2HD2 LEU 50 4.945 7.650 -1.466
365 H GLU 51 H GLU 51 7.815 7.405 -2.239
366 HA GLU 51 HA GLU 51 5.699 6.583 -4.080
367 HB2 GLU 51 2HB GLU 51 7.213 5.020 -5.191
368 HB3 GLU 51 1HB GLU 51 7.706 6.680 -5.454
369 HG2 GLU 51 2HG GLU 51 9.396 6.394 -3.663
370 HG3 GLU 51 1HG GLU 51 8.918 4.709 -3.531
371 H ILE 52 H ILE 52 4.818 4.710 -3.664
372 HA ILE 52 HA ILE 52 5.807 3.329 -1.282
373 HB ILE 52 HB ILE 52 2.959 3.464 -2.304
374 HG12 ILE 52 2HG1 ILE 52 4.192 4.641 0.202
375 HG13 ILE 52 1HG1 ILE 52 3.729 5.558 -1.223
376 HG21 ILE 52 1HG2 ILE 52 4.133 2.106 0.120
377 HG22 ILE 52 2HG2 ILE 52 3.515 1.324 -1.334
378 HG23 ILE 52 3HG2 ILE 52 2.409 2.211 -0.269
379 HD11 ILE 52 3HD1 ILE 52 1.872 4.029 0.587
380 HD12 ILE 52 1HD1 ILE 52 1.391 4.941 -0.844
381 HD13 ILE 52 2HD1 ILE 52 2.085 5.779 0.546
382 H ARG 53 H ARG 53 6.754 1.554 -1.846
383 HA ARG 53 HA ARG 53 5.887 0.175 -4.247
384 HB2 ARG 53 2HB ARG 53 8.273 0.355 -4.051
385 HB3 ARG 53 1HB ARG 53 8.260 -0.280 -2.415
386 HG2 ARG 53 2HG ARG 53 7.335 -2.399 -3.330
387 HG3 ARG 53 1HG ARG 53 7.548 -1.720 -4.938
388 HD2 ARG 53 2HD ARG 53 9.903 -1.653 -4.679
389 HD3 ARG 53 1HD ARG 53 9.787 -2.079 -2.961
390 HE ARG 53 HE ARG 53 8.532 -4.116 -4.087
391 HH11 ARG 53 1HH1 ARG 53 11.755 -2.763 -4.750
392 HH12 ARG 53 2HH1 ARG 53 12.347 -4.214 -5.424
393 HH21 ARG 53 1HH2 ARG 53 9.358 -6.050 -4.983
394 HH22 ARG 53 2HH2 ARG 53 10.956 -6.139 -5.557
395 H TRP 54 H TRP 54 4.183 -1.043 -3.945
396 HA TRP 54 HA TRP 54 3.970 -2.395 -1.399
397 HB2 TRP 54 2HB TRP 54 2.074 -0.989 -1.675
398 HB3 TRP 54 1HB TRP 54 1.877 -1.453 -3.358
399 HD1 TRP 54 HD TRP 54 -0.205 -2.934 -3.661
400 HE1 TRP 54 1HE TRP 54 -1.443 -4.721 -2.283
401 HE3 TRP 54 3HE TRP 54 2.727 -2.956 0.483
402 HZ2 TRP 54 2HZ TRP 54 -1.204 -5.981 0.212
403 HZ3 TRP 54 3HZ TRP 54 2.186 -4.463 2.313
404 HH2 TRP 54 HH TRP 54 0.245 -5.963 2.193
405 H ASP 55 H ASP 55 4.452 -4.405 -1.428
406 HA ASP 55 HA ASP 55 3.890 -6.047 -3.807
407 HB2 ASP 55 2HB ASP 55 6.036 -6.357 -1.680
408 HB3 ASP 55 1HB ASP 55 5.589 -7.651 -2.779
409 H GLY 56 H GLY 56 3.188 -8.251 -3.181
410 HA2 GLY 56 2HA GLY 56 1.128 -8.060 -1.213
411 HA3 GLY 56 1HA GLY 56 1.552 -9.487 -2.142
412 H GLN 57 H GLN 57 3.028 -7.519 0.355
413 HA GLN 57 HA GLN 57 3.059 -9.516 2.340
414 HB2 GLN 57 2HB GLN 57 4.816 -10.454 0.861
415 HB3 GLN 57 1HB GLN 57 5.726 -8.959 1.025
416 HG2 GLN 57 2HG GLN 57 5.933 -9.359 3.429
417 HG3 GLN 57 1HG GLN 57 5.025 -10.856 3.245
418 HE21 GLN 57 1HE2 GLN 57 8.027 -9.244 2.637
419 HE22 GLN 57 2HE2 GLN 57 8.906 -10.672 2.213
420 H VAL 58 H VAL 58 5.066 -6.776 1.154
421 HA VAL 58 HA VAL 58 4.495 -5.406 3.652
422 HB VAL 58 HB VAL 58 6.849 -4.557 3.775
423 HG11 VAL 58 1HG1 VAL 58 6.132 -6.331 5.265
424 HG12 VAL 58 2HG1 VAL 58 7.820 -6.548 4.808
425 HG13 VAL 58 3HG1 VAL 58 6.569 -7.541 4.061
426 HG21 VAL 58 3HG2 VAL 58 8.632 -5.787 2.614
427 HG22 VAL 58 1HG2 VAL 58 7.534 -5.000 1.479
428 HG23 VAL 58 2HG2 VAL 58 7.410 -6.735 1.760
429 H ALA 59 H ALA 59 4.658 -3.193 3.588
430 HA ALA 59 HA ALA 59 4.443 -2.044 0.907
431 HB1 ALA 59 1HB ALA 59 3.332 -1.072 3.532
432 HB2 ALA 59 2HB ALA 59 2.396 -1.861 2.263
433 HB3 ALA 59 3HB ALA 59 3.123 -0.278 1.971
434 H LEU 60 H LEU 60 6.266 -1.278 0.388
435 HA LEU 60 HA LEU 60 8.104 -0.267 2.367
436 HB2 LEU 60 2HB LEU 60 8.861 -1.823 0.693
437 HB3 LEU 60 1HB LEU 60 8.333 -0.754 -0.580
438 HG LEU 60 HG LEU 60 10.028 0.899 0.208
439 HD11 LEU 60 1HD1 LEU 60 11.811 0.086 1.680
440 HD12 LEU 60 2HD1 LEU 60 10.898 -1.409 1.930
441 HD13 LEU 60 3HD1 LEU 60 10.244 0.128 2.492
442 HD21 LEU 60 3HD2 LEU 60 10.401 -0.543 -1.669
443 HD22 LEU 60 1HD2 LEU 60 10.963 -1.830 -0.609
444 HD23 LEU 60 2HD2 LEU 60 11.912 -0.344 -0.761
445 H LEU 61 H LEU 61 7.848 1.715 2.919
446 HA LEU 61 HA LEU 61 6.726 3.728 1.151
447 HB2 LEU 61 2HB LEU 61 5.849 3.368 3.376
448 HB3 LEU 61 1HB LEU 61 7.379 3.618 4.133
449 HG LEU 61 HG LEU 61 5.858 5.479 4.519
450 HD11 LEU 61 1HD1 LEU 61 7.100 7.411 3.742
451 HD12 LEU 61 2HD1 LEU 61 8.011 6.383 2.633
452 HD13 LEU 61 3HD1 LEU 61 8.162 6.151 4.373
453 HD21 LEU 61 3HD2 LEU 61 5.725 5.832 1.544
454 HD22 LEU 61 1HD2 LEU 61 4.923 6.828 2.754
455 HD23 LEU 61 2HD2 LEU 61 4.453 5.141 2.552
456 H ALA 62 H ALA 62 8.107 5.047 0.037
457 HA ALA 62 HA ALA 62 10.743 5.559 1.197
458 HB1 ALA 62 1HB ALA 62 11.726 5.494 -1.025
459 HB2 ALA 62 2HB ALA 62 10.154 5.106 -1.730
460 HB3 ALA 62 3HB ALA 62 10.950 3.953 -0.658
461 H ASP 63 H ASP 63 11.238 7.600 1.354
462 HA ASP 63 HA ASP 63 9.351 9.642 0.396
463 HB2 ASP 63 2HB ASP 63 9.754 9.677 2.768
464 HB3 ASP 63 1HB ASP 63 11.491 9.656 2.530
465 H LEU 64 H LEU 64 9.851 11.060 -1.178
466 HA LEU 64 HA LEU 64 12.684 11.373 -1.994
467 HB2 LEU 64 2HB LEU 64 10.194 11.388 -3.710
468 HB3 LEU 64 1HB LEU 64 11.742 11.937 -4.258
469 HG LEU 64 HG LEU 64 11.188 9.878 -5.201
470 HD11 LEU 64 1HD1 LEU 64 13.152 8.517 -4.584
471 HD12 LEU 64 2HD1 LEU 64 13.373 9.520 -3.152
472 HD13 LEU 64 3HD1 LEU 64 13.533 10.227 -4.761
473 HD21 LEU 64 3HD2 LEU 64 9.662 8.936 -3.628
474 HD22 LEU 64 1HD2 LEU 64 10.937 8.745 -2.420
475 HD23 LEU 64 2HD2 LEU 64 10.971 7.788 -3.905
476 H ASN 65 H ASN 65 12.485 13.261 -0.372
477 HA ASN 65 HA ASN 65 12.251 15.701 -1.763
478 HB2 ASN 65 2HB ASN 65 9.758 15.137 -1.473
479 HB3 ASN 65 1HB ASN 65 10.009 15.312 0.257
480 HD21 ASN 65 1HD2 ASN 65 8.276 16.777 -1.473
481 HD22 ASN 65 2HD2 ASN 65 8.693 18.448 -1.396
482 H SER 66 H SER 66 13.882 16.706 -0.748
483 HA SER 66 HA SER 66 14.447 16.031 1.986
484 HB2 SER 66 2HB SER 66 15.823 17.961 0.130
485 HB3 SER 66 1HB SER 66 16.470 17.363 1.661
486 HG SER 66 HG SER 66 16.258 15.229 0.729
487 H THR 67 H THR 67 12.812 18.565 0.296
488 HA THR 67 HA THR 67 13.129 20.541 2.360
489 HB THR 67 HB THR 67 11.076 20.567 0.141
490 HG1 THR 67 1HG THR 67 13.868 20.769 0.024
491 HG21 THR 67 3HG2 THR 67 11.436 22.998 0.267
492 HG22 THR 67 1HG2 THR 67 12.645 22.758 1.530
493 HG23 THR 67 2HG2 THR 67 10.957 22.355 1.839
494 H ASN 68 H ASN 68 10.402 18.707 1.035
495 HA ASN 68 HA ASN 68 8.800 19.283 3.440
496 HB2 ASN 68 2HB ASN 68 7.939 18.469 0.645
497 HB3 ASN 68 1HB ASN 68 6.836 18.625 2.003
498 HD21 ASN 68 1HD2 ASN 68 5.617 20.252 0.993
499 HD22 ASN 68 2HD2 ASN 68 6.276 21.828 0.766
500 H GLY 69 H GLY 69 10.840 17.267 3.271
501 HA2 GLY 69 2HA GLY 69 10.236 14.691 2.678
502 HA3 GLY 69 1HA GLY 69 11.216 15.153 4.051
503 H THR 70 H THR 70 9.074 13.136 3.322
504 HA THR 70 HA THR 70 6.845 13.640 4.994
505 HB THR 70 HB THR 70 7.709 11.068 3.702
506 HG1 THR 70 1HG THR 70 7.794 12.405 2.055
507 HG21 THR 70 3HG2 THR 70 5.293 10.740 3.499
508 HG22 THR 70 1HG2 THR 70 5.009 12.297 4.281
509 HG23 THR 70 2HG2 THR 70 5.758 10.983 5.186
510 H THR 71 H THR 71 6.428 12.833 7.022
511 HA THR 71 HA THR 71 8.541 11.332 8.353
512 HB THR 71 HB THR 71 7.364 12.109 10.441
513 HG1 THR 71 1HG THR 71 6.254 14.313 9.573
514 HG21 THR 71 3HG2 THR 71 8.500 14.220 8.630
515 HG22 THR 71 1HG2 THR 71 9.396 13.121 9.692
516 HG23 THR 71 2HG2 THR 71 8.313 14.330 10.396
517 H VAL 72 H VAL 72 7.969 9.571 9.588
518 HA VAL 72 HA VAL 72 5.265 8.567 9.150
519 HB VAL 72 HB VAL 72 6.197 6.274 9.420
520 HG11 VAL 72 1HG1 VAL 72 5.916 7.164 7.195
521 HG12 VAL 72 2HG1 VAL 72 7.368 6.161 7.260
522 HG13 VAL 72 3HG1 VAL 72 7.505 7.923 7.274
523 HG21 VAL 72 3HG2 VAL 72 8.154 6.833 10.785
524 HG22 VAL 72 1HG2 VAL 72 8.860 7.691 9.418
525 HG23 VAL 72 2HG2 VAL 72 8.635 5.940 9.341
526 H ASN 73 H ASN 73 4.090 8.604 10.832
527 HA ASN 73 HA ASN 73 3.335 8.839 12.893
528 HB2 ASN 73 2HB ASN 73 5.752 7.131 13.548
529 HB3 ASN 73 1HB ASN 73 4.570 7.590 14.773
530 HD21 ASN 73 1HD2 ASN 73 5.279 4.956 13.608
531 HD22 ASN 73 2HD2 ASN 73 3.810 4.301 12.987
532 H ASN 74 H ASN 74 5.064 10.727 11.690
533 HA ASN 74 HA ASN 74 5.688 12.781 11.991
534 HB2 ASN 74 2HB ASN 74 4.026 12.870 13.885
535 HB3 ASN 74 1HB ASN 74 5.327 12.465 14.992
536 HD21 ASN 74 1HD2 ASN 74 4.903 14.393 16.084
537 HD22 ASN 74 2HD2 ASN 74 5.427 15.928 15.514
538 H ALA 75 H ALA 75 7.475 10.439 12.115
539 HA ALA 75 HA ALA 75 9.876 11.800 13.136
540 HB1 ALA 75 1HB ALA 75 9.375 9.720 14.359
541 HB2 ALA 75 2HB ALA 75 10.878 9.595 13.444
542 HB3 ALA 75 3HB ALA 75 9.408 8.830 12.836
543 HA PRO 76 HA PRO 76 10.859 11.865 8.769
544 HB2 PRO 76 2HB PRO 76 13.388 12.810 8.925
545 HB3 PRO 76 1HB PRO 76 11.979 13.831 9.229
546 HG2 PRO 76 2HG PRO 76 13.820 12.513 11.180
547 HG3 PRO 76 1HG PRO 76 13.105 14.131 11.235
548 HD2 PRO 76 2HD PRO 76 12.146 12.000 12.661
549 HD3 PRO 76 1HD PRO 76 11.138 13.360 12.137
550 H VAL 77 H VAL 77 11.344 10.240 7.471
551 HA VAL 77 HA VAL 77 13.737 8.644 7.900
552 HB VAL 77 HB VAL 77 12.533 6.546 7.429
553 HG11 VAL 77 1HG1 VAL 77 11.422 7.946 9.855
554 HG12 VAL 77 2HG1 VAL 77 12.943 7.061 9.766
555 HG13 VAL 77 3HG1 VAL 77 11.412 6.204 9.578
556 HG21 VAL 77 3HG2 VAL 77 10.650 7.374 6.196
557 HG22 VAL 77 1HG2 VAL 77 10.066 8.252 7.611
558 HG23 VAL 77 2HG2 VAL 77 10.055 6.493 7.606
559 H GLN 78 H GLN 78 14.206 7.369 5.934
560 HA GLN 78 HA GLN 78 13.138 8.656 3.557
561 HB2 GLN 78 2HB GLN 78 15.683 7.158 4.079
562 HB3 GLN 78 1HB GLN 78 15.172 7.694 2.476
563 HG2 GLN 78 2HG GLN 78 15.485 9.513 4.826
564 HG3 GLN 78 1HG GLN 78 16.751 9.234 3.634
565 HE21 GLN 78 1HE2 GLN 78 13.583 10.556 4.205
566 HE22 GLN 78 2HE2 GLN 78 13.449 11.489 2.783
567 H GLU 79 H GLU 79 13.507 5.597 5.181
568 HA GLU 79 HA GLU 79 11.632 4.472 3.271
569 HB2 GLU 79 2HB GLU 79 12.784 2.267 3.482
570 HB3 GLU 79 1HB GLU 79 13.727 3.472 2.620
571 HG2 GLU 79 2HG GLU 79 15.194 3.768 4.443
572 HG3 GLU 79 1HG GLU 79 14.113 2.907 5.538
573 H TRP 80 H TRP 80 10.174 3.063 4.198
574 HA TRP 80 HA TRP 80 10.391 2.346 6.981
575 HB2 TRP 80 2HB TRP 80 9.566 4.611 7.165
576 HB3 TRP 80 1HB TRP 80 8.223 4.322 6.079
577 HD1 TRP 80 HD TRP 80 6.081 3.221 7.127
578 HE1 TRP 80 1HE TRP 80 5.352 2.765 9.556
579 HE3 TRP 80 3HE TRP 80 10.581 3.864 9.405
580 HZ2 TRP 80 2HZ TRP 80 6.552 2.727 12.095
581 HZ3 TRP 80 3HZ TRP 80 10.705 3.604 11.830
582 HH2 TRP 80 HH TRP 80 8.730 3.053 13.145
583 H GLN 81 H GLN 81 8.993 0.720 7.503
584 HA GLN 81 HA GLN 81 7.499 -0.417 5.288
585 HB2 GLN 81 2HB GLN 81 7.515 -2.549 6.512
586 HB3 GLN 81 1HB GLN 81 9.151 -1.950 6.342
587 HG2 GLN 81 2HG GLN 81 7.466 -1.708 8.806
588 HG3 GLN 81 1HG GLN 81 8.656 -2.984 8.544
589 HE21 GLN 81 1HE2 GLN 81 8.427 -0.898 10.605
590 HE22 GLN 81 2HE2 GLN 81 9.934 -0.054 10.590
591 H LEU 82 H LEU 82 5.560 0.350 5.204
592 HA LEU 82 HA LEU 82 4.165 1.682 7.232
593 HB2 LEU 82 2HB LEU 82 2.930 0.209 4.912
594 HB3 LEU 82 1HB LEU 82 2.162 1.423 5.891
595 HG LEU 82 HG LEU 82 4.515 1.912 4.074
596 HD11 LEU 82 1HD1 LEU 82 2.438 1.459 2.845
597 HD12 LEU 82 2HD1 LEU 82 2.915 3.149 2.711
598 HD13 LEU 82 3HD1 LEU 82 1.613 2.688 3.803
599 HD21 LEU 82 3HD2 LEU 82 4.537 3.394 5.985
600 HD22 LEU 82 1HD2 LEU 82 2.837 3.780 5.728
601 HD23 LEU 82 2HD2 LEU 82 4.036 4.272 4.540
602 H ALA 83 H ALA 83 3.064 1.044 8.950
603 HA ALA 83 HA ALA 83 1.982 -1.677 9.033
604 HB1 ALA 83 1HB ALA 83 2.918 0.071 11.300
605 HB2 ALA 83 2HB ALA 83 3.788 -1.322 10.660
606 HB3 ALA 83 3HB ALA 83 2.232 -1.545 11.465
607 H ASP 84 H ASP 84 0.014 -1.793 10.372
608 HA ASP 84 HA ASP 84 -1.852 0.167 9.579
609 HB2 ASP 84 2HB ASP 84 -2.525 -2.146 9.962
610 HB3 ASP 84 1HB ASP 84 -2.080 -2.018 11.660
611 H GLY 85 H GLY 85 -2.262 2.043 10.448
612 HA2 GLY 85 2HA GLY 85 -2.903 3.345 12.341
613 HA3 GLY 85 1HA GLY 85 -1.762 2.419 13.306
614 H ASP 86 H ASP 86 -0.034 2.869 10.607
615 HA ASP 86 HA ASP 86 1.521 4.907 11.843
616 HB2 ASP 86 2HB ASP 86 1.799 3.574 9.152
617 HB3 ASP 86 1HB ASP 86 2.855 4.876 9.668
618 H VAL 87 H VAL 87 1.643 6.952 11.522
619 HA VAL 87 HA VAL 87 -0.235 8.145 9.602
620 HB VAL 87 HB VAL 87 1.170 9.550 11.892
621 HG11 VAL 87 1HG1 VAL 87 -1.184 10.364 10.195
622 HG12 VAL 87 2HG1 VAL 87 0.447 11.021 10.106
623 HG13 VAL 87 3HG1 VAL 87 -0.529 11.278 11.552
624 HG21 VAL 87 3HG2 VAL 87 -0.995 9.418 13.095
625 HG22 VAL 87 1HG2 VAL 87 -0.282 7.827 12.819
626 HG23 VAL 87 2HG2 VAL 87 -1.618 8.381 11.813
627 H ILE 88 H ILE 88 0.639 8.727 7.835
628 HA ILE 88 HA ILE 88 3.467 9.349 7.712
629 HB ILE 88 HB ILE 88 1.402 8.445 5.700
630 HG12 ILE 88 2HG1 ILE 88 3.129 6.799 5.044
631 HG13 ILE 88 1HG1 ILE 88 4.231 7.499 6.211
632 HG21 ILE 88 1HG2 ILE 88 4.010 9.695 4.902
633 HG22 ILE 88 2HG2 ILE 88 2.400 10.355 4.605
634 HG23 ILE 88 3HG2 ILE 88 2.899 8.855 3.820
635 HD11 ILE 88 3HD1 ILE 88 3.264 5.416 7.024
636 HD12 ILE 88 1HD1 ILE 88 1.643 6.080 6.830
637 HD13 ILE 88 2HD1 ILE 88 2.740 6.773 8.019
638 H ARG 89 H ARG 89 3.984 11.463 7.701
639 HA ARG 89 HA ARG 89 1.893 13.433 6.979
640 HB2 ARG 89 2HB ARG 89 4.054 13.696 9.046
641 HB3 ARG 89 1HB ARG 89 2.977 14.976 8.535
642 HG2 ARG 89 2HG ARG 89 1.085 13.586 9.372
643 HG3 ARG 89 1HG ARG 89 2.291 12.484 10.058
644 HD2 ARG 89 2HD ARG 89 1.536 14.160 11.712
645 HD3 ARG 89 1HD ARG 89 3.263 14.307 11.353
646 HE ARG 89 HE ARG 89 1.423 15.952 9.820
647 HH11 ARG 89 1HH1 ARG 89 3.825 15.900 12.457
648 HH12 ARG 89 2HH1 ARG 89 4.065 17.574 12.427
649 HH21 ARG 89 1HH2 ARG 89 1.784 18.184 9.771
650 HH22 ARG 89 2HH2 ARG 89 2.838 18.947 10.853
651 H LEU 90 H LEU 90 2.340 14.717 5.490
652 HA LEU 90 HA LEU 90 5.090 15.460 4.988
653 HB2 LEU 90 2HB LEU 90 4.534 15.794 2.582
654 HB3 LEU 90 1HB LEU 90 4.502 14.119 3.058
655 HG LEU 90 HG LEU 90 1.950 15.694 2.889
656 HD11 LEU 90 1HD1 LEU 90 3.133 16.014 0.766
657 HD12 LEU 90 2HD1 LEU 90 1.756 14.931 0.568
658 HD13 LEU 90 3HD1 LEU 90 3.391 14.274 0.645
659 HD21 LEU 90 3HD2 LEU 90 1.015 13.485 2.390
660 HD22 LEU 90 1HD2 LEU 90 1.892 13.464 3.921
661 HD23 LEU 90 2HD2 LEU 90 2.628 12.774 2.473
662 H GLY 91 H GLY 91 5.127 17.665 3.910
663 HA2 GLY 91 2HA GLY 91 4.126 19.583 5.548
664 HA3 GLY 91 1HA GLY 91 4.473 19.885 3.854
665 H HIS 92 H HIS 92 2.142 19.766 6.229
666 HA HIS 92 HA HIS 92 0.039 20.460 6.379
667 HB2 HIS 92 2HB HIS 92 0.348 22.091 4.600
668 HB3 HIS 92 1HB HIS 92 0.121 20.856 3.374
669 HD1 HIS 92 1HD HIS 92 -2.095 21.247 2.267
670 HD2 HIS 92 2HD HIS 92 -2.228 22.018 6.354
671 HE1 HIS 92 1HE HIS 92 -4.496 21.850 2.796
672 H SER 93 H SER 93 0.702 17.916 4.134
673 HA SER 93 HA SER 93 -2.052 16.975 4.463
674 HB2 SER 93 2HB SER 93 0.025 16.016 2.485
675 HB3 SER 93 1HB SER 93 -1.679 15.568 2.521
676 HG SER 93 HG SER 93 -0.930 18.258 2.403
677 H GLU 94 H GLU 94 -2.481 15.226 5.667
678 HA GLU 94 HA GLU 94 -0.289 13.466 6.257
679 HB2 GLU 94 2HB GLU 94 -1.309 13.187 8.616
680 HB3 GLU 94 1HB GLU 94 -0.333 14.600 8.275
681 HG2 GLU 94 2HG GLU 94 -2.157 15.323 9.572
682 HG3 GLU 94 1HG GLU 94 -2.455 15.876 7.936
683 H ILE 95 H ILE 95 -0.769 11.344 6.683
684 HA ILE 95 HA ILE 95 -3.402 10.503 5.893
685 HB ILE 95 HB ILE 95 -2.559 10.480 3.779
686 HG12 ILE 95 2HG1 ILE 95 -3.175 8.080 4.391
687 HG13 ILE 95 1HG1 ILE 95 -2.200 8.319 2.948
688 HG21 ILE 95 1HG2 ILE 95 -0.294 9.960 3.035
689 HG22 ILE 95 2HG2 ILE 95 0.172 9.781 4.726
690 HG23 ILE 95 3HG2 ILE 95 -0.413 11.333 4.140
691 HD11 ILE 95 3HD1 ILE 95 -0.217 7.558 4.098
692 HD12 ILE 95 1HD1 ILE 95 -1.496 6.360 4.308
693 HD13 ILE 95 2HD1 ILE 95 -1.104 7.460 5.622
694 H ILE 96 H ILE 96 -4.066 8.645 6.746
695 HA ILE 96 HA ILE 96 -2.222 7.366 8.647
696 HB ILE 96 HB ILE 96 -5.275 7.421 8.724
697 HG12 ILE 96 2HG1 ILE 96 -4.889 8.554 10.998
698 HG13 ILE 96 1HG1 ILE 96 -3.223 8.774 10.500
699 HG21 ILE 96 1HG2 ILE 96 -3.375 6.086 10.644
700 HG22 ILE 96 2HG2 ILE 96 -4.477 5.287 9.525
701 HG23 ILE 96 3HG2 ILE 96 -5.119 6.234 10.867
702 HD11 ILE 96 3HD1 ILE 96 -5.646 9.936 9.138
703 HD12 ILE 96 1HD1 ILE 96 -3.972 10.166 8.634
704 HD13 ILE 96 2HD1 ILE 96 -4.520 10.801 10.184
705 H VAL 97 H VAL 97 -1.629 5.334 8.226
706 HA VAL 97 HA VAL 97 -2.811 3.966 5.967
707 HB VAL 97 HB VAL 97 -0.384 3.343 7.676
708 HG11 VAL 97 1HG1 VAL 97 0.100 1.535 6.085
709 HG12 VAL 97 2HG1 VAL 97 -1.436 1.846 5.271
710 HG13 VAL 97 3HG1 VAL 97 -1.425 1.249 6.928
711 HG21 VAL 97 3HG2 VAL 97 0.834 3.821 5.629
712 HG22 VAL 97 1HG2 VAL 97 -0.152 5.204 6.115
713 HG23 VAL 97 2HG2 VAL 97 -0.686 4.153 4.802
714 H ARG 98 H ARG 98 -4.395 2.552 6.192
715 HA ARG 98 HA ARG 98 -4.478 0.982 8.647
716 HB2 ARG 98 2HB ARG 98 -6.733 2.163 7.052
717 HB3 ARG 98 1HB ARG 98 -6.977 0.779 8.105
718 HG2 ARG 98 2HG ARG 98 -5.974 3.490 8.980
719 HG3 ARG 98 1HG ARG 98 -7.621 2.878 9.181
720 HD2 ARG 98 2HD ARG 98 -6.686 0.979 10.487
721 HD3 ARG 98 1HD ARG 98 -5.108 1.743 10.404
722 HE ARG 98 HE ARG 98 -6.632 3.672 11.465
723 HH11 ARG 98 1HH1 ARG 98 -6.092 0.260 12.289
724 HH12 ARG 98 2HH1 ARG 98 -6.499 0.438 13.921
725 HH21 ARG 98 1HH2 ARG 98 -7.102 3.919 13.790
726 HH22 ARG 98 2HH2 ARG 98 -7.063 2.548 14.798
727 H MET 99 H MET 99 -4.860 -1.124 8.461
728 HA MET 99 HA MET 99 -4.800 -2.156 5.721
729 HB2 MET 99 2HB MET 99 -3.421 -3.259 8.172
730 HB3 MET 99 1HB MET 99 -3.565 -4.119 6.644
731 HG2 MET 99 2HG MET 99 -2.334 -2.305 5.546
732 HG3 MET 99 1HG MET 99 -2.146 -1.514 7.106
733 HE1 MET 99 3HE MET 99 0.481 -1.440 6.624
734 HE2 MET 99 1HE MET 99 0.241 -2.304 5.104
735 HE3 MET 99 2HE MET 99 1.443 -2.873 6.263
736 H HIS 100 H HIS 100 -6.124 -3.735 5.240
737 HA HIS 100 HA HIS 100 -7.926 -4.658 7.348
738 HB2 HIS 100 2HB HIS 100 -8.508 -4.407 4.373
739 HB3 HIS 100 1HB HIS 100 -9.622 -5.002 5.589
740 HD1 HIS 100 1HD HIS 100 -10.638 -3.158 7.260
741 HD2 HIS 100 2HD HIS 100 -8.319 -1.666 4.143
742 HE1 HIS 100 1HE HIS 100 -11.130 -0.700 7.133
Start of MODEL 18
1 H1 GLY 1 1HT GLY 1 -3.713 -13.769 -12.576
2 H2 GLY 1 2HT GLY 1 -4.531 -13.110 -13.883
3 H3 GLY 1 3HT GLY 1 -4.044 -14.745 -13.899
4 HA2 GLY 1 1HA GLY 1 -6.436 -14.479 -13.429
5 HA3 GLY 1 2HA GLY 1 -5.540 -15.260 -12.124
6 H HIS 2 H HIS 2 -7.667 -14.318 -11.061
7 HA HIS 2 HA HIS 2 -6.892 -11.653 -10.134
8 HB2 HIS 2 2HB HIS 2 -9.153 -11.046 -9.708
9 HB3 HIS 2 1HB HIS 2 -9.228 -11.861 -11.256
10 HD1 HIS 2 1HD HIS 2 -10.710 -11.838 -7.921
11 HD2 HIS 2 2HD HIS 2 -10.291 -14.590 -11.010
12 HE1 HIS 2 1HE HIS 2 -12.386 -13.659 -7.464
13 H GLY 3 H GLY 3 -7.213 -11.259 -7.838
14 HA2 GLY 3 2HA GLY 3 -7.878 -13.225 -6.036
15 HA3 GLY 3 1HA GLY 3 -6.143 -13.336 -6.339
16 H SER 4 H SER 4 -6.599 -12.773 -3.939
17 HA SER 4 HA SER 4 -6.930 -9.945 -3.475
18 HB2 SER 4 2HB SER 4 -6.113 -12.117 -1.542
19 HB3 SER 4 1HB SER 4 -6.837 -10.551 -1.161
20 HG SER 4 HG SER 4 -8.704 -11.269 -2.332
21 H ALA 5 H ALA 5 -5.248 -8.615 -2.667
22 HA ALA 5 HA ALA 5 -2.575 -9.350 -3.402
23 HB1 ALA 5 1HB ALA 5 -3.357 -7.034 -3.676
24 HB2 ALA 5 2HB ALA 5 -2.008 -7.093 -2.539
25 HB3 ALA 5 3HB ALA 5 -3.654 -6.922 -1.942
26 H GLY 6 H GLY 6 -4.611 -9.597 -0.740
27 HA2 GLY 6 2HA GLY 6 -4.051 -11.204 0.985
28 HA3 GLY 6 1HA GLY 6 -2.398 -10.585 0.943
29 H THR 7 H THR 7 -3.037 -7.940 0.724
30 HA THR 7 HA THR 7 -4.591 -7.174 3.026
31 HB THR 7 HB THR 7 -1.654 -6.543 2.590
32 HG1 THR 7 1HG THR 7 -2.978 -7.857 4.725
33 HG21 THR 7 3HG2 THR 7 -1.803 -5.216 4.668
34 HG22 THR 7 1HG2 THR 7 -3.546 -5.500 4.710
35 HG23 THR 7 2HG2 THR 7 -2.830 -4.569 3.387
36 H SER 8 H SER 8 -5.658 -5.241 2.426
37 HA SER 8 HA SER 8 -4.650 -4.018 -0.017
38 HB2 SER 8 2HB SER 8 -7.343 -3.763 1.319
39 HB3 SER 8 1HB SER 8 -6.902 -3.150 -0.275
40 HG SER 8 HG SER 8 -7.559 -5.690 0.536
41 H VAL 9 H VAL 9 -3.485 -2.263 0.359
42 HA VAL 9 HA VAL 9 -3.880 -0.884 2.892
43 HB VAL 9 HB VAL 9 -1.599 -1.654 2.636
44 HG11 VAL 9 1HG1 VAL 9 -1.472 -1.931 0.267
45 HG12 VAL 9 2HG1 VAL 9 -0.150 -0.885 0.801
46 HG13 VAL 9 3HG1 VAL 9 -1.596 -0.191 0.049
47 HG21 VAL 9 3HG2 VAL 9 -1.834 0.501 3.715
48 HG22 VAL 9 1HG2 VAL 9 -1.731 1.318 2.157
49 HG23 VAL 9 2HG2 VAL 9 -0.335 0.444 2.793
50 H THR 10 H THR 10 -4.663 1.043 3.013
51 HA THR 10 HA THR 10 -5.149 2.488 0.519
52 HB THR 10 HB THR 10 -7.156 2.008 2.738
53 HG1 THR 10 1HG THR 10 -6.362 0.303 1.137
54 HG21 THR 10 3HG2 THR 10 -8.776 2.930 1.131
55 HG22 THR 10 1HG2 THR 10 -7.479 3.184 -0.040
56 HG23 THR 10 2HG2 THR 10 -7.499 4.102 1.464
57 H LEU 11 H LEU 11 -4.689 4.575 0.670
58 HA LEU 11 HA LEU 11 -3.864 5.579 3.242
59 HB2 LEU 11 2HB LEU 11 -2.889 7.467 1.977
60 HB3 LEU 11 1HB LEU 11 -2.267 5.920 1.470
61 HG LEU 11 HG LEU 11 -4.006 6.168 -0.471
62 HD11 LEU 11 1HD1 LEU 11 -3.652 9.050 0.323
63 HD12 LEU 11 2HD1 LEU 11 -5.161 8.137 0.367
64 HD13 LEU 11 3HD1 LEU 11 -4.381 8.493 -1.175
65 HD21 LEU 11 3HD2 LEU 11 -2.327 7.336 -1.827
66 HD22 LEU 11 1HD2 LEU 11 -1.606 6.104 -0.790
67 HD23 LEU 11 2HD2 LEU 11 -1.481 7.808 -0.354
68 H GLN 12 H GLN 12 -4.792 7.198 4.307
69 HA GLN 12 HA GLN 12 -7.487 8.000 3.410
70 HB2 GLN 12 2HB GLN 12 -7.192 6.319 5.283
71 HB3 GLN 12 1HB GLN 12 -6.446 7.600 6.166
72 HG2 GLN 12 2HG GLN 12 -8.452 8.978 6.000
73 HG3 GLN 12 1HG GLN 12 -9.279 7.636 5.205
74 HE21 GLN 12 1HE2 GLN 12 -9.831 8.975 7.679
75 HE22 GLN 12 2HE2 GLN 12 -9.826 7.780 8.924
76 H LEU 13 H LEU 13 -7.846 10.204 3.504
77 HA LEU 13 HA LEU 13 -6.425 11.873 5.395
78 HB2 LEU 13 2HB LEU 13 -5.581 13.483 3.846
79 HB3 LEU 13 1HB LEU 13 -5.039 11.945 3.233
80 HG LEU 13 HG LEU 13 -7.334 12.275 1.854
81 HD11 LEU 13 1HD1 LEU 13 -7.411 14.560 0.978
82 HD12 LEU 13 2HD1 LEU 13 -6.218 15.044 2.183
83 HD13 LEU 13 3HD1 LEU 13 -7.804 14.464 2.696
84 HD21 LEU 13 3HD2 LEU 13 -4.595 13.275 1.063
85 HD22 LEU 13 1HD2 LEU 13 -5.911 12.931 -0.057
86 HD23 LEU 13 2HD2 LEU 13 -5.193 11.627 0.885
87 H ASP 14 H ASP 14 -7.677 13.770 5.831
88 HA ASP 14 HA ASP 14 -10.318 13.455 4.674
89 HB2 ASP 14 2HB ASP 14 -10.470 13.100 7.055
90 HB3 ASP 14 1HB ASP 14 -9.671 14.647 7.369
91 H ASP 15 H ASP 15 -10.926 14.769 3.363
92 HA ASP 15 HA ASP 15 -9.808 17.463 3.354
93 HB2 ASP 15 2HB ASP 15 -9.216 16.098 1.391
94 HB3 ASP 15 1HB ASP 15 -10.918 15.796 1.093
95 H GLY 16 H GLY 16 -12.376 15.910 4.480
96 HA2 GLY 16 2HA GLY 16 -14.195 17.386 5.220
97 HA3 GLY 16 1HA GLY 16 -14.334 17.906 3.547
98 H SER 17 H SER 17 -13.782 14.607 4.642
99 HA SER 17 HA SER 17 -16.336 13.595 4.706
100 HB2 SER 17 2HB SER 17 -16.530 12.517 2.461
101 HB3 SER 17 1HB SER 17 -16.603 14.288 2.416
102 HG SER 17 HG SER 17 -15.158 12.923 0.921
103 H GLY 18 H GLY 18 -13.097 13.097 3.572
104 HA2 GLY 18 2HA GLY 18 -11.640 11.510 4.722
105 HA3 GLY 18 1HA GLY 18 -13.042 10.445 4.849
106 H ARG 19 H ARG 19 -10.492 11.560 2.831
107 HA ARG 19 HA ARG 19 -11.518 10.262 0.412
108 HB2 ARG 19 2HB ARG 19 -8.810 11.432 0.881
109 HB3 ARG 19 1HB ARG 19 -9.567 10.994 -0.633
110 HG2 ARG 19 2HG ARG 19 -10.454 13.192 1.185
111 HG3 ARG 19 1HG ARG 19 -9.383 13.398 -0.212
112 HD2 ARG 19 2HD ARG 19 -11.208 12.610 -1.665
113 HD3 ARG 19 1HD ARG 19 -12.258 12.471 -0.250
114 HE ARG 19 HE ARG 19 -11.002 15.036 -0.706
115 HH11 ARG 19 1HH1 ARG 19 -13.873 13.116 -1.340
116 HH12 ARG 19 2HH1 ARG 19 -14.958 14.440 -1.337
117 HH21 ARG 19 1HH2 ARG 19 -12.460 16.882 -0.688
118 HH22 ARG 19 2HH2 ARG 19 -14.128 16.640 -0.959
119 H THR 20 H THR 20 -10.433 8.581 -0.469
120 HA THR 20 HA THR 20 -8.279 7.349 1.024
121 HB THR 20 HB THR 20 -9.426 5.108 0.971
122 HG1 THR 20 1HG THR 20 -11.522 6.810 0.197
123 HG21 THR 20 3HG2 THR 20 -9.157 6.301 3.059
124 HG22 THR 20 1HG2 THR 20 -10.759 5.538 3.047
125 HG23 THR 20 2HG2 THR 20 -10.570 7.276 2.694
126 H TYR 21 H TYR 21 -6.873 6.387 -0.247
127 HA TYR 21 HA TYR 21 -7.671 5.659 -2.985
128 HB2 TYR 21 2HB TYR 21 -6.390 7.843 -2.928
129 HB3 TYR 21 1HB TYR 21 -5.059 6.961 -2.200
130 HD1 TYR 21 1HD TYR 21 -6.937 7.552 -5.289
131 HD2 TYR 21 2HD TYR 21 -3.633 5.519 -3.543
132 HE1 TYR 21 1HE TYR 21 -6.032 7.113 -7.528
133 HE2 TYR 21 2HE TYR 21 -2.718 5.071 -5.786
134 HH TYR 21 HH TYR 21 -3.784 6.681 -8.514
135 H GLN 22 H GLN 22 -7.161 3.605 -3.371
136 HA GLN 22 HA GLN 22 -5.559 2.260 -1.370
137 HB2 GLN 22 2HB GLN 22 -7.775 1.360 -1.900
138 HB3 GLN 22 1HB GLN 22 -7.273 1.143 -3.569
139 HG2 GLN 22 2HG GLN 22 -5.642 -0.496 -2.922
140 HG3 GLN 22 1HG GLN 22 -6.006 -0.223 -1.216
141 HE21 GLN 22 1HE2 GLN 22 -7.937 -0.938 -0.392
142 HE22 GLN 22 2HE2 GLN 22 -8.889 -2.144 -1.189
143 H LEU 23 H LEU 23 -3.668 1.442 -1.707
144 HA LEU 23 HA LEU 23 -2.198 2.104 -4.083
145 HB2 LEU 23 2HB LEU 23 -1.513 0.445 -1.695
146 HB3 LEU 23 1HB LEU 23 -0.368 0.936 -2.902
147 HG LEU 23 HG LEU 23 -1.845 2.836 -1.061
148 HD11 LEU 23 1HD1 LEU 23 -0.306 1.456 0.187
149 HD12 LEU 23 2HD1 LEU 23 0.370 3.079 0.019
150 HD13 LEU 23 3HD1 LEU 23 0.957 1.756 -0.997
151 HD21 LEU 23 3HD2 LEU 23 -0.231 4.489 -1.858
152 HD22 LEU 23 1HD2 LEU 23 -1.179 3.855 -3.207
153 HD23 LEU 23 2HD2 LEU 23 0.476 3.296 -2.931
154 H ARG 24 H ARG 24 -1.561 0.688 -5.626
155 HA ARG 24 HA ARG 24 -2.669 -2.009 -5.410
156 HB2 ARG 24 2HB ARG 24 -1.936 -0.548 -7.965
157 HB3 ARG 24 1HB ARG 24 -2.669 -2.138 -7.841
158 HG2 ARG 24 2HG ARG 24 -4.483 -0.816 -8.390
159 HG3 ARG 24 1HG ARG 24 -4.596 -0.866 -6.633
160 HD2 ARG 24 2HD ARG 24 -3.346 1.277 -6.547
161 HD3 ARG 24 1HD ARG 24 -3.406 1.332 -8.308
162 HE ARG 24 HE ARG 24 -5.604 1.668 -6.422
163 HH11 ARG 24 1HH1 ARG 24 -4.577 1.611 -9.825
164 HH12 ARG 24 2HH1 ARG 24 -5.883 2.576 -10.361
165 HH21 ARG 24 1HH2 ARG 24 -7.442 2.943 -7.229
166 HH22 ARG 24 2HH2 ARG 24 -7.522 3.285 -8.909
167 H GLU 25 H GLU 25 -1.305 -3.567 -6.797
168 HA GLU 25 HA GLU 25 1.198 -3.635 -5.525
169 HB2 GLU 25 2HB GLU 25 1.652 -5.639 -6.939
170 HB3 GLU 25 1HB GLU 25 0.155 -5.713 -6.026
171 HG2 GLU 25 2HG GLU 25 -1.112 -5.167 -8.013
172 HG3 GLU 25 1HG GLU 25 0.383 -5.029 -8.940
173 H GLY 26 H GLY 26 3.108 -3.063 -6.049
174 HA2 GLY 26 2HA GLY 26 4.769 -2.629 -7.853
175 HA3 GLY 26 1HA GLY 26 3.485 -1.671 -8.603
176 H SER 27 H SER 27 5.344 -0.034 -8.315
177 HA SER 27 HA SER 27 5.115 0.987 -5.622
178 HB2 SER 27 2HB SER 27 7.012 2.443 -6.143
179 HB3 SER 27 1HB SER 27 7.382 0.737 -6.320
180 HG SER 27 HG SER 27 6.464 1.772 -8.674
181 H ASN 28 H ASN 28 4.126 2.753 -5.160
182 HA ASN 28 HA ASN 28 2.761 4.135 -7.351
183 HB2 ASN 28 2HB ASN 28 1.919 3.820 -4.452
184 HB3 ASN 28 1HB ASN 28 1.012 4.696 -5.679
185 HD21 ASN 28 1HD2 ASN 28 1.965 1.552 -4.510
186 HD22 ASN 28 2HD2 ASN 28 0.882 0.613 -5.450
187 H ILE 29 H ILE 29 3.750 5.919 -7.758
188 HA ILE 29 HA ILE 29 5.411 7.261 -5.805
189 HB ILE 29 HB ILE 29 4.825 7.983 -8.688
190 HG12 ILE 29 2HG1 ILE 29 7.174 6.456 -7.547
191 HG13 ILE 29 1HG1 ILE 29 5.833 5.729 -8.426
192 HG21 ILE 29 1HG2 ILE 29 7.067 8.869 -6.850
193 HG22 ILE 29 2HG2 ILE 29 5.700 9.857 -7.365
194 HG23 ILE 29 3HG2 ILE 29 6.886 9.310 -8.551
195 HD11 ILE 29 3HD1 ILE 29 7.832 7.699 -9.506
196 HD12 ILE 29 1HD1 ILE 29 6.446 7.055 -10.393
197 HD13 ILE 29 2HD1 ILE 29 7.727 5.971 -9.859
198 H ILE 30 H ILE 30 4.852 9.068 -4.773
199 HA ILE 30 HA ILE 30 2.292 10.301 -5.419
200 HB ILE 30 HB ILE 30 3.797 10.210 -2.775
201 HG12 ILE 30 2HG1 ILE 30 1.190 8.914 -3.629
202 HG13 ILE 30 1HG1 ILE 30 2.705 8.094 -3.315
203 HG21 ILE 30 1HG2 ILE 30 2.765 12.328 -2.932
204 HG22 ILE 30 2HG2 ILE 30 1.804 11.340 -1.826
205 HG23 ILE 30 3HG2 ILE 30 1.252 11.628 -3.477
206 HD11 ILE 30 3HD1 ILE 30 1.055 9.574 -1.278
207 HD12 ILE 30 1HD1 ILE 30 2.571 8.731 -0.958
208 HD13 ILE 30 2HD1 ILE 30 1.147 7.826 -1.472
209 H GLY 31 H GLY 31 2.326 12.281 -6.143
210 HA2 GLY 31 2HA GLY 31 3.635 14.471 -5.303
211 HA3 GLY 31 1HA GLY 31 4.768 13.759 -6.476
212 H ARG 32 H ARG 32 4.240 15.903 -7.464
213 HA ARG 32 HA ARG 32 1.708 15.660 -8.923
214 HB2 ARG 32 2HB ARG 32 3.274 18.163 -8.327
215 HB3 ARG 32 1HB ARG 32 1.902 18.090 -9.411
216 HG2 ARG 32 2HG ARG 32 0.578 17.238 -7.385
217 HG3 ARG 32 1HG ARG 32 1.965 17.741 -6.451
218 HD2 ARG 32 2HD ARG 32 1.879 19.988 -7.299
219 HD3 ARG 32 1HD ARG 32 0.535 19.584 -8.351
220 HE ARG 32 HE ARG 32 0.241 19.405 -5.431
221 HH11 ARG 32 1HH1 ARG 32 -0.834 20.723 -8.539
222 HH12 ARG 32 2HH1 ARG 32 -1.962 21.809 -7.863
223 HH21 ARG 32 1HH2 ARG 32 -1.382 20.886 -4.496
224 HH22 ARG 32 2HH2 ARG 32 -2.299 21.883 -5.526
225 H GLY 33 H GLY 33 2.095 14.737 -10.771
226 HA2 GLY 33 2HA GLY 33 3.457 16.022 -12.775
227 HA3 GLY 33 1HA GLY 33 4.523 14.781 -12.102
228 H GLN 34 H GLN 34 3.902 14.378 -14.559
229 HA GLN 34 HA GLN 34 1.573 12.671 -14.793
230 HB2 GLN 34 2HB GLN 34 3.851 13.206 -16.723
231 HB3 GLN 34 1HB GLN 34 2.356 12.371 -17.110
232 HG2 GLN 34 2HG GLN 34 2.548 15.256 -16.256
233 HG3 GLN 34 1HG GLN 34 2.426 14.702 -17.925
234 HE21 GLN 34 1HE2 GLN 34 0.491 13.944 -18.673
235 HE22 GLN 34 2HE2 GLN 34 -0.994 14.131 -17.836
236 H ASP 35 H ASP 35 4.913 12.558 -14.085
237 HA ASP 35 HA ASP 35 5.411 9.770 -14.591
238 HB2 ASP 35 2HB ASP 35 7.142 11.621 -14.543
239 HB3 ASP 35 1HB ASP 35 6.933 11.687 -12.803
240 H ALA 36 H ALA 36 4.201 11.708 -12.045
241 HA ALA 36 HA ALA 36 4.454 9.790 -9.925
242 HB1 ALA 36 1HB ALA 36 4.468 12.188 -9.462
243 HB2 ALA 36 2HB ALA 36 3.133 11.388 -8.630
244 HB3 ALA 36 3HB ALA 36 2.829 12.323 -10.095
245 H GLN 37 H GLN 37 2.886 8.479 -9.121
246 HA GLN 37 HA GLN 37 0.801 7.677 -10.943
247 HB2 GLN 37 2HB GLN 37 1.562 6.606 -8.219
248 HB3 GLN 37 1HB GLN 37 0.496 5.835 -9.378
249 HG2 GLN 37 2HG GLN 37 3.438 6.360 -9.793
250 HG3 GLN 37 1HG GLN 37 2.731 4.817 -9.327
251 HE21 GLN 37 1HE2 GLN 37 1.562 3.674 -10.829
252 HE22 GLN 37 2HE2 GLN 37 1.686 3.977 -12.519
253 H PHE 38 H PHE 38 1.094 8.910 -7.649
254 HA PHE 38 HA PHE 38 -1.750 9.601 -7.686
255 HB2 PHE 38 2HB PHE 38 -1.322 7.925 -5.980
256 HB3 PHE 38 1HB PHE 38 0.052 8.836 -5.379
257 HD1 PHE 38 2HD PHE 38 -3.649 9.011 -5.766
258 HD2 PHE 38 1HD PHE 38 -0.224 10.368 -3.638
259 HE1 PHE 38 2HE PHE 38 -5.098 10.134 -4.123
260 HE2 PHE 38 1HE PHE 38 -1.619 11.459 -2.018
261 HZ PHE 38 HZ PHE 38 -4.096 11.366 -2.237
262 H ARG 39 H ARG 39 -2.196 11.679 -7.478
263 HA ARG 39 HA ARG 39 0.062 13.483 -7.134
264 HB2 ARG 39 2HB ARG 39 -2.550 13.800 -8.612
265 HB3 ARG 39 1HB ARG 39 -1.583 15.189 -8.159
266 HG2 ARG 39 2HG ARG 39 -1.148 14.603 -10.463
267 HG3 ARG 39 1HG ARG 39 0.291 14.308 -9.504
268 HD2 ARG 39 2HD ARG 39 0.029 12.508 -11.064
269 HD3 ARG 39 1HD ARG 39 -0.320 11.892 -9.454
270 HE ARG 39 HE ARG 39 -2.758 12.532 -10.336
271 HH11 ARG 39 1HH1 ARG 39 -0.155 10.602 -11.818
272 HH12 ARG 39 2HH1 ARG 39 -1.212 9.704 -12.793
273 HH21 ARG 39 1HH2 ARG 39 -4.180 11.260 -11.679
274 HH22 ARG 39 2HH2 ARG 39 -3.546 10.091 -12.756
275 H LEU 40 H LEU 40 0.027 15.073 -5.656
276 HA LEU 40 HA LEU 40 -1.923 14.773 -3.526
277 HB2 LEU 40 2HB LEU 40 0.622 16.348 -3.728
278 HB3 LEU 40 1HB LEU 40 -0.475 16.513 -2.374
279 HG LEU 40 HG LEU 40 1.025 14.016 -3.157
280 HD11 LEU 40 1HD1 LEU 40 1.308 15.884 -0.810
281 HD12 LEU 40 2HD1 LEU 40 2.389 15.836 -2.196
282 HD13 LEU 40 3HD1 LEU 40 2.273 14.441 -1.119
283 HD21 LEU 40 3HD2 LEU 40 0.169 13.119 -1.037
284 HD22 LEU 40 1HD2 LEU 40 -1.147 13.486 -2.154
285 HD23 LEU 40 2HD2 LEU 40 -0.798 14.579 -0.816
286 HA PRO 41 HA PRO 41 -4.030 18.522 -4.655
287 HB2 PRO 41 2HB PRO 41 -5.597 18.796 -2.501
288 HB3 PRO 41 1HB PRO 41 -5.819 17.443 -3.613
289 HG2 PRO 41 2HG PRO 41 -4.489 17.494 -0.939
290 HG3 PRO 41 1HG PRO 41 -5.536 16.251 -1.646
291 HD2 PRO 41 2HD PRO 41 -2.759 16.182 -1.579
292 HD3 PRO 41 1HD PRO 41 -3.772 15.226 -2.673
293 H ASP 42 H ASP 42 -1.546 18.324 -2.649
294 HA ASP 42 HA ASP 42 -1.648 21.102 -1.705
295 HB2 ASP 42 2HB ASP 42 -0.323 18.666 -0.517
296 HB3 ASP 42 1HB ASP 42 0.157 20.294 -0.058
297 H THR 43 H THR 43 0.511 22.171 -1.714
298 HA THR 43 HA THR 43 2.033 21.131 -3.978
299 HB THR 43 HB THR 43 0.896 23.284 -4.518
300 HG1 THR 43 1HG THR 43 2.552 23.748 -5.714
301 HG21 THR 43 3HG2 THR 43 1.670 25.376 -3.472
302 HG22 THR 43 1HG2 THR 43 2.691 24.444 -2.374
303 HG23 THR 43 2HG2 THR 43 0.937 24.295 -2.282
304 H GLY 44 H GLY 44 4.309 22.548 -3.860
305 HA2 GLY 44 2HA GLY 44 6.321 22.807 -2.616
306 HA3 GLY 44 1HA GLY 44 5.517 22.081 -1.222
307 H VAL 45 H VAL 45 4.543 20.232 -3.400
308 HA VAL 45 HA VAL 45 6.391 18.092 -2.844
309 HB VAL 45 HB VAL 45 3.956 17.827 -2.547
310 HG11 VAL 45 1HG1 VAL 45 2.449 17.708 -4.434
311 HG12 VAL 45 2HG1 VAL 45 3.755 18.251 -5.495
312 HG13 VAL 45 3HG1 VAL 45 3.148 19.313 -4.223
313 HG21 VAL 45 3HG2 VAL 45 5.198 15.823 -3.033
314 HG22 VAL 45 1HG2 VAL 45 5.041 16.115 -4.765
315 HG23 VAL 45 2HG2 VAL 45 3.610 15.759 -3.796
316 H SER 46 H SER 46 7.400 16.848 -4.496
317 HA SER 46 HA SER 46 7.866 18.243 -7.042
318 HB2 SER 46 2HB SER 46 9.835 17.555 -5.620
319 HB3 SER 46 1HB SER 46 9.324 15.878 -5.780
320 HG SER 46 HG SER 46 10.490 17.602 -7.648
321 H ARG 47 H ARG 47 8.371 16.245 -8.828
322 HA ARG 47 HA ARG 47 5.825 14.928 -9.141
323 HB2 ARG 47 2HB ARG 47 6.692 13.960 -11.202
324 HB3 ARG 47 1HB ARG 47 7.169 15.645 -11.139
325 HG2 ARG 47 2HG ARG 47 9.401 14.989 -10.434
326 HG3 ARG 47 1HG ARG 47 8.925 13.292 -10.476
327 HD2 ARG 47 2HD ARG 47 10.086 13.737 -12.484
328 HD3 ARG 47 1HD ARG 47 8.371 13.633 -12.883
329 HE ARG 47 HE ARG 47 8.459 16.154 -12.708
330 HH11 ARG 47 1HH1 ARG 47 11.232 14.214 -13.806
331 HH12 ARG 47 2HH1 ARG 47 11.831 15.396 -14.868
332 HH21 ARG 47 1HH2 ARG 47 9.335 17.819 -14.171
333 HH22 ARG 47 2HH2 ARG 47 10.734 17.481 -15.077
334 H ARG 48 H ARG 48 9.040 14.048 -8.176
335 HA ARG 48 HA ARG 48 7.984 11.553 -7.117
336 HB2 ARG 48 2HB ARG 48 10.730 12.226 -8.165
337 HB3 ARG 48 1HB ARG 48 10.495 10.916 -7.024
338 HG2 ARG 48 2HG ARG 48 8.995 9.809 -8.581
339 HG3 ARG 48 1HG ARG 48 9.202 11.106 -9.753
340 HD2 ARG 48 2HD ARG 48 10.625 9.081 -10.181
341 HD3 ARG 48 1HD ARG 48 11.546 10.578 -9.987
342 HE ARG 48 HE ARG 48 12.485 9.766 -8.100
343 HH11 ARG 48 1HH1 ARG 48 9.954 7.487 -9.082
344 HH12 ARG 48 2HH1 ARG 48 10.327 6.350 -7.873
345 HH21 ARG 48 1HH2 ARG 48 13.003 8.168 -6.481
346 HH22 ARG 48 2HH2 ARG 48 12.035 6.768 -6.320
347 H HIS 49 H HIS 49 7.324 12.295 -5.288
348 HA HIS 49 HA HIS 49 9.177 13.774 -3.556
349 HB2 HIS 49 2HB HIS 49 7.024 14.864 -3.952
350 HB3 HIS 49 1HB HIS 49 6.177 13.430 -3.396
351 HD2 HIS 49 2HD HIS 49 6.459 12.934 -0.591
352 HE1 HIS 49 1HE HIS 49 7.492 16.937 0.218
353 HE2 HIS 49 2HE HIS 49 7.254 14.569 1.152
354 H LEU 50 H LEU 50 7.071 10.989 -3.784
355 HA LEU 50 HA LEU 50 8.723 9.555 -1.978
356 HB2 LEU 50 2HB LEU 50 7.450 10.755 -0.352
357 HB3 LEU 50 1HB LEU 50 5.946 10.476 -1.169
358 HG LEU 50 HG LEU 50 7.465 8.142 -0.034
359 HD11 LEU 50 1HD1 LEU 50 5.624 10.026 1.471
360 HD12 LEU 50 2HD1 LEU 50 7.365 9.891 1.724
361 HD13 LEU 50 3HD1 LEU 50 6.313 8.529 2.102
362 HD21 LEU 50 3HD2 LEU 50 5.446 7.761 -1.392
363 HD22 LEU 50 1HD2 LEU 50 4.531 8.800 -0.300
364 HD23 LEU 50 2HD2 LEU 50 5.196 7.279 0.289
365 H GLU 51 H GLU 51 8.234 7.332 -2.075
366 HA GLU 51 HA GLU 51 6.104 6.628 -3.924
367 HB2 GLU 51 2HB GLU 51 7.525 4.990 -5.063
368 HB3 GLU 51 1HB GLU 51 8.085 6.626 -5.332
369 HG2 GLU 51 2HG GLU 51 9.813 6.267 -3.600
370 HG3 GLU 51 1HG GLU 51 9.240 4.615 -3.415
371 H ILE 52 H ILE 52 5.046 4.852 -3.411
372 HA ILE 52 HA ILE 52 6.047 3.394 -1.083
373 HB ILE 52 HB ILE 52 3.192 3.570 -2.082
374 HG12 ILE 52 2HG1 ILE 52 4.475 4.773 0.391
375 HG13 ILE 52 1HG1 ILE 52 4.034 5.679 -1.048
376 HG21 ILE 52 1HG2 ILE 52 2.678 2.352 0.016
377 HG22 ILE 52 2HG2 ILE 52 4.419 2.246 0.336
378 HG23 ILE 52 3HG2 ILE 52 3.738 1.448 -1.080
379 HD11 ILE 52 3HD1 ILE 52 2.393 5.980 0.708
380 HD12 ILE 52 1HD1 ILE 52 2.141 4.234 0.791
381 HD13 ILE 52 2HD1 ILE 52 1.679 5.119 -0.661
382 H ARG 53 H ARG 53 6.913 1.559 -1.608
383 HA ARG 53 HA ARG 53 6.090 0.252 -4.074
384 HB2 ARG 53 2HB ARG 53 8.476 0.329 -3.783
385 HB3 ARG 53 1HB ARG 53 8.374 -0.336 -2.164
386 HG2 ARG 53 2HG ARG 53 7.416 -2.411 -3.156
387 HG3 ARG 53 1HG ARG 53 7.724 -1.703 -4.740
388 HD2 ARG 53 2HD ARG 53 10.053 -1.727 -4.395
389 HD3 ARG 53 1HD ARG 53 9.865 -2.124 -2.682
390 HE ARG 53 HE ARG 53 8.610 -4.156 -4.007
391 HH11 ARG 53 1HH1 ARG 53 11.903 -2.873 -4.096
392 HH12 ARG 53 2HH1 ARG 53 12.624 -4.360 -4.476
393 HH21 ARG 53 1HH2 ARG 53 9.569 -6.185 -4.455
394 HH22 ARG 53 2HH2 ARG 53 11.253 -6.315 -4.669
395 H TRP 54 H TRP 54 4.392 -0.949 -3.928
396 HA TRP 54 HA TRP 54 3.959 -2.318 -1.429
397 HB2 TRP 54 2HB TRP 54 2.156 -0.824 -1.838
398 HB3 TRP 54 1HB TRP 54 2.016 -1.343 -3.513
399 HD1 TRP 54 HD TRP 54 -0.107 -2.742 -3.830
400 HE1 TRP 54 1HE TRP 54 -1.440 -4.463 -2.443
401 HE3 TRP 54 3HE TRP 54 2.714 -2.780 0.408
402 HZ2 TRP 54 2HZ TRP 54 -1.305 -5.673 0.072
403 HZ3 TRP 54 3HZ TRP 54 2.045 -4.247 2.259
404 HH2 TRP 54 HH TRP 54 0.087 -5.660 2.098
405 H ASP 55 H ASP 55 4.492 -4.325 -1.483
406 HA ASP 55 HA ASP 55 3.708 -5.968 -3.753
407 HB2 ASP 55 2HB ASP 55 6.266 -6.164 -2.123
408 HB3 ASP 55 1HB ASP 55 5.613 -7.564 -2.962
409 H GLY 56 H GLY 56 3.466 -8.319 -2.904
410 HA2 GLY 56 2HA GLY 56 1.439 -8.062 -0.916
411 HA3 GLY 56 1HA GLY 56 1.894 -9.537 -1.733
412 H GLN 57 H GLN 57 3.012 -7.309 0.731
413 HA GLN 57 HA GLN 57 3.098 -9.300 2.741
414 HB2 GLN 57 2HB GLN 57 5.293 -9.766 1.545
415 HB3 GLN 57 1HB GLN 57 5.810 -8.149 2.018
416 HG2 GLN 57 2HG GLN 57 5.407 -8.798 4.390
417 HG3 GLN 57 1HG GLN 57 5.108 -10.438 3.830
418 HE21 GLN 57 1HE2 GLN 57 7.051 -9.489 5.620
419 HE22 GLN 57 2HE2 GLN 57 8.604 -9.900 5.030
420 H VAL 58 H VAL 58 5.014 -6.360 2.088
421 HA VAL 58 HA VAL 58 3.502 -4.913 4.093
422 HB VAL 58 HB VAL 58 5.602 -3.950 5.052
423 HG11 VAL 58 1HG1 VAL 58 5.390 -6.936 5.369
424 HG12 VAL 58 2HG1 VAL 58 4.492 -5.722 6.278
425 HG13 VAL 58 3HG1 VAL 58 6.241 -5.851 6.465
426 HG21 VAL 58 3HG2 VAL 58 7.138 -4.398 3.219
427 HG22 VAL 58 1HG2 VAL 58 6.997 -6.135 3.496
428 HG23 VAL 58 2HG2 VAL 58 7.753 -5.110 4.714
429 H ALA 59 H ALA 59 3.836 -2.597 3.855
430 HA ALA 59 HA ALA 59 4.423 -1.965 1.069
431 HB1 ALA 59 1HB ALA 59 3.168 0.097 1.445
432 HB2 ALA 59 2HB ALA 59 2.965 -0.334 3.144
433 HB3 ALA 59 3HB ALA 59 2.203 -1.308 1.896
434 H LEU 60 H LEU 60 6.217 -1.102 0.588
435 HA LEU 60 HA LEU 60 7.999 -0.191 2.668
436 HB2 LEU 60 2HB LEU 60 8.600 -1.795 0.807
437 HB3 LEU 60 1HB LEU 60 8.398 -0.469 -0.302
438 HG LEU 60 HG LEU 60 10.526 -0.597 1.856
439 HD11 LEU 60 1HD1 LEU 60 12.050 -1.114 0.011
440 HD12 LEU 60 2HD1 LEU 60 10.674 -1.128 -1.095
441 HD13 LEU 60 3HD1 LEU 60 10.787 -2.342 0.173
442 HD21 LEU 60 3HD2 LEU 60 9.962 1.693 1.138
443 HD22 LEU 60 1HD2 LEU 60 10.237 1.226 -0.537
444 HD23 LEU 60 2HD2 LEU 60 11.583 1.228 0.606
445 H LEU 61 H LEU 61 7.768 1.827 3.242
446 HA LEU 61 HA LEU 61 6.753 3.872 1.447
447 HB2 LEU 61 2HB LEU 61 5.855 3.590 3.698
448 HB3 LEU 61 1HB LEU 61 7.402 3.808 4.432
449 HG LEU 61 HG LEU 61 5.933 5.733 4.765
450 HD11 LEU 61 1HD1 LEU 61 8.272 6.286 4.642
451 HD12 LEU 61 2HD1 LEU 61 7.281 7.583 3.978
452 HD13 LEU 61 3HD1 LEU 61 8.150 6.492 2.896
453 HD21 LEU 61 3HD2 LEU 61 4.539 5.431 2.796
454 HD22 LEU 61 1HD2 LEU 61 5.862 5.984 1.777
455 HD23 LEU 61 2HD2 LEU 61 5.109 7.088 2.936
456 H ALA 62 H ALA 62 8.280 4.857 0.201
457 HA ALA 62 HA ALA 62 10.909 5.275 1.415
458 HB1 ALA 62 1HB ALA 62 11.865 5.142 -0.824
459 HB2 ALA 62 2HB ALA 62 10.263 4.852 -1.499
460 HB3 ALA 62 3HB ALA 62 10.998 3.659 -0.425
461 H ASP 63 H ASP 63 11.217 7.296 1.876
462 HA ASP 63 HA ASP 63 9.684 9.432 0.690
463 HB2 ASP 63 2HB ASP 63 10.228 9.670 3.014
464 HB3 ASP 63 1HB ASP 63 11.929 9.359 2.707
465 H LEU 64 H LEU 64 10.373 10.852 -0.860
466 HA LEU 64 HA LEU 64 13.133 10.553 -1.808
467 HB2 LEU 64 2HB LEU 64 11.287 9.269 -3.100
468 HB3 LEU 64 1HB LEU 64 10.706 10.839 -3.585
469 HG LEU 64 HG LEU 64 11.915 9.771 -5.349
470 HD11 LEU 64 1HD1 LEU 64 13.561 11.457 -5.945
471 HD12 LEU 64 2HD1 LEU 64 13.481 12.104 -4.305
472 HD13 LEU 64 3HD1 LEU 64 12.058 12.151 -5.345
473 HD21 LEU 64 3HD2 LEU 64 14.286 9.711 -3.493
474 HD22 LEU 64 1HD2 LEU 64 14.323 9.288 -5.204
475 HD23 LEU 64 2HD2 LEU 64 13.369 8.324 -4.076
476 H ASN 65 H ASN 65 13.217 12.570 -0.386
477 HA ASN 65 HA ASN 65 13.194 14.868 -2.000
478 HB2 ASN 65 2HB ASN 65 10.689 14.623 -1.351
479 HB3 ASN 65 1HB ASN 65 11.211 15.087 0.268
480 HD21 ASN 65 1HD2 ASN 65 10.820 16.106 -2.981
481 HD22 ASN 65 2HD2 ASN 65 11.063 17.800 -2.737
482 H SER 66 H SER 66 14.356 16.529 -0.995
483 HA SER 66 HA SER 66 15.645 15.616 1.454
484 HB2 SER 66 2HB SER 66 16.582 17.672 -0.552
485 HB3 SER 66 1HB SER 66 17.512 17.044 0.812
486 HG SER 66 HG SER 66 16.796 14.911 -0.367
487 H THR 67 H THR 67 13.803 18.354 0.180
488 HA THR 67 HA THR 67 14.356 19.841 2.608
489 HB THR 67 HB THR 67 14.512 21.199 0.640
490 HG1 THR 67 1HG THR 67 13.053 22.835 1.115
491 HG21 THR 67 3HG2 THR 67 11.678 20.375 0.001
492 HG22 THR 67 1HG2 THR 67 13.122 19.917 -0.894
493 HG23 THR 67 2HG2 THR 67 12.592 21.600 -0.877
494 H ASN 68 H ASN 68 11.660 18.200 1.124
495 HA ASN 68 HA ASN 68 9.890 18.936 3.363
496 HB2 ASN 68 2HB ASN 68 9.273 17.888 0.592
497 HB3 ASN 68 1HB ASN 68 8.073 18.029 1.870
498 HD21 ASN 68 1HD2 ASN 68 9.945 19.674 -0.508
499 HD22 ASN 68 2HD2 ASN 68 9.180 21.211 -0.323
500 H GLY 69 H GLY 69 12.008 16.943 3.452
501 HA2 GLY 69 2HA GLY 69 11.452 14.310 2.982
502 HA3 GLY 69 1HA GLY 69 12.359 14.856 4.382
503 H THR 70 H THR 70 10.043 12.918 3.546
504 HA THR 70 HA THR 70 7.811 13.548 5.108
505 HB THR 70 HB THR 70 8.708 10.908 3.973
506 HG1 THR 70 1HG THR 70 8.661 12.242 2.316
507 HG21 THR 70 3HG2 THR 70 5.972 11.987 4.657
508 HG22 THR 70 1HG2 THR 70 6.823 10.714 5.527
509 HG23 THR 70 2HG2 THR 70 6.296 10.443 3.864
510 H THR 71 H THR 71 7.056 12.700 6.999
511 HA THR 71 HA THR 71 8.979 11.332 8.746
512 HB THR 71 HB THR 71 7.615 12.355 10.613
513 HG1 THR 71 1HG THR 71 6.686 13.959 8.460
514 HG21 THR 71 3HG2 THR 71 8.734 14.501 10.496
515 HG22 THR 71 1HG2 THR 71 9.112 14.203 8.784
516 HG23 THR 71 2HG2 THR 71 9.788 13.149 10.047
517 H VAL 72 H VAL 72 8.261 9.585 9.821
518 HA VAL 72 HA VAL 72 5.512 8.757 9.302
519 HB VAL 72 HB VAL 72 6.298 6.447 9.745
520 HG11 VAL 72 1HG1 VAL 72 7.798 7.926 7.582
521 HG12 VAL 72 2HG1 VAL 72 6.175 7.251 7.444
522 HG13 VAL 72 3HG1 VAL 72 7.567 6.180 7.623
523 HG21 VAL 72 3HG2 VAL 72 8.737 5.976 9.732
524 HG22 VAL 72 1HG2 VAL 72 8.242 6.926 11.138
525 HG23 VAL 72 2HG2 VAL 72 9.037 7.718 9.788
526 H ASN 73 H ASN 73 4.246 8.941 10.945
527 HA ASN 73 HA ASN 73 3.447 9.275 13.015
528 HB2 ASN 73 2HB ASN 73 5.732 7.400 13.731
529 HB3 ASN 73 1HB ASN 73 4.471 7.874 14.871
530 HD21 ASN 73 1HD2 ASN 73 5.206 5.261 13.608
531 HD22 ASN 73 2HD2 ASN 73 3.744 4.662 12.902
532 H ASN 74 H ASN 74 5.330 11.029 11.852
533 HA ASN 74 HA ASN 74 6.141 13.024 12.191
534 HB2 ASN 74 2HB ASN 74 4.601 13.232 14.176
535 HB3 ASN 74 1HB ASN 74 5.902 12.639 15.197
536 HD21 ASN 74 1HD2 ASN 74 5.947 14.512 16.398
537 HD22 ASN 74 2HD2 ASN 74 6.569 16.001 15.809
538 H ALA 75 H ALA 75 7.628 10.291 12.652
539 HA ALA 75 HA ALA 75 10.158 11.402 13.589
540 HB1 ALA 75 1HB ALA 75 9.466 9.286 14.611
541 HB2 ALA 75 2HB ALA 75 10.920 9.049 13.634
542 HB3 ALA 75 3HB ALA 75 9.350 8.545 13.016
543 HA PRO 76 HA PRO 76 11.213 11.869 9.239
544 HB2 PRO 76 2HB PRO 76 13.800 12.650 9.641
545 HB3 PRO 76 1HB PRO 76 12.426 13.741 9.857
546 HG2 PRO 76 2HG PRO 76 14.010 12.244 11.900
547 HG3 PRO 76 1HG PRO 76 13.384 13.900 11.961
548 HD2 PRO 76 2HD PRO 76 12.193 11.828 13.233
549 HD3 PRO 76 1HD PRO 76 11.284 13.216 12.602
550 H VAL 77 H VAL 77 11.751 10.275 7.857
551 HA VAL 77 HA VAL 77 14.033 8.539 8.433
552 HB VAL 77 HB VAL 77 12.760 6.497 7.807
553 HG11 VAL 77 1HG1 VAL 77 11.549 6.149 9.910
554 HG12 VAL 77 2HG1 VAL 77 11.660 7.878 10.249
555 HG13 VAL 77 3HG1 VAL 77 13.124 6.898 10.165
556 HG21 VAL 77 3HG2 VAL 77 10.351 8.292 8.005
557 HG22 VAL 77 1HG2 VAL 77 10.291 6.532 7.872
558 HG23 VAL 77 2HG2 VAL 77 10.962 7.498 6.554
559 H GLN 78 H GLN 78 14.535 7.170 6.505
560 HA GLN 78 HA GLN 78 13.951 8.592 4.030
561 HB2 GLN 78 2HB GLN 78 15.969 6.446 4.698
562 HB3 GLN 78 1HB GLN 78 15.756 7.130 3.095
563 HG2 GLN 78 2HG GLN 78 16.399 9.309 3.907
564 HG3 GLN 78 1HG GLN 78 16.533 8.685 5.545
565 HE21 GLN 78 1HE2 GLN 78 18.265 7.415 6.093
566 HE22 GLN 78 2HE2 GLN 78 19.663 7.234 5.105
567 H GLU 79 H GLU 79 13.557 5.490 5.641
568 HA GLU 79 HA GLU 79 11.450 4.839 3.805
569 HB2 GLU 79 2HB GLU 79 12.263 2.560 3.387
570 HB3 GLU 79 1HB GLU 79 13.368 3.757 2.737
571 HG2 GLU 79 2HG GLU 79 14.878 3.413 4.594
572 HG3 GLU 79 1HG GLU 79 13.742 2.281 5.329
573 H TRP 80 H TRP 80 10.075 3.208 4.626
574 HA TRP 80 HA TRP 80 10.364 2.319 7.358
575 HB2 TRP 80 2HB TRP 80 9.629 4.561 7.715
576 HB3 TRP 80 1HB TRP 80 8.341 4.437 6.530
577 HD1 TRP 80 HD TRP 80 6.069 3.351 7.388
578 HE1 TRP 80 1HE TRP 80 5.143 2.880 9.745
579 HE3 TRP 80 3HE TRP 80 10.414 3.778 10.028
580 HZ2 TRP 80 2HZ TRP 80 6.141 2.728 12.374
581 HZ3 TRP 80 3HZ TRP 80 10.338 3.464 12.467
582 HH2 TRP 80 HH TRP 80 8.235 2.955 13.605
583 H GLN 81 H GLN 81 8.833 0.679 7.758
584 HA GLN 81 HA GLN 81 7.316 0.020 5.420
585 HB2 GLN 81 2HB GLN 81 7.093 -2.346 6.413
586 HB3 GLN 81 1HB GLN 81 8.623 -1.834 5.737
587 HG2 GLN 81 2HG GLN 81 9.062 -3.139 7.667
588 HG3 GLN 81 1HG GLN 81 9.473 -1.474 8.021
589 HE21 GLN 81 1HE2 GLN 81 8.468 -0.467 9.711
590 HE22 GLN 81 2HE2 GLN 81 7.299 -1.224 10.721
591 H LEU 82 H LEU 82 5.445 0.578 5.304
592 HA LEU 82 HA LEU 82 3.963 1.820 7.310
593 HB2 LEU 82 2HB LEU 82 2.879 0.475 4.866
594 HB3 LEU 82 1HB LEU 82 2.084 1.678 5.850
595 HG LEU 82 HG LEU 82 4.567 2.159 4.224
596 HD11 LEU 82 1HD1 LEU 82 1.715 3.032 3.757
597 HD12 LEU 82 2HD1 LEU 82 2.602 1.839 2.810
598 HD13 LEU 82 3HD1 LEU 82 3.113 3.525 2.805
599 HD21 LEU 82 3HD2 LEU 82 2.854 3.975 5.897
600 HD22 LEU 82 1HD2 LEU 82 4.100 4.526 4.772
601 HD23 LEU 82 2HD2 LEU 82 4.541 3.544 6.160
602 H ALA 83 H ALA 83 2.396 1.227 8.659
603 HA ALA 83 HA ALA 83 1.337 -1.485 8.564
604 HB1 ALA 83 1HB ALA 83 1.329 -1.486 11.052
605 HB2 ALA 83 2HB ALA 83 2.207 0.041 11.032
606 HB3 ALA 83 3HB ALA 83 2.959 -1.420 10.390
607 H ASP 84 H ASP 84 -0.718 -1.480 9.959
608 HA ASP 84 HA ASP 84 -2.432 0.564 8.938
609 HB2 ASP 84 2HB ASP 84 -3.189 -1.785 9.230
610 HB3 ASP 84 1HB ASP 84 -3.003 -1.610 10.967
611 H GLY 85 H GLY 85 -2.460 2.501 9.759
612 HA2 GLY 85 2HA GLY 85 -3.291 3.880 11.577
613 HA3 GLY 85 1HA GLY 85 -2.523 2.760 12.690
614 H ASP 86 H ASP 86 -0.536 3.481 10.001
615 HA ASP 86 HA ASP 86 1.085 5.151 11.740
616 HB2 ASP 86 2HB ASP 86 1.683 3.909 9.055
617 HB3 ASP 86 1HB ASP 86 2.715 5.155 9.734
618 H VAL 87 H VAL 87 1.625 7.221 11.438
619 HA VAL 87 HA VAL 87 -0.084 8.738 9.584
620 HB VAL 87 HB VAL 87 1.615 9.837 11.845
621 HG11 VAL 87 1HG1 VAL 87 -0.661 11.046 10.301
622 HG12 VAL 87 2HG1 VAL 87 1.046 11.474 10.183
623 HG13 VAL 87 3HG1 VAL 87 0.157 11.788 11.672
624 HG21 VAL 87 3HG2 VAL 87 -1.321 9.121 11.917
625 HG22 VAL 87 1HG2 VAL 87 -0.440 9.964 13.192
626 HG23 VAL 87 2HG2 VAL 87 -0.033 8.294 12.797
627 H ILE 88 H ILE 88 0.896 9.222 7.736
628 HA ILE 88 HA ILE 88 3.789 9.576 7.817
629 HB ILE 88 HB ILE 88 1.937 8.703 5.582
630 HG12 ILE 88 2HG1 ILE 88 3.610 6.863 5.308
631 HG13 ILE 88 1HG1 ILE 88 4.487 7.520 6.675
632 HG21 ILE 88 1HG2 ILE 88 3.764 8.813 3.971
633 HG22 ILE 88 2HG2 ILE 88 4.775 9.594 5.190
634 HG23 ILE 88 3HG2 ILE 88 3.332 10.411 4.589
635 HD11 ILE 88 3HD1 ILE 88 3.174 5.571 7.289
636 HD12 ILE 88 1HD1 ILE 88 1.704 6.380 6.743
637 HD13 ILE 88 2HD1 ILE 88 2.593 7.014 8.125
638 H ARG 89 H ARG 89 4.309 11.676 8.019
639 HA ARG 89 HA ARG 89 2.550 13.639 6.764
640 HB2 ARG 89 2HB ARG 89 2.803 14.098 9.108
641 HB3 ARG 89 1HB ARG 89 4.555 13.988 8.991
642 HG2 ARG 89 2HG ARG 89 4.600 15.997 7.598
643 HG3 ARG 89 1HG ARG 89 2.843 16.104 7.683
644 HD2 ARG 89 2HD ARG 89 4.662 16.179 10.077
645 HD3 ARG 89 1HD ARG 89 4.061 17.619 9.247
646 HE ARG 89 HE ARG 89 1.808 16.481 9.741
647 HH11 ARG 89 1HH1 ARG 89 4.593 16.703 11.959
648 HH12 ARG 89 2HH1 ARG 89 3.647 16.653 13.371
649 HH21 ARG 89 1HH2 ARG 89 0.528 16.441 11.676
650 HH22 ARG 89 2HH2 ARG 89 1.270 16.525 13.215
651 H LEU 90 H LEU 90 3.057 14.281 4.958
652 HA LEU 90 HA LEU 90 5.832 14.689 4.262
653 HB2 LEU 90 2HB LEU 90 5.290 14.240 1.894
654 HB3 LEU 90 1HB LEU 90 5.034 12.838 2.888
655 HG LEU 90 HG LEU 90 2.792 14.594 1.833
656 HD11 LEU 90 1HD1 LEU 90 4.021 13.555 -0.001
657 HD12 LEU 90 2HD1 LEU 90 2.452 12.766 0.211
658 HD13 LEU 90 3HD1 LEU 90 3.916 11.992 0.804
659 HD21 LEU 90 3HD2 LEU 90 2.142 13.258 3.802
660 HD22 LEU 90 1HD2 LEU 90 2.780 11.809 3.020
661 HD23 LEU 90 2HD2 LEU 90 1.386 12.642 2.338
662 H GLY 91 H GLY 91 5.989 16.390 2.505
663 HA2 GLY 91 2HA GLY 91 5.554 18.842 3.498
664 HA3 GLY 91 1HA GLY 91 5.601 18.549 1.777
665 H HIS 92 H HIS 92 3.710 19.338 4.496
666 HA HIS 92 HA HIS 92 1.914 20.618 4.735
667 HB2 HIS 92 2HB HIS 92 1.507 20.422 1.756
668 HB3 HIS 92 1HB HIS 92 0.473 21.360 2.827
669 HD1 HIS 92 1HD HIS 92 3.272 21.772 0.643
670 HD2 HIS 92 2HD HIS 92 2.157 23.341 4.326
671 HE1 HIS 92 1HE HIS 92 4.637 23.869 0.955
672 H SER 93 H SER 93 1.794 17.399 4.094
673 HA SER 93 HA SER 93 -0.960 17.390 4.996
674 HB2 SER 93 2HB SER 93 -0.975 17.415 2.458
675 HB3 SER 93 1HB SER 93 -0.227 15.817 2.535
676 HG SER 93 HG SER 93 -2.748 16.454 2.641
677 H GLU 94 H GLU 94 -1.407 15.696 6.283
678 HA GLU 94 HA GLU 94 0.606 13.594 6.418
679 HB2 GLU 94 2HB GLU 94 -0.034 13.198 8.796
680 HB3 GLU 94 1HB GLU 94 0.614 14.801 8.524
681 HG2 GLU 94 2HG GLU 94 -1.793 15.591 8.433
682 HG3 GLU 94 1HG GLU 94 -2.225 13.997 9.050
683 H ILE 95 H ILE 95 0.085 11.699 5.844
684 HA ILE 95 HA ILE 95 -2.718 11.172 5.204
685 HB ILE 95 HB ILE 95 -1.059 11.257 3.328
686 HG12 ILE 95 2HG1 ILE 95 -1.628 9.073 2.278
687 HG13 ILE 95 1HG1 ILE 95 -2.362 8.598 3.812
688 HG21 ILE 95 1HG2 ILE 95 0.136 8.814 4.575
689 HG22 ILE 95 2HG2 ILE 95 0.898 10.403 4.430
690 HG23 ILE 95 3HG2 ILE 95 0.539 9.458 2.983
691 HD11 ILE 95 3HD1 ILE 95 -4.022 9.397 2.261
692 HD12 ILE 95 1HD1 ILE 95 -3.167 10.940 2.119
693 HD13 ILE 95 2HD1 ILE 95 -3.885 10.438 3.663
694 H ILE 96 H ILE 96 -3.719 9.228 5.971
695 HA ILE 96 HA ILE 96 -2.145 7.863 8.019
696 HB ILE 96 HB ILE 96 -5.151 7.898 7.599
697 HG12 ILE 96 2HG1 ILE 96 -4.342 10.083 8.244
698 HG13 ILE 96 1HG1 ILE 96 -5.267 9.356 9.560
699 HG21 ILE 96 1HG2 ILE 96 -5.286 6.895 9.835
700 HG22 ILE 96 2HG2 ILE 96 -3.524 6.830 9.905
701 HG23 ILE 96 3HG2 ILE 96 -4.393 5.868 8.710
702 HD11 ILE 96 3HD1 ILE 96 -3.320 10.523 10.403
703 HD12 ILE 96 1HD1 ILE 96 -2.267 9.571 9.358
704 HD13 ILE 96 2HD1 ILE 96 -3.147 8.788 10.670
705 H VAL 97 H VAL 97 -1.638 5.867 7.695
706 HA VAL 97 HA VAL 97 -2.571 4.610 5.244
707 HB VAL 97 HB VAL 97 -0.246 3.947 7.058
708 HG11 VAL 97 1HG1 VAL 97 -1.166 1.888 6.176
709 HG12 VAL 97 2HG1 VAL 97 0.343 2.260 5.324
710 HG13 VAL 97 3HG1 VAL 97 -1.212 2.572 4.555
711 HG21 VAL 97 3HG2 VAL 97 1.092 4.589 5.150
712 HG22 VAL 97 1HG2 VAL 97 0.012 5.906 5.608
713 HG23 VAL 97 2HG2 VAL 97 -0.368 4.899 4.207
714 H ARG 98 H ARG 98 -4.154 3.185 5.306
715 HA ARG 98 HA ARG 98 -4.500 1.646 7.760
716 HB2 ARG 98 2HB ARG 98 -6.568 2.432 5.717
717 HB3 ARG 98 1HB ARG 98 -6.854 1.420 7.127
718 HG2 ARG 98 2HG ARG 98 -6.128 4.314 7.036
719 HG3 ARG 98 1HG ARG 98 -7.695 3.654 7.523
720 HD2 ARG 98 2HD ARG 98 -5.046 3.542 8.963
721 HD3 ARG 98 1HD ARG 98 -6.528 4.317 9.501
722 HE ARG 98 HE ARG 98 -5.992 1.423 9.420
723 HH11 ARG 98 1HH1 ARG 98 -8.055 4.076 10.576
724 HH12 ARG 98 2HH1 ARG 98 -8.701 3.156 11.849
725 HH21 ARG 98 1HH2 ARG 98 -6.825 0.244 11.165
726 HH22 ARG 98 2HH2 ARG 98 -8.034 0.899 12.181
727 H MET 99 H MET 99 -5.057 -0.436 7.496
728 HA MET 99 HA MET 99 -4.633 -1.581 4.837
729 HB2 MET 99 2HB MET 99 -3.439 -2.609 7.408
730 HB3 MET 99 1HB MET 99 -3.523 -3.553 5.930
731 HG2 MET 99 2HG MET 99 -2.198 -1.818 4.786
732 HG3 MET 99 1HG MET 99 -2.049 -0.965 6.316
733 HE1 MET 99 3HE MET 99 0.601 -0.996 5.838
734 HE2 MET 99 1HE MET 99 0.350 -1.959 4.381
735 HE3 MET 99 2HE MET 99 1.522 -2.480 5.591
736 H HIS 100 H HIS 100 -6.152 -2.753 4.175
737 HA HIS 100 HA HIS 100 -8.189 -3.707 6.030
738 HB2 HIS 100 2HB HIS 100 -8.382 -3.118 3.052
739 HB3 HIS 100 1HB HIS 100 -9.709 -3.615 4.093
740 HD1 HIS 100 1HD HIS 100 -10.942 -1.736 5.337
741 HD2 HIS 100 2HD HIS 100 -7.450 -0.447 3.496
742 HE1 HIS 100 1HE HIS 100 -10.949 0.779 5.499
Start of MODEL 19
1 H1 GLY 1 1HT GLY 1 -5.630 -14.831 -10.393
2 H2 GLY 1 2HT GLY 1 -7.294 -14.780 -10.137
3 H3 GLY 1 3HT GLY 1 -6.631 -15.962 -11.170
4 HA2 GLY 1 1HA GLY 1 -7.244 -16.901 -9.080
5 HA3 GLY 1 2HA GLY 1 -5.500 -16.954 -9.346
6 H HIS 2 H HIS 2 -6.204 -17.231 -6.877
7 HA HIS 2 HA HIS 2 -5.690 -14.627 -5.673
8 HB2 HIS 2 2HB HIS 2 -7.448 -16.853 -4.649
9 HB3 HIS 2 1HB HIS 2 -6.834 -15.585 -3.600
10 HD1 HIS 2 1HD HIS 2 -8.433 -13.685 -3.302
11 HD2 HIS 2 2HD HIS 2 -9.012 -15.660 -6.909
12 HE1 HIS 2 1HE HIS 2 -10.414 -12.586 -4.385
13 H GLY 3 H GLY 3 -3.595 -14.726 -5.395
14 HA2 GLY 3 2HA GLY 3 -2.561 -16.864 -3.675
15 HA3 GLY 3 1HA GLY 3 -1.686 -16.399 -5.128
16 H SER 4 H SER 4 -3.415 -14.114 -3.174
17 HA SER 4 HA SER 4 -0.852 -13.079 -2.214
18 HB2 SER 4 2HB SER 4 -3.313 -11.459 -2.948
19 HB3 SER 4 1HB SER 4 -1.752 -10.823 -2.422
20 HG SER 4 HG SER 4 -1.139 -10.908 -4.422
21 H ALA 5 H ALA 5 -1.020 -11.954 -0.172
22 HA ALA 5 HA ALA 5 -2.524 -13.429 1.722
23 HB1 ALA 5 1HB ALA 5 -0.300 -12.544 2.220
24 HB2 ALA 5 2HB ALA 5 -1.498 -11.928 3.366
25 HB3 ALA 5 3HB ALA 5 -0.917 -10.898 2.057
26 H GLY 6 H GLY 6 -4.054 -12.569 3.216
27 HA2 GLY 6 2HA GLY 6 -6.045 -10.894 2.007
28 HA3 GLY 6 1HA GLY 6 -6.116 -11.626 3.608
29 H THR 7 H THR 7 -4.239 -9.228 1.901
30 HA THR 7 HA THR 7 -4.710 -7.306 4.036
31 HB THR 7 HB THR 7 -1.996 -8.006 2.876
32 HG1 THR 7 1HG THR 7 -3.334 -8.788 5.116
33 HG21 THR 7 3HG2 THR 7 -1.099 -6.309 4.435
34 HG22 THR 7 1HG2 THR 7 -2.749 -5.876 4.900
35 HG23 THR 7 2HG2 THR 7 -2.187 -5.601 3.245
36 H SER 8 H SER 8 -5.717 -5.744 2.923
37 HA SER 8 HA SER 8 -4.359 -4.804 0.527
38 HB2 SER 8 2HB SER 8 -6.610 -3.864 -0.175
39 HB3 SER 8 1HB SER 8 -6.524 -5.622 -0.172
40 HG SER 8 HG SER 8 -7.390 -5.088 2.204
41 H VAL 9 H VAL 9 -3.454 -2.880 0.775
42 HA VAL 9 HA VAL 9 -4.065 -1.556 3.278
43 HB VAL 9 HB VAL 9 -1.768 -2.210 3.200
44 HG11 VAL 9 1HG1 VAL 9 -1.625 -0.850 0.546
45 HG12 VAL 9 2HG1 VAL 9 -1.446 -2.571 0.889
46 HG13 VAL 9 3HG1 VAL 9 -0.220 -1.428 1.446
47 HG21 VAL 9 3HG2 VAL 9 -0.581 -0.067 3.386
48 HG22 VAL 9 1HG2 VAL 9 -2.150 -0.030 4.190
49 HG23 VAL 9 2HG2 VAL 9 -1.945 0.745 2.619
50 H THR 10 H THR 10 -4.959 0.240 3.390
51 HA THR 10 HA THR 10 -5.419 1.784 0.966
52 HB THR 10 HB THR 10 -7.252 1.484 3.351
53 HG1 THR 10 1HG THR 10 -8.003 -0.218 2.500
54 HG21 THR 10 3HG2 THR 10 -7.568 3.517 2.018
55 HG22 THR 10 1HG2 THR 10 -8.933 2.414 1.828
56 HG23 THR 10 2HG2 THR 10 -7.714 2.538 0.558
57 H LEU 11 H LEU 11 -4.751 3.815 1.140
58 HA LEU 11 HA LEU 11 -3.938 4.666 3.769
59 HB2 LEU 11 2HB LEU 11 -2.739 6.485 2.672
60 HB3 LEU 11 1HB LEU 11 -2.246 4.939 2.041
61 HG LEU 11 HG LEU 11 -3.834 5.537 0.069
62 HD11 LEU 11 1HD1 LEU 11 -4.907 7.489 1.057
63 HD12 LEU 11 2HD1 LEU 11 -4.004 7.952 -0.390
64 HD13 LEU 11 3HD1 LEU 11 -3.346 8.294 1.201
65 HD21 LEU 11 3HD2 LEU 11 -1.449 5.335 -0.155
66 HD22 LEU 11 1HD2 LEU 11 -1.212 6.940 0.538
67 HD23 LEU 11 2HD2 LEU 11 -1.988 6.774 -1.029
68 H GLN 12 H GLN 12 -4.985 6.086 4.891
69 HA GLN 12 HA GLN 12 -7.411 7.205 3.686
70 HB2 GLN 12 2HB GLN 12 -7.624 5.873 5.843
71 HB3 GLN 12 1HB GLN 12 -6.700 7.147 6.631
72 HG2 GLN 12 2HG GLN 12 -8.445 8.769 5.791
73 HG3 GLN 12 1HG GLN 12 -9.409 7.363 5.354
74 HE21 GLN 12 1HE2 GLN 12 -8.161 9.289 7.839
75 HE22 GLN 12 2HE2 GLN 12 -9.084 8.675 9.154
76 H LEU 13 H LEU 13 -7.288 9.192 3.112
77 HA LEU 13 HA LEU 13 -5.100 10.874 4.128
78 HB2 LEU 13 2HB LEU 13 -4.847 10.312 1.785
79 HB3 LEU 13 1HB LEU 13 -6.497 10.799 1.459
80 HG LEU 13 HG LEU 13 -5.830 13.078 2.252
81 HD11 LEU 13 1HD1 LEU 13 -3.448 13.680 2.014
82 HD12 LEU 13 2HD1 LEU 13 -3.058 11.970 1.838
83 HD13 LEU 13 3HD1 LEU 13 -3.753 12.568 3.346
84 HD21 LEU 13 3HD2 LEU 13 -4.716 11.943 -0.301
85 HD22 LEU 13 1HD2 LEU 13 -4.850 13.674 0.033
86 HD23 LEU 13 2HD2 LEU 13 -6.298 12.673 -0.038
87 H ASP 14 H ASP 14 -5.872 12.637 5.261
88 HA ASP 14 HA ASP 14 -8.640 13.156 4.668
89 HB2 ASP 14 2HB ASP 14 -8.379 12.634 7.010
90 HB3 ASP 14 1HB ASP 14 -7.215 13.957 7.187
91 H ASP 15 H ASP 15 -8.760 14.398 3.182
92 HA ASP 15 HA ASP 15 -7.167 16.757 2.877
93 HB2 ASP 15 2HB ASP 15 -7.914 15.567 0.900
94 HB3 ASP 15 1HB ASP 15 -9.588 15.664 1.420
95 H GLY 16 H GLY 16 -9.838 15.812 4.624
96 HA2 GLY 16 2HA GLY 16 -10.940 17.399 6.107
97 HA3 GLY 16 1HA GLY 16 -11.087 18.465 4.702
98 H SER 17 H SER 17 -11.485 15.033 5.058
99 HA SER 17 HA SER 17 -14.272 14.968 4.379
100 HB2 SER 17 2HB SER 17 -12.349 14.173 2.170
101 HB3 SER 17 1HB SER 17 -14.103 14.047 2.115
102 HG SER 17 HG SER 17 -13.634 16.483 2.759
103 H GLY 18 H GLY 18 -11.182 13.311 4.952
104 HA2 GLY 18 2HA GLY 18 -10.723 11.189 5.604
105 HA3 GLY 18 1HA GLY 18 -12.455 10.910 5.758
106 H ARG 19 H ARG 19 -9.892 11.220 3.284
107 HA ARG 19 HA ARG 19 -11.542 9.746 1.365
108 HB2 ARG 19 2HB ARG 19 -8.790 10.922 1.047
109 HB3 ARG 19 1HB ARG 19 -9.775 10.173 -0.197
110 HG2 ARG 19 2HG ARG 19 -10.399 12.730 1.264
111 HG3 ARG 19 1HG ARG 19 -9.738 12.601 -0.368
112 HD2 ARG 19 2HD ARG 19 -11.790 11.330 -1.000
113 HD3 ARG 19 1HD ARG 19 -12.445 11.709 0.594
114 HE ARG 19 HE ARG 19 -11.525 14.026 -0.742
115 HH11 ARG 19 1HH1 ARG 19 -14.276 11.831 -0.628
116 HH12 ARG 19 2HH1 ARG 19 -15.405 12.961 -1.198
117 HH21 ARG 19 1HH2 ARG 19 -13.037 15.582 -1.543
118 HH22 ARG 19 2HH2 ARG 19 -14.670 15.163 -1.750
119 H THR 20 H THR 20 -10.513 7.954 0.220
120 HA THR 20 HA THR 20 -8.319 6.705 1.652
121 HB THR 20 HB THR 20 -9.476 4.475 1.484
122 HG1 THR 20 1HG THR 20 -11.768 6.093 0.985
123 HG21 THR 20 3HG2 THR 20 -9.368 5.624 3.622
124 HG22 THR 20 1HG2 THR 20 -10.931 4.807 3.464
125 HG23 THR 20 2HG2 THR 20 -10.803 6.555 3.195
126 H TYR 21 H TYR 21 -6.891 5.770 0.362
127 HA TYR 21 HA TYR 21 -7.648 5.149 -2.396
128 HB2 TYR 21 2HB TYR 21 -6.395 7.205 -2.597
129 HB3 TYR 21 1HB TYR 21 -5.175 6.632 -1.470
130 HD1 TYR 21 1HD TYR 21 -6.611 5.836 -4.851
131 HD2 TYR 21 2HD TYR 21 -3.209 5.713 -2.293
132 HE1 TYR 21 1HE TYR 21 -5.224 5.027 -6.723
133 HE2 TYR 21 2HE TYR 21 -1.824 4.917 -4.152
134 HH TYR 21 HH TYR 21 -2.021 3.835 -6.204
135 H GLN 22 H GLN 22 -7.371 3.070 -2.693
136 HA GLN 22 HA GLN 22 -5.644 1.691 -0.841
137 HB2 GLN 22 2HB GLN 22 -7.926 0.812 -1.229
138 HB3 GLN 22 1HB GLN 22 -7.496 0.510 -2.907
139 HG2 GLN 22 2HG GLN 22 -5.945 -1.155 -2.312
140 HG3 GLN 22 1HG GLN 22 -5.982 -0.690 -0.616
141 HE21 GLN 22 1HE2 GLN 22 -7.749 -1.208 0.596
142 HE22 GLN 22 2HE2 GLN 22 -8.825 -2.496 0.165
143 H LEU 23 H LEU 23 -3.807 0.847 -1.244
144 HA LEU 23 HA LEU 23 -2.383 1.833 -3.453
145 HB2 LEU 23 2HB LEU 23 -1.656 -0.204 -1.388
146 HB3 LEU 23 1HB LEU 23 -0.531 0.416 -2.562
147 HG LEU 23 HG LEU 23 -1.910 2.039 -0.416
148 HD11 LEU 23 1HD1 LEU 23 -0.204 0.576 0.476
149 HD12 LEU 23 2HD1 LEU 23 0.356 2.249 0.498
150 HD13 LEU 23 3HD1 LEU 23 0.932 1.132 -0.746
151 HD21 LEU 23 3HD2 LEU 23 -0.371 3.837 -1.129
152 HD22 LEU 23 1HD2 LEU 23 -1.537 3.412 -2.382
153 HD23 LEU 23 2HD2 LEU 23 0.126 2.843 -2.492
154 H ARG 24 H ARG 24 -1.714 0.987 -5.197
155 HA ARG 24 HA ARG 24 -2.910 -1.505 -6.097
156 HB2 ARG 24 2HB ARG 24 -1.480 0.716 -7.552
157 HB3 ARG 24 1HB ARG 24 -2.144 -0.724 -8.322
158 HG2 ARG 24 2HG ARG 24 -4.362 -0.114 -7.705
159 HG3 ARG 24 1HG ARG 24 -3.772 1.219 -6.716
160 HD2 ARG 24 2HD ARG 24 -2.924 2.329 -8.684
161 HD3 ARG 24 1HD ARG 24 -3.428 0.971 -9.688
162 HE ARG 24 HE ARG 24 -5.713 1.448 -8.974
163 HH11 ARG 24 1HH1 ARG 24 -3.400 4.146 -8.756
164 HH12 ARG 24 2HH1 ARG 24 -4.572 5.334 -9.113
165 HH21 ARG 24 1HH2 ARG 24 -7.286 3.109 -9.388
166 HH22 ARG 24 2HH2 ARG 24 -6.824 4.748 -9.422
167 H GLU 25 H GLU 25 -1.539 -2.887 -7.423
168 HA GLU 25 HA GLU 25 0.703 -3.723 -5.935
169 HB2 GLU 25 2HB GLU 25 1.047 -5.352 -7.839
170 HB3 GLU 25 1HB GLU 25 -0.532 -5.402 -7.076
171 HG2 GLU 25 2HG GLU 25 -1.452 -4.081 -8.935
172 HG3 GLU 25 1HG GLU 25 0.139 -4.077 -9.692
173 H GLY 26 H GLY 26 2.764 -3.191 -6.013
174 HA2 GLY 26 2HA GLY 26 4.757 -2.651 -7.237
175 HA3 GLY 26 1HA GLY 26 3.744 -1.792 -8.396
176 H SER 27 H SER 27 5.256 0.014 -8.017
177 HA SER 27 HA SER 27 4.823 1.151 -5.426
178 HB2 SER 27 2HB SER 27 6.642 2.744 -6.001
179 HB3 SER 27 1HB SER 27 7.135 1.061 -6.034
180 HG SER 27 HG SER 27 7.743 2.547 -7.841
181 H ASN 28 H ASN 28 3.657 2.773 -5.006
182 HA ASN 28 HA ASN 28 2.192 4.022 -7.208
183 HB2 ASN 28 2HB ASN 28 1.488 3.963 -4.234
184 HB3 ASN 28 1HB ASN 28 0.542 4.757 -5.477
185 HD21 ASN 28 1HD2 ASN 28 2.016 1.537 -5.634
186 HD22 ASN 28 2HD2 ASN 28 0.572 0.638 -5.723
187 H ILE 29 H ILE 29 2.444 6.124 -7.543
188 HA ILE 29 HA ILE 29 4.644 7.329 -5.995
189 HB ILE 29 HB ILE 29 3.764 8.020 -8.795
190 HG12 ILE 29 2HG1 ILE 29 4.598 5.702 -8.710
191 HG13 ILE 29 1HG1 ILE 29 5.688 6.737 -9.611
192 HG21 ILE 29 1HG2 ILE 29 5.911 9.148 -8.965
193 HG22 ILE 29 2HG2 ILE 29 6.280 8.733 -7.292
194 HG23 ILE 29 3HG2 ILE 29 4.941 9.823 -7.652
195 HD11 ILE 29 3HD1 ILE 29 6.910 5.179 -8.230
196 HD12 ILE 29 1HD1 ILE 29 6.067 5.752 -6.791
197 HD13 ILE 29 2HD1 ILE 29 7.170 6.827 -7.649
198 H ILE 30 H ILE 30 4.443 9.250 -5.050
199 HA ILE 30 HA ILE 30 2.042 10.886 -5.489
200 HB ILE 30 HB ILE 30 3.832 10.601 -3.042
201 HG12 ILE 30 2HG1 ILE 30 0.891 9.987 -3.417
202 HG13 ILE 30 1HG1 ILE 30 2.188 8.806 -3.255
203 HG21 ILE 30 1HG2 ILE 30 3.334 12.917 -3.229
204 HG22 ILE 30 2HG2 ILE 30 2.412 12.233 -1.891
205 HG23 ILE 30 3HG2 ILE 30 1.616 12.592 -3.419
206 HD11 ILE 30 3HD1 ILE 30 1.231 10.738 -1.154
207 HD12 ILE 30 1HD1 ILE 30 2.579 9.618 -0.960
208 HD13 ILE 30 2HD1 ILE 30 0.946 8.998 -1.196
209 H GLY 31 H GLY 31 2.405 12.958 -6.190
210 HA2 GLY 31 2HA GLY 31 4.222 14.816 -5.706
211 HA3 GLY 31 1HA GLY 31 5.138 13.779 -6.815
212 H ARG 32 H ARG 32 5.157 15.527 -8.360
213 HA ARG 32 HA ARG 32 2.604 15.502 -9.840
214 HB2 ARG 32 2HB ARG 32 4.510 17.839 -9.721
215 HB3 ARG 32 1HB ARG 32 3.060 17.740 -10.684
216 HG2 ARG 32 2HG ARG 32 1.810 17.597 -8.461
217 HG3 ARG 32 1HG ARG 32 3.338 18.063 -7.730
218 HD2 ARG 32 2HD ARG 32 3.517 19.999 -9.206
219 HD3 ARG 32 1HD ARG 32 1.965 19.600 -9.919
220 HE ARG 32 HE ARG 32 2.019 20.085 -7.066
221 HH11 ARG 32 1HH1 ARG 32 1.214 21.320 -10.319
222 HH12 ARG 32 2HH1 ARG 32 0.380 22.677 -9.699
223 HH21 ARG 32 1HH2 ARG 32 0.947 21.998 -6.312
224 HH22 ARG 32 2HH2 ARG 32 0.218 23.067 -7.429
225 H GLY 33 H GLY 33 3.151 14.146 -11.512
226 HA2 GLY 33 2HA GLY 33 4.818 15.058 -13.484
227 HA3 GLY 33 1HA GLY 33 5.751 13.937 -12.504
228 H GLN 34 H GLN 34 5.771 12.911 -14.622
229 HA GLN 34 HA GLN 34 3.575 11.547 -15.732
230 HB2 GLN 34 2HB GLN 34 6.499 10.805 -15.711
231 HB3 GLN 34 1HB GLN 34 5.287 10.076 -16.748
232 HG2 GLN 34 2HG GLN 34 6.126 12.965 -16.766
233 HG3 GLN 34 1HG GLN 34 6.601 11.733 -17.933
234 HE21 GLN 34 1HE2 GLN 34 5.167 14.223 -18.331
235 HE22 GLN 34 2HE2 GLN 34 3.685 13.777 -19.087
236 H ASP 35 H ASP 35 5.994 10.635 -13.382
237 HA ASP 35 HA ASP 35 5.191 7.981 -12.877
238 HB2 ASP 35 2HB ASP 35 6.571 9.945 -11.056
239 HB3 ASP 35 1HB ASP 35 6.495 8.209 -10.824
240 H ALA 36 H ALA 36 4.261 11.062 -11.616
241 HA ALA 36 HA ALA 36 3.146 10.029 -9.234
242 HB1 ALA 36 1HB ALA 36 2.527 12.240 -8.716
243 HB2 ALA 36 2HB ALA 36 2.813 12.754 -10.383
244 HB3 ALA 36 3HB ALA 36 4.162 12.212 -9.377
245 H GLN 37 H GLN 37 1.560 8.819 -9.312
246 HA GLN 37 HA GLN 37 -0.770 9.076 -10.971
247 HB2 GLN 37 2HB GLN 37 -0.263 7.476 -8.446
248 HB3 GLN 37 1HB GLN 37 -1.618 7.250 -9.543
249 HG2 GLN 37 2HG GLN 37 -0.207 6.419 -11.253
250 HG3 GLN 37 1HG GLN 37 1.243 6.925 -10.388
251 HE21 GLN 37 1HE2 GLN 37 -1.313 4.576 -10.555
252 HE22 GLN 37 2HE2 GLN 37 -0.577 3.429 -9.498
253 H PHE 38 H PHE 38 0.122 9.533 -7.615
254 HA PHE 38 HA PHE 38 -2.320 10.983 -6.976
255 HB2 PHE 38 2HB PHE 38 -1.495 9.172 -5.491
256 HB3 PHE 38 1HB PHE 38 0.019 10.034 -5.303
257 HD1 PHE 38 2HD PHE 38 -0.115 12.356 -4.194
258 HD2 PHE 38 1HD PHE 38 -3.233 9.482 -4.010
259 HE1 PHE 38 2HE PHE 38 -0.971 13.443 -2.194
260 HE2 PHE 38 1HE PHE 38 -4.120 10.578 -1.998
261 HZ PHE 38 HZ PHE 38 -2.977 12.575 -1.084
262 H ARG 39 H ARG 39 -2.195 13.131 -7.297
263 HA ARG 39 HA ARG 39 0.452 14.344 -7.340
264 HB2 ARG 39 2HB ARG 39 -2.054 15.172 -8.800
265 HB3 ARG 39 1HB ARG 39 -0.501 15.994 -8.880
266 HG2 ARG 39 2HG ARG 39 0.534 14.013 -9.841
267 HG3 ARG 39 1HG ARG 39 -0.987 13.139 -9.711
268 HD2 ARG 39 2HD ARG 39 -2.005 14.776 -11.250
269 HD3 ARG 39 1HD ARG 39 -0.427 15.552 -11.418
270 HE ARG 39 HE ARG 39 -0.093 12.859 -11.973
271 HH11 ARG 39 1HH1 ARG 39 -1.687 15.670 -13.419
272 HH12 ARG 39 2HH1 ARG 39 -1.728 15.032 -14.993
273 HH21 ARG 39 1HH2 ARG 39 -0.119 11.978 -14.154
274 HH22 ARG 39 2HH2 ARG 39 -0.813 12.874 -15.418
275 H LEU 40 H LEU 40 0.887 16.115 -6.210
276 HA LEU 40 HA LEU 40 -0.988 16.740 -4.113
277 HB2 LEU 40 2HB LEU 40 1.916 17.428 -4.446
278 HB3 LEU 40 1HB LEU 40 0.939 18.083 -3.148
279 HG LEU 40 HG LEU 40 1.531 15.153 -3.588
280 HD11 LEU 40 1HD1 LEU 40 2.502 17.094 -1.501
281 HD12 LEU 40 2HD1 LEU 40 3.471 16.414 -2.810
282 HD13 LEU 40 3HD1 LEU 40 2.843 15.365 -1.535
283 HD21 LEU 40 3HD2 LEU 40 -0.666 15.466 -2.586
284 HD22 LEU 40 1HD2 LEU 40 0.022 16.573 -1.395
285 HD23 LEU 40 2HD2 LEU 40 0.478 14.873 -1.383
286 HA PRO 41 HA PRO 41 -2.242 20.588 -6.014
287 HB2 PRO 41 2HB PRO 41 -3.185 21.359 -3.332
288 HB3 PRO 41 1HB PRO 41 -4.107 21.112 -4.819
289 HG2 PRO 41 2HG PRO 41 -4.276 19.366 -2.797
290 HG3 PRO 41 1HG PRO 41 -4.293 18.824 -4.484
291 HD2 PRO 41 2HD PRO 41 -2.016 18.828 -2.529
292 HD3 PRO 41 1HD PRO 41 -2.561 17.545 -3.630
293 H ASP 42 H ASP 42 -0.162 20.465 -3.246
294 HA ASP 42 HA ASP 42 0.407 23.326 -3.337
295 HB2 ASP 42 2HB ASP 42 1.298 21.128 -1.495
296 HB3 ASP 42 1HB ASP 42 2.166 22.656 -1.533
297 H THR 43 H THR 43 2.877 23.818 -3.031
298 HA THR 43 HA THR 43 4.319 22.539 -5.223
299 HB THR 43 HB THR 43 4.570 25.348 -4.041
300 HG1 THR 43 1HG THR 43 2.852 25.512 -5.298
301 HG21 THR 43 3HG2 THR 43 6.038 25.840 -5.944
302 HG22 THR 43 1HG2 THR 43 5.910 24.161 -6.476
303 HG23 THR 43 2HG2 THR 43 6.713 24.550 -4.952
304 H GLY 44 H GLY 44 6.882 22.693 -4.748
305 HA2 GLY 44 2HA GLY 44 8.622 22.355 -3.164
306 HA3 GLY 44 1HA GLY 44 7.400 22.081 -1.918
307 H VAL 45 H VAL 45 6.636 20.754 -4.802
308 HA VAL 45 HA VAL 45 7.353 18.084 -3.905
309 HB VAL 45 HB VAL 45 4.986 18.543 -3.555
310 HG11 VAL 45 1HG1 VAL 45 4.826 19.182 -6.476
311 HG12 VAL 45 2HG1 VAL 45 4.600 20.302 -5.131
312 HG13 VAL 45 3HG1 VAL 45 3.440 19.000 -5.396
313 HG21 VAL 45 3HG2 VAL 45 5.562 16.666 -5.815
314 HG22 VAL 45 1HG2 VAL 45 3.993 16.780 -4.997
315 HG23 VAL 45 2HG2 VAL 45 5.415 16.338 -4.076
316 H SER 46 H SER 46 8.666 17.116 -5.297
317 HA SER 46 HA SER 46 9.135 18.164 -7.936
318 HB2 SER 46 2HB SER 46 10.229 15.684 -6.598
319 HB3 SER 46 1HB SER 46 10.950 16.570 -7.945
320 HG SER 46 HG SER 46 10.770 18.406 -6.247
321 H ARG 47 H ARG 47 9.513 15.937 -9.568
322 HA ARG 47 HA ARG 47 6.864 15.170 -10.106
323 HB2 ARG 47 2HB ARG 47 7.704 13.686 -11.861
324 HB3 ARG 47 1HB ARG 47 8.418 15.275 -11.967
325 HG2 ARG 47 2HG ARG 47 10.478 14.337 -10.931
326 HG3 ARG 47 1HG ARG 47 9.700 12.750 -10.935
327 HD2 ARG 47 2HD ARG 47 9.395 12.958 -13.391
328 HD3 ARG 47 1HD ARG 47 10.309 14.462 -13.341
329 HE ARG 47 HE ARG 47 11.784 12.389 -12.154
330 HH11 ARG 47 1HH1 ARG 47 10.742 13.541 -15.335
331 HH12 ARG 47 2HH1 ARG 47 11.974 12.764 -16.197
332 HH21 ARG 47 1HH2 ARG 47 13.504 11.272 -13.357
333 HH22 ARG 47 2HH2 ARG 47 13.580 11.446 -15.045
334 H ARG 48 H ARG 48 9.289 13.706 -8.222
335 HA ARG 48 HA ARG 48 7.235 11.892 -7.298
336 HB2 ARG 48 2HB ARG 48 10.148 11.132 -7.653
337 HB3 ARG 48 1HB ARG 48 8.942 10.163 -6.818
338 HG2 ARG 48 2HG ARG 48 7.636 10.230 -8.977
339 HG3 ARG 48 1HG ARG 48 9.103 10.808 -9.738
340 HD2 ARG 48 2HD ARG 48 8.829 8.275 -8.145
341 HD3 ARG 48 1HD ARG 48 8.797 8.348 -9.907
342 HE ARG 48 HE ARG 48 11.140 9.201 -8.358
343 HH11 ARG 48 1HH1 ARG 48 9.742 7.314 -11.050
344 HH12 ARG 48 2HH1 ARG 48 11.136 6.376 -11.265
345 HH21 ARG 48 1HH2 ARG 48 13.069 7.906 -8.726
346 HH22 ARG 48 2HH2 ARG 48 13.063 6.701 -9.927
347 H HIS 49 H HIS 49 6.808 12.288 -5.354
348 HA HIS 49 HA HIS 49 8.652 13.786 -3.645
349 HB2 HIS 49 2HB HIS 49 6.565 14.872 -4.034
350 HB3 HIS 49 1HB HIS 49 5.645 13.422 -3.674
351 HD2 HIS 49 2HD HIS 49 5.535 12.775 -0.873
352 HE1 HIS 49 1HE HIS 49 6.607 16.667 0.334
353 HE2 HIS 49 2HE HIS 49 6.097 14.320 1.090
354 H LEU 50 H LEU 50 6.775 10.875 -4.020
355 HA LEU 50 HA LEU 50 8.293 9.527 -2.074
356 HB2 LEU 50 2HB LEU 50 6.862 10.817 -0.572
357 HB3 LEU 50 1HB LEU 50 5.436 10.278 -1.416
358 HG LEU 50 HG LEU 50 7.160 8.224 -0.084
359 HD11 LEU 50 1HD1 LEU 50 5.118 9.995 1.282
360 HD12 LEU 50 2HD1 LEU 50 6.857 10.064 1.549
361 HD13 LEU 50 3HD1 LEU 50 5.958 8.623 2.007
362 HD21 LEU 50 3HD2 LEU 50 4.993 7.162 0.242
363 HD22 LEU 50 1HD2 LEU 50 5.227 7.580 -1.452
364 HD23 LEU 50 2HD2 LEU 50 4.185 8.569 -0.423
365 H GLU 51 H GLU 51 7.982 7.355 -2.225
366 HA GLU 51 HA GLU 51 5.922 6.454 -4.076
367 HB2 GLU 51 2HB GLU 51 7.516 4.756 -4.938
368 HB3 GLU 51 1HB GLU 51 7.882 6.387 -5.434
369 HG2 GLU 51 2HG GLU 51 9.617 6.444 -3.610
370 HG3 GLU 51 1HG GLU 51 9.243 4.749 -3.300
371 H ILE 52 H ILE 52 4.872 4.722 -3.485
372 HA ILE 52 HA ILE 52 5.840 3.310 -1.098
373 HB ILE 52 HB ILE 52 2.969 3.489 -2.062
374 HG12 ILE 52 2HG1 ILE 52 4.258 4.825 0.332
375 HG13 ILE 52 1HG1 ILE 52 3.837 5.651 -1.161
376 HG21 ILE 52 1HG2 ILE 52 4.217 2.336 0.434
377 HG22 ILE 52 2HG2 ILE 52 3.523 1.435 -0.914
378 HG23 ILE 52 3HG2 ILE 52 2.481 2.432 0.112
379 HD11 ILE 52 3HD1 ILE 52 1.479 5.166 -0.766
380 HD12 ILE 52 1HD1 ILE 52 2.190 6.048 0.584
381 HD13 ILE 52 2HD1 ILE 52 1.900 4.313 0.722
382 H ARG 53 H ARG 53 6.712 1.495 -1.733
383 HA ARG 53 HA ARG 53 5.696 0.203 -4.136
384 HB2 ARG 53 2HB ARG 53 8.109 0.492 -3.983
385 HB3 ARG 53 1HB ARG 53 8.146 -0.382 -2.470
386 HG2 ARG 53 2HG ARG 53 7.579 -2.428 -3.549
387 HG3 ARG 53 1HG ARG 53 7.228 -1.584 -5.063
388 HD2 ARG 53 2HD ARG 53 9.929 -1.640 -3.722
389 HD3 ARG 53 1HD ARG 53 9.446 -2.696 -5.062
390 HE ARG 53 HE ARG 53 9.235 -0.789 -6.441
391 HH11 ARG 53 1HH1 ARG 53 11.078 -0.186 -3.420
392 HH12 ARG 53 2HH1 ARG 53 11.724 1.288 -3.968
393 HH21 ARG 53 1HH2 ARG 53 10.182 1.245 -7.142
394 HH22 ARG 53 2HH2 ARG 53 11.124 2.153 -6.058
395 H TRP 54 H TRP 54 4.032 -0.931 -3.846
396 HA TRP 54 HA TRP 54 3.738 -2.367 -1.382
397 HB2 TRP 54 2HB TRP 54 1.840 -1.032 -1.852
398 HB3 TRP 54 1HB TRP 54 1.813 -1.537 -3.539
399 HD1 TRP 54 HD TRP 54 -0.149 -3.152 -3.964
400 HE1 TRP 54 1HE TRP 54 -1.362 -5.028 -2.637
401 HE3 TRP 54 3HE TRP 54 2.435 -2.866 0.406
402 HZ2 TRP 54 2HZ TRP 54 -1.219 -6.209 -0.089
403 HZ3 TRP 54 3HZ TRP 54 1.872 -4.363 2.231
404 HH2 TRP 54 HH TRP 54 0.059 -6.022 2.006
405 H ASP 55 H ASP 55 4.608 -4.223 -1.421
406 HA ASP 55 HA ASP 55 4.376 -5.958 -3.784
407 HB2 ASP 55 2HB ASP 55 6.702 -5.423 -2.823
408 HB3 ASP 55 1HB ASP 55 6.208 -6.286 -1.374
409 H GLY 56 H GLY 56 4.355 -8.422 -2.664
410 HA2 GLY 56 2HA GLY 56 1.808 -8.329 -1.294
411 HA3 GLY 56 1HA GLY 56 2.595 -9.805 -1.853
412 H GLN 57 H GLN 57 4.719 -7.948 -0.243
413 HA GLN 57 HA GLN 57 4.470 -9.501 2.212
414 HB2 GLN 57 2HB GLN 57 6.630 -7.735 1.151
415 HB3 GLN 57 1HB GLN 57 6.752 -8.620 2.676
416 HG2 GLN 57 2HG GLN 57 6.586 -10.720 1.416
417 HG3 GLN 57 1HG GLN 57 6.481 -9.798 -0.084
418 HE21 GLN 57 1HE2 GLN 57 8.452 -11.748 0.751
419 HE22 GLN 57 2HE2 GLN 57 9.976 -10.932 0.724
420 H VAL 58 H VAL 58 5.598 -6.173 1.596
421 HA VAL 58 HA VAL 58 3.779 -5.104 3.580
422 HB VAL 58 HB VAL 58 5.617 -3.813 4.683
423 HG11 VAL 58 1HG1 VAL 58 5.939 -6.801 4.895
424 HG12 VAL 58 2HG1 VAL 58 4.791 -5.808 5.790
425 HG13 VAL 58 3HG1 VAL 58 6.521 -5.619 6.069
426 HG21 VAL 58 3HG2 VAL 58 7.455 -5.649 3.142
427 HG22 VAL 58 1HG2 VAL 58 7.955 -4.539 4.419
428 HG23 VAL 58 2HG2 VAL 58 7.292 -3.908 2.908
429 H ALA 59 H ALA 59 3.767 -2.727 3.515
430 HA ALA 59 HA ALA 59 4.169 -1.808 0.796
431 HB1 ALA 59 1HB ALA 59 1.997 -1.337 1.821
432 HB2 ALA 59 2HB ALA 59 2.870 0.174 1.543
433 HB3 ALA 59 3HB ALA 59 2.801 -0.531 3.159
434 H LEU 60 H LEU 60 6.074 -1.224 0.424
435 HA LEU 60 HA LEU 60 7.882 -0.222 2.423
436 HB2 LEU 60 2HB LEU 60 8.472 -1.863 0.635
437 HB3 LEU 60 1HB LEU 60 8.200 -0.622 -0.555
438 HG LEU 60 HG LEU 60 10.379 -0.485 1.537
439 HD11 LEU 60 1HD1 LEU 60 11.890 -1.214 -0.269
440 HD12 LEU 60 2HD1 LEU 60 10.486 -1.455 -1.314
441 HD13 LEU 60 3HD1 LEU 60 10.685 -2.441 0.130
442 HD21 LEU 60 3HD2 LEU 60 11.389 1.158 0.014
443 HD22 LEU 60 1HD2 LEU 60 9.780 1.677 0.528
444 HD23 LEU 60 2HD2 LEU 60 10.010 0.988 -1.079
445 H LEU 61 H LEU 61 7.759 1.805 2.991
446 HA LEU 61 HA LEU 61 6.726 3.878 1.236
447 HB2 LEU 61 2HB LEU 61 5.864 3.553 3.520
448 HB3 LEU 61 1HB LEU 61 7.438 3.806 4.195
449 HG LEU 61 HG LEU 61 5.944 5.699 4.578
450 HD11 LEU 61 1HD1 LEU 61 8.099 6.501 2.650
451 HD12 LEU 61 2HD1 LEU 61 8.266 6.289 4.393
452 HD13 LEU 61 3HD1 LEU 61 7.239 7.571 3.759
453 HD21 LEU 61 3HD2 LEU 61 5.044 7.035 2.794
454 HD22 LEU 61 1HD2 LEU 61 4.508 5.363 2.653
455 HD23 LEU 61 2HD2 LEU 61 5.796 5.965 1.602
456 H ALA 62 H ALA 62 8.191 5.011 0.097
457 HA ALA 62 HA ALA 62 10.766 5.554 1.360
458 HB1 ALA 62 1HB ALA 62 10.267 5.066 -1.575
459 HB2 ALA 62 2HB ALA 62 11.060 3.939 -0.475
460 HB3 ALA 62 3HB ALA 62 11.817 5.489 -0.849
461 H ASP 63 H ASP 63 10.788 7.614 1.866
462 HA ASP 63 HA ASP 63 9.108 9.527 0.482
463 HB2 ASP 63 2HB ASP 63 9.327 9.808 2.888
464 HB3 ASP 63 1HB ASP 63 11.082 9.850 2.768
465 H LEU 64 H LEU 64 9.793 11.040 -0.950
466 HA LEU 64 HA LEU 64 12.632 10.962 -1.650
467 HB2 LEU 64 2HB LEU 64 11.327 9.390 -3.047
468 HB3 LEU 64 1HB LEU 64 10.260 10.692 -3.498
469 HG LEU 64 HG LEU 64 11.909 11.696 -4.882
470 HD11 LEU 64 1HD1 LEU 64 13.813 9.598 -3.803
471 HD12 LEU 64 2HD1 LEU 64 13.886 11.326 -3.444
472 HD13 LEU 64 3HD1 LEU 64 14.182 10.751 -5.083
473 HD21 LEU 64 3HD2 LEU 64 12.331 9.892 -6.449
474 HD22 LEU 64 1HD2 LEU 64 10.704 9.795 -5.782
475 HD23 LEU 64 2HD2 LEU 64 11.964 8.707 -5.201
476 H ASN 65 H ASN 65 12.489 13.037 -0.397
477 HA ASN 65 HA ASN 65 12.094 15.275 -2.160
478 HB2 ASN 65 2HB ASN 65 9.771 14.750 -1.087
479 HB3 ASN 65 1HB ASN 65 10.505 15.276 0.423
480 HD21 ASN 65 1HD2 ASN 65 8.997 16.246 -2.410
481 HD22 ASN 65 2HD2 ASN 65 9.153 17.963 -2.220
482 H SER 66 H SER 66 12.900 17.267 -1.003
483 HA SER 66 HA SER 66 14.824 16.523 1.050
484 HB2 SER 66 2HB SER 66 15.819 18.758 0.332
485 HB3 SER 66 1HB SER 66 15.869 17.453 -0.861
486 HG SER 66 HG SER 66 14.830 19.825 -1.207
487 H THR 67 H THR 67 12.576 19.127 0.188
488 HA THR 67 HA THR 67 12.900 20.383 2.784
489 HB THR 67 HB THR 67 13.028 21.817 0.853
490 HG1 THR 67 1HG THR 67 10.727 22.917 1.518
491 HG21 THR 67 3HG2 THR 67 11.608 20.566 -0.722
492 HG22 THR 67 1HG2 THR 67 11.078 22.243 -0.621
493 HG23 THR 67 2HG2 THR 67 10.176 20.977 0.212
494 H ASN 68 H ASN 68 10.392 18.656 1.064
495 HA ASN 68 HA ASN 68 8.500 19.370 3.203
496 HB2 ASN 68 2HB ASN 68 8.113 20.200 0.812
497 HB3 ASN 68 1HB ASN 68 7.848 18.519 0.377
498 HD21 ASN 68 1HD2 ASN 68 5.784 18.999 -0.239
499 HD22 ASN 68 2HD2 ASN 68 4.499 19.308 0.890
500 H GLY 69 H GLY 69 10.496 17.298 3.103
501 HA2 GLY 69 2HA GLY 69 9.732 14.751 2.398
502 HA3 GLY 69 1HA GLY 69 10.788 15.125 3.747
503 H THR 70 H THR 70 8.587 13.210 3.168
504 HA THR 70 HA THR 70 6.405 13.821 4.880
505 HB THR 70 HB THR 70 7.195 11.176 3.692
506 HG1 THR 70 1HG THR 70 7.253 12.444 1.994
507 HG21 THR 70 3HG2 THR 70 4.529 12.468 4.289
508 HG22 THR 70 1HG2 THR 70 5.291 11.192 5.234
509 HG23 THR 70 2HG2 THR 70 4.762 10.870 3.579
510 H THR 71 H THR 71 6.060 13.110 6.919
511 HA THR 71 HA THR 71 8.311 11.861 8.350
512 HB THR 71 HB THR 71 5.978 13.098 9.726
513 HG1 THR 71 1HG THR 71 7.390 14.306 7.768
514 HG21 THR 71 3HG2 THR 71 7.904 12.212 10.961
515 HG22 THR 71 1HG2 THR 71 7.746 13.956 11.181
516 HG23 THR 71 2HG2 THR 71 8.963 13.312 10.078
517 H VAL 72 H VAL 72 7.847 9.906 9.545
518 HA VAL 72 HA VAL 72 5.114 8.884 9.238
519 HB VAL 72 HB VAL 72 6.115 6.556 9.294
520 HG11 VAL 72 1HG1 VAL 72 7.120 8.307 7.054
521 HG12 VAL 72 2HG1 VAL 72 5.503 7.628 7.180
522 HG13 VAL 72 3HG1 VAL 72 6.892 6.558 6.983
523 HG21 VAL 72 3HG2 VAL 72 8.238 7.112 10.367
524 HG22 VAL 72 1HG2 VAL 72 8.705 8.058 8.953
525 HG23 VAL 72 2HG2 VAL 72 8.504 6.310 8.816
526 H ASN 73 H ASN 73 4.083 8.696 11.049
527 HA ASN 73 HA ASN 73 3.545 8.640 13.252
528 HB2 ASN 73 2HB ASN 73 6.004 6.870 13.354
529 HB3 ASN 73 1HB ASN 73 4.924 7.098 14.725
530 HD21 ASN 73 1HD2 ASN 73 5.545 4.674 13.248
531 HD22 ASN 73 2HD2 ASN 73 4.038 4.079 12.630
532 H ASN 74 H ASN 74 4.928 10.819 12.356
533 HA ASN 74 HA ASN 74 5.905 12.735 12.961
534 HB2 ASN 74 2HB ASN 74 4.417 12.270 15.057
535 HB3 ASN 74 1HB ASN 74 5.916 11.835 15.857
536 HD21 ASN 74 1HD2 ASN 74 4.023 14.003 16.425
537 HD22 ASN 74 2HD2 ASN 74 4.940 15.453 16.355
538 H ALA 75 H ALA 75 7.478 10.263 12.458
539 HA ALA 75 HA ALA 75 10.011 11.125 13.660
540 HB1 ALA 75 1HB ALA 75 9.176 8.340 12.815
541 HB2 ALA 75 2HB ALA 75 9.365 8.904 14.476
542 HB3 ALA 75 3HB ALA 75 10.772 8.787 13.418
543 HA PRO 76 HA PRO 76 10.756 11.683 9.301
544 HB2 PRO 76 2HB PRO 76 13.011 13.161 9.478
545 HB3 PRO 76 1HB PRO 76 11.405 13.817 9.840
546 HG2 PRO 76 2HG PRO 76 13.580 13.012 11.705
547 HG3 PRO 76 1HG PRO 76 12.369 14.288 11.881
548 HD2 PRO 76 2HD PRO 76 12.278 11.721 13.045
549 HD3 PRO 76 1HD PRO 76 10.944 12.885 12.955
550 H VAL 77 H VAL 77 11.564 10.212 8.041
551 HA VAL 77 HA VAL 77 14.206 9.068 8.444
552 HB VAL 77 HB VAL 77 13.392 6.754 8.085
553 HG11 VAL 77 1HG1 VAL 77 12.365 6.297 10.254
554 HG12 VAL 77 2HG1 VAL 77 12.041 8.017 10.458
555 HG13 VAL 77 3HG1 VAL 77 13.707 7.437 10.394
556 HG21 VAL 77 3HG2 VAL 77 11.363 7.209 6.852
557 HG22 VAL 77 1HG2 VAL 77 10.636 7.952 8.276
558 HG23 VAL 77 2HG2 VAL 77 10.988 6.225 8.268
559 H GLN 78 H GLN 78 14.443 7.451 6.395
560 HA GLN 78 HA GLN 78 13.514 9.051 4.122
561 HB2 GLN 78 2HB GLN 78 15.778 7.048 4.222
562 HB3 GLN 78 1HB GLN 78 15.375 8.099 2.869
563 HG2 GLN 78 2HG GLN 78 15.876 10.059 4.268
564 HG3 GLN 78 1HG GLN 78 16.336 8.981 5.582
565 HE21 GLN 78 1HE2 GLN 78 18.413 9.671 5.683
566 HE22 GLN 78 2HE2 GLN 78 19.589 9.379 4.454
567 H GLU 79 H GLU 79 13.676 5.793 5.435
568 HA GLU 79 HA GLU 79 11.629 4.992 3.518
569 HB2 GLU 79 2HB GLU 79 12.701 2.813 3.271
570 HB3 GLU 79 1HB GLU 79 13.783 4.089 2.737
571 HG2 GLU 79 2HG GLU 79 14.952 3.967 4.887
572 HG3 GLU 79 1HG GLU 79 13.905 2.634 5.368
573 H TRP 80 H TRP 80 10.242 3.347 4.337
574 HA TRP 80 HA TRP 80 10.414 2.486 7.077
575 HB2 TRP 80 2HB TRP 80 9.667 4.749 7.374
576 HB3 TRP 80 1HB TRP 80 8.367 4.575 6.203
577 HD1 TRP 80 HD TRP 80 6.171 3.316 7.103
578 HE1 TRP 80 1HE TRP 80 5.276 2.907 9.472
579 HE3 TRP 80 3HE TRP 80 10.463 4.240 9.699
580 HZ2 TRP 80 2HZ TRP 80 6.285 3.013 12.123
581 HZ3 TRP 80 3HZ TRP 80 10.407 4.080 12.158
582 HH2 TRP 80 HH TRP 80 8.352 3.480 13.331
583 H GLN 81 H GLN 81 8.830 0.839 7.397
584 HA GLN 81 HA GLN 81 7.304 0.323 4.998
585 HB2 GLN 81 2HB GLN 81 7.254 -2.131 5.581
586 HB3 GLN 81 1HB GLN 81 8.833 -1.473 5.193
587 HG2 GLN 81 2HG GLN 81 9.293 -2.875 6.948
588 HG3 GLN 81 1HG GLN 81 9.134 -1.316 7.745
589 HE21 GLN 81 1HE2 GLN 81 8.685 -2.241 9.675
590 HE22 GLN 81 2HE2 GLN 81 7.189 -3.011 10.040
591 H LEU 82 H LEU 82 5.363 0.667 4.999
592 HA LEU 82 HA LEU 82 3.980 1.822 7.154
593 HB2 LEU 82 2HB LEU 82 2.807 0.622 4.671
594 HB3 LEU 82 1HB LEU 82 2.064 1.790 5.730
595 HG LEU 82 HG LEU 82 4.499 2.289 4.045
596 HD11 LEU 82 1HD1 LEU 82 3.011 3.720 2.721
597 HD12 LEU 82 2HD1 LEU 82 1.644 3.203 3.703
598 HD13 LEU 82 3HD1 LEU 82 2.493 2.037 2.692
599 HD21 LEU 82 3HD2 LEU 82 2.845 4.137 5.747
600 HD22 LEU 82 1HD2 LEU 82 4.152 4.629 4.680
601 HD23 LEU 82 2HD2 LEU 82 4.488 3.615 6.085
602 H ALA 83 H ALA 83 2.986 0.916 8.789
603 HA ALA 83 HA ALA 83 1.723 -1.703 8.412
604 HB1 ALA 83 1HB ALA 83 2.006 -2.067 10.826
605 HB2 ALA 83 2HB ALA 83 2.821 -0.511 10.962
606 HB3 ALA 83 3HB ALA 83 3.563 -1.816 10.038
607 H ASP 84 H ASP 84 -0.259 -1.944 9.722
608 HA ASP 84 HA ASP 84 -2.045 0.151 9.191
609 HB2 ASP 84 2HB ASP 84 -2.766 -2.178 9.288
610 HB3 ASP 84 1HB ASP 84 -2.380 -2.245 11.001
611 H GLY 85 H GLY 85 -2.376 1.949 10.211
612 HA2 GLY 85 2HA GLY 85 -3.024 3.122 12.185
613 HA3 GLY 85 1HA GLY 85 -1.987 2.059 13.118
614 H ASP 86 H ASP 86 -0.250 2.801 10.405
615 HA ASP 86 HA ASP 86 1.379 4.637 11.876
616 HB2 ASP 86 2HB ASP 86 1.624 3.594 9.058
617 HB3 ASP 86 1HB ASP 86 2.677 4.860 9.663
618 H VAL 87 H VAL 87 1.691 6.720 11.681
619 HA VAL 87 HA VAL 87 -0.339 8.254 10.199
620 HB VAL 87 HB VAL 87 1.639 9.291 12.257
621 HG11 VAL 87 1HG1 VAL 87 0.739 11.005 10.816
622 HG12 VAL 87 2HG1 VAL 87 0.096 11.180 12.450
623 HG13 VAL 87 3HG1 VAL 87 -0.907 10.485 11.180
624 HG21 VAL 87 3HG2 VAL 87 0.209 7.586 13.290
625 HG22 VAL 87 1HG2 VAL 87 -1.220 8.445 12.713
626 HG23 VAL 87 2HG2 VAL 87 -0.157 9.199 13.905
627 H ILE 88 H ILE 88 0.323 8.878 8.277
628 HA ILE 88 HA ILE 88 3.137 9.509 7.892
629 HB ILE 88 HB ILE 88 0.954 8.617 5.996
630 HG12 ILE 88 2HG1 ILE 88 2.631 6.969 5.213
631 HG13 ILE 88 1HG1 ILE 88 3.793 7.622 6.345
632 HG21 ILE 88 1HG2 ILE 88 3.557 9.835 5.120
633 HG22 ILE 88 2HG2 ILE 88 1.958 10.544 4.906
634 HG23 ILE 88 3HG2 ILE 88 2.385 9.054 4.059
635 HD11 ILE 88 3HD1 ILE 88 1.225 6.202 7.030
636 HD12 ILE 88 1HD1 ILE 88 2.365 6.860 8.198
637 HD13 ILE 88 2HD1 ILE 88 2.851 5.528 7.156
638 H ARG 89 H ARG 89 3.597 11.598 7.919
639 HA ARG 89 HA ARG 89 1.404 13.521 7.476
640 HB2 ARG 89 2HB ARG 89 2.458 13.216 9.836
641 HB3 ARG 89 1HB ARG 89 3.857 14.028 9.171
642 HG2 ARG 89 2HG ARG 89 1.086 15.238 9.299
643 HG3 ARG 89 1HG ARG 89 2.341 15.490 10.504
644 HD2 ARG 89 2HD ARG 89 2.494 16.266 7.590
645 HD3 ARG 89 1HD ARG 89 2.155 17.361 8.927
646 HE ARG 89 HE ARG 89 4.570 16.079 9.468
647 HH11 ARG 89 1HH1 ARG 89 3.272 18.469 7.192
648 HH12 ARG 89 2HH1 ARG 89 4.801 19.159 6.855
649 HH21 ARG 89 1HH2 ARG 89 6.647 17.071 9.011
650 HH22 ARG 89 2HH2 ARG 89 6.722 18.383 7.923
651 H LEU 90 H LEU 90 1.668 14.750 5.753
652 HA LEU 90 HA LEU 90 4.368 15.234 4.720
653 HB2 LEU 90 2HB LEU 90 3.382 15.374 2.453
654 HB3 LEU 90 1HB LEU 90 3.249 13.777 3.137
655 HG LEU 90 HG LEU 90 0.860 15.669 3.182
656 HD11 LEU 90 1HD1 LEU 90 1.675 13.743 1.010
657 HD12 LEU 90 2HD1 LEU 90 1.660 15.501 0.870
658 HD13 LEU 90 3HD1 LEU 90 0.151 14.621 1.106
659 HD21 LEU 90 3HD2 LEU 90 -0.369 13.574 3.237
660 HD22 LEU 90 1HD2 LEU 90 0.783 13.628 4.569
661 HD23 LEU 90 2HD2 LEU 90 1.134 12.658 3.139
662 H GLY 91 H GLY 91 4.492 17.345 3.501
663 HA2 GLY 91 2HA GLY 91 3.135 19.349 5.035
664 HA3 GLY 91 1HA GLY 91 4.231 19.627 3.685
665 H HIS 92 H HIS 92 1.019 18.930 4.630
666 HA HIS 92 HA HIS 92 -0.416 20.444 2.897
667 HB2 HIS 92 2HB HIS 92 0.417 19.093 0.982
668 HB3 HIS 92 1HB HIS 92 -0.135 17.620 1.770
669 HD1 HIS 92 1HD HIS 92 -1.590 20.785 0.154
670 HD2 HIS 92 2HD HIS 92 -2.667 16.895 1.166
671 HE1 HIS 92 1HE HIS 92 -3.919 20.442 -0.717
672 H SER 93 H SER 93 -0.291 17.178 4.251
673 HA SER 93 HA SER 93 -2.505 17.615 5.972
674 HB2 SER 93 2HB SER 93 -3.941 15.889 4.851
675 HB3 SER 93 1HB SER 93 -3.723 17.389 3.922
676 HG SER 93 HG SER 93 -3.340 15.899 2.467
677 H GLU 94 H GLU 94 -3.240 15.090 6.559
678 HA GLU 94 HA GLU 94 -0.811 13.519 6.725
679 HB2 GLU 94 2HB GLU 94 -1.519 12.810 9.022
680 HB3 GLU 94 1HB GLU 94 -1.026 14.493 8.902
681 HG2 GLU 94 2HG GLU 94 -3.371 15.161 8.823
682 HG3 GLU 94 1HG GLU 94 -3.843 13.472 8.971
683 H ILE 95 H ILE 95 -1.131 11.314 6.885
684 HA ILE 95 HA ILE 95 -3.731 10.345 6.121
685 HB ILE 95 HB ILE 95 -2.904 10.489 3.996
686 HG12 ILE 95 2HG1 ILE 95 -3.356 8.020 4.471
687 HG13 ILE 95 1HG1 ILE 95 -2.408 8.406 3.038
688 HG21 ILE 95 1HG2 ILE 95 -0.625 10.166 3.222
689 HG22 ILE 95 2HG2 ILE 95 -0.138 9.926 4.901
690 HG23 ILE 95 3HG2 ILE 95 -0.839 11.465 4.397
691 HD11 ILE 95 3HD1 ILE 95 -1.578 6.418 4.276
692 HD12 ILE 95 1HD1 ILE 95 -1.261 7.453 5.660
693 HD13 ILE 95 2HD1 ILE 95 -0.365 7.697 4.158
694 H ILE 96 H ILE 96 -4.212 8.307 6.715
695 HA ILE 96 HA ILE 96 -2.425 7.092 8.727
696 HB ILE 96 HB ILE 96 -5.430 6.775 8.419
697 HG12 ILE 96 2HG1 ILE 96 -3.931 8.393 10.487
698 HG13 ILE 96 1HG1 ILE 96 -4.755 9.084 9.094
699 HG21 ILE 96 1HG2 ILE 96 -5.318 5.752 10.661
700 HG22 ILE 96 2HG2 ILE 96 -3.560 5.913 10.635
701 HG23 ILE 96 3HG2 ILE 96 -4.365 4.855 9.479
702 HD11 ILE 96 3HD1 ILE 96 -6.091 9.278 11.118
703 HD12 ILE 96 1HD1 ILE 96 -6.048 7.527 11.319
704 HD13 ILE 96 2HD1 ILE 96 -6.882 8.236 9.935
705 H VAL 97 H VAL 97 -1.670 5.095 8.214
706 HA VAL 97 HA VAL 97 -2.633 3.818 5.815
707 HB VAL 97 HB VAL 97 -0.358 3.154 7.704
708 HG11 VAL 97 1HG1 VAL 97 0.200 1.266 6.245
709 HG12 VAL 97 2HG1 VAL 97 -1.221 1.601 5.255
710 HG13 VAL 97 3HG1 VAL 97 -1.417 1.038 6.917
711 HG21 VAL 97 3HG2 VAL 97 0.963 3.576 5.722
712 HG22 VAL 97 1HG2 VAL 97 -0.069 4.962 6.094
713 HG23 VAL 97 2HG2 VAL 97 -0.513 3.853 4.797
714 H ARG 98 H ARG 98 -4.113 2.326 5.704
715 HA ARG 98 HA ARG 98 -4.909 0.926 8.145
716 HB2 ARG 98 2HB ARG 98 -6.573 2.162 5.960
717 HB3 ARG 98 1HB ARG 98 -7.216 1.035 7.149
718 HG2 ARG 98 2HG ARG 98 -5.805 3.559 7.938
719 HG3 ARG 98 1HG ARG 98 -7.543 3.503 7.627
720 HD2 ARG 98 2HD ARG 98 -6.138 1.688 9.592
721 HD3 ARG 98 1HD ARG 98 -6.896 3.219 10.037
722 HE ARG 98 HE ARG 98 -8.972 2.342 9.217
723 HH11 ARG 98 1HH1 ARG 98 -6.470 -0.166 9.947
724 HH12 ARG 98 2HH1 ARG 98 -7.624 -1.363 10.170
725 HH21 ARG 98 1HH2 ARG 98 -10.472 0.626 9.511
726 HH22 ARG 98 2HH2 ARG 98 -9.931 -0.935 9.926
727 H MET 99 H MET 99 -5.131 -1.173 7.972
728 HA MET 99 HA MET 99 -4.833 -2.310 5.282
729 HB2 MET 99 2HB MET 99 -3.879 -3.398 7.916
730 HB3 MET 99 1HB MET 99 -3.920 -4.349 6.441
731 HG2 MET 99 2HG MET 99 -2.398 -2.799 5.365
732 HG3 MET 99 1HG MET 99 -2.373 -1.798 6.813
733 HE1 MET 99 3HE MET 99 1.205 -3.444 6.632
734 HE2 MET 99 1HE MET 99 0.300 -1.930 6.621
735 HE3 MET 99 2HE MET 99 0.190 -3.032 5.247
736 H HIS 100 H HIS 100 -6.370 -3.422 4.510
737 HA HIS 100 HA HIS 100 -8.505 -4.356 6.280
738 HB2 HIS 100 2HB HIS 100 -8.598 -3.748 3.302
739 HB3 HIS 100 1HB HIS 100 -9.959 -4.238 4.298
740 HD1 HIS 100 1HD HIS 100 -11.324 -2.328 5.281
741 HD2 HIS 100 2HD HIS 100 -7.547 -1.134 4.044
742 HE1 HIS 100 1HE HIS 100 -11.282 0.189 5.469
Start of MODEL 20
1 H1 GLY 1 1HT GLY 1 -8.486 -22.197 -0.704
2 H2 GLY 1 2HT GLY 1 -7.432 -23.272 0.078
3 H3 GLY 1 3HT GLY 1 -7.480 -21.633 0.517
4 HA2 GLY 1 1HA GLY 1 -9.709 -23.519 0.857
5 HA3 GLY 1 2HA GLY 1 -8.623 -22.962 2.125
6 H HIS 2 H HIS 2 -11.442 -22.541 2.104
7 HA HIS 2 HA HIS 2 -11.808 -19.851 1.210
8 HB2 HIS 2 2HB HIS 2 -13.647 -21.822 2.541
9 HB3 HIS 2 1HB HIS 2 -14.099 -20.133 2.331
10 HD1 HIS 2 1HD HIS 2 -15.760 -20.125 0.474
11 HD2 HIS 2 2HD HIS 2 -12.542 -22.627 -0.319
12 HE1 HIS 2 1HE HIS 2 -16.125 -21.016 -1.842
13 H GLY 3 H GLY 3 -12.380 -18.165 2.531
14 HA2 GLY 3 2HA GLY 3 -12.337 -16.962 4.585
15 HA3 GLY 3 1HA GLY 3 -11.641 -18.387 5.357
16 H SER 4 H SER 4 -10.549 -17.127 2.344
17 HA SER 4 HA SER 4 -7.852 -17.220 2.963
18 HB2 SER 4 2HB SER 4 -9.225 -15.600 0.835
19 HB3 SER 4 1HB SER 4 -7.571 -16.218 0.814
20 HG SER 4 HG SER 4 -8.601 -18.352 1.018
21 H ALA 5 H ALA 5 -6.526 -15.786 3.822
22 HA ALA 5 HA ALA 5 -7.560 -13.217 4.677
23 HB1 ALA 5 1HB ALA 5 -5.409 -13.009 5.847
24 HB2 ALA 5 2HB ALA 5 -4.863 -14.506 5.095
25 HB3 ALA 5 3HB ALA 5 -6.205 -14.537 6.244
26 H GLY 6 H GLY 6 -6.686 -11.271 3.951
27 HA2 GLY 6 2HA GLY 6 -4.774 -11.385 1.766
28 HA3 GLY 6 1HA GLY 6 -6.351 -10.657 1.455
29 H THR 7 H THR 7 -3.952 -9.195 1.277
30 HA THR 7 HA THR 7 -4.450 -7.371 3.500
31 HB THR 7 HB THR 7 -1.721 -7.819 2.256
32 HG1 THR 7 1HG THR 7 -2.428 -9.660 3.462
33 HG21 THR 7 3HG2 THR 7 -0.943 -6.545 4.205
34 HG22 THR 7 1HG2 THR 7 -2.604 -6.401 4.779
35 HG23 THR 7 2HG2 THR 7 -2.120 -5.606 3.284
36 H SER 8 H SER 8 -5.364 -5.668 2.628
37 HA SER 8 HA SER 8 -4.101 -4.514 0.267
38 HB2 SER 8 2HB SER 8 -6.394 -3.498 -0.219
39 HB3 SER 8 1HB SER 8 -6.280 -5.242 -0.438
40 HG SER 8 HG SER 8 -7.009 -5.035 2.016
41 H VAL 9 H VAL 9 -3.706 -2.300 0.429
42 HA VAL 9 HA VAL 9 -4.099 -1.322 3.137
43 HB VAL 9 HB VAL 9 -1.803 -1.919 2.992
44 HG11 VAL 9 1HG1 VAL 9 -1.562 -2.082 0.619
45 HG12 VAL 9 2HG1 VAL 9 -0.288 -1.053 1.279
46 HG13 VAL 9 3HG1 VAL 9 -1.693 -0.335 0.472
47 HG21 VAL 9 3HG2 VAL 9 -2.218 0.187 4.127
48 HG22 VAL 9 1HG2 VAL 9 -2.014 1.064 2.611
49 HG23 VAL 9 2HG2 VAL 9 -0.645 0.214 3.326
50 H THR 10 H THR 10 -5.084 0.458 3.394
51 HA THR 10 HA THR 10 -5.577 2.202 1.076
52 HB THR 10 HB THR 10 -7.333 1.848 3.518
53 HG1 THR 10 1HG THR 10 -8.068 0.130 2.704
54 HG21 THR 10 3HG2 THR 10 -7.886 2.958 0.756
55 HG22 THR 10 1HG2 THR 10 -7.641 3.913 2.217
56 HG23 THR 10 2HG2 THR 10 -9.049 2.859 2.077
57 H LEU 11 H LEU 11 -4.922 4.235 1.329
58 HA LEU 11 HA LEU 11 -4.027 4.985 3.982
59 HB2 LEU 11 2HB LEU 11 -2.645 6.682 2.901
60 HB3 LEU 11 1HB LEU 11 -2.259 5.084 2.311
61 HG LEU 11 HG LEU 11 -3.752 5.803 0.280
62 HD11 LEU 11 1HD1 LEU 11 -4.643 7.859 1.196
63 HD12 LEU 11 2HD1 LEU 11 -3.624 8.228 -0.201
64 HD13 LEU 11 3HD1 LEU 11 -3.017 8.494 1.424
65 HD21 LEU 11 3HD2 LEU 11 -1.786 6.763 -0.815
66 HD22 LEU 11 1HD2 LEU 11 -1.378 5.351 0.159
67 HD23 LEU 11 2HD2 LEU 11 -1.016 6.968 0.759
68 H GLN 12 H GLN 12 -4.905 6.636 5.029
69 HA GLN 12 HA GLN 12 -7.188 7.915 3.730
70 HB2 GLN 12 2HB GLN 12 -6.446 7.856 6.642
71 HB3 GLN 12 1HB GLN 12 -7.826 8.630 5.861
72 HG2 GLN 12 2HG GLN 12 -8.680 6.525 5.177
73 HG3 GLN 12 1HG GLN 12 -7.314 5.685 5.928
74 HE21 GLN 12 1HE2 GLN 12 -8.884 8.505 7.315
75 HE22 GLN 12 2HE2 GLN 12 -9.584 7.696 8.655
76 H LEU 13 H LEU 13 -7.003 9.836 3.112
77 HA LEU 13 HA LEU 13 -4.666 11.469 3.900
78 HB2 LEU 13 2HB LEU 13 -4.635 10.903 1.565
79 HB3 LEU 13 1HB LEU 13 -6.307 11.387 1.376
80 HG LEU 13 HG LEU 13 -5.595 13.682 2.014
81 HD11 LEU 13 1HD1 LEU 13 -3.471 13.243 3.021
82 HD12 LEU 13 2HD1 LEU 13 -3.245 14.306 1.633
83 HD13 LEU 13 3HD1 LEU 13 -2.835 12.591 1.508
84 HD21 LEU 13 3HD2 LEU 13 -4.581 12.489 -0.556
85 HD22 LEU 13 1HD2 LEU 13 -4.764 14.225 -0.255
86 HD23 LEU 13 2HD2 LEU 13 -6.179 13.180 -0.219
87 H ASP 14 H ASP 14 -5.095 13.523 4.753
88 HA ASP 14 HA ASP 14 -7.907 14.042 5.142
89 HB2 ASP 14 2HB ASP 14 -6.433 14.285 7.113
90 HB3 ASP 14 1HB ASP 14 -5.499 15.506 6.259
91 H ASP 15 H ASP 15 -8.624 14.698 3.322
92 HA ASP 15 HA ASP 15 -7.427 17.050 2.122
93 HB2 ASP 15 2HB ASP 15 -7.815 15.111 0.594
94 HB3 ASP 15 1HB ASP 15 -9.521 15.138 1.024
95 H GLY 16 H GLY 16 -8.703 17.253 4.533
96 HA2 GLY 16 2HA GLY 16 -10.215 18.644 5.581
97 HA3 GLY 16 1HA GLY 16 -10.981 18.942 4.023
98 H SER 17 H SER 17 -11.754 16.606 3.127
99 HA SER 17 HA SER 17 -13.907 15.884 4.906
100 HB2 SER 17 2HB SER 17 -14.606 14.612 2.827
101 HB3 SER 17 1HB SER 17 -14.472 16.363 2.633
102 HG SER 17 HG SER 17 -13.318 14.551 1.201
103 H GLY 18 H GLY 18 -10.958 14.695 3.699
104 HA2 GLY 18 2HA GLY 18 -9.697 12.862 4.509
105 HA3 GLY 18 1HA GLY 18 -11.146 12.287 5.338
106 H ARG 19 H ARG 19 -9.300 12.181 2.483
107 HA ARG 19 HA ARG 19 -11.330 10.490 1.178
108 HB2 ARG 19 2HB ARG 19 -8.799 11.587 -0.019
109 HB3 ARG 19 1HB ARG 19 -10.042 10.675 -0.850
110 HG2 ARG 19 2HG ARG 19 -11.602 12.608 -0.263
111 HG3 ARG 19 1HG ARG 19 -10.146 13.485 0.199
112 HD2 ARG 19 2HD ARG 19 -10.954 12.474 -2.508
113 HD3 ARG 19 1HD ARG 19 -10.543 14.120 -2.025
114 HE ARG 19 HE ARG 19 -8.540 11.971 -2.064
115 HH11 ARG 19 1HH1 ARG 19 -9.523 15.215 -3.110
116 HH12 ARG 19 2HH1 ARG 19 -8.123 15.481 -4.038
117 HH21 ARG 19 1HH2 ARG 19 -6.641 12.340 -3.361
118 HH22 ARG 19 2HH2 ARG 19 -6.471 13.833 -4.189
119 H THR 20 H THR 20 -10.398 8.571 0.008
120 HA THR 20 HA THR 20 -8.156 7.496 1.505
121 HB THR 20 HB THR 20 -9.302 5.297 1.403
122 HG1 THR 20 1HG THR 20 -11.796 5.799 1.246
123 HG21 THR 20 3HG2 THR 20 -10.818 5.735 3.288
124 HG22 THR 20 1HG2 THR 20 -10.769 7.462 2.895
125 HG23 THR 20 2HG2 THR 20 -9.300 6.642 3.409
126 H TYR 21 H TYR 21 -6.693 6.438 0.318
127 HA TYR 21 HA TYR 21 -7.316 5.832 -2.477
128 HB2 TYR 21 2HB TYR 21 -5.894 7.862 -2.436
129 HB3 TYR 21 1HB TYR 21 -4.737 7.033 -1.408
130 HD1 TYR 21 2HD TYR 21 -6.118 7.204 -4.833
131 HD2 TYR 21 1HD TYR 21 -3.076 5.565 -2.356
132 HE1 TYR 21 2HE TYR 21 -4.895 6.464 -6.834
133 HE2 TYR 21 1HE TYR 21 -1.842 4.821 -4.356
134 HH TYR 21 HH TYR 21 -2.682 5.865 -7.519
135 H GLN 22 H GLN 22 -6.993 3.762 -2.850
136 HA GLN 22 HA GLN 22 -5.500 2.294 -0.834
137 HB2 GLN 22 2HB GLN 22 -7.829 1.553 -1.381
138 HB3 GLN 22 1HB GLN 22 -7.284 1.185 -3.012
139 HG2 GLN 22 2HG GLN 22 -5.841 -0.533 -2.212
140 HG3 GLN 22 1HG GLN 22 -6.121 -0.062 -0.537
141 HE21 GLN 22 1HE2 GLN 22 -8.088 -0.543 0.406
142 HE22 GLN 22 2HE2 GLN 22 -9.144 -1.766 -0.225
143 H LEU 23 H LEU 23 -3.688 1.267 -1.234
144 HA LEU 23 HA LEU 23 -2.228 2.100 -3.543
145 HB2 LEU 23 2HB LEU 23 -1.509 0.120 -1.407
146 HB3 LEU 23 1HB LEU 23 -0.407 0.752 -2.597
147 HG LEU 23 HG LEU 23 -1.743 2.371 -0.415
148 HD11 LEU 23 1HD1 LEU 23 0.554 2.560 0.455
149 HD12 LEU 23 2HD1 LEU 23 1.066 1.391 -0.780
150 HD13 LEU 23 3HD1 LEU 23 -0.063 0.909 0.474
151 HD21 LEU 23 3HD2 LEU 23 -0.238 4.168 -1.124
152 HD22 LEU 23 1HD2 LEU 23 -1.353 3.722 -2.418
153 HD23 LEU 23 2HD2 LEU 23 0.328 3.173 -2.454
154 H ARG 24 H ARG 24 -1.511 0.864 -5.193
155 HA ARG 24 HA ARG 24 -2.950 -1.657 -5.543
156 HB2 ARG 24 2HB ARG 24 -1.709 0.046 -7.712
157 HB3 ARG 24 1HB ARG 24 -2.832 -1.298 -7.889
158 HG2 ARG 24 2HG ARG 24 -3.475 1.390 -6.682
159 HG3 ARG 24 1HG ARG 24 -3.949 0.831 -8.285
160 HD2 ARG 24 2HD ARG 24 -5.347 -0.869 -7.340
161 HD3 ARG 24 1HD ARG 24 -4.750 -0.524 -5.712
162 HE ARG 24 HE ARG 24 -5.821 1.793 -6.826
163 HH11 ARG 24 1HH1 ARG 24 -6.909 -1.307 -5.548
164 HH12 ARG 24 2HH1 ARG 24 -8.444 -0.703 -5.082
165 HH21 ARG 24 1HH2 ARG 24 -7.927 2.581 -6.156
166 HH22 ARG 24 2HH2 ARG 24 -9.009 1.491 -5.424
167 H GLU 25 H GLU 25 -1.735 -3.384 -6.459
168 HA GLU 25 HA GLU 25 0.856 -3.551 -5.395
169 HB2 GLU 25 2HB GLU 25 1.051 -5.748 -6.574
170 HB3 GLU 25 1HB GLU 25 -0.378 -5.589 -5.572
171 HG2 GLU 25 2HG GLU 25 -1.722 -5.179 -7.578
172 HG3 GLU 25 1HG GLU 25 -0.270 -5.355 -8.569
173 H GLY 26 H GLY 26 2.721 -3.129 -6.034
174 HA2 GLY 26 2HA GLY 26 4.319 -2.983 -7.956
175 HA3 GLY 26 1HA GLY 26 3.093 -1.936 -8.695
176 H SER 27 H SER 27 5.083 -0.380 -8.509
177 HA SER 27 HA SER 27 4.867 0.692 -5.849
178 HB2 SER 27 2HB SER 27 6.991 1.912 -6.277
179 HB3 SER 27 1HB SER 27 7.146 0.164 -6.337
180 HG SER 27 HG SER 27 7.847 1.874 -8.171
181 H ASN 28 H ASN 28 4.078 2.593 -5.497
182 HA ASN 28 HA ASN 28 3.064 4.031 -7.812
183 HB2 ASN 28 2HB ASN 28 1.270 4.876 -6.262
184 HB3 ASN 28 1HB ASN 28 1.176 3.146 -6.600
185 HD21 ASN 28 1HD2 ASN 28 1.604 1.682 -4.930
186 HD22 ASN 28 2HD2 ASN 28 1.708 2.209 -3.288
187 H ILE 29 H ILE 29 3.138 6.270 -7.709
188 HA ILE 29 HA ILE 29 5.101 7.255 -5.765
189 HB ILE 29 HB ILE 29 4.936 7.966 -8.707
190 HG12 ILE 29 2HG1 ILE 29 7.021 6.340 -7.219
191 HG13 ILE 29 1HG1 ILE 29 5.822 5.697 -8.330
192 HG21 ILE 29 1HG2 ILE 29 6.880 8.836 -6.568
193 HG22 ILE 29 2HG2 ILE 29 5.697 9.858 -7.397
194 HG23 ILE 29 3HG2 ILE 29 7.050 9.153 -8.293
195 HD11 ILE 29 3HD1 ILE 29 6.851 6.945 -10.154
196 HD12 ILE 29 1HD1 ILE 29 8.002 5.862 -9.372
197 HD13 ILE 29 2HD1 ILE 29 8.048 7.594 -9.034
198 H ILE 30 H ILE 30 4.623 9.136 -4.842
199 HA ILE 30 HA ILE 30 2.195 10.544 -5.665
200 HB ILE 30 HB ILE 30 3.608 10.520 -2.956
201 HG12 ILE 30 2HG1 ILE 30 0.968 9.268 -3.781
202 HG13 ILE 30 1HG1 ILE 30 2.454 8.392 -3.450
203 HG21 ILE 30 1HG2 ILE 30 1.136 11.962 -3.820
204 HG22 ILE 30 2HG2 ILE 30 2.654 12.645 -3.238
205 HG23 ILE 30 3HG2 ILE 30 1.623 11.726 -2.142
206 HD11 ILE 30 3HD1 ILE 30 2.364 9.147 -1.118
207 HD12 ILE 30 1HD1 ILE 30 0.914 8.255 -1.587
208 HD13 ILE 30 2HD1 ILE 30 0.870 10.014 -1.472
209 H GLY 31 H GLY 31 2.388 12.628 -6.272
210 HA2 GLY 31 2HA GLY 31 3.976 14.662 -5.561
211 HA3 GLY 31 1HA GLY 31 5.013 13.776 -6.698
212 H ARG 32 H ARG 32 4.861 15.540 -8.201
213 HA ARG 32 HA ARG 32 2.346 15.344 -9.714
214 HB2 ARG 32 2HB ARG 32 3.874 17.917 -9.275
215 HB3 ARG 32 1HB ARG 32 2.437 17.720 -10.266
216 HG2 ARG 32 2HG ARG 32 1.167 17.148 -8.214
217 HG3 ARG 32 1HG ARG 32 2.627 17.447 -7.291
218 HD2 ARG 32 2HD ARG 32 1.237 19.421 -7.217
219 HD3 ARG 32 1HD ARG 32 2.717 19.748 -8.105
220 HE ARG 32 HE ARG 32 0.291 19.061 -9.576
221 HH11 ARG 32 1HH1 ARG 32 2.789 21.454 -8.801
222 HH12 ARG 32 2HH1 ARG 32 2.197 22.668 -9.824
223 HH21 ARG 32 1HH2 ARG 32 -0.531 20.744 -11.049
224 HH22 ARG 32 2HH2 ARG 32 0.267 22.247 -11.136
225 H GLY 33 H GLY 33 3.036 14.271 -11.480
226 HA2 GLY 33 2HA GLY 33 4.672 15.448 -13.378
227 HA3 GLY 33 1HA GLY 33 5.636 14.281 -12.461
228 H GLN 34 H GLN 34 5.278 13.639 -15.053
229 HA GLN 34 HA GLN 34 2.828 12.170 -15.412
230 HB2 GLN 34 2HB GLN 34 5.317 12.103 -17.135
231 HB3 GLN 34 1HB GLN 34 3.734 11.483 -17.577
232 HG2 GLN 34 2HG GLN 34 4.491 14.359 -17.119
233 HG3 GLN 34 1HG GLN 34 4.093 13.601 -18.657
234 HE21 GLN 34 1HE2 GLN 34 2.953 15.884 -17.278
235 HE22 GLN 34 2HE2 GLN 34 1.268 15.569 -17.096
236 H ASP 35 H ASP 35 5.832 11.546 -14.025
237 HA ASP 35 HA ASP 35 5.529 8.673 -14.249
238 HB2 ASP 35 2HB ASP 35 7.744 8.504 -13.225
239 HB3 ASP 35 1HB ASP 35 7.789 9.575 -14.610
240 H ALA 36 H ALA 36 4.425 11.074 -12.353
241 HA ALA 36 HA ALA 36 4.399 9.547 -9.892
242 HB1 ALA 36 1HB ALA 36 4.691 11.979 -9.752
243 HB2 ALA 36 2HB ALA 36 3.202 11.473 -8.953
244 HB3 ALA 36 3HB ALA 36 3.138 12.212 -10.553
245 H GLN 37 H GLN 37 2.717 8.432 -9.174
246 HA GLN 37 HA GLN 37 0.565 7.759 -10.987
247 HB2 GLN 37 2HB GLN 37 1.374 6.777 -8.252
248 HB3 GLN 37 1HB GLN 37 -0.057 6.203 -9.087
249 HG2 GLN 37 2HG GLN 37 2.707 6.001 -10.254
250 HG3 GLN 37 1HG GLN 37 1.977 4.751 -9.243
251 HE21 GLN 37 1HE2 GLN 37 2.807 4.666 -12.013
252 HE22 GLN 37 2HE2 GLN 37 1.432 4.160 -12.915
253 H PHE 38 H PHE 38 0.826 8.858 -7.627
254 HA PHE 38 HA PHE 38 -1.886 9.917 -7.823
255 HB2 PHE 38 2HB PHE 38 -1.574 8.343 -5.983
256 HB3 PHE 38 1HB PHE 38 -0.164 9.232 -5.430
257 HD1 PHE 38 2HD PHE 38 -3.836 9.650 -5.991
258 HD2 PHE 38 1HD PHE 38 -0.407 10.814 -3.771
259 HE1 PHE 38 2HE PHE 38 -5.254 10.979 -4.483
260 HE2 PHE 38 1HE PHE 38 -1.753 12.108 -2.286
261 HZ PHE 38 HZ PHE 38 -4.234 12.220 -2.617
262 H ARG 39 H ARG 39 -1.927 11.940 -8.355
263 HA ARG 39 HA ARG 39 0.458 13.508 -7.909
264 HB2 ARG 39 2HB ARG 39 -1.892 14.018 -9.725
265 HB3 ARG 39 1HB ARG 39 -0.389 14.945 -9.680
266 HG2 ARG 39 2HG ARG 39 0.870 13.012 -10.389
267 HG3 ARG 39 1HG ARG 39 -0.572 12.009 -10.318
268 HD2 ARG 39 2HD ARG 39 -1.575 13.461 -12.071
269 HD3 ARG 39 1HD ARG 39 -0.018 14.288 -12.189
270 HE ARG 39 HE ARG 39 0.191 11.455 -12.438
271 HH11 ARG 39 1HH1 ARG 39 -0.347 14.430 -14.262
272 HH12 ARG 39 2HH1 ARG 39 0.004 13.733 -15.777
273 HH21 ARG 39 1HH2 ARG 39 0.666 10.518 -14.457
274 HH22 ARG 39 2HH2 ARG 39 0.633 11.439 -15.905
275 H LEU 40 H LEU 40 0.547 15.008 -6.484
276 HA LEU 40 HA LEU 40 -1.699 15.512 -4.778
277 HB2 LEU 40 2HB LEU 40 1.127 16.518 -4.713
278 HB3 LEU 40 1HB LEU 40 -0.090 17.123 -3.609
279 HG LEU 40 HG LEU 40 0.860 14.260 -3.799
280 HD11 LEU 40 1HD1 LEU 40 1.301 16.394 -1.725
281 HD12 LEU 40 2HD1 LEU 40 2.519 15.754 -2.831
282 HD13 LEU 40 3HD1 LEU 40 1.815 14.713 -1.590
283 HD21 LEU 40 3HD2 LEU 40 -1.097 15.574 -1.908
284 HD22 LEU 40 1HD2 LEU 40 -0.460 13.938 -1.748
285 HD23 LEU 40 2HD2 LEU 40 -1.480 14.350 -3.120
286 HA PRO 41 HA PRO 41 -3.049 19.209 -6.791
287 HB2 PRO 41 2HB PRO 41 -5.038 19.819 -5.161
288 HB3 PRO 41 1HB PRO 41 -5.080 18.317 -6.091
289 HG2 PRO 41 2HG PRO 41 -4.395 18.737 -3.206
290 HG3 PRO 41 1HG PRO 41 -5.365 17.454 -3.946
291 HD2 PRO 41 2HD PRO 41 -2.689 17.244 -3.241
292 HD3 PRO 41 1HD PRO 41 -3.512 16.189 -4.394
293 H ASP 42 H ASP 42 -0.719 19.586 -5.108
294 HA ASP 42 HA ASP 42 -1.266 22.279 -4.044
295 HB2 ASP 42 2HB ASP 42 -1.069 20.460 -2.173
296 HB3 ASP 42 1HB ASP 42 0.618 20.392 -2.686
297 H THR 43 H THR 43 0.991 23.300 -3.617
298 HA THR 43 HA THR 43 2.768 22.473 -5.772
299 HB THR 43 HB THR 43 1.447 24.440 -6.402
300 HG1 THR 43 1HG THR 43 3.192 24.879 -7.474
301 HG21 THR 43 3HG2 THR 43 1.857 26.626 -5.328
302 HG22 THR 43 1HG2 THR 43 2.840 25.816 -4.107
303 HG23 THR 43 2HG2 THR 43 1.117 25.464 -4.225
304 H GLY 44 H GLY 44 5.016 23.158 -5.428
305 HA2 GLY 44 2HA GLY 44 6.785 23.741 -3.899
306 HA3 GLY 44 1HA GLY 44 5.713 23.309 -2.566
307 H VAL 45 H VAL 45 4.739 21.074 -4.142
308 HA VAL 45 HA VAL 45 6.624 19.101 -3.279
309 HB VAL 45 HB VAL 45 4.235 18.718 -2.882
310 HG11 VAL 45 1HG1 VAL 45 3.270 19.913 -4.735
311 HG12 VAL 45 2HG1 VAL 45 2.669 18.255 -4.708
312 HG13 VAL 45 3HG1 VAL 45 3.911 18.726 -5.870
313 HG21 VAL 45 3HG2 VAL 45 5.546 16.752 -3.097
314 HG22 VAL 45 1HG2 VAL 45 5.429 16.797 -4.861
315 HG23 VAL 45 2HG2 VAL 45 3.995 16.469 -3.899
316 H SER 46 H SER 46 7.788 17.757 -4.561
317 HA SER 46 HA SER 46 8.613 18.672 -7.115
318 HB2 SER 46 2HB SER 46 9.212 16.087 -5.704
319 HB3 SER 46 1HB SER 46 10.218 16.940 -6.876
320 HG SER 46 HG SER 46 10.243 18.682 -5.337
321 H ARG 47 H ARG 47 8.966 16.744 -8.766
322 HA ARG 47 HA ARG 47 6.467 15.763 -9.657
323 HB2 ARG 47 2HB ARG 47 7.851 14.330 -11.225
324 HB3 ARG 47 1HB ARG 47 8.123 16.064 -11.334
325 HG2 ARG 47 2HG ARG 47 10.122 15.797 -9.927
326 HG3 ARG 47 1HG ARG 47 9.811 14.062 -9.881
327 HD2 ARG 47 2HD ARG 47 10.235 15.582 -12.431
328 HD3 ARG 47 1HD ARG 47 11.543 14.852 -11.507
329 HE ARG 47 HE ARG 47 9.460 12.989 -12.105
330 HH11 ARG 47 1HH1 ARG 47 12.297 14.619 -13.447
331 HH12 ARG 47 2HH1 ARG 47 12.720 13.324 -14.480
332 HH21 ARG 47 1HH2 ARG 47 10.074 11.224 -13.438
333 HH22 ARG 47 2HH2 ARG 47 11.401 11.349 -14.505
334 H ARG 48 H ARG 48 9.083 14.309 -7.863
335 HA ARG 48 HA ARG 48 7.209 12.235 -7.047
336 HB2 ARG 48 2HB ARG 48 10.203 11.920 -7.416
337 HB3 ARG 48 1HB ARG 48 9.106 10.694 -6.794
338 HG2 ARG 48 2HG ARG 48 7.925 10.754 -8.986
339 HG3 ARG 48 1HG ARG 48 9.176 11.802 -9.601
340 HD2 ARG 48 2HD ARG 48 9.563 9.017 -8.511
341 HD3 ARG 48 1HD ARG 48 9.613 9.479 -10.208
342 HE ARG 48 HE ARG 48 11.595 10.134 -8.150
343 HH11 ARG 48 1HH1 ARG 48 10.692 10.077 -11.574
344 HH12 ARG 48 2HH1 ARG 48 12.300 10.041 -12.137
345 HH21 ARG 48 1HH2 ARG 48 13.835 10.093 -8.963
346 HH22 ARG 48 2HH2 ARG 48 14.105 10.083 -10.637
347 H HIS 49 H HIS 49 6.808 12.415 -5.046
348 HA HIS 49 HA HIS 49 8.553 13.925 -3.252
349 HB2 HIS 49 2HB HIS 49 6.451 15.010 -3.332
350 HB3 HIS 49 1HB HIS 49 5.534 13.523 -3.257
351 HD2 HIS 49 2HD HIS 49 5.268 12.410 -0.666
352 HE1 HIS 49 1HE HIS 49 6.845 15.749 1.358
353 HE2 HIS 49 2HE HIS 49 6.133 13.374 1.567
354 H LEU 50 H LEU 50 6.795 10.962 -3.751
355 HA LEU 50 HA LEU 50 8.392 9.578 -1.874
356 HB2 LEU 50 2HB LEU 50 6.919 10.779 -0.341
357 HB3 LEU 50 1HB LEU 50 5.516 10.241 -1.226
358 HG LEU 50 HG LEU 50 7.248 8.176 0.064
359 HD11 LEU 50 1HD1 LEU 50 5.189 9.906 1.464
360 HD12 LEU 50 2HD1 LEU 50 6.928 9.990 1.734
361 HD13 LEU 50 3HD1 LEU 50 6.044 8.530 2.163
362 HD21 LEU 50 3HD2 LEU 50 5.070 7.101 0.366
363 HD22 LEU 50 1HD2 LEU 50 5.317 7.550 -1.320
364 HD23 LEU 50 2HD2 LEU 50 4.270 8.524 -0.290
365 H GLU 51 H GLU 51 8.036 7.390 -2.085
366 HA GLU 51 HA GLU 51 5.963 6.551 -3.972
367 HB2 GLU 51 2HB GLU 51 7.583 4.987 -5.028
368 HB3 GLU 51 1HB GLU 51 7.868 6.673 -5.404
369 HG2 GLU 51 2HG GLU 51 9.627 6.684 -3.643
370 HG3 GLU 51 1HG GLU 51 9.349 4.961 -3.424
371 H ILE 52 H ILE 52 5.116 4.621 -3.627
372 HA ILE 52 HA ILE 52 6.098 3.176 -1.282
373 HB ILE 52 HB ILE 52 3.207 3.439 -2.144
374 HG12 ILE 52 2HG1 ILE 52 4.605 4.554 0.307
375 HG13 ILE 52 1HG1 ILE 52 4.143 5.503 -1.101
376 HG21 ILE 52 1HG2 ILE 52 4.510 2.050 0.197
377 HG22 ILE 52 2HG2 ILE 52 3.739 1.281 -1.190
378 HG23 ILE 52 3HG2 ILE 52 2.767 2.215 -0.038
379 HD11 ILE 52 3HD1 ILE 52 2.564 5.798 0.717
380 HD12 ILE 52 1HD1 ILE 52 2.266 4.060 0.763
381 HD13 ILE 52 2HD1 ILE 52 1.794 5.000 -0.653
382 H ARG 53 H ARG 53 6.830 1.307 -1.836
383 HA ARG 53 HA ARG 53 5.880 0.025 -4.276
384 HB2 ARG 53 2HB ARG 53 8.329 0.041 -3.815
385 HB3 ARG 53 1HB ARG 53 8.035 -0.882 -2.354
386 HG2 ARG 53 2HG ARG 53 7.069 -2.687 -3.731
387 HG3 ARG 53 1HG ARG 53 7.534 -1.780 -5.168
388 HD2 ARG 53 2HD ARG 53 9.865 -1.836 -4.428
389 HD3 ARG 53 1HD ARG 53 9.385 -2.788 -3.017
390 HE ARG 53 HE ARG 53 8.671 -3.820 -5.621
391 HH11 ARG 53 1HH1 ARG 53 10.980 -4.002 -2.915
392 HH12 ARG 53 2HH1 ARG 53 11.568 -5.526 -3.378
393 HH21 ARG 53 1HH2 ARG 53 9.518 -5.897 -6.215
394 HH22 ARG 53 2HH2 ARG 53 10.747 -6.618 -5.279
395 H TRP 54 H TRP 54 4.091 -1.086 -4.046
396 HA TRP 54 HA TRP 54 3.704 -2.410 -1.509
397 HB2 TRP 54 2HB TRP 54 1.895 -0.893 -1.915
398 HB3 TRP 54 1HB TRP 54 1.724 -1.447 -3.576
399 HD1 TRP 54 HD TRP 54 -0.369 -2.921 -3.851
400 HE1 TRP 54 1HE TRP 54 -1.672 -4.619 -2.395
401 HE3 TRP 54 3HE TRP 54 2.408 -2.696 0.402
402 HZ2 TRP 54 2HZ TRP 54 -1.550 -5.687 0.178
403 HZ3 TRP 54 3HZ TRP 54 1.757 -4.073 2.312
404 HH2 TRP 54 HH TRP 54 -0.187 -5.543 2.208
405 H ASP 55 H ASP 55 3.762 -4.501 -1.442
406 HA ASP 55 HA ASP 55 3.222 -6.102 -3.804
407 HB2 ASP 55 2HB ASP 55 5.778 -5.738 -3.443
408 HB3 ASP 55 1HB ASP 55 5.569 -6.674 -1.968
409 H GLY 56 H GLY 56 3.107 -8.512 -2.834
410 HA2 GLY 56 2HA GLY 56 1.124 -8.292 -0.780
411 HA3 GLY 56 1HA GLY 56 1.630 -9.772 -1.585
412 H GLN 57 H GLN 57 2.834 -7.383 0.692
413 HA GLN 57 HA GLN 57 3.448 -9.333 2.686
414 HB2 GLN 57 2HB GLN 57 5.450 -9.521 1.183
415 HB3 GLN 57 1HB GLN 57 5.775 -7.815 1.445
416 HG2 GLN 57 2HG GLN 57 6.050 -8.290 3.862
417 HG3 GLN 57 1HG GLN 57 5.842 -10.005 3.506
418 HE21 GLN 57 1HE2 GLN 57 7.923 -7.269 3.249
419 HE22 GLN 57 2HE2 GLN 57 9.331 -8.106 2.751
420 H VAL 58 H VAL 58 4.927 -6.176 1.889
421 HA VAL 58 HA VAL 58 3.377 -4.832 3.930
422 HB VAL 58 HB VAL 58 5.391 -3.742 4.913
423 HG11 VAL 58 1HG1 VAL 58 5.430 -6.737 5.195
424 HG12 VAL 58 2HG1 VAL 58 4.452 -5.602 6.124
425 HG13 VAL 58 3HG1 VAL 58 6.210 -5.594 6.287
426 HG21 VAL 58 3HG2 VAL 58 6.957 -4.014 3.076
427 HG22 VAL 58 1HG2 VAL 58 6.961 -5.761 3.311
428 HG23 VAL 58 2HG2 VAL 58 7.634 -4.703 4.552
429 H ALA 59 H ALA 59 3.636 -2.473 3.737
430 HA ALA 59 HA ALA 59 4.096 -1.763 0.946
431 HB1 ALA 59 1HB ALA 59 2.749 -0.196 3.158
432 HB2 ALA 59 2HB ALA 59 1.925 -1.127 1.915
433 HB3 ALA 59 3HB ALA 59 2.865 0.297 1.471
434 H LEU 60 H LEU 60 5.928 -1.013 0.421
435 HA LEU 60 HA LEU 60 7.804 -0.157 2.429
436 HB2 LEU 60 2HB LEU 60 8.434 -1.706 0.669
437 HB3 LEU 60 1HB LEU 60 8.012 -0.491 -0.522
438 HG LEU 60 HG LEU 60 9.822 0.945 0.349
439 HD11 LEU 60 1HD1 LEU 60 11.511 -0.051 1.809
440 HD12 LEU 60 2HD1 LEU 60 10.497 -1.488 1.985
441 HD13 LEU 60 3HD1 LEU 60 9.939 0.064 2.603
442 HD21 LEU 60 3HD2 LEU 60 10.099 -0.472 -1.587
443 HD22 LEU 60 1HD2 LEU 60 10.585 -1.810 -0.557
444 HD23 LEU 60 2HD2 LEU 60 11.614 -0.373 -0.677
445 H LEU 61 H LEU 61 7.761 1.837 3.044
446 HA LEU 61 HA LEU 61 6.785 4.008 1.392
447 HB2 LEU 61 2HB LEU 61 6.047 3.625 3.691
448 HB3 LEU 61 1HB LEU 61 7.655 3.779 4.308
449 HG LEU 61 HG LEU 61 6.308 5.705 4.868
450 HD11 LEU 61 1HD1 LEU 61 8.265 6.529 2.756
451 HD12 LEU 61 2HD1 LEU 61 8.600 6.263 4.468
452 HD13 LEU 61 3HD1 LEU 61 7.544 7.586 3.970
453 HD21 LEU 61 3HD2 LEU 61 4.665 5.459 3.094
454 HD22 LEU 61 1HD2 LEU 61 5.831 6.086 1.935
455 HD23 LEU 61 2HD2 LEU 61 5.227 7.117 3.249
456 H ALA 62 H ALA 62 8.223 5.300 0.301
457 HA ALA 62 HA ALA 62 10.908 5.648 1.389
458 HB1 ALA 62 1HB ALA 62 11.862 5.558 -0.871
459 HB2 ALA 62 2HB ALA 62 10.271 5.191 -1.533
460 HB3 ALA 62 3HB ALA 62 11.071 4.030 -0.473
461 H ASP 63 H ASP 63 11.340 7.699 1.630
462 HA ASP 63 HA ASP 63 9.477 9.714 0.596
463 HB2 ASP 63 2HB ASP 63 9.910 9.809 2.984
464 HB3 ASP 63 1HB ASP 63 11.642 9.833 2.713
465 H LEU 64 H LEU 64 9.996 11.085 -0.991
466 HA LEU 64 HA LEU 64 12.826 11.448 -1.659
467 HB2 LEU 64 2HB LEU 64 11.802 9.768 -3.175
468 HB3 LEU 64 1HB LEU 64 10.540 10.919 -3.559
469 HG LEU 64 HG LEU 64 12.014 12.309 -4.760
470 HD11 LEU 64 1HD1 LEU 64 14.420 11.735 -5.053
471 HD12 LEU 64 2HD1 LEU 64 14.227 10.404 -3.909
472 HD13 LEU 64 3HD1 LEU 64 14.038 12.071 -3.365
473 HD21 LEU 64 3HD2 LEU 64 12.501 9.423 -5.447
474 HD22 LEU 64 1HD2 LEU 64 12.708 10.788 -6.547
475 HD23 LEU 64 2HD2 LEU 64 11.107 10.393 -5.919
476 H ASN 65 H ASN 65 12.262 13.452 -0.331
477 HA ASN 65 HA ASN 65 12.181 15.752 -1.818
478 HB2 ASN 65 2HB ASN 65 9.823 15.263 -2.394
479 HB3 ASN 65 1HB ASN 65 9.413 15.193 -0.684
480 HD21 ASN 65 1HD2 ASN 65 7.916 16.792 -1.012
481 HD22 ASN 65 2HD2 ASN 65 8.323 18.467 -1.174
482 H SER 66 H SER 66 13.453 16.782 -0.501
483 HA SER 66 HA SER 66 13.309 16.337 2.323
484 HB2 SER 66 2HB SER 66 15.449 16.561 1.055
485 HB3 SER 66 1HB SER 66 15.060 18.251 0.763
486 HG SER 66 HG SER 66 16.199 17.099 2.844
487 H THR 67 H THR 67 12.067 18.668 0.103
488 HA THR 67 HA THR 67 11.842 20.920 1.739
489 HB THR 67 HB THR 67 10.068 20.066 -0.555
490 HG1 THR 67 1HG THR 67 11.595 21.334 -1.766
491 HG21 THR 67 3HG2 THR 67 9.197 21.984 0.715
492 HG22 THR 67 1HG2 THR 67 9.760 22.493 -0.879
493 HG23 THR 67 2HG2 THR 67 10.754 22.793 0.549
494 H ASN 68 H ASN 68 9.606 18.239 1.139
495 HA ASN 68 HA ASN 68 7.773 19.266 3.228
496 HB2 ASN 68 2HB ASN 68 7.114 17.676 0.723
497 HB3 ASN 68 1HB ASN 68 5.947 18.135 1.956
498 HD21 ASN 68 1HD2 ASN 68 5.050 20.174 1.849
499 HD22 ASN 68 2HD2 ASN 68 5.429 21.302 0.607
500 H GLY 69 H GLY 69 10.085 17.546 3.535
501 HA2 GLY 69 2HA GLY 69 9.951 14.866 3.182
502 HA3 GLY 69 1HA GLY 69 10.774 15.606 4.536
503 H THR 70 H THR 70 9.045 13.190 3.893
504 HA THR 70 HA THR 70 6.681 13.448 5.455
505 HB THR 70 HB THR 70 7.891 10.972 4.235
506 HG1 THR 70 1HG THR 70 7.847 12.343 2.615
507 HG21 THR 70 3HG2 THR 70 5.533 10.312 4.005
508 HG22 THR 70 1HG2 THR 70 5.032 11.829 4.751
509 HG23 THR 70 2HG2 THR 70 5.932 10.643 5.693
510 H THR 71 H THR 71 6.199 12.412 7.353
511 HA THR 71 HA THR 71 8.386 11.178 8.851
512 HB THR 71 HB THR 71 7.074 12.007 10.866
513 HG1 THR 71 1HG THR 71 6.019 13.777 8.910
514 HG21 THR 71 3HG2 THR 71 8.079 14.225 10.793
515 HG22 THR 71 1HG2 THR 71 8.398 14.001 9.060
516 HG23 THR 71 2HG2 THR 71 9.167 12.935 10.252
517 H VAL 72 H VAL 72 7.912 9.332 9.931
518 HA VAL 72 HA VAL 72 5.175 8.304 9.751
519 HB VAL 72 HB VAL 72 6.195 5.984 9.758
520 HG11 VAL 72 1HG1 VAL 72 7.047 6.016 7.474
521 HG12 VAL 72 2HG1 VAL 72 7.294 7.761 7.581
522 HG13 VAL 72 3HG1 VAL 72 5.664 7.107 7.618
523 HG21 VAL 72 3HG2 VAL 72 8.786 7.521 9.514
524 HG22 VAL 72 1HG2 VAL 72 8.616 5.767 9.369
525 HG23 VAL 72 2HG2 VAL 72 8.278 6.570 10.905
526 H ASN 73 H ASN 73 4.275 8.126 11.619
527 HA ASN 73 HA ASN 73 3.850 8.268 13.827
528 HB2 ASN 73 2HB ASN 73 6.590 6.998 14.244
529 HB3 ASN 73 1HB ASN 73 5.312 7.087 15.451
530 HD21 ASN 73 1HD2 ASN 73 6.501 5.510 12.668
531 HD22 ASN 73 2HD2 ASN 73 5.292 4.297 12.530
532 H ASN 74 H ASN 74 5.263 10.284 12.354
533 HA ASN 74 HA ASN 74 5.944 12.318 12.539
534 HB2 ASN 74 2HB ASN 74 5.817 11.906 15.516
535 HB3 ASN 74 1HB ASN 74 6.439 13.403 14.830
536 HD21 ASN 74 1HD2 ASN 74 4.065 12.964 16.434
537 HD22 ASN 74 2HD2 ASN 74 2.746 13.535 15.472
538 H ALA 75 H ALA 75 7.757 9.789 12.841
539 HA ALA 75 HA ALA 75 10.253 11.164 13.408
540 HB1 ALA 75 1HB ALA 75 9.673 8.276 12.725
541 HB2 ALA 75 2HB ALA 75 9.946 8.910 14.344
542 HB3 ALA 75 3HB ALA 75 11.253 8.924 13.159
543 HA PRO 76 HA PRO 76 10.459 11.744 8.946
544 HB2 PRO 76 2HB PRO 76 12.846 13.085 8.937
545 HB3 PRO 76 1HB PRO 76 11.298 13.870 9.257
546 HG2 PRO 76 2HG PRO 76 13.422 13.019 11.155
547 HG3 PRO 76 1HG PRO 76 12.347 14.423 11.222
548 HD2 PRO 76 2HD PRO 76 11.995 12.143 12.712
549 HD3 PRO 76 1HD PRO 76 10.682 13.247 12.264
550 H VAL 77 H VAL 77 11.134 10.250 7.610
551 HA VAL 77 HA VAL 77 13.688 8.913 8.051
552 HB VAL 77 HB VAL 77 12.663 6.721 7.517
553 HG11 VAL 77 1HG1 VAL 77 11.571 6.286 9.673
554 HG12 VAL 77 2HG1 VAL 77 11.450 8.023 9.949
555 HG13 VAL 77 3HG1 VAL 77 13.034 7.254 9.859
556 HG21 VAL 77 3HG2 VAL 77 10.058 8.226 7.726
557 HG22 VAL 77 1HG2 VAL 77 10.195 6.466 7.675
558 HG23 VAL 77 2HG2 VAL 77 10.718 7.432 6.297
559 H GLN 78 H GLN 78 14.263 7.645 6.057
560 HA GLN 78 HA GLN 78 13.163 8.959 3.717
561 HB2 GLN 78 2HB GLN 78 15.786 7.555 4.168
562 HB3 GLN 78 1HB GLN 78 15.265 8.216 2.615
563 HG2 GLN 78 2HG GLN 78 15.491 9.832 5.131
564 HG3 GLN 78 1HG GLN 78 16.768 9.709 3.926
565 HE21 GLN 78 1HE2 GLN 78 13.489 10.838 4.541
566 HE22 GLN 78 2HE2 GLN 78 13.357 11.905 3.218
567 H GLU 79 H GLU 79 13.344 5.957 5.350
568 HA GLU 79 HA GLU 79 11.554 4.840 3.440
569 HB2 GLU 79 2HB GLU 79 12.827 2.738 3.160
570 HB3 GLU 79 1HB GLU 79 13.656 4.113 2.460
571 HG2 GLU 79 2HG GLU 79 15.064 4.194 4.530
572 HG3 GLU 79 1HG GLU 79 14.316 2.666 5.007
573 H TRP 80 H TRP 80 10.309 3.184 4.312
574 HA TRP 80 HA TRP 80 10.680 2.288 7.016
575 HB2 TRP 80 2HB TRP 80 9.883 4.541 7.411
576 HB3 TRP 80 1HB TRP 80 8.479 4.348 6.393
577 HD1 TRP 80 HD TRP 80 6.433 3.007 7.439
578 HE1 TRP 80 1HE TRP 80 5.793 2.576 9.893
579 HE3 TRP 80 3HE TRP 80 10.949 3.954 9.608
580 HZ2 TRP 80 2HZ TRP 80 7.058 2.623 12.407
581 HZ3 TRP 80 3HZ TRP 80 11.146 3.745 12.050
582 HH2 TRP 80 HH TRP 80 9.224 3.097 13.410
583 H GLN 81 H GLN 81 9.161 0.657 7.499
584 HA GLN 81 HA GLN 81 7.648 -0.207 5.159
585 HB2 GLN 81 2HB GLN 81 7.658 -2.508 6.185
586 HB3 GLN 81 1HB GLN 81 9.253 -1.911 5.762
587 HG2 GLN 81 2HG GLN 81 9.548 -1.266 8.149
588 HG3 GLN 81 1HG GLN 81 8.038 -2.091 8.511
589 HE21 GLN 81 1HE2 GLN 81 10.686 -2.596 9.455
590 HE22 GLN 81 2HE2 GLN 81 11.101 -4.212 9.032
591 H LEU 82 H LEU 82 5.745 0.545 5.230
592 HA LEU 82 HA LEU 82 4.350 1.542 7.453
593 HB2 LEU 82 2HB LEU 82 3.124 0.526 4.912
594 HB3 LEU 82 1HB LEU 82 2.471 1.673 6.070
595 HG LEU 82 HG LEU 82 4.915 2.210 4.417
596 HD11 LEU 82 1HD1 LEU 82 2.973 1.993 2.956
597 HD12 LEU 82 2HD1 LEU 82 3.452 3.685 3.083
598 HD13 LEU 82 3HD1 LEU 82 2.056 3.090 3.983
599 HD21 LEU 82 3HD2 LEU 82 4.745 3.458 6.524
600 HD22 LEU 82 1HD2 LEU 82 3.138 3.990 6.046
601 HD23 LEU 82 2HD2 LEU 82 4.544 4.512 5.123
602 H ALA 83 H ALA 83 2.731 0.739 8.683
603 HA ALA 83 HA ALA 83 1.878 -2.012 8.314
604 HB1 ALA 83 1HB ALA 83 3.633 -2.058 10.010
605 HB2 ALA 83 2HB ALA 83 2.051 -2.346 10.745
606 HB3 ALA 83 3HB ALA 83 2.819 -0.768 10.895
607 H ASP 84 H ASP 84 -0.061 -2.348 9.805
608 HA ASP 84 HA ASP 84 -1.983 -0.360 9.188
609 HB2 ASP 84 2HB ASP 84 -2.540 -2.758 9.348
610 HB3 ASP 84 1HB ASP 84 -2.190 -2.722 11.070
611 H GLY 85 H GLY 85 -2.277 1.466 10.211
612 HA2 GLY 85 2HA GLY 85 -2.974 2.666 12.109
613 HA3 GLY 85 1HA GLY 85 -2.159 1.492 13.128
614 H ASP 86 H ASP 86 -0.187 2.456 10.496
615 HA ASP 86 HA ASP 86 1.476 3.953 12.350
616 HB2 ASP 86 2HB ASP 86 2.347 2.333 10.380
617 HB3 ASP 86 1HB ASP 86 2.121 3.783 9.402
618 H VAL 87 H VAL 87 2.046 6.158 12.041
619 HA VAL 87 HA VAL 87 -0.106 7.647 10.684
620 HB VAL 87 HB VAL 87 1.752 8.693 12.852
621 HG11 VAL 87 1HG1 VAL 87 0.863 10.431 11.429
622 HG12 VAL 87 2HG1 VAL 87 0.142 10.526 13.037
623 HG13 VAL 87 3HG1 VAL 87 -0.777 9.843 11.696
624 HG21 VAL 87 3HG2 VAL 87 0.337 6.913 13.766
625 HG22 VAL 87 1HG2 VAL 87 -1.098 7.715 13.129
626 HG23 VAL 87 2HG2 VAL 87 -0.146 8.486 14.399
627 H ILE 88 H ILE 88 0.534 8.416 8.783
628 HA ILE 88 HA ILE 88 3.343 9.099 8.457
629 HB ILE 88 HB ILE 88 1.210 8.305 6.428
630 HG12 ILE 88 2HG1 ILE 88 2.859 6.559 5.745
631 HG13 ILE 88 1HG1 ILE 88 3.912 7.082 7.037
632 HG21 ILE 88 1HG2 ILE 88 2.464 10.169 5.497
633 HG22 ILE 88 2HG2 ILE 88 2.839 8.673 4.642
634 HG23 ILE 88 3HG2 ILE 88 3.980 9.325 5.822
635 HD11 ILE 88 3HD1 ILE 88 2.207 6.369 8.663
636 HD12 ILE 88 1HD1 ILE 88 2.769 5.044 7.648
637 HD13 ILE 88 2HD1 ILE 88 1.206 5.797 7.334
638 H ARG 89 H ARG 89 3.791 11.239 8.200
639 HA ARG 89 HA ARG 89 1.553 12.983 7.474
640 HB2 ARG 89 2HB ARG 89 2.099 12.778 10.034
641 HB3 ARG 89 1HB ARG 89 3.504 13.750 9.645
642 HG2 ARG 89 2HG ARG 89 0.667 14.609 9.086
643 HG3 ARG 89 1HG ARG 89 1.528 14.999 10.567
644 HD2 ARG 89 2HD ARG 89 2.394 15.764 7.787
645 HD3 ARG 89 1HD ARG 89 1.535 16.830 8.896
646 HE ARG 89 HE ARG 89 3.988 15.696 9.905
647 HH11 ARG 89 1HH1 ARG 89 2.528 18.430 8.226
648 HH12 ARG 89 2HH1 ARG 89 3.744 19.535 8.659
649 HH21 ARG 89 1HH2 ARG 89 5.703 17.181 10.458
650 HH22 ARG 89 2HH2 ARG 89 5.608 18.791 9.923
651 H LEU 90 H LEU 90 2.140 14.563 6.083
652 HA LEU 90 HA LEU 90 4.997 14.897 5.513
653 HB2 LEU 90 2HB LEU 90 4.558 15.020 3.116
654 HB3 LEU 90 1HB LEU 90 4.043 13.468 3.720
655 HG LEU 90 HG LEU 90 2.096 15.729 3.183
656 HD11 LEU 90 1HD1 LEU 90 3.285 15.197 1.124
657 HD12 LEU 90 2HD1 LEU 90 1.618 14.623 1.059
658 HD13 LEU 90 3HD1 LEU 90 2.935 13.484 1.354
659 HD21 LEU 90 3HD2 LEU 90 1.717 12.735 3.412
660 HD22 LEU 90 1HD2 LEU 90 0.455 13.913 3.057
661 HD23 LEU 90 2HD2 LEU 90 1.253 13.927 4.626
662 H GLY 91 H GLY 91 5.384 17.025 4.393
663 HA2 GLY 91 2HA GLY 91 3.871 19.024 5.770
664 HA3 GLY 91 1HA GLY 91 5.128 19.328 4.572
665 H HIS 92 H HIS 92 1.789 18.699 5.120
666 HA HIS 92 HA HIS 92 0.605 20.291 3.267
667 HB2 HIS 92 2HB HIS 92 1.533 18.978 1.400
668 HB3 HIS 92 1HB HIS 92 0.968 17.482 2.130
669 HD1 HIS 92 1HD HIS 92 -0.383 20.548 0.276
670 HD2 HIS 92 2HD HIS 92 -1.625 16.781 1.553
671 HE1 HIS 92 1HE HIS 92 -2.675 20.186 -0.687
672 H SER 93 H SER 93 0.469 17.031 4.627
673 HA SER 93 HA SER 93 -1.980 17.527 5.974
674 HB2 SER 93 2HB SER 93 -2.833 17.239 3.660
675 HB3 SER 93 1HB SER 93 -2.028 15.677 3.568
676 HG SER 93 HG SER 93 -4.400 16.379 4.717
677 H GLU 94 H GLU 94 -2.839 15.117 6.481
678 HA GLU 94 HA GLU 94 -0.565 13.518 7.397
679 HB2 GLU 94 2HB GLU 94 -1.860 13.056 9.458
680 HB3 GLU 94 1HB GLU 94 -1.415 14.747 9.290
681 HG2 GLU 94 2HG GLU 94 -3.697 15.205 8.416
682 HG3 GLU 94 1HG GLU 94 -4.117 13.534 8.773
683 H ILE 95 H ILE 95 -0.911 11.313 7.376
684 HA ILE 95 HA ILE 95 -3.357 10.413 6.225
685 HB ILE 95 HB ILE 95 -2.266 10.726 4.231
686 HG12 ILE 95 2HG1 ILE 95 -2.987 8.296 4.439
687 HG13 ILE 95 1HG1 ILE 95 -1.840 8.659 3.160
688 HG21 ILE 95 1HG2 ILE 95 -0.180 11.478 4.905
689 HG22 ILE 95 2HG2 ILE 95 0.068 10.226 3.687
690 HG23 ILE 95 3HG2 ILE 95 0.323 9.863 5.395
691 HD11 ILE 95 3HD1 ILE 95 -1.390 6.531 4.352
692 HD12 ILE 95 1HD1 ILE 95 -1.144 7.450 5.824
693 HD13 ILE 95 2HD1 ILE 95 -0.036 7.663 4.459
694 H ILE 96 H ILE 96 -3.986 8.464 6.728
695 HA ILE 96 HA ILE 96 -2.480 7.060 8.854
696 HB ILE 96 HB ILE 96 -5.427 6.834 8.167
697 HG12 ILE 96 2HG1 ILE 96 -4.202 8.418 10.440
698 HG13 ILE 96 1HG1 ILE 96 -4.775 9.138 8.939
699 HG21 ILE 96 1HG2 ILE 96 -5.618 5.790 10.374
700 HG22 ILE 96 2HG2 ILE 96 -3.880 5.963 10.611
701 HG23 ILE 96 3HG2 ILE 96 -4.494 4.902 9.341
702 HD11 ILE 96 3HD1 ILE 96 -7.030 8.350 9.426
703 HD12 ILE 96 1HD1 ILE 96 -6.408 9.364 10.726
704 HD13 ILE 96 2HD1 ILE 96 -6.452 7.610 10.918
705 H VAL 97 H VAL 97 -1.781 5.004 8.371
706 HA VAL 97 HA VAL 97 -2.681 3.808 5.865
707 HB VAL 97 HB VAL 97 -0.260 3.282 7.619
708 HG11 VAL 97 1HG1 VAL 97 0.367 1.486 6.063
709 HG12 VAL 97 2HG1 VAL 97 -1.158 1.697 5.203
710 HG13 VAL 97 3HG1 VAL 97 -1.159 1.105 6.866
711 HG21 VAL 97 3HG2 VAL 97 0.956 3.857 5.634
712 HG22 VAL 97 1HG2 VAL 97 -0.210 5.131 6.001
713 HG23 VAL 97 2HG2 VAL 97 -0.550 3.966 4.714
714 H ARG 98 H ARG 98 -4.199 2.297 5.895
715 HA ARG 98 HA ARG 98 -4.359 0.552 8.223
716 HB2 ARG 98 2HB ARG 98 -6.568 1.917 6.730
717 HB3 ARG 98 1HB ARG 98 -6.863 0.470 7.694
718 HG2 ARG 98 2HG ARG 98 -5.752 3.086 8.698
719 HG3 ARG 98 1HG ARG 98 -7.411 2.525 8.910
720 HD2 ARG 98 2HD ARG 98 -6.551 0.568 10.174
721 HD3 ARG 98 1HD ARG 98 -4.916 1.206 10.013
722 HE ARG 98 HE ARG 98 -6.515 3.176 11.104
723 HH11 ARG 98 1HH1 ARG 98 -5.128 0.007 12.078
724 HH12 ARG 98 2HH1 ARG 98 -5.228 0.358 13.720
725 HH21 ARG 98 1HH2 ARG 98 -6.568 3.616 13.413
726 HH22 ARG 98 2HH2 ARG 98 -6.043 2.416 14.498
727 H MET 99 H MET 99 -4.763 -1.553 7.842
728 HA MET 99 HA MET 99 -4.643 -2.338 5.031
729 HB2 MET 99 2HB MET 99 -3.419 -3.693 7.440
730 HB3 MET 99 1HB MET 99 -3.504 -4.421 5.844
731 HG2 MET 99 2HG MET 99 -2.166 -2.587 4.937
732 HG3 MET 99 1HG MET 99 -2.073 -1.866 6.539
733 HE1 MET 99 3HE MET 99 1.572 -3.173 5.850
734 HE2 MET 99 1HE MET 99 0.582 -1.765 6.239
735 HE3 MET 99 2HE MET 99 0.440 -2.531 4.660
736 H HIS 100 H HIS 100 -6.017 -3.725 4.319
737 HA HIS 100 HA HIS 100 -8.134 -4.722 6.106
738 HB2 HIS 100 2HB HIS 100 -8.379 -3.935 3.183
739 HB3 HIS 100 1HB HIS 100 -9.678 -4.418 4.256
740 HD1 HIS 100 1HD HIS 100 -10.982 -2.475 5.226
741 HD2 HIS 100 2HD HIS 100 -7.174 -1.381 3.991
742 HE1 HIS 100 1HE HIS 100 -10.846 0.033 5.490
Start of MODEL 21
1 H1 GLY 1 1HT GLY 1 -15.957 -8.812 -8.367
2 H2 GLY 1 2HT GLY 1 -16.352 -8.439 -6.785
3 H3 GLY 1 3HT GLY 1 -16.682 -10.000 -7.398
4 HA2 GLY 1 1HA GLY 1 -14.737 -10.041 -5.996
5 HA3 GLY 1 2HA GLY 1 -14.308 -10.349 -7.677
6 H HIS 2 H HIS 2 -12.185 -9.640 -6.729
7 HA HIS 2 HA HIS 2 -10.507 -8.240 -6.563
8 HB2 HIS 2 2HB HIS 2 -12.255 -6.269 -8.065
9 HB3 HIS 2 1HB HIS 2 -10.545 -6.064 -7.711
10 HD1 HIS 2 1HD HIS 2 -12.447 -6.738 -10.504
11 HD2 HIS 2 2HD HIS 2 -9.221 -8.704 -8.795
12 HE1 HIS 2 1HE HIS 2 -11.412 -8.111 -12.344
13 H GLY 3 H GLY 3 -10.634 -8.253 -4.378
14 HA2 GLY 3 2HA GLY 3 -11.734 -5.783 -3.213
15 HA3 GLY 3 1HA GLY 3 -11.784 -7.335 -2.387
16 H SER 4 H SER 4 -10.020 -8.046 -1.275
17 HA SER 4 HA SER 4 -8.165 -6.034 -0.577
18 HB2 SER 4 2HB SER 4 -8.274 -8.930 0.260
19 HB3 SER 4 1HB SER 4 -7.317 -7.664 1.029
20 HG SER 4 HG SER 4 -9.758 -6.745 0.858
21 H ALA 5 H ALA 5 -7.929 -9.021 -2.475
22 HA ALA 5 HA ALA 5 -6.295 -9.963 -3.716
23 HB1 ALA 5 1HB ALA 5 -5.171 -7.136 -3.838
24 HB2 ALA 5 2HB ALA 5 -6.331 -7.822 -4.974
25 HB3 ALA 5 3HB ALA 5 -4.691 -8.468 -4.892
26 H GLY 6 H GLY 6 -6.181 -10.006 -0.980
27 HA2 GLY 6 2HA GLY 6 -4.487 -11.115 0.328
28 HA3 GLY 6 1HA GLY 6 -3.298 -10.016 -0.368
29 H THR 7 H THR 7 -3.121 -7.933 0.435
30 HA THR 7 HA THR 7 -4.863 -7.288 2.710
31 HB THR 7 HB THR 7 -1.934 -6.608 2.307
32 HG1 THR 7 1HG THR 7 -1.524 -8.022 3.855
33 HG21 THR 7 3HG2 THR 7 -3.087 -4.739 3.395
34 HG22 THR 7 1HG2 THR 7 -2.041 -5.561 4.550
35 HG23 THR 7 2HG2 THR 7 -3.783 -5.836 4.584
36 H SER 8 H SER 8 -6.096 -5.511 2.347
37 HA SER 8 HA SER 8 -5.429 -3.728 0.178
38 HB2 SER 8 2HB SER 8 -7.598 -3.404 2.263
39 HB3 SER 8 1HB SER 8 -7.493 -2.626 0.699
40 HG SER 8 HG SER 8 -8.863 -4.233 0.369
41 H VAL 9 H VAL 9 -3.892 -2.260 0.582
42 HA VAL 9 HA VAL 9 -3.734 -1.109 3.269
43 HB VAL 9 HB VAL 9 -1.895 -0.647 0.899
44 HG11 VAL 9 1HG1 VAL 9 -1.852 1.140 2.554
45 HG12 VAL 9 2HG1 VAL 9 -0.338 0.231 2.603
46 HG13 VAL 9 3HG1 VAL 9 -1.571 -0.037 3.835
47 HG21 VAL 9 3HG2 VAL 9 -0.306 -2.154 2.003
48 HG22 VAL 9 1HG2 VAL 9 -1.797 -2.985 1.561
49 HG23 VAL 9 2HG2 VAL 9 -1.519 -2.519 3.234
50 H THR 10 H THR 10 -5.049 0.471 3.518
51 HA THR 10 HA THR 10 -5.763 2.079 1.193
52 HB THR 10 HB THR 10 -7.463 1.421 3.608
53 HG1 THR 10 1HG THR 10 -8.342 -0.161 2.419
54 HG21 THR 10 3HG2 THR 10 -8.033 3.554 2.507
55 HG22 THR 10 1HG2 THR 10 -9.296 2.349 2.244
56 HG23 THR 10 2HG2 THR 10 -8.149 2.720 0.957
57 H LEU 11 H LEU 11 -5.056 4.017 1.343
58 HA LEU 11 HA LEU 11 -4.396 5.007 3.949
59 HB2 LEU 11 2HB LEU 11 -3.238 6.868 2.672
60 HB3 LEU 11 1HB LEU 11 -2.543 5.270 2.572
61 HG LEU 11 HG LEU 11 -3.792 5.104 0.342
62 HD11 LEU 11 1HD1 LEU 11 -4.094 7.228 -0.847
63 HD12 LEU 11 2HD1 LEU 11 -3.799 8.093 0.649
64 HD13 LEU 11 3HD1 LEU 11 -5.215 7.043 0.505
65 HD21 LEU 11 3HD2 LEU 11 -1.445 6.962 0.655
66 HD22 LEU 11 1HD2 LEU 11 -1.929 6.178 -0.848
67 HD23 LEU 11 2HD2 LEU 11 -1.386 5.205 0.517
68 H GLN 12 H GLN 12 -5.258 6.543 4.919
69 HA GLN 12 HA GLN 12 -7.865 7.542 3.964
70 HB2 GLN 12 2HB GLN 12 -7.444 6.042 6.099
71 HB3 GLN 12 1HB GLN 12 -6.876 7.530 6.800
72 HG2 GLN 12 2HG GLN 12 -9.665 7.053 5.748
73 HG3 GLN 12 1HG GLN 12 -9.184 7.039 7.436
74 HE21 GLN 12 1HE2 GLN 12 -8.672 9.023 8.439
75 HE22 GLN 12 2HE2 GLN 12 -9.222 10.512 7.762
76 H LEU 13 H LEU 13 -7.814 9.662 3.444
77 HA LEU 13 HA LEU 13 -5.718 11.393 4.536
78 HB2 LEU 13 2HB LEU 13 -5.699 11.206 2.122
79 HB3 LEU 13 1HB LEU 13 -7.411 11.572 2.059
80 HG LEU 13 HG LEU 13 -6.908 13.781 3.022
81 HD11 LEU 13 1HD1 LEU 13 -4.049 13.036 2.444
82 HD12 LEU 13 2HD1 LEU 13 -4.758 13.361 4.026
83 HD13 LEU 13 3HD1 LEU 13 -4.612 14.660 2.841
84 HD21 LEU 13 3HD2 LEU 13 -5.687 13.114 0.352
85 HD22 LEU 13 1HD2 LEU 13 -6.078 14.745 0.912
86 HD23 LEU 13 2HD2 LEU 13 -7.363 13.562 0.704
87 H ASP 14 H ASP 14 -6.454 12.673 6.125
88 HA ASP 14 HA ASP 14 -9.293 13.251 6.189
89 HB2 ASP 14 2HB ASP 14 -8.082 12.699 8.331
90 HB3 ASP 14 1HB ASP 14 -7.141 14.173 8.122
91 H ASP 15 H ASP 15 -9.671 14.558 4.624
92 HA ASP 15 HA ASP 15 -8.070 16.977 4.322
93 HB2 ASP 15 2HB ASP 15 -8.876 17.021 2.026
94 HB3 ASP 15 1HB ASP 15 -8.210 15.432 2.376
95 H GLY 16 H GLY 16 -11.086 15.686 5.198
96 HA2 GLY 16 2HA GLY 16 -12.566 17.420 6.281
97 HA3 GLY 16 1HA GLY 16 -12.513 18.189 4.690
98 H SER 17 H SER 17 -12.346 15.269 3.658
99 HA SER 17 HA SER 17 -15.181 14.652 4.017
100 HB2 SER 17 2HB SER 17 -14.686 15.477 1.732
101 HB3 SER 17 1HB SER 17 -13.465 14.215 1.552
102 HG SER 17 HG SER 17 -16.217 13.760 2.063
103 H GLY 18 H GLY 18 -11.885 13.491 3.706
104 HA2 GLY 18 2HA GLY 18 -11.037 11.641 4.863
105 HA3 GLY 18 1HA GLY 18 -12.682 11.029 5.067
106 H ARG 19 H ARG 19 -10.139 11.561 2.800
107 HA ARG 19 HA ARG 19 -11.543 10.025 0.757
108 HB2 ARG 19 2HB ARG 19 -8.822 11.270 0.626
109 HB3 ARG 19 1HB ARG 19 -9.765 10.547 -0.676
110 HG2 ARG 19 2HG ARG 19 -11.464 12.326 -0.382
111 HG3 ARG 19 1HG ARG 19 -10.461 13.040 0.883
112 HD2 ARG 19 2HD ARG 19 -8.627 13.185 -0.850
113 HD3 ARG 19 1HD ARG 19 -9.859 12.741 -2.025
114 HE ARG 19 HE ARG 19 -10.530 14.993 -0.340
115 HH11 ARG 19 1HH1 ARG 19 -9.052 14.051 -3.405
116 HH12 ARG 19 2HH1 ARG 19 -9.313 15.545 -4.178
117 HH21 ARG 19 1HH2 ARG 19 -10.883 17.063 -1.375
118 HH22 ARG 19 2HH2 ARG 19 -10.446 17.305 -2.992
119 H THR 20 H THR 20 -10.749 8.135 -0.086
120 HA THR 20 HA THR 20 -8.618 6.907 1.454
121 HB THR 20 HB THR 20 -9.984 4.788 1.552
122 HG1 THR 20 1HG THR 20 -11.901 4.806 0.715
123 HG21 THR 20 3HG2 THR 20 -9.670 6.153 3.517
124 HG22 THR 20 1HG2 THR 20 -11.345 5.570 3.499
125 HG23 THR 20 2HG2 THR 20 -10.953 7.232 2.984
126 H TYR 21 H TYR 21 -7.293 5.712 0.335
127 HA TYR 21 HA TYR 21 -8.077 4.761 -2.298
128 HB2 TYR 21 2HB TYR 21 -6.972 6.789 -2.878
129 HB3 TYR 21 1HB TYR 21 -5.688 6.508 -1.716
130 HD1 TYR 21 2HD TYR 21 -7.168 4.919 -4.762
131 HD2 TYR 21 1HD TYR 21 -3.647 5.740 -2.520
132 HE1 TYR 21 2HE TYR 21 -5.815 3.870 -6.505
133 HE2 TYR 21 1HE TYR 21 -2.279 4.690 -4.268
134 HH TYR 21 HH TYR 21 -2.468 3.140 -6.025
135 H GLN 22 H GLN 22 -7.739 2.725 -2.400
136 HA GLN 22 HA GLN 22 -5.906 1.343 -0.655
137 HB2 GLN 22 2HB GLN 22 -8.122 0.411 -1.224
138 HB3 GLN 22 1HB GLN 22 -7.654 0.345 -2.915
139 HG2 GLN 22 2HG GLN 22 -5.906 -1.272 -2.360
140 HG3 GLN 22 1HG GLN 22 -6.383 -1.202 -0.666
141 HE21 GLN 22 1HE2 GLN 22 -6.353 -3.468 -2.478
142 HE22 GLN 22 2HE2 GLN 22 -7.965 -4.080 -2.487
143 H LEU 23 H LEU 23 -3.927 0.865 -1.165
144 HA LEU 23 HA LEU 23 -2.649 1.771 -3.522
145 HB2 LEU 23 2HB LEU 23 -1.729 -0.160 -1.414
146 HB3 LEU 23 1HB LEU 23 -0.701 0.486 -2.666
147 HG LEU 23 HG LEU 23 -2.048 2.107 -0.493
148 HD11 LEU 23 1HD1 LEU 23 -0.297 0.648 0.362
149 HD12 LEU 23 2HD1 LEU 23 0.202 2.339 0.403
150 HD13 LEU 23 3HD1 LEU 23 0.815 1.267 -0.858
151 HD21 LEU 23 3HD2 LEU 23 -0.015 2.898 -2.579
152 HD22 LEU 23 1HD2 LEU 23 -0.599 3.919 -1.269
153 HD23 LEU 23 2HD2 LEU 23 -1.707 3.407 -2.536
154 H ARG 24 H ARG 24 -1.787 0.628 -5.198
155 HA ARG 24 HA ARG 24 -2.875 -2.065 -5.639
156 HB2 ARG 24 2HB ARG 24 -2.253 -1.755 -7.996
157 HB3 ARG 24 1HB ARG 24 -3.323 -0.468 -7.459
158 HG2 ARG 24 2HG ARG 24 -1.636 1.131 -7.519
159 HG3 ARG 24 1HG ARG 24 -0.357 -0.080 -7.418
160 HD2 ARG 24 2HD ARG 24 -2.180 0.313 -9.796
161 HD3 ARG 24 1HD ARG 24 -0.538 0.936 -9.637
162 HE ARG 24 HE ARG 24 0.274 -1.312 -9.543
163 HH11 ARG 24 1HH1 ARG 24 -3.077 -1.006 -10.711
164 HH12 ARG 24 2HH1 ARG 24 -3.046 -2.482 -11.554
165 HH21 ARG 24 1HH2 ARG 24 0.298 -3.326 -10.735
166 HH22 ARG 24 2HH2 ARG 24 -1.088 -3.817 -11.586
167 H GLU 25 H GLU 25 -1.290 -3.623 -6.612
168 HA GLU 25 HA GLU 25 1.144 -3.484 -5.162
169 HB2 GLU 25 2HB GLU 25 1.764 -5.582 -6.202
170 HB3 GLU 25 1HB GLU 25 0.105 -5.666 -5.649
171 HG2 GLU 25 2HG GLU 25 -0.682 -5.359 -7.925
172 HG3 GLU 25 1HG GLU 25 0.984 -5.216 -8.487
173 H GLY 26 H GLY 26 3.162 -3.265 -5.889
174 HA2 GLY 26 2HA GLY 26 4.744 -2.665 -7.591
175 HA3 GLY 26 1HA GLY 26 3.406 -1.882 -8.459
176 H SER 27 H SER 27 4.974 0.020 -8.255
177 HA SER 27 HA SER 27 4.619 1.047 -5.596
178 HB2 SER 27 2HB SER 27 6.461 2.673 -6.167
179 HB3 SER 27 1HB SER 27 6.928 0.983 -6.073
180 HG SER 27 HG SER 27 7.705 2.222 -7.943
181 H ASN 28 H ASN 28 3.576 2.775 -5.166
182 HA ASN 28 HA ASN 28 2.088 4.030 -7.373
183 HB2 ASN 28 2HB ASN 28 1.417 4.066 -4.384
184 HB3 ASN 28 1HB ASN 28 0.420 4.726 -5.661
185 HD21 ASN 28 1HD2 ASN 28 2.006 1.533 -5.607
186 HD22 ASN 28 2HD2 ASN 28 0.589 0.582 -5.590
187 H ILE 29 H ILE 29 3.013 5.877 -7.962
188 HA ILE 29 HA ILE 29 4.774 7.220 -6.046
189 HB ILE 29 HB ILE 29 4.623 7.682 -9.053
190 HG12 ILE 29 2HG1 ILE 29 6.564 5.965 -7.475
191 HG13 ILE 29 1HG1 ILE 29 5.253 5.340 -8.461
192 HG21 ILE 29 1HG2 ILE 29 6.822 8.715 -8.766
193 HG22 ILE 29 2HG2 ILE 29 6.733 8.439 -7.029
194 HG23 ILE 29 3HG2 ILE 29 5.603 9.549 -7.802
195 HD11 ILE 29 3HD1 ILE 29 6.309 6.309 -10.446
196 HD12 ILE 29 1HD1 ILE 29 7.373 5.177 -9.615
197 HD13 ILE 29 2HD1 ILE 29 7.624 6.913 -9.437
198 H ILE 30 H ILE 30 4.428 9.181 -5.279
199 HA ILE 30 HA ILE 30 2.077 10.686 -6.179
200 HB ILE 30 HB ILE 30 3.464 10.701 -3.466
201 HG12 ILE 30 2HG1 ILE 30 0.751 9.586 -4.252
202 HG13 ILE 30 1HG1 ILE 30 2.181 8.636 -3.887
203 HG21 ILE 30 1HG2 ILE 30 2.645 12.869 -3.855
204 HG22 ILE 30 2HG2 ILE 30 1.519 12.088 -2.741
205 HG23 ILE 30 3HG2 ILE 30 1.109 12.269 -4.448
206 HD11 ILE 30 3HD1 ILE 30 2.158 9.477 -1.595
207 HD12 ILE 30 1HD1 ILE 30 0.644 8.673 -2.010
208 HD13 ILE 30 2HD1 ILE 30 0.726 10.436 -1.963
209 H GLY 31 H GLY 31 2.386 12.697 -6.940
210 HA2 GLY 31 2HA GLY 31 3.871 14.730 -6.221
211 HA3 GLY 31 1HA GLY 31 5.073 13.785 -7.116
212 H ARG 32 H ARG 32 4.875 15.962 -8.322
213 HA ARG 32 HA ARG 32 2.820 15.544 -10.408
214 HB2 ARG 32 2HB ARG 32 4.221 18.127 -9.681
215 HB3 ARG 32 1HB ARG 32 2.961 17.938 -10.885
216 HG2 ARG 32 2HG ARG 32 1.383 17.324 -9.067
217 HG3 ARG 32 1HG ARG 32 2.674 17.608 -7.917
218 HD2 ARG 32 2HD ARG 32 2.896 19.910 -8.642
219 HD3 ARG 32 1HD ARG 32 1.626 19.674 -9.839
220 HE ARG 32 HE ARG 32 0.453 19.007 -7.474
221 HH11 ARG 32 1HH1 ARG 32 2.128 21.888 -8.647
222 HH12 ARG 32 2HH1 ARG 32 1.195 22.951 -7.698
223 HH21 ARG 32 1HH2 ARG 32 -0.737 20.440 -6.179
224 HH22 ARG 32 2HH2 ARG 32 -0.477 22.132 -6.265
225 H GLY 33 H GLY 33 3.914 14.467 -11.936
226 HA2 GLY 33 2HA GLY 33 5.986 15.529 -13.401
227 HA3 GLY 33 1HA GLY 33 6.693 14.475 -12.177
228 H GLN 34 H GLN 34 7.293 13.617 -14.366
229 HA GLN 34 HA GLN 34 5.529 12.270 -16.027
230 HB2 GLN 34 2HB GLN 34 7.521 11.027 -16.828
231 HB3 GLN 34 1HB GLN 34 7.757 12.770 -16.756
232 HG2 GLN 34 2HG GLN 34 9.057 12.568 -14.753
233 HG3 GLN 34 1HG GLN 34 8.671 10.858 -14.629
234 HE21 GLN 34 1HE2 GLN 34 10.694 10.205 -14.625
235 HE22 GLN 34 2HE2 GLN 34 11.767 10.280 -15.986
236 H ASP 35 H ASP 35 7.376 10.965 -13.296
237 HA ASP 35 HA ASP 35 6.467 8.252 -13.769
238 HB2 ASP 35 2HB ASP 35 8.012 9.332 -11.398
239 HB3 ASP 35 1HB ASP 35 7.812 7.641 -11.828
240 H ALA 36 H ALA 36 5.387 10.918 -12.036
241 HA ALA 36 HA ALA 36 4.249 9.546 -9.808
242 HB1 ALA 36 1HB ALA 36 3.764 12.332 -10.795
243 HB2 ALA 36 2HB ALA 36 4.978 11.847 -9.606
244 HB3 ALA 36 3HB ALA 36 3.260 11.681 -9.243
245 H GLN 37 H GLN 37 2.164 9.124 -9.370
246 HA GLN 37 HA GLN 37 0.343 8.901 -11.654
247 HB2 GLN 37 2HB GLN 37 0.515 7.485 -8.992
248 HB3 GLN 37 1HB GLN 37 -0.743 7.220 -10.182
249 HG2 GLN 37 2HG GLN 37 0.756 6.208 -11.688
250 HG3 GLN 37 1HG GLN 37 2.162 6.797 -10.798
251 HE21 GLN 37 1HE2 GLN 37 2.985 4.719 -10.617
252 HE22 GLN 37 2HE2 GLN 37 2.332 3.553 -9.541
253 H PHE 38 H PHE 38 0.452 9.462 -8.167
254 HA PHE 38 HA PHE 38 -2.090 10.851 -8.253
255 HB2 PHE 38 2HB PHE 38 -1.855 9.067 -6.623
256 HB3 PHE 38 1HB PHE 38 -0.392 9.797 -5.988
257 HD1 PHE 38 1HD PHE 38 -4.034 10.394 -6.401
258 HD2 PHE 38 2HD PHE 38 -0.515 11.251 -4.189
259 HE1 PHE 38 1HE PHE 38 -5.379 11.577 -4.708
260 HE2 PHE 38 2HE PHE 38 -1.797 12.406 -2.521
261 HZ PHE 38 HZ PHE 38 -4.266 12.590 -2.751
262 H ARG 39 H ARG 39 -2.173 12.977 -8.171
263 HA ARG 39 HA ARG 39 0.290 14.524 -7.761
264 HB2 ARG 39 2HB ARG 39 -2.379 15.654 -8.561
265 HB3 ARG 39 1HB ARG 39 -0.775 16.289 -8.859
266 HG2 ARG 39 2HG ARG 39 -1.979 13.893 -10.207
267 HG3 ARG 39 1HG ARG 39 -1.886 15.513 -10.894
268 HD2 ARG 39 2HD ARG 39 0.574 15.351 -10.755
269 HD3 ARG 39 1HD ARG 39 0.397 13.684 -10.193
270 HE ARG 39 HE ARG 39 -1.032 14.144 -12.600
271 HH11 ARG 39 1HH1 ARG 39 2.127 13.386 -11.333
272 HH12 ARG 39 2HH1 ARG 39 2.763 12.808 -12.831
273 HH21 ARG 39 1HH2 ARG 39 -0.229 13.368 -14.613
274 HH22 ARG 39 2HH2 ARG 39 1.376 12.798 -14.745
275 H LEU 40 H LEU 40 0.384 16.053 -6.065
276 HA LEU 40 HA LEU 40 -1.801 15.946 -4.175
277 HB2 LEU 40 2HB LEU 40 0.982 17.058 -3.972
278 HB3 LEU 40 1HB LEU 40 -0.237 17.408 -2.761
279 HG LEU 40 HG LEU 40 0.840 14.669 -3.448
280 HD11 LEU 40 1HD1 LEU 40 1.825 14.805 -1.213
281 HD12 LEU 40 2HD1 LEU 40 1.244 16.469 -1.074
282 HD13 LEU 40 3HD1 LEU 40 2.454 16.052 -2.292
283 HD21 LEU 40 3HD2 LEU 40 -0.415 13.951 -1.458
284 HD22 LEU 40 1HD2 LEU 40 -1.489 14.556 -2.718
285 HD23 LEU 40 2HD2 LEU 40 -1.111 15.563 -1.324
286 HA PRO 41 HA PRO 41 -3.445 19.725 -5.868
287 HB2 PRO 41 2HB PRO 41 -4.835 20.064 -3.292
288 HB3 PRO 41 1HB PRO 41 -5.515 19.844 -4.908
289 HG2 PRO 41 2HG PRO 41 -5.645 17.887 -3.082
290 HG3 PRO 41 1HG PRO 41 -5.373 17.535 -4.797
291 HD2 PRO 41 2HD PRO 41 -3.385 17.648 -2.556
292 HD3 PRO 41 1HD PRO 41 -3.557 16.440 -3.844
293 H ASP 42 H ASP 42 -1.946 19.634 -2.739
294 HA ASP 42 HA ASP 42 -1.632 22.531 -2.701
295 HB2 ASP 42 2HB ASP 42 -1.024 20.403 -0.660
296 HB3 ASP 42 1HB ASP 42 -0.396 22.039 -0.518
297 H THR 43 H THR 43 0.569 23.338 -2.055
298 HA THR 43 HA THR 43 2.431 22.263 -3.960
299 HB THR 43 HB THR 43 2.081 24.739 -3.773
300 HG1 THR 43 1HG THR 43 4.677 24.745 -3.008
301 HG21 THR 43 3HG2 THR 43 3.454 24.458 -1.093
302 HG22 THR 43 1HG2 THR 43 1.758 24.875 -1.330
303 HG23 THR 43 2HG2 THR 43 3.021 25.976 -1.878
304 H GLY 44 H GLY 44 4.910 22.537 -2.900
305 HA2 GLY 44 2HA GLY 44 6.318 21.921 -1.128
306 HA3 GLY 44 1HA GLY 44 4.940 21.197 -0.304
307 H VAL 45 H VAL 45 4.384 20.203 -3.112
308 HA VAL 45 HA VAL 45 5.652 17.635 -2.746
309 HB VAL 45 HB VAL 45 3.213 17.794 -3.113
310 HG11 VAL 45 1HG1 VAL 45 2.292 18.355 -5.318
311 HG12 VAL 45 2HG1 VAL 45 3.895 18.884 -5.830
312 HG13 VAL 45 3HG1 VAL 45 3.065 19.726 -4.523
313 HG21 VAL 45 3HG2 VAL 45 3.008 16.097 -4.871
314 HG22 VAL 45 1HG2 VAL 45 4.326 15.744 -3.753
315 HG23 VAL 45 2HG2 VAL 45 4.680 16.415 -5.344
316 H SER 46 H SER 46 6.982 16.718 -4.268
317 HA SER 46 HA SER 46 8.116 18.535 -6.255
318 HB2 SER 46 2HB SER 46 9.198 15.987 -5.028
319 HB3 SER 46 1HB SER 46 10.062 17.029 -6.165
320 HG SER 46 HG SER 46 9.036 18.427 -4.079
321 H ARG 47 H ARG 47 9.158 16.891 -8.150
322 HA ARG 47 HA ARG 47 6.897 15.960 -9.586
323 HB2 ARG 47 2HB ARG 47 8.500 14.941 -11.206
324 HB3 ARG 47 1HB ARG 47 8.778 16.644 -10.918
325 HG2 ARG 47 2HG ARG 47 10.662 16.101 -9.495
326 HG3 ARG 47 1HG ARG 47 10.311 14.377 -9.646
327 HD2 ARG 47 2HD ARG 47 10.735 14.559 -12.071
328 HD3 ARG 47 1HD ARG 47 11.164 16.256 -11.845
329 HE ARG 47 HE ARG 47 12.708 14.811 -10.082
330 HH11 ARG 47 1HH1 ARG 47 12.320 14.942 -13.598
331 HH12 ARG 47 2HH1 ARG 47 13.943 14.558 -13.928
332 HH21 ARG 47 1HH2 ARG 47 14.970 14.250 -10.570
333 HH22 ARG 47 2HH2 ARG 47 15.452 14.127 -12.187
334 H ARG 48 H ARG 48 9.347 14.321 -7.797
335 HA ARG 48 HA ARG 48 7.518 12.100 -7.439
336 HB2 ARG 48 2HB ARG 48 10.537 11.995 -7.777
337 HB3 ARG 48 1HB ARG 48 9.572 10.654 -7.185
338 HG2 ARG 48 2HG ARG 48 8.430 10.481 -9.307
339 HG3 ARG 48 1HG ARG 48 9.275 11.910 -9.909
340 HD2 ARG 48 2HD ARG 48 10.585 9.337 -9.048
341 HD3 ARG 48 1HD ARG 48 10.272 9.787 -10.729
342 HE ARG 48 HE ARG 48 12.042 11.292 -8.913
343 HH11 ARG 48 1HH1 ARG 48 11.294 10.208 -12.241
344 HH12 ARG 48 2HH1 ARG 48 12.848 10.600 -12.814
345 HH21 ARG 48 1HH2 ARG 48 14.161 11.785 -9.772
346 HH22 ARG 48 2HH2 ARG 48 14.498 11.504 -11.415
347 H HIS 49 H HIS 49 6.883 12.440 -5.486
348 HA HIS 49 HA HIS 49 8.665 13.797 -3.593
349 HB2 HIS 49 2HB HIS 49 6.486 14.884 -3.984
350 HB3 HIS 49 1HB HIS 49 5.654 13.402 -3.551
351 HD2 HIS 49 2HD HIS 49 5.853 12.728 -0.758
352 HE1 HIS 49 1HE HIS 49 6.757 16.697 0.356
353 HE2 HIS 49 2HE HIS 49 6.517 14.299 1.136
354 H LEU 50 H LEU 50 6.666 10.964 -4.111
355 HA LEU 50 HA LEU 50 8.203 9.479 -2.263
356 HB2 LEU 50 2HB LEU 50 6.910 10.691 -0.662
357 HB3 LEU 50 1HB LEU 50 5.425 10.380 -1.511
358 HG LEU 50 HG LEU 50 6.949 8.070 -0.364
359 HD11 LEU 50 1HD1 LEU 50 5.777 8.452 1.758
360 HD12 LEU 50 2HD1 LEU 50 5.085 9.945 1.125
361 HD13 LEU 50 3HD1 LEU 50 6.823 9.821 1.399
362 HD21 LEU 50 3HD2 LEU 50 4.014 8.722 -0.652
363 HD22 LEU 50 1HD2 LEU 50 4.682 7.207 -0.047
364 HD23 LEU 50 2HD2 LEU 50 4.949 7.680 -1.727
365 H GLU 51 H GLU 51 7.827 7.319 -2.469
366 HA GLU 51 HA GLU 51 5.656 6.518 -4.238
367 HB2 GLU 51 2HB GLU 51 7.132 4.884 -5.371
368 HB3 GLU 51 1HB GLU 51 7.593 6.543 -5.695
369 HG2 GLU 51 2HG GLU 51 9.364 6.311 -3.963
370 HG3 GLU 51 1HG GLU 51 8.905 4.632 -3.790
371 H ILE 52 H ILE 52 4.570 4.848 -3.537
372 HA ILE 52 HA ILE 52 5.695 3.406 -1.246
373 HB ILE 52 HB ILE 52 2.794 3.518 -2.124
374 HG12 ILE 52 2HG1 ILE 52 4.145 4.845 0.242
375 HG13 ILE 52 1HG1 ILE 52 3.620 5.680 -1.217
376 HG21 ILE 52 1HG2 ILE 52 2.386 2.406 0.049
377 HG22 ILE 52 2HG2 ILE 52 4.136 2.336 0.308
378 HG23 ILE 52 3HG2 ILE 52 3.412 1.450 -1.032
379 HD11 ILE 52 3HD1 ILE 52 2.057 6.005 0.616
380 HD12 ILE 52 1HD1 ILE 52 1.834 4.259 0.747
381 HD13 ILE 52 2HD1 ILE 52 1.305 5.111 -0.704
382 H ARG 53 H ARG 53 6.552 1.571 -1.780
383 HA ARG 53 HA ARG 53 5.575 0.195 -4.147
384 HB2 ARG 53 2HB ARG 53 7.976 0.327 -4.072
385 HB3 ARG 53 1HB ARG 53 8.019 -0.344 -2.446
386 HG2 ARG 53 2HG ARG 53 7.053 -2.431 -3.303
387 HG3 ARG 53 1HG ARG 53 7.076 -1.743 -4.923
388 HD2 ARG 53 2HD ARG 53 9.443 -1.665 -4.935
389 HD3 ARG 53 1HD ARG 53 9.532 -2.089 -3.218
390 HE ARG 53 HE ARG 53 8.339 -4.190 -3.990
391 HH11 ARG 53 1HH1 ARG 53 10.756 -2.493 -5.988
392 HH12 ARG 53 2HH1 ARG 53 11.331 -3.901 -6.736
393 HH21 ARG 53 1HH2 ARG 53 9.142 -6.106 -5.022
394 HH22 ARG 53 2HH2 ARG 53 10.413 -6.017 -6.157
395 H TRP 54 H TRP 54 3.984 -1.060 -3.892
396 HA TRP 54 HA TRP 54 3.740 -2.410 -1.374
397 HB2 TRP 54 2HB TRP 54 1.832 -1.084 -1.779
398 HB3 TRP 54 1HB TRP 54 1.730 -1.605 -3.456
399 HD1 TRP 54 HD TRP 54 -0.311 -3.180 -3.767
400 HE1 TRP 54 1HE TRP 54 -1.515 -4.969 -2.363
401 HE3 TRP 54 3HE TRP 54 2.483 -2.936 0.479
402 HZ2 TRP 54 2HZ TRP 54 -1.317 -6.123 0.172
403 HZ3 TRP 54 3HZ TRP 54 1.930 -4.404 2.342
404 HH2 TRP 54 HH TRP 54 0.062 -5.978 2.207
405 H ASP 55 H ASP 55 3.969 -4.507 -1.278
406 HA ASP 55 HA ASP 55 3.740 -6.224 -3.656
407 HB2 ASP 55 2HB ASP 55 5.876 -6.442 -1.488
408 HB3 ASP 55 1HB ASP 55 5.595 -7.634 -2.741
409 H GLY 56 H GLY 56 3.550 -8.585 -2.716
410 HA2 GLY 56 2HA GLY 56 1.464 -8.479 -0.742
411 HA3 GLY 56 1HA GLY 56 2.080 -9.925 -1.539
412 H GLN 57 H GLN 57 3.449 -7.467 0.528
413 HA GLN 57 HA GLN 57 4.310 -9.424 2.538
414 HB2 GLN 57 2HB GLN 57 6.139 -7.358 1.263
415 HB3 GLN 57 1HB GLN 57 6.552 -8.346 2.645
416 HG2 GLN 57 2HG GLN 57 6.564 -10.319 1.274
417 HG3 GLN 57 1HG GLN 57 5.947 -9.405 -0.105
418 HE21 GLN 57 1HE2 GLN 57 8.442 -10.919 0.219
419 HE22 GLN 57 2HE2 GLN 57 9.711 -9.810 -0.111
420 H VAL 58 H VAL 58 5.223 -6.062 1.945
421 HA VAL 58 HA VAL 58 3.418 -4.967 3.883
422 HB VAL 58 HB VAL 58 5.243 -3.745 5.063
423 HG11 VAL 58 1HG1 VAL 58 5.534 -6.734 5.260
424 HG12 VAL 58 2HG1 VAL 58 4.393 -5.727 6.150
425 HG13 VAL 58 3HG1 VAL 58 6.125 -5.572 6.444
426 HG21 VAL 58 3HG2 VAL 58 7.118 -5.572 3.559
427 HG22 VAL 58 1HG2 VAL 58 7.582 -4.470 4.857
428 HG23 VAL 58 2HG2 VAL 58 6.960 -3.829 3.335
429 H ALA 59 H ALA 59 3.536 -2.557 3.693
430 HA ALA 59 HA ALA 59 4.119 -1.882 0.928
431 HB1 ALA 59 1HB ALA 59 2.599 -0.317 3.027
432 HB2 ALA 59 2HB ALA 59 1.888 -1.307 1.759
433 HB3 ALA 59 3HB ALA 59 2.793 0.142 1.335
434 H LEU 60 H LEU 60 5.908 -1.060 0.444
435 HA LEU 60 HA LEU 60 7.699 -0.043 2.453
436 HB2 LEU 60 2HB LEU 60 8.457 -1.622 0.778
437 HB3 LEU 60 1HB LEU 60 7.981 -0.525 -0.494
438 HG LEU 60 HG LEU 60 9.723 1.059 0.260
439 HD11 LEU 60 1HD1 LEU 60 10.464 -1.184 2.133
440 HD12 LEU 60 2HD1 LEU 60 9.837 0.394 2.603
441 HD13 LEU 60 3HD1 LEU 60 11.429 0.267 1.845
442 HD21 LEU 60 3HD2 LEU 60 10.116 -0.540 -1.520
443 HD22 LEU 60 1HD2 LEU 60 10.648 -1.736 -0.344
444 HD23 LEU 60 2HD2 LEU 60 11.595 -0.261 -0.590
445 H LEU 61 H LEU 61 7.656 1.987 2.975
446 HA LEU 61 HA LEU 61 6.531 4.020 1.231
447 HB2 LEU 61 2HB LEU 61 5.801 3.720 3.553
448 HB3 LEU 61 1HB LEU 61 7.401 3.991 4.156
449 HG LEU 61 HG LEU 61 5.940 5.878 4.596
450 HD11 LEU 61 1HD1 LEU 61 8.224 6.509 4.195
451 HD12 LEU 61 2HD1 LEU 61 7.124 7.754 3.608
452 HD13 LEU 61 3HD1 LEU 61 7.903 6.657 2.468
453 HD21 LEU 61 3HD2 LEU 61 5.522 6.117 1.634
454 HD22 LEU 61 1HD2 LEU 61 4.832 7.148 2.885
455 HD23 LEU 61 2HD2 LEU 61 4.352 5.452 2.775
456 H ALA 62 H ALA 62 8.014 4.924 -0.142
457 HA ALA 62 HA ALA 62 10.701 5.403 0.916
458 HB1 ALA 62 1HB ALA 62 9.876 4.894 -1.943
459 HB2 ALA 62 2HB ALA 62 10.723 3.755 -0.890
460 HB3 ALA 62 3HB ALA 62 11.515 5.248 -1.394
461 H ASP 63 H ASP 63 11.181 7.432 1.167
462 HA ASP 63 HA ASP 63 9.418 9.522 0.158
463 HB2 ASP 63 2HB ASP 63 9.882 9.670 2.480
464 HB3 ASP 63 1HB ASP 63 11.601 9.419 2.232
465 H LEU 64 H LEU 64 9.972 10.904 -1.431
466 HA LEU 64 HA LEU 64 12.829 11.099 -2.158
467 HB2 LEU 64 2HB LEU 64 10.446 11.437 -4.007
468 HB3 LEU 64 1HB LEU 64 12.101 11.720 -4.439
469 HG LEU 64 HG LEU 64 11.378 9.794 -5.478
470 HD11 LEU 64 1HD1 LEU 64 13.629 9.633 -4.683
471 HD12 LEU 64 2HD1 LEU 64 12.874 8.040 -4.629
472 HD13 LEU 64 3HD1 LEU 64 13.080 8.973 -3.142
473 HD21 LEU 64 3HD2 LEU 64 10.535 7.812 -4.372
474 HD22 LEU 64 1HD2 LEU 64 9.460 9.195 -4.193
475 HD23 LEU 64 2HD2 LEU 64 10.478 8.685 -2.834
476 H ASN 65 H ASN 65 12.609 12.883 -0.404
477 HA ASN 65 HA ASN 65 12.513 15.379 -1.744
478 HB2 ASN 65 2HB ASN 65 10.016 14.921 -1.382
479 HB3 ASN 65 1HB ASN 65 10.329 15.008 0.343
480 HD21 ASN 65 1HD2 ASN 65 8.629 16.638 -1.360
481 HD22 ASN 65 2HD2 ASN 65 9.130 18.272 -1.183
482 H SER 66 H SER 66 14.274 16.238 -0.820
483 HA SER 66 HA SER 66 14.959 15.479 1.854
484 HB2 SER 66 2HB SER 66 16.955 16.977 1.308
485 HB3 SER 66 1HB SER 66 16.759 15.483 0.374
486 HG SER 66 HG SER 66 16.319 18.157 -0.371
487 H THR 67 H THR 67 13.280 18.025 0.414
488 HA THR 67 HA THR 67 13.957 20.006 2.436
489 HB THR 67 HB THR 67 11.879 20.245 0.249
490 HG1 THR 67 1HG THR 67 13.411 20.499 -1.136
491 HG21 THR 67 3HG2 THR 67 13.565 22.301 1.702
492 HG22 THR 67 1HG2 THR 67 11.851 21.994 1.982
493 HG23 THR 67 2HG2 THR 67 12.389 22.646 0.433
494 H ASN 68 H ASN 68 11.029 18.406 1.258
495 HA ASN 68 HA ASN 68 9.603 19.119 3.745
496 HB2 ASN 68 2HB ASN 68 8.505 18.595 0.969
497 HB3 ASN 68 1HB ASN 68 7.519 18.887 2.397
498 HD21 ASN 68 1HD2 ASN 68 7.663 20.386 -0.069
499 HD22 ASN 68 2HD2 ASN 68 8.100 21.995 0.382
500 H GLY 69 H GLY 69 11.339 16.948 3.359
501 HA2 GLY 69 2HA GLY 69 10.479 14.503 2.615
502 HA3 GLY 69 1HA GLY 69 11.547 14.774 3.970
503 H THR 70 H THR 70 9.478 12.877 3.310
504 HA THR 70 HA THR 70 7.181 13.197 4.840
505 HB THR 70 HB THR 70 8.505 10.678 3.871
506 HG1 THR 70 1HG THR 70 8.262 11.949 2.137
507 HG21 THR 70 3HG2 THR 70 6.203 9.827 3.808
508 HG22 THR 70 1HG2 THR 70 5.620 11.356 4.462
509 HG23 THR 70 2HG2 THR 70 6.649 10.313 5.446
510 H THR 71 H THR 71 6.675 12.676 6.815
511 HA THR 71 HA THR 71 8.738 11.674 8.657
512 HB THR 71 HB THR 71 6.259 13.102 9.432
513 HG1 THR 71 1HG THR 71 8.057 14.044 7.678
514 HG21 THR 71 3HG2 THR 71 7.797 12.349 11.141
515 HG22 THR 71 1HG2 THR 71 7.732 14.111 11.110
516 HG23 THR 71 2HG2 THR 71 9.100 13.260 10.383
517 H VAL 72 H VAL 72 8.049 9.845 9.855
518 HA VAL 72 HA VAL 72 5.321 8.883 9.352
519 HB VAL 72 HB VAL 72 6.227 6.529 9.562
520 HG11 VAL 72 1HG1 VAL 72 5.869 7.517 7.366
521 HG12 VAL 72 2HG1 VAL 72 7.258 6.430 7.359
522 HG13 VAL 72 3HG1 VAL 72 7.501 8.176 7.384
523 HG21 VAL 72 3HG2 VAL 72 8.244 7.044 10.841
524 HG22 VAL 72 1HG2 VAL 72 8.908 7.910 9.457
525 HG23 VAL 72 2HG2 VAL 72 8.632 6.170 9.360
526 H ASN 73 H ASN 73 4.137 8.767 11.098
527 HA ASN 73 HA ASN 73 3.464 8.804 13.265
528 HB2 ASN 73 2HB ASN 73 5.891 7.013 13.575
529 HB3 ASN 73 1HB ASN 73 4.717 7.268 14.861
530 HD21 ASN 73 1HD2 ASN 73 5.435 4.833 13.458
531 HD22 ASN 73 2HD2 ASN 73 3.989 4.203 12.756
532 H ASN 74 H ASN 74 5.126 10.794 12.279
533 HA ASN 74 HA ASN 74 5.853 12.816 12.874
534 HB2 ASN 74 2HB ASN 74 4.380 12.440 14.973
535 HB3 ASN 74 1HB ASN 74 5.873 12.051 15.812
536 HD21 ASN 74 1HD2 ASN 74 7.335 13.723 16.250
537 HD22 ASN 74 2HD2 ASN 74 6.914 15.384 16.133
538 H ALA 75 H ALA 75 7.571 10.422 12.450
539 HA ALA 75 HA ALA 75 10.069 11.580 13.477
540 HB1 ALA 75 1HB ALA 75 9.599 9.439 14.580
541 HB2 ALA 75 2HB ALA 75 11.030 9.324 13.558
542 HB3 ALA 75 3HB ALA 75 9.496 8.648 13.008
543 HA PRO 76 HA PRO 76 10.654 12.036 9.044
544 HB2 PRO 76 2HB PRO 76 13.145 13.143 9.145
545 HB3 PRO 76 1HB PRO 76 11.653 14.044 9.467
546 HG2 PRO 76 2HG PRO 76 13.592 12.847 11.410
547 HG3 PRO 76 1HG PRO 76 12.795 14.431 11.457
548 HD2 PRO 76 2HD PRO 76 11.932 12.332 12.924
549 HD3 PRO 76 1HD PRO 76 10.819 13.549 12.273
550 H VAL 77 H VAL 77 11.393 10.676 7.539
551 HA VAL 77 HA VAL 77 13.709 8.974 8.058
552 HB VAL 77 HB VAL 77 12.439 6.967 7.292
553 HG11 VAL 77 1HG1 VAL 77 12.837 7.242 9.667
554 HG12 VAL 77 2HG1 VAL 77 11.261 6.499 9.393
555 HG13 VAL 77 3HG1 VAL 77 11.368 8.206 9.820
556 HG21 VAL 77 3HG2 VAL 77 10.618 8.051 6.126
557 HG22 VAL 77 1HG2 VAL 77 10.031 8.743 7.639
558 HG23 VAL 77 2HG2 VAL 77 9.971 7.002 7.390
559 H GLN 78 H GLN 78 14.233 7.723 6.052
560 HA GLN 78 HA GLN 78 13.525 9.264 3.645
561 HB2 GLN 78 2HB GLN 78 15.478 8.255 2.579
562 HB3 GLN 78 1HB GLN 78 15.960 8.974 4.108
563 HG2 GLN 78 2HG GLN 78 15.985 6.779 5.154
564 HG3 GLN 78 1HG GLN 78 15.419 6.046 3.657
565 HE21 GLN 78 1HE2 GLN 78 17.186 4.697 3.441
566 HE22 GLN 78 2HE2 GLN 78 18.760 5.285 3.087
567 H GLU 79 H GLU 79 13.090 6.313 5.283
568 HA GLU 79 HA GLU 79 11.286 5.296 3.317
569 HB2 GLU 79 2HB GLU 79 12.425 3.141 3.080
570 HB3 GLU 79 1HB GLU 79 13.435 4.442 2.470
571 HG2 GLU 79 2HG GLU 79 14.665 4.409 4.636
572 HG3 GLU 79 1HG GLU 79 13.715 3.001 5.092
573 H TRP 80 H TRP 80 10.062 3.553 4.228
574 HA TRP 80 HA TRP 80 10.417 2.771 6.960
575 HB2 TRP 80 2HB TRP 80 9.489 4.988 7.301
576 HB3 TRP 80 1HB TRP 80 8.176 4.685 6.185
577 HD1 TRP 80 HD TRP 80 6.065 3.481 7.143
578 HE1 TRP 80 1HE TRP 80 5.281 2.892 9.522
579 HE3 TRP 80 3HE TRP 80 10.488 4.141 9.603
580 HZ2 TRP 80 2HZ TRP 80 6.402 2.755 12.102
581 HZ3 TRP 80 3HZ TRP 80 10.543 3.765 12.036
582 HH2 TRP 80 HH TRP 80 8.533 3.090 13.250
583 H GLN 81 H GLN 81 8.999 1.085 7.455
584 HA GLN 81 HA GLN 81 7.613 -0.004 5.146
585 HB2 GLN 81 2HB GLN 81 7.692 -2.203 6.322
586 HB3 GLN 81 1HB GLN 81 9.285 -1.552 6.010
587 HG2 GLN 81 2HG GLN 81 7.868 -1.327 8.640
588 HG3 GLN 81 1HG GLN 81 8.949 -2.661 8.238
589 HE21 GLN 81 1HE2 GLN 81 10.845 -0.863 6.816
590 HE22 GLN 81 2HE2 GLN 81 11.673 -0.009 8.042
591 H LEU 82 H LEU 82 5.635 0.674 5.091
592 HA LEU 82 HA LEU 82 4.112 1.779 7.161
593 HB2 LEU 82 2HB LEU 82 3.148 0.447 4.669
594 HB3 LEU 82 1HB LEU 82 2.205 1.518 5.685
595 HG LEU 82 HG LEU 82 4.639 2.281 4.097
596 HD11 LEU 82 1HD1 LEU 82 2.726 1.870 2.668
597 HD12 LEU 82 2HD1 LEU 82 3.033 3.602 2.762
598 HD13 LEU 82 3HD1 LEU 82 1.714 2.887 3.687
599 HD21 LEU 82 3HD2 LEU 82 4.030 4.577 4.741
600 HD22 LEU 82 1HD2 LEU 82 4.464 3.577 6.128
601 HD23 LEU 82 2HD2 LEU 82 2.775 3.913 5.786
602 H ALA 83 H ALA 83 2.715 1.024 8.593
603 HA ALA 83 HA ALA 83 1.637 -1.664 8.337
604 HB1 ALA 83 1HB ALA 83 3.434 -1.795 10.004
605 HB2 ALA 83 2HB ALA 83 1.863 -1.945 10.792
606 HB3 ALA 83 3HB ALA 83 2.748 -0.420 10.867
607 H ASP 84 H ASP 84 -0.332 -1.810 9.808
608 HA ASP 84 HA ASP 84 -2.138 0.261 9.154
609 HB2 ASP 84 2HB ASP 84 -2.899 -2.048 9.463
610 HB3 ASP 84 1HB ASP 84 -2.425 -1.992 11.155
611 H GLY 85 H GLY 85 -2.307 2.163 10.062
612 HA2 GLY 85 2HA GLY 85 -2.942 3.474 11.943
613 HA3 GLY 85 1HA GLY 85 -2.073 2.354 12.980
614 H ASP 86 H ASP 86 -0.305 3.142 10.175
615 HA ASP 86 HA ASP 86 1.387 4.835 11.811
616 HB2 ASP 86 2HB ASP 86 1.817 3.686 9.044
617 HB3 ASP 86 1HB ASP 86 2.906 4.863 9.760
618 H VAL 87 H VAL 87 1.732 6.906 11.547
619 HA VAL 87 HA VAL 87 -0.171 8.311 9.788
620 HB VAL 87 HB VAL 87 1.479 9.517 12.038
621 HG11 VAL 87 1HG1 VAL 87 -0.135 11.345 11.936
622 HG12 VAL 87 2HG1 VAL 87 -0.952 10.548 10.591
623 HG13 VAL 87 3HG1 VAL 87 0.704 11.123 10.398
624 HG21 VAL 87 3HG2 VAL 87 -1.376 8.529 12.131
625 HG22 VAL 87 1HG2 VAL 87 -0.558 9.423 13.412
626 HG23 VAL 87 2HG2 VAL 87 -0.003 7.807 12.966
627 H ILE 88 H ILE 88 0.655 8.941 7.919
628 HA ILE 88 HA ILE 88 3.509 9.493 7.792
629 HB ILE 88 HB ILE 88 1.524 8.617 5.688
630 HG12 ILE 88 2HG1 ILE 88 3.214 6.838 5.205
631 HG13 ILE 88 1HG1 ILE 88 4.184 7.446 6.526
632 HG21 ILE 88 1HG2 ILE 88 3.243 8.858 3.955
633 HG22 ILE 88 2HG2 ILE 88 4.300 9.630 5.134
634 HG23 ILE 88 3HG2 ILE 88 2.790 10.409 4.665
635 HD11 ILE 88 3HD1 ILE 88 1.442 6.217 6.742
636 HD12 ILE 88 1HD1 ILE 88 2.392 6.836 8.089
637 HD13 ILE 88 2HD1 ILE 88 2.973 5.450 7.171
638 H ARG 89 H ARG 89 3.993 11.496 7.907
639 HA ARG 89 HA ARG 89 2.077 13.516 6.999
640 HB2 ARG 89 2HB ARG 89 4.234 13.664 9.095
641 HB3 ARG 89 1HB ARG 89 3.328 15.060 8.519
642 HG2 ARG 89 2HG ARG 89 1.268 14.105 9.323
643 HG3 ARG 89 1HG ARG 89 2.113 12.634 9.811
644 HD2 ARG 89 2HD ARG 89 1.668 14.160 11.701
645 HD3 ARG 89 1HD ARG 89 3.378 13.851 11.448
646 HE ARG 89 HE ARG 89 3.460 16.025 10.292
647 HH11 ARG 89 1HH1 ARG 89 0.746 15.524 12.507
648 HH12 ARG 89 2HH1 ARG 89 0.710 17.139 13.016
649 HH21 ARG 89 1HH2 ARG 89 3.374 18.200 10.959
650 HH22 ARG 89 2HH2 ARG 89 2.241 18.712 12.130
651 H LEU 90 H LEU 90 2.570 14.586 5.304
652 HA LEU 90 HA LEU 90 5.344 14.765 4.469
653 HB2 LEU 90 2HB LEU 90 4.699 14.421 2.117
654 HB3 LEU 90 1HB LEU 90 4.385 13.015 3.091
655 HG LEU 90 HG LEU 90 2.220 14.953 2.213
656 HD11 LEU 90 1HD1 LEU 90 3.309 13.940 0.277
657 HD12 LEU 90 2HD1 LEU 90 1.683 13.290 0.501
658 HD13 LEU 90 3HD1 LEU 90 3.086 12.340 0.981
659 HD21 LEU 90 3HD2 LEU 90 1.626 13.543 4.155
660 HD22 LEU 90 1HD2 LEU 90 2.079 12.106 3.239
661 HD23 LEU 90 2HD2 LEU 90 0.710 13.087 2.720
662 H GLY 91 H GLY 91 5.648 16.533 2.845
663 HA2 GLY 91 2HA GLY 91 4.974 18.987 3.784
664 HA3 GLY 91 1HA GLY 91 5.322 18.679 2.091
665 H HIS 92 H HIS 92 3.095 19.769 4.270
666 HA HIS 92 HA HIS 92 1.109 20.738 4.143
667 HB2 HIS 92 2HB HIS 92 1.351 20.266 1.179
668 HB3 HIS 92 1HB HIS 92 -0.013 21.100 1.908
669 HD1 HIS 92 1HD HIS 92 0.263 23.584 2.155
670 HD2 HIS 92 2HD HIS 92 3.896 21.624 1.709
671 HE1 HIS 92 1HE HIS 92 1.994 25.379 1.899
672 H SER 93 H SER 93 1.384 17.541 4.024
673 HA SER 93 HA SER 93 -1.498 17.229 4.143
674 HB2 SER 93 2HB SER 93 -0.854 16.870 1.747
675 HB3 SER 93 1HB SER 93 0.182 15.544 2.265
676 HG SER 93 HG SER 93 -2.462 15.590 1.811
677 H GLU 94 H GLU 94 -2.096 15.033 4.974
678 HA GLU 94 HA GLU 94 -0.007 13.505 6.172
679 HB2 GLU 94 2HB GLU 94 -0.990 13.533 8.441
680 HB3 GLU 94 1HB GLU 94 -0.410 15.115 7.958
681 HG2 GLU 94 2HG GLU 94 -2.782 15.708 7.406
682 HG3 GLU 94 1HG GLU 94 -3.258 14.175 8.133
683 H ILE 95 H ILE 95 -0.462 11.462 6.063
684 HA ILE 95 HA ILE 95 -3.185 10.737 5.308
685 HB ILE 95 HB ILE 95 -1.630 10.913 3.359
686 HG12 ILE 95 2HG1 ILE 95 -1.987 8.554 2.498
687 HG13 ILE 95 1HG1 ILE 95 -2.754 8.251 4.063
688 HG21 ILE 95 1HG2 ILE 95 0.123 9.295 2.991
689 HG22 ILE 95 2HG2 ILE 95 -0.154 8.637 4.599
690 HG23 ILE 95 3HG2 ILE 95 0.446 10.291 4.416
691 HD11 ILE 95 3HD1 ILE 95 -4.423 8.804 2.430
692 HD12 ILE 95 1HD1 ILE 95 -3.577 10.305 2.042
693 HD13 ILE 95 2HD1 ILE 95 -4.297 10.078 3.632
694 H ILE 96 H ILE 96 -3.934 8.837 6.251
695 HA ILE 96 HA ILE 96 -2.100 7.591 8.169
696 HB ILE 96 HB ILE 96 -5.146 7.662 8.253
697 HG12 ILE 96 2HG1 ILE 96 -4.721 8.939 10.457
698 HG13 ILE 96 1HG1 ILE 96 -3.091 9.192 9.862
699 HG21 ILE 96 1HG2 ILE 96 -4.951 6.642 10.476
700 HG22 ILE 96 2HG2 ILE 96 -3.209 6.495 10.242
701 HG23 ILE 96 3HG2 ILE 96 -4.319 5.603 9.198
702 HD11 ILE 96 3HD1 ILE 96 -4.497 11.134 9.469
703 HD12 ILE 96 1HD1 ILE 96 -5.633 10.148 8.547
704 HD13 ILE 96 2HD1 ILE 96 -3.996 10.413 7.942
705 H VAL 97 H VAL 97 -1.560 5.544 7.825
706 HA VAL 97 HA VAL 97 -2.758 4.189 5.554
707 HB VAL 97 HB VAL 97 -0.286 3.612 7.201
708 HG11 VAL 97 1HG1 VAL 97 -1.291 1.488 6.493
709 HG12 VAL 97 2HG1 VAL 97 0.193 1.809 5.591
710 HG13 VAL 97 3HG1 VAL 97 -1.378 2.077 4.834
711 HG21 VAL 97 3HG2 VAL 97 -0.673 4.368 4.325
712 HG22 VAL 97 1HG2 VAL 97 0.871 4.144 5.143
713 HG23 VAL 97 2HG2 VAL 97 -0.195 5.484 5.607
714 H ARG 98 H ARG 98 -4.352 2.732 5.792
715 HA ARG 98 HA ARG 98 -4.402 1.191 8.266
716 HB2 ARG 98 2HB ARG 98 -6.745 1.972 6.533
717 HB3 ARG 98 1HB ARG 98 -6.800 0.994 7.985
718 HG2 ARG 98 2HG ARG 98 -6.081 3.873 7.763
719 HG3 ARG 98 1HG ARG 98 -7.585 3.248 8.456
720 HD2 ARG 98 2HD ARG 98 -4.767 3.093 9.535
721 HD3 ARG 98 1HD ARG 98 -6.153 3.883 10.270
722 HE ARG 98 HE ARG 98 -5.579 1.013 10.177
723 HH11 ARG 98 1HH1 ARG 98 -7.769 3.543 11.289
724 HH12 ARG 98 2HH1 ARG 98 -8.369 2.640 12.602
725 HH21 ARG 98 1HH2 ARG 98 -6.275 -0.153 11.992
726 HH22 ARG 98 2HH2 ARG 98 -7.480 0.466 13.040
727 H MET 99 H MET 99 -5.030 -0.904 8.045
728 HA MET 99 HA MET 99 -4.809 -1.952 5.306
729 HB2 MET 99 2HB MET 99 -3.458 -3.118 7.740
730 HB3 MET 99 1HB MET 99 -3.583 -3.941 6.197
731 HG2 MET 99 2HG MET 99 -2.343 -2.077 5.148
732 HG3 MET 99 1HG MET 99 -2.146 -1.356 6.740
733 HE1 MET 99 3HE MET 99 1.437 -2.687 5.863
734 HE2 MET 99 1HE MET 99 0.476 -1.275 6.300
735 HE3 MET 99 2HE MET 99 0.253 -2.042 4.729
736 H HIS 100 H HIS 100 -5.938 -3.710 4.776
737 HA HIS 100 HA HIS 100 -8.099 -4.449 6.603
738 HB2 HIS 100 2HB HIS 100 -7.890 -4.848 3.598
739 HB3 HIS 100 1HB HIS 100 -9.260 -5.294 4.590
740 HD1 HIS 100 1HD HIS 100 -11.141 -3.666 4.163
741 HD2 HIS 100 2HD HIS 100 -7.432 -1.794 4.157
742 HE1 HIS 100 1HE HIS 100 -11.581 -1.248 3.677
Start of MODEL 22
1 H1 GLY 1 1HT GLY 1 -10.228 -19.128 2.966
2 H2 GLY 1 2HT GLY 1 -10.042 -20.785 3.137
3 H3 GLY 1 3HT GLY 1 -11.580 -20.134 2.847
4 HA2 GLY 1 1HA GLY 1 -10.691 -21.083 0.803
5 HA3 GLY 1 2HA GLY 1 -10.837 -19.336 0.700
6 H HIS 2 H HIS 2 -8.794 -21.877 0.141
7 HA HIS 2 HA HIS 2 -6.315 -20.865 0.963
8 HB2 HIS 2 2HB HIS 2 -5.259 -22.471 -0.584
9 HB3 HIS 2 1HB HIS 2 -6.562 -23.229 0.310
10 HD1 HIS 2 1HD HIS 2 -5.329 -22.658 -3.107
11 HD2 HIS 2 2HD HIS 2 -8.934 -23.671 -1.309
12 HE1 HIS 2 1HE HIS 2 -6.781 -23.615 -4.933
13 H GLY 3 H GLY 3 -5.327 -19.100 0.421
14 HA2 GLY 3 2HA GLY 3 -4.173 -17.818 -1.228
15 HA3 GLY 3 1HA GLY 3 -5.447 -18.218 -2.374
16 H SER 4 H SER 4 -7.414 -17.736 -0.080
17 HA SER 4 HA SER 4 -7.735 -14.942 -0.666
18 HB2 SER 4 2HB SER 4 -9.504 -16.827 0.913
19 HB3 SER 4 1HB SER 4 -9.937 -15.196 0.397
20 HG SER 4 HG SER 4 -9.589 -15.914 -1.761
21 H ALA 5 H ALA 5 -5.757 -14.559 0.418
22 HA ALA 5 HA ALA 5 -6.171 -13.590 3.084
23 HB1 ALA 5 1HB ALA 5 -3.948 -15.504 2.341
24 HB2 ALA 5 2HB ALA 5 -5.234 -15.812 3.515
25 HB3 ALA 5 3HB ALA 5 -4.016 -14.577 3.839
26 H GLY 6 H GLY 6 -4.260 -12.139 3.544
27 HA2 GLY 6 2HA GLY 6 -2.275 -11.252 2.170
28 HA3 GLY 6 1HA GLY 6 -3.572 -10.822 1.048
29 H THR 7 H THR 7 -2.874 -8.622 1.469
30 HA THR 7 HA THR 7 -4.296 -7.587 3.770
31 HB THR 7 HB THR 7 -1.410 -6.961 3.117
32 HG1 THR 7 1HG THR 7 -2.740 -8.272 5.232
33 HG21 THR 7 3HG2 THR 7 -1.503 -5.417 5.044
34 HG22 THR 7 1HG2 THR 7 -3.237 -5.728 5.180
35 HG23 THR 7 2HG2 THR 7 -2.588 -4.922 3.745
36 H SER 8 H SER 8 -5.691 -6.144 2.960
37 HA SER 8 HA SER 8 -4.996 -4.713 0.522
38 HB2 SER 8 2HB SER 8 -7.509 -4.575 2.205
39 HB3 SER 8 1HB SER 8 -7.308 -3.985 0.557
40 HG SER 8 HG SER 8 -6.714 -6.660 0.955
41 H VAL 9 H VAL 9 -3.916 -2.840 0.796
42 HA VAL 9 HA VAL 9 -4.240 -1.530 3.376
43 HB VAL 9 HB VAL 9 -1.951 -2.224 3.171
44 HG11 VAL 9 1HG1 VAL 9 -0.487 -1.490 1.341
45 HG12 VAL 9 2HG1 VAL 9 -1.929 -0.868 0.521
46 HG13 VAL 9 3HG1 VAL 9 -1.772 -2.592 0.844
47 HG21 VAL 9 3HG2 VAL 9 -0.729 -0.092 3.269
48 HG22 VAL 9 1HG2 VAL 9 -2.240 -0.044 4.177
49 HG23 VAL 9 2HG2 VAL 9 -2.140 0.724 2.595
50 H THR 10 H THR 10 -5.112 0.305 3.520
51 HA THR 10 HA THR 10 -5.803 1.726 1.061
52 HB THR 10 HB THR 10 -7.497 1.385 3.540
53 HG1 THR 10 1HG THR 10 -6.828 -0.474 2.044
54 HG21 THR 10 3HG2 THR 10 -9.324 2.086 2.046
55 HG22 THR 10 1HG2 THR 10 -8.186 2.220 0.703
56 HG23 THR 10 2HG2 THR 10 -8.054 3.310 2.079
57 H LEU 11 H LEU 11 -5.539 3.886 1.152
58 HA LEU 11 HA LEU 11 -4.405 4.963 3.596
59 HB2 LEU 11 2HB LEU 11 -3.542 6.801 2.180
60 HB3 LEU 11 1HB LEU 11 -3.005 5.237 1.650
61 HG LEU 11 HG LEU 11 -4.903 5.409 -0.110
62 HD11 LEU 11 1HD1 LEU 11 -5.479 7.656 -0.853
63 HD12 LEU 11 2HD1 LEU 11 -4.572 8.341 0.473
64 HD13 LEU 11 3HD1 LEU 11 -6.023 7.391 0.808
65 HD21 LEU 11 3HD2 LEU 11 -2.554 5.415 -0.667
66 HD22 LEU 11 1HD2 LEU 11 -2.443 7.132 -0.286
67 HD23 LEU 11 2HD2 LEU 11 -3.413 6.595 -1.657
68 H GLN 12 H GLN 12 -5.336 6.559 4.704
69 HA GLN 12 HA GLN 12 -8.011 7.456 3.838
70 HB2 GLN 12 2HB GLN 12 -7.656 5.999 5.996
71 HB3 GLN 12 1HB GLN 12 -6.968 7.452 6.671
72 HG2 GLN 12 2HG GLN 12 -9.806 7.186 5.670
73 HG3 GLN 12 1HG GLN 12 -9.309 7.114 7.350
74 HE21 GLN 12 1HE2 GLN 12 -8.630 9.018 8.343
75 HE22 GLN 12 2HE2 GLN 12 -9.026 10.579 7.713
76 H LEU 13 H LEU 13 -7.978 9.499 3.244
77 HA LEU 13 HA LEU 13 -5.737 11.228 4.042
78 HB2 LEU 13 2HB LEU 13 -5.812 10.831 1.698
79 HB3 LEU 13 1HB LEU 13 -7.525 11.185 1.632
80 HG LEU 13 HG LEU 13 -6.985 13.504 2.334
81 HD11 LEU 13 1HD1 LEU 13 -4.827 13.198 3.291
82 HD12 LEU 13 2HD1 LEU 13 -4.720 14.343 1.956
83 HD13 LEU 13 3HD1 LEU 13 -4.153 12.682 1.742
84 HD21 LEU 13 3HD2 LEU 13 -7.549 13.005 0.078
85 HD22 LEU 13 1HD2 LEU 13 -5.881 12.545 -0.298
86 HD23 LEU 13 2HD2 LEU 13 -6.278 14.223 0.110
87 H ASP 14 H ASP 14 -6.139 13.071 5.134
88 HA ASP 14 HA ASP 14 -8.854 13.775 5.754
89 HB2 ASP 14 2HB ASP 14 -7.149 14.315 7.450
90 HB3 ASP 14 1HB ASP 14 -6.270 15.292 6.269
91 H ASP 15 H ASP 15 -9.834 14.243 4.079
92 HA ASP 15 HA ASP 15 -8.735 16.161 2.220
93 HB2 ASP 15 2HB ASP 15 -9.106 14.039 1.245
94 HB3 ASP 15 1HB ASP 15 -10.716 13.918 1.922
95 H GLY 16 H GLY 16 -10.530 16.245 4.787
96 HA2 GLY 16 2HA GLY 16 -11.829 18.370 5.079
97 HA3 GLY 16 1HA GLY 16 -12.790 17.793 3.714
98 H SER 17 H SER 17 -13.084 15.225 4.156
99 HA SER 17 HA SER 17 -14.149 14.970 6.875
100 HB2 SER 17 2HB SER 17 -15.421 13.826 4.376
101 HB3 SER 17 1HB SER 17 -16.066 13.751 6.019
102 HG SER 17 HG SER 17 -15.673 16.011 4.392
103 H GLY 18 H GLY 18 -12.879 13.327 3.975
104 HA2 GLY 18 2HA GLY 18 -10.910 11.940 4.771
105 HA3 GLY 18 1HA GLY 18 -12.151 11.085 5.679
106 H ARG 19 H ARG 19 -10.422 11.106 2.942
107 HA ARG 19 HA ARG 19 -12.374 9.345 1.628
108 HB2 ARG 19 2HB ARG 19 -10.377 11.174 0.333
109 HB3 ARG 19 1HB ARG 19 -10.983 9.725 -0.460
110 HG2 ARG 19 2HG ARG 19 -13.288 10.629 -0.221
111 HG3 ARG 19 1HG ARG 19 -12.595 12.114 0.436
112 HD2 ARG 19 2HD ARG 19 -11.916 10.976 -2.282
113 HD3 ARG 19 1HD ARG 19 -13.115 12.233 -2.010
114 HE ARG 19 HE ARG 19 -11.366 13.625 -1.166
115 HH11 ARG 19 1HH1 ARG 19 -10.230 10.807 -3.066
116 HH12 ARG 19 2HH1 ARG 19 -8.788 11.579 -3.546
117 HH21 ARG 19 1HH2 ARG 19 -9.370 14.588 -1.844
118 HH22 ARG 19 2HH2 ARG 19 -8.288 13.750 -2.875
119 H THR 20 H THR 20 -11.469 7.575 0.437
120 HA THR 20 HA THR 20 -8.914 6.734 1.560
121 HB THR 20 HB THR 20 -9.883 4.399 1.658
122 HG1 THR 20 1HG THR 20 -12.141 5.881 0.933
123 HG21 THR 20 3HG2 THR 20 -9.604 5.738 3.688
124 HG22 THR 20 1HG2 THR 20 -11.090 4.782 3.783
125 HG23 THR 20 2HG2 THR 20 -11.163 6.506 3.394
126 H TYR 21 H TYR 21 -7.735 5.318 0.286
127 HA TYR 21 HA TYR 21 -8.678 4.612 -2.380
128 HB2 TYR 21 2HB TYR 21 -7.499 6.856 -2.563
129 HB3 TYR 21 1HB TYR 21 -6.069 6.081 -1.898
130 HD1 TYR 21 1HD TYR 21 -8.220 6.400 -4.834
131 HD2 TYR 21 2HD TYR 21 -4.701 4.599 -3.264
132 HE1 TYR 21 1HE TYR 21 -7.508 5.823 -7.101
133 HE2 TYR 21 2HE TYR 21 -3.981 4.012 -5.541
134 HH TYR 21 HH TYR 21 -5.151 3.598 -7.752
135 H GLN 22 H GLN 22 -7.929 2.567 -2.827
136 HA GLN 22 HA GLN 22 -6.217 1.419 -0.783
137 HB2 GLN 22 2HB GLN 22 -8.392 0.334 -1.543
138 HB3 GLN 22 1HB GLN 22 -7.558 -0.061 -3.041
139 HG2 GLN 22 2HG GLN 22 -5.898 -1.340 -1.783
140 HG3 GLN 22 1HG GLN 22 -6.729 -0.944 -0.282
141 HE21 GLN 22 1HE2 GLN 22 -6.708 -2.881 -3.092
142 HE22 GLN 22 2HE2 GLN 22 -8.038 -3.897 -2.679
143 H LEU 23 H LEU 23 -4.194 0.821 -1.103
144 HA LEU 23 HA LEU 23 -2.780 1.724 -3.399
145 HB2 LEU 23 2HB LEU 23 -1.980 -0.121 -1.183
146 HB3 LEU 23 1HB LEU 23 -0.862 0.541 -2.331
147 HG LEU 23 HG LEU 23 -2.439 2.139 -0.292
148 HD11 LEU 23 1HD1 LEU 23 -0.231 2.523 0.729
149 HD12 LEU 23 2HD1 LEU 23 0.462 1.367 -0.418
150 HD13 LEU 23 3HD1 LEU 23 -0.721 0.832 0.766
151 HD21 LEU 23 3HD2 LEU 23 -0.310 3.006 -2.237
152 HD22 LEU 23 1HD2 LEU 23 -0.992 4.010 -0.969
153 HD23 LEU 23 2HD2 LEU 23 -2.014 3.463 -2.300
154 H ARG 24 H ARG 24 -1.765 0.439 -4.970
155 HA ARG 24 HA ARG 24 -2.943 -2.226 -5.232
156 HB2 ARG 24 2HB ARG 24 -2.268 -0.306 -7.473
157 HB3 ARG 24 1HB ARG 24 -2.982 -1.904 -7.645
158 HG2 ARG 24 2HG ARG 24 -4.265 0.479 -6.317
159 HG3 ARG 24 1HG ARG 24 -4.676 -0.190 -7.900
160 HD2 ARG 24 2HD ARG 24 -5.424 -2.252 -6.873
161 HD3 ARG 24 1HD ARG 24 -4.891 -1.691 -5.289
162 HE ARG 24 HE ARG 24 -6.581 0.212 -5.979
163 HH11 ARG 24 1HH1 ARG 24 -6.948 -3.315 -6.125
164 HH12 ARG 24 2HH1 ARG 24 -8.606 -3.302 -5.801
165 HH21 ARG 24 1HH2 ARG 24 -8.838 0.242 -5.530
166 HH22 ARG 24 2HH2 ARG 24 -9.727 -1.214 -5.438
167 H GLU 25 H GLU 25 -1.677 -3.764 -6.153
168 HA GLU 25 HA GLU 25 0.921 -3.867 -5.307
169 HB2 GLU 25 2HB GLU 25 1.126 -5.876 -6.779
170 HB3 GLU 25 1HB GLU 25 -0.230 -5.890 -5.666
171 HG2 GLU 25 2HG GLU 25 -1.711 -5.234 -7.525
172 HG3 GLU 25 1HG GLU 25 -0.331 -5.312 -8.620
173 H GLY 26 H GLY 26 2.629 -2.990 -5.861
174 HA2 GLY 26 2HA GLY 26 4.253 -2.691 -7.742
175 HA3 GLY 26 1HA GLY 26 2.933 -1.797 -8.520
176 H SER 27 H SER 27 4.786 -0.061 -8.272
177 HA SER 27 HA SER 27 4.406 1.023 -5.633
178 HB2 SER 27 2HB SER 27 6.454 2.396 -6.122
179 HB3 SER 27 1HB SER 27 6.717 0.662 -6.011
180 HG SER 27 HG SER 27 7.685 1.850 -7.872
181 H ASN 28 H ASN 28 3.561 2.943 -5.331
182 HA ASN 28 HA ASN 28 2.577 4.284 -7.725
183 HB2 ASN 28 2HB ASN 28 0.832 5.309 -6.250
184 HB3 ASN 28 1HB ASN 28 0.682 3.560 -6.409
185 HD21 ASN 28 1HD2 ASN 28 1.244 2.267 -4.597
186 HD22 ASN 28 2HD2 ASN 28 1.290 2.958 -3.016
187 H ILE 29 H ILE 29 3.364 6.113 -8.208
188 HA ILE 29 HA ILE 29 5.293 7.317 -6.424
189 HB ILE 29 HB ILE 29 4.526 8.158 -9.226
190 HG12 ILE 29 2HG1 ILE 29 5.231 5.825 -9.325
191 HG13 ILE 29 1HG1 ILE 29 6.467 6.854 -10.036
192 HG21 ILE 29 1HG2 ILE 29 5.763 9.846 -7.978
193 HG22 ILE 29 2HG2 ILE 29 6.745 9.189 -9.283
194 HG23 ILE 29 3HG2 ILE 29 7.031 8.670 -7.620
195 HD11 ILE 29 3HD1 ILE 29 7.788 6.652 -7.990
196 HD12 ILE 29 1HD1 ILE 29 7.443 5.077 -8.702
197 HD13 ILE 29 2HD1 ILE 29 6.543 5.618 -7.288
198 H ILE 30 H ILE 30 4.737 8.933 -5.145
199 HA ILE 30 HA ILE 30 2.331 10.478 -5.707
200 HB ILE 30 HB ILE 30 3.879 10.074 -3.109
201 HG12 ILE 30 2HG1 ILE 30 1.094 9.184 -3.893
202 HG13 ILE 30 1HG1 ILE 30 2.506 8.136 -3.797
203 HG21 ILE 30 1HG2 ILE 30 3.070 12.315 -3.135
204 HG22 ILE 30 2HG2 ILE 30 2.128 11.355 -1.996
205 HG23 ILE 30 3HG2 ILE 30 1.452 11.778 -3.565
206 HD11 ILE 30 3HD1 ILE 30 2.628 8.542 -1.399
207 HD12 ILE 30 1HD1 ILE 30 1.055 7.898 -1.862
208 HD13 ILE 30 2HD1 ILE 30 1.235 9.619 -1.504
209 H GLY 31 H GLY 31 2.575 12.471 -6.358
210 HA2 GLY 31 2HA GLY 31 4.191 14.424 -5.416
211 HA3 GLY 31 1HA GLY 31 5.166 13.643 -6.670
212 H ARG 32 H ARG 32 4.996 15.738 -7.746
213 HA ARG 32 HA ARG 32 2.505 15.757 -9.326
214 HB2 ARG 32 2HB ARG 32 4.146 18.170 -8.523
215 HB3 ARG 32 1HB ARG 32 2.676 18.182 -9.489
216 HG2 ARG 32 2HG ARG 32 1.409 17.364 -7.552
217 HG3 ARG 32 1HG ARG 32 2.893 17.337 -6.623
218 HD2 ARG 32 2HD ARG 32 1.625 19.359 -6.145
219 HD3 ARG 32 1HD ARG 32 3.180 19.713 -6.886
220 HE ARG 32 HE ARG 32 0.948 19.541 -8.697
221 HH11 ARG 32 1HH1 ARG 32 3.026 21.648 -6.760
222 HH12 ARG 32 2HH1 ARG 32 2.561 23.080 -7.557
223 HH21 ARG 32 1HH2 ARG 32 0.304 21.542 -9.786
224 HH22 ARG 32 2HH2 ARG 32 0.987 23.024 -9.276
225 H GLY 33 H GLY 33 3.204 14.855 -11.196
226 HA2 GLY 33 2HA GLY 33 4.872 16.198 -12.918
227 HA3 GLY 33 1HA GLY 33 5.821 14.952 -12.113
228 H GLN 34 H GLN 34 5.964 14.163 -14.304
229 HA GLN 34 HA GLN 34 3.637 12.955 -15.491
230 HB2 GLN 34 2HB GLN 34 6.563 12.516 -16.139
231 HB3 GLN 34 1HB GLN 34 5.202 12.047 -17.142
232 HG2 GLN 34 2HG GLN 34 6.053 14.861 -16.483
233 HG3 GLN 34 1HG GLN 34 6.284 14.032 -18.017
234 HE21 GLN 34 1HE2 GLN 34 4.932 16.515 -17.462
235 HE22 GLN 34 2HE2 GLN 34 3.308 16.329 -18.016
236 H ASP 35 H ASP 35 6.422 11.967 -13.606
237 HA ASP 35 HA ASP 35 6.192 9.147 -13.699
238 HB2 ASP 35 2HB ASP 35 7.224 10.811 -11.393
239 HB3 ASP 35 1HB ASP 35 7.619 9.142 -11.748
240 H ALA 36 H ALA 36 4.903 11.628 -11.699
241 HA ALA 36 HA ALA 36 3.974 10.109 -9.555
242 HB1 ALA 36 1HB ALA 36 2.995 12.775 -10.526
243 HB2 ALA 36 2HB ALA 36 4.382 12.496 -9.473
244 HB3 ALA 36 3HB ALA 36 2.757 12.089 -8.914
245 H GLN 37 H GLN 37 2.460 8.716 -9.492
246 HA GLN 37 HA GLN 37 0.391 8.545 -11.524
247 HB2 GLN 37 2HB GLN 37 0.878 6.777 -9.118
248 HB3 GLN 37 1HB GLN 37 -0.084 6.409 -10.535
249 HG2 GLN 37 2HG GLN 37 2.914 6.733 -10.482
250 HG3 GLN 37 1HG GLN 37 2.041 5.209 -10.497
251 HE21 GLN 37 1HE2 GLN 37 3.031 4.551 -12.356
252 HE22 GLN 37 2HE2 GLN 37 2.699 5.189 -13.911
253 H PHE 38 H PHE 38 0.948 9.100 -8.136
254 HA PHE 38 HA PHE 38 -1.825 9.892 -7.701
255 HB2 PHE 38 2HB PHE 38 -0.903 8.099 -6.222
256 HB3 PHE 38 1HB PHE 38 0.403 9.177 -5.770
257 HD1 PHE 38 1HD PHE 38 -0.174 11.264 -4.476
258 HD2 PHE 38 2HD PHE 38 -2.960 8.123 -5.089
259 HE1 PHE 38 1HE PHE 38 -1.420 12.038 -2.553
260 HE2 PHE 38 2HE PHE 38 -4.276 8.913 -3.160
261 HZ PHE 38 HZ PHE 38 -3.514 10.876 -1.877
262 H ARG 39 H ARG 39 -2.025 12.018 -7.814
263 HA ARG 39 HA ARG 39 0.413 13.597 -7.672
264 HB2 ARG 39 2HB ARG 39 -2.111 14.060 -9.264
265 HB3 ARG 39 1HB ARG 39 -0.709 15.135 -9.244
266 HG2 ARG 39 2HG ARG 39 0.698 13.461 -10.189
267 HG3 ARG 39 1HG ARG 39 -0.540 12.231 -10.007
268 HD2 ARG 39 2HD ARG 39 -1.905 13.451 -11.682
269 HD3 ARG 39 1HD ARG 39 -0.564 14.576 -11.907
270 HE ARG 39 HE ARG 39 0.635 12.203 -12.227
271 HH11 ARG 39 1HH1 ARG 39 -2.256 13.529 -13.819
272 HH12 ARG 39 2HH1 ARG 39 -2.039 12.559 -15.207
273 HH21 ARG 39 1HH2 ARG 39 0.876 10.938 -14.116
274 HH22 ARG 39 2HH2 ARG 39 -0.254 11.087 -15.395
275 H LEU 40 H LEU 40 0.566 15.201 -6.340
276 HA LEU 40 HA LEU 40 -1.517 15.474 -4.361
277 HB2 LEU 40 2HB LEU 40 1.272 16.600 -4.475
278 HB3 LEU 40 1HB LEU 40 0.151 16.960 -3.185
279 HG LEU 40 HG LEU 40 1.221 14.215 -3.859
280 HD11 LEU 40 1HD1 LEU 40 1.799 16.047 -1.541
281 HD12 LEU 40 2HD1 LEU 40 2.907 15.659 -2.857
282 HD13 LEU 40 3HD1 LEU 40 2.392 14.402 -1.737
283 HD21 LEU 40 3HD2 LEU 40 0.141 13.536 -1.758
284 HD22 LEU 40 1HD2 LEU 40 -1.034 14.077 -2.956
285 HD23 LEU 40 2HD2 LEU 40 -0.580 15.140 -1.625
286 HA PRO 41 HA PRO 41 -3.042 19.256 -6.014
287 HB2 PRO 41 2HB PRO 41 -4.789 19.887 -4.135
288 HB3 PRO 41 1HB PRO 41 -4.979 18.405 -5.080
289 HG2 PRO 41 2HG PRO 41 -3.945 18.750 -2.294
290 HG3 PRO 41 1HG PRO 41 -5.003 17.485 -2.943
291 HD2 PRO 41 2HD PRO 41 -2.250 17.241 -2.571
292 HD3 PRO 41 1HD PRO 41 -3.232 16.221 -3.631
293 H ASP 42 H ASP 42 -0.749 19.340 -3.626
294 HA ASP 42 HA ASP 42 -1.118 22.246 -3.286
295 HB2 ASP 42 2HB ASP 42 -1.317 20.636 -1.153
296 HB3 ASP 42 1HB ASP 42 0.445 20.736 -1.247
297 H THR 43 H THR 43 1.304 22.971 -2.285
298 HA THR 43 HA THR 43 2.978 22.294 -4.580
299 HB THR 43 HB THR 43 2.198 24.656 -4.499
300 HG1 THR 43 1HG THR 43 4.781 25.253 -4.054
301 HG21 THR 43 3HG2 THR 43 2.098 24.896 -2.053
302 HG22 THR 43 1HG2 THR 43 3.068 26.183 -2.772
303 HG23 THR 43 2HG2 THR 43 3.851 24.815 -1.980
304 H GLY 44 H GLY 44 5.438 22.910 -3.997
305 HA2 GLY 44 2HA GLY 44 7.292 22.570 -2.622
306 HA3 GLY 44 1HA GLY 44 6.207 22.053 -1.336
307 H VAL 45 H VAL 45 5.403 20.637 -4.165
308 HA VAL 45 HA VAL 45 6.533 18.102 -3.254
309 HB VAL 45 HB VAL 45 4.259 18.528 -5.192
310 HG11 VAL 45 1HG1 VAL 45 3.701 16.254 -4.709
311 HG12 VAL 45 2HG1 VAL 45 5.094 16.123 -3.631
312 HG13 VAL 45 3HG1 VAL 45 5.333 16.393 -5.362
313 HG21 VAL 45 3HG2 VAL 45 2.745 18.027 -3.368
314 HG22 VAL 45 1HG2 VAL 45 3.665 19.501 -3.039
315 HG23 VAL 45 2HG2 VAL 45 4.106 17.985 -2.240
316 H SER 46 H SER 46 7.993 17.133 -4.483
317 HA SER 46 HA SER 46 8.878 18.249 -6.962
318 HB2 SER 46 2HB SER 46 10.432 17.267 -5.272
319 HB3 SER 46 1HB SER 46 9.681 15.694 -5.517
320 HG SER 46 HG SER 46 11.674 16.084 -6.675
321 H ARG 47 H ARG 47 9.330 16.421 -8.722
322 HA ARG 47 HA ARG 47 6.788 15.554 -9.676
323 HB2 ARG 47 2HB ARG 47 8.084 14.448 -11.519
324 HB3 ARG 47 1HB ARG 47 8.403 16.161 -11.327
325 HG2 ARG 47 2HG ARG 47 10.468 15.605 -10.090
326 HG3 ARG 47 1HG ARG 47 10.145 13.901 -10.398
327 HD2 ARG 47 2HD ARG 47 10.492 15.997 -12.528
328 HD3 ARG 47 1HD ARG 47 11.782 14.926 -11.979
329 HE ARG 47 HE ARG 47 9.566 13.382 -12.801
330 HH11 ARG 47 1HH1 ARG 47 12.101 15.397 -14.256
331 HH12 ARG 47 2HH1 ARG 47 12.049 14.589 -15.749
332 HH21 ARG 47 1HH2 ARG 47 9.541 12.299 -14.700
333 HH22 ARG 47 2HH2 ARG 47 10.524 12.711 -16.051
334 H ARG 48 H ARG 48 9.376 14.078 -7.982
335 HA ARG 48 HA ARG 48 7.633 11.834 -7.345
336 HB2 ARG 48 2HB ARG 48 10.643 11.647 -7.741
337 HB3 ARG 48 1HB ARG 48 9.579 10.333 -7.266
338 HG2 ARG 48 2HG ARG 48 8.498 10.390 -9.403
339 HG3 ARG 48 1HG ARG 48 9.470 11.757 -9.917
340 HD2 ARG 48 2HD ARG 48 10.560 9.888 -10.875
341 HD3 ARG 48 1HD ARG 48 11.469 10.213 -9.390
342 HE ARG 48 HE ARG 48 10.350 8.399 -8.363
343 HH11 ARG 48 1HH1 ARG 48 9.914 8.516 -11.938
344 HH12 ARG 48 2HH1 ARG 48 9.790 6.829 -12.048
345 HH21 ARG 48 1HH2 ARG 48 10.162 6.110 -8.636
346 HH22 ARG 48 2HH2 ARG 48 9.934 5.449 -10.190
347 H HIS 49 H HIS 49 7.104 12.549 -5.412
348 HA HIS 49 HA HIS 49 9.113 13.809 -3.712
349 HB2 HIS 49 2HB HIS 49 7.110 15.084 -3.838
350 HB3 HIS 49 1HB HIS 49 6.061 13.713 -3.593
351 HD2 HIS 49 2HD HIS 49 6.174 12.734 -0.815
352 HE1 HIS 49 1HE HIS 49 7.315 16.534 0.620
353 HE2 HIS 49 2HE HIS 49 6.825 14.124 1.232
354 H LEU 50 H LEU 50 6.962 11.065 -3.924
355 HA LEU 50 HA LEU 50 8.552 9.561 -2.121
356 HB2 LEU 50 2HB LEU 50 7.342 10.918 -0.526
357 HB3 LEU 50 1HB LEU 50 5.830 10.615 -1.338
358 HG LEU 50 HG LEU 50 7.278 8.317 -0.058
359 HD11 LEU 50 1HD1 LEU 50 7.271 10.160 1.592
360 HD12 LEU 50 2HD1 LEU 50 6.162 8.873 2.053
361 HD13 LEU 50 3HD1 LEU 50 5.538 10.364 1.343
362 HD21 LEU 50 3HD2 LEU 50 5.230 7.939 -1.381
363 HD22 LEU 50 1HD2 LEU 50 4.375 9.088 -0.350
364 HD23 LEU 50 2HD2 LEU 50 4.973 7.576 0.328
365 H GLU 51 H GLU 51 7.825 7.367 -2.159
366 HA GLU 51 HA GLU 51 5.658 6.773 -4.025
367 HB2 GLU 51 2HB GLU 51 6.944 5.007 -5.061
368 HB3 GLU 51 1HB GLU 51 7.748 6.545 -5.311
369 HG2 GLU 51 2HG GLU 51 9.318 5.990 -3.506
370 HG3 GLU 51 1HG GLU 51 8.493 4.457 -3.271
371 H ILE 52 H ILE 52 4.589 4.968 -3.550
372 HA ILE 52 HA ILE 52 5.451 3.577 -1.129
373 HB ILE 52 HB ILE 52 2.632 3.892 -2.191
374 HG12 ILE 52 2HG1 ILE 52 3.922 5.022 0.313
375 HG13 ILE 52 1HG1 ILE 52 3.517 5.945 -1.128
376 HG21 ILE 52 1HG2 ILE 52 1.986 2.722 -0.112
377 HG22 ILE 52 2HG2 ILE 52 3.701 2.475 0.249
378 HG23 ILE 52 3HG2 ILE 52 2.987 1.733 -1.184
379 HD11 ILE 52 3HD1 ILE 52 1.884 6.292 0.630
380 HD12 ILE 52 1HD1 ILE 52 1.554 4.560 0.691
381 HD13 ILE 52 2HD1 ILE 52 1.146 5.487 -0.754
382 H ARG 53 H ARG 53 6.360 1.755 -1.717
383 HA ARG 53 HA ARG 53 5.323 0.432 -4.083
384 HB2 ARG 53 2HB ARG 53 7.780 0.453 -3.963
385 HB3 ARG 53 1HB ARG 53 7.730 -0.342 -2.397
386 HG2 ARG 53 2HG ARG 53 6.564 -2.270 -3.454
387 HG3 ARG 53 1HG ARG 53 6.773 -1.490 -5.009
388 HD2 ARG 53 2HD ARG 53 9.175 -1.678 -4.832
389 HD3 ARG 53 1HD ARG 53 9.036 -2.299 -3.184
390 HE ARG 53 HE ARG 53 7.539 -4.032 -4.543
391 HH11 ARG 53 1HH1 ARG 53 10.863 -2.949 -5.081
392 HH12 ARG 53 2HH1 ARG 53 11.351 -4.384 -5.857
393 HH21 ARG 53 1HH2 ARG 53 8.209 -6.003 -5.579
394 HH22 ARG 53 2HH2 ARG 53 9.809 -6.158 -6.157
395 H TRP 54 H TRP 54 3.730 -0.818 -3.850
396 HA TRP 54 HA TRP 54 3.551 -2.206 -1.337
397 HB2 TRP 54 2HB TRP 54 1.597 -0.868 -1.621
398 HB3 TRP 54 1HB TRP 54 1.436 -1.370 -3.306
399 HD1 TRP 54 HD TRP 54 -0.574 -2.996 -3.529
400 HE1 TRP 54 1HE TRP 54 -1.572 -4.930 -2.132
401 HE3 TRP 54 3HE TRP 54 2.509 -2.793 0.538
402 HZ2 TRP 54 2HZ TRP 54 -1.110 -6.192 0.315
403 HZ3 TRP 54 3HZ TRP 54 2.161 -4.403 2.365
404 HH2 TRP 54 HH TRP 54 0.388 -6.066 2.253
405 H ASP 55 H ASP 55 4.452 -4.063 -1.561
406 HA ASP 55 HA ASP 55 3.902 -5.628 -3.989
407 HB2 ASP 55 2HB ASP 55 6.362 -5.010 -3.303
408 HB3 ASP 55 1HB ASP 55 6.135 -6.204 -2.032
409 H GLY 56 H GLY 56 3.991 -8.088 -3.231
410 HA2 GLY 56 2HA GLY 56 1.893 -8.217 -1.240
411 HA3 GLY 56 1HA GLY 56 2.460 -9.554 -2.219
412 H GLN 57 H GLN 57 3.697 -7.382 0.251
413 HA GLN 57 HA GLN 57 4.280 -9.522 2.063
414 HB2 GLN 57 2HB GLN 57 6.247 -9.623 0.492
415 HB3 GLN 57 1HB GLN 57 6.649 -7.979 0.960
416 HG2 GLN 57 2HG GLN 57 8.052 -9.459 2.195
417 HG3 GLN 57 1HG GLN 57 6.876 -8.773 3.309
418 HE21 GLN 57 1HE2 GLN 57 5.308 -10.129 4.239
419 HE22 GLN 57 2HE2 GLN 57 5.403 -11.844 4.095
420 H VAL 58 H VAL 58 5.674 -6.289 1.386
421 HA VAL 58 HA VAL 58 4.372 -5.249 3.763
422 HB VAL 58 HB VAL 58 6.461 -4.032 4.427
423 HG11 VAL 58 1HG1 VAL 58 6.706 -7.031 4.500
424 HG12 VAL 58 2HG1 VAL 58 5.837 -6.025 5.653
425 HG13 VAL 58 3HG1 VAL 58 7.592 -5.905 5.527
426 HG21 VAL 58 3HG2 VAL 58 7.820 -5.877 2.455
427 HG22 VAL 58 1HG2 VAL 58 8.643 -4.825 3.609
428 HG23 VAL 58 2HG2 VAL 58 7.671 -4.126 2.315
429 H ALA 59 H ALA 59 4.310 -2.954 3.792
430 HA ALA 59 HA ALA 59 4.184 -1.815 1.113
431 HB1 ALA 59 1HB ALA 59 2.165 -1.628 2.488
432 HB2 ALA 59 2HB ALA 59 2.859 -0.031 2.198
433 HB3 ALA 59 3HB ALA 59 3.100 -0.837 3.753
434 H LEU 60 H LEU 60 5.962 -0.957 0.508
435 HA LEU 60 HA LEU 60 7.883 0.012 2.444
436 HB2 LEU 60 2HB LEU 60 8.404 -1.615 0.608
437 HB3 LEU 60 1HB LEU 60 8.060 -0.349 -0.534
438 HG LEU 60 HG LEU 60 10.340 -0.252 1.459
439 HD11 LEU 60 1HD1 LEU 60 10.276 -1.046 -1.441
440 HD12 LEU 60 2HD1 LEU 60 10.566 -2.118 -0.078
441 HD13 LEU 60 3HD1 LEU 60 11.733 -0.844 -0.467
442 HD21 LEU 60 3HD2 LEU 60 11.226 1.485 -0.028
443 HD22 LEU 60 1HD2 LEU 60 9.639 1.950 0.598
444 HD23 LEU 60 2HD2 LEU 60 9.787 1.343 -1.048
445 H LEU 61 H LEU 61 7.767 2.035 2.965
446 HA LEU 61 HA LEU 61 6.620 4.041 1.194
447 HB2 LEU 61 2HB LEU 61 5.786 3.776 3.472
448 HB3 LEU 61 1HB LEU 61 7.357 3.997 4.160
449 HG LEU 61 HG LEU 61 5.918 5.924 4.535
450 HD11 LEU 61 1HD1 LEU 61 7.229 7.771 3.671
451 HD12 LEU 61 2HD1 LEU 61 8.046 6.672 2.560
452 HD13 LEU 61 3HD1 LEU 61 8.248 6.475 4.300
453 HD21 LEU 61 3HD2 LEU 61 5.704 6.123 1.553
454 HD22 LEU 61 1HD2 LEU 61 5.031 7.270 2.711
455 HD23 LEU 61 2HD2 LEU 61 4.423 5.615 2.654
456 H ALA 62 H ALA 62 8.103 5.089 -0.048
457 HA ALA 62 HA ALA 62 10.760 5.538 1.110
458 HB1 ALA 62 1HB ALA 62 10.913 3.810 -0.624
459 HB2 ALA 62 2HB ALA 62 11.743 5.286 -1.119
460 HB3 ALA 62 3HB ALA 62 10.156 4.903 -1.782
461 H ASP 63 H ASP 63 11.198 7.572 1.291
462 HA ASP 63 HA ASP 63 9.571 9.558 -0.099
463 HB2 ASP 63 2HB ASP 63 9.635 9.767 2.318
464 HB3 ASP 63 1HB ASP 63 11.380 9.659 2.338
465 H LEU 64 H LEU 64 10.392 10.758 -1.668
466 HA LEU 64 HA LEU 64 13.281 10.592 -2.363
467 HB2 LEU 64 2HB LEU 64 10.836 11.233 -4.067
468 HB3 LEU 64 1HB LEU 64 12.474 11.395 -4.621
469 HG LEU 64 HG LEU 64 11.323 9.512 -5.573
470 HD11 LEU 64 1HD1 LEU 64 12.997 7.763 -5.128
471 HD12 LEU 64 2HD1 LEU 64 13.615 8.736 -3.783
472 HD13 LEU 64 3HD1 LEU 64 13.669 9.356 -5.442
473 HD21 LEU 64 3HD2 LEU 64 11.133 8.429 -2.767
474 HD22 LEU 64 1HD2 LEU 64 10.834 7.486 -4.230
475 HD23 LEU 64 2HD2 LEU 64 9.806 8.863 -3.851
476 H ASN 65 H ASN 65 13.628 12.345 -0.768
477 HA ASN 65 HA ASN 65 13.008 15.011 -1.540
478 HB2 ASN 65 2HB ASN 65 10.767 14.436 -1.230
479 HB3 ASN 65 1HB ASN 65 11.123 13.420 0.140
480 HD21 ASN 65 1HD2 ASN 65 9.665 14.199 1.272
481 HD22 ASN 65 2HD2 ASN 65 9.592 15.769 1.994
482 H SER 66 H SER 66 14.423 16.246 -0.335
483 HA SER 66 HA SER 66 15.311 15.082 2.191
484 HB2 SER 66 2HB SER 66 17.346 16.585 1.876
485 HB3 SER 66 1HB SER 66 17.184 15.220 0.769
486 HG SER 66 HG SER 66 17.584 17.614 0.083
487 H THR 67 H THR 67 14.598 18.268 0.784
488 HA THR 67 HA THR 67 14.857 19.553 3.294
489 HB THR 67 HB THR 67 15.401 20.806 1.302
490 HG1 THR 67 1HG THR 67 13.526 22.533 1.707
491 HG21 THR 67 3HG2 THR 67 13.802 19.797 -0.266
492 HG22 THR 67 1HG2 THR 67 13.694 21.557 -0.306
493 HG23 THR 67 2HG2 THR 67 12.478 20.613 0.554
494 H ASN 68 H ASN 68 12.062 18.276 1.626
495 HA ASN 68 HA ASN 68 10.289 19.440 3.665
496 HB2 ASN 68 2HB ASN 68 9.729 18.472 0.841
497 HB3 ASN 68 1HB ASN 68 8.447 18.775 2.004
498 HD21 ASN 68 1HD2 ASN 68 7.548 20.385 0.676
499 HD22 ASN 68 2HD2 ASN 68 8.268 21.929 0.521
500 H GLY 69 H GLY 69 11.989 17.210 4.088
501 HA2 GLY 69 2HA GLY 69 11.248 14.676 3.475
502 HA3 GLY 69 1HA GLY 69 11.982 15.098 5.006
503 H THR 70 H THR 70 9.760 13.290 3.845
504 HA THR 70 HA THR 70 7.384 14.006 5.195
505 HB THR 70 HB THR 70 8.259 11.413 3.910
506 HG1 THR 70 1HG THR 70 8.176 12.592 2.220
507 HG21 THR 70 3HG2 THR 70 5.506 12.466 4.595
508 HG22 THR 70 1HG2 THR 70 6.311 11.092 5.346
509 HG23 THR 70 2HG2 THR 70 5.823 11.008 3.650
510 H THR 71 H THR 71 6.571 13.228 7.135
511 HA THR 71 HA THR 71 8.450 11.777 8.808
512 HB THR 71 HB THR 71 6.951 12.600 10.661
513 HG1 THR 71 1HG THR 71 5.871 14.700 9.755
514 HG21 THR 71 3HG2 THR 71 9.070 13.589 10.186
515 HG22 THR 71 1HG2 THR 71 7.921 14.851 10.651
516 HG23 THR 71 2HG2 THR 71 8.354 14.625 8.941
517 H VAL 72 H VAL 72 7.898 9.953 9.782
518 HA VAL 72 HA VAL 72 5.229 8.905 9.308
519 HB VAL 72 HB VAL 72 6.234 6.634 9.501
520 HG11 VAL 72 1HG1 VAL 72 7.488 8.352 7.354
521 HG12 VAL 72 2HG1 VAL 72 5.884 7.635 7.268
522 HG13 VAL 72 3HG1 VAL 72 7.316 6.598 7.274
523 HG21 VAL 72 3HG2 VAL 72 8.220 7.196 10.787
524 HG22 VAL 72 1HG2 VAL 72 8.849 8.129 9.434
525 HG23 VAL 72 2HG2 VAL 72 8.684 6.372 9.295
526 H ASN 73 H ASN 73 4.106 8.852 11.055
527 HA ASN 73 HA ASN 73 3.463 8.983 13.197
528 HB2 ASN 73 2HB ASN 73 5.844 7.146 13.587
529 HB3 ASN 73 1HB ASN 73 4.646 7.476 14.835
530 HD21 ASN 73 1HD2 ASN 73 5.354 4.990 13.523
531 HD22 ASN 73 2HD2 ASN 73 3.894 4.374 12.807
532 H ASN 74 H ASN 74 5.085 11.013 12.194
533 HA ASN 74 HA ASN 74 5.695 13.016 12.881
534 HB2 ASN 74 2HB ASN 74 4.599 12.764 15.069
535 HB3 ASN 74 1HB ASN 74 5.988 11.896 15.695
536 HD21 ASN 74 1HD2 ASN 74 7.762 13.064 16.406
537 HD22 ASN 74 2HD2 ASN 74 7.766 14.772 16.551
538 H ALA 75 H ALA 75 7.633 10.308 12.861
539 HA ALA 75 HA ALA 75 10.099 11.790 13.362
540 HB1 ALA 75 1HB ALA 75 9.680 8.852 12.821
541 HB2 ALA 75 2HB ALA 75 9.848 9.590 14.413
542 HB3 ALA 75 3HB ALA 75 11.204 9.610 13.284
543 HA PRO 76 HA PRO 76 10.481 12.210 8.848
544 HB2 PRO 76 2HB PRO 76 13.137 13.313 9.335
545 HB3 PRO 76 1HB PRO 76 11.707 14.135 8.711
546 HG2 PRO 76 2HG PRO 76 12.761 14.648 11.160
547 HG3 PRO 76 1HG PRO 76 11.032 14.810 10.796
548 HD2 PRO 76 2HD PRO 76 12.482 12.602 12.206
549 HD3 PRO 76 1HD PRO 76 10.906 13.352 12.566
550 H VAL 77 H VAL 77 11.110 10.627 7.499
551 HA VAL 77 HA VAL 77 13.641 9.228 8.008
552 HB VAL 77 HB VAL 77 12.609 7.058 7.461
553 HG11 VAL 77 1HG1 VAL 77 11.266 8.404 9.798
554 HG12 VAL 77 2HG1 VAL 77 12.853 7.639 9.806
555 HG13 VAL 77 3HG1 VAL 77 11.406 6.661 9.553
556 HG21 VAL 77 3HG2 VAL 77 10.129 6.839 7.475
557 HG22 VAL 77 1HG2 VAL 77 10.741 7.792 6.118
558 HG23 VAL 77 2HG2 VAL 77 10.025 8.599 7.509
559 H GLN 78 H GLN 78 14.119 7.777 6.090
560 HA GLN 78 HA GLN 78 13.460 9.209 3.635
561 HB2 GLN 78 2HB GLN 78 15.712 7.279 4.253
562 HB3 GLN 78 1HB GLN 78 15.439 8.038 2.692
563 HG2 GLN 78 2HG GLN 78 15.776 10.233 3.668
564 HG3 GLN 78 1HG GLN 78 16.001 9.504 5.254
565 HE21 GLN 78 1HE2 GLN 78 18.012 10.425 5.419
566 HE22 GLN 78 2HE2 GLN 78 19.389 9.850 4.562
567 H GLU 79 H GLU 79 13.433 6.058 5.202
568 HA GLU 79 HA GLU 79 11.303 5.288 3.478
569 HB2 GLU 79 2HB GLU 79 12.320 3.071 2.934
570 HB3 GLU 79 1HB GLU 79 13.102 4.428 2.149
571 HG2 GLU 79 2HG GLU 79 14.890 4.339 3.830
572 HG3 GLU 79 1HG GLU 79 14.106 2.937 4.559
573 H TRP 80 H TRP 80 10.092 3.549 4.288
574 HA TRP 80 HA TRP 80 10.519 2.599 6.989
575 HB2 TRP 80 2HB TRP 80 9.795 4.822 7.467
576 HB3 TRP 80 1HB TRP 80 8.474 4.762 6.318
577 HD1 TRP 80 HD TRP 80 6.233 3.510 7.182
578 HE1 TRP 80 1HE TRP 80 5.358 3.061 9.566
579 HE3 TRP 80 3HE TRP 80 10.585 4.204 9.777
580 HZ2 TRP 80 2HZ TRP 80 6.380 3.028 12.181
581 HZ3 TRP 80 3HZ TRP 80 10.538 3.953 12.223
582 HH2 TRP 80 HH TRP 80 8.471 3.382 13.391
583 H GLN 81 H GLN 81 8.964 0.947 7.448
584 HA GLN 81 HA GLN 81 7.310 0.327 5.134
585 HB2 GLN 81 2HB GLN 81 7.194 -2.035 5.913
586 HB3 GLN 81 1HB GLN 81 8.815 -1.512 5.508
587 HG2 GLN 81 2HG GLN 81 9.315 -1.270 7.879
588 HG3 GLN 81 1HG GLN 81 7.675 -1.790 8.274
589 HE21 GLN 81 1HE2 GLN 81 8.382 -3.553 9.379
590 HE22 GLN 81 2HE2 GLN 81 9.061 -4.947 8.624
591 H LEU 82 H LEU 82 5.421 0.817 5.220
592 HA LEU 82 HA LEU 82 4.070 2.034 7.352
593 HB2 LEU 82 2HB LEU 82 2.833 0.712 4.950
594 HB3 LEU 82 1HB LEU 82 2.121 1.947 5.957
595 HG LEU 82 HG LEU 82 4.555 2.348 4.237
596 HD11 LEU 82 1HD1 LEU 82 2.574 1.969 2.872
597 HD12 LEU 82 2HD1 LEU 82 3.068 3.658 2.798
598 HD13 LEU 82 3HD1 LEU 82 1.688 3.190 3.787
599 HD21 LEU 82 3HD2 LEU 82 2.835 4.281 5.758
600 HD22 LEU 82 1HD2 LEU 82 4.178 4.709 4.710
601 HD23 LEU 82 2HD2 LEU 82 4.472 3.799 6.193
602 H ALA 83 H ALA 83 2.878 1.268 8.984
603 HA ALA 83 HA ALA 83 1.784 -1.443 8.761
604 HB1 ALA 83 1HB ALA 83 3.459 -1.312 10.554
605 HB2 ALA 83 2HB ALA 83 1.844 -1.546 11.223
606 HB3 ALA 83 3HB ALA 83 2.593 0.051 11.266
607 H ASP 84 H ASP 84 -0.250 -1.669 10.021
608 HA ASP 84 HA ASP 84 -2.108 0.287 9.187
609 HB2 ASP 84 2HB ASP 84 -2.781 -2.015 9.319
610 HB3 ASP 84 1HB ASP 84 -2.395 -2.084 11.029
611 H GLY 85 H GLY 85 -2.405 2.159 10.051
612 HA2 GLY 85 2HA GLY 85 -3.290 3.424 11.853
613 HA3 GLY 85 1HA GLY 85 -2.372 2.428 12.971
614 H ASP 86 H ASP 86 -0.345 2.999 10.412
615 HA ASP 86 HA ASP 86 1.180 4.896 11.904
616 HB2 ASP 86 2HB ASP 86 1.616 3.688 9.176
617 HB3 ASP 86 1HB ASP 86 2.612 5.018 9.738
618 H VAL 87 H VAL 87 1.643 6.951 11.542
619 HA VAL 87 HA VAL 87 -0.283 8.473 9.890
620 HB VAL 87 HB VAL 87 1.481 9.501 12.141
621 HG11 VAL 87 1HG1 VAL 87 -0.857 10.772 10.741
622 HG12 VAL 87 2HG1 VAL 87 0.840 11.218 10.564
623 HG13 VAL 87 3HG1 VAL 87 0.018 11.458 12.109
624 HG21 VAL 87 3HG2 VAL 87 -0.128 7.896 13.053
625 HG22 VAL 87 1HG2 VAL 87 -1.447 8.749 12.253
626 HG23 VAL 87 2HG2 VAL 87 -0.544 9.539 13.543
627 H ILE 88 H ILE 88 0.557 9.090 7.999
628 HA ILE 88 HA ILE 88 3.421 9.683 7.975
629 HB ILE 88 HB ILE 88 1.626 8.744 5.714
630 HG12 ILE 88 2HG1 ILE 88 3.399 6.889 5.543
631 HG13 ILE 88 1HG1 ILE 88 3.972 7.461 7.101
632 HG21 ILE 88 1HG2 ILE 88 3.135 10.415 4.825
633 HG22 ILE 88 2HG2 ILE 88 3.584 8.815 4.239
634 HG23 ILE 88 3HG2 ILE 88 4.514 9.575 5.533
635 HD11 ILE 88 3HD1 ILE 88 1.816 6.935 8.092
636 HD12 ILE 88 1HD1 ILE 88 2.556 5.517 7.350
637 HD13 ILE 88 2HD1 ILE 88 1.239 6.354 6.530
638 H ARG 89 H ARG 89 3.867 11.785 7.852
639 HA ARG 89 HA ARG 89 1.794 13.497 6.700
640 HB2 ARG 89 2HB ARG 89 1.943 13.771 9.146
641 HB3 ARG 89 1HB ARG 89 3.638 14.203 8.983
642 HG2 ARG 89 2HG ARG 89 3.018 16.172 7.665
643 HG3 ARG 89 1HG ARG 89 1.316 15.745 7.830
644 HD2 ARG 89 2HD ARG 89 1.543 15.941 10.276
645 HD3 ARG 89 1HD ARG 89 3.221 16.436 10.060
646 HE ARG 89 HE ARG 89 1.043 17.955 8.824
647 HH11 ARG 89 1HH1 ARG 89 3.843 17.871 10.990
648 HH12 ARG 89 2HH1 ARG 89 3.808 19.532 11.342
649 HH21 ARG 89 1HH2 ARG 89 0.999 20.257 9.317
650 HH22 ARG 89 2HH2 ARG 89 2.169 20.913 10.360
651 H LEU 90 H LEU 90 2.348 14.825 5.209
652 HA LEU 90 HA LEU 90 5.125 15.380 4.686
653 HB2 LEU 90 2HB LEU 90 4.731 15.135 2.231
654 HB3 LEU 90 1HB LEU 90 4.677 13.619 3.082
655 HG LEU 90 HG LEU 90 2.208 15.114 2.152
656 HD11 LEU 90 1HD1 LEU 90 3.611 14.488 0.254
657 HD12 LEU 90 2HD1 LEU 90 2.159 13.488 0.321
658 HD13 LEU 90 3HD1 LEU 90 3.705 12.835 0.862
659 HD21 LEU 90 3HD2 LEU 90 1.102 12.940 2.427
660 HD22 LEU 90 1HD2 LEU 90 1.796 13.480 3.956
661 HD23 LEU 90 2HD2 LEU 90 2.610 12.235 3.010
662 H GLY 91 H GLY 91 5.276 17.265 3.153
663 HA2 GLY 91 2HA GLY 91 4.259 19.509 4.262
664 HA3 GLY 91 1HA GLY 91 4.749 19.420 2.584
665 H HIS 92 H HIS 92 2.222 19.577 4.812
666 HA HIS 92 HA HIS 92 0.157 20.343 4.777
667 HB2 HIS 92 2HB HIS 92 0.688 20.932 1.869
668 HB3 HIS 92 1HB HIS 92 -0.855 21.301 2.639
669 HD1 HIS 92 1HD HIS 92 -0.963 23.590 3.698
670 HD2 HIS 92 2HD HIS 92 2.922 22.201 3.286
671 HE1 HIS 92 1HE HIS 92 0.548 25.440 4.529
672 H SER 93 H SER 93 0.846 17.490 4.159
673 HA SER 93 HA SER 93 -1.939 16.792 3.847
674 HB2 SER 93 2HB SER 93 -0.815 16.699 1.548
675 HB3 SER 93 1HB SER 93 0.146 15.366 2.194
676 HG SER 93 HG SER 93 -2.615 15.515 1.729
677 H GLU 94 H GLU 94 -2.468 15.055 5.063
678 HA GLU 94 HA GLU 94 -0.321 13.479 6.177
679 HB2 GLU 94 2HB GLU 94 -1.500 13.551 8.432
680 HB3 GLU 94 1HB GLU 94 -0.653 15.007 7.949
681 HG2 GLU 94 2HG GLU 94 -2.832 15.938 7.193
682 HG3 GLU 94 1HG GLU 94 -3.612 14.517 7.885
683 H ILE 95 H ILE 95 -0.632 11.459 6.009
684 HA ILE 95 HA ILE 95 -3.301 10.573 5.206
685 HB ILE 95 HB ILE 95 -1.567 10.702 3.383
686 HG12 ILE 95 2HG1 ILE 95 -1.917 8.353 2.538
687 HG13 ILE 95 1HG1 ILE 95 -2.741 8.032 4.063
688 HG21 ILE 95 1HG2 ILE 95 0.413 10.113 4.599
689 HG22 ILE 95 2HG2 ILE 95 0.177 9.010 3.238
690 HG23 ILE 95 3HG2 ILE 95 -0.220 8.489 4.876
691 HD11 ILE 95 3HD1 ILE 95 -4.374 8.585 2.412
692 HD12 ILE 95 1HD1 ILE 95 -3.506 10.069 2.001
693 HD13 ILE 95 2HD1 ILE 95 -4.265 9.884 3.579
694 H ILE 96 H ILE 96 -4.070 8.685 6.120
695 HA ILE 96 HA ILE 96 -2.375 7.432 8.169
696 HB ILE 96 HB ILE 96 -5.402 7.404 7.932
697 HG12 ILE 96 2HG1 ILE 96 -4.598 9.632 8.537
698 HG13 ILE 96 1HG1 ILE 96 -5.439 8.876 9.890
699 HG21 ILE 96 1HG2 ILE 96 -3.618 6.361 10.128
700 HG22 ILE 96 2HG2 ILE 96 -4.593 5.396 9.020
701 HG23 ILE 96 3HG2 ILE 96 -5.375 6.448 10.201
702 HD11 ILE 96 3HD1 ILE 96 -3.475 10.071 10.655
703 HD12 ILE 96 1HD1 ILE 96 -2.455 9.152 9.548
704 HD13 ILE 96 2HD1 ILE 96 -3.255 8.337 10.890
705 H VAL 97 H VAL 97 -2.044 5.294 8.052
706 HA VAL 97 HA VAL 97 -2.941 3.953 5.616
707 HB VAL 97 HB VAL 97 -0.617 3.401 7.478
708 HG11 VAL 97 1HG1 VAL 97 0.000 1.572 5.975
709 HG12 VAL 97 2HG1 VAL 97 -1.474 1.842 5.042
710 HG13 VAL 97 3HG1 VAL 97 -1.578 1.275 6.711
711 HG21 VAL 97 3HG2 VAL 97 -0.741 4.121 4.567
712 HG22 VAL 97 1HG2 VAL 97 0.720 3.916 5.526
713 HG23 VAL 97 2HG2 VAL 97 -0.391 5.249 5.875
714 H ARG 98 H ARG 98 -4.451 2.449 5.706
715 HA ARG 98 HA ARG 98 -4.921 1.029 8.229
716 HB2 ARG 98 2HB ARG 98 -6.883 1.919 6.110
717 HB3 ARG 98 1HB ARG 98 -7.278 0.838 7.434
718 HG2 ARG 98 2HG ARG 98 -6.125 3.508 8.059
719 HG3 ARG 98 1HG ARG 98 -7.807 3.407 7.552
720 HD2 ARG 98 2HD ARG 98 -7.644 3.401 9.968
721 HD3 ARG 98 1HD ARG 98 -8.273 1.867 9.403
722 HE ARG 98 HE ARG 98 -5.892 1.041 9.848
723 HH11 ARG 98 1HH1 ARG 98 -7.183 3.859 11.603
724 HH12 ARG 98 2HH1 ARG 98 -6.532 3.380 13.100
725 HH21 ARG 98 1HH2 ARG 98 -5.028 0.392 12.006
726 HH22 ARG 98 2HH2 ARG 98 -5.321 1.435 13.324
727 H MET 99 H MET 99 -5.093 -1.117 8.057
728 HA MET 99 HA MET 99 -4.839 -2.282 5.372
729 HB2 MET 99 2HB MET 99 -3.440 -3.183 7.891
730 HB3 MET 99 1HB MET 99 -3.468 -4.090 6.398
731 HG2 MET 99 2HG MET 99 -2.353 -2.261 5.238
732 HG3 MET 99 1HG MET 99 -2.312 -1.336 6.732
733 HE1 MET 99 3HE MET 99 0.317 -1.040 6.198
734 HE2 MET 99 1HE MET 99 0.181 -2.096 4.790
735 HE3 MET 99 2HE MET 99 1.419 -2.403 6.009
736 H HIS 100 H HIS 100 -6.024 -3.997 4.903
737 HA HIS 100 HA HIS 100 -7.867 -4.996 6.950
738 HB2 HIS 100 2HB HIS 100 -8.434 -4.546 3.997
739 HB3 HIS 100 1HB HIS 100 -9.566 -5.188 5.173
740 HD1 HIS 100 1HD HIS 100 -11.143 -3.456 6.137
741 HD2 HIS 100 2HD HIS 100 -7.686 -1.760 4.573
742 HE1 HIS 100 1HE HIS 100 -11.445 -0.963 6.291
Start of MODEL 23
1 H1 GLY 1 1HT GLY 1 -7.359 -15.417 -5.751
2 H2 GLY 1 2HT GLY 1 -8.090 -14.449 -6.890
3 H3 GLY 1 3HT GLY 1 -7.014 -15.663 -7.382
4 HA2 GLY 1 1HA GLY 1 -9.278 -16.361 -7.792
5 HA3 GLY 1 2HA GLY 1 -8.505 -17.339 -6.541
6 H HIS 2 H HIS 2 -10.651 -17.876 -5.796
7 HA HIS 2 HA HIS 2 -12.260 -15.730 -4.726
8 HB2 HIS 2 2HB HIS 2 -12.652 -18.724 -4.621
9 HB3 HIS 2 1HB HIS 2 -13.748 -17.575 -3.875
10 HD1 HIS 2 1HD HIS 2 -13.592 -19.554 -6.749
11 HD2 HIS 2 2HD HIS 2 -14.537 -15.574 -6.068
12 HE1 HIS 2 1HE HIS 2 -15.061 -18.830 -8.690
13 H GLY 3 H GLY 3 -11.158 -14.774 -3.131
14 HA2 GLY 3 2HA GLY 3 -11.490 -15.592 -0.571
15 HA3 GLY 3 1HA GLY 3 -9.885 -16.163 -1.039
16 H SER 4 H SER 4 -9.513 -14.484 0.774
17 HA SER 4 HA SER 4 -9.535 -11.777 -0.221
18 HB2 SER 4 2HB SER 4 -8.520 -12.949 2.378
19 HB3 SER 4 1HB SER 4 -8.695 -11.231 2.025
20 HG SER 4 HG SER 4 -10.936 -12.799 1.601
21 H ALA 5 H ALA 5 -7.607 -10.565 -0.513
22 HA ALA 5 HA ALA 5 -5.460 -12.008 -1.703
23 HB1 ALA 5 1HB ALA 5 -5.636 -9.087 -0.950
24 HB2 ALA 5 2HB ALA 5 -6.133 -9.777 -2.497
25 HB3 ALA 5 3HB ALA 5 -4.436 -9.804 -2.023
26 H GLY 6 H GLY 6 -6.065 -10.560 1.391
27 HA2 GLY 6 2HA GLY 6 -4.891 -11.817 3.217
28 HA3 GLY 6 1HA GLY 6 -3.427 -11.533 2.285
29 H THR 7 H THR 7 -3.591 -8.965 1.579
30 HA THR 7 HA THR 7 -4.247 -7.391 3.920
31 HB THR 7 HB THR 7 -1.475 -7.327 2.673
32 HG1 THR 7 1HG THR 7 -2.560 -8.870 4.654
33 HG21 THR 7 3HG2 THR 7 -2.606 -5.973 5.141
34 HG22 THR 7 1HG2 THR 7 -2.224 -5.174 3.617
35 HG23 THR 7 2HG2 THR 7 -0.932 -5.869 4.594
36 H SER 8 H SER 8 -5.304 -5.618 3.206
37 HA SER 8 HA SER 8 -4.613 -4.615 0.543
38 HB2 SER 8 2HB SER 8 -7.227 -4.385 2.035
39 HB3 SER 8 1HB SER 8 -6.924 -3.932 0.355
40 HG SER 8 HG SER 8 -6.966 -6.497 1.514
41 H VAL 9 H VAL 9 -3.566 -2.712 0.740
42 HA VAL 9 HA VAL 9 -3.760 -1.290 3.294
43 HB VAL 9 HB VAL 9 -1.805 -0.823 1.047
44 HG11 VAL 9 1HG1 VAL 9 -1.745 -0.044 3.961
45 HG12 VAL 9 2HG1 VAL 9 -2.031 1.030 2.591
46 HG13 VAL 9 3HG1 VAL 9 -0.457 0.262 2.797
47 HG21 VAL 9 3HG2 VAL 9 -1.502 -3.102 1.793
48 HG22 VAL 9 1HG2 VAL 9 -1.448 -2.579 3.476
49 HG23 VAL 9 2HG2 VAL 9 -0.161 -2.113 2.367
50 H THR 10 H THR 10 -4.749 0.583 3.414
51 HA THR 10 HA THR 10 -5.513 1.919 0.941
52 HB THR 10 HB THR 10 -7.394 1.309 3.246
53 HG1 THR 10 1HG THR 10 -6.973 -0.520 1.992
54 HG21 THR 10 3HG2 THR 10 -9.135 2.206 1.766
55 HG22 THR 10 1HG2 THR 10 -7.915 2.567 0.543
56 HG23 THR 10 2HG2 THR 10 -7.895 3.419 2.088
57 H LEU 11 H LEU 11 -4.943 3.960 1.064
58 HA LEU 11 HA LEU 11 -4.387 4.980 3.688
59 HB2 LEU 11 2HB LEU 11 -3.309 6.920 2.519
60 HB3 LEU 11 1HB LEU 11 -2.552 5.373 2.252
61 HG LEU 11 HG LEU 11 -3.805 5.356 0.017
62 HD11 LEU 11 1HD1 LEU 11 -4.010 8.287 0.640
63 HD12 LEU 11 2HD1 LEU 11 -5.365 7.177 0.429
64 HD13 LEU 11 3HD1 LEU 11 -4.300 7.563 -0.932
65 HD21 LEU 11 3HD2 LEU 11 -2.042 6.671 -1.059
66 HD22 LEU 11 1HD2 LEU 11 -1.408 5.639 0.222
67 HD23 LEU 11 2HD2 LEU 11 -1.616 7.365 0.505
68 H GLN 12 H GLN 12 -5.286 6.627 4.598
69 HA GLN 12 HA GLN 12 -8.014 7.197 3.678
70 HB2 GLN 12 2HB GLN 12 -7.299 5.886 5.855
71 HB3 GLN 12 1HB GLN 12 -6.950 7.472 6.450
72 HG2 GLN 12 2HG GLN 12 -9.680 6.710 5.447
73 HG3 GLN 12 1HG GLN 12 -9.184 6.576 7.127
74 HE21 GLN 12 1HE2 GLN 12 -10.097 8.698 4.575
75 HE22 GLN 12 2HE2 GLN 12 -10.229 10.117 5.569
76 H LEU 13 H LEU 13 -7.976 9.208 2.748
77 HA LEU 13 HA LEU 13 -6.442 11.330 4.017
78 HB2 LEU 13 2HB LEU 13 -6.146 11.193 1.621
79 HB3 LEU 13 1HB LEU 13 -7.881 11.151 1.368
80 HG LEU 13 HG LEU 13 -8.055 13.416 2.228
81 HD11 LEU 13 1HD1 LEU 13 -6.124 13.537 3.658
82 HD12 LEU 13 2HD1 LEU 13 -6.041 14.820 2.454
83 HD13 LEU 13 3HD1 LEU 13 -5.035 13.379 2.274
84 HD21 LEU 13 3HD2 LEU 13 -7.930 13.062 -0.145
85 HD22 LEU 13 1HD2 LEU 13 -6.164 13.084 -0.090
86 HD23 LEU 13 2HD2 LEU 13 -7.084 14.549 0.276
87 H ASP 14 H ASP 14 -7.580 12.125 5.656
88 HA ASP 14 HA ASP 14 -10.446 12.346 5.292
89 HB2 ASP 14 2HB ASP 14 -9.711 11.454 7.439
90 HB3 ASP 14 1HB ASP 14 -8.755 12.909 7.729
91 H ASP 15 H ASP 15 -10.847 13.946 4.002
92 HA ASP 15 HA ASP 15 -9.492 16.478 4.434
93 HB2 ASP 15 2HB ASP 15 -9.430 15.720 2.160
94 HB3 ASP 15 1HB ASP 15 -11.147 15.379 2.146
95 H GLY 16 H GLY 16 -12.501 14.857 4.660
96 HA2 GLY 16 2HA GLY 16 -13.647 16.800 6.361
97 HA3 GLY 16 1HA GLY 16 -14.359 16.884 4.755
98 H SER 17 H SER 17 -14.534 14.310 3.961
99 HA SER 17 HA SER 17 -16.259 13.155 6.047
100 HB2 SER 17 2HB SER 17 -16.611 12.932 3.039
101 HB3 SER 17 1HB SER 17 -17.665 12.225 4.257
102 HG SER 17 HG SER 17 -17.851 14.470 5.045
103 H GLY 18 H GLY 18 -13.405 12.676 4.554
104 HA2 GLY 18 2HA GLY 18 -11.962 10.896 5.021
105 HA3 GLY 18 1HA GLY 18 -13.356 9.907 5.414
106 H ARG 19 H ARG 19 -11.094 10.792 2.976
107 HA ARG 19 HA ARG 19 -12.506 9.121 1.036
108 HB2 ARG 19 2HB ARG 19 -10.037 10.831 0.729
109 HB3 ARG 19 1HB ARG 19 -10.732 9.799 -0.513
110 HG2 ARG 19 2HG ARG 19 -12.008 12.229 0.735
111 HG3 ARG 19 1HG ARG 19 -11.321 12.117 -0.886
112 HD2 ARG 19 2HD ARG 19 -13.703 10.576 0.145
113 HD3 ARG 19 1HD ARG 19 -13.756 11.958 -0.941
114 HE ARG 19 HE ARG 19 -12.140 10.000 -2.086
115 HH11 ARG 19 1HH1 ARG 19 -15.556 10.327 -1.146
116 HH12 ARG 19 2HH1 ARG 19 -16.135 9.433 -2.468
117 HH21 ARG 19 1HH2 ARG 19 -12.968 8.747 -3.885
118 HH22 ARG 19 2HH2 ARG 19 -14.654 8.532 -4.046
119 H THR 20 H THR 20 -11.245 7.478 -0.029
120 HA THR 20 HA THR 20 -8.972 6.524 1.504
121 HB THR 20 HB THR 20 -9.919 4.197 1.396
122 HG1 THR 20 1HG THR 20 -12.137 5.666 0.464
123 HG21 THR 20 3HG2 THR 20 -9.990 5.441 3.490
124 HG22 THR 20 1HG2 THR 20 -11.469 4.482 3.320
125 HG23 THR 20 2HG2 THR 20 -11.480 6.224 2.980
126 H TYR 21 H TYR 21 -7.476 5.551 0.271
127 HA TYR 21 HA TYR 21 -8.156 4.759 -2.456
128 HB2 TYR 21 2HB TYR 21 -7.137 6.859 -2.873
129 HB3 TYR 21 1HB TYR 21 -5.938 6.620 -1.615
130 HD1 TYR 21 1HD TYR 21 -6.943 5.423 -5.011
131 HD2 TYR 21 2HD TYR 21 -3.826 5.756 -2.135
132 HE1 TYR 21 1HE TYR 21 -5.307 4.629 -6.677
133 HE2 TYR 21 2HE TYR 21 -2.201 4.970 -3.782
134 HH TYR 21 HH TYR 21 -2.124 3.705 -5.786
135 H GLN 22 H GLN 22 -7.794 2.694 -2.553
136 HA GLN 22 HA GLN 22 -5.953 1.371 -0.811
137 HB2 GLN 22 2HB GLN 22 -8.070 0.312 -1.599
138 HB3 GLN 22 1HB GLN 22 -7.401 0.269 -3.225
139 HG2 GLN 22 2HG GLN 22 -5.620 -1.200 -2.474
140 HG3 GLN 22 1HG GLN 22 -6.234 -1.128 -0.827
141 HE21 GLN 22 1HE2 GLN 22 -8.122 -2.213 -0.325
142 HE22 GLN 22 2HE2 GLN 22 -8.771 -3.440 -1.346
143 H LEU 23 H LEU 23 -3.967 0.716 -1.224
144 HA LEU 23 HA LEU 23 -2.516 1.972 -3.314
145 HB2 LEU 23 2HB LEU 23 -1.716 -0.242 -1.446
146 HB3 LEU 23 1HB LEU 23 -0.623 0.619 -2.503
147 HG LEU 23 HG LEU 23 -2.110 1.773 -0.142
148 HD11 LEU 23 1HD1 LEU 23 0.136 1.994 0.786
149 HD12 LEU 23 2HD1 LEU 23 0.789 1.188 -0.649
150 HD13 LEU 23 3HD1 LEU 23 -0.265 0.311 0.449
151 HD21 LEU 23 3HD2 LEU 23 -0.142 3.072 -2.030
152 HD22 LEU 23 1HD2 LEU 23 -0.779 3.785 -0.552
153 HD23 LEU 23 2HD2 LEU 23 -1.863 3.458 -1.904
154 H ARG 24 H ARG 24 -1.868 1.206 -5.199
155 HA ARG 24 HA ARG 24 -3.023 -1.210 -6.242
156 HB2 ARG 24 2HB ARG 24 -1.836 -0.691 -8.287
157 HB3 ARG 24 1HB ARG 24 -2.510 0.815 -7.672
158 HG2 ARG 24 2HG ARG 24 -0.412 1.595 -6.959
159 HG3 ARG 24 1HG ARG 24 0.306 -0.008 -7.054
160 HD2 ARG 24 2HD ARG 24 1.143 1.250 -8.874
161 HD3 ARG 24 1HD ARG 24 -0.012 0.091 -9.518
162 HE ARG 24 HE ARG 24 -1.360 2.487 -9.091
163 HH11 ARG 24 1HH1 ARG 24 1.211 1.177 -11.140
164 HH12 ARG 24 2HH1 ARG 24 0.989 2.328 -12.384
165 HH21 ARG 24 1HH2 ARG 24 -1.648 4.035 -10.782
166 HH22 ARG 24 2HH2 ARG 24 -0.680 3.974 -12.195
167 H GLU 25 H GLU 25 -1.715 -3.026 -6.938
168 HA GLU 25 HA GLU 25 0.548 -3.536 -5.278
169 HB2 GLU 25 2HB GLU 25 0.782 -5.603 -6.699
170 HB3 GLU 25 1HB GLU 25 -0.778 -5.440 -5.912
171 HG2 GLU 25 2HG GLU 25 -1.723 -4.594 -8.017
172 HG3 GLU 25 1HG GLU 25 -0.160 -4.846 -8.791
173 H GLY 26 H GLY 26 2.649 -3.248 -5.758
174 HA2 GLY 26 2HA GLY 26 4.392 -2.830 -7.361
175 HA3 GLY 26 1HA GLY 26 3.195 -1.986 -8.352
176 H SER 27 H SER 27 4.321 0.036 -8.254
177 HA SER 27 HA SER 27 4.460 1.031 -5.536
178 HB2 SER 27 2HB SER 27 6.009 2.712 -6.333
179 HB3 SER 27 1HB SER 27 6.603 1.079 -6.562
180 HG SER 27 HG SER 27 5.992 1.160 -8.763
181 H ASN 28 H ASN 28 3.539 2.795 -4.901
182 HA ASN 28 HA ASN 28 1.625 4.137 -6.682
183 HB2 ASN 28 2HB ASN 28 1.755 3.944 -3.644
184 HB3 ASN 28 1HB ASN 28 0.531 4.825 -4.542
185 HD21 ASN 28 1HD2 ASN 28 1.782 1.639 -3.773
186 HD22 ASN 28 2HD2 ASN 28 0.391 0.745 -4.235
187 H ILE 29 H ILE 29 2.507 5.960 -7.423
188 HA ILE 29 HA ILE 29 4.662 7.197 -5.874
189 HB ILE 29 HB ILE 29 3.918 7.667 -8.772
190 HG12 ILE 29 2HG1 ILE 29 6.164 5.990 -7.635
191 HG13 ILE 29 1HG1 ILE 29 4.660 5.332 -8.270
192 HG21 ILE 29 1HG2 ILE 29 6.386 8.428 -7.193
193 HG22 ILE 29 2HG2 ILE 29 5.131 9.536 -7.742
194 HG23 ILE 29 3HG2 ILE 29 6.145 8.699 -8.918
195 HD11 ILE 29 3HD1 ILE 29 6.461 5.177 -9.890
196 HD12 ILE 29 1HD1 ILE 29 6.680 6.926 -9.821
197 HD13 ILE 29 2HD1 ILE 29 5.181 6.247 -10.456
198 H ILE 30 H ILE 30 4.289 8.985 -4.817
199 HA ILE 30 HA ILE 30 2.024 10.665 -5.568
200 HB ILE 30 HB ILE 30 3.413 10.340 -2.876
201 HG12 ILE 30 2HG1 ILE 30 0.588 9.629 -3.715
202 HG13 ILE 30 1HG1 ILE 30 1.892 8.479 -3.472
203 HG21 ILE 30 1HG2 ILE 30 1.239 12.247 -3.661
204 HG22 ILE 30 2HG2 ILE 30 2.851 12.612 -3.055
205 HG23 ILE 30 3HG2 ILE 30 1.668 11.845 -2.000
206 HD11 ILE 30 3HD1 ILE 30 0.691 10.250 -1.354
207 HD12 ILE 30 1HD1 ILE 30 1.986 9.079 -1.111
208 HD13 ILE 30 2HD1 ILE 30 0.375 8.526 -1.571
209 H GLY 31 H GLY 31 2.507 12.618 -6.308
210 HA2 GLY 31 2HA GLY 31 4.274 14.447 -5.395
211 HA3 GLY 31 1HA GLY 31 5.221 13.502 -6.560
212 H ARG 32 H ARG 32 5.052 15.925 -7.385
213 HA ARG 32 HA ARG 32 2.659 15.987 -9.096
214 HB2 ARG 32 2HB ARG 32 4.418 18.313 -8.276
215 HB3 ARG 32 1HB ARG 32 2.985 18.404 -9.284
216 HG2 ARG 32 2HG ARG 32 1.631 17.632 -7.360
217 HG3 ARG 32 1HG ARG 32 3.088 17.638 -6.389
218 HD2 ARG 32 2HD ARG 32 1.847 19.693 -6.020
219 HD3 ARG 32 1HD ARG 32 3.394 20.025 -6.788
220 HE ARG 32 HE ARG 32 1.535 19.798 -8.824
221 HH11 ARG 32 1HH1 ARG 32 1.959 21.877 -6.010
222 HH12 ARG 32 2HH1 ARG 32 1.292 23.264 -6.750
223 HH21 ARG 32 1HH2 ARG 32 0.581 21.684 -9.824
224 HH22 ARG 32 2HH2 ARG 32 0.449 23.138 -8.966
225 H GLY 33 H GLY 33 3.304 15.051 -10.895
226 HA2 GLY 33 2HA GLY 33 5.039 16.284 -12.638
227 HA3 GLY 33 1HA GLY 33 5.902 14.971 -11.839
228 H GLN 34 H GLN 34 5.394 14.890 -14.514
229 HA GLN 34 HA GLN 34 3.036 13.480 -15.137
230 HB2 GLN 34 2HB GLN 34 4.042 12.967 -17.293
231 HB3 GLN 34 1HB GLN 34 4.325 14.642 -16.873
232 HG2 GLN 34 2HG GLN 34 6.380 12.456 -16.543
233 HG3 GLN 34 1HG GLN 34 6.246 13.480 -17.968
234 HE21 GLN 34 1HE2 GLN 34 6.797 15.636 -17.798
235 HE22 GLN 34 2HE2 GLN 34 7.744 16.254 -16.527
236 H ASP 35 H ASP 35 6.024 12.485 -13.810
237 HA ASP 35 HA ASP 35 5.831 9.693 -14.454
238 HB2 ASP 35 2HB ASP 35 7.968 10.935 -13.898
239 HB3 ASP 35 1HB ASP 35 7.434 10.964 -12.224
240 H ALA 36 H ALA 36 4.618 11.746 -11.944
241 HA ALA 36 HA ALA 36 4.219 9.708 -9.984
242 HB1 ALA 36 1HB ALA 36 3.120 11.432 -8.695
243 HB2 ALA 36 2HB ALA 36 3.104 12.492 -10.104
244 HB3 ALA 36 3HB ALA 36 4.637 12.031 -9.366
245 H GLN 37 H GLN 37 2.214 9.026 -9.140
246 HA GLN 37 HA GLN 37 0.208 8.662 -11.210
247 HB2 GLN 37 2HB GLN 37 0.597 7.275 -8.552
248 HB3 GLN 37 1HB GLN 37 -0.549 6.825 -9.806
249 HG2 GLN 37 2HG GLN 37 2.459 6.734 -10.031
250 HG3 GLN 37 1HG GLN 37 1.389 5.349 -9.828
251 HE21 GLN 37 1HE2 GLN 37 3.289 6.022 -11.966
252 HE22 GLN 37 2HE2 GLN 37 2.353 6.018 -13.419
253 H PHE 38 H PHE 38 0.629 9.651 -7.852
254 HA PHE 38 HA PHE 38 -2.009 10.924 -7.903
255 HB2 PHE 38 2HB PHE 38 -1.929 9.085 -6.290
256 HB3 PHE 38 1HB PHE 38 -0.435 9.706 -5.614
257 HD1 PHE 38 1HD PHE 38 -4.076 10.254 -5.869
258 HD2 PHE 38 2HD PHE 38 -0.459 11.437 -3.969
259 HE1 PHE 38 1HE PHE 38 -5.362 11.490 -4.172
260 HE2 PHE 38 2HE PHE 38 -1.685 12.643 -2.297
261 HZ PHE 38 HZ PHE 38 -4.177 12.699 -2.372
262 H ARG 39 H ARG 39 -1.923 13.137 -7.649
263 HA ARG 39 HA ARG 39 0.657 14.160 -6.898
264 HB2 ARG 39 2HB ARG 39 -0.000 16.263 -8.155
265 HB3 ARG 39 1HB ARG 39 0.482 14.851 -9.081
266 HG2 ARG 39 2HG ARG 39 -2.398 15.633 -8.659
267 HG3 ARG 39 1HG ARG 39 -1.429 16.264 -9.991
268 HD2 ARG 39 2HD ARG 39 -0.943 13.853 -10.597
269 HD3 ARG 39 1HD ARG 39 -2.192 13.398 -9.447
270 HE ARG 39 HE ARG 39 -2.779 15.249 -11.627
271 HH11 ARG 39 1HH1 ARG 39 -3.518 12.228 -9.972
272 HH12 ARG 39 2HH1 ARG 39 -4.679 11.712 -11.109
273 HH21 ARG 39 1HH2 ARG 39 -4.366 14.544 -13.200
274 HH22 ARG 39 2HH2 ARG 39 -5.192 13.081 -12.973
275 H LEU 40 H LEU 40 0.903 15.697 -5.481
276 HA LEU 40 HA LEU 40 -1.231 15.995 -3.592
277 HB2 LEU 40 2HB LEU 40 1.585 17.018 -3.646
278 HB3 LEU 40 1HB LEU 40 0.465 17.373 -2.347
279 HG LEU 40 HG LEU 40 1.450 14.627 -3.116
280 HD11 LEU 40 1HD1 LEU 40 2.661 14.755 -1.011
281 HD12 LEU 40 2HD1 LEU 40 2.080 16.407 -0.779
282 HD13 LEU 40 3HD1 LEU 40 3.172 16.033 -2.117
283 HD21 LEU 40 3HD2 LEU 40 -0.277 15.546 -0.814
284 HD22 LEU 40 1HD2 LEU 40 0.353 13.915 -1.042
285 HD23 LEU 40 2HD2 LEU 40 -0.814 14.574 -2.182
286 HA PRO 41 HA PRO 41 -2.493 19.928 -5.148
287 HB2 PRO 41 2HB PRO 41 -4.234 20.578 -3.252
288 HB3 PRO 41 1HB PRO 41 -4.528 19.189 -4.305
289 HG2 PRO 41 2HG PRO 41 -3.570 19.259 -1.477
290 HG3 PRO 41 1HG PRO 41 -4.675 18.118 -2.252
291 HD2 PRO 41 2HD PRO 41 -1.960 17.695 -1.798
292 HD3 PRO 41 1HD PRO 41 -2.951 16.779 -2.938
293 H ASP 42 H ASP 42 0.024 19.948 -3.601
294 HA ASP 42 HA ASP 42 -0.177 22.697 -2.645
295 HB2 ASP 42 2HB ASP 42 -0.187 20.864 -0.705
296 HB3 ASP 42 1HB ASP 42 1.547 20.870 -1.022
297 H THR 43 H THR 43 2.374 23.240 -1.998
298 HA THR 43 HA THR 43 3.823 22.544 -4.447
299 HB THR 43 HB THR 43 4.123 25.088 -2.823
300 HG1 THR 43 1HG THR 43 2.234 25.552 -3.556
301 HG21 THR 43 3HG2 THR 43 5.027 25.963 -4.924
302 HG22 THR 43 1HG2 THR 43 4.754 24.392 -5.684
303 HG23 THR 43 2HG2 THR 43 5.928 24.543 -4.371
304 H GLY 44 H GLY 44 6.244 22.505 -4.153
305 HA2 GLY 44 2HA GLY 44 8.178 22.392 -2.713
306 HA3 GLY 44 1HA GLY 44 7.102 21.971 -1.382
307 H VAL 45 H VAL 45 5.973 20.495 -3.925
308 HA VAL 45 HA VAL 45 6.872 17.896 -3.000
309 HB VAL 45 HB VAL 45 4.738 18.642 -5.019
310 HG11 VAL 45 1HG1 VAL 45 5.141 16.117 -3.467
311 HG12 VAL 45 2HG1 VAL 45 5.446 16.343 -5.192
312 HG13 VAL 45 3HG1 VAL 45 3.801 16.464 -4.560
313 HG21 VAL 45 3HG2 VAL 45 4.266 19.683 -2.878
314 HG22 VAL 45 1HG2 VAL 45 4.451 18.128 -2.072
315 HG23 VAL 45 2HG2 VAL 45 3.121 18.381 -3.207
316 H SER 46 H SER 46 8.170 16.579 -4.221
317 HA SER 46 HA SER 46 9.490 17.567 -6.585
318 HB2 SER 46 2HB SER 46 9.474 14.707 -5.591
319 HB3 SER 46 1HB SER 46 10.732 15.524 -6.501
320 HG SER 46 HG SER 46 10.862 15.119 -4.115
321 H ARG 47 H ARG 47 9.526 15.951 -8.613
322 HA ARG 47 HA ARG 47 6.857 15.504 -9.470
323 HB2 ARG 47 2HB ARG 47 7.767 14.472 -11.479
324 HB3 ARG 47 1HB ARG 47 8.622 15.957 -11.125
325 HG2 ARG 47 2HG ARG 47 10.442 14.497 -10.145
326 HG3 ARG 47 1HG ARG 47 9.551 13.119 -10.795
327 HD2 ARG 47 2HD ARG 47 11.219 13.748 -12.389
328 HD3 ARG 47 1HD ARG 47 9.626 14.170 -13.020
329 HE ARG 47 HE ARG 47 11.412 16.125 -11.742
330 HH11 ARG 47 1HH1 ARG 47 9.184 15.304 -14.429
331 HH12 ARG 47 2HH1 ARG 47 9.308 16.841 -15.142
332 HH21 ARG 47 1HH2 ARG 47 11.549 18.256 -12.814
333 HH22 ARG 47 2HH2 ARG 47 10.666 18.517 -14.236
334 H ARG 48 H ARG 48 9.253 13.574 -7.993
335 HA ARG 48 HA ARG 48 7.164 11.660 -7.314
336 HB2 ARG 48 2HB ARG 48 10.139 11.109 -7.566
337 HB3 ARG 48 1HB ARG 48 8.927 9.967 -7.021
338 HG2 ARG 48 2HG ARG 48 7.899 10.116 -9.291
339 HG3 ARG 48 1HG ARG 48 9.299 11.071 -9.784
340 HD2 ARG 48 2HD ARG 48 9.407 8.305 -8.607
341 HD3 ARG 48 1HD ARG 48 9.566 8.688 -10.329
342 HE ARG 48 HE ARG 48 11.488 10.133 -9.062
343 HH11 ARG 48 1HH1 ARG 48 10.619 6.697 -9.209
344 HH12 ARG 48 2HH1 ARG 48 12.198 6.125 -8.992
345 HH21 ARG 48 1HH2 ARG 48 13.703 9.335 -8.776
346 HH22 ARG 48 2HH2 ARG 48 13.995 7.662 -8.736
347 H HIS 49 H HIS 49 6.686 12.440 -5.348
348 HA HIS 49 HA HIS 49 8.827 13.623 -3.761
349 HB2 HIS 49 2HB HIS 49 6.830 14.955 -3.915
350 HB3 HIS 49 1HB HIS 49 5.803 13.634 -3.397
351 HD2 HIS 49 2HD HIS 49 5.997 13.023 -0.614
352 HE1 HIS 49 1HE HIS 49 7.879 16.668 0.364
353 HE2 HIS 49 2HE HIS 49 7.221 14.361 1.158
354 H LEU 50 H LEU 50 6.657 10.930 -3.863
355 HA LEU 50 HA LEU 50 8.287 9.510 -2.028
356 HB2 LEU 50 2HB LEU 50 7.064 10.809 -0.417
357 HB3 LEU 50 1HB LEU 50 5.548 10.469 -1.206
358 HG LEU 50 HG LEU 50 7.070 8.169 -0.037
359 HD11 LEU 50 1HD1 LEU 50 5.371 10.135 1.501
360 HD12 LEU 50 2HD1 LEU 50 7.118 9.956 1.663
361 HD13 LEU 50 3HD1 LEU 50 6.053 8.638 2.138
362 HD21 LEU 50 3HD2 LEU 50 4.136 8.899 -0.178
363 HD22 LEU 50 1HD2 LEU 50 4.798 7.380 0.425
364 HD23 LEU 50 2HD2 LEU 50 4.972 7.803 -1.279
365 H GLU 51 H GLU 51 7.877 7.350 -2.137
366 HA GLU 51 HA GLU 51 5.628 6.579 -3.831
367 HB2 GLU 51 2HB GLU 51 6.951 4.825 -4.884
368 HB3 GLU 51 1HB GLU 51 7.634 6.408 -5.211
369 HG2 GLU 51 2HG GLU 51 9.397 6.045 -3.650
370 HG3 GLU 51 1HG GLU 51 8.629 4.574 -3.056
371 H ILE 52 H ILE 52 4.591 4.830 -3.244
372 HA ILE 52 HA ILE 52 5.603 3.398 -0.903
373 HB ILE 52 HB ILE 52 2.745 3.588 -1.883
374 HG12 ILE 52 2HG1 ILE 52 4.024 4.725 0.622
375 HG13 ILE 52 1HG1 ILE 52 3.588 5.672 -0.793
376 HG21 ILE 52 1HG2 ILE 52 3.992 2.197 0.471
377 HG22 ILE 52 2HG2 ILE 52 3.296 1.462 -0.974
378 HG23 ILE 52 3HG2 ILE 52 2.247 2.330 0.174
379 HD11 ILE 52 3HD1 ILE 52 1.232 5.124 -0.425
380 HD12 ILE 52 1HD1 ILE 52 1.946 5.910 0.983
381 HD13 ILE 52 2HD1 ILE 52 1.677 4.170 0.990
382 H ARG 53 H ARG 53 6.613 1.682 -1.633
383 HA ARG 53 HA ARG 53 5.643 0.413 -4.051
384 HB2 ARG 53 2HB ARG 53 8.060 0.995 -3.763
385 HB3 ARG 53 1HB ARG 53 8.137 -0.159 -2.446
386 HG2 ARG 53 2HG ARG 53 7.764 -1.985 -3.906
387 HG3 ARG 53 1HG ARG 53 7.326 -0.912 -5.237
388 HD2 ARG 53 2HD ARG 53 10.042 -1.143 -3.938
389 HD3 ARG 53 1HD ARG 53 9.589 -1.728 -5.540
390 HE ARG 53 HE ARG 53 9.523 1.156 -4.831
391 HH11 ARG 53 1HH1 ARG 53 10.522 -1.395 -7.078
392 HH12 ARG 53 2HH1 ARG 53 11.101 -0.287 -8.227
393 HH21 ARG 53 1HH2 ARG 53 10.283 2.588 -6.350
394 HH22 ARG 53 2HH2 ARG 53 10.978 2.049 -7.835
395 H TRP 54 H TRP 54 4.135 -0.995 -3.761
396 HA TRP 54 HA TRP 54 4.033 -2.407 -1.238
397 HB2 TRP 54 2HB TRP 54 2.123 -1.011 -1.403
398 HB3 TRP 54 1HB TRP 54 1.857 -1.439 -3.088
399 HD1 TRP 54 HD TRP 54 -0.132 -2.990 -3.391
400 HE1 TRP 54 1HE TRP 54 -1.281 -4.825 -2.016
401 HE3 TRP 54 3HE TRP 54 2.861 -2.923 0.722
402 HZ2 TRP 54 2HZ TRP 54 -0.967 -6.092 0.480
403 HZ3 TRP 54 3HZ TRP 54 2.395 -4.470 2.556
404 HH2 TRP 54 HH TRP 54 0.510 -6.031 2.449
405 H ASP 55 H ASP 55 4.252 -4.455 -1.234
406 HA ASP 55 HA ASP 55 3.602 -6.101 -3.541
407 HB2 ASP 55 2HB ASP 55 6.072 -5.778 -3.573
408 HB3 ASP 55 1HB ASP 55 6.151 -6.262 -1.884
409 H GLY 56 H GLY 56 3.089 -8.292 -2.768
410 HA2 GLY 56 2HA GLY 56 1.621 -8.178 -0.308
411 HA3 GLY 56 1HA GLY 56 1.773 -9.574 -1.360
412 H GLN 57 H GLN 57 3.947 -7.661 0.609
413 HA GLN 57 HA GLN 57 4.687 -9.920 2.270
414 HB2 GLN 57 2HB GLN 57 6.247 -10.042 0.339
415 HB3 GLN 57 1HB GLN 57 6.703 -8.368 0.611
416 HG2 GLN 57 2HG GLN 57 7.630 -8.987 2.792
417 HG3 GLN 57 1HG GLN 57 7.181 -10.660 2.500
418 HE21 GLN 57 1HE2 GLN 57 9.788 -9.473 2.956
419 HE22 GLN 57 2HE2 GLN 57 10.773 -9.903 1.621
420 H VAL 58 H VAL 58 5.814 -6.641 1.390
421 HA VAL 58 HA VAL 58 5.167 -5.657 4.038
422 HB VAL 58 HB VAL 58 7.340 -4.424 4.164
423 HG11 VAL 58 1HG1 VAL 58 8.736 -6.302 4.927
424 HG12 VAL 58 2HG1 VAL 58 7.597 -7.425 4.178
425 HG13 VAL 58 3HG1 VAL 58 7.078 -6.402 5.515
426 HG21 VAL 58 3HG2 VAL 58 8.191 -6.259 1.922
427 HG22 VAL 58 1HG2 VAL 58 9.262 -5.188 2.830
428 HG23 VAL 58 2HG2 VAL 58 7.987 -4.509 1.819
429 H ALA 59 H ALA 59 5.203 -3.271 4.075
430 HA ALA 59 HA ALA 59 4.556 -2.219 1.419
431 HB1 ALA 59 1HB ALA 59 2.680 -2.119 2.999
432 HB2 ALA 59 2HB ALA 59 3.275 -0.496 2.639
433 HB3 ALA 59 3HB ALA 59 3.707 -1.285 4.161
434 H LEU 60 H LEU 60 6.317 -1.373 0.650
435 HA LEU 60 HA LEU 60 8.291 -0.341 2.458
436 HB2 LEU 60 2HB LEU 60 8.847 -1.975 0.721
437 HB3 LEU 60 1HB LEU 60 8.351 -0.832 -0.503
438 HG LEU 60 HG LEU 60 10.188 0.669 0.237
439 HD11 LEU 60 1HD1 LEU 60 11.963 -0.309 1.640
440 HD12 LEU 60 2HD1 LEU 60 10.927 -1.712 1.930
441 HD13 LEU 60 3HD1 LEU 60 10.441 -0.123 2.511
442 HD21 LEU 60 3HD2 LEU 60 10.951 -2.117 -0.614
443 HD22 LEU 60 1HD2 LEU 60 11.958 -0.678 -0.808
444 HD23 LEU 60 2HD2 LEU 60 10.419 -0.816 -1.671
445 H LEU 61 H LEU 61 7.808 1.625 3.042
446 HA LEU 61 HA LEU 61 6.842 3.639 1.220
447 HB2 LEU 61 2HB LEU 61 5.974 3.430 3.454
448 HB3 LEU 61 1HB LEU 61 7.514 3.575 4.206
449 HG LEU 61 HG LEU 61 6.136 5.544 4.564
450 HD11 LEU 61 1HD1 LEU 61 8.477 6.053 4.402
451 HD12 LEU 61 2HD1 LEU 61 7.506 7.376 3.750
452 HD13 LEU 61 3HD1 LEU 61 8.335 6.266 2.657
453 HD21 LEU 61 3HD2 LEU 61 6.008 5.849 1.580
454 HD22 LEU 61 1HD2 LEU 61 5.300 6.933 2.776
455 HD23 LEU 61 2HD2 LEU 61 4.696 5.283 2.621
456 H ALA 62 H ALA 62 8.171 5.062 0.174
457 HA ALA 62 HA ALA 62 10.870 5.464 1.182
458 HB1 ALA 62 1HB ALA 62 10.998 3.757 -0.588
459 HB2 ALA 62 2HB ALA 62 11.828 5.246 -1.026
460 HB3 ALA 62 3HB ALA 62 10.241 4.886 -1.714
461 H ASP 63 H ASP 63 11.092 7.505 1.501
462 HA ASP 63 HA ASP 63 9.422 9.480 0.177
463 HB2 ASP 63 2HB ASP 63 9.868 9.608 2.621
464 HB3 ASP 63 1HB ASP 63 11.577 9.826 2.272
465 H LEU 64 H LEU 64 10.102 10.943 -1.299
466 HA LEU 64 HA LEU 64 12.886 10.717 -2.279
467 HB2 LEU 64 2HB LEU 64 10.903 9.644 -3.605
468 HB3 LEU 64 1HB LEU 64 10.439 11.279 -3.958
469 HG LEU 64 HG LEU 64 11.462 10.465 -5.859
470 HD11 LEU 64 1HD1 LEU 64 13.577 12.115 -4.534
471 HD12 LEU 64 2HD1 LEU 64 12.195 12.676 -5.481
472 HD13 LEU 64 3HD1 LEU 64 13.480 11.751 -6.261
473 HD21 LEU 64 3HD2 LEU 64 12.476 8.494 -5.012
474 HD22 LEU 64 1HD2 LEU 64 13.746 9.420 -4.204
475 HD23 LEU 64 2HD2 LEU 64 13.647 9.381 -5.975
476 H ASN 65 H ASN 65 13.110 12.602 -0.717
477 HA ASN 65 HA ASN 65 13.179 15.102 -1.964
478 HB2 ASN 65 2HB ASN 65 10.629 14.853 -1.582
479 HB3 ASN 65 1HB ASN 65 10.999 15.003 0.133
480 HD21 ASN 65 1HD2 ASN 65 10.604 16.631 -2.807
481 HD22 ASN 65 2HD2 ASN 65 10.936 18.218 -2.230
482 H SER 66 H SER 66 14.354 16.547 -0.610
483 HA SER 66 HA SER 66 14.894 15.497 2.053
484 HB2 SER 66 2HB SER 66 17.017 16.896 1.931
485 HB3 SER 66 1HB SER 66 16.929 15.491 0.873
486 HG SER 66 HG SER 66 17.704 17.197 -0.219
487 H THR 67 H THR 67 14.284 18.547 0.364
488 HA THR 67 HA THR 67 14.428 20.189 2.674
489 HB THR 67 HB THR 67 14.809 21.155 0.448
490 HG1 THR 67 1HG THR 67 13.986 22.506 2.096
491 HG21 THR 67 3HG2 THR 67 11.872 20.646 -0.090
492 HG22 THR 67 1HG2 THR 67 13.224 19.833 -0.874
493 HG23 THR 67 2HG2 THR 67 12.959 21.555 -1.139
494 H ASN 68 H ASN 68 11.833 18.457 1.212
495 HA ASN 68 HA ASN 68 9.859 19.600 3.075
496 HB2 ASN 68 2HB ASN 68 9.752 20.158 0.561
497 HB3 ASN 68 1HB ASN 68 9.402 18.459 0.310
498 HD21 ASN 68 1HD2 ASN 68 7.453 18.840 -0.529
499 HD22 ASN 68 2HD2 ASN 68 6.084 19.391 0.381
500 H GLY 69 H GLY 69 11.757 17.352 3.313
501 HA2 GLY 69 2HA GLY 69 11.006 14.814 2.660
502 HA3 GLY 69 1HA GLY 69 11.868 15.219 4.123
503 H THR 70 H THR 70 9.876 13.197 3.451
504 HA THR 70 HA THR 70 7.470 13.892 4.862
505 HB THR 70 HB THR 70 8.369 11.329 3.557
506 HG1 THR 70 1HG THR 70 8.076 12.490 1.887
507 HG21 THR 70 3HG2 THR 70 5.624 12.218 4.483
508 HG22 THR 70 1HG2 THR 70 6.581 10.917 5.178
509 HG23 THR 70 2HG2 THR 70 5.951 10.766 3.537
510 H THR 71 H THR 71 6.656 12.784 6.648
511 HA THR 71 HA THR 71 8.630 11.486 8.379
512 HB THR 71 HB THR 71 7.248 12.451 10.253
513 HG1 THR 71 1HG THR 71 6.080 13.766 8.043
514 HG21 THR 71 3HG2 THR 71 8.289 14.626 10.134
515 HG22 THR 71 1HG2 THR 71 8.660 14.334 8.419
516 HG23 THR 71 2HG2 THR 71 9.377 13.294 9.678
517 H VAL 72 H VAL 72 7.933 9.693 9.490
518 HA VAL 72 HA VAL 72 5.195 8.781 8.953
519 HB VAL 72 HB VAL 72 6.035 6.439 9.377
520 HG11 VAL 72 1HG1 VAL 72 7.435 6.222 7.386
521 HG12 VAL 72 2HG1 VAL 72 7.716 7.966 7.397
522 HG13 VAL 72 3HG1 VAL 72 6.099 7.341 7.103
523 HG21 VAL 72 3HG2 VAL 72 8.469 6.056 9.613
524 HG22 VAL 72 1HG2 VAL 72 7.826 7.001 10.963
525 HG23 VAL 72 2HG2 VAL 72 8.716 7.808 9.681
526 H ASN 73 H ASN 73 3.922 8.811 10.651
527 HA ASN 73 HA ASN 73 3.126 9.225 12.700
528 HB2 ASN 73 2HB ASN 73 5.686 7.915 13.708
529 HB3 ASN 73 1HB ASN 73 4.281 8.249 14.710
530 HD21 ASN 73 1HD2 ASN 73 5.664 6.259 12.321
531 HD22 ASN 73 2HD2 ASN 73 4.432 5.085 12.187
532 H ASN 74 H ASN 74 4.880 11.041 11.306
533 HA ASN 74 HA ASN 74 5.520 13.120 11.386
534 HB2 ASN 74 2HB ASN 74 3.869 13.434 13.277
535 HB3 ASN 74 1HB ASN 74 5.185 13.169 14.409
536 HD21 ASN 74 1HD2 ASN 74 5.126 15.184 15.311
537 HD22 ASN 74 2HD2 ASN 74 5.568 16.616 14.462
538 H ALA 75 H ALA 75 7.212 10.600 12.262
539 HA ALA 75 HA ALA 75 9.595 12.037 13.159
540 HB1 ALA 75 1HB ALA 75 10.525 9.792 13.594
541 HB2 ALA 75 2HB ALA 75 9.046 9.063 12.960
542 HB3 ALA 75 3HB ALA 75 8.992 10.020 14.439
543 HA PRO 76 HA PRO 76 10.779 11.975 8.861
544 HB2 PRO 76 2HB PRO 76 13.256 13.020 9.111
545 HB3 PRO 76 1HB PRO 76 11.788 13.991 9.264
546 HG2 PRO 76 2HG PRO 76 13.556 12.880 11.393
547 HG3 PRO 76 1HG PRO 76 12.754 14.457 11.319
548 HD2 PRO 76 2HD PRO 76 11.825 12.344 12.797
549 HD3 PRO 76 1HD PRO 76 10.786 13.629 12.152
550 H VAL 77 H VAL 77 11.357 10.386 7.671
551 HA VAL 77 HA VAL 77 13.829 8.952 8.000
552 HB VAL 77 HB VAL 77 12.765 6.725 7.794
553 HG11 VAL 77 1HG1 VAL 77 11.857 6.409 10.050
554 HG12 VAL 77 2HG1 VAL 77 11.743 8.159 10.239
555 HG13 VAL 77 3HG1 VAL 77 13.320 7.395 10.059
556 HG21 VAL 77 3HG2 VAL 77 10.175 8.208 8.123
557 HG22 VAL 77 1HG2 VAL 77 10.331 6.449 8.190
558 HG23 VAL 77 2HG2 VAL 77 10.724 7.316 6.705
559 H GLN 78 H GLN 78 13.822 7.345 5.995
560 HA GLN 78 HA GLN 78 12.358 8.654 3.803
561 HB2 GLN 78 2HB GLN 78 15.013 7.228 3.628
562 HB3 GLN 78 1HB GLN 78 14.149 7.986 2.296
563 HG2 GLN 78 2HG GLN 78 14.380 10.154 3.433
564 HG3 GLN 78 1HG GLN 78 15.325 9.362 4.686
565 HE21 GLN 78 1HE2 GLN 78 15.550 8.533 1.278
566 HE22 GLN 78 2HE2 GLN 78 17.148 9.152 1.079
567 H GLU 79 H GLU 79 13.483 5.662 5.202
568 HA GLU 79 HA GLU 79 11.726 4.183 3.420
569 HB2 GLU 79 2HB GLU 79 13.215 2.240 3.832
570 HB3 GLU 79 1HB GLU 79 14.039 3.563 3.033
571 HG2 GLU 79 2HG GLU 79 14.265 2.873 5.976
572 HG3 GLU 79 1HG GLU 79 15.426 2.412 4.743
573 H TRP 80 H TRP 80 10.159 2.946 4.354
574 HA TRP 80 HA TRP 80 10.153 2.228 7.188
575 HB2 TRP 80 2HB TRP 80 9.603 4.643 7.247
576 HB3 TRP 80 1HB TRP 80 8.255 4.408 6.172
577 HD1 TRP 80 HD TRP 80 6.033 3.679 7.210
578 HE1 TRP 80 1HE TRP 80 5.233 3.417 9.650
579 HE3 TRP 80 3HE TRP 80 10.557 3.689 9.561
580 HZ2 TRP 80 2HZ TRP 80 6.344 3.217 12.173
581 HZ3 TRP 80 3HZ TRP 80 10.592 3.464 12.006
582 HH2 TRP 80 HH TRP 80 8.495 3.243 13.276
583 H GLN 81 H GLN 81 9.047 0.764 7.649
584 HA GLN 81 HA GLN 81 7.443 -0.574 5.668
585 HB2 GLN 81 2HB GLN 81 8.792 -2.072 6.839
586 HB3 GLN 81 1HB GLN 81 8.639 -1.182 8.339
587 HG2 GLN 81 2HG GLN 81 7.556 -3.198 8.639
588 HG3 GLN 81 1HG GLN 81 6.364 -1.906 8.472
589 HE21 GLN 81 1HE2 GLN 81 6.115 -4.814 8.121
590 HE22 GLN 81 2HE2 GLN 81 5.441 -5.084 6.560
591 H LEU 82 H LEU 82 5.578 0.426 5.449
592 HA LEU 82 HA LEU 82 4.160 1.981 7.302
593 HB2 LEU 82 2HB LEU 82 2.961 0.346 5.070
594 HB3 LEU 82 1HB LEU 82 2.198 1.656 5.947
595 HG LEU 82 HG LEU 82 4.632 1.971 4.199
596 HD11 LEU 82 1HD1 LEU 82 2.593 1.443 2.905
597 HD12 LEU 82 2HD1 LEU 82 3.137 3.109 2.672
598 HD13 LEU 82 3HD1 LEU 82 1.768 2.775 3.725
599 HD21 LEU 82 3HD2 LEU 82 4.154 4.352 4.474
600 HD22 LEU 82 1HD2 LEU 82 4.541 3.564 6.002
601 HD23 LEU 82 2HD2 LEU 82 2.868 3.939 5.608
602 H ALA 83 H ALA 83 2.328 1.593 8.584
603 HA ALA 83 HA ALA 83 1.626 -1.172 9.141
604 HB1 ALA 83 1HB ALA 83 3.280 -0.515 10.838
605 HB2 ALA 83 2HB ALA 83 1.684 -0.725 11.556
606 HB3 ALA 83 3HB ALA 83 2.303 0.898 11.246
607 H ASP 84 H ASP 84 -0.487 -1.197 10.466
608 HA ASP 84 HA ASP 84 -2.328 0.575 9.181
609 HB2 ASP 84 2HB ASP 84 -3.030 -1.722 9.712
610 HB3 ASP 84 1HB ASP 84 -2.809 -1.401 11.427
611 H GLY 85 H GLY 85 -2.549 2.559 9.728
612 HA2 GLY 85 2HA GLY 85 -3.365 4.204 11.234
613 HA3 GLY 85 1HA GLY 85 -2.711 3.252 12.563
614 H ASP 86 H ASP 86 -0.660 3.612 9.781
615 HA ASP 86 HA ASP 86 1.094 5.241 11.434
616 HB2 ASP 86 2HB ASP 86 1.849 3.252 9.797
617 HB3 ASP 86 1HB ASP 86 1.822 4.558 8.603
618 H VAL 87 H VAL 87 1.366 7.318 11.146
619 HA VAL 87 HA VAL 87 -0.319 8.538 9.087
620 HB VAL 87 HB VAL 87 0.962 9.947 11.460
621 HG11 VAL 87 1HG1 VAL 87 -0.599 11.769 10.912
622 HG12 VAL 87 2HG1 VAL 87 -1.150 10.861 9.505
623 HG13 VAL 87 3HG1 VAL 87 0.514 11.430 9.587
624 HG21 VAL 87 3HG2 VAL 87 -1.292 9.966 12.450
625 HG22 VAL 87 1HG2 VAL 87 -0.693 8.322 12.218
626 HG23 VAL 87 2HG2 VAL 87 -1.882 8.990 11.101
627 H ILE 88 H ILE 88 0.642 9.021 7.359
628 HA ILE 88 HA ILE 88 3.519 9.462 7.370
629 HB ILE 88 HB ILE 88 1.569 9.182 5.089
630 HG12 ILE 88 2HG1 ILE 88 1.602 7.101 6.354
631 HG13 ILE 88 1HG1 ILE 88 2.379 6.876 4.796
632 HG21 ILE 88 1HG2 ILE 88 3.547 10.352 4.420
633 HG22 ILE 88 2HG2 ILE 88 3.541 8.744 3.687
634 HG23 ILE 88 3HG2 ILE 88 4.576 9.077 5.078
635 HD11 ILE 88 3HD1 ILE 88 3.783 7.224 7.442
636 HD12 ILE 88 1HD1 ILE 88 4.550 6.985 5.868
637 HD13 ILE 88 2HD1 ILE 88 3.553 5.710 6.558
638 H ARG 89 H ARG 89 3.923 11.557 7.756
639 HA ARG 89 HA ARG 89 2.008 13.493 6.733
640 HB2 ARG 89 2HB ARG 89 2.522 13.360 9.213
641 HB3 ARG 89 1HB ARG 89 4.135 13.928 8.827
642 HG2 ARG 89 2HG ARG 89 3.307 16.003 8.057
643 HG3 ARG 89 1HG ARG 89 1.635 15.435 8.140
644 HD2 ARG 89 2HD ARG 89 2.025 15.069 10.604
645 HD3 ARG 89 1HD ARG 89 3.535 15.951 10.410
646 HE ARG 89 HE ARG 89 2.304 17.883 9.826
647 HH11 ARG 89 1HH1 ARG 89 0.311 15.209 11.076
648 HH12 ARG 89 2HH1 ARG 89 -1.019 16.173 11.461
649 HH21 ARG 89 1HH2 ARG 89 0.492 19.246 10.456
650 HH22 ARG 89 2HH2 ARG 89 -0.881 18.573 11.185
651 H LEU 90 H LEU 90 2.584 14.183 4.911
652 HA LEU 90 HA LEU 90 5.408 14.382 4.234
653 HB2 LEU 90 2HB LEU 90 4.878 14.015 1.890
654 HB3 LEU 90 1HB LEU 90 4.347 12.674 2.855
655 HG LEU 90 HG LEU 90 2.586 14.764 1.546
656 HD11 LEU 90 1HD1 LEU 90 1.911 12.902 0.120
657 HD12 LEU 90 2HD1 LEU 90 3.057 11.851 0.956
658 HD13 LEU 90 3HD1 LEU 90 3.645 13.212 0.007
659 HD21 LEU 90 3HD2 LEU 90 1.826 12.313 3.175
660 HD22 LEU 90 1HD2 LEU 90 0.717 13.225 2.145
661 HD23 LEU 90 2HD2 LEU 90 1.433 14.001 3.537
662 H GLY 91 H GLY 91 5.852 16.019 2.525
663 HA2 GLY 91 2HA GLY 91 5.715 18.475 3.606
664 HA3 GLY 91 1HA GLY 91 5.878 18.205 1.889
665 H HIS 92 H HIS 92 3.932 19.266 4.427
666 HA HIS 92 HA HIS 92 2.213 20.697 4.582
667 HB2 HIS 92 2HB HIS 92 2.193 20.761 1.560
668 HB3 HIS 92 1HB HIS 92 1.253 21.826 2.595
669 HD1 HIS 92 1HD HIS 92 4.124 22.023 0.597
670 HD2 HIS 92 2HD HIS 92 3.307 23.156 4.516
671 HE1 HIS 92 1HE HIS 92 5.852 23.717 1.201
672 H SER 93 H SER 93 1.881 17.670 4.055
673 HA SER 93 HA SER 93 -0.994 17.807 4.280
674 HB2 SER 93 2HB SER 93 -0.531 17.574 1.814
675 HB3 SER 93 1HB SER 93 0.276 16.046 2.156
676 HG SER 93 HG SER 93 -2.452 16.657 2.705
677 H GLU 94 H GLU 94 -1.768 15.333 4.585
678 HA GLU 94 HA GLU 94 0.178 13.678 5.868
679 HB2 GLU 94 2HB GLU 94 -0.978 13.597 8.036
680 HB3 GLU 94 1HB GLU 94 -0.416 15.226 7.703
681 HG2 GLU 94 2HG GLU 94 -2.737 15.754 6.920
682 HG3 GLU 94 1HG GLU 94 -3.226 14.183 7.546
683 H ILE 95 H ILE 95 -0.520 11.563 5.975
684 HA ILE 95 HA ILE 95 -3.218 11.044 5.056
685 HB ILE 95 HB ILE 95 -1.715 11.124 3.055
686 HG12 ILE 95 2HG1 ILE 95 -2.278 8.837 2.167
687 HG13 ILE 95 1HG1 ILE 95 -2.912 8.482 3.777
688 HG21 ILE 95 1HG2 ILE 95 -0.298 8.802 4.312
689 HG22 ILE 95 2HG2 ILE 95 0.363 10.414 3.993
690 HG23 ILE 95 3HG2 ILE 95 -0.077 9.358 2.652
691 HD11 ILE 95 3HD1 ILE 95 -4.703 9.149 2.319
692 HD12 ILE 95 1HD1 ILE 95 -3.858 10.650 1.933
693 HD13 ILE 95 2HD1 ILE 95 -4.453 10.360 3.565
694 H ILE 96 H ILE 96 -4.070 9.063 5.929
695 HA ILE 96 HA ILE 96 -2.302 7.861 7.930
696 HB ILE 96 HB ILE 96 -5.331 7.682 7.739
697 HG12 ILE 96 2HG1 ILE 96 -3.673 9.439 9.573
698 HG13 ILE 96 1HG1 ILE 96 -4.523 10.019 8.147
699 HG21 ILE 96 1HG2 ILE 96 -3.418 6.993 9.981
700 HG22 ILE 96 2HG2 ILE 96 -4.270 5.839 8.957
701 HG23 ILE 96 3HG2 ILE 96 -5.178 6.875 10.058
702 HD11 ILE 96 3HD1 ILE 96 -5.796 8.776 10.578
703 HD12 ILE 96 1HD1 ILE 96 -6.651 9.368 9.157
704 HD13 ILE 96 2HD1 ILE 96 -5.767 10.494 10.185
705 H VAL 97 H VAL 97 -1.486 5.944 7.349
706 HA VAL 97 HA VAL 97 -2.653 4.479 5.147
707 HB VAL 97 HB VAL 97 -0.178 4.013 6.829
708 HG11 VAL 97 1HG1 VAL 97 0.390 2.230 5.229
709 HG12 VAL 97 2HG1 VAL 97 -1.169 2.453 4.434
710 HG13 VAL 97 3HG1 VAL 97 -1.102 1.860 6.092
711 HG21 VAL 97 3HG2 VAL 97 -0.088 5.884 5.267
712 HG22 VAL 97 1HG2 VAL 97 -0.584 4.801 3.965
713 HG23 VAL 97 2HG2 VAL 97 0.984 4.572 4.753
714 H ARG 98 H ARG 98 -4.165 2.923 5.415
715 HA ARG 98 HA ARG 98 -4.235 1.577 8.003
716 HB2 ARG 98 2HB ARG 98 -6.507 1.945 6.050
717 HB3 ARG 98 1HB ARG 98 -6.585 1.175 7.621
718 HG2 ARG 98 2HG ARG 98 -6.092 4.053 7.032
719 HG3 ARG 98 1HG ARG 98 -7.575 3.380 7.723
720 HD2 ARG 98 2HD ARG 98 -4.832 3.594 8.969
721 HD3 ARG 98 1HD ARG 98 -6.291 4.430 9.470
722 HE ARG 98 HE ARG 98 -5.815 1.530 9.762
723 HH11 ARG 98 1HH1 ARG 98 -7.462 4.504 10.902
724 HH12 ARG 98 2HH1 ARG 98 -7.896 3.796 12.386
725 HH21 ARG 98 1HH2 ARG 98 -6.363 0.666 11.842
726 HH22 ARG 98 2HH2 ARG 98 -7.277 1.611 12.942
727 H MET 99 H MET 99 -4.690 -0.546 7.952
728 HA MET 99 HA MET 99 -4.285 -1.862 5.368
729 HB2 MET 99 2HB MET 99 -3.086 -2.757 7.994
730 HB3 MET 99 1HB MET 99 -3.137 -3.752 6.554
731 HG2 MET 99 2HG MET 99 -1.842 -1.998 5.363
732 HG3 MET 99 1HG MET 99 -1.677 -1.152 6.895
733 HE1 MET 99 3HE MET 99 0.988 -1.216 6.387
734 HE2 MET 99 1HE MET 99 0.710 -2.179 4.934
735 HE3 MET 99 2HE MET 99 1.882 -2.715 6.138
736 H HIS 100 H HIS 100 -5.869 -2.951 4.805
737 HA HIS 100 HA HIS 100 -7.833 -3.804 6.760
738 HB2 HIS 100 2HB HIS 100 -8.034 -3.364 3.766
739 HB3 HIS 100 1HB HIS 100 -9.344 -3.967 4.770
740 HD1 HIS 100 1HD HIS 100 -10.778 -2.211 5.936
741 HD2 HIS 100 2HD HIS 100 -7.314 -0.641 4.271
742 HE1 HIS 100 1HE HIS 100 -11.009 0.300 6.070
Start of MODEL 24
1 H1 GLY 1 1HT GLY 1 -8.570 -15.186 -9.748
2 H2 GLY 1 2HT GLY 1 -9.855 -15.237 -10.866
3 H3 GLY 1 3HT GLY 1 -10.083 -14.608 -9.290
4 HA2 GLY 1 1HA GLY 1 -8.318 -13.442 -11.321
5 HA3 GLY 1 2HA GLY 1 -9.924 -12.846 -10.896
6 H HIS 2 H HIS 2 -8.007 -11.083 -10.632
7 HA HIS 2 HA HIS 2 -6.921 -11.205 -7.968
8 HB2 HIS 2 2HB HIS 2 -6.738 -9.038 -10.082
9 HB3 HIS 2 1HB HIS 2 -5.993 -8.922 -8.492
10 HD1 HIS 2 1HD HIS 2 -4.539 -9.130 -11.446
11 HD2 HIS 2 2HD HIS 2 -4.802 -12.000 -8.460
12 HE1 HIS 2 1HE HIS 2 -2.619 -10.705 -11.824
13 H GLY 3 H GLY 3 -8.311 -11.036 -6.490
14 HA2 GLY 3 2HA GLY 3 -9.374 -8.828 -5.446
15 HA3 GLY 3 1HA GLY 3 -10.577 -9.266 -6.661
16 H SER 4 H SER 4 -8.530 -11.291 -4.637
17 HA SER 4 HA SER 4 -10.898 -12.827 -3.914
18 HB2 SER 4 2HB SER 4 -7.971 -13.490 -3.604
19 HB3 SER 4 1HB SER 4 -9.338 -14.595 -3.453
20 HG SER 4 HG SER 4 -7.993 -14.180 -5.577
21 H ALA 5 H ALA 5 -9.495 -10.261 -2.801
22 HA ALA 5 HA ALA 5 -9.370 -9.149 -0.909
23 HB1 ALA 5 1HB ALA 5 -10.564 -9.866 1.100
24 HB2 ALA 5 2HB ALA 5 -10.735 -11.491 0.437
25 HB3 ALA 5 3HB ALA 5 -11.564 -10.138 -0.329
26 H GLY 6 H GLY 6 -7.211 -9.194 -1.053
27 HA2 GLY 6 2HA GLY 6 -5.862 -11.025 0.815
28 HA3 GLY 6 1HA GLY 6 -5.069 -10.177 -0.515
29 H THR 7 H THR 7 -3.596 -9.459 1.254
30 HA THR 7 HA THR 7 -4.408 -7.783 3.312
31 HB THR 7 HB THR 7 -1.840 -7.672 1.708
32 HG1 THR 7 1HG THR 7 -2.682 -9.238 3.920
33 HG21 THR 7 3HG2 THR 7 -2.139 -5.733 3.189
34 HG22 THR 7 1HG2 THR 7 -0.866 -6.789 3.803
35 HG23 THR 7 2HG2 THR 7 -2.475 -6.813 4.538
36 H SER 8 H SER 8 -5.460 -5.941 3.175
37 HA SER 8 HA SER 8 -5.197 -4.357 0.710
38 HB2 SER 8 2HB SER 8 -7.422 -4.253 2.741
39 HB3 SER 8 1HB SER 8 -7.405 -3.534 1.136
40 HG SER 8 HG SER 8 -6.964 -6.275 1.390
41 H VAL 9 H VAL 9 -3.918 -2.636 0.960
42 HA VAL 9 HA VAL 9 -3.753 -1.458 3.616
43 HB VAL 9 HB VAL 9 -2.013 -0.824 1.221
44 HG11 VAL 9 1HG1 VAL 9 -0.484 0.097 2.943
45 HG12 VAL 9 2HG1 VAL 9 -1.716 -0.231 4.164
46 HG13 VAL 9 3HG1 VAL 9 -2.040 0.924 2.876
47 HG21 VAL 9 3HG2 VAL 9 -0.281 -2.237 2.279
48 HG22 VAL 9 1HG2 VAL 9 -1.699 -3.166 1.791
49 HG23 VAL 9 2HG2 VAL 9 -1.465 -2.749 3.485
50 H THR 10 H THR 10 -5.068 0.110 3.949
51 HA THR 10 HA THR 10 -6.073 1.659 1.678
52 HB THR 10 HB THR 10 -7.469 1.086 4.310
53 HG1 THR 10 1HG THR 10 -8.812 -0.229 2.738
54 HG21 THR 10 3HG2 THR 10 -8.201 3.143 3.160
55 HG22 THR 10 1HG2 THR 10 -9.462 1.911 3.126
56 HG23 THR 10 2HG2 THR 10 -8.488 2.218 1.687
57 H LEU 11 H LEU 11 -5.418 3.674 1.737
58 HA LEU 11 HA LEU 11 -4.352 4.714 4.215
59 HB2 LEU 11 2HB LEU 11 -3.433 6.520 2.862
60 HB3 LEU 11 1HB LEU 11 -2.938 4.960 2.251
61 HG LEU 11 HG LEU 11 -4.867 5.365 0.528
62 HD11 LEU 11 1HD1 LEU 11 -4.285 8.197 1.399
63 HD12 LEU 11 2HD1 LEU 11 -5.829 7.354 1.538
64 HD13 LEU 11 3HD1 LEU 11 -5.175 7.739 -0.052
65 HD21 LEU 11 3HD2 LEU 11 -2.265 6.877 0.431
66 HD22 LEU 11 1HD2 LEU 11 -3.291 6.515 -0.958
67 HD23 LEU 11 2HD2 LEU 11 -2.531 5.204 -0.056
68 H GLN 12 H GLN 12 -5.274 6.315 5.372
69 HA GLN 12 HA GLN 12 -7.821 7.359 4.406
70 HB2 GLN 12 2HB GLN 12 -6.594 7.477 7.157
71 HB3 GLN 12 1HB GLN 12 -8.175 8.063 6.635
72 HG2 GLN 12 2HG GLN 12 -8.907 5.883 6.197
73 HG3 GLN 12 1HG GLN 12 -7.335 5.189 6.623
74 HE21 GLN 12 1HE2 GLN 12 -8.931 7.828 8.270
75 HE22 GLN 12 2HE2 GLN 12 -9.176 7.041 9.775
76 H LEU 13 H LEU 13 -7.896 9.385 3.902
77 HA LEU 13 HA LEU 13 -5.481 11.023 4.358
78 HB2 LEU 13 2HB LEU 13 -5.473 10.245 2.099
79 HB3 LEU 13 1HB LEU 13 -7.141 10.732 1.875
80 HG LEU 13 HG LEU 13 -6.398 13.051 2.325
81 HD11 LEU 13 1HD1 LEU 13 -4.266 12.658 3.335
82 HD12 LEU 13 2HD1 LEU 13 -4.037 13.604 1.866
83 HD13 LEU 13 3HD1 LEU 13 -3.660 11.879 1.869
84 HD21 LEU 13 3HD2 LEU 13 -5.599 13.422 0.015
85 HD22 LEU 13 1HD2 LEU 13 -7.006 12.367 0.133
86 HD23 LEU 13 2HD2 LEU 13 -5.407 11.670 -0.161
87 H ASP 14 H ASP 14 -5.847 13.067 5.105
88 HA ASP 14 HA ASP 14 -8.609 13.890 5.342
89 HB2 ASP 14 2HB ASP 14 -7.094 14.379 7.266
90 HB3 ASP 14 1HB ASP 14 -6.112 15.401 6.213
91 H ASP 15 H ASP 15 -9.329 14.344 3.564
92 HA ASP 15 HA ASP 15 -7.881 15.940 1.621
93 HB2 ASP 15 2HB ASP 15 -8.653 13.852 0.812
94 HB3 ASP 15 1HB ASP 15 -10.231 14.082 1.537
95 H GLY 16 H GLY 16 -9.825 16.485 4.096
96 HA2 GLY 16 2HA GLY 16 -10.767 18.748 4.360
97 HA3 GLY 16 1HA GLY 16 -11.533 18.510 2.787
98 H SER 17 H SER 17 -12.315 15.942 2.964
99 HA SER 17 HA SER 17 -14.139 15.932 5.250
100 HB2 SER 17 2HB SER 17 -14.440 14.442 2.621
101 HB3 SER 17 1HB SER 17 -15.649 14.610 3.890
102 HG SER 17 HG SER 17 -14.530 16.762 2.427
103 H GLY 18 H GLY 18 -12.613 13.596 3.002
104 HA2 GLY 18 2HA GLY 18 -10.771 12.421 4.491
105 HA3 GLY 18 1HA GLY 18 -12.247 11.748 5.174
106 H ARG 19 H ARG 19 -9.959 11.454 2.799
107 HA ARG 19 HA ARG 19 -11.677 9.771 1.084
108 HB2 ARG 19 2HB ARG 19 -8.841 10.692 0.654
109 HB3 ARG 19 1HB ARG 19 -9.741 9.611 -0.390
110 HG2 ARG 19 2HG ARG 19 -10.453 12.467 0.201
111 HG3 ARG 19 1HG ARG 19 -9.570 11.918 -1.221
112 HD2 ARG 19 2HD ARG 19 -11.515 10.580 -1.879
113 HD3 ARG 19 1HD ARG 19 -12.394 11.171 -0.466
114 HE ARG 19 HE ARG 19 -11.484 13.397 -1.772
115 HH11 ARG 19 1HH1 ARG 19 -13.770 10.780 -2.416
116 HH12 ARG 19 2HH1 ARG 19 -14.649 11.606 -3.597
117 HH21 ARG 19 1HH2 ARG 19 -12.647 14.575 -3.412
118 HH22 ARG 19 2HH2 ARG 19 -13.958 13.863 -4.216
119 H THR 20 H THR 20 -10.942 7.692 0.562
120 HA THR 20 HA THR 20 -8.752 6.660 2.101
121 HB THR 20 HB THR 20 -10.087 4.559 2.521
122 HG1 THR 20 1HG THR 20 -12.437 6.085 2.376
123 HG21 THR 20 3HG2 THR 20 -11.308 5.473 4.495
124 HG22 THR 20 1HG2 THR 20 -11.031 7.090 3.830
125 HG23 THR 20 2HG2 THR 20 -9.658 6.102 4.323
126 H TYR 21 H TYR 21 -7.538 5.287 0.923
127 HA TYR 21 HA TYR 21 -8.466 4.558 -1.779
128 HB2 TYR 21 2HB TYR 21 -7.306 6.759 -1.853
129 HB3 TYR 21 1HB TYR 21 -5.907 6.037 -1.096
130 HD1 TYR 21 2HD TYR 21 -4.535 4.361 -2.436
131 HD2 TYR 21 1HD TYR 21 -7.627 6.709 -4.181
132 HE1 TYR 21 2HE TYR 21 -3.565 3.974 -4.662
133 HE2 TYR 21 1HE TYR 21 -6.660 6.333 -6.409
134 HH TYR 21 HH TYR 21 -4.252 5.773 -7.301
135 H GLN 22 H GLN 22 -7.875 2.490 -2.211
136 HA GLN 22 HA GLN 22 -6.064 1.173 -0.367
137 HB2 GLN 22 2HB GLN 22 -8.121 -0.037 -0.946
138 HB3 GLN 22 1HB GLN 22 -7.711 0.046 -2.653
139 HG2 GLN 22 2HG GLN 22 -5.788 -1.387 -2.301
140 HG3 GLN 22 1HG GLN 22 -6.077 -1.397 -0.568
141 HE21 GLN 22 1HE2 GLN 22 -5.948 -3.616 -2.507
142 HE22 GLN 22 2HE2 GLN 22 -7.448 -4.442 -2.322
143 H LEU 23 H LEU 23 -4.049 0.978 -0.742
144 HA LEU 23 HA LEU 23 -2.650 2.131 -2.835
145 HB2 LEU 23 2HB LEU 23 -1.836 -0.098 -1.010
146 HB3 LEU 23 1HB LEU 23 -0.729 0.668 -2.118
147 HG LEU 23 HG LEU 23 -2.112 1.950 0.238
148 HD11 LEU 23 1HD1 LEU 23 0.171 2.156 1.089
149 HD12 LEU 23 2HD1 LEU 23 0.765 1.292 -0.332
150 HD13 LEU 23 3HD1 LEU 23 -0.280 0.474 0.819
151 HD21 LEU 23 3HD2 LEU 23 -0.738 3.929 -0.295
152 HD22 LEU 23 1HD2 LEU 23 -1.916 3.581 -1.564
153 HD23 LEU 23 2HD2 LEU 23 -0.222 3.149 -1.788
154 H ARG 24 H ARG 24 -1.842 1.491 -4.705
155 HA ARG 24 HA ARG 24 -3.136 -0.808 -5.870
156 HB2 ARG 24 2HB ARG 24 -1.179 1.038 -7.222
157 HB3 ARG 24 1HB ARG 24 -2.341 -0.062 -7.950
158 HG2 ARG 24 2HG ARG 24 -2.859 2.560 -6.575
159 HG3 ARG 24 1HG ARG 24 -3.230 2.102 -8.236
160 HD2 ARG 24 2HD ARG 24 -4.508 0.987 -5.750
161 HD3 ARG 24 1HD ARG 24 -5.227 2.155 -6.835
162 HE ARG 24 HE ARG 24 -4.770 0.149 -8.487
163 HH11 ARG 24 1HH1 ARG 24 -6.094 0.128 -5.201
164 HH12 ARG 24 2HH1 ARG 24 -7.202 -1.128 -5.494
165 HH21 ARG 24 1HH2 ARG 24 -6.289 -1.593 -8.897
166 HH22 ARG 24 2HH2 ARG 24 -7.299 -2.175 -7.664
167 H GLU 25 H GLU 25 -2.101 -2.499 -6.667
168 HA GLU 25 HA GLU 25 0.399 -3.078 -5.397
169 HB2 GLU 25 2HB GLU 25 0.323 -5.298 -6.618
170 HB3 GLU 25 1HB GLU 25 -1.015 -4.978 -5.533
171 HG2 GLU 25 2HG GLU 25 -2.389 -4.353 -7.492
172 HG3 GLU 25 1HG GLU 25 -1.031 -4.786 -8.528
173 H GLY 26 H GLY 26 2.192 -2.546 -5.930
174 HA2 GLY 26 2HA GLY 26 3.868 -2.512 -7.810
175 HA3 GLY 26 1HA GLY 26 2.667 -1.474 -8.598
176 H SER 27 H SER 27 4.582 0.128 -8.368
177 HA SER 27 HA SER 27 4.335 1.200 -5.699
178 HB2 SER 27 2HB SER 27 6.445 2.445 -6.137
179 HB3 SER 27 1HB SER 27 6.613 0.696 -6.159
180 HG SER 27 HG SER 27 7.503 0.979 -8.024
181 H ASN 28 H ASN 28 3.455 3.039 -5.321
182 HA ASN 28 HA ASN 28 2.479 4.521 -7.622
183 HB2 ASN 28 2HB ASN 28 0.792 5.499 -5.996
184 HB3 ASN 28 1HB ASN 28 0.595 3.785 -6.331
185 HD21 ASN 28 1HD2 ASN 28 1.003 2.297 -4.677
186 HD22 ASN 28 2HD2 ASN 28 1.145 2.809 -3.028
187 H ILE 29 H ILE 29 3.565 6.172 -8.094
188 HA ILE 29 HA ILE 29 5.286 7.401 -6.128
189 HB ILE 29 HB ILE 29 4.967 8.033 -9.080
190 HG12 ILE 29 2HG1 ILE 29 7.089 6.404 -7.653
191 HG13 ILE 29 1HG1 ILE 29 5.791 5.738 -8.634
192 HG21 ILE 29 1HG2 ILE 29 7.104 9.213 -8.836
193 HG22 ILE 29 2HG2 ILE 29 7.106 8.876 -7.105
194 HG23 ILE 29 3HG2 ILE 29 5.868 9.925 -7.799
195 HD11 ILE 29 3HD1 ILE 29 6.711 6.873 -10.594
196 HD12 ILE 29 1HD1 ILE 29 7.884 5.780 -9.860
197 HD13 ILE 29 2HD1 ILE 29 8.017 7.516 -9.595
198 H ILE 30 H ILE 30 4.710 9.052 -4.996
199 HA ILE 30 HA ILE 30 2.343 10.577 -5.711
200 HB ILE 30 HB ILE 30 3.837 10.308 -3.072
201 HG12 ILE 30 2HG1 ILE 30 1.147 9.187 -3.914
202 HG13 ILE 30 1HG1 ILE 30 2.623 8.265 -3.725
203 HG21 ILE 30 1HG2 ILE 30 1.373 11.884 -3.716
204 HG22 ILE 30 2HG2 ILE 30 2.923 12.472 -3.123
205 HG23 ILE 30 3HG2 ILE 30 1.905 11.473 -2.087
206 HD11 ILE 30 3HD1 ILE 30 2.645 8.765 -1.345
207 HD12 ILE 30 1HD1 ILE 30 1.135 7.991 -1.823
208 HD13 ILE 30 2HD1 ILE 30 1.176 9.727 -1.525
209 H GLY 31 H GLY 31 2.557 12.609 -6.318
210 HA2 GLY 31 2HA GLY 31 4.053 14.622 -5.386
211 HA3 GLY 31 1HA GLY 31 5.156 13.833 -6.524
212 H ARG 32 H ARG 32 4.963 15.932 -7.672
213 HA ARG 32 HA ARG 32 2.672 15.668 -9.516
214 HB2 ARG 32 2HB ARG 32 4.011 18.262 -8.712
215 HB3 ARG 32 1HB ARG 32 2.635 18.089 -9.789
216 HG2 ARG 32 2HG ARG 32 1.295 17.277 -7.883
217 HG3 ARG 32 1HG ARG 32 2.690 17.505 -6.845
218 HD2 ARG 32 2HD ARG 32 1.211 19.413 -6.649
219 HD3 ARG 32 1HD ARG 32 2.744 19.880 -7.380
220 HE ARG 32 HE ARG 32 0.459 19.282 -9.095
221 HH11 ARG 32 1HH1 ARG 32 2.772 21.659 -7.845
222 HH12 ARG 32 2HH1 ARG 32 2.269 22.906 -8.901
223 HH21 ARG 32 1HH2 ARG 32 -0.223 21.027 -10.552
224 HH22 ARG 32 2HH2 ARG 32 0.569 22.522 -10.476
225 H GLY 33 H GLY 33 3.663 14.778 -11.238
226 HA2 GLY 33 2HA GLY 33 5.537 16.108 -12.767
227 HA3 GLY 33 1HA GLY 33 6.403 14.979 -11.733
228 H GLN 34 H GLN 34 6.854 14.342 -14.063
229 HA GLN 34 HA GLN 34 4.982 13.021 -15.653
230 HB2 GLN 34 2HB GLN 34 6.828 12.326 -16.999
231 HB3 GLN 34 1HB GLN 34 7.175 13.935 -16.407
232 HG2 GLN 34 2HG GLN 34 8.340 11.386 -15.285
233 HG3 GLN 34 1HG GLN 34 9.155 12.457 -16.416
234 HE21 GLN 34 1HE2 GLN 34 9.809 11.540 -13.722
235 HE22 GLN 34 2HE2 GLN 34 10.136 12.953 -12.792
236 H ASP 35 H ASP 35 6.862 11.827 -12.982
237 HA ASP 35 HA ASP 35 6.196 9.049 -13.634
238 HB2 ASP 35 2HB ASP 35 8.145 10.284 -11.713
239 HB3 ASP 35 1HB ASP 35 7.621 8.628 -11.479
240 H ALA 36 H ALA 36 4.791 11.507 -12.003
241 HA ALA 36 HA ALA 36 4.065 10.099 -9.609
242 HB1 ALA 36 1HB ALA 36 2.795 12.089 -9.052
243 HB2 ALA 36 2HB ALA 36 3.055 12.723 -10.677
244 HB3 ALA 36 3HB ALA 36 4.421 12.515 -9.584
245 H GLN 37 H GLN 37 2.609 8.607 -9.582
246 HA GLN 37 HA GLN 37 0.465 8.520 -11.525
247 HB2 GLN 37 2HB GLN 37 1.331 6.617 -9.354
248 HB3 GLN 37 1HB GLN 37 -0.054 6.350 -10.398
249 HG2 GLN 37 2HG GLN 37 2.797 6.633 -11.331
250 HG3 GLN 37 1HG GLN 37 1.953 5.106 -11.109
251 HE21 GLN 37 1HE2 GLN 37 2.143 4.507 -13.224
252 HE22 GLN 37 2HE2 GLN 37 1.249 5.257 -14.502
253 H PHE 38 H PHE 38 1.069 9.181 -8.181
254 HA PHE 38 HA PHE 38 -1.722 9.968 -7.935
255 HB2 PHE 38 2HB PHE 38 -1.085 8.214 -6.292
256 HB3 PHE 38 1HB PHE 38 0.233 9.239 -5.735
257 HD1 PHE 38 2HD PHE 38 -3.476 9.174 -6.088
258 HD2 PHE 38 1HD PHE 38 -0.127 10.730 -3.990
259 HE1 PHE 38 2HE PHE 38 -4.984 10.206 -4.431
260 HE2 PHE 38 1HE PHE 38 -1.562 11.743 -2.364
261 HZ PHE 38 HZ PHE 38 -4.040 11.501 -2.555
262 H ARG 39 H ARG 39 -1.857 11.981 -8.225
263 HA ARG 39 HA ARG 39 0.526 13.625 -7.929
264 HB2 ARG 39 2HB ARG 39 -1.996 14.104 -9.520
265 HB3 ARG 39 1HB ARG 39 -0.576 15.146 -9.504
266 HG2 ARG 39 2HG ARG 39 0.775 13.452 -10.516
267 HG3 ARG 39 1HG ARG 39 -0.516 12.265 -10.368
268 HD2 ARG 39 2HD ARG 39 -1.889 13.657 -11.886
269 HD3 ARG 39 1HD ARG 39 -0.509 14.730 -12.098
270 HE ARG 39 HE ARG 39 0.698 12.719 -12.962
271 HH11 ARG 39 1HH1 ARG 39 -2.847 12.844 -13.223
272 HH12 ARG 39 2HH1 ARG 39 -2.886 11.832 -14.598
273 HH21 ARG 39 1HH2 ARG 39 0.573 11.367 -14.869
274 HH22 ARG 39 2HH2 ARG 39 -0.947 11.023 -15.557
275 H LEU 40 H LEU 40 0.648 14.928 -6.310
276 HA LEU 40 HA LEU 40 -1.565 15.308 -4.547
277 HB2 LEU 40 2HB LEU 40 1.203 16.490 -4.517
278 HB3 LEU 40 1HB LEU 40 -0.011 16.895 -3.321
279 HG LEU 40 HG LEU 40 1.191 14.164 -3.787
280 HD11 LEU 40 1HD1 LEU 40 2.138 14.486 -1.558
281 HD12 LEU 40 2HD1 LEU 40 1.439 16.107 -1.507
282 HD13 LEU 40 3HD1 LEU 40 2.701 15.726 -2.682
283 HD21 LEU 40 3HD2 LEU 40 -0.067 13.517 -1.768
284 HD22 LEU 40 1HD2 LEU 40 -1.139 13.948 -3.100
285 HD23 LEU 40 2HD2 LEU 40 -0.870 15.083 -1.781
286 HA PRO 41 HA PRO 41 -3.086 18.911 -6.506
287 HB2 PRO 41 2HB PRO 41 -5.009 19.580 -4.760
288 HB3 PRO 41 1HB PRO 41 -5.113 18.126 -5.758
289 HG2 PRO 41 2HG PRO 41 -4.421 18.397 -2.868
290 HG3 PRO 41 1HG PRO 41 -5.312 17.107 -3.695
291 HD2 PRO 41 2HD PRO 41 -2.609 17.018 -2.951
292 HD3 PRO 41 1HD PRO 41 -3.385 15.928 -4.099
293 H ASP 42 H ASP 42 -1.110 19.120 -3.863
294 HA ASP 42 HA ASP 42 -1.602 22.003 -3.420
295 HB2 ASP 42 2HB ASP 42 -1.389 20.333 -1.394
296 HB3 ASP 42 1HB ASP 42 0.311 20.326 -1.930
297 H THR 43 H THR 43 0.394 23.325 -3.186
298 HA THR 43 HA THR 43 2.174 22.617 -5.346
299 HB THR 43 HB THR 43 1.800 25.264 -3.966
300 HG1 THR 43 1HG THR 43 0.614 24.373 -6.405
301 HG21 THR 43 3HG2 THR 43 3.846 25.113 -5.311
302 HG22 THR 43 1HG2 THR 43 2.681 26.183 -6.091
303 HG23 THR 43 2HG2 THR 43 2.910 24.540 -6.692
304 H GLY 44 H GLY 44 4.483 22.773 -5.042
305 HA2 GLY 44 2HA GLY 44 6.383 23.350 -3.687
306 HA3 GLY 44 1HA GLY 44 5.393 23.071 -2.258
307 H VAL 45 H VAL 45 4.710 20.879 -4.588
308 HA VAL 45 HA VAL 45 6.217 18.775 -3.230
309 HB VAL 45 HB VAL 45 3.972 18.488 -5.259
310 HG11 VAL 45 1HG1 VAL 45 3.706 16.301 -4.397
311 HG12 VAL 45 2HG1 VAL 45 5.075 16.535 -3.312
312 HG13 VAL 45 3HG1 VAL 45 5.319 16.543 -5.065
313 HG21 VAL 45 3HG2 VAL 45 3.135 19.723 -3.336
314 HG22 VAL 45 1HG2 VAL 45 3.773 18.477 -2.260
315 HG23 VAL 45 2HG2 VAL 45 2.472 18.086 -3.391
316 H SER 46 H SER 46 7.803 17.755 -4.292
317 HA SER 46 HA SER 46 8.802 18.717 -6.767
318 HB2 SER 46 2HB SER 46 9.513 16.267 -5.155
319 HB3 SER 46 1HB SER 46 10.458 16.881 -6.509
320 HG SER 46 HG SER 46 10.088 17.938 -3.937
321 H ARG 47 H ARG 47 9.450 16.970 -8.526
322 HA ARG 47 HA ARG 47 7.027 16.018 -9.629
323 HB2 ARG 47 2HB ARG 47 8.413 14.970 -11.407
324 HB3 ARG 47 1HB ARG 47 8.716 16.677 -11.165
325 HG2 ARG 47 2HG ARG 47 10.713 15.975 -9.790
326 HG3 ARG 47 1HG ARG 47 10.415 14.334 -10.371
327 HD2 ARG 47 2HD ARG 47 12.064 15.419 -11.776
328 HD3 ARG 47 1HD ARG 47 10.558 15.133 -12.661
329 HE ARG 47 HE ARG 47 10.109 17.586 -11.898
330 HH11 ARG 47 1HH1 ARG 47 13.112 16.283 -13.240
331 HH12 ARG 47 2HH1 ARG 47 13.636 17.776 -13.844
332 HH21 ARG 47 1HH2 ARG 47 10.804 19.582 -12.686
333 HH22 ARG 47 2HH2 ARG 47 12.292 19.743 -13.491
334 H ARG 48 H ARG 48 9.434 14.526 -7.728
335 HA ARG 48 HA ARG 48 7.566 12.364 -7.221
336 HB2 ARG 48 2HB ARG 48 10.597 12.074 -7.425
337 HB3 ARG 48 1HB ARG 48 9.488 10.818 -6.901
338 HG2 ARG 48 2HG ARG 48 8.485 10.738 -9.099
339 HG3 ARG 48 1HG ARG 48 9.494 12.074 -9.628
340 HD2 ARG 48 2HD ARG 48 10.420 10.052 -10.457
341 HD3 ARG 48 1HD ARG 48 11.491 10.675 -9.207
342 HE ARG 48 HE ARG 48 10.002 8.890 -7.852
343 HH11 ARG 48 1HH1 ARG 48 11.772 8.716 -10.906
344 HH12 ARG 48 2HH1 ARG 48 12.083 7.044 -10.789
345 HH21 ARG 48 1HH2 ARG 48 10.478 6.532 -7.699
346 HH22 ARG 48 2HH2 ARG 48 11.323 5.811 -8.992
347 H HIS 49 H HIS 49 7.058 12.557 -5.179
348 HA HIS 49 HA HIS 49 8.805 14.138 -3.423
349 HB2 HIS 49 2HB HIS 49 6.675 15.150 -3.711
350 HB3 HIS 49 1HB HIS 49 5.760 13.714 -3.405
351 HD2 HIS 49 2HD HIS 49 6.736 12.945 -0.421
352 HE1 HIS 49 1HE HIS 49 5.900 16.982 0.486
353 HE2 HIS 49 2HE HIS 49 6.727 14.766 1.369
354 H LEU 50 H LEU 50 6.792 11.267 -3.609
355 HA LEU 50 HA LEU 50 8.534 9.740 -1.982
356 HB2 LEU 50 2HB LEU 50 7.413 10.908 -0.188
357 HB3 LEU 50 1HB LEU 50 5.855 10.707 -0.944
358 HG LEU 50 HG LEU 50 7.322 8.258 0.001
359 HD11 LEU 50 1HD1 LEU 50 7.451 9.882 1.849
360 HD12 LEU 50 2HD1 LEU 50 6.326 8.575 2.208
361 HD13 LEU 50 3HD1 LEU 50 5.715 10.155 1.710
362 HD21 LEU 50 3HD2 LEU 50 4.417 9.086 -0.041
363 HD22 LEU 50 1HD2 LEU 50 5.037 7.504 0.433
364 HD23 LEU 50 2HD2 LEU 50 5.205 8.050 -1.234
365 H GLU 51 H GLU 51 7.877 7.509 -2.130
366 HA GLU 51 HA GLU 51 5.560 7.043 -3.816
367 HB2 GLU 51 2HB GLU 51 6.803 5.339 -5.096
368 HB3 GLU 51 1HB GLU 51 7.356 6.970 -5.413
369 HG2 GLU 51 2HG GLU 51 9.249 6.569 -3.875
370 HG3 GLU 51 1HG GLU 51 8.683 4.913 -3.663
371 H ILE 52 H ILE 52 4.526 5.197 -3.415
372 HA ILE 52 HA ILE 52 5.559 3.693 -1.133
373 HB ILE 52 HB ILE 52 2.678 3.949 -2.035
374 HG12 ILE 52 2HG1 ILE 52 4.058 5.120 0.398
375 HG13 ILE 52 1HG1 ILE 52 3.563 6.035 -1.020
376 HG21 ILE 52 1HG2 ILE 52 3.182 1.810 -1.057
377 HG22 ILE 52 2HG2 ILE 52 2.196 2.755 0.076
378 HG23 ILE 52 3HG2 ILE 52 3.934 2.580 0.340
379 HD11 ILE 52 3HD1 ILE 52 1.730 4.583 0.882
380 HD12 ILE 52 1HD1 ILE 52 1.225 5.502 -0.538
381 HD13 ILE 52 2HD1 ILE 52 1.998 6.326 0.817
382 H ARG 53 H ARG 53 6.343 1.847 -1.732
383 HA ARG 53 HA ARG 53 5.317 0.633 -4.156
384 HB2 ARG 53 2HB ARG 53 7.701 0.659 -4.108
385 HB3 ARG 53 1HB ARG 53 7.750 -0.032 -2.494
386 HG2 ARG 53 2HG ARG 53 6.725 -2.090 -3.377
387 HG3 ARG 53 1HG ARG 53 6.762 -1.385 -4.987
388 HD2 ARG 53 2HD ARG 53 9.129 -1.321 -4.976
389 HD3 ARG 53 1HD ARG 53 9.197 -1.832 -3.281
390 HE ARG 53 HE ARG 53 7.866 -3.835 -4.354
391 HH11 ARG 53 1HH1 ARG 53 10.789 -2.236 -5.558
392 HH12 ARG 53 2HH1 ARG 53 11.377 -3.632 -6.330
393 HH21 ARG 53 1HH2 ARG 53 8.654 -5.699 -5.336
394 HH22 ARG 53 2HH2 ARG 53 10.124 -5.686 -6.209
395 H TRP 54 H TRP 54 3.563 -0.451 -3.839
396 HA TRP 54 HA TRP 54 3.392 -2.064 -1.460
397 HB2 TRP 54 2HB TRP 54 1.405 -0.734 -1.783
398 HB3 TRP 54 1HB TRP 54 1.328 -1.165 -3.486
399 HD1 TRP 54 HD TRP 54 -0.794 -2.588 -3.792
400 HE1 TRP 54 1HE TRP 54 -1.858 -4.607 -2.630
401 HE3 TRP 54 3HE TRP 54 2.361 -2.980 0.199
402 HZ2 TRP 54 2HZ TRP 54 -1.396 -6.198 -0.338
403 HZ3 TRP 54 3HZ TRP 54 1.992 -4.762 1.826
404 HH2 TRP 54 HH TRP 54 0.138 -6.345 1.574
405 H ASP 55 H ASP 55 4.326 -3.907 -1.708
406 HA ASP 55 HA ASP 55 4.223 -5.261 -4.313
407 HB2 ASP 55 2HB ASP 55 6.453 -4.875 -2.970
408 HB3 ASP 55 1HB ASP 55 5.854 -6.127 -1.892
409 H GLY 56 H GLY 56 4.242 -7.918 -3.441
410 HA2 GLY 56 2HA GLY 56 1.543 -7.948 -2.310
411 HA3 GLY 56 1HA GLY 56 2.289 -9.341 -3.071
412 H GLN 57 H GLN 57 4.349 -7.805 -1.031
413 HA GLN 57 HA GLN 57 3.669 -9.617 1.161
414 HB2 GLN 57 2HB GLN 57 6.338 -8.838 0.089
415 HB3 GLN 57 1HB GLN 57 6.158 -9.625 1.665
416 HG2 GLN 57 2HG GLN 57 5.274 -10.736 -1.001
417 HG3 GLN 57 1HG GLN 57 6.698 -11.249 -0.093
418 HE21 GLN 57 1HE2 GLN 57 4.219 -12.674 -0.933
419 HE22 GLN 57 2HE2 GLN 57 3.578 -13.335 0.526
420 H VAL 58 H VAL 58 5.608 -6.649 0.633
421 HA VAL 58 HA VAL 58 4.433 -5.673 3.128
422 HB VAL 58 HB VAL 58 6.528 -4.510 3.684
423 HG11 VAL 58 1HG1 VAL 58 6.878 -7.476 3.335
424 HG12 VAL 58 2HG1 VAL 58 6.131 -6.661 4.709
425 HG13 VAL 58 3HG1 VAL 58 7.853 -6.450 4.388
426 HG21 VAL 58 3HG2 VAL 58 8.634 -5.094 2.525
427 HG22 VAL 58 1HG2 VAL 58 7.492 -4.265 1.466
428 HG23 VAL 58 2HG2 VAL 58 7.700 -6.008 1.339
429 H ALA 59 H ALA 59 4.367 -3.395 3.356
430 HA ALA 59 HA ALA 59 4.087 -2.023 0.800
431 HB1 ALA 59 1HB ALA 59 2.070 -2.099 2.208
432 HB2 ALA 59 2HB ALA 59 2.665 -0.455 2.006
433 HB3 ALA 59 3HB ALA 59 2.967 -1.329 3.516
434 H LEU 60 H LEU 60 5.828 -1.083 0.315
435 HA LEU 60 HA LEU 60 7.709 -0.184 2.336
436 HB2 LEU 60 2HB LEU 60 8.426 -1.685 0.540
437 HB3 LEU 60 1HB LEU 60 7.902 -0.539 -0.652
438 HG LEU 60 HG LEU 60 10.169 0.061 1.260
439 HD11 LEU 60 1HD1 LEU 60 11.668 -0.691 -0.540
440 HD12 LEU 60 2HD1 LEU 60 10.267 -1.214 -1.476
441 HD13 LEU 60 3HD1 LEU 60 10.655 -2.012 0.048
442 HD21 LEU 60 3HD2 LEU 60 10.848 1.626 -0.492
443 HD22 LEU 60 1HD2 LEU 60 9.196 1.971 0.024
444 HD23 LEU 60 2HD2 LEU 60 9.484 1.120 -1.493
445 H LEU 61 H LEU 61 7.696 1.839 2.958
446 HA LEU 61 HA LEU 61 6.493 3.918 1.293
447 HB2 LEU 61 2HB LEU 61 5.566 3.511 3.502
448 HB3 LEU 61 1HB LEU 61 7.100 3.679 4.274
449 HG LEU 61 HG LEU 61 5.611 5.578 4.707
450 HD11 LEU 61 1HD1 LEU 61 6.994 7.478 4.098
451 HD12 LEU 61 2HD1 LEU 61 7.894 6.465 2.969
452 HD13 LEU 61 3HD1 LEU 61 7.958 6.130 4.698
453 HD21 LEU 61 3HD2 LEU 61 4.906 7.094 2.937
454 HD22 LEU 61 1HD2 LEU 61 4.260 5.468 2.716
455 HD23 LEU 61 2HD2 LEU 61 5.629 6.014 1.743
456 H ALA 62 H ALA 62 7.954 5.232 0.242
457 HA ALA 62 HA ALA 62 10.519 5.675 1.551
458 HB1 ALA 62 1HB ALA 62 10.239 4.877 -1.343
459 HB2 ALA 62 2HB ALA 62 10.862 3.855 -0.047
460 HB3 ALA 62 3HB ALA 62 11.739 5.308 -0.521
461 H ASP 63 H ASP 63 10.741 7.744 1.794
462 HA ASP 63 HA ASP 63 9.484 9.808 0.322
463 HB2 ASP 63 2HB ASP 63 11.839 9.703 2.203
464 HB3 ASP 63 1HB ASP 63 11.491 11.176 1.294
465 H LEU 64 H LEU 64 10.227 10.926 -1.455
466 HA LEU 64 HA LEU 64 12.798 10.029 -2.570
467 HB2 LEU 64 2HB LEU 64 10.521 9.217 -3.641
468 HB3 LEU 64 1HB LEU 64 10.414 10.851 -4.225
469 HG LEU 64 HG LEU 64 11.167 9.460 -5.973
470 HD11 LEU 64 1HD1 LEU 64 13.540 11.024 -4.987
471 HD12 LEU 64 2HD1 LEU 64 12.224 11.628 -5.989
472 HD13 LEU 64 3HD1 LEU 64 13.326 10.410 -6.627
473 HD21 LEU 64 3HD2 LEU 64 13.379 8.517 -4.159
474 HD22 LEU 64 1HD2 LEU 64 13.215 8.107 -5.866
475 HD23 LEU 64 2HD2 LEU 64 11.990 7.580 -4.712
476 H ASN 65 H ASN 65 13.417 11.941 -1.251
477 HA ASN 65 HA ASN 65 14.131 14.226 -2.480
478 HB2 ASN 65 2HB ASN 65 11.538 14.589 -2.723
479 HB3 ASN 65 1HB ASN 65 11.565 14.883 -0.990
480 HD21 ASN 65 1HD2 ASN 65 12.451 16.049 -4.091
481 HD22 ASN 65 2HD2 ASN 65 12.857 17.649 -3.623
482 H SER 66 H SER 66 14.849 15.836 -0.810
483 HA SER 66 HA SER 66 14.944 14.613 1.845
484 HB2 SER 66 2HB SER 66 16.755 16.695 0.617
485 HB3 SER 66 1HB SER 66 16.971 15.928 2.196
486 HG SER 66 HG SER 66 17.391 14.046 1.267
487 H THR 67 H THR 67 14.378 17.740 0.224
488 HA THR 67 HA THR 67 13.922 19.200 2.620
489 HB THR 67 HB THR 67 13.138 19.964 -0.203
490 HG1 THR 67 1HG THR 67 15.293 20.727 -0.358
491 HG21 THR 67 3HG2 THR 67 13.603 22.238 0.607
492 HG22 THR 67 1HG2 THR 67 14.017 21.592 2.197
493 HG23 THR 67 2HG2 THR 67 12.364 21.467 1.599
494 H ASN 68 H ASN 68 11.895 17.470 0.363
495 HA ASN 68 HA ASN 68 9.410 18.473 1.508
496 HB2 ASN 68 2HB ASN 68 9.960 16.405 -0.633
497 HB3 ASN 68 1HB ASN 68 8.346 16.808 -0.075
498 HD21 ASN 68 1HD2 ASN 68 9.008 19.716 0.172
499 HD22 ASN 68 2HD2 ASN 68 9.072 20.266 -1.454
500 H GLY 69 H GLY 69 11.252 17.100 3.194
501 HA2 GLY 69 2HA GLY 69 11.040 14.461 3.688
502 HA3 GLY 69 1HA GLY 69 11.291 15.667 4.931
503 H THR 70 H THR 70 9.598 13.094 4.144
504 HA THR 70 HA THR 70 7.044 13.813 5.185
505 HB THR 70 HB THR 70 8.323 11.288 4.058
506 HG1 THR 70 1HG THR 70 8.127 12.459 2.490
507 HG21 THR 70 3HG2 THR 70 6.445 10.725 5.603
508 HG22 THR 70 1HG2 THR 70 6.019 10.408 3.924
509 HG23 THR 70 2HG2 THR 70 5.406 11.851 4.739
510 H THR 71 H THR 71 6.224 12.831 7.089
511 HA THR 71 HA THR 71 8.218 11.648 8.885
512 HB THR 71 HB THR 71 6.626 12.475 10.719
513 HG1 THR 71 1HG THR 71 5.877 14.224 8.614
514 HG21 THR 71 3HG2 THR 71 7.730 14.653 10.829
515 HG22 THR 71 1HG2 THR 71 8.266 14.454 9.150
516 HG23 THR 71 2HG2 THR 71 8.842 13.343 10.404
517 H VAL 72 H VAL 72 7.676 9.847 9.931
518 HA VAL 72 HA VAL 72 5.008 8.763 9.450
519 HB VAL 72 HB VAL 72 6.024 6.496 9.531
520 HG11 VAL 72 1HG1 VAL 72 5.655 7.540 7.338
521 HG12 VAL 72 2HG1 VAL 72 7.113 6.550 7.309
522 HG13 VAL 72 3HG1 VAL 72 7.240 8.303 7.436
523 HG21 VAL 72 3HG2 VAL 72 8.020 6.993 10.835
524 HG22 VAL 72 1HG2 VAL 72 8.645 7.991 9.524
525 HG23 VAL 72 2HG2 VAL 72 8.474 6.247 9.301
526 H ASN 73 H ASN 73 3.903 8.632 11.210
527 HA ASN 73 HA ASN 73 3.269 8.648 13.343
528 HB2 ASN 73 2HB ASN 73 5.742 6.928 13.649
529 HB3 ASN 73 1HB ASN 73 4.613 7.216 14.973
530 HD21 ASN 73 1HD2 ASN 73 5.317 4.760 13.492
531 HD22 ASN 73 2HD2 ASN 73 3.831 4.126 12.878
532 H ASN 74 H ASN 74 4.852 10.740 12.304
533 HA ASN 74 HA ASN 74 5.461 12.773 12.914
534 HB2 ASN 74 2HB ASN 74 4.132 12.505 15.016
535 HB3 ASN 74 1HB ASN 74 5.546 11.829 15.802
536 HD21 ASN 74 1HD2 ASN 74 5.603 13.392 17.392
537 HD22 ASN 74 2HD2 ASN 74 6.037 15.030 17.087
538 H ALA 75 H ALA 75 7.254 10.102 12.965
539 HA ALA 75 HA ALA 75 9.725 11.369 13.836
540 HB1 ALA 75 1HB ALA 75 10.700 9.131 13.657
541 HB2 ALA 75 2HB ALA 75 9.171 8.511 13.030
542 HB3 ALA 75 3HB ALA 75 9.269 9.115 14.686
543 HA PRO 76 HA PRO 76 10.625 12.087 9.519
544 HB2 PRO 76 2HB PRO 76 13.052 13.195 9.826
545 HB3 PRO 76 1HB PRO 76 11.576 14.034 10.328
546 HG2 PRO 76 2HG PRO 76 13.570 12.557 11.993
547 HG3 PRO 76 1HG PRO 76 12.742 14.084 12.330
548 HD2 PRO 76 2HD PRO 76 11.981 11.645 13.354
549 HD3 PRO 76 1HD PRO 76 10.899 13.038 13.164
550 H VAL 77 H VAL 77 11.260 10.624 8.061
551 HA VAL 77 HA VAL 77 13.786 9.199 8.341
552 HB VAL 77 HB VAL 77 12.737 7.036 7.693
553 HG11 VAL 77 1HG1 VAL 77 11.696 6.410 9.820
554 HG12 VAL 77 2HG1 VAL 77 11.586 8.115 10.258
555 HG13 VAL 77 3HG1 VAL 77 13.164 7.359 10.059
556 HG21 VAL 77 3HG2 VAL 77 10.139 8.500 8.097
557 HG22 VAL 77 1HG2 VAL 77 10.285 6.749 7.895
558 HG23 VAL 77 2HG2 VAL 77 10.763 7.835 6.588
559 H GLN 78 H GLN 78 13.923 7.824 6.149
560 HA GLN 78 HA GLN 78 12.565 9.329 4.037
561 HB2 GLN 78 2HB GLN 78 14.462 8.956 2.532
562 HB3 GLN 78 1HB GLN 78 14.968 9.825 3.972
563 HG2 GLN 78 2HG GLN 78 15.979 7.858 4.877
564 HG3 GLN 78 1HG GLN 78 15.336 6.871 3.562
565 HE21 GLN 78 1HE2 GLN 78 17.664 9.237 4.473
566 HE22 GLN 78 2HE2 GLN 78 18.656 9.121 3.069
567 H GLU 79 H GLU 79 12.913 6.377 5.548
568 HA GLU 79 HA GLU 79 11.350 5.085 3.548
569 HB2 GLU 79 2HB GLU 79 12.863 3.098 3.355
570 HB3 GLU 79 1HB GLU 79 13.526 4.553 2.636
571 HG2 GLU 79 2HG GLU 79 14.833 4.873 4.756
572 HG3 GLU 79 1HG GLU 79 14.308 3.259 5.229
573 H TRP 80 H TRP 80 10.041 3.596 4.381
574 HA TRP 80 HA TRP 80 10.355 2.701 7.118
575 HB2 TRP 80 2HB TRP 80 9.449 4.907 7.393
576 HB3 TRP 80 1HB TRP 80 8.161 4.635 6.243
577 HD1 TRP 80 HD TRP 80 5.986 3.502 7.158
578 HE1 TRP 80 1HE TRP 80 5.148 2.973 9.527
579 HE3 TRP 80 3HE TRP 80 10.386 4.083 9.683
580 HZ2 TRP 80 2HZ TRP 80 6.225 2.844 12.132
581 HZ3 TRP 80 3HZ TRP 80 10.390 3.744 12.121
582 HH2 TRP 80 HH TRP 80 8.341 3.144 13.308
583 H GLN 81 H GLN 81 8.944 0.992 7.574
584 HA GLN 81 HA GLN 81 7.518 -0.083 5.261
585 HB2 GLN 81 2HB GLN 81 7.519 -2.273 6.485
586 HB3 GLN 81 1HB GLN 81 9.127 -1.688 6.115
587 HG2 GLN 81 2HG GLN 81 9.426 -0.975 8.422
588 HG3 GLN 81 1HG GLN 81 7.772 -1.448 8.795
589 HE21 GLN 81 1HE2 GLN 81 10.306 -2.370 9.919
590 HE22 GLN 81 2HE2 GLN 81 10.326 -4.078 9.715
591 H LEU 82 H LEU 82 5.460 0.300 5.218
592 HA LEU 82 HA LEU 82 4.011 1.629 7.213
593 HB2 LEU 82 2HB LEU 82 2.890 -0.061 4.996
594 HB3 LEU 82 1HB LEU 82 2.036 1.142 5.931
595 HG LEU 82 HG LEU 82 4.270 1.658 3.980
596 HD11 LEU 82 1HD1 LEU 82 2.085 1.168 2.959
597 HD12 LEU 82 2HD1 LEU 82 2.573 2.839 2.712
598 HD13 LEU 82 3HD1 LEU 82 1.360 2.446 3.929
599 HD21 LEU 82 3HD2 LEU 82 4.493 3.171 5.802
600 HD22 LEU 82 1HD2 LEU 82 2.760 3.498 5.796
601 HD23 LEU 82 2HD2 LEU 82 3.754 4.027 4.447
602 H ALA 83 H ALA 83 2.618 0.985 8.806
603 HA ALA 83 HA ALA 83 1.726 -1.786 8.898
604 HB1 ALA 83 1HB ALA 83 3.524 -1.580 10.561
605 HB2 ALA 83 2HB ALA 83 1.961 -1.776 11.353
606 HB3 ALA 83 3HB ALA 83 2.711 -0.183 11.270
607 H ASP 84 H ASP 84 -0.202 -1.912 10.400
608 HA ASP 84 HA ASP 84 -2.097 0.072 9.586
609 HB2 ASP 84 2HB ASP 84 -2.765 -2.288 9.953
610 HB3 ASP 84 1HB ASP 84 -2.436 -2.096 11.671
611 H GLY 85 H GLY 85 -2.239 1.993 10.445
612 HA2 GLY 85 2HA GLY 85 -3.016 3.224 12.376
613 HA3 GLY 85 1HA GLY 85 -1.952 2.233 13.359
614 H ASP 86 H ASP 86 -0.266 2.913 10.590
615 HA ASP 86 HA ASP 86 1.351 4.791 12.010
616 HB2 ASP 86 2HB ASP 86 1.585 3.697 9.210
617 HB3 ASP 86 1HB ASP 86 2.667 4.938 9.825
618 H VAL 87 H VAL 87 1.435 6.841 11.936
619 HA VAL 87 HA VAL 87 -0.526 8.273 10.258
620 HB VAL 87 HB VAL 87 1.073 9.385 12.589
621 HG11 VAL 87 1HG1 VAL 87 -1.392 10.421 11.204
622 HG12 VAL 87 2HG1 VAL 87 0.242 11.074 11.082
623 HG13 VAL 87 3HG1 VAL 87 -0.622 11.139 12.619
624 HG21 VAL 87 3HG2 VAL 87 -0.343 7.556 13.401
625 HG22 VAL 87 1HG2 VAL 87 -1.746 8.288 12.626
626 HG23 VAL 87 2HG2 VAL 87 -0.951 9.115 13.964
627 H ILE 88 H ILE 88 0.317 9.071 8.450
628 HA ILE 88 HA ILE 88 3.155 9.745 8.487
629 HB ILE 88 HB ILE 88 1.428 8.702 6.229
630 HG12 ILE 88 2HG1 ILE 88 3.700 7.447 7.787
631 HG13 ILE 88 1HG1 ILE 88 2.002 7.040 7.916
632 HG21 ILE 88 1HG2 ILE 88 4.370 9.413 6.220
633 HG22 ILE 88 2HG2 ILE 88 3.090 10.270 5.361
634 HG23 ILE 88 3HG2 ILE 88 3.502 8.617 4.907
635 HD11 ILE 88 3HD1 ILE 88 3.231 5.400 6.613
636 HD12 ILE 88 1HD1 ILE 88 3.701 6.656 5.471
637 HD13 ILE 88 2HD1 ILE 88 2.004 6.209 5.641
638 H ARG 89 H ARG 89 3.629 11.818 7.966
639 HA ARG 89 HA ARG 89 1.544 13.415 6.674
640 HB2 ARG 89 2HB ARG 89 1.529 14.218 8.935
641 HB3 ARG 89 1HB ARG 89 3.288 14.239 9.002
642 HG2 ARG 89 2HG ARG 89 3.356 16.081 7.418
643 HG3 ARG 89 1HG ARG 89 1.605 16.038 7.260
644 HD2 ARG 89 2HD ARG 89 2.938 16.490 9.904
645 HD3 ARG 89 1HD ARG 89 2.670 17.811 8.776
646 HE ARG 89 HE ARG 89 0.323 16.260 9.386
647 HH11 ARG 89 1HH1 ARG 89 2.333 18.996 10.329
648 HH12 ARG 89 2HH1 ARG 89 1.105 19.901 11.060
649 HH21 ARG 89 1HH2 ARG 89 -1.475 17.503 10.412
650 HH22 ARG 89 2HH2 ARG 89 -1.134 18.973 11.170
651 H LEU 90 H LEU 90 2.121 14.579 5.004
652 HA LEU 90 HA LEU 90 4.910 15.052 4.450
653 HB2 LEU 90 2HB LEU 90 4.756 14.244 2.155
654 HB3 LEU 90 1HB LEU 90 4.400 12.937 3.248
655 HG LEU 90 HG LEU 90 2.300 14.469 1.686
656 HD11 LEU 90 1HD1 LEU 90 3.790 13.272 0.190
657 HD12 LEU 90 2HD1 LEU 90 2.210 12.489 0.247
658 HD13 LEU 90 3HD1 LEU 90 3.570 11.793 1.127
659 HD21 LEU 90 3HD2 LEU 90 1.413 13.382 3.712
660 HD22 LEU 90 1HD2 LEU 90 2.135 11.854 3.204
661 HD23 LEU 90 2HD2 LEU 90 0.836 12.576 2.253
662 H GLY 91 H GLY 91 5.211 16.885 3.302
663 HA2 GLY 91 2HA GLY 91 4.519 19.207 3.579
664 HA3 GLY 91 1HA GLY 91 4.321 18.739 1.908
665 H HIS 92 H HIS 92 2.734 19.384 4.923
666 HA HIS 92 HA HIS 92 0.848 20.478 5.441
667 HB2 HIS 92 2HB HIS 92 0.211 20.530 2.487
668 HB3 HIS 92 1HB HIS 92 -0.859 21.184 3.716
669 HD1 HIS 92 1HD HIS 92 1.266 22.455 1.331
670 HD2 HIS 92 2HD HIS 92 0.990 23.016 5.439
671 HE1 HIS 92 1HE HIS 92 2.436 24.637 1.828
672 H SER 93 H SER 93 0.593 17.591 3.563
673 HA SER 93 HA SER 93 -2.111 17.258 4.610
674 HB2 SER 93 2HB SER 93 -1.714 17.090 2.126
675 HB3 SER 93 1HB SER 93 -0.765 15.639 2.440
676 HG SER 93 HG SER 93 -3.337 15.793 2.092
677 H GLU 94 H GLU 94 -2.694 15.016 5.282
678 HA GLU 94 HA GLU 94 -0.519 13.459 6.301
679 HB2 GLU 94 2HB GLU 94 -1.428 13.387 8.601
680 HB3 GLU 94 1HB GLU 94 -0.866 14.984 8.151
681 HG2 GLU 94 2HG GLU 94 -3.276 15.543 7.643
682 HG3 GLU 94 1HG GLU 94 -3.693 14.021 8.435
683 H ILE 95 H ILE 95 -1.012 11.379 6.700
684 HA ILE 95 HA ILE 95 -3.616 10.421 5.906
685 HB ILE 95 HB ILE 95 -2.567 10.557 3.812
686 HG12 ILE 95 2HG1 ILE 95 -3.488 8.208 4.345
687 HG13 ILE 95 1HG1 ILE 95 -2.471 8.385 2.922
688 HG21 ILE 95 1HG2 ILE 95 -0.351 11.110 4.417
689 HG22 ILE 95 2HG2 ILE 95 -0.320 9.804 3.236
690 HG23 ILE 95 3HG2 ILE 95 -0.025 9.457 4.938
691 HD11 ILE 95 3HD1 ILE 95 -1.944 6.325 4.155
692 HD12 ILE 95 1HD1 ILE 95 -1.609 7.282 5.594
693 HD13 ILE 95 2HD1 ILE 95 -0.577 7.438 4.177
694 H ILE 96 H ILE 96 -4.150 8.545 6.871
695 HA ILE 96 HA ILE 96 -2.152 7.318 8.663
696 HB ILE 96 HB ILE 96 -5.185 7.349 8.964
697 HG12 ILE 96 2HG1 ILE 96 -3.027 8.713 10.601
698 HG13 ILE 96 1HG1 ILE 96 -4.116 9.509 9.478
699 HG21 ILE 96 1HG2 ILE 96 -4.808 6.253 11.141
700 HG22 ILE 96 2HG2 ILE 96 -3.086 6.144 10.783
701 HG23 ILE 96 3HG2 ILE 96 -4.246 5.252 9.803
702 HD11 ILE 96 3HD1 ILE 96 -4.919 8.099 12.014
703 HD12 ILE 96 1HD1 ILE 96 -6.013 8.906 10.892
704 HD13 ILE 96 2HD1 ILE 96 -4.814 9.846 11.778
705 H VAL 97 H VAL 97 -1.643 5.255 8.312
706 HA VAL 97 HA VAL 97 -2.838 3.946 6.015
707 HB VAL 97 HB VAL 97 -0.345 3.349 7.620
708 HG11 VAL 97 1HG1 VAL 97 -1.450 1.860 5.237
709 HG12 VAL 97 2HG1 VAL 97 -1.338 1.235 6.884
710 HG13 VAL 97 3HG1 VAL 97 0.133 1.587 5.970
711 HG21 VAL 97 3HG2 VAL 97 -0.246 5.239 6.079
712 HG22 VAL 97 1HG2 VAL 97 -0.820 4.188 4.786
713 HG23 VAL 97 2HG2 VAL 97 0.762 3.898 5.515
714 H ARG 98 H ARG 98 -4.237 2.344 6.103
715 HA ARG 98 HA ARG 98 -4.453 0.755 8.561
716 HB2 ARG 98 2HB ARG 98 -6.470 1.287 6.370
717 HB3 ARG 98 1HB ARG 98 -6.706 0.132 7.675
718 HG2 ARG 98 2HG ARG 98 -6.253 3.057 8.030
719 HG3 ARG 98 1HG ARG 98 -7.850 2.289 8.038
720 HD2 ARG 98 2HD ARG 98 -7.151 0.942 9.968
721 HD3 ARG 98 1HD ARG 98 -5.572 1.722 9.944
722 HE ARG 98 HE ARG 98 -7.659 3.609 10.067
723 HH11 ARG 98 1HH1 ARG 98 -5.844 1.301 12.101
724 HH12 ARG 98 2HH1 ARG 98 -6.053 2.183 13.528
725 HH21 ARG 98 1HH2 ARG 98 -7.960 4.810 12.077
726 HH22 ARG 98 2HH2 ARG 98 -7.303 4.205 13.514
727 H MET 99 H MET 99 -4.211 -1.343 8.370
728 HA MET 99 HA MET 99 -3.795 -2.423 5.671
729 HB2 MET 99 2HB MET 99 -2.079 -3.082 8.064
730 HB3 MET 99 1HB MET 99 -2.049 -3.954 6.548
731 HG2 MET 99 2HG MET 99 -1.379 -1.868 5.402
732 HG3 MET 99 1HG MET 99 -1.277 -1.082 6.978
733 HE1 MET 99 3HE MET 99 0.212 -3.842 4.607
734 HE2 MET 99 1HE MET 99 -0.230 -4.814 6.010
735 HE3 MET 99 2HE MET 99 1.466 -4.558 5.615
736 H HIS 100 H HIS 100 -5.241 -3.762 5.302
737 HA HIS 100 HA HIS 100 -6.463 -5.248 7.486
738 HB2 HIS 100 2HB HIS 100 -7.432 -4.784 4.651
739 HB3 HIS 100 1HB HIS 100 -8.315 -5.647 5.901
740 HD1 HIS 100 1HD HIS 100 -9.792 -4.243 7.406
741 HD2 HIS 100 2HD HIS 100 -7.159 -1.956 5.154
742 HE1 HIS 100 1HE HIS 100 -10.418 -1.839 7.826
Start of MODEL 25
1 H1 GLY 1 1HT GLY 1 -10.413 -14.893 -2.184
2 H2 GLY 1 2HT GLY 1 -11.122 -15.638 -3.536
3 H3 GLY 1 3HT GLY 1 -12.087 -14.765 -2.444
4 HA2 GLY 1 1HA GLY 1 -11.678 -13.550 -4.459
5 HA3 GLY 1 2HA GLY 1 -10.995 -12.749 -3.055
6 H HIS 2 H HIS 2 -10.077 -12.264 -5.663
7 HA HIS 2 HA HIS 2 -7.729 -13.910 -6.001
8 HB2 HIS 2 2HB HIS 2 -8.840 -11.653 -7.661
9 HB3 HIS 2 1HB HIS 2 -7.266 -12.372 -7.962
10 HD1 HIS 2 1HD HIS 2 -8.467 -12.934 -10.372
11 HD2 HIS 2 2HD HIS 2 -9.813 -15.039 -7.051
12 HE1 HIS 2 1HE HIS 2 -9.691 -14.927 -11.264
13 H GLY 3 H GLY 3 -6.327 -13.564 -4.504
14 HA2 GLY 3 2HA GLY 3 -4.707 -11.265 -4.625
15 HA3 GLY 3 1HA GLY 3 -5.664 -11.327 -3.140
16 H SER 4 H SER 4 -2.750 -11.989 -4.180
17 HA SER 4 HA SER 4 -2.381 -14.642 -3.158
18 HB2 SER 4 2HB SER 4 -0.364 -12.493 -3.861
19 HB3 SER 4 1HB SER 4 -0.003 -14.203 -3.593
20 HG SER 4 HG SER 4 -1.430 -14.666 -5.311
21 H ALA 5 H ALA 5 -2.250 -11.409 -1.987
22 HA ALA 5 HA ALA 5 -1.594 -12.392 0.685
23 HB1 ALA 5 1HB ALA 5 0.277 -11.062 -0.182
24 HB2 ALA 5 2HB ALA 5 -0.549 -10.194 1.115
25 HB3 ALA 5 3HB ALA 5 -0.829 -9.746 -0.570
26 H GLY 6 H GLY 6 -3.317 -12.156 1.956
27 HA2 GLY 6 2HA GLY 6 -5.554 -10.553 1.080
28 HA3 GLY 6 1HA GLY 6 -5.495 -11.571 2.518
29 H THR 7 H THR 7 -4.163 -8.627 1.187
30 HA THR 7 HA THR 7 -4.426 -7.341 3.787
31 HB THR 7 HB THR 7 -1.894 -7.371 2.123
32 HG1 THR 7 1HG THR 7 -2.825 -8.965 4.059
33 HG21 THR 7 3HG2 THR 7 -2.486 -6.018 4.776
34 HG22 THR 7 1HG2 THR 7 -2.232 -5.216 3.223
35 HG23 THR 7 2HG2 THR 7 -0.906 -6.089 3.987
36 H SER 8 H SER 8 -5.657 -5.564 3.367
37 HA SER 8 HA SER 8 -5.273 -4.257 0.773
38 HB2 SER 8 2HB SER 8 -7.457 -3.860 2.806
39 HB3 SER 8 1HB SER 8 -7.428 -3.239 1.156
40 HG SER 8 HG SER 8 -7.262 -6.000 1.683
41 H VAL 9 H VAL 9 -3.883 -2.613 0.878
42 HA VAL 9 HA VAL 9 -3.622 -1.206 3.434
43 HB VAL 9 HB VAL 9 -1.866 -0.850 1.001
44 HG11 VAL 9 1HG1 VAL 9 -0.249 0.033 2.640
45 HG12 VAL 9 2HG1 VAL 9 -1.442 -0.203 3.916
46 HG13 VAL 9 3HG1 VAL 9 -1.757 0.946 2.616
47 HG21 VAL 9 3HG2 VAL 9 -1.414 -2.745 3.315
48 HG22 VAL 9 1HG2 VAL 9 -0.224 -2.348 2.075
49 HG23 VAL 9 2HG2 VAL 9 -1.709 -3.186 1.635
50 H THR 10 H THR 10 -4.757 0.528 3.631
51 HA THR 10 HA THR 10 -5.452 2.045 1.242
52 HB THR 10 HB THR 10 -7.239 1.474 3.627
53 HG1 THR 10 1HG THR 10 -6.685 0.084 1.399
54 HG21 THR 10 3HG2 THR 10 -7.805 2.849 0.982
55 HG22 THR 10 1HG2 THR 10 -7.682 3.649 2.549
56 HG23 THR 10 2HG2 THR 10 -8.997 2.514 2.240
57 H LEU 11 H LEU 11 -4.816 4.028 1.408
58 HA LEU 11 HA LEU 11 -4.164 5.046 4.038
59 HB2 LEU 11 2HB LEU 11 -2.785 6.781 2.771
60 HB3 LEU 11 1HB LEU 11 -2.169 5.154 2.812
61 HG LEU 11 HG LEU 11 -3.685 6.150 0.396
62 HD11 LEU 11 1HD1 LEU 11 -0.720 6.415 0.958
63 HD12 LEU 11 2HD1 LEU 11 -1.862 7.756 0.824
64 HD13 LEU 11 3HD1 LEU 11 -1.511 6.752 -0.579
65 HD21 LEU 11 3HD2 LEU 11 -3.244 3.749 0.551
66 HD22 LEU 11 1HD2 LEU 11 -1.535 4.080 0.829
67 HD23 LEU 11 2HD2 LEU 11 -2.262 4.482 -0.717
68 H GLN 12 H GLN 12 -5.165 6.693 4.852
69 HA GLN 12 HA GLN 12 -7.440 7.743 3.346
70 HB2 GLN 12 2HB GLN 12 -6.932 7.593 6.300
71 HB3 GLN 12 1HB GLN 12 -8.382 8.204 5.513
72 HG2 GLN 12 2HG GLN 12 -8.833 6.039 4.605
73 HG3 GLN 12 1HG GLN 12 -7.359 5.391 5.326
74 HE21 GLN 12 1HE2 GLN 12 -9.527 7.678 6.852
75 HE22 GLN 12 2HE2 GLN 12 -10.045 6.606 8.109
76 H LEU 13 H LEU 13 -7.620 9.808 3.061
77 HA LEU 13 HA LEU 13 -5.606 11.593 4.222
78 HB2 LEU 13 2HB LEU 13 -5.082 11.213 1.904
79 HB3 LEU 13 1HB LEU 13 -6.746 11.485 1.442
80 HG LEU 13 HG LEU 13 -6.544 13.811 2.080
81 HD11 LEU 13 1HD1 LEU 13 -4.316 14.800 2.496
82 HD12 LEU 13 2HD1 LEU 13 -3.619 13.181 2.524
83 HD13 LEU 13 3HD1 LEU 13 -4.780 13.665 3.764
84 HD21 LEU 13 3HD2 LEU 13 -4.465 12.871 0.117
85 HD22 LEU 13 1HD2 LEU 13 -5.111 14.508 0.210
86 HD23 LEU 13 2HD2 LEU 13 -6.172 13.161 -0.213
87 H ASP 14 H ASP 14 -6.681 12.841 5.630
88 HA ASP 14 HA ASP 14 -9.178 13.977 4.636
89 HB2 ASP 14 2HB ASP 14 -9.559 12.276 6.500
90 HB3 ASP 14 1HB ASP 14 -8.736 13.412 7.566
91 H ASP 15 H ASP 15 -8.409 15.814 4.019
92 HA ASP 15 HA ASP 15 -7.192 17.578 6.025
93 HB2 ASP 15 2HB ASP 15 -6.385 18.890 4.102
94 HB3 ASP 15 1HB ASP 15 -5.830 17.220 3.978
95 H GLY 16 H GLY 16 -10.000 16.732 5.591
96 HA2 GLY 16 2HA GLY 16 -11.944 18.056 5.896
97 HA3 GLY 16 1HA GLY 16 -11.208 19.317 4.899
98 H SER 17 H SER 17 -10.718 16.161 3.858
99 HA SER 17 HA SER 17 -12.723 16.454 1.731
100 HB2 SER 17 2HB SER 17 -11.065 15.117 0.374
101 HB3 SER 17 1HB SER 17 -10.504 16.724 0.849
102 HG SER 17 HG SER 17 -8.879 15.755 1.793
103 H GLY 18 H GLY 18 -10.659 13.864 2.949
104 HA2 GLY 18 2HA GLY 18 -11.338 11.968 4.160
105 HA3 GLY 18 1HA GLY 18 -13.011 12.267 3.669
106 H ARG 19 H ARG 19 -9.915 11.860 2.013
107 HA ARG 19 HA ARG 19 -11.294 10.140 0.089
108 HB2 ARG 19 2HB ARG 19 -8.707 11.646 -0.098
109 HB3 ARG 19 1HB ARG 19 -9.192 10.398 -1.242
110 HG2 ARG 19 2HG ARG 19 -11.178 11.695 -1.813
111 HG3 ARG 19 1HG ARG 19 -10.688 12.937 -0.657
112 HD2 ARG 19 2HD ARG 19 -8.728 13.434 -1.916
113 HD3 ARG 19 1HD ARG 19 -9.001 12.061 -2.990
114 HE ARG 19 HE ARG 19 -11.249 13.584 -3.168
115 HH11 ARG 19 1HH1 ARG 19 -7.795 14.245 -3.733
116 HH12 ARG 19 2HH1 ARG 19 -8.096 15.271 -5.052
117 HH21 ARG 19 1HH2 ARG 19 -11.585 15.014 -5.009
118 HH22 ARG 19 2HH2 ARG 19 -10.233 15.757 -5.746
119 H THR 20 H THR 20 -10.248 8.259 -0.652
120 HA THR 20 HA THR 20 -8.296 7.134 1.200
121 HB THR 20 HB THR 20 -9.494 4.943 1.023
122 HG1 THR 20 1HG THR 20 -11.246 6.557 -0.479
123 HG21 THR 20 3HG2 THR 20 -11.153 7.207 2.115
124 HG22 THR 20 1HG2 THR 20 -9.874 6.363 2.976
125 HG23 THR 20 2HG2 THR 20 -11.362 5.506 2.553
126 H TYR 21 H TYR 21 -6.775 5.860 0.185
127 HA TYR 21 HA TYR 21 -7.197 5.238 -2.641
128 HB2 TYR 21 2HB TYR 21 -5.719 7.267 -2.467
129 HB3 TYR 21 1HB TYR 21 -4.608 6.332 -1.477
130 HD1 TYR 21 1HD TYR 21 -6.130 6.486 -4.869
131 HD2 TYR 21 2HD TYR 21 -2.898 5.056 -2.504
132 HE1 TYR 21 1HE TYR 21 -4.952 5.778 -6.912
133 HE2 TYR 21 2HE TYR 21 -1.715 4.338 -4.535
134 HH TYR 21 HH TYR 21 -2.211 3.750 -6.829
135 H GLN 22 H GLN 22 -6.595 3.175 -3.112
136 HA GLN 22 HA GLN 22 -5.343 1.716 -0.916
137 HB2 GLN 22 2HB GLN 22 -7.669 0.991 -1.436
138 HB3 GLN 22 1HB GLN 22 -7.160 0.614 -3.076
139 HG2 GLN 22 2HG GLN 22 -5.706 -1.135 -2.280
140 HG3 GLN 22 1HG GLN 22 -6.020 -0.685 -0.607
141 HE21 GLN 22 1HE2 GLN 22 -6.449 -3.266 -1.937
142 HE22 GLN 22 2HE2 GLN 22 -8.133 -3.575 -1.748
143 H LEU 23 H LEU 23 -3.595 0.586 -1.289
144 HA LEU 23 HA LEU 23 -2.014 1.329 -3.536
145 HB2 LEU 23 2HB LEU 23 -1.504 -0.685 -1.377
146 HB3 LEU 23 1HB LEU 23 -0.314 -0.133 -2.527
147 HG LEU 23 HG LEU 23 -1.629 1.509 -0.368
148 HD11 LEU 23 1HD1 LEU 23 0.615 1.592 0.567
149 HD12 LEU 23 2HD1 LEU 23 1.204 0.569 -0.745
150 HD13 LEU 23 3HD1 LEU 23 0.052 -0.073 0.423
151 HD21 LEU 23 3HD2 LEU 23 0.460 2.310 -2.388
152 HD22 LEU 23 1HD2 LEU 23 -0.120 3.294 -1.050
153 HD23 LEU 23 2HD2 LEU 23 -1.216 2.874 -2.362
154 H ARG 24 H ARG 24 -1.818 0.346 -5.402
155 HA ARG 24 HA ARG 24 -2.622 -2.463 -5.611
156 HB2 ARG 24 2HB ARG 24 -1.931 -0.601 -7.903
157 HB3 ARG 24 1HB ARG 24 -2.801 -2.122 -7.970
158 HG2 ARG 24 2HG ARG 24 -3.817 0.464 -6.810
159 HG3 ARG 24 1HG ARG 24 -4.306 -0.267 -8.337
160 HD2 ARG 24 2HD ARG 24 -5.294 -2.145 -7.143
161 HD3 ARG 24 1HD ARG 24 -4.721 -1.486 -5.605
162 HE ARG 24 HE ARG 24 -6.243 0.421 -6.987
163 HH11 ARG 24 1HH1 ARG 24 -6.736 -2.565 -5.120
164 HH12 ARG 24 2HH1 ARG 24 -8.282 -2.133 -4.566
165 HH21 ARG 24 1HH2 ARG 24 -8.356 1.004 -6.236
166 HH22 ARG 24 2HH2 ARG 24 -9.220 -0.049 -5.214
167 H GLU 25 H GLU 25 -1.006 -3.820 -6.737
168 HA GLU 25 HA GLU 25 1.476 -3.287 -5.539
169 HB2 GLU 25 2HB GLU 25 2.351 -5.296 -6.531
170 HB3 GLU 25 1HB GLU 25 0.760 -5.572 -5.850
171 HG2 GLU 25 2HG GLU 25 -0.223 -5.610 -8.024
172 HG3 GLU 25 1HG GLU 25 1.305 -5.126 -8.763
173 H GLY 26 H GLY 26 3.419 -2.933 -6.240
174 HA2 GLY 26 2HA GLY 26 4.953 -2.288 -8.061
175 HA3 GLY 26 1HA GLY 26 3.599 -1.355 -8.718
176 H SER 27 H SER 27 5.701 0.093 -8.263
177 HA SER 27 HA SER 27 5.185 1.192 -5.652
178 HB2 SER 27 2HB SER 27 7.467 0.849 -5.928
179 HB3 SER 27 1HB SER 27 7.499 1.599 -7.547
180 HG SER 27 HG SER 27 8.296 3.057 -5.817
181 H ASN 28 H ASN 28 4.152 2.901 -5.440
182 HA ASN 28 HA ASN 28 3.326 4.349 -7.840
183 HB2 ASN 28 2HB ASN 28 1.284 5.030 -6.467
184 HB3 ASN 28 1HB ASN 28 1.356 3.347 -6.982
185 HD21 ASN 28 1HD2 ASN 28 1.792 1.748 -5.427
186 HD22 ASN 28 2HD2 ASN 28 1.595 2.067 -3.746
187 H ILE 29 H ILE 29 3.981 6.243 -8.082
188 HA ILE 29 HA ILE 29 5.394 7.567 -5.956
189 HB ILE 29 HB ILE 29 5.037 8.347 -8.865
190 HG12 ILE 29 2HG1 ILE 29 7.377 7.058 -7.434
191 HG13 ILE 29 1HG1 ILE 29 6.274 6.241 -8.530
192 HG21 ILE 29 1HG2 ILE 29 6.916 9.477 -6.776
193 HG22 ILE 29 2HG2 ILE 29 5.510 10.300 -7.449
194 HG23 ILE 29 3HG2 ILE 29 6.885 9.916 -8.487
195 HD11 ILE 29 3HD1 ILE 29 7.058 7.674 -10.358
196 HD12 ILE 29 1HD1 ILE 29 8.375 6.761 -9.620
197 HD13 ILE 29 2HD1 ILE 29 8.170 8.469 -9.243
198 H ILE 30 H ILE 30 4.690 9.128 -4.826
199 HA ILE 30 HA ILE 30 2.077 10.328 -5.304
200 HB ILE 30 HB ILE 30 3.747 9.822 -2.803
201 HG12 ILE 30 2HG1 ILE 30 0.990 8.903 -3.621
202 HG13 ILE 30 1HG1 ILE 30 2.450 7.932 -3.633
203 HG21 ILE 30 1HG2 ILE 30 1.171 11.276 -2.720
204 HG22 ILE 30 2HG2 ILE 30 2.744 12.078 -2.703
205 HG23 ILE 30 3HG2 ILE 30 2.307 10.962 -1.409
206 HD11 ILE 30 3HD1 ILE 30 1.141 9.106 -1.186
207 HD12 ILE 30 1HD1 ILE 30 2.562 8.062 -1.202
208 HD13 ILE 30 2HD1 ILE 30 1.003 7.434 -1.729
209 H GLY 31 H GLY 31 2.120 12.366 -6.087
210 HA2 GLY 31 2HA GLY 31 3.447 14.536 -5.102
211 HA3 GLY 31 1HA GLY 31 4.552 13.868 -6.315
212 H ARG 32 H ARG 32 4.267 15.741 -7.606
213 HA ARG 32 HA ARG 32 1.699 15.668 -9.082
214 HB2 ARG 32 2HB ARG 32 3.326 18.123 -8.420
215 HB3 ARG 32 1HB ARG 32 1.883 18.093 -9.414
216 HG2 ARG 32 2HG ARG 32 0.616 17.318 -7.416
217 HG3 ARG 32 1HG ARG 32 2.095 17.482 -6.496
218 HD2 ARG 32 2HD ARG 32 0.854 19.757 -8.029
219 HD3 ARG 32 1HD ARG 32 0.614 19.475 -6.309
220 HE ARG 32 HE ARG 32 3.296 19.517 -6.539
221 HH11 ARG 32 1HH1 ARG 32 0.832 21.790 -7.636
222 HH12 ARG 32 2HH1 ARG 32 1.812 23.176 -7.441
223 HH21 ARG 32 1HH2 ARG 32 4.609 21.363 -6.221
224 HH22 ARG 32 2HH2 ARG 32 4.046 22.913 -6.591
225 H GLY 33 H GLY 33 2.373 14.701 -10.965
226 HA2 GLY 33 2HA GLY 33 3.871 16.096 -12.796
227 HA3 GLY 33 1HA GLY 33 4.963 14.960 -12.002
228 H GLN 34 H GLN 34 5.088 14.141 -14.189
229 HA GLN 34 HA GLN 34 2.847 12.565 -15.137
230 HB2 GLN 34 2HB GLN 34 5.701 12.711 -16.143
231 HB3 GLN 34 1HB GLN 34 4.351 11.956 -16.976
232 HG2 GLN 34 2HG GLN 34 3.271 14.111 -17.238
233 HG3 GLN 34 1HG GLN 34 4.556 14.880 -16.312
234 HE21 GLN 34 1HE2 GLN 34 3.679 13.452 -19.353
235 HE22 GLN 34 2HE2 GLN 34 5.055 14.018 -20.220
236 H ASP 35 H ASP 35 5.935 12.168 -13.551
237 HA ASP 35 HA ASP 35 6.127 9.340 -13.533
238 HB2 ASP 35 2HB ASP 35 7.205 11.346 -11.531
239 HB3 ASP 35 1HB ASP 35 7.708 9.671 -11.656
240 H ALA 36 H ALA 36 4.537 11.668 -11.565
241 HA ALA 36 HA ALA 36 4.004 10.048 -9.316
242 HB1 ALA 36 1HB ALA 36 3.977 12.487 -9.205
243 HB2 ALA 36 2HB ALA 36 2.444 11.799 -8.669
244 HB3 ALA 36 3HB ALA 36 2.572 12.522 -10.271
245 H GLN 37 H GLN 37 2.507 8.600 -8.994
246 HA GLN 37 HA GLN 37 0.582 7.964 -11.083
247 HB2 GLN 37 2HB GLN 37 1.193 6.595 -8.455
248 HB3 GLN 37 1HB GLN 37 0.191 5.963 -9.746
249 HG2 GLN 37 2HG GLN 37 3.173 6.395 -9.817
250 HG3 GLN 37 1HG GLN 37 2.328 4.851 -9.734
251 HE21 GLN 37 1HE2 GLN 37 3.466 7.394 -11.768
252 HE22 GLN 37 2HE2 GLN 37 2.956 6.693 -13.246
253 H PHE 38 H PHE 38 0.946 9.304 -7.951
254 HA PHE 38 HA PHE 38 -1.926 9.783 -7.723
255 HB2 PHE 38 2HB PHE 38 -1.088 8.281 -5.984
256 HB3 PHE 38 1HB PHE 38 0.191 9.413 -5.599
257 HD1 PHE 38 1HD PHE 38 -3.478 8.979 -5.570
258 HD2 PHE 38 2HD PHE 38 -0.150 11.093 -4.004
259 HE1 PHE 38 1HE PHE 38 -4.904 9.923 -3.784
260 HE2 PHE 38 2HE PHE 38 -1.471 11.998 -2.269
261 HZ PHE 38 HZ PHE 38 -3.917 11.449 -2.114
262 H ARG 39 H ARG 39 -2.353 11.812 -8.084
263 HA ARG 39 HA ARG 39 -0.165 13.742 -7.911
264 HB2 ARG 39 2HB ARG 39 -2.649 13.743 -9.626
265 HB3 ARG 39 1HB ARG 39 -1.726 15.200 -9.341
266 HG2 ARG 39 2HG ARG 39 -1.133 14.235 -11.473
267 HG3 ARG 39 1HG ARG 39 0.240 14.170 -10.379
268 HD2 ARG 39 2HD ARG 39 0.095 12.114 -11.637
269 HD3 ARG 39 1HD ARG 39 -0.254 11.796 -9.947
270 HE ARG 39 HE ARG 39 -2.709 12.042 -10.855
271 HH11 ARG 39 1HH1 ARG 39 0.032 10.282 -12.321
272 HH12 ARG 39 2HH1 ARG 39 -0.978 9.183 -13.136
273 HH21 ARG 39 1HH2 ARG 39 -4.038 10.468 -12.002
274 HH22 ARG 39 2HH2 ARG 39 -3.258 9.267 -12.937
275 H LEU 40 H LEU 40 -0.128 15.015 -6.320
276 HA LEU 40 HA LEU 40 -2.343 15.323 -4.525
277 HB2 LEU 40 2HB LEU 40 0.430 16.430 -4.567
278 HB3 LEU 40 1HB LEU 40 -0.741 17.034 -3.415
279 HG LEU 40 HG LEU 40 0.724 15.398 -2.373
280 HD11 LEU 40 1HD1 LEU 40 -2.025 14.270 -2.744
281 HD12 LEU 40 2HD1 LEU 40 -1.552 15.524 -1.602
282 HD13 LEU 40 3HD1 LEU 40 -0.887 13.902 -1.444
283 HD21 LEU 40 3HD2 LEU 40 1.340 14.157 -4.360
284 HD22 LEU 40 1HD2 LEU 40 -0.289 13.471 -4.432
285 HD23 LEU 40 2HD2 LEU 40 0.760 13.130 -3.050
286 HA PRO 41 HA PRO 41 -3.799 18.994 -6.631
287 HB2 PRO 41 2HB PRO 41 -5.748 19.242 -4.465
288 HB3 PRO 41 1HB PRO 41 -6.021 18.904 -6.173
289 HG2 PRO 41 2HG PRO 41 -6.407 17.024 -4.274
290 HG3 PRO 41 1HG PRO 41 -5.833 16.626 -5.899
291 HD2 PRO 41 2HD PRO 41 -4.252 16.902 -3.362
292 HD3 PRO 41 1HD PRO 41 -4.167 15.667 -4.637
293 H ASP 42 H ASP 42 -2.070 18.928 -3.777
294 HA ASP 42 HA ASP 42 -2.561 21.778 -3.211
295 HB2 ASP 42 2HB ASP 42 -2.614 19.867 -1.362
296 HB3 ASP 42 1HB ASP 42 -0.864 20.005 -1.457
297 H THR 43 H THR 43 -0.193 22.526 -2.178
298 HA THR 43 HA THR 43 1.783 21.897 -4.237
299 HB THR 43 HB THR 43 0.749 24.125 -4.678
300 HG1 THR 43 1HG THR 43 3.321 24.775 -3.798
301 HG21 THR 43 3HG2 THR 43 1.927 24.886 -1.997
302 HG22 THR 43 1HG2 THR 43 0.208 24.762 -2.368
303 HG23 THR 43 2HG2 THR 43 1.187 26.004 -3.144
304 H GLY 44 H GLY 44 4.081 22.640 -3.415
305 HA2 GLY 44 2HA GLY 44 5.605 22.727 -1.622
306 HA3 GLY 44 1HA GLY 44 4.331 22.183 -0.522
307 H VAL 45 H VAL 45 3.882 20.533 -3.105
308 HA VAL 45 HA VAL 45 5.504 18.239 -2.339
309 HB VAL 45 HB VAL 45 3.073 17.858 -1.920
310 HG11 VAL 45 1HG1 VAL 45 1.430 17.928 -3.654
311 HG12 VAL 45 2HG1 VAL 45 2.635 18.576 -4.773
312 HG13 VAL 45 3HG1 VAL 45 2.159 19.505 -3.355
313 HG21 VAL 45 3HG2 VAL 45 4.018 16.399 -4.378
314 HG22 VAL 45 1HG2 VAL 45 2.700 15.882 -3.325
315 HG23 VAL 45 2HG2 VAL 45 4.356 15.937 -2.711
316 H SER 46 H SER 46 6.767 17.396 -3.921
317 HA SER 46 HA SER 46 6.918 18.926 -6.383
318 HB2 SER 46 2HB SER 46 8.859 16.951 -5.175
319 HB3 SER 46 1HB SER 46 9.170 18.029 -6.542
320 HG SER 46 HG SER 46 8.472 19.725 -4.979
321 H ARG 47 H ARG 47 7.997 17.339 -8.244
322 HA ARG 47 HA ARG 47 5.788 15.871 -9.187
323 HB2 ARG 47 2HB ARG 47 7.248 15.175 -11.082
324 HB3 ARG 47 1HB ARG 47 7.209 16.905 -10.808
325 HG2 ARG 47 2HG ARG 47 9.390 16.750 -9.673
326 HG3 ARG 47 1HG ARG 47 9.415 15.020 -10.009
327 HD2 ARG 47 2HD ARG 47 9.244 17.179 -12.089
328 HD3 ARG 47 1HD ARG 47 10.736 16.374 -11.620
329 HE ARG 47 HE ARG 47 8.962 14.379 -12.347
330 HH11 ARG 47 1HH1 ARG 47 10.457 17.155 -13.994
331 HH12 ARG 47 2HH1 ARG 47 10.519 16.366 -15.500
332 HH21 ARG 47 1HH2 ARG 47 9.034 13.359 -14.418
333 HH22 ARG 47 2HH2 ARG 47 9.639 14.222 -15.770
334 H ARG 48 H ARG 48 8.689 14.912 -7.668
335 HA ARG 48 HA ARG 48 7.543 12.303 -7.176
336 HB2 ARG 48 2HB ARG 48 10.397 12.939 -7.966
337 HB3 ARG 48 1HB ARG 48 9.895 11.399 -7.290
338 HG2 ARG 48 2HG ARG 48 8.450 11.003 -9.199
339 HG3 ARG 48 1HG ARG 48 8.871 12.579 -9.860
340 HD2 ARG 48 2HD ARG 48 10.783 10.306 -9.371
341 HD3 ARG 48 1HD ARG 48 10.092 10.743 -10.935
342 HE ARG 48 HE ARG 48 11.720 12.632 -9.393
343 HH11 ARG 48 1HH1 ARG 48 11.084 10.905 -12.464
344 HH12 ARG 48 2HH1 ARG 48 12.404 11.618 -13.249
345 HH21 ARG 48 1HH2 ARG 48 13.447 13.619 -10.508
346 HH22 ARG 48 2HH2 ARG 48 13.776 13.221 -12.136
347 H HIS 49 H HIS 49 6.990 12.719 -5.214
348 HA HIS 49 HA HIS 49 8.804 14.180 -3.447
349 HB2 HIS 49 2HB HIS 49 6.576 15.138 -3.760
350 HB3 HIS 49 1HB HIS 49 5.831 13.616 -3.318
351 HD2 HIS 49 2HD HIS 49 6.056 12.991 -0.540
352 HE1 HIS 49 1HE HIS 49 6.621 17.038 0.509
353 HE2 HIS 49 2HE HIS 49 6.466 14.656 1.344
354 H LEU 50 H LEU 50 6.732 11.319 -3.666
355 HA LEU 50 HA LEU 50 8.454 9.832 -1.916
356 HB2 LEU 50 2HB LEU 50 7.053 10.999 -0.317
357 HB3 LEU 50 1HB LEU 50 5.612 10.626 -1.218
358 HG LEU 50 HG LEU 50 7.182 8.396 0.070
359 HD11 LEU 50 1HD1 LEU 50 5.096 10.171 1.380
360 HD12 LEU 50 2HD1 LEU 50 6.814 10.161 1.787
361 HD13 LEU 50 3HD1 LEU 50 5.829 8.735 2.096
362 HD21 LEU 50 3HD2 LEU 50 4.252 8.878 -0.452
363 HD22 LEU 50 1HD2 LEU 50 4.945 7.406 0.233
364 HD23 LEU 50 2HD2 LEU 50 5.309 7.862 -1.434
365 H GLU 51 H GLU 51 7.826 7.508 -1.998
366 HA GLU 51 HA GLU 51 5.827 6.820 -3.988
367 HB2 GLU 51 2HB GLU 51 7.320 5.242 -5.088
368 HB3 GLU 51 1HB GLU 51 7.976 6.866 -5.214
369 HG2 GLU 51 2HG GLU 51 9.543 6.387 -3.420
370 HG3 GLU 51 1HG GLU 51 8.851 4.785 -3.225
371 H ILE 52 H ILE 52 4.957 4.784 -3.630
372 HA ILE 52 HA ILE 52 5.913 3.449 -1.199
373 HB ILE 52 HB ILE 52 3.075 3.447 -2.272
374 HG12 ILE 52 2HG1 ILE 52 4.210 4.718 0.238
375 HG13 ILE 52 1HG1 ILE 52 3.731 5.597 -1.206
376 HG21 ILE 52 1HG2 ILE 52 3.727 1.347 -1.243
377 HG22 ILE 52 2HG2 ILE 52 2.566 2.191 -0.207
378 HG23 ILE 52 3HG2 ILE 52 4.287 2.190 0.197
379 HD11 ILE 52 3HD1 ILE 52 1.898 3.996 0.571
380 HD12 ILE 52 1HD1 ILE 52 1.421 4.902 -0.865
381 HD13 ILE 52 2HD1 ILE 52 2.048 5.752 0.547
382 H ARG 53 H ARG 53 6.870 1.649 -1.653
383 HA ARG 53 HA ARG 53 6.313 0.326 -4.189
384 HB2 ARG 53 2HB ARG 53 8.698 0.840 -3.416
385 HB3 ARG 53 1HB ARG 53 8.464 -0.337 -2.141
386 HG2 ARG 53 2HG ARG 53 8.124 -1.057 -5.019
387 HG3 ARG 53 1HG ARG 53 9.720 -1.041 -4.278
388 HD2 ARG 53 2HD ARG 53 7.385 -2.666 -3.248
389 HD3 ARG 53 1HD ARG 53 8.577 -3.293 -4.379
390 HE ARG 53 HE ARG 53 9.893 -2.259 -2.132
391 HH11 ARG 53 1HH1 ARG 53 7.895 -5.033 -3.092
392 HH12 ARG 53 2HH1 ARG 53 8.542 -6.074 -1.894
393 HH21 ARG 53 1HH2 ARG 53 10.785 -3.740 -0.522
394 HH22 ARG 53 2HH2 ARG 53 10.191 -5.341 -0.414
395 H TRP 54 H TRP 54 4.638 -0.960 -4.090
396 HA TRP 54 HA TRP 54 4.275 -2.531 -1.665
397 HB2 TRP 54 2HB TRP 54 2.455 -1.011 -1.855
398 HB3 TRP 54 1HB TRP 54 2.245 -1.355 -3.565
399 HD1 TRP 54 HD TRP 54 0.161 -2.820 -4.004
400 HE1 TRP 54 1HE TRP 54 -1.162 -4.622 -2.711
401 HE3 TRP 54 3HE TRP 54 2.948 -3.044 0.236
402 HZ2 TRP 54 2HZ TRP 54 -1.052 -5.952 -0.266
403 HZ3 TRP 54 3HZ TRP 54 2.301 -4.587 1.996
404 HH2 TRP 54 HH TRP 54 0.325 -6.032 1.767
405 H ASP 55 H ASP 55 4.234 -4.629 -1.835
406 HA ASP 55 HA ASP 55 3.495 -5.995 -4.276
407 HB2 ASP 55 2HB ASP 55 6.101 -6.489 -2.780
408 HB3 ASP 55 1HB ASP 55 5.352 -7.716 -3.787
409 H GLY 56 H GLY 56 3.176 -8.379 -3.619
410 HA2 GLY 56 2HA GLY 56 1.553 -8.385 -1.261
411 HA3 GLY 56 1HA GLY 56 1.896 -9.773 -2.286
412 H GLN 57 H GLN 57 3.532 -7.661 0.001
413 HA GLN 57 HA GLN 57 4.482 -9.860 1.613
414 HB2 GLN 57 2HB GLN 57 6.206 -9.673 -0.202
415 HB3 GLN 57 1HB GLN 57 6.458 -7.997 0.246
416 HG2 GLN 57 2HG GLN 57 8.218 -9.283 1.196
417 HG3 GLN 57 1HG GLN 57 7.156 -8.772 2.506
418 HE21 GLN 57 1HE2 GLN 57 7.831 -10.429 3.836
419 HE22 GLN 57 2HE2 GLN 57 7.383 -12.070 3.595
420 H VAL 58 H VAL 58 5.577 -6.502 1.038
421 HA VAL 58 HA VAL 58 4.376 -5.589 3.500
422 HB VAL 58 HB VAL 58 6.501 -4.421 4.180
423 HG11 VAL 58 1HG1 VAL 58 5.848 -6.416 5.377
424 HG12 VAL 58 2HG1 VAL 58 7.604 -6.358 5.212
425 HG13 VAL 58 3HG1 VAL 58 6.652 -7.425 4.179
426 HG21 VAL 58 3HG2 VAL 58 7.680 -4.499 2.056
427 HG22 VAL 58 1HG2 VAL 58 7.797 -6.256 2.162
428 HG23 VAL 58 2HG2 VAL 58 8.652 -5.243 3.325
429 H ALA 59 H ALA 59 4.436 -3.245 3.625
430 HA ALA 59 HA ALA 59 4.457 -2.043 0.947
431 HB1 ALA 59 1HB ALA 59 3.061 -1.143 3.462
432 HB2 ALA 59 2HB ALA 59 2.294 -1.951 2.098
433 HB3 ALA 59 3HB ALA 59 2.981 -0.336 1.894
434 H LEU 60 H LEU 60 6.298 -1.190 0.564
435 HA LEU 60 HA LEU 60 7.847 -0.085 2.737
436 HB2 LEU 60 2HB LEU 60 8.831 -1.732 1.183
437 HB3 LEU 60 1HB LEU 60 8.541 -0.647 -0.146
438 HG LEU 60 HG LEU 60 10.395 0.121 2.115
439 HD11 LEU 60 1HD1 LEU 60 12.211 -0.759 0.728
440 HD12 LEU 60 2HD1 LEU 60 11.011 -1.407 -0.401
441 HD13 LEU 60 3HD1 LEU 60 11.110 -2.041 1.240
442 HD21 LEU 60 3HD2 LEU 60 10.247 0.889 -0.802
443 HD22 LEU 60 1HD2 LEU 60 11.411 1.513 0.371
444 HD23 LEU 60 2HD2 LEU 60 9.689 1.880 0.540
445 H LEU 61 H LEU 61 7.624 1.920 3.198
446 HA LEU 61 HA LEU 61 6.593 3.858 1.293
447 HB2 LEU 61 2HB LEU 61 5.553 3.573 3.486
448 HB3 LEU 61 1HB LEU 61 7.045 3.847 4.314
449 HG LEU 61 HG LEU 61 5.493 5.716 4.544
450 HD11 LEU 61 1HD1 LEU 61 7.813 6.551 2.834
451 HD12 LEU 61 2HD1 LEU 61 7.811 6.341 4.584
452 HD13 LEU 61 3HD1 LEU 61 6.835 7.612 3.850
453 HD21 LEU 61 3HD2 LEU 61 4.783 7.061 2.649
454 HD22 LEU 61 1HD2 LEU 61 4.227 5.396 2.523
455 HD23 LEU 61 2HD2 LEU 61 5.599 5.935 1.556
456 H ALA 62 H ALA 62 8.083 5.114 0.248
457 HA ALA 62 HA ALA 62 10.553 5.722 1.658
458 HB1 ALA 62 1HB ALA 62 10.439 4.707 -1.178
459 HB2 ALA 62 2HB ALA 62 11.055 3.814 0.212
460 HB3 ALA 62 3HB ALA 62 11.881 5.272 -0.337
461 H ASP 63 H ASP 63 10.863 7.825 1.630
462 HA ASP 63 HA ASP 63 9.362 9.498 -0.105
463 HB2 ASP 63 2HB ASP 63 11.540 10.080 1.925
464 HB3 ASP 63 1HB ASP 63 10.936 11.338 0.841
465 H LEU 64 H LEU 64 10.133 10.701 -1.811
466 HA LEU 64 HA LEU 64 12.658 9.694 -2.873
467 HB2 LEU 64 2HB LEU 64 10.800 8.625 -4.035
468 HB3 LEU 64 1HB LEU 64 10.044 10.173 -4.310
469 HG LEU 64 HG LEU 64 11.735 10.774 -5.914
470 HD11 LEU 64 1HD1 LEU 64 13.495 9.181 -6.584
471 HD12 LEU 64 2HD1 LEU 64 12.956 8.053 -5.345
472 HD13 LEU 64 3HD1 LEU 64 13.658 9.604 -4.877
473 HD21 LEU 64 3HD2 LEU 64 11.232 9.100 -7.615
474 HD22 LEU 64 1HD2 LEU 64 9.802 9.483 -6.658
475 HD23 LEU 64 2HD2 LEU 64 10.683 7.991 -6.359
476 H ASN 65 H ASN 65 13.387 11.501 -1.732
477 HA ASN 65 HA ASN 65 14.238 13.662 -3.102
478 HB2 ASN 65 2HB ASN 65 11.770 14.390 -3.140
479 HB3 ASN 65 1HB ASN 65 11.840 14.441 -1.384
480 HD21 ASN 65 1HD2 ASN 65 12.960 15.915 -4.330
481 HD22 ASN 65 2HD2 ASN 65 13.521 17.381 -3.605
482 H SER 66 H SER 66 15.494 15.006 -1.567
483 HA SER 66 HA SER 66 15.881 13.443 0.841
484 HB2 SER 66 2HB SER 66 17.675 15.534 -0.397
485 HB3 SER 66 1HB SER 66 18.071 14.481 0.962
486 HG SER 66 HG SER 66 18.839 13.317 -0.600
487 H THR 67 H THR 67 14.988 16.708 -0.148
488 HA THR 67 HA THR 67 15.226 17.616 2.595
489 HB THR 67 HB THR 67 15.996 19.115 0.741
490 HG1 THR 67 1HG THR 67 15.048 19.884 2.853
491 HG21 THR 67 3HG2 THR 67 14.241 18.585 -0.905
492 HG22 THR 67 1HG2 THR 67 14.361 20.324 -0.619
493 HG23 THR 67 2HG2 THR 67 13.056 19.395 0.116
494 H ASN 68 H ASN 68 12.747 16.642 0.380
495 HA ASN 68 HA ASN 68 10.607 17.626 2.071
496 HB2 ASN 68 2HB ASN 68 10.641 16.232 -0.599
497 HB3 ASN 68 1HB ASN 68 9.153 16.382 0.318
498 HD21 ASN 68 1HD2 ASN 68 8.187 17.648 -1.214
499 HD22 ASN 68 2HD2 ASN 68 8.603 19.298 -1.489
500 H GLY 69 H GLY 69 12.423 15.601 3.094
501 HA2 GLY 69 2HA GLY 69 11.387 13.006 3.134
502 HA3 GLY 69 1HA GLY 69 12.349 13.726 4.420
503 H THR 70 H THR 70 9.741 12.063 4.108
504 HA THR 70 HA THR 70 7.762 13.727 5.302
505 HB THR 70 HB THR 70 7.989 11.100 3.933
506 HG1 THR 70 1HG THR 70 7.537 12.207 2.494
507 HG21 THR 70 3HG2 THR 70 5.462 12.046 5.328
508 HG22 THR 70 1HG2 THR 70 6.402 10.626 5.784
509 HG23 THR 70 2HG2 THR 70 5.575 10.674 4.224
510 H THR 71 H THR 71 6.522 13.003 7.211
511 HA THR 71 HA THR 71 8.229 11.722 9.186
512 HB THR 71 HB THR 71 6.394 12.655 10.731
513 HG1 THR 71 1HG THR 71 6.003 14.747 9.022
514 HG21 THR 71 3HG2 THR 71 7.519 14.802 10.885
515 HG22 THR 71 1HG2 THR 71 8.299 14.515 9.316
516 HG23 THR 71 2HG2 THR 71 8.649 13.462 10.705
517 H VAL 72 H VAL 72 7.573 9.986 10.237
518 HA VAL 72 HA VAL 72 4.909 8.923 9.689
519 HB VAL 72 HB VAL 72 5.909 6.623 9.733
520 HG11 VAL 72 1HG1 VAL 72 6.942 6.678 7.501
521 HG12 VAL 72 2HG1 VAL 72 7.118 8.429 7.637
522 HG13 VAL 72 3HG1 VAL 72 5.514 7.715 7.553
523 HG21 VAL 72 3HG2 VAL 72 7.926 7.131 11.010
524 HG22 VAL 72 1HG2 VAL 72 8.529 8.115 9.679
525 HG23 VAL 72 2HG2 VAL 72 8.346 6.369 9.474
526 H ASN 73 H ASN 73 3.823 8.704 11.512
527 HA ASN 73 HA ASN 73 3.261 8.721 13.663
528 HB2 ASN 73 2HB ASN 73 5.804 7.090 14.006
529 HB3 ASN 73 1HB ASN 73 4.606 7.309 15.276
530 HD21 ASN 73 1HD2 ASN 73 5.388 5.680 12.328
531 HD22 ASN 73 2HD2 ASN 73 4.022 4.634 12.297
532 H ASN 74 H ASN 74 4.723 10.867 12.592
533 HA ASN 74 HA ASN 74 5.364 12.880 13.174
534 HB2 ASN 74 2HB ASN 74 3.979 12.652 15.227
535 HB3 ASN 74 1HB ASN 74 5.337 11.922 16.062
536 HD21 ASN 74 1HD2 ASN 74 5.227 13.473 17.646
537 HD22 ASN 74 2HD2 ASN 74 5.754 15.093 17.442
538 H ALA 75 H ALA 75 7.185 10.320 13.070
539 HA ALA 75 HA ALA 75 9.653 11.593 13.984
540 HB1 ALA 75 1HB ALA 75 9.245 9.299 14.780
541 HB2 ALA 75 2HB ALA 75 10.667 9.380 13.737
542 HB3 ALA 75 3HB ALA 75 9.146 8.746 13.109
543 HA PRO 76 HA PRO 76 10.270 12.506 9.617
544 HB2 PRO 76 2HB PRO 76 12.720 13.652 9.873
545 HB3 PRO 76 1HB PRO 76 11.222 14.490 10.297
546 HG2 PRO 76 2HG PRO 76 13.180 13.096 12.070
547 HG3 PRO 76 1HG PRO 76 12.369 14.652 12.318
548 HD2 PRO 76 2HD PRO 76 11.564 12.356 13.510
549 HD3 PRO 76 1HD PRO 76 10.429 13.648 13.065
550 H VAL 77 H VAL 77 10.875 11.058 8.154
551 HA VAL 77 HA VAL 77 13.422 9.665 8.431
552 HB VAL 77 HB VAL 77 12.383 7.526 7.709
553 HG11 VAL 77 1HG1 VAL 77 11.182 8.564 10.272
554 HG12 VAL 77 2HG1 VAL 77 12.767 7.817 10.092
555 HG13 VAL 77 3HG1 VAL 77 11.305 6.867 9.804
556 HG21 VAL 77 3HG2 VAL 77 9.767 8.976 8.104
557 HG22 VAL 77 1HG2 VAL 77 9.928 7.237 7.835
558 HG23 VAL 77 2HG2 VAL 77 10.426 8.378 6.584
559 H GLN 78 H GLN 78 13.651 8.337 6.221
560 HA GLN 78 HA GLN 78 12.365 9.834 4.079
561 HB2 GLN 78 2HB GLN 78 14.354 9.545 2.741
562 HB3 GLN 78 1HB GLN 78 14.787 10.311 4.254
563 HG2 GLN 78 2HG GLN 78 15.181 7.372 3.663
564 HG3 GLN 78 1HG GLN 78 16.398 8.621 3.457
565 HE21 GLN 78 1HE2 GLN 78 16.354 6.225 5.110
566 HE22 GLN 78 2HE2 GLN 78 16.687 6.761 6.714
567 H GLU 79 H GLU 79 12.333 7.009 5.705
568 HA GLU 79 HA GLU 79 11.086 5.523 3.667
569 HB2 GLU 79 2HB GLU 79 12.686 3.672 3.541
570 HB3 GLU 79 1HB GLU 79 13.435 5.163 2.996
571 HG2 GLU 79 2HG GLU 79 14.376 5.370 5.344
572 HG3 GLU 79 1HG GLU 79 13.878 3.693 5.568
573 H TRP 80 H TRP 80 10.015 3.734 4.559
574 HA TRP 80 HA TRP 80 10.308 2.939 7.279
575 HB2 TRP 80 2HB TRP 80 9.352 5.084 7.688
576 HB3 TRP 80 1HB TRP 80 8.098 4.871 6.481
577 HD1 TRP 80 HD TRP 80 5.925 3.554 7.285
578 HE1 TRP 80 1HE TRP 80 5.000 2.993 9.602
579 HE3 TRP 80 3HE TRP 80 10.138 4.419 10.044
580 HZ2 TRP 80 2HZ TRP 80 5.932 2.949 12.266
581 HZ3 TRP 80 3HZ TRP 80 10.025 4.111 12.477
582 HH2 TRP 80 HH TRP 80 7.969 3.391 13.563
583 H GLN 81 H GLN 81 8.932 1.131 7.640
584 HA GLN 81 HA GLN 81 7.419 0.379 5.263
585 HB2 GLN 81 2HB GLN 81 7.468 -2.000 6.013
586 HB3 GLN 81 1HB GLN 81 9.054 -1.333 5.690
587 HG2 GLN 81 2HG GLN 81 9.459 -1.118 8.073
588 HG3 GLN 81 1HG GLN 81 7.840 -1.729 8.412
589 HE21 GLN 81 1HE2 GLN 81 7.388 -3.890 8.021
590 HE22 GLN 81 2HE2 GLN 81 8.633 -5.071 7.866
591 H LEU 82 H LEU 82 5.429 0.453 5.233
592 HA LEU 82 HA LEU 82 3.921 1.705 7.236
593 HB2 LEU 82 2HB LEU 82 2.914 0.116 4.908
594 HB3 LEU 82 1HB LEU 82 2.014 1.279 5.847
595 HG LEU 82 HG LEU 82 4.371 1.893 4.077
596 HD11 LEU 82 1HD1 LEU 82 1.446 2.563 3.769
597 HD12 LEU 82 2HD1 LEU 82 2.331 1.363 2.835
598 HD13 LEU 82 3HD1 LEU 82 2.751 3.069 2.696
599 HD21 LEU 82 3HD2 LEU 82 4.364 3.357 5.962
600 HD22 LEU 82 1HD2 LEU 82 2.634 3.653 5.772
601 HD23 LEU 82 2HD2 LEU 82 3.763 4.229 4.551
602 H ALA 83 H ALA 83 2.342 1.028 8.577
603 HA ALA 83 HA ALA 83 1.412 -1.724 8.567
604 HB1 ALA 83 1HB ALA 83 1.569 -1.845 11.023
605 HB2 ALA 83 2HB ALA 83 2.364 -0.272 11.050
606 HB3 ALA 83 3HB ALA 83 3.167 -1.653 10.302
607 H ASP 84 H ASP 84 -0.505 -1.769 10.230
608 HA ASP 84 HA ASP 84 -2.346 0.252 9.327
609 HB2 ASP 84 2HB ASP 84 -3.125 -2.058 9.634
610 HB3 ASP 84 1HB ASP 84 -2.730 -1.975 11.346
611 H GLY 85 H GLY 85 -2.317 2.188 10.181
612 HA2 GLY 85 2HA GLY 85 -3.057 3.472 12.090
613 HA3 GLY 85 1HA GLY 85 -2.147 2.370 13.109
614 H ASP 86 H ASP 86 -0.459 3.215 10.234
615 HA ASP 86 HA ASP 86 1.301 4.854 11.806
616 HB2 ASP 86 2HB ASP 86 1.394 4.011 8.922
617 HB3 ASP 86 1HB ASP 86 2.488 5.231 9.551
618 H VAL 87 H VAL 87 1.115 6.878 12.128
619 HA VAL 87 HA VAL 87 -0.633 8.515 10.447
620 HB VAL 87 HB VAL 87 1.020 9.431 12.835
621 HG11 VAL 87 1HG1 VAL 87 0.273 11.232 11.407
622 HG12 VAL 87 2HG1 VAL 87 -0.575 11.278 12.953
623 HG13 VAL 87 3HG1 VAL 87 -1.392 10.658 11.518
624 HG21 VAL 87 3HG2 VAL 87 -1.850 8.479 12.827
625 HG22 VAL 87 1HG2 VAL 87 -1.016 9.198 14.204
626 HG23 VAL 87 2HG2 VAL 87 -0.487 7.639 13.565
627 H ILE 88 H ILE 88 0.249 9.341 8.671
628 HA ILE 88 HA ILE 88 3.119 9.900 8.778
629 HB ILE 88 HB ILE 88 1.443 8.806 6.514
630 HG12 ILE 88 2HG1 ILE 88 3.646 7.567 8.175
631 HG13 ILE 88 1HG1 ILE 88 1.946 7.155 8.191
632 HG21 ILE 88 1HG2 ILE 88 3.518 8.675 5.208
633 HG22 ILE 88 2HG2 ILE 88 4.371 9.509 6.513
634 HG23 ILE 88 3HG2 ILE 88 3.091 10.337 5.627
635 HD11 ILE 88 3HD1 ILE 88 3.809 6.768 5.875
636 HD12 ILE 88 1HD1 ILE 88 2.104 6.339 5.915
637 HD13 ILE 88 2HD1 ILE 88 3.239 5.510 6.972
638 H ARG 89 H ARG 89 3.754 11.864 7.902
639 HA ARG 89 HA ARG 89 1.615 13.403 6.687
640 HB2 ARG 89 2HB ARG 89 1.739 14.102 9.047
641 HB3 ARG 89 1HB ARG 89 3.430 14.541 8.817
642 HG2 ARG 89 2HG ARG 89 2.833 16.275 7.274
643 HG3 ARG 89 1HG ARG 89 1.148 15.761 7.280
644 HD2 ARG 89 2HD ARG 89 1.056 16.303 9.703
645 HD3 ARG 89 1HD ARG 89 2.694 16.945 9.579
646 HE ARG 89 HE ARG 89 1.892 18.630 8.115
647 HH11 ARG 89 1HH1 ARG 89 -0.640 16.862 9.897
648 HH12 ARG 89 2HH1 ARG 89 -1.853 17.996 9.598
649 HH21 ARG 89 1HH2 ARG 89 0.179 20.260 7.793
650 HH22 ARG 89 2HH2 ARG 89 -1.383 19.952 8.395
651 H LEU 90 H LEU 90 2.097 14.242 4.912
652 HA LEU 90 HA LEU 90 4.891 14.650 4.229
653 HB2 LEU 90 2HB LEU 90 4.254 14.508 1.846
654 HB3 LEU 90 1HB LEU 90 3.902 13.023 2.687
655 HG LEU 90 HG LEU 90 1.727 15.046 2.137
656 HD11 LEU 90 1HD1 LEU 90 1.235 13.787 0.085
657 HD12 LEU 90 2HD1 LEU 90 2.679 12.807 0.340
658 HD13 LEU 90 3HD1 LEU 90 2.831 14.532 0.006
659 HD21 LEU 90 3HD2 LEU 90 1.716 12.039 2.494
660 HD22 LEU 90 1HD2 LEU 90 0.300 13.054 2.223
661 HD23 LEU 90 2HD2 LEU 90 1.222 13.213 3.713
662 H GLY 91 H GLY 91 5.158 16.542 2.728
663 HA2 GLY 91 2HA GLY 91 4.595 18.914 3.912
664 HA3 GLY 91 1HA GLY 91 4.843 18.767 2.186
665 H HIS 92 H HIS 92 2.685 19.445 4.687
666 HA HIS 92 HA HIS 92 0.783 20.603 4.764
667 HB2 HIS 92 2HB HIS 92 0.728 20.492 1.745
668 HB3 HIS 92 1HB HIS 92 -0.484 21.314 2.716
669 HD1 HIS 92 1HD HIS 92 2.203 22.238 0.731
670 HD2 HIS 92 2HD HIS 92 1.159 23.109 4.654
671 HE1 HIS 92 1HE HIS 92 3.447 24.343 1.335
672 H SER 93 H SER 93 0.895 17.424 3.905
673 HA SER 93 HA SER 93 -1.997 17.211 4.392
674 HB2 SER 93 2HB SER 93 -0.530 15.731 2.190
675 HB3 SER 93 1HB SER 93 -2.208 15.468 2.651
676 HG SER 93 HG SER 93 -1.971 18.042 2.237
677 H GLU 94 H GLU 94 -2.564 15.557 5.788
678 HA GLU 94 HA GLU 94 -0.404 13.718 6.492
679 HB2 GLU 94 2HB GLU 94 -1.493 13.390 8.659
680 HB3 GLU 94 1HB GLU 94 -1.135 15.088 8.400
681 HG2 GLU 94 2HG GLU 94 -3.504 15.420 7.745
682 HG3 GLU 94 1HG GLU 94 -3.819 13.742 8.178
683 H ILE 95 H ILE 95 -0.748 11.588 6.497
684 HA ILE 95 HA ILE 95 -3.229 10.689 5.283
685 HB ILE 95 HB ILE 95 -1.418 10.940 3.587
686 HG12 ILE 95 2HG1 ILE 95 -1.430 8.435 2.842
687 HG13 ILE 95 1HG1 ILE 95 -2.508 8.260 4.220
688 HG21 ILE 95 1HG2 ILE 95 0.053 8.832 5.110
689 HG22 ILE 95 2HG2 ILE 95 0.522 10.528 4.965
690 HG23 ILE 95 3HG2 ILE 95 0.512 9.487 3.537
691 HD11 ILE 95 3HD1 ILE 95 -2.950 10.139 1.920
692 HD12 ILE 95 1HD1 ILE 95 -4.021 9.892 3.300
693 HD13 ILE 95 2HD1 ILE 95 -3.745 8.582 2.153
694 H ILE 96 H ILE 96 -4.043 8.926 6.277
695 HA ILE 96 HA ILE 96 -2.396 7.673 8.363
696 HB ILE 96 HB ILE 96 -5.440 7.775 8.148
697 HG12 ILE 96 2HG1 ILE 96 -5.254 8.937 10.420
698 HG13 ILE 96 1HG1 ILE 96 -3.535 9.096 10.108
699 HG21 ILE 96 1HG2 ILE 96 -5.515 6.617 10.312
700 HG22 ILE 96 2HG2 ILE 96 -3.765 6.425 10.255
701 HG23 ILE 96 3HG2 ILE 96 -4.777 5.629 9.050
702 HD11 ILE 96 3HD1 ILE 96 -5.765 10.317 8.484
703 HD12 ILE 96 1HD1 ILE 96 -4.043 10.478 8.142
704 HD13 ILE 96 2HD1 ILE 96 -4.719 11.160 9.623
705 H VAL 97 H VAL 97 -1.672 5.705 7.944
706 HA VAL 97 HA VAL 97 -2.780 4.302 5.669
707 HB VAL 97 HB VAL 97 -0.275 3.789 7.288
708 HG11 VAL 97 1HG1 VAL 97 -1.302 2.396 4.811
709 HG12 VAL 97 2HG1 VAL 97 -1.183 1.691 6.425
710 HG13 VAL 97 3HG1 VAL 97 0.282 2.145 5.548
711 HG21 VAL 97 3HG2 VAL 97 -0.198 5.771 5.869
712 HG22 VAL 97 1HG2 VAL 97 -0.722 4.796 4.495
713 HG23 VAL 97 2HG2 VAL 97 0.852 4.493 5.236
714 H ARG 98 H ARG 98 -4.110 2.690 5.819
715 HA ARG 98 HA ARG 98 -4.355 1.222 8.341
716 HB2 ARG 98 2HB ARG 98 -6.441 1.909 6.275
717 HB3 ARG 98 1HB ARG 98 -6.701 0.863 7.662
718 HG2 ARG 98 2HG ARG 98 -5.895 3.743 7.829
719 HG3 ARG 98 1HG ARG 98 -7.563 3.169 7.954
720 HD2 ARG 98 2HD ARG 98 -5.258 2.545 9.807
721 HD3 ARG 98 1HD ARG 98 -6.676 3.526 10.172
722 HE ARG 98 HE ARG 98 -6.495 0.646 9.959
723 HH11 ARG 98 1HH1 ARG 98 -8.568 3.487 10.473
724 HH12 ARG 98 2HH1 ARG 98 -9.886 2.651 11.110
725 HH21 ARG 98 1HH2 ARG 98 -8.349 -0.569 10.781
726 HH22 ARG 98 2HH2 ARG 98 -9.778 0.226 11.236
727 H MET 99 H MET 99 -4.689 -0.942 8.164
728 HA MET 99 HA MET 99 -4.456 -2.119 5.502
729 HB2 MET 99 2HB MET 99 -2.912 -3.055 7.920
730 HB3 MET 99 1HB MET 99 -3.073 -3.973 6.441
731 HG2 MET 99 2HG MET 99 -1.992 -2.126 5.207
732 HG3 MET 99 1HG MET 99 -1.731 -1.301 6.738
733 HE1 MET 99 3HE MET 99 1.827 -2.600 5.624
734 HE2 MET 99 1HE MET 99 0.851 -1.176 5.976
735 HE3 MET 99 2HE MET 99 0.519 -2.139 4.535
736 H HIS 100 H HIS 100 -6.134 -3.113 5.140
737 HA HIS 100 HA HIS 100 -7.743 -4.122 7.335
738 HB2 HIS 100 2HB HIS 100 -8.518 -3.595 4.450
739 HB3 HIS 100 1HB HIS 100 -9.594 -4.237 5.680
740 HD1 HIS 100 1HD HIS 100 -10.451 -2.544 7.519
741 HD2 HIS 100 2HD HIS 100 -8.001 -0.862 4.604
742 HE1 HIS 100 1HE HIS 100 -10.663 -0.063 7.777
Start of MODEL 26
1 H1 GLY 1 1HT GLY 1 -11.592 -10.496 -11.945
2 H2 GLY 1 2HT GLY 1 -11.992 -11.035 -10.388
3 H3 GLY 1 3HT GLY 1 -10.501 -11.464 -11.062
4 HA2 GLY 1 1HA GLY 1 -9.809 -9.186 -11.021
5 HA3 GLY 1 2HA GLY 1 -11.366 -8.773 -10.313
6 H HIS 2 H HIS 2 -10.042 -7.944 -8.536
7 HA HIS 2 HA HIS 2 -8.898 -10.057 -6.890
8 HB2 HIS 2 2HB HIS 2 -7.761 -8.270 -5.600
9 HB3 HIS 2 1HB HIS 2 -7.336 -8.206 -7.299
10 HD1 HIS 2 1HD HIS 2 -8.853 -6.147 -4.556
11 HD2 HIS 2 2HD HIS 2 -8.367 -5.945 -8.683
12 HE1 HIS 2 1HE HIS 2 -9.343 -3.787 -5.196
13 H GLY 3 H GLY 3 -9.500 -10.325 -4.791
14 HA2 GLY 3 2HA GLY 3 -12.178 -9.368 -4.149
15 HA3 GLY 3 1HA GLY 3 -11.281 -10.615 -3.277
16 H SER 4 H SER 4 -10.158 -10.061 -1.495
17 HA SER 4 HA SER 4 -9.994 -7.214 -0.881
18 HB2 SER 4 2HB SER 4 -9.681 -9.595 0.969
19 HB3 SER 4 1HB SER 4 -9.850 -7.899 1.423
20 HG SER 4 HG SER 4 -11.770 -9.314 1.489
21 H ALA 5 H ALA 5 -8.239 -9.572 -2.246
22 HA ALA 5 HA ALA 5 -6.074 -9.985 -2.759
23 HB1 ALA 5 1HB ALA 5 -6.072 -7.591 -3.347
24 HB2 ALA 5 2HB ALA 5 -4.499 -8.115 -2.745
25 HB3 ALA 5 3HB ALA 5 -5.582 -7.195 -1.698
26 H GLY 6 H GLY 6 -7.112 -10.435 0.024
27 HA2 GLY 6 2HA GLY 6 -6.239 -11.517 1.885
28 HA3 GLY 6 1HA GLY 6 -4.623 -11.260 1.225
29 H THR 7 H THR 7 -4.152 -8.812 1.058
30 HA THR 7 HA THR 7 -5.082 -7.342 3.379
31 HB THR 7 HB THR 7 -2.191 -7.882 2.677
32 HG1 THR 7 1HG THR 7 -3.832 -9.120 4.216
33 HG21 THR 7 3HG2 THR 7 -1.627 -6.386 4.576
34 HG22 THR 7 1HG2 THR 7 -3.329 -5.946 4.716
35 HG23 THR 7 2HG2 THR 7 -2.427 -5.520 3.264
36 H SER 8 H SER 8 -5.752 -5.460 2.697
37 HA SER 8 HA SER 8 -4.478 -4.294 0.329
38 HB2 SER 8 2HB SER 8 -7.310 -3.955 1.345
39 HB3 SER 8 1HB SER 8 -6.608 -3.001 0.039
40 HG SER 8 HG SER 8 -6.826 -5.834 0.072
41 H VAL 9 H VAL 9 -3.439 -2.446 0.598
42 HA VAL 9 HA VAL 9 -3.800 -1.103 3.138
43 HB VAL 9 HB VAL 9 -1.511 -1.815 2.885
44 HG11 VAL 9 1HG1 VAL 9 -1.404 -2.203 0.539
45 HG12 VAL 9 2HG1 VAL 9 -0.102 -1.090 0.984
46 HG13 VAL 9 3HG1 VAL 9 -1.579 -0.483 0.223
47 HG21 VAL 9 3HG2 VAL 9 -0.276 0.310 2.941
48 HG22 VAL 9 1HG2 VAL 9 -1.772 0.397 3.871
49 HG23 VAL 9 2HG2 VAL 9 -1.684 1.136 2.273
50 H THR 10 H THR 10 -4.631 0.814 3.209
51 HA THR 10 HA THR 10 -5.208 2.156 0.671
52 HB THR 10 HB THR 10 -7.106 1.881 3.017
53 HG1 THR 10 1HG THR 10 -8.183 0.354 1.644
54 HG21 THR 10 3HG2 THR 10 -7.541 2.749 0.150
55 HG22 THR 10 1HG2 THR 10 -7.486 3.822 1.550
56 HG23 THR 10 2HG2 THR 10 -8.786 2.640 1.394
57 H LEU 11 H LEU 11 -4.848 4.282 0.720
58 HA LEU 11 HA LEU 11 -3.850 5.525 3.169
59 HB2 LEU 11 2HB LEU 11 -4.062 6.688 0.403
60 HB3 LEU 11 1HB LEU 11 -3.102 7.285 1.738
61 HG LEU 11 HG LEU 11 -2.709 4.740 0.293
62 HD11 LEU 11 1HD1 LEU 11 -0.665 5.856 -0.644
63 HD12 LEU 11 2HD1 LEU 11 -1.127 7.330 0.204
64 HD13 LEU 11 3HD1 LEU 11 -2.148 6.707 -1.088
65 HD21 LEU 11 3HD2 LEU 11 -1.010 6.038 2.425
66 HD22 LEU 11 1HD2 LEU 11 -0.524 4.625 1.487
67 HD23 LEU 11 2HD2 LEU 11 -1.918 4.533 2.562
68 H GLN 12 H GLN 12 -4.974 7.005 4.180
69 HA GLN 12 HA GLN 12 -7.581 7.821 3.056
70 HB2 GLN 12 2HB GLN 12 -7.591 6.432 5.181
71 HB3 GLN 12 1HB GLN 12 -6.826 7.795 5.956
72 HG2 GLN 12 2HG GLN 12 -8.720 9.241 5.285
73 HG3 GLN 12 1HG GLN 12 -9.547 7.805 4.686
74 HE21 GLN 12 1HE2 GLN 12 -8.452 9.520 7.430
75 HE22 GLN 12 2HE2 GLN 12 -9.354 8.624 8.612
76 H LEU 13 H LEU 13 -7.845 9.892 2.685
77 HA LEU 13 HA LEU 13 -6.052 11.826 3.921
78 HB2 LEU 13 2HB LEU 13 -5.396 11.520 1.613
79 HB3 LEU 13 1HB LEU 13 -7.057 11.650 1.084
80 HG LEU 13 HG LEU 13 -7.106 13.971 1.726
81 HD11 LEU 13 1HD1 LEU 13 -4.998 15.156 2.309
82 HD12 LEU 13 2HD1 LEU 13 -4.188 13.589 2.444
83 HD13 LEU 13 3HD1 LEU 13 -5.513 14.004 3.536
84 HD21 LEU 13 3HD2 LEU 13 -5.619 14.832 -0.027
85 HD22 LEU 13 1HD2 LEU 13 -6.490 13.387 -0.538
86 HD23 LEU 13 2HD2 LEU 13 -4.791 13.275 -0.072
87 H ASP 14 H ASP 14 -7.239 13.064 5.176
88 HA ASP 14 HA ASP 14 -9.962 13.587 4.317
89 HB2 ASP 14 2HB ASP 14 -10.089 12.161 6.260
90 HB3 ASP 14 1HB ASP 14 -9.041 13.250 7.169
91 H ASP 15 H ASP 15 -9.827 15.400 3.436
92 HA ASP 15 HA ASP 15 -8.741 17.709 4.912
93 HB2 ASP 15 2HB ASP 15 -7.860 17.327 2.591
94 HB3 ASP 15 1HB ASP 15 -9.502 17.382 1.978
95 H GLY 16 H GLY 16 -11.167 16.202 5.445
96 HA2 GLY 16 2HA GLY 16 -13.278 16.877 6.177
97 HA3 GLY 16 1HA GLY 16 -13.175 18.273 5.090
98 H SER 17 H SER 17 -12.582 14.880 4.544
99 HA SER 17 HA SER 17 -14.700 14.759 2.567
100 HB2 SER 17 2HB SER 17 -12.992 13.989 0.850
101 HB3 SER 17 1HB SER 17 -12.979 15.710 1.238
102 HG SER 17 HG SER 17 -10.909 14.951 1.243
103 H GLY 18 H GLY 18 -11.727 13.054 3.451
104 HA2 GLY 18 2HA GLY 18 -11.540 10.965 4.524
105 HA3 GLY 18 1HA GLY 18 -13.266 10.718 4.284
106 H ARG 19 H ARG 19 -10.839 11.642 1.910
107 HA ARG 19 HA ARG 19 -11.799 9.631 0.089
108 HB2 ARG 19 2HB ARG 19 -9.561 11.632 -0.103
109 HB3 ARG 19 1HB ARG 19 -9.907 10.399 -1.317
110 HG2 ARG 19 2HG ARG 19 -11.917 12.462 -0.416
111 HG3 ARG 19 1HG ARG 19 -10.844 12.700 -1.799
112 HD2 ARG 19 2HD ARG 19 -12.791 10.396 -1.523
113 HD3 ARG 19 1HD ARG 19 -13.118 11.884 -2.405
114 HE ARG 19 HE ARG 19 -10.858 11.079 -3.556
115 HH11 ARG 19 1HH1 ARG 19 -13.807 9.234 -2.874
116 HH12 ARG 19 2HH1 ARG 19 -13.680 8.266 -4.251
117 HH21 ARG 19 1HH2 ARG 19 -10.706 9.797 -5.434
118 HH22 ARG 19 2HH2 ARG 19 -11.883 8.610 -5.793
119 H THR 20 H THR 20 -10.547 7.966 -0.786
120 HA THR 20 HA THR 20 -8.277 7.200 0.829
121 HB THR 20 HB THR 20 -9.263 4.823 0.720
122 HG1 THR 20 1HG THR 20 -11.398 4.662 0.353
123 HG21 THR 20 3HG2 THR 20 -10.531 6.980 2.368
124 HG22 THR 20 1HG2 THR 20 -9.093 6.067 2.803
125 HG23 THR 20 2HG2 THR 20 -10.670 5.251 2.746
126 H TYR 21 H TYR 21 -6.745 6.013 -0.229
127 HA TYR 21 HA TYR 21 -7.231 5.443 -3.054
128 HB2 TYR 21 2HB TYR 21 -5.886 7.486 -2.936
129 HB3 TYR 21 1HB TYR 21 -4.746 6.701 -1.851
130 HD1 TYR 21 2HD TYR 21 -6.163 6.434 -5.286
131 HD2 TYR 21 1HD TYR 21 -2.854 5.645 -2.734
132 HE1 TYR 21 2HE TYR 21 -4.858 5.667 -7.220
133 HE2 TYR 21 1HE TYR 21 -1.542 4.878 -4.663
134 HH TYR 21 HH TYR 21 -2.529 5.368 -7.874
135 H GLN 22 H GLN 22 -7.095 3.343 -3.300
136 HA GLN 22 HA GLN 22 -5.665 1.659 -1.465
137 HB2 GLN 22 2HB GLN 22 -7.783 0.901 -2.466
138 HB3 GLN 22 1HB GLN 22 -7.072 1.012 -4.069
139 HG2 GLN 22 2HG GLN 22 -5.411 -0.710 -3.398
140 HG3 GLN 22 1HG GLN 22 -6.261 -0.883 -1.869
141 HE21 GLN 22 1HE2 GLN 22 -6.705 -3.024 -2.270
142 HE22 GLN 22 2HE2 GLN 22 -7.889 -3.541 -3.398
143 H LEU 23 H LEU 23 -3.665 0.918 -1.709
144 HA LEU 23 HA LEU 23 -2.115 1.642 -4.049
145 HB2 LEU 23 2HB LEU 23 -1.420 0.017 -1.618
146 HB3 LEU 23 1HB LEU 23 -0.288 0.500 -2.844
147 HG LEU 23 HG LEU 23 -1.747 2.417 -1.011
148 HD11 LEU 23 1HD1 LEU 23 0.517 2.664 -0.003
149 HD12 LEU 23 2HD1 LEU 23 1.011 1.246 -0.963
150 HD13 LEU 23 3HD1 LEU 23 -0.236 1.093 0.259
151 HD21 LEU 23 3HD2 LEU 23 -0.147 4.056 -1.848
152 HD22 LEU 23 1HD2 LEU 23 -1.102 3.400 -3.177
153 HD23 LEU 23 2HD2 LEU 23 0.556 2.849 -2.915
154 H ARG 24 H ARG 24 -2.056 0.316 -5.769
155 HA ARG 24 HA ARG 24 -2.883 -2.437 -5.360
156 HB2 ARG 24 2HB ARG 24 -2.345 -0.970 -7.947
157 HB3 ARG 24 1HB ARG 24 -2.933 -2.622 -7.815
158 HG2 ARG 24 2HG ARG 24 -4.910 -1.669 -6.566
159 HG3 ARG 24 1HG ARG 24 -4.357 -0.083 -7.095
160 HD2 ARG 24 2HD ARG 24 -5.986 -0.845 -8.638
161 HD3 ARG 24 1HD ARG 24 -4.418 -0.943 -9.443
162 HE ARG 24 HE ARG 24 -4.810 -3.401 -8.312
163 HH11 ARG 24 1HH1 ARG 24 -6.539 -1.475 -10.721
164 HH12 ARG 24 2HH1 ARG 24 -7.259 -2.812 -11.477
165 HH21 ARG 24 1HH2 ARG 24 -5.818 -5.232 -9.329
166 HH22 ARG 24 2HH2 ARG 24 -6.846 -5.001 -10.662
167 H GLU 25 H GLU 25 -1.567 -3.875 -7.123
168 HA GLU 25 HA GLU 25 0.922 -4.068 -5.757
169 HB2 GLU 25 2HB GLU 25 1.373 -6.063 -7.195
170 HB3 GLU 25 1HB GLU 25 -0.098 -6.173 -6.254
171 HG2 GLU 25 2HG GLU 25 -0.068 -5.359 -9.147
172 HG3 GLU 25 1HG GLU 25 -0.161 -7.041 -8.636
173 H GLY 26 H GLY 26 2.864 -3.574 -6.322
174 HA2 GLY 26 2HA GLY 26 4.429 -3.170 -8.191
175 HA3 GLY 26 1HA GLY 26 3.161 -2.151 -8.863
176 H SER 27 H SER 27 4.753 -0.452 -8.738
177 HA SER 27 HA SER 27 4.982 0.491 -6.023
178 HB2 SER 27 2HB SER 27 6.733 2.022 -6.924
179 HB3 SER 27 1HB SER 27 7.118 0.309 -6.960
180 HG SER 27 HG SER 27 6.669 0.204 -9.121
181 H ASN 28 H ASN 28 4.358 2.641 -5.577
182 HA ASN 28 HA ASN 28 2.569 3.856 -7.559
183 HB2 ASN 28 2HB ASN 28 2.157 3.580 -4.559
184 HB3 ASN 28 1HB ASN 28 1.132 4.535 -5.618
185 HD21 ASN 28 1HD2 ASN 28 2.060 1.287 -4.693
186 HD22 ASN 28 2HD2 ASN 28 0.751 0.475 -5.458
187 H ILE 29 H ILE 29 3.468 5.675 -8.153
188 HA ILE 29 HA ILE 29 5.364 7.026 -6.424
189 HB ILE 29 HB ILE 29 4.467 7.817 -9.222
190 HG12 ILE 29 2HG1 ILE 29 5.479 5.589 -9.283
191 HG13 ILE 29 1HG1 ILE 29 6.548 6.766 -10.028
192 HG21 ILE 29 1HG2 ILE 29 6.889 8.668 -7.642
193 HG22 ILE 29 2HG2 ILE 29 5.476 9.661 -7.988
194 HG23 ILE 29 3HG2 ILE 29 6.523 9.132 -9.304
195 HD11 ILE 29 3HD1 ILE 29 6.828 5.631 -7.252
196 HD12 ILE 29 1HD1 ILE 29 7.919 6.797 -8.004
197 HD13 ILE 29 2HD1 ILE 29 7.772 5.163 -8.661
198 H ILE 30 H ILE 30 4.966 8.802 -5.298
199 HA ILE 30 HA ILE 30 2.337 10.041 -5.564
200 HB ILE 30 HB ILE 30 4.014 9.477 -3.095
201 HG12 ILE 30 2HG1 ILE 30 1.211 8.640 -3.872
202 HG13 ILE 30 1HG1 ILE 30 2.633 7.613 -3.882
203 HG21 ILE 30 1HG2 ILE 30 3.279 11.648 -2.745
204 HG22 ILE 30 2HG2 ILE 30 2.206 10.598 -1.804
205 HG23 ILE 30 3HG2 ILE 30 1.676 11.287 -3.346
206 HD11 ILE 30 3HD1 ILE 30 1.176 7.221 -1.964
207 HD12 ILE 30 1HD1 ILE 30 1.411 8.886 -1.443
208 HD13 ILE 30 2HD1 ILE 30 2.775 7.762 -1.468
209 H GLY 31 H GLY 31 2.253 12.225 -5.812
210 HA2 GLY 31 2HA GLY 31 3.561 14.242 -4.863
211 HA3 GLY 31 1HA GLY 31 4.769 13.670 -6.031
212 H ARG 32 H ARG 32 4.421 15.796 -6.923
213 HA ARG 32 HA ARG 32 2.031 15.792 -8.627
214 HB2 ARG 32 2HB ARG 32 3.623 18.139 -7.647
215 HB3 ARG 32 1HB ARG 32 2.443 18.230 -8.936
216 HG2 ARG 32 2HG ARG 32 0.854 17.226 -7.102
217 HG3 ARG 32 1HG ARG 32 2.069 17.888 -6.021
218 HD2 ARG 32 2HD ARG 32 1.985 20.049 -7.048
219 HD3 ARG 32 1HD ARG 32 0.827 19.489 -8.241
220 HE ARG 32 HE ARG 32 0.189 19.561 -5.383
221 HH11 ARG 32 1HH1 ARG 32 -0.658 20.338 -8.735
222 HH12 ARG 32 2HH1 ARG 32 -1.950 21.347 -8.343
223 HH21 ARG 32 1HH2 ARG 32 -1.687 20.912 -4.845
224 HH22 ARG 32 2HH2 ARG 32 -2.573 21.651 -6.080
225 H GLY 33 H GLY 33 2.632 14.987 -10.463
226 HA2 GLY 33 2HA GLY 33 4.255 16.355 -12.213
227 HA3 GLY 33 1HA GLY 33 5.194 15.023 -11.528
228 H GLN 34 H GLN 34 4.915 14.686 -14.010
229 HA GLN 34 HA GLN 34 2.439 13.336 -14.638
230 HB2 GLN 34 2HB GLN 34 3.432 12.952 -16.850
231 HB3 GLN 34 1HB GLN 34 3.567 14.637 -16.379
232 HG2 GLN 34 2HG GLN 34 5.928 14.197 -15.720
233 HG3 GLN 34 1HG GLN 34 5.751 12.564 -16.358
234 HE21 GLN 34 1HE2 GLN 34 7.315 12.896 -17.922
235 HE22 GLN 34 2HE2 GLN 34 7.031 13.872 -19.314
236 H ASP 35 H ASP 35 5.338 12.591 -13.189
237 HA ASP 35 HA ASP 35 5.487 9.781 -13.865
238 HB2 ASP 35 2HB ASP 35 6.835 11.244 -11.590
239 HB3 ASP 35 1HB ASP 35 7.275 9.676 -12.245
240 H ALA 36 H ALA 36 3.916 11.786 -11.600
241 HA ALA 36 HA ALA 36 3.733 9.775 -9.542
242 HB1 ALA 36 1HB ALA 36 4.177 12.085 -8.961
243 HB2 ALA 36 2HB ALA 36 2.679 11.503 -8.227
244 HB3 ALA 36 3HB ALA 36 2.620 12.562 -9.641
245 H GLN 37 H GLN 37 1.958 8.715 -8.933
246 HA GLN 37 HA GLN 37 -0.242 8.583 -10.834
247 HB2 GLN 37 2HB GLN 37 0.482 6.873 -8.450
248 HB3 GLN 37 1HB GLN 37 -0.816 6.541 -9.587
249 HG2 GLN 37 2HG GLN 37 0.767 6.211 -11.367
250 HG3 GLN 37 1HG GLN 37 2.097 6.693 -10.312
251 HE21 GLN 37 1HE2 GLN 37 3.152 4.763 -10.600
252 HE22 GLN 37 2HE2 GLN 37 2.623 3.298 -9.854
253 H PHE 38 H PHE 38 0.431 9.023 -7.408
254 HA PHE 38 HA PHE 38 -2.271 10.052 -7.035
255 HB2 PHE 38 2HB PHE 38 -1.719 8.317 -5.450
256 HB3 PHE 38 1HB PHE 38 -0.179 9.081 -5.095
257 HD1 PHE 38 1HD PHE 38 -3.866 9.762 -4.848
258 HD2 PHE 38 2HD PHE 38 0.008 10.359 -3.201
259 HE1 PHE 38 1HE PHE 38 -4.856 10.882 -2.891
260 HE2 PHE 38 2HE PHE 38 -0.930 11.455 -1.286
261 HZ PHE 38 HZ PHE 38 -3.399 11.742 -1.097
262 H ARG 39 H ARG 39 -2.391 12.066 -7.411
263 HA ARG 39 HA ARG 39 -0.104 13.839 -7.035
264 HB2 ARG 39 2HB ARG 39 -2.781 14.305 -8.362
265 HB3 ARG 39 1HB ARG 39 -1.406 15.402 -8.395
266 HG2 ARG 39 2HG ARG 39 -0.124 13.846 -9.704
267 HG3 ARG 39 1HG ARG 39 -1.379 12.621 -9.544
268 HD2 ARG 39 2HD ARG 39 -1.642 15.268 -10.969
269 HD3 ARG 39 1HD ARG 39 -1.472 13.697 -11.744
270 HE ARG 39 HE ARG 39 -3.766 14.582 -10.141
271 HH11 ARG 39 1HH1 ARG 39 -2.453 12.431 -12.667
272 HH12 ARG 39 2HH1 ARG 39 -3.961 11.938 -13.250
273 HH21 ARG 39 1HH2 ARG 39 -5.901 13.848 -10.946
274 HH22 ARG 39 2HH2 ARG 39 -5.958 12.761 -12.241
275 H LEU 40 H LEU 40 -0.078 15.202 -5.355
276 HA LEU 40 HA LEU 40 -2.248 15.053 -3.503
277 HB2 LEU 40 2HB LEU 40 0.434 16.358 -3.356
278 HB3 LEU 40 1HB LEU 40 -0.798 16.756 -2.172
279 HG LEU 40 HG LEU 40 -0.903 14.283 -1.663
280 HD11 LEU 40 1HD1 LEU 40 1.051 12.962 -2.217
281 HD12 LEU 40 2HD1 LEU 40 1.640 14.261 -3.256
282 HD13 LEU 40 3HD1 LEU 40 0.137 13.430 -3.646
283 HD21 LEU 40 3HD2 LEU 40 1.011 14.370 -0.198
284 HD22 LEU 40 1HD2 LEU 40 0.183 15.920 -0.222
285 HD23 LEU 40 2HD2 LEU 40 1.692 15.706 -1.116
286 HA PRO 41 HA PRO 41 -4.355 18.775 -4.579
287 HB2 PRO 41 2HB PRO 41 -5.013 19.196 -1.758
288 HB3 PRO 41 1HB PRO 41 -6.085 18.805 -3.103
289 HG2 PRO 41 2HG PRO 41 -5.528 17.045 -1.137
290 HG3 PRO 41 1HG PRO 41 -5.845 16.545 -2.806
291 HD2 PRO 41 2HD PRO 41 -3.240 16.791 -1.364
292 HD3 PRO 41 1HD PRO 41 -3.796 15.560 -2.517
293 H ASP 42 H ASP 42 -1.732 18.739 -2.413
294 HA ASP 42 HA ASP 42 -1.770 21.652 -2.144
295 HB2 ASP 42 2HB ASP 42 -0.570 19.542 -0.397
296 HB3 ASP 42 1HB ASP 42 -0.029 21.215 -0.313
297 H THR 43 H THR 43 0.364 22.684 -1.983
298 HA THR 43 HA THR 43 2.026 21.745 -4.190
299 HB THR 43 HB THR 43 1.906 24.499 -2.902
300 HG1 THR 43 1HG THR 43 -0.081 23.595 -3.950
301 HG21 THR 43 3HG2 THR 43 3.919 24.033 -4.267
302 HG22 THR 43 1HG2 THR 43 2.893 25.260 -5.013
303 HG23 THR 43 2HG2 THR 43 2.876 23.606 -5.625
304 H GLY 44 H GLY 44 4.457 22.171 -3.805
305 HA2 GLY 44 2HA GLY 44 6.249 22.473 -2.225
306 HA3 GLY 44 1HA GLY 44 5.148 21.952 -0.952
307 H VAL 45 H VAL 45 4.464 20.195 -3.505
308 HA VAL 45 HA VAL 45 5.922 17.882 -2.486
309 HB VAL 45 HB VAL 45 3.438 17.979 -4.230
310 HG11 VAL 45 1HG1 VAL 45 4.671 15.915 -4.377
311 HG12 VAL 45 2HG1 VAL 45 3.133 15.698 -3.529
312 HG13 VAL 45 3HG1 VAL 45 4.643 15.756 -2.620
313 HG21 VAL 45 3HG2 VAL 45 3.613 17.595 -1.254
314 HG22 VAL 45 1HG2 VAL 45 2.153 17.495 -2.245
315 HG23 VAL 45 2HG2 VAL 45 3.003 19.037 -2.074
316 H SER 46 H SER 46 7.348 16.904 -3.798
317 HA SER 46 HA SER 46 8.155 18.135 -6.243
318 HB2 SER 46 2HB SER 46 9.029 15.526 -5.031
319 HB3 SER 46 1HB SER 46 9.924 16.525 -6.179
320 HG SER 46 HG SER 46 10.234 18.045 -4.636
321 H ARG 47 H ARG 47 8.641 16.645 -8.215
322 HA ARG 47 HA ARG 47 6.223 15.506 -9.164
323 HB2 ARG 47 2HB ARG 47 7.620 14.647 -11.113
324 HB3 ARG 47 1HB ARG 47 7.596 16.380 -10.872
325 HG2 ARG 47 2HG ARG 47 9.795 16.292 -9.833
326 HG3 ARG 47 1HG ARG 47 9.800 14.535 -9.975
327 HD2 ARG 47 2HD ARG 47 9.553 16.364 -12.342
328 HD3 ARG 47 1HD ARG 47 11.114 15.834 -11.725
329 HE ARG 47 HE ARG 47 9.035 13.970 -12.757
330 HH11 ARG 47 1HH1 ARG 47 12.454 14.901 -12.421
331 HH12 ARG 47 2HH1 ARG 47 13.022 13.615 -13.363
332 HH21 ARG 47 1HH2 ARG 47 9.806 12.268 -14.016
333 HH22 ARG 47 2HH2 ARG 47 11.490 12.057 -14.311
334 H ARG 48 H ARG 48 9.170 14.051 -8.004
335 HA ARG 48 HA ARG 48 7.595 11.677 -7.391
336 HB2 ARG 48 2HB ARG 48 10.569 11.809 -8.005
337 HB3 ARG 48 1HB ARG 48 9.699 10.374 -7.501
338 HG2 ARG 48 2HG ARG 48 8.408 10.393 -9.529
339 HG3 ARG 48 1HG ARG 48 9.194 11.877 -10.059
340 HD2 ARG 48 2HD ARG 48 11.374 10.648 -9.971
341 HD3 ARG 48 1HD ARG 48 10.465 9.183 -9.595
342 HE ARG 48 HE ARG 48 9.668 10.594 -11.973
343 HH11 ARG 48 1HH1 ARG 48 11.636 7.962 -10.650
344 HH12 ARG 48 2HH1 ARG 48 11.736 7.110 -12.118
345 HH21 ARG 48 1HH2 ARG 48 9.795 9.469 -13.957
346 HH22 ARG 48 2HH2 ARG 48 10.685 8.008 -14.070
347 H HIS 49 H HIS 49 7.072 12.306 -5.463
348 HA HIS 49 HA HIS 49 9.052 13.597 -3.764
349 HB2 HIS 49 2HB HIS 49 6.934 14.769 -4.021
350 HB3 HIS 49 1HB HIS 49 6.032 13.348 -3.535
351 HD2 HIS 49 2HD HIS 49 6.364 12.682 -0.768
352 HE1 HIS 49 1HE HIS 49 7.472 16.613 0.264
353 HE2 HIS 49 2HE HIS 49 7.169 14.204 1.057
354 H LEU 50 H LEU 50 7.130 10.733 -4.124
355 HA LEU 50 HA LEU 50 8.715 9.373 -2.233
356 HB2 LEU 50 2HB LEU 50 7.378 10.532 -0.661
357 HB3 LEU 50 1HB LEU 50 5.895 10.227 -1.498
358 HG LEU 50 HG LEU 50 7.458 7.972 -0.247
359 HD11 LEU 50 1HD1 LEU 50 5.410 9.782 1.061
360 HD12 LEU 50 2HD1 LEU 50 7.135 9.774 1.429
361 HD13 LEU 50 3HD1 LEU 50 6.155 8.358 1.792
362 HD21 LEU 50 3HD2 LEU 50 4.539 8.477 -0.758
363 HD22 LEU 50 1HD2 LEU 50 5.213 7.004 -0.068
364 HD23 LEU 50 2HD2 LEU 50 5.583 7.445 -1.736
365 H GLU 51 H GLU 51 8.440 7.158 -2.387
366 HA GLU 51 HA GLU 51 6.545 6.252 -4.416
367 HB2 GLU 51 2HB GLU 51 8.351 4.628 -5.176
368 HB3 GLU 51 1HB GLU 51 8.520 6.295 -5.684
369 HG2 GLU 51 2HG GLU 51 10.208 6.666 -3.978
370 HG3 GLU 51 1HG GLU 51 9.929 5.052 -3.336
371 H ILE 52 H ILE 52 5.323 4.698 -3.735
372 HA ILE 52 HA ILE 52 6.208 3.104 -1.441
373 HB ILE 52 HB ILE 52 3.424 3.456 -2.567
374 HG12 ILE 52 2HG1 ILE 52 4.651 4.453 0.018
375 HG13 ILE 52 1HG1 ILE 52 4.264 5.447 -1.381
376 HG21 ILE 52 1HG2 ILE 52 4.426 1.900 -0.189
377 HG22 ILE 52 2HG2 ILE 52 3.750 1.258 -1.685
378 HG23 ILE 52 3HG2 ILE 52 2.719 2.181 -0.569
379 HD11 ILE 52 3HD1 ILE 52 2.597 5.687 0.369
380 HD12 ILE 52 1HD1 ILE 52 2.290 3.951 0.326
381 HD13 ILE 52 2HD1 ILE 52 1.894 4.954 -1.072
382 H ARG 53 H ARG 53 6.916 1.170 -1.885
383 HA ARG 53 HA ARG 53 6.048 -0.093 -4.377
384 HB2 ARG 53 2HB ARG 53 8.481 0.175 -4.035
385 HB3 ARG 53 1HB ARG 53 8.371 -0.786 -2.570
386 HG2 ARG 53 2HG ARG 53 7.799 -2.738 -3.818
387 HG3 ARG 53 1HG ARG 53 7.649 -1.797 -5.306
388 HD2 ARG 53 2HD ARG 53 10.168 -2.163 -3.697
389 HD3 ARG 53 1HD ARG 53 9.752 -2.975 -5.222
390 HE ARG 53 HE ARG 53 9.569 -0.587 -6.075
391 HH11 ARG 53 1HH1 ARG 53 12.117 -1.740 -3.875
392 HH12 ARG 53 2HH1 ARG 53 13.220 -0.515 -4.299
393 HH21 ARG 53 1HH2 ARG 53 11.091 1.067 -6.646
394 HH22 ARG 53 2HH2 ARG 53 12.624 1.118 -5.939
395 H TRP 54 H TRP 54 4.451 -1.491 -4.202
396 HA TRP 54 HA TRP 54 4.036 -2.722 -1.610
397 HB2 TRP 54 2HB TRP 54 2.264 -1.177 -1.984
398 HB3 TRP 54 1HB TRP 54 2.042 -1.714 -3.642
399 HD1 TRP 54 HD TRP 54 -0.038 -3.130 -3.943
400 HE1 TRP 54 1HE TRP 54 -1.451 -4.729 -2.491
401 HE3 TRP 54 3HE TRP 54 2.666 -2.933 0.340
402 HZ2 TRP 54 2HZ TRP 54 -1.423 -5.753 0.127
403 HZ3 TRP 54 3HZ TRP 54 1.947 -4.221 2.263
404 HH2 TRP 54 HH TRP 54 -0.077 -5.621 2.180
405 H ASP 55 H ASP 55 3.832 -4.808 -1.475
406 HA ASP 55 HA ASP 55 3.081 -6.544 -3.653
407 HB2 ASP 55 2HB ASP 55 5.633 -6.502 -3.678
408 HB3 ASP 55 1HB ASP 55 5.611 -7.007 -1.996
409 H GLY 56 H GLY 56 2.574 -8.714 -2.531
410 HA2 GLY 56 2HA GLY 56 1.081 -8.183 -0.163
411 HA3 GLY 56 1HA GLY 56 1.291 -9.753 -0.923
412 H GLN 57 H GLN 57 3.348 -7.443 0.714
413 HA GLN 57 HA GLN 57 4.227 -9.476 2.646
414 HB2 GLN 57 2HB GLN 57 6.026 -7.491 1.212
415 HB3 GLN 57 1HB GLN 57 6.521 -8.531 2.529
416 HG2 GLN 57 2HG GLN 57 6.192 -10.471 1.107
417 HG3 GLN 57 1HG GLN 57 5.633 -9.423 -0.199
418 HE21 GLN 57 1HE2 GLN 57 8.355 -10.342 1.734
419 HE22 GLN 57 2HE2 GLN 57 9.566 -9.686 0.690
420 H VAL 58 H VAL 58 5.190 -6.176 1.932
421 HA VAL 58 HA VAL 58 3.697 -5.007 4.063
422 HB VAL 58 HB VAL 58 5.721 -3.850 4.989
423 HG11 VAL 58 1HG1 VAL 58 6.669 -5.672 6.318
424 HG12 VAL 58 2HG1 VAL 58 5.915 -6.843 5.234
425 HG13 VAL 58 3HG1 VAL 58 4.911 -5.780 6.213
426 HG21 VAL 58 3HG2 VAL 58 7.210 -4.054 3.078
427 HG22 VAL 58 1HG2 VAL 58 7.305 -5.799 3.313
428 HG23 VAL 58 2HG2 VAL 58 7.977 -4.710 4.524
429 H ALA 59 H ALA 59 3.848 -2.646 3.753
430 HA ALA 59 HA ALA 59 4.337 -2.062 0.936
431 HB1 ALA 59 1HB ALA 59 2.130 -1.448 1.856
432 HB2 ALA 59 2HB ALA 59 3.031 -0.045 1.281
433 HB3 ALA 59 3HB ALA 59 2.940 -0.388 3.009
434 H LEU 60 H LEU 60 6.160 -1.323 0.415
435 HA LEU 60 HA LEU 60 7.949 -0.290 2.397
436 HB2 LEU 60 2HB LEU 60 8.605 -1.958 0.725
437 HB3 LEU 60 1HB LEU 60 8.275 -0.800 -0.540
438 HG LEU 60 HG LEU 60 10.113 0.610 0.279
439 HD11 LEU 60 1HD1 LEU 60 10.562 -1.666 2.213
440 HD12 LEU 60 2HD1 LEU 60 10.069 -0.025 2.639
441 HD13 LEU 60 3HD1 LEU 60 11.665 -0.316 1.949
442 HD21 LEU 60 3HD2 LEU 60 11.901 -0.899 -0.414
443 HD22 LEU 60 1HD2 LEU 60 10.480 -1.024 -1.458
444 HD23 LEU 60 2HD2 LEU 60 10.787 -2.264 -0.247
445 H LEU 61 H LEU 61 7.737 1.725 2.915
446 HA LEU 61 HA LEU 61 6.790 3.748 1.059
447 HB2 LEU 61 2HB LEU 61 5.697 3.392 3.204
448 HB3 LEU 61 1HB LEU 61 7.166 3.608 4.082
449 HG LEU 61 HG LEU 61 5.653 5.481 4.370
450 HD11 LEU 61 1HD1 LEU 61 7.972 6.371 2.691
451 HD12 LEU 61 2HD1 LEU 61 7.973 6.108 4.434
452 HD13 LEU 61 3HD1 LEU 61 7.000 7.404 3.739
453 HD21 LEU 61 3HD2 LEU 61 5.781 5.838 1.410
454 HD22 LEU 61 1HD2 LEU 61 4.936 6.900 2.537
455 HD23 LEU 61 2HD2 LEU 61 4.395 5.233 2.320
456 H ALA 62 H ALA 62 8.458 4.664 -0.082
457 HA ALA 62 HA ALA 62 10.880 5.307 1.437
458 HB1 ALA 62 1HB ALA 62 12.151 5.134 -0.638
459 HB2 ALA 62 2HB ALA 62 10.677 4.724 -1.515
460 HB3 ALA 62 3HB ALA 62 11.310 3.619 -0.298
461 H ASP 63 H ASP 63 11.200 7.363 1.715
462 HA ASP 63 HA ASP 63 9.573 9.327 0.363
463 HB2 ASP 63 2HB ASP 63 9.952 9.487 2.781
464 HB3 ASP 63 1HB ASP 63 11.684 9.544 2.522
465 H LEU 64 H LEU 64 10.306 10.795 -1.117
466 HA LEU 64 HA LEU 64 13.101 10.519 -2.021
467 HB2 LEU 64 2HB LEU 64 11.151 9.419 -3.393
468 HB3 LEU 64 1HB LEU 64 10.711 11.054 -3.789
469 HG LEU 64 HG LEU 64 11.823 10.142 -5.626
470 HD11 LEU 64 1HD1 LEU 64 13.805 11.936 -4.257
471 HD12 LEU 64 2HD1 LEU 64 12.463 12.425 -5.292
472 HD13 LEU 64 3HD1 LEU 64 13.816 11.518 -5.971
473 HD21 LEU 64 3HD2 LEU 64 14.069 9.158 -5.556
474 HD22 LEU 64 1HD2 LEU 64 12.901 8.260 -4.589
475 HD23 LEU 64 2HD2 LEU 64 14.070 9.321 -3.800
476 H ASN 65 H ASN 65 13.216 12.388 -0.469
477 HA ASN 65 HA ASN 65 13.265 14.895 -1.688
478 HB2 ASN 65 2HB ASN 65 10.702 14.489 -1.470
479 HB3 ASN 65 1HB ASN 65 10.952 14.692 0.257
480 HD21 ASN 65 1HD2 ASN 65 9.453 16.197 -1.721
481 HD22 ASN 65 2HD2 ASN 65 9.992 17.818 -1.669
482 H SER 66 H SER 66 14.400 16.246 -0.329
483 HA SER 66 HA SER 66 14.890 15.196 2.351
484 HB2 SER 66 2HB SER 66 16.988 16.637 2.195
485 HB3 SER 66 1HB SER 66 16.918 15.226 1.136
486 HG SER 66 HG SER 66 17.604 16.972 -0.021
487 H THR 67 H THR 67 14.556 18.259 0.602
488 HA THR 67 HA THR 67 14.445 19.939 2.849
489 HB THR 67 HB THR 67 13.338 20.448 0.088
490 HG1 THR 67 1HG THR 67 15.982 20.462 1.135
491 HG21 THR 67 3HG2 THR 67 14.012 22.769 0.547
492 HG22 THR 67 1HG2 THR 67 14.590 22.293 2.144
493 HG23 THR 67 2HG2 THR 67 12.870 22.204 1.768
494 H ASN 68 H ASN 68 11.937 18.319 0.996
495 HA ASN 68 HA ASN 68 9.873 19.436 2.799
496 HB2 ASN 68 2HB ASN 68 9.576 18.392 -0.042
497 HB3 ASN 68 1HB ASN 68 8.282 19.047 0.945
498 HD21 ASN 68 1HD2 ASN 68 11.145 19.821 -0.945
499 HD22 ASN 68 2HD2 ASN 68 10.833 21.495 -1.065
500 H GLY 69 H GLY 69 11.678 17.223 3.165
501 HA2 GLY 69 2HA GLY 69 10.915 14.692 2.438
502 HA3 GLY 69 1HA GLY 69 11.769 15.091 3.909
503 H THR 70 H THR 70 9.944 13.013 3.417
504 HA THR 70 HA THR 70 7.443 13.688 4.672
505 HB THR 70 HB THR 70 8.530 11.091 3.589
506 HG1 THR 70 1HG THR 70 8.325 12.220 1.842
507 HG21 THR 70 3HG2 THR 70 6.149 10.412 3.471
508 HG22 THR 70 1HG2 THR 70 5.694 11.917 4.268
509 HG23 THR 70 2HG2 THR 70 6.656 10.721 5.133
510 H THR 71 H THR 71 6.685 12.814 6.576
511 HA THR 71 HA THR 71 8.626 11.612 8.402
512 HB THR 71 HB THR 71 6.975 12.655 10.138
513 HG1 THR 71 1HG THR 71 6.553 14.274 7.833
514 HG21 THR 71 3HG2 THR 71 8.291 14.690 10.205
515 HG22 THR 71 1HG2 THR 71 8.961 14.311 8.610
516 HG23 THR 71 2HG2 THR 71 9.273 13.236 9.994
517 H VAL 72 H VAL 72 7.891 9.940 9.708
518 HA VAL 72 HA VAL 72 5.177 8.968 9.212
519 HB VAL 72 HB VAL 72 6.032 6.603 9.503
520 HG11 VAL 72 1HG1 VAL 72 7.488 8.121 7.353
521 HG12 VAL 72 2HG1 VAL 72 5.847 7.501 7.239
522 HG13 VAL 72 3HG1 VAL 72 7.205 6.382 7.381
523 HG21 VAL 72 3HG2 VAL 72 8.450 6.177 9.481
524 HG22 VAL 72 1HG2 VAL 72 7.981 7.122 10.898
525 HG23 VAL 72 2HG2 VAL 72 8.755 7.916 9.531
526 H ASN 73 H ASN 73 4.038 8.758 10.967
527 HA ASN 73 HA ASN 73 3.349 8.967 13.125
528 HB2 ASN 73 2HB ASN 73 5.373 6.989 13.108
529 HB3 ASN 73 1HB ASN 73 5.647 8.013 14.519
530 HD21 ASN 73 1HD2 ASN 73 3.580 5.736 13.031
531 HD22 ASN 73 2HD2 ASN 73 2.529 5.475 14.378
532 H ASN 74 H ASN 74 5.010 11.185 11.958
533 HA ASN 74 HA ASN 74 5.694 13.216 12.508
534 HB2 ASN 74 2HB ASN 74 3.981 13.206 14.334
535 HB3 ASN 74 1HB ASN 74 5.143 12.471 15.420
536 HD21 ASN 74 1HD2 ASN 74 4.930 14.163 16.890
537 HD22 ASN 74 2HD2 ASN 74 5.589 15.734 16.624
538 H ALA 75 H ALA 75 7.379 10.773 12.464
539 HA ALA 75 HA ALA 75 9.775 11.976 13.624
540 HB1 ALA 75 1HB ALA 75 9.236 9.873 14.745
541 HB2 ALA 75 2HB ALA 75 10.700 9.683 13.781
542 HB3 ALA 75 3HB ALA 75 9.164 9.045 13.191
543 HA PRO 76 HA PRO 76 10.869 12.007 9.260
544 HB2 PRO 76 2HB PRO 76 13.581 12.777 9.903
545 HB3 PRO 76 1HB PRO 76 12.264 13.773 9.269
546 HG2 PRO 76 2HG PRO 76 13.321 14.065 11.790
547 HG3 PRO 76 1HG PRO 76 11.684 14.550 11.328
548 HD2 PRO 76 2HD PRO 76 12.595 12.084 12.755
549 HD3 PRO 76 1HD PRO 76 11.171 13.116 13.041
550 H VAL 77 H VAL 77 11.658 10.543 7.867
551 HA VAL 77 HA VAL 77 13.856 8.785 8.557
552 HB VAL 77 HB VAL 77 12.612 6.756 7.836
553 HG11 VAL 77 1HG1 VAL 77 11.241 6.366 9.825
554 HG12 VAL 77 2HG1 VAL 77 11.310 8.086 10.202
555 HG13 VAL 77 3HG1 VAL 77 12.784 7.120 10.221
556 HG21 VAL 77 3HG2 VAL 77 10.904 7.764 6.459
557 HG22 VAL 77 1HG2 VAL 77 10.178 8.536 7.869
558 HG23 VAL 77 2HG2 VAL 77 10.140 6.785 7.714
559 H GLN 78 H GLN 78 14.384 7.486 6.539
560 HA GLN 78 HA GLN 78 13.626 9.027 4.190
561 HB2 GLN 78 2HB GLN 78 15.963 7.131 4.538
562 HB3 GLN 78 1HB GLN 78 15.540 7.910 3.020
563 HG2 GLN 78 2HG GLN 78 15.850 10.122 4.200
564 HG3 GLN 78 1HG GLN 78 16.510 9.212 5.550
565 HE21 GLN 78 1HE2 GLN 78 18.466 10.215 5.338
566 HE22 GLN 78 2HE2 GLN 78 19.596 9.878 4.080
567 H GLU 79 H GLU 79 13.482 5.863 5.615
568 HA GLU 79 HA GLU 79 11.442 5.217 3.728
569 HB2 GLU 79 2HB GLU 79 12.449 3.045 3.109
570 HB3 GLU 79 1HB GLU 79 13.364 4.420 2.517
571 HG2 GLU 79 2HG GLU 79 14.823 4.108 4.576
572 HG3 GLU 79 1HG GLU 79 14.039 2.538 4.737
573 H TRP 80 H TRP 80 10.077 3.613 4.430
574 HA TRP 80 HA TRP 80 10.368 2.567 7.113
575 HB2 TRP 80 2HB TRP 80 9.601 4.785 7.554
576 HB3 TRP 80 1HB TRP 80 8.361 4.740 6.327
577 HD1 TRP 80 HD TRP 80 6.052 3.634 7.012
578 HE1 TRP 80 1HE TRP 80 5.045 3.097 9.323
579 HE3 TRP 80 3HE TRP 80 10.285 3.890 9.866
580 HZ2 TRP 80 2HZ TRP 80 5.888 2.819 11.948
581 HZ3 TRP 80 3HZ TRP 80 10.079 3.488 12.283
582 HH2 TRP 80 HH TRP 80 7.913 2.972 13.292
583 H GLN 81 H GLN 81 8.802 0.922 7.450
584 HA GLN 81 HA GLN 81 7.365 0.198 5.021
585 HB2 GLN 81 2HB GLN 81 7.240 -2.123 5.871
586 HB3 GLN 81 1HB GLN 81 8.899 -1.596 5.697
587 HG2 GLN 81 2HG GLN 81 7.396 -1.625 8.275
588 HG3 GLN 81 1HG GLN 81 8.406 -2.964 7.721
589 HE21 GLN 81 1HE2 GLN 81 10.653 -2.629 7.650
590 HE22 GLN 81 2HE2 GLN 81 11.427 -1.391 8.553
591 H LEU 82 H LEU 82 5.305 0.336 4.999
592 HA LEU 82 HA LEU 82 3.987 1.862 6.907
593 HB2 LEU 82 2HB LEU 82 2.714 0.060 4.877
594 HB3 LEU 82 1HB LEU 82 1.897 1.306 5.776
595 HG LEU 82 HG LEU 82 4.017 1.687 3.672
596 HD11 LEU 82 1HD1 LEU 82 1.757 1.325 2.814
597 HD12 LEU 82 2HD1 LEU 82 2.292 2.981 2.537
598 HD13 LEU 82 3HD1 LEU 82 1.161 2.630 3.840
599 HD21 LEU 82 3HD2 LEU 82 4.493 3.237 5.423
600 HD22 LEU 82 1HD2 LEU 82 2.788 3.677 5.537
601 HD23 LEU 82 2HD2 LEU 82 3.708 4.091 4.096
602 H ALA 83 H ALA 83 2.314 1.529 8.294
603 HA ALA 83 HA ALA 83 1.760 -1.148 9.213
604 HB1 ALA 83 1HB ALA 83 2.680 1.146 10.960
605 HB2 ALA 83 2HB ALA 83 3.590 -0.332 10.642
606 HB3 ALA 83 3HB ALA 83 2.080 -0.405 11.547
607 H ASP 84 H ASP 84 -0.269 -1.191 10.252
608 HA ASP 84 HA ASP 84 -2.157 0.659 9.197
609 HB2 ASP 84 2HB ASP 84 -2.765 -1.683 9.551
610 HB3 ASP 84 1HB ASP 84 -2.518 -1.493 11.284
611 H GLY 85 H GLY 85 -2.510 2.595 9.930
612 HA2 GLY 85 2HA GLY 85 -3.422 3.998 11.594
613 HA3 GLY 85 1HA GLY 85 -2.696 2.967 12.817
614 H ASP 86 H ASP 86 -0.496 3.568 10.309
615 HA ASP 86 HA ASP 86 0.958 5.333 12.074
616 HB2 ASP 86 2HB ASP 86 2.095 3.560 10.543
617 HB3 ASP 86 1HB ASP 86 1.832 4.713 9.237
618 H VAL 87 H VAL 87 1.513 7.426 11.652
619 HA VAL 87 HA VAL 87 -0.388 8.845 9.926
620 HB VAL 87 HB VAL 87 1.312 9.874 12.215
621 HG11 VAL 87 1HG1 VAL 87 -0.932 11.219 10.699
622 HG12 VAL 87 2HG1 VAL 87 0.787 11.579 10.538
623 HG13 VAL 87 3HG1 VAL 87 -0.039 11.893 12.066
624 HG21 VAL 87 3HG2 VAL 87 -0.790 10.016 13.490
625 HG22 VAL 87 1HG2 VAL 87 -0.405 8.355 13.038
626 HG23 VAL 87 2HG2 VAL 87 -1.644 9.243 12.153
627 H ILE 88 H ILE 88 0.532 9.369 8.018
628 HA ILE 88 HA ILE 88 3.410 9.864 8.079
629 HB ILE 88 HB ILE 88 1.665 8.879 5.822
630 HG12 ILE 88 2HG1 ILE 88 3.835 7.567 7.455
631 HG13 ILE 88 1HG1 ILE 88 2.123 7.188 7.468
632 HG21 ILE 88 1HG2 ILE 88 3.404 10.356 4.937
633 HG22 ILE 88 2HG2 ILE 88 3.740 8.679 4.510
634 HG23 ILE 88 3HG2 ILE 88 4.634 9.451 5.820
635 HD11 ILE 88 3HD1 ILE 88 3.414 5.562 6.227
636 HD12 ILE 88 1HD1 ILE 88 3.963 6.831 5.135
637 HD13 ILE 88 2HD1 ILE 88 2.251 6.402 5.195
638 H ARG 89 H ARG 89 4.075 11.823 7.570
639 HA ARG 89 HA ARG 89 2.137 13.581 6.264
640 HB2 ARG 89 2HB ARG 89 2.414 14.177 8.619
641 HB3 ARG 89 1HB ARG 89 4.151 14.304 8.385
642 HG2 ARG 89 2HG ARG 89 3.745 16.128 6.755
643 HG3 ARG 89 1HG ARG 89 2.028 16.049 7.158
644 HD2 ARG 89 2HD ARG 89 3.155 17.812 8.397
645 HD3 ARG 89 1HD ARG 89 2.555 16.557 9.486
646 HE ARG 89 HE ARG 89 5.100 15.792 8.962
647 HH11 ARG 89 1HH1 ARG 89 3.682 18.810 10.171
648 HH12 ARG 89 2HH1 ARG 89 5.016 19.217 11.122
649 HH21 ARG 89 1HH2 ARG 89 6.949 16.359 10.263
650 HH22 ARG 89 2HH2 ARG 89 6.932 17.796 11.166
651 H LEU 90 H LEU 90 2.789 14.196 4.419
652 HA LEU 90 HA LEU 90 5.655 14.399 3.885
653 HB2 LEU 90 2HB LEU 90 5.206 13.944 1.498
654 HB3 LEU 90 1HB LEU 90 4.773 12.589 2.498
655 HG LEU 90 HG LEU 90 2.761 14.518 1.308
656 HD11 LEU 90 1HD1 LEU 90 4.011 13.390 -0.445
657 HD12 LEU 90 2HD1 LEU 90 2.378 12.727 -0.346
658 HD13 LEU 90 3HD1 LEU 90 3.735 11.835 0.335
659 HD21 LEU 90 3HD2 LEU 90 1.175 12.656 1.713
660 HD22 LEU 90 1HD2 LEU 90 1.861 13.243 3.226
661 HD23 LEU 90 2HD2 LEU 90 2.455 11.751 2.512
662 H GLY 91 H GLY 91 6.344 16.286 2.849
663 HA2 GLY 91 2HA GLY 91 6.203 18.575 3.679
664 HA3 GLY 91 1HA GLY 91 5.731 18.545 1.998
665 H HIS 92 H HIS 92 4.680 18.750 5.269
666 HA HIS 92 HA HIS 92 2.897 19.451 6.386
667 HB2 HIS 92 2HB HIS 92 2.865 21.406 4.111
668 HB3 HIS 92 1HB HIS 92 1.781 21.549 5.495
669 HD1 HIS 92 1HD HIS 92 2.772 22.444 7.664
670 HD2 HIS 92 2HD HIS 92 5.619 21.697 4.741
671 HE1 HIS 92 1HE HIS 92 4.935 23.366 8.545
672 H SER 93 H SER 93 2.255 17.363 4.217
673 HA SER 93 HA SER 93 -0.648 17.690 4.462
674 HB2 SER 93 2HB SER 93 0.922 16.282 2.292
675 HB3 SER 93 1HB SER 93 -0.833 16.489 2.345
676 HG SER 93 HG SER 93 1.114 18.530 2.224
677 H GLU 94 H GLU 94 -1.626 16.011 5.593
678 HA GLU 94 HA GLU 94 0.129 13.746 6.103
679 HB2 GLU 94 2HB GLU 94 -1.090 13.424 8.266
680 HB3 GLU 94 1HB GLU 94 -0.082 14.853 8.146
681 HG2 GLU 94 2HG GLU 94 -2.100 16.210 7.730
682 HG3 GLU 94 1HG GLU 94 -3.087 14.759 7.935
683 H ILE 95 H ILE 95 -0.514 11.728 6.058
684 HA ILE 95 HA ILE 95 -3.144 11.165 4.905
685 HB ILE 95 HB ILE 95 -1.267 11.191 3.202
686 HG12 ILE 95 2HG1 ILE 95 -1.653 8.828 2.313
687 HG13 ILE 95 1HG1 ILE 95 -2.684 8.595 3.721
688 HG21 ILE 95 1HG2 ILE 95 0.387 9.403 3.155
689 HG22 ILE 95 2HG2 ILE 95 -0.158 8.884 4.748
690 HG23 ILE 95 3HG2 ILE 95 0.581 10.475 4.546
691 HD11 ILE 95 3HD1 ILE 95 -3.989 9.215 1.781
692 HD12 ILE 95 1HD1 ILE 95 -3.041 10.690 1.598
693 HD13 ILE 95 2HD1 ILE 95 -4.067 10.466 3.016
694 H ILE 96 H ILE 96 -4.067 9.212 5.755
695 HA ILE 96 HA ILE 96 -2.542 8.021 7.970
696 HB ILE 96 HB ILE 96 -5.541 8.047 7.478
697 HG12 ILE 96 2HG1 ILE 96 -4.691 10.217 8.170
698 HG13 ILE 96 1HG1 ILE 96 -5.686 9.502 9.442
699 HG21 ILE 96 1HG2 ILE 96 -4.022 6.911 9.825
700 HG22 ILE 96 2HG2 ILE 96 -4.883 5.986 8.597
701 HG23 ILE 96 3HG2 ILE 96 -5.779 7.033 9.701
702 HD11 ILE 96 3HD1 ILE 96 -2.669 9.647 9.375
703 HD12 ILE 96 1HD1 ILE 96 -3.626 8.868 10.636
704 HD13 ILE 96 2HD1 ILE 96 -3.749 10.609 10.383
705 H VAL 97 H VAL 97 -2.078 5.918 7.896
706 HA VAL 97 HA VAL 97 -2.806 4.528 5.435
707 HB VAL 97 HB VAL 97 -0.552 4.039 7.393
708 HG11 VAL 97 1HG1 VAL 97 -1.371 1.923 6.498
709 HG12 VAL 97 2HG1 VAL 97 0.221 2.324 5.848
710 HG13 VAL 97 3HG1 VAL 97 -1.224 2.554 4.854
711 HG21 VAL 97 3HG2 VAL 97 -0.246 5.961 5.929
712 HG22 VAL 97 1HG2 VAL 97 -0.593 4.943 4.531
713 HG23 VAL 97 2HG2 VAL 97 0.858 4.650 5.492
714 H ARG 98 H ARG 98 -4.207 2.931 5.460
715 HA ARG 98 HA ARG 98 -4.600 1.434 7.943
716 HB2 ARG 98 2HB ARG 98 -6.593 2.286 5.858
717 HB3 ARG 98 1HB ARG 98 -6.907 0.912 6.904
718 HG2 ARG 98 2HG ARG 98 -6.371 3.724 7.846
719 HG3 ARG 98 1HG ARG 98 -7.966 2.977 7.700
720 HD2 ARG 98 2HD ARG 98 -7.238 1.213 9.285
721 HD3 ARG 98 1HD ARG 98 -5.707 2.054 9.484
722 HE ARG 98 HE ARG 98 -7.905 3.744 10.007
723 HH11 ARG 98 1HH1 ARG 98 -5.999 1.085 11.475
724 HH12 ARG 98 2HH1 ARG 98 -6.315 1.583 13.058
725 HH21 ARG 98 1HH2 ARG 98 -8.307 4.385 12.242
726 HH22 ARG 98 2HH2 ARG 98 -7.652 3.472 13.509
727 H MET 99 H MET 99 -4.537 -0.713 7.823
728 HA MET 99 HA MET 99 -4.166 -1.880 5.161
729 HB2 MET 99 2HB MET 99 -2.661 -2.643 7.665
730 HB3 MET 99 1HB MET 99 -2.628 -3.557 6.170
731 HG2 MET 99 2HG MET 99 -1.678 -1.581 5.028
732 HG3 MET 99 1HG MET 99 -1.600 -0.756 6.582
733 HE1 MET 99 3HE MET 99 0.841 -4.564 5.563
734 HE2 MET 99 1HE MET 99 -0.305 -3.808 4.460
735 HE3 MET 99 2HE MET 99 -0.878 -4.614 5.924
736 H HIS 100 H HIS 100 -5.717 -3.113 4.745
737 HA HIS 100 HA HIS 100 -7.255 -4.348 6.900
738 HB2 HIS 100 2HB HIS 100 -7.939 -3.937 3.970
739 HB3 HIS 100 1HB HIS 100 -8.998 -4.680 5.157
740 HD1 HIS 100 1HD HIS 100 -10.492 -3.086 6.475
741 HD2 HIS 100 2HD HIS 100 -7.459 -1.136 4.411
742 HE1 HIS 100 1HE HIS 100 -10.992 -0.629 6.657
Start of MODEL 27
1 H1 GLY 1 1HT GLY 1 -7.381 -18.378 -8.625
2 H2 GLY 1 2HT GLY 1 -8.924 -17.840 -9.106
3 H3 GLY 1 3HT GLY 1 -8.719 -18.494 -7.585
4 HA2 GLY 1 1HA GLY 1 -7.390 -16.647 -6.908
5 HA3 GLY 1 2HA GLY 1 -7.497 -15.996 -8.546
6 H HIS 2 H HIS 2 -8.358 -14.639 -6.231
7 HA HIS 2 HA HIS 2 -11.044 -14.096 -7.028
8 HB2 HIS 2 2HB HIS 2 -12.025 -14.326 -4.755
9 HB3 HIS 2 1HB HIS 2 -11.479 -15.871 -5.374
10 HD1 HIS 2 1HD HIS 2 -11.443 -13.939 -2.328
11 HD2 HIS 2 2HD HIS 2 -8.772 -16.526 -4.199
12 HE1 HIS 2 1HE HIS 2 -9.899 -14.745 -0.539
13 H GLY 3 H GLY 3 -11.827 -12.222 -5.439
14 HA2 GLY 3 2HA GLY 3 -9.781 -10.204 -5.621
15 HA3 GLY 3 1HA GLY 3 -11.425 -9.980 -5.029
16 H SER 4 H SER 4 -8.509 -11.725 -4.124
17 HA SER 4 HA SER 4 -8.968 -12.043 -1.440
18 HB2 SER 4 2HB SER 4 -6.307 -11.702 -2.807
19 HB3 SER 4 1HB SER 4 -6.616 -12.529 -1.275
20 HG SER 4 HG SER 4 -7.761 -14.085 -2.351
21 H ALA 5 H ALA 5 -8.761 -10.811 0.268
22 HA ALA 5 HA ALA 5 -7.177 -8.413 0.199
23 HB1 ALA 5 1HB ALA 5 -9.441 -7.672 -0.395
24 HB2 ALA 5 2HB ALA 5 -8.951 -7.058 1.187
25 HB3 ALA 5 3HB ALA 5 -10.070 -8.422 1.073
26 H GLY 6 H GLY 6 -5.872 -9.829 1.391
27 HA2 GLY 6 2HA GLY 6 -6.765 -10.438 4.102
28 HA3 GLY 6 1HA GLY 6 -5.228 -10.920 3.370
29 H THR 7 H THR 7 -4.574 -8.479 2.272
30 HA THR 7 HA THR 7 -4.556 -6.517 4.392
31 HB THR 7 HB THR 7 -2.025 -7.590 3.110
32 HG1 THR 7 1HG THR 7 -3.348 -8.020 5.475
33 HG21 THR 7 3HG2 THR 7 -1.907 -5.166 3.448
34 HG22 THR 7 1HG2 THR 7 -0.846 -5.994 4.587
35 HG23 THR 7 2HG2 THR 7 -2.401 -5.355 5.133
36 H SER 8 H SER 8 -5.349 -4.835 3.354
37 HA SER 8 HA SER 8 -4.298 -4.214 0.667
38 HB2 SER 8 2HB SER 8 -6.985 -3.360 1.756
39 HB3 SER 8 1HB SER 8 -6.439 -3.345 0.078
40 HG SER 8 HG SER 8 -7.326 -5.410 1.693
41 H VAL 9 H VAL 9 -2.984 -2.420 0.839
42 HA VAL 9 HA VAL 9 -3.316 -0.778 3.235
43 HB VAL 9 HB VAL 9 -1.173 -0.550 1.109
44 HG11 VAL 9 1HG1 VAL 9 -1.287 0.452 3.963
45 HG12 VAL 9 2HG1 VAL 9 -1.449 1.441 2.511
46 HG13 VAL 9 3HG1 VAL 9 0.082 0.642 2.869
47 HG21 VAL 9 3HG2 VAL 9 0.293 -1.788 2.648
48 HG22 VAL 9 1HG2 VAL 9 -1.056 -2.767 2.079
49 HG23 VAL 9 2HG2 VAL 9 -1.088 -2.088 3.702
50 H THR 10 H THR 10 -4.075 1.159 3.229
51 HA THR 10 HA THR 10 -4.822 2.421 0.708
52 HB THR 10 HB THR 10 -6.617 1.888 3.086
53 HG1 THR 10 1HG THR 10 -5.916 0.325 1.079
54 HG21 THR 10 3HG2 THR 10 -8.396 2.680 1.628
55 HG22 THR 10 1HG2 THR 10 -7.224 3.018 0.350
56 HG23 THR 10 2HG2 THR 10 -7.164 3.932 1.860
57 H LEU 11 H LEU 11 -4.442 4.590 0.838
58 HA LEU 11 HA LEU 11 -3.702 5.569 3.452
59 HB2 LEU 11 2HB LEU 11 -2.735 7.531 2.289
60 HB3 LEU 11 1HB LEU 11 -2.003 6.017 1.831
61 HG LEU 11 HG LEU 11 -3.529 6.175 -0.258
62 HD11 LEU 11 1HD1 LEU 11 -4.954 8.011 0.451
63 HD12 LEU 11 2HD1 LEU 11 -4.020 8.476 -0.979
64 HD13 LEU 11 3HD1 LEU 11 -3.542 9.057 0.604
65 HD21 LEU 11 3HD2 LEU 11 -1.208 8.051 0.135
66 HD22 LEU 11 1HD2 LEU 11 -1.846 7.524 -1.423
67 HD23 LEU 11 2HD2 LEU 11 -1.118 6.352 -0.322
68 H GLN 12 H GLN 12 -4.670 7.180 4.471
69 HA GLN 12 HA GLN 12 -7.386 7.743 3.545
70 HB2 GLN 12 2HB GLN 12 -7.215 6.400 5.579
71 HB3 GLN 12 1HB GLN 12 -6.274 7.663 6.316
72 HG2 GLN 12 2HG GLN 12 -8.095 9.215 6.256
73 HG3 GLN 12 1HG GLN 12 -9.090 8.073 5.356
74 HE21 GLN 12 1HE2 GLN 12 -9.971 6.401 6.374
75 HE22 GLN 12 2HE2 GLN 12 -10.084 6.261 8.097
76 H LEU 13 H LEU 13 -8.000 9.632 3.330
77 HA LEU 13 HA LEU 13 -6.283 11.918 4.068
78 HB2 LEU 13 2HB LEU 13 -6.164 11.622 1.722
79 HB3 LEU 13 1HB LEU 13 -7.876 11.293 1.600
80 HG LEU 13 HG LEU 13 -8.298 13.671 2.212
81 HD11 LEU 13 1HD1 LEU 13 -6.495 15.276 1.965
82 HD12 LEU 13 2HD1 LEU 13 -5.333 13.946 1.828
83 HD13 LEU 13 3HD1 LEU 13 -6.254 14.177 3.321
84 HD21 LEU 13 3HD2 LEU 13 -6.716 13.094 -0.280
85 HD22 LEU 13 1HD2 LEU 13 -7.679 14.549 0.011
86 HD23 LEU 13 2HD2 LEU 13 -8.467 12.977 -0.037
87 H ASP 14 H ASP 14 -7.425 13.593 5.138
88 HA ASP 14 HA ASP 14 -10.267 13.025 5.585
89 HB2 ASP 14 2HB ASP 14 -8.931 13.406 7.624
90 HB3 ASP 14 1HB ASP 14 -8.401 14.954 6.966
91 H ASP 15 H ASP 15 -11.159 13.507 3.974
92 HA ASP 15 HA ASP 15 -11.162 16.299 3.312
93 HB2 ASP 15 2HB ASP 15 -9.974 15.231 1.533
94 HB3 ASP 15 1HB ASP 15 -11.187 13.972 1.397
95 H GLY 16 H GLY 16 -12.920 16.531 4.527
96 HA2 GLY 16 2HA GLY 16 -15.247 17.020 4.518
97 HA3 GLY 16 1HA GLY 16 -15.478 15.762 3.308
98 H SER 17 H SER 17 -14.738 13.632 4.134
99 HA SER 17 HA SER 17 -15.517 13.177 6.914
100 HB2 SER 17 2HB SER 17 -16.689 11.095 5.989
101 HB3 SER 17 1HB SER 17 -17.486 12.650 5.739
102 HG SER 17 HG SER 17 -17.354 12.339 3.724
103 H GLY 18 H GLY 18 -13.898 12.044 3.973
104 HA2 GLY 18 2HA GLY 18 -11.572 11.266 4.832
105 HA3 GLY 18 1HA GLY 18 -12.579 9.946 5.427
106 H ARG 19 H ARG 19 -10.724 10.870 3.029
107 HA ARG 19 HA ARG 19 -12.104 9.297 0.945
108 HB2 ARG 19 2HB ARG 19 -9.640 11.013 0.757
109 HB3 ARG 19 1HB ARG 19 -10.408 10.127 -0.545
110 HG2 ARG 19 2HG ARG 19 -11.788 12.224 1.010
111 HG3 ARG 19 1HG ARG 19 -10.793 12.637 -0.408
112 HD2 ARG 19 2HD ARG 19 -12.304 11.052 -1.674
113 HD3 ARG 19 1HD ARG 19 -13.325 11.015 -0.232
114 HE ARG 19 HE ARG 19 -13.018 13.652 -0.663
115 HH11 ARG 19 1HH1 ARG 19 -14.101 11.019 -2.807
116 HH12 ARG 19 2HH1 ARG 19 -15.040 12.053 -3.782
117 HH21 ARG 19 1HH2 ARG 19 -14.273 15.020 -2.021
118 HH22 ARG 19 2HH2 ARG 19 -15.175 14.360 -3.309
119 H THR 20 H THR 20 -10.850 7.674 -0.034
120 HA THR 20 HA THR 20 -8.391 6.957 1.352
121 HB THR 20 HB THR 20 -9.072 4.572 1.386
122 HG1 THR 20 1HG THR 20 -11.610 5.650 0.724
123 HG21 THR 20 3HG2 THR 20 -10.798 6.475 2.936
124 HG22 THR 20 1HG2 THR 20 -9.233 5.848 3.438
125 HG23 THR 20 2HG2 THR 20 -10.628 4.757 3.342
126 H TYR 21 H TYR 21 -6.863 6.285 0.049
127 HA TYR 21 HA TYR 21 -7.596 5.481 -2.673
128 HB2 TYR 21 2HB TYR 21 -6.382 7.540 -2.900
129 HB3 TYR 21 1HB TYR 21 -5.200 7.040 -1.699
130 HD1 TYR 21 1HD TYR 21 -6.398 6.226 -5.160
131 HD2 TYR 21 2HD TYR 21 -3.189 6.045 -2.365
132 HE1 TYR 21 1HE TYR 21 -4.883 5.423 -6.935
133 HE2 TYR 21 2HE TYR 21 -1.684 5.239 -4.125
134 HH TYR 21 HH TYR 21 -1.767 4.130 -6.263
135 H GLN 22 H GLN 22 -7.341 3.410 -2.876
136 HA GLN 22 HA GLN 22 -5.716 1.953 -1.023
137 HB2 GLN 22 2HB GLN 22 -7.860 1.041 -1.930
138 HB3 GLN 22 1HB GLN 22 -7.112 0.955 -3.517
139 HG2 GLN 22 2HG GLN 22 -5.457 -0.617 -2.664
140 HG3 GLN 22 1HG GLN 22 -6.188 -0.524 -1.064
141 HE21 GLN 22 1HE2 GLN 22 -5.811 -2.809 -2.817
142 HE22 GLN 22 2HE2 GLN 22 -7.384 -3.458 -3.093
143 H LEU 23 H LEU 23 -3.732 1.137 -1.392
144 HA LEU 23 HA LEU 23 -2.256 2.358 -3.490
145 HB2 LEU 23 2HB LEU 23 -1.490 0.264 -1.478
146 HB3 LEU 23 1HB LEU 23 -0.372 1.028 -2.583
147 HG LEU 23 HG LEU 23 -1.905 2.401 -0.371
148 HD11 LEU 23 1HD1 LEU 23 -0.110 0.971 0.414
149 HD12 LEU 23 2HD1 LEU 23 0.291 2.674 0.624
150 HD13 LEU 23 3HD1 LEU 23 1.005 1.756 -0.701
151 HD21 LEU 23 3HD2 LEU 23 0.148 3.500 -2.291
152 HD22 LEU 23 1HD2 LEU 23 -0.534 4.352 -0.909
153 HD23 LEU 23 2HD2 LEU 23 -1.571 3.914 -2.263
154 H ARG 24 H ARG 24 -1.810 1.602 -5.377
155 HA ARG 24 HA ARG 24 -2.850 -0.948 -6.196
156 HB2 ARG 24 2HB ARG 24 -1.186 1.108 -7.676
157 HB3 ARG 24 1HB ARG 24 -1.930 -0.307 -8.403
158 HG2 ARG 24 2HG ARG 24 -3.406 2.001 -7.131
159 HG3 ARG 24 1HG ARG 24 -3.208 1.732 -8.860
160 HD2 ARG 24 2HD ARG 24 -4.660 -0.076 -6.921
161 HD3 ARG 24 1HD ARG 24 -5.404 0.989 -8.110
162 HE ARG 24 HE ARG 24 -3.597 -0.787 -9.365
163 HH11 ARG 24 1HH1 ARG 24 -6.833 -0.831 -7.901
164 HH12 ARG 24 2HH1 ARG 24 -7.382 -2.111 -8.878
165 HH21 ARG 24 1HH2 ARG 24 -4.354 -2.523 -10.643
166 HH22 ARG 24 2HH2 ARG 24 -5.960 -3.108 -10.453
167 H GLU 25 H GLU 25 -1.486 -2.607 -7.018
168 HA GLU 25 HA GLU 25 0.845 -2.787 -5.418
169 HB2 GLU 25 2HB GLU 25 1.017 -5.131 -6.543
170 HB3 GLU 25 1HB GLU 25 -0.251 -4.813 -5.377
171 HG2 GLU 25 2HG GLU 25 -1.714 -4.271 -7.422
172 HG3 GLU 25 1HG GLU 25 -0.449 -5.079 -8.350
173 H GLY 26 H GLY 26 2.649 -2.190 -5.792
174 HA2 GLY 26 2HA GLY 26 4.535 -2.249 -7.502
175 HA3 GLY 26 1HA GLY 26 3.433 -1.195 -8.416
176 H SER 27 H SER 27 5.324 0.448 -7.979
177 HA SER 27 HA SER 27 4.899 1.356 -5.284
178 HB2 SER 27 2HB SER 27 6.914 2.730 -5.461
179 HB3 SER 27 1HB SER 27 7.222 1.049 -5.877
180 HG SER 27 HG SER 27 7.925 3.062 -7.218
181 H ASN 28 H ASN 28 3.706 2.851 -4.781
182 HA ASN 28 HA ASN 28 2.357 4.397 -6.852
183 HB2 ASN 28 2HB ASN 28 1.880 4.225 -3.853
184 HB3 ASN 28 1HB ASN 28 0.879 5.125 -4.985
185 HD21 ASN 28 1HD2 ASN 28 1.872 1.940 -3.948
186 HD22 ASN 28 2HD2 ASN 28 0.602 1.072 -4.708
187 H ILE 29 H ILE 29 3.403 6.072 -7.429
188 HA ILE 29 HA ILE 29 5.269 7.418 -5.663
189 HB ILE 29 HB ILE 29 4.616 7.916 -8.572
190 HG12 ILE 29 2HG1 ILE 29 6.907 6.318 -7.415
191 HG13 ILE 29 1HG1 ILE 29 5.436 5.600 -8.059
192 HG21 ILE 29 1HG2 ILE 29 6.997 8.727 -6.889
193 HG22 ILE 29 2HG2 ILE 29 5.713 9.800 -7.446
194 HG23 ILE 29 3HG2 ILE 29 6.787 9.026 -8.616
195 HD11 ILE 29 3HD1 ILE 29 7.264 5.532 -9.656
196 HD12 ILE 29 1HD1 ILE 29 7.391 7.287 -9.595
197 HD13 ILE 29 2HD1 ILE 29 5.935 6.533 -10.245
198 H ILE 30 H ILE 30 4.569 9.058 -4.510
199 HA ILE 30 HA ILE 30 2.126 10.452 -5.249
200 HB ILE 30 HB ILE 30 3.647 10.314 -2.625
201 HG12 ILE 30 2HG1 ILE 30 0.993 9.081 -3.419
202 HG13 ILE 30 1HG1 ILE 30 2.508 8.216 -3.235
203 HG21 ILE 30 1HG2 ILE 30 1.111 11.771 -3.273
204 HG22 ILE 30 2HG2 ILE 30 2.641 12.439 -2.721
205 HG23 ILE 30 3HG2 ILE 30 1.688 11.419 -1.648
206 HD11 ILE 30 3HD1 ILE 30 1.033 9.658 -1.044
207 HD12 ILE 30 1HD1 ILE 30 2.541 8.761 -0.860
208 HD13 ILE 30 2HD1 ILE 30 1.057 7.916 -1.307
209 H GLY 31 H GLY 31 2.223 12.449 -6.005
210 HA2 GLY 31 2HA GLY 31 3.418 14.642 -5.112
211 HA3 GLY 31 1HA GLY 31 4.703 13.940 -6.133
212 H ARG 32 H ARG 32 4.501 15.776 -7.476
213 HA ARG 32 HA ARG 32 2.169 15.485 -9.205
214 HB2 ARG 32 2HB ARG 32 3.353 18.086 -8.279
215 HB3 ARG 32 1HB ARG 32 2.314 17.958 -9.692
216 HG2 ARG 32 2HG ARG 32 0.624 16.869 -8.061
217 HG3 ARG 32 1HG ARG 32 1.672 17.501 -6.826
218 HD2 ARG 32 2HD ARG 32 1.324 19.706 -7.327
219 HD3 ARG 32 1HD ARG 32 0.805 19.380 -8.978
220 HE ARG 32 HE ARG 32 -0.975 18.283 -7.056
221 HH11 ARG 32 1HH1 ARG 32 -0.081 21.413 -8.416
222 HH12 ARG 32 2HH1 ARG 32 -1.674 22.009 -8.433
223 HH21 ARG 32 1HH2 ARG 32 -3.156 19.067 -7.133
224 HH22 ARG 32 2HH2 ARG 32 -3.480 20.632 -7.686
225 H GLY 33 H GLY 33 2.934 14.531 -10.874
226 HA2 GLY 33 2HA GLY 33 4.311 15.913 -12.783
227 HA3 GLY 33 1HA GLY 33 5.466 14.837 -11.978
228 H GLN 34 H GLN 34 4.812 14.420 -14.630
229 HA GLN 34 HA GLN 34 2.789 12.395 -14.806
230 HB2 GLN 34 2HB GLN 34 3.660 11.937 -17.048
231 HB3 GLN 34 1HB GLN 34 3.458 13.664 -16.811
232 HG2 GLN 34 2HG GLN 34 5.796 13.995 -16.586
233 HG3 GLN 34 1HG GLN 34 6.088 12.259 -16.468
234 HE21 GLN 34 1HE2 GLN 34 7.183 14.216 -18.320
235 HE22 GLN 34 2HE2 GLN 34 6.764 13.655 -19.894
236 H ASP 35 H ASP 35 5.962 12.535 -13.740
237 HA ASP 35 HA ASP 35 6.622 9.767 -14.130
238 HB2 ASP 35 2HB ASP 35 8.346 11.585 -14.050
239 HB3 ASP 35 1HB ASP 35 7.950 11.831 -12.354
240 H ALA 36 H ALA 36 4.644 11.436 -12.034
241 HA ALA 36 HA ALA 36 4.983 9.607 -9.802
242 HB1 ALA 36 1HB ALA 36 4.730 11.995 -9.299
243 HB2 ALA 36 2HB ALA 36 3.391 11.060 -8.633
244 HB3 ALA 36 3HB ALA 36 3.162 12.001 -10.107
245 H GLN 37 H GLN 37 2.832 8.798 -8.829
246 HA GLN 37 HA GLN 37 1.151 7.721 -10.976
247 HB2 GLN 37 2HB GLN 37 1.802 6.683 -8.224
248 HB3 GLN 37 1HB GLN 37 0.574 5.996 -9.261
249 HG2 GLN 37 2HG GLN 37 3.534 6.108 -9.829
250 HG3 GLN 37 1HG GLN 37 2.628 4.685 -9.325
251 HE21 GLN 37 1HE2 GLN 37 4.210 4.961 -11.674
252 HE22 GLN 37 2HE2 GLN 37 3.157 4.792 -13.033
253 H PHE 38 H PHE 38 1.184 8.976 -7.678
254 HA PHE 38 HA PHE 38 -1.684 9.480 -7.804
255 HB2 PHE 38 2HB PHE 38 -1.033 7.948 -6.021
256 HB3 PHE 38 1HB PHE 38 0.196 9.069 -5.470
257 HD1 PHE 38 1HD PHE 38 -3.488 8.688 -5.856
258 HD2 PHE 38 2HD PHE 38 -0.299 10.629 -3.837
259 HE1 PHE 38 1HE PHE 38 -5.083 9.642 -4.240
260 HE2 PHE 38 2HE PHE 38 -1.829 11.566 -2.238
261 HZ PHE 38 HZ PHE 38 -4.267 11.089 -2.420
262 H ARG 39 H ARG 39 -2.308 11.508 -7.778
263 HA ARG 39 HA ARG 39 -0.263 13.595 -7.869
264 HB2 ARG 39 2HB ARG 39 -2.144 13.080 -9.606
265 HB3 ARG 39 1HB ARG 39 -3.193 13.877 -8.455
266 HG2 ARG 39 2HG ARG 39 -2.639 15.481 -10.064
267 HG3 ARG 39 1HG ARG 39 -1.639 15.888 -8.662
268 HD2 ARG 39 2HD ARG 39 0.274 14.810 -9.701
269 HD3 ARG 39 1HD ARG 39 -0.734 14.263 -11.036
270 HE ARG 39 HE ARG 39 -0.695 17.126 -10.668
271 HH11 ARG 39 1HH1 ARG 39 0.727 14.385 -12.456
272 HH12 ARG 39 2HH1 ARG 39 1.431 15.350 -13.652
273 HH21 ARG 39 1HH2 ARG 39 0.307 18.451 -12.323
274 HH22 ARG 39 2HH2 ARG 39 1.234 17.751 -13.552
275 H LEU 40 H LEU 40 -0.047 14.918 -6.095
276 HA LEU 40 HA LEU 40 -2.037 14.856 -3.995
277 HB2 LEU 40 2HB LEU 40 0.551 16.382 -4.235
278 HB3 LEU 40 1HB LEU 40 -0.563 16.648 -2.916
279 HG LEU 40 HG LEU 40 0.936 14.094 -3.512
280 HD11 LEU 40 1HD1 LEU 40 2.244 15.960 -2.533
281 HD12 LEU 40 2HD1 LEU 40 2.093 14.574 -1.457
282 HD13 LEU 40 3HD1 LEU 40 1.105 16.010 -1.189
283 HD21 LEU 40 3HD2 LEU 40 -0.035 13.281 -1.410
284 HD22 LEU 40 1HD2 LEU 40 -1.283 13.588 -2.616
285 HD23 LEU 40 2HD2 LEU 40 -1.026 14.737 -1.306
286 HA PRO 41 HA PRO 41 -4.026 18.611 -5.378
287 HB2 PRO 41 2HB PRO 41 -5.719 18.945 -3.372
288 HB3 PRO 41 1HB PRO 41 -5.843 17.526 -4.418
289 HG2 PRO 41 2HG PRO 41 -4.837 17.740 -1.632
290 HG3 PRO 41 1HG PRO 41 -5.618 16.374 -2.444
291 HD2 PRO 41 2HD PRO 41 -2.818 16.774 -2.036
292 HD3 PRO 41 1HD PRO 41 -3.595 15.490 -2.973
293 H ASP 42 H ASP 42 -1.444 19.027 -3.965
294 HA ASP 42 HA ASP 42 -2.094 21.645 -2.845
295 HB2 ASP 42 2HB ASP 42 -1.597 19.651 -1.109
296 HB3 ASP 42 1HB ASP 42 0.058 20.155 -1.447
297 H THR 43 H THR 43 0.232 22.664 -2.285
298 HA THR 43 HA THR 43 1.731 22.506 -4.804
299 HB THR 43 HB THR 43 1.505 24.873 -2.923
300 HG1 THR 43 1HG THR 43 -0.183 23.918 -4.951
301 HG21 THR 43 3HG2 THR 43 2.091 26.122 -4.956
302 HG22 THR 43 1HG2 THR 43 2.180 24.607 -5.858
303 HG23 THR 43 2HG2 THR 43 3.326 24.923 -4.552
304 H GLY 44 H GLY 44 4.134 23.010 -4.483
305 HA2 GLY 44 2HA GLY 44 6.000 23.369 -3.073
306 HA3 GLY 44 1HA GLY 44 5.073 22.735 -1.724
307 H VAL 45 H VAL 45 4.149 20.620 -3.610
308 HA VAL 45 HA VAL 45 6.154 18.719 -2.857
309 HB VAL 45 HB VAL 45 3.769 18.186 -2.636
310 HG11 VAL 45 1HG1 VAL 45 2.849 19.378 -4.520
311 HG12 VAL 45 2HG1 VAL 45 2.375 17.680 -4.585
312 HG13 VAL 45 3HG1 VAL 45 3.655 18.280 -5.643
313 HG21 VAL 45 3HG2 VAL 45 5.215 16.427 -4.603
314 HG22 VAL 45 1HG2 VAL 45 3.797 15.947 -3.672
315 HG23 VAL 45 2HG2 VAL 45 5.297 16.345 -2.842
316 H SER 46 H SER 46 7.484 17.542 -4.159
317 HA SER 46 HA SER 46 8.248 18.611 -6.709
318 HB2 SER 46 2HB SER 46 9.181 16.127 -5.251
319 HB3 SER 46 1HB SER 46 10.074 17.048 -6.462
320 HG SER 46 HG SER 46 9.780 18.864 -4.881
321 H ARG 47 H ARG 47 8.861 16.415 -8.291
322 HA ARG 47 HA ARG 47 6.242 15.400 -8.913
323 HB2 ARG 47 2HB ARG 47 7.284 14.194 -10.809
324 HB3 ARG 47 1HB ARG 47 7.668 15.906 -10.814
325 HG2 ARG 47 2HG ARG 47 9.879 15.427 -9.965
326 HG3 ARG 47 1HG ARG 47 9.483 13.709 -9.864
327 HD2 ARG 47 2HD ARG 47 9.155 13.624 -12.245
328 HD3 ARG 47 1HD ARG 47 9.451 15.358 -12.367
329 HE ARG 47 HE ARG 47 11.676 14.506 -11.223
330 HH11 ARG 47 1HH1 ARG 47 9.911 13.297 -14.050
331 HH12 ARG 47 2HH1 ARG 47 11.293 12.756 -14.878
332 HH21 ARG 47 1HH2 ARG 47 13.594 13.763 -12.348
333 HH22 ARG 47 2HH2 ARG 47 13.453 13.044 -13.873
334 H ARG 48 H ARG 48 9.285 13.963 -7.802
335 HA ARG 48 HA ARG 48 7.642 11.828 -6.717
336 HB2 ARG 48 2HB ARG 48 10.596 11.893 -7.331
337 HB3 ARG 48 1HB ARG 48 9.855 10.686 -6.296
338 HG2 ARG 48 2HG ARG 48 8.380 10.107 -8.215
339 HG3 ARG 48 1HG ARG 48 9.405 11.113 -9.239
340 HD2 ARG 48 2HD ARG 48 11.344 9.782 -8.615
341 HD3 ARG 48 1HD ARG 48 10.349 8.808 -7.533
342 HE ARG 48 HE ARG 48 9.782 8.959 -10.387
343 HH11 ARG 48 1HH1 ARG 48 10.514 6.971 -7.481
344 HH12 ARG 48 2HH1 ARG 48 10.445 5.515 -8.307
345 HH21 ARG 48 1HH2 ARG 48 9.699 6.846 -11.485
346 HH22 ARG 48 2HH2 ARG 48 10.011 5.422 -10.595
347 H HIS 49 H HIS 49 7.095 12.316 -4.839
348 HA HIS 49 HA HIS 49 8.952 13.815 -3.135
349 HB2 HIS 49 2HB HIS 49 6.696 14.808 -3.433
350 HB3 HIS 49 1HB HIS 49 5.976 13.336 -2.793
351 HD2 HIS 49 2HD HIS 49 6.493 12.882 -0.031
352 HE1 HIS 49 1HE HIS 49 7.584 16.889 0.668
353 HE2 HIS 49 2HE HIS 49 7.535 14.513 1.589
354 H LEU 50 H LEU 50 6.760 11.091 -3.288
355 HA LEU 50 HA LEU 50 8.521 9.514 -1.716
356 HB2 LEU 50 2HB LEU 50 7.458 10.650 0.082
357 HB3 LEU 50 1HB LEU 50 5.877 10.505 -0.633
358 HG LEU 50 HG LEU 50 7.303 8.002 0.184
359 HD11 LEU 50 1HD1 LEU 50 6.440 8.299 2.460
360 HD12 LEU 50 2HD1 LEU 50 5.796 9.878 2.015
361 HD13 LEU 50 3HD1 LEU 50 7.540 9.618 2.067
362 HD21 LEU 50 3HD2 LEU 50 5.129 7.901 -0.954
363 HD22 LEU 50 1HD2 LEU 50 4.424 8.913 0.308
364 HD23 LEU 50 2HD2 LEU 50 5.018 7.298 0.700
365 H GLU 51 H GLU 51 7.939 7.325 -1.886
366 HA GLU 51 HA GLU 51 5.585 6.795 -3.489
367 HB2 GLU 51 2HB GLU 51 6.725 5.279 -4.979
368 HB3 GLU 51 1HB GLU 51 7.524 6.833 -5.070
369 HG2 GLU 51 2HG GLU 51 9.205 5.914 -3.450
370 HG3 GLU 51 1HG GLU 51 8.448 4.351 -3.669
371 H ILE 52 H ILE 52 4.601 4.981 -2.969
372 HA ILE 52 HA ILE 52 5.792 3.521 -0.734
373 HB ILE 52 HB ILE 52 2.876 3.514 -1.565
374 HG12 ILE 52 2HG1 ILE 52 4.210 4.940 0.761
375 HG13 ILE 52 1HG1 ILE 52 3.636 5.735 -0.699
376 HG21 ILE 52 1HG2 ILE 52 4.329 2.455 0.866
377 HG22 ILE 52 2HG2 ILE 52 3.667 1.493 -0.453
378 HG23 ILE 52 3HG2 ILE 52 2.578 2.389 0.616
379 HD11 ILE 52 3HD1 ILE 52 1.929 4.275 1.310
380 HD12 ILE 52 1HD1 ILE 52 1.351 5.082 -0.148
381 HD13 ILE 52 2HD1 ILE 52 2.084 6.024 1.152
382 H ARG 53 H ARG 53 6.635 1.673 -1.270
383 HA ARG 53 HA ARG 53 5.907 0.500 -3.827
384 HB2 ARG 53 2HB ARG 53 8.076 -0.337 -1.881
385 HB3 ARG 53 1HB ARG 53 7.881 -0.907 -3.523
386 HG2 ARG 53 2HG ARG 53 8.328 1.408 -4.306
387 HG3 ARG 53 1HG ARG 53 8.665 1.858 -2.639
388 HD2 ARG 53 2HD ARG 53 10.452 0.187 -2.546
389 HD3 ARG 53 1HD ARG 53 10.115 -0.270 -4.210
390 HE ARG 53 HE ARG 53 11.161 2.366 -3.373
391 HH11 ARG 53 1HH1 ARG 53 10.854 -0.149 -5.848
392 HH12 ARG 53 2HH1 ARG 53 12.113 0.470 -6.812
393 HH21 ARG 53 1HH2 ARG 53 12.868 3.184 -4.685
394 HH22 ARG 53 2HH2 ARG 53 13.279 2.445 -6.160
395 H TRP 54 H TRP 54 4.236 -0.701 -3.707
396 HA TRP 54 HA TRP 54 3.804 -2.278 -1.302
397 HB2 TRP 54 2HB TRP 54 2.050 -0.669 -1.460
398 HB3 TRP 54 1HB TRP 54 1.829 -0.976 -3.178
399 HD1 TRP 54 HD TRP 54 -0.403 -2.158 -3.556
400 HE1 TRP 54 1HE TRP 54 -1.788 -3.969 -2.364
401 HE3 TRP 54 3HE TRP 54 2.607 -2.996 0.474
402 HZ2 TRP 54 2HZ TRP 54 -1.635 -5.533 -0.049
403 HZ3 TRP 54 3HZ TRP 54 1.923 -4.675 2.129
404 HH2 TRP 54 HH TRP 54 -0.156 -5.923 1.872
405 H ASP 55 H ASP 55 4.184 -4.277 -1.579
406 HA ASP 55 HA ASP 55 3.587 -5.544 -4.165
407 HB2 ASP 55 2HB ASP 55 6.053 -5.432 -3.613
408 HB3 ASP 55 1HB ASP 55 5.715 -6.343 -2.149
409 H GLY 56 H GLY 56 2.907 -7.853 -3.817
410 HA2 GLY 56 2HA GLY 56 0.936 -7.945 -1.753
411 HA3 GLY 56 1HA GLY 56 1.285 -9.198 -2.930
412 H GLN 57 H GLN 57 3.091 -7.686 -0.333
413 HA GLN 57 HA GLN 57 3.218 -10.104 1.224
414 HB2 GLN 57 2HB GLN 57 5.071 -10.329 -0.488
415 HB3 GLN 57 1HB GLN 57 5.797 -8.886 0.206
416 HG2 GLN 57 2HG GLN 57 6.916 -10.761 1.136
417 HG3 GLN 57 1HG GLN 57 5.889 -10.084 2.394
418 HE21 GLN 57 1HE2 GLN 57 5.810 -11.997 3.522
419 HE22 GLN 57 2HE2 GLN 57 4.908 -13.374 3.013
420 H VAL 58 H VAL 58 5.017 -7.025 0.774
421 HA VAL 58 HA VAL 58 4.182 -6.158 3.429
422 HB VAL 58 HB VAL 58 6.485 -5.315 3.930
423 HG11 VAL 58 1HG1 VAL 58 6.280 -8.300 3.588
424 HG12 VAL 58 2HG1 VAL 58 5.734 -7.364 4.978
425 HG13 VAL 58 3HG1 VAL 58 7.453 -7.464 4.602
426 HG21 VAL 58 3HG2 VAL 58 7.300 -7.024 1.575
427 HG22 VAL 58 1HG2 VAL 58 8.409 -6.261 2.713
428 HG23 VAL 58 2HG2 VAL 58 7.395 -5.265 1.669
429 H ALA 59 H ALA 59 4.542 -3.843 3.785
430 HA ALA 59 HA ALA 59 4.321 -2.333 1.279
431 HB1 ALA 59 1HB ALA 59 2.322 -2.281 2.704
432 HB2 ALA 59 2HB ALA 59 3.066 -0.687 2.566
433 HB3 ALA 59 3HB ALA 59 3.291 -1.643 4.032
434 H LEU 60 H LEU 60 6.105 -1.346 0.781
435 HA LEU 60 HA LEU 60 7.968 -0.538 2.877
436 HB2 LEU 60 2HB LEU 60 8.646 -2.110 1.061
437 HB3 LEU 60 1HB LEU 60 8.297 -0.873 -0.106
438 HG LEU 60 HG LEU 60 10.525 -0.750 1.950
439 HD11 LEU 60 1HD1 LEU 60 11.972 -1.171 -0.008
440 HD12 LEU 60 2HD1 LEU 60 10.516 -1.427 -0.978
441 HD13 LEU 60 3HD1 LEU 60 10.882 -2.513 0.356
442 HD21 LEU 60 3HD2 LEU 60 9.991 0.982 -0.473
443 HD22 LEU 60 1HD2 LEU 60 11.399 1.098 0.588
444 HD23 LEU 60 2HD2 LEU 60 9.783 1.484 1.200
445 H LEU 61 H LEU 61 7.889 1.536 3.399
446 HA LEU 61 HA LEU 61 6.689 3.506 1.619
447 HB2 LEU 61 2HB LEU 61 5.867 3.303 3.886
448 HB3 LEU 61 1HB LEU 61 7.438 3.483 4.577
449 HG LEU 61 HG LEU 61 5.996 5.434 4.931
450 HD11 LEU 61 1HD1 LEU 61 8.249 6.139 3.073
451 HD12 LEU 61 2HD1 LEU 61 8.359 5.911 4.819
452 HD13 LEU 61 3HD1 LEU 61 7.418 7.251 4.166
453 HD21 LEU 61 3HD2 LEU 61 5.972 5.743 1.948
454 HD22 LEU 61 1HD2 LEU 61 5.225 6.828 3.117
455 HD23 LEU 61 2HD2 LEU 61 4.621 5.180 2.933
456 H ALA 62 H ALA 62 8.048 4.805 0.413
457 HA ALA 62 HA ALA 62 10.788 5.133 1.377
458 HB1 ALA 62 1HB ALA 62 10.748 3.486 -0.438
459 HB2 ALA 62 2HB ALA 62 11.586 4.959 -0.923
460 HB3 ALA 62 3HB ALA 62 9.941 4.655 -1.477
461 H ASP 63 H ASP 63 11.354 7.149 1.557
462 HA ASP 63 HA ASP 63 9.700 9.318 0.501
463 HB2 ASP 63 2HB ASP 63 10.237 9.561 2.806
464 HB3 ASP 63 1HB ASP 63 11.919 9.132 2.535
465 H LEU 64 H LEU 64 10.411 10.750 -1.061
466 HA LEU 64 HA LEU 64 13.176 10.439 -2.045
467 HB2 LEU 64 2HB LEU 64 10.677 10.954 -3.680
468 HB3 LEU 64 1HB LEU 64 12.297 11.101 -4.294
469 HG LEU 64 HG LEU 64 11.284 9.186 -5.134
470 HD11 LEU 64 1HD1 LEU 64 12.840 7.402 -4.424
471 HD12 LEU 64 2HD1 LEU 64 13.260 8.357 -3.004
472 HD13 LEU 64 3HD1 LEU 64 13.656 8.954 -4.615
473 HD21 LEU 64 3HD2 LEU 64 10.548 7.295 -3.759
474 HD22 LEU 64 1HD2 LEU 64 9.564 8.743 -3.543
475 HD23 LEU 64 2HD2 LEU 64 10.755 8.290 -2.317
476 H ASN 65 H ASN 65 13.408 12.330 -0.422
477 HA ASN 65 HA ASN 65 13.567 14.721 -1.931
478 HB2 ASN 65 2HB ASN 65 11.028 14.448 -1.056
479 HB3 ASN 65 1HB ASN 65 11.744 15.188 0.375
480 HD21 ASN 65 1HD2 ASN 65 10.887 15.576 -2.886
481 HD22 ASN 65 2HD2 ASN 65 11.143 17.263 -3.052
482 H SER 66 H SER 66 14.952 16.163 -0.918
483 HA SER 66 HA SER 66 16.054 15.157 1.575
484 HB2 SER 66 2HB SER 66 17.920 16.756 1.053
485 HB3 SER 66 1HB SER 66 17.684 15.490 -0.155
486 HG SER 66 HG SER 66 17.723 17.147 -1.408
487 H THR 67 H THR 67 14.810 18.136 0.168
488 HA THR 67 HA THR 67 15.047 19.515 2.664
489 HB THR 67 HB THR 67 15.446 20.822 0.672
490 HG1 THR 67 1HG THR 67 14.663 22.217 2.041
491 HG21 THR 67 3HG2 THR 67 12.592 20.213 -0.133
492 HG22 THR 67 1HG2 THR 67 14.041 19.611 -0.935
493 HG23 THR 67 2HG2 THR 67 13.666 21.333 -0.967
494 H ASN 68 H ASN 68 12.423 18.005 0.884
495 HA ASN 68 HA ASN 68 10.536 18.918 2.924
496 HB2 ASN 68 2HB ASN 68 10.017 17.708 0.190
497 HB3 ASN 68 1HB ASN 68 8.791 18.165 1.371
498 HD21 ASN 68 1HD2 ASN 68 9.346 19.093 -1.369
499 HD22 ASN 68 2HD2 ASN 68 9.459 20.805 -1.249
500 H GLY 69 H GLY 69 12.485 16.825 3.339
501 HA2 GLY 69 2HA GLY 69 11.793 14.205 3.058
502 HA3 GLY 69 1HA GLY 69 12.619 14.832 4.470
503 H THR 70 H THR 70 10.272 12.936 3.633
504 HA THR 70 HA THR 70 7.998 13.828 5.061
505 HB THR 70 HB THR 70 8.724 11.110 3.976
506 HG1 THR 70 1HG THR 70 8.862 12.371 2.304
507 HG21 THR 70 3HG2 THR 70 6.044 12.409 4.513
508 HG22 THR 70 1HG2 THR 70 6.754 11.097 5.447
509 HG23 THR 70 2HG2 THR 70 6.282 10.822 3.771
510 H THR 71 H THR 71 7.145 13.040 6.990
511 HA THR 71 HA THR 71 8.931 11.525 8.732
512 HB THR 71 HB THR 71 7.328 12.526 10.500
513 HG1 THR 71 1HG THR 71 7.118 14.707 8.803
514 HG21 THR 71 3HG2 THR 71 9.659 13.076 10.325
515 HG22 THR 71 1HG2 THR 71 8.700 14.512 10.697
516 HG23 THR 71 2HG2 THR 71 9.304 14.252 9.045
517 H VAL 72 H VAL 72 8.154 9.755 9.724
518 HA VAL 72 HA VAL 72 5.376 9.010 9.233
519 HB VAL 72 HB VAL 72 6.150 6.638 9.225
520 HG11 VAL 72 1HG1 VAL 72 7.149 6.654 6.965
521 HG12 VAL 72 2HG1 VAL 72 7.487 8.377 7.143
522 HG13 VAL 72 3HG1 VAL 72 5.823 7.816 7.073
523 HG21 VAL 72 3HG2 VAL 72 8.222 6.902 10.452
524 HG22 VAL 72 1HG2 VAL 72 8.896 7.870 9.141
525 HG23 VAL 72 2HG2 VAL 72 8.538 6.155 8.883
526 H ASN 73 H ASN 73 4.279 8.858 11.060
527 HA ASN 73 HA ASN 73 3.781 8.967 13.204
528 HB2 ASN 73 2HB ASN 73 5.923 6.830 13.345
529 HB3 ASN 73 1HB ASN 73 4.936 7.283 14.733
530 HD21 ASN 73 1HD2 ASN 73 5.093 4.770 13.249
531 HD22 ASN 73 2HD2 ASN 73 3.490 4.437 12.708
532 H ASN 74 H ASN 74 5.479 10.862 12.221
533 HA ASN 74 HA ASN 74 6.283 12.798 12.937
534 HB2 ASN 74 2HB ASN 74 5.147 12.394 15.123
535 HB3 ASN 74 1HB ASN 74 6.592 11.581 15.694
536 HD21 ASN 74 1HD2 ASN 74 6.997 12.950 17.343
537 HD22 ASN 74 2HD2 ASN 74 7.477 14.585 17.137
538 H ALA 75 H ALA 75 7.920 9.952 12.723
539 HA ALA 75 HA ALA 75 10.529 11.073 13.390
540 HB1 ALA 75 1HB ALA 75 10.013 8.859 14.282
541 HB2 ALA 75 2HB ALA 75 11.355 8.776 13.139
542 HB3 ALA 75 3HB ALA 75 9.741 8.256 12.647
543 HA PRO 76 HA PRO 76 11.065 11.752 8.923
544 HB2 PRO 76 2HB PRO 76 13.779 12.594 9.589
545 HB3 PRO 76 1HB PRO 76 12.451 13.570 8.956
546 HG2 PRO 76 2HG PRO 76 13.421 13.852 11.475
547 HG3 PRO 76 1HG PRO 76 11.732 14.180 11.052
548 HD2 PRO 76 2HD PRO 76 12.932 11.781 12.376
549 HD3 PRO 76 1HD PRO 76 11.411 12.645 12.719
550 H VAL 77 H VAL 77 11.633 10.191 7.525
551 HA VAL 77 HA VAL 77 14.041 8.605 7.998
552 HB VAL 77 HB VAL 77 12.864 6.497 7.512
553 HG11 VAL 77 1HG1 VAL 77 11.660 7.917 9.880
554 HG12 VAL 77 2HG1 VAL 77 13.185 7.031 9.856
555 HG13 VAL 77 3HG1 VAL 77 11.661 6.172 9.621
556 HG21 VAL 77 3HG2 VAL 77 11.023 7.319 6.203
557 HG22 VAL 77 1HG2 VAL 77 10.370 8.174 7.602
558 HG23 VAL 77 2HG2 VAL 77 10.391 6.410 7.576
559 H GLN 78 H GLN 78 14.368 7.150 6.055
560 HA GLN 78 HA GLN 78 13.406 8.470 3.650
561 HB2 GLN 78 2HB GLN 78 15.855 6.751 4.036
562 HB3 GLN 78 1HB GLN 78 15.314 7.379 2.482
563 HG2 GLN 78 2HG GLN 78 15.515 9.672 3.411
564 HG3 GLN 78 1HG GLN 78 16.218 8.966 4.862
565 HE21 GLN 78 1HE2 GLN 78 18.125 10.045 4.560
566 HE22 GLN 78 2HE2 GLN 78 19.258 9.600 3.337
567 H GLU 79 H GLU 79 13.638 5.402 5.354
568 HA GLU 79 HA GLU 79 11.424 4.567 3.770
569 HB2 GLU 79 2HB GLU 79 12.273 2.320 3.284
570 HB3 GLU 79 1HB GLU 79 13.223 3.557 2.502
571 HG2 GLU 79 2HG GLU 79 14.965 3.283 4.198
572 HG3 GLU 79 1HG GLU 79 13.995 2.031 4.975
573 H TRP 80 H TRP 80 10.149 3.011 4.672
574 HA TRP 80 HA TRP 80 10.486 2.277 7.462
575 HB2 TRP 80 2HB TRP 80 9.786 4.504 7.752
576 HB3 TRP 80 1HB TRP 80 8.601 4.436 6.462
577 HD1 TRP 80 HD TRP 80 6.216 3.346 7.133
578 HE1 TRP 80 1HE TRP 80 5.034 3.132 9.419
579 HE3 TRP 80 3HE TRP 80 10.241 4.065 10.187
580 HZ2 TRP 80 2HZ TRP 80 5.730 3.260 12.131
581 HZ3 TRP 80 3HZ TRP 80 9.883 4.017 12.622
582 HH2 TRP 80 HH TRP 80 7.676 3.623 13.566
583 H GLN 81 H GLN 81 8.883 0.665 7.979
584 HA GLN 81 HA GLN 81 7.338 -0.043 5.635
585 HB2 GLN 81 2HB GLN 81 7.128 -2.359 6.539
586 HB3 GLN 81 1HB GLN 81 8.758 -1.879 6.114
587 HG2 GLN 81 2HG GLN 81 9.281 -1.560 8.463
588 HG3 GLN 81 1HG GLN 81 7.631 -2.025 8.898
589 HE21 GLN 81 1HE2 GLN 81 10.160 -3.305 9.592
590 HE22 GLN 81 2HE2 GLN 81 10.042 -4.915 9.007
591 H LEU 82 H LEU 82 5.419 0.331 5.589
592 HA LEU 82 HA LEU 82 3.982 1.816 7.435
593 HB2 LEU 82 2HB LEU 82 2.923 0.058 5.253
594 HB3 LEU 82 1HB LEU 82 2.023 1.299 6.087
595 HG LEU 82 HG LEU 82 4.397 1.699 4.284
596 HD11 LEU 82 1HD1 LEU 82 2.800 2.881 2.877
597 HD12 LEU 82 2HD1 LEU 82 1.505 2.488 4.007
598 HD13 LEU 82 3HD1 LEU 82 2.318 1.201 3.116
599 HD21 LEU 82 3HD2 LEU 82 4.535 3.296 6.045
600 HD22 LEU 82 1HD2 LEU 82 2.811 3.638 5.923
601 HD23 LEU 82 2HD2 LEU 82 3.890 4.103 4.616
602 H ALA 83 H ALA 83 2.422 1.365 8.939
603 HA ALA 83 HA ALA 83 1.310 -1.324 9.154
604 HB1 ALA 83 1HB ALA 83 1.274 -1.071 11.614
605 HB2 ALA 83 2HB ALA 83 2.154 0.450 11.467
606 HB3 ALA 83 3HB ALA 83 2.924 -1.065 10.996
607 H ASP 84 H ASP 84 -0.851 -1.208 10.235
608 HA ASP 84 HA ASP 84 -2.334 0.949 9.104
609 HB2 ASP 84 2HB ASP 84 -3.374 -1.224 9.176
610 HB3 ASP 84 1HB ASP 84 -3.188 -1.313 10.921
611 H GLY 85 H GLY 85 -2.689 2.819 9.910
612 HA2 GLY 85 2HA GLY 85 -3.525 4.238 11.566
613 HA3 GLY 85 1HA GLY 85 -2.819 3.200 12.804
614 H ASP 86 H ASP 86 -0.686 3.673 10.194
615 HA ASP 86 HA ASP 86 1.029 5.278 11.822
616 HB2 ASP 86 2HB ASP 86 1.356 4.231 9.014
617 HB3 ASP 86 1HB ASP 86 2.484 5.403 9.680
618 H VAL 87 H VAL 87 1.503 7.321 11.784
619 HA VAL 87 HA VAL 87 -0.223 9.082 10.174
620 HB VAL 87 HB VAL 87 1.606 9.858 12.471
621 HG11 VAL 87 1HG1 VAL 87 1.023 11.707 11.031
622 HG12 VAL 87 2HG1 VAL 87 0.228 11.877 12.596
623 HG13 VAL 87 3HG1 VAL 87 -0.693 11.327 11.196
624 HG21 VAL 87 3HG2 VAL 87 -1.349 9.240 12.584
625 HG22 VAL 87 1HG2 VAL 87 -0.384 9.886 13.910
626 HG23 VAL 87 2HG2 VAL 87 -0.059 8.266 13.289
627 H ILE 88 H ILE 88 0.666 9.754 8.329
628 HA ILE 88 HA ILE 88 3.560 10.111 8.401
629 HB ILE 88 HB ILE 88 1.871 9.091 6.101
630 HG12 ILE 88 2HG1 ILE 88 3.974 7.777 7.859
631 HG13 ILE 88 1HG1 ILE 88 2.265 7.418 7.797
632 HG21 ILE 88 1HG2 ILE 88 4.835 9.660 6.161
633 HG22 ILE 88 2HG2 ILE 88 3.620 10.561 5.262
634 HG23 ILE 88 3HG2 ILE 88 3.964 8.881 4.835
635 HD11 ILE 88 3HD1 ILE 88 4.241 6.898 5.585
636 HD12 ILE 88 1HD1 ILE 88 2.518 6.540 5.529
637 HD13 ILE 88 2HD1 ILE 88 3.555 5.687 6.667
638 H ARG 89 H ARG 89 4.302 12.059 7.947
639 HA ARG 89 HA ARG 89 2.418 13.945 6.758
640 HB2 ARG 89 2HB ARG 89 4.598 14.448 8.765
641 HB3 ARG 89 1HB ARG 89 3.803 15.732 7.869
642 HG2 ARG 89 2HG ARG 89 1.627 14.807 8.828
643 HG3 ARG 89 1HG ARG 89 2.655 13.886 9.917
644 HD2 ARG 89 2HD ARG 89 3.560 15.802 10.897
645 HD3 ARG 89 1HD ARG 89 2.970 16.853 9.610
646 HE ARG 89 HE ARG 89 1.364 15.645 11.749
647 HH11 ARG 89 1HH1 ARG 89 1.624 17.953 9.036
648 HH12 ARG 89 2HH1 ARG 89 0.174 18.745 9.395
649 HH21 ARG 89 1HH2 ARG 89 -0.630 16.714 12.208
650 HH22 ARG 89 2HH2 ARG 89 -1.177 18.007 11.231
651 H LEU 90 H LEU 90 2.843 14.439 4.828
652 HA LEU 90 HA LEU 90 5.597 14.696 4.005
653 HB2 LEU 90 2HB LEU 90 4.862 14.169 1.656
654 HB3 LEU 90 1HB LEU 90 4.828 12.819 2.751
655 HG LEU 90 HG LEU 90 2.309 14.324 2.038
656 HD11 LEU 90 1HD1 LEU 90 3.419 13.554 -0.027
657 HD12 LEU 90 2HD1 LEU 90 1.952 12.638 0.309
658 HD13 LEU 90 3HD1 LEU 90 3.530 11.930 0.652
659 HD21 LEU 90 3HD2 LEU 90 1.256 12.200 2.628
660 HD22 LEU 90 1HD2 LEU 90 2.226 12.796 3.973
661 HD23 LEU 90 2HD2 LEU 90 2.835 11.489 2.955
662 H GLY 91 H GLY 91 5.773 16.172 2.064
663 HA2 GLY 91 2HA GLY 91 5.476 18.761 2.821
664 HA3 GLY 91 1HA GLY 91 5.553 18.274 1.143
665 H HIS 92 H HIS 92 3.670 19.492 3.662
666 HA HIS 92 HA HIS 92 1.721 20.545 3.869
667 HB2 HIS 92 2HB HIS 92 1.718 20.609 0.848
668 HB3 HIS 92 1HB HIS 92 0.581 21.482 1.861
669 HD1 HIS 92 1HD HIS 92 2.922 22.590 -0.154
670 HD2 HIS 92 2HD HIS 92 2.783 22.706 3.987
671 HE1 HIS 92 1HE HIS 92 4.438 24.480 0.542
672 H SER 93 H SER 93 1.851 17.511 3.225
673 HA SER 93 HA SER 93 -1.045 17.247 3.277
674 HB2 SER 93 2HB SER 93 0.788 15.618 1.549
675 HB3 SER 93 1HB SER 93 -0.918 15.276 1.791
676 HG SER 93 HG SER 93 0.085 17.723 0.797
677 H GLU 94 H GLU 94 -1.478 16.268 5.107
678 HA GLU 94 HA GLU 94 0.321 14.154 5.940
679 HB2 GLU 94 2HB GLU 94 -0.972 14.260 8.202
680 HB3 GLU 94 1HB GLU 94 0.203 15.497 7.808
681 HG2 GLU 94 2HG GLU 94 -1.721 16.453 8.902
682 HG3 GLU 94 1HG GLU 94 -1.562 17.050 7.263
683 H ILE 95 H ILE 95 -0.365 12.096 6.441
684 HA ILE 95 HA ILE 95 -2.985 11.432 5.329
685 HB ILE 95 HB ILE 95 -1.078 11.437 3.601
686 HG12 ILE 95 2HG1 ILE 95 -1.769 9.237 2.616
687 HG13 ILE 95 1HG1 ILE 95 -2.762 8.995 4.058
688 HG21 ILE 95 1HG2 ILE 95 0.345 9.445 3.489
689 HG22 ILE 95 2HG2 ILE 95 -0.241 8.963 5.081
690 HG23 ILE 95 3HG2 ILE 95 0.681 10.457 4.893
691 HD11 ILE 95 3HD1 ILE 95 -3.019 11.177 1.992
692 HD12 ILE 95 1HD1 ILE 95 -3.915 11.137 3.518
693 HD13 ILE 95 2HD1 ILE 95 -4.146 9.857 2.355
694 H ILE 96 H ILE 96 -3.817 9.371 6.135
695 HA ILE 96 HA ILE 96 -2.194 8.206 8.285
696 HB ILE 96 HB ILE 96 -5.218 8.232 7.944
697 HG12 ILE 96 2HG1 ILE 96 -4.325 10.360 8.727
698 HG13 ILE 96 1HG1 ILE 96 -5.263 9.561 9.989
699 HG21 ILE 96 1HG2 ILE 96 -4.522 6.111 8.911
700 HG22 ILE 96 2HG2 ILE 96 -5.349 7.098 10.116
701 HG23 ILE 96 3HG2 ILE 96 -3.590 6.963 10.144
702 HD11 ILE 96 3HD1 ILE 96 -3.143 8.836 11.033
703 HD12 ILE 96 1HD1 ILE 96 -3.287 10.591 10.920
704 HD13 ILE 96 2HD1 ILE 96 -2.263 9.723 9.784
705 H VAL 97 H VAL 97 -1.657 6.153 8.055
706 HA VAL 97 HA VAL 97 -2.412 4.846 5.581
707 HB VAL 97 HB VAL 97 -0.440 4.043 7.732
708 HG11 VAL 97 1HG1 VAL 97 -1.326 2.085 6.562
709 HG12 VAL 97 2HG1 VAL 97 0.361 2.386 6.130
710 HG13 VAL 97 3HG1 VAL 97 -0.932 2.833 5.010
711 HG21 VAL 97 3HG2 VAL 97 1.228 4.709 6.115
712 HG22 VAL 97 1HG2 VAL 97 0.143 6.048 6.477
713 HG23 VAL 97 2HG2 VAL 97 -0.036 5.145 4.965
714 H ARG 98 H ARG 98 -3.871 3.280 5.418
715 HA ARG 98 HA ARG 98 -4.845 1.968 7.846
716 HB2 ARG 98 2HB ARG 98 -6.390 2.884 5.421
717 HB3 ARG 98 1HB ARG 98 -7.049 1.971 6.768
718 HG2 ARG 98 2HG ARG 98 -5.729 4.550 7.386
719 HG3 ARG 98 1HG ARG 98 -7.269 4.607 6.543
720 HD2 ARG 98 2HD ARG 98 -7.479 4.801 8.982
721 HD3 ARG 98 1HD ARG 98 -8.353 3.407 8.328
722 HE ARG 98 HE ARG 98 -6.161 2.243 9.228
723 HH11 ARG 98 1HH1 ARG 98 -7.968 4.967 10.719
724 HH12 ARG 98 2HH1 ARG 98 -7.752 4.381 12.295
725 HH21 ARG 98 1HH2 ARG 98 -5.967 1.459 11.467
726 HH22 ARG 98 2HH2 ARG 98 -6.641 2.369 12.723
727 H MET 99 H MET 99 -5.441 -0.096 7.578
728 HA MET 99 HA MET 99 -4.814 -1.314 4.992
729 HB2 MET 99 2HB MET 99 -4.018 -2.438 7.685
730 HB3 MET 99 1HB MET 99 -3.942 -3.325 6.177
731 HG2 MET 99 2HG MET 99 -2.351 -1.699 5.292
732 HG3 MET 99 1HG MET 99 -2.408 -0.818 6.813
733 HE1 MET 99 3HE MET 99 0.271 -1.903 5.393
734 HE2 MET 99 1HE MET 99 1.155 -2.491 6.801
735 HE3 MET 99 2HE MET 99 0.267 -0.970 6.889
736 H HIS 100 H HIS 100 -6.256 -2.526 4.225
737 HA HIS 100 HA HIS 100 -8.387 -3.597 5.931
738 HB2 HIS 100 2HB HIS 100 -8.470 -2.742 3.001
739 HB3 HIS 100 1HB HIS 100 -9.784 -3.550 3.833
740 HD1 HIS 100 1HD HIS 100 -11.547 -1.978 4.622
741 HD2 HIS 100 2HD HIS 100 -7.848 -0.113 4.313
742 HE1 HIS 100 1HE HIS 100 -11.940 0.427 5.193
Start of MODEL 28
1 H1 GLY 1 1HT GLY 1 -3.545 -9.113 -8.968
2 H2 GLY 1 2HT GLY 1 -3.219 -8.084 -7.651
3 H3 GLY 1 3HT GLY 1 -3.402 -7.439 -9.198
4 HA2 GLY 1 1HA GLY 1 -5.711 -8.080 -9.223
5 HA3 GLY 1 2HA GLY 1 -5.485 -8.773 -7.619
6 H HIS 2 H HIS 2 -7.303 -6.644 -8.423
7 HA HIS 2 HA HIS 2 -6.262 -4.231 -7.336
8 HB2 HIS 2 2HB HIS 2 -8.072 -4.532 -9.128
9 HB3 HIS 2 1HB HIS 2 -9.149 -4.952 -7.799
10 HD1 HIS 2 1HD HIS 2 -10.375 -2.963 -6.834
11 HD2 HIS 2 2HD HIS 2 -6.857 -2.048 -8.765
12 HE1 HIS 2 1HE HIS 2 -10.266 -0.440 -6.863
13 H GLY 3 H GLY 3 -5.598 -4.892 -5.263
14 HA2 GLY 3 2HA GLY 3 -6.074 -4.780 -2.973
15 HA3 GLY 3 1HA GLY 3 -7.763 -5.140 -3.335
16 H SER 4 H SER 4 -8.019 -6.839 -2.020
17 HA SER 4 HA SER 4 -7.967 -8.927 -1.229
18 HB2 SER 4 2HB SER 4 -8.670 -9.335 -3.612
19 HB3 SER 4 1HB SER 4 -6.986 -9.624 -4.027
20 HG SER 4 HG SER 4 -7.704 -11.163 -1.925
21 H ALA 5 H ALA 5 -5.676 -10.709 -2.801
22 HA ALA 5 HA ALA 5 -3.617 -11.470 -2.460
23 HB1 ALA 5 1HB ALA 5 -2.962 -8.818 -1.164
24 HB2 ALA 5 2HB ALA 5 -2.862 -9.150 -2.895
25 HB3 ALA 5 3HB ALA 5 -1.804 -10.002 -1.772
26 H GLY 6 H GLY 6 -4.922 -9.906 0.307
27 HA2 GLY 6 2HA GLY 6 -5.344 -11.757 2.091
28 HA3 GLY 6 1HA GLY 6 -3.577 -11.683 2.178
29 H THR 7 H THR 7 -2.853 -9.300 1.965
30 HA THR 7 HA THR 7 -4.329 -7.805 3.978
31 HB THR 7 HB THR 7 -1.440 -7.617 3.081
32 HG1 THR 7 1HG THR 7 -2.711 -8.644 5.392
33 HG21 THR 7 3HG2 THR 7 -1.160 -6.070 4.987
34 HG22 THR 7 1HG2 THR 7 -2.893 -6.164 5.310
35 HG23 THR 7 2HG2 THR 7 -2.311 -5.437 3.811
36 H SER 8 H SER 8 -5.574 -6.296 3.111
37 HA SER 8 HA SER 8 -4.708 -5.024 0.621
38 HB2 SER 8 2HB SER 8 -7.423 -4.829 1.974
39 HB3 SER 8 1HB SER 8 -7.012 -4.391 0.322
40 HG SER 8 HG SER 8 -6.285 -6.825 0.400
41 H VAL 9 H VAL 9 -3.765 -3.029 0.871
42 HA VAL 9 HA VAL 9 -4.223 -1.744 3.433
43 HB VAL 9 HB VAL 9 -1.928 -2.413 3.272
44 HG11 VAL 9 1HG1 VAL 9 -1.838 -1.018 0.630
45 HG12 VAL 9 2HG1 VAL 9 -1.725 -2.759 0.910
46 HG13 VAL 9 3HG1 VAL 9 -0.435 -1.688 1.464
47 HG21 VAL 9 3HG2 VAL 9 -2.275 -0.232 4.266
48 HG22 VAL 9 1HG2 VAL 9 -2.124 0.540 2.687
49 HG23 VAL 9 2HG2 VAL 9 -0.732 -0.275 3.407
50 H THR 10 H THR 10 -5.092 0.122 3.546
51 HA THR 10 HA THR 10 -5.567 1.665 1.109
52 HB THR 10 HB THR 10 -7.529 1.216 3.383
53 HG1 THR 10 1HG THR 10 -8.277 -0.461 2.359
54 HG21 THR 10 3HG2 THR 10 -9.169 2.158 1.789
55 HG22 THR 10 1HG2 THR 10 -7.879 2.395 0.611
56 HG23 THR 10 2HG2 THR 10 -7.869 3.304 2.121
57 H LEU 11 H LEU 11 -5.206 3.810 1.406
58 HA LEU 11 HA LEU 11 -4.269 4.509 4.058
59 HB2 LEU 11 2HB LEU 11 -3.052 6.343 2.977
60 HB3 LEU 11 1HB LEU 11 -2.569 4.774 2.383
61 HG LEU 11 HG LEU 11 -4.109 5.343 0.365
62 HD11 LEU 11 1HD1 LEU 11 -3.678 8.098 1.491
63 HD12 LEU 11 2HD1 LEU 11 -5.227 7.279 1.269
64 HD13 LEU 11 3HD1 LEU 11 -4.260 7.742 -0.132
65 HD21 LEU 11 3HD2 LEU 11 -1.526 6.822 0.819
66 HD22 LEU 11 1HD2 LEU 11 -2.269 6.505 -0.748
67 HD23 LEU 11 2HD2 LEU 11 -1.692 5.163 0.243
68 H GLN 12 H GLN 12 -5.005 6.268 5.149
69 HA GLN 12 HA GLN 12 -7.382 7.573 4.040
70 HB2 GLN 12 2HB GLN 12 -6.480 7.095 6.867
71 HB3 GLN 12 1HB GLN 12 -7.751 8.227 6.427
72 HG2 GLN 12 2HG GLN 12 -8.992 6.336 5.440
73 HG3 GLN 12 1HG GLN 12 -7.750 5.251 6.079
74 HE21 GLN 12 1HE2 GLN 12 -10.177 7.570 6.869
75 HE22 GLN 12 2HE2 GLN 12 -10.463 7.032 8.487
76 H LEU 13 H LEU 13 -7.213 9.685 3.703
77 HA LEU 13 HA LEU 13 -4.784 10.971 4.740
78 HB2 LEU 13 2HB LEU 13 -4.292 12.024 2.658
79 HB3 LEU 13 1HB LEU 13 -4.461 10.307 2.362
80 HG LEU 13 HG LEU 13 -6.950 11.189 1.854
81 HD11 LEU 13 1HD1 LEU 13 -6.797 13.171 0.400
82 HD12 LEU 13 2HD1 LEU 13 -5.125 13.388 0.924
83 HD13 LEU 13 3HD1 LEU 13 -6.437 13.510 2.093
84 HD21 LEU 13 3HD2 LEU 13 -4.665 10.972 -0.102
85 HD22 LEU 13 1HD2 LEU 13 -6.371 10.968 -0.547
86 HD23 LEU 13 2HD2 LEU 13 -5.713 9.664 0.442
87 H ASP 14 H ASP 14 -4.883 13.070 5.125
88 HA ASP 14 HA ASP 14 -7.569 14.032 5.608
89 HB2 ASP 14 2HB ASP 14 -6.116 14.049 7.558
90 HB3 ASP 14 1HB ASP 14 -4.958 15.065 6.698
91 H ASP 15 H ASP 15 -8.283 14.957 3.969
92 HA ASP 15 HA ASP 15 -6.655 16.813 2.409
93 HB2 ASP 15 2HB ASP 15 -7.716 15.279 0.980
94 HB3 ASP 15 1HB ASP 15 -9.220 15.340 1.886
95 H GLY 16 H GLY 16 -9.359 16.518 4.482
96 HA2 GLY 16 2HA GLY 16 -10.159 18.520 5.622
97 HA3 GLY 16 1HA GLY 16 -10.196 19.290 4.031
98 H SER 17 H SER 17 -10.994 17.002 2.596
99 HA SER 17 HA SER 17 -13.826 16.979 3.226
100 HB2 SER 17 2HB SER 17 -12.395 15.486 1.010
101 HB3 SER 17 1HB SER 17 -14.093 15.965 1.064
102 HG SER 17 HG SER 17 -11.789 17.479 0.583
103 H GLY 18 H GLY 18 -11.055 14.845 3.057
104 HA2 GLY 18 2HA GLY 18 -10.742 13.014 4.569
105 HA3 GLY 18 1HA GLY 18 -12.495 12.817 4.622
106 H ARG 19 H ARG 19 -9.600 12.112 2.895
107 HA ARG 19 HA ARG 19 -11.222 10.515 1.070
108 HB2 ARG 19 2HB ARG 19 -8.763 12.094 0.408
109 HB3 ARG 19 1HB ARG 19 -9.315 10.730 -0.562
110 HG2 ARG 19 2HG ARG 19 -10.958 13.191 0.054
111 HG3 ARG 19 1HG ARG 19 -10.064 12.927 -1.446
112 HD2 ARG 19 2HD ARG 19 -11.418 11.021 -1.997
113 HD3 ARG 19 1HD ARG 19 -12.197 11.050 -0.422
114 HE ARG 19 HE ARG 19 -12.495 13.364 -2.128
115 HH11 ARG 19 1HH1 ARG 19 -13.881 10.383 -0.788
116 HH12 ARG 19 2HH1 ARG 19 -15.500 10.834 -1.058
117 HH21 ARG 19 1HH2 ARG 19 -14.735 13.973 -2.545
118 HH22 ARG 19 2HH2 ARG 19 -15.997 12.927 -2.089
119 H THR 20 H THR 20 -10.357 8.647 0.206
120 HA THR 20 HA THR 20 -8.230 7.435 1.751
121 HB THR 20 HB THR 20 -9.634 5.344 1.756
122 HG1 THR 20 1HG THR 20 -11.785 5.501 1.241
123 HG21 THR 20 3HG2 THR 20 -9.469 6.861 3.703
124 HG22 THR 20 1HG2 THR 20 -11.017 5.991 3.658
125 HG23 THR 20 2HG2 THR 20 -10.918 7.681 3.144
126 H TYR 21 H TYR 21 -7.184 5.749 0.536
127 HA TYR 21 HA TYR 21 -7.924 5.347 -2.247
128 HB2 TYR 21 2HB TYR 21 -6.528 7.455 -2.191
129 HB3 TYR 21 1HB TYR 21 -5.238 6.513 -1.471
130 HD1 TYR 21 2HD TYR 21 -7.151 7.148 -4.528
131 HD2 TYR 21 1HD TYR 21 -3.847 5.069 -2.845
132 HE1 TYR 21 2HE TYR 21 -6.314 6.666 -6.783
133 HE2 TYR 21 1HE TYR 21 -2.990 4.595 -5.106
134 HH TYR 21 HH TYR 21 -4.049 4.418 -7.499
135 H GLN 22 H GLN 22 -7.390 3.232 -2.756
136 HA GLN 22 HA GLN 22 -5.807 1.891 -0.734
137 HB2 GLN 22 2HB GLN 22 -8.005 0.892 -1.315
138 HB3 GLN 22 1HB GLN 22 -7.428 0.633 -2.956
139 HG2 GLN 22 2HG GLN 22 -5.774 -0.930 -2.206
140 HG3 GLN 22 1HG GLN 22 -6.111 -0.547 -0.526
141 HE21 GLN 22 1HE2 GLN 22 -7.926 -1.318 0.417
142 HE22 GLN 22 2HE2 GLN 22 -8.857 -2.622 -0.247
143 H LEU 23 H LEU 23 -3.988 0.736 -1.118
144 HA LEU 23 HA LEU 23 -2.400 1.772 -3.272
145 HB2 LEU 23 2HB LEU 23 -1.845 -0.208 -1.106
146 HB3 LEU 23 1HB LEU 23 -0.630 0.328 -2.227
147 HG LEU 23 HG LEU 23 -2.060 2.036 -0.179
148 HD11 LEU 23 1HD1 LEU 23 0.199 2.227 0.807
149 HD12 LEU 23 2HD1 LEU 23 0.761 1.016 -0.362
150 HD13 LEU 23 3HD1 LEU 23 -0.449 0.589 0.837
151 HD21 LEU 23 3HD2 LEU 23 -1.587 3.372 -2.155
152 HD22 LEU 23 1HD2 LEU 23 0.078 2.780 -2.174
153 HD23 LEU 23 2HD2 LEU 23 -0.475 3.799 -0.854
154 H ARG 24 H ARG 24 -2.100 0.853 -5.144
155 HA ARG 24 HA ARG 24 -3.257 -1.737 -5.733
156 HB2 ARG 24 2HB ARG 24 -1.481 -0.147 -7.576
157 HB3 ARG 24 1HB ARG 24 -2.712 -1.327 -7.989
158 HG2 ARG 24 2HG ARG 24 -3.147 1.457 -6.943
159 HG3 ARG 24 1HG ARG 24 -3.441 0.874 -8.577
160 HD2 ARG 24 2HD ARG 24 -5.207 -0.592 -7.738
161 HD3 ARG 24 1HD ARG 24 -4.881 -0.032 -6.090
162 HE ARG 24 HE ARG 24 -5.537 1.917 -8.135
163 HH11 ARG 24 1HH1 ARG 24 -6.670 0.119 -5.300
164 HH12 ARG 24 2HH1 ARG 24 -7.871 1.275 -4.902
165 HH21 ARG 24 1HH2 ARG 24 -7.169 3.482 -7.581
166 HH22 ARG 24 2HH2 ARG 24 -8.152 3.189 -6.220
167 H GLU 25 H GLU 25 -1.948 -3.512 -6.480
168 HA GLU 25 HA GLU 25 0.622 -3.494 -5.237
169 HB2 GLU 25 2HB GLU 25 0.827 -5.860 -6.001
170 HB3 GLU 25 1HB GLU 25 -0.567 -5.549 -4.987
171 HG2 GLU 25 2HG GLU 25 -1.965 -5.487 -7.011
172 HG3 GLU 25 1HG GLU 25 -0.541 -5.908 -7.967
173 H GLY 26 H GLY 26 2.366 -3.061 -5.959
174 HA2 GLY 26 2HA GLY 26 3.869 -3.094 -7.982
175 HA3 GLY 26 1HA GLY 26 2.579 -2.102 -8.697
176 H SER 27 H SER 27 4.461 -0.479 -8.650
177 HA SER 27 HA SER 27 4.436 0.639 -5.994
178 HB2 SER 27 2HB SER 27 6.427 1.973 -6.783
179 HB3 SER 27 1HB SER 27 6.642 0.236 -6.616
180 HG SER 27 HG SER 27 6.995 0.035 -8.620
181 H ASN 28 H ASN 28 3.910 2.781 -5.694
182 HA ASN 28 HA ASN 28 2.700 4.172 -7.960
183 HB2 ASN 28 2HB ASN 28 0.967 5.038 -6.409
184 HB3 ASN 28 1HB ASN 28 0.842 3.294 -6.638
185 HD21 ASN 28 1HD2 ASN 28 1.431 1.932 -4.878
186 HD22 ASN 28 2HD2 ASN 28 1.511 2.568 -3.275
187 H ILE 29 H ILE 29 2.897 6.406 -7.902
188 HA ILE 29 HA ILE 29 4.837 7.372 -5.936
189 HB ILE 29 HB ILE 29 4.712 8.081 -8.891
190 HG12 ILE 29 2HG1 ILE 29 6.809 6.518 -7.341
191 HG13 ILE 29 1HG1 ILE 29 5.627 5.826 -8.436
192 HG21 ILE 29 1HG2 ILE 29 6.744 9.381 -8.486
193 HG22 ILE 29 2HG2 ILE 29 6.665 8.997 -6.767
194 HG23 ILE 29 3HG2 ILE 29 5.409 9.991 -7.507
195 HD11 ILE 29 3HD1 ILE 29 7.786 7.771 -9.215
196 HD12 ILE 29 1HD1 ILE 29 6.635 6.980 -10.291
197 HD13 ILE 29 2HD1 ILE 29 7.847 6.020 -9.437
198 H ILE 30 H ILE 30 4.343 9.196 -4.960
199 HA ILE 30 HA ILE 30 1.885 10.588 -5.698
200 HB ILE 30 HB ILE 30 3.263 10.272 -2.999
201 HG12 ILE 30 2HG1 ILE 30 0.535 9.346 -3.924
202 HG13 ILE 30 1HG1 ILE 30 1.947 8.309 -3.765
203 HG21 ILE 30 1HG2 ILE 30 0.958 12.031 -3.692
204 HG22 ILE 30 2HG2 ILE 30 2.501 12.459 -2.959
205 HG23 ILE 30 3HG2 ILE 30 1.334 11.495 -2.058
206 HD11 ILE 30 3HD1 ILE 30 1.957 8.765 -1.350
207 HD12 ILE 30 1HD1 ILE 30 0.442 8.043 -1.891
208 HD13 ILE 30 2HD1 ILE 30 0.521 9.770 -1.553
209 H GLY 31 H GLY 31 2.032 12.646 -6.274
210 HA2 GLY 31 2HA GLY 31 3.264 14.755 -5.324
211 HA3 GLY 31 1HA GLY 31 4.597 14.018 -6.234
212 H ARG 32 H ARG 32 4.521 15.936 -7.559
213 HA ARG 32 HA ARG 32 2.500 15.508 -9.615
214 HB2 ARG 32 2HB ARG 32 3.372 18.219 -8.604
215 HB3 ARG 32 1HB ARG 32 2.475 17.974 -10.094
216 HG2 ARG 32 2HG ARG 32 0.755 16.763 -8.601
217 HG3 ARG 32 1HG ARG 32 1.610 17.524 -7.279
218 HD2 ARG 32 2HD ARG 32 0.539 19.091 -9.602
219 HD3 ARG 32 1HD ARG 32 -0.388 18.781 -8.136
220 HE ARG 32 HE ARG 32 1.336 20.000 -6.923
221 HH11 ARG 32 1HH1 ARG 32 1.313 20.517 -10.441
222 HH12 ARG 32 2HH1 ARG 32 1.791 22.141 -10.337
223 HH21 ARG 32 1HH2 ARG 32 1.937 22.233 -6.815
224 HH22 ARG 32 2HH2 ARG 32 2.121 23.159 -8.252
225 H GLY 33 H GLY 33 3.536 14.676 -11.176
226 HA2 GLY 33 2HA GLY 33 5.528 16.016 -12.615
227 HA3 GLY 33 1HA GLY 33 6.220 14.720 -11.641
228 H GLN 34 H GLN 34 6.725 13.859 -13.759
229 HA GLN 34 HA GLN 34 4.580 12.877 -15.407
230 HB2 GLN 34 2HB GLN 34 7.550 12.351 -15.507
231 HB3 GLN 34 1HB GLN 34 6.394 11.938 -16.763
232 HG2 GLN 34 2HG GLN 34 5.946 14.248 -17.203
233 HG3 GLN 34 1HG GLN 34 6.910 14.740 -15.813
234 HE21 GLN 34 1HE2 GLN 34 8.227 16.014 -17.067
235 HE22 GLN 34 2HE2 GLN 34 9.396 15.378 -18.149
236 H ASP 35 H ASP 35 6.907 11.573 -13.118
237 HA ASP 35 HA ASP 35 6.014 8.854 -13.489
238 HB2 ASP 35 2HB ASP 35 7.853 10.061 -11.403
239 HB3 ASP 35 1HB ASP 35 7.473 8.349 -11.494
240 H ALA 36 H ALA 36 5.084 11.509 -11.649
241 HA ALA 36 HA ALA 36 3.978 10.184 -9.391
242 HB1 ALA 36 1HB ALA 36 2.883 12.289 -8.918
243 HB2 ALA 36 2HB ALA 36 3.294 12.877 -10.530
244 HB3 ALA 36 3HB ALA 36 4.571 12.553 -9.355
245 H GLN 37 H GLN 37 2.178 9.100 -9.227
246 HA GLN 37 HA GLN 37 0.318 9.038 -11.474
247 HB2 GLN 37 2HB GLN 37 0.625 7.209 -9.091
248 HB3 GLN 37 1HB GLN 37 -0.441 6.965 -10.462
249 HG2 GLN 37 2HG GLN 37 2.573 6.979 -10.545
250 HG3 GLN 37 1HG GLN 37 1.542 5.553 -10.604
251 HE21 GLN 37 1HE2 GLN 37 2.829 8.226 -12.371
252 HE22 GLN 37 2HE2 GLN 37 2.256 7.765 -13.919
253 H PHE 38 H PHE 38 0.539 9.325 -7.975
254 HA PHE 38 HA PHE 38 -2.199 10.311 -7.859
255 HB2 PHE 38 2HB PHE 38 -1.610 8.467 -6.329
256 HB3 PHE 38 1HB PHE 38 -0.269 9.417 -5.712
257 HD1 PHE 38 2HD PHE 38 -0.686 11.301 -4.219
258 HD2 PHE 38 1HD PHE 38 -3.878 8.887 -5.629
259 HE1 PHE 38 2HE PHE 38 -2.051 12.165 -2.460
260 HE2 PHE 38 1HE PHE 38 -5.326 9.773 -3.843
261 HZ PHE 38 HZ PHE 38 -4.425 11.425 -2.242
262 H ARG 39 H ARG 39 -2.451 12.400 -7.679
263 HA ARG 39 HA ARG 39 -0.034 13.998 -7.504
264 HB2 ARG 39 2HB ARG 39 -2.730 14.535 -8.676
265 HB3 ARG 39 1HB ARG 39 -1.551 15.811 -8.411
266 HG2 ARG 39 2HG ARG 39 -0.003 14.778 -9.909
267 HG3 ARG 39 1HG ARG 39 -1.027 13.352 -10.057
268 HD2 ARG 39 2HD ARG 39 -1.201 14.866 -11.991
269 HD3 ARG 39 1HD ARG 39 -2.727 14.617 -11.165
270 HE ARG 39 HE ARG 39 -2.196 16.845 -10.064
271 HH11 ARG 39 1HH1 ARG 39 -1.160 16.033 -13.367
272 HH12 ARG 39 2HH1 ARG 39 -1.299 17.626 -13.942
273 HH21 ARG 39 1HH2 ARG 39 -2.367 19.078 -10.916
274 HH22 ARG 39 2HH2 ARG 39 -2.002 19.339 -12.563
275 H LEU 40 H LEU 40 0.351 15.330 -5.959
276 HA LEU 40 HA LEU 40 -1.734 15.861 -4.035
277 HB2 LEU 40 2HB LEU 40 1.192 16.499 -3.987
278 HB3 LEU 40 1HB LEU 40 0.064 17.074 -2.783
279 HG LEU 40 HG LEU 40 0.873 14.227 -3.303
280 HD11 LEU 40 1HD1 LEU 40 1.676 14.400 -1.018
281 HD12 LEU 40 2HD1 LEU 40 1.100 16.078 -0.990
282 HD13 LEU 40 3HD1 LEU 40 2.428 15.622 -2.071
283 HD21 LEU 40 3HD2 LEU 40 -0.596 13.658 -1.408
284 HD22 LEU 40 1HD2 LEU 40 -1.518 14.275 -2.783
285 HD23 LEU 40 2HD2 LEU 40 -1.205 15.314 -1.396
286 HA PRO 41 HA PRO 41 -2.341 19.541 -6.563
287 HB2 PRO 41 2HB PRO 41 -4.355 20.237 -4.534
288 HB3 PRO 41 1HB PRO 41 -4.575 19.896 -6.250
289 HG2 PRO 41 2HG PRO 41 -5.419 18.179 -4.374
290 HG3 PRO 41 1HG PRO 41 -4.744 17.610 -5.910
291 HD2 PRO 41 2HD PRO 41 -3.411 17.816 -3.225
292 HD3 PRO 41 1HD PRO 41 -3.374 16.472 -4.373
293 H ASP 42 H ASP 42 -0.478 19.515 -4.097
294 HA ASP 42 HA ASP 42 -0.925 22.232 -3.120
295 HB2 ASP 42 2HB ASP 42 -0.375 20.062 -1.664
296 HB3 ASP 42 1HB ASP 42 1.277 20.577 -2.010
297 H THR 43 H THR 43 1.459 23.255 -2.586
298 HA THR 43 HA THR 43 2.841 23.171 -5.151
299 HB THR 43 HB THR 43 2.489 25.546 -3.297
300 HG1 THR 43 1HG THR 43 0.529 25.093 -4.237
301 HG21 THR 43 3HG2 THR 43 3.540 25.305 -6.116
302 HG22 THR 43 1HG2 THR 43 4.506 25.617 -4.671
303 HG23 THR 43 2HG2 THR 43 3.327 26.817 -5.224
304 H GLY 44 H GLY 44 4.996 22.840 -5.055
305 HA2 GLY 44 2HA GLY 44 7.129 23.111 -3.987
306 HA3 GLY 44 1HA GLY 44 6.318 22.978 -2.428
307 H VAL 45 H VAL 45 4.818 20.907 -4.336
308 HA VAL 45 HA VAL 45 6.030 18.608 -3.114
309 HB VAL 45 HB VAL 45 3.883 18.659 -5.266
310 HG11 VAL 45 1HG1 VAL 45 4.564 16.586 -3.220
311 HG12 VAL 45 2HG1 VAL 45 4.849 16.498 -4.958
312 HG13 VAL 45 3HG1 VAL 45 3.200 16.534 -4.332
313 HG21 VAL 45 3HG2 VAL 45 3.153 20.058 -3.410
314 HG22 VAL 45 1HG2 VAL 45 3.509 18.753 -2.275
315 HG23 VAL 45 2HG2 VAL 45 2.227 18.557 -3.472
316 H SER 46 H SER 46 7.289 17.111 -4.161
317 HA SER 46 HA SER 46 8.580 18.093 -6.529
318 HB2 SER 46 2HB SER 46 9.165 15.661 -4.843
319 HB3 SER 46 1HB SER 46 10.249 16.437 -6.013
320 HG SER 46 HG SER 46 9.311 18.273 -4.391
321 H ARG 47 H ARG 47 9.141 16.493 -8.277
322 HA ARG 47 HA ARG 47 6.772 15.566 -9.495
323 HB2 ARG 47 2HB ARG 47 8.226 14.621 -11.242
324 HB3 ARG 47 1HB ARG 47 8.675 16.268 -10.844
325 HG2 ARG 47 2HG ARG 47 10.525 15.428 -9.504
326 HG3 ARG 47 1HG ARG 47 10.075 13.766 -9.892
327 HD2 ARG 47 2HD ARG 47 10.425 14.358 -12.306
328 HD3 ARG 47 1HD ARG 47 11.054 15.911 -11.759
329 HE ARG 47 HE ARG 47 12.321 13.686 -10.514
330 HH11 ARG 47 1HH1 ARG 47 12.367 15.787 -13.365
331 HH12 ARG 47 2HH1 ARG 47 13.972 15.396 -13.789
332 HH21 ARG 47 1HH2 ARG 47 14.528 13.128 -11.153
333 HH22 ARG 47 2HH2 ARG 47 15.203 13.880 -12.531
334 H ARG 48 H ARG 48 9.287 13.984 -7.748
335 HA ARG 48 HA ARG 48 7.514 11.751 -7.231
336 HB2 ARG 48 2HB ARG 48 10.550 11.693 -7.557
337 HB3 ARG 48 1HB ARG 48 9.574 10.345 -6.995
338 HG2 ARG 48 2HG ARG 48 8.491 10.171 -9.144
339 HG3 ARG 48 1HG ARG 48 9.336 11.605 -9.720
340 HD2 ARG 48 2HD ARG 48 10.358 9.586 -10.582
341 HD3 ARG 48 1HD ARG 48 11.468 10.424 -9.507
342 HE ARG 48 HE ARG 48 10.192 8.533 -7.937
343 HH11 ARG 48 1HH1 ARG 48 12.238 8.456 -10.831
344 HH12 ARG 48 2HH1 ARG 48 12.854 6.897 -10.482
345 HH21 ARG 48 1HH2 ARG 48 10.992 6.511 -7.506
346 HH22 ARG 48 2HH2 ARG 48 12.135 5.744 -8.532
347 H HIS 49 H HIS 49 6.873 12.429 -5.350
348 HA HIS 49 HA HIS 49 8.720 13.883 -3.593
349 HB2 HIS 49 2HB HIS 49 6.740 15.140 -4.041
350 HB3 HIS 49 1HB HIS 49 5.669 13.803 -3.747
351 HD2 HIS 49 2HD HIS 49 5.862 13.034 -0.821
352 HE1 HIS 49 1HE HIS 49 6.149 17.110 0.162
353 HE2 HIS 49 2HE HIS 49 6.050 14.767 1.051
354 H LEU 50 H LEU 50 6.582 11.158 -3.779
355 HA LEU 50 HA LEU 50 8.080 9.745 -1.860
356 HB2 LEU 50 2HB LEU 50 6.717 11.025 -0.323
357 HB3 LEU 50 1HB LEU 50 5.269 10.677 -1.227
358 HG LEU 50 HG LEU 50 6.768 8.410 0.030
359 HD11 LEU 50 1HD1 LEU 50 4.831 10.276 1.440
360 HD12 LEU 50 2HD1 LEU 50 6.555 10.162 1.781
361 HD13 LEU 50 3HD1 LEU 50 5.501 8.793 2.117
362 HD21 LEU 50 3HD2 LEU 50 4.825 7.956 -1.400
363 HD22 LEU 50 1HD2 LEU 50 3.832 8.997 -0.378
364 HD23 LEU 50 2HD2 LEU 50 4.504 7.501 0.274
365 H GLU 51 H GLU 51 7.603 7.571 -2.037
366 HA GLU 51 HA GLU 51 5.546 6.806 -3.913
367 HB2 GLU 51 2HB GLU 51 7.291 5.425 -5.170
368 HB3 GLU 51 1HB GLU 51 7.225 7.156 -5.472
369 HG2 GLU 51 2HG GLU 51 9.098 7.454 -3.897
370 HG3 GLU 51 1HG GLU 51 9.217 5.705 -3.762
371 H ILE 52 H ILE 52 4.874 4.784 -3.753
372 HA ILE 52 HA ILE 52 5.853 3.311 -1.410
373 HB ILE 52 HB ILE 52 3.011 3.568 -2.420
374 HG12 ILE 52 2HG1 ILE 52 4.261 4.552 0.157
375 HG13 ILE 52 1HG1 ILE 52 3.853 5.567 -1.218
376 HG21 ILE 52 1HG2 ILE 52 4.119 2.017 -0.083
377 HG22 ILE 52 2HG2 ILE 52 3.457 1.354 -1.578
378 HG23 ILE 52 3HG2 ILE 52 2.399 2.228 -0.452
379 HD11 ILE 52 3HD1 ILE 52 1.901 4.003 0.463
380 HD12 ILE 52 1HD1 ILE 52 1.491 5.040 -0.904
381 HD13 ILE 52 2HD1 ILE 52 2.193 5.743 0.553
382 H ARG 53 H ARG 53 6.434 1.320 -1.830
383 HA ARG 53 HA ARG 53 5.664 0.131 -4.399
384 HB2 ARG 53 2HB ARG 53 8.110 0.475 -3.932
385 HB3 ARG 53 1HB ARG 53 7.959 -0.626 -2.582
386 HG2 ARG 53 2HG ARG 53 7.289 -2.412 -4.125
387 HG3 ARG 53 1HG ARG 53 7.512 -1.301 -5.480
388 HD2 ARG 53 2HD ARG 53 9.849 -0.966 -4.716
389 HD3 ARG 53 1HD ARG 53 9.594 -2.252 -3.533
390 HE ARG 53 HE ARG 53 9.245 -2.699 -6.408
391 HH11 ARG 53 1HH1 ARG 53 10.853 -3.609 -3.372
392 HH12 ARG 53 2HH1 ARG 53 11.613 -4.961 -4.001
393 HH21 ARG 53 1HH2 ARG 53 10.340 -4.551 -7.306
394 HH22 ARG 53 2HH2 ARG 53 11.311 -5.530 -6.307
395 H TRP 54 H TRP 54 3.997 -1.215 -4.118
396 HA TRP 54 HA TRP 54 3.890 -2.658 -1.598
397 HB2 TRP 54 2HB TRP 54 2.014 -1.180 -1.640
398 HB3 TRP 54 1HB TRP 54 1.661 -1.586 -3.319
399 HD1 TRP 54 HD TRP 54 -0.357 -3.243 -3.540
400 HE1 TRP 54 1HE TRP 54 -1.401 -5.121 -2.071
401 HE3 TRP 54 3HE TRP 54 2.743 -3.017 0.479
402 HZ2 TRP 54 2HZ TRP 54 -0.996 -6.290 0.413
403 HZ3 TRP 54 3HZ TRP 54 2.369 -4.530 2.355
404 HH2 TRP 54 HH TRP 54 0.524 -6.144 2.337
405 H ASP 55 H ASP 55 3.909 -4.764 -1.687
406 HA ASP 55 HA ASP 55 2.773 -6.148 -3.889
407 HB2 ASP 55 2HB ASP 55 4.666 -7.550 -4.408
408 HB3 ASP 55 1HB ASP 55 5.187 -5.887 -4.556
409 H GLY 56 H GLY 56 3.468 -8.734 -3.079
410 HA2 GLY 56 2HA GLY 56 1.715 -8.730 -0.818
411 HA3 GLY 56 1HA GLY 56 2.263 -10.175 -1.669
412 H GLN 57 H GLN 57 4.916 -8.346 -0.852
413 HA GLN 57 HA GLN 57 5.430 -10.000 1.470
414 HB2 GLN 57 2HB GLN 57 7.052 -9.855 -0.307
415 HB3 GLN 57 1HB GLN 57 7.213 -8.129 -0.076
416 HG2 GLN 57 2HG GLN 57 8.034 -8.514 2.221
417 HG3 GLN 57 1HG GLN 57 7.984 -10.250 1.929
418 HE21 GLN 57 1HE2 GLN 57 10.147 -10.406 2.317
419 HE22 GLN 57 2HE2 GLN 57 11.354 -9.887 1.188
420 H VAL 58 H VAL 58 6.244 -6.581 0.809
421 HA VAL 58 HA VAL 58 5.204 -5.875 3.441
422 HB VAL 58 HB VAL 58 7.212 -4.410 3.833
423 HG11 VAL 58 1HG1 VAL 58 8.706 -6.189 4.620
424 HG12 VAL 58 2HG1 VAL 58 7.732 -7.377 3.751
425 HG13 VAL 58 3HG1 VAL 58 7.030 -6.449 5.072
426 HG21 VAL 58 3HG2 VAL 58 9.310 -4.928 2.660
427 HG22 VAL 58 1HG2 VAL 58 8.080 -4.306 1.559
428 HG23 VAL 58 2HG2 VAL 58 8.437 -6.033 1.598
429 H ALA 59 H ALA 59 4.888 -3.600 3.700
430 HA ALA 59 HA ALA 59 4.349 -2.262 1.160
431 HB1 ALA 59 1HB ALA 59 3.073 -0.677 2.570
432 HB2 ALA 59 2HB ALA 59 3.525 -1.635 3.993
433 HB3 ALA 59 3HB ALA 59 2.500 -2.335 2.746
434 H LEU 60 H LEU 60 6.087 -1.353 0.442
435 HA LEU 60 HA LEU 60 8.015 -0.271 2.300
436 HB2 LEU 60 2HB LEU 60 8.693 -1.849 0.591
437 HB3 LEU 60 1HB LEU 60 8.078 -0.785 -0.648
438 HG LEU 60 HG LEU 60 9.827 0.850 -0.115
439 HD11 LEU 60 1HD1 LEU 60 10.081 0.325 2.265
440 HD12 LEU 60 2HD1 LEU 60 11.628 0.237 1.424
441 HD13 LEU 60 3HD1 LEU 60 10.762 -1.245 1.844
442 HD21 LEU 60 3HD2 LEU 60 11.697 -0.496 -0.970
443 HD22 LEU 60 1HD2 LEU 60 10.180 -0.842 -1.808
444 HD23 LEU 60 2HD2 LEU 60 10.780 -1.963 -0.592
445 H LEU 61 H LEU 61 7.840 1.758 2.829
446 HA LEU 61 HA LEU 61 6.602 3.723 1.047
447 HB2 LEU 61 2HB LEU 61 5.630 3.374 3.231
448 HB3 LEU 61 1HB LEU 61 7.134 3.615 4.041
449 HG LEU 61 HG LEU 61 5.572 5.479 4.366
450 HD11 LEU 61 1HD1 LEU 61 6.916 7.406 3.752
451 HD12 LEU 61 2HD1 LEU 61 7.901 6.378 2.711
452 HD13 LEU 61 3HD1 LEU 61 7.882 6.104 4.451
453 HD21 LEU 61 3HD2 LEU 61 4.319 5.253 2.310
454 HD22 LEU 61 1HD2 LEU 61 5.690 5.873 1.395
455 HD23 LEU 61 2HD2 LEU 61 4.854 6.912 2.556
456 H ALA 62 H ALA 62 7.953 5.197 0.092
457 HA ALA 62 HA ALA 62 10.495 5.743 1.415
458 HB1 ALA 62 1HB ALA 62 10.915 4.203 -0.428
459 HB2 ALA 62 2HB ALA 62 11.617 5.790 -0.749
460 HB3 ALA 62 3HB ALA 62 10.117 5.309 -1.546
461 H ASP 63 H ASP 63 10.788 7.798 1.745
462 HA ASP 63 HA ASP 63 9.107 9.817 0.486
463 HB2 ASP 63 2HB ASP 63 9.432 10.049 2.882
464 HB3 ASP 63 1HB ASP 63 11.176 9.914 2.704
465 H LEU 64 H LEU 64 9.840 11.101 -1.110
466 HA LEU 64 HA LEU 64 12.666 10.745 -1.904
467 HB2 LEU 64 2HB LEU 64 10.747 9.534 -3.184
468 HB3 LEU 64 1HB LEU 64 10.333 11.116 -3.773
469 HG LEU 64 HG LEU 64 11.476 9.956 -5.455
470 HD11 LEU 64 1HD1 LEU 64 13.364 11.982 -4.304
471 HD12 LEU 64 2HD1 LEU 64 12.050 12.267 -5.446
472 HD13 LEU 64 3HD1 LEU 64 13.459 11.326 -5.939
473 HD21 LEU 64 3HD2 LEU 64 13.689 9.438 -3.485
474 HD22 LEU 64 1HD2 LEU 64 13.770 9.075 -5.209
475 HD23 LEU 64 2HD2 LEU 64 12.583 8.258 -4.189
476 H ASN 65 H ASN 65 12.847 12.887 -0.579
477 HA ASN 65 HA ASN 65 13.133 15.049 -2.286
478 HB2 ASN 65 2HB ASN 65 11.357 16.599 -1.702
479 HB3 ASN 65 1HB ASN 65 10.598 15.118 -2.264
480 HD21 ASN 65 1HD2 ASN 65 9.575 13.778 -0.735
481 HD22 ASN 65 2HD2 ASN 65 9.183 14.317 0.835
482 H SER 66 H SER 66 13.814 16.996 -1.143
483 HA SER 66 HA SER 66 14.636 16.371 1.596
484 HB2 SER 66 2HB SER 66 15.813 18.374 -0.343
485 HB3 SER 66 1HB SER 66 16.449 17.982 1.258
486 HG SER 66 HG SER 66 16.154 15.701 0.007
487 H THR 67 H THR 67 12.420 18.176 -0.070
488 HA THR 67 HA THR 67 12.510 20.688 1.317
489 HB THR 67 HB THR 67 10.353 19.536 -0.443
490 HG1 THR 67 1HG THR 67 12.885 20.614 -0.978
491 HG21 THR 67 3HG2 THR 67 9.734 21.599 0.753
492 HG22 THR 67 1HG2 THR 67 9.908 21.890 -0.978
493 HG23 THR 67 2HG2 THR 67 11.187 22.385 0.130
494 H ASN 68 H ASN 68 10.208 17.969 1.236
495 HA ASN 68 HA ASN 68 8.736 19.057 3.529
496 HB2 ASN 68 2HB ASN 68 7.736 17.820 0.988
497 HB3 ASN 68 1HB ASN 68 6.703 18.045 2.396
498 HD21 ASN 68 1HD2 ASN 68 6.399 19.099 -0.271
499 HD22 ASN 68 2HD2 ASN 68 6.407 20.818 -0.123
500 H GLY 69 H GLY 69 10.878 17.115 3.489
501 HA2 GLY 69 2HA GLY 69 10.411 14.478 3.078
502 HA3 GLY 69 1HA GLY 69 11.410 15.073 4.389
503 H THR 70 H THR 70 9.008 13.198 3.602
504 HA THR 70 HA THR 70 6.876 13.677 5.283
505 HB THR 70 HB THR 70 7.777 11.074 4.070
506 HG1 THR 70 1HG THR 70 7.688 12.495 2.444
507 HG21 THR 70 3HG2 THR 70 5.370 10.584 4.015
508 HG22 THR 70 1HG2 THR 70 5.041 12.117 4.824
509 HG23 THR 70 2HG2 THR 70 5.932 10.851 5.665
510 H THR 71 H THR 71 6.305 12.988 7.247
511 HA THR 71 HA THR 71 8.320 11.664 8.868
512 HB THR 71 HB THR 71 6.719 12.456 10.732
513 HG1 THR 71 1HG THR 71 6.012 14.402 8.809
514 HG21 THR 71 3HG2 THR 71 7.788 14.642 10.800
515 HG22 THR 71 1HG2 THR 71 8.301 14.440 9.112
516 HG23 THR 71 2HG2 THR 71 8.913 13.349 10.364
517 H VAL 72 H VAL 72 7.877 9.836 9.950
518 HA VAL 72 HA VAL 72 5.228 8.680 9.610
519 HB VAL 72 HB VAL 72 6.287 6.410 9.608
520 HG11 VAL 72 1HG1 VAL 72 5.792 7.454 7.464
521 HG12 VAL 72 2HG1 VAL 72 7.265 6.484 7.366
522 HG13 VAL 72 3HG1 VAL 72 7.368 8.243 7.485
523 HG21 VAL 72 3HG2 VAL 72 8.321 6.961 10.839
524 HG22 VAL 72 1HG2 VAL 72 8.877 7.947 9.490
525 HG23 VAL 72 2HG2 VAL 72 8.713 6.198 9.297
526 H ASN 73 H ASN 73 4.221 8.499 11.413
527 HA ASN 73 HA ASN 73 3.678 8.577 13.502
528 HB2 ASN 73 2HB ASN 73 6.145 6.854 13.772
529 HB3 ASN 73 1HB ASN 73 5.072 7.176 15.139
530 HD21 ASN 73 1HD2 ASN 73 5.619 4.641 13.757
531 HD22 ASN 73 2HD2 ASN 73 4.099 4.056 13.184
532 H ASN 74 H ASN 74 5.067 10.677 12.415
533 HA ASN 74 HA ASN 74 5.437 12.806 12.997
534 HB2 ASN 74 2HB ASN 74 4.087 12.226 15.099
535 HB3 ASN 74 1HB ASN 74 5.629 12.023 15.917
536 HD21 ASN 74 1HD2 ASN 74 5.253 13.691 17.332
537 HD22 ASN 74 2HD2 ASN 74 5.224 15.350 16.877
538 H ALA 75 H ALA 75 7.556 10.588 12.756
539 HA ALA 75 HA ALA 75 9.795 12.380 13.396
540 HB1 ALA 75 1HB ALA 75 9.777 9.360 13.540
541 HB2 ALA 75 2HB ALA 75 9.842 10.456 14.921
542 HB3 ALA 75 3HB ALA 75 11.192 10.381 13.791
543 HA PRO 76 HA PRO 76 10.336 11.984 8.985
544 HB2 PRO 76 2HB PRO 76 12.701 13.237 8.698
545 HB3 PRO 76 1HB PRO 76 11.228 14.111 9.110
546 HG2 PRO 76 2HG PRO 76 13.446 13.215 10.908
547 HG3 PRO 76 1HG PRO 76 12.577 14.760 10.887
548 HD2 PRO 76 2HD PRO 76 12.024 12.742 12.647
549 HD3 PRO 76 1HD PRO 76 10.820 13.928 12.107
550 H VAL 77 H VAL 77 11.206 10.570 7.573
551 HA VAL 77 HA VAL 77 13.663 9.121 8.205
552 HB VAL 77 HB VAL 77 12.674 6.939 7.632
553 HG11 VAL 77 1HG1 VAL 77 11.350 6.499 9.650
554 HG12 VAL 77 2HG1 VAL 77 11.284 8.234 9.960
555 HG13 VAL 77 3HG1 VAL 77 12.835 7.391 9.965
556 HG21 VAL 77 3HG2 VAL 77 10.846 7.644 6.227
557 HG22 VAL 77 1HG2 VAL 77 10.029 8.387 7.602
558 HG23 VAL 77 2HG2 VAL 77 10.226 6.637 7.535
559 H GLN 78 H GLN 78 14.165 7.679 6.257
560 HA GLN 78 HA GLN 78 13.533 9.129 3.795
561 HB2 GLN 78 2HB GLN 78 15.491 6.858 4.238
562 HB3 GLN 78 1HB GLN 78 15.312 7.791 2.763
563 HG2 GLN 78 2HG GLN 78 16.009 9.806 4.036
564 HG3 GLN 78 1HG GLN 78 16.337 8.761 5.415
565 HE21 GLN 78 1HE2 GLN 78 18.495 9.170 5.453
566 HE22 GLN 78 2HE2 GLN 78 19.602 8.646 4.245
567 H GLU 79 H GLU 79 13.474 5.864 5.185
568 HA GLU 79 HA GLU 79 11.201 5.267 3.539
569 HB2 GLU 79 2HB GLU 79 12.210 2.990 2.987
570 HB3 GLU 79 1HB GLU 79 12.820 4.372 2.094
571 HG2 GLU 79 2HG GLU 79 14.784 4.435 3.556
572 HG3 GLU 79 1HG GLU 79 14.168 3.028 4.424
573 H TRP 80 H TRP 80 9.972 3.494 4.268
574 HA TRP 80 HA TRP 80 10.415 2.555 6.985
575 HB2 TRP 80 2HB TRP 80 9.534 4.732 7.363
576 HB3 TRP 80 1HB TRP 80 8.220 4.535 6.222
577 HD1 TRP 80 HD TRP 80 6.025 3.373 7.169
578 HE1 TRP 80 1HE TRP 80 5.240 2.812 9.561
579 HE3 TRP 80 3HE TRP 80 10.480 3.925 9.606
580 HZ2 TRP 80 2HZ TRP 80 6.374 2.664 12.136
581 HZ3 TRP 80 3HZ TRP 80 10.542 3.566 12.034
582 HH2 TRP 80 HH TRP 80 8.527 2.954 13.270
583 H GLN 81 H GLN 81 9.045 0.790 7.436
584 HA GLN 81 HA GLN 81 7.523 -0.173 5.140
585 HB2 GLN 81 2HB GLN 81 7.457 -2.407 6.236
586 HB3 GLN 81 1HB GLN 81 9.097 -1.841 5.994
587 HG2 GLN 81 2HG GLN 81 9.290 -1.297 8.353
588 HG3 GLN 81 1HG GLN 81 7.601 -1.721 8.607
589 HE21 GLN 81 1HE2 GLN 81 9.718 -3.576 6.515
590 HE22 GLN 81 2HE2 GLN 81 9.796 -4.963 7.499
591 H LEU 82 H LEU 82 5.525 0.252 5.075
592 HA LEU 82 HA LEU 82 4.072 1.578 7.088
593 HB2 LEU 82 2HB LEU 82 2.856 0.007 4.827
594 HB3 LEU 82 1HB LEU 82 2.141 1.291 5.773
595 HG LEU 82 HG LEU 82 4.437 1.638 3.864
596 HD11 LEU 82 1HD1 LEU 82 1.545 2.481 3.653
597 HD12 LEU 82 2HD1 LEU 82 2.305 1.198 2.715
598 HD13 LEU 82 3HD1 LEU 82 2.820 2.868 2.503
599 HD21 LEU 82 3HD2 LEU 82 4.597 3.176 5.677
600 HD22 LEU 82 1HD2 LEU 82 2.876 3.544 5.551
601 HD23 LEU 82 2HD2 LEU 82 3.967 4.026 4.263
602 H ALA 83 H ALA 83 2.974 0.878 8.808
603 HA ALA 83 HA ALA 83 1.907 -1.833 8.771
604 HB1 ALA 83 1HB ALA 83 2.154 -1.837 11.230
605 HB2 ALA 83 2HB ALA 83 2.943 -0.264 11.144
606 HB3 ALA 83 3HB ALA 83 3.714 -1.679 10.423
607 H ASP 84 H ASP 84 -0.100 -1.996 9.856
608 HA ASP 84 HA ASP 84 -1.934 0.064 9.252
609 HB2 ASP 84 2HB ASP 84 -2.661 -2.225 9.313
610 HB3 ASP 84 1HB ASP 84 -2.181 -2.389 10.993
611 H GLY 85 H GLY 85 -2.403 1.842 10.334
612 HA2 GLY 85 2HA GLY 85 -3.016 3.012 12.298
613 HA3 GLY 85 1HA GLY 85 -2.102 1.851 13.248
614 H ASP 86 H ASP 86 -0.230 2.740 10.616
615 HA ASP 86 HA ASP 86 1.339 4.481 12.298
616 HB2 ASP 86 2HB ASP 86 1.838 3.439 9.518
617 HB3 ASP 86 1HB ASP 86 2.841 4.701 10.216
618 H VAL 87 H VAL 87 1.703 6.557 12.143
619 HA VAL 87 HA VAL 87 -0.242 8.079 10.541
620 HB VAL 87 HB VAL 87 1.452 9.015 12.868
621 HG11 VAL 87 1HG1 VAL 87 -0.096 10.924 12.949
622 HG12 VAL 87 2HG1 VAL 87 -0.891 10.316 11.493
623 HG13 VAL 87 3HG1 VAL 87 0.791 10.837 11.426
624 HG21 VAL 87 3HG2 VAL 87 -1.439 8.159 12.852
625 HG22 VAL 87 1HG2 VAL 87 -0.591 8.891 14.220
626 HG23 VAL 87 2HG2 VAL 87 -0.087 7.311 13.612
627 H ILE 88 H ILE 88 0.549 8.829 8.728
628 HA ILE 88 HA ILE 88 3.394 9.500 8.593
629 HB ILE 88 HB ILE 88 1.429 8.602 6.479
630 HG12 ILE 88 2HG1 ILE 88 3.797 7.177 7.682
631 HG13 ILE 88 1HG1 ILE 88 2.107 6.851 8.032
632 HG21 ILE 88 1HG2 ILE 88 3.083 10.143 5.526
633 HG22 ILE 88 2HG2 ILE 88 3.352 8.497 4.952
634 HG23 ILE 88 3HG2 ILE 88 4.385 9.171 6.212
635 HD11 ILE 88 3HD1 ILE 88 3.060 5.241 6.515
636 HD12 ILE 88 1HD1 ILE 88 3.440 6.523 5.367
637 HD13 ILE 88 2HD1 ILE 88 1.754 6.152 5.748
638 H ARG 89 H ARG 89 3.895 11.566 7.764
639 HA ARG 89 HA ARG 89 1.608 13.189 6.991
640 HB2 ARG 89 2HB ARG 89 1.805 13.503 9.384
641 HB3 ARG 89 1HB ARG 89 3.493 13.951 9.211
642 HG2 ARG 89 2HG ARG 89 2.886 15.945 8.023
643 HG3 ARG 89 1HG ARG 89 1.186 15.472 8.031
644 HD2 ARG 89 2HD ARG 89 1.155 15.578 10.457
645 HD3 ARG 89 1HD ARG 89 2.863 16.023 10.473
646 HE ARG 89 HE ARG 89 2.039 17.969 9.045
647 HH11 ARG 89 1HH1 ARG 89 0.168 16.555 11.726
648 HH12 ARG 89 2HH1 ARG 89 -0.619 18.023 12.089
649 HH21 ARG 89 1HH2 ARG 89 0.953 19.929 9.564
650 HH22 ARG 89 2HH2 ARG 89 -0.172 19.983 10.839
651 H LEU 90 H LEU 90 1.946 14.366 5.293
652 HA LEU 90 HA LEU 90 4.567 15.487 4.787
653 HB2 LEU 90 2HB LEU 90 4.302 15.036 2.348
654 HB3 LEU 90 1HB LEU 90 4.536 13.584 3.276
655 HG LEU 90 HG LEU 90 1.830 14.471 2.210
656 HD11 LEU 90 1HD1 LEU 90 2.176 12.782 0.480
657 HD12 LEU 90 2HD1 LEU 90 3.800 12.479 1.093
658 HD13 LEU 90 3HD1 LEU 90 3.404 14.044 0.383
659 HD21 LEU 90 3HD2 LEU 90 1.197 12.146 2.604
660 HD22 LEU 90 1HD2 LEU 90 1.732 12.895 4.106
661 HD23 LEU 90 2HD2 LEU 90 2.805 11.797 3.239
662 H GLY 91 H GLY 91 4.464 17.500 3.792
663 HA2 GLY 91 2HA GLY 91 2.400 19.103 4.702
664 HA3 GLY 91 1HA GLY 91 3.612 19.584 3.539
665 H HIS 92 H HIS 92 0.458 18.299 4.023
666 HA HIS 92 HA HIS 92 -1.047 19.745 2.343
667 HB2 HIS 92 2HB HIS 92 0.207 18.786 0.362
668 HB3 HIS 92 1HB HIS 92 -0.286 17.175 0.868
669 HD1 HIS 92 1HD HIS 92 -1.861 20.420 -0.348
670 HD2 HIS 92 2HD HIS 92 -2.699 16.360 -0.112
671 HE1 HIS 92 1HE HIS 92 -4.042 20.072 -1.587
672 H SER 93 H SER 93 -0.363 16.418 3.227
673 HA SER 93 HA SER 93 -2.929 16.204 4.510
674 HB2 SER 93 2HB SER 93 -2.104 14.388 2.242
675 HB3 SER 93 1HB SER 93 -3.453 14.089 3.335
676 HG SER 93 HG SER 93 -4.252 16.160 2.653
677 H GLU 94 H GLU 94 -2.741 15.077 6.290
678 HA GLU 94 HA GLU 94 -0.450 13.359 6.613
679 HB2 GLU 94 2HB GLU 94 -1.270 13.141 8.977
680 HB3 GLU 94 1HB GLU 94 -0.886 14.788 8.519
681 HG2 GLU 94 2HG GLU 94 -3.340 15.128 8.112
682 HG3 GLU 94 1HG GLU 94 -3.599 13.549 8.860
683 H ILE 95 H ILE 95 -0.710 11.151 6.949
684 HA ILE 95 HA ILE 95 -3.267 10.115 6.106
685 HB ILE 95 HB ILE 95 -2.211 10.352 4.040
686 HG12 ILE 95 2HG1 ILE 95 -3.082 7.977 4.429
687 HG13 ILE 95 1HG1 ILE 95 -1.996 8.207 3.065
688 HG21 ILE 95 1HG2 ILE 95 0.349 9.275 5.108
689 HG22 ILE 95 2HG2 ILE 95 -0.026 10.951 4.713
690 HG23 ILE 95 3HG2 ILE 95 0.048 9.736 3.435
691 HD11 ILE 95 3HD1 ILE 95 -1.550 6.111 4.272
692 HD12 ILE 95 1HD1 ILE 95 -1.262 7.030 5.743
693 HD13 ILE 95 2HD1 ILE 95 -0.168 7.204 4.367
694 H ILE 96 H ILE 96 -3.826 8.262 6.940
695 HA ILE 96 HA ILE 96 -1.892 6.917 8.699
696 HB ILE 96 HB ILE 96 -4.917 7.074 9.047
697 HG12 ILE 96 2HG1 ILE 96 -2.688 8.299 10.701
698 HG13 ILE 96 1HG1 ILE 96 -3.729 9.180 9.593
699 HG21 ILE 96 1HG2 ILE 96 -2.820 5.760 10.792
700 HG22 ILE 96 2HG2 ILE 96 -4.027 4.924 9.816
701 HG23 ILE 96 3HG2 ILE 96 -4.532 5.909 11.187
702 HD11 ILE 96 3HD1 ILE 96 -4.394 9.475 11.924
703 HD12 ILE 96 1HD1 ILE 96 -4.634 7.738 12.076
704 HD13 ILE 96 2HD1 ILE 96 -5.658 8.680 10.989
705 H VAL 97 H VAL 97 -1.508 4.865 8.300
706 HA VAL 97 HA VAL 97 -2.630 3.657 5.943
707 HB VAL 97 HB VAL 97 -0.419 2.814 7.830
708 HG11 VAL 97 1HG1 VAL 97 0.041 0.940 6.326
709 HG12 VAL 97 2HG1 VAL 97 -1.384 1.350 5.370
710 HG13 VAL 97 3HG1 VAL 97 -1.570 0.784 7.033
711 HG21 VAL 97 3HG2 VAL 97 0.065 4.615 6.272
712 HG22 VAL 97 1HG2 VAL 97 -0.500 3.597 4.944
713 HG23 VAL 97 2HG2 VAL 97 0.946 3.138 5.845
714 H ARG 98 H ARG 98 -4.216 2.221 5.831
715 HA ARG 98 HA ARG 98 -5.009 0.804 8.263
716 HB2 ARG 98 2HB ARG 98 -6.705 1.817 5.974
717 HB3 ARG 98 1HB ARG 98 -7.289 0.813 7.295
718 HG2 ARG 98 2HG ARG 98 -6.049 3.507 7.625
719 HG3 ARG 98 1HG ARG 98 -7.805 3.228 7.582
720 HD2 ARG 98 2HD ARG 98 -7.614 1.798 9.509
721 HD3 ARG 98 1HD ARG 98 -5.867 1.986 9.531
722 HE ARG 98 HE ARG 98 -7.269 4.450 9.732
723 HH11 ARG 98 1HH1 ARG 98 -6.266 1.576 11.542
724 HH12 ARG 98 2HH1 ARG 98 -6.021 2.380 13.015
725 HH21 ARG 98 1HH2 ARG 98 -6.949 5.588 11.804
726 HH22 ARG 98 2HH2 ARG 98 -6.434 4.724 13.178
727 H MET 99 H MET 99 -5.127 -1.250 8.140
728 HA MET 99 HA MET 99 -4.844 -2.508 5.496
729 HB2 MET 99 2HB MET 99 -3.711 -3.465 8.123
730 HB3 MET 99 1HB MET 99 -3.745 -4.424 6.658
731 HG2 MET 99 2HG MET 99 -2.350 -2.774 5.529
732 HG3 MET 99 1HG MET 99 -2.307 -1.803 7.000
733 HE1 MET 99 3HE MET 99 0.267 -2.869 5.348
734 HE2 MET 99 1HE MET 99 1.324 -3.286 6.694
735 HE3 MET 99 2HE MET 99 0.357 -1.814 6.758
736 H HIS 100 H HIS 100 -6.216 -3.972 4.946
737 HA HIS 100 HA HIS 100 -8.461 -4.541 6.674
738 HB2 HIS 100 2HB HIS 100 -7.877 -5.336 3.810
739 HB3 HIS 100 1HB HIS 100 -9.370 -5.686 4.657
740 HD1 HIS 100 1HD HIS 100 -11.153 -4.177 3.765
741 HD2 HIS 100 2HD HIS 100 -7.491 -2.240 4.030
742 HE1 HIS 100 1HE HIS 100 -11.559 -1.805 3.009
Start of MODEL 29
1 H1 GLY 1 1HT GLY 1 -8.210 -22.842 -0.238
2 H2 GLY 1 2HT GLY 1 -9.850 -23.087 -0.527
3 H3 GLY 1 3HT GLY 1 -8.805 -24.409 -0.481
4 HA2 GLY 1 1HA GLY 1 -10.119 -24.255 1.514
5 HA3 GLY 1 2HA GLY 1 -8.411 -23.990 1.876
6 H HIS 2 H HIS 2 -8.495 -22.534 3.564
7 HA HIS 2 HA HIS 2 -10.101 -20.153 3.059
8 HB2 HIS 2 2HB HIS 2 -9.949 -19.615 5.447
9 HB3 HIS 2 1HB HIS 2 -10.550 -21.249 5.265
10 HD1 HIS 2 1HD HIS 2 -9.266 -23.059 6.560
11 HD2 HIS 2 2HD HIS 2 -7.235 -19.437 6.375
12 HE1 HIS 2 1HE HIS 2 -7.309 -23.274 8.106
13 H GLY 3 H GLY 3 -9.130 -18.137 3.165
14 HA2 GLY 3 2HA GLY 3 -7.151 -16.797 3.498
15 HA3 GLY 3 1HA GLY 3 -6.194 -18.214 3.059
16 H SER 4 H SER 4 -7.086 -15.359 1.949
17 HA SER 4 HA SER 4 -7.518 -16.239 -0.808
18 HB2 SER 4 2HB SER 4 -7.979 -13.541 0.454
19 HB3 SER 4 1HB SER 4 -8.527 -14.090 -1.131
20 HG SER 4 HG SER 4 -9.800 -15.634 -0.085
21 H ALA 5 H ALA 5 -5.100 -15.298 1.246
22 HA ALA 5 HA ALA 5 -3.060 -14.336 1.122
23 HB1 ALA 5 1HB ALA 5 -1.867 -14.428 -1.025
24 HB2 ALA 5 2HB ALA 5 -3.385 -14.742 -1.870
25 HB3 ALA 5 3HB ALA 5 -2.739 -15.937 -0.746
26 H GLY 6 H GLY 6 -5.415 -12.781 1.105
27 HA2 GLY 6 2HA GLY 6 -4.842 -10.536 -0.657
28 HA3 GLY 6 1HA GLY 6 -6.364 -10.866 0.137
29 H THR 7 H THR 7 -3.366 -9.330 0.354
30 HA THR 7 HA THR 7 -3.964 -8.395 3.047
31 HB THR 7 HB THR 7 -1.475 -7.939 1.368
32 HG1 THR 7 1HG THR 7 -2.149 -10.001 3.196
33 HG21 THR 7 3HG2 THR 7 -1.992 -7.699 4.346
34 HG22 THR 7 1HG2 THR 7 -1.806 -6.358 3.215
35 HG23 THR 7 2HG2 THR 7 -0.441 -7.425 3.550
36 H SER 8 H SER 8 -4.782 -6.333 3.185
37 HA SER 8 HA SER 8 -4.593 -4.721 0.737
38 HB2 SER 8 2HB SER 8 -6.917 -4.695 2.680
39 HB3 SER 8 1HB SER 8 -6.788 -3.863 1.142
40 HG SER 8 HG SER 8 -7.251 -6.534 1.685
41 H VAL 9 H VAL 9 -4.005 -2.621 0.966
42 HA VAL 9 HA VAL 9 -3.683 -1.551 3.689
43 HB VAL 9 HB VAL 9 -1.874 -1.038 1.298
44 HG11 VAL 9 1HG1 VAL 9 -2.072 0.889 2.775
45 HG12 VAL 9 2HG1 VAL 9 -0.461 0.181 2.904
46 HG13 VAL 9 3HG1 VAL 9 -1.660 -0.112 4.167
47 HG21 VAL 9 3HG2 VAL 9 -1.473 -3.265 2.161
48 HG22 VAL 9 1HG2 VAL 9 -1.322 -2.634 3.799
49 HG23 VAL 9 2HG2 VAL 9 -0.123 -2.212 2.581
50 H THR 10 H THR 10 -4.826 0.162 3.972
51 HA THR 10 HA THR 10 -5.935 1.496 1.615
52 HB THR 10 HB THR 10 -7.298 1.083 4.289
53 HG1 THR 10 1HG THR 10 -7.941 -0.797 3.580
54 HG21 THR 10 3HG2 THR 10 -9.320 1.699 3.030
55 HG22 THR 10 1HG2 THR 10 -8.347 1.933 1.579
56 HG23 THR 10 2HG2 THR 10 -8.119 2.990 2.971
57 H LEU 11 H LEU 11 -5.554 3.615 1.568
58 HA LEU 11 HA LEU 11 -4.332 4.820 3.878
59 HB2 LEU 11 2HB LEU 11 -3.727 6.685 2.380
60 HB3 LEU 11 1HB LEU 11 -3.155 5.153 1.793
61 HG LEU 11 HG LEU 11 -5.229 5.232 0.223
62 HD11 LEU 11 1HD1 LEU 11 -4.979 8.161 0.873
63 HD12 LEU 11 2HD1 LEU 11 -6.360 7.137 1.249
64 HD13 LEU 11 3HD1 LEU 11 -5.944 7.487 -0.430
65 HD21 LEU 11 3HD2 LEU 11 -3.945 6.512 -1.437
66 HD22 LEU 11 1HD2 LEU 11 -2.945 5.351 -0.561
67 HD23 LEU 11 2HD2 LEU 11 -2.871 7.066 -0.153
68 H GLN 12 H GLN 12 -5.206 6.322 5.059
69 HA GLN 12 HA GLN 12 -8.056 6.909 4.663
70 HB2 GLN 12 2HB GLN 12 -7.073 5.471 6.641
71 HB3 GLN 12 1HB GLN 12 -6.527 7.009 7.244
72 HG2 GLN 12 2HG GLN 12 -9.408 6.332 6.700
73 HG3 GLN 12 1HG GLN 12 -8.629 6.234 8.271
74 HE21 GLN 12 1HE2 GLN 12 -8.130 8.125 9.352
75 HE22 GLN 12 2HE2 GLN 12 -8.845 9.635 8.909
76 H LEU 13 H LEU 13 -8.284 8.940 4.023
77 HA LEU 13 HA LEU 13 -6.344 10.967 4.838
78 HB2 LEU 13 2HB LEU 13 -6.283 10.639 2.468
79 HB3 LEU 13 1HB LEU 13 -8.028 10.679 2.363
80 HG LEU 13 HG LEU 13 -8.005 13.041 2.987
81 HD11 LEU 13 1HD1 LEU 13 -5.898 14.312 2.922
82 HD12 LEU 13 2HD1 LEU 13 -5.003 12.793 2.818
83 HD13 LEU 13 3HD1 LEU 13 -5.956 13.162 4.256
84 HD21 LEU 13 3HD2 LEU 13 -7.117 13.896 0.865
85 HD22 LEU 13 1HD2 LEU 13 -8.067 12.427 0.657
86 HD23 LEU 13 2HD2 LEU 13 -6.304 12.354 0.598
87 H ASP 14 H ASP 14 -7.210 12.085 6.452
88 HA ASP 14 HA ASP 14 -10.020 12.769 6.165
89 HB2 ASP 14 2HB ASP 14 -9.720 11.564 8.238
90 HB3 ASP 14 1HB ASP 14 -8.422 12.664 8.722
91 H ASP 15 H ASP 15 -10.194 14.547 5.264
92 HA ASP 15 HA ASP 15 -8.507 16.802 6.107
93 HB2 ASP 15 2HB ASP 15 -8.326 16.083 3.699
94 HB3 ASP 15 1HB ASP 15 -10.045 16.397 3.520
95 H GLY 16 H GLY 16 -10.899 15.601 7.313
96 HA2 GLY 16 2HA GLY 16 -12.662 16.602 8.483
97 HA3 GLY 16 1HA GLY 16 -12.727 17.877 7.256
98 H SER 17 H SER 17 -12.604 14.378 6.967
99 HA SER 17 HA SER 17 -15.261 14.196 5.926
100 HB2 SER 17 2HB SER 17 -14.414 13.371 3.663
101 HB3 SER 17 1HB SER 17 -14.287 15.108 3.950
102 HG SER 17 HG SER 17 -12.356 14.494 3.150
103 H GLY 18 H GLY 18 -12.252 12.499 5.288
104 HA2 GLY 18 2HA GLY 18 -11.564 10.486 6.419
105 HA3 GLY 18 1HA GLY 18 -13.267 10.161 6.761
106 H ARG 19 H ARG 19 -10.983 10.529 4.121
107 HA ARG 19 HA ARG 19 -12.719 8.836 2.482
108 HB2 ARG 19 2HB ARG 19 -10.398 10.548 1.637
109 HB3 ARG 19 1HB ARG 19 -11.403 9.536 0.608
110 HG2 ARG 19 2HG ARG 19 -12.295 11.953 2.168
111 HG3 ARG 19 1HG ARG 19 -12.043 11.870 0.420
112 HD2 ARG 19 2HD ARG 19 -14.123 10.390 2.032
113 HD3 ARG 19 1HD ARG 19 -14.415 11.724 0.925
114 HE ARG 19 HE ARG 19 -13.795 8.968 0.257
115 HH11 ARG 19 1HH1 ARG 19 -14.320 12.259 -0.934
116 HH12 ARG 19 2HH1 ARG 19 -14.770 11.795 -2.499
117 HH21 ARG 19 1HH2 ARG 19 -14.435 8.288 -1.883
118 HH22 ARG 19 2HH2 ARG 19 -14.851 9.445 -3.057
119 H THR 20 H THR 20 -11.689 7.191 1.218
120 HA THR 20 HA THR 20 -9.148 6.284 2.268
121 HB THR 20 HB THR 20 -10.151 3.954 2.516
122 HG1 THR 20 1HG THR 20 -12.519 5.527 2.479
123 HG21 THR 20 3HG2 THR 20 -10.977 6.174 4.345
124 HG22 THR 20 1HG2 THR 20 -9.496 5.236 4.464
125 HG23 THR 20 2HG2 THR 20 -11.060 4.465 4.807
126 H TYR 21 H TYR 21 -7.928 5.276 0.830
127 HA TYR 21 HA TYR 21 -9.099 4.245 -1.650
128 HB2 TYR 21 2HB TYR 21 -8.122 6.463 -2.202
129 HB3 TYR 21 1HB TYR 21 -6.619 5.981 -1.429
130 HD1 TYR 21 2HD TYR 21 -8.835 5.217 -4.294
131 HD2 TYR 21 1HD TYR 21 -4.929 4.850 -2.646
132 HE1 TYR 21 2HE TYR 21 -8.019 4.338 -6.429
133 HE2 TYR 21 1HE TYR 21 -4.105 3.974 -4.781
134 HH TYR 21 HH TYR 21 -5.812 4.195 -7.654
135 H GLN 22 H GLN 22 -8.085 2.357 -2.335
136 HA GLN 22 HA GLN 22 -6.213 1.328 -0.359
137 HB2 GLN 22 2HB GLN 22 -8.450 0.215 -0.610
138 HB3 GLN 22 1HB GLN 22 -7.967 -0.251 -2.231
139 HG2 GLN 22 2HG GLN 22 -6.267 -1.661 -1.426
140 HG3 GLN 22 1HG GLN 22 -6.391 -0.988 0.204
141 HE21 GLN 22 1HE2 GLN 22 -8.161 -1.493 1.453
142 HE22 GLN 22 2HE2 GLN 22 -9.126 -2.887 1.155
143 H LEU 23 H LEU 23 -4.327 0.523 -0.947
144 HA LEU 23 HA LEU 23 -3.147 1.582 -3.273
145 HB2 LEU 23 2HB LEU 23 -2.094 -0.459 -1.338
146 HB3 LEU 23 1HB LEU 23 -1.142 0.305 -2.589
147 HG LEU 23 HG LEU 23 -2.442 1.749 -0.276
148 HD11 LEU 23 1HD1 LEU 23 -0.158 2.021 0.534
149 HD12 LEU 23 2HD1 LEU 23 0.428 1.019 -0.796
150 HD13 LEU 23 3HD1 LEU 23 -0.614 0.320 0.440
151 HD21 LEU 23 3HD2 LEU 23 -1.076 3.653 -1.014
152 HD22 LEU 23 1HD2 LEU 23 -2.234 3.178 -2.258
153 HD23 LEU 23 2HD2 LEU 23 -0.535 2.725 -2.405
154 H ARG 24 H ARG 24 -2.280 0.663 -5.039
155 HA ARG 24 HA ARG 24 -3.584 -1.785 -5.982
156 HB2 ARG 24 2HB ARG 24 -1.957 0.238 -7.533
157 HB3 ARG 24 1HB ARG 24 -2.996 -1.015 -8.189
158 HG2 ARG 24 2HG ARG 24 -3.885 1.433 -6.669
159 HG3 ARG 24 1HG ARG 24 -4.030 1.167 -8.404
160 HD2 ARG 24 2HD ARG 24 -5.525 -0.733 -7.966
161 HD3 ARG 24 1HD ARG 24 -5.384 -0.427 -6.230
162 HE ARG 24 HE ARG 24 -6.156 1.927 -7.394
163 HH11 ARG 24 1HH1 ARG 24 -7.511 -1.273 -6.793
164 HH12 ARG 24 2HH1 ARG 24 -9.142 -0.804 -6.985
165 HH21 ARG 24 1HH2 ARG 24 -8.402 2.594 -7.686
166 HH22 ARG 24 2HH2 ARG 24 -9.664 1.470 -7.506
167 H GLU 25 H GLU 25 -2.151 -3.235 -7.295
168 HA GLU 25 HA GLU 25 0.223 -3.755 -5.779
169 HB2 GLU 25 2HB GLU 25 0.479 -5.773 -7.244
170 HB3 GLU 25 1HB GLU 25 -1.053 -5.704 -6.398
171 HG2 GLU 25 2HG GLU 25 -0.696 -4.904 -9.285
172 HG3 GLU 25 1HG GLU 25 -1.152 -6.525 -8.773
173 H GLY 26 H GLY 26 2.108 -2.997 -6.138
174 HA2 GLY 26 2HA GLY 26 3.897 -2.717 -7.831
175 HA3 GLY 26 1HA GLY 26 2.691 -1.840 -8.779
176 H SER 27 H SER 27 4.437 -0.186 -8.529
177 HA SER 27 HA SER 27 4.096 1.051 -5.956
178 HB2 SER 27 2HB SER 27 6.318 0.551 -6.300
179 HB3 SER 27 1HB SER 27 6.373 1.286 -7.918
180 HG SER 27 HG SER 27 5.912 2.603 -5.435
181 H ASN 28 H ASN 28 3.669 3.216 -5.783
182 HA ASN 28 HA ASN 28 2.785 4.579 -8.197
183 HB2 ASN 28 2HB ASN 28 1.073 5.723 -6.785
184 HB3 ASN 28 1HB ASN 28 0.748 4.004 -7.038
185 HD21 ASN 28 1HD2 ASN 28 1.075 2.596 -5.228
186 HD22 ASN 28 2HD2 ASN 28 1.033 3.227 -3.620
187 H ILE 29 H ILE 29 3.569 6.490 -8.493
188 HA ILE 29 HA ILE 29 5.445 7.542 -6.501
189 HB ILE 29 HB ILE 29 5.092 8.362 -9.396
190 HG12 ILE 29 2HG1 ILE 29 5.767 6.007 -9.356
191 HG13 ILE 29 1HG1 ILE 29 7.082 7.013 -9.943
192 HG21 ILE 29 1HG2 ILE 29 6.180 10.050 -8.038
193 HG22 ILE 29 2HG2 ILE 29 7.331 9.342 -9.172
194 HG23 ILE 29 3HG2 ILE 29 7.362 8.865 -7.473
195 HD11 ILE 29 3HD1 ILE 29 6.836 5.810 -7.194
196 HD12 ILE 29 1HD1 ILE 29 8.148 6.857 -7.739
197 HD13 ILE 29 2HD1 ILE 29 7.908 5.277 -8.488
198 H ILE 30 H ILE 30 4.852 9.308 -5.406
199 HA ILE 30 HA ILE 30 2.539 10.826 -6.348
200 HB ILE 30 HB ILE 30 3.718 10.607 -3.547
201 HG12 ILE 30 2HG1 ILE 30 1.120 9.528 -4.683
202 HG13 ILE 30 1HG1 ILE 30 2.536 8.574 -4.284
203 HG21 ILE 30 1HG2 ILE 30 1.709 11.857 -2.827
204 HG22 ILE 30 2HG2 ILE 30 1.392 12.224 -4.533
205 HG23 ILE 30 3HG2 ILE 30 2.870 12.783 -3.769
206 HD11 ILE 30 3HD1 ILE 30 2.268 9.157 -1.926
207 HD12 ILE 30 1HD1 ILE 30 0.825 8.378 -2.575
208 HD13 ILE 30 2HD1 ILE 30 0.848 10.124 -2.333
209 H GLY 31 H GLY 31 2.819 12.868 -6.970
210 HA2 GLY 31 2HA GLY 31 4.112 14.939 -5.995
211 HA3 GLY 31 1HA GLY 31 5.451 14.098 -6.807
212 H ARG 32 H ARG 32 5.552 16.002 -8.156
213 HA ARG 32 HA ARG 32 3.546 15.757 -10.290
214 HB2 ARG 32 2HB ARG 32 4.768 18.337 -9.290
215 HB3 ARG 32 1HB ARG 32 3.797 18.191 -10.737
216 HG2 ARG 32 2HG ARG 32 1.921 17.368 -9.223
217 HG3 ARG 32 1HG ARG 32 2.937 17.866 -7.886
218 HD2 ARG 32 2HD ARG 32 3.034 20.133 -8.633
219 HD3 ARG 32 1HD ARG 32 2.214 19.736 -10.133
220 HE ARG 32 HE ARG 32 1.006 19.931 -7.467
221 HH11 ARG 32 1HH1 ARG 32 0.537 19.280 -10.924
222 HH12 ARG 32 2HH1 ARG 32 -1.060 19.841 -10.961
223 HH21 ARG 32 1HH2 ARG 32 -1.247 20.723 -7.547
224 HH22 ARG 32 2HH2 ARG 32 -2.083 20.652 -9.032
225 H GLY 33 H GLY 33 4.680 14.742 -11.818
226 HA2 GLY 33 2HA GLY 33 6.715 16.022 -13.225
227 HA3 GLY 33 1HA GLY 33 7.418 14.803 -12.163
228 H GLN 34 H GLN 34 7.890 14.193 -14.538
229 HA GLN 34 HA GLN 34 5.872 13.003 -16.121
230 HB2 GLN 34 2HB GLN 34 7.750 12.108 -17.427
231 HB3 GLN 34 1HB GLN 34 7.918 13.824 -17.075
232 HG2 GLN 34 2HG GLN 34 9.384 13.148 -15.143
233 HG3 GLN 34 1HG GLN 34 9.375 11.530 -15.820
234 HE21 GLN 34 1HE2 GLN 34 11.603 11.658 -16.112
235 HE22 GLN 34 2HE2 GLN 34 12.291 12.563 -17.400
236 H ASP 35 H ASP 35 7.678 11.794 -13.460
237 HA ASP 35 HA ASP 35 7.031 9.000 -14.112
238 HB2 ASP 35 2HB ASP 35 8.680 10.146 -11.852
239 HB3 ASP 35 1HB ASP 35 8.356 8.439 -12.080
240 H ALA 36 H ALA 36 5.624 11.541 -12.600
241 HA ALA 36 HA ALA 36 4.809 10.242 -10.189
242 HB1 ALA 36 1HB ALA 36 3.861 12.838 -11.370
243 HB2 ALA 36 2HB ALA 36 5.212 12.642 -10.254
244 HB3 ALA 36 3HB ALA 36 3.570 12.266 -9.723
245 H GLN 37 H GLN 37 3.040 9.179 -9.793
246 HA GLN 37 HA GLN 37 1.226 8.577 -11.984
247 HB2 GLN 37 2HB GLN 37 1.481 7.417 -9.197
248 HB3 GLN 37 1HB GLN 37 0.441 6.815 -10.472
249 HG2 GLN 37 2HG GLN 37 3.447 6.878 -10.578
250 HG3 GLN 37 1HG GLN 37 2.477 5.470 -10.159
251 HE21 GLN 37 1HE2 GLN 37 1.299 4.447 -11.771
252 HE22 GLN 37 2HE2 GLN 37 1.633 4.698 -13.445
253 H PHE 38 H PHE 38 1.284 9.636 -8.633
254 HA PHE 38 HA PHE 38 -1.423 10.703 -8.918
255 HB2 PHE 38 2HB PHE 38 -1.318 8.922 -7.267
256 HB3 PHE 38 1HB PHE 38 0.077 9.666 -6.504
257 HD1 PHE 38 1HD PHE 38 -3.539 10.201 -7.206
258 HD2 PHE 38 2HD PHE 38 -0.206 11.131 -4.740
259 HE1 PHE 38 1HE PHE 38 -5.026 11.369 -5.628
260 HE2 PHE 38 2HE PHE 38 -1.632 12.277 -3.179
261 HZ PHE 38 HZ PHE 38 -4.084 12.421 -3.601
262 H ARG 39 H ARG 39 -1.594 12.823 -8.772
263 HA ARG 39 HA ARG 39 0.825 14.396 -8.235
264 HB2 ARG 39 2HB ARG 39 -1.795 15.382 -9.355
265 HB3 ARG 39 1HB ARG 39 -0.220 16.144 -9.465
266 HG2 ARG 39 2HG ARG 39 -1.004 13.582 -10.832
267 HG3 ARG 39 1HG ARG 39 -0.993 15.175 -11.589
268 HD2 ARG 39 2HD ARG 39 1.392 15.321 -11.324
269 HD3 ARG 39 1HD ARG 39 1.418 13.816 -10.403
270 HE ARG 39 HE ARG 39 0.508 12.764 -12.479
271 HH11 ARG 39 1HH1 ARG 39 2.367 15.769 -12.845
272 HH12 ARG 39 2HH1 ARG 39 3.127 15.263 -14.281
273 HH21 ARG 39 1HH2 ARG 39 1.548 12.108 -14.455
274 HH22 ARG 39 2HH2 ARG 39 2.650 13.145 -15.230
275 H LEU 40 H LEU 40 0.877 15.694 -6.431
276 HA LEU 40 HA LEU 40 -1.430 15.705 -4.712
277 HB2 LEU 40 2HB LEU 40 1.305 16.943 -4.408
278 HB3 LEU 40 1HB LEU 40 0.022 17.237 -3.254
279 HG LEU 40 HG LEU 40 1.304 14.567 -3.856
280 HD11 LEU 40 1HD1 LEU 40 2.168 14.744 -1.580
281 HD12 LEU 40 2HD1 LEU 40 1.415 16.327 -1.405
282 HD13 LEU 40 3HD1 LEU 40 2.725 16.105 -2.556
283 HD21 LEU 40 3HD2 LEU 40 -0.839 15.298 -1.855
284 HD22 LEU 40 1HD2 LEU 40 -0.036 13.733 -1.977
285 HD23 LEU 40 2HD2 LEU 40 -1.061 14.303 -3.292
286 HA PRO 41 HA PRO 41 -3.529 19.231 -6.261
287 HB2 PRO 41 2HB PRO 41 -3.758 20.014 -3.393
288 HB3 PRO 41 1HB PRO 41 -5.017 19.898 -4.629
289 HG2 PRO 41 2HG PRO 41 -4.792 18.004 -2.801
290 HG3 PRO 41 1HG PRO 41 -5.116 17.582 -4.493
291 HD2 PRO 41 2HD PRO 41 -2.572 17.354 -2.943
292 HD3 PRO 41 1HD PRO 41 -3.252 16.291 -4.189
293 H ASP 42 H ASP 42 -1.137 19.838 -3.765
294 HA ASP 42 HA ASP 42 -0.978 22.659 -4.455
295 HB2 ASP 42 2HB ASP 42 0.376 21.024 -2.331
296 HB3 ASP 42 1HB ASP 42 0.769 22.712 -2.626
297 H THR 43 H THR 43 1.198 23.664 -4.592
298 HA THR 43 HA THR 43 2.984 22.133 -6.300
299 HB THR 43 HB THR 43 3.975 24.508 -6.602
300 HG1 THR 43 1HG THR 43 3.013 25.808 -5.208
301 HG21 THR 43 3HG2 THR 43 1.222 23.839 -7.665
302 HG22 THR 43 1HG2 THR 43 2.758 23.359 -8.379
303 HG23 THR 43 2HG2 THR 43 2.294 25.062 -8.347
304 H GLY 44 H GLY 44 5.374 22.656 -5.880
305 HA2 GLY 44 2HA GLY 44 7.066 23.245 -4.295
306 HA3 GLY 44 1HA GLY 44 5.872 23.094 -3.009
307 H VAL 45 H VAL 45 4.809 20.733 -4.329
308 HA VAL 45 HA VAL 45 6.325 18.711 -3.061
309 HB VAL 45 HB VAL 45 3.903 18.467 -3.301
310 HG11 VAL 45 1HG1 VAL 45 2.837 18.059 -5.481
311 HG12 VAL 45 2HG1 VAL 45 4.371 18.422 -6.275
312 HG13 VAL 45 3HG1 VAL 45 3.533 19.674 -5.366
313 HG21 VAL 45 3HG2 VAL 45 5.126 16.393 -3.198
314 HG22 VAL 45 1HG2 VAL 45 5.378 16.429 -4.945
315 HG23 VAL 45 2HG2 VAL 45 3.755 16.215 -4.300
316 H SER 46 H SER 46 7.819 17.341 -3.914
317 HA SER 46 HA SER 46 9.228 18.197 -6.158
318 HB2 SER 46 2HB SER 46 9.422 15.621 -4.605
319 HB3 SER 46 1HB SER 46 10.633 16.242 -5.729
320 HG SER 46 HG SER 46 11.007 16.714 -3.486
321 H ARG 47 H ARG 47 9.757 16.931 -8.053
322 HA ARG 47 HA ARG 47 7.651 15.959 -9.582
323 HB2 ARG 47 2HB ARG 47 9.407 14.913 -11.040
324 HB3 ARG 47 1HB ARG 47 9.634 16.622 -10.726
325 HG2 ARG 47 2HG ARG 47 11.317 16.012 -8.992
326 HG3 ARG 47 1HG ARG 47 11.095 14.319 -9.428
327 HD2 ARG 47 2HD ARG 47 11.868 14.790 -11.690
328 HD3 ARG 47 1HD ARG 47 12.045 16.500 -11.274
329 HE ARG 47 HE ARG 47 13.489 14.700 -9.589
330 HH11 ARG 47 1HH1 ARG 47 13.637 16.584 -12.587
331 HH12 ARG 47 2HH1 ARG 47 15.335 16.640 -12.649
332 HH21 ARG 47 1HH2 ARG 47 15.841 14.770 -9.659
333 HH22 ARG 47 2HH2 ARG 47 16.620 15.603 -10.919
334 H ARG 48 H ARG 48 9.916 14.212 -7.639
335 HA ARG 48 HA ARG 48 8.013 12.017 -7.406
336 HB2 ARG 48 2HB ARG 48 11.041 11.909 -7.301
337 HB3 ARG 48 1HB ARG 48 9.965 10.568 -6.970
338 HG2 ARG 48 2HG ARG 48 9.286 10.492 -9.274
339 HG3 ARG 48 1HG ARG 48 10.259 11.919 -9.652
340 HD2 ARG 48 2HD ARG 48 12.269 10.716 -8.936
341 HD3 ARG 48 1HD ARG 48 11.293 9.314 -8.548
342 HE ARG 48 HE ARG 48 11.070 10.181 -11.278
343 HH11 ARG 48 1HH1 ARG 48 12.857 8.138 -9.006
344 HH12 ARG 48 2HH1 ARG 48 13.546 7.166 -10.220
345 HH21 ARG 48 1HH2 ARG 48 11.945 8.875 -12.883
346 HH22 ARG 48 2HH2 ARG 48 13.028 7.599 -12.525
347 H HIS 49 H HIS 49 7.228 12.537 -5.446
348 HA HIS 49 HA HIS 49 9.043 13.835 -3.551
349 HB2 HIS 49 2HB HIS 49 6.896 14.968 -3.996
350 HB3 HIS 49 1HB HIS 49 6.016 13.545 -3.472
351 HD2 HIS 49 2HD HIS 49 6.267 13.008 -0.655
352 HE1 HIS 49 1HE HIS 49 7.430 16.975 0.206
353 HE2 HIS 49 2HE HIS 49 7.187 14.600 1.081
354 H LEU 50 H LEU 50 6.945 11.084 -3.994
355 HA LEU 50 HA LEU 50 8.420 9.606 -2.097
356 HB2 LEU 50 2HB LEU 50 7.167 10.854 -0.531
357 HB3 LEU 50 1HB LEU 50 5.696 10.713 -1.431
358 HG LEU 50 HG LEU 50 6.941 8.307 -0.085
359 HD11 LEU 50 1HD1 LEU 50 5.562 8.853 1.882
360 HD12 LEU 50 2HD1 LEU 50 5.065 10.361 1.118
361 HD13 LEU 50 3HD1 LEU 50 6.751 10.117 1.580
362 HD21 LEU 50 3HD2 LEU 50 4.091 9.087 -0.722
363 HD22 LEU 50 1HD2 LEU 50 4.610 7.566 0.001
364 HD23 LEU 50 2HD2 LEU 50 5.067 7.955 -1.659
365 H GLU 51 H GLU 51 7.870 7.394 -2.215
366 HA GLU 51 HA GLU 51 5.938 6.668 -4.304
367 HB2 GLU 51 2HB GLU 51 7.489 4.874 -5.022
368 HB3 GLU 51 1HB GLU 51 8.104 6.478 -5.368
369 HG2 GLU 51 2HG GLU 51 9.571 6.318 -3.404
370 HG3 GLU 51 1HG GLU 51 8.918 4.724 -3.062
371 H ILE 52 H ILE 52 4.664 5.116 -3.811
372 HA ILE 52 HA ILE 52 5.210 3.588 -1.371
373 HB ILE 52 HB ILE 52 2.560 4.057 -2.773
374 HG12 ILE 52 2HG1 ILE 52 3.560 5.123 -0.114
375 HG13 ILE 52 1HG1 ILE 52 3.399 6.065 -1.590
376 HG21 ILE 52 1HG2 ILE 52 1.580 2.903 -0.840
377 HG22 ILE 52 2HG2 ILE 52 3.203 2.606 -0.205
378 HG23 ILE 52 3HG2 ILE 52 2.708 1.876 -1.734
379 HD11 ILE 52 3HD1 ILE 52 1.557 6.487 -0.062
380 HD12 ILE 52 1HD1 ILE 52 1.146 4.773 -0.063
381 HD13 ILE 52 2HD1 ILE 52 0.978 5.718 -1.542
382 H ARG 53 H ARG 53 5.781 1.578 -1.756
383 HA ARG 53 HA ARG 53 5.043 0.427 -4.340
384 HB2 ARG 53 2HB ARG 53 7.416 0.702 -4.243
385 HB3 ARG 53 1HB ARG 53 7.497 -0.041 -2.662
386 HG2 ARG 53 2HG ARG 53 7.049 -2.190 -3.545
387 HG3 ARG 53 1HG ARG 53 6.568 -1.520 -5.108
388 HD2 ARG 53 2HD ARG 53 9.335 -1.216 -3.956
389 HD3 ARG 53 1HD ARG 53 8.867 -2.529 -5.048
390 HE ARG 53 HE ARG 53 8.537 -0.997 -6.760
391 HH11 ARG 53 1HH1 ARG 53 10.012 0.559 -3.920
392 HH12 ARG 53 2HH1 ARG 53 10.393 1.999 -4.751
393 HH21 ARG 53 1HH2 ARG 53 9.187 0.925 -7.888
394 HH22 ARG 53 2HH2 ARG 53 9.972 2.178 -7.034
395 H TRP 54 H TRP 54 3.488 -0.932 -4.188
396 HA TRP 54 HA TRP 54 3.249 -2.358 -1.705
397 HB2 TRP 54 2HB TRP 54 1.302 -1.062 -2.097
398 HB3 TRP 54 1HB TRP 54 1.222 -1.565 -3.783
399 HD1 TRP 54 HD TRP 54 -0.782 -3.178 -4.099
400 HE1 TRP 54 1HE TRP 54 -1.875 -5.076 -2.732
401 HE3 TRP 54 3HE TRP 54 2.103 -2.966 0.089
402 HZ2 TRP 54 2HZ TRP 54 -1.557 -6.301 -0.257
403 HZ3 TRP 54 3HZ TRP 54 1.647 -4.534 1.909
404 HH2 TRP 54 HH TRP 54 -0.145 -6.166 1.745
405 H ASP 55 H ASP 55 3.898 -4.337 -1.724
406 HA ASP 55 HA ASP 55 3.714 -5.965 -4.178
407 HB2 ASP 55 2HB ASP 55 6.066 -5.390 -3.269
408 HB3 ASP 55 1HB ASP 55 5.653 -6.377 -1.876
409 H GLY 56 H GLY 56 3.598 -8.419 -3.367
410 HA2 GLY 56 2HA GLY 56 1.254 -8.498 -1.682
411 HA3 GLY 56 1HA GLY 56 1.972 -9.860 -2.527
412 H GLN 57 H GLN 57 3.104 -7.603 -0.070
413 HA GLN 57 HA GLN 57 3.311 -9.666 1.944
414 HB2 GLN 57 2HB GLN 57 5.742 -8.101 1.022
415 HB3 GLN 57 1HB GLN 57 5.657 -9.023 2.510
416 HG2 GLN 57 2HG GLN 57 5.369 -11.074 1.191
417 HG3 GLN 57 1HG GLN 57 5.485 -10.125 -0.289
418 HE21 GLN 57 1HE2 GLN 57 7.190 -11.421 2.409
419 HE22 GLN 57 2HE2 GLN 57 8.772 -11.114 1.826
420 H VAL 58 H VAL 58 4.890 -6.502 1.565
421 HA VAL 58 HA VAL 58 3.059 -5.286 3.449
422 HB VAL 58 HB VAL 58 4.929 -4.245 4.721
423 HG11 VAL 58 1HG1 VAL 58 3.877 -6.201 5.680
424 HG12 VAL 58 2HG1 VAL 58 5.600 -6.185 6.060
425 HG13 VAL 58 3HG1 VAL 58 4.987 -7.253 4.801
426 HG21 VAL 58 3HG2 VAL 58 6.686 -4.402 3.038
427 HG22 VAL 58 1HG2 VAL 58 6.700 -6.161 3.203
428 HG23 VAL 58 2HG2 VAL 58 7.203 -5.136 4.555
429 H ALA 59 H ALA 59 3.344 -2.895 3.424
430 HA ALA 59 HA ALA 59 3.920 -2.105 0.689
431 HB1 ALA 59 1HB ALA 59 2.506 -0.583 2.876
432 HB2 ALA 59 2HB ALA 59 1.723 -1.508 1.599
433 HB3 ALA 59 3HB ALA 59 2.670 -0.076 1.195
434 H LEU 60 H LEU 60 5.655 -1.173 0.177
435 HA LEU 60 HA LEU 60 7.522 -0.259 2.197
436 HB2 LEU 60 2HB LEU 60 8.215 -1.827 0.422
437 HB3 LEU 60 1HB LEU 60 7.747 -0.678 -0.794
438 HG LEU 60 HG LEU 60 10.018 -0.153 1.145
439 HD11 LEU 60 1HD1 LEU 60 10.448 -2.221 -0.068
440 HD12 LEU 60 2HD1 LEU 60 11.499 -0.931 -0.653
441 HD13 LEU 60 3HD1 LEU 60 10.077 -1.417 -1.589
442 HD21 LEU 60 3HD2 LEU 60 9.377 0.956 -1.598
443 HD22 LEU 60 1HD2 LEU 60 10.765 1.400 -0.598
444 HD23 LEU 60 2HD2 LEU 60 9.127 1.804 -0.073
445 H LEU 61 H LEU 61 8.009 1.865 2.514
446 HA LEU 61 HA LEU 61 6.689 3.843 0.800
447 HB2 LEU 61 2HB LEU 61 5.623 3.489 2.996
448 HB3 LEU 61 1HB LEU 61 7.112 3.815 3.816
449 HG LEU 61 HG LEU 61 5.510 5.646 4.028
450 HD11 LEU 61 1HD1 LEU 61 6.810 7.563 3.316
451 HD12 LEU 61 2HD1 LEU 61 7.820 6.509 2.322
452 HD13 LEU 61 3HD1 LEU 61 7.814 6.327 4.075
453 HD21 LEU 61 3HD2 LEU 61 4.770 6.951 2.135
454 HD22 LEU 61 1HD2 LEU 61 4.267 5.271 1.997
455 HD23 LEU 61 2HD2 LEU 61 5.624 5.865 1.035
456 H ALA 62 H ALA 62 8.147 5.174 -0.140
457 HA ALA 62 HA ALA 62 10.641 5.714 1.300
458 HB1 ALA 62 1HB ALA 62 11.137 4.076 -0.468
459 HB2 ALA 62 2HB ALA 62 11.923 5.624 -0.773
460 HB3 ALA 62 3HB ALA 62 10.474 5.181 -1.671
461 H ASP 63 H ASP 63 11.300 7.758 1.278
462 HA ASP 63 HA ASP 63 9.526 9.749 0.056
463 HB2 ASP 63 2HB ASP 63 9.550 9.888 2.459
464 HB3 ASP 63 1HB ASP 63 11.299 9.778 2.507
465 H LEU 64 H LEU 64 10.303 10.821 -1.611
466 HA LEU 64 HA LEU 64 13.217 10.910 -2.142
467 HB2 LEU 64 2HB LEU 64 10.820 11.380 -3.938
468 HB3 LEU 64 1HB LEU 64 12.469 11.646 -4.449
469 HG LEU 64 HG LEU 64 11.607 9.708 -5.448
470 HD11 LEU 64 1HD1 LEU 64 13.511 8.907 -3.252
471 HD12 LEU 64 2HD1 LEU 64 13.931 9.546 -4.843
472 HD13 LEU 64 3HD1 LEU 64 13.178 7.957 -4.701
473 HD21 LEU 64 3HD2 LEU 64 9.801 9.127 -3.971
474 HD22 LEU 64 1HD2 LEU 64 10.938 8.648 -2.707
475 HD23 LEU 64 2HD2 LEU 64 10.843 7.727 -4.209
476 H ASN 65 H ASN 65 13.426 12.645 -0.575
477 HA ASN 65 HA ASN 65 12.624 15.264 -1.340
478 HB2 ASN 65 2HB ASN 65 10.450 14.548 -0.934
479 HB3 ASN 65 1HB ASN 65 10.934 13.549 0.409
480 HD21 ASN 65 1HD2 ASN 65 9.523 14.198 1.626
481 HD22 ASN 65 2HD2 ASN 65 9.343 15.762 2.366
482 H SER 66 H SER 66 13.952 16.576 -0.252
483 HA SER 66 HA SER 66 15.301 15.485 2.106
484 HB2 SER 66 2HB SER 66 16.186 17.710 0.284
485 HB3 SER 66 1HB SER 66 17.123 16.978 1.588
486 HG SER 66 HG SER 66 16.781 14.946 0.391
487 H THR 67 H THR 67 13.686 18.456 0.957
488 HA THR 67 HA THR 67 14.360 19.714 3.461
489 HB THR 67 HB THR 67 14.733 21.001 1.432
490 HG1 THR 67 1HG THR 67 14.156 22.081 3.365
491 HG21 THR 67 3HG2 THR 67 12.928 20.100 0.028
492 HG22 THR 67 1HG2 THR 67 12.856 21.862 0.081
493 HG23 THR 67 2HG2 THR 67 11.732 20.901 1.043
494 H ASN 68 H ASN 68 11.567 18.257 2.067
495 HA ASN 68 HA ASN 68 9.877 19.311 4.232
496 HB2 ASN 68 2HB ASN 68 9.196 18.541 1.386
497 HB3 ASN 68 1HB ASN 68 7.966 18.607 2.633
498 HD21 ASN 68 1HD2 ASN 68 6.872 20.242 1.570
499 HD22 ASN 68 2HD2 ASN 68 7.457 21.858 1.488
500 H GLY 69 H GLY 69 11.697 17.168 4.426
501 HA2 GLY 69 2HA GLY 69 11.064 14.632 3.715
502 HA3 GLY 69 1HA GLY 69 11.852 15.022 5.230
503 H THR 70 H THR 70 9.631 13.197 4.052
504 HA THR 70 HA THR 70 7.257 13.736 5.418
505 HB THR 70 HB THR 70 8.330 11.238 4.119
506 HG1 THR 70 1HG THR 70 8.054 12.468 2.475
507 HG21 THR 70 3HG2 THR 70 6.474 10.693 5.632
508 HG22 THR 70 1HG2 THR 70 5.971 10.539 3.950
509 HG23 THR 70 2HG2 THR 70 5.494 11.956 4.890
510 H THR 71 H THR 71 6.449 13.059 7.331
511 HA THR 71 HA THR 71 8.236 11.582 9.096
512 HB THR 71 HB THR 71 6.699 12.537 10.877
513 HG1 THR 71 1HG THR 71 6.013 14.728 9.551
514 HG21 THR 71 3HG2 THR 71 8.360 14.421 9.219
515 HG22 THR 71 1HG2 THR 71 8.911 13.360 10.520
516 HG23 THR 71 2HG2 THR 71 7.820 14.705 10.889
517 H VAL 72 H VAL 72 7.529 9.792 10.056
518 HA VAL 72 HA VAL 72 4.809 8.905 9.487
519 HB VAL 72 HB VAL 72 5.704 6.569 9.636
520 HG11 VAL 72 1HG1 VAL 72 6.839 6.576 7.443
521 HG12 VAL 72 2HG1 VAL 72 7.032 8.325 7.571
522 HG13 VAL 72 3HG1 VAL 72 5.421 7.627 7.439
523 HG21 VAL 72 3HG2 VAL 72 8.378 7.973 9.672
524 HG22 VAL 72 1HG2 VAL 72 8.148 6.232 9.483
525 HG23 VAL 72 2HG2 VAL 72 7.685 7.033 10.989
526 H ASN 73 H ASN 73 3.624 8.843 11.187
527 HA ASN 73 HA ASN 73 2.918 9.123 13.235
528 HB2 ASN 73 2HB ASN 73 4.836 6.914 13.577
529 HB3 ASN 73 1HB ASN 73 4.484 7.779 15.072
530 HD21 ASN 73 1HD2 ASN 73 3.236 5.533 12.708
531 HD22 ASN 73 2HD2 ASN 73 1.731 5.323 13.497
532 H ASN 74 H ASN 74 4.655 10.962 12.187
533 HA ASN 74 HA ASN 74 5.381 12.962 12.648
534 HB2 ASN 74 2HB ASN 74 4.008 12.991 14.740
535 HB3 ASN 74 1HB ASN 74 5.367 12.315 15.625
536 HD21 ASN 74 1HD2 ASN 74 5.462 14.088 17.008
537 HD22 ASN 74 2HD2 ASN 74 6.029 15.633 16.496
538 H ALA 75 H ALA 75 7.047 10.223 12.922
539 HA ALA 75 HA ALA 75 9.574 11.425 13.738
540 HB1 ALA 75 1HB ALA 75 8.945 8.582 12.926
541 HB2 ALA 75 2HB ALA 75 9.016 9.175 14.582
542 HB3 ALA 75 3HB ALA 75 10.476 9.154 13.590
543 HA PRO 76 HA PRO 76 10.278 12.260 9.346
544 HB2 PRO 76 2HB PRO 76 12.843 13.191 9.638
545 HB3 PRO 76 1HB PRO 76 11.410 14.181 9.923
546 HG2 PRO 76 2HG PRO 76 13.160 12.772 11.892
547 HG3 PRO 76 1HG PRO 76 12.414 14.376 12.003
548 HD2 PRO 76 2HD PRO 76 11.432 12.211 13.285
549 HD3 PRO 76 1HD PRO 76 10.383 13.514 12.686
550 H VAL 77 H VAL 77 10.886 10.848 7.833
551 HA VAL 77 HA VAL 77 13.212 9.130 8.289
552 HB VAL 77 HB VAL 77 11.960 7.158 7.408
553 HG11 VAL 77 1HG1 VAL 77 10.712 6.613 9.449
554 HG12 VAL 77 2HG1 VAL 77 10.846 8.296 9.964
555 HG13 VAL 77 3HG1 VAL 77 12.297 7.304 9.790
556 HG21 VAL 77 3HG2 VAL 77 10.162 8.304 6.249
557 HG22 VAL 77 1HG2 VAL 77 9.534 8.914 7.778
558 HG23 VAL 77 2HG2 VAL 77 9.489 7.188 7.439
559 H GLN 78 H GLN 78 13.820 8.020 6.259
560 HA GLN 78 HA GLN 78 12.950 9.549 3.915
561 HB2 GLN 78 2HB GLN 78 15.023 8.847 2.804
562 HB3 GLN 78 1HB GLN 78 15.354 9.713 4.294
563 HG2 GLN 78 2HG GLN 78 15.829 7.604 5.415
564 HG3 GLN 78 1HG GLN 78 15.452 6.728 3.933
565 HE21 GLN 78 1HE2 GLN 78 17.926 6.899 5.487
566 HE22 GLN 78 2HE2 GLN 78 19.125 7.409 4.369
567 H GLU 79 H GLU 79 12.916 6.518 5.441
568 HA GLU 79 HA GLU 79 11.166 5.519 3.411
569 HB2 GLU 79 2HB GLU 79 12.269 3.327 3.256
570 HB3 GLU 79 1HB GLU 79 13.326 4.596 2.657
571 HG2 GLU 79 2HG GLU 79 14.682 4.495 4.611
572 HG3 GLU 79 1HG GLU 79 13.514 3.461 5.433
573 H TRP 80 H TRP 80 9.900 3.764 4.241
574 HA TRP 80 HA TRP 80 10.140 2.993 6.973
575 HB2 TRP 80 2HB TRP 80 9.154 5.172 7.330
576 HB3 TRP 80 1HB TRP 80 7.860 4.916 6.189
577 HD1 TRP 80 HD TRP 80 5.748 3.648 7.055
578 HE1 TRP 80 1HE TRP 80 4.966 2.943 9.392
579 HE3 TRP 80 3HE TRP 80 10.149 4.268 9.565
580 HZ2 TRP 80 2HZ TRP 80 6.076 2.704 11.954
581 HZ3 TRP 80 3HZ TRP 80 10.194 3.789 11.978
582 HH2 TRP 80 HH TRP 80 8.183 3.030 13.141
583 H GLN 81 H GLN 81 8.721 1.261 7.431
584 HA GLN 81 HA GLN 81 7.405 0.168 5.056
585 HB2 GLN 81 2HB GLN 81 8.212 -1.256 7.607
586 HB3 GLN 81 1HB GLN 81 7.433 -2.011 6.224
587 HG2 GLN 81 2HG GLN 81 9.391 -1.410 4.841
588 HG3 GLN 81 1HG GLN 81 10.173 -0.769 6.283
589 HE21 GLN 81 1HE2 GLN 81 11.836 -2.219 6.146
590 HE22 GLN 81 2HE2 GLN 81 11.658 -3.892 6.537
591 H LEU 82 H LEU 82 5.380 0.570 4.963
592 HA LEU 82 HA LEU 82 3.905 1.930 6.886
593 HB2 LEU 82 2HB LEU 82 2.887 0.260 4.617
594 HB3 LEU 82 1HB LEU 82 1.974 1.448 5.521
595 HG LEU 82 HG LEU 82 4.299 1.982 3.687
596 HD11 LEU 82 1HD1 LEU 82 2.209 1.540 2.523
597 HD12 LEU 82 2HD1 LEU 82 2.665 3.236 2.378
598 HD13 LEU 82 3HD1 LEU 82 1.394 2.760 3.499
599 HD21 LEU 82 3HD2 LEU 82 3.793 4.369 4.161
600 HD22 LEU 82 1HD2 LEU 82 4.469 3.478 5.525
601 HD23 LEU 82 2HD2 LEU 82 2.748 3.814 5.474
602 H ALA 83 H ALA 83 2.755 1.335 8.600
603 HA ALA 83 HA ALA 83 1.781 -1.406 8.793
604 HB1 ALA 83 1HB ALA 83 2.164 -1.234 11.233
605 HB2 ALA 83 2HB ALA 83 2.914 0.342 10.988
606 HB3 ALA 83 3HB ALA 83 3.667 -1.102 10.319
607 H ASP 84 H ASP 84 -0.095 -1.467 10.344
608 HA ASP 84 HA ASP 84 -2.026 0.482 9.561
609 HB2 ASP 84 2HB ASP 84 -2.627 -1.901 9.990
610 HB3 ASP 84 1HB ASP 84 -2.233 -1.672 11.688
611 H GLY 85 H GLY 85 -2.166 2.410 10.412
612 HA2 GLY 85 2HA GLY 85 -2.787 3.690 12.375
613 HA3 GLY 85 1HA GLY 85 -1.670 2.693 13.299
614 H ASP 86 H ASP 86 -0.298 3.471 10.304
615 HA ASP 86 HA ASP 86 1.393 5.370 11.634
616 HB2 ASP 86 2HB ASP 86 1.532 4.217 8.873
617 HB3 ASP 86 1HB ASP 86 2.549 5.564 9.359
618 H VAL 87 H VAL 87 1.038 7.318 11.829
619 HA VAL 87 HA VAL 87 -0.720 8.734 9.976
620 HB VAL 87 HB VAL 87 0.756 9.885 12.369
621 HG11 VAL 87 1HG1 VAL 87 -0.983 11.595 12.308
622 HG12 VAL 87 2HG1 VAL 87 -1.693 10.820 10.893
623 HG13 VAL 87 3HG1 VAL 87 -0.071 11.513 10.804
624 HG21 VAL 87 3HG2 VAL 87 -2.023 8.687 12.319
625 HG22 VAL 87 1HG2 VAL 87 -1.315 9.566 13.675
626 HG23 VAL 87 2HG2 VAL 87 -0.623 8.028 13.163
627 H ILE 88 H ILE 88 0.258 9.508 8.238
628 HA ILE 88 HA ILE 88 3.119 10.006 8.400
629 HB ILE 88 HB ILE 88 1.406 9.128 6.064
630 HG12 ILE 88 2HG1 ILE 88 3.473 7.679 7.743
631 HG13 ILE 88 1HG1 ILE 88 1.747 7.394 7.727
632 HG21 ILE 88 1HG2 ILE 88 3.225 10.560 5.295
633 HG22 ILE 88 2HG2 ILE 88 3.514 8.880 4.834
634 HG23 ILE 88 3HG2 ILE 88 4.385 9.584 6.195
635 HD11 ILE 88 3HD1 ILE 88 2.962 5.683 6.496
636 HD12 ILE 88 1HD1 ILE 88 3.611 6.915 5.420
637 HD13 ILE 88 2HD1 ILE 88 1.879 6.590 5.439
638 H ARG 89 H ARG 89 3.723 12.056 8.084
639 HA ARG 89 HA ARG 89 1.860 13.950 6.812
640 HB2 ARG 89 2HB ARG 89 3.960 14.365 8.922
641 HB3 ARG 89 1HB ARG 89 3.433 15.683 7.906
642 HG2 ARG 89 2HG ARG 89 2.344 15.784 10.052
643 HG3 ARG 89 1HG ARG 89 1.164 15.440 8.794
644 HD2 ARG 89 2HD ARG 89 0.945 13.193 9.492
645 HD3 ARG 89 1HD ARG 89 2.400 13.281 10.488
646 HE ARG 89 HE ARG 89 1.217 14.215 12.160
647 HH11 ARG 89 1HH1 ARG 89 -0.840 14.355 9.289
648 HH12 ARG 89 2HH1 ARG 89 -2.243 14.864 10.106
649 HH21 ARG 89 1HH2 ARG 89 -0.741 14.791 13.320
650 HH22 ARG 89 2HH2 ARG 89 -2.180 15.124 12.455
651 H LEU 90 H LEU 90 2.450 14.627 4.897
652 HA LEU 90 HA LEU 90 5.270 14.601 4.200
653 HB2 LEU 90 2HB LEU 90 4.755 13.888 1.897
654 HB3 LEU 90 1HB LEU 90 4.361 12.655 3.064
655 HG LEU 90 HG LEU 90 2.267 14.456 1.853
656 HD11 LEU 90 1HD1 LEU 90 1.810 12.623 0.281
657 HD12 LEU 90 2HD1 LEU 90 3.205 11.740 0.904
658 HD13 LEU 90 3HD1 LEU 90 3.437 13.266 0.052
659 HD21 LEU 90 3HD2 LEU 90 2.120 11.728 3.158
660 HD22 LEU 90 1HD2 LEU 90 0.756 12.618 2.480
661 HD23 LEU 90 2HD2 LEU 90 1.610 13.247 3.888
662 H GLY 91 H GLY 91 5.691 15.981 2.262
663 HA2 GLY 91 2HA GLY 91 5.038 18.605 2.827
664 HA3 GLY 91 1HA GLY 91 5.631 18.044 1.270
665 H HIS 92 H HIS 92 3.109 19.377 2.956
666 HA HIS 92 HA HIS 92 1.177 20.303 2.432
667 HB2 HIS 92 2HB HIS 92 1.798 19.525 -0.422
668 HB3 HIS 92 1HB HIS 92 0.429 20.523 0.054
669 HD1 HIS 92 1HD HIS 92 0.995 22.999 0.875
670 HD2 HIS 92 2HD HIS 92 4.258 20.774 -0.444
671 HE1 HIS 92 1HE HIS 92 2.884 24.613 0.622
672 H SER 93 H SER 93 1.418 17.255 2.920
673 HA SER 93 HA SER 93 -1.436 16.905 2.729
674 HB2 SER 93 2HB SER 93 -0.608 16.070 0.528
675 HB3 SER 93 1HB SER 93 0.415 14.913 1.365
676 HG SER 93 HG SER 93 -1.963 14.487 0.570
677 H GLU 94 H GLU 94 -2.077 14.790 3.821
678 HA GLU 94 HA GLU 94 -0.173 13.664 5.619
679 HB2 GLU 94 2HB GLU 94 -1.560 14.135 7.638
680 HB3 GLU 94 1HB GLU 94 -0.798 15.567 6.963
681 HG2 GLU 94 2HG GLU 94 -2.937 16.172 5.912
682 HG3 GLU 94 1HG GLU 94 -3.677 14.749 6.644
683 H ILE 95 H ILE 95 -0.710 11.579 6.066
684 HA ILE 95 HA ILE 95 -3.370 10.702 5.266
685 HB ILE 95 HB ILE 95 -1.843 10.656 3.279
686 HG12 ILE 95 2HG1 ILE 95 -2.289 8.276 2.644
687 HG13 ILE 95 1HG1 ILE 95 -2.866 8.018 4.290
688 HG21 ILE 95 1HG2 ILE 95 -0.304 8.577 4.810
689 HG22 ILE 95 2HG2 ILE 95 0.265 10.182 4.339
690 HG23 ILE 95 3HG2 ILE 95 -0.084 8.972 3.104
691 HD11 ILE 95 3HD1 ILE 95 -4.551 9.760 3.950
692 HD12 ILE 95 1HD1 ILE 95 -4.718 8.429 2.817
693 HD13 ILE 95 2HD1 ILE 95 -3.995 9.946 2.288
694 H ILE 96 H ILE 96 -4.007 8.751 6.355
695 HA ILE 96 HA ILE 96 -2.007 7.688 8.219
696 HB ILE 96 HB ILE 96 -5.043 7.628 8.481
697 HG12 ILE 96 2HG1 ILE 96 -2.984 9.197 10.056
698 HG13 ILE 96 1HG1 ILE 96 -4.099 9.872 8.879
699 HG21 ILE 96 1HG2 ILE 96 -4.633 6.713 10.725
700 HG22 ILE 96 2HG2 ILE 96 -2.905 6.656 10.382
701 HG23 ILE 96 3HG2 ILE 96 -4.022 5.645 9.461
702 HD11 ILE 96 3HD1 ILE 96 -4.824 10.280 11.168
703 HD12 ILE 96 1HD1 ILE 96 -4.863 8.545 11.472
704 HD13 ILE 96 2HD1 ILE 96 -5.979 9.260 10.306
705 H VAL 97 H VAL 97 -1.581 5.539 8.089
706 HA VAL 97 HA VAL 97 -2.807 4.177 5.821
707 HB VAL 97 HB VAL 97 -0.237 3.654 7.316
708 HG11 VAL 97 1HG1 VAL 97 0.175 1.883 5.655
709 HG12 VAL 97 2HG1 VAL 97 -1.468 2.101 5.037
710 HG13 VAL 97 3HG1 VAL 97 -1.209 1.530 6.686
711 HG21 VAL 97 3HG2 VAL 97 -0.202 5.529 5.767
712 HG22 VAL 97 1HG2 VAL 97 -0.833 4.490 4.489
713 HG23 VAL 97 2HG2 VAL 97 0.771 4.189 5.150
714 H ARG 98 H ARG 98 -4.140 2.473 6.014
715 HA ARG 98 HA ARG 98 -4.215 1.056 8.570
716 HB2 ARG 98 2HB ARG 98 -6.445 1.423 6.578
717 HB3 ARG 98 1HB ARG 98 -6.536 0.548 8.100
718 HG2 ARG 98 2HG ARG 98 -6.165 3.466 7.674
719 HG3 ARG 98 1HG ARG 98 -7.645 2.705 8.283
720 HD2 ARG 98 2HD ARG 98 -4.961 3.050 9.630
721 HD3 ARG 98 1HD ARG 98 -6.512 3.700 10.139
722 HE ARG 98 HE ARG 98 -5.624 0.904 10.356
723 HH11 ARG 98 1HH1 ARG 98 -8.028 3.357 11.229
724 HH12 ARG 98 2HH1 ARG 98 -8.524 2.572 12.647
725 HH21 ARG 98 1HH2 ARG 98 -6.185 -0.095 12.333
726 HH22 ARG 98 2HH2 ARG 98 -7.456 0.534 13.312
727 H MET 99 H MET 99 -4.527 -1.108 8.426
728 HA MET 99 HA MET 99 -3.983 -2.315 5.787
729 HB2 MET 99 2HB MET 99 -2.575 -3.113 8.347
730 HB3 MET 99 1HB MET 99 -2.482 -3.979 6.827
731 HG2 MET 99 2HG MET 99 -1.438 -2.038 5.778
732 HG3 MET 99 1HG MET 99 -1.525 -1.165 7.309
733 HE1 MET 99 3HE MET 99 0.137 -4.138 5.333
734 HE2 MET 99 1HE MET 99 -0.635 -4.987 6.669
735 HE3 MET 99 2HE MET 99 1.122 -4.898 6.581
736 H HIS 100 H HIS 100 -4.765 -4.321 5.411
737 HA HIS 100 HA HIS 100 -6.595 -5.462 7.398
738 HB2 HIS 100 2HB HIS 100 -6.989 -5.471 4.394
739 HB3 HIS 100 1HB HIS 100 -8.097 -6.092 5.595
740 HD1 HIS 100 1HD HIS 100 -9.886 -4.501 6.399
741 HD2 HIS 100 2HD HIS 100 -6.815 -2.575 4.375
742 HE1 HIS 100 1HE HIS 100 -10.626 -2.106 6.116
Start of MODEL 30
1 H1 GLY 1 1HT GLY 1 -0.802 -9.997 -10.574
2 H2 GLY 1 2HT GLY 1 0.543 -10.777 -9.953
3 H3 GLY 1 3HT GLY 1 -0.924 -10.785 -9.087
4 HA2 GLY 1 1HA GLY 1 -0.406 -12.063 -11.701
5 HA3 GLY 1 2HA GLY 1 -0.618 -12.899 -10.164
6 H HIS 2 H HIS 2 -2.698 -12.494 -9.040
7 HA HIS 2 HA HIS 2 -4.836 -11.980 -10.952
8 HB2 HIS 2 2HB HIS 2 -4.690 -14.034 -8.737
9 HB3 HIS 2 1HB HIS 2 -6.227 -13.497 -9.401
10 HD1 HIS 2 1HD HIS 2 -7.061 -15.281 -10.941
11 HD2 HIS 2 2HD HIS 2 -2.951 -14.755 -11.244
12 HE1 HIS 2 1HE HIS 2 -6.289 -16.820 -12.775
13 H GLY 3 H GLY 3 -6.628 -10.875 -10.149
14 HA2 GLY 3 2HA GLY 3 -5.901 -8.892 -8.193
15 HA3 GLY 3 1HA GLY 3 -7.382 -8.941 -9.136
16 H SER 4 H SER 4 -5.901 -11.081 -6.764
17 HA SER 4 HA SER 4 -8.474 -11.458 -5.479
18 HB2 SER 4 2HB SER 4 -5.778 -12.615 -4.752
19 HB3 SER 4 1HB SER 4 -7.368 -13.193 -4.242
20 HG SER 4 HG SER 4 -7.537 -13.192 -6.802
21 H ALA 5 H ALA 5 -8.956 -10.613 -3.472
22 HA ALA 5 HA ALA 5 -7.250 -8.460 -2.607
23 HB1 ALA 5 1HB ALA 5 -9.669 -8.092 -2.785
24 HB2 ALA 5 2HB ALA 5 -9.097 -7.850 -1.133
25 HB3 ALA 5 3HB ALA 5 -9.942 -9.339 -1.570
26 H GLY 6 H GLY 6 -5.513 -9.388 -1.669
27 HA2 GLY 6 2HA GLY 6 -5.893 -11.279 0.508
28 HA3 GLY 6 1HA GLY 6 -4.343 -10.671 -0.083
29 H THR 7 H THR 7 -3.823 -8.477 0.387
30 HA THR 7 HA THR 7 -5.159 -7.410 2.756
31 HB THR 7 HB THR 7 -2.204 -7.299 2.056
32 HG1 THR 7 1HG THR 7 -3.734 -8.838 3.858
33 HG21 THR 7 3HG2 THR 7 -1.936 -6.261 4.285
34 HG22 THR 7 1HG2 THR 7 -3.690 -6.271 4.491
35 HG23 THR 7 2HG2 THR 7 -2.955 -5.279 3.232
36 H SER 8 H SER 8 -6.125 -5.598 2.233
37 HA SER 8 HA SER 8 -5.120 -4.147 -0.109
38 HB2 SER 8 2HB SER 8 -7.812 -3.871 1.260
39 HB3 SER 8 1HB SER 8 -7.317 -3.125 -0.255
40 HG SER 8 HG SER 8 -6.815 -5.642 -0.589
41 H VAL 9 H VAL 9 -4.068 -2.292 0.188
42 HA VAL 9 HA VAL 9 -4.118 -1.126 2.880
43 HB VAL 9 HB VAL 9 -2.195 -0.492 0.639
44 HG11 VAL 9 1HG1 VAL 9 -0.789 0.389 2.466
45 HG12 VAL 9 2HG1 VAL 9 -2.086 0.013 3.600
46 HG13 VAL 9 3HG1 VAL 9 -2.343 1.218 2.339
47 HG21 VAL 9 3HG2 VAL 9 -0.572 -1.954 1.756
48 HG22 VAL 9 1HG2 VAL 9 -1.975 -2.856 1.191
49 HG23 VAL 9 2HG2 VAL 9 -1.815 -2.461 2.899
50 H THR 10 H THR 10 -5.368 0.532 3.146
51 HA THR 10 HA THR 10 -6.015 2.207 0.846
52 HB THR 10 HB THR 10 -7.658 1.748 3.359
53 HG1 THR 10 1HG THR 10 -8.435 0.088 2.399
54 HG21 THR 10 3HG2 THR 10 -8.058 3.921 2.256
55 HG22 THR 10 1HG2 THR 10 -9.453 2.854 2.083
56 HG23 THR 10 2HG2 THR 10 -8.349 3.087 0.728
57 H LEU 11 H LEU 11 -5.253 4.158 0.978
58 HA LEU 11 HA LEU 11 -4.049 5.107 3.443
59 HB2 LEU 11 2HB LEU 11 -4.020 6.360 0.711
60 HB3 LEU 11 1HB LEU 11 -2.993 6.716 2.088
61 HG LEU 11 HG LEU 11 -3.013 4.193 0.555
62 HD11 LEU 11 1HD1 LEU 11 -2.121 6.070 -0.757
63 HD12 LEU 11 2HD1 LEU 11 -0.794 5.003 -0.290
64 HD13 LEU 11 3HD1 LEU 11 -1.059 6.515 0.575
65 HD21 LEU 11 3HD2 LEU 11 -1.175 5.150 2.752
66 HD22 LEU 11 1HD2 LEU 11 -0.906 3.702 1.781
67 HD23 LEU 11 2HD2 LEU 11 -2.316 3.806 2.832
68 H GLN 12 H GLN 12 -4.959 6.570 4.556
69 HA GLN 12 HA GLN 12 -7.384 7.951 3.558
70 HB2 GLN 12 2HB GLN 12 -7.372 6.308 5.601
71 HB3 GLN 12 1HB GLN 12 -6.611 7.630 6.459
72 HG2 GLN 12 2HG GLN 12 -9.344 7.659 5.192
73 HG3 GLN 12 1HG GLN 12 -9.001 7.509 6.912
74 HE21 GLN 12 1HE2 GLN 12 -8.263 9.345 8.018
75 HE22 GLN 12 2HE2 GLN 12 -8.471 10.926 7.365
76 H LEU 13 H LEU 13 -6.891 10.008 2.991
77 HA LEU 13 HA LEU 13 -4.608 11.407 4.190
78 HB2 LEU 13 2HB LEU 13 -4.494 11.077 1.792
79 HB3 LEU 13 1HB LEU 13 -6.094 11.745 1.602
80 HG LEU 13 HG LEU 13 -5.244 13.891 2.433
81 HD11 LEU 13 1HD1 LEU 13 -3.280 13.172 3.647
82 HD12 LEU 13 2HD1 LEU 13 -2.804 14.304 2.381
83 HD13 LEU 13 3HD1 LEU 13 -2.540 12.573 2.160
84 HD21 LEU 13 3HD2 LEU 13 -4.093 14.518 0.343
85 HD22 LEU 13 1HD2 LEU 13 -5.535 13.542 0.067
86 HD23 LEU 13 2HD2 LEU 13 -3.935 12.807 -0.056
87 H ASP 14 H ASP 14 -5.016 13.198 5.396
88 HA ASP 14 HA ASP 14 -7.732 14.198 5.290
89 HB2 ASP 14 2HB ASP 14 -6.972 13.730 7.548
90 HB3 ASP 14 1HB ASP 14 -5.580 14.788 7.323
91 H ASP 15 H ASP 15 -7.856 15.426 3.650
92 HA ASP 15 HA ASP 15 -5.923 17.558 3.275
93 HB2 ASP 15 2HB ASP 15 -6.995 17.858 1.095
94 HB3 ASP 15 1HB ASP 15 -6.617 16.152 1.323
95 H GLY 16 H GLY 16 -8.538 16.901 5.020
96 HA2 GLY 16 2HA GLY 16 -9.621 18.612 6.316
97 HA3 GLY 16 1HA GLY 16 -9.694 19.592 4.853
98 H SER 17 H SER 17 -10.336 17.022 3.331
99 HA SER 17 HA SER 17 -13.186 17.011 3.998
100 HB2 SER 17 2HB SER 17 -11.814 16.330 1.391
101 HB3 SER 17 1HB SER 17 -13.551 16.459 1.666
102 HG SER 17 HG SER 17 -12.243 18.688 2.464
103 H GLY 18 H GLY 18 -10.463 15.013 2.924
104 HA2 GLY 18 2HA GLY 18 -10.103 12.908 4.115
105 HA3 GLY 18 1HA GLY 18 -11.849 12.668 4.035
106 H ARG 19 H ARG 19 -8.897 12.267 2.446
107 HA ARG 19 HA ARG 19 -10.294 11.317 0.020
108 HB2 ARG 19 2HB ARG 19 -7.447 12.241 0.289
109 HB3 ARG 19 1HB ARG 19 -8.204 11.553 -1.142
110 HG2 ARG 19 2HG ARG 19 -9.100 14.094 0.189
111 HG3 ARG 19 1HG ARG 19 -7.906 14.054 -1.118
112 HD2 ARG 19 2HD ARG 19 -10.083 14.629 -1.998
113 HD3 ARG 19 1HD ARG 19 -9.625 13.036 -2.584
114 HE ARG 19 HE ARG 19 -11.169 12.785 -0.245
115 HH11 ARG 19 1HH1 ARG 19 -11.616 13.854 -3.571
116 HH12 ARG 19 2HH1 ARG 19 -13.195 13.225 -3.700
117 HH21 ARG 19 1HH2 ARG 19 -13.298 11.913 -0.420
118 HH22 ARG 19 2HH2 ARG 19 -14.177 12.069 -1.865
119 H THR 20 H THR 20 -9.570 9.416 -0.872
120 HA THR 20 HA THR 20 -7.832 7.822 0.827
121 HB THR 20 HB THR 20 -9.380 5.855 0.475
122 HG1 THR 20 1HG THR 20 -11.317 6.167 -0.403
123 HG21 THR 20 3HG2 THR 20 -10.388 8.234 1.995
124 HG22 THR 20 1HG2 THR 20 -9.300 7.002 2.615
125 HG23 THR 20 2HG2 THR 20 -10.987 6.584 2.258
126 H TYR 21 H TYR 21 -6.559 6.368 -0.228
127 HA TYR 21 HA TYR 21 -6.932 5.921 -3.094
128 HB2 TYR 21 2HB TYR 21 -5.315 7.804 -2.878
129 HB3 TYR 21 1HB TYR 21 -4.335 6.827 -1.794
130 HD1 TYR 21 1HD TYR 21 -5.606 6.978 -5.293
131 HD2 TYR 21 2HD TYR 21 -2.616 5.445 -2.676
132 HE1 TYR 21 1HE TYR 21 -4.320 6.166 -7.228
133 HE2 TYR 21 2HE TYR 21 -1.333 4.630 -4.609
134 HH TYR 21 HH TYR 21 -1.724 4.011 -6.956
135 H GLN 22 H GLN 22 -6.485 3.781 -3.579
136 HA GLN 22 HA GLN 22 -5.470 2.221 -1.330
137 HB2 GLN 22 2HB GLN 22 -7.718 1.594 -2.205
138 HB3 GLN 22 1HB GLN 22 -6.991 1.266 -3.770
139 HG2 GLN 22 2HG GLN 22 -5.669 -0.534 -2.806
140 HG3 GLN 22 1HG GLN 22 -6.311 -0.175 -1.208
141 HE21 GLN 22 1HE2 GLN 22 -6.443 -2.621 -2.737
142 HE22 GLN 22 2HE2 GLN 22 -8.116 -2.992 -2.934
143 H LEU 23 H LEU 23 -3.691 1.027 -1.538
144 HA LEU 23 HA LEU 23 -1.901 1.716 -3.664
145 HB2 LEU 23 2HB LEU 23 -1.603 -0.270 -1.425
146 HB3 LEU 23 1HB LEU 23 -0.339 0.139 -2.558
147 HG LEU 23 HG LEU 23 -1.583 2.002 -0.537
148 HD11 LEU 23 1HD1 LEU 23 -0.108 0.322 0.431
149 HD12 LEU 23 2HD1 LEU 23 0.622 1.926 0.499
150 HD13 LEU 23 3HD1 LEU 23 1.154 0.762 -0.718
151 HD21 LEU 23 3HD2 LEU 23 0.594 2.455 -2.579
152 HD22 LEU 23 1HD2 LEU 23 0.216 3.548 -1.247
153 HD23 LEU 23 2HD2 LEU 23 -0.976 3.255 -2.504
154 H ARG 24 H ARG 24 -1.408 0.636 -5.396
155 HA ARG 24 HA ARG 24 -2.730 -1.930 -5.855
156 HB2 ARG 24 2HB ARG 24 -1.381 -0.033 -7.793
157 HB3 ARG 24 1HB ARG 24 -2.247 -1.503 -8.225
158 HG2 ARG 24 2HG ARG 24 -4.327 -0.546 -7.424
159 HG3 ARG 24 1HG ARG 24 -3.476 0.911 -6.909
160 HD2 ARG 24 2HD ARG 24 -2.800 1.292 -9.258
161 HD3 ARG 24 1HD ARG 24 -3.749 -0.115 -9.725
162 HE ARG 24 HE ARG 24 -5.662 1.160 -8.686
163 HH11 ARG 24 1HH1 ARG 24 -2.915 2.794 -10.244
164 HH12 ARG 24 2HH1 ARG 24 -3.825 4.113 -10.806
165 HH21 ARG 24 1HH2 ARG 24 -6.928 2.999 -9.501
166 HH22 ARG 24 2HH2 ARG 24 -6.163 4.204 -10.425
167 H GLU 25 H GLU 25 -1.342 -3.504 -7.094
168 HA GLU 25 HA GLU 25 1.026 -3.983 -5.631
169 HB2 GLU 25 2HB GLU 25 1.340 -5.870 -7.249
170 HB3 GLU 25 1HB GLU 25 -0.204 -5.871 -6.406
171 HG2 GLU 25 2HG GLU 25 -1.344 -5.128 -8.344
172 HG3 GLU 25 1HG GLU 25 0.171 -4.768 -9.173
173 H GLY 26 H GLY 26 3.024 -3.342 -5.961
174 HA2 GLY 26 2HA GLY 26 4.851 -2.961 -7.544
175 HA3 GLY 26 1HA GLY 26 3.674 -2.122 -8.561
176 H SER 27 H SER 27 5.283 -0.309 -8.322
177 HA SER 27 HA SER 27 5.084 0.839 -5.699
178 HB2 SER 27 2HB SER 27 6.784 2.455 -6.444
179 HB3 SER 27 1HB SER 27 7.281 0.774 -6.566
180 HG SER 27 HG SER 27 7.797 1.252 -8.495
181 H ASN 28 H ASN 28 4.116 2.610 -5.188
182 HA ASN 28 HA ASN 28 2.333 3.870 -7.163
183 HB2 ASN 28 2HB ASN 28 1.973 3.526 -4.157
184 HB3 ASN 28 1HB ASN 28 0.840 4.327 -5.236
185 HD21 ASN 28 1HD2 ASN 28 2.182 1.255 -4.256
186 HD22 ASN 28 2HD2 ASN 28 0.992 0.250 -4.986
187 H ILE 29 H ILE 29 2.896 5.931 -7.523
188 HA ILE 29 HA ILE 29 4.687 7.214 -5.567
189 HB ILE 29 HB ILE 29 4.537 7.742 -8.555
190 HG12 ILE 29 2HG1 ILE 29 6.624 6.227 -6.954
191 HG13 ILE 29 1HG1 ILE 29 5.432 5.499 -8.017
192 HG21 ILE 29 1HG2 ILE 29 6.499 8.729 -6.473
193 HG22 ILE 29 2HG2 ILE 29 5.271 9.704 -7.281
194 HG23 ILE 29 3HG2 ILE 29 6.611 9.026 -8.208
195 HD11 ILE 29 3HD1 ILE 29 7.652 7.357 -8.849
196 HD12 ILE 29 1HD1 ILE 29 6.459 6.636 -9.928
197 HD13 ILE 29 2HD1 ILE 29 7.608 5.607 -9.074
198 H ILE 30 H ILE 30 4.158 9.131 -4.732
199 HA ILE 30 HA ILE 30 1.720 10.464 -5.692
200 HB ILE 30 HB ILE 30 2.935 10.499 -2.888
201 HG12 ILE 30 2HG1 ILE 30 0.381 9.198 -3.882
202 HG13 ILE 30 1HG1 ILE 30 1.859 8.348 -3.467
203 HG21 ILE 30 1HG2 ILE 30 1.935 12.608 -3.295
204 HG22 ILE 30 2HG2 ILE 30 0.866 11.691 -2.229
205 HG23 ILE 30 3HG2 ILE 30 0.485 11.864 -3.947
206 HD11 ILE 30 3HD1 ILE 30 1.626 9.074 -1.146
207 HD12 ILE 30 1HD1 ILE 30 0.204 8.187 -1.694
208 HD13 ILE 30 2HD1 ILE 30 0.152 9.947 -1.570
209 H GLY 31 H GLY 31 1.836 12.592 -6.202
210 HA2 GLY 31 2HA GLY 31 3.388 14.634 -5.408
211 HA3 GLY 31 1HA GLY 31 4.419 13.817 -6.606
212 H ARG 32 H ARG 32 4.171 15.664 -8.004
213 HA ARG 32 HA ARG 32 1.671 15.346 -9.570
214 HB2 ARG 32 2HB ARG 32 3.102 17.965 -9.202
215 HB3 ARG 32 1HB ARG 32 1.619 17.702 -10.085
216 HG2 ARG 32 2HG ARG 32 0.511 17.180 -7.922
217 HG3 ARG 32 1HG ARG 32 2.024 17.586 -7.129
218 HD2 ARG 32 2HD ARG 32 0.396 19.447 -8.852
219 HD3 ARG 32 1HD ARG 32 0.636 19.565 -7.106
220 HE ARG 32 HE ARG 32 3.070 19.587 -8.659
221 HH11 ARG 32 1HH1 ARG 32 0.596 21.652 -7.232
222 HH12 ARG 32 2HH1 ARG 32 1.580 23.055 -7.253
223 HH21 ARG 32 1HH2 ARG 32 4.346 21.433 -8.758
224 HH22 ARG 32 2HH2 ARG 32 3.788 22.933 -8.169
225 H GLY 33 H GLY 33 2.562 14.346 -11.306
226 HA2 GLY 33 2HA GLY 33 4.141 15.677 -13.126
227 HA3 GLY 33 1HA GLY 33 5.204 14.646 -12.166
228 H GLN 34 H GLN 34 5.273 13.841 -14.552
229 HA GLN 34 HA GLN 34 3.109 12.075 -15.211
230 HB2 GLN 34 2HB GLN 34 5.783 12.545 -16.505
231 HB3 GLN 34 1HB GLN 34 4.647 11.334 -17.089
232 HG2 GLN 34 2HG GLN 34 2.973 13.066 -17.456
233 HG3 GLN 34 1HG GLN 34 4.092 14.283 -16.850
234 HE21 GLN 34 1HE2 GLN 34 3.932 15.380 -18.803
235 HE22 GLN 34 2HE2 GLN 34 4.772 14.856 -20.210
236 H ASP 35 H ASP 35 5.977 11.819 -13.372
237 HA ASP 35 HA ASP 35 5.799 8.912 -13.383
238 HB2 ASP 35 2HB ASP 35 7.769 10.804 -12.175
239 HB3 ASP 35 1HB ASP 35 7.563 9.231 -11.417
240 H ALA 36 H ALA 36 4.228 11.345 -11.941
241 HA ALA 36 HA ALA 36 3.804 9.965 -9.437
242 HB1 ALA 36 1HB ALA 36 2.310 11.839 -8.910
243 HB2 ALA 36 2HB ALA 36 2.546 12.483 -10.534
244 HB3 ALA 36 3HB ALA 36 3.900 12.414 -9.408
245 H GLN 37 H GLN 37 1.971 8.903 -8.959
246 HA GLN 37 HA GLN 37 0.238 8.245 -11.213
247 HB2 GLN 37 2HB GLN 37 0.842 6.882 -8.597
248 HB3 GLN 37 1HB GLN 37 -0.353 6.309 -9.758
249 HG2 GLN 37 2HG GLN 37 1.305 5.863 -11.381
250 HG3 GLN 37 1HG GLN 37 2.526 6.741 -10.459
251 HE21 GLN 37 1HE2 GLN 37 3.872 4.971 -10.454
252 HE22 GLN 37 2HE2 GLN 37 3.557 3.596 -9.454
253 H PHE 38 H PHE 38 0.202 8.846 -7.747
254 HA PHE 38 HA PHE 38 -2.485 9.926 -8.001
255 HB2 PHE 38 2HB PHE 38 -2.206 8.309 -6.192
256 HB3 PHE 38 1HB PHE 38 -0.803 9.185 -5.593
257 HD1 PHE 38 2HD PHE 38 -4.440 9.692 -6.259
258 HD2 PHE 38 1HD PHE 38 -1.080 10.679 -3.853
259 HE1 PHE 38 2HE PHE 38 -5.895 10.984 -4.743
260 HE2 PHE 38 1HE PHE 38 -2.467 11.937 -2.363
261 HZ PHE 38 HZ PHE 38 -4.918 12.120 -2.783
262 H ARG 39 H ARG 39 -2.429 11.959 -8.575
263 HA ARG 39 HA ARG 39 -0.174 13.498 -7.660
264 HB2 ARG 39 2HB ARG 39 -0.813 15.194 -9.307
265 HB3 ARG 39 1HB ARG 39 -0.456 13.642 -10.042
266 HG2 ARG 39 2HG ARG 39 -2.796 13.228 -10.365
267 HG3 ARG 39 1HG ARG 39 -3.196 14.719 -9.483
268 HD2 ARG 39 2HD ARG 39 -2.043 16.028 -11.186
269 HD3 ARG 39 1HD ARG 39 -1.626 14.545 -12.037
270 HE ARG 39 HE ARG 39 -3.939 14.218 -12.508
271 HH11 ARG 39 1HH1 ARG 39 -3.219 17.439 -11.206
272 HH12 ARG 39 2HH1 ARG 39 -4.458 18.197 -12.097
273 HH21 ARG 39 1HH2 ARG 39 -5.575 15.312 -13.762
274 HH22 ARG 39 2HH2 ARG 39 -5.809 16.992 -13.587
275 H LEU 40 H LEU 40 -0.309 14.990 -6.263
276 HA LEU 40 HA LEU 40 -2.747 15.320 -4.842
277 HB2 LEU 40 2HB LEU 40 -0.051 16.600 -4.568
278 HB3 LEU 40 1HB LEU 40 -1.406 17.092 -3.564
279 HG LEU 40 HG LEU 40 -0.137 14.348 -3.639
280 HD11 LEU 40 1HD1 LEU 40 -0.083 16.524 -1.557
281 HD12 LEU 40 2HD1 LEU 40 1.265 16.072 -2.595
282 HD13 LEU 40 3HD1 LEU 40 0.646 14.928 -1.401
283 HD21 LEU 40 3HD2 LEU 40 -1.555 13.918 -1.673
284 HD22 LEU 40 1HD2 LEU 40 -2.515 14.208 -3.123
285 HD23 LEU 40 2HD2 LEU 40 -2.342 15.477 -1.916
286 HA PRO 41 HA PRO 41 -4.124 18.835 -7.257
287 HB2 PRO 41 2HB PRO 41 -5.948 19.492 -5.073
288 HB3 PRO 41 1HB PRO 41 -6.336 18.889 -6.684
289 HG2 PRO 41 2HG PRO 41 -6.673 17.390 -4.455
290 HG3 PRO 41 1HG PRO 41 -6.248 16.686 -6.022
291 HD2 PRO 41 2HD PRO 41 -4.484 17.294 -3.678
292 HD3 PRO 41 1HD PRO 41 -4.525 15.856 -4.727
293 H ASP 42 H ASP 42 -2.519 18.952 -4.345
294 HA ASP 42 HA ASP 42 -2.857 21.771 -3.833
295 HB2 ASP 42 2HB ASP 42 -1.327 19.586 -2.456
296 HB3 ASP 42 1HB ASP 42 -1.165 21.269 -1.985
297 H THR 43 H THR 43 -0.486 22.659 -3.045
298 HA THR 43 HA THR 43 1.307 22.159 -5.245
299 HB THR 43 HB THR 43 -0.146 24.256 -5.596
300 HG1 THR 43 1HG THR 43 2.365 25.280 -5.684
301 HG21 THR 43 3HG2 THR 43 -0.034 25.141 -3.293
302 HG22 THR 43 1HG2 THR 43 0.615 26.308 -4.447
303 HG23 THR 43 2HG2 THR 43 1.709 25.342 -3.456
304 H GLY 44 H GLY 44 3.533 23.147 -4.705
305 HA2 GLY 44 2HA GLY 44 5.168 23.596 -3.038
306 HA3 GLY 44 1HA GLY 44 4.068 22.942 -1.821
307 H VAL 45 H VAL 45 3.301 20.800 -3.489
308 HA VAL 45 HA VAL 45 5.236 18.839 -2.790
309 HB VAL 45 HB VAL 45 2.783 18.343 -2.722
310 HG11 VAL 45 1HG1 VAL 45 1.995 19.699 -4.466
311 HG12 VAL 45 2HG1 VAL 45 1.521 18.024 -4.774
312 HG13 VAL 45 3HG1 VAL 45 2.864 18.749 -5.663
313 HG21 VAL 45 3HG2 VAL 45 4.271 16.436 -3.003
314 HG22 VAL 45 1HG2 VAL 45 4.267 16.674 -4.752
315 HG23 VAL 45 2HG2 VAL 45 2.788 16.194 -3.930
316 H SER 46 H SER 46 6.558 17.643 -4.151
317 HA SER 46 HA SER 46 7.373 18.935 -6.607
318 HB2 SER 46 2HB SER 46 8.521 16.550 -5.142
319 HB3 SER 46 1HB SER 46 9.332 17.534 -6.366
320 HG SER 46 HG SER 46 8.561 19.268 -4.669
321 H ARG 47 H ARG 47 8.215 17.012 -8.301
322 HA ARG 47 HA ARG 47 5.810 15.888 -9.306
323 HB2 ARG 47 2HB ARG 47 7.201 14.788 -11.047
324 HB3 ARG 47 1HB ARG 47 7.489 16.510 -10.933
325 HG2 ARG 47 2HG ARG 47 9.558 16.052 -9.681
326 HG3 ARG 47 1HG ARG 47 9.231 14.327 -9.804
327 HD2 ARG 47 2HD ARG 47 9.392 14.458 -12.222
328 HD3 ARG 47 1HD ARG 47 9.662 16.199 -12.123
329 HE ARG 47 HE ARG 47 11.647 15.449 -10.669
330 HH11 ARG 47 1HH1 ARG 47 10.516 13.859 -13.642
331 HH12 ARG 47 2HH1 ARG 47 12.043 13.238 -14.041
332 HH21 ARG 47 1HH2 ARG 47 13.752 14.591 -11.274
333 HH22 ARG 47 2HH2 ARG 47 13.897 13.649 -12.700
334 H ARG 48 H ARG 48 8.518 14.549 -7.578
335 HA ARG 48 HA ARG 48 6.832 12.250 -6.969
336 HB2 ARG 48 2HB ARG 48 9.854 12.260 -7.230
337 HB3 ARG 48 1HB ARG 48 8.871 10.894 -6.744
338 HG2 ARG 48 2HG ARG 48 7.828 10.914 -8.995
339 HG3 ARG 48 1HG ARG 48 8.950 12.195 -9.456
340 HD2 ARG 48 2HD ARG 48 9.664 9.403 -8.562
341 HD3 ARG 48 1HD ARG 48 9.799 10.051 -10.195
342 HE ARG 48 HE ARG 48 11.287 11.601 -8.350
343 HH11 ARG 48 1HH1 ARG 48 11.386 8.575 -10.174
344 HH12 ARG 48 2HH1 ARG 48 13.075 8.406 -10.112
345 HH21 ARG 48 1HH2 ARG 48 13.677 11.365 -8.251
346 HH22 ARG 48 2HH2 ARG 48 14.375 10.036 -9.038
347 H HIS 49 H HIS 49 6.287 12.514 -4.959
348 HA HIS 49 HA HIS 49 8.144 13.921 -3.193
349 HB2 HIS 49 2HB HIS 49 5.995 15.028 -3.241
350 HB3 HIS 49 1HB HIS 49 5.128 13.528 -2.953
351 HD2 HIS 49 2HD HIS 49 5.169 12.603 -0.318
352 HE1 HIS 49 1HE HIS 49 7.114 15.976 1.267
353 HE2 HIS 49 2HE HIS 49 6.397 13.615 1.685
354 H LEU 50 H LEU 50 6.283 10.992 -3.612
355 HA LEU 50 HA LEU 50 8.011 9.629 -1.815
356 HB2 LEU 50 2HB LEU 50 6.609 10.739 -0.209
357 HB3 LEU 50 1HB LEU 50 5.163 10.250 -1.039
358 HG LEU 50 HG LEU 50 6.940 8.156 0.172
359 HD11 LEU 50 1HD1 LEU 50 5.719 8.449 2.282
360 HD12 LEU 50 2HD1 LEU 50 4.856 9.827 1.604
361 HD13 LEU 50 3HD1 LEU 50 6.596 9.922 1.879
362 HD21 LEU 50 3HD2 LEU 50 3.950 8.443 -0.182
363 HD22 LEU 50 1HD2 LEU 50 4.778 7.032 0.473
364 HD23 LEU 50 2HD2 LEU 50 5.018 7.493 -1.212
365 H GLU 51 H GLU 51 7.865 7.432 -2.037
366 HA GLU 51 HA GLU 51 5.901 6.446 -3.931
367 HB2 GLU 51 2HB GLU 51 7.727 5.015 -4.905
368 HB3 GLU 51 1HB GLU 51 7.811 6.723 -5.298
369 HG2 GLU 51 2HG GLU 51 9.538 7.014 -3.570
370 HG3 GLU 51 1HG GLU 51 9.436 5.293 -3.211
371 H ILE 52 H ILE 52 5.144 4.517 -3.513
372 HA ILE 52 HA ILE 52 6.227 3.089 -1.181
373 HB ILE 52 HB ILE 52 3.346 3.268 -2.096
374 HG12 ILE 52 2HG1 ILE 52 4.636 4.291 0.448
375 HG13 ILE 52 1HG1 ILE 52 4.204 5.294 -0.932
376 HG21 ILE 52 1HG2 ILE 52 4.582 1.781 0.215
377 HG22 ILE 52 2HG2 ILE 52 3.911 1.087 -1.260
378 HG23 ILE 52 3HG2 ILE 52 2.843 1.914 -0.111
379 HD11 ILE 52 3HD1 ILE 52 1.859 4.775 -0.590
380 HD12 ILE 52 1HD1 ILE 52 2.572 5.449 0.873
381 HD13 ILE 52 2HD1 ILE 52 2.272 3.714 0.755
382 H ARG 53 H ARG 53 7.100 1.249 -1.825
383 HA ARG 53 HA ARG 53 6.130 0.005 -4.293
384 HB2 ARG 53 2HB ARG 53 8.449 -0.910 -2.562
385 HB3 ARG 53 1HB ARG 53 8.037 -1.503 -4.154
386 HG2 ARG 53 2HG ARG 53 8.470 0.798 -5.036
387 HG3 ARG 53 1HG ARG 53 9.096 1.210 -3.443
388 HD2 ARG 53 2HD ARG 53 10.921 0.605 -4.882
389 HD3 ARG 53 1HD ARG 53 10.732 -0.641 -3.643
390 HE ARG 53 HE ARG 53 9.820 -0.850 -6.432
391 HH11 ARG 53 1HH1 ARG 53 11.151 -2.420 -3.519
392 HH12 ARG 53 2HH1 ARG 53 11.244 -3.958 -4.218
393 HH21 ARG 53 1HH2 ARG 53 9.990 -3.001 -7.392
394 HH22 ARG 53 2HH2 ARG 53 10.565 -4.297 -6.450
395 H TRP 54 H TRP 54 4.451 -1.204 -4.070
396 HA TRP 54 HA TRP 54 4.020 -2.459 -1.511
397 HB2 TRP 54 2HB TRP 54 2.189 -1.059 -2.060
398 HB3 TRP 54 1HB TRP 54 2.093 -1.700 -3.696
399 HD1 TRP 54 HD TRP 54 0.030 -3.203 -3.968
400 HE1 TRP 54 1HE TRP 54 -1.282 -4.862 -2.516
401 HE3 TRP 54 3HE TRP 54 2.722 -2.812 0.348
402 HZ2 TRP 54 2HZ TRP 54 -1.194 -5.881 0.115
403 HZ3 TRP 54 3HZ TRP 54 2.061 -4.154 2.283
404 HH2 TRP 54 HH TRP 54 0.131 -5.667 2.177
405 H ASP 55 H ASP 55 4.587 -4.360 -1.280
406 HA ASP 55 HA ASP 55 3.977 -6.365 -3.296
407 HB2 ASP 55 2HB ASP 55 6.399 -6.175 -1.478
408 HB3 ASP 55 1HB ASP 55 5.909 -7.675 -2.252
409 H GLY 56 H GLY 56 3.303 -8.351 -2.337
410 HA2 GLY 56 2HA GLY 56 1.494 -7.842 -0.195
411 HA3 GLY 56 1HA GLY 56 1.737 -9.376 -1.008
412 H GLN 57 H GLN 57 3.117 -7.241 1.378
413 HA GLN 57 HA GLN 57 3.513 -9.330 3.297
414 HB2 GLN 57 2HB GLN 57 5.486 -9.587 1.728
415 HB3 GLN 57 1HB GLN 57 5.971 -7.961 2.164
416 HG2 GLN 57 2HG GLN 57 6.239 -8.673 4.484
417 HG3 GLN 57 1HG GLN 57 5.774 -10.313 4.025
418 HE21 GLN 57 1HE2 GLN 57 8.269 -7.933 3.964
419 HE22 GLN 57 2HE2 GLN 57 9.481 -8.955 3.300
420 H VAL 58 H VAL 58 5.145 -6.307 2.436
421 HA VAL 58 HA VAL 58 3.708 -4.774 4.377
422 HB VAL 58 HB VAL 58 5.785 -3.774 5.365
423 HG11 VAL 58 1HG1 VAL 58 4.652 -5.446 6.683
424 HG12 VAL 58 2HG1 VAL 58 6.396 -5.569 6.917
425 HG13 VAL 58 3HG1 VAL 58 5.560 -6.725 5.881
426 HG21 VAL 58 3HG2 VAL 58 7.387 -4.324 3.633
427 HG22 VAL 58 1HG2 VAL 58 7.235 -6.042 4.002
428 HG23 VAL 58 2HG2 VAL 58 7.946 -4.940 5.185
429 H ALA 59 H ALA 59 3.951 -2.529 3.874
430 HA ALA 59 HA ALA 59 4.656 -2.223 1.076
431 HB1 ALA 59 1HB ALA 59 2.450 -1.401 1.852
432 HB2 ALA 59 2HB ALA 59 3.455 -0.130 1.152
433 HB3 ALA 59 3HB ALA 59 3.298 -0.265 2.901
434 H LEU 60 H LEU 60 6.387 -1.278 0.420
435 HA LEU 60 HA LEU 60 8.319 -0.344 2.344
436 HB2 LEU 60 2HB LEU 60 8.785 -1.867 0.386
437 HB3 LEU 60 1HB LEU 60 8.444 -0.513 -0.660
438 HG LEU 60 HG LEU 60 10.752 -0.574 1.302
439 HD11 LEU 60 1HD1 LEU 60 12.119 -1.082 -0.679
440 HD12 LEU 60 2HD1 LEU 60 10.633 -1.248 -1.626
441 HD13 LEU 60 3HD1 LEU 60 10.962 -2.361 -0.305
442 HD21 LEU 60 3HD2 LEU 60 11.651 1.230 -0.082
443 HD22 LEU 60 1HD2 LEU 60 10.066 1.686 0.550
444 HD23 LEU 60 2HD2 LEU 60 10.226 1.160 -1.125
445 H LEU 61 H LEU 61 8.021 1.651 3.042
446 HA LEU 61 HA LEU 61 6.871 3.713 1.347
447 HB2 LEU 61 2HB LEU 61 5.980 3.280 3.571
448 HB3 LEU 61 1HB LEU 61 7.513 3.542 4.324
449 HG LEU 61 HG LEU 61 5.957 5.372 4.750
450 HD11 LEU 61 1HD1 LEU 61 7.189 7.331 4.032
451 HD12 LEU 61 2HD1 LEU 61 8.116 6.335 2.907
452 HD13 LEU 61 3HD1 LEU 61 8.257 6.064 4.644
453 HD21 LEU 61 3HD2 LEU 61 4.582 5.062 2.763
454 HD22 LEU 61 1HD2 LEU 61 5.852 5.780 1.782
455 HD23 LEU 61 2HD2 LEU 61 5.018 6.747 3.014
456 H ALA 62 H ALA 62 8.264 4.977 0.240
457 HA ALA 62 HA ALA 62 10.797 5.629 1.524
458 HB1 ALA 62 1HB ALA 62 11.891 5.602 -0.664
459 HB2 ALA 62 2HB ALA 62 10.386 5.082 -1.417
460 HB3 ALA 62 3HB ALA 62 11.214 4.018 -0.282
461 H ASP 63 H ASP 63 10.911 7.671 1.889
462 HA ASP 63 HA ASP 63 9.144 9.613 0.678
463 HB2 ASP 63 2HB ASP 63 9.670 9.931 2.998
464 HB3 ASP 63 1HB ASP 63 11.393 9.803 2.685
465 H LEU 64 H LEU 64 9.683 11.051 -0.925
466 HA LEU 64 HA LEU 64 12.424 10.850 -1.988
467 HB2 LEU 64 2HB LEU 64 10.464 9.619 -3.200
468 HB3 LEU 64 1HB LEU 64 9.904 11.212 -3.614
469 HG LEU 64 HG LEU 64 10.945 10.254 -5.496
470 HD11 LEU 64 1HD1 LEU 64 12.753 11.774 -6.070
471 HD12 LEU 64 2HD1 LEU 64 12.843 12.290 -4.383
472 HD13 LEU 64 3HD1 LEU 64 11.381 12.594 -5.324
473 HD21 LEU 64 3HD2 LEU 64 13.388 9.762 -3.812
474 HD22 LEU 64 1HD2 LEU 64 13.274 9.479 -5.546
475 HD23 LEU 64 2HD2 LEU 64 12.276 8.543 -4.433
476 H ASN 65 H ASN 65 12.635 12.875 -0.528
477 HA ASN 65 HA ASN 65 12.283 15.182 -2.108
478 HB2 ASN 65 2HB ASN 65 9.938 14.702 -0.974
479 HB3 ASN 65 1HB ASN 65 10.724 15.391 0.447
480 HD21 ASN 65 1HD2 ASN 65 9.489 15.968 -2.663
481 HD22 ASN 65 2HD2 ASN 65 9.617 17.688 -2.686
482 H SER 66 H SER 66 13.069 17.107 -0.936
483 HA SER 66 HA SER 66 15.046 16.310 1.048
484 HB2 SER 66 2HB SER 66 16.101 18.503 0.233
485 HB3 SER 66 1HB SER 66 16.102 17.129 -0.880
486 HG SER 66 HG SER 66 15.301 19.388 -1.541
487 H THR 67 H THR 67 12.935 19.058 0.210
488 HA THR 67 HA THR 67 13.265 20.087 2.900
489 HB THR 67 HB THR 67 13.552 21.699 1.173
490 HG1 THR 67 1HG THR 67 11.067 22.643 1.826
491 HG21 THR 67 3HG2 THR 67 11.811 22.291 -0.441
492 HG22 THR 67 1HG2 THR 67 10.788 21.006 0.201
493 HG23 THR 67 2HG2 THR 67 12.304 20.608 -0.603
494 H ASN 68 H ASN 68 10.867 18.380 1.109
495 HA ASN 68 HA ASN 68 8.826 18.999 3.139
496 HB2 ASN 68 2HB ASN 68 8.542 17.748 0.381
497 HB3 ASN 68 1HB ASN 68 7.226 17.967 1.521
498 HD21 ASN 68 1HD2 ASN 68 6.109 19.192 -0.030
499 HD22 ASN 68 2HD2 ASN 68 6.551 20.819 -0.360
500 H GLY 69 H GLY 69 11.152 17.165 3.396
501 HA2 GLY 69 2HA GLY 69 10.785 14.491 3.046
502 HA3 GLY 69 1HA GLY 69 11.649 15.177 4.403
503 H THR 70 H THR 70 9.340 13.142 3.571
504 HA THR 70 HA THR 70 7.186 13.602 5.287
505 HB THR 70 HB THR 70 8.200 11.059 4.047
506 HG1 THR 70 1HG THR 70 7.903 12.370 2.437
507 HG21 THR 70 3HG2 THR 70 5.858 10.359 4.123
508 HG22 THR 70 1HG2 THR 70 5.435 11.841 4.975
509 HG23 THR 70 2HG2 THR 70 6.491 10.659 5.743
510 H THR 71 H THR 71 6.686 12.935 7.295
511 HA THR 71 HA THR 71 8.774 11.773 9.019
512 HB THR 71 HB THR 71 6.249 12.936 10.063
513 HG1 THR 71 1HG THR 71 8.316 14.481 8.838
514 HG21 THR 71 3HG2 THR 71 7.760 13.982 11.658
515 HG22 THR 71 1HG2 THR 71 9.143 13.371 10.751
516 HG23 THR 71 2HG2 THR 71 8.039 12.243 11.539
517 H VAL 72 H VAL 72 8.190 9.770 10.139
518 HA VAL 72 HA VAL 72 5.484 8.754 9.570
519 HB VAL 72 HB VAL 72 6.358 6.399 9.718
520 HG11 VAL 72 1HG1 VAL 72 7.829 8.082 7.714
521 HG12 VAL 72 2HG1 VAL 72 6.186 7.477 7.545
522 HG13 VAL 72 3HG1 VAL 72 7.540 6.346 7.612
523 HG21 VAL 72 3HG2 VAL 72 8.767 5.999 9.721
524 HG22 VAL 72 1HG2 VAL 72 8.255 6.822 11.194
525 HG23 VAL 72 2HG2 VAL 72 9.061 7.731 9.920
526 H ASN 73 H ASN 73 4.201 8.498 11.199
527 HA ASN 73 HA ASN 73 3.348 8.541 13.283
528 HB2 ASN 73 2HB ASN 73 5.805 6.886 13.947
529 HB3 ASN 73 1HB ASN 73 4.431 7.102 15.027
530 HD21 ASN 73 1HD2 ASN 73 5.648 5.455 12.252
531 HD22 ASN 73 2HD2 ASN 73 4.286 4.421 12.028
532 H ASN 74 H ASN 74 5.079 10.561 12.407
533 HA ASN 74 HA ASN 74 5.711 12.536 12.987
534 HB2 ASN 74 2HB ASN 74 5.046 11.778 15.839
535 HB3 ASN 74 1HB ASN 74 5.600 13.385 15.374
536 HD21 ASN 74 1HD2 ASN 74 3.063 12.649 16.553
537 HD22 ASN 74 2HD2 ASN 74 1.855 13.128 15.421
538 H ALA 75 H ALA 75 7.484 10.155 12.961
539 HA ALA 75 HA ALA 75 9.841 11.431 14.173
540 HB1 ALA 75 1HB ALA 75 9.348 8.494 13.642
541 HB2 ALA 75 2HB ALA 75 9.341 9.271 15.225
542 HB3 ALA 75 3HB ALA 75 10.837 9.181 14.295
543 HA PRO 76 HA PRO 76 10.782 11.874 9.840
544 HB2 PRO 76 2HB PRO 76 13.179 13.077 10.031
545 HB3 PRO 76 1HB PRO 76 11.656 13.866 10.502
546 HG2 PRO 76 2HG PRO 76 13.692 12.535 12.253
547 HG3 PRO 76 1HG PRO 76 12.897 14.104 12.471
548 HD2 PRO 76 2HD PRO 76 12.082 11.826 13.724
549 HD3 PRO 76 1HD PRO 76 10.977 13.150 13.306
550 H VAL 77 H VAL 77 11.464 10.507 8.363
551 HA VAL 77 HA VAL 77 13.901 8.942 8.692
552 HB VAL 77 HB VAL 77 12.796 6.832 8.136
553 HG11 VAL 77 1HG1 VAL 77 12.997 7.278 10.519
554 HG12 VAL 77 2HG1 VAL 77 11.544 6.346 10.167
555 HG13 VAL 77 3HG1 VAL 77 11.424 8.071 10.508
556 HG21 VAL 77 3HG2 VAL 77 10.229 8.398 8.206
557 HG22 VAL 77 1HG2 VAL 77 10.329 6.636 8.087
558 HG23 VAL 77 2HG2 VAL 77 10.978 7.648 6.796
559 H GLN 78 H GLN 78 14.054 7.570 6.539
560 HA GLN 78 HA GLN 78 12.841 9.125 4.375
561 HB2 GLN 78 2HB GLN 78 14.717 8.506 2.894
562 HB3 GLN 78 1HB GLN 78 15.239 9.456 4.271
563 HG2 GLN 78 2HG GLN 78 16.152 7.505 5.327
564 HG3 GLN 78 1HG GLN 78 15.488 6.466 4.060
565 HE21 GLN 78 1HE2 GLN 78 17.857 8.865 4.821
566 HE22 GLN 78 2HE2 GLN 78 18.855 8.616 3.439
567 H GLU 79 H GLU 79 13.520 5.927 5.628
568 HA GLU 79 HA GLU 79 11.544 4.946 3.741
569 HB2 GLU 79 2HB GLU 79 12.711 2.798 3.562
570 HB3 GLU 79 1HB GLU 79 13.723 4.105 2.978
571 HG2 GLU 79 2HG GLU 79 15.044 4.042 4.994
572 HG3 GLU 79 1HG GLU 79 13.974 2.828 5.700
573 H TRP 80 H TRP 80 10.234 3.289 4.540
574 HA TRP 80 HA TRP 80 10.390 2.507 7.301
575 HB2 TRP 80 2HB TRP 80 9.483 4.755 7.530
576 HB3 TRP 80 1HB TRP 80 8.219 4.434 6.362
577 HD1 TRP 80 HD TRP 80 6.042 3.386 7.272
578 HE1 TRP 80 1HE TRP 80 5.178 2.792 9.629
579 HE3 TRP 80 3HE TRP 80 10.415 3.811 9.850
580 HZ2 TRP 80 2HZ TRP 80 6.215 2.558 12.219
581 HZ3 TRP 80 3HZ TRP 80 10.393 3.394 12.272
582 HH2 TRP 80 HH TRP 80 8.331 2.784 13.428
583 H GLN 81 H GLN 81 8.861 0.858 7.752
584 HA GLN 81 HA GLN 81 7.662 -0.289 5.330
585 HB2 GLN 81 2HB GLN 81 8.289 -1.653 7.952
586 HB3 GLN 81 1HB GLN 81 7.656 -2.429 6.510
587 HG2 GLN 81 2HG GLN 81 9.717 -1.839 5.319
588 HG3 GLN 81 1HG GLN 81 10.354 -1.143 6.806
589 HE21 GLN 81 1HE2 GLN 81 11.390 -3.295 5.250
590 HE22 GLN 81 2HE2 GLN 81 11.434 -4.688 6.263
591 H LEU 82 H LEU 82 5.649 0.260 5.169
592 HA LEU 82 HA LEU 82 4.048 1.320 7.249
593 HB2 LEU 82 2HB LEU 82 2.996 0.099 4.719
594 HB3 LEU 82 1HB LEU 82 2.224 1.262 5.762
595 HG LEU 82 HG LEU 82 4.661 1.835 4.094
596 HD11 LEU 82 1HD1 LEU 82 2.667 1.585 2.695
597 HD12 LEU 82 2HD1 LEU 82 3.146 3.275 2.803
598 HD13 LEU 82 3HD1 LEU 82 1.783 2.686 3.750
599 HD21 LEU 82 3HD2 LEU 82 2.931 3.612 5.764
600 HD22 LEU 82 1HD2 LEU 82 4.288 4.129 4.770
601 HD23 LEU 82 2HD2 LEU 82 4.560 3.080 6.169
602 H ALA 83 H ALA 83 2.693 0.461 8.640
603 HA ALA 83 HA ALA 83 1.595 -2.198 8.191
604 HB1 ALA 83 1HB ALA 83 1.717 -2.555 10.645
605 HB2 ALA 83 2HB ALA 83 2.594 -1.037 10.813
606 HB3 ALA 83 3HB ALA 83 3.325 -2.385 9.941
607 H ASP 84 H ASP 84 -0.476 -2.364 9.424
608 HA ASP 84 HA ASP 84 -2.178 -0.200 8.896
609 HB2 ASP 84 2HB ASP 84 -3.018 -2.482 9.080
610 HB3 ASP 84 1HB ASP 84 -2.566 -2.533 10.778
611 H GLY 85 H GLY 85 -2.427 1.658 9.919
612 HA2 GLY 85 2HA GLY 85 -3.079 2.762 11.978
613 HA3 GLY 85 1HA GLY 85 -1.957 1.715 12.827
614 H ASP 86 H ASP 86 -0.186 2.373 10.266
615 HA ASP 86 HA ASP 86 1.414 4.259 11.650
616 HB2 ASP 86 2HB ASP 86 1.612 3.137 8.883
617 HB3 ASP 86 1HB ASP 86 2.618 4.491 9.376
618 H VAL 87 H VAL 87 1.717 6.318 11.495
619 HA VAL 87 HA VAL 87 -0.087 7.885 9.775
620 HB VAL 87 HB VAL 87 1.596 8.888 12.107
621 HG11 VAL 87 1HG1 VAL 87 0.219 10.874 11.970
622 HG12 VAL 87 2HG1 VAL 87 -0.621 10.211 10.567
623 HG13 VAL 87 3HG1 VAL 87 1.102 10.591 10.471
624 HG21 VAL 87 3HG2 VAL 87 -0.113 7.341 12.918
625 HG22 VAL 87 1HG2 VAL 87 -1.352 8.227 12.029
626 HG23 VAL 87 2HG2 VAL 87 -0.505 9.004 13.363
627 H ILE 88 H ILE 88 0.843 8.455 7.924
628 HA ILE 88 HA ILE 88 3.696 9.041 8.021
629 HB ILE 88 HB ILE 88 1.951 8.133 5.706
630 HG12 ILE 88 2HG1 ILE 88 3.722 6.304 5.525
631 HG13 ILE 88 1HG1 ILE 88 4.275 6.832 7.104
632 HG21 ILE 88 1HG2 ILE 88 4.826 8.958 5.565
633 HG22 ILE 88 2HG2 ILE 88 3.451 9.815 4.872
634 HG23 ILE 88 3HG2 ILE 88 3.898 8.224 4.256
635 HD11 ILE 88 3HD1 ILE 88 1.559 5.756 6.436
636 HD12 ILE 88 1HD1 ILE 88 2.074 6.323 8.026
637 HD13 ILE 88 2HD1 ILE 88 2.853 4.918 7.302
638 H ARG 89 H ARG 89 3.979 11.117 8.254
639 HA ARG 89 HA ARG 89 1.942 12.900 7.168
640 HB2 ARG 89 2HB ARG 89 2.469 13.083 9.593
641 HB3 ARG 89 1HB ARG 89 4.121 13.506 9.166
642 HG2 ARG 89 2HG ARG 89 3.236 15.465 7.913
643 HG3 ARG 89 1HG ARG 89 1.631 15.083 8.536
644 HD2 ARG 89 2HD ARG 89 2.603 16.773 9.923
645 HD3 ARG 89 1HD ARG 89 2.556 15.264 10.835
646 HE ARG 89 HE ARG 89 5.021 15.585 9.473
647 HH11 ARG 89 1HH1 ARG 89 3.277 16.613 12.385
648 HH12 ARG 89 2HH1 ARG 89 4.676 17.077 13.228
649 HH21 ARG 89 1HH2 ARG 89 6.955 16.226 10.627
650 HH22 ARG 89 2HH2 ARG 89 6.835 16.831 12.206
651 H LEU 90 H LEU 90 2.463 13.462 5.195
652 HA LEU 90 HA LEU 90 5.233 13.827 4.472
653 HB2 LEU 90 2HB LEU 90 4.345 14.437 2.229
654 HB3 LEU 90 1HB LEU 90 3.879 12.838 2.741
655 HG LEU 90 HG LEU 90 1.907 15.073 3.117
656 HD11 LEU 90 1HD1 LEU 90 2.773 15.342 0.823
657 HD12 LEU 90 2HD1 LEU 90 1.122 14.722 0.822
658 HD13 LEU 90 3HD1 LEU 90 2.476 13.631 0.518
659 HD21 LEU 90 3HD2 LEU 90 0.327 13.272 2.613
660 HD22 LEU 90 1HD2 LEU 90 1.386 12.782 3.932
661 HD23 LEU 90 2HD2 LEU 90 1.661 12.165 2.309
662 H GLY 91 H GLY 91 5.929 15.963 3.551
663 HA2 GLY 91 2HA GLY 91 5.147 17.998 5.366
664 HA3 GLY 91 1HA GLY 91 6.196 18.211 3.968
665 H HIS 92 H HIS 92 2.954 18.084 5.106
666 HA HIS 92 HA HIS 92 1.830 20.261 3.976
667 HB2 HIS 92 2HB HIS 92 2.321 19.051 1.738
668 HB3 HIS 92 1HB HIS 92 1.058 17.922 2.219
669 HD1 HIS 92 1HD HIS 92 -1.397 19.019 2.539
670 HD2 HIS 92 2HD HIS 92 1.477 21.384 0.690
671 HE1 HIS 92 1HE HIS 92 -2.635 20.879 1.441
672 H SER 93 H SER 93 0.931 16.824 4.035
673 HA SER 93 HA SER 93 -1.124 17.328 6.063
674 HB2 SER 93 2HB SER 93 -1.723 15.917 3.432
675 HB3 SER 93 1HB SER 93 -2.866 16.230 4.733
676 HG SER 93 HG SER 93 -2.952 17.663 2.878
677 H GLU 94 H GLU 94 -2.093 14.926 6.645
678 HA GLU 94 HA GLU 94 0.122 13.121 6.280
679 HB2 GLU 94 2HB GLU 94 -0.802 12.036 8.503
680 HB3 GLU 94 1HB GLU 94 0.343 13.359 8.539
681 HG2 GLU 94 2HG GLU 94 -1.451 13.587 10.188
682 HG3 GLU 94 1HG GLU 94 -1.415 14.918 9.039
683 H ILE 95 H ILE 95 -0.200 10.954 6.151
684 HA ILE 95 HA ILE 95 -2.825 10.220 5.115
685 HB ILE 95 HB ILE 95 -1.022 10.480 3.355
686 HG12 ILE 95 2HG1 ILE 95 -1.276 8.126 2.372
687 HG13 ILE 95 1HG1 ILE 95 -2.283 7.818 3.784
688 HG21 ILE 95 1HG2 ILE 95 0.915 9.787 4.595
689 HG22 ILE 95 2HG2 ILE 95 0.732 8.852 3.107
690 HG23 ILE 95 3HG2 ILE 95 0.282 8.139 4.658
691 HD11 ILE 95 3HD1 ILE 95 -2.704 10.015 1.805
692 HD12 ILE 95 1HD1 ILE 95 -3.731 9.637 3.176
693 HD13 ILE 95 2HD1 ILE 95 -3.611 8.504 1.832
694 H ILE 96 H ILE 96 -3.702 8.547 6.173
695 HA ILE 96 HA ILE 96 -2.021 7.074 8.075
696 HB ILE 96 HB ILE 96 -5.053 7.349 8.012
697 HG12 ILE 96 2HG1 ILE 96 -3.014 8.559 9.902
698 HG13 ILE 96 1HG1 ILE 96 -3.881 9.431 8.648
699 HG21 ILE 96 1HG2 ILE 96 -4.373 5.199 8.963
700 HG22 ILE 96 2HG2 ILE 96 -5.016 6.256 10.219
701 HG23 ILE 96 3HG2 ILE 96 -3.274 6.023 10.070
702 HD11 ILE 96 3HD1 ILE 96 -4.856 9.851 10.831
703 HD12 ILE 96 1HD1 ILE 96 -5.103 8.119 11.070
704 HD13 ILE 96 2HD1 ILE 96 -5.991 8.972 9.807
705 H VAL 97 H VAL 97 -1.724 4.968 7.863
706 HA VAL 97 HA VAL 97 -2.734 3.703 5.451
707 HB VAL 97 HB VAL 97 -0.497 2.974 7.357
708 HG11 VAL 97 1HG1 VAL 97 -1.411 1.505 4.882
709 HG12 VAL 97 2HG1 VAL 97 -1.583 0.917 6.537
710 HG13 VAL 97 3HG1 VAL 97 0.025 1.123 5.837
711 HG21 VAL 97 3HG2 VAL 97 -0.149 4.817 5.774
712 HG22 VAL 97 1HG2 VAL 97 -0.541 3.712 4.461
713 HG23 VAL 97 2HG2 VAL 97 0.901 3.426 5.450
714 H ARG 98 H ARG 98 -4.503 2.505 5.558
715 HA ARG 98 HA ARG 98 -4.943 0.897 7.964
716 HB2 ARG 98 2HB ARG 98 -6.963 1.908 5.962
717 HB3 ARG 98 1HB ARG 98 -7.311 0.923 7.378
718 HG2 ARG 98 2HG ARG 98 -6.152 3.647 7.364
719 HG3 ARG 98 1HG ARG 98 -7.867 3.315 7.721
720 HD2 ARG 98 2HD ARG 98 -5.390 2.571 9.301
721 HD3 ARG 98 1HD ARG 98 -6.666 3.689 9.774
722 HE ARG 98 HE ARG 98 -7.862 1.247 9.347
723 HH11 ARG 98 1HH1 ARG 98 -5.644 2.707 11.665
724 HH12 ARG 98 2HH1 ARG 98 -5.846 1.478 12.846
725 HH21 ARG 98 1HH2 ARG 98 -8.206 -0.372 11.016
726 HH22 ARG 98 2HH2 ARG 98 -7.332 -0.272 12.473
727 H MET 99 H MET 99 -5.005 -1.136 7.685
728 HA MET 99 HA MET 99 -4.883 -2.124 4.913
729 HB2 MET 99 2HB MET 99 -3.466 -3.310 7.301
730 HB3 MET 99 1HB MET 99 -3.545 -4.062 5.719
731 HG2 MET 99 2HG MET 99 -2.431 -2.052 4.773
732 HG3 MET 99 1HG MET 99 -2.236 -1.451 6.414
733 HE1 MET 99 3HE MET 99 1.389 -2.556 5.346
734 HE2 MET 99 1HE MET 99 0.380 -1.218 5.893
735 HE3 MET 99 2HE MET 99 0.144 -1.897 4.284
736 H HIS 100 H HIS 100 -6.241 -3.478 4.249
737 HA HIS 100 HA HIS 100 -8.218 -4.578 6.063
738 HB2 HIS 100 2HB HIS 100 -8.132 -4.612 3.034
739 HB3 HIS 100 1HB HIS 100 -9.483 -5.121 4.024
740 HD1 HIS 100 1HD HIS 100 -11.189 -3.329 4.591
741 HD2 HIS 100 2HD HIS 100 -7.631 -1.773 3.146
742 HE1 HIS 100 1HE HIS 100 -11.589 -0.865 4.264
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