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 |
|
|
653360 |
6hpj   |
34317 | cing | 1-original | 6 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H VAL 6 H1 VAL 6 -0.096 0.009 6.726
2 HA VAL 6 HA VAL 6 1.506 0.865 8.223
3 HB VAL 6 HB VAL 6 3.832 0.725 7.889
4 HG11 VAL 6 1HG1 VAL 6 2.710 -2.029 7.198
5 HG12 VAL 6 2HG1 VAL 6 4.271 -1.680 7.966
6 HG13 VAL 6 3HG1 VAL 6 2.764 -1.335 8.838
7 HG21 VAL 6 1HG2 VAL 6 3.260 -0.603 5.208
8 HG22 VAL 6 2HG2 VAL 6 3.938 1.026 5.455
9 HG23 VAL 6 3HG2 VAL 6 4.865 -0.404 5.945
10 H ILE 7 H ILE 7 2.596 2.954 7.930
11 HA ILE 7 HA ILE 7 1.258 4.506 5.897
12 HB ILE 7 HB ILE 7 3.475 5.197 7.862
13 HG12 ILE 7 2HG1 ILE 7 0.470 5.723 7.912
14 HG13 ILE 7 3HG1 ILE 7 1.299 4.471 8.857
15 HG21 ILE 7 1HG2 ILE 7 1.722 7.023 6.159
16 HG22 ILE 7 2HG2 ILE 7 2.892 7.554 7.392
17 HG23 ILE 7 3HG2 ILE 7 3.462 6.747 5.927
18 HD11 ILE 7 1HD1 ILE 7 0.932 6.396 10.282
19 HD12 ILE 7 2HD1 ILE 7 2.670 6.249 9.960
20 HD13 ILE 7 3HD1 ILE 7 1.700 7.480 9.112
21 H ARG 8 H ARG 8 2.041 5.400 4.008
22 HA ARG 8 HA ARG 8 4.843 5.183 3.284
23 HB2 ARG 8 2HB ARG 8 3.986 2.858 2.899
24 HB3 ARG 8 3HB ARG 8 2.776 3.507 1.794
25 HG2 ARG 8 2HG ARG 8 4.752 2.569 0.615
26 HG3 ARG 8 3HG ARG 8 4.534 4.284 0.258
27 HD2 ARG 8 2HD ARG 8 6.901 3.776 0.675
28 HD3 ARG 8 3HD ARG 8 6.272 4.871 1.907
29 HE ARG 8 HE ARG 8 6.274 3.083 3.511
30 HH11 ARG 8 1HH1 ARG 8 7.619 2.166 0.376
31 HH12 ARG 8 2HH1 ARG 8 8.558 0.848 1.026
32 HH21 ARG 8 1HH2 ARG 8 7.443 1.304 4.331
33 HH22 ARG 8 2HH2 ARG 8 8.406 0.319 3.259
34 H GLY 9 H GLY 9 5.189 6.013 1.030
35 HA2 GLY 9 2HA GLY 9 3.682 8.422 0.545
36 HA3 GLY 9 3HA GLY 9 5.018 7.790 -0.405
37 HA PRO 10 HA PRO 10 1.671 6.743 -3.309
38 HB2 PRO 10 2HB PRO 10 3.300 6.189 -5.446
39 HB3 PRO 10 3HB PRO 10 2.900 7.857 -4.940
40 HG2 PRO 10 2HG PRO 10 5.378 6.236 -4.317
41 HG3 PRO 10 3HG PRO 10 5.268 7.950 -4.844
42 HD2 PRO 10 2HD PRO 10 5.573 7.191 -2.218
43 HD3 PRO 10 3HD PRO 10 4.681 8.668 -2.688
44 H ALA 11 H ALA 11 2.171 4.664 -5.162
45 HA ALA 11 HA ALA 11 1.774 2.381 -3.496
46 HB1 ALA 11 1HB ALA 11 0.730 2.701 -5.707
47 HB2 ALA 11 2HB ALA 11 2.323 2.584 -6.483
48 HB3 ALA 11 3HB ALA 11 1.642 1.176 -5.637
49 H GLY 12 H GLY 12 4.644 3.889 -3.825
50 HA2 GLY 12 2HA GLY 12 6.415 1.686 -4.465
51 HA3 GLY 12 3HA GLY 12 6.860 3.244 -3.753
52 H ASN 13 H ASN 13 5.173 0.173 -2.937
53 HA ASN 13 HA ASN 13 5.552 0.576 -0.077
54 HB2 ASN 13 2HB ASN 13 4.522 -1.800 -1.674
55 HB3 ASN 13 3HB ASN 13 4.414 -1.624 0.083
56 HD21 ASN 13 1HD2 ASN 13 1.201 -0.519 -1.614
57 HD22 ASN 13 2HD2 ASN 13 2.183 -1.964 -1.728
58 H ASN 14 H ASN 14 7.751 -0.295 -2.409
59 HA ASN 14 HA ASN 14 8.905 -2.671 -1.288
60 HB2 ASN 14 2HB ASN 14 10.134 -0.505 -3.030
61 HB3 ASN 14 3HB ASN 14 10.814 -2.113 -2.753
62 HD21 ASN 14 1HD2 ASN 14 8.422 -1.687 -5.855
63 HD22 ASN 14 2HD2 ASN 14 9.418 -0.458 -5.103
64 H ASP 15 H ASP 15 10.890 -2.897 -0.122
65 HA ASP 15 HA ASP 15 11.161 -0.901 1.973
66 HB2 ASP 15 2HB ASP 15 12.824 -2.564 2.911
67 HB3 ASP 15 3HB ASP 15 11.160 -3.120 2.728
68 H CYS 16 H CYS 16 12.341 -0.844 -1.048
69 HA CYS 16 HA CYS 16 15.151 -0.310 -0.531
70 HB2 CYS 16 2HB CYS 16 13.377 0.124 -2.971
71 HB3 CYS 16 3HB CYS 16 15.148 0.311 -2.948
72 HG CYS 16 HG CYS 16 13.325 -2.349 -2.236
73 H ARG 17 H ARG 17 12.547 1.456 0.404
74 HA ARG 17 HA ARG 17 13.368 4.038 -0.690
75 HB2 ARG 17 2HB ARG 17 11.074 3.034 0.981
76 HB3 ARG 17 3HB ARG 17 11.476 4.769 0.995
77 HG2 ARG 17 2HG ARG 17 11.430 4.809 -1.473
78 HG3 ARG 17 3HG ARG 17 10.934 3.100 -1.491
79 HD2 ARG 17 2HD ARG 17 8.859 3.641 -0.346
80 HD3 ARG 17 3HD ARG 17 9.388 5.313 -0.083
81 HE ARG 17 HE ARG 17 8.936 4.160 -2.806
82 HH11 ARG 17 1HH1 ARG 17 8.518 6.731 -0.423
83 HH12 ARG 17 2HH1 ARG 17 7.770 7.833 -1.547
84 HH21 ARG 17 1HH2 ARG 17 8.008 5.607 -4.279
85 HH22 ARG 17 2HH2 ARG 17 7.486 7.193 -3.760
86 H ILE 18 H ILE 18 14.072 5.813 0.392
87 HA ILE 18 HA ILE 18 14.748 5.582 3.259
88 HB ILE 18 HB ILE 18 16.945 6.422 2.996
89 HG12 ILE 18 2HG1 ILE 18 16.537 6.571 -0.014
90 HG13 ILE 18 3HG1 ILE 18 16.440 7.966 1.079
91 HG21 ILE 18 1HG2 ILE 18 16.623 3.989 2.641
92 HG22 ILE 18 2HG2 ILE 18 16.642 4.264 0.880
93 HG23 ILE 18 3HG2 ILE 18 18.083 4.631 1.857
94 HD11 ILE 18 1HD1 ILE 18 18.762 7.496 1.861
95 HD12 ILE 18 2HD1 ILE 18 18.881 6.198 0.646
96 HD13 ILE 18 3HD1 ILE 18 18.663 7.887 0.131
97 H TYR 19 H TYR 19 15.575 7.869 3.951
98 HA TYR 19 HA TYR 19 13.636 9.815 2.845
99 HB2 TYR 19 2HB TYR 19 12.796 9.484 4.898
100 HB3 TYR 19 3HB TYR 19 14.347 9.088 5.617
101 HD1 TYR 19 HD1 TYR 19 11.913 11.714 5.032
102 HD2 TYR 19 HD2 TYR 19 15.990 10.918 6.150
103 HE1 TYR 19 HE1 TYR 19 12.068 13.964 6.082
104 HE2 TYR 19 HE2 TYR 19 16.152 13.179 7.169
105 HH TYR 19 HH TYR 19 13.423 15.497 7.096
106 H VAL 20 H VAL 20 14.057 12.015 2.725
107 HA VAL 20 HA VAL 20 16.909 12.785 2.930
108 HB VAL 20 HB VAL 20 15.172 13.325 0.495
109 HG11 VAL 20 1HG1 VAL 20 17.293 14.192 -0.461
110 HG12 VAL 20 2HG1 VAL 20 16.793 15.118 0.966
111 HG13 VAL 20 3HG1 VAL 20 18.101 13.919 1.097
112 HG21 VAL 20 1HG2 VAL 20 15.846 10.965 0.537
113 HG22 VAL 20 2HG2 VAL 20 16.786 11.838 -0.686
114 HG23 VAL 20 3HG2 VAL 20 17.528 11.430 0.874
115 H GLY 21 H GLY 21 17.269 14.925 3.470
116 HA2 GLY 21 2HA GLY 21 14.992 16.778 3.643
117 HA3 GLY 21 3HA GLY 21 15.695 16.251 5.184
118 H ASN 22 H ASN 22 15.881 18.795 4.998
119 HA ASN 22 HA ASN 22 17.108 20.674 4.748
120 HB2 ASN 22 2HB ASN 22 18.673 19.285 6.143
121 HB3 ASN 22 3HB ASN 22 19.512 18.829 4.648
122 HD21 ASN 22 1HD2 ASN 22 21.574 21.657 4.946
123 HD22 ASN 22 2HD2 ASN 22 21.427 19.921 4.730
124 H LEU 23 H LEU 23 15.959 19.674 2.364
125 HA LEU 23 HA LEU 23 17.752 19.552 0.179
126 HB2 LEU 23 2HB LEU 23 14.890 20.589 0.294
127 HB3 LEU 23 3HB LEU 23 15.763 20.123 -1.177
128 HG LEU 23 HG LEU 23 15.156 18.246 1.158
129 HD11 LEU 23 1HD1 LEU 23 13.484 17.261 -0.368
130 HD12 LEU 23 2HD1 LEU 23 13.128 18.973 -0.047
131 HD13 LEU 23 3HD1 LEU 23 13.870 18.492 -1.591
132 HD21 LEU 23 1HD2 LEU 23 15.803 16.491 -0.494
133 HD22 LEU 23 2HD2 LEU 23 16.291 17.762 -1.634
134 HD23 LEU 23 3HD2 LEU 23 17.160 17.564 -0.094
135 HA PRO 24 HA PRO 24 19.176 23.707 0.013
136 HB2 PRO 24 2HB PRO 24 20.107 23.814 -2.569
137 HB3 PRO 24 3HB PRO 24 20.921 22.903 -1.258
138 HG2 PRO 24 2HG PRO 24 19.040 21.854 -3.388
139 HG3 PRO 24 3HG PRO 24 20.592 21.150 -2.815
140 HD2 PRO 24 2HD PRO 24 18.140 20.283 -1.918
141 HD3 PRO 24 3HD PRO 24 19.591 20.293 -0.869
142 HA PRO 25 HA PRO 25 16.006 26.262 -1.604
143 HB2 PRO 25 2HB PRO 25 18.068 28.187 -2.593
144 HB3 PRO 25 3HB PRO 25 16.746 28.453 -1.416
145 HG2 PRO 25 2HG PRO 25 19.353 28.236 -0.622
146 HG3 PRO 25 3HG PRO 25 18.009 27.558 0.354
147 HD2 PRO 25 2HD PRO 25 19.881 26.126 -1.537
148 HD3 PRO 25 3HD PRO 25 19.284 25.622 0.075
149 H ASP 26 H ASP 26 18.256 24.839 -3.713
150 HA ASP 26 HA ASP 26 16.664 25.704 -6.060
151 HB2 ASP 26 2HB ASP 26 18.779 25.650 -7.415
152 HB3 ASP 26 3HB ASP 26 18.615 26.986 -6.273
153 H ILE 27 H ILE 27 16.570 23.285 -4.319
154 HA ILE 27 HA ILE 27 17.620 21.041 -5.663
155 HB ILE 27 HB ILE 27 16.659 20.971 -3.403
156 HG12 ILE 27 2HG1 ILE 27 15.278 18.935 -3.589
157 HG13 ILE 27 3HG1 ILE 27 15.091 19.193 -5.331
158 HG21 ILE 27 1HG2 ILE 27 14.216 21.043 -3.063
159 HG22 ILE 27 2HG2 ILE 27 14.798 22.567 -3.765
160 HG23 ILE 27 3HG2 ILE 27 13.973 21.370 -4.791
161 HD11 ILE 27 1HD1 ILE 27 17.744 18.762 -3.883
162 HD12 ILE 27 2HD1 ILE 27 16.867 17.530 -4.817
163 HD13 ILE 27 3HD1 ILE 27 17.539 18.949 -5.640
164 H ARG 28 H ARG 28 16.652 19.537 -7.149
165 HA ARG 28 HA ARG 28 14.343 20.522 -8.715
166 HB2 ARG 28 2HB ARG 28 16.372 21.496 -9.741
167 HB3 ARG 28 3HB ARG 28 17.094 19.886 -9.855
168 HG2 ARG 28 2HG ARG 28 15.127 19.199 -11.311
169 HG3 ARG 28 3HG ARG 28 14.629 20.905 -11.316
170 HD2 ARG 28 2HD ARG 28 17.319 19.802 -12.259
171 HD3 ARG 28 3HD ARG 28 15.997 20.323 -13.309
172 HE ARG 28 HE ARG 28 16.364 22.595 -12.656
173 HH11 ARG 28 1HH1 ARG 28 18.778 20.345 -11.333
174 HH12 ARG 28 2HH1 ARG 28 19.950 21.604 -11.056
175 HH21 ARG 28 1HH2 ARG 28 17.924 24.203 -12.261
176 HH22 ARG 28 2HH2 ARG 28 19.472 23.776 -11.568
177 H THR 29 H THR 29 13.216 18.862 -9.777
178 HA THR 29 HA THR 29 13.329 16.340 -8.533
179 HB THR 29 HB THR 29 12.017 16.724 -11.201
180 HG1 THR 29 1HG THR 29 10.373 17.829 -10.144
181 HG21 THR 29 1HG2 THR 29 11.181 15.413 -8.575
182 HG22 THR 29 2HG2 THR 29 10.222 15.428 -10.072
183 HG23 THR 29 3HG2 THR 29 11.769 14.559 -10.021
184 H LYS 30 H LYS 30 15.039 17.481 -11.361
185 HA LYS 30 HA LYS 30 15.541 14.801 -12.384
186 HB2 LYS 30 2HB LYS 30 15.332 16.887 -13.794
187 HB3 LYS 30 3HB LYS 30 16.855 17.460 -13.098
188 HG2 LYS 30 2HG LYS 30 17.329 16.442 -15.247
189 HG3 LYS 30 3HG LYS 30 17.978 15.384 -13.987
190 HD2 LYS 30 2HD LYS 30 15.880 13.992 -14.150
191 HD3 LYS 30 3HD LYS 30 15.336 15.040 -15.479
192 HE2 LYS 30 2HE LYS 30 17.363 14.427 -16.773
193 HE3 LYS 30 3HE LYS 30 17.896 13.385 -15.444
194 HZ1 LYS 30 1HZ LYS 30 15.438 13.055 -17.021
195 HZ2 LYS 30 2HZ LYS 30 16.778 12.107 -17.098
196 HZ3 LYS 30 3HZ LYS 30 15.853 12.123 -15.735
197 H ASP 31 H ASP 31 16.945 16.854 -9.950
198 HA ASP 31 HA ASP 31 19.672 16.081 -10.247
199 HB2 ASP 31 2HB ASP 31 18.123 17.076 -7.832
200 HB3 ASP 31 3HB ASP 31 19.871 16.825 -7.874
201 H ILE 32 H ILE 32 16.927 14.473 -8.720
202 HA ILE 32 HA ILE 32 18.583 12.552 -7.294
203 HB ILE 32 HB ILE 32 15.638 12.386 -8.022
204 HG12 ILE 32 2HG1 ILE 32 16.004 14.521 -6.902
205 HG13 ILE 32 3HG1 ILE 32 15.181 13.397 -5.817
206 HG21 ILE 32 1HG2 ILE 32 15.554 11.016 -5.916
207 HG22 ILE 32 2HG2 ILE 32 16.517 10.286 -7.211
208 HG23 ILE 32 3HG2 ILE 32 17.332 11.085 -5.850
209 HD11 ILE 32 1HD1 ILE 32 16.950 14.642 -4.633
210 HD12 ILE 32 2HD1 ILE 32 17.318 12.908 -4.667
211 HD13 ILE 32 3HD1 ILE 32 18.167 14.027 -5.765
212 H GLU 33 H GLU 33 17.297 12.928 -10.527
213 HA GLU 33 HA GLU 33 17.634 10.078 -11.178
214 HB2 GLU 33 2HB GLU 33 16.944 12.478 -12.926
215 HB3 GLU 33 3HB GLU 33 16.923 10.779 -13.435
216 HG2 GLU 33 2HG GLU 33 15.254 10.335 -11.576
217 HG3 GLU 33 3HG GLU 33 15.160 12.086 -11.322
218 H ASP 34 H ASP 34 19.607 12.869 -10.990
219 HA ASP 34 HA ASP 34 21.535 11.738 -12.944
220 HB2 ASP 34 2HB ASP 34 21.314 14.455 -11.645
221 HB3 ASP 34 3HB ASP 34 22.729 13.932 -12.563
222 H VAL 35 H VAL 35 21.782 13.279 -9.686
223 HA VAL 35 HA VAL 35 24.392 12.094 -9.324
224 HB VAL 35 HB VAL 35 22.585 13.489 -7.309
225 HG11 VAL 35 1HG1 VAL 35 25.591 12.994 -7.368
226 HG12 VAL 35 2HG1 VAL 35 24.727 13.967 -6.153
227 HG13 VAL 35 3HG1 VAL 35 24.423 12.220 -6.270
228 HG21 VAL 35 1HG2 VAL 35 23.912 15.509 -7.864
229 HG22 VAL 35 2HG2 VAL 35 24.742 14.607 -9.153
230 HG23 VAL 35 3HG2 VAL 35 22.994 14.922 -9.264
231 H PHE 36 H PHE 36 21.209 11.581 -7.669
232 HA PHE 36 HA PHE 36 22.278 9.392 -6.161
233 HB2 PHE 36 2HB PHE 36 19.498 10.443 -6.591
234 HB3 PHE 36 3HB PHE 36 19.810 8.963 -5.682
235 HD1 PHE 36 HD1 PHE 36 20.054 12.612 -5.636
236 HD2 PHE 36 HD2 PHE 36 21.139 8.989 -3.598
237 HE1 PHE 36 HE1 PHE 36 20.569 13.917 -3.598
238 HE2 PHE 36 HE2 PHE 36 21.655 10.297 -1.551
239 HZ PHE 36 HZ PHE 36 21.375 12.764 -1.553
240 H SER 37 H SER 37 21.007 9.567 -9.387
241 HA SER 37 HA SER 37 20.393 6.741 -9.595
242 HB2 SER 37 2HB SER 37 19.407 8.430 -11.098
243 HB3 SER 37 3HB SER 37 21.026 8.826 -11.715
244 HG SER 37 HG SER 37 19.940 7.310 -13.049
245 H LYS 38 H LYS 38 23.286 8.791 -10.058
246 HA LYS 38 HA LYS 38 24.909 6.707 -11.205
247 HB2 LYS 38 2HB LYS 38 25.449 9.092 -11.388
248 HB3 LYS 38 3HB LYS 38 25.645 9.207 -9.627
249 HG2 LYS 38 2HG LYS 38 27.515 7.599 -9.707
250 HG3 LYS 38 3HG LYS 38 27.307 7.426 -11.462
251 HD2 LYS 38 2HD LYS 38 28.002 10.016 -10.008
252 HD3 LYS 38 3HD LYS 38 29.154 8.979 -10.870
253 HE2 LYS 38 2HE LYS 38 27.878 9.315 -12.971
254 HE3 LYS 38 3HE LYS 38 26.743 10.374 -12.114
255 HZ1 LYS 38 1HZ LYS 38 29.629 10.853 -12.428
256 HZ2 LYS 38 2HZ LYS 38 28.432 11.621 -13.254
257 HZ3 LYS 38 3HZ LYS 38 28.578 11.839 -11.630
258 H TYR 39 H TYR 39 23.956 7.617 -7.921
259 HA TYR 39 HA TYR 39 25.857 5.774 -6.722
260 HB2 TYR 39 2HB TYR 39 23.878 7.724 -5.661
261 HB3 TYR 39 3HB TYR 39 24.423 6.403 -4.623
262 HD1 TYR 39 HD1 TYR 39 26.386 6.541 -3.432
263 HD2 TYR 39 HD2 TYR 39 25.786 9.153 -6.797
264 HE1 TYR 39 HE1 TYR 39 28.452 7.765 -2.836
265 HE2 TYR 39 HE2 TYR 39 27.861 10.383 -6.219
266 HH TYR 39 HH TYR 39 29.905 9.439 -3.431
267 H GLY 40 H GLY 40 22.608 5.325 -7.927
268 HA2 GLY 40 2HA GLY 40 22.688 2.576 -7.126
269 HA3 GLY 40 3HA GLY 40 21.690 3.491 -5.992
270 H ALA 41 H ALA 41 21.688 4.606 -9.320
271 HA ALA 41 HA ALA 41 20.022 4.648 -10.881
272 HB1 ALA 41 1HB ALA 41 19.391 2.419 -11.707
273 HB2 ALA 41 2HB ALA 41 21.124 2.506 -11.325
274 HB3 ALA 41 3HB ALA 41 20.012 1.679 -10.208
275 H ILE 42 H ILE 42 18.861 5.807 -8.898
276 HA ILE 42 HA ILE 42 16.808 4.769 -7.411
277 HB ILE 42 HB ILE 42 16.703 7.382 -8.968
278 HG12 ILE 42 2HG1 ILE 42 18.834 7.332 -7.876
279 HG13 ILE 42 3HG1 ILE 42 17.760 8.373 -6.923
280 HG21 ILE 42 1HG2 ILE 42 15.444 6.519 -6.337
281 HG22 ILE 42 2HG2 ILE 42 15.397 8.164 -6.998
282 HG23 ILE 42 3HG2 ILE 42 14.592 6.846 -7.867
283 HD11 ILE 42 1HD1 ILE 42 17.337 6.453 -5.373
284 HD12 ILE 42 2HD1 ILE 42 18.500 5.480 -6.298
285 HD13 ILE 42 3HD1 ILE 42 19.049 6.931 -5.434
286 H ARG 43 H ARG 43 14.830 3.926 -7.699
287 HA ARG 43 HA ARG 43 13.845 3.518 -10.445
288 HB2 ARG 43 2HB ARG 43 12.924 2.559 -7.710
289 HB3 ARG 43 3HB ARG 43 12.082 2.191 -9.232
290 HG2 ARG 43 2HG ARG 43 14.135 1.132 -10.120
291 HG3 ARG 43 3HG ARG 43 14.961 1.436 -8.574
292 HD2 ARG 43 2HD ARG 43 13.348 0.053 -7.385
293 HD3 ARG 43 3HD ARG 43 12.364 -0.138 -8.854
294 HE ARG 43 HE ARG 43 14.987 -1.066 -9.406
295 HH11 ARG 43 1HH1 ARG 43 12.161 -1.923 -7.460
296 HH12 ARG 43 2HH1 ARG 43 12.486 -3.640 -7.535
297 HH21 ARG 43 1HH2 ARG 43 15.404 -3.313 -9.461
298 HH22 ARG 43 2HH2 ARG 43 14.330 -4.421 -8.646
299 H ASP 44 H ASP 44 12.962 5.327 -7.499
300 HA ASP 44 HA ASP 44 11.045 6.883 -9.074
301 HB2 ASP 44 2HB ASP 44 10.232 5.040 -6.840
302 HB3 ASP 44 3HB ASP 44 9.347 6.542 -7.132
303 H ILE 45 H ILE 45 10.388 8.838 -8.263
304 HA ILE 45 HA ILE 45 12.007 9.877 -5.991
305 HB ILE 45 HB ILE 45 11.033 11.058 -8.594
306 HG12 ILE 45 2HG1 ILE 45 13.265 12.184 -8.459
307 HG13 ILE 45 3HG1 ILE 45 13.582 11.331 -6.940
308 HG21 ILE 45 1HG2 ILE 45 11.581 12.641 -6.056
309 HG22 ILE 45 2HG2 ILE 45 11.443 13.333 -7.692
310 HG23 ILE 45 3HG2 ILE 45 10.036 12.561 -6.949
311 HD11 ILE 45 1HD1 ILE 45 13.001 9.970 -9.609
312 HD12 ILE 45 2HD1 ILE 45 14.628 10.247 -8.952
313 HD13 ILE 45 3HD1 ILE 45 13.509 9.172 -8.094
314 H ASP 46 H ASP 46 10.900 11.173 -4.416
315 HA ASP 46 HA ASP 46 7.980 11.349 -4.673
316 HB2 ASP 46 2HB ASP 46 8.439 9.132 -3.678
317 HB3 ASP 46 3HB ASP 46 9.371 9.898 -2.390
318 H LEU 47 H LEU 47 9.214 13.572 -4.944
319 HA LEU 47 HA LEU 47 10.127 14.899 -2.585
320 HB2 LEU 47 2HB LEU 47 8.736 16.066 -5.032
321 HB3 LEU 47 3HB LEU 47 9.684 16.975 -3.843
322 HG LEU 47 HG LEU 47 10.734 14.816 -5.728
323 HD11 LEU 47 1HD1 LEU 47 11.179 17.827 -5.592
324 HD12 LEU 47 2HD1 LEU 47 11.992 16.714 -6.716
325 HD13 LEU 47 3HD1 LEU 47 10.235 16.964 -6.826
326 HD21 LEU 47 1HD2 LEU 47 11.981 14.746 -3.623
327 HD22 LEU 47 2HD2 LEU 47 12.976 15.521 -4.872
328 HD23 LEU 47 3HD2 LEU 47 12.169 16.524 -3.648
329 H LYS 48 H LYS 48 9.091 15.965 -0.959
330 HA LYS 48 HA LYS 48 6.152 16.247 -1.105
331 HB2 LYS 48 2HB LYS 48 7.855 14.928 1.015
332 HB3 LYS 48 3HB LYS 48 6.341 15.745 1.450
333 HG2 LYS 48 2HG LYS 48 5.144 14.396 -0.276
334 HG3 LYS 48 3HG LYS 48 6.642 13.485 -0.579
335 HD2 LYS 48 2HD LYS 48 6.677 12.654 1.696
336 HD3 LYS 48 3HD LYS 48 5.351 13.734 2.166
337 HE2 LYS 48 2HE LYS 48 4.498 11.452 1.818
338 HE3 LYS 48 3HE LYS 48 3.819 12.581 0.634
339 HZ1 LYS 48 1HZ LYS 48 5.487 11.800 -0.936
340 HZ2 LYS 48 2HZ LYS 48 6.028 10.697 0.155
341 HZ3 LYS 48 3HZ LYS 48 4.497 10.595 -0.443
342 H ASN 49 H ASN 49 7.705 18.263 -1.916
343 HA ASN 49 HA ASN 49 8.195 20.119 0.289
344 HB2 ASN 49 2HB ASN 49 8.101 20.520 -2.726
345 HB3 ASN 49 3HB ASN 49 8.650 21.725 -1.554
346 HD21 ASN 49 1HD2 ASN 49 11.576 19.793 -3.019
347 HD22 ASN 49 2HD2 ASN 49 10.215 20.632 -3.733
348 H ARG 50 H ARG 50 5.421 18.842 -0.796
349 HA ARG 50 HA ARG 50 3.734 20.976 -1.521
350 HB2 ARG 50 2HB ARG 50 3.223 18.570 -1.766
351 HB3 ARG 50 3HB ARG 50 3.115 18.408 -0.004
352 HG2 ARG 50 2HG ARG 50 1.198 19.957 0.044
353 HG3 ARG 50 3HG ARG 50 1.331 20.186 -1.717
354 HD2 ARG 50 2HD ARG 50 0.943 17.761 -2.051
355 HD3 ARG 50 3HD ARG 50 0.801 17.541 -0.297
356 HE ARG 50 HE ARG 50 -1.092 19.428 -0.742
357 HH11 ARG 50 1HH1 ARG 50 -0.409 16.351 -2.354
358 HH12 ARG 50 2HH1 ARG 50 -2.068 16.123 -2.855
359 HH21 ARG 50 1HH2 ARG 50 -3.242 19.098 -1.423
360 HH22 ARG 50 2HH2 ARG 50 -3.665 17.659 -2.322
361 H ARG 51 H ARG 51 2.204 22.195 -0.330
362 HA ARG 51 HA ARG 51 3.167 23.273 2.144
363 HB2 ARG 51 2HB ARG 51 0.734 23.614 0.403
364 HB3 ARG 51 3HB ARG 51 0.693 24.237 2.057
365 HG2 ARG 51 2HG ARG 51 1.387 25.996 0.570
366 HG3 ARG 51 3HG ARG 51 2.726 25.576 1.642
367 HD2 ARG 51 2HD ARG 51 2.494 24.353 -1.127
368 HD3 ARG 51 3HD ARG 51 3.199 25.959 -0.894
369 HE ARG 51 HE ARG 51 4.420 23.406 -0.237
370 HH11 ARG 51 1HH1 ARG 51 4.358 26.855 0.541
371 HH12 ARG 51 2HH1 ARG 51 5.989 26.864 1.167
372 HH21 ARG 51 1HH2 ARG 51 6.537 23.442 0.568
373 HH22 ARG 51 2HH2 ARG 51 7.217 24.920 1.208
374 H GLY 52 H GLY 52 1.649 23.533 4.073
375 HA2 GLY 52 2HA GLY 52 0.123 22.602 5.616
376 HA3 GLY 52 3HA GLY 52 0.099 21.091 4.686
377 H GLY 53 H GLY 53 3.305 21.906 4.814
378 HA2 GLY 53 2HA GLY 53 4.058 21.356 7.512
379 HA3 GLY 53 3HA GLY 53 4.103 19.861 6.562
380 HA PRO 54 HA PRO 54 8.033 22.405 5.944
381 HB2 PRO 54 2HB PRO 54 9.805 20.594 7.032
382 HB3 PRO 54 3HB PRO 54 9.003 21.897 7.973
383 HG2 PRO 54 2HG PRO 54 8.236 18.976 7.770
384 HG3 PRO 54 3HG PRO 54 8.289 20.027 9.224
385 HD2 PRO 54 2HD PRO 54 5.965 19.474 7.867
386 HD3 PRO 54 3HD PRO 54 6.249 21.048 8.678
387 HA PRO 55 HA PRO 55 8.673 19.961 2.319
388 HB2 PRO 55 2HB PRO 55 11.076 20.967 1.432
389 HB3 PRO 55 3HB PRO 55 9.532 21.881 1.338
390 HG2 PRO 55 2HG PRO 55 11.735 22.099 3.404
391 HG3 PRO 55 3HG PRO 55 10.827 23.417 2.598
392 HD2 PRO 55 2HD PRO 55 10.218 22.498 5.113
393 HD3 PRO 55 3HD PRO 55 8.966 23.113 3.993
394 H PHE 56 H PHE 56 9.530 17.982 1.873
395 HA PHE 56 HA PHE 56 12.219 17.203 2.626
396 HB2 PHE 56 2HB PHE 56 11.723 15.560 4.245
397 HB3 PHE 56 3HB PHE 56 10.861 16.991 4.797
398 HD1 PHE 56 HD1 PHE 56 8.301 17.089 3.686
399 HD2 PHE 56 HD2 PHE 56 10.628 13.560 4.506
400 HE1 PHE 56 HE1 PHE 56 6.225 15.761 3.896
401 HE2 PHE 56 HE2 PHE 56 8.546 12.266 4.819
402 HZ PHE 56 HZ PHE 56 6.341 13.344 4.457
403 H ALA 57 H ALA 57 12.159 14.540 2.156
404 HA ALA 57 HA ALA 57 10.197 13.890 0.093
405 HB1 ALA 57 1HB ALA 57 13.126 14.310 -0.632
406 HB2 ALA 57 2HB ALA 57 11.868 13.660 -1.707
407 HB3 ALA 57 3HB ALA 57 11.774 15.348 -1.147
408 H PHE 58 H PHE 58 10.561 11.762 -0.869
409 HA PHE 58 HA PHE 58 12.385 10.006 0.686
410 HB2 PHE 58 2HB PHE 58 9.625 9.395 -0.404
411 HB3 PHE 58 3HB PHE 58 10.747 8.169 0.191
412 HD1 PHE 58 HD1 PHE 58 8.197 10.503 1.067
413 HD2 PHE 58 HD2 PHE 58 11.572 8.346 2.620
414 HE1 PHE 58 HE1 PHE 58 7.388 10.898 3.381
415 HE2 PHE 58 HE2 PHE 58 10.741 8.695 4.929
416 HZ PHE 58 HZ PHE 58 8.652 9.986 5.313
417 H VAL 59 H VAL 59 13.234 8.151 -0.507
418 HA VAL 59 HA VAL 59 13.292 8.532 -3.460
419 HB VAL 59 HB VAL 59 15.678 8.407 -1.572
420 HG11 VAL 59 1HG1 VAL 59 15.564 8.279 -4.612
421 HG12 VAL 59 2HG1 VAL 59 17.050 8.448 -3.646
422 HG13 VAL 59 3HG1 VAL 59 16.084 6.967 -3.522
423 HG21 VAL 59 1HG2 VAL 59 14.760 10.479 -3.612
424 HG22 VAL 59 2HG2 VAL 59 14.740 10.667 -1.845
425 HG23 VAL 59 3HG2 VAL 59 16.287 10.542 -2.704
426 H GLU 60 H GLU 60 13.367 6.591 -4.560
427 HA GLU 60 HA GLU 60 13.470 4.145 -2.851
428 HB2 GLU 60 2HB GLU 60 11.230 4.669 -3.657
429 HB3 GLU 60 3HB GLU 60 11.818 4.722 -5.334
430 HG2 GLU 60 2HG GLU 60 12.327 2.388 -5.345
431 HG3 GLU 60 3HG GLU 60 12.161 2.264 -3.585
432 H PHE 61 H PHE 61 15.238 2.998 -3.175
433 HA PHE 61 HA PHE 61 16.847 3.402 -5.549
434 HB2 PHE 61 2HB PHE 61 17.250 2.044 -2.915
435 HB3 PHE 61 3HB PHE 61 18.357 1.737 -4.256
436 HD1 PHE 61 HD1 PHE 61 16.947 4.446 -2.112
437 HD2 PHE 61 HD2 PHE 61 19.994 3.289 -4.912
438 HE1 PHE 61 HE1 PHE 61 18.156 6.565 -1.674
439 HE2 PHE 61 HE2 PHE 61 21.204 5.409 -4.479
440 HZ PHE 61 HZ PHE 61 20.288 7.046 -2.846
441 H GLU 62 H GLU 62 18.048 1.571 -6.574
442 HA GLU 62 HA GLU 62 16.249 -0.277 -7.813
443 HB2 GLU 62 2HB GLU 62 18.300 0.490 -8.898
444 HB3 GLU 62 3HB GLU 62 19.280 -0.158 -7.579
445 HG2 GLU 62 2HG GLU 62 19.389 -1.681 -9.469
446 HG3 GLU 62 3HG GLU 62 18.533 -2.458 -8.138
447 H ASP 63 H ASP 63 18.462 -0.478 -5.027
448 HA ASP 63 HA ASP 63 16.913 -2.659 -3.932
449 HB2 ASP 63 2HB ASP 63 18.866 -4.213 -3.680
450 HB3 ASP 63 3HB ASP 63 18.305 -4.015 -5.339
451 HA PRO 64 HA PRO 64 18.132 -0.849 -0.174
452 HB2 PRO 64 2HB PRO 64 18.833 -3.497 1.015
453 HB3 PRO 64 3HB PRO 64 17.594 -2.319 1.544
454 HG2 PRO 64 2HG PRO 64 16.912 -4.650 0.292
455 HG3 PRO 64 3HG PRO 64 16.018 -3.122 -0.004
456 HD2 PRO 64 2HD PRO 64 18.158 -4.415 -1.693
457 HD3 PRO 64 3HD PRO 64 16.633 -3.630 -2.204
458 H ARG 65 H ARG 65 20.434 -2.913 -1.811
459 HA ARG 65 HA ARG 65 22.598 -2.503 0.083
460 HB2 ARG 65 2HB ARG 65 22.279 -4.518 -1.439
461 HB3 ARG 65 3HB ARG 65 22.755 -3.467 -2.793
462 HG2 ARG 65 2HG ARG 65 24.710 -3.059 -0.762
463 HG3 ARG 65 3HG ARG 65 24.403 -4.805 -0.787
464 HD2 ARG 65 2HD ARG 65 26.172 -4.367 -2.354
465 HD3 ARG 65 3HD ARG 65 24.720 -4.743 -3.297
466 HE ARG 65 HE ARG 65 24.648 -2.528 -4.071
467 HH11 ARG 65 1HH1 ARG 65 27.073 -2.846 -1.515
468 HH12 ARG 65 2HH1 ARG 65 27.766 -1.269 -1.835
469 HH21 ARG 65 1HH2 ARG 65 25.589 -0.531 -4.480
470 HH22 ARG 65 2HH2 ARG 65 26.935 0.036 -3.509
471 H ASP 66 H ASP 66 21.635 -1.112 -3.094
472 HA ASP 66 HA ASP 66 23.968 0.571 -3.262
473 HB2 ASP 66 2HB ASP 66 21.298 0.593 -4.697
474 HB3 ASP 66 3HB ASP 66 22.606 1.745 -5.029
475 H ALA 67 H ALA 67 20.904 0.857 -1.603
476 HA ALA 67 HA ALA 67 20.852 3.718 -1.414
477 HB1 ALA 67 1HB ALA 67 18.887 2.266 -1.016
478 HB2 ALA 67 2HB ALA 67 19.690 1.572 0.412
479 HB3 ALA 67 3HB ALA 67 19.234 3.287 0.399
480 H GLU 68 H GLU 68 22.594 1.176 0.337
481 HA GLU 68 HA GLU 68 23.222 2.763 2.644
482 HB2 GLU 68 2HB GLU 68 23.319 0.308 2.669
483 HB3 GLU 68 3HB GLU 68 24.555 0.323 1.400
484 HG2 GLU 68 2HG GLU 68 25.628 -0.069 3.527
485 HG3 GLU 68 3HG GLU 68 26.112 1.517 2.935
486 H ASP 69 H ASP 69 24.731 2.341 -0.558
487 HA ASP 69 HA ASP 69 27.154 3.735 0.166
488 HB2 ASP 69 2HB ASP 69 25.920 2.957 -2.482
489 HB3 ASP 69 3HB ASP 69 27.448 3.834 -2.342
490 H ALA 70 H ALA 70 24.029 4.714 -1.223
491 HA ALA 70 HA ALA 70 24.880 7.411 -1.847
492 HB1 ALA 70 1HB ALA 70 22.462 7.791 -2.148
493 HB2 ALA 70 2HB ALA 70 22.958 6.278 -2.947
494 HB3 ALA 70 3HB ALA 70 22.107 6.232 -1.383
495 H VAL 71 H VAL 71 23.491 5.748 0.989
496 HA VAL 71 HA VAL 71 22.864 8.164 2.442
497 HB VAL 71 HB VAL 71 23.220 5.220 3.120
498 HG11 VAL 71 1HG1 VAL 71 22.629 7.486 5.069
499 HG12 VAL 71 2HG1 VAL 71 22.423 5.754 5.420
500 HG13 VAL 71 3HG1 VAL 71 24.043 6.404 5.092
501 HG21 VAL 71 1HG2 VAL 71 20.846 7.120 3.358
502 HG22 VAL 71 2HG2 VAL 71 21.126 6.038 1.977
503 HG23 VAL 71 3HG2 VAL 71 20.826 5.358 3.590
504 H SER 72 H SER 72 25.638 5.859 2.355
505 HA SER 72 HA SER 72 27.097 7.206 4.424
506 HB2 SER 72 2HB SER 72 27.431 4.840 3.846
507 HB3 SER 72 3HB SER 72 27.986 5.295 2.225
508 HG SER 72 HG SER 72 29.715 4.931 3.682
509 H GLY 73 H GLY 73 26.528 8.013 1.111
510 HA2 GLY 73 2HA GLY 73 29.118 9.456 0.880
511 HA3 GLY 73 3HA GLY 73 28.032 9.017 -0.445
512 H ARG 74 H ARG 74 25.861 10.186 1.750
513 HA ARG 74 HA ARG 74 26.320 13.025 0.996
514 HB2 ARG 74 2HB ARG 74 23.856 11.370 0.315
515 HB3 ARG 74 3HB ARG 74 23.919 13.133 0.218
516 HG2 ARG 74 2HG ARG 74 25.749 11.266 -1.350
517 HG3 ARG 74 3HG ARG 74 24.270 12.012 -1.978
518 HD2 ARG 74 2HD ARG 74 25.224 14.266 -1.433
519 HD3 ARG 74 3HD ARG 74 26.750 13.488 -0.992
520 HE ARG 74 HE ARG 74 25.658 13.878 -3.689
521 HH11 ARG 74 1HH1 ARG 74 28.035 12.188 -1.686
522 HH12 ARG 74 2HH1 ARG 74 29.068 11.794 -3.037
523 HH21 ARG 74 1HH2 ARG 74 27.045 13.384 -5.428
524 HH22 ARG 74 2HH2 ARG 74 28.518 12.485 -5.148
525 H ASP 75 H ASP 75 25.259 10.757 3.362
526 HA ASP 75 HA ASP 75 23.310 12.508 4.607
527 HB2 ASP 75 2HB ASP 75 23.351 9.993 4.796
528 HB3 ASP 75 3HB ASP 75 24.825 10.128 5.763
529 H GLY 76 H GLY 76 23.555 13.827 6.409
530 HA2 GLY 76 2HA GLY 76 24.553 15.028 8.054
531 HA3 GLY 76 3HA GLY 76 25.717 13.701 8.219
532 H TYR 77 H TYR 77 25.166 15.926 5.395
533 HA TYR 77 HA TYR 77 28.074 16.359 5.441
534 HB2 TYR 77 2HB TYR 77 27.480 15.437 3.417
535 HB3 TYR 77 3HB TYR 77 26.048 16.456 3.250
536 HD1 TYR 77 HD1 TYR 77 26.122 18.324 1.869
537 HD2 TYR 77 HD2 TYR 77 29.786 16.737 3.479
538 HE1 TYR 77 HE1 TYR 77 27.414 19.964 0.532
539 HE2 TYR 77 HE2 TYR 77 31.086 18.379 2.138
540 HH TYR 77 HH TYR 77 29.488 20.750 -0.030
541 H ASP 78 H ASP 78 29.072 18.176 5.745
542 HA ASP 78 HA ASP 78 27.750 20.337 6.990
543 HB2 ASP 78 2HB ASP 78 30.008 19.865 7.535
544 HB3 ASP 78 3HB ASP 78 30.517 19.971 5.847
545 H TYR 79 H TYR 79 26.269 21.535 6.037
546 HA TYR 79 HA TYR 79 26.929 22.774 3.420
547 HB2 TYR 79 2HB TYR 79 25.045 21.336 3.216
548 HB3 TYR 79 3HB TYR 79 24.302 21.997 4.668
549 HD1 TYR 79 HD1 TYR 79 24.921 22.519 1.088
550 HD2 TYR 79 HD2 TYR 79 23.209 24.185 4.653
551 HE1 TYR 79 HE1 TYR 79 23.656 24.150 -0.297
552 HE2 TYR 79 HE2 TYR 79 21.927 25.821 3.282
553 HH TYR 79 HH TYR 79 21.498 26.604 1.176
554 H ASP 80 H ASP 80 25.788 24.959 3.126
555 HA ASP 80 HA ASP 80 26.898 26.735 5.026
556 HB2 ASP 80 2HB ASP 80 26.658 27.444 2.772
557 HB3 ASP 80 3HB ASP 80 24.919 27.112 2.778
558 H GLY 81 H GLY 81 26.241 26.536 7.117
559 HA2 GLY 81 2HA GLY 81 24.977 27.256 8.912
560 HA3 GLY 81 3HA GLY 81 23.706 27.773 7.797
561 H TYR 82 H TYR 82 24.269 24.663 6.845
562 HA TYR 82 HA TYR 82 22.608 23.399 8.935
563 HB2 TYR 82 2HB TYR 82 21.811 23.610 6.021
564 HB3 TYR 82 3HB TYR 82 21.078 22.502 7.180
565 HD1 TYR 82 HD1 TYR 82 19.479 23.230 8.805
566 HD2 TYR 82 HD2 TYR 82 21.546 26.069 6.322
567 HE1 TYR 82 HE1 TYR 82 17.893 24.995 9.517
568 HE2 TYR 82 HE2 TYR 82 19.955 27.847 7.025
569 HH TYR 82 HH TYR 82 17.270 27.188 9.298
570 H ARG 83 H ARG 83 22.001 21.027 7.779
571 HA ARG 83 HA ARG 83 24.505 19.798 6.798
572 HB2 ARG 83 2HB ARG 83 24.654 19.895 9.297
573 HB3 ARG 83 3HB ARG 83 23.155 18.957 9.398
574 HG2 ARG 83 2HG ARG 83 24.209 17.064 8.287
575 HG3 ARG 83 3HG ARG 83 25.673 18.026 7.957
576 HD2 ARG 83 2HD ARG 83 26.016 18.327 10.399
577 HD3 ARG 83 3HD ARG 83 24.604 17.300 10.708
578 HE ARG 83 HE ARG 83 26.919 16.244 9.144
579 HH11 ARG 83 1HH1 ARG 83 24.928 16.158 12.066
580 HH12 ARG 83 2HH1 ARG 83 25.577 14.621 12.595
581 HH21 ARG 83 1HH2 ARG 83 27.737 14.253 9.852
582 HH22 ARG 83 2HH2 ARG 83 27.162 13.544 11.343
583 H LEU 84 H LEU 84 24.037 18.251 5.348
584 HA LEU 84 HA LEU 84 21.337 17.917 4.470
585 HB2 LEU 84 2HB LEU 84 23.989 16.596 3.829
586 HB3 LEU 84 3HB LEU 84 22.486 15.961 3.148
587 HG LEU 84 HG LEU 84 23.648 17.498 1.607
588 HD11 LEU 84 1HD1 LEU 84 21.164 17.231 1.548
589 HD12 LEU 84 2HD1 LEU 84 21.006 18.642 2.618
590 HD13 LEU 84 3HD1 LEU 84 21.702 18.831 0.997
591 HD21 LEU 84 1HD2 LEU 84 24.622 19.024 3.328
592 HD22 LEU 84 2HD2 LEU 84 23.764 19.880 2.031
593 HD23 LEU 84 3HD2 LEU 84 22.997 19.685 3.620
594 H ARG 85 H ARG 85 19.924 16.195 4.568
595 HA ARG 85 HA ARG 85 20.587 14.053 6.549
596 HB2 ARG 85 2HB ARG 85 17.823 15.108 5.829
597 HB3 ARG 85 3HB ARG 85 18.247 14.002 7.148
598 HG2 ARG 85 2HG ARG 85 19.083 16.930 6.938
599 HG3 ARG 85 3HG ARG 85 17.785 16.291 7.957
600 HD2 ARG 85 2HD ARG 85 19.424 14.874 9.160
601 HD3 ARG 85 3HD ARG 85 20.734 15.567 8.173
602 HE ARG 85 HE ARG 85 19.438 17.760 9.257
603 HH11 ARG 85 1HH1 ARG 85 21.056 14.892 10.533
604 HH12 ARG 85 2HH1 ARG 85 21.509 15.666 12.035
605 HH21 ARG 85 1HH2 ARG 85 20.056 18.757 11.203
606 HH22 ARG 85 2HH2 ARG 85 20.970 17.863 12.400
607 H VAL 86 H VAL 86 20.867 12.152 5.593
608 HA VAL 86 HA VAL 86 19.056 11.343 3.411
609 HB VAL 86 HB VAL 86 22.076 11.113 3.122
610 HG11 VAL 86 1HG1 VAL 86 20.744 9.324 2.035
611 HG12 VAL 86 2HG1 VAL 86 19.773 10.564 1.203
612 HG13 VAL 86 3HG1 VAL 86 21.507 10.390 0.839
613 HG21 VAL 86 1HG2 VAL 86 20.128 12.999 1.734
614 HG22 VAL 86 2HG2 VAL 86 21.435 13.467 2.849
615 HG23 VAL 86 3HG2 VAL 86 21.827 12.753 1.273
616 H GLU 87 H GLU 87 18.196 10.059 5.182
617 HA GLU 87 HA GLU 87 19.657 7.514 5.449
618 HB2 GLU 87 2HB GLU 87 19.449 7.490 7.890
619 HB3 GLU 87 3HB GLU 87 20.457 8.848 7.363
620 HG2 GLU 87 2HG GLU 87 18.524 10.380 7.589
621 HG3 GLU 87 3HG GLU 87 17.504 9.029 8.109
622 H PHE 88 H PHE 88 18.302 5.782 6.318
623 HA PHE 88 HA PHE 88 15.611 6.036 5.348
624 HB2 PHE 88 2HB PHE 88 15.482 3.613 6.287
625 HB3 PHE 88 3HB PHE 88 16.430 3.991 4.847
626 HD1 PHE 88 HD1 PHE 88 16.642 3.180 8.459
627 HD2 PHE 88 HD2 PHE 88 18.821 3.804 4.804
628 HE1 PHE 88 HE1 PHE 88 18.671 2.214 9.504
629 HE2 PHE 88 HE2 PHE 88 20.847 2.833 5.845
630 HZ PHE 88 HZ PHE 88 20.776 2.036 8.198
631 HA PRO 89 HA PRO 89 13.172 6.951 8.859
632 HB2 PRO 89 2HB PRO 89 11.492 4.554 8.198
633 HB3 PRO 89 3HB PRO 89 10.997 6.263 8.428
634 HG2 PRO 89 2HG PRO 89 11.155 5.149 5.941
635 HG3 PRO 89 3HG PRO 89 11.652 6.847 6.231
636 HD2 PRO 89 2HD PRO 89 13.386 4.393 5.946
637 HD3 PRO 89 3HD PRO 89 13.642 6.053 5.324
638 H5' A 90 1H5* A 90 15.281 17.232 13.670
639 H5'' A 90 2H5* A 90 15.650 15.497 13.751
640 H4' A 90 H4* A 90 17.590 17.598 12.668
641 H3' A 90 H3* A 90 15.279 17.063 11.379
642 H2' A 90 1H2* A 90 15.204 14.752 11.393
643 HO2' A 90 2HO* A 90 15.533 15.220 9.165
644 H1' A 90 H1* A 90 18.037 14.069 11.102
645 H8 A 90 H8 A 90 15.128 12.614 11.694
646 H61 A 90 1H6 A 90 16.656 10.286 17.227
647 H62 A 90 2H6 A 90 15.521 10.198 15.897
648 H2 A 90 H2 A 90 19.599 13.469 16.206
649 HO5' A 90 H5T A 90 16.158 16.609 15.698
650 H5' A 91 1H5* A 91 14.451 20.372 10.353
651 H5'' A 91 2H5* A 91 14.300 18.632 10.679
652 H4' A 91 H4* A 91 12.341 19.296 9.454
653 H3' A 91 H3* A 91 14.099 17.282 8.541
654 H2' A 91 1H2* A 91 14.955 18.560 6.754
655 HO2' A 91 2HO* A 91 12.494 17.531 5.751
656 H1' A 91 H1* A 91 12.186 19.752 6.397
657 H8 A 91 H8 A 91 13.699 19.570 3.849
658 H61 A 91 1H6 A 91 16.839 24.904 3.609
659 H62 A 91 2H6 A 91 16.281 23.524 2.688
660 H2 A 91 H2 A 91 15.482 24.291 7.808
661 H5' C 92 1H5* C 92 10.182 15.705 6.777
662 H5'' C 92 2H5* C 92 8.958 16.157 7.983
663 H4' C 92 H4* C 92 8.274 14.106 6.848
664 H3' C 92 H3* C 92 8.448 14.429 9.639
665 H2' C 92 1H2* C 92 10.280 12.990 9.924
666 HO2' C 92 2HO* C 92 9.484 10.906 10.464
667 H1' C 92 H1* C 92 9.200 11.271 7.668
668 H41 C 92 1H4 C 92 14.837 8.418 8.491
669 H42 C 92 2H4 C 92 15.558 9.877 9.146
670 H5 C 92 H5 C 92 14.328 11.981 9.364
671 H6 C 92 H6 C 92 12.163 13.044 9.040
672 H5' A 93 1H5* A 93 4.014 12.142 7.678
673 H5'' A 93 2H5* A 93 5.386 11.360 6.863
674 H4' A 93 H4* A 93 3.714 13.245 5.234
675 H3' A 93 H3* A 93 2.269 11.508 6.793
676 H2' A 93 1H2* A 93 3.129 9.467 6.179
677 HO2' A 93 2HO* A 93 1.439 10.144 3.997
678 H1' A 93 H1* A 93 3.779 10.016 3.359
679 H8 A 93 H8 A 93 5.057 9.152 6.851
680 H61 A 93 1H6 A 93 9.024 5.430 3.849
681 H62 A 93 2H6 A 93 8.437 5.917 5.428
682 H2 A 93 H2 A 93 6.760 7.785 0.836
683 H5' A 94 1H5* A 94 -1.167 14.824 3.896
684 H5'' A 94 2H5* A 94 -0.681 13.403 2.950
685 H4' A 94 H4* A 94 -1.117 15.310 1.481
686 H3' A 94 H3* A 94 1.043 13.685 1.281
687 H2' A 94 1H2* A 94 2.692 14.908 2.365
688 HO2' A 94 2HO* A 94 3.122 15.100 0.010
689 H1' A 94 H1* A 94 1.803 17.640 1.701
690 H8 A 94 H8 A 94 4.328 16.792 3.185
691 H61 A 94 1H6 A 94 2.693 17.696 9.084
692 H62 A 94 2H6 A 94 4.034 17.429 7.987
693 H2 A 94 H2 A 94 -1.018 17.607 6.627
694 H5' A 95 1H5* A 95 -1.398 13.001 -2.473
695 H5'' A 95 2H5* A 95 -1.581 13.771 -0.889
696 H4' A 95 H4* A 95 -2.960 11.866 -0.795
697 H3' A 95 H3* A 95 -0.488 11.870 0.778
698 HO3' A 95 H3T A 95 -3.089 10.832 1.291
699 H2' A 95 1H2* A 95 -0.031 9.592 0.907
700 HO2' A 95 2HO* A 95 -2.086 9.038 1.755
701 H1' A 95 H1* A 95 -1.013 8.620 -1.433
702 H8 A 95 H8 A 95 1.797 9.793 0.202
703 H61 A 95 1H6 A 95 4.594 11.381 -5.100
704 H62 A 95 2H6 A 95 4.840 11.073 -3.393
705 H2 A 95 H2 A 95 0.273 10.814 -5.941
Start of MODEL 2
1 H VAL 6 H1 VAL 6 -3.164 8.951 -3.420
2 HA VAL 6 HA VAL 6 -4.807 9.088 -0.994
3 HB VAL 6 HB VAL 6 -4.873 6.979 -3.169
4 HG11 VAL 6 1HG1 VAL 6 -5.521 6.185 -0.934
5 HG12 VAL 6 2HG1 VAL 6 -6.647 7.558 -0.760
6 HG13 VAL 6 3HG1 VAL 6 -6.944 6.303 -1.985
7 HG21 VAL 6 1HG2 VAL 6 -5.758 9.093 -4.063
8 HG22 VAL 6 2HG2 VAL 6 -7.086 7.962 -3.741
9 HG23 VAL 6 3HG2 VAL 6 -6.771 9.296 -2.613
10 H ILE 7 H ILE 7 -2.756 6.716 -2.803
11 HA ILE 7 HA ILE 7 -2.019 5.345 -0.383
12 HB ILE 7 HB ILE 7 -0.843 5.320 -3.183
13 HG12 ILE 7 2HG1 ILE 7 -2.773 3.425 -1.759
14 HG13 ILE 7 3HG1 ILE 7 -3.230 4.613 -2.990
15 HG21 ILE 7 1HG2 ILE 7 -0.414 3.382 -0.868
16 HG22 ILE 7 2HG2 ILE 7 0.206 3.181 -2.523
17 HG23 ILE 7 3HG2 ILE 7 0.802 4.507 -1.527
18 HD11 ILE 7 1HD1 ILE 7 -1.697 3.477 -4.617
19 HD12 ILE 7 2HD1 ILE 7 -1.416 2.203 -3.403
20 HD13 ILE 7 3HD1 ILE 7 -3.042 2.462 -4.065
21 H ARG 8 H ARG 8 -0.139 5.452 0.834
22 HA ARG 8 HA ARG 8 1.222 7.992 0.902
23 HB2 ARG 8 2HB ARG 8 0.840 6.873 2.958
24 HB3 ARG 8 3HB ARG 8 1.534 5.359 2.369
25 HG2 ARG 8 2HG ARG 8 3.316 7.783 2.380
26 HG3 ARG 8 3HG ARG 8 2.913 7.054 3.940
27 HD2 ARG 8 2HD ARG 8 4.148 5.558 1.586
28 HD3 ARG 8 3HD ARG 8 5.020 6.146 2.997
29 HE ARG 8 HE ARG 8 3.391 3.762 2.825
30 HH11 ARG 8 1HH1 ARG 8 4.533 6.272 5.037
31 HH12 ARG 8 2HH1 ARG 8 4.261 5.309 6.464
32 HH21 ARG 8 1HH2 ARG 8 3.096 2.497 4.705
33 HH22 ARG 8 2HH2 ARG 8 3.491 3.154 6.275
34 H GLY 9 H GLY 9 3.099 8.624 0.014
35 HA2 GLY 9 2HA GLY 9 5.048 8.584 -1.184
36 HA3 GLY 9 3HA GLY 9 5.319 6.991 -0.463
37 HA PRO 10 HA PRO 10 4.777 6.243 -5.003
38 HB2 PRO 10 2HB PRO 10 6.950 4.600 -5.298
39 HB3 PRO 10 3HB PRO 10 7.061 6.385 -5.389
40 HG2 PRO 10 2HG PRO 10 7.707 4.571 -3.067
41 HG3 PRO 10 3HG PRO 10 8.612 6.006 -3.656
42 HD2 PRO 10 2HD PRO 10 6.870 6.063 -1.513
43 HD3 PRO 10 3HD PRO 10 7.164 7.482 -2.568
44 H ALA 11 H ALA 11 4.380 4.066 -6.029
45 HA ALA 11 HA ALA 11 2.844 2.411 -4.235
46 HB1 ALA 11 1HB ALA 11 3.654 2.001 -7.146
47 HB2 ALA 11 2HB ALA 11 2.378 1.119 -6.282
48 HB3 ALA 11 3HB ALA 11 2.203 2.863 -6.585
49 H GLY 12 H GLY 12 6.181 2.506 -4.823
50 HA2 GLY 12 2HA GLY 12 6.707 -0.350 -4.862
51 HA3 GLY 12 3HA GLY 12 7.885 0.958 -4.658
52 H ASN 13 H ASN 13 8.217 -1.306 -3.161
53 HA ASN 13 HA ASN 13 6.856 -1.136 -0.605
54 HB2 ASN 13 2HB ASN 13 9.288 -2.729 -1.508
55 HB3 ASN 13 3HB ASN 13 8.428 -2.958 0.022
56 HD21 ASN 13 1HD2 ASN 13 7.238 -5.419 -2.606
57 HD22 ASN 13 2HD2 ASN 13 8.824 -4.959 -2.021
58 H ASN 14 H ASN 14 7.746 -0.567 1.412
59 HA ASN 14 HA ASN 14 9.643 1.628 1.308
60 HB2 ASN 14 2HB ASN 14 7.600 1.424 2.820
61 HB3 ASN 14 3HB ASN 14 8.494 0.206 3.741
62 HD21 ASN 14 1HD2 ASN 14 10.037 2.655 5.719
63 HD22 ASN 14 2HD2 ASN 14 9.354 1.050 5.566
64 H ASP 15 H ASP 15 9.992 -1.750 1.394
65 HA ASP 15 HA ASP 15 12.126 -1.980 3.292
66 HB2 ASP 15 2HB ASP 15 11.147 -3.795 1.074
67 HB3 ASP 15 3HB ASP 15 12.437 -4.233 2.199
68 H CYS 16 H CYS 16 12.125 -0.576 0.217
69 HA CYS 16 HA CYS 16 15.088 -0.809 0.106
70 HB2 CYS 16 2HB CYS 16 13.153 -1.029 -2.240
71 HB3 CYS 16 3HB CYS 16 14.921 -0.914 -2.380
72 HG CYS 16 HG CYS 16 15.526 -3.031 -1.114
73 H ARG 17 H ARG 17 12.711 1.201 0.833
74 HA ARG 17 HA ARG 17 13.596 3.449 -0.872
75 HB2 ARG 17 2HB ARG 17 11.173 2.818 -0.768
76 HB3 ARG 17 3HB ARG 17 11.183 3.178 0.975
77 HG2 ARG 17 2HG ARG 17 11.611 5.487 0.587
78 HG3 ARG 17 3HG ARG 17 12.105 5.182 -1.097
79 HD2 ARG 17 2HD ARG 17 9.872 6.164 -1.090
80 HD3 ARG 17 3HD ARG 17 9.806 4.497 -1.669
81 HE ARG 17 HE ARG 17 9.017 5.362 1.087
82 HH11 ARG 17 1HH1 ARG 17 8.695 3.165 -1.680
83 HH12 ARG 17 2HH1 ARG 17 7.284 2.377 -1.032
84 HH21 ARG 17 1HH2 ARG 17 7.204 4.292 1.913
85 HH22 ARG 17 2HH2 ARG 17 6.455 2.985 1.020
86 H ILE 18 H ILE 18 14.214 5.422 0.022
87 HA ILE 18 HA ILE 18 14.880 5.407 2.923
88 HB ILE 18 HB ILE 18 17.051 6.290 2.496
89 HG12 ILE 18 2HG1 ILE 18 16.440 6.230 -0.485
90 HG13 ILE 18 3HG1 ILE 18 16.425 7.695 0.518
91 HG21 ILE 18 1HG2 ILE 18 16.713 3.806 2.294
92 HG22 ILE 18 2HG2 ILE 18 16.674 4.005 0.526
93 HG23 ILE 18 3HG2 ILE 18 18.142 4.420 1.445
94 HD11 ILE 18 1HD1 ILE 18 18.571 7.493 -0.640
95 HD12 ILE 18 2HD1 ILE 18 18.802 7.305 1.113
96 HD13 ILE 18 3HD1 ILE 18 18.832 5.878 0.047
97 H TYR 19 H TYR 19 15.815 7.785 3.363
98 HA TYR 19 HA TYR 19 13.763 9.648 2.325
99 HB2 TYR 19 2HB TYR 19 12.894 9.273 4.369
100 HB3 TYR 19 3HB TYR 19 14.445 8.915 5.112
101 HD1 TYR 19 HD1 TYR 19 16.027 10.754 5.716
102 HD2 TYR 19 HD2 TYR 19 11.977 11.509 4.478
103 HE1 TYR 19 HE1 TYR 19 16.133 13.005 6.760
104 HE2 TYR 19 HE2 TYR 19 12.070 13.751 5.561
105 HH TYR 19 HH TYR 19 13.350 15.249 6.724
106 H VAL 20 H VAL 20 14.153 11.917 2.460
107 HA VAL 20 HA VAL 20 17.034 12.611 2.406
108 HB VAL 20 HB VAL 20 15.044 13.529 0.314
109 HG11 VAL 20 1HG1 VAL 20 16.988 15.006 0.737
110 HG12 VAL 20 2HG1 VAL 20 18.085 13.634 0.449
111 HG13 VAL 20 3HG1 VAL 20 17.069 14.255 -0.873
112 HG21 VAL 20 1HG2 VAL 20 15.342 11.123 0.015
113 HG22 VAL 20 2HG2 VAL 20 16.248 11.990 -1.238
114 HG23 VAL 20 3HG2 VAL 20 17.106 11.298 0.162
115 H GLY 21 H GLY 21 17.477 14.317 3.642
116 HA2 GLY 21 2HA GLY 21 15.287 16.273 4.181
117 HA3 GLY 21 3HA GLY 21 16.283 15.613 5.482
118 H ASN 22 H ASN 22 16.142 18.294 5.196
119 HA ASN 22 HA ASN 22 17.294 20.209 4.996
120 HB2 ASN 22 2HB ASN 22 19.049 18.823 6.139
121 HB3 ASN 22 3HB ASN 22 19.762 18.502 4.547
122 HD21 ASN 22 1HD2 ASN 22 21.724 21.398 4.805
123 HD22 ASN 22 2HD2 ASN 22 21.607 19.689 4.440
124 H LEU 23 H LEU 23 16.114 18.905 2.572
125 HA LEU 23 HA LEU 23 17.782 19.629 0.341
126 HB2 LEU 23 2HB LEU 23 14.785 19.233 0.664
127 HB3 LEU 23 3HB LEU 23 15.549 19.586 -0.893
128 HG LEU 23 HG LEU 23 16.308 17.215 0.864
129 HD11 LEU 23 1HD1 LEU 23 15.026 15.863 -0.753
130 HD12 LEU 23 2HD1 LEU 23 13.971 17.041 0.059
131 HD13 LEU 23 3HD1 LEU 23 14.522 17.346 -1.604
132 HD21 LEU 23 1HD2 LEU 23 18.097 17.892 -0.656
133 HD22 LEU 23 2HD2 LEU 23 17.341 16.412 -1.280
134 HD23 LEU 23 3HD2 LEU 23 16.956 17.980 -2.021
135 HA PRO 24 HA PRO 24 17.292 24.049 0.410
136 HB2 PRO 24 2HB PRO 24 17.341 23.887 -2.570
137 HB3 PRO 24 3HB PRO 24 18.416 24.810 -1.472
138 HG2 PRO 24 2HG PRO 24 19.251 22.537 -2.754
139 HG3 PRO 24 3HG PRO 24 19.802 22.957 -1.100
140 HD2 PRO 24 2HD PRO 24 17.701 20.968 -1.940
141 HD3 PRO 24 3HD PRO 24 18.913 20.872 -0.624
142 HA PRO 25 HA PRO 25 12.995 24.706 -0.527
143 HB2 PRO 25 2HB PRO 25 12.909 27.421 -0.944
144 HB3 PRO 25 3HB PRO 25 13.151 26.684 0.669
145 HG2 PRO 25 2HG PRO 25 15.235 27.807 -1.214
146 HG3 PRO 25 3HG PRO 25 15.090 28.036 0.560
147 HD2 PRO 25 2HD PRO 25 16.791 26.197 -0.574
148 HD3 PRO 25 3HD PRO 25 15.988 25.919 1.002
149 H ASP 26 H ASP 26 15.542 25.535 -2.765
150 HA ASP 26 HA ASP 26 13.634 25.911 -4.990
151 HB2 ASP 26 2HB ASP 26 16.624 26.333 -4.763
152 HB3 ASP 26 3HB ASP 26 15.716 26.507 -6.270
153 H ILE 27 H ILE 27 14.443 23.254 -3.553
154 HA ILE 27 HA ILE 27 15.922 21.702 -5.400
155 HB ILE 27 HB ILE 27 15.525 21.091 -3.042
156 HG12 ILE 27 2HG1 ILE 27 14.984 18.701 -3.327
157 HG13 ILE 27 3HG1 ILE 27 14.346 19.013 -4.945
158 HG21 ILE 27 1HG2 ILE 27 12.668 20.489 -3.927
159 HG22 ILE 27 2HG2 ILE 27 13.355 20.212 -2.314
160 HG23 ILE 27 3HG2 ILE 27 13.152 21.870 -2.915
161 HD11 ILE 27 1HD1 ILE 27 16.669 18.120 -4.980
162 HD12 ILE 27 2HD1 ILE 27 16.576 19.739 -5.708
163 HD13 ILE 27 3HD1 ILE 27 17.223 19.537 -4.060
164 H ARG 28 H ARG 28 15.228 20.073 -6.901
165 HA ARG 28 HA ARG 28 12.423 20.173 -7.793
166 HB2 ARG 28 2HB ARG 28 13.652 21.899 -9.117
167 HB3 ARG 28 3HB ARG 28 14.816 20.667 -9.616
168 HG2 ARG 28 2HG ARG 28 13.158 21.050 -11.381
169 HG3 ARG 28 3HG ARG 28 13.013 19.403 -10.756
170 HD2 ARG 28 2HD ARG 28 10.795 20.442 -11.065
171 HD3 ARG 28 3HD ARG 28 11.090 20.094 -9.361
172 HE ARG 28 HE ARG 28 11.236 22.390 -8.888
173 HH11 ARG 28 1HH1 ARG 28 10.895 21.825 -12.367
174 HH12 ARG 28 2HH1 ARG 28 10.506 23.490 -12.721
175 HH21 ARG 28 1HH2 ARG 28 10.717 24.556 -9.378
176 HH22 ARG 28 2HH2 ARG 28 10.394 25.028 -11.032
177 H THR 29 H THR 29 11.805 18.263 -8.989
178 HA THR 29 HA THR 29 12.947 15.967 -7.892
179 HB THR 29 HB THR 29 11.328 15.766 -10.396
180 HG1 THR 29 1HG THR 29 9.510 16.307 -9.170
181 HG21 THR 29 1HG2 THR 29 11.259 14.408 -7.665
182 HG22 THR 29 2HG2 THR 29 10.212 14.007 -9.047
183 HG23 THR 29 3HG2 THR 29 11.962 13.728 -9.147
184 H LYS 30 H LYS 30 13.883 17.605 -10.842
185 HA LYS 30 HA LYS 30 15.125 15.307 -12.052
186 HB2 LYS 30 2HB LYS 30 14.422 17.217 -13.390
187 HB3 LYS 30 3HB LYS 30 15.480 18.300 -12.464
188 HG2 LYS 30 2HG LYS 30 16.519 17.742 -14.614
189 HG3 LYS 30 3HG LYS 30 17.473 17.079 -13.283
190 HD2 LYS 30 2HD LYS 30 16.261 14.860 -13.640
191 HD3 LYS 30 3HD LYS 30 15.535 15.573 -15.094
192 HE2 LYS 30 2HE LYS 30 18.509 15.279 -14.521
193 HE3 LYS 30 3HE LYS 30 17.567 14.233 -15.593
194 HZ1 LYS 30 1HZ LYS 30 18.021 17.122 -15.971
195 HZ2 LYS 30 2HZ LYS 30 18.725 15.911 -16.831
196 HZ3 LYS 30 3HZ LYS 30 17.105 16.163 -16.954
197 H ASP 31 H ASP 31 16.127 17.708 -9.640
198 HA ASP 31 HA ASP 31 18.957 17.325 -9.912
199 HB2 ASP 31 2HB ASP 31 17.707 19.208 -8.735
200 HB3 ASP 31 3HB ASP 31 17.374 18.075 -7.416
201 H ILE 32 H ILE 32 16.319 15.622 -8.253
202 HA ILE 32 HA ILE 32 18.048 13.950 -6.639
203 HB ILE 32 HB ILE 32 15.124 13.699 -7.437
204 HG12 ILE 32 2HG1 ILE 32 16.481 14.791 -4.931
205 HG13 ILE 32 3HG1 ILE 32 15.682 15.764 -6.183
206 HG21 ILE 32 1HG2 ILE 32 16.668 12.314 -5.199
207 HG22 ILE 32 2HG2 ILE 32 14.938 12.126 -5.552
208 HG23 ILE 32 3HG2 ILE 32 16.140 11.525 -6.701
209 HD11 ILE 32 1HD1 ILE 32 14.162 15.504 -4.317
210 HD12 ILE 32 2HD1 ILE 32 13.543 14.555 -5.691
211 HD13 ILE 32 3HD1 ILE 32 14.359 13.739 -4.333
212 H GLU 33 H GLU 33 16.610 13.776 -9.894
213 HA GLU 33 HA GLU 33 17.162 10.948 -10.235
214 HB2 GLU 33 2HB GLU 33 16.402 13.191 -12.133
215 HB3 GLU 33 3HB GLU 33 16.610 11.502 -12.643
216 HG2 GLU 33 2HG GLU 33 14.873 10.778 -11.057
217 HG3 GLU 33 3HG GLU 33 14.675 12.439 -10.481
218 H ASP 34 H ASP 34 19.077 13.841 -10.428
219 HA ASP 34 HA ASP 34 21.101 12.488 -12.093
220 HB2 ASP 34 2HB ASP 34 20.902 15.261 -10.914
221 HB3 ASP 34 3HB ASP 34 22.360 14.650 -11.711
222 H VAL 35 H VAL 35 20.896 13.833 -8.745
223 HA VAL 35 HA VAL 35 23.570 12.962 -8.123
224 HB VAL 35 HB VAL 35 21.247 13.829 -6.354
225 HG11 VAL 35 1HG1 VAL 35 24.215 13.523 -5.715
226 HG12 VAL 35 2HG1 VAL 35 22.992 14.241 -4.639
227 HG13 VAL 35 3HG1 VAL 35 22.895 12.523 -5.063
228 HG21 VAL 35 1HG2 VAL 35 22.470 15.976 -6.284
229 HG22 VAL 35 2HG2 VAL 35 23.689 15.325 -7.405
230 HG23 VAL 35 3HG2 VAL 35 22.014 15.568 -7.948
231 H PHE 36 H PHE 36 20.289 11.682 -7.199
232 HA PHE 36 HA PHE 36 21.491 9.536 -5.734
233 HB2 PHE 36 2HB PHE 36 18.666 9.994 -6.693
234 HB3 PHE 36 3HB PHE 36 19.164 8.558 -5.813
235 HD1 PHE 36 HD1 PHE 36 19.204 12.296 -5.538
236 HD2 PHE 36 HD2 PHE 36 19.205 8.520 -3.484
237 HE1 PHE 36 HE1 PHE 36 18.926 13.473 -3.375
238 HE2 PHE 36 HE2 PHE 36 18.939 9.699 -1.320
239 HZ PHE 36 HZ PHE 36 18.803 12.175 -1.261
240 H SER 37 H SER 37 20.515 9.864 -9.111
241 HA SER 37 HA SER 37 20.675 7.074 -9.740
242 HB2 SER 37 2HB SER 37 19.572 8.683 -11.205
243 HB3 SER 37 3HB SER 37 21.121 9.540 -11.455
244 HG SER 37 HG SER 37 20.475 6.882 -12.205
245 H LYS 38 H LYS 38 23.127 9.642 -9.372
246 HA LYS 38 HA LYS 38 25.287 8.083 -10.488
247 HB2 LYS 38 2HB LYS 38 25.383 10.525 -10.295
248 HB3 LYS 38 3HB LYS 38 25.254 10.416 -8.526
249 HG2 LYS 38 2HG LYS 38 27.388 9.212 -8.412
250 HG3 LYS 38 3HG LYS 38 27.522 9.245 -10.189
251 HD2 LYS 38 2HD LYS 38 27.562 11.715 -10.151
252 HD3 LYS 38 3HD LYS 38 27.377 11.700 -8.388
253 HE2 LYS 38 2HE LYS 38 29.727 12.041 -8.973
254 HE3 LYS 38 3HE LYS 38 29.515 10.489 -8.156
255 HZ1 LYS 38 1HZ LYS 38 29.741 10.864 -11.068
256 HZ2 LYS 38 2HZ LYS 38 30.922 10.293 -10.081
257 HZ3 LYS 38 3HZ LYS 38 29.545 9.421 -10.302
258 H TYR 39 H TYR 39 23.736 8.320 -7.296
259 HA TYR 39 HA TYR 39 25.767 6.676 -6.049
260 HB2 TYR 39 2HB TYR 39 23.216 7.915 -5.119
261 HB3 TYR 39 3HB TYR 39 23.948 6.608 -4.189
262 HD1 TYR 39 HD1 TYR 39 26.190 6.821 -3.201
263 HD2 TYR 39 HD2 TYR 39 24.224 10.124 -5.127
264 HE1 TYR 39 HE1 TYR 39 27.780 8.385 -2.125
265 HE2 TYR 39 HE2 TYR 39 25.819 11.699 -4.069
266 HH TYR 39 HH TYR 39 28.440 10.581 -1.891
267 H GLY 40 H GLY 40 22.906 5.874 -7.866
268 HA2 GLY 40 2HA GLY 40 23.481 3.145 -7.952
269 HA3 GLY 40 3HA GLY 40 22.400 3.353 -6.567
270 H ALA 41 H ALA 41 21.261 1.792 -8.209
271 HA ALA 41 HA ALA 41 19.856 3.155 -10.380
272 HB1 ALA 41 1HB ALA 41 20.648 0.843 -10.644
273 HB2 ALA 41 2HB ALA 41 19.671 0.325 -9.258
274 HB3 ALA 41 3HB ALA 41 18.872 0.907 -10.739
275 H ILE 42 H ILE 42 18.515 4.707 -9.452
276 HA ILE 42 HA ILE 42 16.584 3.982 -7.383
277 HB ILE 42 HB ILE 42 17.200 6.438 -9.031
278 HG12 ILE 42 2HG1 ILE 42 17.364 7.441 -6.751
279 HG13 ILE 42 3HG1 ILE 42 16.978 5.863 -6.043
280 HG21 ILE 42 1HG2 ILE 42 14.756 6.383 -9.011
281 HG22 ILE 42 2HG2 ILE 42 14.753 6.024 -7.261
282 HG23 ILE 42 3HG2 ILE 42 15.325 7.595 -7.854
283 HD11 ILE 42 1HD1 ILE 42 19.441 6.420 -6.104
284 HD12 ILE 42 2HD1 ILE 42 19.024 4.896 -6.910
285 HD13 ILE 42 3HD1 ILE 42 19.349 6.355 -7.879
286 H ARG 43 H ARG 43 14.352 3.794 -7.641
287 HA ARG 43 HA ARG 43 13.397 3.231 -10.416
288 HB2 ARG 43 2HB ARG 43 12.712 2.016 -7.727
289 HB3 ARG 43 3HB ARG 43 11.658 1.840 -9.143
290 HG2 ARG 43 2HG ARG 43 13.380 0.725 -10.403
291 HG3 ARG 43 3HG ARG 43 14.604 1.090 -9.166
292 HD2 ARG 43 2HD ARG 43 13.735 -1.269 -9.065
293 HD3 ARG 43 3HD ARG 43 13.529 -0.350 -7.562
294 HE ARG 43 HE ARG 43 11.357 -0.950 -9.531
295 HH11 ARG 43 1HH1 ARG 43 12.452 -0.195 -6.252
296 HH12 ARG 43 2HH1 ARG 43 10.851 -0.303 -5.559
297 HH21 ARG 43 1HH2 ARG 43 9.272 -1.121 -8.587
298 HH22 ARG 43 2HH2 ARG 43 9.065 -0.851 -6.873
299 H ASP 44 H ASP 44 12.730 4.868 -7.323
300 HA ASP 44 HA ASP 44 10.674 6.470 -8.665
301 HB2 ASP 44 2HB ASP 44 10.100 4.602 -6.371
302 HB3 ASP 44 3HB ASP 44 9.160 6.082 -6.609
303 H ILE 45 H ILE 45 9.984 8.349 -7.596
304 HA ILE 45 HA ILE 45 11.626 9.228 -5.281
305 HB ILE 45 HB ILE 45 11.207 10.765 -7.882
306 HG12 ILE 45 2HG1 ILE 45 13.860 10.911 -7.355
307 HG13 ILE 45 3HG1 ILE 45 13.528 9.330 -6.628
308 HG21 ILE 45 1HG2 ILE 45 10.942 12.292 -6.005
309 HG22 ILE 45 2HG2 ILE 45 12.401 11.637 -5.219
310 HG23 ILE 45 3HG2 ILE 45 12.532 12.551 -6.740
311 HD11 ILE 45 1HD1 ILE 45 12.539 8.572 -8.783
312 HD12 ILE 45 2HD1 ILE 45 12.812 10.186 -9.479
313 HD13 ILE 45 3HD1 ILE 45 14.197 9.170 -9.032
314 H ASP 46 H ASP 46 10.552 10.797 -3.956
315 HA ASP 46 HA ASP 46 7.761 11.430 -4.717
316 HB2 ASP 46 2HB ASP 46 7.673 9.380 -3.381
317 HB3 ASP 46 3HB ASP 46 8.591 10.160 -2.087
318 H LEU 47 H LEU 47 9.828 13.231 -4.944
319 HA LEU 47 HA LEU 47 10.125 14.900 -2.640
320 HB2 LEU 47 2HB LEU 47 11.604 15.147 -4.540
321 HB3 LEU 47 3HB LEU 47 10.242 15.440 -5.635
322 HG LEU 47 HG LEU 47 9.721 17.553 -4.401
323 HD11 LEU 47 1HD1 LEU 47 10.733 16.982 -2.216
324 HD12 LEU 47 2HD1 LEU 47 12.346 16.937 -2.965
325 HD13 LEU 47 3HD1 LEU 47 11.452 18.468 -2.877
326 HD21 LEU 47 1HD2 LEU 47 11.108 17.561 -6.434
327 HD22 LEU 47 2HD2 LEU 47 11.638 18.813 -5.293
328 HD23 LEU 47 3HD2 LEU 47 12.568 17.303 -5.450
329 H LYS 48 H LYS 48 8.680 16.105 -1.601
330 HA LYS 48 HA LYS 48 6.543 17.461 -3.082
331 HB2 LYS 48 2HB LYS 48 4.743 16.563 -1.646
332 HB3 LYS 48 3HB LYS 48 5.509 15.295 -2.614
333 HG2 LYS 48 2HG LYS 48 6.919 14.665 -0.648
334 HG3 LYS 48 3HG LYS 48 6.082 15.891 0.324
335 HD2 LYS 48 2HD LYS 48 3.925 14.758 -0.059
336 HD3 LYS 48 3HD LYS 48 4.723 13.562 -1.101
337 HE2 LYS 48 2HE LYS 48 5.320 14.026 1.849
338 HE3 LYS 48 3HE LYS 48 4.347 12.699 1.200
339 HZ1 LYS 48 1HZ LYS 48 7.184 13.180 0.560
340 HZ2 LYS 48 2HZ LYS 48 6.623 12.044 1.610
341 HZ3 LYS 48 3HZ LYS 48 6.266 11.929 0.012
342 H ASN 49 H ASN 49 5.331 18.995 -1.685
343 HA ASN 49 HA ASN 49 7.226 20.496 -0.142
344 HB2 ASN 49 2HB ASN 49 5.356 22.066 0.174
345 HB3 ASN 49 3HB ASN 49 5.508 21.562 -1.511
346 HD21 ASN 49 1HD2 ASN 49 2.238 20.326 -1.730
347 HD22 ASN 49 2HD2 ASN 49 3.703 20.860 -2.532
348 H ARG 50 H ARG 50 6.969 21.229 2.060
349 HA ARG 50 HA ARG 50 6.024 19.071 3.857
350 HB2 ARG 50 2HB ARG 50 8.344 19.854 4.040
351 HB3 ARG 50 3HB ARG 50 7.772 21.516 4.302
352 HG2 ARG 50 2HG ARG 50 6.571 20.667 6.384
353 HG3 ARG 50 3HG ARG 50 7.403 19.116 6.137
354 HD2 ARG 50 2HD ARG 50 8.710 21.844 6.486
355 HD3 ARG 50 3HD ARG 50 8.646 20.565 7.706
356 HE ARG 50 HE ARG 50 10.172 20.450 5.131
357 HH11 ARG 50 1HH1 ARG 50 9.598 19.341 8.432
358 HH12 ARG 50 2HH1 ARG 50 11.019 18.323 8.471
359 HH21 ARG 50 1HH2 ARG 50 12.024 19.093 5.199
360 HH22 ARG 50 2HH2 ARG 50 12.363 18.165 6.646
361 H ARG 51 H ARG 51 3.741 19.644 3.441
362 HA ARG 51 HA ARG 51 1.784 20.758 3.806
363 HB2 ARG 51 2HB ARG 51 3.107 22.054 6.204
364 HB3 ARG 51 3HB ARG 51 1.396 21.652 5.978
365 HG2 ARG 51 2HG ARG 51 3.702 19.713 6.406
366 HG3 ARG 51 3HG ARG 51 2.385 20.085 7.526
367 HD2 ARG 51 2HD ARG 51 0.777 19.233 5.731
368 HD3 ARG 51 3HD ARG 51 2.194 18.599 4.875
369 HE ARG 51 HE ARG 51 0.889 17.434 7.141
370 HH11 ARG 51 1HH1 ARG 51 4.135 17.931 5.807
371 HH12 ARG 51 2HH1 ARG 51 4.825 16.589 6.686
372 HH21 ARG 51 1HH2 ARG 51 1.817 15.678 8.260
373 HH22 ARG 51 2HH2 ARG 51 3.508 15.310 8.052
374 H GLY 52 H GLY 52 3.916 22.024 2.162
375 HA2 GLY 52 2HA GLY 52 3.667 23.974 0.817
376 HA3 GLY 52 3HA GLY 52 2.871 24.799 2.168
377 H GLY 53 H GLY 53 5.285 23.376 3.774
378 HA2 GLY 53 2HA GLY 53 7.077 25.698 3.645
379 HA3 GLY 53 3HA GLY 53 7.133 24.345 4.788
380 HA PRO 54 HA PRO 54 10.699 24.106 1.784
381 HB2 PRO 54 2HB PRO 54 11.859 22.924 4.295
382 HB3 PRO 54 3HB PRO 54 12.616 24.029 3.102
383 HG2 PRO 54 2HG PRO 54 11.696 24.944 5.497
384 HG3 PRO 54 3HG PRO 54 11.484 25.910 3.993
385 HD2 PRO 54 2HD PRO 54 9.464 24.221 5.452
386 HD3 PRO 54 3HD PRO 54 9.248 25.785 4.610
387 HA PRO 55 HA PRO 55 9.066 20.063 0.905
388 HB2 PRO 55 2HB PRO 55 11.337 19.959 -1.051
389 HB3 PRO 55 3HB PRO 55 9.592 19.666 -1.332
390 HG2 PRO 55 2HG PRO 55 10.770 22.001 -2.104
391 HG3 PRO 55 3HG PRO 55 9.117 21.977 -1.409
392 HD2 PRO 55 2HD PRO 55 11.722 22.716 -0.074
393 HD3 PRO 55 3HD PRO 55 10.100 23.456 0.085
394 H PHE 56 H PHE 56 9.665 17.802 0.821
395 HA PHE 56 HA PHE 56 12.371 17.008 1.696
396 HB2 PHE 56 2HB PHE 56 11.665 15.907 3.632
397 HB3 PHE 56 3HB PHE 56 10.773 17.421 3.733
398 HD1 PHE 56 HD1 PHE 56 10.560 13.916 3.998
399 HD2 PHE 56 HD2 PHE 56 8.317 17.310 2.602
400 HE1 PHE 56 HE1 PHE 56 8.456 12.663 4.336
401 HE2 PHE 56 HE2 PHE 56 6.213 16.024 2.872
402 HZ PHE 56 HZ PHE 56 6.282 13.695 3.749
403 H ALA 57 H ALA 57 12.431 14.485 1.408
404 HA ALA 57 HA ALA 57 10.420 13.592 -0.559
405 HB1 ALA 57 1HB ALA 57 13.366 13.902 -1.260
406 HB2 ALA 57 2HB ALA 57 12.083 13.280 -2.322
407 HB3 ALA 57 3HB ALA 57 12.079 14.987 -1.815
408 H PHE 58 H PHE 58 10.685 11.421 -1.265
409 HA PHE 58 HA PHE 58 12.580 9.758 0.324
410 HB2 PHE 58 2HB PHE 58 9.811 9.006 -0.684
411 HB3 PHE 58 3HB PHE 58 10.949 7.908 0.095
412 HD1 PHE 58 HD1 PHE 58 11.707 8.455 2.496
413 HD2 PHE 58 HD2 PHE 58 8.276 10.224 0.612
414 HE1 PHE 58 HE1 PHE 58 10.813 9.083 4.722
415 HE2 PHE 58 HE2 PHE 58 7.423 10.931 2.838
416 HZ PHE 58 HZ PHE 58 8.681 10.350 4.891
417 H VAL 59 H VAL 59 13.460 7.923 -0.822
418 HA VAL 59 HA VAL 59 13.209 8.022 -3.784
419 HB VAL 59 HB VAL 59 15.779 8.204 -2.169
420 HG11 VAL 59 1HG1 VAL 59 15.343 7.792 -5.154
421 HG12 VAL 59 2HG1 VAL 59 16.911 8.131 -4.386
422 HG13 VAL 59 3HG1 VAL 59 16.053 6.621 -4.013
423 HG21 VAL 59 1HG2 VAL 59 14.667 10.383 -2.538
424 HG22 VAL 59 2HG2 VAL 59 16.144 10.263 -3.515
425 HG23 VAL 59 3HG2 VAL 59 14.553 10.036 -4.281
426 H GLU 60 H GLU 60 13.191 5.994 -4.653
427 HA GLU 60 HA GLU 60 13.701 3.772 -2.729
428 HB2 GLU 60 2HB GLU 60 11.328 4.067 -3.104
429 HB3 GLU 60 3HB GLU 60 11.557 4.022 -4.864
430 HG2 GLU 60 2HG GLU 60 12.286 1.720 -4.787
431 HG3 GLU 60 3HG GLU 60 12.371 1.744 -3.016
432 H PHE 61 H PHE 61 14.946 2.162 -3.283
433 HA PHE 61 HA PHE 61 16.342 2.389 -5.875
434 HB2 PHE 61 2HB PHE 61 17.116 1.195 -3.222
435 HB3 PHE 61 3HB PHE 61 18.023 0.881 -4.701
436 HD1 PHE 61 HD1 PHE 61 19.735 2.324 -5.359
437 HD2 PHE 61 HD2 PHE 61 16.709 3.726 -2.640
438 HE1 PHE 61 HE1 PHE 61 20.980 4.451 -5.059
439 HE2 PHE 61 HE2 PHE 61 17.951 5.847 -2.351
440 HZ PHE 61 HZ PHE 61 20.090 6.209 -3.564
441 H GLU 62 H GLU 62 17.088 0.533 -7.048
442 HA GLU 62 HA GLU 62 15.117 -1.628 -7.200
443 HB2 GLU 62 2HB GLU 62 16.105 -0.643 -9.221
444 HB3 GLU 62 3HB GLU 62 17.730 -1.073 -8.670
445 HG2 GLU 62 2HG GLU 62 17.210 -3.451 -8.820
446 HG3 GLU 62 3HG GLU 62 15.513 -3.100 -9.182
447 H ASP 63 H ASP 63 18.040 -0.970 -5.488
448 HA ASP 63 HA ASP 63 18.073 -3.691 -4.391
449 HB2 ASP 63 2HB ASP 63 19.484 -3.902 -6.385
450 HB3 ASP 63 3HB ASP 63 20.416 -2.481 -5.907
451 HA PRO 64 HA PRO 64 18.655 -0.810 -1.062
452 HB2 PRO 64 2HB PRO 64 18.903 -2.626 1.010
453 HB3 PRO 64 3HB PRO 64 17.344 -2.167 0.250
454 HG2 PRO 64 2HG PRO 64 19.062 -4.595 -0.304
455 HG3 PRO 64 3HG PRO 64 17.284 -4.507 -0.110
456 HD2 PRO 64 2HD PRO 64 18.475 -4.589 -2.560
457 HD3 PRO 64 3HD PRO 64 16.996 -3.620 -2.274
458 H ARG 65 H ARG 65 20.974 -3.194 -2.108
459 HA ARG 65 HA ARG 65 23.051 -2.491 -0.232
460 HB2 ARG 65 2HB ARG 65 23.166 -3.737 -3.008
461 HB3 ARG 65 3HB ARG 65 24.530 -3.654 -1.863
462 HG2 ARG 65 2HG ARG 65 23.264 -4.970 -0.217
463 HG3 ARG 65 3HG ARG 65 21.869 -5.047 -1.311
464 HD2 ARG 65 2HD ARG 65 24.644 -6.175 -1.877
465 HD3 ARG 65 3HD ARG 65 23.208 -7.119 -1.429
466 HE ARG 65 HE ARG 65 22.481 -5.625 -3.679
467 HH11 ARG 65 1HH1 ARG 65 24.837 -8.128 -2.865
468 HH12 ARG 65 2HH1 ARG 65 24.911 -8.757 -4.494
469 HH21 ARG 65 1HH2 ARG 65 22.620 -6.421 -5.791
470 HH22 ARG 65 2HH2 ARG 65 23.622 -7.810 -6.156
471 H ASP 66 H ASP 66 21.795 -1.061 -3.190
472 HA ASP 66 HA ASP 66 24.116 0.735 -3.466
473 HB2 ASP 66 2HB ASP 66 21.468 0.582 -4.947
474 HB3 ASP 66 3HB ASP 66 22.787 1.697 -5.324
475 H ALA 67 H ALA 67 20.902 0.680 -2.028
476 HA ALA 67 HA ALA 67 20.607 3.521 -1.716
477 HB1 ALA 67 1HB ALA 67 18.872 2.893 -0.100
478 HB2 ALA 67 2HB ALA 67 18.749 1.855 -1.542
479 HB3 ALA 67 3HB ALA 67 19.484 1.222 -0.053
480 H GLU 68 H GLU 68 22.440 1.033 -0.030
481 HA GLU 68 HA GLU 68 22.832 2.487 2.418
482 HB2 GLU 68 2HB GLU 68 23.123 0.065 2.258
483 HB3 GLU 68 3HB GLU 68 24.425 0.272 1.065
484 HG2 GLU 68 2HG GLU 68 25.818 1.418 2.722
485 HG3 GLU 68 3HG GLU 68 24.501 1.356 3.906
486 H ASP 69 H ASP 69 24.421 2.508 -0.772
487 HA ASP 69 HA ASP 69 26.703 4.021 0.179
488 HB2 ASP 69 2HB ASP 69 25.643 3.340 -2.577
489 HB3 ASP 69 3HB ASP 69 27.089 4.323 -2.309
490 H ALA 70 H ALA 70 23.572 4.817 -1.306
491 HA ALA 70 HA ALA 70 24.146 7.586 -1.770
492 HB1 ALA 70 1HB ALA 70 22.292 6.311 -2.836
493 HB2 ALA 70 2HB ALA 70 21.508 6.151 -1.252
494 HB3 ALA 70 3HB ALA 70 21.690 7.760 -1.990
495 H VAL 71 H VAL 71 23.201 5.693 1.055
496 HA VAL 71 HA VAL 71 22.489 8.090 2.604
497 HB VAL 71 HB VAL 71 22.608 5.102 3.169
498 HG11 VAL 71 1HG1 VAL 71 23.321 6.206 5.235
499 HG12 VAL 71 2HG1 VAL 71 21.984 7.370 5.109
500 HG13 VAL 71 3HG1 VAL 71 21.645 5.650 5.412
501 HG21 VAL 71 1HG2 VAL 71 20.686 5.953 1.873
502 HG22 VAL 71 2HG2 VAL 71 20.174 5.432 3.498
503 HG23 VAL 71 3HG2 VAL 71 20.365 7.162 3.138
504 H SER 72 H SER 72 25.108 5.606 2.437
505 HA SER 72 HA SER 72 26.508 6.572 4.722
506 HB2 SER 72 2HB SER 72 26.810 4.315 3.809
507 HB3 SER 72 3HB SER 72 27.453 4.994 2.298
508 HG SER 72 HG SER 72 28.586 5.214 4.889
509 H GLY 73 H GLY 73 26.295 7.765 1.437
510 HA2 GLY 73 2HA GLY 73 28.856 9.210 1.617
511 HA3 GLY 73 3HA GLY 73 27.740 9.163 0.242
512 H ARG 74 H ARG 74 25.563 9.837 2.541
513 HA ARG 74 HA ARG 74 26.117 12.733 2.655
514 HB2 ARG 74 2HB ARG 74 23.877 11.492 1.029
515 HB3 ARG 74 3HB ARG 74 23.892 13.196 1.524
516 HG2 ARG 74 2HG ARG 74 26.040 13.545 0.368
517 HG3 ARG 74 3HG ARG 74 26.055 11.851 -0.152
518 HD2 ARG 74 2HD ARG 74 23.849 13.832 -0.824
519 HD3 ARG 74 3HD ARG 74 25.215 13.449 -1.895
520 HE ARG 74 HE ARG 74 24.341 11.002 -1.609
521 HH11 ARG 74 1HH1 ARG 74 22.334 13.911 -1.850
522 HH12 ARG 74 2HH1 ARG 74 20.985 13.046 -2.552
523 HH21 ARG 74 1HH2 ARG 74 22.566 9.920 -2.519
524 HH22 ARG 74 2HH2 ARG 74 21.106 10.800 -2.915
525 H ASP 75 H ASP 75 25.481 10.354 4.558
526 HA ASP 75 HA ASP 75 22.967 11.076 5.743
527 HB2 ASP 75 2HB ASP 75 23.798 9.665 7.671
528 HB3 ASP 75 3HB ASP 75 23.670 8.863 6.108
529 H GLY 76 H GLY 76 25.717 12.901 5.610
530 HA2 GLY 76 2HA GLY 76 24.864 14.830 7.426
531 HA3 GLY 76 3HA GLY 76 25.994 13.786 8.315
532 H TYR 77 H TYR 77 25.609 16.051 5.630
533 HA TYR 77 HA TYR 77 28.550 16.381 5.612
534 HB2 TYR 77 2HB TYR 77 28.064 15.418 3.546
535 HB3 TYR 77 3HB TYR 77 26.627 16.410 3.309
536 HD1 TYR 77 HD1 TYR 77 26.725 18.500 2.209
537 HD2 TYR 77 HD2 TYR 77 30.355 16.579 3.486
538 HE1 TYR 77 HE1 TYR 77 28.053 20.181 0.951
539 HE2 TYR 77 HE2 TYR 77 31.688 18.264 2.242
540 HH TYR 77 HH TYR 77 30.148 20.921 0.398
541 H ASP 78 H ASP 78 29.445 18.340 5.729
542 HA ASP 78 HA ASP 78 27.884 20.351 7.039
543 HB2 ASP 78 2HB ASP 78 30.178 19.980 7.650
544 HB3 ASP 78 3HB ASP 78 30.730 20.266 5.995
545 H TYR 79 H TYR 79 26.232 21.094 5.712
546 HA TYR 79 HA TYR 79 26.819 22.251 3.081
547 HB2 TYR 79 2HB TYR 79 24.715 20.978 3.800
548 HB3 TYR 79 3HB TYR 79 24.307 22.376 4.805
549 HD1 TYR 79 HD1 TYR 79 25.196 21.449 1.290
550 HD2 TYR 79 HD2 TYR 79 23.007 24.076 3.877
551 HE1 TYR 79 HE1 TYR 79 24.132 22.499 -0.699
552 HE2 TYR 79 HE2 TYR 79 21.918 25.133 1.899
553 HH TYR 79 HH TYR 79 22.670 24.105 -1.447
554 H ASP 80 H ASP 80 25.476 24.533 2.928
555 HA ASP 80 HA ASP 80 27.049 26.432 4.341
556 HB2 ASP 80 2HB ASP 80 24.597 26.668 2.568
557 HB3 ASP 80 3HB ASP 80 25.484 28.053 3.216
558 H GLY 81 H GLY 81 26.673 25.922 6.593
559 HA2 GLY 81 2HA GLY 81 25.818 26.762 8.578
560 HA3 GLY 81 3HA GLY 81 24.473 27.508 7.692
561 H TYR 82 H TYR 82 24.703 24.326 6.660
562 HA TYR 82 HA TYR 82 22.989 23.255 8.821
563 HB2 TYR 82 2HB TYR 82 22.242 23.432 5.897
564 HB3 TYR 82 3HB TYR 82 21.446 22.351 7.040
565 HD1 TYR 82 HD1 TYR 82 19.876 23.165 8.683
566 HD2 TYR 82 HD2 TYR 82 22.053 25.878 6.160
567 HE1 TYR 82 HE1 TYR 82 18.381 25.014 9.394
568 HE2 TYR 82 HE2 TYR 82 20.547 27.739 6.849
569 HH TYR 82 HH TYR 82 18.759 28.357 8.155
570 H ARG 83 H ARG 83 22.284 20.835 7.935
571 HA ARG 83 HA ARG 83 24.718 19.523 6.881
572 HB2 ARG 83 2HB ARG 83 24.980 19.472 9.304
573 HB3 ARG 83 3HB ARG 83 23.335 18.829 9.497
574 HG2 ARG 83 2HG ARG 83 23.957 16.772 8.307
575 HG3 ARG 83 3HG ARG 83 25.575 17.433 7.978
576 HD2 ARG 83 2HD ARG 83 25.666 15.895 9.877
577 HD3 ARG 83 3HD ARG 83 26.024 17.546 10.403
578 HE ARG 83 HE ARG 83 24.059 17.587 11.657
579 HH11 ARG 83 1HH1 ARG 83 24.078 14.741 9.558
580 HH12 ARG 83 2HH1 ARG 83 22.720 13.993 10.365
581 HH21 ARG 83 1HH2 ARG 83 22.282 16.592 12.684
582 HH22 ARG 83 2HH2 ARG 83 21.701 15.044 12.118
583 H LEU 84 H LEU 84 24.269 17.852 5.526
584 HA LEU 84 HA LEU 84 21.595 17.491 4.561
585 HB2 LEU 84 2HB LEU 84 24.253 16.109 4.134
586 HB3 LEU 84 3HB LEU 84 22.775 15.389 3.495
587 HG LEU 84 HG LEU 84 23.958 16.776 1.823
588 HD11 LEU 84 1HD1 LEU 84 22.008 17.993 1.020
589 HD12 LEU 84 2HD1 LEU 84 21.503 16.433 1.704
590 HD13 LEU 84 3HD1 LEU 84 21.257 17.941 2.623
591 HD21 LEU 84 1HD2 LEU 84 24.839 18.495 3.408
592 HD22 LEU 84 2HD2 LEU 84 24.010 19.197 1.999
593 HD23 LEU 84 3HD2 LEU 84 23.188 19.148 3.569
594 H ARG 85 H ARG 85 20.214 15.662 4.676
595 HA ARG 85 HA ARG 85 20.826 13.708 6.824
596 HB2 ARG 85 2HB ARG 85 18.262 15.325 6.575
597 HB3 ARG 85 3HB ARG 85 18.465 13.903 7.621
598 HG2 ARG 85 2HG ARG 85 20.384 15.050 8.745
599 HG3 ARG 85 3HG ARG 85 20.044 16.507 7.784
600 HD2 ARG 85 2HD ARG 85 18.094 15.147 9.684
601 HD3 ARG 85 3HD ARG 85 19.040 16.591 10.064
602 HE ARG 85 HE ARG 85 17.842 17.718 8.160
603 HH11 ARG 85 1HH1 ARG 85 16.375 14.955 9.812
604 HH12 ARG 85 2HH1 ARG 85 14.741 15.444 9.428
605 HH21 ARG 85 1HH2 ARG 85 15.697 18.335 7.680
606 HH22 ARG 85 2HH2 ARG 85 14.369 17.305 8.164
607 H VAL 86 H VAL 86 21.353 12.968 4.367
608 HA VAL 86 HA VAL 86 19.030 11.625 3.192
609 HB VAL 86 HB VAL 86 21.976 11.271 2.526
610 HG11 VAL 86 1HG1 VAL 86 19.407 10.747 0.977
611 HG12 VAL 86 2HG1 VAL 86 21.060 10.528 0.355
612 HG13 VAL 86 3HG1 VAL 86 20.467 9.509 1.684
613 HG21 VAL 86 1HG2 VAL 86 21.395 13.639 2.301
614 HG22 VAL 86 2HG2 VAL 86 21.533 12.889 0.698
615 HG23 VAL 86 3HG2 VAL 86 19.924 13.212 1.394
616 H GLU 87 H GLU 87 18.214 10.196 4.707
617 HA GLU 87 HA GLU 87 19.818 7.772 5.132
618 HB2 GLU 87 2HB GLU 87 19.526 7.790 7.565
619 HB3 GLU 87 3HB GLU 87 20.442 9.221 7.051
620 HG2 GLU 87 2HG GLU 87 18.339 10.566 7.127
621 HG3 GLU 87 3HG GLU 87 17.466 9.135 7.708
622 H PHE 88 H PHE 88 18.488 5.993 6.052
623 HA PHE 88 HA PHE 88 15.850 6.090 4.898
624 HB2 PHE 88 2HB PHE 88 15.794 3.683 5.889
625 HB3 PHE 88 3HB PHE 88 16.795 4.084 4.489
626 HD1 PHE 88 HD1 PHE 88 16.926 3.618 8.198
627 HD2 PHE 88 HD2 PHE 88 19.119 3.766 4.505
628 HE1 PHE 88 HE1 PHE 88 18.958 2.796 9.370
629 HE2 PHE 88 HE2 PHE 88 21.147 2.938 5.679
630 HZ PHE 88 HZ PHE 88 21.064 2.452 8.104
631 HA PRO 89 HA PRO 89 13.129 6.920 8.221
632 HB2 PRO 89 2HB PRO 89 11.700 4.382 7.501
633 HB3 PRO 89 3HB PRO 89 11.040 6.040 7.688
634 HG2 PRO 89 2HG PRO 89 11.440 4.937 5.226
635 HG3 PRO 89 3HG PRO 89 11.785 6.673 5.536
636 HD2 PRO 89 2HD PRO 89 13.715 4.363 5.353
637 HD3 PRO 89 3HD PRO 89 13.883 6.048 4.762
638 H5' A 90 1H5* A 90 7.166 11.519 13.255
639 H5'' A 90 2H5* A 90 8.042 10.151 12.538
640 H4' A 90 H4* A 90 8.307 11.056 15.453
641 H3' A 90 H3* A 90 9.570 12.041 12.986
642 H2' A 90 1H2* A 90 11.770 11.320 13.311
643 HO2' A 90 2HO* A 90 11.872 12.132 15.502
644 H1' A 90 H1* A 90 11.397 8.905 14.408
645 H8 A 90 H8 A 90 11.632 10.653 11.460
646 H61 A 90 1H6 A 90 8.313 6.567 8.215
647 H62 A 90 2H6 A 90 9.397 7.944 8.125
648 H2 A 90 H2 A 90 7.703 5.709 12.545
649 HO5' A 90 H5T A 90 7.059 8.818 14.114
650 H5' A 91 1H5* A 91 10.892 15.011 13.148
651 H5'' A 91 2H5* A 91 9.878 16.382 13.647
652 H4' A 91 H4* A 91 9.996 15.165 10.836
653 H3' A 91 H3* A 91 11.901 16.781 11.836
654 H2' A 91 1H2* A 91 10.618 18.397 12.926
655 HO2' A 91 2HO* A 91 11.685 19.569 11.256
656 H1' A 91 H1* A 91 8.424 18.729 11.002
657 H8 A 91 H8 A 91 9.326 19.781 13.997
658 H61 A 91 1H6 A 91 4.400 17.532 17.005
659 H62 A 91 2H6 A 91 5.757 18.635 17.096
660 H2 A 91 H2 A 91 4.638 15.513 13.044
661 H5' C 92 1H5* C 92 10.855 15.609 6.540
662 H5'' C 92 2H5* C 92 9.620 16.332 7.587
663 H4' C 92 H4* C 92 8.541 14.618 6.286
664 H3' C 92 H3* C 92 8.424 14.685 9.039
665 H2' C 92 1H2* C 92 10.108 13.049 9.405
666 HO2' C 92 2HO* C 92 7.650 11.645 9.095
667 H1' C 92 H1* C 92 8.979 11.424 7.108
668 H41 C 92 1H4 C 92 14.442 8.247 7.918
669 H42 C 92 2H4 C 92 15.256 9.670 8.539
670 H5 C 92 H5 C 92 14.125 11.820 8.836
671 H6 C 92 H6 C 92 12.021 12.994 8.555
672 H5' A 93 1H5* A 93 3.844 12.777 7.007
673 H5'' A 93 2H5* A 93 5.281 11.815 6.593
674 H4' A 93 H4* A 93 3.555 13.200 4.498
675 H3' A 93 H3* A 93 3.165 10.635 5.998
676 H2' A 93 1H2* A 93 2.761 9.366 4.061
677 HO2' A 93 2HO* A 93 1.343 10.963 3.093
678 H1' A 93 H1* A 93 4.632 10.475 2.430
679 H8 A 93 H8 A 93 4.943 9.633 6.186
680 H61 A 93 1H6 A 93 8.657 5.070 4.141
681 H62 A 93 2H6 A 93 7.979 5.822 5.571
682 H2 A 93 H2 A 93 7.096 7.340 0.635
683 H5' A 94 1H5* A 94 -0.698 10.582 8.680
684 H5'' A 94 2H5* A 94 -0.475 12.300 8.276
685 H4' A 94 H4* A 94 0.110 11.900 10.626
686 H3' A 94 H3* A 94 1.814 13.149 8.684
687 H2' A 94 1H2* A 94 3.501 11.538 8.819
688 HO2' A 94 2HO* A 94 4.451 13.370 9.816
689 H1' A 94 H1* A 94 2.747 11.035 11.708
690 H8 A 94 H8 A 94 5.334 10.136 11.805
691 H61 A 94 1H6 A 94 5.764 4.832 8.622
692 H62 A 94 2H6 A 94 6.552 5.877 9.783
693 H2 A 94 H2 A 94 1.928 6.813 7.511
694 H5' A 95 1H5* A 95 -0.726 14.651 13.126
695 H5'' A 95 2H5* A 95 -0.058 13.020 12.870
696 H4' A 95 H4* A 95 -2.951 13.718 12.239
697 H3' A 95 H3* A 95 -1.684 13.539 14.855
698 HO3' A 95 H3T A 95 -3.840 14.020 15.477
699 H2' A 95 1H2* A 95 -2.448 11.485 15.633
700 HO2' A 95 2HO* A 95 -4.615 11.827 13.811
701 H1' A 95 H1* A 95 -2.768 10.033 13.369
702 H8 A 95 H8 A 95 -0.270 12.002 15.453
703 H61 A 95 1H6 A 95 3.962 7.890 13.573
704 H62 A 95 2H6 A 95 3.641 9.219 14.668
705 H2 A 95 H2 A 95 0.256 7.235 11.193
Start of MODEL 3
1 H VAL 6 H1 VAL 6 -1.012 0.756 -6.727
2 HA VAL 6 HA VAL 6 -2.859 2.831 -5.803
3 HB VAL 6 HB VAL 6 -0.971 1.167 -4.115
4 HG11 VAL 6 1HG1 VAL 6 -2.363 2.085 -2.269
5 HG12 VAL 6 2HG1 VAL 6 -1.539 3.370 -3.167
6 HG13 VAL 6 3HG1 VAL 6 -3.271 3.056 -3.447
7 HG21 VAL 6 1HG2 VAL 6 -2.691 -0.327 -5.005
8 HG22 VAL 6 2HG2 VAL 6 -3.034 0.027 -3.305
9 HG23 VAL 6 3HG2 VAL 6 -3.963 0.845 -4.581
10 H ILE 7 H ILE 7 -1.973 4.780 -5.103
11 HA ILE 7 HA ILE 7 0.443 5.583 -6.434
12 HB ILE 7 HB ILE 7 -1.452 6.891 -4.461
13 HG12 ILE 7 2HG1 ILE 7 -1.781 8.447 -6.400
14 HG13 ILE 7 3HG1 ILE 7 -0.686 7.446 -7.367
15 HG21 ILE 7 1HG2 ILE 7 0.744 7.806 -3.915
16 HG22 ILE 7 2HG2 ILE 7 1.097 8.066 -5.647
17 HG23 ILE 7 3HG2 ILE 7 -0.178 9.003 -4.839
18 HD11 ILE 7 1HD1 ILE 7 -3.143 7.009 -7.752
19 HD12 ILE 7 2HD1 ILE 7 -2.226 5.570 -7.282
20 HD13 ILE 7 3HD1 ILE 7 -3.251 6.408 -6.084
21 H ARG 8 H ARG 8 2.419 6.356 -5.448
22 HA ARG 8 HA ARG 8 3.473 4.463 -3.596
23 HB2 ARG 8 2HB ARG 8 5.498 5.914 -3.646
24 HB3 ARG 8 3HB ARG 8 4.902 5.425 -5.231
25 HG2 ARG 8 2HG ARG 8 5.633 7.768 -5.202
26 HG3 ARG 8 3HG ARG 8 3.908 7.643 -5.587
27 HD2 ARG 8 2HD ARG 8 3.269 8.444 -3.434
28 HD3 ARG 8 3HD ARG 8 4.895 8.180 -2.770
29 HE ARG 8 HE ARG 8 5.668 10.127 -3.834
30 HH11 ARG 8 1HH1 ARG 8 2.232 9.571 -4.441
31 HH12 ARG 8 2HH1 ARG 8 1.968 11.176 -5.081
32 HH21 ARG 8 1HH2 ARG 8 5.314 12.178 -4.709
33 HH22 ARG 8 2HH2 ARG 8 3.714 12.670 -5.210
34 H GLY 9 H GLY 9 4.799 5.174 -1.640
35 HA2 GLY 9 2HA GLY 9 5.013 6.163 0.405
36 HA3 GLY 9 3HA GLY 9 4.011 7.493 -0.171
37 HA PRO 10 HA PRO 10 0.494 4.961 1.542
38 HB2 PRO 10 2HB PRO 10 0.437 2.221 1.525
39 HB3 PRO 10 3HB PRO 10 -0.002 3.205 0.087
40 HG2 PRO 10 2HG PRO 10 2.636 1.846 0.696
41 HG3 PRO 10 3HG PRO 10 1.712 1.869 -0.845
42 HD2 PRO 10 2HD PRO 10 3.817 3.552 -0.357
43 HD3 PRO 10 3HD PRO 10 2.402 4.041 -1.344
44 H ALA 11 H ALA 11 3.697 3.606 2.159
45 HA ALA 11 HA ALA 11 3.410 3.997 5.020
46 HB1 ALA 11 1HB ALA 11 3.758 1.193 3.886
47 HB2 ALA 11 2HB ALA 11 3.935 1.640 5.600
48 HB3 ALA 11 3HB ALA 11 2.353 1.790 4.803
49 H GLY 12 H GLY 12 5.491 3.704 6.125
50 HA2 GLY 12 2HA GLY 12 7.698 4.491 4.390
51 HA3 GLY 12 3HA GLY 12 7.701 4.386 6.165
52 H ASN 13 H ASN 13 6.444 1.485 5.295
53 HA ASN 13 HA ASN 13 9.034 0.166 5.688
54 HB2 ASN 13 2HB ASN 13 7.632 -1.872 5.985
55 HB3 ASN 13 3HB ASN 13 7.187 -0.549 7.069
56 HD21 ASN 13 1HD2 ASN 13 3.864 -1.366 6.146
57 HD22 ASN 13 2HD2 ASN 13 5.104 -1.517 7.373
58 H ASN 14 H ASN 14 7.803 1.398 2.983
59 HA ASN 14 HA ASN 14 7.567 -0.816 1.201
60 HB2 ASN 14 2HB ASN 14 6.852 1.667 0.951
61 HB3 ASN 14 3HB ASN 14 8.520 1.952 0.426
62 HD21 ASN 14 1HD2 ASN 14 6.504 1.350 -2.636
63 HD22 ASN 14 2HD2 ASN 14 6.602 2.563 -1.374
64 H ASP 15 H ASP 15 9.081 -1.621 -0.360
65 HA ASP 15 HA ASP 15 11.712 -1.910 0.819
66 HB2 ASP 15 2HB ASP 15 10.399 -3.134 -1.617
67 HB3 ASP 15 3HB ASP 15 12.057 -3.490 -1.109
68 H CYS 16 H CYS 16 13.708 -1.518 -0.039
69 HA CYS 16 HA CYS 16 15.345 -0.441 -1.128
70 HB2 CYS 16 2HB CYS 16 13.434 -0.804 -3.456
71 HB3 CYS 16 3HB CYS 16 15.124 -0.271 -3.606
72 HG CYS 16 HG CYS 16 13.894 -3.042 -2.311
73 H ARG 17 H ARG 17 12.585 1.226 -0.425
74 HA ARG 17 HA ARG 17 13.343 3.689 -1.805
75 HB2 ARG 17 2HB ARG 17 11.138 2.943 0.120
76 HB3 ARG 17 3HB ARG 17 11.527 4.647 -0.206
77 HG2 ARG 17 2HG ARG 17 11.363 4.184 -2.658
78 HG3 ARG 17 3HG ARG 17 10.770 2.552 -2.273
79 HD2 ARG 17 2HD ARG 17 8.871 3.595 -1.020
80 HD3 ARG 17 3HD ARG 17 9.456 5.199 -1.477
81 HE ARG 17 HE ARG 17 8.134 3.224 -3.215
82 HH11 ARG 17 1HH1 ARG 17 9.922 6.271 -2.993
83 HH12 ARG 17 2HH1 ARG 17 9.425 6.811 -4.583
84 HH21 ARG 17 1HH2 ARG 17 7.525 3.953 -5.292
85 HH22 ARG 17 2HH2 ARG 17 8.069 5.507 -5.871
86 H ILE 18 H ILE 18 14.187 5.526 -0.942
87 HA ILE 18 HA ILE 18 15.077 5.453 1.895
88 HB ILE 18 HB ILE 18 17.159 6.507 1.303
89 HG12 ILE 18 2HG1 ILE 18 16.487 6.169 -1.637
90 HG13 ILE 18 3HG1 ILE 18 16.218 7.687 -0.762
91 HG21 ILE 18 1HG2 ILE 18 18.282 4.644 0.220
92 HG22 ILE 18 2HG2 ILE 18 17.025 4.043 1.314
93 HG23 ILE 18 3HG2 ILE 18 16.736 4.052 -0.444
94 HD11 ILE 18 1HD1 ILE 18 18.899 6.269 -1.015
95 HD12 ILE 18 2HD1 ILE 18 18.393 7.720 -1.902
96 HD13 ILE 18 3HD1 ILE 18 18.597 7.791 -0.135
97 H TYR 19 H TYR 19 15.763 7.771 2.513
98 HA TYR 19 HA TYR 19 13.802 9.681 1.393
99 HB2 TYR 19 2HB TYR 19 12.715 9.286 3.315
100 HB3 TYR 19 3HB TYR 19 14.156 8.768 4.175
101 HD1 TYR 19 HD1 TYR 19 11.970 11.613 3.435
102 HD2 TYR 19 HD2 TYR 19 15.721 10.392 5.141
103 HE1 TYR 19 HE1 TYR 19 12.116 13.776 4.668
104 HE2 TYR 19 HE2 TYR 19 15.869 12.540 6.372
105 HH TYR 19 HH TYR 19 13.409 15.105 6.039
106 H VAL 20 H VAL 20 14.188 11.869 1.434
107 HA VAL 20 HA VAL 20 16.965 12.702 2.009
108 HB VAL 20 HB VAL 20 15.512 13.390 -0.566
109 HG11 VAL 20 1HG1 VAL 20 18.377 13.826 0.377
110 HG12 VAL 20 2HG1 VAL 20 17.748 14.216 -1.238
111 HG13 VAL 20 3HG1 VAL 20 17.124 15.080 0.187
112 HG21 VAL 20 1HG2 VAL 20 16.089 11.003 -0.610
113 HG22 VAL 20 2HG2 VAL 20 17.160 11.914 -1.686
114 HG23 VAL 20 3HG2 VAL 20 17.752 11.383 -0.094
115 H GLY 21 H GLY 21 17.145 14.868 2.708
116 HA2 GLY 21 2HA GLY 21 14.684 16.499 2.748
117 HA3 GLY 21 3HA GLY 21 15.299 15.945 4.311
118 H ASN 22 H ASN 22 15.117 18.558 4.046
119 HA ASN 22 HA ASN 22 16.137 20.557 4.053
120 HB2 ASN 22 2HB ASN 22 17.663 19.248 5.616
121 HB3 ASN 22 3HB ASN 22 18.767 19.063 4.251
122 HD21 ASN 22 1HD2 ASN 22 20.307 22.068 5.298
123 HD22 ASN 22 2HD2 ASN 22 20.454 20.338 5.069
124 H LEU 23 H LEU 23 15.670 19.200 1.448
125 HA LEU 23 HA LEU 23 17.791 19.882 -0.349
126 HB2 LEU 23 2HB LEU 23 14.780 19.671 -0.737
127 HB3 LEU 23 3HB LEU 23 15.941 19.845 -2.060
128 HG LEU 23 HG LEU 23 15.986 17.572 -0.022
129 HD11 LEU 23 1HD1 LEU 23 14.948 17.631 -2.888
130 HD12 LEU 23 2HD1 LEU 23 15.062 16.195 -1.850
131 HD13 LEU 23 3HD1 LEU 23 13.946 17.513 -1.421
132 HD21 LEU 23 1HD2 LEU 23 17.426 18.023 -2.678
133 HD22 LEU 23 2HD2 LEU 23 18.182 17.995 -1.064
134 HD23 LEU 23 3HD2 LEU 23 17.476 16.516 -1.747
135 HA PRO 24 HA PRO 24 17.638 24.223 -0.335
136 HB2 PRO 24 2HB PRO 24 18.287 24.864 -2.961
137 HB3 PRO 24 3HB PRO 24 19.456 24.295 -1.728
138 HG2 PRO 24 2HG PRO 24 18.063 22.700 -3.891
139 HG3 PRO 24 3HG PRO 24 19.772 22.611 -3.360
140 HD2 PRO 24 2HD PRO 24 17.882 20.820 -2.522
141 HD3 PRO 24 3HD PRO 24 19.229 21.347 -1.459
142 HA PRO 25 HA PRO 25 13.642 25.583 -1.562
143 HB2 PRO 25 2HB PRO 25 14.776 28.260 -2.191
144 HB3 PRO 25 3HB PRO 25 13.518 27.820 -0.997
145 HG2 PRO 25 2HG PRO 25 16.065 28.499 -0.240
146 HG3 PRO 25 3HG PRO 25 15.127 27.231 0.623
147 HD2 PRO 25 2HD PRO 25 17.296 26.894 -1.451
148 HD3 PRO 25 3HD PRO 25 16.999 25.967 0.053
149 H ASP 26 H ASP 26 16.142 25.365 -3.815
150 HA ASP 26 HA ASP 26 14.289 25.967 -6.056
151 HB2 ASP 26 2HB ASP 26 15.863 27.899 -5.607
152 HB3 ASP 26 3HB ASP 26 17.217 26.810 -5.941
153 H ILE 27 H ILE 27 15.134 23.473 -4.683
154 HA ILE 27 HA ILE 27 17.087 22.095 -6.216
155 HB ILE 27 HB ILE 27 16.320 21.290 -4.049
156 HG12 ILE 27 2HG1 ILE 27 15.808 18.915 -4.605
157 HG13 ILE 27 3HG1 ILE 27 15.537 19.372 -6.294
158 HG21 ILE 27 1HG2 ILE 27 13.629 20.755 -5.387
159 HG22 ILE 27 2HG2 ILE 27 14.088 20.336 -3.722
160 HG23 ILE 27 3HG2 ILE 27 13.953 22.040 -4.204
161 HD11 ILE 27 1HD1 ILE 27 17.826 18.461 -5.894
162 HD12 ILE 27 2HD1 ILE 27 17.865 20.129 -6.493
163 HD13 ILE 27 3HD1 ILE 27 18.147 19.791 -4.764
164 H ARG 28 H ARG 28 16.999 20.965 -8.145
165 HA ARG 28 HA ARG 28 14.538 21.380 -9.756
166 HB2 ARG 28 2HB ARG 28 17.303 20.440 -10.602
167 HB3 ARG 28 3HB ARG 28 15.963 20.888 -11.672
168 HG2 ARG 28 2HG ARG 28 16.011 23.200 -10.761
169 HG3 ARG 28 3HG ARG 28 17.394 22.758 -9.732
170 HD2 ARG 28 2HD ARG 28 17.327 22.639 -12.775
171 HD3 ARG 28 3HD ARG 28 18.133 23.881 -11.797
172 HE ARG 28 HE ARG 28 18.966 21.109 -11.257
173 HH11 ARG 28 1HH1 ARG 28 19.615 24.073 -13.067
174 HH12 ARG 28 2HH1 ARG 28 21.287 23.651 -13.371
175 HH21 ARG 28 1HH2 ARG 28 21.100 20.591 -11.651
176 HH22 ARG 28 2HH2 ARG 28 22.137 21.668 -12.565
177 H THR 29 H THR 29 13.602 19.628 -10.957
178 HA THR 29 HA THR 29 13.545 17.168 -9.508
179 HB THR 29 HB THR 29 11.865 16.489 -10.929
180 HG1 THR 29 1HG THR 29 11.690 17.244 -13.053
181 HG21 THR 29 1HG2 THR 29 11.795 19.514 -11.314
182 HG22 THR 29 2HG2 THR 29 10.409 18.399 -11.296
183 HG23 THR 29 3HG2 THR 29 11.331 18.693 -9.804
184 H LYS 30 H LYS 30 15.599 18.304 -12.054
185 HA LYS 30 HA LYS 30 16.315 15.644 -13.002
186 HB2 LYS 30 2HB LYS 30 16.303 17.615 -14.503
187 HB3 LYS 30 3HB LYS 30 17.524 18.399 -13.486
188 HG2 LYS 30 2HG LYS 30 18.586 17.424 -15.463
189 HG3 LYS 30 3HG LYS 30 19.133 16.582 -14.005
190 HD2 LYS 30 2HD LYS 30 17.412 14.793 -14.449
191 HD3 LYS 30 3HD LYS 30 17.002 15.627 -15.972
192 HE2 LYS 30 2HE LYS 30 19.385 15.370 -16.690
193 HE3 LYS 30 3HE LYS 30 19.718 14.499 -15.182
194 HZ1 LYS 30 1HZ LYS 30 17.861 13.666 -17.306
195 HZ2 LYS 30 2HZ LYS 30 19.293 12.947 -16.913
196 HZ3 LYS 30 3HZ LYS 30 18.018 12.896 -15.868
197 H ASP 31 H ASP 31 17.425 17.876 -10.518
198 HA ASP 31 HA ASP 31 20.125 16.974 -10.362
199 HB2 ASP 31 2HB ASP 31 18.303 18.223 -8.286
200 HB3 ASP 31 3HB ASP 31 20.039 17.954 -8.062
201 H ILE 32 H ILE 32 17.117 15.651 -9.082
202 HA ILE 32 HA ILE 32 18.403 13.922 -7.154
203 HB ILE 32 HB ILE 32 15.645 13.609 -8.376
204 HG12 ILE 32 2HG1 ILE 32 15.842 15.942 -7.670
205 HG13 ILE 32 3HG1 ILE 32 14.777 15.045 -6.580
206 HG21 ILE 32 1HG2 ILE 32 15.127 12.667 -6.121
207 HG22 ILE 32 2HG2 ILE 32 16.378 11.751 -6.983
208 HG23 ILE 32 3HG2 ILE 32 16.840 12.859 -5.677
209 HD11 ILE 32 1HD1 ILE 32 16.605 14.844 -4.922
210 HD12 ILE 32 2HD1 ILE 32 17.707 15.693 -6.028
211 HD13 ILE 32 3HD1 ILE 32 16.312 16.545 -5.334
212 H GLU 33 H GLU 33 17.845 13.798 -10.610
213 HA GLU 33 HA GLU 33 17.961 10.891 -10.785
214 HB2 GLU 33 2HB GLU 33 18.304 13.048 -12.914
215 HB3 GLU 33 3HB GLU 33 18.125 11.302 -13.201
216 HG2 GLU 33 2HG GLU 33 15.911 11.401 -12.019
217 HG3 GLU 33 3HG GLU 33 16.077 13.170 -11.950
218 H ASP 34 H ASP 34 20.224 13.643 -11.413
219 HA ASP 34 HA ASP 34 22.290 11.941 -12.398
220 HB2 ASP 34 2HB ASP 34 22.312 14.776 -11.336
221 HB3 ASP 34 3HB ASP 34 23.733 13.971 -12.013
222 H VAL 35 H VAL 35 21.730 13.307 -9.126
223 HA VAL 35 HA VAL 35 24.260 12.359 -8.119
224 HB VAL 35 HB VAL 35 21.693 13.188 -6.704
225 HG11 VAL 35 1HG1 VAL 35 24.514 12.754 -5.635
226 HG12 VAL 35 2HG1 VAL 35 23.177 13.485 -4.721
227 HG13 VAL 35 3HG1 VAL 35 23.081 11.785 -5.229
228 HG21 VAL 35 1HG2 VAL 35 22.730 14.979 -8.061
229 HG22 VAL 35 2HG2 VAL 35 22.932 15.306 -6.326
230 HG23 VAL 35 3HG2 VAL 35 24.297 14.672 -7.277
231 H PHE 36 H PHE 36 20.862 11.152 -7.765
232 HA PHE 36 HA PHE 36 21.847 8.894 -6.255
233 HB2 PHE 36 2HB PHE 36 19.102 9.646 -7.227
234 HB3 PHE 36 3HB PHE 36 19.451 8.138 -6.364
235 HD1 PHE 36 HD1 PHE 36 20.329 8.173 -4.028
236 HD2 PHE 36 HD2 PHE 36 19.034 11.750 -6.040
237 HE1 PHE 36 HE1 PHE 36 20.236 9.367 -1.857
238 HE2 PHE 36 HE2 PHE 36 18.955 12.941 -3.873
239 HZ PHE 36 HZ PHE 36 19.557 11.750 -1.780
240 H SER 37 H SER 37 21.218 9.399 -9.689
241 HA SER 37 HA SER 37 21.193 6.596 -10.353
242 HB2 SER 37 2HB SER 37 20.411 8.281 -11.938
243 HB3 SER 37 3HB SER 37 22.029 9.025 -11.979
244 HG SER 37 HG SER 37 21.324 6.408 -12.813
245 H LYS 38 H LYS 38 23.774 9.002 -9.729
246 HA LYS 38 HA LYS 38 25.919 7.289 -10.573
247 HB2 LYS 38 2HB LYS 38 26.186 9.710 -10.323
248 HB3 LYS 38 3HB LYS 38 25.820 9.602 -8.592
249 HG2 LYS 38 2HG LYS 38 28.237 9.799 -8.951
250 HG3 LYS 38 3HG LYS 38 27.846 8.234 -8.227
251 HD2 LYS 38 2HD LYS 38 28.017 7.148 -10.448
252 HD3 LYS 38 3HD LYS 38 28.329 8.727 -11.204
253 HE2 LYS 38 2HE LYS 38 30.370 8.988 -9.813
254 HE3 LYS 38 3HE LYS 38 30.058 7.410 -9.068
255 HZ1 LYS 38 1HZ LYS 38 30.276 6.418 -11.247
256 HZ2 LYS 38 2HZ LYS 38 30.565 7.887 -11.929
257 HZ3 LYS 38 3HZ LYS 38 31.641 7.257 -10.862
258 H TYR 39 H TYR 39 24.015 7.616 -7.585
259 HA TYR 39 HA TYR 39 25.712 5.796 -6.134
260 HB2 TYR 39 2HB TYR 39 23.069 7.078 -5.567
261 HB3 TYR 39 3HB TYR 39 23.653 5.735 -4.572
262 HD1 TYR 39 HD1 TYR 39 23.886 9.277 -5.156
263 HD2 TYR 39 HD2 TYR 39 25.939 5.887 -3.493
264 HE1 TYR 39 HE1 TYR 39 25.381 10.808 -3.899
265 HE2 TYR 39 HE2 TYR 39 27.455 7.407 -2.245
266 HH TYR 39 HH TYR 39 28.053 9.588 -1.839
267 H GLY 40 H GLY 40 23.165 5.223 -8.429
268 HA2 GLY 40 2HA GLY 40 23.729 2.586 -8.845
269 HA3 GLY 40 3HA GLY 40 22.632 2.516 -7.460
270 H ALA 41 H ALA 41 21.563 1.214 -9.377
271 HA ALA 41 HA ALA 41 20.244 2.777 -11.418
272 HB1 ALA 41 1HB ALA 41 20.843 0.423 -11.762
273 HB2 ALA 41 2HB ALA 41 19.785 -0.062 -10.420
274 HB3 ALA 41 3HB ALA 41 19.088 0.638 -11.905
275 H ILE 42 H ILE 42 18.470 3.984 -11.198
276 HA ILE 42 HA ILE 42 16.884 3.797 -8.717
277 HB ILE 42 HB ILE 42 17.016 5.807 -10.993
278 HG12 ILE 42 2HG1 ILE 42 17.838 5.963 -8.057
279 HG13 ILE 42 3HG1 ILE 42 18.949 5.770 -9.428
280 HG21 ILE 42 1HG2 ILE 42 14.718 5.702 -10.118
281 HG22 ILE 42 2HG2 ILE 42 15.339 5.878 -8.450
282 HG23 ILE 42 3HG2 ILE 42 15.497 7.204 -9.626
283 HD11 ILE 42 1HD1 ILE 42 18.069 7.938 -10.367
284 HD12 ILE 42 2HD1 ILE 42 17.148 8.157 -8.857
285 HD13 ILE 42 3HD1 ILE 42 18.921 8.110 -8.820
286 H ARG 43 H ARG 43 14.785 3.160 -8.597
287 HA ARG 43 HA ARG 43 13.411 2.242 -11.060
288 HB2 ARG 43 2HB ARG 43 12.751 2.068 -8.089
289 HB3 ARG 43 3HB ARG 43 11.663 1.524 -9.379
290 HG2 ARG 43 2HG ARG 43 13.399 -0.081 -10.147
291 HG3 ARG 43 3HG ARG 43 14.432 0.417 -8.776
292 HD2 ARG 43 2HD ARG 43 12.626 -0.187 -7.204
293 HD3 ARG 43 3HD ARG 43 11.575 -0.649 -8.558
294 HE ARG 43 HE ARG 43 13.737 -2.257 -8.938
295 HH11 ARG 43 1HH1 ARG 43 11.725 -1.544 -6.118
296 HH12 ARG 43 2HH1 ARG 43 11.971 -3.116 -5.395
297 HH21 ARG 43 1HH2 ARG 43 14.043 -4.303 -7.973
298 HH22 ARG 43 2HH2 ARG 43 13.274 -4.688 -6.448
299 H ASP 44 H ASP 44 13.223 4.712 -8.473
300 HA ASP 44 HA ASP 44 11.270 6.236 -10.060
301 HB2 ASP 44 2HB ASP 44 9.953 4.505 -8.775
302 HB3 ASP 44 3HB ASP 44 10.591 5.191 -7.281
303 H ILE 45 H ILE 45 10.911 8.350 -9.246
304 HA ILE 45 HA ILE 45 12.586 9.250 -6.967
305 HB ILE 45 HB ILE 45 12.714 10.104 -9.813
306 HG12 ILE 45 2HG1 ILE 45 14.672 10.533 -7.536
307 HG13 ILE 45 3HG1 ILE 45 14.495 8.956 -8.329
308 HG21 ILE 45 1HG2 ILE 45 13.355 12.425 -9.235
309 HG22 ILE 45 2HG2 ILE 45 11.662 12.110 -8.835
310 HG23 ILE 45 3HG2 ILE 45 12.887 12.137 -7.543
311 HD11 ILE 45 1HD1 ILE 45 15.228 11.558 -9.736
312 HD12 ILE 45 2HD1 ILE 45 16.325 10.211 -9.365
313 HD13 ILE 45 3HD1 ILE 45 14.996 9.979 -10.526
314 H ASP 46 H ASP 46 11.666 10.898 -5.732
315 HA ASP 46 HA ASP 46 8.975 11.805 -6.521
316 HB2 ASP 46 2HB ASP 46 8.651 9.653 -5.404
317 HB3 ASP 46 3HB ASP 46 9.599 10.213 -4.018
318 H LEU 47 H LEU 47 10.787 13.651 -6.637
319 HA LEU 47 HA LEU 47 11.360 15.061 -4.236
320 HB2 LEU 47 2HB LEU 47 12.329 15.710 -6.377
321 HB3 LEU 47 3HB LEU 47 10.722 16.028 -7.051
322 HG LEU 47 HG LEU 47 10.392 17.850 -5.375
323 HD11 LEU 47 1HD1 LEU 47 13.308 17.266 -4.699
324 HD12 LEU 47 2HD1 LEU 47 12.378 18.669 -4.129
325 HD13 LEU 47 3HD1 LEU 47 11.922 17.034 -3.606
326 HD21 LEU 47 1HD2 LEU 47 11.268 18.336 -7.626
327 HD22 LEU 47 2HD2 LEU 47 11.983 19.428 -6.416
328 HD23 LEU 47 3HD2 LEU 47 12.931 18.065 -7.046
329 H LYS 48 H LYS 48 10.104 16.411 -2.909
330 HA LYS 48 HA LYS 48 7.219 16.574 -3.554
331 HB2 LYS 48 2HB LYS 48 7.761 14.370 -2.476
332 HB3 LYS 48 3HB LYS 48 8.311 15.247 -1.041
333 HG2 LYS 48 2HG LYS 48 6.096 16.084 -0.613
334 HG3 LYS 48 3HG LYS 48 5.529 15.575 -2.229
335 HD2 LYS 48 2HD LYS 48 5.879 13.213 -1.628
336 HD3 LYS 48 3HD LYS 48 6.516 13.688 -0.045
337 HE2 LYS 48 2HE LYS 48 4.182 12.994 0.161
338 HE3 LYS 48 3HE LYS 48 4.337 14.724 0.519
339 HZ1 LYS 48 1HZ LYS 48 3.607 15.181 -1.722
340 HZ2 LYS 48 2HZ LYS 48 3.420 13.571 -2.027
341 HZ3 LYS 48 3HZ LYS 48 2.483 14.315 -0.894
342 H ASN 49 H ASN 49 6.009 17.801 -1.833
343 HA ASN 49 HA ASN 49 7.653 19.882 -0.532
344 HB2 ASN 49 2HB ASN 49 6.358 21.655 -1.683
345 HB3 ASN 49 3HB ASN 49 7.308 20.688 -2.805
346 HD21 ASN 49 1HD2 ASN 49 4.084 21.067 -4.494
347 HD22 ASN 49 2HD2 ASN 49 5.500 22.014 -4.089
348 H ARG 50 H ARG 50 5.294 21.593 -0.232
349 HA ARG 50 HA ARG 50 3.777 22.052 1.363
350 HB2 ARG 50 2HB ARG 50 3.017 19.115 1.201
351 HB3 ARG 50 3HB ARG 50 2.067 20.421 1.933
352 HG2 ARG 50 2HG ARG 50 2.169 21.594 -0.348
353 HG3 ARG 50 3HG ARG 50 2.783 20.061 -1.001
354 HD2 ARG 50 2HD ARG 50 0.149 20.456 0.488
355 HD3 ARG 50 3HD ARG 50 0.333 20.261 -1.268
356 HE ARG 50 HE ARG 50 1.529 18.055 0.158
357 HH11 ARG 50 1HH1 ARG 50 -1.560 19.398 -0.919
358 HH12 ARG 50 2HH1 ARG 50 -2.350 17.833 -0.957
359 HH21 ARG 50 1HH2 ARG 50 0.433 16.016 0.101
360 HH22 ARG 50 2HH2 ARG 50 -1.246 15.968 -0.388
361 H ARG 51 H ARG 51 2.931 21.239 3.643
362 HA ARG 51 HA ARG 51 3.505 21.292 5.832
363 HB2 ARG 51 2HB ARG 51 4.031 18.906 5.396
364 HB3 ARG 51 3HB ARG 51 5.722 19.352 5.079
365 HG2 ARG 51 2HG ARG 51 5.966 20.200 7.363
366 HG3 ARG 51 3HG ARG 51 4.236 19.918 7.679
367 HD2 ARG 51 2HD ARG 51 4.598 17.491 7.276
368 HD3 ARG 51 3HD ARG 51 6.330 17.804 7.042
369 HE ARG 51 HE ARG 51 6.060 18.869 9.453
370 HH11 ARG 51 1HH1 ARG 51 4.719 15.831 8.218
371 HH12 ARG 51 2HH1 ARG 51 4.609 15.106 9.802
372 HH21 ARG 51 1HH2 ARG 51 5.886 17.897 11.505
373 HH22 ARG 51 2HH2 ARG 51 5.310 16.251 11.647
374 H GLY 52 H GLY 52 5.080 22.128 7.420
375 HA2 GLY 52 2HA GLY 52 6.430 24.427 6.377
376 HA3 GLY 52 3HA GLY 52 6.493 23.838 8.044
377 H GLY 53 H GLY 53 8.760 24.920 7.064
378 HA2 GLY 53 2HA GLY 53 11.021 24.428 7.058
379 HA3 GLY 53 3HA GLY 53 10.636 22.701 7.148
380 HA PRO 54 HA PRO 54 12.252 23.819 2.889
381 HB2 PRO 54 2HB PRO 54 14.354 22.029 2.881
382 HB3 PRO 54 3HB PRO 54 14.475 23.701 3.516
383 HG2 PRO 54 2HG PRO 54 14.039 21.127 5.042
384 HG3 PRO 54 3HG PRO 54 15.130 22.496 5.448
385 HD2 PRO 54 2HD PRO 54 12.665 22.183 6.595
386 HD3 PRO 54 3HD PRO 54 13.350 23.802 6.249
387 HA PRO 55 HA PRO 55 10.266 20.363 0.973
388 HB2 PRO 55 2HB PRO 55 11.728 20.054 -1.361
389 HB3 PRO 55 3HB PRO 55 10.516 21.345 -1.084
390 HG2 PRO 55 2HG PRO 55 13.528 21.506 -0.849
391 HG3 PRO 55 3HG PRO 55 12.391 22.703 -1.549
392 HD2 PRO 55 2HD PRO 55 13.419 22.933 0.980
393 HD3 PRO 55 3HD PRO 55 11.771 23.497 0.564
394 H PHE 56 H PHE 56 10.703 18.111 0.068
395 HA PHE 56 HA PHE 56 13.224 16.858 0.956
396 HB2 PHE 56 2HB PHE 56 12.262 15.562 2.657
397 HB3 PHE 56 3HB PHE 56 11.574 17.148 2.951
398 HD1 PHE 56 HD1 PHE 56 10.876 13.742 2.772
399 HD2 PHE 56 HD2 PHE 56 9.199 17.532 1.612
400 HE1 PHE 56 HE1 PHE 56 8.611 12.762 2.844
401 HE2 PHE 56 HE2 PHE 56 6.934 16.520 1.603
402 HZ PHE 56 HZ PHE 56 6.641 14.129 2.228
403 H ALA 57 H ALA 57 12.831 14.319 0.512
404 HA ALA 57 HA ALA 57 10.959 13.850 -1.691
405 HB1 ALA 57 1HB ALA 57 12.716 13.443 -3.361
406 HB2 ALA 57 2HB ALA 57 12.834 15.113 -2.754
407 HB3 ALA 57 3HB ALA 57 13.967 13.880 -2.176
408 H PHE 58 H PHE 58 11.208 11.661 -2.619
409 HA PHE 58 HA PHE 58 12.705 9.758 -0.889
410 HB2 PHE 58 2HB PHE 58 9.960 9.345 -2.117
411 HB3 PHE 58 3HB PHE 58 10.911 8.105 -1.304
412 HD1 PHE 58 HD1 PHE 58 11.621 8.609 1.172
413 HD2 PHE 58 HD2 PHE 58 8.414 10.582 -0.897
414 HE1 PHE 58 HE1 PHE 58 10.628 9.277 3.343
415 HE2 PHE 58 HE2 PHE 58 7.465 11.319 1.271
416 HZ PHE 58 HZ PHE 58 8.563 10.646 3.396
417 H VAL 59 H VAL 59 13.406 7.813 -1.992
418 HA VAL 59 HA VAL 59 13.444 7.928 -4.957
419 HB VAL 59 HB VAL 59 15.853 7.911 -3.094
420 HG11 VAL 59 1HG1 VAL 59 16.200 6.188 -4.799
421 HG12 VAL 59 2HG1 VAL 59 15.722 7.327 -6.083
422 HG13 VAL 59 3HG1 VAL 59 17.217 7.598 -5.160
423 HG21 VAL 59 1HG2 VAL 59 15.046 10.158 -3.696
424 HG22 VAL 59 2HG2 VAL 59 16.578 9.821 -4.520
425 HG23 VAL 59 3HG2 VAL 59 15.043 9.716 -5.417
426 H GLU 60 H GLU 60 13.491 5.827 -5.843
427 HA GLU 60 HA GLU 60 13.743 3.611 -3.853
428 HB2 GLU 60 2HB GLU 60 11.423 3.889 -4.711
429 HB3 GLU 60 3HB GLU 60 12.035 3.692 -6.367
430 HG2 GLU 60 2HG GLU 60 12.923 1.451 -5.766
431 HG3 GLU 60 3HG GLU 60 12.301 1.649 -4.119
432 H PHE 61 H PHE 61 15.442 2.323 -4.172
433 HA PHE 61 HA PHE 61 16.781 2.354 -6.777
434 HB2 PHE 61 2HB PHE 61 17.547 1.316 -4.069
435 HB3 PHE 61 3HB PHE 61 18.436 0.856 -5.522
436 HD1 PHE 61 HD1 PHE 61 17.761 3.534 -3.154
437 HD2 PHE 61 HD2 PHE 61 19.572 2.556 -6.927
438 HE1 PHE 61 HE1 PHE 61 19.016 5.659 -3.097
439 HE2 PHE 61 HE2 PHE 61 20.801 4.704 -6.902
440 HZ PHE 61 HZ PHE 61 20.548 6.253 -4.979
441 H GLU 62 H GLU 62 17.611 0.416 -7.815
442 HA GLU 62 HA GLU 62 15.524 -1.535 -8.218
443 HB2 GLU 62 2HB GLU 62 16.949 -0.869 -10.059
444 HB3 GLU 62 3HB GLU 62 18.407 -1.281 -9.143
445 HG2 GLU 62 2HG GLU 62 17.968 -2.990 -10.810
446 HG3 GLU 62 3HG GLU 62 17.780 -3.674 -9.192
447 H ASP 63 H ASP 63 18.279 -1.256 -6.097
448 HA ASP 63 HA ASP 63 17.640 -3.853 -4.891
449 HB2 ASP 63 2HB ASP 63 20.326 -3.115 -6.062
450 HB3 ASP 63 3HB ASP 63 20.184 -4.274 -4.736
451 HA PRO 64 HA PRO 64 18.267 -1.648 -1.167
452 HB2 PRO 64 2HB PRO 64 19.058 -3.654 0.557
453 HB3 PRO 64 3HB PRO 64 17.375 -3.461 -0.039
454 HG2 PRO 64 2HG PRO 64 19.528 -5.332 -1.048
455 HG3 PRO 64 3HG PRO 64 17.787 -5.667 -0.762
456 HD2 PRO 64 2HD PRO 64 18.807 -5.117 -3.243
457 HD3 PRO 64 3HD PRO 64 17.158 -4.617 -2.758
458 H ARG 65 H ARG 65 20.828 -3.473 -2.686
459 HA ARG 65 HA ARG 65 23.000 -2.665 -0.980
460 HB2 ARG 65 2HB ARG 65 23.188 -4.571 -2.503
461 HB3 ARG 65 3HB ARG 65 22.862 -3.531 -3.899
462 HG2 ARG 65 2HG ARG 65 24.946 -2.245 -3.418
463 HG3 ARG 65 3HG ARG 65 25.278 -3.337 -2.052
464 HD2 ARG 65 2HD ARG 65 25.354 -5.254 -3.591
465 HD3 ARG 65 3HD ARG 65 24.951 -4.197 -4.957
466 HE ARG 65 HE ARG 65 27.551 -4.511 -3.679
467 HH11 ARG 65 1HH1 ARG 65 25.501 -2.334 -5.573
468 HH12 ARG 65 2HH1 ARG 65 26.855 -1.466 -6.253
469 HH21 ARG 65 1HH2 ARG 65 29.297 -3.364 -4.586
470 HH22 ARG 65 2HH2 ARG 65 29.000 -2.036 -5.685
471 H ASP 66 H ASP 66 21.460 -1.275 -3.904
472 HA ASP 66 HA ASP 66 23.398 0.876 -4.079
473 HB2 ASP 66 2HB ASP 66 20.699 0.430 -5.395
474 HB3 ASP 66 3HB ASP 66 21.777 1.785 -5.750
475 H ALA 67 H ALA 67 20.350 0.360 -2.404
476 HA ALA 67 HA ALA 67 19.840 3.146 -1.842
477 HB1 ALA 67 1HB ALA 67 18.086 1.395 -1.751
478 HB2 ALA 67 2HB ALA 67 18.956 0.592 -0.426
479 HB3 ALA 67 3HB ALA 67 18.260 2.209 -0.180
480 H GLU 68 H GLU 68 21.677 0.518 -0.264
481 HA GLU 68 HA GLU 68 22.201 1.982 2.152
482 HB2 GLU 68 2HB GLU 68 22.358 -0.452 2.088
483 HB3 GLU 68 3HB GLU 68 23.558 -0.374 0.788
484 HG2 GLU 68 2HG GLU 68 24.698 -0.851 2.860
485 HG3 GLU 68 3HG GLU 68 25.151 0.764 2.320
486 H ASP 69 H ASP 69 23.735 1.822 -1.048
487 HA ASP 69 HA ASP 69 26.174 3.101 -0.225
488 HB2 ASP 69 2HB ASP 69 24.880 2.606 -2.916
489 HB3 ASP 69 3HB ASP 69 26.412 3.472 -2.735
490 H ALA 70 H ALA 70 23.072 4.352 -1.467
491 HA ALA 70 HA ALA 70 24.044 7.045 -1.831
492 HB1 ALA 70 1HB ALA 70 21.236 5.965 -1.375
493 HB2 ALA 70 2HB ALA 70 21.652 7.580 -2.002
494 HB3 ALA 70 3HB ALA 70 22.030 6.128 -2.958
495 H VAL 71 H VAL 71 22.688 5.187 0.886
496 HA VAL 71 HA VAL 71 22.384 7.553 2.555
497 HB VAL 71 HB VAL 71 22.214 4.556 3.059
498 HG11 VAL 71 1HG1 VAL 71 21.672 6.857 4.981
499 HG12 VAL 71 2HG1 VAL 71 21.223 5.162 5.265
500 HG13 VAL 71 3HG1 VAL 71 22.938 5.608 5.144
501 HG21 VAL 71 1HG2 VAL 71 20.400 5.554 1.697
502 HG22 VAL 71 2HG2 VAL 71 19.794 5.081 3.299
503 HG23 VAL 71 3HG2 VAL 71 20.136 6.791 2.946
504 H SER 72 H SER 72 24.839 5.072 1.922
505 HA SER 72 HA SER 72 26.481 5.796 4.211
506 HB2 SER 72 2HB SER 72 26.451 3.511 3.290
507 HB3 SER 72 3HB SER 72 27.047 4.122 1.733
508 HG SER 72 HG SER 72 28.730 3.312 3.040
509 H GLY 73 H GLY 73 25.828 7.250 1.212
510 HA2 GLY 73 2HA GLY 73 28.414 8.146 0.414
511 HA3 GLY 73 3HA GLY 73 26.859 8.861 -0.043
512 H ARG 74 H ARG 74 25.804 10.337 1.548
513 HA ARG 74 HA ARG 74 27.459 11.423 3.690
514 HB2 ARG 74 2HB ARG 74 28.416 12.578 1.738
515 HB3 ARG 74 3HB ARG 74 26.800 13.047 1.206
516 HG2 ARG 74 2HG ARG 74 27.790 14.950 2.228
517 HG3 ARG 74 3HG ARG 74 26.537 14.382 3.334
518 HD2 ARG 74 2HD ARG 74 29.439 13.531 3.623
519 HD3 ARG 74 3HD ARG 74 28.856 15.061 4.298
520 HE ARG 74 HE ARG 74 27.166 13.710 5.583
521 HH11 ARG 74 1HH1 ARG 74 30.266 12.311 4.596
522 HH12 ARG 74 2HH1 ARG 74 30.275 11.136 5.891
523 HH21 ARG 74 1HH2 ARG 74 27.187 12.148 7.229
524 HH22 ARG 74 2HH2 ARG 74 28.536 11.053 7.390
525 H ASP 75 H ASP 75 26.165 12.104 5.289
526 HA ASP 75 HA ASP 75 23.555 13.310 4.732
527 HB2 ASP 75 2HB ASP 75 22.339 11.754 6.181
528 HB3 ASP 75 3HB ASP 75 23.032 10.899 4.799
529 H GLY 76 H GLY 76 22.576 14.094 6.854
530 HA2 GLY 76 2HA GLY 76 22.721 15.186 8.843
531 HA3 GLY 76 3HA GLY 76 23.936 13.980 9.317
532 H TYR 77 H TYR 77 24.060 16.519 6.725
533 HA TYR 77 HA TYR 77 26.706 17.197 7.829
534 HB2 TYR 77 2HB TYR 77 26.990 16.426 5.680
535 HB3 TYR 77 3HB TYR 77 25.585 17.302 5.062
536 HD1 TYR 77 HD1 TYR 77 28.923 17.963 6.656
537 HD2 TYR 77 HD2 TYR 77 25.906 19.278 3.881
538 HE1 TYR 77 HE1 TYR 77 30.391 19.839 5.955
539 HE2 TYR 77 HE2 TYR 77 27.363 21.164 3.186
540 HH TYR 77 HH TYR 77 29.387 22.209 3.465
541 H ASP 78 H ASP 78 27.334 19.082 8.508
542 HA ASP 78 HA ASP 78 25.397 20.958 9.370
543 HB2 ASP 78 2HB ASP 78 27.395 20.672 10.629
544 HB3 ASP 78 3HB ASP 78 28.412 20.997 9.220
545 H TYR 79 H TYR 79 24.181 22.110 8.039
546 HA TYR 79 HA TYR 79 25.529 23.648 5.889
547 HB2 TYR 79 2HB TYR 79 24.032 22.045 4.961
548 HB3 TYR 79 3HB TYR 79 22.753 22.480 6.093
549 HD1 TYR 79 HD1 TYR 79 21.440 24.520 5.811
550 HD2 TYR 79 HD2 TYR 79 24.506 23.426 3.008
551 HE1 TYR 79 HE1 TYR 79 20.502 26.130 4.175
552 HE2 TYR 79 HE2 TYR 79 23.582 25.049 1.360
553 HH TYR 79 HH TYR 79 20.716 27.071 2.093
554 H ASP 80 H ASP 80 24.244 25.719 5.323
555 HA ASP 80 HA ASP 80 24.438 27.418 7.561
556 HB2 ASP 80 2HB ASP 80 24.800 28.284 5.370
557 HB3 ASP 80 3HB ASP 80 23.189 27.771 4.833
558 H GLY 81 H GLY 81 23.201 27.040 9.329
559 HA2 GLY 81 2HA GLY 81 21.363 27.382 10.658
560 HA3 GLY 81 3HA GLY 81 20.436 27.877 9.232
561 H TYR 82 H TYR 82 21.666 24.965 8.307
562 HA TYR 82 HA TYR 82 19.609 23.330 9.662
563 HB2 TYR 82 2HB TYR 82 19.747 23.785 6.677
564 HB3 TYR 82 3HB TYR 82 18.864 22.457 7.435
565 HD1 TYR 82 HD1 TYR 82 19.033 26.135 7.104
566 HD2 TYR 82 HD2 TYR 82 16.743 22.772 8.489
567 HE1 TYR 82 HE1 TYR 82 17.046 27.609 7.379
568 HE2 TYR 82 HE2 TYR 82 14.751 24.234 8.767
569 HH TYR 82 HH TYR 82 14.842 27.737 8.018
570 H ARG 83 H ARG 83 19.715 21.033 8.205
571 HA ARG 83 HA ARG 83 22.525 20.155 8.039
572 HB2 ARG 83 2HB ARG 83 21.912 20.024 10.441
573 HB3 ARG 83 3HB ARG 83 20.539 18.979 10.027
574 HG2 ARG 83 2HG ARG 83 22.052 17.269 9.154
575 HG3 ARG 83 3HG ARG 83 23.454 18.337 9.404
576 HD2 ARG 83 2HD ARG 83 22.920 18.412 11.845
577 HD3 ARG 83 3HD ARG 83 21.599 17.262 11.572
578 HE ARG 83 HE ARG 83 24.419 16.571 10.852
579 HH11 ARG 83 1HH1 ARG 83 21.495 15.917 12.719
580 HH12 ARG 83 2HH1 ARG 83 22.070 14.372 13.302
581 HH21 ARG 83 1HH2 ARG 83 25.147 14.569 11.609
582 HH22 ARG 83 2HH2 ARG 83 24.142 13.607 12.669
583 H LEU 84 H LEU 84 22.718 18.689 6.437
584 HA LEU 84 HA LEU 84 20.444 18.098 4.772
585 HB2 LEU 84 2HB LEU 84 23.334 17.147 4.858
586 HB3 LEU 84 3HB LEU 84 22.180 16.490 3.697
587 HG LEU 84 HG LEU 84 23.527 18.256 2.687
588 HD11 LEU 84 1HD1 LEU 84 20.650 19.188 3.054
589 HD12 LEU 84 2HD1 LEU 84 21.741 19.568 1.711
590 HD13 LEU 84 3HD1 LEU 84 21.182 17.894 1.948
591 HD21 LEU 84 1HD2 LEU 84 23.921 19.613 4.749
592 HD22 LEU 84 2HD2 LEU 84 23.372 20.574 3.360
593 HD23 LEU 84 3HD2 LEU 84 22.239 20.177 4.666
594 H ARG 85 H ARG 85 19.344 16.136 4.386
595 HA ARG 85 HA ARG 85 20.072 13.876 6.203
596 HB2 ARG 85 2HB ARG 85 17.226 14.579 5.418
597 HB3 ARG 85 3HB ARG 85 17.781 13.311 6.517
598 HG2 ARG 85 2HG ARG 85 17.138 14.884 8.039
599 HG3 ARG 85 3HG ARG 85 18.836 15.365 7.857
600 HD2 ARG 85 2HD ARG 85 18.195 17.119 6.267
601 HD3 ARG 85 3HD ARG 85 16.517 16.555 6.264
602 HE ARG 85 HE ARG 85 17.840 18.190 8.287
603 HH11 ARG 85 1HH1 ARG 85 15.160 16.003 7.586
604 HH12 ARG 85 2HH1 ARG 85 14.148 16.603 8.869
605 HH21 ARG 85 1HH2 ARG 85 16.506 18.982 9.981
606 HH22 ARG 85 2HH2 ARG 85 14.917 18.297 10.237
607 H VAL 86 H VAL 86 20.471 12.061 5.214
608 HA VAL 86 HA VAL 86 19.000 11.328 2.773
609 HB VAL 86 HB VAL 86 22.030 11.129 2.886
610 HG11 VAL 86 1HG1 VAL 86 21.754 10.507 0.493
611 HG12 VAL 86 2HG1 VAL 86 20.899 9.371 1.564
612 HG13 VAL 86 3HG1 VAL 86 19.994 10.622 0.675
613 HG21 VAL 86 1HG2 VAL 86 22.029 12.835 1.085
614 HG22 VAL 86 2HG2 VAL 86 20.277 13.057 1.309
615 HG23 VAL 86 3HG2 VAL 86 21.414 13.485 2.615
616 H GLU 87 H GLU 87 17.921 9.955 4.305
617 HA GLU 87 HA GLU 87 19.437 7.493 4.941
618 HB2 GLU 87 2HB GLU 87 18.685 7.526 7.274
619 HB3 GLU 87 3HB GLU 87 19.676 8.955 6.935
620 HG2 GLU 87 2HG GLU 87 17.640 10.327 6.650
621 HG3 GLU 87 3HG GLU 87 16.623 8.909 6.942
622 H PHE 88 H PHE 88 17.931 5.773 5.841
623 HA PHE 88 HA PHE 88 15.768 5.436 4.040
624 HB2 PHE 88 2HB PHE 88 16.687 3.970 6.502
625 HB3 PHE 88 3HB PHE 88 15.238 3.477 5.613
626 HD1 PHE 88 HD1 PHE 88 15.371 2.473 3.409
627 HD2 PHE 88 HD2 PHE 88 18.914 3.716 5.501
628 HE1 PHE 88 HE1 PHE 88 16.767 1.160 1.825
629 HE2 PHE 88 HE2 PHE 88 20.308 2.410 3.919
630 HZ PHE 88 HZ PHE 88 19.236 1.130 2.084
631 HA PRO 89 HA PRO 89 12.262 7.190 6.057
632 HB2 PRO 89 2HB PRO 89 10.276 5.428 5.311
633 HB3 PRO 89 3HB PRO 89 11.001 6.653 4.214
634 HG2 PRO 89 2HG PRO 89 11.659 3.702 4.453
635 HG3 PRO 89 3HG PRO 89 11.451 4.685 2.966
636 HD2 PRO 89 2HD PRO 89 13.906 4.088 3.998
637 HD3 PRO 89 3HD PRO 89 13.569 5.646 3.186
638 H5' A 90 1H5* A 90 9.186 22.513 13.622
639 H5'' A 90 2H5* A 90 7.509 22.750 14.140
640 H4' A 90 H4* A 90 9.379 20.597 15.248
641 H3' A 90 H3* A 90 8.396 20.496 12.721
642 H2' A 90 1H2* A 90 6.154 20.948 13.011
643 HO2' A 90 2HO* A 90 6.284 18.241 13.890
644 H1' A 90 H1* A 90 5.596 19.756 15.617
645 H8 A 90 H8 A 90 3.991 21.543 13.524
646 H61 A 90 1H6 A 90 3.592 26.741 16.865
647 H62 A 90 2H6 A 90 2.933 25.851 15.508
648 H2 A 90 H2 A 90 6.840 24.235 18.594
649 HO5' A 90 H5T A 90 8.296 23.087 16.254
650 H5' A 91 1H5* A 91 8.325 17.322 11.345
651 H5'' A 91 2H5* A 91 9.888 16.501 11.188
652 H4' A 91 H4* A 91 9.162 17.014 8.952
653 H3' A 91 H3* A 91 11.580 17.983 9.905
654 H2' A 91 1H2* A 91 10.883 20.151 10.383
655 HO2' A 91 2HO* A 91 12.469 20.314 8.692
656 H1' A 91 H1* A 91 9.151 20.258 7.922
657 H8 A 91 H8 A 91 10.472 22.574 9.865
658 H61 A 91 1H6 A 91 5.120 24.649 12.191
659 H62 A 91 2H6 A 91 6.819 25.007 11.958
660 H2 A 91 H2 A 91 4.384 20.628 10.423
661 H5' C 92 1H5* C 92 10.615 15.862 5.127
662 H5'' C 92 2H5* C 92 9.250 16.684 5.909
663 H4' C 92 H4* C 92 8.369 14.767 4.752
664 H3' C 92 H3* C 92 8.028 15.079 7.503
665 H2' C 92 1H2* C 92 9.578 13.427 8.137
666 HO2' C 92 2HO* C 92 7.518 12.671 8.865
667 H1' C 92 H1* C 92 8.713 11.763 5.754
668 H41 C 92 1H4 C 92 13.835 8.351 7.406
669 H42 C 92 2H4 C 92 14.572 9.723 8.205
670 H5 C 92 H5 C 92 13.527 11.922 8.298
671 H6 C 92 H6 C 92 11.564 13.215 7.648
672 H5' A 93 1H5* A 93 3.531 13.420 4.975
673 H5'' A 93 2H5* A 93 4.840 12.234 4.762
674 H4' A 93 H4* A 93 3.772 13.848 2.421
675 H3' A 93 H3* A 93 2.004 12.326 3.851
676 H2' A 93 1H2* A 93 3.249 10.339 3.897
677 HO2' A 93 2HO* A 93 1.804 10.253 1.442
678 H1' A 93 H1* A 93 4.070 10.583 1.019
679 H8 A 93 H8 A 93 5.180 9.909 4.606
680 H61 A 93 1H6 A 93 8.967 5.687 2.052
681 H62 A 93 2H6 A 93 8.399 6.367 3.567
682 H2 A 93 H2 A 93 6.899 7.892 -1.208
683 H5' A 94 1H5* A 94 -0.208 12.147 -0.220
684 H5'' A 94 2H5* A 94 -0.692 13.817 -0.593
685 H4' A 94 H4* A 94 -2.613 12.474 -1.028
686 H3' A 94 H3* A 94 -2.689 14.421 1.086
687 H2' A 94 1H2* A 94 -3.090 12.853 2.777
688 HO2' A 94 2HO* A 94 -5.094 13.982 2.587
689 H1' A 94 H1* A 94 -4.515 11.103 0.747
690 H8 A 94 H8 A 94 -5.608 9.484 2.502
691 H61 A 94 1H6 A 94 -1.538 7.447 6.713
692 H62 A 94 2H6 A 94 -3.165 7.280 6.094
693 H2 A 94 H2 A 94 0.467 10.558 4.237
694 H5' A 95 1H5* A 95 -5.240 13.514 -3.444
695 H5'' A 95 2H5* A 95 -4.537 12.287 -2.369
696 H4' A 95 H4* A 95 -3.252 13.256 -4.966
697 H3' A 95 H3* A 95 -5.535 11.793 -4.941
698 HO3' A 95 H3T A 95 -4.640 10.712 -6.792
699 H2' A 95 1H2* A 95 -4.784 10.193 -3.333
700 HO2' A 95 2HO* A 95 -5.470 9.030 -5.204
701 H1' A 95 H1* A 95 -2.173 9.935 -4.833
702 H8 A 95 H8 A 95 -4.060 8.336 -2.325
703 H61 A 95 1H6 A 95 0.883 7.953 1.396
704 H62 A 95 2H6 A 95 -0.756 7.387 1.121
705 H2 A 95 H2 A 95 1.795 10.895 -1.812
Start of MODEL 4
1 H VAL 6 H1 VAL 6 -1.245 11.659 -3.999
2 HA VAL 6 HA VAL 6 -3.726 11.330 -2.478
3 HB VAL 6 HB VAL 6 -2.942 9.959 -5.062
4 HG11 VAL 6 1HG1 VAL 6 -5.528 10.048 -3.446
5 HG12 VAL 6 2HG1 VAL 6 -5.318 9.230 -5.012
6 HG13 VAL 6 3HG1 VAL 6 -4.435 8.651 -3.582
7 HG21 VAL 6 1HG2 VAL 6 -3.381 12.334 -5.498
8 HG22 VAL 6 2HG2 VAL 6 -4.733 11.349 -6.081
9 HG23 VAL 6 3HG2 VAL 6 -4.889 12.246 -4.553
10 H ILE 7 H ILE 7 -1.145 9.319 -4.021
11 HA ILE 7 HA ILE 7 -1.464 7.231 -2.065
12 HB ILE 7 HB ILE 7 0.855 7.724 -3.963
13 HG12 ILE 7 2HG1 ILE 7 -1.211 7.790 -5.259
14 HG13 ILE 7 3HG1 ILE 7 -0.343 6.285 -5.569
15 HG21 ILE 7 1HG2 ILE 7 -0.239 5.220 -2.605
16 HG22 ILE 7 2HG2 ILE 7 1.007 5.221 -3.872
17 HG23 ILE 7 3HG2 ILE 7 1.336 5.999 -2.314
18 HD11 ILE 7 1HD1 ILE 7 -2.723 6.589 -3.684
19 HD12 ILE 7 2HD1 ILE 7 -2.762 5.879 -5.307
20 HD13 ILE 7 3HD1 ILE 7 -1.847 5.074 -4.017
21 H ARG 8 H ARG 8 -0.006 6.591 -0.412
22 HA ARG 8 HA ARG 8 1.005 8.719 1.196
23 HB2 ARG 8 2HB ARG 8 0.291 6.714 2.255
24 HB3 ARG 8 3HB ARG 8 1.292 5.700 1.212
25 HG2 ARG 8 2HG ARG 8 2.933 7.640 2.684
26 HG3 ARG 8 3HG ARG 8 1.957 6.639 3.778
27 HD2 ARG 8 2HD ARG 8 3.750 5.577 1.558
28 HD3 ARG 8 3HD ARG 8 4.186 5.649 3.267
29 HE ARG 8 HE ARG 8 2.341 3.758 1.990
30 HH11 ARG 8 1HH1 ARG 8 3.486 5.172 5.023
31 HH12 ARG 8 2HH1 ARG 8 2.934 3.832 5.997
32 HH21 ARG 8 1HH2 ARG 8 1.617 2.022 3.284
33 HH22 ARG 8 2HH2 ARG 8 1.880 2.051 5.013
34 H GLY 9 H GLY 9 2.679 6.361 -0.948
35 HA2 GLY 9 2HA GLY 9 5.036 8.108 -1.069
36 HA3 GLY 9 3HA GLY 9 5.251 6.605 -0.171
37 HA PRO 10 HA PRO 10 6.371 5.856 -4.628
38 HB2 PRO 10 2HB PRO 10 8.062 3.851 -3.163
39 HB3 PRO 10 3HB PRO 10 8.501 4.903 -4.544
40 HG2 PRO 10 2HG PRO 10 9.329 5.494 -2.020
41 HG3 PRO 10 3HG PRO 10 8.795 6.788 -3.134
42 HD2 PRO 10 2HD PRO 10 7.268 5.501 -0.873
43 HD3 PRO 10 3HD PRO 10 7.305 7.217 -1.388
44 H ALA 11 H ALA 11 5.432 3.754 -1.933
45 HA ALA 11 HA ALA 11 4.173 1.895 -1.788
46 HB1 ALA 11 1HB ALA 11 2.918 2.999 -4.329
47 HB2 ALA 11 2HB ALA 11 2.177 1.840 -3.205
48 HB3 ALA 11 3HB ALA 11 2.533 3.497 -2.665
49 H GLY 12 H GLY 12 6.697 1.744 -3.584
50 HA2 GLY 12 2HA GLY 12 6.116 -0.272 -5.562
51 HA3 GLY 12 3HA GLY 12 7.714 0.168 -4.943
52 H ASN 13 H ASN 13 6.679 -2.525 -5.488
53 HA ASN 13 HA ASN 13 5.939 -3.763 -2.988
54 HB2 ASN 13 2HB ASN 13 6.940 -4.923 -5.617
55 HB3 ASN 13 3HB ASN 13 6.249 -5.874 -4.290
56 HD21 ASN 13 1HD2 ASN 13 3.636 -5.038 -6.923
57 HD22 ASN 13 2HD2 ASN 13 5.261 -5.691 -7.023
58 H ASN 14 H ASN 14 8.959 -2.718 -4.289
59 HA ASN 14 HA ASN 14 10.525 -4.753 -2.857
60 HB2 ASN 14 2HB ASN 14 11.170 -3.831 -5.122
61 HB3 ASN 14 3HB ASN 14 11.454 -2.265 -4.345
62 HD21 ASN 14 1HD2 ASN 14 14.801 -3.223 -3.823
63 HD22 ASN 14 2HD2 ASN 14 13.675 -2.055 -4.466
64 H ASP 15 H ASP 15 12.160 -4.133 -1.275
65 HA ASP 15 HA ASP 15 11.299 -2.039 0.594
66 HB2 ASP 15 2HB ASP 15 13.702 -3.910 0.611
67 HB3 ASP 15 3HB ASP 15 13.152 -2.904 1.959
68 H CYS 16 H CYS 16 14.309 -1.705 1.230
69 HA CYS 16 HA CYS 16 16.000 -0.282 0.780
70 HB2 CYS 16 2HB CYS 16 15.188 -0.739 -2.111
71 HB3 CYS 16 3HB CYS 16 16.723 -0.033 -1.559
72 HG CYS 16 HG CYS 16 15.415 -3.009 -0.979
73 H ARG 17 H ARG 17 13.003 0.728 0.820
74 HA ARG 17 HA ARG 17 13.229 3.330 -0.421
75 HB2 ARG 17 2HB ARG 17 11.313 1.987 1.458
76 HB3 ARG 17 3HB ARG 17 11.362 3.760 1.467
77 HG2 ARG 17 2HG ARG 17 11.102 3.777 -1.002
78 HG3 ARG 17 3HG ARG 17 10.908 2.009 -0.979
79 HD2 ARG 17 2HD ARG 17 9.125 4.010 0.489
80 HD3 ARG 17 3HD ARG 17 8.725 3.225 -1.041
81 HE ARG 17 HE ARG 17 8.688 2.021 1.638
82 HH11 ARG 17 1HH1 ARG 17 8.726 1.414 -1.866
83 HH12 ARG 17 2HH1 ARG 17 7.988 -0.154 -1.703
84 HH21 ARG 17 1HH2 ARG 17 7.750 -0.045 1.793
85 HH22 ARG 17 2HH2 ARG 17 7.461 -0.992 0.347
86 H ILE 18 H ILE 18 13.783 5.292 0.426
87 HA ILE 18 HA ILE 18 14.738 5.404 3.228
88 HB ILE 18 HB ILE 18 16.750 6.580 2.595
89 HG12 ILE 18 2HG1 ILE 18 16.084 6.036 -0.321
90 HG13 ILE 18 3HG1 ILE 18 15.794 7.594 0.486
91 HG21 ILE 18 1HG2 ILE 18 18.024 4.739 1.654
92 HG22 ILE 18 2HG2 ILE 18 16.773 4.099 2.737
93 HG23 ILE 18 3HG2 ILE 18 16.548 4.015 0.972
94 HD11 ILE 18 1HD1 ILE 18 18.488 6.209 0.169
95 HD12 ILE 18 2HD1 ILE 18 17.936 7.674 -0.678
96 HD13 ILE 18 3HD1 ILE 18 18.212 7.716 1.076
97 H TYR 19 H TYR 19 15.248 7.766 3.759
98 HA TYR 19 HA TYR 19 13.136 9.488 2.593
99 HB2 TYR 19 2HB TYR 19 12.248 9.283 4.611
100 HB3 TYR 19 3HB TYR 19 13.759 8.789 5.370
101 HD1 TYR 19 HD1 TYR 19 11.519 11.609 4.685
102 HD2 TYR 19 HD2 TYR 19 15.416 10.461 6.092
103 HE1 TYR 19 HE1 TYR 19 11.780 13.834 5.779
104 HE2 TYR 19 HE2 TYR 19 15.690 12.675 7.168
105 HH TYR 19 HH TYR 19 13.187 15.229 6.970
106 H VAL 20 H VAL 20 13.413 11.722 2.443
107 HA VAL 20 HA VAL 20 16.191 12.701 2.693
108 HB VAL 20 HB VAL 20 14.450 13.051 0.217
109 HG11 VAL 20 1HG1 VAL 20 17.292 13.933 0.865
110 HG12 VAL 20 2HG1 VAL 20 16.504 14.085 -0.725
111 HG13 VAL 20 3HG1 VAL 20 15.882 15.000 0.659
112 HG21 VAL 20 1HG2 VAL 20 16.190 11.699 -0.920
113 HG22 VAL 20 2HG2 VAL 20 16.974 11.395 0.652
114 HG23 VAL 20 3HG2 VAL 20 15.340 10.767 0.324
115 H GLY 21 H GLY 21 16.336 14.931 3.148
116 HA2 GLY 21 2HA GLY 21 13.891 16.543 3.267
117 HA3 GLY 21 3HA GLY 21 14.565 16.084 4.836
118 H ASN 22 H ASN 22 14.487 18.628 4.602
119 HA ASN 22 HA ASN 22 15.530 20.621 4.469
120 HB2 ASN 22 2HB ASN 22 17.305 19.403 5.737
121 HB3 ASN 22 3HB ASN 22 18.100 19.031 4.198
122 HD21 ASN 22 1HD2 ASN 22 19.970 21.984 4.485
123 HD22 ASN 22 2HD2 ASN 22 19.958 20.244 4.309
124 H LEU 23 H LEU 23 16.938 22.070 3.023
125 HA LEU 23 HA LEU 23 16.074 21.852 0.330
126 HB2 LEU 23 2HB LEU 23 18.370 23.437 1.549
127 HB3 LEU 23 3HB LEU 23 17.672 23.728 -0.050
128 HG LEU 23 HG LEU 23 16.105 23.900 2.569
129 HD11 LEU 23 1HD1 LEU 23 17.251 26.088 0.789
130 HD12 LEU 23 2HD1 LEU 23 16.212 26.337 2.213
131 HD13 LEU 23 3HD1 LEU 23 17.839 25.648 2.413
132 HD21 LEU 23 1HD2 LEU 23 14.694 23.392 0.602
133 HD22 LEU 23 2HD2 LEU 23 14.435 25.063 1.152
134 HD23 LEU 23 3HD2 LEU 23 15.440 24.744 -0.284
135 HA PRO 24 HA PRO 24 18.917 19.002 -1.344
136 HB2 PRO 24 2HB PRO 24 18.974 19.765 -3.989
137 HB3 PRO 24 3HB PRO 24 17.561 18.978 -3.213
138 HG2 PRO 24 2HG PRO 24 18.008 21.925 -3.734
139 HG3 PRO 24 3HG PRO 24 16.529 20.945 -4.015
140 HD2 PRO 24 2HD PRO 24 16.880 22.499 -1.780
141 HD3 PRO 24 3HD PRO 24 15.986 20.944 -1.725
142 HA PRO 25 HA PRO 25 22.954 20.817 -1.487
143 HB2 PRO 25 2HB PRO 25 24.344 19.034 -3.051
144 HB3 PRO 25 3HB PRO 25 23.801 18.662 -1.381
145 HG2 PRO 25 2HG PRO 25 22.492 17.894 -4.001
146 HG3 PRO 25 3HG PRO 25 22.756 16.882 -2.541
147 HD2 PRO 25 2HD PRO 25 20.362 18.112 -3.089
148 HD3 PRO 25 3HD PRO 25 20.955 17.863 -1.415
149 H ASP 26 H ASP 26 20.961 20.517 -4.258
150 HA ASP 26 HA ASP 26 22.408 22.704 -5.590
151 HB2 ASP 26 2HB ASP 26 23.350 20.584 -6.533
152 HB3 ASP 26 3HB ASP 26 21.714 20.095 -7.004
153 H ILE 27 H ILE 27 20.931 24.103 -6.519
154 HA ILE 27 HA ILE 27 18.178 23.601 -5.751
155 HB ILE 27 HB ILE 27 19.081 25.728 -5.201
156 HG12 ILE 27 2HG1 ILE 27 17.521 27.269 -6.179
157 HG13 ILE 27 3HG1 ILE 27 17.278 26.240 -7.602
158 HG21 ILE 27 1HG2 ILE 27 20.891 25.864 -6.868
159 HG22 ILE 27 2HG2 ILE 27 19.708 26.128 -8.163
160 HG23 ILE 27 3HG2 ILE 27 19.903 27.336 -6.882
161 HD11 ILE 27 1HD1 ILE 27 16.252 24.495 -6.192
162 HD12 ILE 27 2HD1 ILE 27 16.567 25.471 -4.736
163 HD13 ILE 27 3HD1 ILE 27 15.418 26.046 -5.962
164 H ARG 28 H ARG 28 17.799 21.805 -7.190
165 HA ARG 28 HA ARG 28 16.237 22.801 -9.418
166 HB2 ARG 28 2HB ARG 28 17.234 21.224 -11.087
167 HB3 ARG 28 3HB ARG 28 18.312 22.547 -10.625
168 HG2 ARG 28 2HG ARG 28 19.502 21.042 -9.048
169 HG3 ARG 28 3HG ARG 28 18.439 19.699 -9.539
170 HD2 ARG 28 2HD ARG 28 19.239 19.836 -11.825
171 HD3 ARG 28 3HD ARG 28 20.168 21.302 -11.466
172 HE ARG 28 HE ARG 28 21.595 19.952 -9.970
173 HH11 ARG 28 1HH1 ARG 28 19.682 18.253 -12.429
174 HH12 ARG 28 2HH1 ARG 28 20.766 16.872 -12.445
175 HH21 ARG 28 1HH2 ARG 28 22.947 18.133 -10.034
176 HH22 ARG 28 2HH2 ARG 28 22.577 16.806 -11.124
177 H THR 29 H THR 29 14.557 21.387 -9.972
178 HA THR 29 HA THR 29 13.891 19.529 -7.889
179 HB THR 29 HB THR 29 11.778 19.396 -8.820
180 HG1 THR 29 1HG THR 29 12.243 18.667 -10.840
181 HG21 THR 29 1HG2 THR 29 11.143 21.652 -9.463
182 HG22 THR 29 2HG2 THR 29 12.408 21.761 -8.223
183 HG23 THR 29 3HG2 THR 29 12.806 22.041 -9.937
184 H LYS 30 H LYS 30 15.737 19.158 -10.721
185 HA LYS 30 HA LYS 30 15.056 16.356 -11.152
186 HB2 LYS 30 2HB LYS 30 15.803 18.052 -12.921
187 HB3 LYS 30 3HB LYS 30 17.430 17.928 -12.231
188 HG2 LYS 30 2HG LYS 30 17.302 16.441 -14.134
189 HG3 LYS 30 3HG LYS 30 17.334 15.428 -12.684
190 HD2 LYS 30 2HD LYS 30 14.823 15.264 -12.792
191 HD3 LYS 30 3HD LYS 30 14.853 16.235 -14.274
192 HE2 LYS 30 2HE LYS 30 16.247 14.524 -15.378
193 HE3 LYS 30 3HE LYS 30 16.276 13.571 -13.883
194 HZ1 LYS 30 1HZ LYS 30 13.861 14.239 -15.438
195 HZ2 LYS 30 2HZ LYS 30 14.612 12.773 -15.408
196 HZ3 LYS 30 3HZ LYS 30 13.888 13.356 -14.053
197 H ASP 31 H ASP 31 16.781 17.968 -8.773
198 HA ASP 31 HA ASP 31 19.221 16.630 -8.548
199 HB2 ASP 31 2HB ASP 31 18.813 18.515 -7.183
200 HB3 ASP 31 3HB ASP 31 17.335 17.806 -6.513
201 H ILE 32 H ILE 32 16.020 15.589 -7.320
202 HA ILE 32 HA ILE 32 17.140 13.268 -5.992
203 HB ILE 32 HB ILE 32 15.185 14.568 -5.172
204 HG12 ILE 32 2HG1 ILE 32 14.335 11.713 -5.786
205 HG13 ILE 32 3HG1 ILE 32 15.633 12.102 -4.634
206 HG21 ILE 32 1HG2 ILE 32 13.697 13.278 -7.501
207 HG22 ILE 32 2HG2 ILE 32 12.990 14.302 -6.229
208 HG23 ILE 32 3HG2 ILE 32 14.127 14.999 -7.395
209 HD11 ILE 32 1HD1 ILE 32 12.766 13.097 -4.465
210 HD12 ILE 32 2HD1 ILE 32 13.514 11.849 -3.442
211 HD13 ILE 32 3HD1 ILE 32 14.085 13.528 -3.343
212 H GLU 33 H GLU 33 16.566 13.953 -9.233
213 HA GLU 33 HA GLU 33 16.057 11.075 -9.841
214 HB2 GLU 33 2HB GLU 33 15.412 13.534 -11.518
215 HB3 GLU 33 3HB GLU 33 15.095 11.846 -11.964
216 HG2 GLU 33 2HG GLU 33 13.664 11.654 -9.883
217 HG3 GLU 33 3HG GLU 33 13.854 13.405 -9.674
218 H ASP 34 H ASP 34 18.507 13.299 -9.665
219 HA ASP 34 HA ASP 34 19.935 11.967 -11.913
220 HB2 ASP 34 2HB ASP 34 19.501 14.176 -12.656
221 HB3 ASP 34 3HB ASP 34 19.956 14.871 -11.096
222 H VAL 35 H VAL 35 20.522 13.767 -8.818
223 HA VAL 35 HA VAL 35 23.208 12.734 -8.614
224 HB VAL 35 HB VAL 35 21.350 13.979 -6.548
225 HG11 VAL 35 1HG1 VAL 35 23.459 14.435 -5.308
226 HG12 VAL 35 2HG1 VAL 35 23.122 12.699 -5.439
227 HG13 VAL 35 3HG1 VAL 35 24.352 13.446 -6.489
228 HG21 VAL 35 1HG2 VAL 35 23.594 15.121 -8.271
229 HG22 VAL 35 2HG2 VAL 35 21.857 15.474 -8.438
230 HG23 VAL 35 3HG2 VAL 35 22.737 16.005 -6.988
231 H PHE 36 H PHE 36 20.036 11.799 -7.174
232 HA PHE 36 HA PHE 36 21.172 9.625 -5.694
233 HB2 PHE 36 2HB PHE 36 18.356 10.330 -6.501
234 HB3 PHE 36 3HB PHE 36 18.744 8.831 -5.656
235 HD1 PHE 36 HD1 PHE 36 18.967 8.778 -3.330
236 HD2 PHE 36 HD2 PHE 36 19.125 12.558 -5.374
237 HE1 PHE 36 HE1 PHE 36 18.943 9.965 -1.145
238 HE2 PHE 36 HE2 PHE 36 19.082 13.739 -3.192
239 HZ PHE 36 HZ PHE 36 18.994 12.443 -1.080
240 H SER 37 H SER 37 20.149 9.947 -9.021
241 HA SER 37 HA SER 37 20.026 7.112 -9.574
242 HB2 SER 37 2HB SER 37 20.396 9.539 -11.367
243 HB3 SER 37 3HB SER 37 20.108 7.879 -11.939
244 HG SER 37 HG SER 37 18.197 9.242 -11.692
245 H LYS 38 H LYS 38 22.597 9.487 -9.254
246 HA LYS 38 HA LYS 38 24.605 7.848 -10.576
247 HB2 LYS 38 2HB LYS 38 24.777 10.307 -10.413
248 HB3 LYS 38 3HB LYS 38 24.853 10.190 -8.641
249 HG2 LYS 38 2HG LYS 38 26.929 8.861 -8.795
250 HG3 LYS 38 3HG LYS 38 26.857 8.932 -10.566
251 HD2 LYS 38 2HD LYS 38 27.104 11.322 -8.691
252 HD3 LYS 38 3HD LYS 38 28.426 10.618 -9.638
253 HE2 LYS 38 2HE LYS 38 25.901 11.883 -10.780
254 HE3 LYS 38 3HE LYS 38 27.501 12.641 -10.716
255 HZ1 LYS 38 1HZ LYS 38 27.070 11.669 -12.851
256 HZ2 LYS 38 2HZ LYS 38 28.322 10.885 -12.128
257 HZ3 LYS 38 3HZ LYS 38 26.835 10.182 -12.194
258 H TYR 39 H TYR 39 23.286 8.259 -7.295
259 HA TYR 39 HA TYR 39 25.241 6.544 -6.072
260 HB2 TYR 39 2HB TYR 39 22.604 7.657 -5.193
261 HB3 TYR 39 3HB TYR 39 23.416 6.396 -4.258
262 HD1 TYR 39 HD1 TYR 39 25.787 6.769 -3.463
263 HD2 TYR 39 HD2 TYR 39 23.295 9.923 -4.987
264 HE1 TYR 39 HE1 TYR 39 27.302 8.457 -2.439
265 HE2 TYR 39 HE2 TYR 39 24.784 11.614 -3.944
266 HH TYR 39 HH TYR 39 26.685 11.976 -2.718
267 H GLY 40 H GLY 40 22.354 5.848 -7.912
268 HA2 GLY 40 2HA GLY 40 23.074 3.253 -8.503
269 HA3 GLY 40 3HA GLY 40 22.148 3.097 -7.004
270 H ALA 41 H ALA 41 21.082 1.811 -9.083
271 HA ALA 41 HA ALA 41 19.352 3.426 -10.726
272 HB1 ALA 41 1HB ALA 41 19.278 0.467 -10.026
273 HB2 ALA 41 2HB ALA 41 18.357 1.250 -11.338
274 HB3 ALA 41 3HB ALA 41 20.131 1.199 -11.405
275 H ILE 42 H ILE 42 17.452 4.351 -10.191
276 HA ILE 42 HA ILE 42 16.223 3.611 -7.594
277 HB ILE 42 HB ILE 42 15.552 5.975 -9.372
278 HG12 ILE 42 2HG1 ILE 42 17.591 5.834 -7.114
279 HG13 ILE 42 3HG1 ILE 42 17.954 6.070 -8.837
280 HG21 ILE 42 1HG2 ILE 42 13.902 5.345 -7.642
281 HG22 ILE 42 2HG2 ILE 42 15.170 5.420 -6.397
282 HG23 ILE 42 3HG2 ILE 42 14.660 6.894 -7.253
283 HD11 ILE 42 1HD1 ILE 42 17.999 8.237 -7.784
284 HD12 ILE 42 2HD1 ILE 42 16.533 8.161 -8.780
285 HD13 ILE 42 3HD1 ILE 42 16.426 7.966 -7.009
286 H ARG 43 H ARG 43 14.193 2.763 -7.444
287 HA ARG 43 HA ARG 43 12.836 1.896 -9.912
288 HB2 ARG 43 2HB ARG 43 12.172 1.543 -6.956
289 HB3 ARG 43 3HB ARG 43 11.287 0.805 -8.305
290 HG2 ARG 43 2HG ARG 43 13.274 -0.458 -8.970
291 HG3 ARG 43 3HG ARG 43 14.249 0.357 -7.724
292 HD2 ARG 43 2HD ARG 43 13.528 -1.884 -6.957
293 HD3 ARG 43 3HD ARG 43 12.844 -0.597 -5.954
294 HE ARG 43 HE ARG 43 10.707 -1.112 -6.716
295 HH11 ARG 43 1HH1 ARG 43 13.133 -2.863 -8.613
296 HH12 ARG 43 2HH1 ARG 43 11.955 -3.902 -9.378
297 HH21 ARG 43 1HH2 ARG 43 9.187 -2.483 -7.745
298 HH22 ARG 43 2HH2 ARG 43 9.727 -3.685 -8.889
299 H ASP 44 H ASP 44 12.306 4.098 -7.135
300 HA ASP 44 HA ASP 44 10.382 5.641 -8.698
301 HB2 ASP 44 2HB ASP 44 9.556 3.942 -6.356
302 HB3 ASP 44 3HB ASP 44 8.715 5.458 -6.717
303 H ILE 45 H ILE 45 9.623 7.592 -7.734
304 HA ILE 45 HA ILE 45 11.282 8.608 -5.483
305 HB ILE 45 HB ILE 45 10.781 9.844 -8.215
306 HG12 ILE 45 2HG1 ILE 45 13.304 10.489 -7.545
307 HG13 ILE 45 3HG1 ILE 45 13.146 9.026 -6.556
308 HG21 ILE 45 1HG2 ILE 45 11.590 11.277 -5.652
309 HG22 ILE 45 2HG2 ILE 45 11.693 11.972 -7.285
310 HG23 ILE 45 3HG2 ILE 45 10.112 11.556 -6.612
311 HD11 ILE 45 1HD1 ILE 45 14.072 8.542 -8.824
312 HD12 ILE 45 2HD1 ILE 45 12.501 7.744 -8.599
313 HD13 ILE 45 3HD1 ILE 45 12.614 9.233 -9.565
314 H ASP 46 H ASP 46 10.238 10.110 -4.124
315 HA ASP 46 HA ASP 46 7.442 10.804 -4.792
316 HB2 ASP 46 2HB ASP 46 7.300 8.765 -3.459
317 HB3 ASP 46 3HB ASP 46 8.328 9.487 -2.212
318 H LEU 47 H LEU 47 9.129 12.730 -5.203
319 HA LEU 47 HA LEU 47 9.785 14.379 -2.976
320 HB2 LEU 47 2HB LEU 47 10.607 14.841 -5.238
321 HB3 LEU 47 3HB LEU 47 8.947 15.054 -5.822
322 HG LEU 47 HG LEU 47 8.672 17.015 -4.307
323 HD11 LEU 47 1HD1 LEU 47 10.705 17.991 -3.261
324 HD12 LEU 47 2HD1 LEU 47 10.300 16.410 -2.561
325 HD13 LEU 47 3HD1 LEU 47 11.631 16.550 -3.732
326 HD21 LEU 47 1HD2 LEU 47 10.132 18.533 -5.575
327 HD22 LEU 47 2HD2 LEU 47 11.118 17.154 -6.116
328 HD23 LEU 47 3HD2 LEU 47 9.428 17.304 -6.648
329 H LYS 48 H LYS 48 8.562 15.718 -1.667
330 HA LYS 48 HA LYS 48 5.668 15.979 -2.263
331 HB2 LYS 48 2HB LYS 48 6.279 13.841 -0.920
332 HB3 LYS 48 3HB LYS 48 6.619 14.947 0.421
333 HG2 LYS 48 2HG LYS 48 4.263 15.881 0.109
334 HG3 LYS 48 3HG LYS 48 3.983 14.593 -1.074
335 HD2 LYS 48 2HD LYS 48 4.583 14.306 1.893
336 HD3 LYS 48 3HD LYS 48 3.097 13.861 1.048
337 HE2 LYS 48 2HE LYS 48 5.826 12.566 0.632
338 HE3 LYS 48 3HE LYS 48 4.509 11.888 1.599
339 HZ1 LYS 48 1HZ LYS 48 4.610 10.979 -0.621
340 HZ2 LYS 48 2HZ LYS 48 3.180 11.753 -0.367
341 HZ3 LYS 48 3HZ LYS 48 4.364 12.455 -1.284
342 H ASN 49 H ASN 49 4.615 17.640 -1.084
343 HA ASN 49 HA ASN 49 6.326 19.874 -0.379
344 HB2 ASN 49 2HB ASN 49 4.187 20.103 -1.591
345 HB3 ASN 49 3HB ASN 49 3.316 19.486 -0.174
346 HD21 ASN 49 1HD2 ASN 49 4.865 23.328 -0.200
347 HD22 ASN 49 2HD2 ASN 49 5.401 22.138 -1.367
348 H ARG 50 H ARG 50 6.183 21.049 1.671
349 HA ARG 50 HA ARG 50 5.156 19.594 3.997
350 HB2 ARG 50 2HB ARG 50 7.395 18.681 3.850
351 HB3 ARG 50 3HB ARG 50 8.084 20.296 3.593
352 HG2 ARG 50 2HG ARG 50 8.495 19.630 5.894
353 HG3 ARG 50 3HG ARG 50 7.340 20.963 5.873
354 HD2 ARG 50 2HD ARG 50 5.584 18.900 5.820
355 HD3 ARG 50 3HD ARG 50 6.941 18.081 6.600
356 HE ARG 50 HE ARG 50 6.442 20.646 7.815
357 HH11 ARG 50 1HH1 ARG 50 5.294 17.310 7.703
358 HH12 ARG 50 2HH1 ARG 50 4.410 17.438 9.206
359 HH21 ARG 50 1HH2 ARG 50 5.325 20.781 9.795
360 HH22 ARG 50 2HH2 ARG 50 4.465 19.388 10.408
361 H ARG 51 H ARG 51 4.728 20.979 5.771
362 HA ARG 51 HA ARG 51 4.815 23.879 5.093
363 HB2 ARG 51 2HB ARG 51 3.079 22.404 7.103
364 HB3 ARG 51 3HB ARG 51 2.931 24.105 6.614
365 HG2 ARG 51 2HG ARG 51 2.415 23.358 4.283
366 HG3 ARG 51 3HG ARG 51 2.527 21.666 4.818
367 HD2 ARG 51 2HD ARG 51 0.746 22.143 6.517
368 HD3 ARG 51 3HD ARG 51 0.549 23.757 5.804
369 HE ARG 51 HE ARG 51 0.040 22.493 3.633
370 HH11 ARG 51 1HH1 ARG 51 -0.666 21.178 6.849
371 HH12 ARG 51 2HH1 ARG 51 -1.917 20.116 6.268
372 HH21 ARG 51 1HH2 ARG 51 -1.637 21.117 2.911
373 HH22 ARG 51 2HH2 ARG 51 -2.494 20.114 4.063
374 H GLY 52 H GLY 52 5.502 25.386 6.653
375 HA2 GLY 52 2HA GLY 52 6.560 26.184 8.532
376 HA3 GLY 52 3HA GLY 52 6.255 24.630 9.327
377 H GLY 53 H GLY 53 7.853 24.094 6.370
378 HA2 GLY 53 2HA GLY 53 10.558 24.679 7.089
379 HA3 GLY 53 3HA GLY 53 10.168 23.001 7.507
380 HA PRO 54 HA PRO 54 11.464 23.567 2.973
381 HB2 PRO 54 2HB PRO 54 13.448 21.483 3.788
382 HB3 PRO 54 3HB PRO 54 13.688 22.929 2.762
383 HG2 PRO 54 2HG PRO 54 14.592 22.837 5.343
384 HG3 PRO 54 3HG PRO 54 13.909 24.342 4.632
385 HD2 PRO 54 2HD PRO 54 12.592 22.358 6.484
386 HD3 PRO 54 3HD PRO 54 12.491 24.148 6.468
387 HA PRO 55 HA PRO 55 9.221 19.952 1.677
388 HB2 PRO 55 2HB PRO 55 11.208 19.652 -0.536
389 HB3 PRO 55 3HB PRO 55 9.428 19.810 -0.630
390 HG2 PRO 55 2HG PRO 55 11.087 21.877 -1.282
391 HG3 PRO 55 3HG PRO 55 9.530 22.158 -0.438
392 HD2 PRO 55 2HD PRO 55 12.317 22.098 0.715
393 HD3 PRO 55 3HD PRO 55 10.945 23.177 1.110
394 H PHE 56 H PHE 56 9.550 17.567 1.111
395 HA PHE 56 HA PHE 56 12.156 16.417 1.875
396 HB2 PHE 56 2HB PHE 56 11.388 15.297 3.773
397 HB3 PHE 56 3HB PHE 56 10.585 16.848 3.958
398 HD1 PHE 56 HD1 PHE 56 8.139 16.906 2.731
399 HD2 PHE 56 HD2 PHE 56 10.178 13.383 4.123
400 HE1 PHE 56 HE1 PHE 56 5.972 15.719 2.917
401 HE2 PHE 56 HE2 PHE 56 8.006 12.222 4.382
402 HZ PHE 56 HZ PHE 56 5.901 13.374 3.726
403 H ALA 57 H ALA 57 11.872 13.905 1.570
404 HA ALA 57 HA ALA 57 9.760 13.173 -0.330
405 HB1 ALA 57 1HB ALA 57 11.398 14.505 -1.688
406 HB2 ALA 57 2HB ALA 57 12.664 13.342 -1.228
407 HB3 ALA 57 3HB ALA 57 11.278 12.806 -2.207
408 H PHE 58 H PHE 58 10.104 10.937 -1.190
409 HA PHE 58 HA PHE 58 11.978 9.329 0.470
410 HB2 PHE 58 2HB PHE 58 9.225 8.526 -0.513
411 HB3 PHE 58 3HB PHE 58 10.386 7.440 0.253
412 HD1 PHE 58 HD1 PHE 58 7.749 9.807 0.779
413 HD2 PHE 58 HD2 PHE 58 11.127 7.932 2.656
414 HE1 PHE 58 HE1 PHE 58 6.927 10.556 2.999
415 HE2 PHE 58 HE2 PHE 58 10.261 8.610 4.885
416 HZ PHE 58 HZ PHE 58 8.175 9.937 5.057
417 H VAL 59 H VAL 59 12.903 7.471 -0.602
418 HA VAL 59 HA VAL 59 12.785 7.537 -3.578
419 HB VAL 59 HB VAL 59 15.259 7.718 -1.806
420 HG11 VAL 59 1HG1 VAL 59 15.665 6.086 -3.589
421 HG12 VAL 59 2HG1 VAL 59 15.036 7.230 -4.804
422 HG13 VAL 59 3HG1 VAL 59 16.542 7.590 -3.931
423 HG21 VAL 59 1HG2 VAL 59 14.162 9.505 -4.014
424 HG22 VAL 59 2HG2 VAL 59 14.220 9.885 -2.279
425 HG23 VAL 59 3HG2 VAL 59 15.730 9.728 -3.196
426 H GLU 60 H GLU 60 12.950 5.491 -4.480
427 HA GLU 60 HA GLU 60 13.391 3.249 -2.549
428 HB2 GLU 60 2HB GLU 60 11.034 3.428 -3.118
429 HB3 GLU 60 3HB GLU 60 11.408 3.473 -4.846
430 HG2 GLU 60 2HG GLU 60 12.303 1.208 -4.794
431 HG3 GLU 60 3HG GLU 60 12.156 1.153 -3.030
432 H PHE 61 H PHE 61 15.378 2.486 -2.975
433 HA PHE 61 HA PHE 61 16.435 2.478 -5.673
434 HB2 PHE 61 2HB PHE 61 17.510 1.621 -3.006
435 HB3 PHE 61 3HB PHE 61 18.344 1.227 -4.504
436 HD1 PHE 61 HD1 PHE 61 19.036 3.084 -6.088
437 HD2 PHE 61 HD2 PHE 61 17.684 3.815 -2.073
438 HE1 PHE 61 HE1 PHE 61 20.086 5.324 -6.144
439 HE2 PHE 61 HE2 PHE 61 18.761 6.045 -2.120
440 HZ PHE 61 HZ PHE 61 19.957 6.805 -4.162
441 H GLU 62 H GLU 62 17.394 0.641 -6.752
442 HA GLU 62 HA GLU 62 15.582 -1.621 -6.863
443 HB2 GLU 62 2HB GLU 62 16.623 -0.765 -8.889
444 HB3 GLU 62 3HB GLU 62 18.235 -0.969 -8.197
445 HG2 GLU 62 2HG GLU 62 17.825 -2.765 -9.752
446 HG3 GLU 62 3HG GLU 62 17.898 -3.434 -8.117
447 H ASP 63 H ASP 63 18.708 -0.899 -5.368
448 HA ASP 63 HA ASP 63 18.681 -3.573 -4.086
449 HB2 ASP 63 2HB ASP 63 20.992 -2.227 -5.500
450 HB3 ASP 63 3HB ASP 63 21.238 -3.483 -4.284
451 HA PRO 64 HA PRO 64 19.281 -1.396 -0.355
452 HB2 PRO 64 2HB PRO 64 20.606 -3.268 1.182
453 HB3 PRO 64 3HB PRO 64 18.873 -3.396 0.748
454 HG2 PRO 64 2HG PRO 64 21.249 -4.748 -0.552
455 HG3 PRO 64 3HG PRO 64 19.659 -5.456 -0.129
456 HD2 PRO 64 2HD PRO 64 20.281 -4.612 -2.660
457 HD3 PRO 64 3HD PRO 64 18.622 -4.491 -1.996
458 H ARG 65 H ARG 65 22.018 -2.713 -2.135
459 HA ARG 65 HA ARG 65 24.084 -1.465 -0.538
460 HB2 ARG 65 2HB ARG 65 24.098 -2.430 -3.431
461 HB3 ARG 65 3HB ARG 65 25.530 -2.016 -2.466
462 HG2 ARG 65 2HG ARG 65 24.940 -3.796 -0.837
463 HG3 ARG 65 3HG ARG 65 23.535 -4.233 -1.837
464 HD2 ARG 65 2HD ARG 65 25.035 -4.722 -3.736
465 HD3 ARG 65 3HD ARG 65 26.438 -4.283 -2.746
466 HE ARG 65 HE ARG 65 26.198 -6.264 -1.486
467 HH11 ARG 65 1HH1 ARG 65 23.675 -5.959 -3.937
468 HH12 ARG 65 2HH1 ARG 65 23.187 -7.636 -3.813
469 HH21 ARG 65 1HH2 ARG 65 25.548 -8.446 -1.348
470 HH22 ARG 65 2HH2 ARG 65 24.249 -9.040 -2.352
471 H ASP 66 H ASP 66 21.963 -0.430 -3.169
472 HA ASP 66 HA ASP 66 23.539 1.947 -3.773
473 HB2 ASP 66 2HB ASP 66 20.720 1.090 -4.523
474 HB3 ASP 66 3HB ASP 66 21.535 2.534 -5.139
475 H ALA 67 H ALA 67 20.823 1.099 -1.661
476 HA ALA 67 HA ALA 67 20.049 3.820 -1.109
477 HB1 ALA 67 1HB ALA 67 18.530 1.902 -0.807
478 HB2 ALA 67 2HB ALA 67 19.619 1.230 0.432
479 HB3 ALA 67 3HB ALA 67 18.767 2.758 0.734
480 H GLU 68 H GLU 68 22.332 1.488 0.360
481 HA GLU 68 HA GLU 68 22.817 3.049 2.711
482 HB2 GLU 68 2HB GLU 68 23.317 0.659 2.622
483 HB3 GLU 68 3HB GLU 68 24.437 0.911 1.276
484 HG2 GLU 68 2HG GLU 68 25.700 0.619 3.314
485 HG3 GLU 68 3HG GLU 68 25.901 2.279 2.757
486 H ASP 69 H ASP 69 24.193 3.036 -0.572
487 HA ASP 69 HA ASP 69 26.448 4.677 0.115
488 HB2 ASP 69 2HB ASP 69 25.163 3.875 -2.502
489 HB3 ASP 69 3HB ASP 69 26.562 4.954 -2.419
490 H ALA 70 H ALA 70 23.153 5.406 -1.048
491 HA ALA 70 HA ALA 70 23.725 8.178 -1.596
492 HB1 ALA 70 1HB ALA 70 21.271 8.373 -1.703
493 HB2 ALA 70 2HB ALA 70 21.830 6.949 -2.611
494 HB3 ALA 70 3HB ALA 70 21.099 6.748 -1.003
495 H VAL 71 H VAL 71 22.849 6.291 1.271
496 HA VAL 71 HA VAL 71 22.038 8.579 2.862
497 HB VAL 71 HB VAL 71 22.744 5.677 3.440
498 HG11 VAL 71 1HG1 VAL 71 21.953 6.065 5.761
499 HG12 VAL 71 2HG1 VAL 71 23.443 6.964 5.414
500 HG13 VAL 71 3HG1 VAL 71 21.881 7.811 5.443
501 HG21 VAL 71 1HG2 VAL 71 20.566 6.226 2.333
502 HG22 VAL 71 2HG2 VAL 71 20.351 5.518 3.953
503 HG23 VAL 71 3HG2 VAL 71 20.153 7.270 3.701
504 H SER 72 H SER 72 25.012 6.500 2.679
505 HA SER 72 HA SER 72 26.358 8.075 4.683
506 HB2 SER 72 2HB SER 72 28.270 6.663 4.180
507 HB3 SER 72 3HB SER 72 26.805 5.659 4.220
508 HG SER 72 HG SER 72 28.141 5.241 2.394
509 H GLY 73 H GLY 73 25.669 8.722 1.411
510 HA2 GLY 73 2HA GLY 73 28.262 10.056 0.899
511 HA3 GLY 73 3HA GLY 73 27.002 9.685 -0.288
512 H ARG 74 H ARG 74 25.160 10.976 2.113
513 HA ARG 74 HA ARG 74 25.754 13.788 1.459
514 HB2 ARG 74 2HB ARG 74 24.556 12.922 -0.527
515 HB3 ARG 74 3HB ARG 74 23.217 12.401 0.505
516 HG2 ARG 74 2HG ARG 74 22.741 14.530 -0.661
517 HG3 ARG 74 3HG ARG 74 22.715 14.728 1.099
518 HD2 ARG 74 2HD ARG 74 23.905 16.594 -0.004
519 HD3 ARG 74 3HD ARG 74 25.001 15.662 1.036
520 HE ARG 74 HE ARG 74 24.873 15.031 -1.868
521 HH11 ARG 74 1HH1 ARG 74 26.664 16.409 0.866
522 HH12 ARG 74 2HH1 ARG 74 28.195 16.361 0.028
523 HH21 ARG 74 1HH2 ARG 74 26.886 15.020 -2.940
524 HH22 ARG 74 2HH2 ARG 74 28.316 15.612 -2.127
525 H ASP 75 H ASP 75 24.337 11.433 3.555
526 HA ASP 75 HA ASP 75 22.326 13.076 4.751
527 HB2 ASP 75 2HB ASP 75 22.523 10.589 4.975
528 HB3 ASP 75 3HB ASP 75 23.953 10.824 5.995
529 H GLY 76 H GLY 76 22.386 14.447 6.526
530 HA2 GLY 76 2HA GLY 76 23.223 15.806 8.143
531 HA3 GLY 76 3HA GLY 76 24.442 14.551 8.449
532 H TYR 77 H TYR 77 23.942 16.602 5.495
533 HA TYR 77 HA TYR 77 26.822 17.191 5.681
534 HB2 TYR 77 2HB TYR 77 26.452 16.039 3.715
535 HB3 TYR 77 3HB TYR 77 24.964 16.905 3.357
536 HD1 TYR 77 HD1 TYR 77 28.658 17.419 3.643
537 HD2 TYR 77 HD2 TYR 77 24.942 18.750 1.931
538 HE1 TYR 77 HE1 TYR 77 29.897 19.008 2.195
539 HE2 TYR 77 HE2 TYR 77 26.176 20.335 0.472
540 HH TYR 77 HH TYR 77 29.748 20.617 0.578
541 H ASP 78 H ASP 78 27.699 19.098 5.780
542 HA ASP 78 HA ASP 78 26.171 21.267 6.750
543 HB2 ASP 78 2HB ASP 78 28.415 21.033 7.447
544 HB3 ASP 78 3HB ASP 78 29.012 21.003 5.780
545 H TYR 79 H TYR 79 24.658 22.260 5.601
546 HA TYR 79 HA TYR 79 25.353 23.229 2.880
547 HB2 TYR 79 2HB TYR 79 23.548 21.677 2.814
548 HB3 TYR 79 3HB TYR 79 22.713 22.485 4.145
549 HD1 TYR 79 HD1 TYR 79 21.532 24.592 3.812
550 HD2 TYR 79 HD2 TYR 79 23.455 22.559 0.553
551 HE1 TYR 79 HE1 TYR 79 20.218 25.956 2.203
552 HE2 TYR 79 HE2 TYR 79 22.153 23.926 -1.073
553 HH TYR 79 HH TYR 79 19.798 26.411 -0.003
554 H ASP 80 H ASP 80 24.100 25.296 2.295
555 HA ASP 80 HA ASP 80 25.050 27.345 3.991
556 HB2 ASP 80 2HB ASP 80 24.821 27.754 1.659
557 HB3 ASP 80 3HB ASP 80 23.099 27.349 1.684
558 H GLY 81 H GLY 81 24.338 27.326 6.089
559 HA2 GLY 81 2HA GLY 81 22.980 28.184 7.747
560 HA3 GLY 81 3HA GLY 81 21.709 28.486 6.551
561 H TYR 82 H TYR 82 22.520 25.315 6.015
562 HA TYR 82 HA TYR 82 20.839 24.221 8.188
563 HB2 TYR 82 2HB TYR 82 20.170 23.988 5.235
564 HB3 TYR 82 3HB TYR 82 19.430 23.031 6.516
565 HD1 TYR 82 HD1 TYR 82 19.756 26.429 5.116
566 HD2 TYR 82 HD2 TYR 82 17.765 23.940 7.990
567 HE1 TYR 82 HE1 TYR 82 18.062 28.213 5.471
568 HE2 TYR 82 HE2 TYR 82 16.063 25.711 8.357
569 HH TYR 82 HH TYR 82 15.352 27.817 7.791
570 H ARG 83 H ARG 83 20.423 21.687 7.323
571 HA ARG 83 HA ARG 83 23.025 20.526 6.536
572 HB2 ARG 83 2HB ARG 83 23.116 20.857 8.994
573 HB3 ARG 83 3HB ARG 83 21.633 19.896 9.169
574 HG2 ARG 83 2HG ARG 83 22.748 17.922 8.275
575 HG3 ARG 83 3HG ARG 83 24.202 18.877 7.885
576 HD2 ARG 83 2HD ARG 83 24.475 19.417 10.296
577 HD3 ARG 83 3HD ARG 83 23.069 18.401 10.670
578 HE ARG 83 HE ARG 83 25.497 17.287 9.322
579 HH11 ARG 83 1HH1 ARG 83 23.181 17.243 12.001
580 HH12 ARG 83 2HH1 ARG 83 23.785 15.736 12.647
581 HH21 ARG 83 1HH2 ARG 83 26.256 15.333 10.182
582 HH22 ARG 83 2HH2 ARG 83 25.523 14.653 11.617
583 H LEU 84 H LEU 84 22.744 18.786 5.298
584 HA LEU 84 HA LEU 84 20.152 18.228 4.260
585 HB2 LEU 84 2HB LEU 84 22.911 17.054 3.985
586 HB3 LEU 84 3HB LEU 84 21.541 16.150 3.330
587 HG LEU 84 HG LEU 84 22.667 17.595 1.650
588 HD11 LEU 84 1HD1 LEU 84 19.784 18.361 2.256
589 HD12 LEU 84 2HD1 LEU 84 20.615 18.505 0.694
590 HD13 LEU 84 3HD1 LEU 84 20.315 16.897 1.390
591 HD21 LEU 84 1HD2 LEU 84 23.207 19.505 3.166
592 HD22 LEU 84 2HD2 LEU 84 22.361 20.004 1.685
593 HD23 LEU 84 3HD2 LEU 84 21.475 19.916 3.218
594 H ARG 85 H ARG 85 18.874 16.369 4.329
595 HA ARG 85 HA ARG 85 19.451 14.407 6.516
596 HB2 ARG 85 2HB ARG 85 16.766 15.524 5.598
597 HB3 ARG 85 3HB ARG 85 16.989 14.237 6.793
598 HG2 ARG 85 2HG ARG 85 18.129 17.049 7.108
599 HG3 ARG 85 3HG ARG 85 16.560 16.547 7.751
600 HD2 ARG 85 2HD ARG 85 19.235 15.256 8.445
601 HD3 ARG 85 3HD ARG 85 18.364 16.411 9.457
602 HE ARG 85 HE ARG 85 17.806 13.585 9.178
603 HH11 ARG 85 1HH1 ARG 85 16.335 16.730 9.850
604 HH12 ARG 85 2HH1 ARG 85 14.968 16.038 10.695
605 HH21 ARG 85 1HH2 ARG 85 16.022 12.715 10.298
606 HH22 ARG 85 2HH2 ARG 85 14.808 13.783 10.967
607 H VAL 86 H VAL 86 19.941 12.506 5.632
608 HA VAL 86 HA VAL 86 18.244 11.486 3.453
609 HB VAL 86 HB VAL 86 21.278 11.427 3.217
610 HG11 VAL 86 1HG1 VAL 86 20.761 10.606 0.938
611 HG12 VAL 86 2HG1 VAL 86 20.088 9.526 2.178
612 HG13 VAL 86 3HG1 VAL 86 19.021 10.659 1.318
613 HG21 VAL 86 1HG2 VAL 86 20.512 13.730 2.861
614 HG22 VAL 86 2HG2 VAL 86 20.982 12.989 1.325
615 HG23 VAL 86 3HG2 VAL 86 19.258 13.150 1.733
616 H GLU 87 H GLU 87 17.408 10.186 5.173
617 HA GLU 87 HA GLU 87 19.139 7.871 5.833
618 HB2 GLU 87 2HB GLU 87 18.523 8.035 8.216
619 HB3 GLU 87 3HB GLU 87 19.424 9.474 7.682
620 HG2 GLU 87 2HG GLU 87 17.275 10.690 7.389
621 HG3 GLU 87 3HG GLU 87 16.395 9.257 7.941
622 H PHE 88 H PHE 88 17.838 6.122 6.958
623 HA PHE 88 HA PHE 88 15.565 5.539 5.360
624 HB2 PHE 88 2HB PHE 88 16.819 4.226 7.755
625 HB3 PHE 88 3HB PHE 88 15.322 3.615 7.053
626 HD1 PHE 88 HD1 PHE 88 18.902 4.341 6.274
627 HD2 PHE 88 HD2 PHE 88 15.312 2.293 5.081
628 HE1 PHE 88 HE1 PHE 88 20.187 3.078 4.580
629 HE2 PHE 88 HE2 PHE 88 16.604 1.013 3.392
630 HZ PHE 88 HZ PHE 88 19.041 1.415 3.132
631 HA PRO 89 HA PRO 89 12.127 7.151 7.591
632 HB2 PRO 89 2HB PRO 89 10.194 5.284 7.001
633 HB3 PRO 89 3HB PRO 89 10.801 6.494 5.817
634 HG2 PRO 89 2HG PRO 89 11.610 3.595 6.137
635 HG3 PRO 89 3HG PRO 89 11.253 4.495 4.626
636 HD2 PRO 89 2HD PRO 89 13.806 4.076 5.514
637 HD3 PRO 89 3HD PRO 89 13.329 5.583 4.664
638 H5' A 90 1H5* A 90 9.310 11.211 13.549
639 H5'' A 90 2H5* A 90 8.627 12.522 12.566
640 H4' A 90 H4* A 90 9.956 13.477 14.388
641 H3' A 90 H3* A 90 10.280 14.180 11.703
642 H2' A 90 1H2* A 90 12.255 12.895 11.390
643 HO2' A 90 2HO* A 90 12.740 15.192 11.084
644 H1' A 90 H1* A 90 13.137 13.750 14.160
645 H8 A 90 H8 A 90 15.656 13.096 13.710
646 H61 A 90 1H6 A 90 16.224 7.231 11.800
647 H62 A 90 2H6 A 90 17.087 8.662 12.321
648 H2 A 90 H2 A 90 11.883 8.269 11.819
649 HO5' A 90 H5T A 90 10.952 11.003 11.980
650 H5' A 91 1H5* A 91 7.981 16.140 11.297
651 H5'' A 91 2H5* A 91 9.629 15.813 10.722
652 H4' A 91 H4* A 91 8.512 17.194 9.079
653 H3' A 91 H3* A 91 10.786 18.290 10.646
654 H2' A 91 1H2* A 91 10.416 20.554 10.182
655 HO2' A 91 2HO* A 91 10.082 20.163 7.897
656 H1' A 91 H1* A 91 7.715 20.667 10.310
657 H8 A 91 H8 A 91 10.597 21.043 12.102
658 H61 A 91 1H6 A 91 7.911 19.629 17.501
659 H62 A 91 2H6 A 91 9.308 20.361 16.741
660 H2 A 91 H2 A 91 5.235 18.244 14.225
661 H5' C 92 1H5* C 92 10.191 15.680 6.139
662 H5'' C 92 2H5* C 92 8.893 16.529 7.004
663 H4' C 92 H4* C 92 7.953 14.499 6.106
664 H3' C 92 H3* C 92 7.855 15.068 8.825
665 H2' C 92 1H2* C 92 9.545 13.572 9.461
666 HO2' C 92 2HO* C 92 8.552 11.674 10.236
667 H1' C 92 H1* C 92 8.524 11.603 7.377
668 H41 C 92 1H4 C 92 14.013 8.663 8.798
669 H42 C 92 2H4 C 92 14.736 10.151 9.369
670 H5 C 92 H5 C 92 13.555 12.291 9.362
671 H6 C 92 H6 C 92 11.470 13.392 8.788
672 H5' A 93 1H5* A 93 3.343 12.792 6.922
673 H5'' A 93 2H5* A 93 4.806 11.819 6.655
674 H4' A 93 H4* A 93 3.240 13.018 4.339
675 H3' A 93 H3* A 93 2.586 10.646 6.050
676 H2' A 93 1H2* A 93 2.192 9.247 4.193
677 HO2' A 93 2HO* A 93 0.928 10.806 3.028
678 H1' A 93 H1* A 93 4.221 10.114 2.579
679 H8 A 93 H8 A 93 4.222 9.457 6.368
680 H61 A 93 1H6 A 93 7.812 4.604 4.854
681 H62 A 93 2H6 A 93 7.038 5.449 6.180
682 H2 A 93 H2 A 93 6.753 6.831 1.131
683 H5' A 94 1H5* A 94 0.135 13.656 6.837
684 H5'' A 94 2H5* A 94 -0.766 12.572 7.915
685 H4' A 94 H4* A 94 -2.084 14.732 6.205
686 H3' A 94 H3* A 94 -0.410 15.433 8.205
687 H2' A 94 1H2* A 94 -1.054 13.973 9.897
688 HO2' A 94 2HO* A 94 -3.009 16.034 10.071
689 H1' A 94 H1* A 94 -3.967 13.908 9.508
690 H8 A 94 H8 A 94 -1.728 12.487 11.416
691 H61 A 94 1H6 A 94 -2.587 6.700 9.387
692 H62 A 94 2H6 A 94 -1.898 7.689 10.659
693 H2 A 94 H2 A 94 -4.356 9.484 6.397
694 H5' A 95 1H5* A 95 -0.600 17.953 9.660
695 H5'' A 95 2H5* A 95 -0.976 19.547 8.965
696 H4' A 95 H4* A 95 1.836 18.432 8.805
697 H3' A 95 H3* A 95 0.570 18.755 11.284
698 HO3' A 95 H3T A 95 2.753 18.911 12.002
699 H2' A 95 1H2* A 95 0.212 21.082 11.072
700 HO2' A 95 2HO* A 95 1.907 22.135 12.195
701 H1' A 95 H1* A 95 2.899 21.285 9.681
702 H8 A 95 H8 A 95 3.073 23.893 9.941
703 H61 A 95 1H6 A 95 -2.076 26.815 8.101
704 H62 A 95 2H6 A 95 -0.417 27.029 8.628
705 H2 A 95 H2 A 95 -2.870 22.438 8.031
Start of MODEL 5
1 H VAL 6 H1 VAL 6 -3.816 4.604 -6.388
2 HA VAL 6 HA VAL 6 -3.315 6.294 -4.794
3 HB VAL 6 HB VAL 6 -1.735 3.781 -4.177
4 HG11 VAL 6 1HG1 VAL 6 -3.319 5.747 -2.457
5 HG12 VAL 6 2HG1 VAL 6 -2.566 4.246 -1.870
6 HG13 VAL 6 3HG1 VAL 6 -1.549 5.559 -2.488
7 HG21 VAL 6 1HG2 VAL 6 -3.904 3.116 -5.093
8 HG22 VAL 6 2HG2 VAL 6 -3.903 2.883 -3.337
9 HG23 VAL 6 3HG2 VAL 6 -4.736 4.286 -4.039
10 H ILE 7 H ILE 7 -1.885 7.686 -3.783
11 HA ILE 7 HA ILE 7 0.495 8.373 -5.224
12 HB ILE 7 HB ILE 7 -0.364 9.173 -2.409
13 HG12 ILE 7 2HG1 ILE 7 -2.169 9.651 -4.001
14 HG13 ILE 7 3HG1 ILE 7 -1.393 11.146 -3.470
15 HG21 ILE 7 1HG2 ILE 7 1.539 10.438 -4.421
16 HG22 ILE 7 2HG2 ILE 7 0.961 11.233 -2.942
17 HG23 ILE 7 3HG2 ILE 7 1.942 9.763 -2.824
18 HD11 ILE 7 1HD1 ILE 7 -0.845 9.736 -6.120
19 HD12 ILE 7 2HD1 ILE 7 -1.832 11.195 -5.887
20 HD13 ILE 7 3HD1 ILE 7 -0.087 11.247 -5.568
21 H ARG 8 H ARG 8 2.694 8.194 -4.603
22 HA ARG 8 HA ARG 8 3.397 5.682 -3.402
23 HB2 ARG 8 2HB ARG 8 4.673 6.937 -5.201
24 HB3 ARG 8 3HB ARG 8 5.177 8.085 -3.948
25 HG2 ARG 8 2HG ARG 8 6.117 6.099 -2.648
26 HG3 ARG 8 3HG ARG 8 5.771 5.103 -4.084
27 HD2 ARG 8 2HD ARG 8 7.645 7.484 -3.869
28 HD3 ARG 8 3HD ARG 8 8.100 5.804 -4.161
29 HE ARG 8 HE ARG 8 6.831 7.674 -6.092
30 HH11 ARG 8 1HH1 ARG 8 8.231 4.471 -5.453
31 HH12 ARG 8 2HH1 ARG 8 8.288 4.056 -7.147
32 HH21 ARG 8 1HH2 ARG 8 6.914 7.064 -8.284
33 HH22 ARG 8 2HH2 ARG 8 7.565 5.500 -8.724
34 H GLY 9 H GLY 9 4.275 5.217 -1.401
35 HA2 GLY 9 2HA GLY 9 5.354 6.012 0.659
36 HA3 GLY 9 3HA GLY 9 4.318 7.440 0.593
37 HA PRO 10 HA PRO 10 1.130 5.399 2.941
38 HB2 PRO 10 2HB PRO 10 -0.827 5.976 0.751
39 HB3 PRO 10 3HB PRO 10 -0.918 6.399 2.490
40 HG2 PRO 10 2HG PRO 10 -0.317 8.277 0.608
41 HG3 PRO 10 3HG PRO 10 0.502 8.274 2.209
42 HD2 PRO 10 2HD PRO 10 1.513 7.257 -0.441
43 HD3 PRO 10 3HD PRO 10 2.390 8.157 0.840
44 H ALA 11 H ALA 11 1.970 4.385 -0.246
45 HA ALA 11 HA ALA 11 1.082 1.649 0.382
46 HB1 ALA 11 1HB ALA 11 -0.788 2.590 -0.920
47 HB2 ALA 11 2HB ALA 11 0.342 3.102 -2.190
48 HB3 ALA 11 3HB ALA 11 0.086 1.370 -1.868
49 H GLY 12 H GLY 12 2.147 0.048 -1.037
50 HA2 GLY 12 2HA GLY 12 4.123 0.582 -2.936
51 HA3 GLY 12 3HA GLY 12 4.933 0.642 -1.357
52 H ASN 13 H ASN 13 5.942 -1.256 -2.804
53 HA ASN 13 HA ASN 13 4.770 -3.757 -1.729
54 HB2 ASN 13 2HB ASN 13 5.621 -3.329 -4.621
55 HB3 ASN 13 3HB ASN 13 5.159 -4.877 -3.908
56 HD21 ASN 13 1HD2 ASN 13 1.679 -4.328 -4.121
57 HD22 ASN 13 2HD2 ASN 13 2.979 -5.361 -3.566
58 H ASN 14 H ASN 14 7.346 -1.735 -1.748
59 HA ASN 14 HA ASN 14 9.220 -3.941 -1.175
60 HB2 ASN 14 2HB ASN 14 9.817 -1.680 -3.125
61 HB3 ASN 14 3HB ASN 14 10.989 -2.878 -2.534
62 HD21 ASN 14 1HD2 ASN 14 9.950 -5.466 -4.707
63 HD22 ASN 14 2HD2 ASN 14 10.933 -5.006 -3.334
64 H ASP 15 H ASP 15 10.858 -3.379 0.274
65 HA ASP 15 HA ASP 15 10.316 -0.908 1.793
66 HB2 ASP 15 2HB ASP 15 11.857 -3.434 2.470
67 HB3 ASP 15 3HB ASP 15 11.745 -2.027 3.534
68 H CYS 16 H CYS 16 12.090 -1.413 -0.801
69 HA CYS 16 HA CYS 16 14.742 -0.676 0.093
70 HB2 CYS 16 2HB CYS 16 13.446 -0.884 -2.646
71 HB3 CYS 16 3HB CYS 16 15.160 -0.489 -2.385
72 HG CYS 16 HG CYS 16 13.439 -3.147 -1.454
73 H ARG 17 H ARG 17 12.095 1.207 0.266
74 HA ARG 17 HA ARG 17 13.091 3.598 -1.055
75 HB2 ARG 17 2HB ARG 17 10.899 3.204 1.025
76 HB3 ARG 17 3HB ARG 17 11.261 4.725 0.196
77 HG2 ARG 17 2HG ARG 17 10.875 3.575 -2.000
78 HG3 ARG 17 3HG ARG 17 10.351 2.128 -1.107
79 HD2 ARG 17 2HD ARG 17 8.586 3.490 0.008
80 HD3 ARG 17 3HD ARG 17 9.078 4.898 -0.946
81 HE ARG 17 HE ARG 17 8.596 3.239 -2.945
82 HH11 ARG 17 1HH1 ARG 17 6.740 3.650 0.038
83 HH12 ARG 17 2HH1 ARG 17 5.233 3.146 -0.692
84 HH21 ARG 17 1HH2 ARG 17 6.624 2.556 -3.858
85 HH22 ARG 17 2HH2 ARG 17 5.161 2.553 -2.897
86 H ILE 18 H ILE 18 14.046 5.394 -0.139
87 HA ILE 18 HA ILE 18 14.681 5.315 2.758
88 HB ILE 18 HB ILE 18 16.927 6.077 2.399
89 HG12 ILE 18 2HG1 ILE 18 16.506 5.773 -0.594
90 HG13 ILE 18 3HG1 ILE 18 16.439 7.328 0.261
91 HG21 ILE 18 1HG2 ILE 18 16.449 3.655 0.626
92 HG22 ILE 18 2HG2 ILE 18 17.934 4.059 1.517
93 HG23 ILE 18 3HG2 ILE 18 16.466 3.631 2.412
94 HD11 ILE 18 1HD1 ILE 18 18.836 5.454 0.147
95 HD12 ILE 18 2HD1 ILE 18 18.668 7.025 -0.662
96 HD13 ILE 18 3HD1 ILE 18 18.744 6.954 1.109
97 H TYR 19 H TYR 19 15.534 7.529 3.435
98 HA TYR 19 HA TYR 19 13.667 9.498 2.258
99 HB2 TYR 19 2HB TYR 19 12.709 9.224 4.245
100 HB3 TYR 19 3HB TYR 19 14.187 8.699 5.039
101 HD1 TYR 19 HD1 TYR 19 12.076 11.588 4.210
102 HD2 TYR 19 HD2 TYR 19 15.806 10.308 5.916
103 HE1 TYR 19 HE1 TYR 19 12.320 13.799 5.330
104 HE2 TYR 19 HE2 TYR 19 16.066 12.515 7.023
105 HH TYR 19 HH TYR 19 13.619 15.102 6.732
106 H VAL 20 H VAL 20 14.077 11.659 2.131
107 HA VAL 20 HA VAL 20 16.878 12.519 2.519
108 HB VAL 20 HB VAL 20 15.283 13.057 -0.008
109 HG11 VAL 20 1HG1 VAL 20 18.168 13.601 0.798
110 HG12 VAL 20 2HG1 VAL 20 17.482 13.898 -0.820
111 HG13 VAL 20 3HG1 VAL 20 16.885 14.821 0.575
112 HG21 VAL 20 1HG2 VAL 20 15.922 10.691 0.036
113 HG22 VAL 20 2HG2 VAL 20 16.938 11.567 -1.124
114 HG23 VAL 20 3HG2 VAL 20 17.593 11.133 0.472
115 H GLY 21 H GLY 21 17.084 14.646 3.200
116 HA2 GLY 21 2HA GLY 21 14.714 16.396 3.173
117 HA3 GLY 21 3HA GLY 21 15.287 15.867 4.764
118 H ASN 22 H ASN 22 15.294 18.450 4.533
119 HA ASN 22 HA ASN 22 16.438 20.378 4.508
120 HB2 ASN 22 2HB ASN 22 17.921 18.974 6.028
121 HB3 ASN 22 3HB ASN 22 18.965 18.703 4.627
122 HD21 ASN 22 1HD2 ASN 22 20.742 21.648 5.309
123 HD22 ASN 22 2HD2 ASN 22 20.748 19.953 4.850
124 H LEU 23 H LEU 23 15.873 18.947 1.919
125 HA LEU 23 HA LEU 23 17.977 19.556 0.081
126 HB2 LEU 23 2HB LEU 23 14.958 19.329 -0.261
127 HB3 LEU 23 3HB LEU 23 16.089 19.488 -1.611
128 HG LEU 23 HG LEU 23 16.178 17.234 0.439
129 HD11 LEU 23 1HD1 LEU 23 15.137 17.286 -2.423
130 HD12 LEU 23 2HD1 LEU 23 15.262 15.848 -1.386
131 HD13 LEU 23 3HD1 LEU 23 14.134 17.151 -0.956
132 HD21 LEU 23 1HD2 LEU 23 17.619 17.704 -2.208
133 HD22 LEU 23 2HD2 LEU 23 18.369 17.655 -0.591
134 HD23 LEU 23 3HD2 LEU 23 17.663 16.185 -1.290
135 HA PRO 24 HA PRO 24 17.948 23.899 -0.260
136 HB2 PRO 24 2HB PRO 24 17.701 23.558 -3.234
137 HB3 PRO 24 3HB PRO 24 18.899 24.514 -2.306
138 HG2 PRO 24 2HG PRO 24 19.554 22.093 -3.394
139 HG3 PRO 24 3HG PRO 24 20.168 22.586 -1.779
140 HD2 PRO 24 2HD PRO 24 17.915 20.698 -2.450
141 HD3 PRO 24 3HD PRO 24 19.129 20.613 -1.133
142 HA PRO 25 HA PRO 25 13.637 24.991 -0.542
143 HB2 PRO 25 2HB PRO 25 14.622 27.787 -0.933
144 HB3 PRO 25 3HB PRO 25 13.498 27.155 0.310
145 HG2 PRO 25 2HG PRO 25 16.079 27.808 0.913
146 HG3 PRO 25 3HG PRO 25 15.264 26.399 1.668
147 HD2 PRO 25 2HD PRO 25 17.239 26.440 -0.614
148 HD3 PRO 25 3HD PRO 25 17.092 25.290 0.753
149 H ASP 26 H ASP 26 15.910 25.329 -3.047
150 HA ASP 26 HA ASP 26 13.778 25.926 -4.999
151 HB2 ASP 26 2HB ASP 26 15.397 27.361 -6.269
152 HB3 ASP 26 3HB ASP 26 14.823 28.038 -4.742
153 H ILE 27 H ILE 27 15.130 23.433 -4.101
154 HA ILE 27 HA ILE 27 17.042 22.535 -5.942
155 HB ILE 27 HB ILE 27 16.441 21.323 -3.900
156 HG12 ILE 27 2HG1 ILE 27 16.242 19.024 -4.801
157 HG13 ILE 27 3HG1 ILE 27 15.848 19.676 -6.403
158 HG21 ILE 27 1HG2 ILE 27 13.820 20.650 -5.305
159 HG22 ILE 27 2HG2 ILE 27 14.353 20.055 -3.720
160 HG23 ILE 27 3HG2 ILE 27 13.989 21.780 -3.939
161 HD11 ILE 27 1HD1 ILE 27 18.428 20.200 -4.854
162 HD12 ILE 27 2HD1 ILE 27 18.247 19.038 -6.188
163 HD13 ILE 27 3HD1 ILE 27 18.066 20.780 -6.493
164 H ARG 28 H ARG 28 16.954 21.526 -7.965
165 HA ARG 28 HA ARG 28 14.704 22.381 -9.614
166 HB2 ARG 28 2HB ARG 28 16.973 22.681 -10.395
167 HB3 ARG 28 3HB ARG 28 17.326 20.960 -10.183
168 HG2 ARG 28 2HG ARG 28 15.788 20.353 -11.965
169 HG3 ARG 28 3HG ARG 28 15.234 22.041 -12.110
170 HD2 ARG 28 2HD ARG 28 17.434 22.762 -12.827
171 HD3 ARG 28 3HD ARG 28 18.134 21.179 -12.471
172 HE ARG 28 HE ARG 28 16.184 21.737 -14.676
173 HH11 ARG 28 1HH1 ARG 28 18.778 19.774 -13.257
174 HH12 ARG 28 2HH1 ARG 28 19.012 18.837 -14.710
175 HH21 ARG 28 1HH2 ARG 28 16.522 20.482 -16.551
176 HH22 ARG 28 2HH2 ARG 28 17.725 19.216 -16.557
177 H THR 29 H THR 29 13.345 21.046 -10.835
178 HA THR 29 HA THR 29 12.542 18.688 -9.479
179 HB THR 29 HB THR 29 11.482 19.275 -12.203
180 HG1 THR 29 1HG THR 29 10.289 20.976 -11.314
181 HG21 THR 29 1HG2 THR 29 10.217 18.662 -9.493
182 HG22 THR 29 2HG2 THR 29 9.348 18.792 -11.035
183 HG23 THR 29 3HG2 THR 29 10.516 17.472 -10.786
184 H LYS 30 H LYS 30 15.275 18.638 -10.832
185 HA LYS 30 HA LYS 30 14.975 15.904 -11.896
186 HB2 LYS 30 2HB LYS 30 14.789 17.370 -13.864
187 HB3 LYS 30 3HB LYS 30 16.295 18.186 -13.424
188 HG2 LYS 30 2HG LYS 30 16.711 16.563 -15.193
189 HG3 LYS 30 3HG LYS 30 17.530 16.033 -13.715
190 HD2 LYS 30 2HD LYS 30 15.632 14.479 -13.241
191 HD3 LYS 30 3HD LYS 30 14.843 15.007 -14.746
192 HE2 LYS 30 2HE LYS 30 16.862 14.252 -16.014
193 HE3 LYS 30 3HE LYS 30 17.560 13.653 -14.499
194 HZ1 LYS 30 1HZ LYS 30 16.477 11.890 -15.653
195 HZ2 LYS 30 2HZ LYS 30 15.621 12.219 -14.287
196 HZ3 LYS 30 3HZ LYS 30 15.060 12.722 -15.746
197 H ASP 31 H ASP 31 16.846 18.459 -10.367
198 HA ASP 31 HA ASP 31 19.365 17.109 -10.428
199 HB2 ASP 31 2HB ASP 31 18.253 19.293 -8.666
200 HB3 ASP 31 3HB ASP 31 19.895 18.661 -8.502
201 H ILE 32 H ILE 32 16.512 16.661 -8.472
202 HA ILE 32 HA ILE 32 17.800 15.281 -6.305
203 HB ILE 32 HB ILE 32 15.608 16.323 -6.065
204 HG12 ILE 32 2HG1 ILE 32 14.322 14.482 -5.063
205 HG13 ILE 32 3HG1 ILE 32 15.332 13.286 -5.889
206 HG21 ILE 32 1HG2 ILE 32 14.662 14.262 -8.103
207 HG22 ILE 32 2HG2 ILE 32 13.617 15.382 -7.196
208 HG23 ILE 32 3HG2 ILE 32 14.785 16.016 -8.373
209 HD11 ILE 32 1HD1 ILE 32 15.996 13.644 -3.509
210 HD12 ILE 32 2HD1 ILE 32 17.310 14.058 -4.632
211 HD13 ILE 32 3HD1 ILE 32 16.339 15.345 -3.871
212 H GLU 33 H GLU 33 17.049 14.432 -9.599
213 HA GLU 33 HA GLU 33 17.266 11.536 -9.028
214 HB2 GLU 33 2HB GLU 33 16.799 13.050 -11.629
215 HB3 GLU 33 3HB GLU 33 16.740 11.289 -11.409
216 HG2 GLU 33 2HG GLU 33 14.895 11.621 -9.738
217 HG3 GLU 33 3HG GLU 33 14.882 13.346 -10.153
218 H ASP 34 H ASP 34 19.084 14.315 -10.211
219 HA ASP 34 HA ASP 34 21.016 12.891 -11.746
220 HB2 ASP 34 2HB ASP 34 20.672 15.266 -12.042
221 HB3 ASP 34 3HB ASP 34 21.072 15.579 -10.348
222 H VAL 35 H VAL 35 21.113 14.060 -8.331
223 HA VAL 35 HA VAL 35 23.742 13.022 -7.862
224 HB VAL 35 HB VAL 35 21.484 13.701 -5.931
225 HG11 VAL 35 1HG1 VAL 35 23.297 13.916 -4.262
226 HG12 VAL 35 2HG1 VAL 35 23.173 12.255 -4.874
227 HG13 VAL 35 3HG1 VAL 35 24.468 13.324 -5.469
228 HG21 VAL 35 1HG2 VAL 35 22.174 15.611 -7.347
229 HG22 VAL 35 2HG2 VAL 35 22.703 15.833 -5.667
230 HG23 VAL 35 3HG2 VAL 35 23.875 15.323 -6.907
231 H PHE 36 H PHE 36 20.432 11.708 -7.268
232 HA PHE 36 HA PHE 36 21.550 9.373 -6.002
233 HB2 PHE 36 2HB PHE 36 18.761 10.193 -6.713
234 HB3 PHE 36 3HB PHE 36 19.138 8.557 -6.156
235 HD1 PHE 36 HD1 PHE 36 20.030 8.136 -3.912
236 HD2 PHE 36 HD2 PHE 36 18.920 12.088 -5.175
237 HE1 PHE 36 HE1 PHE 36 20.062 8.899 -1.553
238 HE2 PHE 36 HE2 PHE 36 18.949 12.853 -2.819
239 HZ PHE 36 HZ PHE 36 19.542 11.263 -1.005
240 H SER 37 H SER 37 20.528 10.033 -9.349
241 HA SER 37 HA SER 37 20.693 7.261 -10.114
242 HB2 SER 37 2HB SER 37 20.727 8.074 -12.387
243 HB3 SER 37 3HB SER 37 19.536 9.014 -11.468
244 HG SER 37 HG SER 37 20.961 10.701 -11.379
245 H LYS 38 H LYS 38 23.079 9.789 -9.475
246 HA LYS 38 HA LYS 38 25.268 8.433 -10.790
247 HB2 LYS 38 2HB LYS 38 25.313 10.842 -10.253
248 HB3 LYS 38 3HB LYS 38 25.245 10.466 -8.519
249 HG2 LYS 38 2HG LYS 38 27.397 9.288 -8.658
250 HG3 LYS 38 3HG LYS 38 27.449 9.558 -10.415
251 HD2 LYS 38 2HD LYS 38 27.463 12.008 -10.038
252 HD3 LYS 38 3HD LYS 38 27.409 11.736 -8.281
253 HE2 LYS 38 2HE LYS 38 29.545 10.497 -8.410
254 HE3 LYS 38 3HE LYS 38 29.597 10.758 -10.163
255 HZ1 LYS 38 1HZ LYS 38 29.686 13.119 -9.744
256 HZ2 LYS 38 2HZ LYS 38 29.638 12.877 -8.117
257 HZ3 LYS 38 3HZ LYS 38 30.935 12.359 -8.986
258 H TYR 39 H TYR 39 23.806 8.327 -7.517
259 HA TYR 39 HA TYR 39 25.703 6.411 -6.547
260 HB2 TYR 39 2HB TYR 39 23.001 7.287 -5.572
261 HB3 TYR 39 3HB TYR 39 23.840 5.911 -4.851
262 HD1 TYR 39 HD1 TYR 39 23.593 9.495 -4.953
263 HD2 TYR 39 HD2 TYR 39 26.182 6.221 -3.923
264 HE1 TYR 39 HE1 TYR 39 24.990 11.039 -3.598
265 HE2 TYR 39 HE2 TYR 39 27.593 7.756 -2.571
266 HH TYR 39 HH TYR 39 26.851 11.251 -2.279
267 H GLY 40 H GLY 40 23.013 6.073 -8.688
268 HA2 GLY 40 2HA GLY 40 22.647 4.288 -10.111
269 HA3 GLY 40 3HA GLY 40 23.900 3.374 -9.273
270 H ALA 41 H ALA 41 21.738 2.050 -10.122
271 HA ALA 41 HA ALA 41 20.100 0.645 -9.585
272 HB1 ALA 41 1HB ALA 41 20.139 -0.385 -7.358
273 HB2 ALA 41 2HB ALA 41 21.789 -0.177 -7.995
274 HB3 ALA 41 3HB ALA 41 21.158 0.935 -6.752
275 H ILE 42 H ILE 42 19.590 3.646 -9.296
276 HA ILE 42 HA ILE 42 17.269 3.711 -7.512
277 HB ILE 42 HB ILE 42 18.560 5.590 -9.476
278 HG12 ILE 42 2HG1 ILE 42 18.397 7.136 -7.607
279 HG13 ILE 42 3HG1 ILE 42 17.371 6.009 -6.700
280 HG21 ILE 42 1HG2 ILE 42 16.193 5.695 -10.158
281 HG22 ILE 42 2HG2 ILE 42 15.700 5.901 -8.456
282 HG23 ILE 42 3HG2 ILE 42 16.657 7.156 -9.273
283 HD11 ILE 42 1HD1 ILE 42 20.225 5.403 -7.558
284 HD12 ILE 42 2HD1 ILE 42 19.768 6.024 -5.949
285 HD13 ILE 42 3HD1 ILE 42 19.197 4.429 -6.473
286 H ARG 43 H ARG 43 15.162 3.348 -7.997
287 HA ARG 43 HA ARG 43 14.507 2.728 -10.844
288 HB2 ARG 43 2HB ARG 43 13.423 1.482 -8.287
289 HB3 ARG 43 3HB ARG 43 12.725 1.220 -9.892
290 HG2 ARG 43 2HG ARG 43 15.600 0.561 -9.118
291 HG3 ARG 43 3HG ARG 43 14.269 -0.612 -9.232
292 HD2 ARG 43 2HD ARG 43 13.957 0.032 -11.625
293 HD3 ARG 43 3HD ARG 43 15.379 1.088 -11.510
294 HE ARG 43 HE ARG 43 16.537 -1.158 -10.755
295 HH11 ARG 43 1HH1 ARG 43 14.117 -0.714 -13.297
296 HH12 ARG 43 2HH1 ARG 43 14.678 -2.079 -14.232
297 HH21 ARG 43 1HH2 ARG 43 17.263 -2.899 -11.988
298 HH22 ARG 43 2HH2 ARG 43 16.468 -3.325 -13.490
299 H ASP 44 H ASP 44 13.732 4.571 -7.979
300 HA ASP 44 HA ASP 44 12.001 6.261 -9.569
301 HB2 ASP 44 2HB ASP 44 10.862 4.450 -7.471
302 HB3 ASP 44 3HB ASP 44 10.229 6.089 -7.613
303 H ILE 45 H ILE 45 11.641 8.287 -8.789
304 HA ILE 45 HA ILE 45 12.831 8.977 -6.142
305 HB ILE 45 HB ILE 45 13.298 10.092 -8.817
306 HG12 ILE 45 2HG1 ILE 45 15.122 11.298 -7.513
307 HG13 ILE 45 3HG1 ILE 45 14.497 10.514 -6.051
308 HG21 ILE 45 1HG2 ILE 45 11.612 11.768 -8.136
309 HG22 ILE 45 2HG2 ILE 45 12.529 12.060 -6.628
310 HG23 ILE 45 3HG2 ILE 45 13.240 12.462 -8.202
311 HD11 ILE 45 1HD1 ILE 45 15.471 9.059 -8.553
312 HD12 ILE 45 2HD1 ILE 45 16.435 9.296 -7.077
313 HD13 ILE 45 3HD1 ILE 45 14.968 8.295 -7.021
314 H ASP 46 H ASP 46 11.639 10.570 -4.921
315 HA ASP 46 HA ASP 46 8.974 11.279 -5.960
316 HB2 ASP 46 2HB ASP 46 8.670 9.125 -4.895
317 HB3 ASP 46 3HB ASP 46 9.470 9.692 -3.423
318 H LEU 47 H LEU 47 10.147 13.356 -6.031
319 HA LEU 47 HA LEU 47 10.776 14.764 -3.609
320 HB2 LEU 47 2HB LEU 47 11.572 15.502 -5.806
321 HB3 LEU 47 3HB LEU 47 9.904 15.692 -6.375
322 HG LEU 47 HG LEU 47 9.546 17.460 -4.627
323 HD11 LEU 47 1HD1 LEU 47 11.582 18.446 -3.583
324 HD12 LEU 47 2HD1 LEU 47 11.290 16.787 -3.020
325 HD13 LEU 47 3HD1 LEU 47 12.549 17.098 -4.236
326 HD21 LEU 47 1HD2 LEU 47 10.167 18.032 -6.957
327 HD22 LEU 47 2HD2 LEU 47 10.890 19.176 -5.804
328 HD23 LEU 47 3HD2 LEU 47 11.888 17.895 -6.527
329 H LYS 48 H LYS 48 9.469 15.943 -2.211
330 HA LYS 48 HA LYS 48 6.591 16.164 -2.791
331 HB2 LYS 48 2HB LYS 48 7.261 13.810 -1.855
332 HB3 LYS 48 3HB LYS 48 7.472 14.656 -0.314
333 HG2 LYS 48 2HG LYS 48 5.076 15.537 -0.631
334 HG3 LYS 48 3HG LYS 48 4.944 14.416 -1.999
335 HD2 LYS 48 2HD LYS 48 5.494 13.727 0.917
336 HD3 LYS 48 3HD LYS 48 4.017 13.374 0.010
337 HE2 LYS 48 2HE LYS 48 6.782 12.216 -0.545
338 HE3 LYS 48 3HE LYS 48 5.445 11.365 0.239
339 HZ1 LYS 48 1HZ LYS 48 5.617 10.827 -2.081
340 HZ2 LYS 48 2HZ LYS 48 4.185 11.580 -1.786
341 HZ3 LYS 48 3HZ LYS 48 5.423 12.395 -2.518
342 H ASN 49 H ASN 49 5.446 17.273 -0.897
343 HA ASN 49 HA ASN 49 7.167 18.587 1.061
344 HB2 ASN 49 2HB ASN 49 7.292 20.025 -1.031
345 HB3 ASN 49 3HB ASN 49 5.546 20.277 -0.882
346 HD21 ASN 49 1HD2 ASN 49 6.671 23.210 0.849
347 HD22 ASN 49 2HD2 ASN 49 6.179 22.592 -0.715
348 H ARG 50 H ARG 50 5.899 19.689 2.708
349 HA ARG 50 HA ARG 50 2.998 19.277 2.725
350 HB2 ARG 50 2HB ARG 50 3.946 17.081 3.400
351 HB3 ARG 50 3HB ARG 50 4.856 17.873 4.697
352 HG2 ARG 50 2HG ARG 50 2.764 16.721 5.461
353 HG3 ARG 50 3HG ARG 50 2.802 18.432 5.883
354 HD2 ARG 50 2HD ARG 50 0.592 17.773 5.015
355 HD3 ARG 50 3HD ARG 50 1.362 18.957 3.950
356 HE ARG 50 HE ARG 50 1.604 16.046 3.332
357 HH11 ARG 50 1HH1 ARG 50 0.351 19.240 2.474
358 HH12 ARG 50 2HH1 ARG 50 -0.078 18.752 0.849
359 HH21 ARG 50 1HH2 ARG 50 1.027 15.443 1.258
360 HH22 ARG 50 2HH2 ARG 50 0.302 16.599 0.155
361 H ARG 51 H ARG 51 5.487 21.280 3.170
362 HA ARG 51 HA ARG 51 4.219 22.793 5.359
363 HB2 ARG 51 2HB ARG 51 6.362 22.914 6.616
364 HB3 ARG 51 3HB ARG 51 5.701 21.271 6.543
365 HG2 ARG 51 2HG ARG 51 7.231 20.817 4.564
366 HG3 ARG 51 3HG ARG 51 7.978 22.403 4.855
367 HD2 ARG 51 2HD ARG 51 9.276 20.588 5.910
368 HD3 ARG 51 3HD ARG 51 8.609 21.684 7.132
369 HE ARG 51 HE ARG 51 7.363 19.942 7.985
370 HH11 ARG 51 1HH1 ARG 51 8.452 19.041 4.738
371 HH12 ARG 51 2HH1 ARG 51 7.751 17.437 4.842
372 HH21 ARG 51 1HH2 ARG 51 6.488 17.882 8.078
373 HH22 ARG 51 2HH2 ARG 51 6.661 16.776 6.727
374 H GLY 52 H GLY 52 5.318 24.940 5.669
375 HA2 GLY 52 2HA GLY 52 5.868 26.147 3.084
376 HA3 GLY 52 3HA GLY 52 5.800 26.955 4.670
377 H GLY 53 H GLY 53 7.782 24.542 5.428
378 HA2 GLY 53 2HA GLY 53 10.226 26.075 5.070
379 HA3 GLY 53 3HA GLY 53 10.050 24.497 5.852
380 HA PRO 54 HA PRO 54 12.292 24.080 1.759
381 HB2 PRO 54 2HB PRO 54 13.903 22.237 3.486
382 HB3 PRO 54 3HB PRO 54 14.462 23.430 2.267
383 HG2 PRO 54 2HG PRO 54 14.674 23.915 4.949
384 HG3 PRO 54 3HG PRO 54 14.258 25.222 3.787
385 HD2 PRO 54 2HD PRO 54 12.433 23.672 5.620
386 HD3 PRO 54 3HD PRO 54 12.396 25.407 5.186
387 HA PRO 55 HA PRO 55 10.128 20.337 0.868
388 HB2 PRO 55 2HB PRO 55 11.391 19.519 -1.427
389 HB3 PRO 55 3HB PRO 55 10.332 20.959 -1.356
390 HG2 PRO 55 2HG PRO 55 13.358 20.852 -1.228
391 HG3 PRO 55 3HG PRO 55 12.321 21.972 -2.172
392 HD2 PRO 55 2HD PRO 55 13.436 22.642 0.247
393 HD3 PRO 55 3HD PRO 55 11.855 23.279 -0.290
394 H PHE 56 H PHE 56 10.545 17.943 0.332
395 HA PHE 56 HA PHE 56 13.158 16.884 1.225
396 HB2 PHE 56 2HB PHE 56 12.359 15.807 3.101
397 HB3 PHE 56 3HB PHE 56 11.384 17.265 3.183
398 HD1 PHE 56 HD1 PHE 56 9.017 17.047 1.822
399 HD2 PHE 56 HD2 PHE 56 11.336 13.785 3.401
400 HE1 PHE 56 HE1 PHE 56 6.984 15.616 1.884
401 HE2 PHE 56 HE2 PHE 56 9.287 12.402 3.555
402 HZ PHE 56 HZ PHE 56 7.134 13.288 2.732
403 H ALA 57 H ALA 57 12.887 14.303 0.902
404 HA ALA 57 HA ALA 57 10.935 13.671 -1.191
405 HB1 ALA 57 1HB ALA 57 12.677 14.936 -2.426
406 HB2 ALA 57 2HB ALA 57 13.911 13.814 -1.810
407 HB3 ALA 57 3HB ALA 57 12.648 13.226 -2.909
408 H PHE 58 H PHE 58 11.236 11.458 -2.048
409 HA PHE 58 HA PHE 58 12.789 9.695 -0.225
410 HB2 PHE 58 2HB PHE 58 10.091 9.179 -1.501
411 HB3 PHE 58 3HB PHE 58 11.081 7.935 -0.736
412 HD1 PHE 58 HD1 PHE 58 8.686 10.568 -0.210
413 HD2 PHE 58 HD2 PHE 58 11.656 8.137 1.732
414 HE1 PHE 58 HE1 PHE 58 7.759 11.197 2.007
415 HE2 PHE 58 HE2 PHE 58 10.692 8.708 3.933
416 HZ PHE 58 HZ PHE 58 8.751 10.254 4.077
417 H VAL 59 H VAL 59 13.636 7.746 -1.179
418 HA VAL 59 HA VAL 59 13.900 7.831 -4.140
419 HB VAL 59 HB VAL 59 16.139 7.554 -2.090
420 HG11 VAL 59 1HG1 VAL 59 17.613 7.357 -4.085
421 HG12 VAL 59 2HG1 VAL 59 16.466 6.002 -3.981
422 HG13 VAL 59 3HG1 VAL 59 16.174 7.326 -5.132
423 HG21 VAL 59 1HG2 VAL 59 15.607 9.631 -4.253
424 HG22 VAL 59 2HG2 VAL 59 15.463 9.887 -2.494
425 HG23 VAL 59 3HG2 VAL 59 17.050 9.560 -3.213
426 H GLU 60 H GLU 60 13.958 5.766 -5.081
427 HA GLU 60 HA GLU 60 13.581 3.531 -3.143
428 HB2 GLU 60 2HB GLU 60 11.446 4.305 -4.056
429 HB3 GLU 60 3HB GLU 60 12.037 4.048 -5.710
430 HG2 GLU 60 2HG GLU 60 12.161 1.691 -5.423
431 HG3 GLU 60 3HG GLU 60 12.048 1.816 -3.657
432 H PHE 61 H PHE 61 15.112 2.095 -3.302
433 HA PHE 61 HA PHE 61 16.710 1.946 -5.758
434 HB2 PHE 61 2HB PHE 61 17.105 0.964 -2.937
435 HB3 PHE 61 3HB PHE 61 18.132 0.427 -4.266
436 HD1 PHE 61 HD1 PHE 61 16.918 3.560 -2.598
437 HD2 PHE 61 HD2 PHE 61 20.003 1.642 -4.898
438 HE1 PHE 61 HE1 PHE 61 18.343 5.578 -2.374
439 HE2 PHE 61 HE2 PHE 61 21.430 3.658 -4.664
440 HZ PHE 61 HZ PHE 61 20.598 5.629 -3.405
441 H GLU 62 H GLU 62 17.452 -0.085 -6.669
442 HA GLU 62 HA GLU 62 15.364 -2.089 -6.893
443 HB2 GLU 62 2HB GLU 62 16.792 -1.576 -8.789
444 HB3 GLU 62 3HB GLU 62 18.255 -1.953 -7.851
445 HG2 GLU 62 2HG GLU 62 17.598 -4.296 -7.672
446 HG3 GLU 62 3HG GLU 62 16.045 -3.952 -8.463
447 H ASP 63 H ASP 63 18.270 -1.570 -4.954
448 HA ASP 63 HA ASP 63 17.469 -3.729 -3.190
449 HB2 ASP 63 2HB ASP 63 19.784 -4.768 -3.217
450 HB3 ASP 63 3HB ASP 63 18.749 -5.098 -4.609
451 HA PRO 64 HA PRO 64 19.098 -0.954 -0.226
452 HB2 PRO 64 2HB PRO 64 19.699 -2.625 1.874
453 HB3 PRO 64 3HB PRO 64 18.021 -2.233 1.375
454 HG2 PRO 64 2HG PRO 64 19.674 -4.677 0.695
455 HG3 PRO 64 3HG PRO 64 17.957 -4.598 1.206
456 HD2 PRO 64 2HD PRO 64 18.719 -4.836 -1.408
457 HD3 PRO 64 3HD PRO 64 17.250 -3.937 -0.919
458 H ARG 65 H ARG 65 21.042 -3.292 -1.783
459 HA ARG 65 HA ARG 65 23.447 -3.128 -0.259
460 HB2 ARG 65 2HB ARG 65 22.990 -4.921 -1.852
461 HB3 ARG 65 3HB ARG 65 22.932 -3.757 -3.192
462 HG2 ARG 65 2HG ARG 65 25.311 -3.180 -2.804
463 HG3 ARG 65 3HG ARG 65 25.372 -4.324 -1.442
464 HD2 ARG 65 2HD ARG 65 24.723 -5.041 -4.335
465 HD3 ARG 65 3HD ARG 65 26.296 -5.258 -3.565
466 HE ARG 65 HE ARG 65 25.306 -6.904 -2.061
467 HH11 ARG 65 1HH1 ARG 65 23.300 -5.948 -4.823
468 HH12 ARG 65 2HH1 ARG 65 22.345 -7.408 -4.778
469 HH21 ARG 65 1HH2 ARG 65 24.039 -8.805 -2.039
470 HH22 ARG 65 2HH2 ARG 65 22.758 -9.017 -3.210
471 H ASP 66 H ASP 66 22.179 -1.168 -2.980
472 HA ASP 66 HA ASP 66 24.617 0.489 -2.876
473 HB2 ASP 66 2HB ASP 66 22.293 0.360 -4.809
474 HB3 ASP 66 3HB ASP 66 23.532 1.620 -4.870
475 H ALA 67 H ALA 67 21.399 0.495 -1.626
476 HA ALA 67 HA ALA 67 21.013 3.332 -1.482
477 HB1 ALA 67 1HB ALA 67 19.308 2.748 0.193
478 HB2 ALA 67 2HB ALA 67 19.207 1.647 -1.202
479 HB3 ALA 67 3HB ALA 67 19.965 1.104 0.315
480 H GLU 68 H GLU 68 22.909 1.017 0.398
481 HA GLU 68 HA GLU 68 23.253 2.668 2.727
482 HB2 GLU 68 2HB GLU 68 23.625 0.247 2.746
483 HB3 GLU 68 3HB GLU 68 24.931 0.415 1.549
484 HG2 GLU 68 2HG GLU 68 26.265 1.726 3.137
485 HG3 GLU 68 3HG GLU 68 24.940 1.692 4.312
486 H ASP 69 H ASP 69 24.826 2.513 -0.452
487 HA ASP 69 HA ASP 69 27.110 4.092 0.376
488 HB2 ASP 69 2HB ASP 69 26.036 3.295 -2.348
489 HB3 ASP 69 3HB ASP 69 27.503 4.246 -2.104
490 H ALA 70 H ALA 70 23.976 4.793 -1.181
491 HA ALA 70 HA ALA 70 24.570 7.569 -1.681
492 HB1 ALA 70 1HB ALA 70 21.915 6.119 -1.326
493 HB2 ALA 70 2HB ALA 70 22.143 7.730 -2.051
494 HB3 ALA 70 3HB ALA 70 22.801 6.291 -2.858
495 H VAL 71 H VAL 71 23.445 5.707 1.110
496 HA VAL 71 HA VAL 71 22.528 8.043 2.592
497 HB VAL 71 HB VAL 71 23.084 5.120 3.223
498 HG11 VAL 71 1HG1 VAL 71 22.275 7.293 5.199
499 HG12 VAL 71 2HG1 VAL 71 22.188 5.546 5.509
500 HG13 VAL 71 3HG1 VAL 71 23.764 6.323 5.242
501 HG21 VAL 71 1HG2 VAL 71 20.979 5.803 2.031
502 HG22 VAL 71 2HG2 VAL 71 20.667 5.087 3.633
503 HG23 VAL 71 3HG2 VAL 71 20.573 6.848 3.404
504 H SER 72 H SER 72 25.435 5.887 2.647
505 HA SER 72 HA SER 72 26.692 7.410 4.759
506 HB2 SER 72 2HB SER 72 27.801 5.344 2.825
507 HB3 SER 72 3HB SER 72 28.649 5.975 4.252
508 HG SER 72 HG SER 72 26.230 4.506 4.186
509 H GLY 73 H GLY 73 26.237 8.139 1.485
510 HA2 GLY 73 2HA GLY 73 28.894 9.404 1.161
511 HA3 GLY 73 3HA GLY 73 27.700 9.087 -0.107
512 H ARG 74 H ARG 74 25.785 10.361 2.272
513 HA ARG 74 HA ARG 74 26.455 13.174 1.710
514 HB2 ARG 74 2HB ARG 74 25.297 12.392 -0.324
515 HB3 ARG 74 3HB ARG 74 23.912 11.878 0.649
516 HG2 ARG 74 2HG ARG 74 23.519 14.062 -0.452
517 HG3 ARG 74 3HG ARG 74 23.451 14.189 1.309
518 HD2 ARG 74 2HD ARG 74 24.710 16.068 0.312
519 HD3 ARG 74 3HD ARG 74 25.743 15.081 1.361
520 HE ARG 74 HE ARG 74 25.727 14.535 -1.563
521 HH11 ARG 74 1HH1 ARG 74 27.406 15.849 1.255
522 HH12 ARG 74 2HH1 ARG 74 28.971 15.840 0.472
523 HH21 ARG 74 1HH2 ARG 74 27.780 14.549 -2.568
524 HH22 ARG 74 2HH2 ARG 74 29.177 15.119 -1.687
525 H ASP 75 H ASP 75 24.888 10.781 3.670
526 HA ASP 75 HA ASP 75 22.919 12.464 4.886
527 HB2 ASP 75 2HB ASP 75 22.974 9.967 5.000
528 HB3 ASP 75 3HB ASP 75 24.399 10.073 6.047
529 H GLY 76 H GLY 76 22.998 13.800 6.671
530 HA2 GLY 76 2HA GLY 76 23.844 15.039 8.377
531 HA3 GLY 76 3HA GLY 76 25.037 13.757 8.632
532 H TYR 77 H TYR 77 24.522 16.015 5.823
533 HA TYR 77 HA TYR 77 27.415 16.544 6.000
534 HB2 TYR 77 2HB TYR 77 27.052 15.481 4.000
535 HB3 TYR 77 3HB TYR 77 25.561 16.369 3.672
536 HD1 TYR 77 HD1 TYR 77 25.575 18.217 2.247
537 HD2 TYR 77 HD2 TYR 77 29.251 16.910 4.066
538 HE1 TYR 77 HE1 TYR 77 26.830 19.866 0.883
539 HE2 TYR 77 HE2 TYR 77 30.514 18.563 2.707
540 HH TYR 77 HH TYR 77 28.883 20.757 0.388
541 H ASP 78 H ASP 78 28.346 18.450 5.994
542 HA ASP 78 HA ASP 78 26.921 20.552 7.252
543 HB2 ASP 78 2HB ASP 78 29.214 20.272 7.747
544 HB3 ASP 78 3HB ASP 78 29.676 20.321 6.040
545 H TYR 79 H TYR 79 25.376 21.682 6.348
546 HA TYR 79 HA TYR 79 25.907 22.936 3.703
547 HB2 TYR 79 2HB TYR 79 24.109 21.398 3.506
548 HB3 TYR 79 3HB TYR 79 23.338 22.000 4.973
549 HD1 TYR 79 HD1 TYR 79 23.879 22.571 1.394
550 HD2 TYR 79 HD2 TYR 79 22.154 24.147 4.995
551 HE1 TYR 79 HE1 TYR 79 22.492 24.129 0.037
552 HE2 TYR 79 HE2 TYR 79 20.743 25.696 3.653
553 HH TYR 79 HH TYR 79 20.901 25.787 0.073
554 H ASP 80 H ASP 80 24.678 25.052 3.420
555 HA ASP 80 HA ASP 80 25.696 26.894 5.288
556 HB2 ASP 80 2HB ASP 80 25.359 27.572 3.040
557 HB3 ASP 80 3HB ASP 80 23.646 27.132 3.091
558 H GLY 81 H GLY 81 25.099 26.679 7.396
559 HA2 GLY 81 2HA GLY 81 23.832 27.337 9.210
560 HA3 GLY 81 3HA GLY 81 22.497 27.757 8.116
561 H TYR 82 H TYR 82 23.232 24.689 7.179
562 HA TYR 82 HA TYR 82 21.668 23.352 9.304
563 HB2 TYR 82 2HB TYR 82 20.827 23.515 6.400
564 HB3 TYR 82 3HB TYR 82 20.158 22.375 7.566
565 HD1 TYR 82 HD1 TYR 82 18.589 23.069 9.265
566 HD2 TYR 82 HD2 TYR 82 20.425 25.938 6.645
567 HE1 TYR 82 HE1 TYR 82 16.944 24.779 9.997
568 HE2 TYR 82 HE2 TYR 82 18.780 27.656 7.365
569 HH TYR 82 HH TYR 82 16.969 28.116 8.690
570 H ARG 83 H ARG 83 21.139 20.960 8.109
571 HA ARG 83 HA ARG 83 23.709 19.848 7.145
572 HB2 ARG 83 2HB ARG 83 23.886 19.804 9.594
573 HB3 ARG 83 3HB ARG 83 22.312 18.987 9.710
574 HG2 ARG 83 2HG ARG 83 23.199 17.051 8.486
575 HG3 ARG 83 3HG ARG 83 24.761 17.888 8.277
576 HD2 ARG 83 2HD ARG 83 24.920 16.313 10.139
577 HD3 ARG 83 3HD ARG 83 25.028 17.967 10.745
578 HE ARG 83 HE ARG 83 22.578 16.231 10.891
579 HH11 ARG 83 1HH1 ARG 83 24.615 18.808 12.199
580 HH12 ARG 83 2HH1 ARG 83 23.629 19.026 13.625
581 HH21 ARG 83 1HH2 ARG 83 21.304 16.541 12.740
582 HH22 ARG 83 2HH2 ARG 83 21.749 17.748 13.926
583 H LEU 84 H LEU 84 23.369 18.294 5.673
584 HA LEU 84 HA LEU 84 20.743 17.790 4.677
585 HB2 LEU 84 2HB LEU 84 23.496 16.620 4.201
586 HB3 LEU 84 3HB LEU 84 22.078 15.849 3.487
587 HG LEU 84 HG LEU 84 23.178 17.396 1.926
588 HD11 LEU 84 1HD1 LEU 84 21.187 18.546 1.172
589 HD12 LEU 84 2HD1 LEU 84 20.732 16.946 1.795
590 HD13 LEU 84 3HD1 LEU 84 20.433 18.409 2.769
591 HD21 LEU 84 1HD2 LEU 84 23.969 19.050 3.631
592 HD22 LEU 84 2HD2 LEU 84 23.120 19.802 2.264
593 HD23 LEU 84 3HD2 LEU 84 22.289 19.614 3.818
594 H ARG 85 H ARG 85 19.481 15.906 4.671
595 HA ARG 85 HA ARG 85 20.278 13.767 6.600
596 HB2 ARG 85 2HB ARG 85 17.491 14.924 6.201
597 HB3 ARG 85 3HB ARG 85 17.922 13.528 7.224
598 HG2 ARG 85 2HG ARG 85 19.470 15.017 8.514
599 HG3 ARG 85 3HG ARG 85 18.868 16.402 7.578
600 HD2 ARG 85 2HD ARG 85 17.132 14.551 9.265
601 HD3 ARG 85 3HD ARG 85 17.749 16.119 9.807
602 HE ARG 85 HE ARG 85 15.548 15.636 7.944
603 HH11 ARG 85 1HH1 ARG 85 17.975 17.969 9.029
604 HH12 ARG 85 2HH1 ARG 85 17.026 19.353 8.537
605 HH21 ARG 85 1HH2 ARG 85 14.314 17.462 7.373
606 HH22 ARG 85 2HH2 ARG 85 14.976 19.068 7.565
607 H VAL 86 H VAL 86 20.538 11.922 5.643
608 HA VAL 86 HA VAL 86 18.772 11.160 3.401
609 HB VAL 86 HB VAL 86 21.799 10.947 3.231
610 HG11 VAL 86 1HG1 VAL 86 21.324 10.284 0.896
611 HG12 VAL 86 2HG1 VAL 86 20.565 9.165 2.042
612 HG13 VAL 86 3HG1 VAL 86 19.578 10.399 1.220
613 HG21 VAL 86 1HG2 VAL 86 21.172 13.299 2.988
614 HG22 VAL 86 2HG2 VAL 86 21.604 12.624 1.402
615 HG23 VAL 86 3HG2 VAL 86 19.893 12.860 1.827
616 H GLU 87 H GLU 87 17.832 9.807 5.026
617 HA GLU 87 HA GLU 87 19.439 7.370 5.565
618 HB2 GLU 87 2HB GLU 87 18.810 7.397 7.937
619 HB3 GLU 87 3HB GLU 87 19.739 8.852 7.519
620 HG2 GLU 87 2HG GLU 87 17.679 10.176 7.386
621 HG3 GLU 87 3HG GLU 87 16.697 8.724 7.648
622 H PHE 88 H PHE 88 18.135 5.567 6.434
623 HA PHE 88 HA PHE 88 15.735 5.295 4.893
624 HB2 PHE 88 2HB PHE 88 17.064 3.395 5.021
625 HB3 PHE 88 3HB PHE 88 17.272 3.535 6.762
626 HD1 PHE 88 HD1 PHE 88 15.083 2.334 4.083
627 HD2 PHE 88 HD2 PHE 88 15.540 2.792 8.330
628 HE1 PHE 88 HE1 PHE 88 13.260 0.694 4.454
629 HE2 PHE 88 HE2 PHE 88 13.720 1.139 8.705
630 HZ PHE 88 HZ PHE 88 12.581 0.091 6.769
631 HA PRO 89 HA PRO 89 12.783 6.784 7.787
632 HB2 PRO 89 2HB PRO 89 10.496 5.680 6.724
633 HB3 PRO 89 3HB PRO 89 11.359 7.069 5.996
634 HG2 PRO 89 2HG PRO 89 11.512 4.152 5.222
635 HG3 PRO 89 3HG PRO 89 11.403 5.595 4.156
636 HD2 PRO 89 2HD PRO 89 13.776 4.328 4.694
637 HD3 PRO 89 3HD PRO 89 13.675 6.099 4.439
638 H5' A 90 1H5* A 90 4.319 16.635 9.927
639 H5'' A 90 2H5* A 90 3.462 16.318 11.444
640 H4' A 90 H4* A 90 4.175 19.079 10.336
641 H3' A 90 H3* A 90 5.985 17.406 11.466
642 H2' A 90 1H2* A 90 4.958 16.738 13.426
643 HO2' A 90 2HO* A 90 5.789 19.373 14.068
644 H1' A 90 H1* A 90 3.352 19.053 14.155
645 H8 A 90 H8 A 90 3.683 15.966 15.075
646 H61 A 90 1H6 A 90 -2.011 14.076 13.544
647 H62 A 90 2H6 A 90 -0.577 13.710 14.484
648 H2 A 90 H2 A 90 -1.191 17.882 11.375
649 HO5' A 90 H5T A 90 1.720 17.576 10.578
650 H5' A 91 1H5* A 91 8.393 17.694 9.709
651 H5'' A 91 2H5* A 91 8.183 17.397 11.449
652 H4' A 91 H4* A 91 10.734 18.525 10.214
653 H3' A 91 H3* A 91 9.772 15.834 10.014
654 H2' A 91 1H2* A 91 10.248 15.261 12.227
655 HO2' A 91 2HO* A 91 12.780 15.247 10.936
656 H1' A 91 H1* A 91 12.530 17.258 12.239
657 H8 A 91 H8 A 91 13.569 16.501 14.525
658 H61 A 91 1H6 A 91 9.289 15.663 18.933
659 H62 A 91 2H6 A 91 11.010 15.720 18.596
660 H2 A 91 H2 A 91 7.185 16.489 15.107
661 H5' C 92 1H5* C 92 10.529 15.565 5.465
662 H5'' C 92 2H5* C 92 9.132 16.267 6.304
663 H4' C 92 H4* C 92 8.449 14.171 5.276
664 H3' C 92 H3* C 92 8.121 14.725 8.007
665 H2' C 92 1H2* C 92 9.791 13.239 8.741
666 HO2' C 92 2HO* C 92 7.789 12.404 9.562
667 H1' C 92 H1* C 92 9.005 11.362 6.479
668 H41 C 92 1H4 C 92 14.222 8.269 8.403
669 H42 C 92 2H4 C 92 14.913 9.719 9.103
670 H5 C 92 H5 C 92 13.788 11.897 9.022
671 H6 C 92 H6 C 92 11.786 13.056 8.274
672 H5' A 93 1H5* A 93 5.512 14.287 3.462
673 H5'' A 93 2H5* A 93 3.932 14.478 4.228
674 H4' A 93 H4* A 93 3.747 13.068 2.224
675 H3' A 93 H3* A 93 2.838 12.351 4.857
676 H2' A 93 1H2* A 93 4.158 10.453 5.025
677 HO2' A 93 2HO* A 93 2.070 9.680 3.249
678 H1' A 93 H1* A 93 4.069 10.141 2.009
679 H8 A 93 H8 A 93 5.661 9.244 5.300
680 H61 A 93 1H6 A 93 9.251 5.368 2.052
681 H62 A 93 2H6 A 93 8.754 5.858 3.656
682 H2 A 93 H2 A 93 7.061 7.989 -0.819
683 H5' A 94 1H5* A 94 0.743 15.079 5.008
684 H5'' A 94 2H5* A 94 1.730 13.733 5.611
685 H4' A 94 H4* A 94 -1.207 14.119 6.328
686 H3' A 94 H3* A 94 0.985 15.726 7.211
687 H2' A 94 1H2* A 94 1.917 14.065 8.570
688 HO2' A 94 2HO* A 94 1.138 15.636 10.048
689 H1' A 94 H1* A 94 -0.886 13.001 9.062
690 H8 A 94 H8 A 94 -0.386 11.293 10.960
691 H61 A 94 1H6 A 94 4.896 8.163 10.115
692 H62 A 94 2H6 A 94 3.472 8.328 11.118
693 H2 A 94 H2 A 94 4.554 11.207 6.878
694 H5' A 95 1H5* A 95 0.019 18.143 9.264
695 H5'' A 95 2H5* A 95 -1.180 19.335 8.720
696 H4' A 95 H4* A 95 1.772 19.329 7.911
697 H3' A 95 H3* A 95 1.010 19.953 10.409
698 HO3' A 95 H3T A 95 2.564 21.677 10.296
699 H2' A 95 1H2* A 95 -0.813 21.353 10.045
700 HO2' A 95 2HO* A 95 0.706 22.789 10.970
701 H1' A 95 H1* A 95 0.034 22.810 7.653
702 H8 A 95 H8 A 95 -2.621 22.551 9.529
703 H61 A 95 1H6 A 95 -6.374 20.127 5.236
704 H62 A 95 2H6 A 95 -6.300 20.932 6.790
705 H2 A 95 H2 A 95 -2.178 19.633 3.833
Start of MODEL 6
1 H VAL 6 H1 VAL 6 -1.917 1.347 -4.779
2 HA VAL 6 HA VAL 6 -3.022 4.050 -4.669
3 HB VAL 6 HB VAL 6 -2.555 4.133 -2.347
4 HG11 VAL 6 1HG1 VAL 6 -4.034 2.423 -1.450
5 HG12 VAL 6 2HG1 VAL 6 -4.678 2.987 -3.004
6 HG13 VAL 6 3HG1 VAL 6 -3.836 1.418 -2.897
7 HG21 VAL 6 1HG2 VAL 6 -0.450 2.844 -2.290
8 HG22 VAL 6 2HG2 VAL 6 -1.599 2.231 -1.090
9 HG23 VAL 6 3HG2 VAL 6 -1.353 1.343 -2.609
10 H ILE 7 H ILE 7 -1.445 5.691 -3.983
11 HA ILE 7 HA ILE 7 0.912 5.495 -5.633
12 HB ILE 7 HB ILE 7 1.261 7.773 -5.072
13 HG12 ILE 7 2HG1 ILE 7 -0.554 7.352 -2.662
14 HG13 ILE 7 3HG1 ILE 7 1.205 7.559 -2.620
15 HG21 ILE 7 1HG2 ILE 7 -1.756 7.386 -4.889
16 HG22 ILE 7 2HG2 ILE 7 -0.879 8.790 -5.537
17 HG23 ILE 7 3HG2 ILE 7 -0.814 7.242 -6.392
18 HD11 ILE 7 1HD1 ILE 7 -0.827 9.624 -3.552
19 HD12 ILE 7 2HD1 ILE 7 0.159 9.680 -2.077
20 HD13 ILE 7 3HD1 ILE 7 0.941 9.815 -3.669
21 H ARG 8 H ARG 8 3.103 6.112 -4.762
22 HA ARG 8 HA ARG 8 3.947 4.227 -2.764
23 HB2 ARG 8 2HB ARG 8 5.414 4.844 -4.584
24 HB3 ARG 8 3HB ARG 8 5.308 6.564 -4.156
25 HG2 ARG 8 2HG ARG 8 6.405 6.071 -1.964
26 HG3 ARG 8 3HG ARG 8 6.591 4.377 -2.462
27 HD2 ARG 8 2HD ARG 8 7.704 6.783 -3.975
28 HD3 ARG 8 3HD ARG 8 8.626 5.819 -2.821
29 HE ARG 8 HE ARG 8 8.608 3.963 -4.318
30 HH11 ARG 8 1HH1 ARG 8 7.052 6.832 -5.689
31 HH12 ARG 8 2HH1 ARG 8 7.128 6.222 -7.326
32 HH21 ARG 8 1HH2 ARG 8 8.719 3.222 -6.426
33 HH22 ARG 8 2HH2 ARG 8 8.067 4.159 -7.750
34 H GLY 9 H GLY 9 4.387 4.455 -0.628
35 HA2 GLY 9 2HA GLY 9 5.286 5.918 1.126
36 HA3 GLY 9 3HA GLY 9 4.214 7.195 0.548
37 HA PRO 10 HA PRO 10 0.915 5.927 3.197
38 HB2 PRO 10 2HB PRO 10 -0.845 5.197 0.888
39 HB3 PRO 10 3HB PRO 10 -1.162 6.336 2.236
40 HG2 PRO 10 2HG PRO 10 -0.534 7.235 -0.265
41 HG3 PRO 10 3HG PRO 10 0.094 8.052 1.205
42 HD2 PRO 10 2HD PRO 10 1.495 6.107 -0.630
43 HD3 PRO 10 3HD PRO 10 2.127 7.591 0.160
44 H ALA 11 H ALA 11 2.271 3.634 1.054
45 HA ALA 11 HA ALA 11 1.278 1.433 2.739
46 HB1 ALA 11 1HB ALA 11 -0.349 1.532 0.907
47 HB2 ALA 11 2HB ALA 11 0.968 1.475 -0.290
48 HB3 ALA 11 3HB ALA 11 0.657 0.076 0.767
49 H GLY 12 H GLY 12 2.541 -0.507 2.545
50 HA2 GLY 12 2HA GLY 12 5.360 0.097 2.062
51 HA3 GLY 12 3HA GLY 12 4.686 -1.372 2.811
52 H ASN 13 H ASN 13 3.371 -0.240 -0.250
53 HA ASN 13 HA ASN 13 3.924 -2.778 -1.477
54 HB2 ASN 13 2HB ASN 13 2.812 -0.181 -2.597
55 HB3 ASN 13 3HB ASN 13 2.817 -1.730 -3.445
56 HD21 ASN 13 1HD2 ASN 13 -0.532 -1.305 -1.871
57 HD22 ASN 13 2HD2 ASN 13 0.430 -0.442 -3.052
58 H ASN 14 H ASN 14 6.100 -0.370 -0.905
59 HA ASN 14 HA ASN 14 7.639 -1.083 -3.349
60 HB2 ASN 14 2HB ASN 14 7.262 1.681 -2.148
61 HB3 ASN 14 3HB ASN 14 8.518 1.278 -3.330
62 HD21 ASN 14 1HD2 ASN 14 6.417 1.530 -6.113
63 HD22 ASN 14 2HD2 ASN 14 8.035 1.379 -5.455
64 H ASP 15 H ASP 15 9.756 -1.512 -3.049
65 HA ASP 15 HA ASP 15 10.771 -1.437 -0.249
66 HB2 ASP 15 2HB ASP 15 11.359 -3.375 -2.514
67 HB3 ASP 15 3HB ASP 15 12.161 -3.382 -0.940
68 H CYS 16 H CYS 16 13.324 -1.663 -0.328
69 HA CYS 16 HA CYS 16 15.292 -0.616 -0.689
70 HB2 CYS 16 2HB CYS 16 14.291 -0.653 -3.564
71 HB3 CYS 16 3HB CYS 16 15.962 -0.300 -3.074
72 HG CYS 16 HG CYS 16 15.787 -2.746 -3.969
73 H ARG 17 H ARG 17 12.699 1.073 -0.342
74 HA ARG 17 HA ARG 17 13.374 3.617 -1.554
75 HB2 ARG 17 2HB ARG 17 11.382 2.712 0.532
76 HB3 ARG 17 3HB ARG 17 11.637 4.434 0.176
77 HG2 ARG 17 2HG ARG 17 11.128 4.075 -2.191
78 HG3 ARG 17 3HG ARG 17 10.893 2.336 -1.899
79 HD2 ARG 17 2HD ARG 17 9.286 4.564 -0.571
80 HD3 ARG 17 3HD ARG 17 8.745 3.622 -1.972
81 HE ARG 17 HE ARG 17 9.110 1.586 -0.413
82 HH11 ARG 17 1HH1 ARG 17 8.007 4.762 0.689
83 HH12 ARG 17 2HH1 ARG 17 7.113 4.107 2.038
84 HH21 ARG 17 1HH2 ARG 17 7.956 0.767 1.339
85 HH22 ARG 17 2HH2 ARG 17 7.095 1.847 2.417
86 H ILE 18 H ILE 18 14.138 5.478 -0.591
87 HA ILE 18 HA ILE 18 15.051 5.332 2.221
88 HB ILE 18 HB ILE 18 17.117 6.467 1.716
89 HG12 ILE 18 2HG1 ILE 18 16.675 6.124 -1.254
90 HG13 ILE 18 3HG1 ILE 18 16.113 7.586 -0.419
91 HG21 ILE 18 1HG2 ILE 18 16.839 4.039 -0.101
92 HG22 ILE 18 2HG2 ILE 18 18.341 4.671 0.612
93 HG23 ILE 18 3HG2 ILE 18 17.081 3.986 1.658
94 HD11 ILE 18 1HD1 ILE 18 18.365 8.047 0.413
95 HD12 ILE 18 2HD1 ILE 18 18.978 6.562 -0.341
96 HD13 ILE 18 3HD1 ILE 18 18.377 7.888 -1.361
97 H TYR 19 H TYR 19 15.741 7.712 2.828
98 HA TYR 19 HA TYR 19 13.708 9.553 1.728
99 HB2 TYR 19 2HB TYR 19 12.584 9.052 3.602
100 HB3 TYR 19 3HB TYR 19 14.023 8.650 4.527
101 HD1 TYR 19 HD1 TYR 19 11.640 11.282 3.718
102 HD2 TYR 19 HD2 TYR 19 15.482 10.441 5.465
103 HE1 TYR 19 HE1 TYR 19 11.579 13.462 4.919
104 HE2 TYR 19 HE2 TYR 19 15.437 12.634 6.628
105 HH TYR 19 HH TYR 19 14.296 14.592 6.951
106 H VAL 20 H VAL 20 14.005 11.742 1.794
107 HA VAL 20 HA VAL 20 16.745 12.648 2.438
108 HB VAL 20 HB VAL 20 15.310 13.351 -0.144
109 HG11 VAL 20 1HG1 VAL 20 16.883 15.058 0.646
110 HG12 VAL 20 2HG1 VAL 20 18.146 13.822 0.850
111 HG13 VAL 20 3HG1 VAL 20 17.547 14.221 -0.777
112 HG21 VAL 20 1HG2 VAL 20 17.001 11.920 -1.263
113 HG22 VAL 20 2HG2 VAL 20 17.584 11.384 0.333
114 HG23 VAL 20 3HG2 VAL 20 15.935 10.979 -0.218
115 H GLY 21 H GLY 21 16.907 14.749 3.192
116 HA2 GLY 21 2HA GLY 21 14.509 16.464 3.200
117 HA3 GLY 21 3HA GLY 21 15.071 15.872 4.770
118 H ASN 22 H ASN 22 15.099 18.422 4.778
119 HA ASN 22 HA ASN 22 16.225 20.371 4.857
120 HB2 ASN 22 2HB ASN 22 17.794 18.944 6.201
121 HB3 ASN 22 3HB ASN 22 18.745 18.678 4.732
122 HD21 ASN 22 1HD2 ASN 22 20.638 21.556 5.297
123 HD22 ASN 22 2HD2 ASN 22 20.569 19.866 4.846
124 H LEU 23 H LEU 23 15.582 19.044 2.182
125 HA LEU 23 HA LEU 23 17.597 19.922 0.330
126 HB2 LEU 23 2HB LEU 23 14.624 19.353 0.005
127 HB3 LEU 23 3HB LEU 23 15.734 19.651 -1.344
128 HG LEU 23 HG LEU 23 16.085 17.415 0.702
129 HD11 LEU 23 1HD1 LEU 23 14.966 17.347 -2.130
130 HD12 LEU 23 2HD1 LEU 23 15.267 15.930 -1.102
131 HD13 LEU 23 3HD1 LEU 23 14.024 17.117 -0.643
132 HD21 LEU 23 1HD2 LEU 23 17.643 16.533 -1.050
133 HD22 LEU 23 2HD2 LEU 23 17.392 18.017 -1.995
134 HD23 LEU 23 3HD2 LEU 23 18.183 18.093 -0.400
135 HA PRO 24 HA PRO 24 16.723 24.242 0.326
136 HB2 PRO 24 2HB PRO 24 17.633 24.964 -2.165
137 HB3 PRO 24 3HB PRO 24 18.722 24.502 -0.820
138 HG2 PRO 24 2HG PRO 24 17.746 22.801 -3.126
139 HG3 PRO 24 3HG PRO 24 19.406 22.919 -2.447
140 HD2 PRO 24 2HD PRO 24 17.655 20.896 -1.796
141 HD3 PRO 24 3HD PRO 24 18.864 21.530 -0.639
142 HA PRO 25 HA PRO 25 12.784 24.837 -1.637
143 HB2 PRO 25 2HB PRO 25 13.636 27.631 -2.264
144 HB3 PRO 25 3HB PRO 25 12.209 27.066 -1.339
145 HG2 PRO 25 2HG PRO 25 14.386 28.172 -0.099
146 HG3 PRO 25 3HG PRO 25 13.475 26.818 0.637
147 HD2 PRO 25 2HD PRO 25 16.088 26.741 -0.867
148 HD3 PRO 25 3HD PRO 25 15.584 25.831 0.593
149 H ASP 26 H ASP 26 15.804 25.560 -3.262
150 HA ASP 26 HA ASP 26 14.552 25.939 -5.876
151 HB2 ASP 26 2HB ASP 26 17.436 25.869 -4.950
152 HB3 ASP 26 3HB ASP 26 16.945 26.096 -6.639
153 H ILE 27 H ILE 27 14.730 23.229 -4.170
154 HA ILE 27 HA ILE 27 16.182 21.395 -5.756
155 HB ILE 27 HB ILE 27 15.367 20.929 -3.476
156 HG12 ILE 27 2HG1 ILE 27 14.476 18.650 -3.822
157 HG13 ILE 27 3HG1 ILE 27 14.179 19.005 -5.530
158 HG21 ILE 27 1HG2 ILE 27 12.606 20.756 -4.767
159 HG22 ILE 27 2HG2 ILE 27 13.002 20.404 -3.073
160 HG23 ILE 27 3HG2 ILE 27 13.150 22.064 -3.692
161 HD11 ILE 27 1HD1 ILE 27 16.616 19.364 -5.875
162 HD12 ILE 27 2HD1 ILE 27 16.902 19.077 -4.144
163 HD13 ILE 27 3HD1 ILE 27 16.308 17.759 -5.181
164 H ARG 28 H ARG 28 15.538 19.908 -7.358
165 HA ARG 28 HA ARG 28 12.897 20.277 -8.624
166 HB2 ARG 28 2HB ARG 28 14.394 21.862 -9.781
167 HB3 ARG 28 3HB ARG 28 15.537 20.541 -10.112
168 HG2 ARG 28 2HG ARG 28 13.887 19.408 -11.515
169 HG3 ARG 28 3HG ARG 28 12.637 20.589 -11.056
170 HD2 ARG 28 2HD ARG 28 13.938 22.394 -12.112
171 HD3 ARG 28 3HD ARG 28 15.230 21.245 -12.506
172 HE ARG 28 HE ARG 28 12.521 20.662 -13.556
173 HH11 ARG 28 1HH1 ARG 28 15.755 21.938 -14.170
174 HH12 ARG 28 2HH1 ARG 28 15.634 21.740 -15.905
175 HH21 ARG 28 1HH2 ARG 28 12.385 20.409 -15.821
176 HH22 ARG 28 2HH2 ARG 28 13.730 20.879 -16.832
177 H THR 29 H THR 29 12.278 18.438 -9.935
178 HA THR 29 HA THR 29 12.960 16.053 -8.662
179 HB THR 29 HB THR 29 11.759 16.014 -11.405
180 HG1 THR 29 1HG THR 29 9.830 16.708 -10.465
181 HG21 THR 29 1HG2 THR 29 11.984 13.907 -10.149
182 HG22 THR 29 2HG2 THR 29 11.136 14.632 -8.758
183 HG23 THR 29 3HG2 THR 29 10.272 14.363 -10.289
184 H LYS 30 H LYS 30 14.518 17.473 -11.477
185 HA LYS 30 HA LYS 30 15.701 14.937 -12.305
186 HB2 LYS 30 2HB LYS 30 16.906 16.294 -13.926
187 HB3 LYS 30 3HB LYS 30 15.184 16.686 -13.949
188 HG2 LYS 30 2HG LYS 30 15.505 18.815 -13.163
189 HG3 LYS 30 3HG LYS 30 16.858 18.358 -12.108
190 HD2 LYS 30 2HD LYS 30 17.050 18.475 -15.146
191 HD3 LYS 30 3HD LYS 30 17.513 19.813 -14.076
192 HE2 LYS 30 2HE LYS 30 18.664 17.007 -13.821
193 HE3 LYS 30 3HE LYS 30 19.413 18.280 -14.800
194 HZ1 LYS 30 1HZ LYS 30 19.656 19.598 -12.842
195 HZ2 LYS 30 2HZ LYS 30 18.854 18.505 -11.913
196 HZ3 LYS 30 3HZ LYS 30 20.314 18.114 -12.568
197 H ASP 31 H ASP 31 16.448 17.258 -9.842
198 HA ASP 31 HA ASP 31 19.319 16.937 -9.924
199 HB2 ASP 31 2HB ASP 31 17.451 17.763 -7.671
200 HB3 ASP 31 3HB ASP 31 19.216 17.880 -7.636
201 H ILE 32 H ILE 32 16.644 15.091 -8.600
202 HA ILE 32 HA ILE 32 18.342 13.331 -7.019
203 HB ILE 32 HB ILE 32 15.461 13.149 -7.981
204 HG12 ILE 32 2HG1 ILE 32 16.678 13.861 -5.271
205 HG13 ILE 32 3HG1 ILE 32 15.984 15.015 -6.424
206 HG21 ILE 32 1HG2 ILE 32 16.926 11.449 -5.912
207 HG22 ILE 32 2HG2 ILE 32 15.199 11.342 -6.328
208 HG23 ILE 32 3HG2 ILE 32 16.415 10.890 -7.526
209 HD11 ILE 32 1HD1 ILE 32 13.793 13.821 -6.250
210 HD12 ILE 32 2HD1 ILE 32 14.497 12.784 -4.979
211 HD13 ILE 32 3HD1 ILE 32 14.339 14.528 -4.713
212 H GLU 33 H GLU 33 17.319 13.638 -10.365
213 HA GLU 33 HA GLU 33 17.959 10.866 -11.045
214 HB2 GLU 33 2HB GLU 33 17.423 13.315 -12.780
215 HB3 GLU 33 3HB GLU 33 17.613 11.658 -13.378
216 HG2 GLU 33 2HG GLU 33 15.692 10.936 -11.998
217 HG3 GLU 33 3HG GLU 33 15.482 12.594 -11.408
218 H ASP 34 H ASP 34 19.682 13.803 -10.523
219 HA ASP 34 HA ASP 34 22.033 12.854 -12.033
220 HB2 ASP 34 2HB ASP 34 21.488 15.407 -10.486
221 HB3 ASP 34 3HB ASP 34 23.032 15.016 -11.254
222 H VAL 35 H VAL 35 21.590 14.185 -8.707
223 HA VAL 35 HA VAL 35 24.108 13.172 -7.867
224 HB VAL 35 HB VAL 35 21.718 14.062 -6.204
225 HG11 VAL 35 1HG1 VAL 35 23.453 14.584 -4.502
226 HG12 VAL 35 2HG1 VAL 35 23.371 12.848 -4.864
227 HG13 VAL 35 3HG1 VAL 35 24.684 13.841 -5.551
228 HG21 VAL 35 1HG2 VAL 35 22.414 15.793 -7.821
229 HG22 VAL 35 2HG2 VAL 35 22.893 16.253 -6.176
230 HG23 VAL 35 3HG2 VAL 35 24.106 15.606 -7.307
231 H PHE 36 H PHE 36 20.768 12.045 -6.996
232 HA PHE 36 HA PHE 36 21.846 9.855 -5.519
233 HB2 PHE 36 2HB PHE 36 19.065 10.583 -6.375
234 HB3 PHE 36 3HB PHE 36 19.423 9.040 -5.599
235 HD1 PHE 36 HD1 PHE 36 19.297 12.693 -5.099
236 HD2 PHE 36 HD2 PHE 36 20.141 8.881 -3.296
237 HE1 PHE 36 HE1 PHE 36 19.295 13.755 -2.865
238 HE2 PHE 36 HE2 PHE 36 20.136 9.942 -1.057
239 HZ PHE 36 HZ PHE 36 19.708 12.378 -0.833
240 H SER 37 H SER 37 21.336 10.226 -8.905
241 HA SER 37 HA SER 37 21.116 7.402 -9.488
242 HB2 SER 37 2HB SER 37 20.351 9.084 -11.083
243 HB3 SER 37 3HB SER 37 21.990 9.777 -11.174
244 HG SER 37 HG SER 37 21.179 7.175 -11.971
245 H LYS 38 H LYS 38 23.783 9.728 -9.006
246 HA LYS 38 HA LYS 38 25.849 7.817 -9.723
247 HB2 LYS 38 2HB LYS 38 25.939 10.340 -8.015
248 HB3 LYS 38 3HB LYS 38 27.360 9.444 -8.581
249 HG2 LYS 38 2HG LYS 38 25.278 10.740 -10.396
250 HG3 LYS 38 3HG LYS 38 26.862 11.429 -10.000
251 HD2 LYS 38 2HD LYS 38 27.958 9.417 -10.992
252 HD3 LYS 38 3HD LYS 38 26.356 8.797 -11.460
253 HE2 LYS 38 2HE LYS 38 25.958 10.839 -12.804
254 HE3 LYS 38 3HE LYS 38 27.544 11.468 -12.333
255 HZ1 LYS 38 1HZ LYS 38 28.545 9.577 -13.422
256 HZ2 LYS 38 2HZ LYS 38 27.067 8.988 -13.846
257 HZ3 LYS 38 3HZ LYS 38 27.601 10.408 -14.480
258 H TYR 39 H TYR 39 23.961 8.497 -6.821
259 HA TYR 39 HA TYR 39 25.693 6.870 -5.157
260 HB2 TYR 39 2HB TYR 39 23.095 8.277 -4.678
261 HB3 TYR 39 3HB TYR 39 23.735 7.100 -3.519
262 HD1 TYR 39 HD1 TYR 39 23.965 10.497 -4.712
263 HD2 TYR 39 HD2 TYR 39 26.035 7.407 -2.548
264 HE1 TYR 39 HE1 TYR 39 25.532 12.193 -3.801
265 HE2 TYR 39 HE2 TYR 39 27.619 9.096 -1.644
266 HH TYR 39 HH TYR 39 28.223 11.312 -1.609
267 H GLY 40 H GLY 40 23.110 6.087 -7.319
268 HA2 GLY 40 2HA GLY 40 23.581 3.326 -7.116
269 HA3 GLY 40 3HA GLY 40 22.222 3.685 -6.037
270 H ALA 41 H ALA 41 21.825 2.000 -8.167
271 HA ALA 41 HA ALA 41 20.825 3.425 -10.487
272 HB1 ALA 41 1HB ALA 41 20.456 0.549 -9.539
273 HB2 ALA 41 2HB ALA 41 20.010 1.175 -11.142
274 HB3 ALA 41 3HB ALA 41 21.719 1.133 -10.646
275 H ILE 42 H ILE 42 19.133 4.779 -10.181
276 HA ILE 42 HA ILE 42 17.071 4.206 -8.203
277 HB ILE 42 HB ILE 42 17.377 6.381 -10.302
278 HG12 ILE 42 2HG1 ILE 42 17.784 6.399 -7.281
279 HG13 ILE 42 3HG1 ILE 42 19.077 6.379 -8.495
280 HG21 ILE 42 1HG2 ILE 42 15.369 6.098 -8.027
281 HG22 ILE 42 2HG2 ILE 42 15.575 7.548 -9.038
282 HG23 ILE 42 3HG2 ILE 42 14.997 6.049 -9.767
283 HD11 ILE 42 1HD1 ILE 42 18.162 8.529 -9.432
284 HD12 ILE 42 2HD1 ILE 42 17.035 8.596 -8.052
285 HD13 ILE 42 3HD1 ILE 42 18.782 8.656 -7.770
286 H ARG 43 H ARG 43 14.996 3.504 -8.533
287 HA ARG 43 HA ARG 43 14.233 2.744 -11.318
288 HB2 ARG 43 2HB ARG 43 13.113 1.843 -8.633
289 HB3 ARG 43 3HB ARG 43 12.571 1.279 -10.220
290 HG2 ARG 43 2HG ARG 43 15.398 0.903 -9.129
291 HG3 ARG 43 3HG ARG 43 14.102 -0.304 -9.056
292 HD2 ARG 43 2HD ARG 43 15.328 -0.930 -10.941
293 HD3 ARG 43 3HD ARG 43 13.937 -0.071 -11.612
294 HE ARG 43 HE ARG 43 15.837 1.904 -11.357
295 HH11 ARG 43 1HH1 ARG 43 15.795 -1.283 -12.892
296 HH12 ARG 43 2HH1 ARG 43 16.993 -0.844 -14.089
297 HH21 ARG 43 1HH2 ARG 43 17.371 2.451 -12.942
298 HH22 ARG 43 2HH2 ARG 43 17.879 1.267 -14.125
299 H ASP 44 H ASP 44 13.349 4.632 -8.459
300 HA ASP 44 HA ASP 44 11.592 6.266 -10.122
301 HB2 ASP 44 2HB ASP 44 10.549 4.456 -7.975
302 HB3 ASP 44 3HB ASP 44 9.825 6.056 -8.147
303 H ILE 45 H ILE 45 10.924 8.247 -9.261
304 HA ILE 45 HA ILE 45 12.437 9.135 -6.850
305 HB ILE 45 HB ILE 45 11.758 10.601 -9.441
306 HG12 ILE 45 2HG1 ILE 45 14.306 11.190 -8.977
307 HG13 ILE 45 3HG1 ILE 45 14.274 9.687 -8.039
308 HG21 ILE 45 1HG2 ILE 45 12.742 11.717 -6.785
309 HG22 ILE 45 2HG2 ILE 45 12.766 12.606 -8.327
310 HG23 ILE 45 3HG2 ILE 45 11.220 12.120 -7.620
311 HD11 ILE 45 1HD1 ILE 45 13.448 9.993 -10.970
312 HD12 ILE 45 2HD1 ILE 45 14.992 9.326 -10.401
313 HD13 ILE 45 3HD1 ILE 45 13.474 8.466 -10.061
314 H ASP 46 H ASP 46 11.324 10.563 -5.418
315 HA ASP 46 HA ASP 46 8.451 10.928 -5.918
316 HB2 ASP 46 2HB ASP 46 8.715 8.693 -4.873
317 HB3 ASP 46 3HB ASP 46 9.562 9.432 -3.512
318 H LEU 47 H LEU 47 10.239 12.934 -6.052
319 HA LEU 47 HA LEU 47 10.707 14.348 -3.619
320 HB2 LEU 47 2HB LEU 47 11.858 14.951 -5.655
321 HB3 LEU 47 3HB LEU 47 10.327 15.212 -6.507
322 HG LEU 47 HG LEU 47 9.815 17.129 -4.992
323 HD11 LEU 47 1HD1 LEU 47 12.648 16.617 -3.981
324 HD12 LEU 47 2HD1 LEU 47 11.667 18.059 -3.618
325 HD13 LEU 47 3HD1 LEU 47 11.151 16.466 -3.030
326 HD21 LEU 47 1HD2 LEU 47 10.921 17.456 -7.179
327 HD22 LEU 47 2HD2 LEU 47 11.476 18.651 -5.986
328 HD23 LEU 47 3HD2 LEU 47 12.511 17.266 -6.400
329 H LYS 48 H LYS 48 9.419 15.620 -2.344
330 HA LYS 48 HA LYS 48 6.663 16.196 -3.297
331 HB2 LYS 48 2HB LYS 48 7.668 15.139 -0.636
332 HB3 LYS 48 3HB LYS 48 6.134 16.004 -0.791
333 HG2 LYS 48 2HG LYS 48 5.422 14.325 -2.536
334 HG3 LYS 48 3HG LYS 48 6.909 13.410 -2.204
335 HD2 LYS 48 2HD LYS 48 6.251 13.164 0.165
336 HD3 LYS 48 3HD LYS 48 4.807 14.148 -0.121
337 HE2 LYS 48 2HE LYS 48 4.138 11.835 -0.129
338 HE3 LYS 48 3HE LYS 48 4.022 12.455 -1.788
339 HZ1 LYS 48 1HZ LYS 48 5.069 10.287 -1.674
340 HZ2 LYS 48 2HZ LYS 48 6.112 11.401 -2.270
341 HZ3 LYS 48 3HZ LYS 48 6.259 10.873 -0.716
342 H ASN 49 H ASN 49 5.863 18.217 -2.834
343 HA ASN 49 HA ASN 49 7.697 20.276 -1.894
344 HB2 ASN 49 2HB ASN 49 4.695 20.346 -2.408
345 HB3 ASN 49 3HB ASN 49 5.737 21.753 -2.168
346 HD21 ASN 49 1HD2 ASN 49 5.179 21.142 -5.852
347 HD22 ASN 49 2HD2 ASN 49 4.110 21.326 -4.474
348 H ARG 50 H ARG 50 6.911 21.785 -0.042
349 HA ARG 50 HA ARG 50 5.303 20.459 1.998
350 HB2 ARG 50 2HB ARG 50 7.778 19.598 2.103
351 HB3 ARG 50 3HB ARG 50 8.133 21.199 2.776
352 HG2 ARG 50 2HG ARG 50 7.756 19.625 4.589
353 HG3 ARG 50 3HG ARG 50 6.396 20.760 4.562
354 HD2 ARG 50 2HD ARG 50 4.986 19.123 3.426
355 HD3 ARG 50 3HD ARG 50 6.370 18.057 3.155
356 HE ARG 50 HE ARG 50 6.189 17.256 5.323
357 HH11 ARG 50 1HH1 ARG 50 4.141 20.125 4.970
358 HH12 ARG 50 2HH1 ARG 50 3.381 19.907 6.528
359 HH21 ARG 50 1HH2 ARG 50 5.127 16.960 7.287
360 HH22 ARG 50 2HH2 ARG 50 3.944 18.125 7.847
361 H ARG 51 H ARG 51 4.685 21.870 3.683
362 HA ARG 51 HA ARG 51 5.309 24.753 3.237
363 HB2 ARG 51 2HB ARG 51 2.725 23.471 4.214
364 HB3 ARG 51 3HB ARG 51 3.016 25.211 4.027
365 HG2 ARG 51 2HG ARG 51 3.363 24.910 1.600
366 HG3 ARG 51 3HG ARG 51 3.147 23.155 1.770
367 HD2 ARG 51 2HD ARG 51 0.843 23.485 2.567
368 HD3 ARG 51 3HD ARG 51 1.050 25.241 2.485
369 HE ARG 51 HE ARG 51 0.849 25.175 0.157
370 HH11 ARG 51 1HH1 ARG 51 0.965 21.889 1.480
371 HH12 ARG 51 2HH1 ARG 51 0.558 21.144 -0.048
372 HH21 ARG 51 1HH2 ARG 51 0.248 24.167 -1.798
373 HH22 ARG 51 2HH2 ARG 51 0.107 22.429 -1.880
374 H GLY 52 H GLY 52 5.436 26.070 5.141
375 HA2 GLY 52 2HA GLY 52 5.943 26.523 7.334
376 HA3 GLY 52 3HA GLY 52 5.278 24.941 7.789
377 H GLY 53 H GLY 53 7.578 24.510 5.335
378 HA2 GLY 53 2HA GLY 53 10.040 24.642 6.757
379 HA3 GLY 53 3HA GLY 53 9.361 23.010 6.916
380 HA PRO 54 HA PRO 54 11.679 23.610 2.843
381 HB2 PRO 54 2HB PRO 54 13.670 21.754 3.268
382 HB3 PRO 54 3HB PRO 54 13.804 23.480 3.747
383 HG2 PRO 54 2HG PRO 54 13.071 21.094 5.456
384 HG3 PRO 54 3HG PRO 54 14.160 22.468 5.850
385 HD2 PRO 54 2HD PRO 54 11.551 22.339 6.706
386 HD3 PRO 54 3HD PRO 54 12.352 23.889 6.315
387 HA PRO 55 HA PRO 55 9.720 20.048 1.086
388 HB2 PRO 55 2HB PRO 55 11.289 19.602 -1.143
389 HB3 PRO 55 3HB PRO 55 10.101 20.939 -1.001
390 HG2 PRO 55 2HG PRO 55 13.097 21.025 -0.578
391 HG3 PRO 55 3HG PRO 55 12.043 22.203 -1.441
392 HD2 PRO 55 2HD PRO 55 12.900 22.591 1.130
393 HD3 PRO 55 3HD PRO 55 11.294 23.146 0.569
394 H PHE 56 H PHE 56 10.198 17.741 0.347
395 HA PHE 56 HA PHE 56 12.692 16.567 1.383
396 HB2 PHE 56 2HB PHE 56 11.676 15.282 3.072
397 HB3 PHE 56 3HB PHE 56 11.020 16.896 3.326
398 HD1 PHE 56 HD1 PHE 56 8.693 17.286 1.880
399 HD2 PHE 56 HD2 PHE 56 10.228 13.513 3.267
400 HE1 PHE 56 HE1 PHE 56 6.410 16.329 1.825
401 HE2 PHE 56 HE2 PHE 56 7.930 12.601 3.324
402 HZ PHE 56 HZ PHE 56 6.019 13.991 2.567
403 H ALA 57 H ALA 57 12.537 14.094 0.898
404 HA ALA 57 HA ALA 57 10.688 13.455 -1.295
405 HB1 ALA 57 1HB ALA 57 12.471 14.839 -2.362
406 HB2 ALA 57 2HB ALA 57 13.693 13.708 -1.744
407 HB3 ALA 57 3HB ALA 57 12.499 13.154 -2.935
408 H PHE 58 H PHE 58 11.163 11.284 -2.218
409 HA PHE 58 HA PHE 58 12.801 9.537 -0.458
410 HB2 PHE 58 2HB PHE 58 10.086 8.824 -1.630
411 HB3 PHE 58 3HB PHE 58 11.124 7.770 -0.673
412 HD1 PHE 58 HD1 PHE 58 8.612 10.390 -0.613
413 HD2 PHE 58 HD2 PHE 58 11.516 8.279 1.751
414 HE1 PHE 58 HE1 PHE 58 7.560 11.262 1.463
415 HE2 PHE 58 HE2 PHE 58 10.430 9.099 3.820
416 HZ PHE 58 HZ PHE 58 8.470 10.599 3.683
417 H VAL 59 H VAL 59 13.559 7.604 -1.606
418 HA VAL 59 HA VAL 59 13.534 7.826 -4.570
419 HB VAL 59 HB VAL 59 15.977 7.751 -2.758
420 HG11 VAL 59 1HG1 VAL 59 17.283 7.670 -4.884
421 HG12 VAL 59 2HG1 VAL 59 16.317 6.208 -4.634
422 HG13 VAL 59 3HG1 VAL 59 15.761 7.449 -5.786
423 HG21 VAL 59 1HG2 VAL 59 15.086 10.007 -3.098
424 HG22 VAL 59 2HG2 VAL 59 16.593 9.811 -4.021
425 HG23 VAL 59 3HG2 VAL 59 15.021 9.736 -4.856
426 H GLU 60 H GLU 60 13.440 5.842 -5.528
427 HA GLU 60 HA GLU 60 13.659 3.483 -3.714
428 HB2 GLU 60 2HB GLU 60 11.412 3.753 -4.487
429 HB3 GLU 60 3HB GLU 60 11.944 3.967 -6.172
430 HG2 GLU 60 2HG GLU 60 12.688 1.687 -6.329
431 HG3 GLU 60 3HG GLU 60 12.556 1.460 -4.580
432 H PHE 61 H PHE 61 15.556 2.509 -3.936
433 HA PHE 61 HA PHE 61 16.999 2.570 -6.459
434 HB2 PHE 61 2HB PHE 61 17.553 1.261 -3.798
435 HB3 PHE 61 3HB PHE 61 18.613 1.104 -5.201
436 HD1 PHE 61 HD1 PHE 61 19.055 3.548 -6.402
437 HD2 PHE 61 HD2 PHE 61 18.246 2.825 -2.239
438 HE1 PHE 61 HE1 PHE 61 20.195 5.673 -5.809
439 HE2 PHE 61 HE2 PHE 61 19.404 4.925 -1.645
440 HZ PHE 61 HZ PHE 61 20.372 6.362 -3.431
441 H GLU 62 H GLU 62 17.882 0.645 -7.520
442 HA GLU 62 HA GLU 62 15.850 -1.372 -8.005
443 HB2 GLU 62 2HB GLU 62 17.387 -0.542 -9.751
444 HB3 GLU 62 3HB GLU 62 18.775 -1.175 -8.840
445 HG2 GLU 62 2HG GLU 62 17.865 -3.472 -9.034
446 HG3 GLU 62 3HG GLU 62 16.471 -2.855 -9.926
447 H ASP 63 H ASP 63 18.892 -1.144 -6.167
448 HA ASP 63 HA ASP 63 18.271 -3.771 -4.906
449 HB2 ASP 63 2HB ASP 63 21.002 -2.608 -5.579
450 HB3 ASP 63 3HB ASP 63 20.721 -4.094 -4.650
451 HA PRO 64 HA PRO 64 18.289 -1.455 -1.180
452 HB2 PRO 64 2HB PRO 64 18.865 -3.408 0.675
453 HB3 PRO 64 3HB PRO 64 17.297 -3.313 -0.200
454 HG2 PRO 64 2HG PRO 64 19.694 -5.058 -0.799
455 HG3 PRO 64 3HG PRO 64 17.952 -5.505 -0.804
456 HD2 PRO 64 2HD PRO 64 19.350 -4.893 -3.093
457 HD3 PRO 64 3HD PRO 64 17.608 -4.534 -2.897
458 H ARG 65 H ARG 65 21.140 -3.086 -2.319
459 HA ARG 65 HA ARG 65 22.923 -2.371 -0.166
460 HB2 ARG 65 2HB ARG 65 24.678 -3.079 -1.738
461 HB3 ARG 65 3HB ARG 65 23.343 -4.244 -1.700
462 HG2 ARG 65 2HG ARG 65 22.386 -3.098 -3.748
463 HG3 ARG 65 3HG ARG 65 23.854 -2.112 -3.828
464 HD2 ARG 65 2HD ARG 65 25.230 -4.088 -4.134
465 HD3 ARG 65 3HD ARG 65 23.844 -5.151 -3.826
466 HE ARG 65 HE ARG 65 22.844 -4.412 -5.919
467 HH11 ARG 65 1HH1 ARG 65 26.253 -3.559 -5.476
468 HH12 ARG 65 2HH1 ARG 65 26.527 -3.335 -7.188
469 HH21 ARG 65 1HH2 ARG 65 23.221 -4.101 -8.100
470 HH22 ARG 65 2HH2 ARG 65 24.816 -3.651 -8.681
471 H ASP 66 H ASP 66 21.497 -0.538 -2.739
472 HA ASP 66 HA ASP 66 23.678 1.345 -3.032
473 HB2 ASP 66 2HB ASP 66 20.754 1.430 -3.818
474 HB3 ASP 66 3HB ASP 66 21.912 2.717 -4.183
475 H ALA 67 H ALA 67 21.130 0.932 -0.690
476 HA ALA 67 HA ALA 67 21.005 3.672 0.173
477 HB1 ALA 67 1HB ALA 67 19.860 2.701 2.136
478 HB2 ALA 67 2HB ALA 67 19.227 2.018 0.620
479 HB3 ALA 67 3HB ALA 67 20.349 1.070 1.624
480 H GLU 68 H GLU 68 23.357 1.126 0.562
481 HA GLU 68 HA GLU 68 24.420 2.061 3.090
482 HB2 GLU 68 2HB GLU 68 25.694 0.391 0.881
483 HB3 GLU 68 3HB GLU 68 26.306 0.552 2.534
484 HG2 GLU 68 2HG GLU 68 23.590 -0.619 1.783
485 HG3 GLU 68 3HG GLU 68 25.034 -1.562 2.180
486 H ASP 69 H ASP 69 24.611 3.178 -0.188
487 HA ASP 69 HA ASP 69 27.156 4.602 0.323
488 HB2 ASP 69 2HB ASP 69 25.540 4.116 -2.194
489 HB3 ASP 69 3HB ASP 69 26.952 5.177 -2.122
490 H ALA 70 H ALA 70 23.709 5.286 -0.405
491 HA ALA 70 HA ALA 70 24.168 8.135 -0.603
492 HB1 ALA 70 1HB ALA 70 22.293 6.992 -1.727
493 HB2 ALA 70 2HB ALA 70 21.627 6.509 -0.152
494 HB3 ALA 70 3HB ALA 70 21.697 8.230 -0.599
495 H VAL 71 H VAL 71 23.435 5.863 2.014
496 HA VAL 71 HA VAL 71 22.621 8.022 3.813
497 HB VAL 71 HB VAL 71 22.825 5.011 4.209
498 HG11 VAL 71 1HG1 VAL 71 21.596 7.189 5.946
499 HG12 VAL 71 2HG1 VAL 71 21.182 5.466 6.085
500 HG13 VAL 71 3HG1 VAL 71 22.837 5.996 6.408
501 HG21 VAL 71 1HG2 VAL 71 21.180 5.693 2.474
502 HG22 VAL 71 2HG2 VAL 71 20.366 5.096 3.933
503 HG23 VAL 71 3HG2 VAL 71 20.461 6.845 3.617
504 H SER 72 H SER 72 25.574 7.201 2.747
505 HA SER 72 HA SER 72 26.790 7.917 5.363
506 HB2 SER 72 2HB SER 72 26.959 5.478 5.170
507 HB3 SER 72 3HB SER 72 27.690 5.638 3.558
508 HG SER 72 HG SER 72 29.240 5.369 5.239
509 H GLY 73 H GLY 73 26.764 8.060 1.859
510 HA2 GLY 73 2HA GLY 73 29.338 9.510 1.799
511 HA3 GLY 73 3HA GLY 73 28.404 8.925 0.413
512 H ARG 74 H ARG 74 26.105 10.329 2.348
513 HA ARG 74 HA ARG 74 26.605 13.099 1.436
514 HB2 ARG 74 2HB ARG 74 25.539 11.881 -0.468
515 HB3 ARG 74 3HB ARG 74 24.176 11.470 0.582
516 HG2 ARG 74 2HG ARG 74 23.660 13.399 -0.862
517 HG3 ARG 74 3HG ARG 74 23.626 13.867 0.844
518 HD2 ARG 74 2HD ARG 74 24.781 15.541 -0.547
519 HD3 ARG 74 3HD ARG 74 25.880 14.839 0.647
520 HE ARG 74 HE ARG 74 26.652 13.308 -1.255
521 HH11 ARG 74 1HH1 ARG 74 25.409 16.570 -1.837
522 HH12 ARG 74 2HH1 ARG 74 26.293 16.755 -3.336
523 HH21 ARG 74 1HH2 ARG 74 27.778 13.574 -3.191
524 HH22 ARG 74 2HH2 ARG 74 27.644 15.064 -4.097
525 H ASP 75 H ASP 75 25.087 10.813 3.570
526 HA ASP 75 HA ASP 75 23.034 12.520 4.622
527 HB2 ASP 75 2HB ASP 75 23.141 10.026 4.835
528 HB3 ASP 75 3HB ASP 75 24.511 10.207 5.942
529 H GLY 76 H GLY 76 23.032 13.850 6.462
530 HA2 GLY 76 2HA GLY 76 23.844 15.179 8.126
531 HA3 GLY 76 3HA GLY 76 25.072 13.938 8.416
532 H TYR 77 H TYR 77 24.546 16.058 5.502
533 HA TYR 77 HA TYR 77 27.409 16.631 5.634
534 HB2 TYR 77 2HB TYR 77 26.793 15.934 3.508
535 HB3 TYR 77 3HB TYR 77 25.355 16.967 3.481
536 HD1 TYR 77 HD1 TYR 77 25.449 18.824 2.108
537 HD2 TYR 77 HD2 TYR 77 29.076 17.372 3.914
538 HE1 TYR 77 HE1 TYR 77 26.736 20.606 0.956
539 HE2 TYR 77 HE2 TYR 77 30.368 19.156 2.770
540 HH TYR 77 HH TYR 77 28.797 21.562 0.629
541 H ASP 78 H ASP 78 28.351 18.417 6.185
542 HA ASP 78 HA ASP 78 26.850 20.435 7.558
543 HB2 ASP 78 2HB ASP 78 29.055 19.782 8.298
544 HB3 ASP 78 3HB ASP 78 29.767 20.230 6.742
545 H TYR 79 H TYR 79 25.378 21.321 6.058
546 HA TYR 79 HA TYR 79 26.321 22.630 3.625
547 HB2 TYR 79 2HB TYR 79 24.062 21.491 4.090
548 HB3 TYR 79 3HB TYR 79 23.662 22.893 5.089
549 HD1 TYR 79 HD1 TYR 79 24.778 21.926 1.653
550 HD2 TYR 79 HD2 TYR 79 22.698 24.790 4.081
551 HE1 TYR 79 HE1 TYR 79 23.995 23.088 -0.403
552 HE2 TYR 79 HE2 TYR 79 21.924 25.972 2.042
553 HH TYR 79 HH TYR 79 22.789 24.849 -1.252
554 H ASP 80 H ASP 80 25.229 25.001 3.480
555 HA ASP 80 HA ASP 80 26.750 26.659 5.252
556 HB2 ASP 80 2HB ASP 80 26.432 27.319 2.967
557 HB3 ASP 80 3HB ASP 80 24.666 27.273 3.142
558 H GLY 81 H GLY 81 26.015 26.120 7.365
559 HA2 GLY 81 2HA GLY 81 24.897 26.876 9.254
560 HA3 GLY 81 3HA GLY 81 23.734 27.737 8.229
561 H TYR 82 H TYR 82 24.008 24.587 7.052
562 HA TYR 82 HA TYR 82 21.864 23.552 8.819
563 HB2 TYR 82 2HB TYR 82 21.722 23.830 5.821
564 HB3 TYR 82 3HB TYR 82 20.693 22.729 6.737
565 HD1 TYR 82 HD1 TYR 82 18.829 23.501 8.045
566 HD2 TYR 82 HD2 TYR 82 21.546 26.278 6.209
567 HE1 TYR 82 HE1 TYR 82 17.248 25.354 8.526
568 HE2 TYR 82 HE2 TYR 82 19.962 28.144 6.677
569 HH TYR 82 HH TYR 82 16.834 27.599 8.339
570 H ARG 83 H ARG 83 21.222 21.210 7.879
571 HA ARG 83 HA ARG 83 23.702 19.636 7.435
572 HB2 ARG 83 2HB ARG 83 23.376 19.959 9.907
573 HB3 ARG 83 3HB ARG 83 21.767 19.258 9.749
574 HG2 ARG 83 2HG ARG 83 23.259 17.539 10.544
575 HG3 ARG 83 3HG ARG 83 22.820 17.142 8.876
576 HD2 ARG 83 2HD ARG 83 25.225 16.816 9.288
577 HD3 ARG 83 3HD ARG 83 24.954 18.081 8.070
578 HE ARG 83 HE ARG 83 25.147 19.570 10.307
579 HH11 ARG 83 1HH1 ARG 83 27.157 16.907 9.116
580 HH12 ARG 83 2HH1 ARG 83 28.596 17.477 9.924
581 HH21 ARG 83 1HH2 ARG 83 27.055 20.292 11.345
582 HH22 ARG 83 2HH2 ARG 83 28.537 19.378 11.182
583 H LEU 84 H LEU 84 23.263 18.317 5.779
584 HA LEU 84 HA LEU 84 20.622 17.944 4.746
585 HB2 LEU 84 2HB LEU 84 23.331 16.711 4.207
586 HB3 LEU 84 3HB LEU 84 21.887 16.025 3.466
587 HG LEU 84 HG LEU 84 23.032 17.603 1.978
588 HD11 LEU 84 1HD1 LEU 84 20.324 18.670 2.882
589 HD12 LEU 84 2HD1 LEU 84 21.086 18.873 1.288
590 HD13 LEU 84 3HD1 LEU 84 20.565 17.263 1.832
591 HD21 LEU 84 1HD2 LEU 84 23.907 19.148 3.736
592 HD22 LEU 84 2HD2 LEU 84 23.067 19.991 2.414
593 HD23 LEU 84 3HD2 LEU 84 22.255 19.765 3.976
594 H ARG 85 H ARG 85 19.358 16.043 4.571
595 HA ARG 85 HA ARG 85 19.930 13.925 6.611
596 HB2 ARG 85 2HB ARG 85 17.208 15.024 5.802
597 HB3 ARG 85 3HB ARG 85 17.542 13.765 7.012
598 HG2 ARG 85 2HG ARG 85 18.792 15.411 8.379
599 HG3 ARG 85 3HG ARG 85 18.464 16.670 7.167
600 HD2 ARG 85 2HD ARG 85 16.023 16.345 7.508
601 HD3 ARG 85 3HD ARG 85 16.375 15.136 8.762
602 HE ARG 85 HE ARG 85 17.682 17.686 9.245
603 HH11 ARG 85 1HH1 ARG 85 14.678 15.873 9.618
604 HH12 ARG 85 2HH1 ARG 85 14.116 16.827 10.967
605 HH21 ARG 85 1HH2 ARG 85 16.946 18.915 11.034
606 HH22 ARG 85 2HH2 ARG 85 15.401 18.549 11.768
607 H VAL 86 H VAL 86 20.370 12.089 5.658
608 HA VAL 86 HA VAL 86 18.749 11.251 3.339
609 HB VAL 86 HB VAL 86 21.780 11.063 3.309
610 HG11 VAL 86 1HG1 VAL 86 19.629 10.495 1.226
611 HG12 VAL 86 2HG1 VAL 86 21.385 10.396 0.963
612 HG13 VAL 86 3HG1 VAL 86 20.591 9.277 2.096
613 HG21 VAL 86 1HG2 VAL 86 19.934 12.956 1.801
614 HG22 VAL 86 2HG2 VAL 86 21.141 13.413 3.030
615 HG23 VAL 86 3HG2 VAL 86 21.666 12.726 1.476
616 H GLU 87 H GLU 87 17.723 9.895 4.858
617 HA GLU 87 HA GLU 87 19.261 7.413 5.377
618 HB2 GLU 87 2HB GLU 87 18.512 7.298 7.685
619 HB3 GLU 87 3HB GLU 87 19.435 8.790 7.443
620 HG2 GLU 87 2HG GLU 87 17.315 10.060 7.196
621 HG3 GLU 87 3HG GLU 87 16.390 8.570 7.426
622 H PHE 88 H PHE 88 17.816 5.556 5.893
623 HA PHE 88 HA PHE 88 15.449 5.740 4.246
624 HB2 PHE 88 2HB PHE 88 15.234 3.258 5.020
625 HB3 PHE 88 3HB PHE 88 16.457 3.767 3.851
626 HD1 PHE 88 HD1 PHE 88 18.780 3.615 4.306
627 HD2 PHE 88 HD2 PHE 88 15.919 2.829 7.416
628 HE1 PHE 88 HE1 PHE 88 20.587 2.687 5.735
629 HE2 PHE 88 HE2 PHE 88 17.731 1.906 8.841
630 HZ PHE 88 HZ PHE 88 20.059 1.831 8.002
631 HA PRO 89 HA PRO 89 12.290 6.353 7.187
632 HB2 PRO 89 2HB PRO 89 10.226 4.879 6.104
633 HB3 PRO 89 3HB PRO 89 10.782 6.445 5.440
634 HG2 PRO 89 2HG PRO 89 11.471 3.651 4.504
635 HG3 PRO 89 3HG PRO 89 11.075 5.093 3.515
636 HD2 PRO 89 2HD PRO 89 13.647 4.280 3.951
637 HD3 PRO 89 3HD PRO 89 13.210 6.007 3.795
638 H5' A 90 1H5* A 90 8.173 11.516 16.341
639 H5'' A 90 2H5* A 90 8.751 13.006 17.103
640 H4' A 90 H4* A 90 9.344 13.183 14.821
641 H3' A 90 H3* A 90 7.790 15.129 15.928
642 H2' A 90 1H2* A 90 5.658 14.502 15.317
643 HO2' A 90 2HO* A 90 6.042 16.344 13.971
644 H1' A 90 H1* A 90 6.142 13.213 12.731
645 H8 A 90 H8 A 90 3.618 13.688 14.657
646 H61 A 90 1H6 A 90 2.636 7.787 16.260
647 H62 A 90 2H6 A 90 1.935 9.391 16.181
648 H2 A 90 H2 A 90 6.777 8.109 14.653
649 HO5' A 90 H5T A 90 6.615 12.452 17.735
650 H5' A 91 1H5* A 91 9.939 14.092 12.167
651 H5'' A 91 2H5* A 91 11.336 13.087 12.573
652 H4' A 91 H4* A 91 11.412 15.987 11.605
653 H3' A 91 H3* A 91 11.108 13.706 10.101
654 H2' A 91 1H2* A 91 12.992 12.444 10.424
655 HO2' A 91 2HO* A 91 13.687 13.598 8.535
656 H1' A 91 H1* A 91 14.921 14.179 11.607
657 H8 A 91 H8 A 91 13.728 11.019 11.588
658 H61 A 91 1H6 A 91 13.579 10.505 17.756
659 H62 A 91 2H6 A 91 13.529 9.624 16.242
660 H2 A 91 H2 A 91 13.940 14.824 16.743
661 H5' C 92 1H5* C 92 10.281 15.330 5.858
662 H5'' C 92 2H5* C 92 8.887 16.064 6.673
663 H4' C 92 H4* C 92 7.997 14.315 5.320
664 H3' C 92 H3* C 92 7.630 14.318 8.077
665 H2' C 92 1H2* C 92 9.225 12.640 8.533
666 HO2' C 92 2HO* C 92 7.145 11.814 9.204
667 H1' C 92 H1* C 92 8.357 11.157 6.040
668 H41 C 92 1H4 C 92 13.574 7.798 7.525
669 H42 C 92 2H4 C 92 14.334 9.189 8.277
670 H5 C 92 H5 C 92 13.255 11.369 8.421
671 H6 C 92 H6 C 92 11.237 12.621 7.874
672 H5' A 93 1H5* A 93 3.086 12.987 5.359
673 H5'' A 93 2H5* A 93 4.409 11.830 5.162
674 H4' A 93 H4* A 93 3.412 13.540 2.849
675 H3' A 93 H3* A 93 1.660 11.897 4.107
676 H2' A 93 1H2* A 93 3.037 9.990 4.259
677 HO2' A 93 2HO* A 93 1.702 9.821 1.753
678 H1' A 93 H1* A 93 4.013 10.239 1.433
679 H8 A 93 H8 A 93 4.958 9.776 5.111
680 H61 A 93 1H6 A 93 9.103 5.690 2.944
681 H62 A 93 2H6 A 93 8.408 6.393 4.394
682 H2 A 93 H2 A 93 7.121 7.644 -0.522
683 H5' A 94 1H5* A 94 0.256 16.059 1.991
684 H5'' A 94 2H5* A 94 0.661 15.637 0.314
685 H4' A 94 H4* A 94 2.667 16.765 2.318
686 H3' A 94 H3* A 94 0.598 18.272 1.345
687 H2' A 94 1H2* A 94 0.903 17.700 -0.939
688 HO2' A 94 2HO* A 94 2.559 19.976 -0.457
689 H1' A 94 H1* A 94 3.880 18.081 -0.668
690 H8 A 94 H8 A 94 3.683 18.364 -3.363
691 H61 A 94 1H6 A 94 2.178 12.927 -5.919
692 H62 A 94 2H6 A 94 2.794 14.537 -6.232
693 H2 A 94 H2 A 94 1.454 12.634 -1.542
694 H5' A 95 1H5* A 95 0.544 17.368 3.515
695 H5'' A 95 2H5* A 95 0.074 18.698 4.596
696 H4' A 95 H4* A 95 1.960 16.443 5.420
697 H3' A 95 H3* A 95 -0.605 15.887 4.888
698 HO3' A 95 H3T A 95 -0.578 14.591 6.816
699 H2' A 95 1H2* A 95 -1.701 17.676 5.899
700 HO2' A 95 2HO* A 95 -2.433 15.873 7.109
701 H1' A 95 H1* A 95 -0.078 17.968 8.341
702 H8 A 95 H8 A 95 -2.612 19.416 6.658
703 H61 A 95 1H6 A 95 0.093 24.970 6.272
704 H62 A 95 2H6 A 95 -1.416 24.092 6.117
705 H2 A 95 H2 A 95 3.223 21.993 7.335
Start of MODEL 7
1 H VAL 6 H1 VAL 6 -5.274 7.324 5.268
2 HA VAL 6 HA VAL 6 -3.022 8.051 5.322
3 HB VAL 6 HB VAL 6 -3.106 5.054 5.753
4 HG11 VAL 6 1HG1 VAL 6 -1.689 7.351 7.173
5 HG12 VAL 6 2HG1 VAL 6 -1.592 5.636 7.622
6 HG13 VAL 6 3HG1 VAL 6 -0.920 6.179 6.074
7 HG21 VAL 6 1HG2 VAL 6 -5.145 5.995 6.730
8 HG22 VAL 6 2HG2 VAL 6 -3.988 5.602 8.013
9 HG23 VAL 6 3HG2 VAL 6 -4.205 7.292 7.506
10 H ILE 7 H ILE 7 -2.717 8.557 2.949
11 HA ILE 7 HA ILE 7 -1.402 6.639 1.262
12 HB ILE 7 HB ILE 7 -1.466 9.682 1.274
13 HG12 ILE 7 2HG1 ILE 7 -2.973 7.644 -0.426
14 HG13 ILE 7 3HG1 ILE 7 -3.653 8.496 0.973
15 HG21 ILE 7 1HG2 ILE 7 -0.509 7.778 -0.907
16 HG22 ILE 7 2HG2 ILE 7 -0.665 9.540 -1.065
17 HG23 ILE 7 3HG2 ILE 7 0.525 8.866 0.055
18 HD11 ILE 7 1HD1 ILE 7 -2.667 9.764 -1.613
19 HD12 ILE 7 2HD1 ILE 7 -4.341 9.659 -1.033
20 HD13 ILE 7 3HD1 ILE 7 -3.170 10.680 -0.174
21 H ARG 8 H ARG 8 0.815 6.327 0.865
22 HA ARG 8 HA ARG 8 2.756 7.861 2.439
23 HB2 ARG 8 2HB ARG 8 2.053 6.197 4.060
24 HB3 ARG 8 3HB ARG 8 2.276 4.885 2.896
25 HG2 ARG 8 2HG ARG 8 4.602 6.701 3.525
26 HG3 ARG 8 3HG ARG 8 4.140 5.473 4.711
27 HD2 ARG 8 2HD ARG 8 4.763 4.821 1.795
28 HD3 ARG 8 3HD ARG 8 5.944 4.754 3.090
29 HE ARG 8 HE ARG 8 4.730 2.958 4.131
30 HH11 ARG 8 1HH1 ARG 8 3.509 3.845 0.921
31 HH12 ARG 8 2HH1 ARG 8 2.708 2.314 0.686
32 HH21 ARG 8 1HH2 ARG 8 3.646 0.993 3.801
33 HH22 ARG 8 2HH2 ARG 8 2.761 0.712 2.322
34 H GLY 9 H GLY 9 4.470 8.235 1.216
35 HA2 GLY 9 2HA GLY 9 6.167 7.974 -0.277
36 HA3 GLY 9 3HA GLY 9 6.005 6.238 -0.002
37 HA PRO 10 HA PRO 10 4.800 7.108 -4.408
38 HB2 PRO 10 2HB PRO 10 6.742 5.655 -5.644
39 HB3 PRO 10 3HB PRO 10 7.024 7.335 -5.073
40 HG2 PRO 10 2HG PRO 10 7.834 4.737 -3.768
41 HG3 PRO 10 3HG PRO 10 8.772 6.257 -3.913
42 HD2 PRO 10 2HD PRO 10 7.321 5.496 -1.651
43 HD3 PRO 10 3HD PRO 10 7.701 7.193 -2.067
44 H ALA 11 H ALA 11 5.749 4.220 -2.575
45 HA ALA 11 HA ALA 11 3.447 2.722 -3.480
46 HB1 ALA 11 1HB ALA 11 6.231 1.831 -4.342
47 HB2 ALA 11 2HB ALA 11 4.741 0.878 -4.514
48 HB3 ALA 11 3HB ALA 11 4.936 2.389 -5.430
49 H GLY 12 H GLY 12 3.453 0.512 -2.444
50 HA2 GLY 12 2HA GLY 12 4.685 0.629 0.235
51 HA3 GLY 12 3HA GLY 12 3.457 -0.520 -0.332
52 H ASN 13 H ASN 13 5.022 -1.994 0.859
53 HA ASN 13 HA ASN 13 6.507 -3.703 0.823
54 HB2 ASN 13 2HB ASN 13 5.079 -4.078 -1.303
55 HB3 ASN 13 3HB ASN 13 6.482 -3.500 -2.205
56 HD21 ASN 13 1HD2 ASN 13 7.034 -7.072 -2.298
57 HD22 ASN 13 2HD2 ASN 13 6.193 -5.771 -3.116
58 H ASN 14 H ASN 14 8.695 -4.457 -0.468
59 HA ASN 14 HA ASN 14 10.914 -4.107 -0.705
60 HB2 ASN 14 2HB ASN 14 9.958 -2.623 -2.572
61 HB3 ASN 14 3HB ASN 14 10.309 -1.248 -1.512
62 HD21 ASN 14 1HD2 ASN 14 13.248 -1.470 -3.667
63 HD22 ASN 14 2HD2 ASN 14 11.571 -0.959 -3.722
64 H ASP 15 H ASP 15 12.821 -2.989 0.180
65 HA ASP 15 HA ASP 15 12.279 -1.261 2.509
66 HB2 ASP 15 2HB ASP 15 13.840 -2.672 3.894
67 HB3 ASP 15 3HB ASP 15 12.259 -3.379 3.549
68 H CYS 16 H CYS 16 13.972 -1.750 -0.296
69 HA CYS 16 HA CYS 16 16.509 -0.581 0.512
70 HB2 CYS 16 2HB CYS 16 15.190 -0.922 -2.216
71 HB3 CYS 16 3HB CYS 16 16.878 -0.430 -1.930
72 HG CYS 16 HG CYS 16 15.302 -3.213 -1.110
73 H ARG 17 H ARG 17 13.451 0.659 0.520
74 HA ARG 17 HA ARG 17 13.893 3.189 -0.814
75 HB2 ARG 17 2HB ARG 17 11.711 1.943 -0.585
76 HB3 ARG 17 3HB ARG 17 11.719 2.345 1.142
77 HG2 ARG 17 2HG ARG 17 11.779 4.759 0.575
78 HG3 ARG 17 3HG ARG 17 11.766 4.341 -1.156
79 HD2 ARG 17 2HD ARG 17 9.583 3.657 0.859
80 HD3 ARG 17 3HD ARG 17 9.501 4.940 -0.348
81 HE ARG 17 HE ARG 17 9.459 3.271 -2.104
82 HH11 ARG 17 1HH1 ARG 17 9.066 1.988 1.183
83 HH12 ARG 17 2HH1 ARG 17 8.377 0.484 0.615
84 HH21 ARG 17 1HH2 ARG 17 8.567 1.311 -2.779
85 HH22 ARG 17 2HH2 ARG 17 8.040 0.122 -1.603
86 H ILE 18 H ILE 18 14.178 5.231 0.161
87 HA ILE 18 HA ILE 18 14.752 5.308 3.066
88 HB ILE 18 HB ILE 18 16.901 6.354 2.737
89 HG12 ILE 18 2HG1 ILE 18 16.527 5.945 -0.257
90 HG13 ILE 18 3HG1 ILE 18 16.348 7.497 0.579
91 HG21 ILE 18 1HG2 ILE 18 18.201 4.481 1.957
92 HG22 ILE 18 2HG2 ILE 18 16.769 3.860 2.800
93 HG23 ILE 18 3HG2 ILE 18 16.822 3.843 1.025
94 HD11 ILE 18 1HD1 ILE 18 18.697 7.317 1.393
95 HD12 ILE 18 2HD1 ILE 18 18.882 5.819 0.448
96 HD13 ILE 18 3HD1 ILE 18 18.581 7.359 -0.378
97 H TYR 19 H TYR 19 15.377 7.626 3.668
98 HA TYR 19 HA TYR 19 13.436 9.461 2.397
99 HB2 TYR 19 2HB TYR 19 12.500 9.368 4.409
100 HB3 TYR 19 3HB TYR 19 13.937 8.699 5.176
101 HD1 TYR 19 HD1 TYR 19 15.695 10.147 6.069
102 HD2 TYR 19 HD2 TYR 19 12.077 11.769 4.416
103 HE1 TYR 19 HE1 TYR 19 16.165 12.304 7.193
104 HE2 TYR 19 HE2 TYR 19 12.527 13.939 5.551
105 HH TYR 19 HH TYR 19 13.972 15.124 6.893
106 H VAL 20 H VAL 20 13.838 11.700 2.328
107 HA VAL 20 HA VAL 20 16.668 12.510 2.627
108 HB VAL 20 HB VAL 20 14.999 13.102 0.157
109 HG11 VAL 20 1HG1 VAL 20 17.181 13.931 -0.717
110 HG12 VAL 20 2HG1 VAL 20 16.637 14.851 0.702
111 HG13 VAL 20 3HG1 VAL 20 17.917 13.626 0.876
112 HG21 VAL 20 1HG2 VAL 20 15.624 10.724 0.185
113 HG22 VAL 20 2HG2 VAL 20 16.589 11.610 -1.018
114 HG23 VAL 20 3HG2 VAL 20 17.309 11.158 0.546
115 H GLY 21 H GLY 21 16.975 14.621 3.297
116 HA2 GLY 21 2HA GLY 21 14.755 16.521 3.320
117 HA3 GLY 21 3HA GLY 21 15.183 15.865 4.910
118 H ASN 22 H ASN 22 15.505 18.357 5.037
119 HA ASN 22 HA ASN 22 16.806 20.200 5.144
120 HB2 ASN 22 2HB ASN 22 18.174 18.593 6.534
121 HB3 ASN 22 3HB ASN 22 19.162 18.297 5.091
122 HD21 ASN 22 1HD2 ASN 22 21.154 21.132 5.683
123 HD22 ASN 22 2HD2 ASN 22 20.989 19.517 5.018
124 H LEU 23 H LEU 23 16.089 19.055 2.456
125 HA LEU 23 HA LEU 23 18.231 19.563 0.637
126 HB2 LEU 23 2HB LEU 23 15.201 19.650 0.368
127 HB3 LEU 23 3HB LEU 23 16.294 19.839 -1.013
128 HG LEU 23 HG LEU 23 16.305 17.427 0.858
129 HD11 LEU 23 1HD1 LEU 23 15.065 17.776 -1.903
130 HD12 LEU 23 2HD1 LEU 23 15.178 16.244 -1.000
131 HD13 LEU 23 3HD1 LEU 23 14.180 17.573 -0.374
132 HD21 LEU 23 1HD2 LEU 23 17.584 17.946 -1.863
133 HD22 LEU 23 2HD2 LEU 23 18.450 17.781 -0.313
134 HD23 LEU 23 3HD2 LEU 23 17.592 16.390 -1.002
135 HA PRO 24 HA PRO 24 18.638 23.884 0.699
136 HB2 PRO 24 2HB PRO 24 19.090 24.505 -1.969
137 HB3 PRO 24 3HB PRO 24 20.295 23.741 -0.880
138 HG2 PRO 24 2HG PRO 24 18.471 22.416 -2.900
139 HG3 PRO 24 3HG PRO 24 20.205 22.096 -2.577
140 HD2 PRO 24 2HD PRO 24 18.213 20.532 -1.551
141 HD3 PRO 24 3HD PRO 24 19.706 20.866 -0.627
142 HA PRO 25 HA PRO 25 14.786 25.790 -0.164
143 HB2 PRO 25 2HB PRO 25 15.465 28.432 -0.542
144 HB3 PRO 25 3HB PRO 25 15.528 27.607 1.047
145 HG2 PRO 25 2HG PRO 25 17.791 28.139 -0.893
146 HG3 PRO 25 3HG PRO 25 17.776 28.339 0.892
147 HD2 PRO 25 2HD PRO 25 18.838 26.135 -0.349
148 HD3 PRO 25 3HD PRO 25 18.037 26.045 1.249
149 H ASP 26 H ASP 26 17.089 25.385 -2.596
150 HA ASP 26 HA ASP 26 15.079 26.001 -4.649
151 HB2 ASP 26 2HB ASP 26 16.253 28.074 -4.593
152 HB3 ASP 26 3HB ASP 26 17.825 27.264 -4.530
153 H ILE 27 H ILE 27 14.835 24.209 -5.788
154 HA ILE 27 HA ILE 27 17.137 22.842 -6.924
155 HB ILE 27 HB ILE 27 17.026 21.819 -4.673
156 HG12 ILE 27 2HG1 ILE 27 16.734 19.445 -5.322
157 HG13 ILE 27 3HG1 ILE 27 16.004 19.946 -6.854
158 HG21 ILE 27 1HG2 ILE 27 14.192 20.992 -5.434
159 HG22 ILE 27 2HG2 ILE 27 15.069 20.527 -3.965
160 HG23 ILE 27 3HG2 ILE 27 14.619 22.226 -4.221
161 HD11 ILE 27 1HD1 ILE 27 18.429 19.375 -7.066
162 HD12 ILE 27 2HD1 ILE 27 18.098 21.061 -7.520
163 HD13 ILE 27 3HD1 ILE 27 18.814 20.689 -5.936
164 H ARG 28 H ARG 28 16.528 21.538 -8.728
165 HA ARG 28 HA ARG 28 13.936 22.295 -9.845
166 HB2 ARG 28 2HB ARG 28 16.099 20.470 -10.955
167 HB3 ARG 28 3HB ARG 28 14.748 21.151 -11.867
168 HG2 ARG 28 2HG ARG 28 16.866 22.866 -10.495
169 HG3 ARG 28 3HG ARG 28 16.997 22.291 -12.160
170 HD2 ARG 28 2HD ARG 28 16.126 24.525 -12.243
171 HD3 ARG 28 3HD ARG 28 14.820 23.417 -12.688
172 HE ARG 28 HE ARG 28 13.621 24.152 -10.858
173 HH11 ARG 28 1HH1 ARG 28 17.030 24.990 -10.379
174 HH12 ARG 28 2HH1 ARG 28 16.710 25.860 -8.889
175 HH21 ARG 28 1HH2 ARG 28 13.262 25.317 -8.925
176 HH22 ARG 28 2HH2 ARG 28 14.619 26.051 -8.093
177 H THR 29 H THR 29 12.442 20.736 -10.774
178 HA THR 29 HA THR 29 11.810 18.725 -8.835
179 HB THR 29 HB THR 29 9.742 18.541 -9.832
180 HG1 THR 29 1HG THR 29 10.357 17.946 -11.879
181 HG21 THR 29 1HG2 THR 29 10.661 21.287 -10.792
182 HG22 THR 29 2HG2 THR 29 9.004 20.789 -10.392
183 HG23 THR 29 3HG2 THR 29 10.218 20.901 -9.108
184 H LYS 30 H LYS 30 14.224 18.432 -10.850
185 HA LYS 30 HA LYS 30 13.753 15.532 -11.241
186 HB2 LYS 30 2HB LYS 30 13.160 16.653 -13.359
187 HB3 LYS 30 3HB LYS 30 14.726 17.474 -13.372
188 HG2 LYS 30 2HG LYS 30 14.782 15.563 -14.886
189 HG3 LYS 30 3HG LYS 30 15.881 15.276 -13.531
190 HD2 LYS 30 2HD LYS 30 14.125 13.881 -12.423
191 HD3 LYS 30 3HD LYS 30 13.043 14.184 -13.803
192 HE2 LYS 30 2HE LYS 30 14.748 13.143 -15.306
193 HE3 LYS 30 3HE LYS 30 15.748 12.789 -13.881
194 HZ1 LYS 30 1HZ LYS 30 13.045 11.752 -14.413
195 HZ2 LYS 30 2HZ LYS 30 14.451 10.898 -14.464
196 HZ3 LYS 30 3HZ LYS 30 13.891 11.485 -13.031
197 H ASP 31 H ASP 31 15.904 18.236 -10.597
198 HA ASP 31 HA ASP 31 18.357 16.837 -10.981
199 HB2 ASP 31 2HB ASP 31 17.633 19.264 -9.336
200 HB3 ASP 31 3HB ASP 31 19.279 18.623 -9.459
201 H ILE 32 H ILE 32 16.020 16.724 -8.378
202 HA ILE 32 HA ILE 32 17.839 15.684 -6.398
203 HB ILE 32 HB ILE 32 15.732 16.813 -5.816
204 HG12 ILE 32 2HG1 ILE 32 14.830 15.222 -4.186
205 HG13 ILE 32 3HG1 ILE 32 15.612 13.870 -5.011
206 HG21 ILE 32 1HG2 ILE 32 14.364 16.047 -7.740
207 HG22 ILE 32 2HG2 ILE 32 14.367 14.393 -7.079
208 HG23 ILE 32 3HG2 ILE 32 13.562 15.698 -6.190
209 HD11 ILE 32 1HD1 ILE 32 16.882 14.633 -3.008
210 HD12 ILE 32 2HD1 ILE 32 17.838 14.816 -4.495
211 HD13 ILE 32 3HD1 ILE 32 17.070 16.241 -3.751
212 H GLU 33 H GLU 33 16.238 14.333 -9.190
213 HA GLU 33 HA GLU 33 16.449 11.570 -8.198
214 HB2 GLU 33 2HB GLU 33 15.645 12.609 -10.945
215 HB3 GLU 33 3HB GLU 33 15.371 10.986 -10.273
216 HG2 GLU 33 2HG GLU 33 13.975 12.096 -8.457
217 HG3 GLU 33 3HG GLU 33 14.108 13.604 -9.373
218 H ASP 34 H ASP 34 18.123 13.924 -10.244
219 HA ASP 34 HA ASP 34 19.707 11.965 -11.653
220 HB2 ASP 34 2HB ASP 34 19.924 14.968 -11.355
221 HB3 ASP 34 3HB ASP 34 21.049 14.003 -12.313
222 H VAL 35 H VAL 35 20.170 13.810 -8.651
223 HA VAL 35 HA VAL 35 22.969 13.122 -8.380
224 HB VAL 35 HB VAL 35 20.819 14.022 -6.416
225 HG11 VAL 35 1HG1 VAL 35 23.813 13.641 -5.969
226 HG12 VAL 35 2HG1 VAL 35 22.699 14.451 -4.843
227 HG13 VAL 35 3HG1 VAL 35 22.506 12.721 -5.184
228 HG21 VAL 35 1HG2 VAL 35 21.529 15.688 -8.113
229 HG22 VAL 35 2HG2 VAL 35 22.096 16.147 -6.492
230 HG23 VAL 35 3HG2 VAL 35 23.226 15.434 -7.661
231 H PHE 36 H PHE 36 19.858 11.770 -7.139
232 HA PHE 36 HA PHE 36 21.214 9.619 -5.800
233 HB2 PHE 36 2HB PHE 36 18.333 10.246 -6.350
234 HB3 PHE 36 3HB PHE 36 18.818 8.690 -5.673
235 HD1 PHE 36 HD1 PHE 36 19.209 12.376 -5.089
236 HD2 PHE 36 HD2 PHE 36 19.159 8.435 -3.383
237 HE1 PHE 36 HE1 PHE 36 19.301 13.361 -2.812
238 HE2 PHE 36 HE2 PHE 36 19.252 9.420 -1.103
239 HZ PHE 36 HZ PHE 36 19.323 11.887 -0.821
240 H SER 37 H SER 37 19.875 10.007 -9.037
241 HA SER 37 HA SER 37 20.008 7.221 -9.748
242 HB2 SER 37 2HB SER 37 18.699 8.829 -11.035
243 HB3 SER 37 3HB SER 37 20.177 9.732 -11.455
244 HG SER 37 HG SER 37 20.898 7.941 -12.588
245 H LYS 38 H LYS 38 22.436 9.787 -9.472
246 HA LYS 38 HA LYS 38 24.467 8.337 -10.967
247 HB2 LYS 38 2HB LYS 38 24.529 10.783 -10.745
248 HB3 LYS 38 3HB LYS 38 24.635 10.641 -8.976
249 HG2 LYS 38 2HG LYS 38 26.804 9.536 -9.146
250 HG3 LYS 38 3HG LYS 38 26.668 9.472 -10.917
251 HD2 LYS 38 2HD LYS 38 28.135 11.317 -10.252
252 HD3 LYS 38 3HD LYS 38 26.656 11.946 -11.006
253 HE2 LYS 38 2HE LYS 38 25.693 12.405 -8.786
254 HE3 LYS 38 3HE LYS 38 27.131 11.725 -8.004
255 HZ1 LYS 38 1HZ LYS 38 27.234 14.107 -8.118
256 HZ2 LYS 38 2HZ LYS 38 28.435 13.451 -9.034
257 HZ3 LYS 38 3HZ LYS 38 27.105 14.088 -9.760
258 H TYR 39 H TYR 39 23.382 8.539 -7.591
259 HA TYR 39 HA TYR 39 25.580 6.899 -6.656
260 HB2 TYR 39 2HB TYR 39 23.206 8.160 -5.373
261 HB3 TYR 39 3HB TYR 39 24.022 6.833 -4.553
262 HD1 TYR 39 HD1 TYR 39 25.752 7.302 -3.120
263 HD2 TYR 39 HD2 TYR 39 24.909 10.040 -6.323
264 HE1 TYR 39 HE1 TYR 39 27.504 8.830 -2.262
265 HE2 TYR 39 HE2 TYR 39 26.675 11.573 -5.483
266 HH TYR 39 HH TYR 39 28.274 11.940 -3.883
267 H GLY 40 H GLY 40 22.594 6.069 -8.166
268 HA2 GLY 40 2HA GLY 40 23.246 3.359 -8.316
269 HA3 GLY 40 3HA GLY 40 22.241 3.530 -6.873
270 H ALA 41 H ALA 41 21.098 1.948 -8.594
271 HA ALA 41 HA ALA 41 19.584 3.357 -10.658
272 HB1 ALA 41 1HB ALA 41 19.454 0.504 -9.603
273 HB2 ALA 41 2HB ALA 41 18.625 1.111 -11.056
274 HB3 ALA 41 3HB ALA 41 20.403 1.065 -11.002
275 H ILE 42 H ILE 42 17.908 4.621 -10.117
276 HA ILE 42 HA ILE 42 16.274 4.038 -7.746
277 HB ILE 42 HB ILE 42 16.600 6.307 -9.678
278 HG12 ILE 42 2HG1 ILE 42 16.537 7.609 -7.586
279 HG13 ILE 42 3HG1 ILE 42 16.102 6.158 -6.669
280 HG21 ILE 42 1HG2 ILE 42 14.064 5.866 -8.058
281 HG22 ILE 42 2HG2 ILE 42 14.522 7.371 -8.884
282 HG23 ILE 42 3HG2 ILE 42 14.184 5.922 -9.839
283 HD11 ILE 42 1HD1 ILE 42 18.684 6.527 -8.245
284 HD12 ILE 42 2HD1 ILE 42 18.514 6.719 -6.484
285 HD13 ILE 42 3HD1 ILE 42 18.255 5.126 -7.226
286 H ARG 43 H ARG 43 14.217 3.261 -7.740
287 HA ARG 43 HA ARG 43 13.043 2.422 -10.359
288 HB2 ARG 43 2HB ARG 43 12.504 1.444 -7.530
289 HB3 ARG 43 3HB ARG 43 11.731 0.829 -8.999
290 HG2 ARG 43 2HG ARG 43 14.724 0.661 -8.407
291 HG3 ARG 43 3HG ARG 43 13.548 -0.639 -8.158
292 HD2 ARG 43 2HD ARG 43 14.458 -1.165 -10.234
293 HD3 ARG 43 3HD ARG 43 12.953 -0.335 -10.667
294 HE ARG 43 HE ARG 43 14.560 1.747 -10.806
295 HH11 ARG 43 1HH1 ARG 43 15.300 -1.557 -11.806
296 HH12 ARG 43 2HH1 ARG 43 16.468 -1.057 -13.007
297 HH21 ARG 43 1HH2 ARG 43 16.054 2.380 -12.370
298 HH22 ARG 43 2HH2 ARG 43 16.893 1.183 -13.334
299 H ASP 44 H ASP 44 12.554 4.255 -7.378
300 HA ASP 44 HA ASP 44 10.333 5.661 -8.639
301 HB2 ASP 44 2HB ASP 44 9.933 3.841 -6.281
302 HB3 ASP 44 3HB ASP 44 8.971 5.315 -6.429
303 H ILE 45 H ILE 45 9.562 7.530 -7.512
304 HA ILE 45 HA ILE 45 11.347 8.620 -5.412
305 HB ILE 45 HB ILE 45 10.698 9.898 -8.102
306 HG12 ILE 45 2HG1 ILE 45 12.677 8.411 -8.099
307 HG13 ILE 45 3HG1 ILE 45 13.081 10.112 -8.391
308 HG21 ILE 45 1HG2 ILE 45 11.842 11.159 -5.587
309 HG22 ILE 45 2HG2 ILE 45 11.970 11.876 -7.212
310 HG23 ILE 45 3HG2 ILE 45 10.377 11.625 -6.492
311 HD11 ILE 45 1HD1 ILE 45 13.375 8.679 -5.718
312 HD12 ILE 45 2HD1 ILE 45 14.692 9.050 -6.846
313 HD13 ILE 45 3HD1 ILE 45 13.809 10.374 -6.054
314 H ASP 46 H ASP 46 10.320 10.222 -4.124
315 HA ASP 46 HA ASP 46 7.489 10.826 -4.797
316 HB2 ASP 46 2HB ASP 46 7.567 8.946 -3.123
317 HB3 ASP 46 3HB ASP 46 8.457 10.019 -2.031
318 H LEU 47 H LEU 47 9.508 12.552 -5.445
319 HA LEU 47 HA LEU 47 10.214 14.470 -3.513
320 HB2 LEU 47 2HB LEU 47 11.088 14.572 -5.769
321 HB3 LEU 47 3HB LEU 47 9.460 14.758 -6.443
322 HG LEU 47 HG LEU 47 9.230 16.947 -5.262
323 HD11 LEU 47 1HD1 LEU 47 11.285 18.002 -4.338
324 HD12 LEU 47 2HD1 LEU 47 10.812 16.567 -3.405
325 HD13 LEU 47 3HD1 LEU 47 12.159 16.470 -4.560
326 HD21 LEU 47 1HD2 LEU 47 11.691 16.683 -7.036
327 HD22 LEU 47 2HD2 LEU 47 10.008 16.838 -7.602
328 HD23 LEU 47 3HD2 LEU 47 10.779 18.178 -6.730
329 H LYS 48 H LYS 48 9.115 15.995 -2.369
330 HA LYS 48 HA LYS 48 6.277 16.524 -3.023
331 HB2 LYS 48 2HB LYS 48 6.617 14.405 -1.577
332 HB3 LYS 48 3HB LYS 48 7.130 15.512 -0.290
333 HG2 LYS 48 2HG LYS 48 4.919 16.699 -0.513
334 HG3 LYS 48 3HG LYS 48 4.435 15.493 -1.719
335 HD2 LYS 48 2HD LYS 48 5.109 15.034 1.213
336 HD3 LYS 48 3HD LYS 48 3.529 14.846 0.444
337 HE2 LYS 48 2HE LYS 48 6.000 13.154 -0.143
338 HE3 LYS 48 3HE LYS 48 4.622 12.650 0.845
339 HZ1 LYS 48 1HZ LYS 48 3.224 12.837 -1.067
340 HZ2 LYS 48 2HZ LYS 48 4.482 13.357 -2.006
341 HZ3 LYS 48 3HZ LYS 48 4.493 11.838 -1.400
342 H ASN 49 H ASN 49 5.451 18.410 -1.962
343 HA ASN 49 HA ASN 49 7.399 20.007 -0.396
344 HB2 ASN 49 2HB ASN 49 6.025 20.901 -2.955
345 HB3 ASN 49 3HB ASN 49 6.837 22.001 -1.831
346 HD21 ASN 49 1HD2 ASN 49 8.995 20.116 -4.639
347 HD22 ASN 49 2HD2 ASN 49 7.247 20.227 -4.646
348 H ARG 50 H ARG 50 4.343 18.729 -0.664
349 HA ARG 50 HA ARG 50 2.310 19.173 0.227
350 HB2 ARG 50 2HB ARG 50 3.743 18.731 2.200
351 HB3 ARG 50 3HB ARG 50 3.957 20.482 2.417
352 HG2 ARG 50 2HG ARG 50 1.509 20.755 2.701
353 HG3 ARG 50 3HG ARG 50 1.271 19.023 2.402
354 HD2 ARG 50 2HD ARG 50 2.869 20.229 4.699
355 HD3 ARG 50 3HD ARG 50 1.234 19.563 4.817
356 HE ARG 50 HE ARG 50 2.164 17.359 4.181
357 HH11 ARG 50 1HH1 ARG 50 4.382 19.813 5.461
358 HH12 ARG 50 2HH1 ARG 50 5.573 18.627 5.949
359 HH21 ARG 50 1HH2 ARG 50 3.744 15.878 4.766
360 HH22 ARG 50 2HH2 ARG 50 5.210 16.403 5.573
361 H ARG 51 H ARG 51 3.205 22.083 1.913
362 HA ARG 51 HA ARG 51 2.061 23.795 -0.211
363 HB2 ARG 51 2HB ARG 51 0.980 23.632 2.629
364 HB3 ARG 51 3HB ARG 51 0.489 24.823 1.400
365 HG2 ARG 51 2HG ARG 51 -0.307 22.967 -0.053
366 HG3 ARG 51 3HG ARG 51 0.132 21.799 1.213
367 HD2 ARG 51 2HD ARG 51 -1.390 22.951 2.794
368 HD3 ARG 51 3HD ARG 51 -1.871 24.064 1.505
369 HE ARG 51 HE ARG 51 -2.316 21.099 1.429
370 HH11 ARG 51 1HH1 ARG 51 -3.379 24.398 0.728
371 HH12 ARG 51 2HH1 ARG 51 -4.891 23.884 0.015
372 HH21 ARG 51 1HH2 ARG 51 -4.294 20.455 0.490
373 HH22 ARG 51 2HH2 ARG 51 -5.406 21.657 -0.123
374 H GLY 52 H GLY 52 4.588 23.253 1.788
375 HA2 GLY 52 2HA GLY 52 5.819 25.718 1.567
376 HA3 GLY 52 3HA GLY 52 4.909 25.815 3.086
377 H GLY 53 H GLY 53 7.362 26.103 3.667
378 HA2 GLY 53 2HA GLY 53 8.996 25.247 5.059
379 HA3 GLY 53 3HA GLY 53 8.230 23.653 4.982
380 HA PRO 54 HA PRO 54 12.155 23.773 2.392
381 HB2 PRO 54 2HB PRO 54 13.522 21.794 3.757
382 HB3 PRO 54 3HB PRO 54 13.627 23.534 4.164
383 HG2 PRO 54 2HG PRO 54 11.923 21.397 5.454
384 HG3 PRO 54 3HG PRO 54 12.880 22.699 6.243
385 HD2 PRO 54 2HD PRO 54 10.177 22.890 5.835
386 HD3 PRO 54 3HD PRO 54 11.258 24.318 5.754
387 HA PRO 55 HA PRO 55 10.612 20.407 0.057
388 HB2 PRO 55 2HB PRO 55 13.385 19.679 -0.748
389 HB3 PRO 55 3HB PRO 55 11.995 20.153 -1.773
390 HG2 PRO 55 2HG PRO 55 14.098 21.847 -1.290
391 HG3 PRO 55 3HG PRO 55 12.411 22.439 -1.477
392 HD2 PRO 55 2HD PRO 55 14.005 22.023 1.050
393 HD3 PRO 55 3HD PRO 55 12.836 23.316 0.632
394 H PHE 56 H PHE 56 10.410 18.144 -0.021
395 HA PHE 56 HA PHE 56 12.126 16.477 1.657
396 HB2 PHE 56 2HB PHE 56 10.783 16.833 3.420
397 HB3 PHE 56 3HB PHE 56 9.413 17.324 2.428
398 HD1 PHE 56 HD1 PHE 56 7.703 15.846 1.800
399 HD2 PHE 56 HD2 PHE 56 11.225 14.334 3.755
400 HE1 PHE 56 HE1 PHE 56 6.601 13.642 2.097
401 HE2 PHE 56 HE2 PHE 56 10.114 12.141 4.046
402 HZ PHE 56 HZ PHE 56 7.815 11.789 3.201
403 H ALA 57 H ALA 57 12.040 14.219 1.191
404 HA ALA 57 HA ALA 57 10.218 13.353 -0.918
405 HB1 ALA 57 1HB ALA 57 13.188 13.678 -1.511
406 HB2 ALA 57 2HB ALA 57 11.963 12.969 -2.594
407 HB3 ALA 57 3HB ALA 57 11.894 14.695 -2.176
408 H PHE 58 H PHE 58 10.329 11.168 -1.405
409 HA PHE 58 HA PHE 58 12.233 9.541 0.181
410 HB2 PHE 58 2HB PHE 58 9.367 9.114 -0.437
411 HB3 PHE 58 3HB PHE 58 10.420 7.704 -0.512
412 HD1 PHE 58 HD1 PHE 58 11.065 6.562 1.389
413 HD2 PHE 58 HD2 PHE 58 9.403 10.507 1.769
414 HE1 PHE 58 HE1 PHE 58 11.046 6.308 3.849
415 HE2 PHE 58 HE2 PHE 58 9.320 10.223 4.241
416 HZ PHE 58 HZ PHE 58 10.161 8.136 5.278
417 H VAL 59 H VAL 59 13.201 7.695 -0.785
418 HA VAL 59 HA VAL 59 13.250 7.766 -3.755
419 HB VAL 59 HB VAL 59 15.650 7.796 -1.876
420 HG11 VAL 59 1HG1 VAL 59 15.447 7.619 -4.905
421 HG12 VAL 59 2HG1 VAL 59 16.958 7.863 -3.994
422 HG13 VAL 59 3HG1 VAL 59 16.047 6.348 -3.806
423 HG21 VAL 59 1HG2 VAL 59 14.650 9.829 -3.918
424 HG22 VAL 59 2HG2 VAL 59 14.638 10.027 -2.146
425 HG23 VAL 59 3HG2 VAL 59 16.180 9.931 -3.015
426 H GLU 60 H GLU 60 13.370 5.745 -4.682
427 HA GLU 60 HA GLU 60 13.718 3.459 -2.789
428 HB2 GLU 60 2HB GLU 60 11.368 3.739 -3.300
429 HB3 GLU 60 3HB GLU 60 11.711 3.793 -5.039
430 HG2 GLU 60 2HG GLU 60 12.489 1.485 -5.022
431 HG3 GLU 60 3HG GLU 60 12.419 1.432 -3.253
432 H PHE 61 H PHE 61 15.543 2.498 -3.223
433 HA PHE 61 HA PHE 61 16.661 2.455 -5.910
434 HB2 PHE 61 2HB PHE 61 17.623 1.499 -3.220
435 HB3 PHE 61 3HB PHE 61 18.480 1.125 -4.721
436 HD1 PHE 61 HD1 PHE 61 17.749 3.695 -2.247
437 HD2 PHE 61 HD2 PHE 61 19.434 2.935 -6.129
438 HE1 PHE 61 HE1 PHE 61 18.953 5.869 -2.156
439 HE2 PHE 61 HE2 PHE 61 20.625 5.116 -6.035
440 HZ PHE 61 HZ PHE 61 20.374 6.578 -4.055
441 H GLU 62 H GLU 62 17.444 0.539 -6.989
442 HA GLU 62 HA GLU 62 15.534 -1.658 -6.925
443 HB2 GLU 62 2HB GLU 62 16.417 -0.945 -9.057
444 HB3 GLU 62 3HB GLU 62 18.079 -1.056 -8.460
445 HG2 GLU 62 2HG GLU 62 17.617 -2.941 -9.915
446 HG3 GLU 62 3HG GLU 62 17.874 -3.510 -8.269
447 H ASP 63 H ASP 63 18.741 -0.973 -5.617
448 HA ASP 63 HA ASP 63 18.764 -3.668 -4.382
449 HB2 ASP 63 2HB ASP 63 21.034 -2.221 -5.767
450 HB3 ASP 63 3HB ASP 63 21.312 -3.522 -4.604
451 HA PRO 64 HA PRO 64 19.356 -1.575 -0.596
452 HB2 PRO 64 2HB PRO 64 20.670 -3.487 0.891
453 HB3 PRO 64 3HB PRO 64 18.940 -3.613 0.439
454 HG2 PRO 64 2HG PRO 64 21.333 -4.919 -0.877
455 HG3 PRO 64 3HG PRO 64 19.732 -5.636 -0.498
456 HD2 PRO 64 2HD PRO 64 20.408 -4.704 -2.991
457 HD3 PRO 64 3HD PRO 64 18.736 -4.631 -2.364
458 H ARG 65 H ARG 65 22.126 -2.892 -2.357
459 HA ARG 65 HA ARG 65 24.126 -1.558 -0.716
460 HB2 ARG 65 2HB ARG 65 24.265 -2.780 -3.503
461 HB3 ARG 65 3HB ARG 65 25.661 -2.257 -2.542
462 HG2 ARG 65 2HG ARG 65 23.676 -4.430 -1.743
463 HG3 ARG 65 3HG ARG 65 25.302 -4.701 -2.379
464 HD2 ARG 65 2HD ARG 65 26.266 -3.481 -0.435
465 HD3 ARG 65 3HD ARG 65 24.634 -3.254 0.221
466 HE ARG 65 HE ARG 65 25.278 -6.038 -0.334
467 HH11 ARG 65 1HH1 ARG 65 25.561 -3.412 2.015
468 HH12 ARG 65 2HH1 ARG 65 25.677 -4.487 3.386
469 HH21 ARG 65 1HH2 ARG 65 25.457 -7.430 1.465
470 HH22 ARG 65 2HH2 ARG 65 25.636 -6.771 3.073
471 H ASP 66 H ASP 66 22.107 -0.687 -3.472
472 HA ASP 66 HA ASP 66 23.693 1.653 -4.156
473 HB2 ASP 66 2HB ASP 66 20.876 0.785 -4.849
474 HB3 ASP 66 3HB ASP 66 21.611 2.293 -5.419
475 H ALA 67 H ALA 67 20.959 0.956 -1.997
476 HA ALA 67 HA ALA 67 20.474 3.721 -1.318
477 HB1 ALA 67 1HB ALA 67 19.120 2.720 0.501
478 HB2 ALA 67 2HB ALA 67 18.776 1.936 -1.059
479 HB3 ALA 67 3HB ALA 67 19.806 1.124 0.139
480 H GLU 68 H GLU 68 22.600 1.126 -0.140
481 HA GLU 68 HA GLU 68 23.352 2.372 2.319
482 HB2 GLU 68 2HB GLU 68 23.705 -0.005 1.837
483 HB3 GLU 68 3HB GLU 68 24.801 0.410 0.501
484 HG2 GLU 68 2HG GLU 68 26.365 1.467 2.080
485 HG3 GLU 68 3HG GLU 68 25.268 1.108 3.424
486 H ASP 69 H ASP 69 24.479 2.708 -1.044
487 HA ASP 69 HA ASP 69 26.801 4.262 -0.306
488 HB2 ASP 69 2HB ASP 69 25.421 3.665 -2.931
489 HB3 ASP 69 3HB ASP 69 26.824 4.740 -2.814
490 H ALA 70 H ALA 70 23.467 5.077 -1.298
491 HA ALA 70 HA ALA 70 24.042 7.882 -1.666
492 HB1 ALA 70 1HB ALA 70 21.444 6.386 -1.129
493 HB2 ALA 70 2HB ALA 70 21.575 8.075 -1.681
494 HB3 ALA 70 3HB ALA 70 22.139 6.746 -2.729
495 H VAL 71 H VAL 71 23.214 5.815 1.088
496 HA VAL 71 HA VAL 71 22.559 8.070 2.823
497 HB VAL 71 HB VAL 71 22.962 5.081 3.252
498 HG11 VAL 71 1HG1 VAL 71 23.648 6.222 5.316
499 HG12 VAL 71 2HG1 VAL 71 22.157 7.199 5.288
500 HG13 VAL 71 3HG1 VAL 71 22.071 5.443 5.541
501 HG21 VAL 71 1HG2 VAL 71 20.547 5.097 3.634
502 HG22 VAL 71 2HG2 VAL 71 20.493 6.865 3.444
503 HG23 VAL 71 3HG2 VAL 71 20.898 5.829 2.058
504 H SER 72 H SER 72 25.261 5.676 2.523
505 HA SER 72 HA SER 72 26.719 6.836 4.700
506 HB2 SER 72 2HB SER 72 26.928 4.482 4.024
507 HB3 SER 72 3HB SER 72 27.601 4.981 2.456
508 HG SER 72 HG SER 72 28.724 5.467 5.020
509 H GLY 73 H GLY 73 26.356 7.825 1.403
510 HA2 GLY 73 2HA GLY 73 29.052 9.085 1.347
511 HA3 GLY 73 3HA GLY 73 28.020 8.755 -0.048
512 H ARG 74 H ARG 74 25.940 10.070 2.268
513 HA ARG 74 HA ARG 74 26.607 12.863 1.634
514 HB2 ARG 74 2HB ARG 74 25.575 12.108 -0.431
515 HB3 ARG 74 3HB ARG 74 24.182 11.462 0.450
516 HG2 ARG 74 2HG ARG 74 23.415 13.650 1.046
517 HG3 ARG 74 3HG ARG 74 24.960 14.398 0.585
518 HD2 ARG 74 2HD ARG 74 23.186 14.780 -1.105
519 HD3 ARG 74 3HD ARG 74 24.576 13.911 -1.760
520 HE ARG 74 HE ARG 74 21.902 12.730 -1.121
521 HH11 ARG 74 1HH1 ARG 74 25.066 12.492 -2.682
522 HH12 ARG 74 2HH1 ARG 74 24.635 11.060 -3.590
523 HH21 ARG 74 1HH2 ARG 74 21.365 10.874 -2.344
524 HH22 ARG 74 2HH2 ARG 74 22.553 10.161 -3.405
525 H ASP 75 H ASP 75 24.961 10.518 3.593
526 HA ASP 75 HA ASP 75 23.015 12.289 4.744
527 HB2 ASP 75 2HB ASP 75 22.968 9.785 4.852
528 HB3 ASP 75 3HB ASP 75 24.358 9.839 5.950
529 H GLY 76 H GLY 76 23.101 13.523 6.646
530 HA2 GLY 76 2HA GLY 76 23.978 14.668 8.397
531 HA3 GLY 76 3HA GLY 76 25.121 13.324 8.605
532 H TYR 77 H TYR 77 24.840 15.597 5.777
533 HA TYR 77 HA TYR 77 27.718 16.024 6.088
534 HB2 TYR 77 2HB TYR 77 27.191 15.383 3.917
535 HB3 TYR 77 3HB TYR 77 25.814 16.482 3.823
536 HD1 TYR 77 HD1 TYR 77 29.531 16.638 4.366
537 HD2 TYR 77 HD2 TYR 77 26.040 18.448 2.620
538 HE1 TYR 77 HE1 TYR 77 30.960 18.389 3.343
539 HE2 TYR 77 HE2 TYR 77 27.461 20.203 1.590
540 HH TYR 77 HH TYR 77 31.020 20.265 2.015
541 H ASP 78 H ASP 78 28.720 17.755 6.697
542 HA ASP 78 HA ASP 78 27.282 19.845 8.038
543 HB2 ASP 78 2HB ASP 78 29.442 19.056 8.811
544 HB3 ASP 78 3HB ASP 78 30.200 19.508 7.283
545 H TYR 79 H TYR 79 25.899 20.844 6.526
546 HA TYR 79 HA TYR 79 26.952 22.076 4.090
547 HB2 TYR 79 2HB TYR 79 24.616 21.085 4.538
548 HB3 TYR 79 3HB TYR 79 24.303 22.519 5.520
549 HD1 TYR 79 HD1 TYR 79 23.457 24.458 4.475
550 HD2 TYR 79 HD2 TYR 79 25.394 21.441 2.115
551 HE1 TYR 79 HE1 TYR 79 22.776 25.657 2.409
552 HE2 TYR 79 HE2 TYR 79 24.738 22.637 0.031
553 HH TYR 79 HH TYR 79 22.868 25.695 0.106
554 H ASP 80 H ASP 80 25.943 24.531 3.963
555 HA ASP 80 HA ASP 80 27.580 26.115 5.668
556 HB2 ASP 80 2HB ASP 80 25.429 26.776 3.635
557 HB3 ASP 80 3HB ASP 80 26.404 27.994 4.472
558 H GLY 81 H GLY 81 26.701 25.300 7.764
559 HA2 GLY 81 2HA GLY 81 25.721 26.132 9.720
560 HA3 GLY 81 3HA GLY 81 24.649 27.170 8.753
561 H TYR 82 H TYR 82 24.688 24.024 7.462
562 HA TYR 82 HA TYR 82 22.408 23.141 9.137
563 HB2 TYR 82 2HB TYR 82 22.422 23.437 6.132
564 HB3 TYR 82 3HB TYR 82 21.264 22.430 7.009
565 HD1 TYR 82 HD1 TYR 82 22.433 25.902 6.502
566 HD2 TYR 82 HD2 TYR 82 19.426 23.355 8.212
567 HE1 TYR 82 HE1 TYR 82 20.995 27.888 6.904
568 HE2 TYR 82 HE2 TYR 82 17.977 25.335 8.622
569 HH TYR 82 HH TYR 82 18.975 28.646 7.695
570 H ARG 83 H ARG 83 21.666 20.816 8.133
571 HA ARG 83 HA ARG 83 24.090 19.140 7.782
572 HB2 ARG 83 2HB ARG 83 23.685 19.461 10.233
573 HB3 ARG 83 3HB ARG 83 22.050 18.839 10.022
574 HG2 ARG 83 2HG ARG 83 23.452 17.055 10.868
575 HG3 ARG 83 3HG ARG 83 23.010 16.676 9.190
576 HD2 ARG 83 2HD ARG 83 25.396 16.222 9.643
577 HD3 ARG 83 3HD ARG 83 25.212 17.495 8.422
578 HE ARG 83 HE ARG 83 25.451 18.991 10.648
579 HH11 ARG 83 1HH1 ARG 83 27.315 16.195 9.538
580 HH12 ARG 83 2HH1 ARG 83 28.761 16.678 10.389
581 HH21 ARG 83 1HH2 ARG 83 27.351 19.599 11.738
582 HH22 ARG 83 2HH2 ARG 83 28.784 18.606 11.621
583 H LEU 84 H LEU 84 23.650 17.944 6.042
584 HA LEU 84 HA LEU 84 21.055 17.663 4.911
585 HB2 LEU 84 2HB LEU 84 23.745 16.350 4.487
586 HB3 LEU 84 3HB LEU 84 22.320 15.703 3.671
587 HG LEU 84 HG LEU 84 23.573 17.273 2.243
588 HD11 LEU 84 1HD1 LEU 84 21.122 16.967 1.958
589 HD12 LEU 84 2HD1 LEU 84 20.836 18.355 3.035
590 HD13 LEU 84 3HD1 LEU 84 21.663 18.592 1.489
591 HD21 LEU 84 1HD2 LEU 84 24.368 18.795 4.061
592 HD22 LEU 84 2HD2 LEU 84 23.608 19.655 2.701
593 HD23 LEU 84 3HD2 LEU 84 22.710 19.430 4.214
594 H ARG 85 H ARG 85 19.716 15.816 4.665
595 HA ARG 85 HA ARG 85 20.133 13.641 6.670
596 HB2 ARG 85 2HB ARG 85 17.491 14.986 5.983
597 HB3 ARG 85 3HB ARG 85 17.749 13.662 7.139
598 HG2 ARG 85 2HG ARG 85 19.181 15.147 8.515
599 HG3 ARG 85 3HG ARG 85 18.906 16.476 7.368
600 HD2 ARG 85 2HD ARG 85 16.468 16.305 7.778
601 HD3 ARG 85 3HD ARG 85 16.766 15.041 8.984
602 HE ARG 85 HE ARG 85 18.278 16.916 10.050
603 HH11 ARG 85 1HH1 ARG 85 15.108 17.329 8.511
604 HH12 ARG 85 2HH1 ARG 85 14.733 18.768 9.430
605 HH21 ARG 85 1HH2 ARG 85 17.745 18.782 11.230
606 HH22 ARG 85 2HH2 ARG 85 16.202 19.566 10.995
607 H VAL 86 H VAL 86 20.490 11.856 5.603
608 HA VAL 86 HA VAL 86 18.640 11.094 3.433
609 HB VAL 86 HB VAL 86 21.666 10.870 3.152
610 HG11 VAL 86 1HG1 VAL 86 20.429 9.040 2.075
611 HG12 VAL 86 2HG1 VAL 86 19.350 10.209 1.283
612 HG13 VAL 86 3HG1 VAL 86 21.073 10.155 0.842
613 HG21 VAL 86 1HG2 VAL 86 20.982 13.211 2.860
614 HG22 VAL 86 2HG2 VAL 86 21.402 12.485 1.292
615 HG23 VAL 86 3HG2 VAL 86 19.695 12.710 1.735
616 H GLU 87 H GLU 87 17.721 9.722 5.014
617 HA GLU 87 HA GLU 87 19.289 7.282 5.566
618 HB2 GLU 87 2HB GLU 87 18.834 7.385 7.970
619 HB3 GLU 87 3HB GLU 87 19.781 8.798 7.475
620 HG2 GLU 87 2HG GLU 87 17.755 10.185 7.420
621 HG3 GLU 87 3HG GLU 87 16.749 8.782 7.818
622 H PHE 88 H PHE 88 17.901 5.549 6.526
623 HA PHE 88 HA PHE 88 15.238 5.651 5.380
624 HB2 PHE 88 2HB PHE 88 15.182 3.256 6.410
625 HB3 PHE 88 3HB PHE 88 16.113 3.629 4.954
626 HD1 PHE 88 HD1 PHE 88 18.540 3.652 4.955
627 HD2 PHE 88 HD2 PHE 88 16.323 2.802 8.535
628 HE1 PHE 88 HE1 PHE 88 20.606 2.799 6.029
629 HE2 PHE 88 HE2 PHE 88 18.393 1.940 9.612
630 HZ PHE 88 HZ PHE 88 20.532 1.941 8.361
631 HA PRO 89 HA PRO 89 12.664 6.641 8.742
632 HB2 PRO 89 2HB PRO 89 11.179 4.080 8.263
633 HB3 PRO 89 3HB PRO 89 10.552 5.757 8.366
634 HG2 PRO 89 2HG PRO 89 10.828 4.499 5.969
635 HG3 PRO 89 3HG PRO 89 11.212 6.242 6.157
636 HD2 PRO 89 2HD PRO 89 13.100 3.896 6.042
637 HD3 PRO 89 3HD PRO 89 13.273 5.535 5.330
638 H5' A 90 1H5* A 90 11.939 19.012 17.057
639 H5'' A 90 2H5* A 90 13.656 19.195 16.638
640 H4' A 90 H4* A 90 12.373 19.583 14.639
641 H3' A 90 H3* A 90 14.134 21.531 15.695
642 H2' A 90 1H2* A 90 12.428 23.013 16.369
643 HO2' A 90 2HO* A 90 13.592 24.117 14.716
644 H1' A 90 H1* A 90 10.856 22.164 13.916
645 H8 A 90 H8 A 90 9.656 24.596 14.198
646 H61 A 90 1H6 A 90 6.230 24.633 19.356
647 H62 A 90 2H6 A 90 6.563 25.454 17.841
648 H2 A 90 H2 A 90 8.915 21.088 19.516
649 HO5' A 90 H5T A 90 13.084 20.298 18.575
650 H5' A 91 1H5* A 91 13.327 19.401 10.849
651 H5'' A 91 2H5* A 91 12.005 19.852 11.951
652 H4' A 91 H4* A 91 12.947 16.977 11.596
653 H3' A 91 H3* A 91 11.264 18.699 9.848
654 H2' A 91 1H2* A 91 9.405 17.222 9.782
655 HO2' A 91 2HO* A 91 10.723 15.305 9.534
656 H1' A 91 H1* A 91 9.317 16.575 12.393
657 H8 A 91 H8 A 91 9.118 19.306 9.897
658 H61 A 91 1H6 A 91 6.516 22.862 14.249
659 H62 A 91 2H6 A 91 6.864 22.717 12.541
660 H2 A 91 H2 A 91 8.189 19.243 16.234
661 H5' C 92 1H5* C 92 10.634 15.684 5.548
662 H5'' C 92 2H5* C 92 9.271 16.428 6.407
663 H4' C 92 H4* C 92 8.625 14.217 5.602
664 H3' C 92 H3* C 92 8.428 14.994 8.331
665 H2' C 92 1H2* C 92 10.039 13.462 9.093
666 HO2' C 92 2HO* C 92 7.685 11.890 8.728
667 H1' C 92 H1* C 92 9.185 11.568 6.882
668 H41 C 92 1H4 C 92 14.285 8.374 8.968
669 H42 C 92 2H4 C 92 15.069 9.835 9.527
670 H5 C 92 H5 C 92 14.015 12.049 9.344
671 H6 C 92 H6 C 92 12.054 13.243 8.535
672 H5' A 93 1H5* A 93 3.895 13.173 5.758
673 H5'' A 93 2H5* A 93 5.228 12.014 5.560
674 H4' A 93 H4* A 93 4.484 13.804 3.252
675 H3' A 93 H3* A 93 2.475 12.272 4.469
676 H2' A 93 1H2* A 93 2.901 10.108 3.870
677 HO2' A 93 2HO* A 93 1.645 10.682 1.988
678 H1' A 93 H1* A 93 4.959 10.270 1.903
679 H8 A 93 H8 A 93 4.411 10.315 5.692
680 H61 A 93 1H6 A 93 8.154 5.355 5.690
681 H62 A 93 2H6 A 93 7.198 6.420 6.702
682 H2 A 93 H2 A 93 7.868 6.920 1.530
683 H5' A 94 1H5* A 94 -0.467 12.261 2.529
684 H5'' A 94 2H5* A 94 -0.879 13.806 1.751
685 H4' A 94 H4* A 94 -1.968 12.984 4.477
686 H3' A 94 H3* A 94 -2.673 11.510 2.346
687 H2' A 94 1H2* A 94 -2.885 13.221 0.765
688 HO2' A 94 2HO* A 94 -5.448 13.023 1.984
689 H1' A 94 H1* A 94 -4.439 15.100 2.479
690 H8 A 94 H8 A 94 -2.998 14.681 -0.662
691 H61 A 94 1H6 A 94 -0.457 20.331 -0.508
692 H62 A 94 2H6 A 94 -0.881 18.972 -1.528
693 H2 A 94 H2 A 94 -1.647 19.239 3.643
694 H5' A 95 1H5* A 95 -3.509 12.537 6.402
695 H5'' A 95 2H5* A 95 -1.939 11.840 6.841
696 H4' A 95 H4* A 95 -4.644 10.535 7.419
697 H3' A 95 H3* A 95 -3.649 12.724 8.733
698 HO3' A 95 H3T A 95 -4.795 11.884 10.512
699 H2' A 95 1H2* A 95 -1.516 11.803 9.207
700 HO2' A 95 2HO* A 95 -3.162 10.939 11.381
701 H1' A 95 H1* A 95 -2.791 9.176 9.969
702 H8 A 95 H8 A 95 -0.499 8.637 11.240
703 H61 A 95 1H6 A 95 4.226 8.430 7.237
704 H62 A 95 2H6 A 95 3.715 8.070 8.877
705 H2 A 95 H2 A 95 0.723 10.188 5.141
Start of MODEL 8
1 H VAL 6 H1 VAL 6 -1.159 4.812 10.430
2 HA VAL 6 HA VAL 6 -1.191 6.796 9.147
3 HB VAL 6 HB VAL 6 1.665 5.832 9.455
4 HG11 VAL 6 1HG1 VAL 6 1.432 8.041 8.403
5 HG12 VAL 6 2HG1 VAL 6 0.343 8.568 9.709
6 HG13 VAL 6 3HG1 VAL 6 2.052 8.209 10.057
7 HG21 VAL 6 1HG2 VAL 6 1.474 6.659 11.794
8 HG22 VAL 6 2HG2 VAL 6 -0.275 6.889 11.552
9 HG23 VAL 6 3HG2 VAL 6 0.438 5.255 11.498
10 H ILE 7 H ILE 7 -0.732 7.958 7.264
11 HA ILE 7 HA ILE 7 -0.643 6.403 4.853
12 HB ILE 7 HB ILE 7 -0.342 9.393 5.336
13 HG12 ILE 7 2HG1 ILE 7 -2.755 7.692 4.567
14 HG13 ILE 7 3HG1 ILE 7 -2.463 8.395 6.170
15 HG21 ILE 7 1HG2 ILE 7 0.539 8.737 3.121
16 HG22 ILE 7 2HG2 ILE 7 -0.962 7.845 2.776
17 HG23 ILE 7 3HG2 ILE 7 -0.978 9.616 2.945
18 HD11 ILE 7 1HD1 ILE 7 -4.014 9.819 4.971
19 HD12 ILE 7 2HD1 ILE 7 -2.466 10.679 5.124
20 HD13 ILE 7 3HD1 ILE 7 -2.918 9.927 3.576
21 H ARG 8 H ARG 8 0.985 6.353 3.234
22 HA ARG 8 HA ARG 8 3.682 7.305 3.972
23 HB2 ARG 8 2HB ARG 8 3.245 4.919 4.822
24 HB3 ARG 8 3HB ARG 8 3.209 4.414 3.129
25 HG2 ARG 8 2HG ARG 8 5.558 6.029 4.138
26 HG3 ARG 8 3HG ARG 8 5.417 4.327 4.600
27 HD2 ARG 8 2HD ARG 8 5.159 3.792 2.107
28 HD3 ARG 8 3HD ARG 8 5.728 5.449 1.795
29 HE ARG 8 HE ARG 8 7.619 4.537 3.501
30 HH11 ARG 8 1HH1 ARG 8 6.230 3.182 0.538
31 HH12 ARG 8 2HH1 ARG 8 7.699 2.341 0.105
32 HH21 ARG 8 1HH2 ARG 8 9.510 3.404 2.911
33 HH22 ARG 8 2HH2 ARG 8 9.521 2.426 1.458
34 H GLY 9 H GLY 9 5.130 7.306 2.111
35 HA2 GLY 9 2HA GLY 9 4.216 8.419 -0.195
36 HA3 GLY 9 3HA GLY 9 5.693 7.482 -0.098
37 HA PRO 10 HA PRO 10 2.033 5.271 -2.359
38 HB2 PRO 10 2HB PRO 10 2.212 6.173 -4.952
39 HB3 PRO 10 3HB PRO 10 1.220 6.975 -3.694
40 HG2 PRO 10 2HG PRO 10 3.985 7.707 -4.665
41 HG3 PRO 10 3HG PRO 10 2.588 8.789 -4.330
42 HD2 PRO 10 2HD PRO 10 4.646 8.388 -2.543
43 HD3 PRO 10 3HD PRO 10 2.964 8.698 -2.014
44 H ALA 11 H ALA 11 2.200 3.832 -4.392
45 HA ALA 11 HA ALA 11 3.185 2.204 -5.553
46 HB1 ALA 11 1HB ALA 11 5.629 4.005 -5.583
47 HB2 ALA 11 2HB ALA 11 5.278 2.668 -6.696
48 HB3 ALA 11 3HB ALA 11 4.240 4.116 -6.693
49 H GLY 12 H GLY 12 3.722 2.443 -2.433
50 HA2 GLY 12 2HA GLY 12 4.567 -0.168 -2.115
51 HA3 GLY 12 3HA GLY 12 6.069 0.765 -2.106
52 H ASN 13 H ASN 13 5.134 -0.769 0.069
53 HA ASN 13 HA ASN 13 4.966 1.374 2.115
54 HB2 ASN 13 2HB ASN 13 3.300 -1.173 2.054
55 HB3 ASN 13 3HB ASN 13 3.424 -0.077 3.441
56 HD21 ASN 13 1HD2 ASN 13 0.728 0.686 0.570
57 HD22 ASN 13 2HD2 ASN 13 1.569 -0.839 0.761
58 H ASN 14 H ASN 14 6.517 -1.305 0.817
59 HA ASN 14 HA ASN 14 8.391 -1.402 3.051
60 HB2 ASN 14 2HB ASN 14 6.667 -3.120 3.674
61 HB3 ASN 14 3HB ASN 14 6.925 -3.909 2.113
62 HD21 ASN 14 1HD2 ASN 14 9.041 -5.954 4.182
63 HD22 ASN 14 2HD2 ASN 14 7.401 -5.782 3.589
64 H ASP 15 H ASP 15 10.194 -0.932 1.872
65 HA ASP 15 HA ASP 15 10.866 -2.452 -0.508
66 HB2 ASP 15 2HB ASP 15 10.862 -0.310 -1.936
67 HB3 ASP 15 3HB ASP 15 9.315 -1.111 -1.631
68 H CYS 16 H CYS 16 12.770 -1.314 -1.710
69 HA CYS 16 HA CYS 16 14.878 -0.871 0.233
70 HB2 CYS 16 2HB CYS 16 14.825 -0.780 -2.807
71 HB3 CYS 16 3HB CYS 16 16.290 -0.664 -1.804
72 HG CYS 16 HG CYS 16 14.066 -3.083 -2.031
73 H ARG 17 H ARG 17 12.567 1.160 -0.090
74 HA ARG 17 HA ARG 17 13.766 3.484 -1.295
75 HB2 ARG 17 2HB ARG 17 11.289 2.844 -1.095
76 HB3 ARG 17 3HB ARG 17 11.391 3.396 0.590
77 HG2 ARG 17 2HG ARG 17 12.114 5.629 -0.182
78 HG3 ARG 17 3HG ARG 17 12.099 5.050 -1.865
79 HD2 ARG 17 2HD ARG 17 9.683 5.170 -0.005
80 HD3 ARG 17 3HD ARG 17 10.044 6.341 -1.288
81 HE ARG 17 HE ARG 17 9.993 3.698 -2.388
82 HH11 ARG 17 1HH1 ARG 17 7.830 6.193 -1.119
83 HH12 ARG 17 2HH1 ARG 17 6.472 5.651 -2.088
84 HH21 ARG 17 1HH2 ARG 17 8.225 3.073 -3.661
85 HH22 ARG 17 2HH2 ARG 17 6.688 3.908 -3.511
86 H ILE 18 H ILE 18 14.446 5.389 -0.315
87 HA ILE 18 HA ILE 18 15.050 5.277 2.592
88 HB ILE 18 HB ILE 18 17.242 6.173 2.222
89 HG12 ILE 18 2HG1 ILE 18 16.698 6.098 -0.770
90 HG13 ILE 18 3HG1 ILE 18 16.643 7.576 0.215
91 HG21 ILE 18 1HG2 ILE 18 18.342 4.304 1.179
92 HG22 ILE 18 2HG2 ILE 18 16.900 3.690 2.005
93 HG23 ILE 18 3HG2 ILE 18 16.882 3.895 0.241
94 HD11 ILE 18 1HD1 ILE 18 18.813 7.368 -0.893
95 HD12 ILE 18 2HD1 ILE 18 19.005 7.240 0.869
96 HD13 ILE 18 3HD1 ILE 18 19.075 5.778 -0.146
97 H TYR 19 H TYR 19 16.049 7.671 3.058
98 HA TYR 19 HA TYR 19 13.954 9.537 2.111
99 HB2 TYR 19 2HB TYR 19 13.076 9.146 4.118
100 HB3 TYR 19 3HB TYR 19 14.597 8.660 4.844
101 HD1 TYR 19 HD1 TYR 19 12.375 11.522 4.160
102 HD2 TYR 19 HD2 TYR 19 16.157 10.270 5.785
103 HE1 TYR 19 HE1 TYR 19 12.578 13.687 5.377
104 HE2 TYR 19 HE2 TYR 19 16.367 12.431 6.986
105 HH TYR 19 HH TYR 19 13.889 15.001 6.699
106 H VAL 20 H VAL 20 14.296 11.731 2.081
107 HA VAL 20 HA VAL 20 17.072 12.672 2.406
108 HB VAL 20 HB VAL 20 15.403 13.092 -0.106
109 HG11 VAL 20 1HG1 VAL 20 16.822 15.023 0.436
110 HG12 VAL 20 2HG1 VAL 20 18.238 13.960 0.618
111 HG13 VAL 20 3HG1 VAL 20 17.463 14.164 -0.972
112 HG21 VAL 20 1HG2 VAL 20 17.179 11.779 -1.238
113 HG22 VAL 20 2HG2 VAL 20 17.907 11.422 0.341
114 HG23 VAL 20 3HG2 VAL 20 16.280 10.805 -0.061
115 H GLY 21 H GLY 21 17.182 14.883 2.998
116 HA2 GLY 21 2HA GLY 21 14.716 16.467 3.052
117 HA3 GLY 21 3HA GLY 21 15.262 15.887 4.630
118 H ASN 22 H ASN 22 15.164 18.403 4.685
119 HA ASN 22 HA ASN 22 16.170 20.416 4.833
120 HB2 ASN 22 2HB ASN 22 17.721 18.935 6.251
121 HB3 ASN 22 3HB ASN 22 18.810 18.931 4.859
122 HD21 ASN 22 1HD2 ASN 22 20.292 21.925 5.915
123 HD22 ASN 22 2HD2 ASN 22 20.468 20.300 5.278
124 H LEU 23 H LEU 23 15.759 19.235 2.087
125 HA LEU 23 HA LEU 23 17.971 19.976 0.437
126 HB2 LEU 23 2HB LEU 23 14.998 19.727 -0.158
127 HB3 LEU 23 3HB LEU 23 16.259 19.916 -1.393
128 HG LEU 23 HG LEU 23 16.140 17.621 0.620
129 HD11 LEU 23 1HD1 LEU 23 15.387 17.733 -2.326
130 HD12 LEU 23 2HD1 LEU 23 15.408 16.272 -1.306
131 HD13 LEU 23 3HD1 LEU 23 14.251 17.579 -0.967
132 HD21 LEU 23 1HD2 LEU 23 18.422 18.065 -0.171
133 HD22 LEU 23 2HD2 LEU 23 17.803 16.603 -0.970
134 HD23 LEU 23 3HD2 LEU 23 17.848 18.136 -1.856
135 HA PRO 24 HA PRO 24 17.521 24.438 0.691
136 HB2 PRO 24 2HB PRO 24 19.072 24.322 -1.863
137 HB3 PRO 24 3HB PRO 24 19.409 25.266 -0.377
138 HG2 PRO 24 2HG PRO 24 20.846 23.022 -1.009
139 HG3 PRO 24 3HG PRO 24 20.417 23.421 0.686
140 HD2 PRO 24 2HD PRO 24 19.131 21.425 -1.166
141 HD3 PRO 24 3HD PRO 24 19.455 21.307 0.595
142 HA PRO 25 HA PRO 25 14.178 25.090 -2.108
143 HB2 PRO 25 2HB PRO 25 14.171 27.841 -2.345
144 HB3 PRO 25 3HB PRO 25 13.649 26.975 -0.867
145 HG2 PRO 25 2HG PRO 25 16.324 28.274 -1.438
146 HG3 PRO 25 3HG PRO 25 15.348 28.339 0.063
147 HD2 PRO 25 2HD PRO 25 17.467 26.625 -0.257
148 HD3 PRO 25 3HD PRO 25 16.023 26.191 0.715
149 H ASP 26 H ASP 26 17.431 25.991 -2.911
150 HA ASP 26 HA ASP 26 16.803 26.866 -5.622
151 HB2 ASP 26 2HB ASP 26 19.405 26.328 -4.166
152 HB3 ASP 26 3HB ASP 26 19.311 26.874 -5.850
153 H ILE 27 H ILE 27 16.907 23.832 -4.182
154 HA ILE 27 HA ILE 27 18.311 22.378 -6.246
155 HB ILE 27 HB ILE 27 16.428 21.621 -3.989
156 HG12 ILE 27 2HG1 ILE 27 18.735 22.336 -3.410
157 HG13 ILE 27 3HG1 ILE 27 18.420 20.646 -3.003
158 HG21 ILE 27 1HG2 ILE 27 17.731 19.796 -6.041
159 HG22 ILE 27 2HG2 ILE 27 17.068 19.238 -4.485
160 HG23 ILE 27 3HG2 ILE 27 15.996 19.970 -5.691
161 HD11 ILE 27 1HD1 ILE 27 19.921 21.605 -5.480
162 HD12 ILE 27 2HD1 ILE 27 20.651 20.927 -4.014
163 HD13 ILE 27 3HD1 ILE 27 19.617 19.908 -5.039
164 H ARG 28 H ARG 28 17.607 21.383 -8.035
165 HA ARG 28 HA ARG 28 14.931 22.123 -9.035
166 HB2 ARG 28 2HB ARG 28 17.143 20.529 -10.376
167 HB3 ARG 28 3HB ARG 28 15.721 21.243 -11.161
168 HG2 ARG 28 2HG ARG 28 16.506 23.504 -10.599
169 HG3 ARG 28 3HG ARG 28 17.909 22.829 -9.747
170 HD2 ARG 28 2HD ARG 28 17.278 22.447 -12.708
171 HD3 ARG 28 3HD ARG 28 18.500 23.551 -12.039
172 HE ARG 28 HE ARG 28 18.850 20.806 -11.150
173 HH11 ARG 28 1HH1 ARG 28 19.511 23.054 -13.791
174 HH12 ARG 28 2HH1 ARG 28 20.887 22.146 -14.376
175 HH21 ARG 28 1HH2 ARG 28 20.615 19.649 -11.910
176 HH22 ARG 28 2HH2 ARG 28 21.528 20.208 -13.300
177 H THR 29 H THR 29 13.423 20.515 -9.845
178 HA THR 29 HA THR 29 13.149 18.294 -8.079
179 HB THR 29 HB THR 29 11.128 17.842 -9.136
180 HG1 THR 29 1HG THR 29 10.729 18.463 -11.271
181 HG21 THR 29 1HG2 THR 29 11.238 20.163 -8.179
182 HG22 THR 29 2HG2 THR 29 11.612 20.777 -9.810
183 HG23 THR 29 3HG2 THR 29 10.052 19.984 -9.492
184 H LYS 30 H LYS 30 14.968 18.622 -10.985
185 HA LYS 30 HA LYS 30 14.916 15.749 -11.592
186 HB2 LYS 30 2HB LYS 30 14.937 17.484 -13.376
187 HB3 LYS 30 3HB LYS 30 16.504 18.065 -12.796
188 HG2 LYS 30 2HG LYS 30 16.808 16.612 -14.734
189 HG3 LYS 30 3HG LYS 30 17.505 15.843 -13.300
190 HD2 LYS 30 2HD LYS 30 15.464 14.447 -13.065
191 HD3 LYS 30 3HD LYS 30 14.743 15.261 -14.472
192 HE2 LYS 30 2HE LYS 30 16.651 14.466 -15.872
193 HE3 LYS 30 3HE LYS 30 17.303 13.610 -14.463
194 HZ1 LYS 30 1HZ LYS 30 14.697 13.106 -15.730
195 HZ2 LYS 30 2HZ LYS 30 16.030 12.139 -15.816
196 HZ3 LYS 30 3HZ LYS 30 15.252 12.349 -14.382
197 H ASP 31 H ASP 31 16.804 17.968 -9.657
198 HA ASP 31 HA ASP 31 19.319 16.621 -9.823
199 HB2 ASP 31 2HB ASP 31 18.109 18.324 -7.613
200 HB3 ASP 31 3HB ASP 31 19.813 17.851 -7.713
201 H ILE 32 H ILE 32 16.362 15.870 -8.110
202 HA ILE 32 HA ILE 32 17.545 14.179 -6.097
203 HB ILE 32 HB ILE 32 14.771 14.636 -7.217
204 HG12 ILE 32 2HG1 ILE 32 14.317 15.183 -4.817
205 HG13 ILE 32 3HG1 ILE 32 16.027 14.892 -4.446
206 HG21 ILE 32 1HG2 ILE 32 14.838 12.222 -6.802
207 HG22 ILE 32 2HG2 ILE 32 15.555 12.502 -5.194
208 HG23 ILE 32 3HG2 ILE 32 13.891 13.027 -5.547
209 HD11 ILE 32 1HD1 ILE 32 15.039 16.960 -6.456
210 HD12 ILE 32 2HD1 ILE 32 15.430 17.317 -4.757
211 HD13 ILE 32 3HD1 ILE 32 16.705 16.758 -5.851
212 H GLU 33 H GLU 33 16.876 13.809 -9.513
213 HA GLU 33 HA GLU 33 16.980 10.855 -9.307
214 HB2 GLU 33 2HB GLU 33 16.488 12.719 -11.666
215 HB3 GLU 33 3HB GLU 33 16.411 10.940 -11.704
216 HG2 GLU 33 2HG GLU 33 14.617 11.012 -9.973
217 HG3 GLU 33 3HG GLU 33 14.644 12.784 -10.036
218 H ASP 34 H ASP 34 18.815 13.661 -10.592
219 HA ASP 34 HA ASP 34 20.630 12.045 -12.101
220 HB2 ASP 34 2HB ASP 34 20.764 14.904 -11.119
221 HB3 ASP 34 3HB ASP 34 22.033 14.155 -12.093
222 H VAL 35 H VAL 35 20.923 13.468 -8.813
223 HA VAL 35 HA VAL 35 23.640 12.524 -8.515
224 HB VAL 35 HB VAL 35 21.577 13.432 -6.464
225 HG11 VAL 35 1HG1 VAL 35 24.598 13.070 -6.257
226 HG12 VAL 35 2HG1 VAL 35 23.563 13.824 -5.021
227 HG13 VAL 35 3HG1 VAL 35 23.366 12.105 -5.416
228 HG21 VAL 35 1HG2 VAL 35 22.817 15.567 -6.555
229 HG22 VAL 35 2HG2 VAL 35 23.854 14.917 -7.846
230 HG23 VAL 35 3HG2 VAL 35 22.117 15.166 -8.134
231 H PHE 36 H PHE 36 20.400 11.317 -7.531
232 HA PHE 36 HA PHE 36 21.581 9.109 -6.094
233 HB2 PHE 36 2HB PHE 36 18.751 9.847 -6.786
234 HB3 PHE 36 3HB PHE 36 19.172 8.320 -5.996
235 HD1 PHE 36 HD1 PHE 36 19.551 8.212 -3.665
236 HD2 PHE 36 HD2 PHE 36 19.493 12.031 -5.645
237 HE1 PHE 36 HE1 PHE 36 19.647 9.359 -1.468
238 HE2 PHE 36 HE2 PHE 36 19.592 13.174 -3.446
239 HZ PHE 36 HZ PHE 36 19.675 11.841 -1.360
240 H SER 37 H SER 37 20.500 9.566 -9.419
241 HA SER 37 HA SER 37 20.472 6.758 -10.062
242 HB2 SER 37 2HB SER 37 19.348 8.395 -11.489
243 HB3 SER 37 3HB SER 37 20.887 9.231 -11.787
244 HG SER 37 HG SER 37 20.333 7.777 -13.466
245 H LYS 38 H LYS 38 22.991 9.254 -9.845
246 HA LYS 38 HA LYS 38 25.045 7.681 -11.117
247 HB2 LYS 38 2HB LYS 38 25.211 10.125 -10.919
248 HB3 LYS 38 3HB LYS 38 25.159 10.008 -9.150
249 HG2 LYS 38 2HG LYS 38 27.452 10.361 -9.911
250 HG3 LYS 38 3HG LYS 38 27.299 8.758 -9.167
251 HD2 LYS 38 2HD LYS 38 27.131 7.712 -11.406
252 HD3 LYS 38 3HD LYS 38 27.217 9.316 -12.167
253 HE2 LYS 38 2HE LYS 38 29.414 8.234 -12.226
254 HE3 LYS 38 3HE LYS 38 29.465 9.662 -11.186
255 HZ1 LYS 38 1HZ LYS 38 30.562 7.770 -10.201
256 HZ2 LYS 38 2HZ LYS 38 29.273 8.215 -9.285
257 HZ3 LYS 38 3HZ LYS 38 29.177 6.885 -10.253
258 H TYR 39 H TYR 39 23.733 7.931 -7.831
259 HA TYR 39 HA TYR 39 25.831 6.202 -6.780
260 HB2 TYR 39 2HB TYR 39 23.600 7.757 -5.573
261 HB3 TYR 39 3HB TYR 39 24.273 6.392 -4.679
262 HD1 TYR 39 HD1 TYR 39 26.127 6.661 -3.352
263 HD2 TYR 39 HD2 TYR 39 25.408 9.480 -6.519
264 HE1 TYR 39 HE1 TYR 39 28.025 8.025 -2.554
265 HE2 TYR 39 HE2 TYR 39 27.315 10.858 -5.726
266 HH TYR 39 HH TYR 39 29.274 9.926 -2.870
267 H GLY 40 H GLY 40 22.853 5.523 -8.342
268 HA2 GLY 40 2HA GLY 40 23.237 2.748 -8.150
269 HA3 GLY 40 3HA GLY 40 22.134 3.192 -6.837
270 H ALA 41 H ALA 41 21.157 1.484 -8.629
271 HA ALA 41 HA ALA 41 19.857 2.819 -10.866
272 HB1 ALA 41 1HB ALA 41 19.520 0.038 -9.674
273 HB2 ALA 41 2HB ALA 41 18.838 0.592 -11.217
274 HB3 ALA 41 3HB ALA 41 20.601 0.485 -11.016
275 H ILE 42 H ILE 42 18.355 4.333 -10.305
276 HA ILE 42 HA ILE 42 16.485 3.959 -8.117
277 HB ILE 42 HB ILE 42 16.576 5.924 -10.442
278 HG12 ILE 42 2HG1 ILE 42 17.356 6.236 -7.515
279 HG13 ILE 42 3HG1 ILE 42 18.490 6.052 -8.872
280 HG21 ILE 42 1HG2 ILE 42 14.857 5.963 -7.928
281 HG22 ILE 42 2HG2 ILE 42 14.944 7.259 -9.141
282 HG23 ILE 42 3HG2 ILE 42 14.277 5.689 -9.590
283 HD11 ILE 42 1HD1 ILE 42 16.548 8.354 -8.417
284 HD12 ILE 42 2HD1 ILE 42 18.321 8.404 -8.376
285 HD13 ILE 42 3HD1 ILE 42 17.485 8.112 -9.915
286 H ARG 43 H ARG 43 14.277 3.446 -8.244
287 HA ARG 43 HA ARG 43 13.247 2.618 -10.914
288 HB2 ARG 43 2HB ARG 43 12.968 1.102 -8.287
289 HB3 ARG 43 3HB ARG 43 12.107 0.696 -9.780
290 HG2 ARG 43 2HG ARG 43 15.140 0.763 -9.488
291 HG3 ARG 43 3HG ARG 43 14.135 -0.697 -9.418
292 HD2 ARG 43 2HD ARG 43 13.370 -0.350 -11.711
293 HD3 ARG 43 3HD ARG 43 14.223 1.199 -11.805
294 HE ARG 43 HE ARG 43 15.724 -1.347 -11.349
295 HH11 ARG 43 1HH1 ARG 43 15.136 1.578 -13.240
296 HH12 ARG 43 2HH1 ARG 43 16.529 1.328 -14.272
297 HH21 ARG 43 1HH2 ARG 43 17.537 -1.619 -12.648
298 HH22 ARG 43 2HH2 ARG 43 17.897 -0.489 -13.934
299 H ASP 44 H ASP 44 12.770 4.220 -7.868
300 HA ASP 44 HA ASP 44 10.393 5.462 -8.983
301 HB2 ASP 44 2HB ASP 44 10.195 3.596 -6.641
302 HB3 ASP 44 3HB ASP 44 9.182 5.045 -6.690
303 H ILE 45 H ILE 45 9.642 7.333 -7.884
304 HA ILE 45 HA ILE 45 11.498 8.481 -5.869
305 HB ILE 45 HB ILE 45 10.662 9.679 -8.542
306 HG12 ILE 45 2HG1 ILE 45 12.758 8.419 -8.596
307 HG13 ILE 45 3HG1 ILE 45 13.036 10.161 -8.791
308 HG21 ILE 45 1HG2 ILE 45 10.216 11.417 -6.940
309 HG22 ILE 45 2HG2 ILE 45 11.754 11.119 -6.094
310 HG23 ILE 45 3HG2 ILE 45 11.749 11.799 -7.736
311 HD11 ILE 45 1HD1 ILE 45 14.724 9.187 -7.295
312 HD12 ILE 45 2HD1 ILE 45 13.698 10.319 -6.394
313 HD13 ILE 45 3HD1 ILE 45 13.465 8.562 -6.224
314 H ASP 46 H ASP 46 10.545 10.114 -4.561
315 HA ASP 46 HA ASP 46 7.663 10.597 -4.922
316 HB2 ASP 46 2HB ASP 46 7.869 8.531 -3.570
317 HB3 ASP 46 3HB ASP 46 8.870 9.411 -2.399
318 H LEU 47 H LEU 47 9.732 12.358 -5.428
319 HA LEU 47 HA LEU 47 10.442 14.067 -3.281
320 HB2 LEU 47 2HB LEU 47 11.512 14.319 -5.415
321 HB3 LEU 47 3HB LEU 47 9.957 14.518 -6.238
322 HG LEU 47 HG LEU 47 9.600 16.678 -5.049
323 HD11 LEU 47 1HD1 LEU 47 12.467 16.230 -4.088
324 HD12 LEU 47 2HD1 LEU 47 11.542 17.730 -3.906
325 HD13 LEU 47 3HD1 LEU 47 11.022 16.264 -3.051
326 HD21 LEU 47 1HD2 LEU 47 10.610 16.591 -7.293
327 HD22 LEU 47 2HD2 LEU 47 11.285 17.931 -6.330
328 HD23 LEU 47 3HD2 LEU 47 12.225 16.436 -6.567
329 H LYS 48 H LYS 48 9.364 15.585 -2.111
330 HA LYS 48 HA LYS 48 6.607 16.337 -2.944
331 HB2 LYS 48 2HB LYS 48 7.725 15.420 -0.285
332 HB3 LYS 48 3HB LYS 48 6.317 16.487 -0.371
333 HG2 LYS 48 2HG LYS 48 5.146 14.809 -1.794
334 HG3 LYS 48 3HG LYS 48 6.546 13.716 -1.637
335 HD2 LYS 48 2HD LYS 48 6.280 13.678 0.808
336 HD3 LYS 48 3HD LYS 48 4.966 14.864 0.709
337 HE2 LYS 48 2HE LYS 48 4.036 12.631 1.013
338 HE3 LYS 48 3HE LYS 48 3.625 13.232 -0.609
339 HZ1 LYS 48 1HZ LYS 48 5.417 11.905 -1.480
340 HZ2 LYS 48 2HZ LYS 48 5.809 11.366 0.027
341 HZ3 LYS 48 3HZ LYS 48 4.369 10.964 -0.649
342 H ASN 49 H ASN 49 6.041 18.488 -2.637
343 HA ASN 49 HA ASN 49 8.194 20.370 -2.012
344 HB2 ASN 49 2HB ASN 49 6.547 22.071 -2.532
345 HB3 ASN 49 3HB ASN 49 6.472 20.814 -3.777
346 HD21 ASN 49 1HD2 ASN 49 3.041 21.881 -2.319
347 HD22 ASN 49 2HD2 ASN 49 4.444 22.834 -2.755
348 H ARG 50 H ARG 50 5.938 18.509 -0.307
349 HA ARG 50 HA ARG 50 5.195 18.383 1.800
350 HB2 ARG 50 2HB ARG 50 7.649 18.673 2.224
351 HB3 ARG 50 3HB ARG 50 7.345 20.393 2.536
352 HG2 ARG 50 2HG ARG 50 5.886 19.848 4.414
353 HG3 ARG 50 3HG ARG 50 5.941 18.118 4.004
354 HD2 ARG 50 2HD ARG 50 8.362 18.067 4.474
355 HD3 ARG 50 3HD ARG 50 8.346 19.804 4.813
356 HE ARG 50 HE ARG 50 7.395 19.401 6.892
357 HH11 ARG 50 1HH1 ARG 50 7.386 16.442 4.959
358 HH12 ARG 50 2HH1 ARG 50 6.867 15.437 6.299
359 HH21 ARG 50 1HH2 ARG 50 6.734 18.041 8.626
360 HH22 ARG 50 2HH2 ARG 50 6.468 16.335 8.329
361 H ARG 51 H ARG 51 3.893 19.386 3.439
362 HA ARG 51 HA ARG 51 2.263 21.508 2.359
363 HB2 ARG 51 2HB ARG 51 1.335 19.626 3.597
364 HB3 ARG 51 3HB ARG 51 2.272 20.058 5.036
365 HG2 ARG 51 2HG ARG 51 1.002 22.078 5.369
366 HG3 ARG 51 3HG ARG 51 0.240 21.941 3.769
367 HD2 ARG 51 2HD ARG 51 -1.298 21.226 5.568
368 HD3 ARG 51 3HD ARG 51 -0.926 19.902 4.456
369 HE ARG 51 HE ARG 51 0.184 20.239 7.213
370 HH11 ARG 51 1HH1 ARG 51 -0.528 18.196 4.412
371 HH12 ARG 51 2HH1 ARG 51 -0.082 16.719 5.239
372 HH21 ARG 51 1HH2 ARG 51 0.736 18.285 8.262
373 HH22 ARG 51 2HH2 ARG 51 0.612 16.766 7.402
374 H GLY 52 H GLY 52 5.168 21.525 4.150
375 HA2 GLY 52 2HA GLY 52 5.236 24.369 4.291
376 HA3 GLY 52 3HA GLY 52 4.903 23.702 5.903
377 H GLY 53 H GLY 53 7.273 25.124 5.378
378 HA2 GLY 53 2HA GLY 53 9.527 24.927 5.831
379 HA3 GLY 53 3HA GLY 53 9.293 23.192 6.118
380 HA PRO 54 HA PRO 54 11.623 23.925 2.120
381 HB2 PRO 54 2HB PRO 54 13.820 22.362 2.752
382 HB3 PRO 54 3HB PRO 54 13.699 24.115 3.111
383 HG2 PRO 54 2HG PRO 54 13.170 21.767 4.946
384 HG3 PRO 54 3HG PRO 54 14.066 23.281 5.302
385 HD2 PRO 54 2HD PRO 54 11.460 22.907 6.047
386 HD3 PRO 54 3HD PRO 54 12.068 24.509 5.540
387 HA PRO 55 HA PRO 55 10.217 20.129 0.357
388 HB2 PRO 55 2HB PRO 55 12.696 20.051 -1.301
389 HB3 PRO 55 3HB PRO 55 10.981 20.059 -1.825
390 HG2 PRO 55 2HG PRO 55 12.561 22.280 -2.060
391 HG3 PRO 55 3HG PRO 55 10.826 22.400 -1.621
392 HD2 PRO 55 2HD PRO 55 13.241 22.557 0.177
393 HD3 PRO 55 3HD PRO 55 11.727 23.515 0.216
394 H PHE 56 H PHE 56 10.684 17.828 0.124
395 HA PHE 56 HA PHE 56 13.217 16.739 1.099
396 HB2 PHE 56 2HB PHE 56 12.414 15.789 3.082
397 HB3 PHE 56 3HB PHE 56 11.650 17.371 3.130
398 HD1 PHE 56 HD1 PHE 56 9.230 17.314 1.745
399 HD2 PHE 56 HD2 PHE 56 11.135 14.034 3.760
400 HE1 PHE 56 HE1 PHE 56 7.033 16.175 1.973
401 HE2 PHE 56 HE2 PHE 56 8.939 12.914 4.026
402 HZ PHE 56 HZ PHE 56 6.898 13.955 3.079
403 H ALA 57 H ALA 57 12.916 14.204 0.926
404 HA ALA 57 HA ALA 57 10.800 13.427 -0.952
405 HB1 ALA 57 1HB ALA 57 13.711 13.542 -1.835
406 HB2 ALA 57 2HB ALA 57 12.345 12.919 -2.789
407 HB3 ALA 57 3HB ALA 57 12.436 14.648 -2.382
408 H PHE 58 H PHE 58 11.187 11.188 -1.797
409 HA PHE 58 HA PHE 58 12.934 9.526 -0.063
410 HB2 PHE 58 2HB PHE 58 10.101 8.829 -0.948
411 HB3 PHE 58 3HB PHE 58 11.181 7.789 -0.031
412 HD1 PHE 58 HD1 PHE 58 11.795 8.340 2.312
413 HD2 PHE 58 HD2 PHE 58 8.827 10.564 0.133
414 HE1 PHE 58 HE1 PHE 58 10.931 9.269 4.437
415 HE2 PHE 58 HE2 PHE 58 7.997 11.530 2.260
416 HZ PHE 58 HZ PHE 58 9.030 10.862 4.415
417 H VAL 59 H VAL 59 13.850 7.732 -1.172
418 HA VAL 59 HA VAL 59 13.543 7.805 -4.136
419 HB VAL 59 HB VAL 59 16.120 7.829 -2.511
420 HG11 VAL 59 1HG1 VAL 59 15.667 7.636 -5.518
421 HG12 VAL 59 2HG1 VAL 59 17.243 7.882 -4.734
422 HG13 VAL 59 3HG1 VAL 59 16.346 6.370 -4.465
423 HG21 VAL 59 1HG2 VAL 59 16.547 9.958 -3.714
424 HG22 VAL 59 2HG2 VAL 59 14.928 9.857 -4.450
425 HG23 VAL 59 3HG2 VAL 59 15.100 10.056 -2.692
426 H GLU 60 H GLU 60 13.472 5.783 -5.058
427 HA GLU 60 HA GLU 60 13.922 3.510 -3.180
428 HB2 GLU 60 2HB GLU 60 11.570 3.812 -3.601
429 HB3 GLU 60 3HB GLU 60 11.843 3.858 -5.356
430 HG2 GLU 60 2HG GLU 60 12.570 1.554 -5.383
431 HG3 GLU 60 3HG GLU 60 12.587 1.482 -3.608
432 H PHE 61 H PHE 61 15.522 2.257 -3.640
433 HA PHE 61 HA PHE 61 16.636 2.191 -6.363
434 HB2 PHE 61 2HB PHE 61 17.592 1.107 -3.718
435 HB3 PHE 61 3HB PHE 61 18.410 0.803 -5.256
436 HD1 PHE 61 HD1 PHE 61 18.074 3.061 -2.503
437 HD2 PHE 61 HD2 PHE 61 19.127 2.844 -6.666
438 HE1 PHE 61 HE1 PHE 61 19.288 5.209 -2.305
439 HE2 PHE 61 HE2 PHE 61 20.339 5.001 -6.468
440 HZ PHE 61 HZ PHE 61 20.424 6.183 -4.292
441 H GLU 62 H GLU 62 17.259 0.149 -7.404
442 HA GLU 62 HA GLU 62 15.123 -1.802 -7.374
443 HB2 GLU 62 2HB GLU 62 16.388 -1.281 -9.404
444 HB3 GLU 62 3HB GLU 62 17.896 -1.839 -8.642
445 HG2 GLU 62 2HG GLU 62 17.022 -4.109 -8.453
446 HG3 GLU 62 3HG GLU 62 15.439 -3.595 -9.056
447 H ASP 63 H ASP 63 18.313 -1.522 -5.868
448 HA ASP 63 HA ASP 63 17.824 -4.069 -4.408
449 HB2 ASP 63 2HB ASP 63 20.390 -3.093 -5.689
450 HB3 ASP 63 3HB ASP 63 20.348 -4.343 -4.437
451 HA PRO 64 HA PRO 64 18.648 -1.681 -0.782
452 HB2 PRO 64 2HB PRO 64 19.508 -3.640 0.945
453 HB3 PRO 64 3HB PRO 64 17.803 -3.463 0.436
454 HG2 PRO 64 2HG PRO 64 19.903 -5.364 -0.646
455 HG3 PRO 64 3HG PRO 64 18.187 -5.700 -0.248
456 HD2 PRO 64 2HD PRO 64 19.079 -5.197 -2.801
457 HD3 PRO 64 3HD PRO 64 17.440 -4.733 -2.238
458 H ARG 65 H ARG 65 21.023 -3.473 -2.543
459 HA ARG 65 HA ARG 65 23.383 -2.940 -1.025
460 HB2 ARG 65 2HB ARG 65 23.235 -4.633 -2.798
461 HB3 ARG 65 3HB ARG 65 22.863 -3.370 -3.986
462 HG2 ARG 65 2HG ARG 65 25.140 -2.339 -3.451
463 HG3 ARG 65 3HG ARG 65 25.486 -3.801 -2.500
464 HD2 ARG 65 2HD ARG 65 26.395 -4.045 -4.761
465 HD3 ARG 65 3HD ARG 65 25.050 -5.175 -4.552
466 HE ARG 65 HE ARG 65 25.024 -2.640 -6.131
467 HH11 ARG 65 1HH1 ARG 65 23.506 -5.731 -5.290
468 HH12 ARG 65 2HH1 ARG 65 22.268 -5.578 -6.520
469 HH21 ARG 65 1HH2 ARG 65 23.408 -2.501 -7.733
470 HH22 ARG 65 2HH2 ARG 65 22.244 -3.796 -7.919
471 H ASP 66 H ASP 66 21.589 -1.095 -3.504
472 HA ASP 66 HA ASP 66 23.686 0.896 -3.783
473 HB2 ASP 66 2HB ASP 66 20.822 0.742 -4.768
474 HB3 ASP 66 3HB ASP 66 21.921 2.074 -5.137
475 H ALA 67 H ALA 67 21.041 0.447 -1.581
476 HA ALA 67 HA ALA 67 20.543 3.236 -1.052
477 HB1 ALA 67 1HB ALA 67 18.893 1.482 -0.590
478 HB2 ALA 67 2HB ALA 67 19.996 0.723 0.583
479 HB3 ALA 67 3HB ALA 67 19.325 2.334 0.914
480 H GLU 68 H GLU 68 22.878 0.837 0.152
481 HA GLU 68 HA GLU 68 23.591 2.340 2.516
482 HB2 GLU 68 2HB GLU 68 25.060 0.155 0.982
483 HB3 GLU 68 3HB GLU 68 25.518 0.775 2.580
484 HG2 GLU 68 2HG GLU 68 23.274 0.112 3.451
485 HG3 GLU 68 3HG GLU 68 22.879 -0.581 1.866
486 H ASP 69 H ASP 69 24.536 2.427 -0.884
487 HA ASP 69 HA ASP 69 26.994 3.903 -0.367
488 HB2 ASP 69 2HB ASP 69 25.482 3.179 -2.890
489 HB3 ASP 69 3HB ASP 69 26.960 4.144 -2.891
490 H ALA 70 H ALA 70 23.658 4.722 -1.308
491 HA ALA 70 HA ALA 70 24.326 7.469 -1.955
492 HB1 ALA 70 1HB ALA 70 21.865 7.714 -2.099
493 HB2 ALA 70 2HB ALA 70 22.418 6.276 -2.980
494 HB3 ALA 70 3HB ALA 70 21.657 6.104 -1.379
495 H VAL 71 H VAL 71 23.384 5.678 0.953
496 HA VAL 71 HA VAL 71 22.629 8.070 2.447
497 HB VAL 71 HB VAL 71 23.080 5.136 3.109
498 HG11 VAL 71 1HG1 VAL 71 22.340 7.393 5.018
499 HG12 VAL 71 2HG1 VAL 71 22.192 5.657 5.384
500 HG13 VAL 71 3HG1 VAL 71 23.791 6.366 5.097
501 HG21 VAL 71 1HG2 VAL 71 20.636 6.958 3.171
502 HG22 VAL 71 2HG2 VAL 71 21.008 5.772 1.902
503 HG23 VAL 71 3HG2 VAL 71 20.653 5.220 3.557
504 H SER 72 H SER 72 25.366 5.685 2.676
505 HA SER 72 HA SER 72 26.742 7.371 4.575
506 HB2 SER 72 2HB SER 72 27.644 4.938 2.981
507 HB3 SER 72 3HB SER 72 28.561 5.682 4.309
508 HG SER 72 HG SER 72 27.254 3.940 5.020
509 H GLY 73 H GLY 73 26.324 7.793 1.290
510 HA2 GLY 73 2HA GLY 73 29.084 8.535 0.652
511 HA3 GLY 73 3HA GLY 73 27.672 8.630 -0.412
512 H ARG 74 H ARG 74 26.271 10.194 1.977
513 HA ARG 74 HA ARG 74 27.700 12.729 1.938
514 HB2 ARG 74 2HB ARG 74 25.959 13.930 0.596
515 HB3 ARG 74 3HB ARG 74 26.933 12.793 -0.343
516 HG2 ARG 74 2HG ARG 74 25.146 11.109 -0.231
517 HG3 ARG 74 3HG ARG 74 24.157 12.198 0.775
518 HD2 ARG 74 2HD ARG 74 23.955 13.794 -1.009
519 HD3 ARG 74 3HD ARG 74 25.186 12.968 -1.981
520 HE ARG 74 HE ARG 74 22.370 12.219 -1.704
521 HH11 ARG 74 1HH1 ARG 74 25.624 11.191 -2.617
522 HH12 ARG 74 2HH1 ARG 74 25.063 9.907 -3.657
523 HH21 ARG 74 1HH2 ARG 74 21.653 10.530 -3.077
524 HH22 ARG 74 2HH2 ARG 74 22.815 9.525 -3.909
525 H ASP 75 H ASP 75 26.069 10.761 3.771
526 HA ASP 75 HA ASP 75 23.843 12.328 4.638
527 HB2 ASP 75 2HB ASP 75 23.952 10.888 6.706
528 HB3 ASP 75 3HB ASP 75 23.719 10.064 5.172
529 H GLY 76 H GLY 76 23.536 13.807 6.227
530 HA2 GLY 76 2HA GLY 76 24.016 15.368 7.823
531 HA3 GLY 76 3HA GLY 76 25.283 14.268 8.392
532 H TYR 77 H TYR 77 24.622 16.700 5.778
533 HA TYR 77 HA TYR 77 27.492 17.405 5.964
534 HB2 TYR 77 2HB TYR 77 27.182 16.559 3.820
535 HB3 TYR 77 3HB TYR 77 25.659 17.420 3.592
536 HD1 TYR 77 HD1 TYR 77 25.584 19.635 2.733
537 HD2 TYR 77 HD2 TYR 77 29.340 17.876 3.874
538 HE1 TYR 77 HE1 TYR 77 26.788 21.523 1.653
539 HE2 TYR 77 HE2 TYR 77 30.554 19.762 2.797
540 HH TYR 77 HH TYR 77 28.822 22.457 1.183
541 H ASP 78 H ASP 78 28.211 19.386 6.197
542 HA ASP 78 HA ASP 78 26.585 21.124 7.743
543 HB2 ASP 78 2HB ASP 78 28.886 20.966 8.234
544 HB3 ASP 78 3HB ASP 78 29.355 21.335 6.568
545 H TYR 79 H TYR 79 24.927 22.215 6.979
546 HA TYR 79 HA TYR 79 25.356 23.921 4.584
547 HB2 TYR 79 2HB TYR 79 23.660 22.289 4.177
548 HB3 TYR 79 3HB TYR 79 22.865 22.640 5.712
549 HD1 TYR 79 HD1 TYR 79 23.422 23.786 2.261
550 HD2 TYR 79 HD2 TYR 79 21.494 24.625 6.003
551 HE1 TYR 79 HE1 TYR 79 21.943 25.425 1.122
552 HE2 TYR 79 HE2 TYR 79 19.982 26.250 4.871
553 HH TYR 79 HH TYR 79 19.417 27.263 2.895
554 H ASP 80 H ASP 80 23.943 25.964 4.648
555 HA ASP 80 HA ASP 80 24.868 27.557 6.767
556 HB2 ASP 80 2HB ASP 80 22.705 27.969 4.685
557 HB3 ASP 80 3HB ASP 80 23.234 29.226 5.806
558 H GLY 81 H GLY 81 24.330 26.921 8.817
559 HA2 GLY 81 2HA GLY 81 23.060 27.182 10.724
560 HA3 GLY 81 3HA GLY 81 21.685 27.695 9.726
561 H TYR 82 H TYR 82 22.592 24.871 8.277
562 HA TYR 82 HA TYR 82 21.141 23.112 10.162
563 HB2 TYR 82 2HB TYR 82 20.276 23.678 7.315
564 HB3 TYR 82 3HB TYR 82 19.702 22.309 8.267
565 HD1 TYR 82 HD1 TYR 82 19.697 25.992 8.004
566 HD2 TYR 82 HD2 TYR 82 18.099 22.559 10.036
567 HE1 TYR 82 HE1 TYR 82 17.939 27.423 9.020
568 HE2 TYR 82 HE2 TYR 82 16.336 23.969 11.056
569 HH TYR 82 HH TYR 82 15.461 26.089 11.249
570 H ARG 83 H ARG 83 20.798 20.873 8.658
571 HA ARG 83 HA ARG 83 23.479 20.115 7.652
572 HB2 ARG 83 2HB ARG 83 23.211 19.718 10.209
573 HB3 ARG 83 3HB ARG 83 22.001 18.503 9.766
574 HG2 ARG 83 2HG ARG 83 23.991 17.241 9.941
575 HG3 ARG 83 3HG ARG 83 23.844 17.538 8.199
576 HD2 ARG 83 2HD ARG 83 26.104 18.028 8.725
577 HD3 ARG 83 3HD ARG 83 25.316 19.606 8.562
578 HE ARG 83 HE ARG 83 26.092 18.260 11.124
579 HH11 ARG 83 1HH1 ARG 83 25.096 21.191 9.398
580 HH12 ARG 83 2HH1 ARG 83 25.554 22.246 10.711
581 HH21 ARG 83 1HH2 ARG 83 26.603 19.653 12.833
582 HH22 ARG 83 2HH2 ARG 83 26.356 21.376 12.669
583 H LEU 84 H LEU 84 23.255 18.856 5.859
584 HA LEU 84 HA LEU 84 20.674 18.280 4.776
585 HB2 LEU 84 2HB LEU 84 23.517 17.556 4.080
586 HB3 LEU 84 3HB LEU 84 22.182 16.683 3.302
587 HG LEU 84 HG LEU 84 21.184 18.838 2.579
588 HD11 LEU 84 1HD1 LEU 84 23.753 19.991 3.741
589 HD12 LEU 84 2HD1 LEU 84 22.659 20.867 2.644
590 HD13 LEU 84 3HD1 LEU 84 22.088 20.372 4.242
591 HD21 LEU 84 1HD2 LEU 84 24.079 18.350 1.765
592 HD22 LEU 84 2HD2 LEU 84 22.648 17.562 1.071
593 HD23 LEU 84 3HD2 LEU 84 22.900 19.309 0.841
594 H ARG 85 H ARG 85 19.590 16.318 4.450
595 HA ARG 85 HA ARG 85 20.382 14.113 6.310
596 HB2 ARG 85 2HB ARG 85 17.594 15.105 5.616
597 HB3 ARG 85 3HB ARG 85 17.983 13.711 6.645
598 HG2 ARG 85 2HG ARG 85 19.114 15.169 8.256
599 HG3 ARG 85 3HG ARG 85 18.809 16.592 7.225
600 HD2 ARG 85 2HD ARG 85 16.390 16.290 7.447
601 HD3 ARG 85 3HD ARG 85 16.639 14.785 8.349
602 HE ARG 85 HE ARG 85 17.904 17.130 9.554
603 HH11 ARG 85 1HH1 ARG 85 14.951 15.221 9.261
604 HH12 ARG 85 2HH1 ARG 85 14.375 15.630 10.860
605 HH21 ARG 85 1HH2 ARG 85 17.086 17.719 11.635
606 HH22 ARG 85 2HH2 ARG 85 15.546 17.079 12.170
607 H VAL 86 H VAL 86 20.773 12.269 5.353
608 HA VAL 86 HA VAL 86 19.217 11.431 3.004
609 HB VAL 86 HB VAL 86 22.263 11.417 2.930
610 HG11 VAL 86 1HG1 VAL 86 21.885 10.765 0.575
611 HG12 VAL 86 2HG1 VAL 86 21.158 9.588 1.690
612 HG13 VAL 86 3HG1 VAL 86 20.127 10.772 0.854
613 HG21 VAL 86 1HG2 VAL 86 21.506 13.736 2.683
614 HG22 VAL 86 2HG2 VAL 86 22.038 13.094 1.115
615 HG23 VAL 86 3HG2 VAL 86 20.302 13.228 1.470
616 H GLU 87 H GLU 87 18.327 10.040 4.647
617 HA GLU 87 HA GLU 87 19.957 7.618 5.078
618 HB2 GLU 87 2HB GLU 87 19.477 7.580 7.477
619 HB3 GLU 87 3HB GLU 87 20.401 9.036 7.056
620 HG2 GLU 87 2HG GLU 87 18.291 10.354 7.012
621 HG3 GLU 87 3HG GLU 87 17.374 8.906 7.442
622 H PHE 88 H PHE 88 18.593 5.804 5.950
623 HA PHE 88 HA PHE 88 16.003 5.891 4.659
624 HB2 PHE 88 2HB PHE 88 15.921 3.461 5.582
625 HB3 PHE 88 3HB PHE 88 16.943 3.897 4.218
626 HD1 PHE 88 HD1 PHE 88 19.275 3.634 4.269
627 HD2 PHE 88 HD2 PHE 88 17.002 3.278 7.898
628 HE1 PHE 88 HE1 PHE 88 21.285 2.763 5.438
629 HE2 PHE 88 HE2 PHE 88 19.008 2.405 9.070
630 HZ PHE 88 HZ PHE 88 21.152 2.148 7.841
631 HA PRO 89 HA PRO 89 13.222 6.711 7.920
632 HB2 PRO 89 2HB PRO 89 11.716 4.260 7.075
633 HB3 PRO 89 3HB PRO 89 11.119 5.936 7.289
634 HG2 PRO 89 2HG PRO 89 11.561 4.907 4.803
635 HG3 PRO 89 3HG PRO 89 11.966 6.612 5.195
636 HD2 PRO 89 2HD PRO 89 13.814 4.234 4.992
637 HD3 PRO 89 3HD PRO 89 14.065 5.930 4.460
638 H5' A 90 1H5* A 90 12.210 16.461 14.374
639 H5'' A 90 2H5* A 90 13.172 15.007 14.037
640 H4' A 90 H4* A 90 11.792 16.645 11.865
641 H3' A 90 H3* A 90 10.364 15.318 13.763
642 H2' A 90 1H2* A 90 11.513 13.264 13.673
643 HO2' A 90 2HO* A 90 9.312 12.810 13.141
644 H1' A 90 H1* A 90 11.610 13.262 10.675
645 H8 A 90 H8 A 90 12.011 10.628 11.566
646 H61 A 90 1H6 A 90 17.907 10.198 13.430
647 H62 A 90 2H6 A 90 16.479 9.292 12.979
648 H2 A 90 H2 A 90 16.878 14.511 13.090
649 HO5' A 90 H5T A 90 14.403 16.976 14.119
650 H5' A 91 1H5* A 91 10.953 17.097 9.813
651 H5'' A 91 2H5* A 91 10.479 18.634 10.566
652 H4' A 91 H4* A 91 9.565 17.681 7.806
653 H3' A 91 H3* A 91 11.988 19.054 8.700
654 H2' A 91 1H2* A 91 11.629 21.210 7.876
655 HO2' A 91 2HO* A 91 11.101 20.374 5.734
656 H1' A 91 H1* A 91 8.970 21.515 8.171
657 H8 A 91 H8 A 91 12.078 21.788 9.732
658 H61 A 91 1H6 A 91 9.572 21.761 15.395
659 H62 A 91 2H6 A 91 11.010 22.111 14.462
660 H2 A 91 H2 A 91 6.500 20.298 12.516
661 H5' C 92 1H5* C 92 10.167 15.883 7.969
662 H5'' C 92 2H5* C 92 11.464 14.672 7.996
663 H4' C 92 H4* C 92 9.332 14.677 5.830
664 H3' C 92 H3* C 92 8.532 14.517 8.391
665 H2' C 92 1H2* C 92 10.239 12.947 9.025
666 HO2' C 92 2HO* C 92 7.770 11.685 8.538
667 H1' C 92 H1* C 92 9.492 11.302 6.598
668 H41 C 92 1H4 C 92 14.702 8.130 8.477
669 H42 C 92 2H4 C 92 15.418 9.575 9.159
670 H5 C 92 H5 C 92 14.292 11.753 9.128
671 H6 C 92 H6 C 92 12.274 12.928 8.411
672 H5' A 93 1H5* A 93 6.151 14.177 4.894
673 H5'' A 93 2H5* A 93 4.720 14.864 5.673
674 H4' A 93 H4* A 93 4.093 14.298 3.436
675 H3' A 93 H3* A 93 2.797 13.233 5.672
676 H2' A 93 1H2* A 93 3.250 11.005 5.539
677 HO2' A 93 2HO* A 93 1.171 11.072 4.500
678 H1' A 93 H1* A 93 3.992 10.711 2.724
679 H8 A 93 H8 A 93 5.023 10.645 6.368
680 H61 A 93 1H6 A 93 9.145 6.352 4.571
681 H62 A 93 2H6 A 93 8.446 7.172 5.954
682 H2 A 93 H2 A 93 7.204 8.057 0.942
683 H5' A 94 1H5* A 94 -1.398 14.985 3.384
684 H5'' A 94 2H5* A 94 -0.791 13.593 2.463
685 H4' A 94 H4* A 94 -1.198 16.319 1.199
686 H3' A 94 H3* A 94 -3.255 14.765 2.306
687 H2' A 94 1H2* A 94 -3.308 12.973 0.936
688 HO2' A 94 2HO* A 94 -5.125 14.177 0.149
689 H1' A 94 H1* A 94 -2.169 14.243 -1.490
690 H8 A 94 H8 A 94 -3.152 11.616 -1.911
691 H61 A 94 1H6 A 94 1.333 7.747 -0.125
692 H62 A 94 2H6 A 94 -0.140 7.905 -1.064
693 H2 A 94 H2 A 94 2.261 11.779 1.516
694 H5' A 95 1H5* A 95 -2.628 19.999 -0.441
695 H5'' A 95 2H5* A 95 -1.301 19.096 -1.199
696 H4' A 95 H4* A 95 -1.149 20.204 1.641
697 H3' A 95 H3* A 95 -1.447 21.930 -0.377
698 HO3' A 95 H3T A 95 0.206 23.203 0.619
699 H2' A 95 1H2* A 95 -0.043 20.943 -1.975
700 HO2' A 95 2HO* A 95 0.841 23.035 -1.598
701 H1' A 95 H1* A 95 2.230 20.278 -0.187
702 H8 A 95 H8 A 95 1.082 19.976 -3.417
703 H61 A 95 1H6 A 95 2.223 13.890 -3.609
704 H62 A 95 2H6 A 95 1.889 15.317 -4.571
705 H2 A 95 H2 A 95 2.227 15.162 0.657
Start of MODEL 9
1 H VAL 6 H1 VAL 6 -3.122 6.968 -6.157
2 HA VAL 6 HA VAL 6 -3.521 9.291 -4.426
3 HB VAL 6 HB VAL 6 -4.281 7.054 -3.529
4 HG11 VAL 6 1HG1 VAL 6 -1.271 6.535 -3.431
5 HG12 VAL 6 2HG1 VAL 6 -2.535 5.527 -2.699
6 HG13 VAL 6 3HG1 VAL 6 -2.433 5.672 -4.466
7 HG21 VAL 6 1HG2 VAL 6 -2.019 8.449 -2.039
8 HG22 VAL 6 2HG2 VAL 6 -3.706 9.009 -2.118
9 HG23 VAL 6 3HG2 VAL 6 -3.314 7.464 -1.329
10 H ILE 7 H ILE 7 -1.653 10.199 -3.433
11 HA ILE 7 HA ILE 7 0.656 10.204 -5.168
12 HB ILE 7 HB ILE 7 0.287 11.386 -2.391
13 HG12 ILE 7 2HG1 ILE 7 -1.472 12.193 -3.901
14 HG13 ILE 7 3HG1 ILE 7 -0.307 13.475 -3.550
15 HG21 ILE 7 1HG2 ILE 7 2.033 13.003 -3.207
16 HG22 ILE 7 2HG2 ILE 7 2.623 11.344 -2.996
17 HG23 ILE 7 3HG2 ILE 7 2.270 11.953 -4.629
18 HD11 ILE 7 1HD1 ILE 7 -0.368 11.779 -6.090
19 HD12 ILE 7 2HD1 ILE 7 -0.913 13.462 -5.941
20 HD13 ILE 7 3HD1 ILE 7 0.802 13.070 -5.736
21 H ARG 8 H ARG 8 2.827 9.605 -4.603
22 HA ARG 8 HA ARG 8 3.024 6.995 -3.492
23 HB2 ARG 8 2HB ARG 8 4.558 8.008 -5.200
24 HB3 ARG 8 3HB ARG 8 5.203 9.071 -3.939
25 HG2 ARG 8 2HG ARG 8 5.752 6.889 -2.633
26 HG3 ARG 8 3HG ARG 8 5.448 6.054 -4.171
27 HD2 ARG 8 2HD ARG 8 7.498 8.196 -3.545
28 HD3 ARG 8 3HD ARG 8 7.818 6.520 -4.016
29 HE ARG 8 HE ARG 8 6.968 8.747 -5.782
30 HH11 ARG 8 1HH1 ARG 8 7.846 5.326 -5.453
31 HH12 ARG 8 2HH1 ARG 8 7.924 5.077 -7.180
32 HH21 ARG 8 1HH2 ARG 8 7.065 8.359 -8.027
33 HH22 ARG 8 2HH2 ARG 8 7.528 6.777 -8.618
34 H GLY 9 H GLY 9 3.779 6.230 -1.529
35 HA2 GLY 9 2HA GLY 9 5.380 7.179 0.301
36 HA3 GLY 9 3HA GLY 9 4.004 8.194 0.685
37 HA PRO 10 HA PRO 10 2.009 4.411 2.483
38 HB2 PRO 10 2HB PRO 10 1.146 3.047 -0.045
39 HB3 PRO 10 3HB PRO 10 0.203 3.373 1.445
40 HG2 PRO 10 2HG PRO 10 -0.176 4.856 -0.812
41 HG3 PRO 10 3HG PRO 10 -0.190 5.621 0.814
42 HD2 PRO 10 2HD PRO 10 2.040 5.537 -1.222
43 HD3 PRO 10 3HD PRO 10 1.499 6.908 -0.199
44 H ALA 11 H ALA 11 2.457 2.080 2.858
45 HA ALA 11 HA ALA 11 5.174 1.431 2.175
46 HB1 ALA 11 1HB ALA 11 2.986 -0.229 3.502
47 HB2 ALA 11 2HB ALA 11 4.729 -0.597 3.507
48 HB3 ALA 11 3HB ALA 11 4.123 0.855 4.337
49 H GLY 12 H GLY 12 5.928 -0.494 1.081
50 HA2 GLY 12 2HA GLY 12 4.659 -2.451 -0.260
51 HA3 GLY 12 3HA GLY 12 4.374 -1.075 -1.345
52 H ASN 13 H ASN 13 5.744 -3.077 -2.437
53 HA ASN 13 HA ASN 13 7.686 -3.722 -3.420
54 HB2 ASN 13 2HB ASN 13 8.251 -0.747 -3.171
55 HB3 ASN 13 3HB ASN 13 9.155 -1.865 -4.205
56 HD21 ASN 13 1HD2 ASN 13 6.464 -0.163 -6.225
57 HD22 ASN 13 2HD2 ASN 13 7.777 0.405 -5.213
58 H ASN 14 H ASN 14 7.654 -4.291 -0.724
59 HA ASN 14 HA ASN 14 8.966 -4.924 0.997
60 HB2 ASN 14 2HB ASN 14 11.160 -4.775 -1.097
61 HB3 ASN 14 3HB ASN 14 11.285 -5.601 0.459
62 HD21 ASN 14 1HD2 ASN 14 10.359 -8.054 -2.252
63 HD22 ASN 14 2HD2 ASN 14 11.646 -6.883 -2.051
64 H ASP 15 H ASP 15 8.673 -1.933 0.364
65 HA ASP 15 HA ASP 15 9.367 0.029 1.220
66 HB2 ASP 15 2HB ASP 15 10.057 -1.812 3.515
67 HB3 ASP 15 3HB ASP 15 10.123 -0.042 3.620
68 H CYS 16 H CYS 16 11.258 -1.136 -0.583
69 HA CYS 16 HA CYS 16 13.931 -0.721 0.384
70 HB2 CYS 16 2HB CYS 16 12.765 -0.709 -2.432
71 HB3 CYS 16 3HB CYS 16 14.499 -0.736 -2.039
72 HG CYS 16 HG CYS 16 12.114 -2.896 -1.330
73 H ARG 17 H ARG 17 11.481 1.492 0.098
74 HA ARG 17 HA ARG 17 12.851 3.690 -1.179
75 HB2 ARG 17 2HB ARG 17 10.362 3.251 -1.067
76 HB3 ARG 17 3HB ARG 17 10.425 3.684 0.654
77 HG2 ARG 17 2HG ARG 17 11.288 5.922 0.059
78 HG3 ARG 17 3HG ARG 17 11.239 5.480 -1.670
79 HD2 ARG 17 2HD ARG 17 8.863 5.594 0.233
80 HD3 ARG 17 3HD ARG 17 9.246 6.784 -1.024
81 HE ARG 17 HE ARG 17 8.981 4.816 -2.655
82 HH11 ARG 17 1HH1 ARG 17 7.187 5.063 0.381
83 HH12 ARG 17 2HH1 ARG 17 5.887 4.030 -0.166
84 HH21 ARG 17 1HH2 ARG 17 7.284 3.519 -3.354
85 HH22 ARG 17 2HH2 ARG 17 5.919 3.182 -2.307
86 H ILE 18 H ILE 18 13.719 5.558 -0.191
87 HA ILE 18 HA ILE 18 14.180 5.400 2.748
88 HB ILE 18 HB ILE 18 16.438 6.062 2.519
89 HG12 ILE 18 2HG1 ILE 18 16.023 6.311 -0.484
90 HG13 ILE 18 3HG1 ILE 18 16.113 7.679 0.644
91 HG21 ILE 18 1HG2 ILE 18 15.899 3.665 2.111
92 HG22 ILE 18 2HG2 ILE 18 15.979 3.978 0.357
93 HG23 ILE 18 3HG2 ILE 18 17.429 4.187 1.373
94 HD11 ILE 18 1HD1 ILE 18 18.289 7.351 -0.399
95 HD12 ILE 18 2HD1 ILE 18 18.389 6.956 1.332
96 HD13 ILE 18 3HD1 ILE 18 18.321 5.654 0.117
97 H TYR 19 H TYR 19 15.236 7.658 3.386
98 HA TYR 19 HA TYR 19 13.337 9.678 2.353
99 HB2 TYR 19 2HB TYR 19 12.393 9.216 4.334
100 HB3 TYR 19 3HB TYR 19 13.902 8.797 5.115
101 HD1 TYR 19 HD1 TYR 19 11.513 11.472 4.491
102 HD2 TYR 19 HD2 TYR 19 15.486 10.581 5.878
103 HE1 TYR 19 HE1 TYR 19 11.562 13.626 5.731
104 HE2 TYR 19 HE2 TYR 19 15.550 12.748 7.091
105 HH TYR 19 HH TYR 19 12.792 15.031 7.045
106 H VAL 20 H VAL 20 13.810 11.895 2.487
107 HA VAL 20 HA VAL 20 16.692 12.573 2.734
108 HB VAL 20 HB VAL 20 14.875 13.168 0.363
109 HG11 VAL 20 1HG1 VAL 20 16.210 15.151 0.909
110 HG12 VAL 20 2HG1 VAL 20 17.679 14.159 1.018
111 HG13 VAL 20 3HG1 VAL 20 16.858 14.375 -0.551
112 HG21 VAL 20 1HG2 VAL 20 15.887 10.929 0.293
113 HG22 VAL 20 2HG2 VAL 20 16.632 11.982 -0.925
114 HG23 VAL 20 3HG2 VAL 20 17.491 11.631 0.597
115 H GLY 21 H GLY 21 16.403 13.758 4.580
116 HA2 GLY 21 2HA GLY 21 14.286 15.764 4.777
117 HA3 GLY 21 3HA GLY 21 15.578 15.451 5.951
118 H ASN 22 H ASN 22 14.799 18.051 5.176
119 HA ASN 22 HA ASN 22 15.623 20.046 4.452
120 HB2 ASN 22 2HB ASN 22 17.641 18.981 5.717
121 HB3 ASN 22 3HB ASN 22 18.327 18.723 4.113
122 HD21 ASN 22 1HD2 ASN 22 19.819 21.895 4.766
123 HD22 ASN 22 2HD2 ASN 22 20.051 20.165 4.942
124 H LEU 23 H LEU 23 17.367 20.888 2.526
125 HA LEU 23 HA LEU 23 16.834 19.318 0.089
126 HB2 LEU 23 2HB LEU 23 14.923 20.962 0.570
127 HB3 LEU 23 3HB LEU 23 16.096 22.257 0.319
128 HG LEU 23 HG LEU 23 16.536 21.241 -1.997
129 HD11 LEU 23 1HD1 LEU 23 13.970 19.745 -1.279
130 HD12 LEU 23 2HD1 LEU 23 14.730 19.783 -2.885
131 HD13 LEU 23 3HD1 LEU 23 15.556 18.984 -1.531
132 HD21 LEU 23 1HD2 LEU 23 15.145 23.242 -1.666
133 HD22 LEU 23 2HD2 LEU 23 14.438 22.208 -2.933
134 HD23 LEU 23 3HD2 LEU 23 13.737 22.221 -1.298
135 HA PRO 24 HA PRO 24 21.021 20.605 -0.368
136 HB2 PRO 24 2HB PRO 24 21.468 19.898 -3.001
137 HB3 PRO 24 3HB PRO 24 21.380 18.730 -1.642
138 HG2 PRO 24 2HG PRO 24 19.241 19.464 -3.641
139 HG3 PRO 24 3HG PRO 24 19.663 17.846 -2.994
140 HD2 PRO 24 2HD PRO 24 17.555 19.335 -2.059
141 HD3 PRO 24 3HD PRO 24 18.489 18.222 -1.008
142 HA PRO 25 HA PRO 25 20.997 24.633 -2.047
143 HB2 PRO 25 2HB PRO 25 23.653 25.107 -2.509
144 HB3 PRO 25 3HB PRO 25 22.985 24.877 -0.864
145 HG2 PRO 25 2HG PRO 25 24.390 22.854 -2.632
146 HG3 PRO 25 3HG PRO 25 24.642 23.177 -0.885
147 HD2 PRO 25 2HD PRO 25 23.067 21.126 -1.842
148 HD3 PRO 25 3HD PRO 25 22.740 21.959 -0.293
149 H ASP 26 H ASP 26 21.661 21.992 -4.047
150 HA ASP 26 HA ASP 26 21.720 23.734 -6.442
151 HB2 ASP 26 2HB ASP 26 23.142 21.932 -7.531
152 HB3 ASP 26 3HB ASP 26 23.918 22.982 -6.340
153 H ILE 27 H ILE 27 19.492 22.414 -5.000
154 HA ILE 27 HA ILE 27 18.573 20.141 -6.390
155 HB ILE 27 HB ILE 27 17.603 20.866 -4.286
156 HG12 ILE 27 2HG1 ILE 27 15.168 20.884 -4.857
157 HG13 ILE 27 3HG1 ILE 27 15.574 21.121 -6.561
158 HG21 ILE 27 1HG2 ILE 27 16.581 23.313 -5.797
159 HG22 ILE 27 2HG2 ILE 27 16.225 22.902 -4.112
160 HG23 ILE 27 3HG2 ILE 27 17.885 23.319 -4.582
161 HD11 ILE 27 1HD1 ILE 27 16.437 18.751 -4.845
162 HD12 ILE 27 2HD1 ILE 27 15.126 18.742 -6.046
163 HD13 ILE 27 3HD1 ILE 27 16.807 18.963 -6.573
164 H ARG 28 H ARG 28 17.441 19.800 -8.241
165 HA ARG 28 HA ARG 28 16.166 22.000 -9.674
166 HB2 ARG 28 2HB ARG 28 18.469 22.221 -10.458
167 HB3 ARG 28 3HB ARG 28 18.542 20.494 -10.849
168 HG2 ARG 28 2HG ARG 28 16.928 20.748 -12.623
169 HG3 ARG 28 3HG ARG 28 16.571 22.423 -12.142
170 HD2 ARG 28 2HD ARG 28 19.327 21.475 -13.027
171 HD3 ARG 28 3HD ARG 28 18.120 22.152 -14.131
172 HE ARG 28 HE ARG 28 18.244 24.268 -12.998
173 HH11 ARG 28 1HH1 ARG 28 20.718 21.942 -11.950
174 HH12 ARG 28 2HH1 ARG 28 21.772 23.188 -11.341
175 HH21 ARG 28 1HH2 ARG 28 19.649 25.848 -12.187
176 HH22 ARG 28 2HH2 ARG 28 21.177 25.385 -11.474
177 H THR 29 H THR 29 14.917 21.130 -11.556
178 HA THR 29 HA THR 29 13.386 18.974 -10.625
179 HB THR 29 HB THR 29 13.115 19.850 -13.463
180 HG1 THR 29 1HG THR 29 12.184 21.770 -12.721
181 HG21 THR 29 1HG2 THR 29 11.445 18.325 -12.464
182 HG22 THR 29 2HG2 THR 29 11.198 19.466 -11.120
183 HG23 THR 29 3HG2 THR 29 10.723 19.922 -12.772
184 H LYS 30 H LYS 30 16.335 18.470 -11.902
185 HA LYS 30 HA LYS 30 15.575 15.719 -12.619
186 HB2 LYS 30 2HB LYS 30 15.496 16.969 -14.757
187 HB3 LYS 30 3HB LYS 30 17.149 17.546 -14.484
188 HG2 LYS 30 2HG LYS 30 17.151 15.657 -16.047
189 HG3 LYS 30 3HG LYS 30 17.979 15.199 -14.553
190 HD2 LYS 30 2HD LYS 30 15.907 14.063 -13.762
191 HD3 LYS 30 3HD LYS 30 15.085 14.541 -15.267
192 HE2 LYS 30 2HE LYS 30 16.806 13.284 -16.568
193 HE3 LYS 30 3HE LYS 30 17.560 12.778 -15.048
194 HZ1 LYS 30 1HZ LYS 30 15.472 11.707 -14.469
195 HZ2 LYS 30 2HZ LYS 30 14.817 12.138 -15.908
196 HZ3 LYS 30 3HZ LYS 30 16.087 11.097 -15.867
197 H ASP 31 H ASP 31 17.900 18.116 -11.535
198 HA ASP 31 HA ASP 31 20.172 16.375 -11.479
199 HB2 ASP 31 2HB ASP 31 19.496 18.883 -9.898
200 HB3 ASP 31 3HB ASP 31 21.063 18.074 -9.855
201 H ILE 32 H ILE 32 17.335 16.601 -9.500
202 HA ILE 32 HA ILE 32 18.472 15.390 -7.136
203 HB ILE 32 HB ILE 32 16.431 16.799 -7.139
204 HG12 ILE 32 2HG1 ILE 32 15.013 15.424 -5.697
205 HG13 ILE 32 3HG1 ILE 32 15.804 13.943 -6.260
206 HG21 ILE 32 1HG2 ILE 32 15.490 16.034 -9.309
207 HG22 ILE 32 2HG2 ILE 32 15.128 14.452 -8.575
208 HG23 ILE 32 3HG2 ILE 32 14.310 15.917 -7.993
209 HD11 ILE 32 1HD1 ILE 32 17.934 14.672 -5.260
210 HD12 ILE 32 2HD1 ILE 32 17.212 16.234 -4.810
211 HD13 ILE 32 3HD1 ILE 32 16.646 14.733 -4.040
212 H GLU 33 H GLU 33 17.642 14.207 -10.272
213 HA GLU 33 HA GLU 33 17.464 11.412 -9.264
214 HB2 GLU 33 2HB GLU 33 16.980 12.542 -12.053
215 HB3 GLU 33 3HB GLU 33 16.696 10.873 -11.515
216 HG2 GLU 33 2HG GLU 33 15.050 11.761 -9.830
217 HG3 GLU 33 3HG GLU 33 15.250 13.372 -10.550
218 H ASP 34 H ASP 34 19.542 13.749 -10.795
219 HA ASP 34 HA ASP 34 21.167 11.896 -12.279
220 HB2 ASP 34 2HB ASP 34 21.048 14.204 -12.937
221 HB3 ASP 34 3HB ASP 34 21.584 14.742 -11.342
222 H VAL 35 H VAL 35 21.671 13.585 -9.121
223 HA VAL 35 HA VAL 35 24.175 12.266 -8.667
224 HB VAL 35 HB VAL 35 24.125 13.251 -6.484
225 HG11 VAL 35 1HG1 VAL 35 24.445 14.786 -8.421
226 HG12 VAL 35 2HG1 VAL 35 22.700 15.120 -8.429
227 HG13 VAL 35 3HG1 VAL 35 23.689 15.593 -7.030
228 HG21 VAL 35 1HG2 VAL 35 21.876 12.636 -5.756
229 HG22 VAL 35 2HG2 VAL 35 22.097 14.390 -5.605
230 HG23 VAL 35 3HG2 VAL 35 21.154 13.733 -6.963
231 H PHE 36 H PHE 36 20.798 11.455 -7.850
232 HA PHE 36 HA PHE 36 21.618 9.212 -6.229
233 HB2 PHE 36 2HB PHE 36 18.998 10.229 -7.234
234 HB3 PHE 36 3HB PHE 36 19.119 8.593 -6.594
235 HD1 PHE 36 HD1 PHE 36 19.211 12.165 -5.750
236 HD2 PHE 36 HD2 PHE 36 19.776 8.173 -4.256
237 HE1 PHE 36 HE1 PHE 36 19.078 13.015 -3.425
238 HE2 PHE 36 HE2 PHE 36 19.649 9.034 -1.924
239 HZ PHE 36 HZ PHE 36 19.308 11.456 -1.516
240 H SER 37 H SER 37 20.780 9.586 -9.661
241 HA SER 37 HA SER 37 20.757 6.777 -10.223
242 HB2 SER 37 2HB SER 37 19.818 8.421 -11.770
243 HB3 SER 37 3HB SER 37 21.412 9.188 -11.960
244 HG SER 37 HG SER 37 20.693 6.540 -12.698
245 H LYS 38 H LYS 38 23.341 9.113 -9.683
246 HA LYS 38 HA LYS 38 25.420 7.438 -10.839
247 HB2 LYS 38 2HB LYS 38 25.668 9.871 -10.751
248 HB3 LYS 38 3HB LYS 38 25.488 9.858 -8.989
249 HG2 LYS 38 2HG LYS 38 27.841 10.095 -9.614
250 HG3 LYS 38 3HG LYS 38 27.578 8.560 -8.771
251 HD2 LYS 38 2HD LYS 38 27.547 7.354 -10.930
252 HD3 LYS 38 3HD LYS 38 27.696 8.891 -11.803
253 HE2 LYS 38 2HE LYS 38 29.878 7.783 -11.661
254 HE3 LYS 38 3HE LYS 38 29.895 9.284 -10.724
255 HZ1 LYS 38 1HZ LYS 38 29.556 7.983 -8.745
256 HZ2 LYS 38 2HZ LYS 38 29.517 6.581 -9.609
257 HZ3 LYS 38 3HZ LYS 38 30.902 7.467 -9.534
258 H TYR 39 H TYR 39 23.942 7.903 -7.631
259 HA TYR 39 HA TYR 39 25.940 6.168 -6.414
260 HB2 TYR 39 2HB TYR 39 23.778 7.901 -5.355
261 HB3 TYR 39 3HB TYR 39 24.323 6.540 -4.371
262 HD1 TYR 39 HD1 TYR 39 25.653 9.515 -6.244
263 HD2 TYR 39 HD2 TYR 39 26.225 6.671 -3.068
264 HE1 TYR 39 HE1 TYR 39 27.627 10.795 -5.463
265 HE2 TYR 39 HE2 TYR 39 28.199 7.944 -2.276
266 HH TYR 39 HH TYR 39 29.329 10.920 -3.929
267 H GLY 40 H GLY 40 23.064 5.448 -8.088
268 HA2 GLY 40 2HA GLY 40 23.394 2.692 -7.621
269 HA3 GLY 40 3HA GLY 40 22.170 3.268 -6.474
270 H ALA 41 H ALA 41 21.248 1.444 -8.043
271 HA ALA 41 HA ALA 41 20.165 2.427 -10.553
272 HB1 ALA 41 1HB ALA 41 19.579 -0.087 -8.939
273 HB2 ALA 41 2HB ALA 41 19.073 0.216 -10.619
274 HB3 ALA 41 3HB ALA 41 20.800 0.064 -10.225
275 H ILE 42 H ILE 42 19.436 4.206 -8.506
276 HA ILE 42 HA ILE 42 16.938 3.762 -7.277
277 HB ILE 42 HB ILE 42 18.390 6.226 -8.257
278 HG12 ILE 42 2HG1 ILE 42 18.459 6.705 -5.811
279 HG13 ILE 42 3HG1 ILE 42 17.626 5.171 -5.494
280 HG21 ILE 42 1HG2 ILE 42 16.004 6.763 -8.494
281 HG22 ILE 42 2HG2 ILE 42 15.684 6.146 -6.855
282 HG23 ILE 42 3HG2 ILE 42 16.692 7.597 -7.089
283 HD11 ILE 42 1HD1 ILE 42 19.492 3.888 -6.277
284 HD12 ILE 42 2HD1 ILE 42 20.250 5.316 -7.022
285 HD13 ILE 42 3HD1 ILE 42 20.181 5.173 -5.260
286 H ARG 43 H ARG 43 14.829 3.905 -7.917
287 HA ARG 43 HA ARG 43 14.356 4.001 -10.840
288 HB2 ARG 43 2HB ARG 43 12.596 3.177 -8.500
289 HB3 ARG 43 3HB ARG 43 12.107 3.127 -10.198
290 HG2 ARG 43 2HG ARG 43 14.432 1.577 -8.968
291 HG3 ARG 43 3HG ARG 43 12.845 0.909 -9.386
292 HD2 ARG 43 2HD ARG 43 14.880 2.088 -11.325
293 HD3 ARG 43 3HD ARG 43 14.459 0.378 -11.150
294 HE ARG 43 HE ARG 43 12.966 2.432 -12.579
295 HH11 ARG 43 1HH1 ARG 43 12.728 -0.709 -10.950
296 HH12 ARG 43 2HH1 ARG 43 11.285 -1.173 -11.816
297 HH21 ARG 43 1HH2 ARG 43 11.101 1.785 -13.702
298 HH22 ARG 43 2HH2 ARG 43 10.374 0.224 -13.383
299 H ASP 44 H ASP 44 13.027 5.445 -7.810
300 HA ASP 44 HA ASP 44 11.939 7.655 -9.477
301 HB2 ASP 44 2HB ASP 44 10.434 5.925 -7.506
302 HB3 ASP 44 3HB ASP 44 9.883 7.527 -7.993
303 H ILE 45 H ILE 45 11.579 9.630 -8.536
304 HA ILE 45 HA ILE 45 12.668 10.058 -5.796
305 HB ILE 45 HB ILE 45 12.868 11.556 -8.381
306 HG12 ILE 45 2HG1 ILE 45 15.028 12.230 -7.457
307 HG13 ILE 45 3HG1 ILE 45 14.609 11.520 -5.886
308 HG21 ILE 45 1HG2 ILE 45 13.183 13.726 -7.232
309 HG22 ILE 45 2HG2 ILE 45 11.520 13.145 -7.063
310 HG23 ILE 45 3HG2 ILE 45 12.665 12.993 -5.700
311 HD11 ILE 45 1HD1 ILE 45 16.141 10.093 -7.301
312 HD12 ILE 45 2HD1 ILE 45 14.646 9.280 -6.823
313 HD13 ILE 45 3HD1 ILE 45 14.815 9.924 -8.478
314 H ASP 46 H ASP 46 11.431 11.455 -4.406
315 HA ASP 46 HA ASP 46 8.767 12.237 -5.399
316 HB2 ASP 46 2HB ASP 46 8.490 9.985 -4.507
317 HB3 ASP 46 3HB ASP 46 9.250 10.460 -2.988
318 H LEU 47 H LEU 47 10.239 14.248 -5.224
319 HA LEU 47 HA LEU 47 10.662 15.360 -2.596
320 HB2 LEU 47 2HB LEU 47 11.982 16.154 -4.460
321 HB3 LEU 47 3HB LEU 47 10.525 16.544 -5.391
322 HG LEU 47 HG LEU 47 9.929 18.287 -3.702
323 HD11 LEU 47 1HD1 LEU 47 11.685 19.007 -2.100
324 HD12 LEU 47 2HD1 LEU 47 11.138 17.354 -1.753
325 HD13 LEU 47 3HD1 LEU 47 12.688 17.617 -2.586
326 HD21 LEU 47 1HD2 LEU 47 11.189 18.847 -5.755
327 HD22 LEU 47 2HD2 LEU 47 11.674 19.881 -4.392
328 HD23 LEU 47 3HD2 LEU 47 12.721 18.534 -4.900
329 H LYS 48 H LYS 48 9.253 16.358 -1.238
330 HA LYS 48 HA LYS 48 6.584 17.081 -2.311
331 HB2 LYS 48 2HB LYS 48 7.462 16.169 0.454
332 HB3 LYS 48 3HB LYS 48 5.833 16.718 0.028
333 HG2 LYS 48 2HG LYS 48 5.648 14.888 -1.641
334 HG3 LYS 48 3HG LYS 48 7.291 14.341 -1.226
335 HD2 LYS 48 2HD LYS 48 6.524 13.996 1.136
336 HD3 LYS 48 3HD LYS 48 4.871 14.416 0.634
337 HE2 LYS 48 2HE LYS 48 6.536 12.132 -0.505
338 HE3 LYS 48 3HE LYS 48 5.260 11.954 0.712
339 HZ1 LYS 48 1HZ LYS 48 4.448 11.479 -1.457
340 HZ2 LYS 48 2HZ LYS 48 3.708 12.839 -0.893
341 HZ3 LYS 48 3HZ LYS 48 4.900 12.953 -2.029
342 H ASN 49 H ASN 49 5.770 19.071 -1.879
343 HA ASN 49 HA ASN 49 7.687 21.163 -1.199
344 HB2 ASN 49 2HB ASN 49 5.873 22.657 -1.901
345 HB3 ASN 49 3HB ASN 49 6.156 21.395 -3.101
346 HD21 ASN 49 1HD2 ASN 49 2.470 21.775 -2.648
347 HD22 ASN 49 2HD2 ASN 49 3.795 22.807 -3.142
348 H ARG 50 H ARG 50 6.019 23.082 -0.065
349 HA ARG 50 HA ARG 50 6.262 22.714 2.675
350 HB2 ARG 50 2HB ARG 50 5.890 24.889 1.662
351 HB3 ARG 50 3HB ARG 50 4.320 24.373 1.030
352 HG2 ARG 50 2HG ARG 50 4.029 25.813 2.990
353 HG3 ARG 50 3HG ARG 50 3.432 24.183 3.332
354 HD2 ARG 50 2HD ARG 50 4.730 25.060 5.227
355 HD3 ARG 50 3HD ARG 50 5.534 23.656 4.521
356 HE ARG 50 HE ARG 50 7.281 25.025 3.760
357 HH11 ARG 50 1HH1 ARG 50 4.674 26.982 5.135
358 HH12 ARG 50 2HH1 ARG 50 5.626 28.448 5.156
359 HH21 ARG 50 1HH2 ARG 50 8.496 26.947 3.800
360 HH22 ARG 50 2HH2 ARG 50 7.790 28.427 4.406
361 H ARG 51 H ARG 51 5.146 21.683 4.242
362 HA ARG 51 HA ARG 51 2.439 20.645 3.730
363 HB2 ARG 51 2HB ARG 51 4.211 19.043 2.764
364 HB3 ARG 51 3HB ARG 51 4.695 18.733 4.442
365 HG2 ARG 51 2HG ARG 51 2.338 18.023 4.938
366 HG3 ARG 51 3HG ARG 51 1.926 18.298 3.233
367 HD2 ARG 51 2HD ARG 51 3.693 16.659 2.578
368 HD3 ARG 51 3HD ARG 51 4.013 16.345 4.295
369 HE ARG 51 HE ARG 51 1.842 15.297 2.687
370 HH11 ARG 51 1HH1 ARG 51 2.718 16.257 5.982
371 HH12 ARG 51 2HH1 ARG 51 1.516 15.222 6.717
372 HH21 ARG 51 1HH2 ARG 51 0.322 13.985 3.651
373 HH22 ARG 51 2HH2 ARG 51 0.148 13.922 5.394
374 H GLY 52 H GLY 52 3.242 22.638 5.517
375 HA2 GLY 52 2HA GLY 52 2.720 23.143 7.738
376 HA3 GLY 52 3HA GLY 52 2.619 21.413 8.115
377 H GLY 53 H GLY 53 5.433 22.015 6.351
378 HA2 GLY 53 2HA GLY 53 7.191 22.970 8.438
379 HA3 GLY 53 3HA GLY 53 7.266 21.200 8.243
380 HA PRO 54 HA PRO 54 10.087 23.326 5.158
381 HB2 PRO 54 2HB PRO 54 12.290 21.709 5.660
382 HB3 PRO 54 3HB PRO 54 11.949 23.256 6.510
383 HG2 PRO 54 2HG PRO 54 11.372 20.425 7.411
384 HG3 PRO 54 3HG PRO 54 12.028 21.795 8.370
385 HD2 PRO 54 2HD PRO 54 9.397 21.059 8.468
386 HD3 PRO 54 3HD PRO 54 9.898 22.775 8.595
387 HA PRO 55 HA PRO 55 9.330 20.254 2.109
388 HB2 PRO 55 2HB PRO 55 11.466 20.545 0.383
389 HB3 PRO 55 3HB PRO 55 10.081 21.688 0.482
390 HG2 PRO 55 2HG PRO 55 12.821 21.922 1.737
391 HG3 PRO 55 3HG PRO 55 11.845 23.191 0.926
392 HD2 PRO 55 2HD PRO 55 11.959 22.952 3.651
393 HD3 PRO 55 3HD PRO 55 10.472 23.480 2.802
394 H PHE 56 H PHE 56 9.944 18.141 1.416
395 HA PHE 56 HA PHE 56 12.479 16.984 2.325
396 HB2 PHE 56 2HB PHE 56 11.566 15.468 3.903
397 HB3 PHE 56 3HB PHE 56 10.979 17.053 4.377
398 HD1 PHE 56 HD1 PHE 56 8.554 17.609 3.033
399 HD2 PHE 56 HD2 PHE 56 10.075 13.757 4.203
400 HE1 PHE 56 HE1 PHE 56 6.243 16.716 3.133
401 HE2 PHE 56 HE2 PHE 56 7.757 12.914 4.440
402 HZ PHE 56 HZ PHE 56 5.843 14.371 3.854
403 H ALA 57 H ALA 57 12.513 14.610 1.635
404 HA ALA 57 HA ALA 57 10.628 14.051 -0.571
405 HB1 ALA 57 1HB ALA 57 13.638 14.315 -0.949
406 HB2 ALA 57 2HB ALA 57 12.452 13.873 -2.197
407 HB3 ALA 57 3HB ALA 57 12.446 15.508 -1.485
408 H PHE 58 H PHE 58 11.292 11.951 -1.681
409 HA PHE 58 HA PHE 58 12.702 10.076 0.126
410 HB2 PHE 58 2HB PHE 58 9.969 9.601 -1.111
411 HB3 PHE 58 3HB PHE 58 10.926 8.389 -0.259
412 HD1 PHE 58 HD1 PHE 58 11.243 8.501 2.172
413 HD2 PHE 58 HD2 PHE 58 8.745 11.302 0.081
414 HE1 PHE 58 HE1 PHE 58 10.238 9.212 4.328
415 HE2 PHE 58 HE2 PHE 58 7.784 12.060 2.235
416 HZ PHE 58 HZ PHE 58 8.532 11.002 4.368
417 H VAL 59 H VAL 59 13.330 8.078 -1.018
418 HA VAL 59 HA VAL 59 13.441 8.349 -3.975
419 HB VAL 59 HB VAL 59 15.808 7.924 -2.097
420 HG11 VAL 59 1HG1 VAL 59 17.140 7.775 -4.181
421 HG12 VAL 59 2HG1 VAL 59 15.975 6.435 -4.038
422 HG13 VAL 59 3HG1 VAL 59 15.634 7.808 -5.129
423 HG21 VAL 59 1HG2 VAL 59 16.699 9.945 -3.243
424 HG22 VAL 59 2HG2 VAL 59 15.172 10.094 -4.138
425 HG23 VAL 59 3HG2 VAL 59 15.192 10.292 -2.369
426 H GLU 60 H GLU 60 13.215 6.394 -5.011
427 HA GLU 60 HA GLU 60 12.885 4.059 -3.186
428 HB2 GLU 60 2HB GLU 60 10.788 4.981 -4.041
429 HB3 GLU 60 3HB GLU 60 11.335 4.747 -5.712
430 HG2 GLU 60 2HG GLU 60 11.321 2.381 -5.511
431 HG3 GLU 60 3HG GLU 60 11.288 2.446 -3.744
432 H PHE 61 H PHE 61 14.014 2.297 -3.556
433 HA PHE 61 HA PHE 61 15.917 2.401 -5.789
434 HB2 PHE 61 2HB PHE 61 15.880 0.986 -3.137
435 HB3 PHE 61 3HB PHE 61 17.016 0.546 -4.411
436 HD1 PHE 61 HD1 PHE 61 15.793 3.670 -2.676
437 HD2 PHE 61 HD2 PHE 61 19.097 1.514 -4.402
438 HE1 PHE 61 HE1 PHE 61 17.324 5.488 -2.022
439 HE2 PHE 61 HE2 PHE 61 20.636 3.338 -3.714
440 HZ PHE 61 HZ PHE 61 19.749 5.324 -2.527
441 H GLU 62 H GLU 62 16.465 0.728 -7.168
442 HA GLU 62 HA GLU 62 14.429 -1.315 -7.667
443 HB2 GLU 62 2HB GLU 62 15.733 -0.232 -9.508
444 HB3 GLU 62 3HB GLU 62 17.229 -0.856 -8.799
445 HG2 GLU 62 2HG GLU 62 16.595 -2.277 -10.638
446 HG3 GLU 62 3HG GLU 62 16.400 -3.186 -9.137
447 H ASP 63 H ASP 63 17.423 -0.914 -5.913
448 HA ASP 63 HA ASP 63 17.128 -3.543 -4.667
449 HB2 ASP 63 2HB ASP 63 18.463 -4.141 -6.567
450 HB3 ASP 63 3HB ASP 63 19.533 -2.753 -6.327
451 HA PRO 64 HA PRO 64 18.093 -0.517 -1.557
452 HB2 PRO 64 2HB PRO 64 17.976 -2.169 0.656
453 HB3 PRO 64 3HB PRO 64 16.533 -1.542 -0.205
454 HG2 PRO 64 2HG PRO 64 17.867 -4.244 -0.484
455 HG3 PRO 64 3HG PRO 64 16.113 -3.864 -0.374
456 HD2 PRO 64 2HD PRO 64 17.363 -4.338 -2.754
457 HD3 PRO 64 3HD PRO 64 16.035 -3.147 -2.612
458 H ARG 65 H ARG 65 20.100 -3.115 -2.525
459 HA ARG 65 HA ARG 65 22.122 -2.971 -0.508
460 HB2 ARG 65 2HB ARG 65 21.928 -4.817 -2.113
461 HB3 ARG 65 3HB ARG 65 22.285 -3.710 -3.455
462 HG2 ARG 65 2HG ARG 65 24.523 -3.279 -2.556
463 HG3 ARG 65 3HG ARG 65 24.169 -4.272 -1.123
464 HD2 ARG 65 2HD ARG 65 23.865 -6.253 -2.576
465 HD3 ARG 65 3HD ARG 65 24.186 -5.256 -4.003
466 HE ARG 65 HE ARG 65 26.464 -5.215 -3.489
467 HH11 ARG 65 1HH1 ARG 65 24.630 -6.732 -0.877
468 HH12 ARG 65 2HH1 ARG 65 26.050 -7.382 -0.088
469 HH21 ARG 65 1HH2 ARG 65 28.310 -6.068 -2.446
470 HH22 ARG 65 2HH2 ARG 65 28.132 -7.002 -0.977
471 H ASP 66 H ASP 66 21.326 -0.933 -3.283
472 HA ASP 66 HA ASP 66 23.899 0.417 -3.295
473 HB2 ASP 66 2HB ASP 66 21.249 1.027 -4.639
474 HB3 ASP 66 3HB ASP 66 22.738 1.957 -4.886
475 H ALA 67 H ALA 67 21.060 0.676 -1.345
476 HA ALA 67 HA ALA 67 21.097 3.517 -0.946
477 HB1 ALA 67 1HB ALA 67 19.137 2.067 -0.489
478 HB2 ALA 67 2HB ALA 67 20.036 1.274 0.826
479 HB3 ALA 67 3HB ALA 67 19.613 2.998 0.945
480 H GLU 68 H GLU 68 23.103 0.903 0.239
481 HA GLU 68 HA GLU 68 23.900 2.077 2.723
482 HB2 GLU 68 2HB GLU 68 24.264 -0.281 2.166
483 HB3 GLU 68 3HB GLU 68 25.335 0.168 0.826
484 HG2 GLU 68 2HG GLU 68 26.935 1.173 2.395
485 HG3 GLU 68 3HG GLU 68 25.838 0.867 3.748
486 H ASP 69 H ASP 69 24.774 2.707 -0.633
487 HA ASP 69 HA ASP 69 27.081 4.350 0.177
488 HB2 ASP 69 2HB ASP 69 25.914 3.567 -2.509
489 HB3 ASP 69 3HB ASP 69 27.266 4.692 -2.318
490 H ALA 70 H ALA 70 23.766 4.753 -1.067
491 HA ALA 70 HA ALA 70 24.074 7.553 -1.664
492 HB1 ALA 70 1HB ALA 70 22.398 6.079 -2.737
493 HB2 ALA 70 2HB ALA 70 21.594 5.859 -1.167
494 HB3 ALA 70 3HB ALA 70 21.621 7.466 -1.926
495 H VAL 71 H VAL 71 23.224 5.681 1.213
496 HA VAL 71 HA VAL 71 22.144 7.930 2.684
497 HB VAL 71 HB VAL 71 23.038 5.111 3.392
498 HG11 VAL 71 1HG1 VAL 71 21.881 7.225 5.257
499 HG12 VAL 71 2HG1 VAL 71 21.886 5.484 5.599
500 HG13 VAL 71 3HG1 VAL 71 23.423 6.346 5.447
501 HG21 VAL 71 1HG2 VAL 71 20.915 5.477 2.089
502 HG22 VAL 71 2HG2 VAL 71 20.625 4.781 3.698
503 HG23 VAL 71 3HG2 VAL 71 20.326 6.512 3.397
504 H SER 72 H SER 72 25.202 7.349 1.531
505 HA SER 72 HA SER 72 26.389 9.009 3.690
506 HB2 SER 72 2HB SER 72 27.046 6.645 4.040
507 HB3 SER 72 3HB SER 72 27.710 6.592 2.392
508 HG SER 72 HG SER 72 29.163 8.224 2.991
509 H GLY 73 H GLY 73 25.447 8.975 0.570
510 HA2 GLY 73 2HA GLY 73 27.870 9.842 -0.769
511 HA3 GLY 73 3HA GLY 73 26.214 9.863 -1.408
512 H ARG 74 H ARG 74 25.192 11.448 0.939
513 HA ARG 74 HA ARG 74 26.685 13.953 0.889
514 HB2 ARG 74 2HB ARG 74 25.262 13.748 -1.305
515 HB3 ARG 74 3HB ARG 74 23.877 14.068 -0.241
516 HG2 ARG 74 2HG ARG 74 24.948 16.195 0.496
517 HG3 ARG 74 3HG ARG 74 26.372 15.812 -0.496
518 HD2 ARG 74 2HD ARG 74 24.862 15.761 -2.515
519 HD3 ARG 74 3HD ARG 74 23.541 16.347 -1.483
520 HE ARG 74 HE ARG 74 25.772 18.076 -1.155
521 HH11 ARG 74 1HH1 ARG 74 23.382 17.168 -3.602
522 HH12 ARG 74 2HH1 ARG 74 23.459 18.719 -4.410
523 HH21 ARG 74 1HH2 ARG 74 25.901 20.057 -2.280
524 HH22 ARG 74 2HH2 ARG 74 24.937 20.307 -3.722
525 H ASP 75 H ASP 75 25.181 11.775 2.641
526 HA ASP 75 HA ASP 75 23.126 13.233 4.017
527 HB2 ASP 75 2HB ASP 75 23.313 10.753 3.970
528 HB3 ASP 75 3HB ASP 75 24.820 10.859 4.887
529 H GLY 76 H GLY 76 23.189 14.227 6.085
530 HA2 GLY 76 2HA GLY 76 24.066 15.386 7.829
531 HA3 GLY 76 3HA GLY 76 25.474 14.303 7.755
532 H TYR 77 H TYR 77 24.288 16.633 5.251
533 HA TYR 77 HA TYR 77 27.045 17.680 5.223
534 HB2 TYR 77 2HB TYR 77 26.592 16.773 3.143
535 HB3 TYR 77 3HB TYR 77 24.953 17.420 3.105
536 HD1 TYR 77 HD1 TYR 77 24.517 19.243 1.760
537 HD2 TYR 77 HD2 TYR 77 28.492 18.676 3.295
538 HE1 TYR 77 HE1 TYR 77 25.286 21.217 0.474
539 HE2 TYR 77 HE2 TYR 77 29.276 20.651 2.007
540 HH TYR 77 HH TYR 77 28.687 22.343 0.573
541 H ASP 78 H ASP 78 27.607 19.678 5.573
542 HA ASP 78 HA ASP 78 25.878 21.413 6.993
543 HB2 ASP 78 2HB ASP 78 28.217 21.473 7.415
544 HB3 ASP 78 3HB ASP 78 28.590 21.776 5.718
545 H TYR 79 H TYR 79 24.090 22.218 6.125
546 HA TYR 79 HA TYR 79 24.306 23.635 3.528
547 HB2 TYR 79 2HB TYR 79 22.793 21.815 3.373
548 HB3 TYR 79 3HB TYR 79 22.018 22.241 4.896
549 HD1 TYR 79 HD1 TYR 79 20.314 23.897 5.030
550 HD2 TYR 79 HD2 TYR 79 22.411 23.234 1.347
551 HE1 TYR 79 HE1 TYR 79 18.580 25.218 3.816
552 HE2 TYR 79 HE2 TYR 79 20.703 24.568 0.122
553 HH TYR 79 HH TYR 79 17.894 26.030 1.789
554 H ASP 80 H ASP 80 22.556 25.453 3.373
555 HA ASP 80 HA ASP 80 23.340 27.464 5.209
556 HB2 ASP 80 2HB ASP 80 22.731 28.080 3.001
557 HB3 ASP 80 3HB ASP 80 21.147 27.302 3.143
558 H GLY 81 H GLY 81 22.936 27.147 7.341
559 HA2 GLY 81 2HA GLY 81 21.702 27.463 9.255
560 HA3 GLY 81 3HA GLY 81 20.247 27.679 8.273
561 H TYR 82 H TYR 82 21.360 24.835 7.110
562 HA TYR 82 HA TYR 82 20.317 23.154 9.309
563 HB2 TYR 82 2HB TYR 82 19.166 23.258 6.514
564 HB3 TYR 82 3HB TYR 82 18.894 21.929 7.631
565 HD1 TYR 82 HD1 TYR 82 17.372 22.120 9.490
566 HD2 TYR 82 HD2 TYR 82 18.319 25.527 7.052
567 HE1 TYR 82 HE1 TYR 82 15.471 23.356 10.499
568 HE2 TYR 82 HE2 TYR 82 16.411 26.781 8.052
569 HH TYR 82 HH TYR 82 14.279 25.323 10.536
570 H ARG 83 H ARG 83 20.173 20.730 8.073
571 HA ARG 83 HA ARG 83 22.820 20.175 6.865
572 HB2 ARG 83 2HB ARG 83 23.117 20.168 9.346
573 HB3 ARG 83 3HB ARG 83 21.857 18.923 9.464
574 HG2 ARG 83 2HG ARG 83 23.219 17.366 8.164
575 HG3 ARG 83 3HG ARG 83 24.433 18.637 7.854
576 HD2 ARG 83 2HD ARG 83 24.809 18.837 10.311
577 HD3 ARG 83 3HD ARG 83 23.666 17.504 10.570
578 HE ARG 83 HE ARG 83 26.110 17.127 8.890
579 HH11 ARG 83 1HH1 ARG 83 24.199 16.266 11.745
580 HH12 ARG 83 2HH1 ARG 83 25.156 14.846 12.089
581 HH21 ARG 83 1HH2 ARG 83 27.336 15.286 9.366
582 HH22 ARG 83 2HH2 ARG 83 26.946 14.299 10.751
583 H LEU 84 H LEU 84 22.690 18.532 5.437
584 HA LEU 84 HA LEU 84 20.134 17.591 4.585
585 HB2 LEU 84 2HB LEU 84 23.003 16.807 4.002
586 HB3 LEU 84 3HB LEU 84 21.667 15.882 3.327
587 HG LEU 84 HG LEU 84 22.568 17.602 1.774
588 HD11 LEU 84 1HD1 LEU 84 20.406 18.413 1.020
589 HD12 LEU 84 2HD1 LEU 84 20.247 16.741 1.602
590 HD13 LEU 84 3HD1 LEU 84 19.684 18.092 2.612
591 HD21 LEU 84 1HD2 LEU 84 21.294 19.628 3.657
592 HD22 LEU 84 2HD2 LEU 84 23.048 19.384 3.465
593 HD23 LEU 84 3HD2 LEU 84 22.074 19.962 2.101
594 H ARG 85 H ARG 85 19.075 15.635 4.843
595 HA ARG 85 HA ARG 85 20.243 13.687 6.778
596 HB2 ARG 85 2HB ARG 85 17.476 14.935 6.849
597 HB3 ARG 85 3HB ARG 85 17.917 13.462 7.738
598 HG2 ARG 85 2HG ARG 85 19.662 14.647 8.959
599 HG3 ARG 85 3HG ARG 85 19.386 16.122 8.020
600 HD2 ARG 85 2HD ARG 85 17.309 14.788 9.796
601 HD3 ARG 85 3HD ARG 85 18.305 16.178 10.270
602 HE ARG 85 HE ARG 85 17.259 17.313 8.204
603 HH11 ARG 85 1HH1 ARG 85 15.569 14.999 10.303
604 HH12 ARG 85 2HH1 ARG 85 13.990 15.616 9.870
605 HH21 ARG 85 1HH2 ARG 85 15.175 18.093 7.709
606 HH22 ARG 85 2HH2 ARG 85 13.766 17.326 8.404
607 H VAL 86 H VAL 86 20.805 12.735 4.645
608 HA VAL 86 HA VAL 86 18.560 11.417 3.258
609 HB VAL 86 HB VAL 86 21.566 11.257 2.801
610 HG11 VAL 86 1HG1 VAL 86 20.374 9.280 1.941
611 HG12 VAL 86 2HG1 VAL 86 19.199 10.327 1.116
612 HG13 VAL 86 3HG1 VAL 86 20.902 10.319 0.603
613 HG21 VAL 86 1HG2 VAL 86 19.405 12.855 1.369
614 HG22 VAL 86 2HG2 VAL 86 20.683 13.523 2.408
615 HG23 VAL 86 3HG2 VAL 86 21.110 12.732 0.873
616 H GLU 87 H GLU 87 17.710 10.016 4.806
617 HA GLU 87 HA GLU 87 19.259 7.550 5.180
618 HB2 GLU 87 2HB GLU 87 18.900 7.495 7.610
619 HB3 GLU 87 3HB GLU 87 19.889 8.898 7.151
620 HG2 GLU 87 2HG GLU 87 17.866 10.341 7.251
621 HG3 GLU 87 3HG GLU 87 16.890 8.943 7.731
622 H PHE 88 H PHE 88 17.924 5.754 5.982
623 HA PHE 88 HA PHE 88 15.341 5.869 4.730
624 HB2 PHE 88 2HB PHE 88 15.232 3.452 5.682
625 HB3 PHE 88 3HB PHE 88 16.318 3.869 4.349
626 HD1 PHE 88 HD1 PHE 88 16.167 3.089 7.972
627 HD2 PHE 88 HD2 PHE 88 18.690 3.813 4.573
628 HE1 PHE 88 HE1 PHE 88 18.120 2.242 9.244
629 HE2 PHE 88 HE2 PHE 88 20.649 2.958 5.844
630 HZ PHE 88 HZ PHE 88 20.366 2.185 8.181
631 HA PRO 89 HA PRO 89 12.586 6.654 8.052
632 HB2 PRO 89 2HB PRO 89 10.426 5.100 7.343
633 HB3 PRO 89 3HB PRO 89 10.862 6.630 6.516
634 HG2 PRO 89 2HG PRO 89 11.470 3.794 5.653
635 HG3 PRO 89 3HG PRO 89 10.901 5.179 4.659
636 HD2 PRO 89 2HD PRO 89 13.537 4.413 4.782
637 HD3 PRO 89 3HD PRO 89 13.041 6.123 4.582
638 H5' A 90 1H5* A 90 13.004 16.855 12.643
639 H5'' A 90 2H5* A 90 11.558 16.922 13.668
640 H4' A 90 H4* A 90 11.180 15.246 11.972
641 H3' A 90 H3* A 90 11.531 14.360 14.793
642 H2' A 90 1H2* A 90 11.866 12.090 14.322
643 HO2' A 90 2HO* A 90 10.102 12.000 12.779
644 H1' A 90 H1* A 90 13.472 12.279 12.158
645 H8 A 90 H8 A 90 13.402 12.056 15.569
646 H61 A 90 1H6 A 90 18.817 14.953 16.315
647 H62 A 90 2H6 A 90 17.618 13.925 17.075
648 H2 A 90 H2 A 90 17.369 15.801 12.194
649 HO5' A 90 H5T A 90 13.490 16.884 14.897
650 H5' A 91 1H5* A 91 7.457 15.691 11.706
651 H5'' A 91 2H5* A 91 9.065 15.111 11.218
652 H4' A 91 H4* A 91 8.445 16.743 9.594
653 H3' A 91 H3* A 91 10.674 17.281 11.326
654 H2' A 91 1H2* A 91 9.704 19.188 12.284
655 HO2' A 91 2HO* A 91 11.422 19.980 10.939
656 H1' A 91 H1* A 91 8.215 19.662 9.685
657 H8 A 91 H8 A 91 9.119 21.774 12.078
658 H61 A 91 1H6 A 91 3.357 23.023 14.001
659 H62 A 91 2H6 A 91 5.027 23.558 14.028
660 H2 A 91 H2 A 91 3.242 19.249 11.644
661 H5' C 92 1H5* C 92 10.017 15.794 6.407
662 H5'' C 92 2H5* C 92 8.777 16.514 7.448
663 H4' C 92 H4* C 92 7.807 14.555 6.431
664 H3' C 92 H3* C 92 8.013 14.825 9.230
665 H2' C 92 1H2* C 92 9.619 13.152 9.528
666 HO2' C 92 2HO* C 92 7.148 11.759 9.287
667 H1' C 92 H1* C 92 8.361 11.616 7.218
668 H41 C 92 1H4 C 92 13.619 8.069 7.933
669 H42 C 92 2H4 C 92 14.475 9.375 8.723
670 H5 C 92 H5 C 92 13.484 11.587 9.076
671 H6 C 92 H6 C 92 11.488 12.930 8.752
672 H5' A 93 1H5* A 93 3.440 12.829 7.066
673 H5'' A 93 2H5* A 93 4.987 11.995 6.810
674 H4' A 93 H4* A 93 3.377 13.287 4.560
675 H3' A 93 H3* A 93 3.328 10.508 5.745
676 H2' A 93 1H2* A 93 3.064 9.595 3.563
677 HO2' A 93 2HO* A 93 1.508 11.181 2.857
678 H1' A 93 H1* A 93 4.799 11.322 2.296
679 H8 A 93 H8 A 93 5.480 9.668 5.690
680 H61 A 93 1H6 A 93 9.060 5.861 2.308
681 H62 A 93 2H6 A 93 8.489 6.208 3.929
682 H2 A 93 H2 A 93 7.029 8.754 -0.426
683 H5' A 94 1H5* A 94 -0.258 12.286 3.234
684 H5'' A 94 2H5* A 94 -1.697 11.253 3.360
685 H4' A 94 H4* A 94 0.412 10.991 1.167
686 H3' A 94 H3* A 94 -1.631 13.007 1.480
687 H2' A 94 1H2* A 94 -3.363 12.258 0.150
688 HO2' A 94 2HO* A 94 -1.978 12.280 -1.726
689 H1' A 94 H1* A 94 -3.021 9.549 0.005
690 H8 A 94 H8 A 94 -4.949 11.935 1.338
691 H61 A 94 1H6 A 94 -5.749 9.081 6.770
692 H62 A 94 2H6 A 94 -6.336 10.348 5.716
693 H2 A 94 H2 A 94 -2.274 7.192 4.724
694 H5' A 95 1H5* A 95 -0.734 15.049 -1.867
695 H5'' A 95 2H5* A 95 1.019 15.229 -2.070
696 H4' A 95 H4* A 95 -0.056 17.277 -2.787
697 H3' A 95 H3* A 95 2.043 17.278 -1.067
698 HO3' A 95 H3T A 95 2.093 19.498 -1.448
699 H2' A 95 1H2* A 95 0.975 17.363 1.002
700 HO2' A 95 2HO* A 95 0.749 20.061 0.126
701 H1' A 95 H1* A 95 -1.352 19.028 0.303
702 H8 A 95 H8 A 95 -0.278 17.666 2.990
703 H61 A 95 1H6 A 95 -4.658 13.333 3.613
704 H62 A 95 2H6 A 95 -3.404 14.238 4.436
705 H2 A 95 H2 A 95 -4.736 14.776 -0.601
Start of MODEL 10
1 H VAL 6 H1 VAL 6 0.122 1.420 0.401
2 HA VAL 6 HA VAL 6 1.165 3.492 -0.052
3 HB VAL 6 HB VAL 6 2.356 1.348 -1.838
4 HG11 VAL 6 1HG1 VAL 6 3.428 3.578 -1.965
5 HG12 VAL 6 2HG1 VAL 6 3.568 3.612 -0.191
6 HG13 VAL 6 3HG1 VAL 6 4.482 2.418 -1.136
7 HG21 VAL 6 1HG2 VAL 6 2.605 1.703 1.174
8 HG22 VAL 6 2HG2 VAL 6 1.805 0.349 0.344
9 HG23 VAL 6 3HG2 VAL 6 3.557 0.583 0.173
10 H ILE 7 H ILE 7 0.857 1.818 -3.210
11 HA ILE 7 HA ILE 7 0.610 2.534 -5.318
12 HB ILE 7 HB ILE 7 -0.983 4.716 -3.944
13 HG12 ILE 7 2HG1 ILE 7 -2.129 2.490 -5.615
14 HG13 ILE 7 3HG1 ILE 7 -1.505 2.070 -4.003
15 HG21 ILE 7 1HG2 ILE 7 -0.802 3.990 -6.899
16 HG22 ILE 7 2HG2 ILE 7 -2.031 5.064 -6.178
17 HG23 ILE 7 3HG2 ILE 7 -0.325 5.534 -6.157
18 HD11 ILE 7 1HD1 ILE 7 -3.896 2.633 -3.886
19 HD12 ILE 7 2HD1 ILE 7 -2.909 3.790 -2.968
20 HD13 ILE 7 3HD1 ILE 7 -3.563 4.246 -4.558
21 H ARG 8 H ARG 8 1.741 5.175 -3.181
22 HA ARG 8 HA ARG 8 3.993 5.649 -4.960
23 HB2 ARG 8 2HB ARG 8 2.347 6.968 -6.135
24 HB3 ARG 8 3HB ARG 8 1.774 7.715 -4.641
25 HG2 ARG 8 2HG ARG 8 4.684 8.032 -5.381
26 HG3 ARG 8 3HG ARG 8 3.457 8.967 -6.262
27 HD2 ARG 8 2HD ARG 8 2.563 9.756 -4.021
28 HD3 ARG 8 3HD ARG 8 3.997 9.021 -3.269
29 HE ARG 8 HE ARG 8 5.376 10.634 -4.244
30 HH11 ARG 8 1HH1 ARG 8 2.004 11.062 -5.218
31 HH12 ARG 8 2HH1 ARG 8 2.274 12.665 -5.863
32 HH21 ARG 8 1HH2 ARG 8 5.701 12.703 -5.110
33 HH22 ARG 8 2HH2 ARG 8 4.366 13.610 -5.781
34 H GLY 9 H GLY 9 2.089 6.356 -2.051
35 HA2 GLY 9 2HA GLY 9 4.457 6.751 -0.447
36 HA3 GLY 9 3HA GLY 9 3.675 8.282 -0.841
37 HA PRO 10 HA PRO 10 0.527 7.966 2.119
38 HB2 PRO 10 2HB PRO 10 -1.696 7.300 0.231
39 HB3 PRO 10 3HB PRO 10 -1.549 8.675 1.366
40 HG2 PRO 10 2HG PRO 10 -1.200 9.003 -1.323
41 HG3 PRO 10 3HG PRO 10 -0.210 9.905 -0.133
42 HD2 PRO 10 2HD PRO 10 0.525 7.449 -1.725
43 HD3 PRO 10 3HD PRO 10 1.528 8.871 -1.313
44 H ALA 11 H ALA 11 -0.072 6.548 3.608
45 HA ALA 11 HA ALA 11 -0.560 4.635 4.694
46 HB1 ALA 11 1HB ALA 11 -2.155 4.002 2.187
47 HB2 ALA 11 2HB ALA 11 -2.378 3.270 3.792
48 HB3 ALA 11 3HB ALA 11 -2.711 5.001 3.547
49 H GLY 12 H GLY 12 -0.558 2.180 4.668
50 HA2 GLY 12 2HA GLY 12 0.412 0.154 4.185
51 HA3 GLY 12 3HA GLY 12 0.991 0.808 2.645
52 H ASN 13 H ASN 13 2.645 -0.876 3.898
53 HA ASN 13 HA ASN 13 4.519 0.484 5.658
54 HB2 ASN 13 2HB ASN 13 4.710 -2.129 4.118
55 HB3 ASN 13 3HB ASN 13 5.848 -1.588 5.359
56 HD21 ASN 13 1HD2 ASN 13 3.257 -3.937 6.824
57 HD22 ASN 13 2HD2 ASN 13 4.323 -4.028 5.435
58 H ASN 14 H ASN 14 6.862 0.705 5.076
59 HA ASN 14 HA ASN 14 7.116 2.208 2.622
60 HB2 ASN 14 2HB ASN 14 8.293 2.798 4.727
61 HB3 ASN 14 3HB ASN 14 9.215 1.287 4.620
62 HD21 ASN 14 1HD2 ASN 14 11.729 2.987 2.857
63 HD22 ASN 14 2HD2 ASN 14 11.274 2.017 4.244
64 H ASP 15 H ASP 15 8.242 1.724 0.774
65 HA ASP 15 HA ASP 15 8.791 -1.113 0.194
66 HB2 ASP 15 2HB ASP 15 8.947 1.398 -1.510
67 HB3 ASP 15 3HB ASP 15 9.166 -0.257 -2.101
68 H CYS 16 H CYS 16 10.905 -0.686 -1.696
69 HA CYS 16 HA CYS 16 13.235 -0.629 -0.013
70 HB2 CYS 16 2HB CYS 16 12.874 -0.482 -3.034
71 HB3 CYS 16 3HB CYS 16 14.439 -0.680 -2.211
72 HG CYS 16 HG CYS 16 13.668 -2.987 -3.135
73 H ARG 17 H ARG 17 11.292 1.873 -0.525
74 HA ARG 17 HA ARG 17 13.070 3.903 -1.530
75 HB2 ARG 17 2HB ARG 17 10.363 3.889 -0.172
76 HB3 ARG 17 3HB ARG 17 11.226 5.407 -0.487
77 HG2 ARG 17 2HG ARG 17 11.364 4.893 -2.866
78 HG3 ARG 17 3HG ARG 17 10.555 3.324 -2.610
79 HD2 ARG 17 2HD ARG 17 8.525 4.434 -1.882
80 HD3 ARG 17 3HD ARG 17 9.338 6.011 -1.884
81 HE ARG 17 HE ARG 17 9.107 4.472 -4.430
82 HH11 ARG 17 1HH1 ARG 17 8.251 7.276 -2.465
83 HH12 ARG 17 2HH1 ARG 17 7.592 8.179 -3.802
84 HH21 ARG 17 1HH2 ARG 17 8.260 5.652 -6.175
85 HH22 ARG 17 2HH2 ARG 17 7.600 7.250 -5.924
86 H ILE 18 H ILE 18 13.877 5.711 -0.445
87 HA ILE 18 HA ILE 18 14.092 5.532 2.513
88 HB ILE 18 HB ILE 18 16.394 6.200 2.451
89 HG12 ILE 18 2HG1 ILE 18 16.237 6.210 -0.584
90 HG13 ILE 18 3HG1 ILE 18 16.239 7.664 0.436
91 HG21 ILE 18 1HG2 ILE 18 15.847 3.778 2.188
92 HG22 ILE 18 2HG2 ILE 18 16.082 3.953 0.430
93 HG23 ILE 18 3HG2 ILE 18 17.441 4.223 1.548
94 HD11 ILE 18 1HD1 ILE 18 18.464 5.598 0.250
95 HD12 ILE 18 2HD1 ILE 18 18.497 7.266 -0.364
96 HD13 ILE 18 3HD1 ILE 18 18.443 6.968 1.387
97 H TYR 19 H TYR 19 15.098 7.779 3.234
98 HA TYR 19 HA TYR 19 13.490 9.846 1.854
99 HB2 TYR 19 2HB TYR 19 12.157 9.507 3.627
100 HB3 TYR 19 3HB TYR 19 13.461 9.025 4.699
101 HD1 TYR 19 HD1 TYR 19 15.050 10.789 5.596
102 HD2 TYR 19 HD2 TYR 19 11.331 11.751 3.662
103 HE1 TYR 19 HE1 TYR 19 15.085 13.033 6.655
104 HE2 TYR 19 HE2 TYR 19 11.349 13.992 4.754
105 HH TYR 19 HH TYR 19 13.996 15.025 6.914
106 H VAL 20 H VAL 20 14.070 11.982 1.859
107 HA VAL 20 HA VAL 20 16.867 12.543 2.676
108 HB VAL 20 HB VAL 20 15.637 13.360 0.023
109 HG11 VAL 20 1HG1 VAL 20 17.315 14.940 0.883
110 HG12 VAL 20 2HG1 VAL 20 18.455 13.605 1.154
111 HG13 VAL 20 3HG1 VAL 20 17.965 14.032 -0.503
112 HG21 VAL 20 1HG2 VAL 20 17.272 11.768 -0.971
113 HG22 VAL 20 2HG2 VAL 20 17.688 11.197 0.661
114 HG23 VAL 20 3HG2 VAL 20 16.048 10.942 0.014
115 H GLY 21 H GLY 21 17.220 14.581 3.510
116 HA2 GLY 21 2HA GLY 21 15.004 16.554 3.424
117 HA3 GLY 21 3HA GLY 21 15.550 15.956 5.000
118 H ASN 22 H ASN 22 15.810 18.480 4.985
119 HA ASN 22 HA ASN 22 17.072 20.335 4.960
120 HB2 ASN 22 2HB ASN 22 18.595 18.861 6.282
121 HB3 ASN 22 3HB ASN 22 19.448 18.460 4.785
122 HD21 ASN 22 1HD2 ASN 22 21.640 21.121 5.516
123 HD22 ASN 22 2HD2 ASN 22 21.431 19.390 5.344
124 H LEU 23 H LEU 23 16.192 19.059 2.345
125 HA LEU 23 HA LEU 23 18.192 19.799 0.403
126 HB2 LEU 23 2HB LEU 23 15.188 19.397 0.183
127 HB3 LEU 23 3HB LEU 23 16.277 19.619 -1.200
128 HG LEU 23 HG LEU 23 16.522 17.362 0.842
129 HD11 LEU 23 1HD1 LEU 23 15.463 17.349 -2.018
130 HD12 LEU 23 2HD1 LEU 23 15.646 15.933 -0.961
131 HD13 LEU 23 3HD1 LEU 23 14.468 17.201 -0.549
132 HD21 LEU 23 1HD2 LEU 23 18.672 17.907 -0.204
133 HD22 LEU 23 2HD2 LEU 23 18.042 16.404 -0.908
134 HD23 LEU 23 3HD2 LEU 23 17.909 17.922 -1.818
135 HA PRO 24 HA PRO 24 17.644 24.196 0.457
136 HB2 PRO 24 2HB PRO 24 18.134 24.094 -2.491
137 HB3 PRO 24 3HB PRO 24 19.014 25.020 -1.238
138 HG2 PRO 24 2HG PRO 24 20.087 22.779 -2.391
139 HG3 PRO 24 3HG PRO 24 20.346 23.170 -0.661
140 HD2 PRO 24 2HD PRO 24 18.428 21.188 -1.880
141 HD3 PRO 24 3HD PRO 24 19.418 21.058 -0.392
142 HA PRO 25 HA PRO 25 13.538 24.901 -1.100
143 HB2 PRO 25 2HB PRO 25 13.520 27.622 -1.484
144 HB3 PRO 25 3HB PRO 25 13.508 26.862 0.138
145 HG2 PRO 25 2HG PRO 25 15.863 28.003 -1.389
146 HG3 PRO 25 3HG PRO 25 15.454 28.203 0.346
147 HD2 PRO 25 2HD PRO 25 17.298 26.387 -0.549
148 HD3 PRO 25 3HD PRO 25 16.267 26.075 0.883
149 H ASP 26 H ASP 26 16.393 25.733 -2.912
150 HA ASP 26 HA ASP 26 14.916 26.239 -5.396
151 HB2 ASP 26 2HB ASP 26 17.869 26.231 -4.711
152 HB3 ASP 26 3HB ASP 26 17.235 26.513 -6.336
153 H ILE 27 H ILE 27 15.201 23.499 -3.850
154 HA ILE 27 HA ILE 27 16.654 21.743 -5.515
155 HB ILE 27 HB ILE 27 15.884 21.180 -3.241
156 HG12 ILE 27 2HG1 ILE 27 14.998 18.915 -3.642
157 HG13 ILE 27 3HG1 ILE 27 14.660 19.321 -5.331
158 HG21 ILE 27 1HG2 ILE 27 13.529 20.647 -2.804
159 HG22 ILE 27 2HG2 ILE 27 13.673 22.324 -3.364
160 HG23 ILE 27 3HG2 ILE 27 13.103 21.057 -4.479
161 HD11 ILE 27 1HD1 ILE 27 17.414 19.359 -4.014
162 HD12 ILE 27 2HD1 ILE 27 16.791 18.070 -5.075
163 HD13 ILE 27 3HD1 ILE 27 17.079 19.691 -5.733
164 H ARG 28 H ARG 28 15.972 20.249 -7.128
165 HA ARG 28 HA ARG 28 13.374 20.754 -8.441
166 HB2 ARG 28 2HB ARG 28 14.991 22.290 -9.505
167 HB3 ARG 28 3HB ARG 28 16.091 20.933 -9.801
168 HG2 ARG 28 2HG ARG 28 14.368 19.869 -11.253
169 HG3 ARG 28 3HG ARG 28 13.286 21.252 -10.955
170 HD2 ARG 28 2HD ARG 28 14.423 21.551 -13.085
171 HD3 ARG 28 3HD ARG 28 15.003 22.769 -11.938
172 HE ARG 28 HE ARG 28 16.934 21.045 -11.556
173 HH11 ARG 28 1HH1 ARG 28 15.341 21.682 -14.646
174 HH12 ARG 28 2HH1 ARG 28 16.735 21.210 -15.591
175 HH21 ARG 28 1HH2 ARG 28 18.702 20.413 -12.787
176 HH22 ARG 28 2HH2 ARG 28 18.654 20.509 -14.536
177 H THR 29 H THR 29 12.647 18.953 -9.685
178 HA THR 29 HA THR 29 13.402 16.485 -8.579
179 HB THR 29 HB THR 29 11.964 16.606 -11.202
180 HG1 THR 29 1HG THR 29 10.125 17.251 -10.069
181 HG21 THR 29 1HG2 THR 29 10.570 14.894 -10.065
182 HG22 THR 29 2HG2 THR 29 12.290 14.434 -10.082
183 HG23 THR 29 3HG2 THR 29 11.555 15.079 -8.597
184 H LYS 30 H LYS 30 14.697 18.088 -11.430
185 HA LYS 30 HA LYS 30 15.918 15.624 -12.417
186 HB2 LYS 30 2HB LYS 30 15.703 18.476 -13.282
187 HB3 LYS 30 3HB LYS 30 17.120 17.578 -13.851
188 HG2 LYS 30 2HG LYS 30 14.513 16.139 -14.026
189 HG3 LYS 30 3HG LYS 30 14.705 17.530 -15.108
190 HD2 LYS 30 2HD LYS 30 15.457 15.382 -16.150
191 HD3 LYS 30 3HD LYS 30 16.740 16.604 -16.056
192 HE2 LYS 30 2HE LYS 30 17.600 15.518 -13.987
193 HE3 LYS 30 3HE LYS 30 16.350 14.270 -14.137
194 HZ1 LYS 30 1HZ LYS 30 18.409 14.829 -16.166
195 HZ2 LYS 30 2HZ LYS 30 18.505 13.631 -15.051
196 HZ3 LYS 30 3HZ LYS 30 17.313 13.597 -16.190
197 H ASP 31 H ASP 31 16.762 18.099 -10.115
198 HA ASP 31 HA ASP 31 19.628 17.762 -10.419
199 HB2 ASP 31 2HB ASP 31 17.948 18.967 -8.190
200 HB3 ASP 31 3HB ASP 31 19.715 18.995 -8.260
201 H ILE 32 H ILE 32 17.094 16.379 -8.312
202 HA ILE 32 HA ILE 32 19.033 14.912 -6.721
203 HB ILE 32 HB ILE 32 16.996 15.666 -5.691
204 HG12 ILE 32 2HG1 ILE 32 16.731 12.653 -6.064
205 HG13 ILE 32 3HG1 ILE 32 17.984 13.411 -5.065
206 HG21 ILE 32 1HG2 ILE 32 15.524 13.971 -7.756
207 HG22 ILE 32 2HG2 ILE 32 14.768 14.830 -6.391
208 HG23 ILE 32 3HG2 ILE 32 15.549 15.744 -7.695
209 HD11 ILE 32 1HD1 ILE 32 16.123 12.756 -3.655
210 HD12 ILE 32 2HD1 ILE 32 16.204 14.535 -3.728
211 HD13 ILE 32 3HD1 ILE 32 14.976 13.646 -4.670
212 H GLU 33 H GLU 33 17.377 14.385 -9.773
213 HA GLU 33 HA GLU 33 17.558 11.482 -9.657
214 HB2 GLU 33 2HB GLU 33 16.896 13.528 -11.791
215 HB3 GLU 33 3HB GLU 33 17.131 11.813 -12.196
216 HG2 GLU 33 2HG GLU 33 15.402 11.142 -10.629
217 HG3 GLU 33 3HG GLU 33 15.174 12.812 -10.091
218 H ASP 34 H ASP 34 19.511 14.167 -11.029
219 HA ASP 34 HA ASP 34 21.305 12.332 -12.361
220 HB2 ASP 34 2HB ASP 34 21.455 15.296 -11.748
221 HB3 ASP 34 3HB ASP 34 22.707 14.415 -12.642
222 H VAL 35 H VAL 35 21.275 13.913 -9.168
223 HA VAL 35 HA VAL 35 24.018 13.249 -8.548
224 HB VAL 35 HB VAL 35 21.565 14.016 -6.910
225 HG11 VAL 35 1HG1 VAL 35 23.144 14.291 -4.990
226 HG12 VAL 35 2HG1 VAL 35 22.954 12.592 -5.473
227 HG13 VAL 35 3HG1 VAL 35 24.412 13.495 -5.954
228 HG21 VAL 35 1HG2 VAL 35 24.199 15.433 -7.521
229 HG22 VAL 35 2HG2 VAL 35 22.654 15.754 -8.335
230 HG23 VAL 35 3HG2 VAL 35 22.827 16.104 -6.602
231 H PHE 36 H PHE 36 20.805 11.742 -7.787
232 HA PHE 36 HA PHE 36 22.131 9.543 -6.469
233 HB2 PHE 36 2HB PHE 36 19.274 10.176 -7.075
234 HB3 PHE 36 3HB PHE 36 19.746 8.550 -6.588
235 HD1 PHE 36 HD1 PHE 36 20.186 8.008 -4.343
236 HD2 PHE 36 HD2 PHE 36 19.915 12.132 -5.509
237 HE1 PHE 36 HE1 PHE 36 20.203 8.686 -1.954
238 HE2 PHE 36 HE2 PHE 36 19.946 12.811 -3.124
239 HZ PHE 36 HZ PHE 36 20.087 11.089 -1.343
240 H SER 37 H SER 37 20.956 10.008 -9.779
241 HA SER 37 HA SER 37 21.103 7.219 -10.458
242 HB2 SER 37 2HB SER 37 19.871 8.774 -11.838
243 HB3 SER 37 3HB SER 37 21.348 9.717 -12.168
244 HG SER 37 HG SER 37 20.842 8.245 -13.848
245 H LYS 38 H LYS 38 23.544 9.811 -10.275
246 HA LYS 38 HA LYS 38 25.615 8.183 -11.520
247 HB2 LYS 38 2HB LYS 38 25.627 10.777 -9.937
248 HB3 LYS 38 3HB LYS 38 27.106 10.010 -10.546
249 HG2 LYS 38 2HG LYS 38 26.276 10.109 -12.842
250 HG3 LYS 38 3HG LYS 38 24.732 10.787 -12.291
251 HD2 LYS 38 2HD LYS 38 25.956 12.748 -11.344
252 HD3 LYS 38 3HD LYS 38 27.479 12.089 -11.954
253 HE2 LYS 38 2HE LYS 38 25.067 12.841 -13.663
254 HE3 LYS 38 3HE LYS 38 26.525 13.825 -13.455
255 HZ1 LYS 38 1HZ LYS 38 27.796 12.040 -14.428
256 HZ2 LYS 38 2HZ LYS 38 26.433 11.126 -14.625
257 HZ3 LYS 38 3HZ LYS 38 26.613 12.533 -15.456
258 H TYR 39 H TYR 39 24.331 8.631 -8.262
259 HA TYR 39 HA TYR 39 26.595 7.206 -7.102
260 HB2 TYR 39 2HB TYR 39 24.300 8.726 -5.996
261 HB3 TYR 39 3HB TYR 39 25.053 7.485 -4.994
262 HD1 TYR 39 HD1 TYR 39 26.773 8.073 -3.626
263 HD2 TYR 39 HD2 TYR 39 26.140 10.330 -7.228
264 HE1 TYR 39 HE1 TYR 39 28.583 9.605 -2.958
265 HE2 TYR 39 HE2 TYR 39 27.977 11.875 -6.575
266 HH TYR 39 HH TYR 39 29.819 11.464 -3.535
267 H GLY 40 H GLY 40 23.774 6.095 -8.597
268 HA2 GLY 40 2HA GLY 40 24.352 3.407 -7.975
269 HA3 GLY 40 3HA GLY 40 23.106 3.942 -6.839
270 H ALA 41 H ALA 41 22.389 1.936 -8.353
271 HA ALA 41 HA ALA 41 21.171 2.757 -10.864
272 HB1 ALA 41 1HB ALA 41 21.007 0.179 -9.268
273 HB2 ALA 41 2HB ALA 41 20.423 0.413 -10.935
274 HB3 ALA 41 3HB ALA 41 22.160 0.526 -10.577
275 H ILE 42 H ILE 42 20.212 4.345 -8.680
276 HA ILE 42 HA ILE 42 17.806 3.537 -7.513
277 HB ILE 42 HB ILE 42 18.879 6.203 -8.474
278 HG12 ILE 42 2HG1 ILE 42 18.857 6.657 -6.002
279 HG13 ILE 42 3HG1 ILE 42 18.342 4.987 -5.727
280 HG21 ILE 42 1HG2 ILE 42 16.242 5.734 -7.026
281 HG22 ILE 42 2HG2 ILE 42 17.024 7.306 -7.287
282 HG23 ILE 42 3HG2 ILE 42 16.443 6.379 -8.678
283 HD11 ILE 42 1HD1 ILE 42 20.863 5.483 -5.523
284 HD12 ILE 42 2HD1 ILE 42 20.414 4.109 -6.556
285 HD13 ILE 42 3HD1 ILE 42 20.857 5.670 -7.289
286 H ARG 43 H ARG 43 15.695 3.359 -8.185
287 HA ARG 43 HA ARG 43 15.327 3.256 -11.121
288 HB2 ARG 43 2HB ARG 43 13.645 2.224 -8.804
289 HB3 ARG 43 3HB ARG 43 13.269 1.987 -10.517
290 HG2 ARG 43 2HG ARG 43 15.769 0.970 -9.097
291 HG3 ARG 43 3HG ARG 43 14.365 0.001 -9.576
292 HD2 ARG 43 2HD ARG 43 14.779 0.719 -11.969
293 HD3 ARG 43 3HD ARG 43 16.286 1.477 -11.420
294 HE ARG 43 HE ARG 43 17.179 -0.685 -10.877
295 HH11 ARG 43 1HH1 ARG 43 14.055 -0.809 -12.534
296 HH12 ARG 43 2HH1 ARG 43 14.251 -2.480 -13.014
297 HH21 ARG 43 1HH2 ARG 43 17.406 -2.829 -11.498
298 HH22 ARG 43 2HH2 ARG 43 16.160 -3.619 -12.446
299 H ASP 44 H ASP 44 14.059 4.963 -8.252
300 HA ASP 44 HA ASP 44 12.771 6.864 -10.073
301 HB2 ASP 44 2HB ASP 44 11.220 5.082 -8.210
302 HB3 ASP 44 3HB ASP 44 10.629 6.698 -8.620
303 H ILE 45 H ILE 45 12.225 8.850 -9.297
304 HA ILE 45 HA ILE 45 13.195 9.530 -6.554
305 HB ILE 45 HB ILE 45 13.622 10.750 -9.225
306 HG12 ILE 45 2HG1 ILE 45 15.556 11.760 -8.036
307 HG13 ILE 45 3HG1 ILE 45 14.960 11.099 -6.509
308 HG21 ILE 45 1HG2 ILE 45 12.941 12.550 -6.857
309 HG22 ILE 45 2HG2 ILE 45 13.608 13.073 -8.412
310 HG23 ILE 45 3HG2 ILE 45 11.981 12.378 -8.353
311 HD11 ILE 45 1HD1 ILE 45 15.689 9.423 -8.949
312 HD12 ILE 45 2HD1 ILE 45 16.769 9.719 -7.566
313 HD13 ILE 45 3HD1 ILE 45 15.255 8.818 -7.327
314 H ASP 46 H ASP 46 11.884 11.014 -5.357
315 HA ASP 46 HA ASP 46 9.280 11.726 -6.516
316 HB2 ASP 46 2HB ASP 46 8.983 9.472 -5.601
317 HB3 ASP 46 3HB ASP 46 9.610 9.999 -4.039
318 H LEU 47 H LEU 47 10.529 13.761 -6.356
319 HA LEU 47 HA LEU 47 11.079 14.948 -3.790
320 HB2 LEU 47 2HB LEU 47 12.227 15.684 -5.810
321 HB3 LEU 47 3HB LEU 47 10.687 16.065 -6.591
322 HG LEU 47 HG LEU 47 10.279 17.849 -4.880
323 HD11 LEU 47 1HD1 LEU 47 12.210 18.572 -3.491
324 HD12 LEU 47 2HD1 LEU 47 11.676 16.945 -3.043
325 HD13 LEU 47 3HD1 LEU 47 13.137 17.159 -4.043
326 HD21 LEU 47 1HD2 LEU 47 11.308 18.353 -7.059
327 HD22 LEU 47 2HD2 LEU 47 11.967 19.400 -5.785
328 HD23 LEU 47 3HD2 LEU 47 12.924 18.019 -6.379
329 H LYS 48 H LYS 48 9.873 16.435 -2.592
330 HA LYS 48 HA LYS 48 7.202 17.225 -3.545
331 HB2 LYS 48 2HB LYS 48 6.865 15.085 -2.346
332 HB3 LYS 48 3HB LYS 48 7.660 15.757 -0.915
333 HG2 LYS 48 2HG LYS 48 5.913 17.514 -0.770
334 HG3 LYS 48 3HG LYS 48 5.103 16.826 -2.195
335 HD2 LYS 48 2HD LYS 48 5.615 15.357 0.429
336 HD3 LYS 48 3HD LYS 48 4.073 16.098 -0.015
337 HE2 LYS 48 2HE LYS 48 5.439 13.895 -1.624
338 HE3 LYS 48 3HE LYS 48 4.198 13.607 -0.402
339 HZ1 LYS 48 1HZ LYS 48 3.295 13.720 -2.620
340 HZ2 LYS 48 2HZ LYS 48 2.679 14.913 -1.682
341 HZ3 LYS 48 3HZ LYS 48 3.830 15.267 -2.808
342 H ASN 49 H ASN 49 6.554 19.228 -2.711
343 HA ASN 49 HA ASN 49 8.234 20.479 -0.642
344 HB2 ASN 49 2HB ASN 49 8.727 22.428 -2.129
345 HB3 ASN 49 3HB ASN 49 9.503 20.935 -2.658
346 HD21 ASN 49 1HD2 ASN 49 8.298 22.135 -5.825
347 HD22 ASN 49 2HD2 ASN 49 9.646 22.239 -4.709
348 H ARG 50 H ARG 50 5.290 19.690 -1.335
349 HA ARG 50 HA ARG 50 4.104 22.085 -0.132
350 HB2 ARG 50 2HB ARG 50 2.440 22.365 -1.934
351 HB3 ARG 50 3HB ARG 50 4.085 22.641 -2.535
352 HG2 ARG 50 2HG ARG 50 4.121 20.258 -3.372
353 HG3 ARG 50 3HG ARG 50 2.414 20.119 -2.901
354 HD2 ARG 50 2HD ARG 50 1.860 22.027 -4.388
355 HD3 ARG 50 3HD ARG 50 3.564 22.162 -4.856
356 HE ARG 50 HE ARG 50 1.614 20.189 -5.778
357 HH11 ARG 50 1HH1 ARG 50 5.059 20.893 -5.351
358 HH12 ARG 50 2HH1 ARG 50 5.556 19.807 -6.628
359 HH21 ARG 50 1HH2 ARG 50 2.301 18.771 -7.430
360 HH22 ARG 50 2HH2 ARG 50 4.002 18.604 -7.797
361 H ARG 51 H ARG 51 1.755 21.681 0.306
362 HA ARG 51 HA ARG 51 0.145 20.505 1.351
363 HB2 ARG 51 2HB ARG 51 -0.189 19.422 -0.787
364 HB3 ARG 51 3HB ARG 51 1.112 18.267 -0.462
365 HG2 ARG 51 2HG ARG 51 -1.042 17.218 -0.113
366 HG3 ARG 51 3HG ARG 51 -0.172 17.333 1.426
367 HD2 ARG 51 2HD ARG 51 -1.524 19.272 2.084
368 HD3 ARG 51 3HD ARG 51 -2.288 19.309 0.482
369 HE ARG 51 HE ARG 51 -2.573 16.838 2.090
370 HH11 ARG 51 1HH1 ARG 51 -4.019 19.837 0.909
371 HH12 ARG 51 2HH1 ARG 51 -5.659 19.288 1.169
372 HH21 ARG 51 1HH2 ARG 51 -4.717 16.145 2.423
373 HH22 ARG 51 2HH2 ARG 51 -6.052 17.214 2.052
374 H GLY 52 H GLY 52 3.376 19.052 1.435
375 HA2 GLY 52 2HA GLY 52 2.779 17.848 4.094
376 HA3 GLY 52 3HA GLY 52 4.185 17.510 3.070
377 H GLY 53 H GLY 53 5.532 17.956 4.937
378 HA2 GLY 53 2HA GLY 53 5.673 20.603 6.100
379 HA3 GLY 53 3HA GLY 53 6.838 19.278 6.276
380 HA PRO 54 HA PRO 54 8.916 22.555 3.746
381 HB2 PRO 54 2HB PRO 54 11.441 22.043 4.784
382 HB3 PRO 54 3HB PRO 54 10.262 23.193 5.494
383 HG2 PRO 54 2HG PRO 54 10.847 20.341 6.308
384 HG3 PRO 54 3HG PRO 54 10.560 21.776 7.353
385 HD2 PRO 54 2HD PRO 54 8.620 19.918 6.825
386 HD3 PRO 54 3HD PRO 54 8.238 21.653 7.048
387 HA PRO 55 HA PRO 55 10.218 20.173 0.431
388 HB2 PRO 55 2HB PRO 55 13.007 21.299 0.569
389 HB3 PRO 55 3HB PRO 55 11.895 21.197 -0.837
390 HG2 PRO 55 2HG PRO 55 12.242 23.539 0.507
391 HG3 PRO 55 3HG PRO 55 10.615 23.042 -0.070
392 HD2 PRO 55 2HD PRO 55 11.751 22.901 2.711
393 HD3 PRO 55 3HD PRO 55 10.083 23.277 2.171
394 H PHE 56 H PHE 56 10.744 18.082 0.191
395 HA PHE 56 HA PHE 56 13.133 16.859 1.324
396 HB2 PHE 56 2HB PHE 56 12.056 15.450 2.899
397 HB3 PHE 56 3HB PHE 56 11.451 17.064 3.263
398 HD1 PHE 56 HD1 PHE 56 9.145 17.664 1.958
399 HD2 PHE 56 HD2 PHE 56 10.569 13.693 2.801
400 HE1 PHE 56 HE1 PHE 56 6.824 16.807 1.865
401 HE2 PHE 56 HE2 PHE 56 8.241 12.860 2.782
402 HZ PHE 56 HZ PHE 56 6.374 14.393 2.281
403 H ALA 57 H ALA 57 12.910 14.365 0.756
404 HA ALA 57 HA ALA 57 11.087 13.904 -1.511
405 HB1 ALA 57 1HB ALA 57 14.108 13.951 -1.858
406 HB2 ALA 57 2HB ALA 57 12.911 13.501 -3.097
407 HB3 ALA 57 3HB ALA 57 12.987 15.175 -2.492
408 H PHE 58 H PHE 58 11.106 11.755 -2.306
409 HA PHE 58 HA PHE 58 12.463 9.797 -0.527
410 HB2 PHE 58 2HB PHE 58 9.874 9.560 -2.086
411 HB3 PHE 58 3HB PHE 58 10.663 8.210 -1.268
412 HD1 PHE 58 HD1 PHE 58 8.362 10.904 -0.939
413 HD2 PHE 58 HD2 PHE 58 11.097 8.439 1.273
414 HE1 PHE 58 HE1 PHE 58 7.253 11.569 1.178
415 HE2 PHE 58 HE2 PHE 58 9.965 9.065 3.381
416 HZ PHE 58 HZ PHE 58 8.050 10.645 3.341
417 H VAL 59 H VAL 59 13.425 7.944 -1.496
418 HA VAL 59 HA VAL 59 13.916 8.149 -4.426
419 HB VAL 59 HB VAL 59 16.007 7.858 -2.233
420 HG11 VAL 59 1HG1 VAL 59 16.517 6.412 -4.165
421 HG12 VAL 59 2HG1 VAL 59 16.256 7.784 -5.267
422 HG13 VAL 59 3HG1 VAL 59 17.623 7.801 -4.126
423 HG21 VAL 59 1HG2 VAL 59 15.304 10.189 -2.556
424 HG22 VAL 59 2HG2 VAL 59 16.932 9.951 -3.229
425 HG23 VAL 59 3HG2 VAL 59 15.527 10.033 -4.313
426 H GLU 60 H GLU 60 13.875 6.185 -5.433
427 HA GLU 60 HA GLU 60 13.369 3.852 -3.647
428 HB2 GLU 60 2HB GLU 60 11.444 4.636 -4.954
429 HB3 GLU 60 3HB GLU 60 12.365 4.431 -6.454
430 HG2 GLU 60 2HG GLU 60 12.482 2.054 -6.178
431 HG3 GLU 60 3HG GLU 60 11.940 2.154 -4.496
432 H PHE 61 H PHE 61 14.940 2.425 -3.557
433 HA PHE 61 HA PHE 61 16.902 2.255 -5.742
434 HB2 PHE 61 2HB PHE 61 16.849 1.272 -2.900
435 HB3 PHE 61 3HB PHE 61 18.062 0.725 -4.059
436 HD1 PHE 61 HD1 PHE 61 16.620 3.909 -2.666
437 HD2 PHE 61 HD2 PHE 61 20.051 1.890 -4.302
438 HE1 PHE 61 HE1 PHE 61 18.019 5.905 -2.207
439 HE2 PHE 61 HE2 PHE 61 21.448 3.886 -3.827
440 HZ PHE 61 HZ PHE 61 20.436 5.883 -2.756
441 H GLU 62 H GLU 62 17.594 0.268 -6.717
442 HA GLU 62 HA GLU 62 15.459 -1.730 -6.947
443 HB2 GLU 62 2HB GLU 62 16.831 -2.752 -8.596
444 HB3 GLU 62 3HB GLU 62 16.967 -1.003 -8.847
445 HG2 GLU 62 2HG GLU 62 19.131 -0.998 -7.633
446 HG3 GLU 62 3HG GLU 62 18.983 -2.740 -7.354
447 H ASP 63 H ASP 63 18.470 -1.239 -5.219
448 HA ASP 63 HA ASP 63 17.903 -3.361 -3.356
449 HB2 ASP 63 2HB ASP 63 20.141 -3.645 -5.363
450 HB3 ASP 63 3HB ASP 63 20.307 -4.320 -3.743
451 HA PRO 64 HA PRO 64 19.917 -0.553 -0.745
452 HB2 PRO 64 2HB PRO 64 20.735 -2.150 1.341
453 HB3 PRO 64 3HB PRO 64 19.015 -1.781 1.000
454 HG2 PRO 64 2HG PRO 64 20.600 -4.247 0.231
455 HG3 PRO 64 3HG PRO 64 18.954 -4.145 0.937
456 HD2 PRO 64 2HD PRO 64 19.400 -4.467 -1.755
457 HD3 PRO 64 3HD PRO 64 18.005 -3.542 -1.125
458 H ARG 65 H ARG 65 21.725 -2.785 -2.518
459 HA ARG 65 HA ARG 65 24.254 -2.729 -1.202
460 HB2 ARG 65 2HB ARG 65 25.128 -3.378 -3.458
461 HB3 ARG 65 3HB ARG 65 23.801 -4.399 -2.882
462 HG2 ARG 65 2HG ARG 65 22.251 -3.487 -4.392
463 HG3 ARG 65 3HG ARG 65 23.184 -1.998 -4.625
464 HD2 ARG 65 2HD ARG 65 24.173 -4.724 -5.528
465 HD3 ARG 65 3HD ARG 65 23.244 -3.628 -6.564
466 HE ARG 65 HE ARG 65 25.089 -1.923 -6.044
467 HH11 ARG 65 1HH1 ARG 65 25.663 -5.412 -6.221
468 HH12 ARG 65 2HH1 ARG 65 27.346 -5.224 -6.660
469 HH21 ARG 65 1HH2 ARG 65 27.270 -1.715 -6.634
470 HH22 ARG 65 2HH2 ARG 65 28.246 -3.135 -6.920
471 H ASP 66 H ASP 66 22.643 -0.303 -3.191
472 HA ASP 66 HA ASP 66 25.197 1.048 -3.729
473 HB2 ASP 66 2HB ASP 66 22.352 1.584 -4.614
474 HB3 ASP 66 3HB ASP 66 23.704 2.656 -4.981
475 H ALA 67 H ALA 67 23.098 0.996 -1.129
476 HA ALA 67 HA ALA 67 22.977 3.798 -0.511
477 HB1 ALA 67 1HB ALA 67 22.810 1.356 1.299
478 HB2 ALA 67 2HB ALA 67 22.287 2.998 1.718
479 HB3 ALA 67 3HB ALA 67 21.441 2.099 0.434
480 H GLU 68 H GLU 68 25.569 1.530 -0.486
481 HA GLU 68 HA GLU 68 27.004 2.457 1.807
482 HB2 GLU 68 2HB GLU 68 27.988 1.173 -0.774
483 HB3 GLU 68 3HB GLU 68 28.933 1.341 0.721
484 HG2 GLU 68 2HG GLU 68 27.189 0.014 1.935
485 HG3 GLU 68 3HG GLU 68 26.338 -0.230 0.408
486 H ASP 69 H ASP 69 26.425 3.890 -1.285
487 HA ASP 69 HA ASP 69 28.474 5.975 -0.674
488 HB2 ASP 69 2HB ASP 69 27.618 4.837 -3.352
489 HB3 ASP 69 3HB ASP 69 28.498 6.359 -3.180
490 H ALA 70 H ALA 70 25.208 5.255 -1.905
491 HA ALA 70 HA ALA 70 24.630 8.049 -2.464
492 HB1 ALA 70 1HB ALA 70 22.823 5.601 -2.331
493 HB2 ALA 70 2HB ALA 70 22.418 7.179 -3.054
494 HB3 ALA 70 3HB ALA 70 23.682 6.176 -3.782
495 H VAL 71 H VAL 71 24.727 6.188 0.396
496 HA VAL 71 HA VAL 71 22.943 8.155 1.735
497 HB VAL 71 HB VAL 71 23.046 5.157 2.245
498 HG11 VAL 71 1HG1 VAL 71 22.719 6.419 4.326
499 HG12 VAL 71 2HG1 VAL 71 21.426 7.368 3.560
500 HG13 VAL 71 3HG1 VAL 71 21.205 5.627 3.845
501 HG21 VAL 71 1HG2 VAL 71 21.776 5.700 0.216
502 HG22 VAL 71 2HG2 VAL 71 20.665 5.237 1.527
503 HG23 VAL 71 3HG2 VAL 71 20.877 6.955 1.098
504 H SER 72 H SER 72 25.402 5.562 2.330
505 HA SER 72 HA SER 72 26.218 6.705 4.837
506 HB2 SER 72 2HB SER 72 27.565 4.717 2.968
507 HB3 SER 72 3HB SER 72 28.100 5.075 4.620
508 HG SER 72 HG SER 72 26.130 4.317 5.383
509 H GLY 73 H GLY 73 26.698 7.803 1.680
510 HA2 GLY 73 2HA GLY 73 29.261 9.145 2.420
511 HA3 GLY 73 3HA GLY 73 28.786 8.712 0.763
512 H ARG 74 H ARG 74 26.110 9.835 2.632
513 HA ARG 74 HA ARG 74 26.490 12.641 1.762
514 HB2 ARG 74 2HB ARG 74 25.534 11.467 -0.175
515 HB3 ARG 74 3HB ARG 74 24.207 10.855 0.825
516 HG2 ARG 74 2HG ARG 74 23.386 13.135 1.209
517 HG3 ARG 74 3HG ARG 74 24.799 13.816 0.373
518 HD2 ARG 74 2HD ARG 74 22.739 11.973 -0.904
519 HD3 ARG 74 3HD ARG 74 22.745 13.741 -1.049
520 HE ARG 74 HE ARG 74 24.967 13.547 -2.158
521 HH11 ARG 74 1HH1 ARG 74 22.842 10.712 -2.096
522 HH12 ARG 74 2HH1 ARG 74 23.581 10.002 -3.517
523 HH21 ARG 74 1HH2 ARG 74 25.915 12.573 -3.971
524 HH22 ARG 74 2HH2 ARG 74 25.328 11.031 -4.545
525 H ASP 75 H ASP 75 24.976 10.250 3.835
526 HA ASP 75 HA ASP 75 23.012 12.003 4.995
527 HB2 ASP 75 2HB ASP 75 22.990 9.513 5.159
528 HB3 ASP 75 3HB ASP 75 24.430 9.583 6.189
529 H GLY 76 H GLY 76 23.187 13.492 6.627
530 HA2 GLY 76 2HA GLY 76 24.097 14.769 8.285
531 HA3 GLY 76 3HA GLY 76 25.275 13.473 8.578
532 H TYR 77 H TYR 77 24.952 15.124 5.415
533 HA TYR 77 HA TYR 77 27.813 15.559 5.539
534 HB2 TYR 77 2HB TYR 77 27.105 14.615 3.530
535 HB3 TYR 77 3HB TYR 77 25.777 15.761 3.350
536 HD1 TYR 77 HD1 TYR 77 29.518 15.611 3.450
537 HD2 TYR 77 HD2 TYR 77 26.021 17.668 2.021
538 HE1 TYR 77 HE1 TYR 77 30.956 17.075 2.057
539 HE2 TYR 77 HE2 TYR 77 27.456 19.133 0.616
540 HH TYR 77 HH TYR 77 31.016 18.793 0.527
541 H ASP 78 H ASP 78 28.958 17.378 5.383
542 HA ASP 78 HA ASP 78 27.990 19.568 6.869
543 HB2 ASP 78 2HB ASP 78 30.293 19.052 6.925
544 HB3 ASP 78 3HB ASP 78 30.445 19.147 5.168
545 H TYR 79 H TYR 79 26.274 20.722 6.202
546 HA TYR 79 HA TYR 79 26.490 22.101 3.580
547 HB2 TYR 79 2HB TYR 79 24.563 20.656 3.749
548 HB3 TYR 79 3HB TYR 79 24.111 21.356 5.298
549 HD1 TYR 79 HD1 TYR 79 22.980 23.474 5.452
550 HD2 TYR 79 HD2 TYR 79 24.240 21.922 1.654
551 HE1 TYR 79 HE1 TYR 79 21.512 25.121 4.309
552 HE2 TYR 79 HE2 TYR 79 22.790 23.577 0.491
553 HH TYR 79 HH TYR 79 20.796 25.950 2.292
554 H ASP 80 H ASP 80 25.290 24.319 3.670
555 HA ASP 80 HA ASP 80 26.751 25.967 5.442
556 HB2 ASP 80 2HB ASP 80 26.091 26.821 3.329
557 HB3 ASP 80 3HB ASP 80 24.385 26.466 3.634
558 H GLY 81 H GLY 81 26.481 25.605 7.612
559 HA2 GLY 81 2HA GLY 81 25.561 26.151 9.647
560 HA3 GLY 81 3HA GLY 81 24.119 26.766 8.826
561 H TYR 82 H TYR 82 24.441 23.748 7.529
562 HA TYR 82 HA TYR 82 23.156 22.309 9.775
563 HB2 TYR 82 2HB TYR 82 21.866 22.803 7.081
564 HB3 TYR 82 3HB TYR 82 21.315 21.582 8.230
565 HD1 TYR 82 HD1 TYR 82 21.676 25.201 7.631
566 HD2 TYR 82 HD2 TYR 82 20.086 22.164 10.220
567 HE1 TYR 82 HE1 TYR 82 20.263 26.912 8.757
568 HE2 TYR 82 HE2 TYR 82 18.680 23.858 11.356
569 HH TYR 82 HH TYR 82 18.716 27.314 10.403
570 H ARG 83 H ARG 83 22.396 19.998 8.773
571 HA ARG 83 HA ARG 83 24.574 18.932 7.067
572 HB2 ARG 83 2HB ARG 83 23.538 17.959 9.740
573 HB3 ARG 83 3HB ARG 83 24.314 16.881 8.565
574 HG2 ARG 83 2HG ARG 83 26.316 18.398 8.542
575 HG3 ARG 83 3HG ARG 83 25.530 19.418 9.770
576 HD2 ARG 83 2HD ARG 83 25.435 17.456 11.301
577 HD3 ARG 83 3HD ARG 83 26.268 16.476 10.084
578 HE ARG 83 HE ARG 83 27.422 18.597 11.782
579 HH11 ARG 83 1HH1 ARG 83 27.879 16.402 9.042
580 HH12 ARG 83 2HH1 ARG 83 29.622 16.536 9.080
581 HH21 ARG 83 1HH2 ARG 83 29.698 18.725 11.823
582 HH22 ARG 83 2HH2 ARG 83 30.647 17.835 10.654
583 H LEU 84 H LEU 84 23.908 17.516 5.534
584 HA LEU 84 HA LEU 84 21.177 17.435 4.762
585 HB2 LEU 84 2HB LEU 84 23.651 15.839 4.045
586 HB3 LEU 84 3HB LEU 84 22.075 15.349 3.422
587 HG LEU 84 HG LEU 84 23.340 16.770 1.838
588 HD11 LEU 84 1HD1 LEU 84 20.855 16.705 1.817
589 HD12 LEU 84 2HD1 LEU 84 20.823 18.134 2.881
590 HD13 LEU 84 3HD1 LEU 84 21.510 18.256 1.250
591 HD21 LEU 84 1HD2 LEU 84 24.462 18.215 3.537
592 HD22 LEU 84 2HD2 LEU 84 23.664 19.133 2.241
593 HD23 LEU 84 3HD2 LEU 84 22.899 19.020 3.834
594 H ARG 85 H ARG 85 19.661 15.674 4.787
595 HA ARG 85 HA ARG 85 20.228 13.595 6.863
596 HB2 ARG 85 2HB ARG 85 18.573 15.372 7.587
597 HB3 ARG 85 3HB ARG 85 17.559 14.895 6.215
598 HG2 ARG 85 2HG ARG 85 16.627 13.675 7.960
599 HG3 ARG 85 3HG ARG 85 17.724 12.480 7.244
600 HD2 ARG 85 2HD ARG 85 18.342 14.269 9.635
601 HD3 ARG 85 3HD ARG 85 17.805 12.587 9.752
602 HE ARG 85 HE ARG 85 19.917 12.024 8.428
603 HH11 ARG 85 1HH1 ARG 85 19.716 14.826 10.578
604 HH12 ARG 85 2HH1 ARG 85 21.433 14.824 10.916
605 HH21 ARG 85 1HH2 ARG 85 22.135 12.113 8.805
606 HH22 ARG 85 2HH2 ARG 85 22.801 13.279 9.933
607 H VAL 86 H VAL 86 20.480 11.708 5.945
608 HA VAL 86 HA VAL 86 18.608 10.963 3.772
609 HB VAL 86 HB VAL 86 21.573 10.315 3.688
610 HG11 VAL 86 1HG1 VAL 86 20.048 8.713 2.553
611 HG12 VAL 86 2HG1 VAL 86 19.330 10.056 1.642
612 HG13 VAL 86 3HG1 VAL 86 21.037 9.617 1.386
613 HG21 VAL 86 1HG2 VAL 86 21.318 12.721 3.346
614 HG22 VAL 86 2HG2 VAL 86 21.651 11.925 1.791
615 HG23 VAL 86 3HG2 VAL 86 19.993 12.439 2.186
616 H GLU 87 H GLU 87 17.408 9.821 5.256
617 HA GLU 87 HA GLU 87 18.546 7.164 5.867
618 HB2 GLU 87 2HB GLU 87 17.775 7.210 8.185
619 HB3 GLU 87 3HB GLU 87 18.948 8.519 7.914
620 HG2 GLU 87 2HG GLU 87 17.066 10.124 7.625
621 HG3 GLU 87 3HG GLU 87 15.915 8.817 7.935
622 H PHE 88 H PHE 88 16.885 5.554 6.366
623 HA PHE 88 HA PHE 88 14.548 6.019 4.741
624 HB2 PHE 88 2HB PHE 88 14.021 3.603 5.487
625 HB3 PHE 88 3HB PHE 88 15.367 3.933 4.396
626 HD1 PHE 88 HD1 PHE 88 14.475 3.041 7.886
627 HD2 PHE 88 HD2 PHE 88 17.643 3.535 5.018
628 HE1 PHE 88 HE1 PHE 88 16.054 1.907 9.429
629 HE2 PHE 88 HE2 PHE 88 19.217 2.391 6.559
630 HZ PHE 88 HZ PHE 88 18.420 1.574 8.762
631 HA PRO 89 HA PRO 89 11.381 7.043 7.578
632 HB2 PRO 89 2HB PRO 89 9.762 4.814 6.398
633 HB3 PRO 89 3HB PRO 89 9.343 6.547 6.585
634 HG2 PRO 89 2HG PRO 89 10.049 5.506 4.163
635 HG3 PRO 89 3HG PRO 89 10.558 7.150 4.665
636 HD2 PRO 89 2HD PRO 89 12.166 4.596 4.671
637 HD3 PRO 89 3HD PRO 89 12.665 6.266 4.243
638 H5' A 90 1H5* A 90 19.309 17.990 9.967
639 H5'' A 90 2H5* A 90 19.362 18.189 11.731
640 H4' A 90 H4* A 90 16.818 18.070 10.043
641 H3' A 90 H3* A 90 18.428 20.232 10.025
642 H2' A 90 1H2* A 90 18.940 20.449 12.282
643 HO2' A 90 2HO* A 90 16.419 21.743 12.030
644 H1' A 90 H1* A 90 16.346 19.801 13.496
645 H8 A 90 H8 A 90 19.215 20.603 14.631
646 H61 A 90 1H6 A 90 20.790 15.143 17.098
647 H62 A 90 2H6 A 90 21.118 16.865 17.087
648 H2 A 90 H2 A 90 17.483 14.444 14.197
649 HO5' A 90 H5T A 90 18.104 16.265 11.869
650 H5' A 91 1H5* A 91 13.318 19.139 8.544
651 H5'' A 91 2H5* A 91 14.072 19.038 10.150
652 H4' A 91 H4* A 91 14.068 16.752 8.131
653 H3' A 91 H3* A 91 12.179 17.475 10.375
654 H2' A 91 1H2* A 91 12.026 15.197 10.993
655 HO2' A 91 2HO* A 91 11.729 14.499 8.758
656 H1' A 91 H1* A 91 14.662 14.507 10.360
657 H8 A 91 H8 A 91 14.657 13.550 12.785
658 H61 A 91 1H6 A 91 13.985 17.964 17.081
659 H62 A 91 2H6 A 91 14.340 16.273 16.806
660 H2 A 91 H2 A 91 13.309 19.810 13.086
661 H5' C 92 1H5* C 92 10.215 15.787 5.887
662 H5'' C 92 2H5* C 92 8.737 16.655 6.356
663 H4' C 92 H4* C 92 7.916 14.981 4.945
664 H3' C 92 H3* C 92 7.196 14.893 7.623
665 H2' C 92 1H2* C 92 8.716 13.165 8.213
666 HO2' C 92 2HO* C 92 6.577 12.370 8.657
667 H1' C 92 H1* C 92 8.088 11.756 5.614
668 H41 C 92 1H4 C 92 13.091 8.296 7.556
669 H42 C 92 2H4 C 92 13.821 9.679 8.339
670 H5 C 92 H5 C 92 12.763 11.881 8.401
671 H6 C 92 H6 C 92 10.799 13.159 7.699
672 H5' A 93 1H5* A 93 2.898 13.811 4.397
673 H5'' A 93 2H5* A 93 4.181 12.583 4.357
674 H4' A 93 H4* A 93 3.680 14.343 1.945
675 H3' A 93 H3* A 93 1.553 12.956 2.949
676 H2' A 93 1H2* A 93 2.766 10.931 3.294
677 HO2' A 93 2HO* A 93 0.909 10.423 2.071
678 H1' A 93 H1* A 93 3.862 11.184 0.495
679 H8 A 93 H8 A 93 4.553 10.074 4.098
680 H61 A 93 1H6 A 93 8.157 5.756 1.429
681 H62 A 93 2H6 A 93 7.509 6.324 2.952
682 H2 A 93 H2 A 93 6.609 8.492 -1.734
683 H5' A 94 1H5* A 94 -0.624 15.757 2.596
684 H5'' A 94 2H5* A 94 0.125 14.290 3.227
685 H4' A 94 H4* A 94 -2.156 14.565 4.083
686 H3' A 94 H3* A 94 -1.375 12.206 2.449
687 H2' A 94 1H2* A 94 -3.563 11.459 2.005
688 HO2' A 94 2HO* A 94 -4.294 11.788 4.202
689 H1' A 94 H1* A 94 -4.760 13.808 1.467
690 H8 A 94 H8 A 94 -2.537 11.264 0.306
691 H61 A 94 1H6 A 94 -1.298 14.559 -4.790
692 H62 A 94 2H6 A 94 -1.169 12.985 -4.036
693 H2 A 94 H2 A 94 -3.254 17.260 -1.836
694 H5' A 95 1H5* A 95 0.285 13.562 7.208
695 H5'' A 95 2H5* A 95 -1.174 14.199 6.410
696 H4' A 95 H4* A 95 1.569 15.157 5.573
697 H3' A 95 H3* A 95 0.745 15.452 8.224
698 HO3' A 95 H3T A 95 2.772 16.044 7.180
699 H2' A 95 1H2* A 95 -1.185 16.727 7.720
700 HO2' A 95 2HO* A 95 0.217 18.071 8.994
701 H1' A 95 H1* A 95 0.411 18.113 5.538
702 H8 A 95 H8 A 95 -1.241 20.065 5.047
703 H61 A 95 1H6 A 95 -7.171 18.244 4.894
704 H62 A 95 2H6 A 95 -6.079 19.589 4.647
705 H2 A 95 H2 A 95 -4.682 14.751 6.081
Start of MODEL 11
1 H VAL 6 H1 VAL 6 -3.740 4.220 0.196
2 HA VAL 6 HA VAL 6 -4.281 7.091 0.061
3 HB VAL 6 HB VAL 6 -3.361 6.339 2.238
4 HG11 VAL 6 1HG1 VAL 6 -1.021 5.565 2.354
5 HG12 VAL 6 2HG1 VAL 6 -2.009 4.414 1.430
6 HG13 VAL 6 3HG1 VAL 6 -0.924 5.547 0.587
7 HG21 VAL 6 1HG2 VAL 6 -2.905 8.596 1.338
8 HG22 VAL 6 2HG2 VAL 6 -1.555 7.992 2.315
9 HG23 VAL 6 3HG2 VAL 6 -1.429 7.983 0.547
10 H ILE 7 H ILE 7 -3.132 8.284 -1.402
11 HA ILE 7 HA ILE 7 -2.104 6.851 -3.693
12 HB ILE 7 HB ILE 7 -2.306 9.791 -2.956
13 HG12 ILE 7 2HG1 ILE 7 -3.829 8.056 -4.960
14 HG13 ILE 7 3HG1 ILE 7 -4.417 8.505 -3.348
15 HG21 ILE 7 1HG2 ILE 7 -0.409 9.496 -4.506
16 HG22 ILE 7 2HG2 ILE 7 -1.442 8.543 -5.601
17 HG23 ILE 7 3HG2 ILE 7 -1.767 10.267 -5.329
18 HD11 ILE 7 1HD1 ILE 7 -4.235 10.922 -3.997
19 HD12 ILE 7 2HD1 ILE 7 -3.819 10.404 -5.651
20 HD13 ILE 7 3HD1 ILE 7 -5.407 10.006 -4.971
21 H ARG 8 H ARG 8 -0.026 6.815 -4.513
22 HA ARG 8 HA ARG 8 2.194 6.517 -4.425
23 HB2 ARG 8 2HB ARG 8 2.219 8.844 -4.856
24 HB3 ARG 8 3HB ARG 8 1.962 9.250 -3.153
25 HG2 ARG 8 2HG ARG 8 4.327 9.550 -4.048
26 HG3 ARG 8 3HG ARG 8 4.176 8.639 -2.546
27 HD2 ARG 8 2HD ARG 8 5.764 7.512 -3.983
28 HD3 ARG 8 3HD ARG 8 4.322 6.510 -3.843
29 HE ARG 8 HE ARG 8 4.645 8.348 -6.176
30 HH11 ARG 8 1HH1 ARG 8 4.399 5.054 -4.887
31 HH12 ARG 8 2HH1 ARG 8 4.154 4.338 -6.462
32 HH21 ARG 8 1HH2 ARG 8 4.299 7.373 -8.213
33 HH22 ARG 8 2HH2 ARG 8 4.095 5.643 -8.330
34 H GLY 9 H GLY 9 2.517 8.240 -1.337
35 HA2 GLY 9 2HA GLY 9 4.175 6.034 -0.491
36 HA3 GLY 9 3HA GLY 9 3.916 7.547 0.367
37 HA PRO 10 HA PRO 10 1.017 4.065 2.041
38 HB2 PRO 10 2HB PRO 10 2.601 2.154 3.175
39 HB3 PRO 10 3HB PRO 10 2.088 2.084 1.456
40 HG2 PRO 10 2HG PRO 10 4.711 3.062 2.601
41 HG3 PRO 10 3HG PRO 10 4.441 1.988 1.186
42 HD2 PRO 10 2HD PRO 10 4.898 4.701 0.970
43 HD3 PRO 10 3HD PRO 10 3.884 3.794 -0.194
44 H ALA 11 H ALA 11 0.934 3.419 4.490
45 HA ALA 11 HA ALA 11 1.733 5.672 6.094
46 HB1 ALA 11 1HB ALA 11 0.721 2.906 6.890
47 HB2 ALA 11 2HB ALA 11 0.776 4.340 7.941
48 HB3 ALA 11 3HB ALA 11 -0.299 4.315 6.521
49 H GLY 12 H GLY 12 3.414 2.888 5.009
50 HA2 GLY 12 2HA GLY 12 5.886 3.603 6.041
51 HA3 GLY 12 3HA GLY 12 5.201 2.488 7.241
52 H ASN 13 H ASN 13 7.536 2.073 5.457
53 HA ASN 13 HA ASN 13 6.807 -0.566 4.494
54 HB2 ASN 13 2HB ASN 13 7.482 -0.197 2.171
55 HB3 ASN 13 3HB ASN 13 6.090 0.805 2.571
56 HD21 ASN 13 1HD2 ASN 13 8.721 2.756 0.644
57 HD22 ASN 13 2HD2 ASN 13 7.966 1.196 0.393
58 H ASN 14 H ASN 14 8.815 -1.545 3.329
59 HA ASN 14 HA ASN 14 11.332 -0.501 4.485
60 HB2 ASN 14 2HB ASN 14 11.949 -2.810 5.164
61 HB3 ASN 14 3HB ASN 14 10.581 -2.150 6.068
62 HD21 ASN 14 1HD2 ASN 14 9.457 -5.532 5.371
63 HD22 ASN 14 2HD2 ASN 14 10.488 -4.634 6.466
64 H ASP 15 H ASP 15 10.081 -0.470 1.806
65 HA ASP 15 HA ASP 15 11.340 -2.416 0.102
66 HB2 ASP 15 2HB ASP 15 10.349 0.386 -0.574
67 HB3 ASP 15 3HB ASP 15 10.540 -0.973 -1.691
68 H CYS 16 H CYS 16 12.681 -1.326 -1.864
69 HA CYS 16 HA CYS 16 15.232 -0.558 -0.841
70 HB2 CYS 16 2HB CYS 16 15.671 -0.021 -3.279
71 HB3 CYS 16 3HB CYS 16 15.079 -1.671 -2.979
72 HG CYS 16 HG CYS 16 14.040 -0.599 -5.182
73 H ARG 17 H ARG 17 12.394 1.255 -1.154
74 HA ARG 17 HA ARG 17 13.403 3.760 -2.030
75 HB2 ARG 17 2HB ARG 17 10.983 2.867 -0.467
76 HB3 ARG 17 3HB ARG 17 11.361 4.597 -0.598
77 HG2 ARG 17 2HG ARG 17 11.454 4.433 -3.043
78 HG3 ARG 17 3HG ARG 17 11.038 2.703 -2.958
79 HD2 ARG 17 2HD ARG 17 8.869 3.191 -2.054
80 HD3 ARG 17 3HD ARG 17 9.304 4.879 -1.746
81 HE ARG 17 HE ARG 17 9.079 3.732 -4.508
82 HH11 ARG 17 1HH1 ARG 17 8.456 6.306 -2.170
83 HH12 ARG 17 2HH1 ARG 17 7.778 7.391 -3.354
84 HH21 ARG 17 1HH2 ARG 17 8.199 5.137 -6.039
85 HH22 ARG 17 2HH2 ARG 17 7.607 6.712 -5.564
86 H ILE 18 H ILE 18 14.172 5.541 -1.015
87 HA ILE 18 HA ILE 18 14.599 5.402 1.926
88 HB ILE 18 HB ILE 18 16.793 6.347 1.722
89 HG12 ILE 18 2HG1 ILE 18 16.506 6.241 -1.304
90 HG13 ILE 18 3HG1 ILE 18 16.308 7.718 -0.334
91 HG21 ILE 18 1HG2 ILE 18 16.605 4.043 -0.253
92 HG22 ILE 18 2HG2 ILE 18 17.995 4.487 0.763
93 HG23 ILE 18 3HG2 ILE 18 16.509 3.873 1.517
94 HD11 ILE 18 1HD1 ILE 18 18.828 6.016 -0.490
95 HD12 ILE 18 2HD1 ILE 18 18.575 7.620 -1.210
96 HD13 ILE 18 3HD1 ILE 18 18.611 7.437 0.558
97 H TYR 19 H TYR 19 15.311 7.653 2.690
98 HA TYR 19 HA TYR 19 13.459 9.637 1.504
99 HB2 TYR 19 2HB TYR 19 12.397 9.298 3.432
100 HB3 TYR 19 3HB TYR 19 13.815 8.686 4.256
101 HD1 TYR 19 HD1 TYR 19 15.402 10.193 5.364
102 HD2 TYR 19 HD2 TYR 19 11.828 11.678 3.497
103 HE1 TYR 19 HE1 TYR 19 15.587 12.275 6.694
104 HE2 TYR 19 HE2 TYR 19 11.997 13.770 4.837
105 HH TYR 19 HH TYR 19 13.196 14.928 6.416
106 H VAL 20 H VAL 20 13.924 11.856 1.576
107 HA VAL 20 HA VAL 20 16.816 12.488 1.844
108 HB VAL 20 HB VAL 20 15.065 13.296 -0.511
109 HG11 VAL 20 1HG1 VAL 20 18.047 13.590 0.017
110 HG12 VAL 20 2HG1 VAL 20 17.194 14.077 -1.467
111 HG13 VAL 20 3HG1 VAL 20 16.852 14.908 0.068
112 HG21 VAL 20 1HG2 VAL 20 15.543 10.889 -0.621
113 HG22 VAL 20 2HG2 VAL 20 16.504 11.764 -1.832
114 HG23 VAL 20 3HG2 VAL 20 17.271 11.200 -0.330
115 H GLY 21 H GLY 21 16.457 13.602 3.758
116 HA2 GLY 21 2HA GLY 21 14.497 15.806 3.776
117 HA3 GLY 21 3HA GLY 21 15.468 15.236 5.138
118 H ASN 22 H ASN 22 15.208 17.904 4.699
119 HA ASN 22 HA ASN 22 16.295 19.853 4.429
120 HB2 ASN 22 2HB ASN 22 17.987 18.556 5.833
121 HB3 ASN 22 3HB ASN 22 18.873 18.258 4.328
122 HD21 ASN 22 1HD2 ASN 22 20.638 21.256 4.865
123 HD22 ASN 22 2HD2 ASN 22 20.688 19.522 4.625
124 H LEU 23 H LEU 23 15.590 18.084 2.006
125 HA LEU 23 HA LEU 23 17.425 18.781 -0.080
126 HB2 LEU 23 2HB LEU 23 15.748 16.965 -0.255
127 HB3 LEU 23 3HB LEU 23 14.446 18.158 -0.130
128 HG LEU 23 HG LEU 23 15.444 19.270 -2.226
129 HD11 LEU 23 1HD1 LEU 23 16.801 16.539 -2.401
130 HD12 LEU 23 2HD1 LEU 23 16.788 17.779 -3.670
131 HD13 LEU 23 3HD1 LEU 23 17.648 18.078 -2.143
132 HD21 LEU 23 1HD2 LEU 23 13.368 17.905 -2.206
133 HD22 LEU 23 2HD2 LEU 23 14.300 17.664 -3.706
134 HD23 LEU 23 3HD2 LEU 23 14.343 16.435 -2.422
135 HA PRO 24 HA PRO 24 16.224 23.104 -0.024
136 HB2 PRO 24 2HB PRO 24 17.938 24.028 -1.961
137 HB3 PRO 24 3HB PRO 24 18.472 23.623 -0.298
138 HG2 PRO 24 2HG PRO 24 18.673 21.927 -2.798
139 HG3 PRO 24 3HG PRO 24 19.906 22.194 -1.523
140 HD2 PRO 24 2HD PRO 24 18.280 19.977 -1.615
141 HD3 PRO 24 3HD PRO 24 18.868 20.673 -0.076
142 HA PRO 25 HA PRO 25 13.365 23.095 -3.441
143 HB2 PRO 25 2HB PRO 25 12.631 25.743 -3.472
144 HB3 PRO 25 3HB PRO 25 12.110 24.597 -2.195
145 HG2 PRO 25 2HG PRO 25 14.376 26.603 -2.122
146 HG3 PRO 25 3HG PRO 25 13.161 26.248 -0.851
147 HD2 PRO 25 2HD PRO 25 15.697 25.185 -0.829
148 HD3 PRO 25 3HD PRO 25 14.278 24.304 -0.183
149 H ASP 26 H ASP 26 16.329 24.880 -3.362
150 HA ASP 26 HA ASP 26 16.102 25.984 -6.042
151 HB2 ASP 26 2HB ASP 26 18.370 25.829 -4.043
152 HB3 ASP 26 3HB ASP 26 18.522 26.575 -5.644
153 H ILE 27 H ILE 27 16.453 22.837 -5.114
154 HA ILE 27 HA ILE 27 18.679 21.995 -6.684
155 HB ILE 27 HB ILE 27 17.619 20.657 -4.869
156 HG12 ILE 27 2HG1 ILE 27 17.579 18.456 -6.029
157 HG13 ILE 27 3HG1 ILE 27 17.568 19.283 -7.597
158 HG21 ILE 27 1HG2 ILE 27 15.359 20.204 -6.868
159 HG22 ILE 27 2HG2 ILE 27 15.515 19.473 -5.257
160 HG23 ILE 27 3HG2 ILE 27 15.245 21.222 -5.413
161 HD11 ILE 27 1HD1 ILE 27 19.776 20.272 -7.110
162 HD12 ILE 27 2HD1 ILE 27 19.746 19.569 -5.474
163 HD13 ILE 27 3HD1 ILE 27 19.847 18.512 -6.900
164 H ARG 28 H ARG 28 18.792 21.184 -8.827
165 HA ARG 28 HA ARG 28 16.893 22.381 -10.658
166 HB2 ARG 28 2HB ARG 28 19.348 22.174 -11.090
167 HB3 ARG 28 3HB ARG 28 19.151 20.415 -11.212
168 HG2 ARG 28 2HG ARG 28 17.675 20.662 -13.141
169 HG3 ARG 28 3HG ARG 28 17.655 22.431 -12.935
170 HD2 ARG 28 2HD ARG 28 19.186 21.924 -14.716
171 HD3 ARG 28 3HD ARG 28 20.133 22.443 -13.319
172 HE ARG 28 HE ARG 28 20.676 20.075 -12.880
173 HH11 ARG 28 1HH1 ARG 28 19.377 20.867 -16.077
174 HH12 ARG 28 2HH1 ARG 28 20.039 19.432 -16.822
175 HH21 ARG 28 1HH2 ARG 28 21.491 18.226 -13.859
176 HH22 ARG 28 2HH2 ARG 28 21.262 17.942 -15.572
177 H THR 29 H THR 29 15.657 21.227 -12.269
178 HA THR 29 HA THR 29 14.088 19.178 -11.082
179 HB THR 29 HB THR 29 12.666 19.345 -12.889
180 HG1 THR 29 1HG THR 29 13.359 20.016 -14.920
181 HG21 THR 29 1HG2 THR 29 14.159 22.002 -12.981
182 HG22 THR 29 2HG2 THR 29 12.460 21.707 -13.401
183 HG23 THR 29 3HG2 THR 29 12.992 21.541 -11.713
184 H LYS 30 H LYS 30 17.100 18.643 -12.006
185 HA LYS 30 HA LYS 30 16.501 15.843 -12.780
186 HB2 LYS 30 2HB LYS 30 16.892 17.225 -14.878
187 HB3 LYS 30 3HB LYS 30 18.495 17.627 -14.242
188 HG2 LYS 30 2HG LYS 30 18.871 15.810 -15.707
189 HG3 LYS 30 3HG LYS 30 18.897 15.083 -14.090
190 HD2 LYS 30 2HD LYS 30 16.396 14.576 -14.446
191 HD3 LYS 30 3HD LYS 30 16.650 15.024 -16.143
192 HE2 LYS 30 2HE LYS 30 18.021 12.791 -14.595
193 HE3 LYS 30 3HE LYS 30 16.868 12.613 -15.924
194 HZ1 LYS 30 1HZ LYS 30 18.492 13.713 -17.351
195 HZ2 LYS 30 2HZ LYS 30 19.563 13.774 -16.097
196 HZ3 LYS 30 3HZ LYS 30 19.084 12.322 -16.703
197 H ASP 31 H ASP 31 18.742 18.273 -11.437
198 HA ASP 31 HA ASP 31 20.778 16.406 -10.714
199 HB2 ASP 31 2HB ASP 31 19.932 19.025 -9.442
200 HB3 ASP 31 3HB ASP 31 21.383 18.115 -8.999
201 H ILE 32 H ILE 32 17.566 16.900 -9.557
202 HA ILE 32 HA ILE 32 17.887 15.949 -6.886
203 HB ILE 32 HB ILE 32 15.962 17.262 -7.642
204 HG12 ILE 32 2HG1 ILE 32 14.993 14.483 -6.862
205 HG13 ILE 32 3HG1 ILE 32 15.806 15.580 -5.725
206 HG21 ILE 32 1HG2 ILE 32 14.235 16.277 -9.097
207 HG22 ILE 32 2HG2 ILE 32 15.786 16.313 -9.942
208 HG23 ILE 32 3HG2 ILE 32 15.187 14.783 -9.250
209 HD11 ILE 32 1HD1 ILE 32 13.387 15.790 -5.503
210 HD12 ILE 32 2HD1 ILE 32 14.058 17.301 -6.158
211 HD13 ILE 32 3HD1 ILE 32 13.221 16.157 -7.236
212 H GLU 33 H GLU 33 18.021 14.290 -9.960
213 HA GLU 33 HA GLU 33 17.954 11.744 -8.418
214 HB2 GLU 33 2HB GLU 33 16.863 10.637 -10.298
215 HB3 GLU 33 3HB GLU 33 15.856 11.954 -9.663
216 HG2 GLU 33 2HG GLU 33 16.626 13.427 -11.498
217 HG3 GLU 33 3HG GLU 33 17.635 12.119 -12.136
218 H ASP 34 H ASP 34 19.519 13.728 -10.895
219 HA ASP 34 HA ASP 34 21.178 11.578 -11.839
220 HB2 ASP 34 2HB ASP 34 21.299 14.574 -12.114
221 HB3 ASP 34 3HB ASP 34 22.640 13.549 -12.647
222 H VAL 35 H VAL 35 21.451 13.789 -9.083
223 HA VAL 35 HA VAL 35 24.207 13.125 -8.500
224 HB VAL 35 HB VAL 35 21.864 14.082 -6.798
225 HG11 VAL 35 1HG1 VAL 35 23.571 14.598 -5.059
226 HG12 VAL 35 2HG1 VAL 35 23.408 12.853 -5.332
227 HG13 VAL 35 3HG1 VAL 35 24.791 13.733 -6.025
228 HG21 VAL 35 1HG2 VAL 35 24.397 15.465 -7.796
229 HG22 VAL 35 2HG2 VAL 35 22.778 15.673 -8.491
230 HG23 VAL 35 3HG2 VAL 35 23.103 16.216 -6.830
231 H PHE 36 H PHE 36 20.995 11.761 -7.626
232 HA PHE 36 HA PHE 36 22.113 9.660 -6.042
233 HB2 PHE 36 2HB PHE 36 19.401 10.106 -7.244
234 HB3 PHE 36 3HB PHE 36 19.826 8.603 -6.415
235 HD1 PHE 36 HD1 PHE 36 20.314 8.545 -4.026
236 HD2 PHE 36 HD2 PHE 36 19.172 12.196 -5.987
237 HE1 PHE 36 HE1 PHE 36 19.889 9.597 -1.816
238 HE2 PHE 36 HE2 PHE 36 18.738 13.246 -3.779
239 HZ PHE 36 HZ PHE 36 19.108 11.953 -1.697
240 H SER 37 H SER 37 21.473 9.945 -9.509
241 HA SER 37 HA SER 37 21.872 7.173 -10.121
242 HB2 SER 37 2HB SER 37 22.260 9.721 -11.734
243 HB3 SER 37 3HB SER 37 22.450 8.095 -12.416
244 HG SER 37 HG SER 37 20.321 7.653 -11.918
245 H LYS 38 H LYS 38 24.109 9.800 -9.342
246 HA LYS 38 HA LYS 38 26.464 8.340 -10.206
247 HB2 LYS 38 2HB LYS 38 26.520 10.748 -10.049
248 HB3 LYS 38 3HB LYS 38 26.061 10.714 -8.340
249 HG2 LYS 38 2HG LYS 38 28.538 9.222 -9.161
250 HG3 LYS 38 3HG LYS 38 28.598 10.992 -9.110
251 HD2 LYS 38 2HD LYS 38 27.805 10.983 -6.775
252 HD3 LYS 38 3HD LYS 38 27.738 9.209 -6.783
253 HE2 LYS 38 2HE LYS 38 30.163 9.126 -7.277
254 HE3 LYS 38 3HE LYS 38 30.234 10.895 -7.234
255 HZ1 LYS 38 1HZ LYS 38 30.898 9.946 -5.157
256 HZ2 LYS 38 2HZ LYS 38 29.503 10.800 -4.949
257 HZ3 LYS 38 3HZ LYS 38 29.467 9.153 -4.991
258 H TYR 39 H TYR 39 24.550 8.597 -7.200
259 HA TYR 39 HA TYR 39 26.375 6.979 -5.685
260 HB2 TYR 39 2HB TYR 39 23.601 7.988 -5.207
261 HB3 TYR 39 3HB TYR 39 24.292 6.744 -4.167
262 HD1 TYR 39 HD1 TYR 39 26.319 7.153 -2.840
263 HD2 TYR 39 HD2 TYR 39 24.359 10.282 -5.041
264 HE1 TYR 39 HE1 TYR 39 27.582 8.857 -1.536
265 HE2 TYR 39 HE2 TYR 39 25.612 11.987 -3.754
266 HH TYR 39 HH TYR 39 28.007 11.096 -1.240
267 H GLY 40 H GLY 40 23.936 6.074 -7.995
268 HA2 GLY 40 2HA GLY 40 24.710 3.453 -8.240
269 HA3 GLY 40 3HA GLY 40 23.558 3.406 -6.889
270 H ALA 41 H ALA 41 22.450 1.958 -8.537
271 HA ALA 41 HA ALA 41 21.193 3.314 -10.806
272 HB1 ALA 41 1HB ALA 41 22.010 0.997 -10.989
273 HB2 ALA 41 2HB ALA 41 20.891 0.499 -9.698
274 HB3 ALA 41 3HB ALA 41 20.255 1.086 -11.253
275 H ILE 42 H ILE 42 19.603 4.716 -10.331
276 HA ILE 42 HA ILE 42 17.463 3.964 -8.422
277 HB ILE 42 HB ILE 42 18.320 6.527 -9.797
278 HG12 ILE 42 2HG1 ILE 42 18.104 7.386 -7.439
279 HG13 ILE 42 3HG1 ILE 42 17.769 5.729 -6.905
280 HG21 ILE 42 1HG2 ILE 42 15.672 6.004 -8.392
281 HG22 ILE 42 2HG2 ILE 42 16.288 7.607 -8.847
282 HG23 ILE 42 3HG2 ILE 42 15.895 6.430 -10.112
283 HD11 ILE 42 1HD1 ILE 42 20.272 6.550 -8.435
284 HD12 ILE 42 2HD1 ILE 42 20.187 6.464 -6.658
285 HD13 ILE 42 3HD1 ILE 42 19.971 4.993 -7.624
286 H ARG 43 H ARG 43 15.310 3.752 -9.127
287 HA ARG 43 HA ARG 43 14.974 3.480 -12.084
288 HB2 ARG 43 2HB ARG 43 13.141 1.864 -11.437
289 HB3 ARG 43 3HB ARG 43 14.800 1.325 -11.060
290 HG2 ARG 43 2HG ARG 43 14.561 1.760 -8.768
291 HG3 ARG 43 3HG ARG 43 13.152 2.812 -9.005
292 HD2 ARG 43 2HD ARG 43 12.328 0.744 -8.107
293 HD3 ARG 43 3HD ARG 43 11.839 0.836 -9.812
294 HE ARG 43 HE ARG 43 13.999 -0.621 -10.147
295 HH11 ARG 43 1HH1 ARG 43 11.758 -0.794 -7.422
296 HH12 ARG 43 2HH1 ARG 43 12.080 -2.483 -7.106
297 HH21 ARG 43 1HH2 ARG 43 14.412 -2.796 -9.724
298 HH22 ARG 43 2HH2 ARG 43 13.590 -3.625 -8.415
299 H ASP 44 H ASP 44 13.820 4.999 -9.131
300 HA ASP 44 HA ASP 44 12.001 6.638 -10.722
301 HB2 ASP 44 2HB ASP 44 11.020 4.672 -8.664
302 HB3 ASP 44 3HB ASP 44 10.157 6.188 -8.930
303 H ILE 45 H ILE 45 11.096 8.461 -9.657
304 HA ILE 45 HA ILE 45 12.532 9.251 -7.177
305 HB ILE 45 HB ILE 45 13.311 10.373 -9.359
306 HG12 ILE 45 2HG1 ILE 45 13.335 12.657 -8.407
307 HG13 ILE 45 3HG1 ILE 45 12.144 12.171 -7.190
308 HG21 ILE 45 1HG2 ILE 45 10.603 11.740 -9.094
309 HG22 ILE 45 2HG2 ILE 45 11.873 12.124 -10.275
310 HG23 ILE 45 3HG2 ILE 45 11.030 10.561 -10.359
311 HD11 ILE 45 1HD1 ILE 45 13.734 10.528 -6.266
312 HD12 ILE 45 2HD1 ILE 45 14.899 10.917 -7.555
313 HD13 ILE 45 3HD1 ILE 45 14.485 12.137 -6.331
314 H ASP 46 H ASP 46 11.293 10.873 -5.885
315 HA ASP 46 HA ASP 46 8.419 11.013 -6.414
316 HB2 ASP 46 2HB ASP 46 8.736 8.790 -5.407
317 HB3 ASP 46 3HB ASP 46 9.587 9.520 -4.042
318 H LEU 47 H LEU 47 9.727 13.215 -6.534
319 HA LEU 47 HA LEU 47 10.334 14.577 -4.098
320 HB2 LEU 47 2HB LEU 47 11.100 15.432 -6.219
321 HB3 LEU 47 3HB LEU 47 9.443 15.515 -6.846
322 HG LEU 47 HG LEU 47 8.891 17.256 -5.152
323 HD11 LEU 47 1HD1 LEU 47 10.588 16.684 -3.433
324 HD12 LEU 47 2HD1 LEU 47 11.884 17.151 -4.564
325 HD13 LEU 47 3HD1 LEU 47 10.744 18.370 -3.947
326 HD21 LEU 47 1HD2 LEU 47 11.311 17.857 -6.900
327 HD22 LEU 47 2HD2 LEU 47 9.613 17.862 -7.427
328 HD23 LEU 47 3HD2 LEU 47 10.181 19.059 -6.240
329 H LYS 48 H LYS 48 9.078 15.644 -2.609
330 HA LYS 48 HA LYS 48 6.193 15.982 -3.127
331 HB2 LYS 48 2HB LYS 48 7.548 14.379 -0.945
332 HB3 LYS 48 3HB LYS 48 5.935 15.079 -0.728
333 HG2 LYS 48 2HG LYS 48 5.196 13.904 -2.828
334 HG3 LYS 48 3HG LYS 48 6.776 13.104 -2.900
335 HD2 LYS 48 2HD LYS 48 4.775 12.899 -0.610
336 HD3 LYS 48 3HD LYS 48 5.063 11.659 -1.847
337 HE2 LYS 48 2HE LYS 48 7.159 12.695 0.112
338 HE3 LYS 48 3HE LYS 48 6.257 11.180 0.295
339 HZ1 LYS 48 1HZ LYS 48 8.035 11.819 -1.959
340 HZ2 LYS 48 2HZ LYS 48 8.398 10.819 -0.694
341 HZ3 LYS 48 3HZ LYS 48 7.209 10.417 -1.751
342 H ASN 49 H ASN 49 5.230 17.098 -1.055
343 HA ASN 49 HA ASN 49 7.102 19.069 0.089
344 HB2 ASN 49 2HB ASN 49 5.557 20.935 -0.589
345 HB3 ASN 49 3HB ASN 49 6.437 20.179 -1.918
346 HD21 ASN 49 1HD2 ASN 49 3.298 20.213 -3.567
347 HD22 ASN 49 2HD2 ASN 49 4.867 20.981 -3.417
348 H ARG 50 H ARG 50 5.654 20.644 1.533
349 HA ARG 50 HA ARG 50 3.515 19.163 2.919
350 HB2 ARG 50 2HB ARG 50 5.609 18.344 3.935
351 HB3 ARG 50 3HB ARG 50 6.129 20.010 4.237
352 HG2 ARG 50 2HG ARG 50 4.284 20.351 5.812
353 HG3 ARG 50 3HG ARG 50 3.610 18.753 5.410
354 HD2 ARG 50 2HD ARG 50 4.886 18.733 7.537
355 HD3 ARG 50 3HD ARG 50 5.604 17.663 6.315
356 HE ARG 50 HE ARG 50 6.703 20.390 6.428
357 HH11 ARG 50 1HH1 ARG 50 6.967 17.088 7.654
358 HH12 ARG 50 2HH1 ARG 50 8.698 17.212 7.914
359 HH21 ARG 50 1HH2 ARG 50 8.962 20.504 6.785
360 HH22 ARG 50 2HH2 ARG 50 9.797 19.117 7.463
361 H ARG 51 H ARG 51 2.451 20.550 4.570
362 HA ARG 51 HA ARG 51 1.921 23.151 3.464
363 HB2 ARG 51 2HB ARG 51 1.091 21.934 6.125
364 HB3 ARG 51 3HB ARG 51 0.361 23.349 5.364
365 HG2 ARG 51 2HG ARG 51 0.384 20.517 4.226
366 HG3 ARG 51 3HG ARG 51 -0.999 21.320 4.984
367 HD2 ARG 51 2HD ARG 51 0.400 22.199 2.428
368 HD3 ARG 51 3HD ARG 51 -1.176 21.406 2.535
369 HE ARG 51 HE ARG 51 -1.796 23.482 3.983
370 HH11 ARG 51 1HH1 ARG 51 0.353 23.491 1.174
371 HH12 ARG 51 2HH1 ARG 51 0.014 25.157 0.768
372 HH21 ARG 51 1HH2 ARG 51 -2.221 25.659 3.433
373 HH22 ARG 51 2HH2 ARG 51 -1.436 26.378 2.048
374 H GLY 52 H GLY 52 4.591 22.235 5.206
375 HA2 GLY 52 2HA GLY 52 5.294 24.969 5.794
376 HA3 GLY 52 3HA GLY 52 4.964 24.041 7.272
377 H GLY 53 H GLY 53 7.512 25.137 6.597
378 HA2 GLY 53 2HA GLY 53 9.713 24.474 6.750
379 HA3 GLY 53 3HA GLY 53 9.181 22.789 6.838
380 HA PRO 54 HA PRO 54 11.145 23.688 2.661
381 HB2 PRO 54 2HB PRO 54 13.269 21.951 2.879
382 HB3 PRO 54 3HB PRO 54 13.325 23.659 3.434
383 HG2 PRO 54 2HG PRO 54 12.841 21.153 5.066
384 HG3 PRO 54 3HG PRO 54 13.888 22.561 5.459
385 HD2 PRO 54 2HD PRO 54 11.350 22.259 6.469
386 HD3 PRO 54 3HD PRO 54 12.052 23.863 6.114
387 HA PRO 55 HA PRO 55 9.332 19.991 0.983
388 HB2 PRO 55 2HB PRO 55 10.701 19.701 -1.376
389 HB3 PRO 55 3HB PRO 55 9.478 20.982 -1.095
390 HG2 PRO 55 2HG PRO 55 12.495 21.179 -0.944
391 HG3 PRO 55 3HG PRO 55 11.336 22.337 -1.676
392 HD2 PRO 55 2HD PRO 55 12.405 22.671 0.840
393 HD3 PRO 55 3HD PRO 55 10.760 23.230 0.403
394 H PHE 56 H PHE 56 10.010 17.758 0.037
395 HA PHE 56 HA PHE 56 12.686 16.836 0.796
396 HB2 PHE 56 2HB PHE 56 12.013 15.366 2.501
397 HB3 PHE 56 3HB PHE 56 11.133 16.841 2.899
398 HD1 PHE 56 HD1 PHE 56 10.891 13.386 2.659
399 HD2 PHE 56 HD2 PHE 56 8.682 16.932 1.644
400 HE1 PHE 56 HE1 PHE 56 8.763 12.090 2.758
401 HE2 PHE 56 HE2 PHE 56 6.574 15.617 1.662
402 HZ PHE 56 HZ PHE 56 6.618 13.206 2.226
403 H ALA 57 H ALA 57 12.739 14.378 0.167
404 HA ALA 57 HA ALA 57 10.702 13.724 -1.860
405 HB1 ALA 57 1HB ALA 57 13.662 14.030 -2.511
406 HB2 ALA 57 2HB ALA 57 12.410 13.434 -3.620
407 HB3 ALA 57 3HB ALA 57 12.363 15.118 -3.052
408 H PHE 58 H PHE 58 10.751 11.585 -2.585
409 HA PHE 58 HA PHE 58 12.442 9.740 -1.008
410 HB2 PHE 58 2HB PHE 58 9.648 9.547 -1.991
411 HB3 PHE 58 3HB PHE 58 10.627 8.080 -2.047
412 HD1 PHE 58 HD1 PHE 58 9.832 6.719 -0.376
413 HD2 PHE 58 HD2 PHE 58 10.551 10.866 0.504
414 HE1 PHE 58 HE1 PHE 58 9.514 6.263 2.043
415 HE2 PHE 58 HE2 PHE 58 10.160 10.421 2.905
416 HZ PHE 58 HZ PHE 58 9.647 8.113 3.678
417 H VAL 59 H VAL 59 13.456 7.961 -1.994
418 HA VAL 59 HA VAL 59 13.811 8.201 -4.947
419 HB VAL 59 HB VAL 59 15.954 7.917 -2.798
420 HG11 VAL 59 1HG1 VAL 59 16.462 6.442 -4.697
421 HG12 VAL 59 2HG1 VAL 59 16.181 7.784 -5.831
422 HG13 VAL 59 3HG1 VAL 59 17.552 7.849 -4.694
423 HG21 VAL 59 1HG2 VAL 59 15.207 10.244 -3.187
424 HG22 VAL 59 2HG2 VAL 59 16.854 9.994 -3.808
425 HG23 VAL 59 3HG2 VAL 59 15.478 10.035 -4.933
426 H GLU 60 H GLU 60 13.899 6.230 -5.996
427 HA GLU 60 HA GLU 60 13.685 3.830 -4.232
428 HB2 GLU 60 2HB GLU 60 11.502 4.478 -5.176
429 HB3 GLU 60 3HB GLU 60 12.184 4.406 -6.815
430 HG2 GLU 60 2HG GLU 60 12.665 2.029 -6.562
431 HG3 GLU 60 3HG GLU 60 12.173 2.078 -4.858
432 H PHE 61 H PHE 61 15.299 2.472 -4.481
433 HA PHE 61 HA PHE 61 17.018 2.715 -6.814
434 HB2 PHE 61 2HB PHE 61 17.271 1.346 -4.166
435 HB3 PHE 61 3HB PHE 61 18.375 0.978 -5.495
436 HD1 PHE 61 HD1 PHE 61 17.151 3.708 -3.285
437 HD2 PHE 61 HD2 PHE 61 20.101 2.478 -6.161
438 HE1 PHE 61 HE1 PHE 61 18.489 5.729 -2.781
439 HE2 PHE 61 HE2 PHE 61 21.439 4.504 -5.662
440 HZ PHE 61 HZ PHE 61 20.635 6.131 -3.973
441 H GLU 62 H GLU 62 17.783 1.105 -8.162
442 HA GLU 62 HA GLU 62 15.865 -0.973 -8.850
443 HB2 GLU 62 2HB GLU 62 17.081 0.226 -10.605
444 HB3 GLU 62 3HB GLU 62 18.627 -0.176 -9.853
445 HG2 GLU 62 2HG GLU 62 18.279 -1.571 -11.803
446 HG3 GLU 62 3HG GLU 62 18.271 -2.573 -10.353
447 H ASP 63 H ASP 63 18.573 -0.632 -6.740
448 HA ASP 63 HA ASP 63 18.443 -3.486 -6.045
449 HB2 ASP 63 2HB ASP 63 20.159 -3.503 -7.713
450 HB3 ASP 63 3HB ASP 63 20.939 -2.081 -7.012
451 HA PRO 64 HA PRO 64 18.238 -1.294 -2.188
452 HB2 PRO 64 2HB PRO 64 18.858 -4.010 -1.079
453 HB3 PRO 64 3HB PRO 64 17.548 -2.874 -0.619
454 HG2 PRO 64 2HG PRO 64 17.038 -5.056 -2.150
455 HG3 PRO 64 3HG PRO 64 16.231 -3.485 -2.479
456 HD2 PRO 64 2HD PRO 64 18.561 -4.754 -3.915
457 HD3 PRO 64 3HD PRO 64 17.192 -3.809 -4.578
458 H ARG 65 H ARG 65 21.013 -3.213 -3.255
459 HA ARG 65 HA ARG 65 22.704 -2.622 -1.001
460 HB2 ARG 65 2HB ARG 65 23.187 -4.500 -2.472
461 HB3 ARG 65 3HB ARG 65 23.307 -3.424 -3.873
462 HG2 ARG 65 2HG ARG 65 25.535 -4.079 -3.048
463 HG3 ARG 65 3HG ARG 65 25.287 -2.331 -2.915
464 HD2 ARG 65 2HD ARG 65 24.704 -2.616 -0.504
465 HD3 ARG 65 3HD ARG 65 24.971 -4.355 -0.658
466 HE ARG 65 HE ARG 65 27.281 -4.001 -0.666
467 HH11 ARG 65 1HH1 ARG 65 25.573 -0.920 -0.986
468 HH12 ARG 65 2HH1 ARG 65 27.002 0.041 -0.706
469 HH21 ARG 65 1HH2 ARG 65 29.139 -2.722 -0.303
470 HH22 ARG 65 2HH2 ARG 65 29.018 -0.975 -0.310
471 H ASP 66 H ASP 66 21.894 -0.894 -4.003
472 HA ASP 66 HA ASP 66 24.068 0.997 -3.746
473 HB2 ASP 66 2HB ASP 66 21.537 0.945 -5.413
474 HB3 ASP 66 3HB ASP 66 22.714 2.258 -5.474
475 H ALA 67 H ALA 67 20.865 0.747 -2.377
476 HA ALA 67 HA ALA 67 20.485 3.538 -1.847
477 HB1 ALA 67 1HB ALA 67 19.390 1.071 -0.433
478 HB2 ALA 67 2HB ALA 67 18.757 2.727 -0.292
479 HB3 ALA 67 3HB ALA 67 18.657 1.873 -1.846
480 H GLU 68 H GLU 68 22.411 1.006 -0.347
481 HA GLU 68 HA GLU 68 22.673 2.310 2.225
482 HB2 GLU 68 2HB GLU 68 24.406 0.220 0.840
483 HB3 GLU 68 3HB GLU 68 24.500 0.680 2.550
484 HG2 GLU 68 2HG GLU 68 22.100 -0.006 2.822
485 HG3 GLU 68 3HG GLU 68 22.092 -0.553 1.139
486 H ASP 69 H ASP 69 24.271 2.586 -0.925
487 HA ASP 69 HA ASP 69 26.592 3.957 0.163
488 HB2 ASP 69 2HB ASP 69 25.577 3.528 -2.660
489 HB3 ASP 69 3HB ASP 69 27.047 4.430 -2.277
490 H ALA 70 H ALA 70 23.526 4.971 -1.390
491 HA ALA 70 HA ALA 70 24.254 7.748 -1.526
492 HB1 ALA 70 1HB ALA 70 21.533 6.382 -1.465
493 HB2 ALA 70 2HB ALA 70 21.843 8.066 -1.954
494 HB3 ALA 70 3HB ALA 70 22.495 6.724 -2.923
495 H VAL 71 H VAL 71 22.853 5.639 0.963
496 HA VAL 71 HA VAL 71 22.014 7.883 2.628
497 HB VAL 71 HB VAL 71 22.159 4.867 2.967
498 HG11 VAL 71 1HG1 VAL 71 21.293 6.945 5.023
499 HG12 VAL 71 2HG1 VAL 71 20.978 5.196 5.146
500 HG13 VAL 71 3HG1 VAL 71 22.646 5.801 5.177
501 HG21 VAL 71 1HG2 VAL 71 20.341 5.825 1.569
502 HG22 VAL 71 2HG2 VAL 71 19.698 5.113 3.067
503 HG23 VAL 71 3HG2 VAL 71 19.868 6.882 2.912
504 H SER 72 H SER 72 24.722 5.497 2.550
505 HA SER 72 HA SER 72 25.866 6.360 5.020
506 HB2 SER 72 2HB SER 72 26.345 4.175 4.011
507 HB3 SER 72 3HB SER 72 27.101 4.966 2.610
508 HG SER 72 HG SER 72 27.968 5.097 5.310
509 H GLY 73 H GLY 73 25.876 7.769 1.825
510 HA2 GLY 73 2HA GLY 73 28.375 9.253 2.286
511 HA3 GLY 73 3HA GLY 73 27.376 9.252 0.824
512 H ARG 74 H ARG 74 24.995 9.757 2.954
513 HA ARG 74 HA ARG 74 25.487 12.644 3.322
514 HB2 ARG 74 2HB ARG 74 23.370 11.545 1.438
515 HB3 ARG 74 3HB ARG 74 23.443 13.226 2.010
516 HG2 ARG 74 2HG ARG 74 25.755 13.408 1.059
517 HG3 ARG 74 3HG ARG 74 25.561 11.775 0.375
518 HD2 ARG 74 2HD ARG 74 23.608 12.535 -0.915
519 HD3 ARG 74 3HD ARG 74 23.763 14.156 -0.206
520 HE ARG 74 HE ARG 74 26.038 12.986 -1.733
521 HH11 ARG 74 1HH1 ARG 74 23.454 15.398 -1.493
522 HH12 ARG 74 2HH1 ARG 74 24.114 16.403 -2.761
523 HH21 ARG 74 1HH2 ARG 74 26.877 14.326 -3.380
524 HH22 ARG 74 2HH2 ARG 74 26.038 15.794 -3.829
525 H ASP 75 H ASP 75 24.741 10.156 4.992
526 HA ASP 75 HA ASP 75 22.096 10.681 5.976
527 HB2 ASP 75 2HB ASP 75 22.835 9.234 7.914
528 HB3 ASP 75 3HB ASP 75 22.887 8.497 6.310
529 H GLY 76 H GLY 76 24.654 12.720 6.146
530 HA2 GLY 76 2HA GLY 76 23.565 14.496 7.967
531 HA3 GLY 76 3HA GLY 76 24.651 13.469 8.926
532 H TYR 77 H TYR 77 24.417 15.834 6.304
533 HA TYR 77 HA TYR 77 27.332 16.276 6.564
534 HB2 TYR 77 2HB TYR 77 27.120 15.203 4.500
535 HB3 TYR 77 3HB TYR 77 25.681 16.124 4.067
536 HD1 TYR 77 HD1 TYR 77 29.320 16.599 4.803
537 HD2 TYR 77 HD2 TYR 77 25.838 18.010 2.715
538 HE1 TYR 77 HE1 TYR 77 30.723 18.262 3.600
539 HE2 TYR 77 HE2 TYR 77 27.237 19.680 1.510
540 HH TYR 77 HH TYR 77 30.760 19.973 2.074
541 H ASP 78 H ASP 78 28.131 18.274 6.657
542 HA ASP 78 HA ASP 78 26.425 20.257 7.754
543 HB2 ASP 78 2HB ASP 78 28.664 20.126 8.490
544 HB3 ASP 78 3HB ASP 78 29.298 20.230 6.838
545 H TYR 79 H TYR 79 24.884 21.231 6.642
546 HA TYR 79 HA TYR 79 25.579 22.452 4.024
547 HB2 TYR 79 2HB TYR 79 23.872 20.805 3.785
548 HB3 TYR 79 3HB TYR 79 22.964 21.457 5.151
549 HD1 TYR 79 HD1 TYR 79 21.619 23.461 4.953
550 HD2 TYR 79 HD2 TYR 79 23.834 21.924 1.608
551 HE1 TYR 79 HE1 TYR 79 20.281 24.888 3.419
552 HE2 TYR 79 HE2 TYR 79 22.521 23.366 0.068
553 HH TYR 79 HH TYR 79 20.858 24.940 -0.116
554 H ASP 80 H ASP 80 24.203 24.483 3.575
555 HA ASP 80 HA ASP 80 25.024 26.451 5.417
556 HB2 ASP 80 2HB ASP 80 24.732 27.024 3.128
557 HB3 ASP 80 3HB ASP 80 23.044 26.491 3.138
558 H GLY 81 H GLY 81 24.360 26.337 7.502
559 HA2 GLY 81 2HA GLY 81 22.975 26.917 9.254
560 HA3 GLY 81 3HA GLY 81 21.683 27.263 8.094
561 H TYR 82 H TYR 82 22.595 24.213 7.255
562 HA TYR 82 HA TYR 82 20.992 22.837 9.329
563 HB2 TYR 82 2HB TYR 82 20.286 22.941 6.388
564 HB3 TYR 82 3HB TYR 82 19.656 21.734 7.506
565 HD1 TYR 82 HD1 TYR 82 19.725 25.344 6.719
566 HD2 TYR 82 HD2 TYR 82 17.931 22.245 9.092
567 HE1 TYR 82 HE1 TYR 82 17.903 26.912 7.375
568 HE2 TYR 82 HE2 TYR 82 16.127 23.808 9.780
569 HH TYR 82 HH TYR 82 15.995 27.193 8.619
570 H ARG 83 H ARG 83 20.652 20.391 8.206
571 HA ARG 83 HA ARG 83 23.304 19.427 7.322
572 HB2 ARG 83 2HB ARG 83 23.341 19.316 9.771
573 HB3 ARG 83 3HB ARG 83 21.803 18.432 9.771
574 HG2 ARG 83 2HG ARG 83 22.866 16.571 8.521
575 HG3 ARG 83 3HG ARG 83 24.399 17.475 8.482
576 HD2 ARG 83 2HD ARG 83 24.466 15.830 10.282
577 HD3 ARG 83 3HD ARG 83 24.459 17.464 10.957
578 HE ARG 83 HE ARG 83 22.082 15.633 10.836
579 HH11 ARG 83 1HH1 ARG 83 23.896 18.234 12.405
580 HH12 ARG 83 2HH1 ARG 83 22.784 18.353 13.751
581 HH21 ARG 83 1HH2 ARG 83 20.648 15.822 12.604
582 HH22 ARG 83 2HH2 ARG 83 20.954 16.998 13.861
583 H LEU 84 H LEU 84 23.145 17.670 5.953
584 HA LEU 84 HA LEU 84 20.623 17.190 4.688
585 HB2 LEU 84 2HB LEU 84 23.364 15.916 4.557
586 HB3 LEU 84 3HB LEU 84 22.003 15.167 3.725
587 HG LEU 84 HG LEU 84 23.320 16.621 2.233
588 HD11 LEU 84 1HD1 LEU 84 20.515 17.714 2.732
589 HD12 LEU 84 2HD1 LEU 84 21.437 17.796 1.223
590 HD13 LEU 84 3HD1 LEU 84 20.888 16.220 1.841
591 HD21 LEU 84 1HD2 LEU 84 22.299 18.934 3.933
592 HD22 LEU 84 2HD2 LEU 84 23.975 18.336 3.918
593 HD23 LEU 84 3HD2 LEU 84 23.263 19.044 2.450
594 H ARG 85 H ARG 85 19.307 15.315 4.639
595 HA ARG 85 HA ARG 85 19.780 13.347 6.815
596 HB2 ARG 85 2HB ARG 85 17.109 14.670 6.198
597 HB3 ARG 85 3HB ARG 85 17.404 13.392 7.395
598 HG2 ARG 85 2HG ARG 85 19.027 14.945 8.545
599 HG3 ARG 85 3HG ARG 85 18.505 16.231 7.437
600 HD2 ARG 85 2HD ARG 85 16.692 14.666 9.314
601 HD3 ARG 85 3HD ARG 85 17.296 16.298 9.613
602 HE ARG 85 HE ARG 85 15.191 15.491 7.709
603 HH11 ARG 85 1HH1 ARG 85 17.397 18.045 8.766
604 HH12 ARG 85 2HH1 ARG 85 16.409 19.331 8.118
605 HH21 ARG 85 1HH2 ARG 85 13.903 17.199 6.887
606 HH22 ARG 85 2HH2 ARG 85 14.448 18.849 7.034
607 H VAL 86 H VAL 86 20.656 12.649 4.432
608 HA VAL 86 HA VAL 86 18.542 11.294 2.927
609 HB VAL 86 HB VAL 86 21.560 11.060 2.663
610 HG11 VAL 86 1HG1 VAL 86 19.251 10.437 0.764
611 HG12 VAL 86 2HG1 VAL 86 20.975 10.311 0.368
612 HG13 VAL 86 3HG1 VAL 86 20.274 9.237 1.593
613 HG21 VAL 86 1HG2 VAL 86 20.897 13.399 2.376
614 HG22 VAL 86 2HG2 VAL 86 21.257 12.691 0.789
615 HG23 VAL 86 3HG2 VAL 86 19.566 12.915 1.295
616 H GLU 87 H GLU 87 17.569 9.823 4.295
617 HA GLU 87 HA GLU 87 19.126 7.401 4.844
618 HB2 GLU 87 2HB GLU 87 18.508 7.326 7.213
619 HB3 GLU 87 3HB GLU 87 19.497 8.763 6.870
620 HG2 GLU 87 2HG GLU 87 17.442 10.147 6.768
621 HG3 GLU 87 3HG GLU 87 16.452 8.713 7.106
622 H PHE 88 H PHE 88 17.680 5.584 5.554
623 HA PHE 88 HA PHE 88 15.174 5.763 4.124
624 HB2 PHE 88 2HB PHE 88 14.993 3.317 5.001
625 HB3 PHE 88 3HB PHE 88 16.106 3.768 3.707
626 HD1 PHE 88 HD1 PHE 88 18.444 3.524 3.905
627 HD2 PHE 88 HD2 PHE 88 15.921 3.017 7.349
628 HE1 PHE 88 HE1 PHE 88 20.367 2.604 5.179
629 HE2 PHE 88 HE2 PHE 88 17.846 2.102 8.625
630 HZ PHE 88 HZ PHE 88 20.067 1.891 7.539
631 HA PRO 89 HA PRO 89 12.159 6.542 7.142
632 HB2 PRO 89 2HB PRO 89 10.770 4.011 6.315
633 HB3 PRO 89 3HB PRO 89 10.117 5.678 6.411
634 HG2 PRO 89 2HG PRO 89 10.752 4.533 4.018
635 HG3 PRO 89 3HG PRO 89 11.074 6.269 4.335
636 HD2 PRO 89 2HD PRO 89 12.997 3.948 4.379
637 HD3 PRO 89 3HD PRO 89 13.242 5.619 3.781
638 H5' A 90 1H5* A 90 4.965 17.361 10.834
639 H5'' A 90 2H5* A 90 6.684 17.722 10.578
640 H4' A 90 H4* A 90 6.357 16.518 12.695
641 H3' A 90 H3* A 90 8.294 15.884 10.840
642 H2' A 90 1H2* A 90 7.127 14.144 9.760
643 HO2' A 90 2HO* A 90 8.398 12.953 12.017
644 H1' A 90 H1* A 90 6.079 13.084 12.371
645 H8 A 90 H8 A 90 5.987 10.996 10.450
646 H61 A 90 1H6 A 90 1.000 12.004 6.919
647 H62 A 90 2H6 A 90 2.197 10.818 7.415
648 H2 A 90 H2 A 90 1.822 15.718 9.224
649 HO5' A 90 H5T A 90 5.168 15.636 9.408
650 H5' A 91 1H5* A 91 10.808 18.239 12.122
651 H5'' A 91 2H5* A 91 9.681 17.391 11.051
652 H4' A 91 H4* A 91 11.760 17.797 9.857
653 H3' A 91 H3* A 91 10.521 15.366 9.913
654 H2' A 91 1H2* A 91 11.670 14.273 11.599
655 HO2' A 91 2HO* A 91 13.454 14.146 9.392
656 H1' A 91 H1* A 91 14.350 15.440 11.257
657 H8 A 91 H8 A 91 13.170 13.261 13.209
658 H61 A 91 1H6 A 91 13.118 16.546 18.456
659 H62 A 91 2H6 A 91 13.064 14.939 17.764
660 H2 A 91 H2 A 91 13.390 19.403 15.046
661 H5' C 92 1H5* C 92 10.281 15.428 4.965
662 H5'' C 92 2H5* C 92 8.916 16.137 5.853
663 H4' C 92 H4* C 92 8.180 14.156 4.633
664 H3' C 92 H3* C 92 7.701 14.550 7.368
665 H2' C 92 1H2* C 92 9.296 12.974 8.105
666 HO2' C 92 2HO* C 92 6.948 11.481 7.473
667 H1' C 92 H1* C 92 8.577 11.231 5.726
668 H41 C 92 1H4 C 92 13.660 7.973 7.747
669 H42 C 92 2H4 C 92 14.343 9.380 8.536
670 H5 C 92 H5 C 92 13.246 11.574 8.505
671 H6 C 92 H6 C 92 11.309 12.801 7.699
672 H5' A 93 1H5* A 93 4.927 14.532 2.757
673 H5'' A 93 2H5* A 93 3.406 14.573 3.665
674 H4' A 93 H4* A 93 3.150 13.367 1.520
675 H3' A 93 H3* A 93 2.919 11.732 4.060
676 H2' A 93 1H2* A 93 2.364 9.849 2.719
677 HO2' A 93 2HO* A 93 0.830 10.921 1.399
678 H1' A 93 H1* A 93 4.027 10.490 0.564
679 H8 A 93 H8 A 93 4.307 9.946 4.342
680 H61 A 93 1H6 A 93 7.608 4.945 2.696
681 H62 A 93 2H6 A 93 6.880 5.801 4.040
682 H2 A 93 H2 A 93 6.822 7.398 -0.947
683 H5' A 94 1H5* A 94 -1.840 10.821 2.221
684 H5'' A 94 2H5* A 94 -0.913 11.975 1.241
685 H4' A 94 H4* A 94 -3.612 12.682 2.448
686 H3' A 94 H3* A 94 -2.952 10.997 0.086
687 H2' A 94 1H2* A 94 -4.243 12.250 -1.468
688 HO2' A 94 2HO* A 94 -5.666 13.896 -0.746
689 H1' A 94 H1* A 94 -3.430 14.698 -0.743
690 H8 A 94 H8 A 94 -2.759 12.181 -2.831
691 H61 A 94 1H6 A 94 3.381 12.941 -2.772
692 H62 A 94 2H6 A 94 2.023 12.212 -3.614
693 H2 A 94 H2 A 94 1.693 15.105 0.738
694 H5' A 95 1H5* A 95 -6.035 10.220 -2.497
695 H5'' A 95 2H5* A 95 -7.592 11.055 -2.328
696 H4' A 95 H4* A 95 -7.068 8.205 -1.348
697 H3' A 95 H3* A 95 -7.074 8.783 -3.973
698 HO3' A 95 H3T A 95 -8.171 6.792 -4.249
699 H2' A 95 1H2* A 95 -8.962 10.102 -4.220
700 HO2' A 95 2HO* A 95 -10.152 7.518 -4.024
701 H1' A 95 H1* A 95 -10.782 8.925 -2.250
702 H8 A 95 H8 A 95 -10.582 11.538 -4.249
703 H61 A 95 1H6 A 95 -10.876 15.827 0.210
704 H62 A 95 2H6 A 95 -11.027 15.527 -1.509
705 H2 A 95 H2 A 95 -9.792 11.949 2.104
Start of MODEL 12
1 H VAL 6 H1 VAL 6 -0.382 0.042 0.366
2 HA VAL 6 HA VAL 6 -1.416 1.023 2.917
3 HB VAL 6 HB VAL 6 0.640 -0.457 3.008
4 HG11 VAL 6 1HG1 VAL 6 1.950 1.986 1.728
5 HG12 VAL 6 2HG1 VAL 6 2.781 0.559 2.382
6 HG13 VAL 6 3HG1 VAL 6 1.746 0.404 0.946
7 HG21 VAL 6 1HG2 VAL 6 0.009 1.151 4.784
8 HG22 VAL 6 2HG2 VAL 6 1.768 0.994 4.617
9 HG23 VAL 6 3HG2 VAL 6 0.948 2.422 3.960
10 H ILE 7 H ILE 7 -1.142 3.248 3.386
11 HA ILE 7 HA ILE 7 -1.244 4.879 0.963
12 HB ILE 7 HB ILE 7 -1.476 5.994 3.744
13 HG12 ILE 7 2HG1 ILE 7 -3.603 4.303 2.367
14 HG13 ILE 7 3HG1 ILE 7 -2.783 3.927 3.892
15 HG21 ILE 7 1HG2 ILE 7 -3.000 6.471 1.144
16 HG22 ILE 7 2HG2 ILE 7 -3.114 7.449 2.629
17 HG23 ILE 7 3HG2 ILE 7 -1.611 7.432 1.693
18 HD11 ILE 7 1HD1 ILE 7 -4.667 6.266 3.381
19 HD12 ILE 7 2HD1 ILE 7 -4.975 4.843 4.388
20 HD13 ILE 7 3HD1 ILE 7 -3.738 6.024 4.881
21 H ARG 8 H ARG 8 1.256 3.771 2.866
22 HA ARG 8 HA ARG 8 2.780 6.103 3.404
23 HB2 ARG 8 2HB ARG 8 3.307 4.027 4.469
24 HB3 ARG 8 3HB ARG 8 3.553 3.201 2.921
25 HG2 ARG 8 2HG ARG 8 5.233 5.624 3.533
26 HG3 ARG 8 3HG ARG 8 5.610 4.109 4.370
27 HD2 ARG 8 2HD ARG 8 5.238 4.092 1.370
28 HD3 ARG 8 3HD ARG 8 6.759 4.649 2.061
29 HE ARG 8 HE ARG 8 5.621 1.909 2.321
30 HH11 ARG 8 1HH1 ARG 8 8.303 4.163 2.784
31 HH12 ARG 8 2HH1 ARG 8 9.481 2.893 3.036
32 HH21 ARG 8 1HH2 ARG 8 7.173 0.275 2.665
33 HH22 ARG 8 2HH2 ARG 8 8.846 0.699 2.962
34 H GLY 9 H GLY 9 4.293 7.265 2.249
35 HA2 GLY 9 2HA GLY 9 5.375 8.121 0.409
36 HA3 GLY 9 3HA GLY 9 5.528 6.442 -0.133
37 HA PRO 10 HA PRO 10 2.707 8.258 -3.271
38 HB2 PRO 10 2HB PRO 10 3.776 6.994 -5.440
39 HB3 PRO 10 3HB PRO 10 4.542 8.436 -4.707
40 HG2 PRO 10 2HG PRO 10 5.242 5.518 -4.287
41 HG3 PRO 10 3HG PRO 10 6.345 6.907 -4.593
42 HD2 PRO 10 2HD PRO 10 5.798 5.892 -2.076
43 HD3 PRO 10 3HD PRO 10 6.227 7.603 -2.367
44 H ALA 11 H ALA 11 1.963 6.300 -1.417
45 HA ALA 11 HA ALA 11 0.723 4.465 -1.038
46 HB1 ALA 11 1HB ALA 11 -0.130 4.752 -3.942
47 HB2 ALA 11 2HB ALA 11 -0.983 3.861 -2.665
48 HB3 ALA 11 3HB ALA 11 -0.832 5.631 -2.561
49 H GLY 12 H GLY 12 3.502 4.278 -2.513
50 HA2 GLY 12 2HA GLY 12 3.344 1.476 -3.454
51 HA3 GLY 12 3HA GLY 12 4.749 2.558 -3.540
52 H ASN 13 H ASN 13 5.349 0.106 -2.655
53 HA ASN 13 HA ASN 13 6.096 0.629 0.123
54 HB2 ASN 13 2HB ASN 13 3.837 -0.487 0.251
55 HB3 ASN 13 3HB ASN 13 4.525 -1.879 -0.605
56 HD21 ASN 13 1HD2 ASN 13 4.996 -3.158 2.684
57 HD22 ASN 13 2HD2 ASN 13 3.999 -3.206 1.244
58 H ASN 14 H ASN 14 8.183 0.056 0.323
59 HA ASN 14 HA ASN 14 9.193 -2.459 -0.700
60 HB2 ASN 14 2HB ASN 14 9.211 -0.905 -2.717
61 HB3 ASN 14 3HB ASN 14 10.356 0.116 -1.844
62 HD21 ASN 14 1HD2 ASN 14 12.308 -2.121 -4.077
63 HD22 ASN 14 2HD2 ASN 14 11.080 -0.888 -4.273
64 H ASP 15 H ASP 15 10.983 -3.066 0.534
65 HA ASP 15 HA ASP 15 11.635 -1.385 2.813
66 HB2 ASP 15 2HB ASP 15 12.656 -4.084 1.881
67 HB3 ASP 15 3HB ASP 15 13.152 -3.305 3.390
68 H CYS 16 H CYS 16 12.821 -1.559 -0.378
69 HA CYS 16 HA CYS 16 15.599 -0.952 0.229
70 HB2 CYS 16 2HB CYS 16 13.977 -0.793 -2.346
71 HB3 CYS 16 3HB CYS 16 15.740 -0.601 -2.225
72 HG CYS 16 HG CYS 16 13.805 -3.174 -1.485
73 H ARG 17 H ARG 17 12.885 0.853 0.753
74 HA ARG 17 HA ARG 17 13.702 3.325 -0.536
75 HB2 ARG 17 2HB ARG 17 11.476 2.535 1.354
76 HB3 ARG 17 3HB ARG 17 11.810 4.240 0.965
77 HG2 ARG 17 2HG ARG 17 11.676 3.716 -1.448
78 HG3 ARG 17 3HG ARG 17 11.228 2.039 -1.059
79 HD2 ARG 17 2HD ARG 17 9.167 2.759 -0.027
80 HD3 ARG 17 3HD ARG 17 9.680 4.458 -0.073
81 HE ARG 17 HE ARG 17 9.020 2.814 -2.485
82 HH11 ARG 17 1HH1 ARG 17 9.097 5.925 -0.791
83 HH12 ARG 17 2HH1 ARG 17 8.465 6.807 -2.161
84 HH21 ARG 17 1HH2 ARG 17 8.276 3.993 -4.250
85 HH22 ARG 17 2HH2 ARG 17 7.939 5.705 -4.108
86 H ILE 18 H ILE 18 14.335 5.233 0.392
87 HA ILE 18 HA ILE 18 15.155 5.212 3.245
88 HB ILE 18 HB ILE 18 17.293 6.199 2.760
89 HG12 ILE 18 2HG1 ILE 18 16.696 5.844 -0.202
90 HG13 ILE 18 3HG1 ILE 18 16.599 7.393 0.659
91 HG21 ILE 18 1HG2 ILE 18 17.073 3.717 2.799
92 HG22 ILE 18 2HG2 ILE 18 16.967 3.725 1.021
93 HG23 ILE 18 3HG2 ILE 18 18.449 4.284 1.831
94 HD11 ILE 18 1HD1 ILE 18 19.093 5.676 0.351
95 HD12 ILE 18 2HD1 ILE 18 18.757 7.228 -0.442
96 HD13 ILE 18 3HD1 ILE 18 18.990 7.162 1.322
97 H TYR 19 H TYR 19 15.871 7.533 3.836
98 HA TYR 19 HA TYR 19 13.855 9.372 2.678
99 HB2 TYR 19 2HB TYR 19 12.921 9.050 4.673
100 HB3 TYR 19 3HB TYR 19 14.434 8.628 5.465
101 HD1 TYR 19 HD1 TYR 19 12.032 11.276 4.850
102 HD2 TYR 19 HD2 TYR 19 16.058 10.443 6.113
103 HE1 TYR 19 HE1 TYR 19 12.156 13.511 5.954
104 HE2 TYR 19 HE2 TYR 19 16.184 12.661 7.205
105 HH TYR 19 HH TYR 19 13.456 14.981 7.130
106 H VAL 20 H VAL 20 14.175 11.612 2.660
107 HA VAL 20 HA VAL 20 16.995 12.502 2.905
108 HB VAL 20 HB VAL 20 15.181 12.984 0.508
109 HG11 VAL 20 1HG1 VAL 20 17.192 14.105 -0.436
110 HG12 VAL 20 2HG1 VAL 20 16.559 14.947 0.990
111 HG13 VAL 20 3HG1 VAL 20 18.010 13.927 1.135
112 HG21 VAL 20 1HG2 VAL 20 16.122 10.721 0.487
113 HG22 VAL 20 2HG2 VAL 20 16.930 11.728 -0.732
114 HG23 VAL 20 3HG2 VAL 20 17.748 11.378 0.806
115 H GLY 21 H GLY 21 17.195 14.640 3.617
116 HA2 GLY 21 2HA GLY 21 14.719 16.224 3.965
117 HA3 GLY 21 3HA GLY 21 15.590 15.728 5.420
118 H ASN 22 H ASN 22 15.336 18.300 5.244
119 HA ASN 22 HA ASN 22 16.273 20.329 5.100
120 HB2 ASN 22 2HB ASN 22 18.199 19.117 6.174
121 HB3 ASN 22 3HB ASN 22 18.904 18.919 4.559
122 HD21 ASN 22 1HD2 ASN 22 20.636 21.928 5.197
123 HD22 ASN 22 2HD2 ASN 22 20.738 20.185 5.018
124 H LEU 23 H LEU 23 17.117 21.966 3.618
125 HA LEU 23 HA LEU 23 16.369 21.322 0.880
126 HB2 LEU 23 2HB LEU 23 15.729 23.435 2.124
127 HB3 LEU 23 3HB LEU 23 17.434 23.917 2.050
128 HG LEU 23 HG LEU 23 17.237 23.605 -0.515
129 HD11 LEU 23 1HD1 LEU 23 15.063 22.355 -0.450
130 HD12 LEU 23 2HD1 LEU 23 14.282 23.797 0.229
131 HD13 LEU 23 3HD1 LEU 23 14.955 23.845 -1.418
132 HD21 LEU 23 1HD2 LEU 23 17.374 25.804 0.601
133 HD22 LEU 23 2HD2 LEU 23 16.247 25.863 -0.773
134 HD23 LEU 23 3HD2 LEU 23 15.618 25.773 0.889
135 HA PRO 24 HA PRO 24 20.635 20.576 -0.317
136 HB2 PRO 24 2HB PRO 24 20.264 20.476 -3.044
137 HB3 PRO 24 3HB PRO 24 19.806 19.148 -1.936
138 HG2 PRO 24 2HG PRO 24 18.045 21.297 -3.119
139 HG3 PRO 24 3HG PRO 24 17.713 19.539 -2.961
140 HD2 PRO 24 2HD PRO 24 16.742 21.411 -1.208
141 HD3 PRO 24 3HD PRO 24 17.181 19.756 -0.684
142 HA PRO 25 HA PRO 25 22.395 24.473 -1.334
143 HB2 PRO 25 2HB PRO 25 23.912 23.199 -3.582
144 HB3 PRO 25 3HB PRO 25 24.532 24.149 -2.192
145 HG2 PRO 25 2HG PRO 25 24.782 21.430 -2.278
146 HG3 PRO 25 3HG PRO 25 24.408 22.283 -0.745
147 HD2 PRO 25 2HD PRO 25 22.540 20.801 -2.590
148 HD3 PRO 25 3HD PRO 25 22.578 20.835 -0.800
149 H ASP 26 H ASP 26 21.027 22.565 -3.992
150 HA ASP 26 HA ASP 26 19.683 24.935 -4.993
151 HB2 ASP 26 2HB ASP 26 20.438 24.621 -7.336
152 HB3 ASP 26 3HB ASP 26 21.714 25.184 -6.256
153 H ILE 27 H ILE 27 18.069 24.349 -6.706
154 HA ILE 27 HA ILE 27 17.451 21.503 -6.930
155 HB ILE 27 HB ILE 27 16.445 22.036 -4.769
156 HG12 ILE 27 2HG1 ILE 27 14.054 21.572 -5.246
157 HG13 ILE 27 3HG1 ILE 27 14.318 21.926 -6.957
158 HG21 ILE 27 1HG2 ILE 27 16.253 24.490 -5.066
159 HG22 ILE 27 2HG2 ILE 27 14.927 24.235 -6.229
160 HG23 ILE 27 3HG2 ILE 27 14.716 23.764 -4.536
161 HD11 ILE 27 1HD1 ILE 27 15.929 20.041 -7.101
162 HD12 ILE 27 2HD1 ILE 27 15.713 19.727 -5.363
163 HD13 ILE 27 3HD1 ILE 27 14.361 19.477 -6.490
164 H ARG 28 H ARG 28 16.184 21.027 -8.692
165 HA ARG 28 HA ARG 28 15.070 23.256 -10.290
166 HB2 ARG 28 2HB ARG 28 17.039 21.187 -11.345
167 HB3 ARG 28 3HB ARG 28 16.150 22.349 -12.342
168 HG2 ARG 28 2HG ARG 28 17.243 24.227 -11.192
169 HG3 ARG 28 3HG ARG 28 18.084 23.106 -10.102
170 HD2 ARG 28 2HD ARG 28 19.260 22.091 -12.015
171 HD3 ARG 28 3HD ARG 28 18.381 23.150 -13.132
172 HE ARG 28 HE ARG 28 19.794 24.900 -12.593
173 HH11 ARG 28 1HH1 ARG 28 20.177 22.325 -10.180
174 HH12 ARG 28 2HH1 ARG 28 21.577 23.072 -9.450
175 HH21 ARG 28 1HH2 ARG 28 21.639 25.833 -11.605
176 HH22 ARG 28 2HH2 ARG 28 22.396 25.031 -10.245
177 H THR 29 H THR 29 13.899 21.205 -8.602
178 HA THR 29 HA THR 29 12.291 19.693 -8.547
179 HB THR 29 HB THR 29 10.415 20.012 -9.768
180 HG1 THR 29 1HG THR 29 10.420 20.599 -11.932
181 HG21 THR 29 1HG2 THR 29 11.284 22.185 -8.848
182 HG22 THR 29 2HG2 THR 29 11.980 22.540 -10.450
183 HG23 THR 29 3HG2 THR 29 10.220 22.378 -10.259
184 H LYS 30 H LYS 30 14.882 18.972 -10.230
185 HA LYS 30 HA LYS 30 13.991 16.184 -10.483
186 HB2 LYS 30 2HB LYS 30 14.743 15.924 -12.783
187 HB3 LYS 30 3HB LYS 30 13.515 17.191 -12.696
188 HG2 LYS 30 2HG LYS 30 15.018 18.340 -13.969
189 HG3 LYS 30 3HG LYS 30 15.691 18.754 -12.386
190 HD2 LYS 30 2HD LYS 30 17.467 18.073 -13.930
191 HD3 LYS 30 3HD LYS 30 17.348 16.923 -12.595
192 HE2 LYS 30 2HE LYS 30 17.629 15.747 -14.734
193 HE3 LYS 30 3HE LYS 30 16.053 15.376 -14.031
194 HZ1 LYS 30 1HZ LYS 30 15.084 17.011 -15.513
195 HZ2 LYS 30 2HZ LYS 30 16.559 17.349 -16.155
196 HZ3 LYS 30 3HZ LYS 30 15.890 15.859 -16.368
197 H ASP 31 H ASP 31 16.307 18.511 -9.640
198 HA ASP 31 HA ASP 31 18.707 17.036 -10.118
199 HB2 ASP 31 2HB ASP 31 17.992 19.170 -8.090
200 HB3 ASP 31 3HB ASP 31 19.622 18.505 -8.286
201 H ILE 32 H ILE 32 16.157 16.600 -7.807
202 HA ILE 32 HA ILE 32 17.690 15.109 -5.874
203 HB ILE 32 HB ILE 32 15.544 16.203 -5.349
204 HG12 ILE 32 2HG1 ILE 32 14.391 14.343 -4.205
205 HG13 ILE 32 3HG1 ILE 32 15.315 13.164 -5.140
206 HG21 ILE 32 1HG2 ILE 32 13.423 15.270 -6.200
207 HG22 ILE 32 2HG2 ILE 32 14.419 15.875 -7.536
208 HG23 ILE 32 3HG2 ILE 32 14.318 14.127 -7.220
209 HD11 ILE 32 1HD1 ILE 32 16.516 15.242 -3.253
210 HD12 ILE 32 2HD1 ILE 32 16.266 13.526 -2.863
211 HD13 ILE 32 3HD1 ILE 32 17.419 13.989 -4.134
212 H GLU 33 H GLU 33 16.542 14.437 -9.085
213 HA GLU 33 HA GLU 33 16.546 11.515 -8.636
214 HB2 GLU 33 2HB GLU 33 15.984 13.126 -11.153
215 HB3 GLU 33 3HB GLU 33 15.708 11.392 -10.916
216 HG2 GLU 33 2HG GLU 33 14.092 11.961 -9.077
217 HG3 GLU 33 3HG GLU 33 14.324 13.675 -9.446
218 H ASP 34 H ASP 34 18.389 14.130 -10.253
219 HA ASP 34 HA ASP 34 20.047 12.342 -11.756
220 HB2 ASP 34 2HB ASP 34 20.309 15.259 -11.004
221 HB3 ASP 34 3HB ASP 34 21.506 14.407 -11.990
222 H VAL 35 H VAL 35 20.458 13.899 -8.556
223 HA VAL 35 HA VAL 35 23.205 13.033 -8.280
224 HB VAL 35 HB VAL 35 21.115 13.965 -6.273
225 HG11 VAL 35 1HG1 VAL 35 22.824 12.611 -5.130
226 HG12 VAL 35 2HG1 VAL 35 24.113 13.537 -5.940
227 HG13 VAL 35 3HG1 VAL 35 23.053 14.328 -4.751
228 HG21 VAL 35 1HG2 VAL 35 21.790 15.664 -7.950
229 HG22 VAL 35 2HG2 VAL 35 22.421 16.069 -6.339
230 HG23 VAL 35 3HG2 VAL 35 23.501 15.358 -7.559
231 H PHE 36 H PHE 36 19.995 11.759 -7.229
232 HA PHE 36 HA PHE 36 21.244 9.574 -5.825
233 HB2 PHE 36 2HB PHE 36 18.407 10.317 -6.423
234 HB3 PHE 36 3HB PHE 36 18.816 8.724 -5.784
235 HD1 PHE 36 HD1 PHE 36 19.250 12.376 -5.085
236 HD2 PHE 36 HD2 PHE 36 19.236 8.383 -3.495
237 HE1 PHE 36 HE1 PHE 36 19.419 13.290 -2.783
238 HE2 PHE 36 HE2 PHE 36 19.421 9.297 -1.196
239 HZ PHE 36 HZ PHE 36 19.503 11.750 -0.840
240 H SER 37 H SER 37 19.823 9.878 -9.088
241 HA SER 37 HA SER 37 20.003 7.055 -9.616
242 HB2 SER 37 2HB SER 37 19.665 7.668 -11.945
243 HB3 SER 37 3HB SER 37 18.571 8.619 -10.920
244 HG SER 37 HG SER 37 19.847 10.376 -11.197
245 H LYS 38 H LYS 38 22.349 9.681 -9.582
246 HA LYS 38 HA LYS 38 24.370 8.253 -11.100
247 HB2 LYS 38 2HB LYS 38 24.385 10.689 -10.891
248 HB3 LYS 38 3HB LYS 38 24.545 10.559 -9.125
249 HG2 LYS 38 2HG LYS 38 26.729 9.418 -9.395
250 HG3 LYS 38 3HG LYS 38 26.565 9.522 -11.160
251 HD2 LYS 38 2HD LYS 38 26.672 11.906 -9.262
252 HD3 LYS 38 3HD LYS 38 28.027 11.310 -10.244
253 HE2 LYS 38 2HE LYS 38 26.670 11.717 -12.296
254 HE3 LYS 38 3HE LYS 38 25.365 12.362 -11.283
255 HZ1 LYS 38 1HZ LYS 38 26.881 14.053 -10.519
256 HZ2 LYS 38 2HZ LYS 38 28.089 13.470 -11.472
257 HZ3 LYS 38 3HZ LYS 38 26.734 14.111 -12.154
258 H TYR 39 H TYR 39 23.380 8.468 -7.685
259 HA TYR 39 HA TYR 39 25.635 6.850 -6.822
260 HB2 TYR 39 2HB TYR 39 23.371 8.212 -5.461
261 HB3 TYR 39 3HB TYR 39 24.197 6.887 -4.634
262 HD1 TYR 39 HD1 TYR 39 25.154 9.958 -6.622
263 HD2 TYR 39 HD2 TYR 39 25.942 7.389 -3.265
264 HE1 TYR 39 HE1 TYR 39 26.989 11.457 -5.910
265 HE2 TYR 39 HE2 TYR 39 27.771 8.885 -2.533
266 HH TYR 39 HH TYR 39 28.961 10.806 -2.985
267 H GLY 40 H GLY 40 22.612 5.975 -8.190
268 HA2 GLY 40 2HA GLY 40 23.217 3.225 -8.029
269 HA3 GLY 40 3HA GLY 40 22.123 3.591 -6.685
270 H ALA 41 H ALA 41 21.140 1.831 -8.352
271 HA ALA 41 HA ALA 41 19.696 3.037 -10.584
272 HB1 ALA 41 1HB ALA 41 18.836 0.737 -10.876
273 HB2 ALA 41 2HB ALA 41 20.609 0.756 -10.727
274 HB3 ALA 41 3HB ALA 41 19.605 0.248 -9.351
275 H ILE 42 H ILE 42 18.551 4.670 -9.262
276 HA ILE 42 HA ILE 42 16.504 3.914 -7.401
277 HB ILE 42 HB ILE 42 17.128 6.357 -9.054
278 HG12 ILE 42 2HG1 ILE 42 17.169 7.417 -6.837
279 HG13 ILE 42 3HG1 ILE 42 16.621 5.907 -6.080
280 HG21 ILE 42 1HG2 ILE 42 14.560 5.907 -7.481
281 HG22 ILE 42 2HG2 ILE 42 15.134 7.482 -8.074
282 HG23 ILE 42 3HG2 ILE 42 14.691 6.212 -9.230
283 HD11 ILE 42 1HD1 ILE 42 18.683 4.782 -6.675
284 HD12 ILE 42 2HD1 ILE 42 19.198 6.164 -7.676
285 HD13 ILE 42 3HD1 ILE 42 19.105 6.328 -5.908
286 H ARG 43 H ARG 43 14.377 3.363 -7.674
287 HA ARG 43 HA ARG 43 13.462 2.893 -10.481
288 HB2 ARG 43 2HB ARG 43 12.569 1.617 -7.864
289 HB3 ARG 43 3HB ARG 43 11.960 1.207 -9.473
290 HG2 ARG 43 2HG ARG 43 14.863 0.871 -8.587
291 HG3 ARG 43 3HG ARG 43 13.638 -0.406 -8.567
292 HD2 ARG 43 2HD ARG 43 14.791 -0.763 -10.582
293 HD3 ARG 43 3HD ARG 43 13.309 0.072 -11.078
294 HE ARG 43 HE ARG 43 15.024 2.153 -10.770
295 HH11 ARG 43 1HH1 ARG 43 15.389 -0.935 -12.452
296 HH12 ARG 43 2HH1 ARG 43 16.524 -0.293 -13.619
297 HH21 ARG 43 1HH2 ARG 43 16.506 2.954 -12.282
298 HH22 ARG 43 2HH2 ARG 43 17.152 1.906 -13.529
299 H ASP 44 H ASP 44 12.770 4.509 -7.422
300 HA ASP 44 HA ASP 44 10.680 6.052 -8.743
301 HB2 ASP 44 2HB ASP 44 10.060 4.066 -6.579
302 HB3 ASP 44 3HB ASP 44 9.150 5.585 -6.665
303 H ILE 45 H ILE 45 9.758 7.794 -7.397
304 HA ILE 45 HA ILE 45 11.585 8.744 -5.275
305 HB ILE 45 HB ILE 45 12.262 9.512 -7.671
306 HG12 ILE 45 2HG1 ILE 45 12.623 11.900 -6.886
307 HG13 ILE 45 3HG1 ILE 45 11.725 11.485 -5.418
308 HG21 ILE 45 1HG2 ILE 45 9.923 10.004 -8.408
309 HG22 ILE 45 2HG2 ILE 45 9.859 11.336 -7.229
310 HG23 ILE 45 3HG2 ILE 45 11.011 11.402 -8.574
311 HD11 ILE 45 1HD1 ILE 45 13.357 9.637 -4.990
312 HD12 ILE 45 2HD1 ILE 45 14.247 10.099 -6.456
313 HD13 ILE 45 3HD1 ILE 45 14.165 11.222 -5.080
314 H ASP 46 H ASP 46 10.630 10.574 -4.067
315 HA ASP 46 HA ASP 46 7.817 11.229 -4.598
316 HB2 ASP 46 2HB ASP 46 7.864 9.061 -3.242
317 HB3 ASP 46 3HB ASP 46 8.644 9.968 -1.947
318 H LEU 47 H LEU 47 9.424 13.131 -4.987
319 HA LEU 47 HA LEU 47 10.462 14.520 -2.687
320 HB2 LEU 47 2HB LEU 47 11.363 14.955 -4.883
321 HB3 LEU 47 3HB LEU 47 9.754 15.371 -5.518
322 HG LEU 47 HG LEU 47 9.671 17.345 -4.006
323 HD11 LEU 47 1HD1 LEU 47 11.785 18.095 -2.928
324 HD12 LEU 47 2HD1 LEU 47 11.191 16.579 -2.222
325 HD13 LEU 47 3HD1 LEU 47 12.548 16.549 -3.374
326 HD21 LEU 47 1HD2 LEU 47 12.144 17.179 -5.779
327 HD22 LEU 47 2HD2 LEU 47 10.494 17.547 -6.326
328 HD23 LEU 47 3HD2 LEU 47 11.340 18.676 -5.240
329 H LYS 48 H LYS 48 9.471 15.929 -1.266
330 HA LYS 48 HA LYS 48 6.656 16.669 -1.858
331 HB2 LYS 48 2HB LYS 48 7.945 15.707 0.727
332 HB3 LYS 48 3HB LYS 48 6.331 16.425 0.628
333 HG2 LYS 48 2HG LYS 48 5.590 14.613 -0.874
334 HG3 LYS 48 3HG LYS 48 7.235 13.929 -0.890
335 HD2 LYS 48 2HD LYS 48 7.078 13.664 1.603
336 HD3 LYS 48 3HD LYS 48 5.372 14.157 1.511
337 HE2 LYS 48 2HE LYS 48 6.662 11.756 0.155
338 HE3 LYS 48 3HE LYS 48 5.572 11.713 1.553
339 HZ1 LYS 48 1HZ LYS 48 3.849 12.626 0.150
340 HZ2 LYS 48 2HZ LYS 48 4.869 12.643 -1.150
341 HZ3 LYS 48 3HZ LYS 48 4.431 11.218 -0.480
342 H ASN 49 H ASN 49 6.264 18.776 -1.788
343 HA ASN 49 HA ASN 49 7.517 20.485 0.193
344 HB2 ASN 49 2HB ASN 49 8.364 22.112 -1.598
345 HB3 ASN 49 3HB ASN 49 9.333 20.666 -1.287
346 HD21 ASN 49 1HD2 ASN 49 9.467 20.592 -4.849
347 HD22 ASN 49 2HD2 ASN 49 10.271 21.204 -3.419
348 H ARG 50 H ARG 50 5.481 20.170 -2.730
349 HA ARG 50 HA ARG 50 3.957 22.583 -2.068
350 HB2 ARG 50 2HB ARG 50 4.361 21.994 -4.400
351 HB3 ARG 50 3HB ARG 50 3.624 20.400 -4.166
352 HG2 ARG 50 2HG ARG 50 2.095 21.973 -5.310
353 HG3 ARG 50 3HG ARG 50 1.429 21.428 -3.765
354 HD2 ARG 50 2HD ARG 50 2.198 23.535 -2.690
355 HD3 ARG 50 3HD ARG 50 2.903 24.060 -4.228
356 HE ARG 50 HE ARG 50 0.789 24.601 -5.024
357 HH11 ARG 50 1HH1 ARG 50 0.504 22.741 -2.036
358 HH12 ARG 50 2HH1 ARG 50 -1.199 23.081 -1.841
359 HH21 ARG 50 1HH2 ARG 50 -1.438 25.037 -4.747
360 HH22 ARG 50 2HH2 ARG 50 -2.308 24.364 -3.390
361 H ARG 51 H ARG 51 3.884 19.195 -1.307
362 HA ARG 51 HA ARG 51 1.047 19.160 -0.599
363 HB2 ARG 51 2HB ARG 51 3.292 17.134 -0.441
364 HB3 ARG 51 3HB ARG 51 1.677 16.831 0.247
365 HG2 ARG 51 2HG ARG 51 0.614 17.223 -1.901
366 HG3 ARG 51 3HG ARG 51 2.168 17.649 -2.646
367 HD2 ARG 51 2HD ARG 51 1.686 14.953 -1.327
368 HD3 ARG 51 3HD ARG 51 1.274 15.259 -3.025
369 HE ARG 51 HE ARG 51 3.950 16.096 -2.612
370 HH11 ARG 51 1HH1 ARG 51 2.029 13.131 -2.636
371 HH12 ARG 51 2HH1 ARG 51 3.346 12.145 -3.227
372 HH21 ARG 51 1HH2 ARG 51 5.666 14.761 -3.393
373 HH22 ARG 51 2HH2 ARG 51 5.408 13.046 -3.550
374 H GLY 52 H GLY 52 3.290 20.892 0.772
375 HA2 GLY 52 2HA GLY 52 3.033 21.985 2.833
376 HA3 GLY 52 3HA GLY 52 2.051 20.641 3.436
377 H GLY 53 H GLY 53 3.802 21.541 5.186
378 HA2 GLY 53 2HA GLY 53 5.422 20.771 6.636
379 HA3 GLY 53 3HA GLY 53 5.633 19.341 5.616
380 HA PRO 54 HA PRO 54 9.320 22.239 5.126
381 HB2 PRO 54 2HB PRO 54 11.214 20.542 6.189
382 HB3 PRO 54 3HB PRO 54 10.308 21.743 7.164
383 HG2 PRO 54 2HG PRO 54 9.784 18.779 6.848
384 HG3 PRO 54 3HG PRO 54 9.731 19.773 8.340
385 HD2 PRO 54 2HD PRO 54 7.477 19.079 6.929
386 HD3 PRO 54 3HD PRO 54 7.611 20.629 7.810
387 HA PRO 55 HA PRO 55 10.408 19.995 1.477
388 HB2 PRO 55 2HB PRO 55 13.036 20.696 1.057
389 HB3 PRO 55 3HB PRO 55 11.656 21.801 0.776
390 HG2 PRO 55 2HG PRO 55 13.491 21.656 3.178
391 HG3 PRO 55 3HG PRO 55 12.880 23.109 2.329
392 HD2 PRO 55 2HD PRO 55 11.757 22.168 4.653
393 HD3 PRO 55 3HD PRO 55 10.786 22.965 3.380
394 H PHE 56 H PHE 56 10.649 17.815 1.428
395 HA PHE 56 HA PHE 56 13.155 16.552 2.230
396 HB2 PHE 56 2HB PHE 56 12.367 15.277 4.017
397 HB3 PHE 56 3HB PHE 56 11.606 16.823 4.354
398 HD1 PHE 56 HD1 PHE 56 11.109 13.361 4.163
399 HD2 PHE 56 HD2 PHE 56 9.138 17.060 3.199
400 HE1 PHE 56 HE1 PHE 56 8.905 12.259 4.449
401 HE2 PHE 56 HE2 PHE 56 6.940 15.933 3.392
402 HZ PHE 56 HZ PHE 56 6.827 13.534 4.011
403 H ALA 57 H ALA 57 12.781 14.050 1.756
404 HA ALA 57 HA ALA 57 10.666 13.560 -0.209
405 HB1 ALA 57 1HB ALA 57 12.225 13.158 -2.064
406 HB2 ALA 57 2HB ALA 57 12.349 14.844 -1.508
407 HB3 ALA 57 3HB ALA 57 13.592 13.664 -1.041
408 H PHE 58 H PHE 58 10.719 11.385 -1.068
409 HA PHE 58 HA PHE 58 12.471 9.534 0.427
410 HB2 PHE 58 2HB PHE 58 9.573 9.352 -0.114
411 HB3 PHE 58 3HB PHE 58 10.513 7.871 -0.300
412 HD1 PHE 58 HD1 PHE 58 9.709 10.606 2.126
413 HD2 PHE 58 HD2 PHE 58 11.242 6.635 1.535
414 HE1 PHE 58 HE1 PHE 58 9.751 10.254 4.584
415 HE2 PHE 58 HE2 PHE 58 11.315 6.295 3.995
416 HZ PHE 58 HZ PHE 58 10.570 8.100 5.513
417 H VAL 59 H VAL 59 13.258 7.663 -0.596
418 HA VAL 59 HA VAL 59 13.340 7.843 -3.563
419 HB VAL 59 HB VAL 59 15.714 7.472 -1.693
420 HG11 VAL 59 1HG1 VAL 59 17.022 7.646 -3.794
421 HG12 VAL 59 2HG1 VAL 59 15.951 6.228 -3.790
422 HG13 VAL 59 3HG1 VAL 59 15.501 7.675 -4.724
423 HG21 VAL 59 1HG2 VAL 59 16.466 9.658 -2.581
424 HG22 VAL 59 2HG2 VAL 59 14.915 9.832 -3.438
425 HG23 VAL 59 3HG2 VAL 59 14.958 9.798 -1.661
426 H GLU 60 H GLU 60 13.432 5.836 -4.609
427 HA GLU 60 HA GLU 60 13.460 3.457 -2.810
428 HB2 GLU 60 2HB GLU 60 11.181 3.894 -3.555
429 HB3 GLU 60 3HB GLU 60 11.716 3.993 -5.247
430 HG2 GLU 60 2HG GLU 60 12.377 1.660 -5.251
431 HG3 GLU 60 3HG GLU 60 12.093 1.527 -3.508
432 H PHE 61 H PHE 61 15.172 2.246 -3.170
433 HA PHE 61 HA PHE 61 16.528 2.345 -5.768
434 HB2 PHE 61 2HB PHE 61 17.255 1.198 -3.076
435 HB3 PHE 61 3HB PHE 61 18.198 0.879 -4.533
436 HD1 PHE 61 HD1 PHE 61 19.838 2.390 -5.286
437 HD2 PHE 61 HD2 PHE 61 16.904 3.678 -2.413
438 HE1 PHE 61 HE1 PHE 61 21.085 4.506 -4.951
439 HE2 PHE 61 HE2 PHE 61 18.139 5.802 -2.106
440 HZ PHE 61 HZ PHE 61 20.240 6.211 -3.369
441 H GLU 62 H GLU 62 17.236 0.438 -6.921
442 HA GLU 62 HA GLU 62 15.195 -1.591 -7.153
443 HB2 GLU 62 2HB GLU 62 16.564 -0.865 -9.054
444 HB3 GLU 62 3HB GLU 62 18.038 -1.415 -8.235
445 HG2 GLU 62 2HG GLU 62 17.241 -3.736 -8.287
446 HG3 GLU 62 3HG GLU 62 15.698 -3.209 -8.997
447 H ASP 63 H ASP 63 18.095 -1.193 -5.231
448 HA ASP 63 HA ASP 63 17.473 -3.634 -3.777
449 HB2 ASP 63 2HB ASP 63 19.896 -4.427 -3.947
450 HB3 ASP 63 3HB ASP 63 18.853 -4.686 -5.349
451 HA PRO 64 HA PRO 64 18.886 -1.235 -0.414
452 HB2 PRO 64 2HB PRO 64 19.736 -3.118 1.383
453 HB3 PRO 64 3HB PRO 64 18.011 -2.886 0.959
454 HG2 PRO 64 2HG PRO 64 19.944 -4.956 -0.112
455 HG3 PRO 64 3HG PRO 64 18.241 -5.180 0.421
456 HD2 PRO 64 2HD PRO 64 18.957 -4.897 -2.214
457 HD3 PRO 64 3HD PRO 64 17.402 -4.290 -1.576
458 H ARG 65 H ARG 65 21.050 -3.041 -2.351
459 HA ARG 65 HA ARG 65 23.455 -2.748 -0.805
460 HB2 ARG 65 2HB ARG 65 22.754 -4.256 -2.918
461 HB3 ARG 65 3HB ARG 65 23.483 -2.918 -3.811
462 HG2 ARG 65 2HG ARG 65 24.789 -4.671 -1.682
463 HG3 ARG 65 3HG ARG 65 25.167 -4.629 -3.411
464 HD2 ARG 65 2HD ARG 65 25.666 -2.438 -1.362
465 HD3 ARG 65 3HD ARG 65 26.882 -3.440 -2.158
466 HE ARG 65 HE ARG 65 25.525 -2.199 -4.246
467 HH11 ARG 65 1HH1 ARG 65 27.398 -1.192 -1.422
468 HH12 ARG 65 2HH1 ARG 65 27.847 0.346 -2.117
469 HH21 ARG 65 1HH2 ARG 65 26.125 -0.192 -5.129
470 HH22 ARG 65 2HH2 ARG 65 27.202 0.876 -4.249
471 H ASP 66 H ASP 66 22.148 -0.971 -3.678
472 HA ASP 66 HA ASP 66 24.282 0.958 -3.631
473 HB2 ASP 66 2HB ASP 66 21.600 0.899 -5.038
474 HB3 ASP 66 3HB ASP 66 22.796 2.180 -5.257
475 H ALA 67 H ALA 67 21.309 0.711 -1.852
476 HA ALA 67 HA ALA 67 20.883 3.504 -1.387
477 HB1 ALA 67 1HB ALA 67 19.469 2.706 0.470
478 HB2 ALA 67 2HB ALA 67 19.179 1.753 -1.008
479 HB3 ALA 67 3HB ALA 67 20.164 1.078 0.311
480 H GLU 68 H GLU 68 23.187 1.167 -0.108
481 HA GLU 68 HA GLU 68 23.749 2.621 2.327
482 HB2 GLU 68 2HB GLU 68 24.206 0.219 2.113
483 HB3 GLU 68 3HB GLU 68 25.312 0.529 0.764
484 HG2 GLU 68 2HG GLU 68 26.625 0.150 2.749
485 HG3 GLU 68 3HG GLU 68 26.785 1.845 2.290
486 H ASP 69 H ASP 69 24.936 2.732 -1.025
487 HA ASP 69 HA ASP 69 27.227 4.389 -0.391
488 HB2 ASP 69 2HB ASP 69 25.791 3.750 -2.984
489 HB3 ASP 69 3HB ASP 69 27.223 4.786 -2.883
490 H ALA 70 H ALA 70 23.867 5.025 -1.387
491 HA ALA 70 HA ALA 70 24.289 7.843 -1.837
492 HB1 ALA 70 1HB ALA 70 21.816 7.908 -1.866
493 HB2 ALA 70 2HB ALA 70 22.443 6.576 -2.864
494 HB3 ALA 70 3HB ALA 70 21.765 6.236 -1.256
495 H VAL 71 H VAL 71 23.630 5.841 1.001
496 HA VAL 71 HA VAL 71 22.838 8.138 2.635
497 HB VAL 71 HB VAL 71 23.368 5.194 3.166
498 HG11 VAL 71 1HG1 VAL 71 24.082 6.418 5.184
499 HG12 VAL 71 2HG1 VAL 71 22.564 7.348 5.177
500 HG13 VAL 71 3HG1 VAL 71 22.534 5.603 5.480
501 HG21 VAL 71 1HG2 VAL 71 21.248 5.880 2.013
502 HG22 VAL 71 2HG2 VAL 71 20.955 5.161 3.613
503 HG23 VAL 71 3HG2 VAL 71 20.866 6.925 3.396
504 H SER 72 H SER 72 25.648 5.839 2.496
505 HA SER 72 HA SER 72 27.055 7.222 4.587
506 HB2 SER 72 2HB SER 72 27.348 4.828 4.114
507 HB3 SER 72 3HB SER 72 27.995 5.219 2.504
508 HG SER 72 HG SER 72 29.110 5.933 5.017
509 H GLY 73 H GLY 73 26.695 7.864 1.193
510 HA2 GLY 73 2HA GLY 73 29.335 9.212 1.030
511 HA3 GLY 73 3HA GLY 73 28.300 8.743 -0.321
512 H ARG 74 H ARG 74 26.248 10.190 1.962
513 HA ARG 74 HA ARG 74 26.820 12.935 1.077
514 HB2 ARG 74 2HB ARG 74 25.730 11.971 -0.869
515 HB3 ARG 74 3HB ARG 74 24.370 11.415 0.123
516 HG2 ARG 74 2HG ARG 74 23.619 13.658 0.523
517 HG3 ARG 74 3HG ARG 74 25.150 14.350 -0.060
518 HD2 ARG 74 2HD ARG 74 23.303 14.571 -1.717
519 HD3 ARG 74 3HD ARG 74 24.678 13.655 -2.331
520 HE ARG 74 HE ARG 74 22.024 12.547 -1.529
521 HH11 ARG 74 1HH1 ARG 74 25.193 12.112 -3.035
522 HH12 ARG 74 2HH1 ARG 74 24.759 10.599 -3.790
523 HH21 ARG 74 1HH2 ARG 74 21.475 10.574 -2.558
524 HH22 ARG 74 2HH2 ARG 74 22.673 9.733 -3.519
525 H ASP 75 H ASP 75 25.308 10.729 3.292
526 HA ASP 75 HA ASP 75 23.377 12.546 4.395
527 HB2 ASP 75 2HB ASP 75 23.373 10.090 4.752
528 HB3 ASP 75 3HB ASP 75 24.864 10.233 5.701
529 H GLY 76 H GLY 76 23.510 13.961 6.153
530 HA2 GLY 76 2HA GLY 76 24.446 15.344 7.703
531 HA3 GLY 76 3HA GLY 76 25.715 14.128 7.932
532 H TYR 77 H TYR 77 24.769 16.410 5.245
533 HA TYR 77 HA TYR 77 27.646 17.038 5.032
534 HB2 TYR 77 2HB TYR 77 27.088 16.034 3.042
535 HB3 TYR 77 3HB TYR 77 25.519 16.834 2.948
536 HD1 TYR 77 HD1 TYR 77 29.189 17.584 2.863
537 HD2 TYR 77 HD2 TYR 77 25.234 18.747 1.644
538 HE1 TYR 77 HE1 TYR 77 30.159 19.366 1.423
539 HE2 TYR 77 HE2 TYR 77 26.191 20.518 0.201
540 HH TYR 77 HH TYR 77 29.723 21.084 -0.031
541 H ASP 78 H ASP 78 28.459 19.006 4.879
542 HA ASP 78 HA ASP 78 27.202 20.962 6.482
543 HB2 ASP 78 2HB ASP 78 29.554 20.778 6.506
544 HB3 ASP 78 3HB ASP 78 29.673 20.945 4.750
545 H TYR 79 H TYR 79 25.472 22.071 5.965
546 HA TYR 79 HA TYR 79 25.471 23.523 3.375
547 HB2 TYR 79 2HB TYR 79 23.737 21.921 3.320
548 HB3 TYR 79 3HB TYR 79 23.206 22.320 4.953
549 HD1 TYR 79 HD1 TYR 79 22.970 23.166 1.420
550 HD2 TYR 79 HD2 TYR 79 22.041 24.473 5.403
551 HE1 TYR 79 HE1 TYR 79 21.296 24.747 0.498
552 HE2 TYR 79 HE2 TYR 79 20.339 26.045 4.494
553 HH TYR 79 HH TYR 79 19.732 26.349 0.980
554 H ASP 80 H ASP 80 24.183 25.597 3.444
555 HA ASP 80 HA ASP 80 25.395 27.323 5.309
556 HB2 ASP 80 2HB ASP 80 24.726 28.164 3.192
557 HB3 ASP 80 3HB ASP 80 23.048 27.670 3.444
558 H GLY 81 H GLY 81 25.105 26.895 7.459
559 HA2 GLY 81 2HA GLY 81 24.089 27.350 9.475
560 HA3 GLY 81 3HA GLY 81 22.606 27.822 8.622
561 H TYR 82 H TYR 82 23.288 24.858 7.321
562 HA TYR 82 HA TYR 82 22.075 23.293 9.517
563 HB2 TYR 82 2HB TYR 82 20.830 23.651 6.780
564 HB3 TYR 82 3HB TYR 82 20.393 22.365 7.900
565 HD1 TYR 82 HD1 TYR 82 18.992 22.748 9.802
566 HD2 TYR 82 HD2 TYR 82 20.400 26.029 7.409
567 HE1 TYR 82 HE1 TYR 82 17.368 24.254 10.924
568 HE2 TYR 82 HE2 TYR 82 18.761 27.547 8.519
569 HH TYR 82 HH TYR 82 16.538 26.376 11.079
570 H ARG 83 H ARG 83 21.500 20.968 8.254
571 HA ARG 83 HA ARG 83 24.006 20.056 6.948
572 HB2 ARG 83 2HB ARG 83 24.041 19.855 9.549
573 HB3 ARG 83 3HB ARG 83 22.807 18.609 9.331
574 HG2 ARG 83 2HG ARG 83 24.817 17.375 9.342
575 HG3 ARG 83 3HG ARG 83 24.467 17.571 7.610
576 HD2 ARG 83 2HD ARG 83 26.775 18.101 7.858
577 HD3 ARG 83 3HD ARG 83 25.965 19.663 7.693
578 HE ARG 83 HE ARG 83 27.001 18.457 10.236
579 HH11 ARG 83 1HH1 ARG 83 25.887 21.295 8.433
580 HH12 ARG 83 2HH1 ARG 83 26.468 22.421 9.634
581 HH21 ARG 83 1HH2 ARG 83 27.712 19.952 11.793
582 HH22 ARG 83 2HH2 ARG 83 27.480 21.666 11.532
583 H LEU 84 H LEU 84 23.564 18.595 5.358
584 HA LEU 84 HA LEU 84 20.851 18.044 4.618
585 HB2 LEU 84 2HB LEU 84 23.572 17.045 3.750
586 HB3 LEU 84 3HB LEU 84 22.115 16.244 3.159
587 HG LEU 84 HG LEU 84 22.949 17.941 1.583
588 HD11 LEU 84 1HD1 LEU 84 20.528 17.373 1.723
589 HD12 LEU 84 2HD1 LEU 84 20.289 18.767 2.805
590 HD13 LEU 84 3HD1 LEU 84 20.832 19.023 1.135
591 HD21 LEU 84 1HD2 LEU 84 23.869 19.541 3.274
592 HD22 LEU 84 2HD2 LEU 84 22.812 20.319 2.073
593 HD23 LEU 84 3HD2 LEU 84 22.207 20.000 3.707
594 H ARG 85 H ARG 85 19.694 16.082 4.623
595 HA ARG 85 HA ARG 85 20.743 13.961 6.454
596 HB2 ARG 85 2HB ARG 85 17.898 15.007 6.242
597 HB3 ARG 85 3HB ARG 85 18.407 13.587 7.174
598 HG2 ARG 85 2HG ARG 85 19.896 15.006 8.551
599 HG3 ARG 85 3HG ARG 85 19.427 16.429 7.601
600 HD2 ARG 85 2HD ARG 85 18.159 16.349 9.698
601 HD3 ARG 85 3HD ARG 85 17.078 16.146 8.309
602 HE ARG 85 HE ARG 85 18.031 13.635 9.468
603 HH11 ARG 85 1HH1 ARG 85 15.577 16.165 9.628
604 HH12 ARG 85 2HH1 ARG 85 14.359 15.122 10.318
605 HH21 ARG 85 1HH2 ARG 85 16.444 12.278 10.359
606 HH22 ARG 85 2HH2 ARG 85 14.865 12.912 10.763
607 H VAL 86 H VAL 86 20.927 12.058 5.541
608 HA VAL 86 HA VAL 86 19.005 11.220 3.469
609 HB VAL 86 HB VAL 86 22.017 11.022 3.065
610 HG11 VAL 86 1HG1 VAL 86 20.759 9.140 2.095
611 HG12 VAL 86 2HG1 VAL 86 19.639 10.278 1.313
612 HG13 VAL 86 3HG1 VAL 86 21.346 10.215 0.808
613 HG21 VAL 86 1HG2 VAL 86 19.963 12.788 1.682
614 HG22 VAL 86 2HG2 VAL 86 21.311 13.340 2.708
615 HG23 VAL 86 3HG2 VAL 86 21.640 12.556 1.148
616 H GLU 87 H GLU 87 18.198 9.978 5.234
617 HA GLU 87 HA GLU 87 19.818 7.556 5.813
618 HB2 GLU 87 2HB GLU 87 19.245 7.734 8.208
619 HB3 GLU 87 3HB GLU 87 20.220 9.117 7.668
620 HG2 GLU 87 2HG GLU 87 18.124 10.461 7.411
621 HG3 GLU 87 3HG GLU 87 17.189 9.089 8.023
622 H PHE 88 H PHE 88 18.543 5.756 6.622
623 HA PHE 88 HA PHE 88 16.013 5.618 5.271
624 HB2 PHE 88 2HB PHE 88 16.045 3.261 6.395
625 HB3 PHE 88 3HB PHE 88 17.105 3.666 5.044
626 HD1 PHE 88 HD1 PHE 88 19.493 3.979 5.324
627 HD2 PHE 88 HD2 PHE 88 16.975 2.935 8.651
628 HE1 PHE 88 HE1 PHE 88 21.500 3.347 6.648
629 HE2 PHE 88 HE2 PHE 88 18.975 2.299 9.967
630 HZ PHE 88 HZ PHE 88 21.237 2.506 8.964
631 HA PRO 89 HA PRO 89 13.083 6.430 8.412
632 HB2 PRO 89 2HB PRO 89 11.112 4.574 7.849
633 HB3 PRO 89 3HB PRO 89 11.402 6.057 6.875
634 HG2 PRO 89 2HG PRO 89 12.340 3.229 6.335
635 HG3 PRO 89 3HG PRO 89 11.645 4.419 5.187
636 HD2 PRO 89 2HD PRO 89 14.334 3.984 5.401
637 HD3 PRO 89 3HD PRO 89 13.665 5.610 5.051
638 H5' A 90 1H5* A 90 2.637 16.406 10.582
639 H5'' A 90 2H5* A 90 3.300 14.978 11.399
640 H4' A 90 H4* A 90 4.997 16.630 11.507
641 H3' A 90 H3* A 90 4.124 15.532 13.834
642 H2' A 90 1H2* A 90 2.508 17.054 14.523
643 HO2' A 90 2HO* A 90 4.196 17.357 16.065
644 H1' A 90 H1* A 90 3.675 19.570 13.570
645 H8 A 90 H8 A 90 0.975 18.704 15.072
646 H61 A 90 1H6 A 90 -3.005 19.951 10.487
647 H62 A 90 2H6 A 90 -2.842 19.661 12.207
648 H2 A 90 H2 A 90 1.072 19.648 8.731
649 HO5' A 90 H5T A 90 1.145 15.461 12.037
650 H5' A 91 1H5* A 91 6.616 17.940 11.333
651 H5'' A 91 2H5* A 91 7.113 16.371 10.663
652 H4' A 91 H4* A 91 8.330 17.973 9.425
653 H3' A 91 H3* A 91 9.696 16.077 10.818
654 H2' A 91 1H2* A 91 10.377 17.165 12.744
655 HO2' A 91 2HO* A 91 12.326 17.165 11.393
656 H1' A 91 H1* A 91 10.531 19.944 11.901
657 H8 A 91 H8 A 91 10.580 18.250 14.662
658 H61 A 91 1H6 A 91 5.444 20.672 17.141
659 H62 A 91 2H6 A 91 6.915 19.787 17.478
660 H2 A 91 H2 A 91 5.373 21.472 12.763
661 H5' C 92 1H5* C 92 10.562 15.285 6.521
662 H5'' C 92 2H5* C 92 9.305 16.014 7.537
663 H4' C 92 H4* C 92 8.343 14.107 6.402
664 H3' C 92 H3* C 92 8.300 14.425 9.172
665 H2' C 92 1H2* C 92 9.960 12.813 9.622
666 HO2' C 92 2HO* C 92 8.902 10.852 10.184
667 H1' C 92 H1* C 92 8.853 11.103 7.367
668 H41 C 92 1H4 C 92 14.245 7.881 8.472
669 H42 C 92 2H4 C 92 15.085 9.331 8.982
670 H5 C 92 H5 C 92 13.991 11.515 9.134
671 H6 C 92 H6 C 92 11.889 12.701 8.775
672 H5' A 93 1H5* A 93 3.708 12.947 6.254
673 H5'' A 93 2H5* A 93 4.980 11.713 6.350
674 H4' A 93 H4* A 93 4.671 13.376 3.839
675 H3' A 93 H3* A 93 2.420 12.137 4.670
676 H2' A 93 1H2* A 93 3.484 10.090 5.312
677 HO2' A 93 2HO* A 93 2.569 9.814 2.627
678 H1' A 93 H1* A 93 4.951 9.964 2.683
679 H8 A 93 H8 A 93 5.131 9.501 6.469
680 H61 A 93 1H6 A 93 8.920 4.760 5.120
681 H62 A 93 2H6 A 93 8.052 5.579 6.404
682 H2 A 93 H2 A 93 8.056 7.009 1.364
683 H5' A 94 1H5* A 94 0.008 15.142 2.039
684 H5'' A 94 2H5* A 94 0.599 15.091 3.707
685 H4' A 94 H4* A 94 -1.768 15.161 3.866
686 H3' A 94 H3* A 94 -0.432 12.660 4.611
687 H2' A 94 1H2* A 94 -2.067 11.100 4.092
688 HO2' A 94 2HO* A 94 -3.633 12.304 5.403
689 H1' A 94 H1* A 94 -3.402 12.221 2.012
690 H8 A 94 H8 A 94 -0.903 10.022 2.945
691 H61 A 94 1H6 A 94 1.927 10.463 -2.542
692 H62 A 94 2H6 A 94 1.781 9.526 -1.067
693 H2 A 94 H2 A 94 -0.806 13.947 -2.124
694 H5' A 95 1H5* A 95 1.444 12.730 6.861
695 H5'' A 95 2H5* A 95 0.127 11.625 6.399
696 H4' A 95 H4* A 95 1.250 11.819 9.231
697 H3' A 95 H3* A 95 2.845 10.932 7.269
698 HO3' A 95 H3T A 95 3.448 9.200 8.744
699 H2' A 95 1H2* A 95 1.305 9.591 6.088
700 HO2' A 95 2HO* A 95 2.966 8.146 6.709
701 H1' A 95 H1* A 95 0.066 8.299 8.458
702 H8 A 95 H8 A 95 -0.081 8.113 5.121
703 H61 A 95 1H6 A 95 -6.102 9.487 4.744
704 H62 A 95 2H6 A 95 -4.732 8.790 3.908
705 H2 A 95 H2 A 95 -4.641 10.804 8.742
Start of MODEL 13
1 H VAL 6 H1 VAL 6 -2.369 10.325 3.875
2 HA VAL 6 HA VAL 6 -2.640 8.709 2.172
3 HB VAL 6 HB VAL 6 0.210 9.323 1.349
4 HG11 VAL 6 1HG1 VAL 6 -2.030 7.654 0.115
5 HG12 VAL 6 2HG1 VAL 6 -0.433 7.933 -0.615
6 HG13 VAL 6 3HG1 VAL 6 -0.565 7.025 0.904
7 HG21 VAL 6 1HG2 VAL 6 -2.410 10.176 0.045
8 HG22 VAL 6 2HG2 VAL 6 -1.168 11.255 0.737
9 HG23 VAL 6 3HG2 VAL 6 -0.805 10.298 -0.706
10 H ILE 7 H ILE 7 -2.103 6.547 2.616
11 HA ILE 7 HA ILE 7 -1.187 6.170 5.295
12 HB ILE 7 HB ILE 7 -1.752 4.215 3.033
13 HG12 ILE 7 2HG1 ILE 7 -3.426 5.103 5.428
14 HG13 ILE 7 3HG1 ILE 7 -3.653 5.667 3.754
15 HG21 ILE 7 1HG2 ILE 7 -1.935 2.504 4.831
16 HG22 ILE 7 2HG2 ILE 7 -0.304 3.177 4.746
17 HG23 ILE 7 3HG2 ILE 7 -1.412 3.722 6.025
18 HD11 ILE 7 1HD1 ILE 7 -3.975 2.811 4.755
19 HD12 ILE 7 2HD1 ILE 7 -5.255 3.908 4.210
20 HD13 ILE 7 3HD1 ILE 7 -4.053 3.295 3.049
21 H ARG 8 H ARG 8 0.436 5.917 2.142
22 HA ARG 8 HA ARG 8 3.023 5.730 3.468
23 HB2 ARG 8 2HB ARG 8 2.264 3.362 3.464
24 HB3 ARG 8 3HB ARG 8 2.016 3.445 1.714
25 HG2 ARG 8 2HG ARG 8 4.130 2.325 2.265
26 HG3 ARG 8 3HG ARG 8 4.434 3.814 1.363
27 HD2 ARG 8 2HD ARG 8 6.013 3.634 3.212
28 HD3 ARG 8 3HD ARG 8 4.930 5.000 3.486
29 HE ARG 8 HE ARG 8 4.600 2.310 4.782
30 HH11 ARG 8 1HH1 ARG 8 4.531 5.843 4.971
31 HH12 ARG 8 2HH1 ARG 8 4.001 5.855 6.640
32 HH21 ARG 8 1HH2 ARG 8 3.955 2.360 6.964
33 HH22 ARG 8 2HH2 ARG 8 3.684 3.889 7.761
34 H GLY 9 H GLY 9 4.816 5.973 1.932
35 HA2 GLY 9 2HA GLY 9 4.325 7.836 -0.150
36 HA3 GLY 9 3HA GLY 9 5.824 6.977 0.123
37 HA PRO 10 HA PRO 10 3.702 5.233 -3.739
38 HB2 PRO 10 2HB PRO 10 5.425 6.313 -5.614
39 HB3 PRO 10 3HB PRO 10 3.881 7.077 -5.131
40 HG2 PRO 10 2HG PRO 10 6.677 7.709 -4.165
41 HG3 PRO 10 3HG PRO 10 5.357 8.843 -4.591
42 HD2 PRO 10 2HD PRO 10 5.942 8.151 -2.000
43 HD3 PRO 10 3HD PRO 10 4.269 8.502 -2.543
44 H ALA 11 H ALA 11 4.658 3.407 -4.822
45 HA ALA 11 HA ALA 11 7.486 2.822 -4.372
46 HB1 ALA 11 1HB ALA 11 7.020 0.786 -3.038
47 HB2 ALA 11 2HB ALA 11 6.528 2.264 -2.179
48 HB3 ALA 11 3HB ALA 11 5.298 1.242 -2.964
49 H GLY 12 H GLY 12 8.102 0.708 -5.252
50 HA2 GLY 12 2HA GLY 12 6.200 -0.705 -6.962
51 HA3 GLY 12 3HA GLY 12 7.465 0.193 -7.833
52 H ASN 13 H ASN 13 8.644 -0.725 -4.810
53 HA ASN 13 HA ASN 13 9.568 -3.406 -5.597
54 HB2 ASN 13 2HB ASN 13 11.170 -1.739 -6.595
55 HB3 ASN 13 3HB ASN 13 11.461 -1.100 -4.968
56 HD21 ASN 13 1HD2 ASN 13 14.247 -3.276 -4.939
57 HD22 ASN 13 2HD2 ASN 13 13.689 -1.624 -5.045
58 H ASN 14 H ASN 14 10.599 -4.519 -3.757
59 HA ASN 14 HA ASN 14 9.276 -3.889 -1.263
60 HB2 ASN 14 2HB ASN 14 11.445 -5.907 -1.940
61 HB3 ASN 14 3HB ASN 14 10.515 -5.873 -0.435
62 HD21 ASN 14 1HD2 ASN 14 9.012 -8.338 -2.886
63 HD22 ASN 14 2HD2 ASN 14 10.629 -8.091 -2.264
64 H ASP 15 H ASP 15 10.141 -3.042 0.626
65 HA ASP 15 HA ASP 15 11.350 -1.432 1.675
66 HB2 ASP 15 2HB ASP 15 13.682 -2.287 2.288
67 HB3 ASP 15 3HB ASP 15 12.276 -3.249 2.718
68 H CYS 16 H CYS 16 14.476 -1.453 1.032
69 HA CYS 16 HA CYS 16 15.900 -0.059 -0.022
70 HB2 CYS 16 2HB CYS 16 13.940 -0.477 -2.309
71 HB3 CYS 16 3HB CYS 16 15.539 0.287 -2.470
72 HG CYS 16 HG CYS 16 14.778 -2.723 -1.348
73 H ARG 17 H ARG 17 13.087 1.088 1.102
74 HA ARG 17 HA ARG 17 13.205 3.731 -0.170
75 HB2 ARG 17 2HB ARG 17 11.387 2.384 1.814
76 HB3 ARG 17 3HB ARG 17 11.395 4.157 1.672
77 HG2 ARG 17 2HG ARG 17 10.905 4.042 -0.703
78 HG3 ARG 17 3HG ARG 17 11.023 2.270 -0.690
79 HD2 ARG 17 2HD ARG 17 9.005 3.874 0.940
80 HD3 ARG 17 3HD ARG 17 8.661 3.171 -0.642
81 HE ARG 17 HE ARG 17 8.819 1.775 1.901
82 HH11 ARG 17 1HH1 ARG 17 9.166 1.438 -1.599
83 HH12 ARG 17 2HH1 ARG 17 8.874 -0.283 -1.592
84 HH21 ARG 17 1HH2 ARG 17 8.363 -0.467 1.883
85 HH22 ARG 17 2HH2 ARG 17 8.379 -1.347 0.369
86 H ILE 18 H ILE 18 14.028 5.546 0.667
87 HA ILE 18 HA ILE 18 14.921 5.566 3.495
88 HB ILE 18 HB ILE 18 17.072 6.566 2.907
89 HG12 ILE 18 2HG1 ILE 18 17.718 6.113 0.363
90 HG13 ILE 18 3HG1 ILE 18 15.990 6.399 0.098
91 HG21 ILE 18 1HG2 ILE 18 16.612 3.968 1.390
92 HG22 ILE 18 2HG2 ILE 18 18.148 4.571 2.046
93 HG23 ILE 18 3HG2 ILE 18 16.832 4.103 3.150
94 HD11 ILE 18 1HD1 ILE 18 17.389 8.457 -0.125
95 HD12 ILE 18 2HD1 ILE 18 16.201 8.618 1.182
96 HD13 ILE 18 3HD1 ILE 18 17.904 8.274 1.567
97 H TYR 19 H TYR 19 15.592 7.867 4.121
98 HA TYR 19 HA TYR 19 13.621 9.734 2.931
99 HB2 TYR 19 2HB TYR 19 12.635 9.400 4.903
100 HB3 TYR 19 3HB TYR 19 14.125 8.965 5.724
101 HD1 TYR 19 HD1 TYR 19 15.720 10.740 6.473
102 HD2 TYR 19 HD2 TYR 19 11.784 11.658 5.018
103 HE1 TYR 19 HE1 TYR 19 15.815 12.933 7.629
104 HE2 TYR 19 HE2 TYR 19 11.866 13.853 6.202
105 HH TYR 19 HH TYR 19 14.694 14.866 8.128
106 H VAL 20 H VAL 20 13.985 11.989 2.960
107 HA VAL 20 HA VAL 20 16.855 12.758 3.128
108 HB VAL 20 HB VAL 20 14.924 13.318 0.834
109 HG11 VAL 20 1HG1 VAL 20 16.876 14.504 -0.170
110 HG12 VAL 20 2HG1 VAL 20 16.249 15.302 1.288
111 HG13 VAL 20 3HG1 VAL 20 17.739 14.332 1.375
112 HG21 VAL 20 1HG2 VAL 20 15.946 11.072 0.741
113 HG22 VAL 20 2HG2 VAL 20 16.618 12.121 -0.525
114 HG23 VAL 20 3HG2 VAL 20 17.561 11.798 0.945
115 H GLY 21 H GLY 21 16.957 14.291 4.634
116 HA2 GLY 21 2HA GLY 21 14.763 16.321 4.768
117 HA3 GLY 21 3HA GLY 21 15.699 15.773 6.166
118 H ASN 22 H ASN 22 15.588 18.424 5.765
119 HA ASN 22 HA ASN 22 16.747 20.334 5.420
120 HB2 ASN 22 2HB ASN 22 18.403 19.069 6.839
121 HB3 ASN 22 3HB ASN 22 19.214 18.565 5.351
122 HD21 ASN 22 1HD2 ASN 22 21.217 21.445 5.449
123 HD22 ASN 22 2HD2 ASN 22 21.104 19.698 5.303
124 H LEU 23 H LEU 23 15.833 18.645 3.061
125 HA LEU 23 HA LEU 23 17.674 18.996 0.918
126 HB2 LEU 23 2HB LEU 23 15.687 17.453 0.986
127 HB3 LEU 23 3HB LEU 23 14.635 18.873 0.890
128 HG LEU 23 HG LEU 23 15.824 19.460 -1.302
129 HD11 LEU 23 1HD1 LEU 23 17.805 17.926 -0.921
130 HD12 LEU 23 2HD1 LEU 23 16.705 16.542 -1.062
131 HD13 LEU 23 3HD1 LEU 23 16.961 17.618 -2.455
132 HD21 LEU 23 1HD2 LEU 23 14.271 16.848 -1.063
133 HD22 LEU 23 2HD2 LEU 23 13.573 18.482 -1.197
134 HD23 LEU 23 3HD2 LEU 23 14.478 17.786 -2.560
135 HA PRO 24 HA PRO 24 17.249 23.423 0.674
136 HB2 PRO 24 2HB PRO 24 18.695 23.882 -1.613
137 HB3 PRO 24 3HB PRO 24 19.442 23.470 -0.033
138 HG2 PRO 24 2HG PRO 24 18.849 21.642 -2.374
139 HG3 PRO 24 3HG PRO 24 20.333 21.722 -1.369
140 HD2 PRO 24 2HD PRO 24 18.332 19.876 -0.983
141 HD3 PRO 24 3HD PRO 24 19.315 20.517 0.376
142 HA PRO 25 HA PRO 25 13.868 24.032 -2.086
143 HB2 PRO 25 2HB PRO 25 13.921 26.749 -2.461
144 HB3 PRO 25 3HB PRO 25 13.453 25.982 -0.906
145 HG2 PRO 25 2HG PRO 25 16.133 27.155 -1.695
146 HG3 PRO 25 3HG PRO 25 15.228 27.367 -0.156
147 HD2 PRO 25 2HD PRO 25 17.279 25.554 -0.455
148 HD3 PRO 25 3HD PRO 25 15.879 25.252 0.621
149 H ASP 26 H ASP 26 17.130 24.721 -2.993
150 HA ASP 26 HA ASP 26 16.560 25.561 -5.710
151 HB2 ASP 26 2HB ASP 26 19.098 24.688 -4.298
152 HB3 ASP 26 3HB ASP 26 19.038 25.209 -5.988
153 H ILE 27 H ILE 27 16.133 22.604 -4.257
154 HA ILE 27 HA ILE 27 17.311 20.842 -6.163
155 HB ILE 27 HB ILE 27 16.549 20.248 -3.840
156 HG12 ILE 27 2HG1 ILE 27 15.637 18.048 -4.367
157 HG13 ILE 27 3HG1 ILE 27 15.197 18.565 -6.000
158 HG21 ILE 27 1HG2 ILE 27 13.767 20.329 -5.091
159 HG22 ILE 27 2HG2 ILE 27 14.169 19.838 -3.428
160 HG23 ILE 27 3HG2 ILE 27 14.394 21.522 -3.933
161 HD11 ILE 27 1HD1 ILE 27 18.045 18.481 -4.901
162 HD12 ILE 27 2HD1 ILE 27 17.317 17.237 -5.937
163 HD13 ILE 27 3HD1 ILE 27 17.575 18.877 -6.569
164 H ARG 28 H ARG 28 16.158 19.498 -7.748
165 HA ARG 28 HA ARG 28 13.660 20.704 -8.829
166 HB2 ARG 28 2HB ARG 28 16.021 19.757 -10.498
167 HB3 ARG 28 3HB ARG 28 14.502 20.452 -11.091
168 HG2 ARG 28 2HG ARG 28 15.034 22.586 -9.939
169 HG3 ARG 28 3HG ARG 28 16.564 21.883 -9.351
170 HD2 ARG 28 2HD ARG 28 17.272 21.499 -11.702
171 HD3 ARG 28 3HD ARG 28 15.775 22.261 -12.260
172 HE ARG 28 HE ARG 28 16.606 24.366 -11.681
173 HH11 ARG 28 1HH1 ARG 28 18.773 21.825 -10.495
174 HH12 ARG 28 2HH1 ARG 28 20.057 22.945 -10.108
175 HH21 ARG 28 1HH2 ARG 28 18.304 25.794 -11.179
176 HH22 ARG 28 2HH2 ARG 28 19.796 25.188 -10.504
177 H THR 29 H THR 29 12.313 19.192 -9.969
178 HA THR 29 HA THR 29 12.234 16.685 -8.690
179 HB THR 29 HB THR 29 10.747 17.146 -11.243
180 HG1 THR 29 1HG THR 29 9.331 18.469 -10.085
181 HG21 THR 29 1HG2 THR 29 10.348 15.077 -9.960
182 HG22 THR 29 2HG2 THR 29 10.014 16.034 -8.495
183 HG23 THR 29 3HG2 THR 29 8.921 16.127 -9.900
184 H LYS 30 H LYS 30 14.059 17.604 -11.466
185 HA LYS 30 HA LYS 30 14.317 14.785 -12.346
186 HB2 LYS 30 2HB LYS 30 13.942 16.631 -14.008
187 HB3 LYS 30 3HB LYS 30 15.492 17.336 -13.520
188 HG2 LYS 30 2HG LYS 30 15.933 14.539 -14.081
189 HG3 LYS 30 3HG LYS 30 14.967 15.218 -15.403
190 HD2 LYS 30 2HD LYS 30 17.346 15.446 -15.917
191 HD3 LYS 30 3HD LYS 30 16.624 17.050 -15.669
192 HE2 LYS 30 2HE LYS 30 17.496 17.112 -13.365
193 HE3 LYS 30 3HE LYS 30 18.157 15.482 -13.555
194 HZ1 LYS 30 1HZ LYS 30 19.608 16.317 -15.249
195 HZ2 LYS 30 2HZ LYS 30 18.966 17.831 -15.132
196 HZ3 LYS 30 3HZ LYS 30 19.808 17.189 -13.872
197 H ASP 31 H ASP 31 16.083 17.363 -10.659
198 HA ASP 31 HA ASP 31 18.663 16.114 -10.905
199 HB2 ASP 31 2HB ASP 31 17.564 18.141 -8.927
200 HB3 ASP 31 3HB ASP 31 19.261 17.644 -9.018
201 H ILE 32 H ILE 32 15.958 15.750 -8.661
202 HA ILE 32 HA ILE 32 17.509 14.320 -6.677
203 HB ILE 32 HB ILE 32 15.490 15.697 -6.181
204 HG12 ILE 32 2HG1 ILE 32 15.046 12.788 -5.407
205 HG13 ILE 32 3HG1 ILE 32 16.345 13.789 -4.724
206 HG21 ILE 32 1HG2 ILE 32 14.154 15.020 -8.177
207 HG22 ILE 32 2HG2 ILE 32 13.957 13.399 -7.490
208 HG23 ILE 32 3HG2 ILE 32 13.255 14.809 -6.661
209 HD11 ILE 32 1HD1 ILE 32 13.357 14.367 -4.568
210 HD12 ILE 32 2HD1 ILE 32 14.408 13.832 -3.239
211 HD13 ILE 32 3HD1 ILE 32 14.643 15.443 -3.964
212 H GLU 33 H GLU 33 16.237 13.436 -9.750
213 HA GLU 33 HA GLU 33 16.426 10.567 -8.947
214 HB2 GLU 33 2HB GLU 33 14.857 10.040 -10.719
215 HB3 GLU 33 3HB GLU 33 14.137 11.227 -9.613
216 HG2 GLU 33 2HG GLU 33 14.709 13.047 -11.181
217 HG3 GLU 33 3HG GLU 33 15.452 11.877 -12.290
218 H ASP 34 H ASP 34 18.078 13.019 -10.465
219 HA ASP 34 HA ASP 34 19.181 11.284 -12.585
220 HB2 ASP 34 2HB ASP 34 18.672 13.466 -13.336
221 HB3 ASP 34 3HB ASP 34 19.451 14.217 -11.935
222 H VAL 35 H VAL 35 20.562 13.391 -9.980
223 HA VAL 35 HA VAL 35 23.134 12.145 -10.153
224 HB VAL 35 HB VAL 35 21.839 13.714 -7.885
225 HG11 VAL 35 1HG1 VAL 35 24.764 13.088 -8.491
226 HG12 VAL 35 2HG1 VAL 35 24.187 14.185 -7.214
227 HG13 VAL 35 3HG1 VAL 35 23.817 12.450 -7.128
228 HG21 VAL 35 1HG2 VAL 35 23.619 14.597 -10.194
229 HG22 VAL 35 2HG2 VAL 35 21.895 14.985 -9.991
230 HG23 VAL 35 3HG2 VAL 35 23.082 15.633 -8.846
231 H PHE 36 H PHE 36 20.275 11.634 -8.045
232 HA PHE 36 HA PHE 36 21.512 9.647 -6.441
233 HB2 PHE 36 2HB PHE 36 18.640 10.320 -7.036
234 HB3 PHE 36 3HB PHE 36 19.087 8.958 -6.004
235 HD1 PHE 36 HD1 PHE 36 20.034 9.260 -3.807
236 HD2 PHE 36 HD2 PHE 36 19.121 12.645 -6.292
237 HE1 PHE 36 HE1 PHE 36 20.278 10.762 -1.848
238 HE2 PHE 36 HE2 PHE 36 19.380 14.151 -4.336
239 HZ PHE 36 HZ PHE 36 19.958 13.205 -2.108
240 H SER 37 H SER 37 20.026 9.440 -9.634
241 HA SER 37 HA SER 37 19.797 6.577 -9.646
242 HB2 SER 37 2HB SER 37 18.550 7.944 -11.207
243 HB3 SER 37 3HB SER 37 20.054 8.592 -11.910
244 HG SER 37 HG SER 37 19.167 6.849 -13.114
245 H LYS 38 H LYS 38 22.459 8.859 -10.337
246 HA LYS 38 HA LYS 38 24.241 6.828 -11.370
247 HB2 LYS 38 2HB LYS 38 24.938 9.412 -9.913
248 HB3 LYS 38 3HB LYS 38 26.005 8.470 -10.972
249 HG2 LYS 38 2HG LYS 38 23.470 9.946 -11.792
250 HG3 LYS 38 3HG LYS 38 25.137 10.415 -12.168
251 HD2 LYS 38 2HD LYS 38 25.439 8.322 -13.466
252 HD3 LYS 38 3HD LYS 38 23.760 7.861 -13.119
253 HE2 LYS 38 2HE LYS 38 24.611 10.395 -14.588
254 HE3 LYS 38 3HE LYS 38 24.021 8.915 -15.357
255 HZ1 LYS 38 1HZ LYS 38 22.491 10.587 -13.474
256 HZ2 LYS 38 2HZ LYS 38 22.270 10.509 -15.091
257 HZ3 LYS 38 3HZ LYS 38 21.959 9.189 -14.160
258 H TYR 39 H TYR 39 23.244 7.870 -8.138
259 HA TYR 39 HA TYR 39 25.312 6.293 -6.861
260 HB2 TYR 39 2HB TYR 39 23.069 7.988 -5.874
261 HB3 TYR 39 3HB TYR 39 23.790 6.797 -4.795
262 HD1 TYR 39 HD1 TYR 39 24.805 9.600 -7.096
263 HD2 TYR 39 HD2 TYR 39 25.685 7.296 -3.566
264 HE1 TYR 39 HE1 TYR 39 26.663 11.145 -6.553
265 HE2 TYR 39 HE2 TYR 39 27.527 8.851 -3.007
266 HH TYR 39 HH TYR 39 28.711 10.722 -3.642
267 H GLY 40 H GLY 40 22.168 5.379 -8.090
268 HA2 GLY 40 2HA GLY 40 22.580 2.681 -7.336
269 HA3 GLY 40 3HA GLY 40 21.584 3.429 -6.079
270 H ALA 41 H ALA 41 21.151 4.642 -9.345
271 HA ALA 41 HA ALA 41 19.357 4.562 -10.740
272 HB1 ALA 41 1HB ALA 41 19.572 1.601 -10.113
273 HB2 ALA 41 2HB ALA 41 18.761 2.315 -11.526
274 HB3 ALA 41 3HB ALA 41 20.520 2.484 -11.328
275 H ILE 42 H ILE 42 18.229 5.715 -8.819
276 HA ILE 42 HA ILE 42 16.304 4.438 -7.215
277 HB ILE 42 HB ILE 42 16.625 7.208 -8.382
278 HG12 ILE 42 2HG1 ILE 42 16.862 7.825 -6.029
279 HG13 ILE 42 3HG1 ILE 42 16.451 6.167 -5.521
280 HG21 ILE 42 1HG2 ILE 42 14.679 7.961 -7.036
281 HG22 ILE 42 2HG2 ILE 42 14.203 6.896 -8.370
282 HG23 ILE 42 3HG2 ILE 42 14.271 6.264 -6.701
283 HD11 ILE 42 1HD1 ILE 42 18.808 6.804 -7.311
284 HD12 ILE 42 2HD1 ILE 42 18.937 6.769 -5.537
285 HD13 ILE 42 3HD1 ILE 42 18.489 5.293 -6.428
286 H ARG 43 H ARG 43 14.177 3.873 -7.457
287 HA ARG 43 HA ARG 43 13.185 3.728 -10.269
288 HB2 ARG 43 2HB ARG 43 12.393 2.082 -7.833
289 HB3 ARG 43 3HB ARG 43 11.834 1.838 -9.491
290 HG2 ARG 43 2HG ARG 43 14.698 1.560 -8.482
291 HG3 ARG 43 3HG ARG 43 13.609 0.240 -8.950
292 HD2 ARG 43 2HD ARG 43 14.645 2.424 -10.814
293 HD3 ARG 43 3HD ARG 43 15.251 0.771 -10.729
294 HE ARG 43 HE ARG 43 12.432 1.441 -11.500
295 HH11 ARG 43 1HH1 ARG 43 15.420 -0.414 -11.978
296 HH12 ARG 43 2HH1 ARG 43 14.753 -1.358 -13.286
297 HH21 ARG 43 1HH2 ARG 43 11.587 0.164 -13.181
298 HH22 ARG 43 2HH2 ARG 43 12.591 -1.029 -13.969
299 H ASP 44 H ASP 44 12.504 5.026 -7.065
300 HA ASP 44 HA ASP 44 10.226 6.454 -8.222
301 HB2 ASP 44 2HB ASP 44 9.942 4.444 -6.011
302 HB3 ASP 44 3HB ASP 44 8.908 5.878 -6.042
303 H ILE 45 H ILE 45 9.405 8.225 -7.033
304 HA ILE 45 HA ILE 45 11.175 9.312 -4.914
305 HB ILE 45 HB ILE 45 10.526 10.542 -7.617
306 HG12 ILE 45 2HG1 ILE 45 12.612 9.268 -7.501
307 HG13 ILE 45 3HG1 ILE 45 12.917 11.000 -7.715
308 HG21 ILE 45 1HG2 ILE 45 11.555 12.656 -6.736
309 HG22 ILE 45 2HG2 ILE 45 9.963 12.287 -6.059
310 HG23 ILE 45 3HG2 ILE 45 11.428 11.983 -5.094
311 HD11 ILE 45 1HD1 ILE 45 13.408 11.212 -5.278
312 HD12 ILE 45 2HD1 ILE 45 13.168 9.455 -5.099
313 HD13 ILE 45 3HD1 ILE 45 14.496 10.072 -6.095
314 H ASP 46 H ASP 46 10.164 10.952 -3.643
315 HA ASP 46 HA ASP 46 7.297 11.469 -4.170
316 HB2 ASP 46 2HB ASP 46 7.483 9.471 -2.657
317 HB3 ASP 46 3HB ASP 46 8.390 10.471 -1.511
318 H LEU 47 H LEU 47 9.345 13.224 -4.698
319 HA LEU 47 HA LEU 47 10.048 14.958 -2.561
320 HB2 LEU 47 2HB LEU 47 11.190 15.015 -4.714
321 HB3 LEU 47 3HB LEU 47 9.685 15.418 -5.547
322 HG LEU 47 HG LEU 47 9.582 17.585 -4.332
323 HD11 LEU 47 1HD1 LEU 47 10.847 16.983 -2.300
324 HD12 LEU 47 2HD1 LEU 47 12.311 16.712 -3.283
325 HD13 LEU 47 3HD1 LEU 47 11.623 18.347 -3.123
326 HD21 LEU 47 1HD2 LEU 47 10.635 17.428 -6.545
327 HD22 LEU 47 2HD2 LEU 47 11.451 18.638 -5.538
328 HD23 LEU 47 3HD2 LEU 47 12.201 17.042 -5.787
329 H LYS 48 H LYS 48 8.934 16.402 -1.414
330 HA LYS 48 HA LYS 48 6.667 17.849 -2.520
331 HB2 LYS 48 2HB LYS 48 5.082 17.082 -0.752
332 HB3 LYS 48 3HB LYS 48 5.539 15.797 -1.880
333 HG2 LYS 48 2HG LYS 48 7.268 15.025 -0.210
334 HG3 LYS 48 3HG LYS 48 6.601 16.209 0.946
335 HD2 LYS 48 2HD LYS 48 4.399 15.131 0.814
336 HD3 LYS 48 3HD LYS 48 4.988 14.015 -0.437
337 HE2 LYS 48 2HE LYS 48 6.067 14.200 2.406
338 HE3 LYS 48 3HE LYS 48 4.927 12.971 1.833
339 HZ1 LYS 48 1HZ LYS 48 7.210 12.213 1.830
340 HZ2 LYS 48 2HZ LYS 48 6.564 12.192 0.320
341 HZ3 LYS 48 3HZ LYS 48 7.624 13.381 0.738
342 H ASN 49 H ASN 49 5.700 19.277 -0.599
343 HA ASN 49 HA ASN 49 7.870 20.049 1.244
344 HB2 ASN 49 2HB ASN 49 7.882 22.377 0.411
345 HB3 ASN 49 3HB ASN 49 8.444 21.229 -0.808
346 HD21 ASN 49 1HD2 ASN 49 6.292 23.293 -2.828
347 HD22 ASN 49 2HD2 ASN 49 7.915 23.216 -2.171
348 H ARG 50 H ARG 50 4.771 19.253 1.093
349 HA ARG 50 HA ARG 50 2.854 19.810 2.188
350 HB2 ARG 50 2HB ARG 50 4.852 20.856 4.228
351 HB3 ARG 50 3HB ARG 50 3.132 20.512 4.534
352 HG2 ARG 50 2HG ARG 50 3.512 18.141 3.867
353 HG3 ARG 50 3HG ARG 50 5.242 18.499 3.654
354 HD2 ARG 50 2HD ARG 50 4.880 17.503 5.844
355 HD3 ARG 50 3HD ARG 50 5.368 19.196 6.044
356 HE ARG 50 HE ARG 50 2.771 19.582 6.183
357 HH11 ARG 50 1HH1 ARG 50 4.616 16.889 7.554
358 HH12 ARG 50 2HH1 ARG 50 3.400 16.509 8.745
359 HH21 ARG 50 1HH2 ARG 50 1.210 19.080 7.781
360 HH22 ARG 50 2HH2 ARG 50 1.513 17.788 8.919
361 H ARG 51 H ARG 51 4.011 21.909 0.350
362 HA ARG 51 HA ARG 51 3.571 24.030 -0.309
363 HB2 ARG 51 2HB ARG 51 1.112 23.678 1.438
364 HB3 ARG 51 3HB ARG 51 1.313 24.902 0.171
365 HG2 ARG 51 2HG ARG 51 1.537 23.143 -1.537
366 HG3 ARG 51 3HG ARG 51 1.417 21.884 -0.290
367 HD2 ARG 51 2HD ARG 51 -0.729 23.952 -0.892
368 HD3 ARG 51 3HD ARG 51 -0.740 22.280 -1.473
369 HE ARG 51 HE ARG 51 -1.052 23.178 1.356
370 HH11 ARG 51 1HH1 ARG 51 -1.219 20.602 -1.065
371 HH12 ARG 51 2HH1 ARG 51 -2.027 19.488 0.014
372 HH21 ARG 51 1HH2 ARG 51 -2.076 21.693 2.743
373 HH22 ARG 51 2HH2 ARG 51 -2.542 20.117 2.146
374 H GLY 52 H GLY 52 5.055 23.602 2.371
375 HA2 GLY 52 2HA GLY 52 5.511 26.371 2.876
376 HA3 GLY 52 3HA GLY 52 4.478 25.704 4.150
377 H GLY 53 H GLY 53 7.317 26.709 4.202
378 HA2 GLY 53 2HA GLY 53 9.210 26.148 5.399
379 HA3 GLY 53 3HA GLY 53 8.498 24.558 5.751
380 HA PRO 54 HA PRO 54 11.925 24.191 2.560
381 HB2 PRO 54 2HB PRO 54 13.531 22.446 3.991
382 HB3 PRO 54 3HB PRO 54 13.676 24.231 4.072
383 HG2 PRO 54 2HG PRO 54 12.266 22.365 5.976
384 HG3 PRO 54 3HG PRO 54 13.290 23.787 6.355
385 HD2 PRO 54 2HD PRO 54 10.543 23.878 6.368
386 HD3 PRO 54 3HD PRO 54 11.548 25.284 5.904
387 HA PRO 55 HA PRO 55 10.001 20.438 1.247
388 HB2 PRO 55 2HB PRO 55 11.678 19.663 -0.772
389 HB3 PRO 55 3HB PRO 55 10.596 21.086 -0.899
390 HG2 PRO 55 2HG PRO 55 13.544 21.028 -0.222
391 HG3 PRO 55 3HG PRO 55 12.674 22.135 -1.330
392 HD2 PRO 55 2HD PRO 55 13.318 22.811 1.263
393 HD3 PRO 55 3HD PRO 55 11.849 23.422 0.446
394 H PHE 56 H PHE 56 10.368 18.098 1.040
395 HA PHE 56 HA PHE 56 12.913 16.946 1.902
396 HB2 PHE 56 2HB PHE 56 12.197 16.018 3.916
397 HB3 PHE 56 3HB PHE 56 11.432 17.605 3.992
398 HD1 PHE 56 HD1 PHE 56 10.960 14.116 4.329
399 HD2 PHE 56 HD2 PHE 56 8.942 17.685 3.025
400 HE1 PHE 56 HE1 PHE 56 8.769 13.039 4.774
401 HE2 PHE 56 HE2 PHE 56 6.755 16.584 3.424
402 HZ PHE 56 HZ PHE 56 6.677 14.262 4.293
403 H ALA 57 H ALA 57 12.621 14.447 1.641
404 HA ALA 57 HA ALA 57 10.339 13.750 -0.074
405 HB1 ALA 57 1HB ALA 57 13.171 13.853 -1.178
406 HB2 ALA 57 2HB ALA 57 11.720 13.298 -2.043
407 HB3 ALA 57 3HB ALA 57 11.879 15.007 -1.569
408 H PHE 58 H PHE 58 10.097 11.584 -0.477
409 HA PHE 58 HA PHE 58 12.014 9.766 0.833
410 HB2 PHE 58 2HB PHE 58 9.136 9.561 0.162
411 HB3 PHE 58 3HB PHE 58 10.106 8.096 -0.035
412 HD1 PHE 58 HD1 PHE 58 9.889 10.890 2.500
413 HD2 PHE 58 HD2 PHE 58 10.015 6.658 1.739
414 HE1 PHE 58 HE1 PHE 58 9.832 10.436 4.948
415 HE2 PHE 58 HE2 PHE 58 10.015 6.217 4.169
416 HZ PHE 58 HZ PHE 58 9.912 8.106 5.778
417 H VAL 59 H VAL 59 12.984 8.025 -0.224
418 HA VAL 59 HA VAL 59 12.985 8.193 -3.192
419 HB VAL 59 HB VAL 59 15.434 8.076 -1.383
420 HG11 VAL 59 1HG1 VAL 59 16.680 8.275 -3.525
421 HG12 VAL 59 2HG1 VAL 59 15.742 6.769 -3.418
422 HG13 VAL 59 3HG1 VAL 59 15.141 8.122 -4.409
423 HG21 VAL 59 1HG2 VAL 59 14.493 10.333 -1.427
424 HG22 VAL 59 2HG2 VAL 59 15.963 10.283 -2.421
425 HG23 VAL 59 3HG2 VAL 59 14.362 10.274 -3.199
426 H GLU 60 H GLU 60 13.311 6.196 -4.233
427 HA GLU 60 HA GLU 60 13.482 3.845 -2.415
428 HB2 GLU 60 2HB GLU 60 11.157 4.175 -2.836
429 HB3 GLU 60 3HB GLU 60 11.431 4.418 -4.571
430 HG2 GLU 60 2HG GLU 60 11.956 2.127 -4.935
431 HG3 GLU 60 3HG GLU 60 12.238 1.832 -3.209
432 H PHE 61 H PHE 61 15.099 2.624 -2.939
433 HA PHE 61 HA PHE 61 16.378 2.891 -5.545
434 HB2 PHE 61 2HB PHE 61 17.174 1.598 -2.949
435 HB3 PHE 61 3HB PHE 61 18.100 1.382 -4.438
436 HD1 PHE 61 HD1 PHE 61 16.689 4.113 -2.275
437 HD2 PHE 61 HD2 PHE 61 19.763 2.872 -5.009
438 HE1 PHE 61 HE1 PHE 61 17.880 6.259 -1.907
439 HE2 PHE 61 HE2 PHE 61 20.947 5.026 -4.655
440 HZ PHE 61 HZ PHE 61 20.009 6.712 -3.094
441 H GLU 62 H GLU 62 17.226 1.048 -6.759
442 HA GLU 62 HA GLU 62 15.195 -1.023 -7.115
443 HB2 GLU 62 2HB GLU 62 16.322 -0.038 -9.032
444 HB3 GLU 62 3HB GLU 62 17.905 -0.543 -8.411
445 HG2 GLU 62 2HG GLU 62 17.369 -2.879 -8.688
446 HG3 GLU 62 3HG GLU 62 15.663 -2.510 -8.988
447 H ASP 63 H ASP 63 18.294 -0.645 -5.496
448 HA ASP 63 HA ASP 63 18.027 -3.370 -4.390
449 HB2 ASP 63 2HB ASP 63 20.477 -2.249 -5.764
450 HB3 ASP 63 3HB ASP 63 20.569 -3.546 -4.564
451 HA PRO 64 HA PRO 64 18.755 -1.223 -0.654
452 HB2 PRO 64 2HB PRO 64 19.402 -3.296 1.021
453 HB3 PRO 64 3HB PRO 64 17.747 -3.057 0.359
454 HG2 PRO 64 2HG PRO 64 19.909 -4.936 -0.617
455 HG3 PRO 64 3HG PRO 64 18.154 -5.255 -0.399
456 HD2 PRO 64 2HD PRO 64 19.295 -4.624 -2.834
457 HD3 PRO 64 3HD PRO 64 17.615 -4.181 -2.404
458 H ARG 65 H ARG 65 21.257 -3.117 -2.209
459 HA ARG 65 HA ARG 65 23.359 -2.526 -0.313
460 HB2 ARG 65 2HB ARG 65 23.468 -3.436 -3.217
461 HB3 ARG 65 3HB ARG 65 24.823 -3.442 -2.074
462 HG2 ARG 65 2HG ARG 65 23.562 -4.986 -0.592
463 HG3 ARG 65 3HG ARG 65 22.228 -5.018 -1.769
464 HD2 ARG 65 2HD ARG 65 23.775 -5.909 -3.491
465 HD3 ARG 65 3HD ARG 65 25.097 -5.881 -2.317
466 HE ARG 65 HE ARG 65 24.115 -7.691 -1.136
467 HH11 ARG 65 1HH1 ARG 65 22.243 -6.753 -3.986
468 HH12 ARG 65 2HH1 ARG 65 21.354 -8.258 -4.042
469 HH21 ARG 65 1HH2 ARG 65 22.916 -9.642 -1.221
470 HH22 ARG 65 2HH2 ARG 65 21.722 -9.880 -2.470
471 H ASP 66 H ASP 66 21.931 -0.829 -3.045
472 HA ASP 66 HA ASP 66 24.245 0.992 -3.241
473 HB2 ASP 66 2HB ASP 66 21.648 0.792 -4.796
474 HB3 ASP 66 3HB ASP 66 22.909 2.001 -5.080
475 H ALA 67 H ALA 67 21.117 0.829 -1.693
476 HA ALA 67 HA ALA 67 20.653 3.655 -1.495
477 HB1 ALA 67 1HB ALA 67 19.732 1.363 0.298
478 HB2 ALA 67 2HB ALA 67 19.038 2.999 0.257
479 HB3 ALA 67 3HB ALA 67 18.895 1.936 -1.161
480 H GLU 68 H GLU 68 22.703 1.382 0.269
481 HA GLU 68 HA GLU 68 23.091 3.088 2.575
482 HB2 GLU 68 2HB GLU 68 24.721 0.774 1.450
483 HB3 GLU 68 3HB GLU 68 24.989 1.524 3.029
484 HG2 GLU 68 2HG GLU 68 22.376 0.217 2.155
485 HG3 GLU 68 3HG GLU 68 23.627 -0.586 3.111
486 H ASP 69 H ASP 69 24.509 2.879 -0.653
487 HA ASP 69 HA ASP 69 26.881 4.394 0.068
488 HB2 ASP 69 2HB ASP 69 25.666 3.584 -2.586
489 HB3 ASP 69 3HB ASP 69 27.147 4.539 -2.432
490 H ALA 70 H ALA 70 23.690 5.163 -1.316
491 HA ALA 70 HA ALA 70 24.358 7.919 -1.864
492 HB1 ALA 70 1HB ALA 70 21.930 8.135 -2.214
493 HB2 ALA 70 2HB ALA 70 22.535 6.666 -3.009
494 HB3 ALA 70 3HB ALA 70 21.665 6.550 -1.458
495 H VAL 71 H VAL 71 23.209 6.092 0.943
496 HA VAL 71 HA VAL 71 22.364 8.475 2.411
497 HB VAL 71 HB VAL 71 22.664 5.510 3.014
498 HG11 VAL 71 1HG1 VAL 71 21.725 5.981 5.278
499 HG12 VAL 71 2HG1 VAL 71 23.362 6.635 5.072
500 HG13 VAL 71 3HG1 VAL 71 21.957 7.721 4.994
501 HG21 VAL 71 1HG2 VAL 71 20.659 6.351 1.764
502 HG22 VAL 71 2HG2 VAL 71 20.241 5.666 3.349
503 HG23 VAL 71 3HG2 VAL 71 20.295 7.433 3.125
504 H SER 72 H SER 72 25.184 6.214 2.357
505 HA SER 72 HA SER 72 26.478 7.406 4.609
506 HB2 SER 72 2HB SER 72 26.990 5.149 3.815
507 HB3 SER 72 3HB SER 72 27.567 5.800 2.264
508 HG SER 72 HG SER 72 28.677 6.249 4.838
509 H GLY 73 H GLY 73 26.176 8.391 1.270
510 HA2 GLY 73 2HA GLY 73 28.572 10.088 1.353
511 HA3 GLY 73 3HA GLY 73 27.462 9.856 -0.011
512 H ARG 74 H ARG 74 25.462 10.455 2.610
513 HA ARG 74 HA ARG 74 25.601 13.404 2.283
514 HB2 ARG 74 2HB ARG 74 23.170 11.692 1.647
515 HB3 ARG 74 3HB ARG 74 23.187 13.466 1.735
516 HG2 ARG 74 2HG ARG 74 24.833 13.550 -0.106
517 HG3 ARG 74 3HG ARG 74 24.826 11.771 -0.204
518 HD2 ARG 74 2HD ARG 74 22.410 11.798 -0.714
519 HD3 ARG 74 3HD ARG 74 22.400 13.567 -0.598
520 HE ARG 74 HE ARG 74 23.314 13.702 -2.721
521 HH11 ARG 74 1HH1 ARG 74 23.705 10.411 -1.496
522 HH12 ARG 74 2HH1 ARG 74 24.308 9.793 -3.020
523 HH21 ARG 74 1HH2 ARG 74 24.071 12.870 -4.690
524 HH22 ARG 74 2HH2 ARG 74 24.508 11.178 -4.828
525 H ASP 75 H ASP 75 25.097 10.711 4.315
526 HA ASP 75 HA ASP 75 23.155 11.834 6.079
527 HB2 ASP 75 2HB ASP 75 23.478 9.484 6.103
528 HB3 ASP 75 3HB ASP 75 25.216 9.647 6.361
529 H GLY 76 H GLY 76 23.311 13.568 7.346
530 HA2 GLY 76 2HA GLY 76 24.153 15.065 8.852
531 HA3 GLY 76 3HA GLY 76 25.340 13.825 9.303
532 H TYR 77 H TYR 77 24.825 15.683 6.211
533 HA TYR 77 HA TYR 77 27.745 16.018 6.176
534 HB2 TYR 77 2HB TYR 77 27.044 14.878 4.273
535 HB3 TYR 77 3HB TYR 77 25.682 15.965 4.004
536 HD1 TYR 77 HD1 TYR 77 25.863 17.756 2.505
537 HD2 TYR 77 HD2 TYR 77 29.426 15.943 4.090
538 HE1 TYR 77 HE1 TYR 77 27.243 19.153 0.987
539 HE2 TYR 77 HE2 TYR 77 30.813 17.325 2.562
540 HH TYR 77 HH TYR 77 29.358 19.695 0.292
541 H ASP 78 H ASP 78 28.817 17.834 6.063
542 HA ASP 78 HA ASP 78 27.623 20.150 7.183
543 HB2 ASP 78 2HB ASP 78 29.896 19.690 7.637
544 HB3 ASP 78 3HB ASP 78 30.305 19.595 5.917
545 H TYR 79 H TYR 79 26.094 21.273 6.176
546 HA TYR 79 HA TYR 79 26.619 22.185 3.402
547 HB2 TYR 79 2HB TYR 79 24.672 20.807 3.528
548 HB3 TYR 79 3HB TYR 79 24.053 21.698 4.916
549 HD1 TYR 79 HD1 TYR 79 24.545 21.761 1.263
550 HD2 TYR 79 HD2 TYR 79 22.973 23.843 4.673
551 HE1 TYR 79 HE1 TYR 79 23.249 23.246 -0.252
552 HE2 TYR 79 HE2 TYR 79 21.666 25.335 3.168
553 HH TYR 79 HH TYR 79 21.810 25.013 -0.399
554 H ASP 80 H ASP 80 25.480 24.374 2.952
555 HA ASP 80 HA ASP 80 26.790 26.319 4.520
556 HB2 ASP 80 2HB ASP 80 26.320 26.774 2.232
557 HB3 ASP 80 3HB ASP 80 24.588 26.495 2.453
558 H GLY 81 H GLY 81 26.336 26.372 6.681
559 HA2 GLY 81 2HA GLY 81 25.261 27.290 8.504
560 HA3 GLY 81 3HA GLY 81 23.905 27.745 7.463
561 H TYR 82 H TYR 82 24.296 24.525 6.796
562 HA TYR 82 HA TYR 82 22.757 23.561 9.129
563 HB2 TYR 82 2HB TYR 82 21.742 23.519 6.276
564 HB3 TYR 82 3HB TYR 82 21.073 22.538 7.577
565 HD1 TYR 82 HD1 TYR 82 21.568 26.005 6.399
566 HD2 TYR 82 HD2 TYR 82 19.627 23.443 9.250
567 HE1 TYR 82 HE1 TYR 82 20.091 27.891 7.082
568 HE2 TYR 82 HE2 TYR 82 18.150 25.310 9.943
569 HH TYR 82 HH TYR 82 17.593 27.511 9.627
570 H ARG 83 H ARG 83 21.970 21.113 8.301
571 HA ARG 83 HA ARG 83 24.350 19.659 7.306
572 HB2 ARG 83 2HB ARG 83 24.726 19.894 9.720
573 HB3 ARG 83 3HB ARG 83 23.099 19.255 10.049
574 HG2 ARG 83 2HG ARG 83 23.704 17.114 9.016
575 HG3 ARG 83 3HG ARG 83 25.303 17.754 8.578
576 HD2 ARG 83 2HD ARG 83 25.480 16.391 10.602
577 HD3 ARG 83 3HD ARG 83 25.825 18.089 10.973
578 HE ARG 83 HE ARG 83 23.229 16.699 11.556
579 HH11 ARG 83 1HH1 ARG 83 25.684 19.119 12.348
580 HH12 ARG 83 2HH1 ARG 83 24.879 19.622 13.816
581 HH21 ARG 83 1HH2 ARG 83 22.197 17.388 13.469
582 HH22 ARG 83 2HH2 ARG 83 22.915 18.651 14.445
583 H LEU 84 H LEU 84 23.756 17.964 6.090
584 HA LEU 84 HA LEU 84 21.000 17.678 5.369
585 HB2 LEU 84 2HB LEU 84 23.562 16.233 4.678
586 HB3 LEU 84 3HB LEU 84 22.000 15.551 4.204
587 HG LEU 84 HG LEU 84 21.403 17.674 3.066
588 HD11 LEU 84 1HD1 LEU 84 22.784 19.290 4.254
589 HD12 LEU 84 2HD1 LEU 84 24.270 18.423 3.788
590 HD13 LEU 84 3HD1 LEU 84 23.292 19.265 2.563
591 HD21 LEU 84 1HD2 LEU 84 22.971 17.347 1.159
592 HD22 LEU 84 2HD2 LEU 84 24.024 16.373 2.211
593 HD23 LEU 84 3HD2 LEU 84 22.383 15.803 1.815
594 H ARG 85 H ARG 85 19.635 15.849 5.542
595 HA ARG 85 HA ARG 85 20.250 13.964 7.764
596 HB2 ARG 85 2HB ARG 85 17.661 15.507 7.318
597 HB3 ARG 85 3HB ARG 85 17.866 14.166 8.461
598 HG2 ARG 85 2HG ARG 85 19.697 15.437 9.586
599 HG3 ARG 85 3HG ARG 85 19.386 16.815 8.509
600 HD2 ARG 85 2HD ARG 85 17.320 15.562 10.360
601 HD3 ARG 85 3HD ARG 85 18.278 16.991 10.765
602 HE ARG 85 HE ARG 85 17.246 18.059 8.704
603 HH11 ARG 85 1HH1 ARG 85 15.576 15.530 10.540
604 HH12 ARG 85 2HH1 ARG 85 13.985 16.085 10.067
605 HH21 ARG 85 1HH2 ARG 85 15.150 18.768 8.137
606 HH22 ARG 85 2HH2 ARG 85 13.749 17.890 8.707
607 H VAL 86 H VAL 86 20.814 13.334 5.173
608 HA VAL 86 HA VAL 86 18.600 11.814 4.031
609 HB VAL 86 HB VAL 86 21.600 11.798 3.490
610 HG11 VAL 86 1HG1 VAL 86 20.974 10.633 1.396
611 HG12 VAL 86 2HG1 VAL 86 20.533 9.672 2.815
612 HG13 VAL 86 3HG1 VAL 86 19.279 10.575 1.934
613 HG21 VAL 86 1HG2 VAL 86 20.513 13.953 2.955
614 HG22 VAL 86 2HG2 VAL 86 20.942 13.079 1.468
615 HG23 VAL 86 3HG2 VAL 86 19.256 13.090 2.036
616 H GLU 87 H GLU 87 17.827 10.357 5.514
617 HA GLU 87 HA GLU 87 19.573 8.052 6.042
618 HB2 GLU 87 2HB GLU 87 19.131 8.038 8.447
619 HB3 GLU 87 3HB GLU 87 19.937 9.555 8.000
620 HG2 GLU 87 2HG GLU 87 17.750 10.715 7.972
621 HG3 GLU 87 3HG GLU 87 16.934 9.195 8.391
622 H PHE 88 H PHE 88 18.333 6.183 6.918
623 HA PHE 88 HA PHE 88 15.804 5.996 5.566
624 HB2 PHE 88 2HB PHE 88 15.840 3.667 6.748
625 HB3 PHE 88 3HB PHE 88 16.901 4.040 5.390
626 HD1 PHE 88 HD1 PHE 88 19.294 4.439 5.701
627 HD2 PHE 88 HD2 PHE 88 16.757 3.344 8.989
628 HE1 PHE 88 HE1 PHE 88 21.298 3.864 7.052
629 HE2 PHE 88 HE2 PHE 88 18.757 2.763 10.345
630 HZ PHE 88 HZ PHE 88 21.028 3.026 9.377
631 HA PRO 89 HA PRO 89 12.882 6.923 8.668
632 HB2 PRO 89 2HB PRO 89 10.860 5.142 8.089
633 HB3 PRO 89 3HB PRO 89 11.216 6.606 7.116
634 HG2 PRO 89 2HG PRO 89 12.054 3.740 6.584
635 HG3 PRO 89 3HG PRO 89 11.425 4.957 5.426
636 HD2 PRO 89 2HD PRO 89 14.095 4.415 5.701
637 HD3 PRO 89 3HD PRO 89 13.500 6.061 5.322
638 H5' A 90 1H5* A 90 7.545 22.068 13.049
639 H5'' A 90 2H5* A 90 9.112 21.619 13.746
640 H4' A 90 H4* A 90 9.573 22.189 11.494
641 H3' A 90 H3* A 90 10.833 23.592 13.482
642 H2' A 90 1H2* A 90 9.597 25.525 13.648
643 HO2' A 90 2HO* A 90 10.991 25.930 11.211
644 H1' A 90 H1* A 90 8.558 25.847 10.943
645 H8 A 90 H8 A 90 8.165 27.120 13.938
646 H61 A 90 1H6 A 90 2.151 25.723 14.475
647 H62 A 90 2H6 A 90 3.458 26.711 15.101
648 H2 A 90 H2 A 90 3.869 23.190 11.247
649 HO5' A 90 H5T A 90 7.912 23.015 15.103
650 H5' A 91 1H5* A 91 12.391 21.236 8.829
651 H5'' A 91 2H5* A 91 11.041 22.387 8.944
652 H4' A 91 H4* A 91 10.683 19.416 9.480
653 H3' A 91 H3* A 91 11.453 20.357 6.974
654 H2' A 91 1H2* A 91 9.627 21.869 6.727
655 HO2' A 91 2HO* A 91 9.439 20.454 4.968
656 H1' A 91 H1* A 91 7.822 19.768 7.951
657 H8 A 91 H8 A 91 5.493 20.859 7.621
658 H61 A 91 1H6 A 91 5.546 27.028 8.195
659 H62 A 91 2H6 A 91 4.538 25.621 7.933
660 H2 A 91 H2 A 91 9.731 25.563 8.620
661 H5' C 92 1H5* C 92 9.313 16.395 8.582
662 H5'' C 92 2H5* C 92 10.593 15.222 8.932
663 H4' C 92 H4* C 92 8.447 14.890 6.779
664 H3' C 92 H3* C 92 8.027 14.791 9.493
665 H2' C 92 1H2* C 92 9.733 13.227 9.960
666 HO2' C 92 2HO* C 92 7.720 12.336 10.709
667 H1' C 92 H1* C 92 8.886 11.632 7.529
668 H41 C 92 1H4 C 92 14.257 8.536 9.040
669 H42 C 92 2H4 C 92 14.975 9.978 9.723
670 H5 C 92 H5 C 92 13.805 12.119 9.831
671 H6 C 92 H6 C 92 11.733 13.279 9.252
672 H5' A 93 1H5* A 93 3.492 13.561 6.351
673 H5'' A 93 2H5* A 93 4.723 12.287 6.507
674 H4' A 93 H4* A 93 4.563 13.949 3.986
675 H3' A 93 H3* A 93 2.265 12.758 4.739
676 H2' A 93 1H2* A 93 3.165 10.630 5.279
677 HO2' A 93 2HO* A 93 1.594 10.442 3.484
678 H1' A 93 H1* A 93 4.861 10.568 2.796
679 H8 A 93 H8 A 93 5.119 10.306 6.632
680 H61 A 93 1H6 A 93 7.932 4.890 5.464
681 H62 A 93 2H6 A 93 7.394 5.976 6.727
682 H2 A 93 H2 A 93 6.909 6.830 1.583
683 H5' A 94 1H5* A 94 0.600 15.817 3.637
684 H5'' A 94 2H5* A 94 0.836 14.230 4.395
685 H4' A 94 H4* A 94 -1.610 14.700 2.671
686 H3' A 94 H3* A 94 -0.930 16.262 5.043
687 H2' A 94 1H2* A 94 -2.336 15.347 6.656
688 HO2' A 94 2HO* A 94 -4.231 15.669 5.313
689 H1' A 94 H1* A 94 -2.540 12.761 5.910
690 H8 A 94 H8 A 94 -0.208 15.486 6.986
691 H61 A 94 1H6 A 94 3.627 11.043 8.972
692 H62 A 94 2H6 A 94 3.350 12.771 8.919
693 H2 A 94 H2 A 94 0.437 9.123 6.547
694 H5' A 95 1H5* A 95 -2.004 18.697 5.567
695 H5'' A 95 2H5* A 95 -2.293 20.044 4.441
696 H4' A 95 H4* A 95 0.448 19.403 5.613
697 H3' A 95 H3* A 95 -1.751 21.229 6.622
698 HO3' A 95 H3T A 95 -1.017 20.370 8.596
699 H2' A 95 1H2* A 95 -0.063 22.748 7.329
700 HO2' A 95 2HO* A 95 1.309 21.265 8.359
701 H1' A 95 H1* A 95 1.695 22.220 5.204
702 H8 A 95 H8 A 95 1.648 24.859 5.257
703 H61 A 95 1H6 A 95 -3.792 27.091 3.294
704 H62 A 95 2H6 A 95 -2.143 27.499 3.723
705 H2 A 95 H2 A 95 -4.215 22.690 3.828
Start of MODEL 14
1 H VAL 6 H1 VAL 6 -3.084 12.223 5.647
2 HA VAL 6 HA VAL 6 -3.406 10.205 6.830
3 HB VAL 6 HB VAL 6 -5.064 10.249 4.290
4 HG11 VAL 6 1HG1 VAL 6 -5.403 8.254 5.705
5 HG12 VAL 6 2HG1 VAL 6 -5.640 9.300 7.128
6 HG13 VAL 6 3HG1 VAL 6 -6.814 9.335 5.796
7 HG21 VAL 6 1HG2 VAL 6 -5.372 11.832 6.880
8 HG22 VAL 6 2HG2 VAL 6 -5.001 12.495 5.272
9 HG23 VAL 6 3HG2 VAL 6 -6.575 11.743 5.572
10 H ILE 7 H ILE 7 -3.357 9.353 3.311
11 HA ILE 7 HA ILE 7 -2.545 6.628 3.970
12 HB ILE 7 HB ILE 7 -2.815 8.047 1.290
13 HG12 ILE 7 2HG1 ILE 7 -4.748 6.236 2.805
14 HG13 ILE 7 3HG1 ILE 7 -4.926 7.992 2.608
15 HG21 ILE 7 1HG2 ILE 7 -2.910 5.752 0.363
16 HG22 ILE 7 2HG2 ILE 7 -1.379 6.027 1.200
17 HG23 ILE 7 3HG2 ILE 7 -2.656 5.080 1.991
18 HD11 ILE 7 1HD1 ILE 7 -4.989 5.911 0.391
19 HD12 ILE 7 2HD1 ILE 7 -6.333 6.903 0.980
20 HD13 ILE 7 3HD1 ILE 7 -4.984 7.681 0.131
21 H ARG 8 H ARG 8 -0.531 5.676 3.560
22 HA ARG 8 HA ARG 8 1.743 7.386 3.914
23 HB2 ARG 8 2HB ARG 8 1.485 5.072 4.802
24 HB3 ARG 8 3HB ARG 8 1.617 4.431 3.158
25 HG2 ARG 8 2HG ARG 8 3.794 6.297 4.022
26 HG3 ARG 8 3HG ARG 8 3.726 4.758 4.881
27 HD2 ARG 8 2HD ARG 8 3.651 4.884 1.853
28 HD3 ARG 8 3HD ARG 8 5.175 4.847 2.762
29 HE ARG 8 HE ARG 8 4.006 2.712 3.837
30 HH11 ARG 8 1HH1 ARG 8 3.919 3.730 0.452
31 HH12 ARG 8 2HH1 ARG 8 3.872 2.101 -0.166
32 HH21 ARG 8 1HH2 ARG 8 3.903 0.591 3.013
33 HH22 ARG 8 2HH2 ARG 8 3.865 0.316 1.289
34 H GLY 9 H GLY 9 3.703 7.286 2.485
35 HA2 GLY 9 2HA GLY 9 3.435 8.531 0.088
36 HA3 GLY 9 3HA GLY 9 4.788 7.496 0.464
37 HA PRO 10 HA PRO 10 1.870 5.452 -2.768
38 HB2 PRO 10 2HB PRO 10 2.503 6.692 -5.145
39 HB3 PRO 10 3HB PRO 10 1.167 7.229 -4.075
40 HG2 PRO 10 2HG PRO 10 3.984 8.325 -4.285
41 HG3 PRO 10 3HG PRO 10 2.437 9.233 -4.198
42 HD2 PRO 10 2HD PRO 10 4.040 8.812 -2.011
43 HD3 PRO 10 3HD PRO 10 2.258 8.887 -1.883
44 H ALA 11 H ALA 11 5.125 6.120 -2.157
45 HA ALA 11 HA ALA 11 6.440 4.772 -4.294
46 HB1 ALA 11 1HB ALA 11 7.240 5.107 -1.376
47 HB2 ALA 11 2HB ALA 11 8.321 4.637 -2.707
48 HB3 ALA 11 3HB ALA 11 7.579 6.256 -2.692
49 H GLY 12 H GLY 12 7.523 2.670 -4.197
50 HA2 GLY 12 2HA GLY 12 5.673 0.571 -3.528
51 HA3 GLY 12 3HA GLY 12 7.302 0.379 -4.187
52 H ASN 13 H ASN 13 6.511 -1.447 -2.384
53 HA ASN 13 HA ASN 13 7.209 -0.695 0.351
54 HB2 ASN 13 2HB ASN 13 6.602 -3.381 -0.935
55 HB3 ASN 13 3HB ASN 13 6.699 -3.078 0.803
56 HD21 ASN 13 1HD2 ASN 13 3.114 -2.959 -0.494
57 HD22 ASN 13 2HD2 ASN 13 4.419 -4.100 -0.729
58 H ASN 14 H ASN 14 8.507 -3.056 1.145
59 HA ASN 14 HA ASN 14 10.538 -3.904 1.533
60 HB2 ASN 14 2HB ASN 14 11.156 -3.221 -1.356
61 HB3 ASN 14 3HB ASN 14 12.074 -4.324 -0.323
62 HD21 ASN 14 1HD2 ASN 14 9.599 -6.205 -2.503
63 HD22 ASN 14 2HD2 ASN 14 10.802 -4.975 -2.846
64 H ASP 15 H ASP 15 12.915 -3.437 1.688
65 HA ASP 15 HA ASP 15 13.137 -0.806 2.828
66 HB2 ASP 15 2HB ASP 15 15.065 -3.132 2.592
67 HB3 ASP 15 3HB ASP 15 15.462 -1.613 3.416
68 H CYS 16 H CYS 16 13.241 -1.442 -0.334
69 HA CYS 16 HA CYS 16 15.727 -0.224 -1.134
70 HB2 CYS 16 2HB CYS 16 13.078 -0.519 -2.611
71 HB3 CYS 16 3HB CYS 16 14.649 -0.127 -3.345
72 HG CYS 16 HG CYS 16 14.102 -2.610 -3.861
73 H ARG 17 H ARG 17 12.806 1.051 0.227
74 HA ARG 17 HA ARG 17 13.056 3.681 -1.033
75 HB2 ARG 17 2HB ARG 17 10.935 2.362 -0.127
76 HB3 ARG 17 3HB ARG 17 11.411 3.092 1.422
77 HG2 ARG 17 2HG ARG 17 11.510 5.333 0.133
78 HG3 ARG 17 3HG ARG 17 10.690 4.472 -1.189
79 HD2 ARG 17 2HD ARG 17 9.720 4.890 1.664
80 HD3 ARG 17 3HD ARG 17 9.007 5.583 0.194
81 HE ARG 17 HE ARG 17 8.612 3.067 -0.413
82 HH11 ARG 17 1HH1 ARG 17 8.387 4.510 2.806
83 HH12 ARG 17 2HH1 ARG 17 7.298 3.283 3.411
84 HH21 ARG 17 1HH2 ARG 17 7.191 1.499 0.385
85 HH22 ARG 17 2HH2 ARG 17 6.601 1.587 2.033
86 H ILE 18 H ILE 18 13.608 5.605 0.095
87 HA ILE 18 HA ILE 18 14.851 5.275 2.771
88 HB ILE 18 HB ILE 18 16.756 6.565 2.184
89 HG12 ILE 18 2HG1 ILE 18 15.775 6.821 -0.676
90 HG13 ILE 18 3HG1 ILE 18 15.520 8.082 0.543
91 HG21 ILE 18 1HG2 ILE 18 16.362 4.549 -0.055
92 HG22 ILE 18 2HG2 ILE 18 17.906 5.131 0.611
93 HG23 ILE 18 3HG2 ILE 18 16.821 4.150 1.621
94 HD11 ILE 18 1HD1 ILE 18 17.530 8.596 -0.738
95 HD12 ILE 18 2HD1 ILE 18 17.958 8.217 0.942
96 HD13 ILE 18 3HD1 ILE 18 18.225 7.012 -0.339
97 H TYR 19 H TYR 19 15.487 7.671 3.465
98 HA TYR 19 HA TYR 19 13.224 9.456 2.803
99 HB2 TYR 19 2HB TYR 19 12.490 8.856 4.834
100 HB3 TYR 19 3HB TYR 19 14.092 8.483 5.453
101 HD1 TYR 19 HD1 TYR 19 15.579 10.226 6.332
102 HD2 TYR 19 HD2 TYR 19 11.562 11.121 5.076
103 HE1 TYR 19 HE1 TYR 19 15.649 12.339 7.624
104 HE2 TYR 19 HE2 TYR 19 11.634 13.245 6.391
105 HH TYR 19 HH TYR 19 12.865 14.588 7.741
106 H VAL 20 H VAL 20 13.533 11.706 2.882
107 HA VAL 20 HA VAL 20 16.377 12.534 2.930
108 HB VAL 20 HB VAL 20 14.492 13.214 0.646
109 HG11 VAL 20 1HG1 VAL 20 16.561 14.082 -0.387
110 HG12 VAL 20 2HG1 VAL 20 16.225 14.908 1.148
111 HG13 VAL 20 3HG1 VAL 20 17.478 13.649 1.073
112 HG21 VAL 20 1HG2 VAL 20 15.057 10.842 0.510
113 HG22 VAL 20 2HG2 VAL 20 15.957 11.752 -0.719
114 HG23 VAL 20 3HG2 VAL 20 16.782 11.211 0.762
115 H GLY 21 H GLY 21 15.973 13.625 4.891
116 HA2 GLY 21 2HA GLY 21 13.970 15.741 4.964
117 HA3 GLY 21 3HA GLY 21 15.190 15.381 6.201
118 H ASN 22 H ASN 22 14.420 17.991 4.937
119 HA ASN 22 HA ASN 22 15.357 19.861 4.036
120 HB2 ASN 22 2HB ASN 22 17.075 19.135 5.870
121 HB3 ASN 22 3HB ASN 22 18.084 18.639 4.512
122 HD21 ASN 22 1HD2 ASN 22 19.370 21.946 4.810
123 HD22 ASN 22 2HD2 ASN 22 19.612 20.273 5.281
124 H LEU 23 H LEU 23 17.461 20.448 2.399
125 HA LEU 23 HA LEU 23 17.607 18.390 0.306
126 HB2 LEU 23 2HB LEU 23 16.770 19.705 -1.428
127 HB3 LEU 23 3HB LEU 23 15.607 19.919 -0.117
128 HG LEU 23 HG LEU 23 17.860 21.880 -0.804
129 HD11 LEU 23 1HD1 LEU 23 16.051 23.260 -1.755
130 HD12 LEU 23 2HD1 LEU 23 16.192 21.700 -2.602
131 HD13 LEU 23 3HD1 LEU 23 14.880 21.964 -1.426
132 HD21 LEU 23 1HD2 LEU 23 15.456 22.068 1.068
133 HD22 LEU 23 2HD2 LEU 23 17.174 22.118 1.529
134 HD23 LEU 23 3HD2 LEU 23 16.477 23.447 0.588
135 HA PRO 24 HA PRO 24 21.747 19.834 0.161
136 HB2 PRO 24 2HB PRO 24 22.506 19.089 -2.377
137 HB3 PRO 24 3HB PRO 24 22.246 17.924 -1.038
138 HG2 PRO 24 2HG PRO 24 20.355 18.663 -3.281
139 HG3 PRO 24 3HG PRO 24 20.724 17.041 -2.608
140 HD2 PRO 24 2HD PRO 24 18.499 18.511 -1.905
141 HD3 PRO 24 3HD PRO 24 19.309 17.387 -0.774
142 HA PRO 25 HA PRO 25 21.780 23.859 -1.688
143 HB2 PRO 25 2HB PRO 25 24.672 23.498 -2.299
144 HB3 PRO 25 3HB PRO 25 23.873 24.735 -1.276
145 HG2 PRO 25 2HG PRO 25 25.333 22.658 -0.217
146 HG3 PRO 25 3HG PRO 25 23.880 23.333 0.592
147 HD2 PRO 25 2HD PRO 25 24.129 20.815 -1.045
148 HD3 PRO 25 3HD PRO 25 23.175 21.121 0.439
149 H ASP 26 H ASP 26 23.277 21.119 -3.373
150 HA ASP 26 HA ASP 26 23.111 22.461 -6.001
151 HB2 ASP 26 2HB ASP 26 23.913 19.601 -5.312
152 HB3 ASP 26 3HB ASP 26 24.248 20.484 -6.813
153 H ILE 27 H ILE 27 21.263 22.305 -7.195
154 HA ILE 27 HA ILE 27 19.702 19.848 -7.207
155 HB ILE 27 HB ILE 27 18.780 20.739 -5.221
156 HG12 ILE 27 2HG1 ILE 27 17.197 19.979 -7.161
157 HG13 ILE 27 3HG1 ILE 27 16.538 20.711 -5.692
158 HG21 ILE 27 1HG2 ILE 27 19.559 23.034 -5.324
159 HG22 ILE 27 2HG2 ILE 27 18.466 23.393 -6.672
160 HG23 ILE 27 3HG2 ILE 27 17.804 23.021 -5.066
161 HD11 ILE 27 1HD1 ILE 27 15.459 21.584 -7.744
162 HD12 ILE 27 2HD1 ILE 27 16.251 22.861 -6.800
163 HD13 ILE 27 3HD1 ILE 27 17.011 22.245 -8.284
164 H ARG 28 H ARG 28 18.569 19.613 -9.082
165 HA ARG 28 HA ARG 28 18.225 21.996 -10.827
166 HB2 ARG 28 2HB ARG 28 19.398 19.330 -11.695
167 HB3 ARG 28 3HB ARG 28 18.993 20.667 -12.777
168 HG2 ARG 28 2HG ARG 28 20.627 22.128 -11.647
169 HG3 ARG 28 3HG ARG 28 21.042 20.811 -10.522
170 HD2 ARG 28 2HD ARG 28 21.376 20.765 -13.546
171 HD3 ARG 28 3HD ARG 28 22.683 20.930 -12.354
172 HE ARG 28 HE ARG 28 21.638 18.627 -11.518
173 HH11 ARG 28 1HH1 ARG 28 22.291 19.645 -14.853
174 HH12 ARG 28 2HH1 ARG 28 22.457 18.005 -15.426
175 HH21 ARG 28 1HH2 ARG 28 21.793 16.558 -12.283
176 HH22 ARG 28 2HH2 ARG 28 22.169 16.229 -13.957
177 H THR 29 H THR 29 16.472 20.172 -9.091
178 HA THR 29 HA THR 29 14.504 19.129 -9.183
179 HB THR 29 HB THR 29 13.747 20.359 -11.794
180 HG1 THR 29 1HG THR 29 13.519 22.321 -10.721
181 HG21 THR 29 1HG2 THR 29 12.081 19.086 -10.469
182 HG22 THR 29 2HG2 THR 29 12.418 20.111 -9.058
183 HG23 THR 29 3HG2 THR 29 11.676 20.813 -10.511
184 H LYS 30 H LYS 30 16.822 17.866 -10.635
185 HA LYS 30 HA LYS 30 15.280 15.577 -11.675
186 HB2 LYS 30 2HB LYS 30 15.781 17.220 -13.593
187 HB3 LYS 30 3HB LYS 30 17.495 16.852 -13.317
188 HG2 LYS 30 2HG LYS 30 16.810 14.355 -13.604
189 HG3 LYS 30 3HG LYS 30 15.266 14.977 -14.200
190 HD2 LYS 30 2HD LYS 30 16.739 14.541 -16.089
191 HD3 LYS 30 3HD LYS 30 16.550 16.301 -15.932
192 HE2 LYS 30 2HE LYS 30 18.695 16.477 -14.791
193 HE3 LYS 30 3HE LYS 30 18.832 14.716 -14.695
194 HZ1 LYS 30 1HZ LYS 30 18.958 14.645 -17.087
195 HZ2 LYS 30 2HZ LYS 30 18.816 16.282 -17.190
196 HZ3 LYS 30 3HZ LYS 30 20.144 15.610 -16.489
197 H ASP 31 H ASP 31 17.853 16.974 -9.951
198 HA ASP 31 HA ASP 31 19.911 15.089 -10.314
199 HB2 ASP 31 2HB ASP 31 19.145 16.915 -8.029
200 HB3 ASP 31 3HB ASP 31 20.581 15.885 -7.962
201 H ILE 32 H ILE 32 16.889 14.739 -8.603
202 HA ILE 32 HA ILE 32 17.770 12.569 -6.906
203 HB ILE 32 HB ILE 32 14.949 13.290 -7.771
204 HG12 ILE 32 2HG1 ILE 32 15.995 15.329 -6.929
205 HG13 ILE 32 3HG1 ILE 32 14.839 14.708 -5.751
206 HG21 ILE 32 1HG2 ILE 32 16.104 11.841 -5.357
207 HG22 ILE 32 2HG2 ILE 32 14.407 12.370 -5.494
208 HG23 ILE 32 3HG2 ILE 32 15.064 11.160 -6.621
209 HD11 ILE 32 1HD1 ILE 32 16.912 15.458 -4.650
210 HD12 ILE 32 2HD1 ILE 32 16.698 13.704 -4.440
211 HD13 ILE 32 3HD1 ILE 32 17.865 14.326 -5.632
212 H GLU 33 H GLU 33 16.919 12.828 -10.285
213 HA GLU 33 HA GLU 33 16.877 9.855 -10.413
214 HB2 GLU 33 2HB GLU 33 15.307 10.006 -12.288
215 HB3 GLU 33 3HB GLU 33 14.620 10.677 -10.797
216 HG2 GLU 33 2HG GLU 33 15.166 12.966 -11.572
217 HG3 GLU 33 3HG GLU 33 15.830 12.287 -13.075
218 H ASP 34 H ASP 34 18.864 12.302 -10.864
219 HA ASP 34 HA ASP 34 20.066 10.925 -13.205
220 HB2 ASP 34 2HB ASP 34 19.304 12.982 -14.074
221 HB3 ASP 34 3HB ASP 34 19.906 13.892 -12.680
222 H VAL 35 H VAL 35 21.000 13.235 -10.556
223 HA VAL 35 HA VAL 35 23.703 12.209 -10.511
224 HB VAL 35 HB VAL 35 22.131 13.842 -8.478
225 HG11 VAL 35 1HG1 VAL 35 24.033 12.712 -7.411
226 HG12 VAL 35 2HG1 VAL 35 25.113 13.266 -8.713
227 HG13 VAL 35 3HG1 VAL 35 24.376 14.443 -7.603
228 HG21 VAL 35 1HG2 VAL 35 22.400 14.950 -10.679
229 HG22 VAL 35 2HG2 VAL 35 23.407 15.732 -9.442
230 HG23 VAL 35 3HG2 VAL 35 24.149 14.634 -10.627
231 H PHE 36 H PHE 36 20.895 11.858 -8.258
232 HA PHE 36 HA PHE 36 22.158 9.779 -6.779
233 HB2 PHE 36 2HB PHE 36 19.329 10.767 -6.965
234 HB3 PHE 36 3HB PHE 36 19.749 9.337 -6.015
235 HD1 PHE 36 HD1 PHE 36 21.474 9.492 -4.186
236 HD2 PHE 36 HD2 PHE 36 19.743 12.950 -6.064
237 HE1 PHE 36 HE1 PHE 36 22.190 10.896 -2.268
238 HE2 PHE 36 HE2 PHE 36 20.451 14.352 -4.139
239 HZ PHE 36 HZ PHE 36 21.680 13.320 -2.242
240 H SER 37 H SER 37 20.620 9.722 -9.874
241 HA SER 37 HA SER 37 19.967 6.910 -9.859
242 HB2 SER 37 2HB SER 37 18.941 8.485 -11.446
243 HB3 SER 37 3HB SER 37 20.537 8.827 -12.151
244 HG SER 37 HG SER 37 19.358 7.235 -13.318
245 H LYS 38 H LYS 38 22.914 8.823 -10.519
246 HA LYS 38 HA LYS 38 24.422 6.496 -11.406
247 HB2 LYS 38 2HB LYS 38 25.266 9.228 -10.351
248 HB3 LYS 38 3HB LYS 38 26.386 7.991 -10.964
249 HG2 LYS 38 2HG LYS 38 25.208 7.972 -13.139
250 HG3 LYS 38 3HG LYS 38 24.106 9.237 -12.559
251 HD2 LYS 38 2HD LYS 38 27.136 9.510 -12.767
252 HD3 LYS 38 3HD LYS 38 25.979 10.131 -13.954
253 HE2 LYS 38 2HE LYS 38 24.930 11.526 -12.188
254 HE3 LYS 38 3HE LYS 38 26.118 10.926 -11.014
255 HZ1 LYS 38 1HZ LYS 38 26.739 12.453 -13.458
256 HZ2 LYS 38 2HZ LYS 38 26.774 13.040 -11.920
257 HZ3 LYS 38 3HZ LYS 38 27.845 11.880 -12.383
258 H TYR 39 H TYR 39 23.545 7.940 -8.294
259 HA TYR 39 HA TYR 39 25.405 6.323 -6.806
260 HB2 TYR 39 2HB TYR 39 23.143 8.124 -6.077
261 HB3 TYR 39 3HB TYR 39 23.725 6.962 -4.891
262 HD1 TYR 39 HD1 TYR 39 24.693 9.932 -6.893
263 HD2 TYR 39 HD2 TYR 39 25.844 7.144 -3.833
264 HE1 TYR 39 HE1 TYR 39 26.564 11.423 -6.248
265 HE2 TYR 39 HE2 TYR 39 27.710 8.632 -3.165
266 HH TYR 39 HH TYR 39 28.825 10.593 -3.590
267 H GLY 40 H GLY 40 22.242 5.519 -8.116
268 HA2 GLY 40 2HA GLY 40 22.539 2.804 -7.328
269 HA3 GLY 40 3HA GLY 40 21.504 3.614 -6.135
270 H ALA 41 H ALA 41 21.262 4.879 -9.368
271 HA ALA 41 HA ALA 41 19.554 4.877 -10.866
272 HB1 ALA 41 1HB ALA 41 20.706 2.805 -11.461
273 HB2 ALA 41 2HB ALA 41 19.685 1.893 -10.320
274 HB3 ALA 41 3HB ALA 41 18.958 2.664 -11.749
275 H ILE 42 H ILE 42 18.209 6.074 -9.308
276 HA ILE 42 HA ILE 42 16.229 4.852 -7.690
277 HB ILE 42 HB ILE 42 16.561 7.549 -9.016
278 HG12 ILE 42 2HG1 ILE 42 16.504 8.284 -6.629
279 HG13 ILE 42 3HG1 ILE 42 16.327 6.589 -6.127
280 HG21 ILE 42 1HG2 ILE 42 14.517 8.331 -7.848
281 HG22 ILE 42 2HG2 ILE 42 14.155 7.170 -9.140
282 HG23 ILE 42 3HG2 ILE 42 14.131 6.647 -7.428
283 HD11 ILE 42 1HD1 ILE 42 18.685 7.483 -6.001
284 HD12 ILE 42 2HD1 ILE 42 18.519 6.039 -7.022
285 HD13 ILE 42 3HD1 ILE 42 18.654 7.652 -7.771
286 H ARG 43 H ARG 43 14.141 4.189 -8.043
287 HA ARG 43 HA ARG 43 13.321 3.892 -10.897
288 HB2 ARG 43 2HB ARG 43 12.449 2.485 -8.348
289 HB3 ARG 43 3HB ARG 43 11.697 2.235 -9.939
290 HG2 ARG 43 2HG ARG 43 13.906 1.529 -10.855
291 HG3 ARG 43 3HG ARG 43 14.618 1.715 -9.239
292 HD2 ARG 43 2HD ARG 43 12.286 -0.134 -9.933
293 HD3 ARG 43 3HD ARG 43 13.969 -0.647 -9.759
294 HE ARG 43 HE ARG 43 13.887 -0.159 -7.413
295 HH11 ARG 43 1HH1 ARG 43 10.752 0.136 -9.030
296 HH12 ARG 43 2HH1 ARG 43 9.854 0.006 -7.535
297 HH21 ARG 43 1HH2 ARG 43 12.702 -0.358 -5.516
298 HH22 ARG 43 2HH2 ARG 43 10.953 -0.228 -5.548
299 H ASP 44 H ASP 44 12.409 5.334 -7.792
300 HA ASP 44 HA ASP 44 10.304 6.854 -9.136
301 HB2 ASP 44 2HB ASP 44 9.725 4.773 -7.046
302 HB3 ASP 44 3HB ASP 44 8.719 6.221 -7.169
303 H ILE 45 H ILE 45 9.357 8.565 -7.897
304 HA ILE 45 HA ILE 45 11.083 9.501 -5.659
305 HB ILE 45 HB ILE 45 10.114 10.952 -8.131
306 HG12 ILE 45 2HG1 ILE 45 12.822 10.894 -6.741
307 HG13 ILE 45 3HG1 ILE 45 12.366 9.773 -8.039
308 HG21 ILE 45 1HG2 ILE 45 9.477 12.375 -6.241
309 HG22 ILE 45 2HG2 ILE 45 11.116 12.209 -5.543
310 HG23 ILE 45 3HG2 ILE 45 10.872 13.069 -7.075
311 HD11 ILE 45 1HD1 ILE 45 12.541 12.808 -8.260
312 HD12 ILE 45 2HD1 ILE 45 13.633 11.615 -8.986
313 HD13 ILE 45 3HD1 ILE 45 11.953 11.724 -9.549
314 H ASP 46 H ASP 46 10.004 10.764 -4.067
315 HA ASP 46 HA ASP 46 7.058 10.939 -4.270
316 HB2 ASP 46 2HB ASP 46 7.623 8.779 -3.158
317 HB3 ASP 46 3HB ASP 46 8.537 9.675 -1.934
318 H LEU 47 H LEU 47 8.701 13.038 -4.700
319 HA LEU 47 HA LEU 47 9.486 14.532 -2.428
320 HB2 LEU 47 2HB LEU 47 10.219 15.084 -4.693
321 HB3 LEU 47 3HB LEU 47 8.544 15.359 -5.198
322 HG LEU 47 HG LEU 47 8.402 17.260 -3.567
323 HD11 LEU 47 1HD1 LEU 47 10.551 18.153 -2.670
324 HD12 LEU 47 2HD1 LEU 47 10.157 16.564 -1.987
325 HD13 LEU 47 3HD1 LEU 47 11.386 16.701 -3.263
326 HD21 LEU 47 1HD2 LEU 47 8.944 17.641 -5.938
327 HD22 LEU 47 2HD2 LEU 47 9.809 18.796 -4.895
328 HD23 LEU 47 3HD2 LEU 47 10.674 17.407 -5.590
329 H LYS 48 H LYS 48 8.421 15.830 -1.015
330 HA LYS 48 HA LYS 48 5.578 16.490 -1.505
331 HB2 LYS 48 2HB LYS 48 5.584 14.323 -0.332
332 HB3 LYS 48 3HB LYS 48 6.630 14.986 0.930
333 HG2 LYS 48 2HG LYS 48 4.867 16.606 1.560
334 HG3 LYS 48 3HG LYS 48 3.816 15.970 0.276
335 HD2 LYS 48 2HD LYS 48 4.935 14.342 2.610
336 HD3 LYS 48 3HD LYS 48 3.315 15.053 2.573
337 HE2 LYS 48 2HE LYS 48 4.370 13.042 0.541
338 HE3 LYS 48 3HE LYS 48 3.385 12.618 1.949
339 HZ1 LYS 48 1HZ LYS 48 2.077 12.878 -0.047
340 HZ2 LYS 48 2HZ LYS 48 1.630 13.958 1.104
341 HZ3 LYS 48 3HZ LYS 48 2.533 14.452 -0.188
342 H ASN 49 H ASN 49 4.809 18.266 -0.218
343 HA ASN 49 HA ASN 49 6.917 19.765 1.242
344 HB2 ASN 49 2HB ASN 49 6.183 21.845 0.085
345 HB3 ASN 49 3HB ASN 49 6.945 20.667 -0.990
346 HD21 ASN 49 1HD2 ASN 49 4.142 21.692 -3.013
347 HD22 ASN 49 2HD2 ASN 49 5.788 22.118 -2.597
348 H ARG 50 H ARG 50 3.983 18.324 1.496
349 HA ARG 50 HA ARG 50 2.380 20.303 2.794
350 HB2 ARG 50 2HB ARG 50 1.529 18.164 1.899
351 HB3 ARG 50 3HB ARG 50 2.489 17.272 3.085
352 HG2 ARG 50 2HG ARG 50 0.125 17.419 3.754
353 HG3 ARG 50 3HG ARG 50 1.167 18.247 4.924
354 HD2 ARG 50 2HD ARG 50 0.576 20.412 3.971
355 HD3 ARG 50 3HD ARG 50 -0.332 19.626 2.660
356 HE ARG 50 HE ARG 50 -1.684 18.639 4.705
357 HH11 ARG 50 1HH1 ARG 50 -0.435 21.930 4.353
358 HH12 ARG 50 2HH1 ARG 50 -1.695 22.625 5.349
359 HH21 ARG 50 1HH2 ARG 50 -3.283 19.559 5.971
360 HH22 ARG 50 2HH2 ARG 50 -3.311 21.284 6.270
361 H ARG 51 H ARG 51 5.270 18.708 3.713
362 HA ARG 51 HA ARG 51 5.038 18.667 6.564
363 HB2 ARG 51 2HB ARG 51 6.706 17.377 5.415
364 HB3 ARG 51 3HB ARG 51 7.322 18.807 4.572
365 HG2 ARG 51 2HG ARG 51 8.137 19.727 6.736
366 HG3 ARG 51 3HG ARG 51 7.577 18.241 7.555
367 HD2 ARG 51 2HD ARG 51 9.039 16.897 6.081
368 HD3 ARG 51 3HD ARG 51 9.555 18.366 5.236
369 HE ARG 51 HE ARG 51 10.482 17.389 7.825
370 HH11 ARG 51 1HH1 ARG 51 10.103 20.278 5.804
371 HH12 ARG 51 2HH1 ARG 51 11.400 21.130 6.605
372 HH21 ARG 51 1HH2 ARG 51 12.170 18.491 8.785
373 HH22 ARG 51 2HH2 ARG 51 12.574 20.125 8.308
374 H GLY 52 H GLY 52 5.454 21.283 4.283
375 HA2 GLY 52 2HA GLY 52 5.668 23.556 4.635
376 HA3 GLY 52 3HA GLY 52 5.617 23.284 6.389
377 H GLY 53 H GLY 53 7.397 25.156 5.353
378 HA2 GLY 53 2HA GLY 53 9.630 25.748 5.410
379 HA3 GLY 53 3HA GLY 53 9.903 24.272 6.355
380 HA PRO 54 HA PRO 54 12.240 23.585 2.446
381 HB2 PRO 54 2HB PRO 54 13.547 21.640 4.318
382 HB3 PRO 54 3HB PRO 54 14.306 22.768 3.150
383 HG2 PRO 54 2HG PRO 54 14.309 23.286 5.834
384 HG3 PRO 54 3HG PRO 54 14.091 24.599 4.626
385 HD2 PRO 54 2HD PRO 54 12.012 23.201 6.302
386 HD3 PRO 54 3HD PRO 54 12.134 24.931 5.856
387 HA PRO 55 HA PRO 55 9.829 20.007 1.434
388 HB2 PRO 55 2HB PRO 55 11.156 19.105 -0.798
389 HB3 PRO 55 3HB PRO 55 10.152 20.594 -0.786
390 HG2 PRO 55 2HG PRO 55 13.157 20.339 -0.539
391 HG3 PRO 55 3HG PRO 55 12.210 21.511 -1.518
392 HD2 PRO 55 2HD PRO 55 13.270 22.138 0.936
393 HD3 PRO 55 3HD PRO 55 11.732 22.834 0.344
394 H PHE 56 H PHE 56 10.031 17.605 1.101
395 HA PHE 56 HA PHE 56 12.596 16.356 1.776
396 HB2 PHE 56 2HB PHE 56 11.932 15.359 3.781
397 HB3 PHE 56 3HB PHE 56 11.322 16.995 3.970
398 HD1 PHE 56 HD1 PHE 56 8.758 17.148 2.784
399 HD2 PHE 56 HD2 PHE 56 10.589 13.726 4.640
400 HE1 PHE 56 HE1 PHE 56 6.513 16.215 3.294
401 HE2 PHE 56 HE2 PHE 56 8.350 12.831 5.208
402 HZ PHE 56 HZ PHE 56 6.311 14.072 4.524
403 H ALA 57 H ALA 57 12.216 13.870 1.539
404 HA ALA 57 HA ALA 57 9.889 13.210 -0.137
405 HB1 ALA 57 1HB ALA 57 12.727 13.183 -1.248
406 HB2 ALA 57 2HB ALA 57 11.253 12.666 -2.103
407 HB3 ALA 57 3HB ALA 57 11.482 14.374 -1.666
408 H PHE 58 H PHE 58 9.917 10.963 -0.877
409 HA PHE 58 HA PHE 58 11.630 9.193 0.791
410 HB2 PHE 58 2HB PHE 58 8.719 8.836 0.054
411 HB3 PHE 58 3HB PHE 58 9.738 7.576 0.750
412 HD1 PHE 58 HD1 PHE 58 10.827 7.984 3.021
413 HD2 PHE 58 HD2 PHE 58 7.648 10.405 1.446
414 HE1 PHE 58 HE1 PHE 58 10.322 8.817 5.309
415 HE2 PHE 58 HE2 PHE 58 7.179 11.281 3.717
416 HZ PHE 58 HZ PHE 58 8.509 10.479 5.653
417 H VAL 59 H VAL 59 13.170 9.180 -0.899
418 HA VAL 59 HA VAL 59 12.511 8.518 -3.605
419 HB VAL 59 HB VAL 59 15.125 8.404 -2.045
420 HG11 VAL 59 1HG1 VAL 59 14.602 8.434 -5.048
421 HG12 VAL 59 2HG1 VAL 59 16.201 8.585 -4.279
422 HG13 VAL 59 3HG1 VAL 59 15.278 7.075 -4.113
423 HG21 VAL 59 1HG2 VAL 59 14.085 10.645 -2.085
424 HG22 VAL 59 2HG2 VAL 59 15.536 10.601 -3.103
425 HG23 VAL 59 3HG2 VAL 59 13.929 10.545 -3.855
426 H GLU 60 H GLU 60 12.830 6.556 -4.768
427 HA GLU 60 HA GLU 60 13.048 4.129 -3.050
428 HB2 GLU 60 2HB GLU 60 10.728 4.543 -3.703
429 HB3 GLU 60 3HB GLU 60 11.207 4.609 -5.415
430 HG2 GLU 60 2HG GLU 60 11.993 2.284 -5.314
431 HG3 GLU 60 3HG GLU 60 11.592 2.195 -3.590
432 H PHE 61 H PHE 61 14.649 2.836 -3.549
433 HA PHE 61 HA PHE 61 16.134 3.327 -6.039
434 HB2 PHE 61 2HB PHE 61 16.862 2.073 -3.404
435 HB3 PHE 61 3HB PHE 61 17.871 1.880 -4.834
436 HD1 PHE 61 HD1 PHE 61 19.511 3.430 -5.316
437 HD2 PHE 61 HD2 PHE 61 16.201 4.580 -2.833
438 HE1 PHE 61 HE1 PHE 61 20.577 5.637 -4.924
439 HE2 PHE 61 HE2 PHE 61 17.260 6.788 -2.442
440 HZ PHE 61 HZ PHE 61 19.452 7.319 -3.481
441 H GLU 62 H GLU 62 17.286 1.553 -7.147
442 HA GLU 62 HA GLU 62 15.453 -0.572 -7.876
443 HB2 GLU 62 2HB GLU 62 16.946 0.422 -9.514
444 HB3 GLU 62 3HB GLU 62 18.370 -0.037 -8.555
445 HG2 GLU 62 2HG GLU 62 17.865 -2.408 -8.867
446 HG3 GLU 62 3HG GLU 62 16.345 -2.012 -9.686
447 H ASP 63 H ASP 63 18.229 -0.220 -5.705
448 HA ASP 63 HA ASP 63 17.666 -2.890 -4.614
449 HB2 ASP 63 2HB ASP 63 20.338 -1.978 -5.702
450 HB3 ASP 63 3HB ASP 63 20.221 -3.217 -4.450
451 HA PRO 64 HA PRO 64 18.126 -0.729 -0.830
452 HB2 PRO 64 2HB PRO 64 18.494 -2.792 0.918
453 HB3 PRO 64 3HB PRO 64 16.933 -2.483 0.089
454 HG2 PRO 64 2HG PRO 64 19.084 -4.488 -0.645
455 HG3 PRO 64 3HG PRO 64 17.306 -4.725 -0.591
456 HD2 PRO 64 2HD PRO 64 18.703 -4.185 -2.916
457 HD3 PRO 64 3HD PRO 64 17.012 -3.659 -2.654
458 H ARG 65 H ARG 65 20.657 -2.787 -2.128
459 HA ARG 65 HA ARG 65 22.603 -2.185 -0.060
460 HB2 ARG 65 2HB ARG 65 22.686 -4.269 -1.321
461 HB3 ARG 65 3HB ARG 65 22.866 -3.388 -2.852
462 HG2 ARG 65 2HG ARG 65 24.840 -2.844 -0.641
463 HG3 ARG 65 3HG ARG 65 24.972 -4.383 -1.510
464 HD2 ARG 65 2HD ARG 65 25.296 -3.309 -3.615
465 HD3 ARG 65 3HD ARG 65 24.783 -1.739 -2.976
466 HE ARG 65 HE ARG 65 27.243 -3.032 -1.905
467 HH11 ARG 65 1HH1 ARG 65 25.730 -0.443 -3.788
468 HH12 ARG 65 2HH1 ARG 65 27.079 0.653 -3.582
469 HH21 ARG 65 1HH2 ARG 65 29.018 -1.599 -1.717
470 HH22 ARG 65 2HH2 ARG 65 28.950 -0.021 -2.472
471 H ASP 66 H ASP 66 21.745 -0.824 -3.246
472 HA ASP 66 HA ASP 66 24.048 0.947 -3.257
473 HB2 ASP 66 2HB ASP 66 21.563 0.769 -4.982
474 HB3 ASP 66 3HB ASP 66 22.819 1.998 -5.204
475 H ALA 67 H ALA 67 20.936 1.038 -1.766
476 HA ALA 67 HA ALA 67 20.622 3.887 -1.668
477 HB1 ALA 67 1HB ALA 67 18.767 2.337 -1.259
478 HB2 ALA 67 2HB ALA 67 19.613 1.656 0.148
479 HB3 ALA 67 3HB ALA 67 19.046 3.338 0.183
480 H GLU 68 H GLU 68 22.715 1.626 0.002
481 HA GLU 68 HA GLU 68 23.218 3.239 2.339
482 HB2 GLU 68 2HB GLU 68 24.897 1.113 0.939
483 HB3 GLU 68 3HB GLU 68 25.222 1.762 2.549
484 HG2 GLU 68 2HG GLU 68 22.630 0.350 1.762
485 HG3 GLU 68 3HG GLU 68 24.015 -0.460 2.504
486 H ASP 69 H ASP 69 24.559 3.089 -0.957
487 HA ASP 69 HA ASP 69 26.796 4.835 -0.348
488 HB2 ASP 69 2HB ASP 69 25.557 3.854 -2.935
489 HB3 ASP 69 3HB ASP 69 26.969 4.918 -2.864
490 H ALA 70 H ALA 70 23.502 5.274 -1.577
491 HA ALA 70 HA ALA 70 23.880 8.033 -2.350
492 HB1 ALA 70 1HB ALA 70 21.375 6.434 -1.682
493 HB2 ALA 70 2HB ALA 70 21.412 8.023 -2.483
494 HB3 ALA 70 3HB ALA 70 22.107 6.601 -3.298
495 H VAL 71 H VAL 71 22.963 6.314 0.631
496 HA VAL 71 HA VAL 71 22.105 8.698 2.039
497 HB VAL 71 HB VAL 71 22.820 5.838 2.771
498 HG11 VAL 71 1HG1 VAL 71 22.187 8.093 4.725
499 HG12 VAL 71 2HG1 VAL 71 22.173 6.366 5.121
500 HG13 VAL 71 3HG1 VAL 71 23.694 7.145 4.642
501 HG21 VAL 71 1HG2 VAL 71 20.581 6.382 1.803
502 HG22 VAL 71 2HG2 VAL 71 20.460 5.808 3.483
503 HG23 VAL 71 3HG2 VAL 71 20.307 7.542 3.124
504 H SER 72 H SER 72 25.136 6.770 1.768
505 HA SER 72 HA SER 72 26.583 8.472 3.604
506 HB2 SER 72 2HB SER 72 27.544 6.441 1.548
507 HB3 SER 72 3HB SER 72 28.557 7.202 2.791
508 HG SER 72 HG SER 72 26.336 5.490 3.158
509 H GLY 73 H GLY 73 25.356 9.190 0.605
510 HA2 GLY 73 2HA GLY 73 27.674 10.262 -0.719
511 HA3 GLY 73 3HA GLY 73 25.974 10.536 -1.138
512 H ARG 74 H ARG 74 25.208 11.680 1.497
513 HA ARG 74 HA ARG 74 26.894 14.009 1.884
514 HB2 ARG 74 2HB ARG 74 25.619 14.315 -0.372
515 HB3 ARG 74 3HB ARG 74 24.193 14.602 0.640
516 HG2 ARG 74 2HG ARG 74 25.367 16.472 1.777
517 HG3 ARG 74 3HG ARG 74 26.848 16.091 0.870
518 HD2 ARG 74 2HD ARG 74 25.558 16.483 -1.255
519 HD3 ARG 74 3HD ARG 74 24.197 17.058 -0.276
520 HE ARG 74 HE ARG 74 26.081 18.677 0.662
521 HH11 ARG 74 1HH1 ARG 74 25.529 17.656 -2.680
522 HH12 ARG 74 2HH1 ARG 74 26.216 19.113 -3.364
523 HH21 ARG 74 1HH2 ARG 74 27.007 20.551 -0.265
524 HH22 ARG 74 2HH2 ARG 74 27.049 20.741 -2.005
525 H ASP 75 H ASP 75 25.564 11.895 3.530
526 HA ASP 75 HA ASP 75 23.299 13.054 4.803
527 HB2 ASP 75 2HB ASP 75 23.801 11.397 6.645
528 HB3 ASP 75 3HB ASP 75 23.466 10.756 5.041
529 H GLY 76 H GLY 76 22.970 14.161 6.681
530 HA2 GLY 76 2HA GLY 76 23.414 15.595 8.393
531 HA3 GLY 76 3HA GLY 76 24.879 14.635 8.688
532 H TYR 77 H TYR 77 23.897 16.826 5.943
533 HA TYR 77 HA TYR 77 26.613 17.944 6.126
534 HB2 TYR 77 2HB TYR 77 26.241 16.968 4.025
535 HB3 TYR 77 3HB TYR 77 24.648 17.713 3.867
536 HD1 TYR 77 HD1 TYR 77 28.225 18.134 3.361
537 HD2 TYR 77 HD2 TYR 77 24.443 20.177 3.459
538 HE1 TYR 77 HE1 TYR 77 29.226 20.032 2.117
539 HE2 TYR 77 HE2 TYR 77 25.437 22.086 2.224
540 HH TYR 77 HH TYR 77 27.332 22.959 1.267
541 H ASP 78 H ASP 78 27.092 20.001 6.332
542 HA ASP 78 HA ASP 78 25.229 21.683 7.709
543 HB2 ASP 78 2HB ASP 78 27.564 21.721 8.281
544 HB3 ASP 78 3HB ASP 78 28.016 22.135 6.623
545 H TYR 79 H TYR 79 23.454 21.897 6.232
546 HA TYR 79 HA TYR 79 23.867 23.424 3.787
547 HB2 TYR 79 2HB TYR 79 22.247 21.647 3.791
548 HB3 TYR 79 3HB TYR 79 21.438 22.311 5.207
549 HD1 TYR 79 HD1 TYR 79 21.896 22.603 1.581
550 HD2 TYR 79 HD2 TYR 79 19.981 24.261 5.045
551 HE1 TYR 79 HE1 TYR 79 20.348 23.861 0.107
552 HE2 TYR 79 HE2 TYR 79 18.407 25.516 3.581
553 HH TYR 79 HH TYR 79 18.589 25.336 0.012
554 H ASP 80 H ASP 80 22.280 25.305 3.432
555 HA ASP 80 HA ASP 80 23.058 27.394 5.205
556 HB2 ASP 80 2HB ASP 80 22.714 27.863 2.892
557 HB3 ASP 80 3HB ASP 80 21.051 27.262 2.944
558 H GLY 81 H GLY 81 22.421 27.038 7.314
559 HA2 GLY 81 2HA GLY 81 21.019 27.665 9.048
560 HA3 GLY 81 3HA GLY 81 19.684 27.877 7.905
561 H TYR 82 H TYR 82 20.932 24.869 7.191
562 HA TYR 82 HA TYR 82 19.445 23.436 9.310
563 HB2 TYR 82 2HB TYR 82 18.822 23.232 6.346
564 HB3 TYR 82 3HB TYR 82 18.255 22.098 7.567
565 HD1 TYR 82 HD1 TYR 82 16.421 22.611 9.028
566 HD2 TYR 82 HD2 TYR 82 18.025 25.590 6.371
567 HE1 TYR 82 HE1 TYR 82 14.439 24.043 9.445
568 HE2 TYR 82 HE2 TYR 82 16.041 27.029 6.774
569 HH TYR 82 HH TYR 82 14.051 27.253 7.883
570 H ARG 83 H ARG 83 19.452 20.904 8.419
571 HA ARG 83 HA ARG 83 22.245 20.225 7.631
572 HB2 ARG 83 2HB ARG 83 21.715 20.270 10.221
573 HB3 ARG 83 3HB ARG 83 20.835 18.771 9.876
574 HG2 ARG 83 2HG ARG 83 23.029 18.095 10.496
575 HG3 ARG 83 3HG ARG 83 23.014 17.976 8.720
576 HD2 ARG 83 2HD ARG 83 24.051 20.238 8.591
577 HD3 ARG 83 3HD ARG 83 24.037 20.335 10.361
578 HE ARG 83 HE ARG 83 25.508 18.116 9.015
579 HH11 ARG 83 1HH1 ARG 83 27.657 17.842 9.681
580 HH12 ARG 83 2HH1 ARG 83 28.417 19.023 10.723
581 HH21 ARG 83 1HH2 ARG 83 25.564 21.064 10.968
582 HH22 ARG 83 2HH2 ARG 83 27.226 20.837 11.468
583 H LEU 84 H LEU 84 22.283 18.570 6.170
584 HA LEU 84 HA LEU 84 19.837 17.590 5.050
585 HB2 LEU 84 2HB LEU 84 22.771 16.950 4.785
586 HB3 LEU 84 3HB LEU 84 21.604 15.794 4.138
587 HG LEU 84 HG LEU 84 22.442 17.435 2.456
588 HD11 LEU 84 1HD1 LEU 84 20.261 17.862 1.458
589 HD12 LEU 84 2HD1 LEU 84 20.261 16.261 2.219
590 HD13 LEU 84 3HD1 LEU 84 19.451 17.629 3.022
591 HD21 LEU 84 1HD2 LEU 84 20.768 19.452 3.997
592 HD22 LEU 84 2HD2 LEU 84 22.545 19.402 4.003
593 HD23 LEU 84 3HD2 LEU 84 21.666 19.738 2.493
594 H ARG 85 H ARG 85 18.657 15.770 5.409
595 HA ARG 85 HA ARG 85 19.753 13.746 7.301
596 HB2 ARG 85 2HB ARG 85 16.927 14.873 7.278
597 HB3 ARG 85 3HB ARG 85 17.473 13.464 8.213
598 HG2 ARG 85 2HG ARG 85 19.212 14.934 9.290
599 HG3 ARG 85 3HG ARG 85 18.458 16.331 8.496
600 HD2 ARG 85 2HD ARG 85 17.023 14.396 10.366
601 HD3 ARG 85 3HD ARG 85 17.667 15.972 10.846
602 HE ARG 85 HE ARG 85 15.266 15.453 9.216
603 HH11 ARG 85 1HH1 ARG 85 17.646 17.823 10.338
604 HH12 ARG 85 2HH1 ARG 85 16.567 19.181 10.135
605 HH21 ARG 85 1HH2 ARG 85 13.888 17.247 8.933
606 HH22 ARG 85 2HH2 ARG 85 14.479 18.865 9.242
607 H VAL 86 H VAL 86 20.275 13.323 4.771
608 HA VAL 86 HA VAL 86 18.131 11.722 3.563
609 HB VAL 86 HB VAL 86 19.558 12.893 2.052
610 HG11 VAL 86 1HG1 VAL 86 21.972 11.500 3.284
611 HG12 VAL 86 2HG1 VAL 86 21.970 12.582 1.881
612 HG13 VAL 86 3HG1 VAL 86 21.551 13.217 3.482
613 HG21 VAL 86 1HG2 VAL 86 20.383 9.963 2.067
614 HG22 VAL 86 2HG2 VAL 86 18.873 10.614 1.385
615 HG23 VAL 86 3HG2 VAL 86 20.439 11.066 0.674
616 H GLU 87 H GLU 87 17.602 10.078 4.920
617 HA GLU 87 HA GLU 87 19.557 7.918 5.215
618 HB2 GLU 87 2HB GLU 87 19.261 7.746 7.650
619 HB3 GLU 87 3HB GLU 87 20.001 9.295 7.217
620 HG2 GLU 87 2HG GLU 87 17.792 10.408 7.390
621 HG3 GLU 87 3HG GLU 87 17.038 8.866 7.818
622 H PHE 88 H PHE 88 18.456 5.970 6.323
623 HA PHE 88 HA PHE 88 16.079 5.397 4.880
624 HB2 PHE 88 2HB PHE 88 17.524 3.975 7.114
625 HB3 PHE 88 3HB PHE 88 16.088 3.313 6.322
626 HD1 PHE 88 HD1 PHE 88 19.660 4.089 5.947
627 HD2 PHE 88 HD2 PHE 88 16.153 2.542 3.993
628 HE1 PHE 88 HE1 PHE 88 21.080 3.131 4.154
629 HE2 PHE 88 HE2 PHE 88 17.580 1.570 2.210
630 HZ PHE 88 HZ PHE 88 20.050 1.861 2.298
631 HA PRO 89 HA PRO 89 12.793 6.669 7.518
632 HB2 PRO 89 2HB PRO 89 10.942 4.666 7.065
633 HB3 PRO 89 3HB PRO 89 11.286 6.006 5.926
634 HG2 PRO 89 2HG PRO 89 12.336 3.166 5.884
635 HG3 PRO 89 3HG PRO 89 11.758 4.168 4.509
636 HD2 PRO 89 2HD PRO 89 14.412 3.850 5.066
637 HD3 PRO 89 3HD PRO 89 13.749 5.393 4.433
638 H5' A 90 1H5* A 90 16.614 21.828 14.478
639 H5'' A 90 2H5* A 90 15.569 22.999 15.312
640 H4' A 90 H4* A 90 14.552 20.709 13.564
641 H3' A 90 H3* A 90 15.842 22.799 12.470
642 H2' A 90 1H2* A 90 14.942 24.579 13.674
643 HO2' A 90 2HO* A 90 13.038 24.113 11.614
644 H1' A 90 H1* A 90 12.128 23.736 13.822
645 H8 A 90 H8 A 90 13.740 26.275 14.853
646 H61 A 90 1H6 A 90 13.469 25.106 20.929
647 H62 A 90 2H6 A 90 13.772 26.336 19.717
648 H2 A 90 H2 A 90 12.625 21.315 18.761
649 HO5' A 90 H5T A 90 14.596 21.216 16.378
650 H5' A 91 1H5* A 91 12.126 19.538 10.532
651 H5'' A 91 2H5* A 91 11.951 20.308 12.126
652 H4' A 91 H4* A 91 12.875 17.435 11.925
653 H3' A 91 H3* A 91 10.460 18.221 10.730
654 H2' A 91 1H2* A 91 9.438 18.983 12.701
655 HO2' A 91 2HO* A 91 9.083 16.155 12.728
656 H1' A 91 H1* A 91 10.785 16.747 14.244
657 H8 A 91 H8 A 91 9.758 17.047 16.607
658 H61 A 91 1H6 A 91 8.670 22.968 18.079
659 H62 A 91 2H6 A 91 8.622 21.316 18.658
660 H2 A 91 H2 A 91 10.211 22.846 13.907
661 H5' C 92 1H5* C 92 10.509 15.393 7.539
662 H5'' C 92 2H5* C 92 9.341 15.999 8.731
663 H4' C 92 H4* C 92 8.230 14.402 7.247
664 H3' C 92 H3* C 92 8.191 14.314 10.036
665 H2' C 92 1H2* C 92 9.689 12.520 10.275
666 HO2' C 92 2HO* C 92 7.645 11.763 11.090
667 H1' C 92 H1* C 92 8.542 11.192 7.816
668 H41 C 92 1H4 C 92 13.812 7.675 8.628
669 H42 C 92 2H4 C 92 14.682 9.022 9.324
670 H5 C 92 H5 C 92 13.657 11.212 9.699
671 H6 C 92 H6 C 92 11.626 12.519 9.407
672 H5' A 93 1H5* A 93 3.377 13.494 7.407
673 H5'' A 93 2H5* A 93 4.584 12.218 7.131
674 H4' A 93 H4* A 93 4.021 14.223 4.943
675 H3' A 93 H3* A 93 1.836 13.026 6.000
676 H2' A 93 1H2* A 93 2.567 10.799 6.012
677 HO2' A 93 2HO* A 93 0.762 11.077 4.426
678 H1' A 93 H1* A 93 3.889 10.907 3.343
679 H8 A 93 H8 A 93 4.413 10.210 7.080
680 H61 A 93 1H6 A 93 7.717 5.349 5.056
681 H62 A 93 2H6 A 93 7.150 6.187 6.485
682 H2 A 93 H2 A 93 6.240 7.654 1.528
683 H5' A 94 1H5* A 94 0.308 16.273 6.012
684 H5'' A 94 2H5* A 94 0.845 14.619 6.309
685 H4' A 94 H4* A 94 -2.049 15.071 5.584
686 H3' A 94 H3* A 94 -1.103 16.733 7.497
687 H2' A 94 1H2* A 94 0.069 15.138 8.777
688 HO2' A 94 2HO* A 94 -2.592 15.147 9.791
689 H1' A 94 H1* A 94 -2.168 13.138 8.640
690 H8 A 94 H8 A 94 0.735 13.688 10.340
691 H61 A 94 1H6 A 94 3.176 8.214 8.795
692 H62 A 94 2H6 A 94 3.282 9.578 9.887
693 H2 A 94 H2 A 94 -0.175 9.064 5.991
694 H5' A 95 1H5* A 95 -1.938 19.180 7.730
695 H5'' A 95 2H5* A 95 -1.894 18.061 9.104
696 H4' A 95 H4* A 95 -1.759 20.361 9.912
697 H3' A 95 H3* A 95 -3.495 18.474 10.922
698 HO3' A 95 H3T A 95 -2.295 19.954 12.178
699 H2' A 95 1H2* A 95 -5.403 19.183 9.710
700 HO2' A 95 2HO* A 95 -5.316 20.790 12.058
701 H1' A 95 H1* A 95 -4.655 22.076 10.169
702 H8 A 95 H8 A 95 -7.476 20.433 9.384
703 H61 A 95 1H6 A 95 -8.181 23.193 3.882
704 H62 A 95 2H6 A 95 -8.977 22.256 5.128
705 H2 A 95 H2 A 95 -3.964 23.777 5.194
Start of MODEL 15
1 H VAL 6 H1 VAL 6 -1.173 10.765 -2.499
2 HA VAL 6 HA VAL 6 -2.052 11.952 0.023
3 HB VAL 6 HB VAL 6 -3.768 10.700 -2.141
4 HG11 VAL 6 1HG1 VAL 6 -4.436 12.267 0.389
5 HG12 VAL 6 2HG1 VAL 6 -5.611 11.685 -0.813
6 HG13 VAL 6 3HG1 VAL 6 -4.674 10.521 0.147
7 HG21 VAL 6 1HG2 VAL 6 -2.848 12.836 -2.963
8 HG22 VAL 6 2HG2 VAL 6 -4.562 13.014 -2.559
9 HG23 VAL 6 3HG2 VAL 6 -3.321 13.632 -1.440
10 H ILE 7 H ILE 7 -2.149 10.655 1.695
11 HA ILE 7 HA ILE 7 -1.792 8.854 2.996
12 HB ILE 7 HB ILE 7 -3.546 7.589 0.875
13 HG12 ILE 7 2HG1 ILE 7 -4.393 8.475 3.644
14 HG13 ILE 7 3HG1 ILE 7 -4.223 9.687 2.364
15 HG21 ILE 7 1HG2 ILE 7 -2.866 6.645 3.697
16 HG22 ILE 7 2HG2 ILE 7 -4.120 5.939 2.655
17 HG23 ILE 7 3HG2 ILE 7 -2.408 5.831 2.187
18 HD11 ILE 7 1HD1 ILE 7 -5.947 7.189 2.181
19 HD12 ILE 7 2HD1 ILE 7 -6.528 8.849 2.454
20 HD13 ILE 7 3HD1 ILE 7 -5.751 8.431 0.914
21 H ARG 8 H ARG 8 0.361 8.595 2.946
22 HA ARG 8 HA ARG 8 2.357 7.626 2.651
23 HB2 ARG 8 2HB ARG 8 0.981 5.621 3.207
24 HB3 ARG 8 3HB ARG 8 0.782 5.299 1.485
25 HG2 ARG 8 2HG ARG 8 2.552 3.934 2.583
26 HG3 ARG 8 3HG ARG 8 3.152 4.874 1.211
27 HD2 ARG 8 2HD ARG 8 4.677 4.909 3.213
28 HD3 ARG 8 3HD ARG 8 4.168 6.507 2.679
29 HE ARG 8 HE ARG 8 2.916 6.792 4.637
30 HH11 ARG 8 1HH1 ARG 8 4.106 3.465 4.435
31 HH12 ARG 8 2HH1 ARG 8 3.748 3.116 6.108
32 HH21 ARG 8 1HH2 ARG 8 2.444 6.301 6.806
33 HH22 ARG 8 2HH2 ARG 8 2.792 4.711 7.438
34 H GLY 9 H GLY 9 3.914 6.578 0.991
35 HA2 GLY 9 2HA GLY 9 4.176 8.436 -1.119
36 HA3 GLY 9 3HA GLY 9 5.141 6.989 -0.881
37 HA PRO 10 HA PRO 10 2.207 6.729 -4.658
38 HB2 PRO 10 2HB PRO 10 4.844 6.508 -6.070
39 HB3 PRO 10 3HB PRO 10 3.357 7.375 -6.579
40 HG2 PRO 10 2HG PRO 10 5.526 8.721 -5.602
41 HG3 PRO 10 3HG PRO 10 3.849 9.229 -5.212
42 HD2 PRO 10 2HD PRO 10 5.794 7.671 -3.510
43 HD3 PRO 10 3HD PRO 10 4.630 8.950 -3.036
44 H ALA 11 H ALA 11 1.830 4.800 -5.857
45 HA ALA 11 HA ALA 11 1.653 2.562 -6.079
46 HB1 ALA 11 1HB ALA 11 4.677 2.628 -5.797
47 HB2 ALA 11 2HB ALA 11 3.717 1.327 -6.540
48 HB3 ALA 11 3HB ALA 11 3.767 2.936 -7.296
49 H GLY 12 H GLY 12 1.881 3.797 -3.218
50 HA2 GLY 12 2HA GLY 12 1.457 2.935 -1.118
51 HA3 GLY 12 3HA GLY 12 1.337 1.328 -1.848
52 H ASN 13 H ASN 13 2.406 0.819 0.313
53 HA ASN 13 HA ASN 13 5.159 1.556 0.699
54 HB2 ASN 13 2HB ASN 13 3.406 -0.620 1.895
55 HB3 ASN 13 3HB ASN 13 5.067 -0.297 2.416
56 HD21 ASN 13 1HD2 ASN 13 2.152 1.771 4.127
57 HD22 ASN 13 2HD2 ASN 13 2.002 0.206 3.350
58 H ASN 14 H ASN 14 7.030 0.374 0.408
59 HA ASN 14 HA ASN 14 6.990 -2.321 -0.683
60 HB2 ASN 14 2HB ASN 14 6.643 -0.691 -2.678
61 HB3 ASN 14 3HB ASN 14 8.294 -0.150 -2.369
62 HD21 ASN 14 1HD2 ASN 14 9.218 -2.689 -4.687
63 HD22 ASN 14 2HD2 ASN 14 9.066 -0.972 -4.391
64 H ASP 15 H ASP 15 9.388 -3.008 -1.066
65 HA ASP 15 HA ASP 15 10.900 -2.130 1.252
66 HB2 ASP 15 2HB ASP 15 12.537 -3.871 0.458
67 HB3 ASP 15 3HB ASP 15 10.911 -4.443 0.831
68 H CYS 16 H CYS 16 13.400 -1.987 0.897
69 HA CYS 16 HA CYS 16 15.166 -0.776 0.231
70 HB2 CYS 16 2HB CYS 16 13.823 -1.030 -2.480
71 HB3 CYS 16 3HB CYS 16 15.482 -0.444 -2.216
72 HG CYS 16 HG CYS 16 14.103 -3.335 -1.425
73 H ARG 17 H ARG 17 12.378 0.692 0.783
74 HA ARG 17 HA ARG 17 12.968 3.281 -0.438
75 HB2 ARG 17 2HB ARG 17 10.907 2.296 1.543
76 HB3 ARG 17 3HB ARG 17 11.123 4.024 1.199
77 HG2 ARG 17 2HG ARG 17 10.728 3.612 -1.211
78 HG3 ARG 17 3HG ARG 17 10.460 1.888 -0.864
79 HD2 ARG 17 2HD ARG 17 8.840 4.221 0.251
80 HD3 ARG 17 3HD ARG 17 8.312 3.093 -1.009
81 HE ARG 17 HE ARG 17 8.796 1.318 0.870
82 HH11 ARG 17 1HH1 ARG 17 7.329 4.508 1.292
83 HH12 ARG 17 2HH1 ARG 17 6.419 4.024 2.704
84 HH21 ARG 17 1HH2 ARG 17 7.646 0.736 2.740
85 HH22 ARG 17 2HH2 ARG 17 6.561 1.880 3.494
86 H ILE 18 H ILE 18 13.825 5.078 0.520
87 HA ILE 18 HA ILE 18 14.380 5.013 3.430
88 HB ILE 18 HB ILE 18 16.579 5.916 3.177
89 HG12 ILE 18 2HG1 ILE 18 16.328 5.708 0.156
90 HG13 ILE 18 3HG1 ILE 18 16.066 7.217 1.056
91 HG21 ILE 18 1HG2 ILE 18 16.351 3.546 1.286
92 HG22 ILE 18 2HG2 ILE 18 17.778 4.030 2.239
93 HG23 ILE 18 3HG2 ILE 18 16.323 3.449 3.068
94 HD11 ILE 18 1HD1 ILE 18 18.632 5.585 1.023
95 HD12 ILE 18 2HD1 ILE 18 18.355 7.161 0.255
96 HD13 ILE 18 3HD1 ILE 18 18.341 7.034 2.026
97 H TYR 19 H TYR 19 15.177 7.357 4.033
98 HA TYR 19 HA TYR 19 13.365 9.264 2.661
99 HB2 TYR 19 2HB TYR 19 12.152 8.942 4.515
100 HB3 TYR 19 3HB TYR 19 13.541 8.560 5.524
101 HD1 TYR 19 HD1 TYR 19 11.286 11.207 4.441
102 HD2 TYR 19 HD2 TYR 19 15.057 10.383 6.336
103 HE1 TYR 19 HE1 TYR 19 11.251 13.462 5.493
104 HE2 TYR 19 HE2 TYR 19 15.046 12.658 7.344
105 HH TYR 19 HH TYR 19 12.369 14.959 6.809
106 H VAL 20 H VAL 20 13.802 11.431 2.566
107 HA VAL 20 HA VAL 20 16.583 12.228 3.245
108 HB VAL 20 HB VAL 20 15.143 12.762 0.619
109 HG11 VAL 20 1HG1 VAL 20 17.909 13.548 1.631
110 HG12 VAL 20 2HG1 VAL 20 17.322 13.779 -0.035
111 HG13 VAL 20 3HG1 VAL 20 16.556 14.651 1.310
112 HG21 VAL 20 1HG2 VAL 20 15.978 10.448 0.760
113 HG22 VAL 20 2HG2 VAL 20 16.956 11.403 -0.375
114 HG23 VAL 20 3HG2 VAL 20 17.580 11.055 1.253
115 H GLY 21 H GLY 21 16.764 14.237 4.088
116 HA2 GLY 21 2HA GLY 21 14.435 16.072 3.983
117 HA3 GLY 21 3HA GLY 21 15.091 15.581 5.556
118 H ASN 22 H ASN 22 15.094 18.191 5.131
119 HA ASN 22 HA ASN 22 16.272 20.099 4.893
120 HB2 ASN 22 2HB ASN 22 17.742 18.769 6.528
121 HB3 ASN 22 3HB ASN 22 18.793 18.444 5.138
122 HD21 ASN 22 1HD2 ASN 22 20.504 21.454 5.669
123 HD22 ASN 22 2HD2 ASN 22 20.553 19.729 5.344
124 H LEU 23 H LEU 23 15.806 18.236 2.464
125 HA LEU 23 HA LEU 23 17.932 18.596 0.630
126 HB2 LEU 23 2HB LEU 23 15.972 17.035 0.395
127 HB3 LEU 23 3HB LEU 23 14.933 18.435 0.114
128 HG LEU 23 HG LEU 23 16.541 19.016 -1.844
129 HD11 LEU 23 1HD1 LEU 23 17.204 16.061 -1.449
130 HD12 LEU 23 2HD1 LEU 23 17.761 17.104 -2.781
131 HD13 LEU 23 3HD1 LEU 23 18.333 17.387 -1.122
132 HD21 LEU 23 1HD2 LEU 23 14.253 18.159 -2.151
133 HD22 LEU 23 2HD2 LEU 23 15.353 17.441 -3.340
134 HD23 LEU 23 3HD2 LEU 23 14.833 16.491 -1.929
135 HA PRO 24 HA PRO 24 17.618 22.987 0.220
136 HB2 PRO 24 2HB PRO 24 19.120 23.367 -2.073
137 HB3 PRO 24 3HB PRO 24 19.822 23.030 -0.457
138 HG2 PRO 24 2HG PRO 24 19.321 21.101 -2.725
139 HG3 PRO 24 3HG PRO 24 20.748 21.213 -1.642
140 HD2 PRO 24 2HD PRO 24 18.746 19.385 -1.277
141 HD3 PRO 24 3HD PRO 24 19.634 20.106 0.101
142 HA PRO 25 HA PRO 25 14.249 23.497 -2.598
143 HB2 PRO 25 2HB PRO 25 14.090 26.240 -2.686
144 HB3 PRO 25 3HB PRO 25 13.627 25.281 -1.247
145 HG2 PRO 25 2HG PRO 25 16.228 26.735 -1.770
146 HG3 PRO 25 3HG PRO 25 15.249 26.705 -0.266
147 HD2 PRO 25 2HD PRO 25 17.450 25.106 -0.658
148 HD3 PRO 25 3HD PRO 25 16.042 24.582 0.318
149 H ASP 26 H ASP 26 17.482 24.344 -3.305
150 HA ASP 26 HA ASP 26 17.041 25.624 -5.848
151 HB2 ASP 26 2HB ASP 26 19.475 24.336 -4.582
152 HB3 ASP 26 3HB ASP 26 19.496 25.149 -6.155
153 H ILE 27 H ILE 27 16.537 22.431 -4.912
154 HA ILE 27 HA ILE 27 17.507 21.073 -7.252
155 HB ILE 27 HB ILE 27 17.002 19.981 -5.069
156 HG12 ILE 27 2HG1 ILE 27 15.819 17.995 -5.968
157 HG13 ILE 27 3HG1 ILE 27 15.369 18.911 -7.414
158 HG21 ILE 27 1HG2 ILE 27 14.077 20.369 -5.859
159 HG22 ILE 27 2HG2 ILE 27 14.693 19.515 -4.424
160 HG23 ILE 27 3HG2 ILE 27 14.910 21.269 -4.568
161 HD11 ILE 27 1HD1 ILE 27 17.390 17.477 -7.755
162 HD12 ILE 27 2HD1 ILE 27 17.740 19.198 -8.008
163 HD13 ILE 27 3HD1 ILE 27 18.235 18.410 -6.494
164 H ARG 28 H ARG 28 16.348 20.424 -9.156
165 HA ARG 28 HA ARG 28 13.601 21.294 -9.554
166 HB2 ARG 28 2HB ARG 28 15.073 23.396 -9.804
167 HB3 ARG 28 3HB ARG 28 15.758 22.622 -11.243
168 HG2 ARG 28 2HG ARG 28 13.464 22.468 -12.223
169 HG3 ARG 28 3HG ARG 28 12.804 23.241 -10.768
170 HD2 ARG 28 2HD ARG 28 14.861 24.477 -12.634
171 HD3 ARG 28 3HD ARG 28 13.135 24.854 -12.641
172 HE ARG 28 HE ARG 28 15.137 25.743 -10.684
173 HH11 ARG 28 1HH1 ARG 28 11.704 25.338 -11.426
174 HH12 ARG 28 2HH1 ARG 28 11.186 26.527 -10.249
175 HH21 ARG 28 1HH2 ARG 28 14.435 27.284 -9.147
176 HH22 ARG 28 2HH2 ARG 28 12.731 27.615 -8.950
177 H THR 29 H THR 29 12.760 20.527 -11.614
178 HA THR 29 HA THR 29 12.468 18.798 -13.026
179 HB THR 29 HB THR 29 13.733 18.811 -14.913
180 HG1 THR 29 1HG THR 29 15.981 19.213 -14.891
181 HG21 THR 29 1HG2 THR 29 14.472 21.062 -15.336
182 HG22 THR 29 2HG2 THR 29 13.085 21.157 -14.230
183 HG23 THR 29 3HG2 THR 29 14.744 21.366 -13.609
184 H LYS 30 H LYS 30 14.329 16.887 -14.143
185 HA LYS 30 HA LYS 30 14.093 14.893 -12.071
186 HB2 LYS 30 2HB LYS 30 15.021 13.387 -13.777
187 HB3 LYS 30 3HB LYS 30 13.711 14.388 -14.442
188 HG2 LYS 30 2HG LYS 30 15.391 15.934 -15.410
189 HG3 LYS 30 3HG LYS 30 16.695 14.917 -14.762
190 HD2 LYS 30 2HD LYS 30 14.570 14.020 -16.758
191 HD3 LYS 30 3HD LYS 30 16.249 14.443 -17.156
192 HE2 LYS 30 2HE LYS 30 17.050 12.624 -15.663
193 HE3 LYS 30 3HE LYS 30 15.371 12.178 -15.321
194 HZ1 LYS 30 1HZ LYS 30 16.658 12.129 -17.965
195 HZ2 LYS 30 2HZ LYS 30 16.302 10.816 -17.045
196 HZ3 LYS 30 3HZ LYS 30 15.089 11.740 -17.672
197 H ASP 31 H ASP 31 16.173 17.299 -11.860
198 HA ASP 31 HA ASP 31 18.750 16.129 -11.884
199 HB2 ASP 31 2HB ASP 31 17.610 18.410 -10.267
200 HB3 ASP 31 3HB ASP 31 19.313 17.936 -10.225
201 H ILE 32 H ILE 32 16.142 15.742 -9.582
202 HA ILE 32 HA ILE 32 17.842 14.783 -7.435
203 HB ILE 32 HB ILE 32 15.657 15.862 -7.048
204 HG12 ILE 32 2HG1 ILE 32 15.558 12.947 -6.157
205 HG13 ILE 32 3HG1 ILE 32 16.666 14.148 -5.463
206 HG21 ILE 32 1HG2 ILE 32 14.473 14.958 -9.047
207 HG22 ILE 32 2HG2 ILE 32 14.456 13.346 -8.292
208 HG23 ILE 32 3HG2 ILE 32 13.559 14.697 -7.557
209 HD11 ILE 32 1HD1 ILE 32 13.625 14.304 -5.458
210 HD12 ILE 32 2HD1 ILE 32 14.664 13.980 -4.060
211 HD13 ILE 32 3HD1 ILE 32 14.717 15.572 -4.849
212 H GLU 33 H GLU 33 16.600 13.421 -10.374
213 HA GLU 33 HA GLU 33 16.769 10.649 -9.368
214 HB2 GLU 33 2HB GLU 33 16.082 11.737 -12.129
215 HB3 GLU 33 3HB GLU 33 15.902 10.060 -11.572
216 HG2 GLU 33 2HG GLU 33 14.283 10.845 -9.840
217 HG3 GLU 33 3HG GLU 33 14.422 12.492 -10.494
218 H ASP 34 H ASP 34 18.511 13.025 -11.340
219 HA ASP 34 HA ASP 34 20.232 11.074 -12.581
220 HB2 ASP 34 2HB ASP 34 20.329 14.095 -12.372
221 HB3 ASP 34 3HB ASP 34 21.547 13.133 -13.234
222 H VAL 35 H VAL 35 20.526 13.158 -9.685
223 HA VAL 35 HA VAL 35 23.310 12.521 -9.250
224 HB VAL 35 HB VAL 35 21.085 13.517 -7.423
225 HG11 VAL 35 1HG1 VAL 35 24.070 13.259 -6.891
226 HG12 VAL 35 2HG1 VAL 35 22.917 14.124 -5.847
227 HG13 VAL 35 3HG1 VAL 35 22.774 12.367 -6.059
228 HG21 VAL 35 1HG2 VAL 35 22.282 15.666 -7.643
229 HG22 VAL 35 2HG2 VAL 35 23.479 14.897 -8.712
230 HG23 VAL 35 3HG2 VAL 35 21.792 15.062 -9.243
231 H PHE 36 H PHE 36 20.188 11.221 -7.979
232 HA PHE 36 HA PHE 36 21.519 9.192 -6.459
233 HB2 PHE 36 2HB PHE 36 18.671 9.717 -7.201
234 HB3 PHE 36 3HB PHE 36 19.135 8.170 -6.486
235 HD1 PHE 36 HD1 PHE 36 19.556 7.930 -4.176
236 HD2 PHE 36 HD2 PHE 36 19.199 11.857 -5.890
237 HE1 PHE 36 HE1 PHE 36 19.486 8.919 -1.902
238 HE2 PHE 36 HE2 PHE 36 19.129 12.841 -3.613
239 HZ PHE 36 HZ PHE 36 19.263 11.368 -1.619
240 H SER 37 H SER 37 20.278 9.223 -9.792
241 HA SER 37 HA SER 37 20.421 6.421 -10.214
242 HB2 SER 37 2HB SER 37 19.322 7.886 -11.795
243 HB3 SER 37 3HB SER 37 20.847 8.751 -12.121
244 HG SER 37 HG SER 37 20.414 7.168 -13.697
245 H LYS 38 H LYS 38 22.918 8.963 -10.206
246 HA LYS 38 HA LYS 38 24.995 7.254 -11.270
247 HB2 LYS 38 2HB LYS 38 25.073 9.705 -11.468
248 HB3 LYS 38 3HB LYS 38 25.087 9.871 -9.705
249 HG2 LYS 38 2HG LYS 38 27.349 10.146 -10.628
250 HG3 LYS 38 3HG LYS 38 27.256 8.729 -9.571
251 HD2 LYS 38 2HD LYS 38 28.556 8.262 -11.626
252 HD3 LYS 38 3HD LYS 38 27.101 7.249 -11.543
253 HE2 LYS 38 2HE LYS 38 25.921 8.794 -13.062
254 HE3 LYS 38 3HE LYS 38 27.354 9.841 -13.119
255 HZ1 LYS 38 1HZ LYS 38 27.236 7.045 -14.035
256 HZ2 LYS 38 2HZ LYS 38 27.230 8.366 -15.013
257 HZ3 LYS 38 3HZ LYS 38 28.558 8.020 -14.109
258 H TYR 39 H TYR 39 23.751 8.015 -8.031
259 HA TYR 39 HA TYR 39 25.984 6.616 -6.780
260 HB2 TYR 39 2HB TYR 39 23.786 8.350 -5.799
261 HB3 TYR 39 3HB TYR 39 24.507 7.193 -4.677
262 HD1 TYR 39 HD1 TYR 39 25.167 10.222 -6.690
263 HD2 TYR 39 HD2 TYR 39 26.778 7.346 -3.933
264 HE1 TYR 39 HE1 TYR 39 27.077 11.739 -6.234
265 HE2 TYR 39 HE2 TYR 39 28.683 8.854 -3.456
266 HH TYR 39 HH TYR 39 29.690 10.865 -3.942
267 H GLY 40 H GLY 40 22.949 5.502 -7.944
268 HA2 GLY 40 2HA GLY 40 23.461 2.899 -6.873
269 HA3 GLY 40 3HA GLY 40 22.260 3.719 -5.861
270 H ALA 41 H ALA 41 22.110 4.667 -9.198
271 HA ALA 41 HA ALA 41 20.497 4.331 -10.767
272 HB1 ALA 41 1HB ALA 41 20.909 1.421 -9.991
273 HB2 ALA 41 2HB ALA 41 20.232 2.021 -11.520
274 HB3 ALA 41 3HB ALA 41 21.929 2.351 -11.109
275 H ILE 42 H ILE 42 19.423 5.082 -8.281
276 HA ILE 42 HA ILE 42 17.363 3.669 -7.153
277 HB ILE 42 HB ILE 42 17.771 6.581 -7.812
278 HG12 ILE 42 2HG1 ILE 42 17.862 6.782 -5.379
279 HG13 ILE 42 3HG1 ILE 42 17.428 5.071 -5.181
280 HG21 ILE 42 1HG2 ILE 42 15.330 6.290 -7.993
281 HG22 ILE 42 2HG2 ILE 42 15.308 5.444 -6.426
282 HG23 ILE 42 3HG2 ILE 42 15.758 7.162 -6.514
283 HD11 ILE 42 1HD1 ILE 42 19.890 5.952 -6.722
284 HD12 ILE 42 2HD1 ILE 42 19.915 5.668 -4.970
285 HD13 ILE 42 3HD1 ILE 42 19.519 4.333 -6.081
286 H ARG 43 H ARG 43 15.287 3.089 -7.594
287 HA ARG 43 HA ARG 43 14.532 3.051 -10.429
288 HB2 ARG 43 2HB ARG 43 13.399 1.817 -7.898
289 HB3 ARG 43 3HB ARG 43 12.640 1.632 -9.494
290 HG2 ARG 43 2HG ARG 43 14.603 0.542 -10.394
291 HG3 ARG 43 3HG ARG 43 15.536 0.895 -8.922
292 HD2 ARG 43 2HD ARG 43 14.713 -1.468 -9.017
293 HD3 ARG 43 3HD ARG 43 14.137 -0.578 -7.598
294 HE ARG 43 HE ARG 43 12.517 -1.285 -10.009
295 HH11 ARG 43 1HH1 ARG 43 12.745 -0.277 -6.629
296 HH12 ARG 43 2HH1 ARG 43 11.022 -0.357 -6.364
297 HH21 ARG 43 1HH2 ARG 43 10.270 -1.449 -9.614
298 HH22 ARG 43 2HH2 ARG 43 9.628 -1.047 -8.035
299 H ASP 44 H ASP 44 13.374 4.499 -7.372
300 HA ASP 44 HA ASP 44 11.626 6.268 -8.949
301 HB2 ASP 44 2HB ASP 44 10.622 4.280 -6.922
302 HB3 ASP 44 3HB ASP 44 9.765 5.797 -7.210
303 H ILE 45 H ILE 45 10.660 8.043 -7.790
304 HA ILE 45 HA ILE 45 12.112 8.814 -5.333
305 HB ILE 45 HB ILE 45 13.181 9.682 -7.542
306 HG12 ILE 45 2HG1 ILE 45 13.439 12.021 -6.647
307 HG13 ILE 45 3HG1 ILE 45 12.281 11.617 -5.371
308 HG21 ILE 45 1HG2 ILE 45 10.735 11.491 -7.456
309 HG22 ILE 45 2HG2 ILE 45 12.106 11.611 -8.582
310 HG23 ILE 45 3HG2 ILE 45 11.021 10.211 -8.666
311 HD11 ILE 45 1HD1 ILE 45 14.902 10.157 -5.946
312 HD12 ILE 45 2HD1 ILE 45 14.617 11.296 -4.610
313 HD13 ILE 45 3HD1 ILE 45 13.748 9.744 -4.654
314 H ASP 46 H ASP 46 11.005 10.655 -4.235
315 HA ASP 46 HA ASP 46 8.276 11.244 -5.175
316 HB2 ASP 46 2HB ASP 46 8.090 9.196 -3.758
317 HB3 ASP 46 3HB ASP 46 8.847 10.075 -2.425
318 H LEU 47 H LEU 47 9.737 13.226 -5.502
319 HA LEU 47 HA LEU 47 10.575 14.759 -3.251
320 HB2 LEU 47 2HB LEU 47 11.329 15.058 -5.592
321 HB3 LEU 47 3HB LEU 47 9.728 15.643 -6.045
322 HG LEU 47 HG LEU 47 11.512 17.398 -5.697
323 HD11 LEU 47 1HD1 LEU 47 9.044 17.888 -5.592
324 HD12 LEU 47 2HD1 LEU 47 9.144 17.760 -3.819
325 HD13 LEU 47 3HD1 LEU 47 10.069 19.004 -4.666
326 HD21 LEU 47 1HD2 LEU 47 12.126 18.057 -3.455
327 HD22 LEU 47 2HD2 LEU 47 11.114 16.789 -2.742
328 HD23 LEU 47 3HD2 LEU 47 12.557 16.349 -3.695
329 H LYS 48 H LYS 48 9.429 15.870 -1.758
330 HA LYS 48 HA LYS 48 6.681 16.778 -2.392
331 HB2 LYS 48 2HB LYS 48 7.589 14.800 -0.319
332 HB3 LYS 48 3HB LYS 48 6.361 15.988 0.136
333 HG2 LYS 48 2HG LYS 48 4.982 15.289 -1.826
334 HG3 LYS 48 3HG LYS 48 6.183 14.018 -2.178
335 HD2 LYS 48 2HD LYS 48 5.790 12.985 -0.002
336 HD3 LYS 48 3HD LYS 48 4.752 14.333 0.495
337 HE2 LYS 48 2HE LYS 48 3.360 12.447 -0.135
338 HE3 LYS 48 3HE LYS 48 3.141 13.771 -1.292
339 HZ1 LYS 48 1HZ LYS 48 4.852 11.416 -1.702
340 HZ2 LYS 48 2HZ LYS 48 3.373 11.661 -2.391
341 HZ3 LYS 48 3HZ LYS 48 4.645 12.628 -2.778
342 H ASN 49 H ASN 49 5.883 18.372 -0.840
343 HA ASN 49 HA ASN 49 7.679 19.359 1.220
344 HB2 ASN 49 2HB ASN 49 8.452 20.504 -0.924
345 HB3 ASN 49 3HB ASN 49 6.863 21.286 -0.999
346 HD21 ASN 49 1HD2 ASN 49 9.088 23.683 0.718
347 HD22 ASN 49 2HD2 ASN 49 8.864 23.021 -0.889
348 H ARG 50 H ARG 50 6.325 19.681 2.901
349 HA ARG 50 HA ARG 50 3.793 21.079 2.589
350 HB2 ARG 50 2HB ARG 50 3.201 18.836 1.760
351 HB3 ARG 50 3HB ARG 50 3.817 18.101 3.252
352 HG2 ARG 50 2HG ARG 50 2.103 19.221 4.576
353 HG3 ARG 50 3HG ARG 50 1.563 20.144 3.151
354 HD2 ARG 50 2HD ARG 50 1.013 17.985 2.019
355 HD3 ARG 50 3HD ARG 50 1.443 17.119 3.505
356 HE ARG 50 HE ARG 50 -0.382 18.789 4.502
357 HH11 ARG 50 1HH1 ARG 50 -0.449 16.994 1.457
358 HH12 ARG 50 2HH1 ARG 50 -2.189 16.855 1.434
359 HH21 ARG 50 1HH2 ARG 50 -2.667 18.660 4.410
360 HH22 ARG 50 2HH2 ARG 50 -3.440 17.789 3.105
361 H ARG 51 H ARG 51 3.043 21.868 4.537
362 HA ARG 51 HA ARG 51 3.281 22.678 6.649
363 HB2 ARG 51 2HB ARG 51 3.652 19.706 7.133
364 HB3 ARG 51 3HB ARG 51 3.441 20.889 8.439
365 HG2 ARG 51 2HG ARG 51 1.297 21.630 7.413
366 HG3 ARG 51 3HG ARG 51 1.463 20.368 6.178
367 HD2 ARG 51 2HD ARG 51 1.325 19.914 9.187
368 HD3 ARG 51 3HD ARG 51 -0.009 19.673 8.044
369 HE ARG 51 HE ARG 51 2.546 18.107 8.008
370 HH11 ARG 51 1HH1 ARG 51 -0.967 18.308 7.622
371 HH12 ARG 51 2HH1 ARG 51 -1.138 16.612 7.237
372 HH21 ARG 51 1HH2 ARG 51 2.286 15.885 7.492
373 HH22 ARG 51 2HH2 ARG 51 0.692 15.250 7.170
374 H GLY 52 H GLY 52 5.749 22.743 5.046
375 HA2 GLY 52 2HA GLY 52 7.586 23.346 7.229
376 HA3 GLY 52 3HA GLY 52 8.084 21.964 6.241
377 H GLY 53 H GLY 53 9.782 24.030 6.280
378 HA2 GLY 53 2HA GLY 53 9.260 25.960 4.158
379 HA3 GLY 53 3HA GLY 53 10.758 25.765 5.082
380 HA PRO 54 HA PRO 54 12.591 23.749 1.635
381 HB2 PRO 54 2HB PRO 54 14.301 21.943 2.813
382 HB3 PRO 54 3HB PRO 54 14.578 23.715 2.808
383 HG2 PRO 54 2HG PRO 54 13.401 21.998 5.001
384 HG3 PRO 54 3HG PRO 54 14.593 23.332 5.148
385 HD2 PRO 54 2HD PRO 54 11.918 23.670 5.649
386 HD3 PRO 54 3HD PRO 54 12.932 24.970 4.950
387 HA PRO 55 HA PRO 55 10.285 20.084 0.777
388 HB2 PRO 55 2HB PRO 55 11.772 19.001 -1.278
389 HB3 PRO 55 3HB PRO 55 10.745 20.454 -1.465
390 HG2 PRO 55 2HG PRO 55 13.732 20.304 -1.005
391 HG3 PRO 55 3HG PRO 55 12.828 21.361 -2.137
392 HD2 PRO 55 2HD PRO 55 13.712 22.233 0.302
393 HD3 PRO 55 3HD PRO 55 12.186 22.824 -0.416
394 H PHE 56 H PHE 56 10.537 17.674 0.529
395 HA PHE 56 HA PHE 56 12.975 16.439 1.636
396 HB2 PHE 56 2HB PHE 56 11.890 15.438 3.482
397 HB3 PHE 56 3HB PHE 56 11.330 17.104 3.553
398 HD1 PHE 56 HD1 PHE 56 10.368 13.675 3.549
399 HD2 PHE 56 HD2 PHE 56 9.016 17.586 2.366
400 HE1 PHE 56 HE1 PHE 56 8.020 12.889 3.643
401 HE2 PHE 56 HE2 PHE 56 6.671 16.770 2.372
402 HZ PHE 56 HZ PHE 56 6.173 14.424 3.005
403 H ALA 57 H ALA 57 12.615 13.934 1.343
404 HA ALA 57 HA ALA 57 10.558 13.279 -0.631
405 HB1 ALA 57 1HB ALA 57 12.271 14.474 -1.977
406 HB2 ALA 57 2HB ALA 57 13.498 13.315 -1.420
407 HB3 ALA 57 3HB ALA 57 12.142 12.757 -2.430
408 H PHE 58 H PHE 58 10.636 11.032 -1.321
409 HA PHE 58 HA PHE 58 12.241 9.286 0.486
410 HB2 PHE 58 2HB PHE 58 9.606 8.697 -0.905
411 HB3 PHE 58 3HB PHE 58 10.522 7.570 0.105
412 HD1 PHE 58 HD1 PHE 58 11.057 8.360 2.539
413 HD2 PHE 58 HD2 PHE 58 7.936 9.996 0.079
414 HE1 PHE 58 HE1 PHE 58 9.974 9.306 4.548
415 HE2 PHE 58 HE2 PHE 58 6.915 11.052 2.076
416 HZ PHE 58 HZ PHE 58 7.917 10.684 4.324
417 H VAL 59 H VAL 59 13.201 7.412 -0.464
418 HA VAL 59 HA VAL 59 13.562 7.596 -3.410
419 HB VAL 59 HB VAL 59 15.742 7.188 -1.322
420 HG11 VAL 59 1HG1 VAL 59 15.850 7.558 -4.334
421 HG12 VAL 59 2HG1 VAL 59 17.256 7.415 -3.246
422 HG13 VAL 59 3HG1 VAL 59 16.153 6.037 -3.466
423 HG21 VAL 59 1HG2 VAL 59 14.967 9.506 -1.265
424 HG22 VAL 59 2HG2 VAL 59 16.558 9.415 -2.048
425 HG23 VAL 59 3HG2 VAL 59 15.089 9.618 -3.032
426 H GLU 60 H GLU 60 13.611 5.631 -4.459
427 HA GLU 60 HA GLU 60 13.405 3.237 -2.687
428 HB2 GLU 60 2HB GLU 60 11.242 3.832 -3.601
429 HB3 GLU 60 3HB GLU 60 11.906 3.864 -5.247
430 HG2 GLU 60 2HG GLU 60 12.394 1.480 -5.164
431 HG3 GLU 60 3HG GLU 60 11.921 1.403 -3.453
432 H PHE 61 H PHE 61 15.151 2.049 -2.862
433 HA PHE 61 HA PHE 61 16.872 2.258 -5.190
434 HB2 PHE 61 2HB PHE 61 17.110 0.947 -2.507
435 HB3 PHE 61 3HB PHE 61 18.242 0.566 -3.802
436 HD1 PHE 61 HD1 PHE 61 16.833 3.458 -1.879
437 HD2 PHE 61 HD2 PHE 61 20.080 1.941 -4.264
438 HE1 PHE 61 HE1 PHE 61 18.167 5.480 -1.357
439 HE2 PHE 61 HE2 PHE 61 21.400 3.963 -3.752
440 HZ PHE 61 HZ PHE 61 20.460 5.727 -2.272
441 H GLU 62 H GLU 62 17.820 0.519 -6.383
442 HA GLU 62 HA GLU 62 15.977 -1.723 -6.907
443 HB2 GLU 62 2HB GLU 62 17.074 -0.561 -8.780
444 HB3 GLU 62 3HB GLU 62 18.669 -0.917 -8.094
445 HG2 GLU 62 2HG GLU 62 18.299 -3.319 -8.374
446 HG3 GLU 62 3HG GLU 62 16.639 -3.025 -8.933
447 H ASP 63 H ASP 63 18.919 -0.973 -5.156
448 HA ASP 63 HA ASP 63 18.945 -3.619 -3.930
449 HB2 ASP 63 2HB ASP 63 20.237 -4.072 -5.916
450 HB3 ASP 63 3HB ASP 63 21.209 -2.610 -5.683
451 HA PRO 64 HA PRO 64 19.817 -0.546 -0.842
452 HB2 PRO 64 2HB PRO 64 19.978 -2.223 1.353
453 HB3 PRO 64 3HB PRO 64 18.441 -1.713 0.583
454 HG2 PRO 64 2HG PRO 64 19.986 -4.282 0.201
455 HG3 PRO 64 3HG PRO 64 18.215 -4.059 0.402
456 HD2 PRO 64 2HD PRO 64 19.368 -4.409 -2.053
457 HD3 PRO 64 3HD PRO 64 17.951 -3.344 -1.822
458 H ARG 65 H ARG 65 21.938 -3.080 -1.851
459 HA ARG 65 HA ARG 65 24.110 -2.635 -0.025
460 HB2 ARG 65 2HB ARG 65 23.905 -4.645 -1.399
461 HB3 ARG 65 3HB ARG 65 24.011 -3.673 -2.884
462 HG2 ARG 65 2HG ARG 65 26.295 -2.982 -2.299
463 HG3 ARG 65 3HG ARG 65 26.202 -3.909 -0.779
464 HD2 ARG 65 2HD ARG 65 25.893 -5.093 -3.576
465 HD3 ARG 65 3HD ARG 65 27.398 -5.104 -2.649
466 HE ARG 65 HE ARG 65 26.428 -6.612 -1.059
467 HH11 ARG 65 1HH1 ARG 65 24.318 -5.945 -3.827
468 HH12 ARG 65 2HH1 ARG 65 23.362 -7.386 -3.588
469 HH21 ARG 65 1HH2 ARG 65 25.162 -8.480 -0.776
470 HH22 ARG 65 2HH2 ARG 65 23.829 -8.810 -1.859
471 H ASP 66 H ASP 66 22.957 -0.953 -2.918
472 HA ASP 66 HA ASP 66 25.434 0.557 -3.228
473 HB2 ASP 66 2HB ASP 66 22.717 0.748 -4.564
474 HB3 ASP 66 3HB ASP 66 24.090 1.799 -4.949
475 H ALA 67 H ALA 67 22.644 0.845 -1.231
476 HA ALA 67 HA ALA 67 22.523 3.715 -1.121
477 HB1 ALA 67 1HB ALA 67 21.122 3.315 0.857
478 HB2 ALA 67 2HB ALA 67 20.662 2.214 -0.462
479 HB3 ALA 67 3HB ALA 67 21.637 1.612 0.896
480 H GLU 68 H GLU 68 24.770 1.396 0.136
481 HA GLU 68 HA GLU 68 25.556 2.790 2.515
482 HB2 GLU 68 2HB GLU 68 27.096 0.900 0.682
483 HB3 GLU 68 3HB GLU 68 27.611 1.386 2.308
484 HG2 GLU 68 2HG GLU 68 25.008 -0.073 1.665
485 HG3 GLU 68 3HG GLU 68 26.488 -0.852 2.237
486 H ASP 69 H ASP 69 26.084 3.395 -0.873
487 HA ASP 69 HA ASP 69 28.291 5.290 -0.247
488 HB2 ASP 69 2HB ASP 69 27.346 4.006 -2.822
489 HB3 ASP 69 3HB ASP 69 28.517 5.329 -2.768
490 H ALA 70 H ALA 70 25.005 5.089 -1.526
491 HA ALA 70 HA ALA 70 24.919 7.787 -2.525
492 HB1 ALA 70 1HB ALA 70 23.452 5.900 -3.297
493 HB2 ALA 70 2HB ALA 70 22.676 5.895 -1.705
494 HB3 ALA 70 3HB ALA 70 22.519 7.321 -2.761
495 H VAL 71 H VAL 71 24.268 6.217 0.592
496 HA VAL 71 HA VAL 71 22.998 8.639 1.663
497 HB VAL 71 HB VAL 71 23.724 5.953 2.901
498 HG11 VAL 71 1HG1 VAL 71 22.128 8.291 4.027
499 HG12 VAL 71 2HG1 VAL 71 22.241 6.679 4.763
500 HG13 VAL 71 3HG1 VAL 71 23.693 7.691 4.637
501 HG21 VAL 71 1HG2 VAL 71 21.940 5.846 1.188
502 HG22 VAL 71 2HG2 VAL 71 21.277 5.578 2.815
503 HG23 VAL 71 3HG2 VAL 71 21.062 7.151 2.012
504 H SER 72 H SER 72 26.019 6.726 2.174
505 HA SER 72 HA SER 72 26.988 8.432 4.255
506 HB2 SER 72 2HB SER 72 27.701 6.094 3.926
507 HB3 SER 72 3HB SER 72 28.482 6.544 2.391
508 HG SER 72 HG SER 72 29.933 6.502 4.182
509 H GLY 73 H GLY 73 26.791 8.904 0.840
510 HA2 GLY 73 2HA GLY 73 29.224 10.455 0.542
511 HA3 GLY 73 3HA GLY 73 27.917 10.261 -0.637
512 H ARG 74 H ARG 74 26.080 11.200 1.856
513 HA ARG 74 HA ARG 74 26.761 14.045 1.907
514 HB2 ARG 74 2HB ARG 74 24.638 14.723 0.727
515 HB3 ARG 74 3HB ARG 74 25.878 14.004 -0.310
516 HG2 ARG 74 2HG ARG 74 24.708 11.819 -0.226
517 HG3 ARG 74 3HG ARG 74 23.439 12.542 0.791
518 HD2 ARG 74 2HD ARG 74 22.788 14.053 -0.972
519 HD3 ARG 74 3HD ARG 74 24.216 13.641 -1.939
520 HE ARG 74 HE ARG 74 21.748 12.058 -1.639
521 HH11 ARG 74 1HH1 ARG 74 25.095 12.180 -2.772
522 HH12 ARG 74 2HH1 ARG 74 24.886 10.881 -3.923
523 HH21 ARG 74 1HH2 ARG 74 21.492 10.372 -3.172
524 HH22 ARG 74 2HH2 ARG 74 22.852 9.846 -4.137
525 H ASP 75 H ASP 75 25.434 11.429 3.459
526 HA ASP 75 HA ASP 75 23.248 12.768 4.799
527 HB2 ASP 75 2HB ASP 75 23.395 10.311 4.654
528 HB3 ASP 75 3HB ASP 75 24.903 10.344 5.584
529 H GLY 76 H GLY 76 23.229 13.842 6.793
530 HA2 GLY 76 2HA GLY 76 24.026 14.969 8.602
531 HA3 GLY 76 3HA GLY 76 25.344 13.778 8.669
532 H TYR 77 H TYR 77 24.647 16.102 5.986
533 HA TYR 77 HA TYR 77 27.467 16.899 6.239
534 HB2 TYR 77 2HB TYR 77 27.111 15.958 4.154
535 HB3 TYR 77 3HB TYR 77 25.583 16.811 3.919
536 HD1 TYR 77 HD1 TYR 77 25.501 18.793 2.693
537 HD2 TYR 77 HD2 TYR 77 29.259 17.452 4.300
538 HE1 TYR 77 HE1 TYR 77 26.672 20.622 1.477
539 HE2 TYR 77 HE2 TYR 77 30.430 19.272 3.095
540 HH TYR 77 HH TYR 77 28.690 21.602 1.009
541 H ASP 78 H ASP 78 28.218 18.877 6.417
542 HA ASP 78 HA ASP 78 26.583 20.802 7.725
543 HB2 ASP 78 2HB ASP 78 28.891 20.661 8.266
544 HB3 ASP 78 3HB ASP 78 29.379 20.879 6.582
545 H TYR 79 H TYR 79 24.920 21.739 6.719
546 HA TYR 79 HA TYR 79 25.393 23.011 4.081
547 HB2 TYR 79 2HB TYR 79 23.713 21.314 3.986
548 HB3 TYR 79 3HB TYR 79 22.902 21.948 5.418
549 HD1 TYR 79 HD1 TYR 79 21.379 23.778 5.297
550 HD2 TYR 79 HD2 TYR 79 23.601 22.568 1.830
551 HE1 TYR 79 HE1 TYR 79 19.879 25.156 3.865
552 HE2 TYR 79 HE2 TYR 79 22.129 23.954 0.386
553 HH TYR 79 HH TYR 79 20.345 25.380 0.312
554 H ASP 80 H ASP 80 23.834 25.007 3.789
555 HA ASP 80 HA ASP 80 24.753 26.999 5.539
556 HB2 ASP 80 2HB ASP 80 22.498 26.923 3.513
557 HB3 ASP 80 3HB ASP 80 22.998 28.392 4.358
558 H GLY 81 H GLY 81 24.324 26.768 7.685
559 HA2 GLY 81 2HA GLY 81 23.117 27.283 9.583
560 HA3 GLY 81 3HA GLY 81 21.698 27.601 8.575
561 H TYR 82 H TYR 82 22.597 24.599 7.574
562 HA TYR 82 HA TYR 82 21.261 23.151 9.780
563 HB2 TYR 82 2HB TYR 82 20.240 23.286 6.935
564 HB3 TYR 82 3HB TYR 82 19.763 22.033 8.085
565 HD1 TYR 82 HD1 TYR 82 18.176 22.452 9.828
566 HD2 TYR 82 HD2 TYR 82 19.675 25.665 7.401
567 HE1 TYR 82 HE1 TYR 82 16.403 23.941 10.715
568 HE2 TYR 82 HE2 TYR 82 17.900 27.171 8.282
569 HH TYR 82 HH TYR 82 16.100 27.361 9.679
570 H ARG 83 H ARG 83 20.866 20.716 8.633
571 HA ARG 83 HA ARG 83 23.468 19.790 7.551
572 HB2 ARG 83 2HB ARG 83 23.730 19.745 9.998
573 HB3 ARG 83 3HB ARG 83 22.220 18.830 10.154
574 HG2 ARG 83 2HG ARG 83 23.185 16.960 8.886
575 HG3 ARG 83 3HG ARG 83 24.679 17.890 8.617
576 HD2 ARG 83 2HD ARG 83 24.997 16.303 10.451
577 HD3 ARG 83 3HD ARG 83 25.071 17.964 11.059
578 HE ARG 83 HE ARG 83 22.701 16.140 11.322
579 HH11 ARG 83 1HH1 ARG 83 24.731 18.759 12.564
580 HH12 ARG 83 2HH1 ARG 83 23.806 18.939 14.033
581 HH21 ARG 83 1HH2 ARG 83 21.511 16.395 13.247
582 HH22 ARG 83 2HH2 ARG 83 21.994 17.598 14.420
583 H LEU 84 H LEU 84 23.204 18.171 6.131
584 HA LEU 84 HA LEU 84 20.596 17.533 5.176
585 HB2 LEU 84 2HB LEU 84 23.376 16.428 4.691
586 HB3 LEU 84 3HB LEU 84 21.968 15.621 4.008
587 HG LEU 84 HG LEU 84 23.026 17.170 2.412
588 HD11 LEU 84 1HD1 LEU 84 20.246 18.076 3.263
589 HD12 LEU 84 2HD1 LEU 84 20.976 18.258 1.660
590 HD13 LEU 84 3HD1 LEU 84 20.597 16.636 2.284
591 HD21 LEU 84 1HD2 LEU 84 22.863 19.583 2.692
592 HD22 LEU 84 2HD2 LEU 84 22.072 19.395 4.263
593 HD23 LEU 84 3HD2 LEU 84 23.769 18.895 4.058
594 H ARG 85 H ARG 85 19.353 15.640 5.290
595 HA ARG 85 HA ARG 85 20.157 13.623 7.342
596 HB2 ARG 85 2HB ARG 85 18.583 15.260 8.326
597 HB3 ARG 85 3HB ARG 85 17.444 14.963 7.000
598 HG2 ARG 85 2HG ARG 85 17.211 12.616 7.697
599 HG3 ARG 85 3HG ARG 85 18.419 12.863 8.984
600 HD2 ARG 85 2HD ARG 85 17.000 14.563 10.041
601 HD3 ARG 85 3HD ARG 85 15.822 14.426 8.717
602 HE ARG 85 HE ARG 85 16.401 11.970 10.257
603 HH11 ARG 85 1HH1 ARG 85 14.256 14.725 9.685
604 HH12 ARG 85 2HH1 ARG 85 12.893 13.988 10.477
605 HH21 ARG 85 1HH2 ARG 85 14.625 11.020 11.276
606 HH22 ARG 85 2HH2 ARG 85 13.110 11.889 11.421
607 H VAL 86 H VAL 86 20.465 11.814 6.339
608 HA VAL 86 HA VAL 86 18.425 10.958 4.367
609 HB VAL 86 HB VAL 86 21.422 10.540 4.068
610 HG11 VAL 86 1HG1 VAL 86 19.067 9.918 2.231
611 HG12 VAL 86 2HG1 VAL 86 20.784 9.652 1.851
612 HG13 VAL 86 3HG1 VAL 86 20.006 8.725 3.156
613 HG21 VAL 86 1HG2 VAL 86 20.854 12.893 3.624
614 HG22 VAL 86 2HG2 VAL 86 21.206 12.053 2.101
615 HG23 VAL 86 3HG2 VAL 86 19.523 12.385 2.556
616 H GLU 87 H GLU 87 17.415 9.708 5.852
617 HA GLU 87 HA GLU 87 18.807 7.175 6.488
618 HB2 GLU 87 2HB GLU 87 18.104 7.209 8.820
619 HB3 GLU 87 3HB GLU 87 19.125 8.621 8.473
620 HG2 GLU 87 2HG GLU 87 17.095 10.024 8.235
621 HG3 GLU 87 3HG GLU 87 16.073 8.616 8.563
622 H PHE 88 H PHE 88 17.316 5.438 7.115
623 HA PHE 88 HA PHE 88 14.971 5.547 5.461
624 HB2 PHE 88 2HB PHE 88 14.677 3.160 6.444
625 HB3 PHE 88 3HB PHE 88 15.968 3.523 5.294
626 HD1 PHE 88 HD1 PHE 88 18.302 3.558 5.957
627 HD2 PHE 88 HD2 PHE 88 15.200 2.730 8.813
628 HE1 PHE 88 HE1 PHE 88 20.003 2.722 7.562
629 HE2 PHE 88 HE2 PHE 88 16.895 1.892 10.419
630 HZ PHE 88 HZ PHE 88 19.301 1.895 9.798
631 HA PRO 89 HA PRO 89 11.734 6.447 8.273
632 HB2 PRO 89 2HB PRO 89 9.690 4.895 7.270
633 HB3 PRO 89 3HB PRO 89 10.269 6.403 6.491
634 HG2 PRO 89 2HG PRO 89 10.957 3.541 5.804
635 HG3 PRO 89 3HG PRO 89 10.588 4.903 4.694
636 HD2 PRO 89 2HD PRO 89 13.149 4.105 5.257
637 HD3 PRO 89 3HD PRO 89 12.727 5.812 4.936
638 H5' A 90 1H5* A 90 3.133 16.020 15.085
639 H5'' A 90 2H5* A 90 2.460 17.400 14.198
640 H4' A 90 H4* A 90 4.123 16.326 12.811
641 H3' A 90 H3* A 90 1.533 16.814 11.918
642 H2' A 90 1H2* A 90 0.748 14.601 12.232
643 HO2' A 90 2HO* A 90 0.554 15.063 9.979
644 H1' A 90 H1* A 90 3.384 13.540 11.193
645 H8 A 90 H8 A 90 0.701 11.948 10.971
646 H61 A 90 1H6 A 90 1.404 8.028 15.713
647 H62 A 90 2H6 A 90 0.534 8.343 14.227
648 H2 A 90 H2 A 90 4.198 11.431 16.323
649 HO5' A 90 H5T A 90 0.843 16.115 15.202
650 H5' A 91 1H5* A 91 6.513 17.019 9.714
651 H5'' A 91 2H5* A 91 5.764 15.648 10.568
652 H4' A 91 H4* A 91 7.735 17.605 11.835
653 H3' A 91 H3* A 91 8.102 14.865 10.591
654 H2' A 91 1H2* A 91 9.721 14.379 12.256
655 HO2' A 91 2HO* A 91 10.856 16.382 12.081
656 H1' A 91 H1* A 91 8.450 15.799 14.319
657 H8 A 91 H8 A 91 8.846 13.511 15.553
658 H61 A 91 1H6 A 91 5.446 8.936 13.132
659 H62 A 91 2H6 A 91 6.489 9.403 14.460
660 H2 A 91 H2 A 91 5.103 12.475 10.454
661 H5' C 92 1H5* C 92 10.021 15.456 6.476
662 H5'' C 92 2H5* C 92 8.659 16.169 7.366
663 H4' C 92 H4* C 92 7.761 14.622 5.725
664 H3' C 92 H3* C 92 7.193 14.541 8.440
665 H2' C 92 1H2* C 92 8.555 12.702 8.959
666 HO2' C 92 2HO* C 92 6.137 11.551 7.975
667 H1' C 92 H1* C 92 7.851 11.350 6.349
668 H41 C 92 1H4 C 92 12.857 7.815 8.116
669 H42 C 92 2H4 C 92 13.653 9.196 8.843
670 H5 C 92 H5 C 92 12.623 11.415 8.961
671 H6 C 92 H6 C 92 10.637 12.698 8.392
672 H5' A 93 1H5* A 93 2.780 13.841 5.100
673 H5'' A 93 2H5* A 93 3.947 12.502 5.222
674 H4' A 93 H4* A 93 3.782 14.195 2.715
675 H3' A 93 H3* A 93 1.499 12.988 3.548
676 H2' A 93 1H2* A 93 2.308 10.816 3.932
677 HO2' A 93 2HO* A 93 0.892 10.878 1.891
678 H1' A 93 H1* A 93 4.104 10.729 1.563
679 H8 A 93 H8 A 93 4.102 10.577 5.409
680 H61 A 93 1H6 A 93 7.683 5.568 4.563
681 H62 A 93 2H6 A 93 6.944 6.613 5.765
682 H2 A 93 H2 A 93 6.553 7.200 0.576
683 H5' A 94 1H5* A 94 -1.187 15.109 3.423
684 H5'' A 94 2H5* A 94 -0.373 13.560 3.659
685 H4' A 94 H4* A 94 -2.515 13.426 1.630
686 H3' A 94 H3* A 94 -3.139 14.976 3.963
687 H2' A 94 1H2* A 94 -4.016 13.471 5.476
688 HO2' A 94 2HO* A 94 -5.769 13.001 3.991
689 H1' A 94 H1* A 94 -3.095 11.027 4.705
690 H8 A 94 H8 A 94 -2.262 14.354 6.182
691 H61 A 94 1H6 A 94 2.913 11.794 8.435
692 H62 A 94 2H6 A 94 1.874 13.197 8.490
693 H2 A 94 H2 A 94 1.147 8.968 5.483
694 H5' A 95 1H5* A 95 -7.259 16.540 1.666
695 H5'' A 95 2H5* A 95 -7.266 14.798 2.009
696 H4' A 95 H4* A 95 -9.145 15.144 0.602
697 H3' A 95 H3* A 95 -7.221 13.416 -0.218
698 HO3' A 95 H3T A 95 -8.739 12.844 -1.856
699 H2' A 95 1H2* A 95 -5.931 14.668 -1.673
700 HO2' A 95 2HO* A 95 -8.273 14.355 -3.266
701 H1' A 95 H1* A 95 -7.829 16.610 -2.720
702 H8 A 95 H8 A 95 -4.685 16.169 -2.892
703 H61 A 95 1H6 A 95 -2.855 21.053 0.443
704 H62 A 95 2H6 A 95 -2.355 19.839 -0.713
705 H2 A 95 H2 A 95 -7.152 20.309 1.335
Start of MODEL 16
1 H VAL 6 H1 VAL 6 -4.401 5.850 -7.912
2 HA VAL 6 HA VAL 6 -4.632 5.150 -5.656
3 HB VAL 6 HB VAL 6 -1.930 3.815 -6.015
4 HG11 VAL 6 1HG1 VAL 6 -3.942 3.870 -3.727
5 HG12 VAL 6 2HG1 VAL 6 -2.457 2.884 -3.774
6 HG13 VAL 6 3HG1 VAL 6 -2.344 4.653 -3.749
7 HG21 VAL 6 1HG2 VAL 6 -3.188 1.685 -5.721
8 HG22 VAL 6 2HG2 VAL 6 -4.717 2.593 -5.817
9 HG23 VAL 6 3HG2 VAL 6 -3.629 2.514 -7.221
10 H ILE 7 H ILE 7 -3.952 6.584 -4.080
11 HA ILE 7 HA ILE 7 -2.556 8.910 -5.001
12 HB ILE 7 HB ILE 7 -3.407 7.994 -2.231
13 HG12 ILE 7 2HG1 ILE 7 -4.673 10.048 -4.085
14 HG13 ILE 7 3HG1 ILE 7 -5.181 8.345 -4.032
15 HG21 ILE 7 1HG2 ILE 7 -1.620 9.670 -2.046
16 HG22 ILE 7 2HG2 ILE 7 -2.464 10.732 -3.205
17 HG23 ILE 7 3HG2 ILE 7 -3.166 10.400 -1.607
18 HD11 ILE 7 1HD1 ILE 7 -5.245 10.296 -1.691
19 HD12 ILE 7 2HD1 ILE 7 -6.640 9.691 -2.605
20 HD13 ILE 7 3HD1 ILE 7 -5.683 8.569 -1.617
21 H ARG 8 H ARG 8 -0.512 9.732 -4.366
22 HA ARG 8 HA ARG 8 1.575 7.783 -4.272
23 HB2 ARG 8 2HB ARG 8 1.935 9.890 -5.369
24 HB3 ARG 8 3HB ARG 8 1.479 10.793 -3.912
25 HG2 ARG 8 2HG ARG 8 3.908 10.833 -4.195
26 HG3 ARG 8 3HG ARG 8 3.473 9.940 -2.732
27 HD2 ARG 8 2HD ARG 8 5.178 8.681 -3.815
28 HD3 ARG 8 3HD ARG 8 3.675 7.798 -4.109
29 HE ARG 8 HE ARG 8 3.785 9.328 -6.332
30 HH11 ARG 8 1HH1 ARG 8 6.267 7.417 -4.704
31 HH12 ARG 8 2HH1 ARG 8 7.161 7.104 -6.175
32 HH21 ARG 8 1HH2 ARG 8 4.997 8.925 -8.247
33 HH22 ARG 8 2HH2 ARG 8 6.455 7.963 -8.160
34 H GLY 9 H GLY 9 2.898 7.085 -2.650
35 HA2 GLY 9 2HA GLY 9 3.727 6.711 -0.554
36 HA3 GLY 9 3HA GLY 9 3.197 8.332 -0.122
37 HA PRO 10 HA PRO 10 -0.714 5.889 0.957
38 HB2 PRO 10 2HB PRO 10 -1.183 3.355 0.041
39 HB3 PRO 10 3HB PRO 10 -1.486 4.807 -0.971
40 HG2 PRO 10 2HG PRO 10 0.934 2.979 -0.990
41 HG3 PRO 10 3HG PRO 10 -0.001 3.617 -2.389
42 HD2 PRO 10 2HD PRO 10 2.342 4.763 -1.504
43 HD3 PRO 10 3HD PRO 10 1.010 5.713 -2.231
44 H ALA 11 H ALA 11 2.385 4.350 1.026
45 HA ALA 11 HA ALA 11 1.992 3.407 3.760
46 HB1 ALA 11 1HB ALA 11 2.610 1.070 3.234
47 HB2 ALA 11 2HB ALA 11 1.094 1.515 2.428
48 HB3 ALA 11 3HB ALA 11 2.610 1.456 1.499
49 H GLY 12 H GLY 12 4.180 2.147 4.359
50 HA2 GLY 12 2HA GLY 12 6.524 3.151 2.914
51 HA3 GLY 12 3HA GLY 12 6.273 3.846 4.520
52 H ASN 13 H ASN 13 8.558 2.534 4.228
53 HA ASN 13 HA ASN 13 9.892 0.850 4.925
54 HB2 ASN 13 2HB ASN 13 7.564 0.217 6.767
55 HB3 ASN 13 3HB ASN 13 9.219 -0.389 6.943
56 HD21 ASN 13 1HD2 ASN 13 10.614 2.653 8.125
57 HD22 ASN 13 2HD2 ASN 13 10.945 1.096 7.398
58 H ASN 14 H ASN 14 10.009 -1.643 5.358
59 HA ASN 14 HA ASN 14 10.060 -3.658 4.355
60 HB2 ASN 14 2HB ASN 14 7.108 -3.130 3.869
61 HB3 ASN 14 3HB ASN 14 7.908 -4.703 3.774
62 HD21 ASN 14 1HD2 ASN 14 6.292 -4.226 7.159
63 HD22 ASN 14 2HD2 ASN 14 5.720 -4.100 5.506
64 H ASP 15 H ASP 15 10.083 -0.988 2.623
65 HA ASP 15 HA ASP 15 10.138 -2.406 0.004
66 HB2 ASP 15 2HB ASP 15 9.122 0.384 0.635
67 HB3 ASP 15 3HB ASP 15 9.455 -0.201 -0.999
68 H CYS 16 H CYS 16 11.497 -1.190 -1.647
69 HA CYS 16 HA CYS 16 14.095 -0.645 -0.502
70 HB2 CYS 16 2HB CYS 16 12.998 -0.459 -3.335
71 HB3 CYS 16 3HB CYS 16 14.704 -0.229 -2.897
72 HG CYS 16 HG CYS 16 14.420 -2.607 -3.888
73 H ARG 17 H ARG 17 11.441 1.254 -0.415
74 HA ARG 17 HA ARG 17 12.487 3.746 -1.428
75 HB2 ARG 17 2HB ARG 17 10.153 3.086 0.405
76 HB3 ARG 17 3HB ARG 17 10.562 4.731 -0.126
77 HG2 ARG 17 2HG ARG 17 10.428 3.941 -2.504
78 HG3 ARG 17 3HG ARG 17 9.820 2.380 -1.910
79 HD2 ARG 17 2HD ARG 17 7.945 3.600 -0.762
80 HD3 ARG 17 3HD ARG 17 8.521 5.115 -1.468
81 HE ARG 17 HE ARG 17 7.022 3.008 -2.796
82 HH11 ARG 17 1HH1 ARG 17 9.266 5.704 -3.283
83 HH12 ARG 17 2HH1 ARG 17 8.829 5.894 -4.974
84 HH21 ARG 17 1HH2 ARG 17 6.468 3.329 -4.995
85 HH22 ARG 17 2HH2 ARG 17 7.282 4.577 -5.920
86 H ILE 18 H ILE 18 13.310 5.496 -0.356
87 HA ILE 18 HA ILE 18 13.745 5.325 2.572
88 HB ILE 18 HB ILE 18 16.007 6.053 2.423
89 HG12 ILE 18 2HG1 ILE 18 15.767 6.091 -0.606
90 HG13 ILE 18 3HG1 ILE 18 15.727 7.535 0.429
91 HG21 ILE 18 1HG2 ILE 18 17.098 4.137 1.418
92 HG22 ILE 18 2HG2 ILE 18 15.568 3.618 2.158
93 HG23 ILE 18 3HG2 ILE 18 15.680 3.817 0.389
94 HD11 ILE 18 1HD1 ILE 18 17.979 6.905 1.335
95 HD12 ILE 18 2HD1 ILE 18 18.043 5.582 0.143
96 HD13 ILE 18 3HD1 ILE 18 17.973 7.273 -0.400
97 H TYR 19 H TYR 19 14.733 7.610 3.197
98 HA TYR 19 HA TYR 19 13.021 9.641 1.892
99 HB2 TYR 19 2HB TYR 19 11.858 9.381 3.793
100 HB3 TYR 19 3HB TYR 19 13.251 8.893 4.743
101 HD1 TYR 19 HD1 TYR 19 14.890 10.581 5.562
102 HD2 TYR 19 HD2 TYR 19 11.132 11.687 3.791
103 HE1 TYR 19 HE1 TYR 19 15.040 12.811 6.654
104 HE2 TYR 19 HE2 TYR 19 11.281 13.929 4.876
105 HH TYR 19 HH TYR 19 12.526 15.316 6.195
106 H VAL 20 H VAL 20 13.592 11.799 1.858
107 HA VAL 20 HA VAL 20 16.428 12.421 2.442
108 HB VAL 20 HB VAL 20 15.041 12.986 -0.209
109 HG11 VAL 20 1HG1 VAL 20 17.871 13.534 0.767
110 HG12 VAL 20 2HG1 VAL 20 17.295 13.767 -0.900
111 HG13 VAL 20 3HG1 VAL 20 16.618 14.748 0.418
112 HG21 VAL 20 1HG2 VAL 20 15.627 10.616 -0.053
113 HG22 VAL 20 2HG2 VAL 20 16.755 11.442 -1.150
114 HG23 VAL 20 3HG2 VAL 20 17.266 11.034 0.507
115 H GLY 21 H GLY 21 16.771 14.616 2.989
116 HA2 GLY 21 2HA GLY 21 14.535 16.503 2.825
117 HA3 GLY 21 3HA GLY 21 14.887 15.912 4.454
118 H ASN 22 H ASN 22 15.116 18.449 4.357
119 HA ASN 22 HA ASN 22 16.381 20.287 4.552
120 HB2 ASN 22 2HB ASN 22 17.601 18.690 6.131
121 HB3 ASN 22 3HB ASN 22 18.779 18.454 4.823
122 HD21 ASN 22 1HD2 ASN 22 20.600 21.248 5.909
123 HD22 ASN 22 2HD2 ASN 22 20.586 19.579 5.378
124 H LEU 23 H LEU 23 16.037 19.028 1.813
125 HA LEU 23 HA LEU 23 18.417 19.527 0.312
126 HB2 LEU 23 2HB LEU 23 15.477 19.593 -0.490
127 HB3 LEU 23 3HB LEU 23 16.832 19.621 -1.631
128 HG LEU 23 HG LEU 23 16.313 17.386 0.383
129 HD11 LEU 23 1HD1 LEU 23 15.777 17.533 -2.610
130 HD12 LEU 23 2HD1 LEU 23 15.575 16.090 -1.589
131 HD13 LEU 23 3HD1 LEU 23 14.539 17.511 -1.334
132 HD21 LEU 23 1HD2 LEU 23 18.232 17.651 -1.977
133 HD22 LEU 23 2HD2 LEU 23 18.680 17.557 -0.258
134 HD23 LEU 23 3HD2 LEU 23 17.944 16.153 -1.058
135 HA PRO 24 HA PRO 24 18.462 23.926 0.419
136 HB2 PRO 24 2HB PRO 24 20.029 24.452 -1.786
137 HB3 PRO 24 3HB PRO 24 20.673 23.789 -0.245
138 HG2 PRO 24 2HG PRO 24 19.951 22.306 -2.783
139 HG3 PRO 24 3HG PRO 24 21.392 22.096 -1.730
140 HD2 PRO 24 2HD PRO 24 19.178 20.468 -1.602
141 HD3 PRO 24 3HD PRO 24 20.176 20.854 -0.165
142 HA PRO 25 HA PRO 25 15.233 25.179 -2.324
143 HB2 PRO 25 2HB PRO 25 15.602 27.900 -2.444
144 HB3 PRO 25 3HB PRO 25 14.990 27.050 -0.984
145 HG2 PRO 25 2HG PRO 25 17.810 27.981 -1.583
146 HG3 PRO 25 3HG PRO 25 16.888 28.144 -0.054
147 HD2 PRO 25 2HD PRO 25 18.733 26.162 -0.471
148 HD3 PRO 25 3HD PRO 25 17.263 25.903 0.521
149 H ASP 26 H ASP 26 18.585 25.712 -3.093
150 HA ASP 26 HA ASP 26 18.023 26.708 -5.791
151 HB2 ASP 26 2HB ASP 26 20.591 26.097 -4.293
152 HB3 ASP 26 3HB ASP 26 20.546 26.635 -5.971
153 H ILE 27 H ILE 27 17.771 23.686 -4.507
154 HA ILE 27 HA ILE 27 19.320 22.131 -6.357
155 HB ILE 27 HB ILE 27 18.369 21.393 -4.110
156 HG12 ILE 27 2HG1 ILE 27 17.775 19.090 -4.880
157 HG13 ILE 27 3HG1 ILE 27 17.770 19.677 -6.558
158 HG21 ILE 27 1HG2 ILE 27 15.804 21.015 -5.713
159 HG22 ILE 27 2HG2 ILE 27 16.078 20.601 -4.009
160 HG23 ILE 27 3HG2 ILE 27 16.060 22.303 -4.512
161 HD11 ILE 27 1HD1 ILE 27 19.922 18.582 -5.904
162 HD12 ILE 27 2HD1 ILE 27 20.143 20.284 -6.376
163 HD13 ILE 27 3HD1 ILE 27 20.155 19.829 -4.655
164 H ARG 28 H ARG 28 18.742 21.153 -8.312
165 HA ARG 28 HA ARG 28 16.525 22.412 -9.757
166 HB2 ARG 28 2HB ARG 28 18.711 22.047 -10.841
167 HB3 ARG 28 3HB ARG 28 18.553 20.297 -10.570
168 HG2 ARG 28 2HG ARG 28 16.553 20.242 -12.031
169 HG3 ARG 28 3HG ARG 28 16.679 22.005 -12.264
170 HD2 ARG 28 2HD ARG 28 17.662 20.753 -14.153
171 HD3 ARG 28 3HD ARG 28 18.889 21.711 -13.301
172 HE ARG 28 HE ARG 28 19.587 19.617 -12.148
173 HH11 ARG 28 1HH1 ARG 28 17.824 19.343 -15.208
174 HH12 ARG 28 2HH1 ARG 28 18.422 17.727 -15.515
175 HH21 ARG 28 1HH2 ARG 28 20.328 17.564 -12.575
176 HH22 ARG 28 2HH2 ARG 28 19.822 16.704 -14.017
177 H THR 29 H THR 29 14.767 21.245 -10.705
178 HA THR 29 HA THR 29 13.627 19.389 -8.898
179 HB THR 29 HB THR 29 11.682 19.518 -10.141
180 HG1 THR 29 1HG THR 29 11.707 20.024 -12.352
181 HG21 THR 29 1HG2 THR 29 12.487 21.770 -9.335
182 HG22 THR 29 2HG2 THR 29 13.162 22.061 -10.958
183 HG23 THR 29 3HG2 THR 29 11.409 21.850 -10.745
184 H LYS 30 H LYS 30 16.053 18.646 -10.993
185 HA LYS 30 HA LYS 30 15.132 15.824 -11.132
186 HB2 LYS 30 2HB LYS 30 16.294 17.423 -13.437
187 HB3 LYS 30 3HB LYS 30 16.133 15.655 -13.402
188 HG2 LYS 30 2HG LYS 30 13.642 16.015 -12.925
189 HG3 LYS 30 3HG LYS 30 13.905 17.729 -13.303
190 HD2 LYS 30 2HD LYS 30 13.105 16.578 -15.291
191 HD3 LYS 30 3HD LYS 30 14.792 17.069 -15.543
192 HE2 LYS 30 2HE LYS 30 15.555 14.790 -14.983
193 HE3 LYS 30 3HE LYS 30 13.884 14.308 -14.628
194 HZ1 LYS 30 1HZ LYS 30 14.890 15.193 -17.249
195 HZ2 LYS 30 2HZ LYS 30 14.559 13.634 -16.827
196 HZ3 LYS 30 3HZ LYS 30 13.342 14.736 -16.925
197 H ASP 31 H ASP 31 17.427 17.804 -9.837
198 HA ASP 31 HA ASP 31 19.811 16.363 -10.487
199 HB2 ASP 31 2HB ASP 31 18.994 18.070 -8.131
200 HB3 ASP 31 3HB ASP 31 20.565 17.250 -8.193
201 H ILE 32 H ILE 32 17.197 15.696 -8.226
202 HA ILE 32 HA ILE 32 18.593 13.541 -6.882
203 HB ILE 32 HB ILE 32 16.824 14.866 -5.815
204 HG12 ILE 32 2HG1 ILE 32 15.837 12.003 -6.172
205 HG13 ILE 32 3HG1 ILE 32 17.270 12.429 -5.211
206 HG21 ILE 32 1HG2 ILE 32 14.466 14.606 -6.476
207 HG22 ILE 32 2HG2 ILE 32 15.417 15.253 -7.825
208 HG23 ILE 32 3HG2 ILE 32 14.945 13.541 -7.819
209 HD11 ILE 32 1HD1 ILE 32 15.335 12.260 -3.737
210 HD12 ILE 32 2HD1 ILE 32 15.850 13.958 -3.831
211 HD13 ILE 32 3HD1 ILE 32 14.419 13.410 -4.732
212 H GLU 33 H GLU 33 16.998 13.877 -9.948
213 HA GLU 33 HA GLU 33 16.410 10.978 -10.114
214 HB2 GLU 33 2HB GLU 33 15.868 13.217 -12.109
215 HB3 GLU 33 3HB GLU 33 15.252 11.554 -12.171
216 HG2 GLU 33 2HG GLU 33 14.138 11.995 -9.925
217 HG3 GLU 33 3HG GLU 33 14.603 13.696 -10.103
218 H ASP 34 H ASP 34 18.923 13.212 -10.827
219 HA ASP 34 HA ASP 34 19.868 11.579 -13.108
220 HB2 ASP 34 2HB ASP 34 20.451 14.415 -12.266
221 HB3 ASP 34 3HB ASP 34 21.430 13.555 -13.466
222 H VAL 35 H VAL 35 21.506 13.338 -10.389
223 HA VAL 35 HA VAL 35 23.828 11.704 -10.871
224 HB VAL 35 HB VAL 35 23.809 14.126 -10.099
225 HG11 VAL 35 1HG1 VAL 35 23.768 14.535 -7.692
226 HG12 VAL 35 2HG1 VAL 35 22.223 13.809 -8.181
227 HG13 VAL 35 3HG1 VAL 35 23.453 12.819 -7.361
228 HG21 VAL 35 1HG2 VAL 35 25.827 12.688 -10.186
229 HG22 VAL 35 2HG2 VAL 35 25.879 13.819 -8.813
230 HG23 VAL 35 3HG2 VAL 35 25.479 12.108 -8.541
231 H PHE 36 H PHE 36 21.239 11.654 -8.415
232 HA PHE 36 HA PHE 36 22.557 9.595 -6.892
233 HB2 PHE 36 2HB PHE 36 19.783 10.760 -6.836
234 HB3 PHE 36 3HB PHE 36 20.254 9.383 -5.834
235 HD1 PHE 36 HD1 PHE 36 21.945 9.584 -4.074
236 HD2 PHE 36 HD2 PHE 36 20.649 12.991 -6.351
237 HE1 PHE 36 HE1 PHE 36 22.933 11.102 -2.370
238 HE2 PHE 36 HE2 PHE 36 21.642 14.506 -4.653
239 HZ PHE 36 HZ PHE 36 22.792 13.559 -2.670
240 H SER 37 H SER 37 20.467 9.587 -9.698
241 HA SER 37 HA SER 37 19.728 6.804 -9.500
242 HB2 SER 37 2HB SER 37 18.422 8.387 -10.843
243 HB3 SER 37 3HB SER 37 19.835 8.716 -11.866
244 HG SER 37 HG SER 37 18.430 7.150 -12.782
245 H LYS 38 H LYS 38 22.500 8.608 -10.816
246 HA LYS 38 HA LYS 38 23.658 6.316 -12.146
247 HB2 LYS 38 2HB LYS 38 24.195 8.655 -12.765
248 HB3 LYS 38 3HB LYS 38 24.856 8.935 -11.155
249 HG2 LYS 38 2HG LYS 38 26.650 8.537 -12.787
250 HG3 LYS 38 3HG LYS 38 26.636 7.313 -11.524
251 HD2 LYS 38 2HD LYS 38 27.046 6.203 -13.597
252 HD3 LYS 38 3HD LYS 38 25.403 5.765 -13.119
253 HE2 LYS 38 2HE LYS 38 26.029 8.039 -15.052
254 HE3 LYS 38 3HE LYS 38 25.786 6.365 -15.579
255 HZ1 LYS 38 1HZ LYS 38 23.600 6.426 -14.622
256 HZ2 LYS 38 2HZ LYS 38 23.798 7.994 -14.151
257 HZ3 LYS 38 3HZ LYS 38 23.780 7.605 -15.748
258 H TYR 39 H TYR 39 23.649 7.635 -8.878
259 HA TYR 39 HA TYR 39 25.847 5.959 -8.003
260 HB2 TYR 39 2HB TYR 39 24.117 8.036 -6.772
261 HB3 TYR 39 3HB TYR 39 24.882 6.856 -5.704
262 HD1 TYR 39 HD1 TYR 39 26.799 7.508 -4.718
263 HD2 TYR 39 HD2 TYR 39 25.979 8.880 -8.711
264 HE1 TYR 39 HE1 TYR 39 28.925 8.755 -4.709
265 HE2 TYR 39 HE2 TYR 39 28.110 10.155 -8.712
266 HH TYR 39 HH TYR 39 29.993 10.708 -7.537
267 H GLY 40 H GLY 40 22.410 5.369 -8.243
268 HA2 GLY 40 2HA GLY 40 22.846 2.843 -6.777
269 HA3 GLY 40 3HA GLY 40 21.671 3.971 -6.084
270 H ALA 41 H ALA 41 21.806 4.066 -9.552
271 HA ALA 41 HA ALA 41 20.272 3.488 -11.118
272 HB1 ALA 41 1HB ALA 41 20.367 0.840 -9.634
273 HB2 ALA 41 2HB ALA 41 19.800 1.089 -11.301
274 HB3 ALA 41 3HB ALA 41 21.508 1.376 -10.890
275 H ILE 42 H ILE 42 19.164 4.899 -8.933
276 HA ILE 42 HA ILE 42 16.919 3.943 -7.669
277 HB ILE 42 HB ILE 42 17.466 6.623 -8.968
278 HG12 ILE 42 2HG1 ILE 42 17.469 5.755 -6.044
279 HG13 ILE 42 3HG1 ILE 42 18.913 5.759 -7.067
280 HG21 ILE 42 1HG2 ILE 42 15.213 5.870 -7.056
281 HG22 ILE 42 2HG2 ILE 42 15.625 7.524 -7.572
282 HG23 ILE 42 3HG2 ILE 42 15.018 6.366 -8.755
283 HD11 ILE 42 1HD1 ILE 42 17.206 8.205 -6.428
284 HD12 ILE 42 2HD1 ILE 42 18.799 7.817 -5.754
285 HD13 ILE 42 3HD1 ILE 42 18.631 8.184 -7.486
286 H ARG 43 H ARG 43 14.822 3.487 -8.112
287 HA ARG 43 HA ARG 43 14.110 3.294 -10.997
288 HB2 ARG 43 2HB ARG 43 13.058 1.819 -8.551
289 HB3 ARG 43 3HB ARG 43 12.485 1.589 -10.215
290 HG2 ARG 43 2HG ARG 43 15.318 1.076 -9.218
291 HG3 ARG 43 3HG ARG 43 14.095 -0.157 -9.574
292 HD2 ARG 43 2HD ARG 43 13.995 0.702 -11.939
293 HD3 ARG 43 3HD ARG 43 15.336 1.796 -11.555
294 HE ARG 43 HE ARG 43 15.717 -1.105 -11.077
295 HH11 ARG 43 1HH1 ARG 43 16.394 1.762 -13.036
296 HH12 ARG 43 2HH1 ARG 43 17.743 1.018 -13.867
297 HH21 ARG 43 1HH2 ARG 43 17.489 -2.050 -12.181
298 HH22 ARG 43 2HH2 ARG 43 18.359 -1.129 -13.383
299 H ASP 44 H ASP 44 13.195 4.876 -7.979
300 HA ASP 44 HA ASP 44 11.184 6.359 -9.535
301 HB2 ASP 44 2HB ASP 44 9.908 4.430 -8.714
302 HB3 ASP 44 3HB ASP 44 10.427 4.778 -7.056
303 H ILE 45 H ILE 45 10.449 8.298 -8.550
304 HA ILE 45 HA ILE 45 11.932 9.217 -6.148
305 HB ILE 45 HB ILE 45 11.887 10.539 -8.888
306 HG12 ILE 45 2HG1 ILE 45 14.394 10.841 -7.908
307 HG13 ILE 45 3HG1 ILE 45 13.951 9.344 -7.068
308 HG21 ILE 45 1HG2 ILE 45 12.931 12.500 -7.769
309 HG22 ILE 45 2HG2 ILE 45 11.255 12.245 -7.259
310 HG23 ILE 45 3HG2 ILE 45 12.595 11.763 -6.187
311 HD11 ILE 45 1HD1 ILE 45 13.414 8.292 -9.252
312 HD12 ILE 45 2HD1 ILE 45 13.752 9.825 -10.085
313 HD13 ILE 45 3HD1 ILE 45 15.064 8.939 -9.277
314 H ASP 46 H ASP 46 10.853 10.801 -4.955
315 HA ASP 46 HA ASP 46 8.190 11.654 -5.914
316 HB2 ASP 46 2HB ASP 46 7.846 9.577 -4.642
317 HB3 ASP 46 3HB ASP 46 8.712 10.272 -3.261
318 H LEU 47 H LEU 47 10.174 13.382 -6.063
319 HA LEU 47 HA LEU 47 10.794 14.870 -3.734
320 HB2 LEU 47 2HB LEU 47 11.998 15.176 -5.816
321 HB3 LEU 47 3HB LEU 47 10.515 15.676 -6.653
322 HG LEU 47 HG LEU 47 10.358 17.674 -5.167
323 HD11 LEU 47 1HD1 LEU 47 13.080 16.706 -4.176
324 HD12 LEU 47 2HD1 LEU 47 12.368 18.296 -3.825
325 HD13 LEU 47 3HD1 LEU 47 11.597 16.825 -3.203
326 HD21 LEU 47 1HD2 LEU 47 12.251 18.892 -6.193
327 HD22 LEU 47 2HD2 LEU 47 13.025 17.345 -6.609
328 HD23 LEU 47 3HD2 LEU 47 11.483 17.799 -7.370
329 H LYS 48 H LYS 48 9.640 16.210 -2.464
330 HA LYS 48 HA LYS 48 6.992 17.156 -3.431
331 HB2 LYS 48 2HB LYS 48 7.907 15.939 -0.836
332 HB3 LYS 48 3HB LYS 48 6.623 17.161 -0.809
333 HG2 LYS 48 2HG LYS 48 5.276 15.842 -2.375
334 HG3 LYS 48 3HG LYS 48 6.571 14.636 -2.526
335 HD2 LYS 48 2HD LYS 48 6.340 13.988 -0.208
336 HD3 LYS 48 3HD LYS 48 5.270 15.362 0.132
337 HE2 LYS 48 2HE LYS 48 3.996 13.254 -0.080
338 HE3 LYS 48 3HE LYS 48 3.537 14.433 -1.318
339 HZ1 LYS 48 1HZ LYS 48 4.989 13.254 -2.847
340 HZ2 LYS 48 2HZ LYS 48 5.352 12.147 -1.695
341 HZ3 LYS 48 3HZ LYS 48 3.810 12.271 -2.254
342 H ASN 49 H ASN 49 6.409 19.237 -3.007
343 HA ASN 49 HA ASN 49 8.592 21.109 -2.535
344 HB2 ASN 49 2HB ASN 49 6.881 22.802 -3.133
345 HB3 ASN 49 3HB ASN 49 7.023 21.518 -4.327
346 HD21 ASN 49 1HD2 ASN 49 3.439 21.765 -4.141
347 HD22 ASN 49 2HD2 ASN 49 4.845 22.440 -4.939
348 H ARG 50 H ARG 50 6.676 23.117 -1.366
349 HA ARG 50 HA ARG 50 7.442 22.774 1.349
350 HB2 ARG 50 2HB ARG 50 7.134 24.945 0.190
351 HB3 ARG 50 3HB ARG 50 5.400 24.639 0.072
352 HG2 ARG 50 2HG ARG 50 6.006 26.189 1.933
353 HG3 ARG 50 3HG ARG 50 5.139 24.756 2.492
354 HD2 ARG 50 2HD ARG 50 7.017 25.275 3.976
355 HD3 ARG 50 3HD ARG 50 7.292 23.724 3.176
356 HE ARG 50 HE ARG 50 8.655 25.240 1.497
357 HH11 ARG 50 1HH1 ARG 50 8.492 25.586 5.018
358 HH12 ARG 50 2HH1 ARG 50 10.097 26.263 5.137
359 HH21 ARG 50 1HH2 ARG 50 10.721 26.182 1.685
360 HH22 ARG 50 2HH2 ARG 50 11.347 26.616 3.260
361 H ARG 51 H ARG 51 4.972 21.195 -0.313
362 HA ARG 51 HA ARG 51 2.838 21.069 1.519
363 HB2 ARG 51 2HB ARG 51 2.652 20.073 -0.665
364 HB3 ARG 51 3HB ARG 51 4.065 19.042 -0.378
365 HG2 ARG 51 2HG ARG 51 2.041 17.709 -0.201
366 HG3 ARG 51 3HG ARG 51 2.833 17.813 1.376
367 HD2 ARG 51 2HD ARG 51 1.240 19.612 2.044
368 HD3 ARG 51 3HD ARG 51 0.446 19.467 0.460
369 HE ARG 51 HE ARG 51 0.530 16.893 1.630
370 HH11 ARG 51 1HH1 ARG 51 -0.988 20.033 2.225
371 HH12 ARG 51 2HH1 ARG 51 -2.384 19.332 3.010
372 HH21 ARG 51 1HH2 ARG 51 -1.317 16.009 2.628
373 HH22 ARG 51 2HH2 ARG 51 -2.557 17.064 3.264
374 H GLY 52 H GLY 52 2.509 20.045 3.462
375 HA2 GLY 52 2HA GLY 52 3.031 18.899 5.408
376 HA3 GLY 52 3HA GLY 52 4.275 18.016 4.505
377 H GLY 53 H GLY 53 6.093 18.239 5.773
378 HA2 GLY 53 2HA GLY 53 6.853 20.723 7.059
379 HA3 GLY 53 3HA GLY 53 7.847 19.265 6.847
380 HA PRO 54 HA PRO 54 9.662 22.611 4.137
381 HB2 PRO 54 2HB PRO 54 12.081 21.101 5.064
382 HB3 PRO 54 3HB PRO 54 11.844 22.875 4.898
383 HG2 PRO 54 2HG PRO 54 11.820 21.655 7.346
384 HG3 PRO 54 3HG PRO 54 10.716 23.017 6.961
385 HD2 PRO 54 2HD PRO 54 10.119 20.065 7.041
386 HD3 PRO 54 3HD PRO 54 9.104 21.449 7.551
387 HA PRO 55 HA PRO 55 10.056 20.149 0.555
388 HB2 PRO 55 2HB PRO 55 12.895 21.089 0.178
389 HB3 PRO 55 3HB PRO 55 11.540 21.088 -0.995
390 HG2 PRO 55 2HG PRO 55 12.310 23.373 0.274
391 HG3 PRO 55 3HG PRO 55 10.571 23.013 -0.008
392 HD2 PRO 55 2HD PRO 55 12.172 22.731 2.529
393 HD3 PRO 55 3HD PRO 55 10.476 23.258 2.301
394 H PHE 56 H PHE 56 10.490 18.028 0.152
395 HA PHE 56 HA PHE 56 12.868 16.678 1.196
396 HB2 PHE 56 2HB PHE 56 11.797 15.428 2.895
397 HB3 PHE 56 3HB PHE 56 11.234 17.068 3.183
398 HD1 PHE 56 HD1 PHE 56 8.908 17.630 1.865
399 HD2 PHE 56 HD2 PHE 56 10.281 13.707 2.963
400 HE1 PHE 56 HE1 PHE 56 6.572 16.801 1.832
401 HE2 PHE 56 HE2 PHE 56 7.938 12.902 3.028
402 HZ PHE 56 HZ PHE 56 6.087 14.426 2.416
403 H ALA 57 H ALA 57 12.373 14.155 0.817
404 HA ALA 57 HA ALA 57 10.476 13.691 -1.370
405 HB1 ALA 57 1HB ALA 57 13.485 13.508 -1.824
406 HB2 ALA 57 2HB ALA 57 12.211 13.125 -3.005
407 HB3 ALA 57 3HB ALA 57 12.443 14.801 -2.460
408 H PHE 58 H PHE 58 10.521 11.440 -2.124
409 HA PHE 58 HA PHE 58 11.999 9.586 -0.329
410 HB2 PHE 58 2HB PHE 58 9.292 9.131 -1.636
411 HB3 PHE 58 3HB PHE 58 10.204 7.939 -0.719
412 HD1 PHE 58 HD1 PHE 58 10.725 8.404 1.736
413 HD2 PHE 58 HD2 PHE 58 7.831 10.624 -0.536
414 HE1 PHE 58 HE1 PHE 58 9.689 9.208 3.841
415 HE2 PHE 58 HE2 PHE 58 6.839 11.484 1.567
416 HZ PHE 58 HZ PHE 58 7.763 10.767 3.757
417 H VAL 59 H VAL 59 12.737 7.610 -1.383
418 HA VAL 59 HA VAL 59 12.978 7.805 -4.338
419 HB VAL 59 HB VAL 59 15.266 7.769 -2.331
420 HG11 VAL 59 1HG1 VAL 59 15.717 6.230 -4.197
421 HG12 VAL 59 2HG1 VAL 59 15.306 7.519 -5.363
422 HG13 VAL 59 3HG1 VAL 59 16.740 7.676 -4.308
423 HG21 VAL 59 1HG2 VAL 59 14.406 10.028 -2.759
424 HG22 VAL 59 2HG2 VAL 59 15.985 9.827 -3.544
425 HG23 VAL 59 3HG2 VAL 59 14.507 9.751 -4.523
426 H GLU 60 H GLU 60 12.903 5.803 -5.250
427 HA GLU 60 HA GLU 60 13.113 3.474 -3.402
428 HB2 GLU 60 2HB GLU 60 10.938 3.826 -4.612
429 HB3 GLU 60 3HB GLU 60 11.818 3.603 -6.144
430 HG2 GLU 60 2HG GLU 60 12.564 1.366 -5.404
431 HG3 GLU 60 3HG GLU 60 11.695 1.581 -3.877
432 H PHE 61 H PHE 61 14.940 2.395 -3.495
433 HA PHE 61 HA PHE 61 16.711 2.684 -5.801
434 HB2 PHE 61 2HB PHE 61 17.050 1.554 -3.045
435 HB3 PHE 61 3HB PHE 61 18.218 1.206 -4.319
436 HD1 PHE 61 HD1 PHE 61 20.020 2.630 -4.647
437 HD2 PHE 61 HD2 PHE 61 16.460 4.143 -2.766
438 HE1 PHE 61 HE1 PHE 61 21.146 4.802 -4.269
439 HE2 PHE 61 HE2 PHE 61 17.580 6.322 -2.408
440 HZ PHE 61 HZ PHE 61 19.928 6.656 -3.143
441 H GLU 62 H GLU 62 17.752 1.033 -6.956
442 HA GLU 62 HA GLU 62 16.091 -1.281 -7.573
443 HB2 GLU 62 2HB GLU 62 17.383 -0.232 -9.334
444 HB3 GLU 62 3HB GLU 62 18.873 -0.354 -8.382
445 HG2 GLU 62 2HG GLU 62 18.912 -2.052 -10.092
446 HG3 GLU 62 3HG GLU 62 18.768 -2.833 -8.518
447 H ASP 63 H ASP 63 18.853 -0.544 -5.512
448 HA ASP 63 HA ASP 63 18.635 -3.129 -4.182
449 HB2 ASP 63 2HB ASP 63 20.085 -3.691 -6.078
450 HB3 ASP 63 3HB ASP 63 21.136 -2.318 -5.715
451 HA PRO 64 HA PRO 64 19.477 0.113 -1.217
452 HB2 PRO 64 2HB PRO 64 19.334 -1.421 1.082
453 HB3 PRO 64 3HB PRO 64 17.906 -0.826 0.175
454 HG2 PRO 64 2HG PRO 64 19.214 -3.555 0.053
455 HG3 PRO 64 3HG PRO 64 17.470 -3.150 0.105
456 HD2 PRO 64 2HD PRO 64 18.769 -3.764 -2.223
457 HD3 PRO 64 3HD PRO 64 17.442 -2.565 -2.175
458 H ARG 65 H ARG 65 21.458 -2.626 -1.909
459 HA ARG 65 HA ARG 65 23.502 -2.155 0.078
460 HB2 ARG 65 2HB ARG 65 23.562 -3.575 -2.614
461 HB3 ARG 65 3HB ARG 65 24.855 -3.646 -1.399
462 HG2 ARG 65 2HG ARG 65 23.374 -4.715 0.211
463 HG3 ARG 65 3HG ARG 65 21.970 -4.468 -0.843
464 HD2 ARG 65 2HD ARG 65 23.029 -5.907 -2.574
465 HD3 ARG 65 3HD ARG 65 24.397 -6.190 -1.482
466 HE ARG 65 HE ARG 65 23.109 -7.696 -0.276
467 HH11 ARG 65 1HH1 ARG 65 20.985 -5.742 -2.326
468 HH12 ARG 65 2HH1 ARG 65 19.580 -6.733 -2.018
469 HH21 ARG 65 1HH2 ARG 65 21.252 -8.967 0.114
470 HH22 ARG 65 2HH2 ARG 65 19.729 -8.552 -0.635
471 H ASP 66 H ASP 66 22.582 -0.516 -2.829
472 HA ASP 66 HA ASP 66 25.217 0.568 -3.402
473 HB2 ASP 66 2HB ASP 66 22.437 1.267 -4.380
474 HB3 ASP 66 3HB ASP 66 23.911 2.072 -4.938
475 H ALA 67 H ALA 67 23.149 1.110 -0.860
476 HA ALA 67 HA ALA 67 23.106 3.951 -0.678
477 HB1 ALA 67 1HB ALA 67 22.572 3.519 1.699
478 HB2 ALA 67 2HB ALA 67 21.641 2.450 0.620
479 HB3 ALA 67 3HB ALA 67 23.054 1.821 1.500
480 H GLU 68 H GLU 68 25.735 1.716 -0.386
481 HA GLU 68 HA GLU 68 27.257 3.071 1.616
482 HB2 GLU 68 2HB GLU 68 28.121 1.306 -0.715
483 HB3 GLU 68 3HB GLU 68 29.163 1.793 0.639
484 HG2 GLU 68 2HG GLU 68 27.554 0.738 2.230
485 HG3 GLU 68 3HG GLU 68 26.591 0.178 0.854
486 H ASP 69 H ASP 69 26.487 3.928 -1.634
487 HA ASP 69 HA ASP 69 28.550 6.079 -1.528
488 HB2 ASP 69 2HB ASP 69 27.498 4.537 -3.920
489 HB3 ASP 69 3HB ASP 69 28.418 6.037 -4.044
490 H ALA 70 H ALA 70 25.222 5.165 -2.420
491 HA ALA 70 HA ALA 70 24.574 7.837 -3.366
492 HB1 ALA 70 1HB ALA 70 22.811 5.429 -2.795
493 HB2 ALA 70 2HB ALA 70 22.368 6.859 -3.757
494 HB3 ALA 70 3HB ALA 70 23.630 5.751 -4.344
495 H VAL 71 H VAL 71 24.806 6.433 -0.252
496 HA VAL 71 HA VAL 71 22.937 8.500 0.811
497 HB VAL 71 HB VAL 71 23.211 5.608 1.715
498 HG11 VAL 71 1HG1 VAL 71 21.660 7.951 2.875
499 HG12 VAL 71 2HG1 VAL 71 21.402 6.247 3.336
500 HG13 VAL 71 3HG1 VAL 71 22.958 7.035 3.669
501 HG21 VAL 71 1HG2 VAL 71 20.795 5.519 1.134
502 HG22 VAL 71 2HG2 VAL 71 20.895 7.180 0.507
503 HG23 VAL 71 3HG2 VAL 71 21.805 5.873 -0.285
504 H SER 72 H SER 72 25.626 6.217 1.647
505 HA SER 72 HA SER 72 26.368 7.626 4.021
506 HB2 SER 72 2HB SER 72 27.953 5.782 2.191
507 HB3 SER 72 3HB SER 72 28.456 6.283 3.822
508 HG SER 72 HG SER 72 26.652 5.260 4.659
509 H GLY 73 H GLY 73 26.675 8.519 0.744
510 HA2 GLY 73 2HA GLY 73 29.175 10.029 1.124
511 HA3 GLY 73 3HA GLY 73 28.256 9.836 -0.377
512 H ARG 74 H ARG 74 25.959 10.631 1.951
513 HA ARG 74 HA ARG 74 26.428 13.531 1.807
514 HB2 ARG 74 2HB ARG 74 25.452 12.941 -0.399
515 HB3 ARG 74 3HB ARG 74 24.066 12.204 0.412
516 HG2 ARG 74 2HG ARG 74 23.559 14.476 -0.427
517 HG3 ARG 74 3HG ARG 74 23.386 14.373 1.325
518 HD2 ARG 74 2HD ARG 74 24.554 16.452 0.639
519 HD3 ARG 74 3HD ARG 74 25.600 15.423 1.632
520 HE ARG 74 HE ARG 74 25.771 15.277 -1.339
521 HH11 ARG 74 1HH1 ARG 74 27.253 16.175 1.750
522 HH12 ARG 74 2HH1 ARG 74 28.857 16.319 1.066
523 HH21 ARG 74 1HH2 ARG 74 27.868 15.480 -2.197
524 HH22 ARG 74 2HH2 ARG 74 29.198 15.945 -1.162
525 H ASP 75 H ASP 75 24.879 10.769 3.243
526 HA ASP 75 HA ASP 75 22.752 12.119 4.586
527 HB2 ASP 75 2HB ASP 75 22.912 9.655 4.329
528 HB3 ASP 75 3HB ASP 75 24.318 9.639 5.400
529 H GLY 76 H GLY 76 22.661 13.267 6.499
530 HA2 GLY 76 2HA GLY 76 23.329 14.256 8.442
531 HA3 GLY 76 3HA GLY 76 24.511 12.948 8.622
532 H TYR 77 H TYR 77 24.260 15.524 6.070
533 HA TYR 77 HA TYR 77 27.115 16.030 6.592
534 HB2 TYR 77 2HB TYR 77 26.883 15.311 4.411
535 HB3 TYR 77 3HB TYR 77 25.428 16.270 4.139
536 HD1 TYR 77 HD1 TYR 77 29.087 16.685 4.887
537 HD2 TYR 77 HD2 TYR 77 25.561 18.308 3.029
538 HE1 TYR 77 HE1 TYR 77 30.449 18.503 3.903
539 HE2 TYR 77 HE2 TYR 77 26.916 20.144 2.054
540 HH TYR 77 HH TYR 77 30.449 20.404 2.619
541 H ASP 78 H ASP 78 27.979 17.869 7.130
542 HA ASP 78 HA ASP 78 26.377 19.813 8.429
543 HB2 ASP 78 2HB ASP 78 28.568 19.393 9.228
544 HB3 ASP 78 3HB ASP 78 29.286 19.710 7.641
545 H TYR 79 H TYR 79 24.971 21.058 7.416
546 HA TYR 79 HA TYR 79 25.885 22.580 5.037
547 HB2 TYR 79 2HB TYR 79 24.104 21.092 4.478
548 HB3 TYR 79 3HB TYR 79 23.165 21.584 5.884
549 HD1 TYR 79 HD1 TYR 79 21.917 23.667 5.912
550 HD2 TYR 79 HD2 TYR 79 24.243 22.520 2.488
551 HE1 TYR 79 HE1 TYR 79 20.724 25.366 4.544
552 HE2 TYR 79 HE2 TYR 79 23.072 24.227 1.112
553 HH TYR 79 HH TYR 79 21.490 25.880 1.075
554 H ASP 80 H ASP 80 24.615 24.736 4.824
555 HA ASP 80 HA ASP 80 25.440 26.356 6.973
556 HB2 ASP 80 2HB ASP 80 25.335 27.280 4.783
557 HB3 ASP 80 3HB ASP 80 23.620 26.866 4.615
558 H GLY 81 H GLY 81 24.630 25.972 8.973
559 HA2 GLY 81 2HA GLY 81 23.180 26.405 10.710
560 HA3 GLY 81 3HA GLY 81 21.970 26.967 9.539
561 H TYR 82 H TYR 82 22.773 24.017 8.331
562 HA TYR 82 HA TYR 82 21.007 22.463 10.122
563 HB2 TYR 82 2HB TYR 82 20.455 23.008 7.196
564 HB3 TYR 82 3HB TYR 82 19.696 21.706 8.114
565 HD1 TYR 82 HD1 TYR 82 20.000 25.370 7.808
566 HD2 TYR 82 HD2 TYR 82 17.939 22.099 9.676
567 HE1 TYR 82 HE1 TYR 82 18.231 26.940 8.590
568 HE2 TYR 82 HE2 TYR 82 16.178 23.650 10.479
569 HH TYR 82 HH TYR 82 15.433 25.810 10.535
570 H ARG 83 H ARG 83 20.610 20.216 8.620
571 HA ARG 83 HA ARG 83 23.257 19.192 7.798
572 HB2 ARG 83 2HB ARG 83 23.154 19.005 10.277
573 HB3 ARG 83 3HB ARG 83 21.677 18.043 10.130
574 HG2 ARG 83 2HG ARG 83 22.872 16.290 8.930
575 HG3 ARG 83 3HG ARG 83 24.347 17.290 8.868
576 HD2 ARG 83 2HD ARG 83 24.409 17.313 11.359
577 HD3 ARG 83 3HD ARG 83 22.984 16.266 11.389
578 HE ARG 83 HE ARG 83 25.517 15.412 10.039
579 HH11 ARG 83 1HH1 ARG 83 22.973 14.857 12.441
580 HH12 ARG 83 2HH1 ARG 83 23.538 13.250 12.827
581 HH21 ARG 83 1HH2 ARG 83 26.215 13.318 10.559
582 HH22 ARG 83 2HH2 ARG 83 25.370 12.380 11.770
583 H LEU 84 H LEU 84 23.048 17.797 6.171
584 HA LEU 84 HA LEU 84 20.517 17.454 4.906
585 HB2 LEU 84 2HB LEU 84 23.283 16.287 4.537
586 HB3 LEU 84 3HB LEU 84 21.925 15.634 3.619
587 HG LEU 84 HG LEU 84 23.194 17.336 2.366
588 HD11 LEU 84 1HD1 LEU 84 21.273 18.620 1.576
589 HD12 LEU 84 2HD1 LEU 84 20.804 16.933 1.886
590 HD13 LEU 84 3HD1 LEU 84 20.353 18.207 3.037
591 HD21 LEU 84 1HD2 LEU 84 23.803 18.792 4.303
592 HD22 LEU 84 2HD2 LEU 84 23.081 19.683 2.940
593 HD23 LEU 84 3HD2 LEU 84 22.111 19.337 4.385
594 H ARG 85 H ARG 85 19.169 15.677 4.653
595 HA ARG 85 HA ARG 85 19.664 13.390 6.520
596 HB2 ARG 85 2HB ARG 85 16.992 14.534 5.632
597 HB3 ARG 85 3HB ARG 85 17.251 13.173 6.734
598 HG2 ARG 85 2HG ARG 85 18.401 14.720 8.327
599 HG3 ARG 85 3HG ARG 85 18.037 16.077 7.226
600 HD2 ARG 85 2HD ARG 85 15.615 15.475 7.353
601 HD3 ARG 85 3HD ARG 85 16.014 14.214 8.535
602 HE ARG 85 HE ARG 85 17.086 16.454 9.675
603 HH11 ARG 85 1HH1 ARG 85 13.936 15.713 8.280
604 HH12 ARG 85 2HH1 ARG 85 13.056 16.758 9.360
605 HH21 ARG 85 1HH2 ARG 85 15.930 17.886 11.057
606 HH22 ARG 85 2HH2 ARG 85 14.193 18.022 10.920
607 H VAL 86 H VAL 86 19.923 11.498 5.571
608 HA VAL 86 HA VAL 86 18.308 10.828 3.213
609 HB VAL 86 HB VAL 86 21.299 10.282 3.212
610 HG11 VAL 86 1HG1 VAL 86 19.823 8.726 1.949
611 HG12 VAL 86 2HG1 VAL 86 19.156 10.112 1.054
612 HG13 VAL 86 3HG1 VAL 86 20.870 9.672 0.872
613 HG21 VAL 86 1HG2 VAL 86 19.777 12.444 1.703
614 HG22 VAL 86 2HG2 VAL 86 20.998 12.709 2.975
615 HG23 VAL 86 3HG2 VAL 86 21.472 11.985 1.429
616 H GLU 87 H GLU 87 17.137 9.626 4.789
617 HA GLU 87 HA GLU 87 18.378 7.040 5.477
618 HB2 GLU 87 2HB GLU 87 17.727 7.242 7.839
619 HB3 GLU 87 3HB GLU 87 18.919 8.471 7.392
620 HG2 GLU 87 2HG GLU 87 17.109 10.146 7.133
621 HG3 GLU 87 3HG GLU 87 15.901 8.923 7.565
622 H PHE 88 H PHE 88 16.751 5.462 6.245
623 HA PHE 88 HA PHE 88 14.322 5.765 4.735
624 HB2 PHE 88 2HB PHE 88 13.850 3.450 5.809
625 HB3 PHE 88 3HB PHE 88 15.080 3.651 4.559
626 HD1 PHE 88 HD1 PHE 88 17.470 3.508 5.077
627 HD2 PHE 88 HD2 PHE 88 14.488 2.978 8.130
628 HE1 PHE 88 HE1 PHE 88 19.181 2.532 6.585
629 HE2 PHE 88 HE2 PHE 88 16.205 2.017 9.639
630 HZ PHE 88 HZ PHE 88 18.548 1.795 8.869
631 HA PRO 89 HA PRO 89 11.303 7.148 7.550
632 HB2 PRO 89 2HB PRO 89 9.668 4.725 6.865
633 HB3 PRO 89 3HB PRO 89 9.207 6.458 6.801
634 HG2 PRO 89 2HG PRO 89 9.790 5.054 4.534
635 HG3 PRO 89 3HG PRO 89 10.303 6.766 4.728
636 HD2 PRO 89 2HD PRO 89 11.939 4.251 5.044
637 HD3 PRO 89 3HD PRO 89 12.395 5.827 4.323
638 H5' A 90 1H5* A 90 9.670 20.620 14.328
639 H5'' A 90 2H5* A 90 11.410 20.267 14.372
640 H4' A 90 H4* A 90 9.352 18.692 12.758
641 H3' A 90 H3* A 90 9.443 18.571 15.455
642 H2' A 90 1H2* A 90 11.701 18.324 15.893
643 HO2' A 90 2HO* A 90 10.823 16.265 16.478
644 H1' A 90 H1* A 90 12.588 16.694 13.635
645 H8 A 90 H8 A 90 14.022 18.139 16.077
646 H61 A 90 1H6 A 90 17.047 22.512 12.888
647 H62 A 90 2H6 A 90 16.955 21.653 14.410
648 H2 A 90 H2 A 90 13.780 20.933 10.310
649 HO5' A 90 H5T A 90 11.452 20.587 12.113
650 H5' A 91 1H5* A 91 7.274 15.269 11.643
651 H5'' A 91 2H5* A 91 8.989 15.685 11.811
652 H4' A 91 H4* A 91 8.450 15.766 9.474
653 H3' A 91 H3* A 91 9.652 17.882 10.692
654 H2' A 91 1H2* A 91 7.830 19.195 11.242
655 HO2' A 91 2HO* A 91 8.902 20.445 9.645
656 H1' A 91 H1* A 91 6.116 18.689 8.897
657 H8 A 91 H8 A 91 5.772 20.610 11.334
658 H61 A 91 1H6 A 91 1.512 17.473 14.564
659 H62 A 91 2H6 A 91 2.279 19.033 14.337
660 H2 A 91 H2 A 91 3.387 14.666 11.665
661 H5' C 92 1H5* C 92 9.855 15.998 5.433
662 H5'' C 92 2H5* C 92 8.468 16.771 6.220
663 H4' C 92 H4* C 92 7.627 14.895 4.962
664 H3' C 92 H3* C 92 7.201 15.194 7.711
665 H2' C 92 1H2* C 92 8.683 13.482 8.369
666 HO2' C 92 2HO* C 92 6.256 12.146 7.684
667 H1' C 92 H1* C 92 7.853 11.871 5.940
668 H41 C 92 1H4 C 92 12.843 8.352 7.749
669 H42 C 92 2H4 C 92 13.654 9.742 8.446
670 H5 C 92 H5 C 92 12.664 11.972 8.488
671 H6 C 92 H6 C 92 10.711 13.287 7.834
672 H5' A 93 1H5* A 93 2.728 13.940 4.741
673 H5'' A 93 2H5* A 93 3.955 12.656 4.740
674 H4' A 93 H4* A 93 3.417 14.301 2.240
675 H3' A 93 H3* A 93 1.300 13.037 3.385
676 H2' A 93 1H2* A 93 2.460 11.000 3.852
677 HO2' A 93 2HO* A 93 1.230 10.730 1.294
678 H1' A 93 H1* A 93 3.534 10.983 1.027
679 H8 A 93 H8 A 93 4.292 10.293 4.715
680 H61 A 93 1H6 A 93 7.778 5.635 2.504
681 H62 A 93 2H6 A 93 7.184 6.410 3.965
682 H2 A 93 H2 A 93 6.206 7.992 -0.929
683 H5' A 94 1H5* A 94 -1.120 12.250 1.998
684 H5'' A 94 2H5* A 94 -1.799 13.089 0.589
685 H4' A 94 H4* A 94 -2.531 13.835 3.452
686 H3' A 94 H3* A 94 -3.183 11.370 2.591
687 H2' A 94 1H2* A 94 -3.899 11.826 0.415
688 HO2' A 94 2HO* A 94 -5.782 11.035 1.528
689 H1' A 94 H1* A 94 -5.388 14.329 0.881
690 H8 A 94 H8 A 94 -4.664 12.402 -1.646
691 H61 A 94 1H6 A 94 -1.168 16.482 -4.720
692 H62 A 94 2H6 A 94 -2.067 14.987 -4.845
693 H2 A 94 H2 A 94 -1.543 17.891 -0.518
694 H5' A 95 1H5* A 95 -6.536 10.505 4.307
695 H5'' A 95 2H5* A 95 -6.668 11.120 5.961
696 H4' A 95 H4* A 95 -7.530 8.858 5.898
697 H3' A 95 H3* A 95 -5.741 9.682 7.774
698 HO3' A 95 H3T A 95 -6.157 7.619 8.744
699 H2' A 95 1H2* A 95 -3.745 9.022 6.762
700 HO2' A 95 2HO* A 95 -3.843 7.739 8.642
701 H1' A 95 H1* A 95 -4.729 6.461 5.625
702 H8 A 95 H8 A 95 -1.818 7.654 5.888
703 H61 A 95 1H6 A 95 -0.832 9.153 -0.034
704 H62 A 95 2H6 A 95 -0.084 8.825 1.512
705 H2 A 95 H2 A 95 -5.238 8.730 0.577
Start of MODEL 17
1 H VAL 6 H1 VAL 6 -2.196 7.006 -9.629
2 HA VAL 6 HA VAL 6 -3.251 7.110 -7.527
3 HB VAL 6 HB VAL 6 -3.498 4.601 -7.390
4 HG11 VAL 6 1HG1 VAL 6 -1.111 4.001 -7.737
5 HG12 VAL 6 2HG1 VAL 6 -0.691 4.794 -6.203
6 HG13 VAL 6 3HG1 VAL 6 -1.738 3.357 -6.211
7 HG21 VAL 6 1HG2 VAL 6 -2.423 6.013 -4.912
8 HG22 VAL 6 2HG2 VAL 6 -4.080 6.177 -5.551
9 HG23 VAL 6 3HG2 VAL 6 -3.508 4.607 -4.950
10 H ILE 7 H ILE 7 -2.224 8.053 -5.682
11 HA ILE 7 HA ILE 7 0.304 9.236 -6.299
12 HB ILE 7 HB ILE 7 -1.352 9.150 -3.748
13 HG12 ILE 7 2HG1 ILE 7 -1.006 11.321 -5.859
14 HG13 ILE 7 3HG1 ILE 7 -2.371 10.196 -5.801
15 HG21 ILE 7 1HG2 ILE 7 1.011 9.659 -3.219
16 HG22 ILE 7 2HG2 ILE 7 1.016 10.935 -4.456
17 HG23 ILE 7 3HG2 ILE 7 -0.009 11.087 -3.010
18 HD11 ILE 7 1HD1 ILE 7 -1.634 12.232 -3.655
19 HD12 ILE 7 2HD1 ILE 7 -3.021 12.297 -4.756
20 HD13 ILE 7 3HD1 ILE 7 -2.937 11.023 -3.516
21 H ARG 8 H ARG 8 2.359 8.896 -5.417
22 HA ARG 8 HA ARG 8 2.931 6.145 -4.735
23 HB2 ARG 8 2HB ARG 8 4.446 7.388 -6.156
24 HB3 ARG 8 3HB ARG 8 4.640 8.652 -4.928
25 HG2 ARG 8 2HG ARG 8 5.718 7.033 -3.399
26 HG3 ARG 8 3HG ARG 8 5.506 5.739 -4.603
27 HD2 ARG 8 2HD ARG 8 7.097 8.299 -5.001
28 HD3 ARG 8 3HD ARG 8 7.789 6.743 -4.544
29 HE ARG 8 HE ARG 8 7.284 5.859 -6.713
30 HH11 ARG 8 1HH1 ARG 8 6.470 9.291 -6.391
31 HH12 ARG 8 2HH1 ARG 8 6.432 9.554 -8.119
32 HH21 ARG 8 1HH2 ARG 8 7.259 6.251 -8.960
33 HH22 ARG 8 2HH2 ARG 8 6.851 7.834 -9.568
34 H GLY 9 H GLY 9 3.931 5.354 -2.836
35 HA2 GLY 9 2HA GLY 9 5.033 5.704 -0.760
36 HA3 GLY 9 3HA GLY 9 4.156 7.207 -0.538
37 HA PRO 10 HA PRO 10 0.799 4.087 0.771
38 HB2 PRO 10 2HB PRO 10 0.815 1.505 -0.144
39 HB3 PRO 10 3HB PRO 10 0.043 2.853 -1.044
40 HG2 PRO 10 2HG PRO 10 2.776 1.627 -1.475
41 HG3 PRO 10 3HG PRO 10 1.542 2.073 -2.701
42 HD2 PRO 10 2HD PRO 10 3.673 3.685 -2.095
43 HD3 PRO 10 3HD PRO 10 2.068 4.353 -2.540
44 H ALA 11 H ALA 11 0.704 2.408 2.484
45 HA ALA 11 HA ALA 11 3.144 2.289 3.965
46 HB1 ALA 11 1HB ALA 11 0.546 0.738 4.304
47 HB2 ALA 11 2HB ALA 11 1.826 0.908 5.526
48 HB3 ALA 11 3HB ALA 11 0.899 2.332 5.006
49 H GLY 12 H GLY 12 4.353 0.411 4.637
50 HA2 GLY 12 2HA GLY 12 4.067 -2.191 3.632
51 HA3 GLY 12 3HA GLY 12 5.073 -1.305 2.470
52 H ASN 13 H ASN 13 6.426 -3.268 3.458
53 HA ASN 13 HA ASN 13 8.300 -2.072 5.405
54 HB2 ASN 13 2HB ASN 13 6.973 -4.792 5.716
55 HB3 ASN 13 3HB ASN 13 8.353 -4.224 6.671
56 HD21 ASN 13 1HD2 ASN 13 4.621 -3.287 7.834
57 HD22 ASN 13 2HD2 ASN 13 5.001 -4.486 6.618
58 H ASN 14 H ASN 14 10.363 -3.269 5.475
59 HA ASN 14 HA ASN 14 12.209 -4.003 4.378
60 HB2 ASN 14 2HB ASN 14 10.258 -6.065 3.289
61 HB3 ASN 14 3HB ASN 14 12.022 -6.213 3.295
62 HD21 ASN 14 1HD2 ASN 14 10.531 -8.027 6.258
63 HD22 ASN 14 2HD2 ASN 14 10.252 -8.077 4.529
64 H ASP 15 H ASP 15 10.459 -1.979 3.000
65 HA ASP 15 HA ASP 15 10.706 -2.530 0.183
66 HB2 ASP 15 2HB ASP 15 10.038 -0.088 -0.026
67 HB3 ASP 15 3HB ASP 15 8.892 -1.192 0.737
68 H CYS 16 H CYS 16 11.856 -1.228 -1.385
69 HA CYS 16 HA CYS 16 14.620 -0.771 -0.539
70 HB2 CYS 16 2HB CYS 16 13.227 -0.692 -3.249
71 HB3 CYS 16 3HB CYS 16 14.967 -0.452 -3.001
72 HG CYS 16 HG CYS 16 13.072 -3.043 -2.241
73 H ARG 17 H ARG 17 11.864 1.084 -0.457
74 HA ARG 17 HA ARG 17 12.756 3.534 -1.645
75 HB2 ARG 17 2HB ARG 17 10.674 3.001 0.514
76 HB3 ARG 17 3HB ARG 17 10.875 4.526 -0.378
77 HG2 ARG 17 2HG ARG 17 10.424 3.334 -2.501
78 HG3 ARG 17 3HG ARG 17 10.173 1.821 -1.603
79 HD2 ARG 17 2HD ARG 17 8.564 4.382 -1.226
80 HD3 ARG 17 3HD ARG 17 8.041 2.976 -2.167
81 HE ARG 17 HE ARG 17 8.770 2.274 0.559
82 HH11 ARG 17 1HH1 ARG 17 6.173 3.558 -1.468
83 HH12 ARG 17 2HH1 ARG 17 4.914 3.056 -0.354
84 HH21 ARG 17 1HH2 ARG 17 7.122 1.623 1.948
85 HH22 ARG 17 2HH2 ARG 17 5.444 1.986 1.584
86 H ILE 18 H ILE 18 13.657 5.363 -0.735
87 HA ILE 18 HA ILE 18 14.338 5.263 2.164
88 HB ILE 18 HB ILE 18 16.513 6.195 1.781
89 HG12 ILE 18 2HG1 ILE 18 15.995 6.029 -1.212
90 HG13 ILE 18 3HG1 ILE 18 15.864 7.522 -0.265
91 HG21 ILE 18 1HG2 ILE 18 16.139 3.833 -0.099
92 HG22 ILE 18 2HG2 ILE 18 17.632 4.307 0.744
93 HG23 ILE 18 3HG2 ILE 18 16.241 3.727 1.678
94 HD11 ILE 18 1HD1 ILE 18 18.071 7.398 -1.304
95 HD12 ILE 18 2HD1 ILE 18 18.224 7.274 0.465
96 HD13 ILE 18 3HD1 ILE 18 18.374 5.821 -0.550
97 H TYR 19 H TYR 19 15.059 7.508 2.904
98 HA TYR 19 HA TYR 19 13.173 9.472 1.738
99 HB2 TYR 19 2HB TYR 19 12.090 9.051 3.653
100 HB3 TYR 19 3HB TYR 19 13.539 8.574 4.523
101 HD1 TYR 19 HD1 TYR 19 11.305 11.366 3.724
102 HD2 TYR 19 HD2 TYR 19 15.075 10.262 5.469
103 HE1 TYR 19 HE1 TYR 19 11.378 13.536 4.944
104 HE2 TYR 19 HE2 TYR 19 15.154 12.428 6.686
105 HH TYR 19 HH TYR 19 12.580 14.890 6.355
106 H VAL 20 H VAL 20 13.571 11.669 1.827
107 HA VAL 20 HA VAL 20 16.366 12.480 2.376
108 HB VAL 20 HB VAL 20 14.839 13.043 -0.190
109 HG11 VAL 20 1HG1 VAL 20 16.982 14.110 -0.906
110 HG12 VAL 20 2HG1 VAL 20 16.232 14.954 0.467
111 HG13 VAL 20 3HG1 VAL 20 17.622 13.873 0.737
112 HG21 VAL 20 1HG2 VAL 20 15.721 10.754 -0.170
113 HG22 VAL 20 2HG2 VAL 20 16.675 11.760 -1.276
114 HG23 VAL 20 3HG2 VAL 20 17.320 11.353 0.329
115 H GLY 21 H GLY 21 16.549 14.658 3.070
116 HA2 GLY 21 2HA GLY 21 14.171 16.368 3.036
117 HA3 GLY 21 3HA GLY 21 14.622 15.741 4.632
118 H ASN 22 H ASN 22 14.668 18.272 4.708
119 HA ASN 22 HA ASN 22 15.818 20.197 4.956
120 HB2 ASN 22 2HB ASN 22 17.181 18.582 6.400
121 HB3 ASN 22 3HB ASN 22 18.324 18.500 5.056
122 HD21 ASN 22 1HD2 ASN 22 19.969 21.428 6.073
123 HD22 ASN 22 2HD2 ASN 22 20.031 19.848 5.316
124 H LEU 23 H LEU 23 15.474 19.059 2.154
125 HA LEU 23 HA LEU 23 17.797 19.721 0.632
126 HB2 LEU 23 2HB LEU 23 14.845 19.622 -0.101
127 HB3 LEU 23 3HB LEU 23 16.157 19.802 -1.281
128 HG LEU 23 HG LEU 23 15.926 17.466 0.665
129 HD11 LEU 23 1HD1 LEU 23 15.137 16.166 -1.256
130 HD12 LEU 23 2HD1 LEU 23 14.035 17.523 -0.944
131 HD13 LEU 23 3HD1 LEU 23 15.198 17.619 -2.287
132 HD21 LEU 23 1HD2 LEU 23 17.558 16.420 -0.913
133 HD22 LEU 23 2HD2 LEU 23 17.648 17.954 -1.809
134 HD23 LEU 23 3HD2 LEU 23 18.228 17.864 -0.131
135 HA PRO 24 HA PRO 24 17.671 24.107 0.780
136 HB2 PRO 24 2HB PRO 24 19.011 24.762 -1.530
137 HB3 PRO 24 3HB PRO 24 19.817 24.045 -0.098
138 HG2 PRO 24 2HG PRO 24 18.858 22.650 -2.612
139 HG3 PRO 24 3HG PRO 24 20.415 22.439 -1.738
140 HD2 PRO 24 2HD PRO 24 18.288 20.739 -1.426
141 HD3 PRO 24 3HD PRO 24 19.428 21.119 -0.094
142 HA PRO 25 HA PRO 25 14.205 25.515 -1.613
143 HB2 PRO 25 2HB PRO 25 15.621 28.124 -1.955
144 HB3 PRO 25 3HB PRO 25 14.015 27.796 -1.238
145 HG2 PRO 25 2HG PRO 25 16.193 28.424 0.305
146 HG3 PRO 25 3HG PRO 25 14.957 27.241 0.851
147 HD2 PRO 25 2HD PRO 25 17.680 26.717 -0.323
148 HD3 PRO 25 3HD PRO 25 16.828 25.869 1.000
149 H ASP 26 H ASP 26 17.487 25.736 -2.811
150 HA ASP 26 HA ASP 26 16.694 26.413 -5.540
151 HB2 ASP 26 2HB ASP 26 19.358 25.759 -4.265
152 HB3 ASP 26 3HB ASP 26 19.153 26.108 -5.987
153 H ILE 27 H ILE 27 16.157 23.657 -3.955
154 HA ILE 27 HA ILE 27 17.432 21.645 -5.485
155 HB ILE 27 HB ILE 27 16.316 21.293 -3.308
156 HG12 ILE 27 2HG1 ILE 27 15.147 19.177 -3.820
157 HG13 ILE 27 3HG1 ILE 27 15.073 19.609 -5.535
158 HG21 ILE 27 1HG2 ILE 27 13.871 21.139 -3.164
159 HG22 ILE 27 2HG2 ILE 27 14.335 22.761 -3.718
160 HG23 ILE 27 3HG2 ILE 27 13.713 21.571 -4.878
161 HD11 ILE 27 1HD1 ILE 27 17.641 19.253 -3.920
162 HD12 ILE 27 2HD1 ILE 27 16.938 18.039 -5.007
163 HD13 ILE 27 3HD1 ILE 27 17.539 19.575 -5.667
164 H ARG 28 H ARG 28 16.608 20.287 -7.179
165 HA ARG 28 HA ARG 28 14.277 21.270 -8.694
166 HB2 ARG 28 2HB ARG 28 16.229 22.505 -9.589
167 HB3 ARG 28 3HB ARG 28 17.071 20.969 -9.874
168 HG2 ARG 28 2HG ARG 28 15.339 20.294 -11.487
169 HG3 ARG 28 3HG ARG 28 14.419 21.779 -11.135
170 HD2 ARG 28 2HD ARG 28 16.341 23.135 -11.961
171 HD3 ARG 28 3HD ARG 28 17.242 21.649 -12.289
172 HE ARG 28 HE ARG 28 15.907 21.245 -14.176
173 HH11 ARG 28 1HH1 ARG 28 14.655 23.998 -12.329
174 HH12 ARG 28 2HH1 ARG 28 13.580 24.512 -13.604
175 HH21 ARG 28 1HH2 ARG 28 14.514 21.963 -15.838
176 HH22 ARG 28 2HH2 ARG 28 13.504 23.368 -15.588
177 H THR 29 H THR 29 13.399 19.663 -10.106
178 HA THR 29 HA THR 29 13.558 17.059 -9.025
179 HB THR 29 HB THR 29 11.870 16.462 -10.489
180 HG1 THR 29 1HG THR 29 11.617 17.463 -12.501
181 HG21 THR 29 1HG2 THR 29 11.667 19.508 -10.467
182 HG22 THR 29 2HG2 THR 29 10.331 18.349 -10.626
183 HG23 THR 29 3HG2 THR 29 11.226 18.457 -9.097
184 H LYS 30 H LYS 30 15.580 18.525 -11.406
185 HA LYS 30 HA LYS 30 16.369 15.936 -12.570
186 HB2 LYS 30 2HB LYS 30 16.089 18.039 -13.932
187 HB3 LYS 30 3HB LYS 30 17.450 18.737 -13.033
188 HG2 LYS 30 2HG LYS 30 18.377 16.215 -13.942
189 HG3 LYS 30 3HG LYS 30 17.456 16.881 -15.299
190 HD2 LYS 30 2HD LYS 30 19.798 17.563 -15.445
191 HD3 LYS 30 3HD LYS 30 18.777 18.984 -15.153
192 HE2 LYS 30 2HE LYS 30 19.338 18.916 -12.751
193 HE3 LYS 30 3HE LYS 30 20.277 17.438 -12.991
194 HZ1 LYS 30 1HZ LYS 30 21.651 19.397 -12.921
195 HZ2 LYS 30 2HZ LYS 30 21.767 18.668 -14.389
196 HZ3 LYS 30 3HZ LYS 30 20.879 20.046 -14.219
197 H ASP 31 H ASP 31 17.522 18.311 -10.180
198 HA ASP 31 HA ASP 31 20.209 17.289 -10.109
199 HB2 ASP 31 2HB ASP 31 18.591 18.916 -8.128
200 HB3 ASP 31 3HB ASP 31 20.309 18.542 -7.936
201 H ILE 32 H ILE 32 17.194 16.477 -8.420
202 HA ILE 32 HA ILE 32 18.518 14.836 -6.437
203 HB ILE 32 HB ILE 32 16.430 15.990 -5.947
204 HG12 ILE 32 2HG1 ILE 32 15.823 13.010 -6.025
205 HG13 ILE 32 3HG1 ILE 32 17.042 13.703 -4.938
206 HG21 ILE 32 1HG2 ILE 32 15.424 15.930 -8.199
207 HG22 ILE 32 2HG2 ILE 32 15.200 14.169 -8.066
208 HG23 ILE 32 3HG2 ILE 32 14.300 15.273 -7.000
209 HD11 ILE 32 1HD1 ILE 32 14.087 14.455 -5.019
210 HD12 ILE 32 2HD1 ILE 32 14.906 13.495 -3.776
211 HD13 ILE 32 3HD1 ILE 32 15.326 15.212 -3.980
212 H GLU 33 H GLU 33 17.684 14.294 -9.775
213 HA GLU 33 HA GLU 33 17.669 11.361 -9.246
214 HB2 GLU 33 2HB GLU 33 16.759 11.099 -11.468
215 HB3 GLU 33 3HB GLU 33 15.766 12.238 -10.535
216 HG2 GLU 33 2HG GLU 33 16.862 14.131 -11.650
217 HG3 GLU 33 3HG GLU 33 17.886 13.008 -12.579
218 H ASP 34 H ASP 34 19.606 13.981 -10.564
219 HA ASP 34 HA ASP 34 21.300 12.229 -12.123
220 HB2 ASP 34 2HB ASP 34 21.523 15.100 -11.236
221 HB3 ASP 34 3HB ASP 34 22.853 14.267 -12.056
222 H VAL 35 H VAL 35 21.716 13.780 -8.887
223 HA VAL 35 HA VAL 35 24.290 12.515 -8.560
224 HB VAL 35 HB VAL 35 24.337 13.478 -6.392
225 HG11 VAL 35 1HG1 VAL 35 22.747 15.352 -8.198
226 HG12 VAL 35 2HG1 VAL 35 23.804 15.826 -6.851
227 HG13 VAL 35 3HG1 VAL 35 24.498 15.063 -8.302
228 HG21 VAL 35 1HG2 VAL 35 22.155 12.785 -5.542
229 HG22 VAL 35 2HG2 VAL 35 22.355 14.532 -5.342
230 HG23 VAL 35 3HG2 VAL 35 21.335 13.912 -6.661
231 H PHE 36 H PHE 36 20.949 11.626 -7.752
232 HA PHE 36 HA PHE 36 21.827 9.438 -6.087
233 HB2 PHE 36 2HB PHE 36 19.162 10.351 -7.074
234 HB3 PHE 36 3HB PHE 36 19.355 8.741 -6.383
235 HD1 PHE 36 HD1 PHE 36 19.698 12.371 -5.637
236 HD2 PHE 36 HD2 PHE 36 19.665 8.371 -4.055
237 HE1 PHE 36 HE1 PHE 36 19.581 13.284 -3.335
238 HE2 PHE 36 HE2 PHE 36 19.537 9.294 -1.749
239 HZ PHE 36 HZ PHE 36 19.480 11.747 -1.396
240 H SER 37 H SER 37 20.731 9.637 -9.509
241 HA SER 37 HA SER 37 20.810 6.786 -9.855
242 HB2 SER 37 2HB SER 37 20.707 7.256 -12.225
243 HB3 SER 37 3HB SER 37 19.600 8.344 -11.373
244 HG SER 37 HG SER 37 20.982 10.000 -11.677
245 H LYS 38 H LYS 38 23.293 9.281 -9.747
246 HA LYS 38 HA LYS 38 25.362 7.664 -10.963
247 HB2 LYS 38 2HB LYS 38 25.535 10.100 -10.872
248 HB3 LYS 38 3HB LYS 38 25.413 10.070 -9.103
249 HG2 LYS 38 2HG LYS 38 27.738 10.390 -9.792
250 HG3 LYS 38 3HG LYS 38 27.561 8.831 -8.972
251 HD2 LYS 38 2HD LYS 38 27.475 7.667 -11.141
252 HD3 LYS 38 3HD LYS 38 27.603 9.216 -12.000
253 HE2 LYS 38 2HE LYS 38 29.672 8.095 -10.062
254 HE3 LYS 38 3HE LYS 38 29.784 8.003 -11.827
255 HZ1 LYS 38 1HZ LYS 38 31.028 9.849 -10.969
256 HZ2 LYS 38 2HZ LYS 38 29.775 10.407 -11.880
257 HZ3 LYS 38 3HZ LYS 38 29.699 10.482 -10.238
258 H TYR 39 H TYR 39 24.102 8.187 -7.657
259 HA TYR 39 HA TYR 39 26.122 6.448 -6.524
260 HB2 TYR 39 2HB TYR 39 23.949 8.147 -5.447
261 HB3 TYR 39 3HB TYR 39 24.508 6.787 -4.460
262 HD1 TYR 39 HD1 TYR 39 25.989 9.598 -6.506
263 HD2 TYR 39 HD2 TYR 39 26.221 7.119 -2.998
264 HE1 TYR 39 HE1 TYR 39 27.938 10.916 -5.705
265 HE2 TYR 39 HE2 TYR 39 28.163 8.424 -2.189
266 HH TYR 39 HH TYR 39 29.588 10.178 -2.608
267 H GLY 40 H GLY 40 23.155 5.671 -8.066
268 HA2 GLY 40 2HA GLY 40 23.478 2.918 -7.420
269 HA3 GLY 40 3HA GLY 40 22.241 3.597 -6.357
270 H ALA 41 H ALA 41 21.265 1.699 -7.735
271 HA ALA 41 HA ALA 41 20.394 2.413 -10.419
272 HB1 ALA 41 1HB ALA 41 20.999 0.103 -9.809
273 HB2 ALA 41 2HB ALA 41 19.688 0.071 -8.608
274 HB3 ALA 41 3HB ALA 41 19.304 0.206 -10.340
275 H ILE 42 H ILE 42 19.445 4.480 -8.948
276 HA ILE 42 HA ILE 42 16.824 4.029 -7.851
277 HB ILE 42 HB ILE 42 18.308 6.499 -8.821
278 HG12 ILE 42 2HG1 ILE 42 18.103 7.081 -6.378
279 HG13 ILE 42 3HG1 ILE 42 17.436 5.467 -6.084
280 HG21 ILE 42 1HG2 ILE 42 16.453 7.820 -7.818
281 HG22 ILE 42 2HG2 ILE 42 15.936 6.915 -9.247
282 HG23 ILE 42 3HG2 ILE 42 15.512 6.324 -7.621
283 HD11 ILE 42 1HD1 ILE 42 19.968 5.812 -5.698
284 HD12 ILE 42 2HD1 ILE 42 19.487 4.407 -6.681
285 HD13 ILE 42 3HD1 ILE 42 20.102 5.884 -7.466
286 H ARG 43 H ARG 43 14.792 4.286 -8.764
287 HA ARG 43 HA ARG 43 14.732 4.653 -11.728
288 HB2 ARG 43 2HB ARG 43 13.023 2.776 -10.044
289 HB3 ARG 43 3HB ARG 43 12.890 3.013 -11.796
290 HG2 ARG 43 2HG ARG 43 15.346 1.932 -10.338
291 HG3 ARG 43 3HG ARG 43 14.161 0.962 -11.231
292 HD2 ARG 43 2HD ARG 43 14.721 2.124 -13.311
293 HD3 ARG 43 3HD ARG 43 15.851 3.182 -12.458
294 HE ARG 43 HE ARG 43 16.209 0.215 -12.659
295 HH11 ARG 43 1HH1 ARG 43 17.556 3.491 -12.611
296 HH12 ARG 43 2HH1 ARG 43 19.179 2.942 -12.949
297 HH21 ARG 43 1HH2 ARG 43 18.308 -0.463 -13.009
298 HH22 ARG 43 2HH2 ARG 43 19.618 0.695 -13.150
299 H ASP 44 H ASP 44 13.095 5.159 -8.588
300 HA ASP 44 HA ASP 44 11.385 7.145 -9.995
301 HB2 ASP 44 2HB ASP 44 10.593 5.152 -7.890
302 HB3 ASP 44 3HB ASP 44 9.696 6.658 -8.118
303 H ILE 45 H ILE 45 10.742 9.007 -8.970
304 HA ILE 45 HA ILE 45 12.122 9.738 -6.453
305 HB ILE 45 HB ILE 45 12.299 11.154 -9.138
306 HG12 ILE 45 2HG1 ILE 45 14.674 11.514 -7.899
307 HG13 ILE 45 3HG1 ILE 45 14.186 10.010 -7.100
308 HG21 ILE 45 1HG2 ILE 45 13.174 13.136 -7.917
309 HG22 ILE 45 2HG2 ILE 45 11.463 12.847 -7.574
310 HG23 ILE 45 3HG2 ILE 45 12.705 12.383 -6.377
311 HD11 ILE 45 1HD1 ILE 45 13.888 8.940 -9.329
312 HD12 ILE 45 2HD1 ILE 45 14.323 10.467 -10.122
313 HD13 ILE 45 3HD1 ILE 45 15.531 9.593 -9.154
314 H ASP 46 H ASP 46 11.032 11.334 -5.243
315 HA ASP 46 HA ASP 46 8.476 12.348 -6.305
316 HB2 ASP 46 2HB ASP 46 8.027 10.115 -5.247
317 HB3 ASP 46 3HB ASP 46 8.664 10.742 -3.724
318 H LEU 47 H LEU 47 10.393 14.046 -6.152
319 HA LEU 47 HA LEU 47 10.876 15.281 -3.622
320 HB2 LEU 47 2HB LEU 47 12.279 15.769 -5.534
321 HB3 LEU 47 3HB LEU 47 10.885 16.314 -6.485
322 HG LEU 47 HG LEU 47 10.545 18.204 -4.908
323 HD11 LEU 47 1HD1 LEU 47 13.159 17.194 -3.708
324 HD12 LEU 47 2HD1 LEU 47 12.402 18.761 -3.334
325 HD13 LEU 47 3HD1 LEU 47 11.582 17.257 -2.879
326 HD21 LEU 47 1HD2 LEU 47 11.892 18.468 -6.965
327 HD22 LEU 47 2HD2 LEU 47 12.504 19.495 -5.648
328 HD23 LEU 47 3HD2 LEU 47 13.355 17.995 -6.067
329 H LYS 48 H LYS 48 9.609 16.521 -2.333
330 HA LYS 48 HA LYS 48 7.086 17.601 -3.467
331 HB2 LYS 48 2HB LYS 48 7.712 16.496 -0.700
332 HB3 LYS 48 3HB LYS 48 6.195 17.294 -1.167
333 HG2 LYS 48 2HG LYS 48 5.817 15.546 -2.897
334 HG3 LYS 48 3HG LYS 48 7.334 14.751 -2.416
335 HD2 LYS 48 2HD LYS 48 6.402 14.532 -0.082
336 HD3 LYS 48 3HD LYS 48 4.844 15.120 -0.702
337 HE2 LYS 48 2HE LYS 48 6.353 12.649 -1.670
338 HE3 LYS 48 3HE LYS 48 4.945 12.630 -0.599
339 HZ1 LYS 48 1HZ LYS 48 4.970 13.666 -3.350
340 HZ2 LYS 48 2HZ LYS 48 4.357 12.217 -2.879
341 HZ3 LYS 48 3HZ LYS 48 3.654 13.612 -2.349
342 H ASN 49 H ASN 49 6.460 19.661 -2.763
343 HA ASN 49 HA ASN 49 8.710 21.280 -1.663
344 HB2 ASN 49 2HB ASN 49 6.454 22.067 -3.541
345 HB3 ASN 49 3HB ASN 49 7.719 23.149 -2.947
346 HD21 ASN 49 1HD2 ASN 49 8.569 21.744 -6.385
347 HD22 ASN 49 2HD2 ASN 49 7.135 22.504 -5.730
348 H ARG 50 H ARG 50 7.929 23.380 -0.661
349 HA ARG 50 HA ARG 50 7.002 24.376 1.137
350 HB2 ARG 50 2HB ARG 50 5.214 24.654 -0.533
351 HB3 ARG 50 3HB ARG 50 4.422 23.183 0.058
352 HG2 ARG 50 2HG ARG 50 4.163 24.208 2.298
353 HG3 ARG 50 3HG ARG 50 5.012 25.664 1.733
354 HD2 ARG 50 2HD ARG 50 2.409 24.578 0.587
355 HD3 ARG 50 3HD ARG 50 2.536 25.930 1.715
356 HE ARG 50 HE ARG 50 3.865 27.123 -0.035
357 HH11 ARG 50 1HH1 ARG 50 1.687 24.501 -0.985
358 HH12 ARG 50 2HH1 ARG 50 1.495 25.094 -2.617
359 HH21 ARG 50 1HH2 ARG 50 3.591 27.878 -2.167
360 HH22 ARG 50 2HH2 ARG 50 2.564 27.010 -3.283
361 H ARG 51 H ARG 51 4.477 21.947 1.504
362 HA ARG 51 HA ARG 51 3.964 20.601 3.238
363 HB2 ARG 51 2HB ARG 51 6.006 19.457 2.123
364 HB3 ARG 51 3HB ARG 51 6.923 20.014 3.530
365 HG2 ARG 51 2HG ARG 51 6.207 17.753 3.953
366 HG3 ARG 51 3HG ARG 51 5.232 18.801 4.998
367 HD2 ARG 51 2HD ARG 51 3.407 18.738 3.284
368 HD3 ARG 51 3HD ARG 51 4.383 17.609 2.324
369 HE ARG 51 HE ARG 51 4.308 16.240 4.587
370 HH11 ARG 51 1HH1 ARG 51 1.705 18.074 3.045
371 HH12 ARG 51 2HH1 ARG 51 0.440 17.100 3.763
372 HH21 ARG 51 1HH2 ARG 51 2.625 14.971 5.484
373 HH22 ARG 51 2HH2 ARG 51 0.954 15.344 5.125
374 H GLY 52 H GLY 52 4.902 23.491 3.798
375 HA2 GLY 52 2HA GLY 52 4.644 24.765 5.700
376 HA3 GLY 52 3HA GLY 52 4.514 23.286 6.669
377 H GLY 53 H GLY 53 7.329 23.336 4.651
378 HA2 GLY 53 2HA GLY 53 9.081 24.834 6.388
379 HA3 GLY 53 3HA GLY 53 9.163 23.097 6.723
380 HA PRO 54 HA PRO 54 12.186 23.748 3.294
381 HB2 PRO 54 2HB PRO 54 13.384 21.394 4.701
382 HB3 PRO 54 3HB PRO 54 14.191 22.878 4.107
383 HG2 PRO 54 2HG PRO 54 13.719 22.460 6.777
384 HG3 PRO 54 3HG PRO 54 13.606 24.089 6.038
385 HD2 PRO 54 2HD PRO 54 11.384 22.179 6.757
386 HD3 PRO 54 3HD PRO 54 11.449 23.963 6.932
387 HA PRO 55 HA PRO 55 10.218 20.501 0.985
388 HB2 PRO 55 2HB PRO 55 12.058 20.165 -1.058
389 HB3 PRO 55 3HB PRO 55 10.880 21.507 -0.969
390 HG2 PRO 55 2HG PRO 55 13.801 21.506 -0.198
391 HG3 PRO 55 3HG PRO 55 12.858 22.779 -1.045
392 HD2 PRO 55 2HD PRO 55 13.453 22.878 1.637
393 HD3 PRO 55 3HD PRO 55 11.938 23.558 0.970
394 H PHE 56 H PHE 56 10.481 18.227 0.396
395 HA PHE 56 HA PHE 56 12.906 16.831 1.337
396 HB2 PHE 56 2HB PHE 56 11.905 15.704 3.094
397 HB3 PHE 56 3HB PHE 56 11.071 17.246 3.248
398 HD1 PHE 56 HD1 PHE 56 8.764 17.425 1.935
399 HD2 PHE 56 HD2 PHE 56 10.698 13.737 2.998
400 HE1 PHE 56 HE1 PHE 56 6.591 16.236 1.775
401 HE2 PHE 56 HE2 PHE 56 8.506 12.569 2.941
402 HZ PHE 56 HZ PHE 56 6.473 13.802 2.249
403 H ALA 57 H ALA 57 12.487 14.367 0.787
404 HA ALA 57 HA ALA 57 10.641 14.069 -1.487
405 HB1 ALA 57 1HB ALA 57 13.665 13.965 -1.825
406 HB2 ALA 57 2HB ALA 57 12.454 13.630 -3.083
407 HB3 ALA 57 3HB ALA 57 12.607 15.268 -2.414
408 H PHE 58 H PHE 58 10.736 11.939 -2.468
409 HA PHE 58 HA PHE 58 12.044 9.876 -0.801
410 HB2 PHE 58 2HB PHE 58 9.249 10.052 -1.731
411 HB3 PHE 58 3HB PHE 58 10.033 8.487 -1.959
412 HD1 PHE 58 HD1 PHE 58 9.488 11.112 0.688
413 HD2 PHE 58 HD2 PHE 58 10.118 6.967 -0.252
414 HE1 PHE 58 HE1 PHE 58 9.179 10.521 3.078
415 HE2 PHE 58 HE2 PHE 58 9.843 6.380 2.140
416 HZ PHE 58 HZ PHE 58 9.363 8.149 3.804
417 H VAL 59 H VAL 59 12.752 7.959 -1.808
418 HA VAL 59 HA VAL 59 13.187 8.135 -4.733
419 HB VAL 59 HB VAL 59 15.348 7.868 -2.604
420 HG11 VAL 59 1HG1 VAL 59 15.792 6.324 -4.445
421 HG12 VAL 59 2HG1 VAL 59 15.491 7.625 -5.630
422 HG13 VAL 59 3HG1 VAL 59 16.899 7.709 -4.540
423 HG21 VAL 59 1HG2 VAL 59 14.694 10.201 -3.024
424 HG22 VAL 59 2HG2 VAL 59 16.292 9.885 -3.721
425 HG23 VAL 59 3HG2 VAL 59 14.860 9.954 -4.777
426 H GLU 60 H GLU 60 13.404 6.097 -5.699
427 HA GLU 60 HA GLU 60 13.158 3.761 -3.879
428 HB2 GLU 60 2HB GLU 60 10.937 4.143 -4.537
429 HB3 GLU 60 3HB GLU 60 11.408 4.602 -6.175
430 HG2 GLU 60 2HG GLU 60 10.343 2.425 -6.230
431 HG3 GLU 60 3HG GLU 60 12.038 2.268 -6.687
432 H PHE 61 H PHE 61 14.523 2.235 -4.252
433 HA PHE 61 HA PHE 61 16.253 2.336 -6.627
434 HB2 PHE 61 2HB PHE 61 16.412 0.850 -3.996
435 HB3 PHE 61 3HB PHE 61 17.516 0.569 -5.338
436 HD1 PHE 61 HD1 PHE 61 19.562 1.615 -5.222
437 HD2 PHE 61 HD2 PHE 61 16.145 3.547 -3.455
438 HE1 PHE 61 HE1 PHE 61 21.012 3.453 -4.420
439 HE2 PHE 61 HE2 PHE 61 17.589 5.402 -2.694
440 HZ PHE 61 HZ PHE 61 20.022 5.355 -3.155
441 H GLU 62 H GLU 62 16.688 0.603 -8.045
442 HA GLU 62 HA GLU 62 14.634 -1.485 -8.232
443 HB2 GLU 62 2HB GLU 62 15.582 -0.499 -10.265
444 HB3 GLU 62 3HB GLU 62 17.221 -0.980 -9.761
445 HG2 GLU 62 2HG GLU 62 16.577 -3.358 -9.866
446 HG3 GLU 62 3HG GLU 62 14.917 -2.901 -10.281
447 H ASP 63 H ASP 63 17.772 -0.976 -6.796
448 HA ASP 63 HA ASP 63 17.776 -3.679 -5.669
449 HB2 ASP 63 2HB ASP 63 18.904 -4.059 -7.770
450 HB3 ASP 63 3HB ASP 63 19.932 -2.641 -7.535
451 HA PRO 64 HA PRO 64 19.039 -0.728 -2.575
452 HB2 PRO 64 2HB PRO 64 18.818 -2.345 -0.362
453 HB3 PRO 64 3HB PRO 64 17.400 -1.700 -1.248
454 HG2 PRO 64 2HG PRO 64 18.690 -4.429 -1.480
455 HG3 PRO 64 3HG PRO 64 16.944 -4.025 -1.377
456 HD2 PRO 64 2HD PRO 64 18.230 -4.543 -3.754
457 HD3 PRO 64 3HD PRO 64 16.857 -3.410 -3.633
458 H ARG 65 H ARG 65 20.886 -3.284 -3.742
459 HA ARG 65 HA ARG 65 22.808 -3.604 -1.642
460 HB2 ARG 65 2HB ARG 65 22.851 -4.214 -4.613
461 HB3 ARG 65 3HB ARG 65 24.180 -4.633 -3.512
462 HG2 ARG 65 2HG ARG 65 22.740 -6.024 -2.155
463 HG3 ARG 65 3HG ARG 65 21.296 -5.493 -3.037
464 HD2 ARG 65 2HD ARG 65 22.200 -6.504 -5.117
465 HD3 ARG 65 3HD ARG 65 23.633 -7.045 -4.219
466 HE ARG 65 HE ARG 65 22.422 -8.800 -3.342
467 HH11 ARG 65 1HH1 ARG 65 20.178 -6.388 -4.623
468 HH12 ARG 65 2HH1 ARG 65 18.778 -7.419 -4.444
469 HH21 ARG 65 1HH2 ARG 65 20.574 -10.124 -3.099
470 HH22 ARG 65 2HH2 ARG 65 19.000 -9.523 -3.562
471 H ASP 66 H ASP 66 22.240 -0.842 -3.446
472 HA ASP 66 HA ASP 66 24.956 0.083 -2.721
473 HB2 ASP 66 2HB ASP 66 24.991 1.514 -4.768
474 HB3 ASP 66 3HB ASP 66 25.163 -0.222 -5.047
475 H ALA 67 H ALA 67 21.763 0.347 -2.068
476 HA ALA 67 HA ALA 67 21.385 3.192 -2.044
477 HB1 ALA 67 1HB ALA 67 20.095 0.988 -0.373
478 HB2 ALA 67 2HB ALA 67 19.473 2.642 -0.567
479 HB3 ALA 67 3HB ALA 67 19.529 1.542 -1.964
480 H GLU 68 H GLU 68 23.148 0.966 0.012
481 HA GLU 68 HA GLU 68 23.135 2.589 2.393
482 HB2 GLU 68 2HB GLU 68 25.101 0.481 1.410
483 HB3 GLU 68 3HB GLU 68 25.032 1.151 3.055
484 HG2 GLU 68 2HG GLU 68 22.668 0.334 3.248
485 HG3 GLU 68 3HG GLU 68 22.814 -0.405 1.647
486 H ASP 69 H ASP 69 25.007 2.585 -0.618
487 HA ASP 69 HA ASP 69 27.062 4.367 0.428
488 HB2 ASP 69 2HB ASP 69 26.351 3.430 -2.372
489 HB3 ASP 69 3HB ASP 69 27.713 4.488 -1.995
490 H ALA 70 H ALA 70 24.049 4.659 -1.425
491 HA ALA 70 HA ALA 70 24.343 7.461 -2.022
492 HB1 ALA 70 1HB ALA 70 22.823 5.922 -3.251
493 HB2 ALA 70 2HB ALA 70 21.864 5.705 -1.766
494 HB3 ALA 70 3HB ALA 70 21.930 7.296 -2.561
495 H VAL 71 H VAL 71 23.363 5.621 0.804
496 HA VAL 71 HA VAL 71 22.065 7.916 2.098
497 HB VAL 71 HB VAL 71 22.664 5.027 2.800
498 HG11 VAL 71 1HG1 VAL 71 21.612 7.158 4.714
499 HG12 VAL 71 2HG1 VAL 71 21.587 5.402 5.007
500 HG13 VAL 71 3HG1 VAL 71 23.137 6.252 4.879
501 HG21 VAL 71 1HG2 VAL 71 20.110 6.693 2.766
502 HG22 VAL 71 2HG2 VAL 71 20.649 5.631 1.448
503 HG23 VAL 71 3HG2 VAL 71 20.217 4.933 3.025
504 H SER 72 H SER 72 24.963 5.813 2.734
505 HA SER 72 HA SER 72 25.844 7.506 4.878
506 HB2 SER 72 2HB SER 72 26.285 5.081 4.771
507 HB3 SER 72 3HB SER 72 27.266 5.319 3.310
508 HG SER 72 HG SER 72 28.515 5.218 5.244
509 H GLY 73 H GLY 73 26.213 7.721 1.438
510 HA2 GLY 73 2HA GLY 73 28.756 9.194 1.600
511 HA3 GLY 73 3HA GLY 73 27.900 8.683 0.138
512 H ARG 74 H ARG 74 25.637 10.128 2.258
513 HA ARG 74 HA ARG 74 26.138 12.848 1.226
514 HB2 ARG 74 2HB ARG 74 25.035 11.619 -0.622
515 HB3 ARG 74 3HB ARG 74 23.675 11.241 0.446
516 HG2 ARG 74 2HG ARG 74 23.118 13.607 0.668
517 HG3 ARG 74 3HG ARG 74 24.574 14.070 -0.239
518 HD2 ARG 74 2HD ARG 74 22.284 12.377 -1.325
519 HD3 ARG 74 3HD ARG 74 22.495 14.111 -1.623
520 HE ARG 74 HE ARG 74 24.665 13.537 -2.729
521 HH11 ARG 74 1HH1 ARG 74 22.138 11.079 -2.457
522 HH12 ARG 74 2HH1 ARG 74 22.729 10.154 -3.818
523 HH21 ARG 74 1HH2 ARG 74 25.418 12.310 -4.487
524 HH22 ARG 74 2HH2 ARG 74 24.567 10.865 -4.983
525 H ASP 75 H ASP 75 24.681 10.695 3.548
526 HA ASP 75 HA ASP 75 22.670 12.532 4.467
527 HB2 ASP 75 2HB ASP 75 22.497 11.034 6.413
528 HB3 ASP 75 3HB ASP 75 22.403 10.183 4.867
529 H GLY 76 H GLY 76 22.554 13.677 6.443
530 HA2 GLY 76 2HA GLY 76 23.268 14.908 8.193
531 HA3 GLY 76 3HA GLY 76 24.540 13.694 8.414
532 H TYR 77 H TYR 77 24.036 16.064 5.687
533 HA TYR 77 HA TYR 77 26.886 16.698 6.005
534 HB2 TYR 77 2HB TYR 77 26.483 16.010 3.840
535 HB3 TYR 77 3HB TYR 77 24.991 16.942 3.709
536 HD1 TYR 77 HD1 TYR 77 24.978 19.026 2.670
537 HD2 TYR 77 HD2 TYR 77 28.688 17.413 4.145
538 HE1 TYR 77 HE1 TYR 77 26.205 20.915 1.635
539 HE2 TYR 77 HE2 TYR 77 29.922 19.297 3.104
540 HH TYR 77 HH TYR 77 28.238 21.886 1.283
541 H ASP 78 H ASP 78 27.746 18.518 6.592
542 HA ASP 78 HA ASP 78 26.139 20.452 7.939
543 HB2 ASP 78 2HB ASP 78 28.371 19.962 8.693
544 HB3 ASP 78 3HB ASP 78 29.053 20.391 7.117
545 H TYR 79 H TYR 79 24.699 21.630 6.808
546 HA TYR 79 HA TYR 79 25.530 22.913 4.295
547 HB2 TYR 79 2HB TYR 79 23.492 21.724 4.183
548 HB3 TYR 79 3HB TYR 79 22.875 22.470 5.654
549 HD1 TYR 79 HD1 TYR 79 23.927 23.316 2.172
550 HD2 TYR 79 HD2 TYR 79 21.503 24.333 5.565
551 HE1 TYR 79 HE1 TYR 79 22.796 25.074 0.825
552 HE2 TYR 79 HE2 TYR 79 20.353 26.091 4.229
553 HH TYR 79 HH TYR 79 21.216 26.734 0.807
554 H ASP 80 H ASP 80 24.346 25.221 4.052
555 HA ASP 80 HA ASP 80 25.917 26.946 5.636
556 HB2 ASP 80 2HB ASP 80 23.745 27.380 3.580
557 HB3 ASP 80 3HB ASP 80 24.619 28.712 4.350
558 H GLY 81 H GLY 81 23.812 25.405 7.195
559 HA2 GLY 81 2HA GLY 81 23.263 27.120 9.247
560 HA3 GLY 81 3HA GLY 81 21.930 27.436 8.118
561 H TYR 82 H TYR 82 22.479 24.326 7.394
562 HA TYR 82 HA TYR 82 21.043 23.160 9.710
563 HB2 TYR 82 2HB TYR 82 20.093 23.103 6.830
564 HB3 TYR 82 3HB TYR 82 19.395 22.165 8.156
565 HD1 TYR 82 HD1 TYR 82 18.034 23.211 9.880
566 HD2 TYR 82 HD2 TYR 82 19.741 25.526 6.684
567 HE1 TYR 82 HE1 TYR 82 16.522 25.102 10.445
568 HE2 TYR 82 HE2 TYR 82 18.232 27.410 7.237
569 HH TYR 82 HH TYR 82 15.880 27.237 9.937
570 H ARG 83 H ARG 83 20.475 20.688 8.628
571 HA ARG 83 HA ARG 83 23.051 19.642 7.577
572 HB2 ARG 83 2HB ARG 83 23.105 19.557 10.063
573 HB3 ARG 83 3HB ARG 83 21.625 18.578 10.046
574 HG2 ARG 83 2HG ARG 83 22.743 16.787 8.869
575 HG3 ARG 83 3HG ARG 83 24.190 17.797 8.601
576 HD2 ARG 83 2HD ARG 83 24.509 17.949 11.068
577 HD3 ARG 83 3HD ARG 83 23.116 16.871 11.293
578 HE ARG 83 HE ARG 83 25.523 16.013 9.733
579 HH11 ARG 83 1HH1 ARG 83 23.252 15.513 12.401
580 HH12 ARG 83 2HH1 ARG 83 23.887 13.931 12.793
581 HH21 ARG 83 1HH2 ARG 83 26.312 13.941 10.259
582 HH22 ARG 83 2HH2 ARG 83 25.606 13.045 11.587
583 H LEU 84 H LEU 84 22.713 18.385 5.916
584 HA LEU 84 HA LEU 84 20.143 17.848 4.869
585 HB2 LEU 84 2HB LEU 84 22.940 16.861 4.309
586 HB3 LEU 84 3HB LEU 84 21.571 16.105 3.490
587 HG LEU 84 HG LEU 84 22.614 17.881 2.138
588 HD11 LEU 84 1HD1 LEU 84 19.783 18.582 3.020
589 HD12 LEU 84 2HD1 LEU 84 20.553 18.986 1.468
590 HD13 LEU 84 3HD1 LEU 84 20.213 17.290 1.876
591 HD21 LEU 84 1HD2 LEU 84 23.254 19.385 4.031
592 HD22 LEU 84 2HD2 LEU 84 22.395 20.221 2.723
593 HD23 LEU 84 3HD2 LEU 84 21.537 19.817 4.228
594 H ARG 85 H ARG 85 18.985 15.911 4.556
595 HA ARG 85 HA ARG 85 19.721 13.653 6.364
596 HB2 ARG 85 2HB ARG 85 16.924 14.721 5.814
597 HB3 ARG 85 3HB ARG 85 17.348 13.328 6.831
598 HG2 ARG 85 2HG ARG 85 18.650 14.854 8.327
599 HG3 ARG 85 3HG ARG 85 18.156 16.233 7.323
600 HD2 ARG 85 2HD ARG 85 16.693 16.106 9.240
601 HD3 ARG 85 3HD ARG 85 15.767 15.685 7.785
602 HE ARG 85 HE ARG 85 16.440 13.230 8.570
603 HH11 ARG 85 1HH1 ARG 85 15.409 15.965 10.560
604 HH12 ARG 85 2HH1 ARG 85 14.684 14.945 11.782
605 HH21 ARG 85 1HH2 ARG 85 15.514 11.932 10.197
606 HH22 ARG 85 2HH2 ARG 85 14.751 12.674 11.584
607 H VAL 86 H VAL 86 20.024 11.849 5.312
608 HA VAL 86 HA VAL 86 18.302 11.180 3.008
609 HB VAL 86 HB VAL 86 21.343 10.971 2.928
610 HG11 VAL 86 1HG1 VAL 86 20.179 9.114 1.769
611 HG12 VAL 86 2HG1 VAL 86 19.200 10.291 0.864
612 HG13 VAL 86 3HG1 VAL 86 20.955 10.211 0.604
613 HG21 VAL 86 1HG2 VAL 86 19.420 12.770 1.394
614 HG22 VAL 86 2HG2 VAL 86 20.651 13.282 2.576
615 HG23 VAL 86 3HG2 VAL 86 21.151 12.567 1.029
616 H GLU 87 H GLU 87 17.285 9.815 4.583
617 HA GLU 87 HA GLU 87 18.867 7.402 5.267
618 HB2 GLU 87 2HB GLU 87 18.074 7.518 7.605
619 HB3 GLU 87 3HB GLU 87 19.061 8.935 7.189
620 HG2 GLU 87 2HG GLU 87 16.985 10.248 6.782
621 HG3 GLU 87 3HG GLU 87 16.008 8.838 7.221
622 H PHE 88 H PHE 88 17.588 5.598 6.016
623 HA PHE 88 HA PHE 88 15.248 5.277 4.396
624 HB2 PHE 88 2HB PHE 88 16.666 3.433 4.555
625 HB3 PHE 88 3HB PHE 88 16.774 3.544 6.309
626 HD1 PHE 88 HD1 PHE 88 14.816 2.278 3.495
627 HD2 PHE 88 HD2 PHE 88 14.959 2.751 7.765
628 HE1 PHE 88 HE1 PHE 88 13.063 0.540 3.747
629 HE2 PHE 88 HE2 PHE 88 13.195 1.012 8.010
630 HZ PHE 88 HZ PHE 88 12.251 -0.090 6.000
631 HA PRO 89 HA PRO 89 12.124 6.622 7.165
632 HB2 PRO 89 2HB PRO 89 9.949 5.275 6.130
633 HB3 PRO 89 3HB PRO 89 10.701 6.709 5.357
634 HG2 PRO 89 2HG PRO 89 11.133 3.781 4.711
635 HG3 PRO 89 3HG PRO 89 10.896 5.156 3.579
636 HD2 PRO 89 2HD PRO 89 13.366 4.160 4.168
637 HD3 PRO 89 3HD PRO 89 13.102 5.906 3.876
638 H5' A 90 1H5* A 90 11.555 19.971 14.105
639 H5'' A 90 2H5* A 90 12.185 20.984 12.793
640 H4' A 90 H4* A 90 11.270 18.089 12.456
641 H3' A 90 H3* A 90 13.508 18.695 13.836
642 H2' A 90 1H2* A 90 14.508 20.293 12.480
643 HO2' A 90 2HO* A 90 15.953 18.487 12.373
644 H1' A 90 H1* A 90 13.884 19.225 9.815
645 H8 A 90 H8 A 90 15.437 21.773 10.795
646 H61 A 90 1H6 A 90 11.286 26.124 9.324
647 H62 A 90 2H6 A 90 12.966 25.818 9.715
648 H2 A 90 H2 A 90 9.182 22.204 9.458
649 HO5' A 90 H5T A 90 10.208 20.662 11.706
650 H5' A 91 1H5* A 91 12.293 14.395 10.808
651 H5'' A 91 2H5* A 91 12.420 16.094 10.317
652 H4' A 91 H4* A 91 10.701 15.246 8.968
653 H3' A 91 H3* A 91 10.018 17.278 10.627
654 H2' A 91 1H2* A 91 9.232 16.162 12.506
655 HO2' A 91 2HO* A 91 7.049 15.940 10.696
656 H1' A 91 H1* A 91 8.004 13.785 11.330
657 H8 A 91 H8 A 91 8.559 14.829 14.300
658 H61 A 91 1H6 A 91 12.843 10.666 15.928
659 H62 A 91 2H6 A 91 11.695 11.853 16.519
660 H2 A 91 H2 A 91 12.544 10.658 11.493
661 H5' C 92 1H5* C 92 9.549 14.540 7.551
662 H5'' C 92 2H5* C 92 10.108 15.217 6.002
663 H4' C 92 H4* C 92 7.912 14.448 4.981
664 H3' C 92 H3* C 92 6.993 14.207 7.535
665 H2' C 92 1H2* C 92 8.637 12.634 8.237
666 HO2' C 92 2HO* C 92 6.431 11.122 7.250
667 H1' C 92 H1* C 92 8.217 11.063 5.690
668 H41 C 92 1H4 C 92 13.463 8.162 7.830
669 H42 C 92 2H4 C 92 14.048 9.628 8.588
670 H5 C 92 H5 C 92 12.779 11.718 8.595
671 H6 C 92 H6 C 92 10.728 12.789 7.833
672 H5' A 93 1H5* A 93 3.000 12.845 3.895
673 H5'' A 93 2H5* A 93 4.315 11.652 4.019
674 H4' A 93 H4* A 93 4.134 13.445 1.593
675 H3' A 93 H3* A 93 1.863 12.084 2.218
676 H2' A 93 1H2* A 93 2.901 10.002 2.677
677 HO2' A 93 2HO* A 93 2.265 10.001 -0.100
678 H1' A 93 H1* A 93 4.583 10.194 0.189
679 H8 A 93 H8 A 93 4.650 9.428 3.946
680 H61 A 93 1H6 A 93 7.862 4.407 2.167
681 H62 A 93 2H6 A 93 7.135 5.222 3.539
682 H2 A 93 H2 A 93 7.221 7.033 -1.383
683 H5' A 94 1H5* A 94 -0.645 13.184 1.528
684 H5'' A 94 2H5* A 94 -0.130 11.563 1.018
685 H4' A 94 H4* A 94 -2.443 13.118 -0.224
686 H3' A 94 H3* A 94 -2.364 11.668 2.270
687 H2' A 94 1H2* A 94 -2.610 9.570 1.281
688 HO2' A 94 2HO* A 94 -4.767 10.151 2.139
689 H1' A 94 H1* A 94 -3.996 10.896 -1.070
690 H8 A 94 H8 A 94 -4.851 8.734 -2.263
691 H61 A 94 1H6 A 94 -0.654 4.181 -2.348
692 H62 A 94 2H6 A 94 -2.252 4.675 -2.880
693 H2 A 94 H2 A 94 1.029 7.558 0.012
694 H5' A 95 1H5* A 95 -5.281 15.357 3.585
695 H5'' A 95 2H5* A 95 -3.967 15.284 2.401
696 H4' A 95 H4* A 95 -3.385 16.941 4.058
697 H3' A 95 H3* A 95 -1.650 14.969 3.392
698 HO3' A 95 H3T A 95 -1.297 16.820 5.534
699 H2' A 95 1H2* A 95 -2.043 13.371 5.031
700 HO2' A 95 2HO* A 95 -0.698 13.723 6.860
701 H1' A 95 H1* A 95 -2.706 15.095 7.315
702 H8 A 95 H8 A 95 -2.511 11.968 6.954
703 H61 A 95 1H6 A 95 -8.542 10.578 7.149
704 H62 A 95 2H6 A 95 -6.917 9.938 7.280
705 H2 A 95 H2 A 95 -8.162 14.922 6.266
Start of MODEL 18
1 H VAL 6 H1 VAL 6 -1.237 3.020 -7.867
2 HA VAL 6 HA VAL 6 -1.616 3.740 -5.639
3 HB VAL 6 HB VAL 6 0.343 2.288 -6.304
4 HG11 VAL 6 1HG1 VAL 6 1.908 4.869 -5.839
5 HG12 VAL 6 2HG1 VAL 6 2.590 3.249 -6.074
6 HG13 VAL 6 3HG1 VAL 6 1.718 4.039 -7.402
7 HG21 VAL 6 1HG2 VAL 6 -0.393 2.636 -3.957
8 HG22 VAL 6 2HG2 VAL 6 1.363 2.410 -4.084
9 HG23 VAL 6 3HG2 VAL 6 0.700 4.036 -3.829
10 H ILE 7 H ILE 7 -1.343 5.234 -3.940
11 HA ILE 7 HA ILE 7 -1.213 7.971 -4.898
12 HB ILE 7 HB ILE 7 -2.193 8.576 -2.922
13 HG12 ILE 7 2HG1 ILE 7 -0.410 7.891 -1.383
14 HG13 ILE 7 3HG1 ILE 7 -2.008 7.507 -0.760
15 HG21 ILE 7 1HG2 ILE 7 -2.938 5.623 -3.064
16 HG22 ILE 7 2HG2 ILE 7 -3.876 6.929 -2.310
17 HG23 ILE 7 3HG2 ILE 7 -3.614 6.923 -4.067
18 HD11 ILE 7 1HD1 ILE 7 -1.743 5.143 -1.389
19 HD12 ILE 7 2HD1 ILE 7 -0.151 5.496 -2.109
20 HD13 ILE 7 3HD1 ILE 7 -0.404 5.670 -0.359
21 H ARG 8 H ARG 8 1.150 5.792 -4.044
22 HA ARG 8 HA ARG 8 3.311 5.865 -3.442
23 HB2 ARG 8 2HB ARG 8 3.645 7.385 -5.236
24 HB3 ARG 8 3HB ARG 8 2.966 8.737 -4.325
25 HG2 ARG 8 2HG ARG 8 5.375 8.950 -4.406
26 HG3 ARG 8 3HG ARG 8 4.851 8.651 -2.739
27 HD2 ARG 8 2HD ARG 8 6.847 7.344 -3.240
28 HD3 ARG 8 3HD ARG 8 5.481 6.251 -2.986
29 HE ARG 8 HE ARG 8 5.533 6.747 -5.737
30 HH11 ARG 8 1HH1 ARG 8 7.766 5.406 -3.342
31 HH12 ARG 8 2HH1 ARG 8 8.519 4.329 -4.507
32 HH21 ARG 8 1HH2 ARG 8 6.550 5.317 -7.209
33 HH22 ARG 8 2HH2 ARG 8 7.843 4.278 -6.649
34 H GLY 9 H GLY 9 4.394 5.773 -1.601
35 HA2 GLY 9 2HA GLY 9 5.313 6.770 0.356
36 HA3 GLY 9 3HA GLY 9 3.911 7.814 0.513
37 HA PRO 10 HA PRO 10 2.358 4.929 3.509
38 HB2 PRO 10 2HB PRO 10 -0.376 5.464 2.413
39 HB3 PRO 10 3HB PRO 10 0.226 5.641 4.094
40 HG2 PRO 10 2HG PRO 10 -0.198 7.814 2.492
41 HG3 PRO 10 3HG PRO 10 1.208 7.736 3.616
42 HD2 PRO 10 2HD PRO 10 1.132 7.219 0.643
43 HD3 PRO 10 3HD PRO 10 2.345 8.115 1.611
44 H ALA 11 H ALA 11 2.357 4.254 0.251
45 HA ALA 11 HA ALA 11 1.506 1.477 0.719
46 HB1 ALA 11 1HB ALA 11 0.031 1.482 -1.252
47 HB2 ALA 11 2HB ALA 11 -0.542 2.640 -0.030
48 HB3 ALA 11 3HB ALA 11 0.323 3.223 -1.476
49 H GLY 12 H GLY 12 1.863 0.254 -1.506
50 HA2 GLY 12 2HA GLY 12 3.246 -0.116 -3.388
51 HA3 GLY 12 3HA GLY 12 4.221 1.301 -2.954
52 H ASN 13 H ASN 13 5.956 -0.387 -3.466
53 HA ASN 13 HA ASN 13 6.397 -2.547 -1.632
54 HB2 ASN 13 2HB ASN 13 8.677 -2.576 -2.698
55 HB3 ASN 13 3HB ASN 13 7.320 -2.665 -3.833
56 HD21 ASN 13 1HD2 ASN 13 9.160 -0.250 -5.658
57 HD22 ASN 13 2HD2 ASN 13 8.754 -1.950 -5.512
58 H ASN 14 H ASN 14 8.667 -2.667 -0.503
59 HA ASN 14 HA ASN 14 9.335 -0.176 0.917
60 HB2 ASN 14 2HB ASN 14 7.338 -1.389 2.039
61 HB3 ASN 14 3HB ASN 14 8.491 -2.659 2.459
62 HD21 ASN 14 1HD2 ASN 14 8.613 -0.657 5.462
63 HD22 ASN 14 2HD2 ASN 14 7.736 -1.962 4.693
64 H ASP 15 H ASP 15 11.047 -0.924 2.728
65 HA ASP 15 HA ASP 15 13.152 -1.578 3.086
66 HB2 ASP 15 2HB ASP 15 12.128 -4.134 1.849
67 HB3 ASP 15 3HB ASP 15 13.746 -3.972 2.540
68 H CYS 16 H CYS 16 12.331 -0.569 0.184
69 HA CYS 16 HA CYS 16 15.158 -0.702 -0.738
70 HB2 CYS 16 2HB CYS 16 12.697 -0.846 -2.529
71 HB3 CYS 16 3HB CYS 16 14.386 -0.843 -3.058
72 HG CYS 16 HG CYS 16 12.752 -3.033 -1.214
73 H ARG 17 H ARG 17 12.665 1.190 0.412
74 HA ARG 17 HA ARG 17 13.294 3.515 -1.308
75 HB2 ARG 17 2HB ARG 17 10.911 2.687 -0.804
76 HB3 ARG 17 3HB ARG 17 11.176 3.261 0.858
77 HG2 ARG 17 2HG ARG 17 11.762 5.515 -0.096
78 HG3 ARG 17 3HG ARG 17 11.306 4.894 -1.703
79 HD2 ARG 17 2HD ARG 17 9.521 5.075 0.756
80 HD3 ARG 17 3HD ARG 17 9.439 6.148 -0.654
81 HE ARG 17 HE ARG 17 9.094 3.667 -1.771
82 HH11 ARG 17 1HH1 ARG 17 7.536 5.367 0.904
83 HH12 ARG 17 2HH1 ARG 17 6.030 4.489 0.741
84 HH21 ARG 17 1HH2 ARG 17 7.099 2.562 -1.985
85 HH22 ARG 17 2HH2 ARG 17 5.758 2.970 -0.944
86 H ILE 18 H ILE 18 14.071 5.455 -0.402
87 HA ILE 18 HA ILE 18 14.766 5.403 2.491
88 HB ILE 18 HB ILE 18 16.934 6.304 2.083
89 HG12 ILE 18 2HG1 ILE 18 16.339 6.175 -0.900
90 HG13 ILE 18 3HG1 ILE 18 16.336 7.664 0.070
91 HG21 ILE 18 1HG2 ILE 18 16.606 3.823 1.939
92 HG22 ILE 18 2HG2 ILE 18 16.572 3.976 0.163
93 HG23 ILE 18 3HG2 ILE 18 18.036 4.415 1.076
94 HD11 ILE 18 1HD1 ILE 18 18.715 5.823 -0.396
95 HD12 ILE 18 2HD1 ILE 18 18.478 7.448 -1.068
96 HD13 ILE 18 3HD1 ILE 18 18.715 7.244 0.685
97 H TYR 19 H TYR 19 15.604 7.721 3.076
98 HA TYR 19 HA TYR 19 13.646 9.642 1.958
99 HB2 TYR 19 2HB TYR 19 12.627 9.214 3.916
100 HB3 TYR 19 3HB TYR 19 14.118 8.810 4.753
101 HD1 TYR 19 HD1 TYR 19 11.723 11.457 4.024
102 HD2 TYR 19 HD2 TYR 19 15.658 10.609 5.538
103 HE1 TYR 19 HE1 TYR 19 11.783 13.687 5.134
104 HE2 TYR 19 HE2 TYR 19 15.723 12.838 6.634
105 HH TYR 19 HH TYR 19 14.610 14.805 7.008
106 H VAL 20 H VAL 20 14.031 11.830 1.975
107 HA VAL 20 HA VAL 20 16.834 12.687 2.434
108 HB VAL 20 HB VAL 20 15.258 13.143 -0.125
109 HG11 VAL 20 1HG1 VAL 20 16.643 15.079 0.449
110 HG12 VAL 20 2HG1 VAL 20 18.043 14.018 0.745
111 HG13 VAL 20 3HG1 VAL 20 17.384 14.191 -0.901
112 HG21 VAL 20 1HG2 VAL 20 16.152 10.857 -0.033
113 HG22 VAL 20 2HG2 VAL 20 17.083 11.829 -1.188
114 HG23 VAL 20 3HG2 VAL 20 17.757 11.487 0.423
115 H GLY 21 H GLY 21 17.021 14.844 3.069
116 HA2 GLY 21 2HA GLY 21 14.643 16.572 3.021
117 HA3 GLY 21 3HA GLY 21 15.203 16.057 4.617
118 H ASN 22 H ASN 22 15.164 18.689 4.129
119 HA ASN 22 HA ASN 22 16.314 20.619 4.009
120 HB2 ASN 22 2HB ASN 22 17.722 19.340 5.723
121 HB3 ASN 22 3HB ASN 22 18.861 19.032 4.401
122 HD21 ASN 22 1HD2 ASN 22 20.472 22.084 5.092
123 HD22 ASN 22 2HD2 ASN 22 20.587 20.343 4.905
124 H LEU 23 H LEU 23 15.726 19.275 1.534
125 HA LEU 23 HA LEU 23 17.916 19.395 -0.273
126 HB2 LEU 23 2HB LEU 23 14.924 19.775 -0.644
127 HB3 LEU 23 3HB LEU 23 16.067 19.723 -1.998
128 HG LEU 23 HG LEU 23 15.816 17.492 0.064
129 HD11 LEU 23 1HD1 LEU 23 14.556 17.740 -2.698
130 HD12 LEU 23 2HD1 LEU 23 14.513 16.299 -1.662
131 HD13 LEU 23 3HD1 LEU 23 13.685 17.787 -1.147
132 HD21 LEU 23 1HD2 LEU 23 17.955 17.513 -1.162
133 HD22 LEU 23 2HD2 LEU 23 16.943 16.189 -1.760
134 HD23 LEU 23 3HD2 LEU 23 17.090 17.685 -2.708
135 HA PRO 24 HA PRO 24 18.564 23.760 -0.537
136 HB2 PRO 24 2HB PRO 24 19.791 23.928 -2.993
137 HB3 PRO 24 3HB PRO 24 20.598 23.263 -1.534
138 HG2 PRO 24 2HG PRO 24 19.265 21.771 -3.805
139 HG3 PRO 24 3HG PRO 24 20.816 21.404 -2.978
140 HD2 PRO 24 2HD PRO 24 18.459 20.125 -2.373
141 HD3 PRO 24 3HD PRO 24 19.732 20.437 -1.150
142 HA PRO 25 HA PRO 25 15.190 25.367 -2.891
143 HB2 PRO 25 2HB PRO 25 16.035 27.929 -3.463
144 HB3 PRO 25 3HB PRO 25 15.530 27.400 -1.824
145 HG2 PRO 25 2HG PRO 25 18.321 27.674 -2.942
146 HG3 PRO 25 3HG PRO 25 17.707 28.163 -1.327
147 HD2 PRO 25 2HD PRO 25 19.080 25.820 -1.758
148 HD3 PRO 25 3HD PRO 25 17.789 25.967 -0.523
149 H ASP 26 H ASP 26 18.380 25.106 -4.219
150 HA ASP 26 HA ASP 26 17.519 25.797 -6.941
151 HB2 ASP 26 2HB ASP 26 20.181 24.949 -5.769
152 HB3 ASP 26 3HB ASP 26 19.910 25.244 -7.491
153 H ILE 27 H ILE 27 16.886 23.160 -5.154
154 HA ILE 27 HA ILE 27 17.881 21.020 -6.745
155 HB ILE 27 HB ILE 27 17.025 20.873 -4.382
156 HG12 ILE 27 2HG1 ILE 27 15.885 18.715 -4.600
157 HG13 ILE 27 3HG1 ILE 27 15.589 19.009 -6.320
158 HG21 ILE 27 1HG2 ILE 27 14.281 20.987 -5.712
159 HG22 ILE 27 2HG2 ILE 27 14.615 20.723 -3.989
160 HG23 ILE 27 3HG2 ILE 27 14.988 22.291 -4.738
161 HD11 ILE 27 1HD1 ILE 27 18.358 18.866 -5.031
162 HD12 ILE 27 2HD1 ILE 27 17.573 17.520 -5.889
163 HD13 ILE 27 3HD1 ILE 27 18.009 18.991 -6.772
164 H ARG 28 H ARG 28 16.704 19.618 -8.207
165 HA ARG 28 HA ARG 28 14.277 20.788 -9.457
166 HB2 ARG 28 2HB ARG 28 16.676 19.793 -11.035
167 HB3 ARG 28 3HB ARG 28 15.167 20.461 -11.687
168 HG2 ARG 28 2HG ARG 28 15.688 22.633 -10.497
169 HG3 ARG 28 3HG ARG 28 17.273 21.949 -10.055
170 HD2 ARG 28 2HD ARG 28 16.197 22.397 -12.864
171 HD3 ARG 28 3HD ARG 28 17.492 23.310 -12.078
172 HE ARG 28 HE ARG 28 18.587 20.897 -11.952
173 HH11 ARG 28 1HH1 ARG 28 16.814 22.375 -14.626
174 HH12 ARG 28 2HH1 ARG 28 17.612 21.405 -15.845
175 HH21 ARG 28 1HH2 ARG 28 19.556 19.602 -13.549
176 HH22 ARG 28 2HH2 ARG 28 19.197 19.864 -15.241
177 H THR 29 H THR 29 13.156 19.192 -10.854
178 HA THR 29 HA THR 29 12.868 16.760 -9.406
179 HB THR 29 HB THR 29 11.016 16.320 -10.702
180 HG1 THR 29 1HG THR 29 10.795 17.090 -12.811
181 HG21 THR 29 1HG2 THR 29 11.352 19.334 -11.068
182 HG22 THR 29 2HG2 THR 29 9.824 18.427 -10.977
183 HG23 THR 29 3HG2 THR 29 10.863 18.563 -9.545
184 H LYS 30 H LYS 30 15.208 17.507 -11.691
185 HA LYS 30 HA LYS 30 15.447 14.634 -12.474
186 HB2 LYS 30 2HB LYS 30 15.175 16.197 -14.366
187 HB3 LYS 30 3HB LYS 30 16.544 17.161 -13.772
188 HG2 LYS 30 2HG LYS 30 17.332 15.741 -15.577
189 HG3 LYS 30 3HG LYS 30 18.035 15.163 -14.060
190 HD2 LYS 30 2HD LYS 30 16.128 13.470 -13.938
191 HD3 LYS 30 3HD LYS 30 15.678 13.981 -15.577
192 HE2 LYS 30 2HE LYS 30 18.014 13.397 -16.325
193 HE3 LYS 30 3HE LYS 30 18.344 12.808 -14.681
194 HZ1 LYS 30 1HZ LYS 30 16.509 11.251 -14.985
195 HZ2 LYS 30 2HZ LYS 30 16.305 11.761 -16.528
196 HZ3 LYS 30 3HZ LYS 30 17.705 11.006 -16.089
197 H ASP 31 H ASP 31 17.192 17.439 -11.097
198 HA ASP 31 HA ASP 31 19.737 16.163 -10.967
199 HB2 ASP 31 2HB ASP 31 18.508 18.327 -9.225
200 HB3 ASP 31 3HB ASP 31 20.219 17.872 -9.227
201 H ILE 32 H ILE 32 16.827 15.908 -9.021
202 HA ILE 32 HA ILE 32 18.094 14.804 -6.684
203 HB ILE 32 HB ILE 32 15.933 15.998 -6.673
204 HG12 ILE 32 2HG1 ILE 32 15.533 13.119 -5.773
205 HG13 ILE 32 3HG1 ILE 32 16.642 14.234 -4.954
206 HG21 ILE 32 1HG2 ILE 32 15.040 15.080 -8.822
207 HG22 ILE 32 2HG2 ILE 32 14.834 13.497 -8.040
208 HG23 ILE 32 3HG2 ILE 32 13.890 14.899 -7.484
209 HD11 ILE 32 1HD1 ILE 32 13.653 14.666 -5.337
210 HD12 ILE 32 2HD1 ILE 32 14.487 14.251 -3.819
211 HD13 ILE 32 3HD1 ILE 32 14.777 15.825 -4.588
212 H GLU 33 H GLU 33 17.355 13.440 -9.818
213 HA GLU 33 HA GLU 33 17.821 10.764 -8.585
214 HB2 GLU 33 2HB GLU 33 16.629 9.746 -10.384
215 HB3 GLU 33 3HB GLU 33 15.598 11.014 -9.702
216 HG2 GLU 33 2HG GLU 33 16.121 12.503 -11.557
217 HG3 GLU 33 3HG GLU 33 17.343 11.376 -12.179
218 H ASP 34 H ASP 34 19.186 13.259 -10.473
219 HA ASP 34 HA ASP 34 20.786 11.612 -12.216
220 HB2 ASP 34 2HB ASP 34 20.343 13.927 -12.774
221 HB3 ASP 34 3HB ASP 34 21.049 14.473 -11.250
222 H VAL 35 H VAL 35 21.566 13.415 -9.173
223 HA VAL 35 HA VAL 35 24.170 12.220 -8.985
224 HB VAL 35 HB VAL 35 23.481 14.400 -7.948
225 HG11 VAL 35 1HG1 VAL 35 22.344 14.383 -5.791
226 HG12 VAL 35 2HG1 VAL 35 21.297 13.603 -6.992
227 HG13 VAL 35 3HG1 VAL 35 22.207 12.612 -5.826
228 HG21 VAL 35 1HG2 VAL 35 24.632 12.319 -6.042
229 HG22 VAL 35 2HG2 VAL 35 25.544 13.193 -7.288
230 HG23 VAL 35 3HG2 VAL 35 24.832 14.085 -5.927
231 H PHE 36 H PHE 36 20.957 11.326 -7.731
232 HA PHE 36 HA PHE 36 22.002 9.211 -6.091
233 HB2 PHE 36 2HB PHE 36 19.249 9.956 -7.027
234 HB3 PHE 36 3HB PHE 36 19.549 8.418 -6.217
235 HD1 PHE 36 HD1 PHE 36 19.965 8.261 -3.872
236 HD2 PHE 36 HD2 PHE 36 19.711 12.104 -5.789
237 HE1 PHE 36 HE1 PHE 36 19.871 9.359 -1.660
238 HE2 PHE 36 HE2 PHE 36 19.610 13.204 -3.571
239 HZ PHE 36 HZ PHE 36 19.696 11.834 -1.501
240 H SER 37 H SER 37 21.033 9.346 -9.500
241 HA SER 37 HA SER 37 21.030 6.509 -9.900
242 HB2 SER 37 2HB SER 37 19.975 8.012 -11.492
243 HB3 SER 37 3HB SER 37 21.523 8.833 -11.800
244 HG SER 37 HG SER 37 22.301 6.939 -12.699
245 H LYS 38 H LYS 38 23.581 8.980 -9.722
246 HA LYS 38 HA LYS 38 25.673 7.279 -10.756
247 HB2 LYS 38 2HB LYS 38 25.879 9.727 -10.691
248 HB3 LYS 38 3HB LYS 38 25.757 9.714 -8.920
249 HG2 LYS 38 2HG LYS 38 27.836 8.420 -8.746
250 HG3 LYS 38 3HG LYS 38 27.952 8.337 -10.521
251 HD2 LYS 38 2HD LYS 38 28.133 10.797 -10.637
252 HD3 LYS 38 3HD LYS 38 27.940 10.910 -8.879
253 HE2 LYS 38 2HE LYS 38 30.311 11.077 -9.479
254 HE3 LYS 38 3HE LYS 38 30.010 9.598 -8.556
255 HZ1 LYS 38 1HZ LYS 38 31.407 9.204 -10.469
256 HZ2 LYS 38 2HZ LYS 38 29.989 8.382 -10.623
257 HZ3 LYS 38 3HZ LYS 38 30.243 9.762 -11.485
258 H TYR 39 H TYR 39 24.218 7.833 -7.555
259 HA TYR 39 HA TYR 39 26.140 6.074 -6.270
260 HB2 TYR 39 2HB TYR 39 23.864 7.741 -5.321
261 HB3 TYR 39 3HB TYR 39 24.419 6.391 -4.319
262 HD1 TYR 39 HD1 TYR 39 25.313 9.700 -5.669
263 HD2 TYR 39 HD2 TYR 39 26.622 6.329 -3.344
264 HE1 TYR 39 HE1 TYR 39 27.204 11.050 -4.778
265 HE2 TYR 39 HE2 TYR 39 28.503 7.660 -2.449
266 HH TYR 39 HH TYR 39 29.586 9.685 -2.476
267 H GLY 40 H GLY 40 23.208 5.391 -7.969
268 HA2 GLY 40 2HA GLY 40 23.516 2.619 -7.607
269 HA3 GLY 40 3HA GLY 40 22.356 3.168 -6.383
270 H ALA 41 H ALA 41 21.257 1.429 -7.934
271 HA ALA 41 HA ALA 41 20.186 2.566 -10.400
272 HB1 ALA 41 1HB ALA 41 19.680 -0.053 -8.937
273 HB2 ALA 41 2HB ALA 41 19.053 0.351 -10.549
274 HB3 ALA 41 3HB ALA 41 20.810 0.211 -10.291
275 H ILE 42 H ILE 42 19.053 4.419 -9.498
276 HA ILE 42 HA ILE 42 16.759 4.014 -7.770
277 HB ILE 42 HB ILE 42 17.851 6.282 -9.445
278 HG12 ILE 42 2HG1 ILE 42 17.815 7.423 -7.243
279 HG13 ILE 42 3HG1 ILE 42 17.099 5.983 -6.499
280 HG21 ILE 42 1HG2 ILE 42 15.144 6.253 -8.046
281 HG22 ILE 42 2HG2 ILE 42 15.958 7.699 -8.678
282 HG23 ILE 42 3HG2 ILE 42 15.426 6.440 -9.799
283 HD11 ILE 42 1HD1 ILE 42 19.590 6.205 -6.173
284 HD12 ILE 42 2HD1 ILE 42 19.085 4.678 -6.920
285 HD13 ILE 42 3HD1 ILE 42 19.781 5.980 -7.928
286 H ARG 43 H ARG 43 14.566 4.041 -8.332
287 HA ARG 43 HA ARG 43 13.951 3.633 -11.224
288 HB2 ARG 43 2HB ARG 43 12.906 2.075 -8.830
289 HB3 ARG 43 3HB ARG 43 12.210 1.978 -10.458
290 HG2 ARG 43 2HG ARG 43 15.105 1.319 -9.766
291 HG3 ARG 43 3HG ARG 43 13.812 0.127 -9.966
292 HD2 ARG 43 2HD ARG 43 13.446 0.957 -12.295
293 HD3 ARG 43 3HD ARG 43 14.810 2.068 -12.102
294 HE ARG 43 HE ARG 43 14.946 -0.901 -12.259
295 HH11 ARG 43 1HH1 ARG 43 16.614 2.213 -12.044
296 HH12 ARG 43 2HH1 ARG 43 18.138 1.556 -12.591
297 HH21 ARG 43 1HH2 ARG 43 16.956 -1.729 -12.930
298 HH22 ARG 43 2HH2 ARG 43 18.339 -0.675 -13.067
299 H ASP 44 H ASP 44 13.031 5.044 -8.130
300 HA ASP 44 HA ASP 44 11.160 6.753 -9.587
301 HB2 ASP 44 2HB ASP 44 10.230 4.731 -7.578
302 HB3 ASP 44 3HB ASP 44 9.423 6.298 -7.660
303 H ILE 45 H ILE 45 10.249 8.518 -8.367
304 HA ILE 45 HA ILE 45 11.882 9.349 -6.021
305 HB ILE 45 HB ILE 45 11.258 10.914 -8.563
306 HG12 ILE 45 2HG1 ILE 45 13.270 9.528 -8.712
307 HG13 ILE 45 3HG1 ILE 45 13.648 11.263 -8.696
308 HG21 ILE 45 1HG2 ILE 45 12.306 11.926 -5.897
309 HG22 ILE 45 2HG2 ILE 45 12.463 12.812 -7.429
310 HG23 ILE 45 3HG2 ILE 45 10.852 12.456 -6.780
311 HD11 ILE 45 1HD1 ILE 45 13.885 9.387 -6.297
312 HD12 ILE 45 2HD1 ILE 45 15.229 9.976 -7.288
313 HD13 ILE 45 3HD1 ILE 45 14.281 11.120 -6.313
314 H ASP 46 H ASP 46 10.819 10.906 -4.657
315 HA ASP 46 HA ASP 46 7.991 11.501 -5.272
316 HB2 ASP 46 2HB ASP 46 8.044 9.398 -3.937
317 HB3 ASP 46 3HB ASP 46 8.921 10.257 -2.660
318 H LEU 47 H LEU 47 9.908 13.322 -5.650
319 HA LEU 47 HA LEU 47 10.678 14.913 -3.465
320 HB2 LEU 47 2HB LEU 47 11.522 15.298 -5.711
321 HB3 LEU 47 3HB LEU 47 9.891 15.651 -6.308
322 HG LEU 47 HG LEU 47 9.787 17.658 -4.847
323 HD11 LEU 47 1HD1 LEU 47 11.342 16.955 -3.062
324 HD12 LEU 47 2HD1 LEU 47 12.686 16.934 -4.228
325 HD13 LEU 47 3HD1 LEU 47 11.898 18.469 -3.795
326 HD21 LEU 47 1HD2 LEU 47 12.238 17.512 -6.645
327 HD22 LEU 47 2HD2 LEU 47 10.577 17.823 -7.181
328 HD23 LEU 47 3HD2 LEU 47 11.406 19.002 -6.134
329 H LYS 48 H LYS 48 9.660 16.324 -2.116
330 HA LYS 48 HA LYS 48 6.820 17.002 -2.640
331 HB2 LYS 48 2HB LYS 48 8.102 15.674 -0.244
332 HB3 LYS 48 3HB LYS 48 6.667 16.691 -0.059
333 HG2 LYS 48 2HG LYS 48 5.405 15.289 -1.613
334 HG3 LYS 48 3HG LYS 48 6.853 14.314 -1.962
335 HD2 LYS 48 2HD LYS 48 6.975 13.588 0.381
336 HD3 LYS 48 3HD LYS 48 5.573 14.596 0.794
337 HE2 LYS 48 2HE LYS 48 5.576 12.282 -1.185
338 HE3 LYS 48 3HE LYS 48 4.974 12.210 0.483
339 HZ1 LYS 48 1HZ LYS 48 3.186 12.581 -1.033
340 HZ2 LYS 48 2HZ LYS 48 3.390 13.932 -0.110
341 HZ3 LYS 48 3HZ LYS 48 3.909 13.912 -1.672
342 H ASN 49 H ASN 49 6.052 18.833 -1.461
343 HA ASN 49 HA ASN 49 8.052 20.557 -0.163
344 HB2 ASN 49 2HB ASN 49 7.364 22.502 -1.578
345 HB3 ASN 49 3HB ASN 49 8.227 21.248 -2.471
346 HD21 ASN 49 1HD2 ASN 49 5.580 21.936 -4.807
347 HD22 ASN 49 2HD2 ASN 49 7.180 22.451 -4.318
348 H ARG 50 H ARG 50 5.336 18.968 0.191
349 HA ARG 50 HA ARG 50 3.426 20.981 1.005
350 HB2 ARG 50 2HB ARG 50 3.612 18.018 1.696
351 HB3 ARG 50 3HB ARG 50 2.184 19.044 1.890
352 HG2 ARG 50 2HG ARG 50 3.540 18.424 -0.777
353 HG3 ARG 50 3HG ARG 50 2.093 17.615 -0.154
354 HD2 ARG 50 2HD ARG 50 2.313 20.597 -0.695
355 HD3 ARG 50 3HD ARG 50 1.558 19.419 -1.783
356 HE ARG 50 HE ARG 50 0.017 18.903 0.215
357 HH11 ARG 50 1HH1 ARG 50 1.400 22.104 -0.411
358 HH12 ARG 50 2HH1 ARG 50 0.112 22.944 0.416
359 HH21 ARG 50 1HH2 ARG 50 -1.641 20.011 1.250
360 HH22 ARG 50 2HH2 ARG 50 -1.621 21.762 1.351
361 H ARG 51 H ARG 51 2.566 21.069 3.243
362 HA ARG 51 HA ARG 51 2.768 21.521 5.452
363 HB2 ARG 51 2HB ARG 51 4.911 19.369 5.440
364 HB3 ARG 51 3HB ARG 51 3.985 19.941 6.840
365 HG2 ARG 51 2HG ARG 51 1.883 19.183 5.793
366 HG3 ARG 51 3HG ARG 51 2.781 18.624 4.365
367 HD2 ARG 51 2HD ARG 51 4.108 17.110 5.853
368 HD3 ARG 51 3HD ARG 51 3.043 17.562 7.197
369 HE ARG 51 HE ARG 51 2.088 16.258 4.665
370 HH11 ARG 51 1HH1 ARG 51 2.001 16.552 8.190
371 HH12 ARG 51 2HH1 ARG 51 0.725 15.370 8.371
372 HH21 ARG 51 1HH2 ARG 51 0.452 14.753 4.918
373 HH22 ARG 51 2HH2 ARG 51 -0.144 14.327 6.512
374 H GLY 52 H GLY 52 4.490 22.002 7.300
375 HA2 GLY 52 2HA GLY 52 5.943 24.318 6.345
376 HA3 GLY 52 3HA GLY 52 5.821 23.745 8.010
377 H GLY 53 H GLY 53 8.204 24.717 7.361
378 HA2 GLY 53 2HA GLY 53 10.425 24.146 7.580
379 HA3 GLY 53 3HA GLY 53 9.978 22.431 7.572
380 HA PRO 54 HA PRO 54 12.106 23.738 3.542
381 HB2 PRO 54 2HB PRO 54 13.902 21.485 4.334
382 HB3 PRO 54 3HB PRO 54 14.336 23.090 3.671
383 HG2 PRO 54 2HG PRO 54 14.719 22.483 6.308
384 HG3 PRO 54 3HG PRO 54 14.188 24.118 5.783
385 HD2 PRO 54 2HD PRO 54 12.529 21.860 6.908
386 HD3 PRO 54 3HD PRO 54 12.435 23.614 7.256
387 HA PRO 55 HA PRO 55 10.184 20.397 1.360
388 HB2 PRO 55 2HB PRO 55 11.804 20.125 -0.869
389 HB3 PRO 55 3HB PRO 55 10.612 21.446 -0.643
390 HG2 PRO 55 2HG PRO 55 13.600 21.494 -0.165
391 HG3 PRO 55 3HG PRO 55 12.565 22.752 -0.918
392 HD2 PRO 55 2HD PRO 55 13.393 22.873 1.695
393 HD3 PRO 55 3HD PRO 55 11.804 23.509 1.168
394 H PHE 56 H PHE 56 10.532 18.121 0.638
395 HA PHE 56 HA PHE 56 13.041 16.829 1.476
396 HB2 PHE 56 2HB PHE 56 12.119 15.602 3.254
397 HB3 PHE 56 3HB PHE 56 11.508 17.225 3.537
398 HD1 PHE 56 HD1 PHE 56 9.083 17.685 2.409
399 HD2 PHE 56 HD2 PHE 56 10.684 13.818 3.387
400 HE1 PHE 56 HE1 PHE 56 6.786 16.761 2.535
401 HE2 PHE 56 HE2 PHE 56 8.388 12.925 3.640
402 HZ PHE 56 HZ PHE 56 6.435 14.376 3.160
403 H ALA 57 H ALA 57 12.614 14.318 1.112
404 HA ALA 57 HA ALA 57 10.608 13.753 -0.942
405 HB1 ALA 57 1HB ALA 57 12.359 15.054 -2.167
406 HB2 ALA 57 2HB ALA 57 13.573 13.872 -1.640
407 HB3 ALA 57 3HB ALA 57 12.258 13.364 -2.724
408 H PHE 58 H PHE 58 11.060 11.543 -1.936
409 HA PHE 58 HA PHE 58 12.688 9.792 -0.173
410 HB2 PHE 58 2HB PHE 58 9.939 9.141 -1.293
411 HB3 PHE 58 3HB PHE 58 10.985 8.032 -0.409
412 HD1 PHE 58 HD1 PHE 58 11.386 8.319 2.005
413 HD2 PHE 58 HD2 PHE 58 8.658 10.848 -0.150
414 HE1 PHE 58 HE1 PHE 58 10.397 9.072 4.146
415 HE2 PHE 58 HE2 PHE 58 7.688 11.625 1.991
416 HZ PHE 58 HZ PHE 58 8.548 10.736 4.141
417 H VAL 59 H VAL 59 13.480 7.871 -1.273
418 HA VAL 59 HA VAL 59 13.455 8.087 -4.240
419 HB VAL 59 HB VAL 59 15.890 7.703 -2.446
420 HG11 VAL 59 1HG1 VAL 59 17.146 7.748 -4.582
421 HG12 VAL 59 2HG1 VAL 59 16.021 6.372 -4.509
422 HG13 VAL 59 3HG1 VAL 59 15.612 7.809 -5.480
423 HG21 VAL 59 1HG2 VAL 59 16.652 9.839 -3.451
424 HG22 VAL 59 2HG2 VAL 59 15.094 10.000 -4.287
425 HG23 VAL 59 3HG2 VAL 59 15.164 10.052 -2.508
426 H GLU 60 H GLU 60 13.237 6.151 -5.265
427 HA GLU 60 HA GLU 60 13.142 3.739 -3.512
428 HB2 GLU 60 2HB GLU 60 10.968 4.279 -4.328
429 HB3 GLU 60 3HB GLU 60 11.583 4.543 -5.975
430 HG2 GLU 60 2HG GLU 60 12.172 2.166 -6.168
431 HG3 GLU 60 3HG GLU 60 11.611 1.875 -4.508
432 H PHE 61 H PHE 61 14.594 2.242 -3.818
433 HA PHE 61 HA PHE 61 16.249 2.314 -6.257
434 HB2 PHE 61 2HB PHE 61 16.673 1.134 -3.511
435 HB3 PHE 61 3HB PHE 61 17.696 0.725 -4.884
436 HD1 PHE 61 HD1 PHE 61 19.600 1.973 -5.322
437 HD2 PHE 61 HD2 PHE 61 16.386 3.746 -3.074
438 HE1 PHE 61 HE1 PHE 61 20.989 3.981 -4.907
439 HE2 PHE 61 HE2 PHE 61 17.771 5.752 -2.673
440 HZ PHE 61 HZ PHE 61 20.087 5.866 -3.577
441 H GLU 62 H GLU 62 16.866 0.458 -7.443
442 HA GLU 62 HA GLU 62 14.843 -1.638 -7.629
443 HB2 GLU 62 2HB GLU 62 15.962 -0.813 -9.639
444 HB3 GLU 62 3HB GLU 62 17.548 -1.164 -8.944
445 HG2 GLU 62 2HG GLU 62 16.983 -2.873 -10.564
446 HG3 GLU 62 3HG GLU 62 17.029 -3.589 -8.952
447 H ASP 63 H ASP 63 17.834 -1.068 -5.931
448 HA ASP 63 HA ASP 63 17.637 -3.671 -4.615
449 HB2 ASP 63 2HB ASP 63 18.979 -4.259 -6.531
450 HB3 ASP 63 3HB ASP 63 20.013 -2.840 -6.307
451 HA PRO 64 HA PRO 64 18.593 -0.600 -1.535
452 HB2 PRO 64 2HB PRO 64 18.582 -2.256 0.677
453 HB3 PRO 64 3HB PRO 64 17.106 -1.646 -0.135
454 HG2 PRO 64 2HG PRO 64 18.478 -4.325 -0.460
455 HG3 PRO 64 3HG PRO 64 16.719 -3.983 -0.308
456 HD2 PRO 64 2HD PRO 64 17.914 -4.439 -2.714
457 HD3 PRO 64 3HD PRO 64 16.570 -3.273 -2.538
458 H ARG 65 H ARG 65 20.619 -3.212 -2.498
459 HA ARG 65 HA ARG 65 22.738 -2.998 -0.609
460 HB2 ARG 65 2HB ARG 65 22.588 -4.828 -2.226
461 HB3 ARG 65 3HB ARG 65 22.727 -3.676 -3.573
462 HG2 ARG 65 2HG ARG 65 24.995 -3.031 -2.779
463 HG3 ARG 65 3HG ARG 65 24.863 -4.237 -1.476
464 HD2 ARG 65 2HD ARG 65 24.598 -6.024 -3.154
465 HD3 ARG 65 3HD ARG 65 24.646 -4.830 -4.461
466 HE ARG 65 HE ARG 65 26.903 -5.929 -2.989
467 HH11 ARG 65 1HH1 ARG 65 25.761 -3.114 -4.816
468 HH12 ARG 65 2HH1 ARG 65 27.367 -2.640 -5.306
469 HH21 ARG 65 1HH2 ARG 65 28.983 -5.265 -3.623
470 HH22 ARG 65 2HH2 ARG 65 29.193 -3.849 -4.625
471 H ASP 66 H ASP 66 21.858 -1.065 -3.474
472 HA ASP 66 HA ASP 66 24.339 0.503 -3.263
473 HB2 ASP 66 2HB ASP 66 21.980 0.651 -5.173
474 HB3 ASP 66 3HB ASP 66 23.452 1.635 -5.280
475 H ALA 67 H ALA 67 21.107 0.604 -2.038
476 HA ALA 67 HA ALA 67 20.802 3.460 -1.924
477 HB1 ALA 67 1HB ALA 67 19.582 1.263 -0.201
478 HB2 ALA 67 2HB ALA 67 18.996 2.934 -0.338
479 HB3 ALA 67 3HB ALA 67 18.922 1.853 -1.748
480 H GLU 68 H GLU 68 22.559 1.092 0.005
481 HA GLU 68 HA GLU 68 22.877 2.749 2.349
482 HB2 GLU 68 2HB GLU 68 23.100 0.317 2.409
483 HB3 GLU 68 3HB GLU 68 24.463 0.388 1.275
484 HG2 GLU 68 2HG GLU 68 25.800 1.651 2.887
485 HG3 GLU 68 3HG GLU 68 24.432 1.726 4.011
486 H ASP 69 H ASP 69 24.510 2.476 -0.784
487 HA ASP 69 HA ASP 69 26.853 3.952 0.052
488 HB2 ASP 69 2HB ASP 69 25.735 3.187 -2.662
489 HB3 ASP 69 3HB ASP 69 27.235 4.094 -2.439
490 H ALA 70 H ALA 70 23.736 4.796 -1.447
491 HA ALA 70 HA ALA 70 24.442 7.525 -2.019
492 HB1 ALA 70 1HB ALA 70 21.727 6.224 -1.522
493 HB2 ALA 70 2HB ALA 70 22.004 7.808 -2.284
494 HB3 ALA 70 3HB ALA 70 22.551 6.320 -3.095
495 H VAL 71 H VAL 71 23.262 5.787 0.841
496 HA VAL 71 HA VAL 71 22.577 8.189 2.323
497 HB VAL 71 HB VAL 71 22.942 5.236 2.952
498 HG11 VAL 71 1HG1 VAL 71 23.728 6.388 4.956
499 HG12 VAL 71 2HG1 VAL 71 22.305 7.461 4.939
500 HG13 VAL 71 3HG1 VAL 71 22.108 5.721 5.245
501 HG21 VAL 71 1HG2 VAL 71 20.866 5.979 1.802
502 HG22 VAL 71 2HG2 VAL 71 20.530 5.378 3.440
503 HG23 VAL 71 3HG2 VAL 71 20.558 7.125 3.130
504 H SER 72 H SER 72 25.452 6.182 1.768
505 HA SER 72 HA SER 72 26.943 7.410 3.970
506 HB2 SER 72 2HB SER 72 27.234 5.028 3.386
507 HB3 SER 72 3HB SER 72 27.765 5.487 1.759
508 HG SER 72 HG SER 72 29.025 6.150 4.213
509 H GLY 73 H GLY 73 26.182 8.271 0.743
510 HA2 GLY 73 2HA GLY 73 28.709 9.296 -0.127
511 HA3 GLY 73 3HA GLY 73 27.116 9.689 -0.799
512 H ARG 74 H ARG 74 25.832 10.871 1.372
513 HA ARG 74 HA ARG 74 27.504 12.858 2.665
514 HB2 ARG 74 2HB ARG 74 27.369 13.784 0.359
515 HB3 ARG 74 3HB ARG 74 25.599 13.729 0.447
516 HG2 ARG 74 2HG ARG 74 25.626 15.332 2.328
517 HG3 ARG 74 3HG ARG 74 27.406 15.334 2.316
518 HD2 ARG 74 2HD ARG 74 27.362 16.143 -0.046
519 HD3 ARG 74 3HD ARG 74 25.589 16.222 0.045
520 HE ARG 74 HE ARG 74 27.318 17.795 1.909
521 HH11 ARG 74 1HH1 ARG 74 24.755 17.643 -0.531
522 HH12 ARG 74 2HH1 ARG 74 24.338 19.330 -0.364
523 HH21 ARG 74 1HH2 ARG 74 26.739 19.978 2.121
524 HH22 ARG 74 2HH2 ARG 74 25.455 20.655 1.144
525 H ASP 75 H ASP 75 26.566 13.130 4.609
526 HA ASP 75 HA ASP 75 23.708 13.556 4.883
527 HB2 ASP 75 2HB ASP 75 23.750 11.095 4.611
528 HB3 ASP 75 3HB ASP 75 24.943 10.964 5.905
529 H GLY 76 H GLY 76 23.185 14.418 6.923
530 HA2 GLY 76 2HA GLY 76 23.397 14.982 9.120
531 HA3 GLY 76 3HA GLY 76 24.880 14.017 9.219
532 H TYR 77 H TYR 77 23.514 17.178 8.367
533 HA TYR 77 HA TYR 77 24.271 19.231 8.574
534 HB2 TYR 77 2HB TYR 77 24.473 18.922 10.821
535 HB3 TYR 77 3HB TYR 77 25.870 17.861 10.654
536 HD1 TYR 77 HD1 TYR 77 27.812 18.811 11.565
537 HD2 TYR 77 HD2 TYR 77 25.024 21.332 9.473
538 HE1 TYR 77 HE1 TYR 77 29.325 20.750 11.895
539 HE2 TYR 77 HE2 TYR 77 26.548 23.258 9.741
540 HH TYR 77 HH TYR 77 29.663 22.988 11.504
541 H ASP 78 H ASP 78 24.929 20.119 6.785
542 HA ASP 78 HA ASP 78 27.757 20.565 6.452
543 HB2 ASP 78 2HB ASP 78 27.086 18.215 5.490
544 HB3 ASP 78 3HB ASP 78 26.218 19.119 4.249
545 H TYR 79 H TYR 79 25.241 22.033 6.835
546 HA TYR 79 HA TYR 79 25.345 23.711 4.350
547 HB2 TYR 79 2HB TYR 79 23.204 22.161 5.043
548 HB3 TYR 79 3HB TYR 79 22.834 23.615 5.976
549 HD1 TYR 79 HD1 TYR 79 21.852 25.483 4.888
550 HD2 TYR 79 HD2 TYR 79 23.758 22.404 2.608
551 HE1 TYR 79 HE1 TYR 79 20.952 26.501 2.806
552 HE2 TYR 79 HE2 TYR 79 22.870 23.407 0.485
553 HH TYR 79 HH TYR 79 20.839 26.365 0.527
554 H ASP 80 H ASP 80 24.168 25.840 4.967
555 HA ASP 80 HA ASP 80 25.551 26.925 7.313
556 HB2 ASP 80 2HB ASP 80 25.845 28.154 5.278
557 HB3 ASP 80 3HB ASP 80 24.099 28.188 4.976
558 H GLY 81 H GLY 81 24.528 26.719 9.235
559 HA2 GLY 81 2HA GLY 81 22.915 27.050 10.848
560 HA3 GLY 81 3HA GLY 81 21.953 27.955 9.658
561 H TYR 82 H TYR 82 22.624 25.115 8.142
562 HA TYR 82 HA TYR 82 20.361 23.630 9.327
563 HB2 TYR 82 2HB TYR 82 20.700 24.475 6.461
564 HB3 TYR 82 3HB TYR 82 19.771 23.043 6.902
565 HD1 TYR 82 HD1 TYR 82 17.539 23.218 7.626
566 HD2 TYR 82 HD2 TYR 82 20.035 26.714 7.520
567 HE1 TYR 82 HE1 TYR 82 15.556 24.637 8.086
568 HE2 TYR 82 HE2 TYR 82 18.058 28.145 8.003
569 HH TYR 82 HH TYR 82 14.777 26.768 8.397
570 H ARG 83 H ARG 83 20.154 21.328 8.361
571 HA ARG 83 HA ARG 83 22.847 20.237 7.881
572 HB2 ARG 83 2HB ARG 83 22.081 18.350 9.433
573 HB3 ARG 83 3HB ARG 83 22.601 19.872 10.210
574 HG2 ARG 83 2HG ARG 83 19.681 19.452 9.555
575 HG3 ARG 83 3HG ARG 83 20.383 18.624 10.960
576 HD2 ARG 83 2HD ARG 83 21.077 20.686 11.963
577 HD3 ARG 83 3HD ARG 83 20.685 21.614 10.518
578 HE ARG 83 HE ARG 83 18.263 20.845 10.939
579 HH11 ARG 83 1HH1 ARG 83 20.604 21.354 13.547
580 HH12 ARG 83 2HH1 ARG 83 19.367 21.684 14.736
581 HH21 ARG 83 1HH2 ARG 83 16.704 21.284 12.475
582 HH22 ARG 83 2HH2 ARG 83 17.143 21.656 14.129
583 H LEU 84 H LEU 84 22.953 18.633 6.438
584 HA LEU 84 HA LEU 84 20.631 18.041 4.816
585 HB2 LEU 84 2HB LEU 84 23.451 16.889 4.891
586 HB3 LEU 84 3HB LEU 84 22.237 16.471 3.679
587 HG LEU 84 HG LEU 84 23.837 18.121 2.833
588 HD11 LEU 84 1HD1 LEU 84 21.518 18.133 1.977
589 HD12 LEU 84 2HD1 LEU 84 21.061 19.320 3.220
590 HD13 LEU 84 3HD1 LEU 84 22.228 19.764 1.962
591 HD21 LEU 84 1HD2 LEU 84 24.159 19.196 5.140
592 HD22 LEU 84 2HD2 LEU 84 24.115 20.293 3.728
593 HD23 LEU 84 3HD2 LEU 84 22.694 20.143 4.771
594 H ARG 85 H ARG 85 19.418 16.155 4.747
595 HA ARG 85 HA ARG 85 20.216 13.970 6.616
596 HB2 ARG 85 2HB ARG 85 17.488 15.284 6.403
597 HB3 ARG 85 3HB ARG 85 17.773 13.704 7.167
598 HG2 ARG 85 2HG ARG 85 19.370 14.695 8.736
599 HG3 ARG 85 3HG ARG 85 19.198 16.284 7.971
600 HD2 ARG 85 2HD ARG 85 16.896 14.771 9.251
601 HD3 ARG 85 3HD ARG 85 17.874 15.983 10.093
602 HE ARG 85 HE ARG 85 17.153 17.526 8.128
603 HH11 ARG 85 1HH1 ARG 85 15.162 15.005 9.610
604 HH12 ARG 85 2HH1 ARG 85 13.658 15.821 9.239
605 HH21 ARG 85 1HH2 ARG 85 15.172 18.575 7.686
606 HH22 ARG 85 2HH2 ARG 85 13.665 17.762 8.047
607 H VAL 86 H VAL 86 20.645 12.280 5.505
608 HA VAL 86 HA VAL 86 18.833 11.483 3.302
609 HB VAL 86 HB VAL 86 21.876 11.440 3.151
610 HG11 VAL 86 1HG1 VAL 86 19.721 10.731 1.103
611 HG12 VAL 86 2HG1 VAL 86 21.476 10.724 0.817
612 HG13 VAL 86 3HG1 VAL 86 20.758 9.567 1.956
613 HG21 VAL 86 1HG2 VAL 86 21.052 13.734 2.908
614 HG22 VAL 86 2HG2 VAL 86 21.578 13.105 1.337
615 HG23 VAL 86 3HG2 VAL 86 19.845 13.195 1.713
616 H GLU 87 H GLU 87 17.913 10.038 4.781
617 HA GLU 87 HA GLU 87 19.462 7.562 5.144
618 HB2 GLU 87 2HB GLU 87 18.934 7.422 7.539
619 HB3 GLU 87 3HB GLU 87 19.943 8.841 7.195
620 HG2 GLU 87 2HG GLU 87 17.923 10.284 7.228
621 HG3 GLU 87 3HG GLU 87 16.911 8.868 7.545
622 H PHE 88 H PHE 88 18.054 5.757 5.898
623 HA PHE 88 HA PHE 88 15.568 5.861 4.466
624 HB2 PHE 88 2HB PHE 88 15.388 3.453 5.447
625 HB3 PHE 88 3HB PHE 88 16.545 3.852 4.169
626 HD1 PHE 88 HD1 PHE 88 16.158 3.022 7.749
627 HD2 PHE 88 HD2 PHE 88 18.931 3.900 4.584
628 HE1 PHE 88 HE1 PHE 88 18.024 2.185 9.151
629 HE2 PHE 88 HE2 PHE 88 20.802 3.082 5.996
630 HZ PHE 88 HZ PHE 88 20.348 2.221 8.276
631 HA PRO 89 HA PRO 89 12.613 6.721 7.591
632 HB2 PRO 89 2HB PRO 89 10.473 5.201 6.739
633 HB3 PRO 89 3HB PRO 89 10.997 6.723 5.941
634 HG2 PRO 89 2HG PRO 89 11.605 3.871 5.149
635 HG3 PRO 89 3HG PRO 89 11.139 5.252 4.097
636 HD2 PRO 89 2HD PRO 89 13.735 4.439 4.405
637 HD3 PRO 89 3HD PRO 89 13.299 6.158 4.160
638 H5' A 90 1H5* A 90 14.624 21.675 12.932
639 H5'' A 90 2H5* A 90 14.580 23.306 13.639
640 H4' A 90 H4* A 90 12.695 22.263 11.471
641 H3' A 90 H3* A 90 15.360 23.500 11.389
642 H2' A 90 1H2* A 90 14.851 25.561 10.431
643 HO2' A 90 2HO* A 90 13.570 24.528 8.723
644 H1' A 90 H1* A 90 12.468 26.131 11.547
645 H8 A 90 H8 A 90 15.779 26.641 11.837
646 H61 A 90 1H6 A 90 15.773 26.867 18.021
647 H62 A 90 2H6 A 90 16.674 27.251 16.567
648 H2 A 90 H2 A 90 11.949 24.992 16.711
649 HO5' A 90 H5T A 90 12.478 22.840 14.370
650 H5' A 91 1H5* A 91 12.796 19.742 8.432
651 H5'' A 91 2H5* A 91 12.118 21.277 9.018
652 H4' A 91 H4* A 91 11.711 18.666 10.525
653 H3' A 91 H3* A 91 10.677 19.255 7.902
654 H2' A 91 1H2* A 91 9.005 20.685 8.592
655 HO2' A 91 2HO* A 91 7.851 18.737 8.088
656 H1' A 91 H1* A 91 8.887 19.345 11.303
657 H8 A 91 H8 A 91 6.818 21.343 9.555
658 H61 A 91 1H6 A 91 7.081 26.083 13.539
659 H62 A 91 2H6 A 91 6.208 25.386 12.191
660 H2 A 91 H2 A 91 10.493 23.348 14.407
661 H5' C 92 1H5* C 92 10.396 15.696 5.916
662 H5'' C 92 2H5* C 92 9.063 16.459 6.813
663 H4' C 92 H4* C 92 8.109 14.590 5.646
664 H3' C 92 H3* C 92 8.033 14.770 8.443
665 H2' C 92 1H2* C 92 9.574 13.060 8.854
666 HO2' C 92 2HO* C 92 7.558 12.273 9.675
667 H1' C 92 H1* C 92 8.547 11.542 6.441
668 H41 C 92 1H4 C 92 13.815 8.145 7.666
669 H42 C 92 2H4 C 92 14.629 9.533 8.352
670 H5 C 92 H5 C 92 13.565 11.722 8.565
671 H6 C 92 H6 C 92 11.534 12.990 8.111
672 H5' A 93 1H5* A 93 3.385 13.554 5.754
673 H5'' A 93 2H5* A 93 4.680 12.374 5.461
674 H4' A 93 H4* A 93 3.946 14.334 3.284
675 H3' A 93 H3* A 93 1.845 13.034 4.363
676 H2' A 93 1H2* A 93 2.862 10.907 4.580
677 HO2' A 93 2HO* A 93 0.948 10.653 3.284
678 H1' A 93 H1* A 93 3.974 10.934 1.797
679 H8 A 93 H8 A 93 4.648 10.273 5.492
680 H61 A 93 1H6 A 93 8.626 5.982 3.360
681 H62 A 93 2H6 A 93 7.880 6.642 4.799
682 H2 A 93 H2 A 93 6.969 8.259 -0.107
683 H5' A 94 1H5* A 94 -0.913 15.640 2.189
684 H5'' A 94 2H5* A 94 -1.116 13.878 2.027
685 H4' A 94 H4* A 94 -1.407 15.729 -0.360
686 H3' A 94 H3* A 94 -3.045 16.012 1.898
687 H2' A 94 1H2* A 94 -3.925 13.822 1.805
688 HO2' A 94 2HO* A 94 -5.974 13.964 0.777
689 H1' A 94 H1* A 94 -3.965 14.065 -1.214
690 H8 A 94 H8 A 94 -5.575 12.031 -1.604
691 H61 A 94 1H6 A 94 -3.866 6.990 1.581
692 H62 A 94 2H6 A 94 -4.989 7.622 0.395
693 H2 A 94 H2 A 94 -1.207 10.347 2.774
694 H5' A 95 1H5* A 95 -1.810 16.507 -2.236
695 H5'' A 95 2H5* A 95 -0.667 17.695 -1.566
696 H4' A 95 H4* A 95 -0.276 17.755 -3.892
697 H3' A 95 H3* A 95 -1.047 20.054 -2.693
698 HO3' A 95 H3T A 95 -0.603 21.026 -4.759
699 H2' A 95 1H2* A 95 -3.344 20.088 -3.042
700 HO2' A 95 2HO* A 95 -2.687 21.766 -4.444
701 H1' A 95 H1* A 95 -3.577 18.730 -5.616
702 H8 A 95 H8 A 95 -5.527 19.866 -3.263
703 H61 A 95 1H6 A 95 -8.018 14.412 -1.694
704 H62 A 95 2H6 A 95 -8.179 16.153 -1.582
705 H2 A 95 H2 A 95 -4.280 13.613 -3.969
Start of MODEL 19
1 H VAL 6 H1 VAL 6 -1.363 0.774 -7.130
2 HA VAL 6 HA VAL 6 -2.292 1.161 -4.996
3 HB VAL 6 HB VAL 6 -0.773 -0.524 -3.886
4 HG11 VAL 6 1HG1 VAL 6 1.105 1.878 -3.706
5 HG12 VAL 6 2HG1 VAL 6 1.310 0.311 -2.895
6 HG13 VAL 6 3HG1 VAL 6 1.406 0.406 -4.662
7 HG21 VAL 6 1HG2 VAL 6 -1.031 2.186 -2.519
8 HG22 VAL 6 2HG2 VAL 6 -2.341 0.990 -2.671
9 HG23 VAL 6 3HG2 VAL 6 -0.883 0.602 -1.734
10 H ILE 7 H ILE 7 -2.268 3.257 -4.034
11 HA ILE 7 HA ILE 7 -1.162 5.282 -5.731
12 HB ILE 7 HB ILE 7 -2.388 5.432 -2.948
13 HG12 ILE 7 2HG1 ILE 7 -3.597 5.923 -5.704
14 HG13 ILE 7 3HG1 ILE 7 -3.825 4.447 -4.746
15 HG21 ILE 7 1HG2 ILE 7 -2.776 7.822 -3.471
16 HG22 ILE 7 2HG2 ILE 7 -1.049 7.454 -3.452
17 HG23 ILE 7 3HG2 ILE 7 -1.900 7.632 -5.005
18 HD11 ILE 7 1HD1 ILE 7 -4.721 7.256 -3.986
19 HD12 ILE 7 2HD1 ILE 7 -5.751 5.879 -4.405
20 HD13 ILE 7 3HD1 ILE 7 -4.800 5.843 -2.904
21 H ARG 8 H ARG 8 0.499 6.793 -5.327
22 HA ARG 8 HA ARG 8 2.862 5.756 -4.174
23 HB2 ARG 8 2HB ARG 8 2.914 7.425 -5.932
24 HB3 ARG 8 3HB ARG 8 2.016 8.574 -4.932
25 HG2 ARG 8 2HG ARG 8 4.383 9.175 -4.977
26 HG3 ARG 8 3HG ARG 8 3.907 8.698 -3.339
27 HD2 ARG 8 2HD ARG 8 6.090 7.730 -3.924
28 HD3 ARG 8 3HD ARG 8 4.893 6.455 -3.698
29 HE ARG 8 HE ARG 8 5.135 5.853 -5.914
30 HH11 ARG 8 1HH1 ARG 8 6.387 9.126 -5.481
31 HH12 ARG 8 2HH1 ARG 8 7.096 9.201 -7.074
32 HH21 ARG 8 1HH2 ARG 8 6.025 5.985 -8.013
33 HH22 ARG 8 2HH2 ARG 8 6.853 7.439 -8.523
34 H GLY 9 H GLY 9 3.884 6.013 -2.235
35 HA2 GLY 9 2HA GLY 9 4.168 6.447 -0.012
36 HA3 GLY 9 3HA GLY 9 3.194 7.915 -0.239
37 HA PRO 10 HA PRO 10 -0.059 4.516 0.748
38 HB2 PRO 10 2HB PRO 10 0.718 1.904 1.056
39 HB3 PRO 10 3HB PRO 10 0.354 2.628 -0.546
40 HG2 PRO 10 2HG PRO 10 3.058 2.224 0.759
41 HG3 PRO 10 3HG PRO 10 2.573 1.864 -0.928
42 HD2 PRO 10 2HD PRO 10 3.880 4.177 -0.230
43 HD3 PRO 10 3HD PRO 10 2.670 4.125 -1.546
44 H ALA 11 H ALA 11 2.762 5.239 2.317
45 HA ALA 11 HA ALA 11 3.501 5.261 4.449
46 HB1 ALA 11 1HB ALA 11 0.569 4.879 5.159
47 HB2 ALA 11 2HB ALA 11 1.842 5.519 6.217
48 HB3 ALA 11 3HB ALA 11 1.358 6.434 4.778
49 H GLY 12 H GLY 12 3.052 2.567 2.998
50 HA2 GLY 12 2HA GLY 12 2.815 0.648 5.183
51 HA3 GLY 12 3HA GLY 12 3.246 0.312 3.495
52 H ASN 13 H ASN 13 4.784 -1.160 4.868
53 HA ASN 13 HA ASN 13 7.027 0.044 6.178
54 HB2 ASN 13 2HB ASN 13 8.039 -2.215 5.935
55 HB3 ASN 13 3HB ASN 13 6.403 -2.259 6.620
56 HD21 ASN 13 1HD2 ASN 13 7.265 -4.237 3.174
57 HD22 ASN 13 2HD2 ASN 13 8.473 -3.380 4.104
58 H ASN 14 H ASN 14 9.206 0.224 5.464
59 HA ASN 14 HA ASN 14 9.474 1.145 2.728
60 HB2 ASN 14 2HB ASN 14 10.622 2.126 4.754
61 HB3 ASN 14 3HB ASN 14 11.624 0.668 4.824
62 HD21 ASN 14 1HD2 ASN 14 13.829 2.808 2.950
63 HD22 ASN 14 2HD2 ASN 14 13.377 2.359 4.585
64 H ASP 15 H ASP 15 11.193 0.318 1.261
65 HA ASP 15 HA ASP 15 12.116 -2.420 1.728
66 HB2 ASP 15 2HB ASP 15 9.948 -2.869 0.761
67 HB3 ASP 15 3HB ASP 15 10.212 -1.680 -0.523
68 H CYS 16 H CYS 16 11.886 0.251 -0.669
69 HA CYS 16 HA CYS 16 14.823 0.054 -1.022
70 HB2 CYS 16 2HB CYS 16 12.760 -0.012 -3.252
71 HB3 CYS 16 3HB CYS 16 14.478 0.377 -3.503
72 HG CYS 16 HG CYS 16 13.136 -2.344 -2.213
73 H ARG 17 H ARG 17 12.373 1.928 -0.024
74 HA ARG 17 HA ARG 17 13.089 4.333 -1.568
75 HB2 ARG 17 2HB ARG 17 11.007 3.886 0.605
76 HB3 ARG 17 3HB ARG 17 11.302 5.434 -0.218
77 HG2 ARG 17 2HG ARG 17 10.901 4.315 -2.413
78 HG3 ARG 17 3HG ARG 17 10.471 2.819 -1.549
79 HD2 ARG 17 2HD ARG 17 8.631 4.029 -0.411
80 HD3 ARG 17 3HD ARG 17 9.029 5.500 -1.311
81 HE ARG 17 HE ARG 17 8.630 4.076 -3.403
82 HH11 ARG 17 1HH1 ARG 17 6.922 3.527 -0.354
83 HH12 ARG 17 2HH1 ARG 17 5.548 2.774 -1.134
84 HH21 ARG 17 1HH2 ARG 17 6.845 3.099 -4.378
85 HH22 ARG 17 2HH2 ARG 17 5.494 2.545 -3.414
86 H ILE 18 H ILE 18 13.761 6.300 -0.610
87 HA ILE 18 HA ILE 18 15.137 6.015 2.025
88 HB ILE 18 HB ILE 18 16.994 7.277 1.204
89 HG12 ILE 18 2HG1 ILE 18 15.841 7.331 -1.591
90 HG13 ILE 18 3HG1 ILE 18 15.505 8.641 -0.441
91 HG21 ILE 18 1HG2 ILE 18 17.934 5.733 -0.453
92 HG22 ILE 18 2HG2 ILE 18 17.017 4.840 0.783
93 HG23 ILE 18 3HG2 ILE 18 16.314 5.109 -0.829
94 HD11 ILE 18 1HD1 ILE 18 17.455 9.209 -1.817
95 HD12 ILE 18 2HD1 ILE 18 17.928 9.013 -0.115
96 HD13 ILE 18 3HD1 ILE 18 18.277 7.724 -1.291
97 H TYR 19 H TYR 19 15.918 8.472 2.553
98 HA TYR 19 HA TYR 19 13.746 10.344 1.994
99 HB2 TYR 19 2HB TYR 19 12.660 9.568 3.810
100 HB3 TYR 19 3HB TYR 19 14.126 9.008 4.602
101 HD1 TYR 19 HD1 TYR 19 11.788 11.795 4.249
102 HD2 TYR 19 HD2 TYR 19 15.584 10.551 5.840
103 HE1 TYR 19 HE1 TYR 19 11.811 13.780 5.759
104 HE2 TYR 19 HE2 TYR 19 15.613 12.524 7.343
105 HH TYR 19 HH TYR 19 12.942 14.892 7.442
106 H VAL 20 H VAL 20 14.123 12.552 2.510
107 HA VAL 20 HA VAL 20 16.950 13.206 3.102
108 HB VAL 20 HB VAL 20 15.480 14.088 0.581
109 HG11 VAL 20 1HG1 VAL 20 17.687 15.156 0.046
110 HG12 VAL 20 2HG1 VAL 20 16.869 15.889 1.451
111 HG13 VAL 20 3HG1 VAL 20 18.227 14.782 1.701
112 HG21 VAL 20 1HG2 VAL 20 17.909 12.291 0.980
113 HG22 VAL 20 2HG2 VAL 20 16.315 11.794 0.358
114 HG23 VAL 20 3HG2 VAL 20 17.325 12.900 -0.587
115 H GLY 21 H GLY 21 16.455 14.279 4.973
116 HA2 GLY 21 2HA GLY 21 14.547 16.536 4.867
117 HA3 GLY 21 3HA GLY 21 15.416 15.957 6.295
118 H ASN 22 H ASN 22 15.381 18.660 5.804
119 HA ASN 22 HA ASN 22 16.648 20.511 5.447
120 HB2 ASN 22 2HB ASN 22 18.088 19.197 7.090
121 HB3 ASN 22 3HB ASN 22 19.038 18.657 5.706
122 HD21 ASN 22 1HD2 ASN 22 21.086 21.469 6.378
123 HD22 ASN 22 2HD2 ASN 22 20.925 19.724 6.481
124 H LEU 23 H LEU 23 15.807 18.900 3.101
125 HA LEU 23 HA LEU 23 17.791 18.684 1.128
126 HB2 LEU 23 2HB LEU 23 15.492 17.764 0.960
127 HB3 LEU 23 3HB LEU 23 14.847 19.410 0.870
128 HG LEU 23 HG LEU 23 16.302 19.735 -1.223
129 HD11 LEU 23 1HD1 LEU 23 16.982 17.700 -2.401
130 HD12 LEU 23 2HD1 LEU 23 17.767 17.723 -0.807
131 HD13 LEU 23 3HD1 LEU 23 16.351 16.686 -1.085
132 HD21 LEU 23 1HD2 LEU 23 14.089 17.635 -1.221
133 HD22 LEU 23 2HD2 LEU 23 13.865 19.402 -1.313
134 HD23 LEU 23 3HD2 LEU 23 14.656 18.531 -2.649
135 HA PRO 24 HA PRO 24 18.672 23.061 0.862
136 HB2 PRO 24 2HB PRO 24 20.710 22.957 -0.975
137 HB3 PRO 24 3HB PRO 24 20.904 22.464 0.739
138 HG2 PRO 24 2HG PRO 24 20.430 20.714 -1.682
139 HG3 PRO 24 3HG PRO 24 21.569 20.454 -0.319
140 HD2 PRO 24 2HD PRO 24 19.101 19.243 -0.475
141 HD3 PRO 24 3HD PRO 24 19.866 19.676 1.088
142 HA PRO 25 HA PRO 25 16.452 24.385 -2.715
143 HB2 PRO 25 2HB PRO 25 17.451 26.918 -3.091
144 HB3 PRO 25 3HB PRO 25 16.381 26.480 -1.722
145 HG2 PRO 25 2HG PRO 25 19.395 26.721 -1.748
146 HG3 PRO 25 3HG PRO 25 18.235 27.320 -0.515
147 HD2 PRO 25 2HD PRO 25 19.633 24.975 -0.240
148 HD3 PRO 25 3HD PRO 25 17.976 25.190 0.414
149 H ASP 26 H ASP 26 19.779 23.718 -2.768
150 HA ASP 26 HA ASP 26 20.345 24.592 -5.470
151 HB2 ASP 26 2HB ASP 26 21.787 22.752 -3.538
152 HB3 ASP 26 3HB ASP 26 22.395 23.157 -5.152
153 H ILE 27 H ILE 27 18.418 22.076 -4.321
154 HA ILE 27 HA ILE 27 19.145 20.020 -6.192
155 HB ILE 27 HB ILE 27 17.895 19.660 -4.052
156 HG12 ILE 27 2HG1 ILE 27 16.227 18.064 -4.912
157 HG13 ILE 27 3HG1 ILE 27 16.355 18.769 -6.524
158 HG21 ILE 27 1HG2 ILE 27 16.423 21.679 -4.225
159 HG22 ILE 27 2HG2 ILE 27 15.549 20.893 -5.555
160 HG23 ILE 27 3HG2 ILE 27 15.510 20.183 -3.929
161 HD11 ILE 27 1HD1 ILE 27 18.674 17.504 -5.000
162 HD12 ILE 27 2HD1 ILE 27 17.709 16.681 -6.249
163 HD13 ILE 27 3HD1 ILE 27 18.708 18.083 -6.685
164 H ARG 28 H ARG 28 18.014 19.392 -8.145
165 HA ARG 28 HA ARG 28 16.292 21.522 -9.321
166 HB2 ARG 28 2HB ARG 28 18.596 20.068 -10.672
167 HB3 ARG 28 3HB ARG 28 17.448 21.130 -11.498
168 HG2 ARG 28 2HG ARG 28 19.282 22.004 -9.216
169 HG3 ARG 28 3HG ARG 28 19.607 22.255 -10.938
170 HD2 ARG 28 2HD ARG 28 17.500 23.563 -11.140
171 HD3 ARG 28 3HD ARG 28 17.201 23.351 -9.410
172 HE ARG 28 HE ARG 28 19.359 24.977 -10.659
173 HH11 ARG 28 1HH1 ARG 28 17.638 23.912 -7.767
174 HH12 ARG 28 2HH1 ARG 28 18.228 25.224 -6.778
175 HH21 ARG 28 1HH2 ARG 28 20.152 26.667 -9.340
176 HH22 ARG 28 2HH2 ARG 28 19.676 26.766 -7.662
177 H THR 29 H THR 29 14.870 20.799 -11.009
178 HA THR 29 HA THR 29 13.649 18.338 -10.284
179 HB THR 29 HB THR 29 12.792 19.749 -12.768
180 HG1 THR 29 1HG THR 29 11.873 21.364 -11.491
181 HG21 THR 29 1HG2 THR 29 11.346 18.705 -10.292
182 HG22 THR 29 2HG2 THR 29 10.570 19.346 -11.762
183 HG23 THR 29 3HG2 THR 29 11.499 17.842 -11.841
184 H LYS 30 H LYS 30 16.397 18.366 -11.812
185 HA LYS 30 HA LYS 30 15.683 15.968 -13.395
186 HB2 LYS 30 2HB LYS 30 15.736 17.868 -14.979
187 HB3 LYS 30 3HB LYS 30 17.354 18.305 -14.409
188 HG2 LYS 30 2HG LYS 30 17.519 17.073 -16.513
189 HG3 LYS 30 3HG LYS 30 18.220 16.111 -15.200
190 HD2 LYS 30 2HD LYS 30 16.070 14.851 -15.009
191 HD3 LYS 30 3HD LYS 30 15.423 15.778 -16.382
192 HE2 LYS 30 2HE LYS 30 17.884 13.991 -16.411
193 HE3 LYS 30 3HE LYS 30 16.294 13.557 -17.063
194 HZ1 LYS 30 1HZ LYS 30 16.501 15.379 -18.606
195 HZ2 LYS 30 2HZ LYS 30 17.987 15.771 -18.016
196 HZ3 LYS 30 3HZ LYS 30 17.759 14.333 -18.779
197 H ASP 31 H ASP 31 18.154 17.958 -11.741
198 HA ASP 31 HA ASP 31 20.250 16.024 -11.920
199 HB2 ASP 31 2HB ASP 31 19.668 18.137 -9.816
200 HB3 ASP 31 3HB ASP 31 21.172 17.212 -9.930
201 H ILE 32 H ILE 32 17.322 16.195 -10.038
202 HA ILE 32 HA ILE 32 18.110 14.471 -7.899
203 HB ILE 32 HB ILE 32 16.216 16.075 -7.844
204 HG12 ILE 32 2HG1 ILE 32 15.192 13.237 -7.438
205 HG13 ILE 32 3HG1 ILE 32 16.405 13.981 -6.372
206 HG21 ILE 32 1HG2 ILE 32 14.825 14.064 -9.669
207 HG22 ILE 32 2HG2 ILE 32 14.090 15.515 -8.947
208 HG23 ILE 32 3HG2 ILE 32 15.378 15.681 -10.157
209 HD11 ILE 32 1HD1 ILE 32 13.611 15.065 -6.911
210 HD12 ILE 32 2HD1 ILE 32 14.160 14.256 -5.429
211 HD13 ILE 32 3HD1 ILE 32 14.838 15.837 -5.880
212 H GLU 33 H GLU 33 17.390 13.839 -11.260
213 HA GLU 33 HA GLU 33 17.211 10.952 -10.569
214 HB2 GLU 33 2HB GLU 33 15.718 10.603 -12.443
215 HB3 GLU 33 3HB GLU 33 15.029 11.780 -11.310
216 HG2 GLU 33 2HG GLU 33 15.741 13.631 -12.773
217 HG3 GLU 33 3HG GLU 33 16.490 12.474 -13.892
218 H ASP 34 H ASP 34 19.221 13.253 -11.822
219 HA ASP 34 HA ASP 34 20.360 11.370 -13.794
220 HB2 ASP 34 2HB ASP 34 20.875 14.281 -13.223
221 HB3 ASP 34 3HB ASP 34 22.008 13.298 -14.157
222 H VAL 35 H VAL 35 21.662 13.273 -10.994
223 HA VAL 35 HA VAL 35 24.087 11.718 -11.204
224 HB VAL 35 HB VAL 35 23.904 14.152 -10.504
225 HG11 VAL 35 1HG1 VAL 35 22.129 13.831 -8.758
226 HG12 VAL 35 2HG1 VAL 35 23.307 12.919 -7.781
227 HG13 VAL 35 3HG1 VAL 35 23.586 14.632 -8.132
228 HG21 VAL 35 1HG2 VAL 35 25.976 12.808 -10.327
229 HG22 VAL 35 2HG2 VAL 35 25.832 13.945 -8.968
230 HG23 VAL 35 3HG2 VAL 35 25.463 12.220 -8.731
231 H PHE 36 H PHE 36 21.316 11.685 -8.926
232 HA PHE 36 HA PHE 36 22.586 9.708 -7.221
233 HB2 PHE 36 2HB PHE 36 19.660 10.490 -7.475
234 HB3 PHE 36 3HB PHE 36 20.421 9.654 -6.113
235 HD1 PHE 36 HD1 PHE 36 22.499 10.956 -5.044
236 HD2 PHE 36 HD2 PHE 36 19.325 12.775 -7.303
237 HE1 PHE 36 HE1 PHE 36 23.009 13.153 -3.999
238 HE2 PHE 36 HE2 PHE 36 19.827 14.964 -6.253
239 HZ PHE 36 HZ PHE 36 21.664 15.151 -4.592
240 H SER 37 H SER 37 20.734 9.668 -10.207
241 HA SER 37 HA SER 37 19.913 6.904 -10.033
242 HB2 SER 37 2HB SER 37 18.786 8.500 -11.513
243 HB3 SER 37 3HB SER 37 20.304 8.768 -12.400
244 HG SER 37 HG SER 37 18.795 6.376 -12.217
245 H LYS 38 H LYS 38 22.845 8.636 -11.112
246 HA LYS 38 HA LYS 38 24.079 6.279 -12.253
247 HB2 LYS 38 2HB LYS 38 24.726 8.599 -12.837
248 HB3 LYS 38 3HB LYS 38 25.324 8.842 -11.181
249 HG2 LYS 38 2HG LYS 38 26.996 7.066 -11.486
250 HG3 LYS 38 3HG LYS 38 26.317 6.667 -13.070
251 HD2 LYS 38 2HD LYS 38 28.313 8.027 -13.392
252 HD3 LYS 38 3HD LYS 38 26.886 8.953 -13.885
253 HE2 LYS 38 2HE LYS 38 28.358 10.386 -12.604
254 HE3 LYS 38 3HE LYS 38 26.886 10.089 -11.665
255 HZ1 LYS 38 1HZ LYS 38 28.088 8.429 -10.419
256 HZ2 LYS 38 2HZ LYS 38 29.446 8.676 -11.310
257 HZ3 LYS 38 3HZ LYS 38 28.881 9.871 -10.335
258 H TYR 39 H TYR 39 23.752 7.671 -9.020
259 HA TYR 39 HA TYR 39 25.751 5.909 -7.868
260 HB2 TYR 39 2HB TYR 39 23.910 7.998 -6.806
261 HB3 TYR 39 3HB TYR 39 24.566 6.792 -5.694
262 HD1 TYR 39 HD1 TYR 39 25.872 9.004 -8.460
263 HD2 TYR 39 HD2 TYR 39 26.456 7.295 -4.564
264 HE1 TYR 39 HE1 TYR 39 27.992 10.283 -8.219
265 HE2 TYR 39 HE2 TYR 39 28.572 8.551 -4.315
266 HH TYR 39 HH TYR 39 30.028 10.046 -5.282
267 H GLY 40 H GLY 40 22.353 5.415 -8.559
268 HA2 GLY 40 2HA GLY 40 22.559 2.805 -7.267
269 HA3 GLY 40 3HA GLY 40 21.493 3.927 -6.411
270 H ALA 41 H ALA 41 21.619 4.224 -9.908
271 HA ALA 41 HA ALA 41 20.014 3.870 -11.488
272 HB1 ALA 41 1HB ALA 41 21.130 1.677 -11.360
273 HB2 ALA 41 2HB ALA 41 19.949 1.150 -10.137
274 HB3 ALA 41 3HB ALA 41 19.420 1.510 -11.800
275 H ILE 42 H ILE 42 18.898 5.381 -9.544
276 HA ILE 42 HA ILE 42 16.660 4.531 -8.156
277 HB ILE 42 HB ILE 42 17.258 7.102 -9.636
278 HG12 ILE 42 2HG1 ILE 42 17.208 6.460 -6.659
279 HG13 ILE 42 3HG1 ILE 42 18.661 6.310 -7.659
280 HG21 ILE 42 1HG2 ILE 42 14.981 6.568 -7.684
281 HG22 ILE 42 2HG2 ILE 42 15.442 8.156 -8.341
282 HG23 ILE 42 3HG2 ILE 42 14.800 6.915 -9.422
283 HD11 ILE 42 1HD1 ILE 42 18.621 8.488 -6.524
284 HD12 ILE 42 2HD1 ILE 42 18.516 8.689 -8.290
285 HD13 ILE 42 3HD1 ILE 42 17.066 8.882 -7.283
286 H ARG 43 H ARG 43 14.584 4.000 -8.583
287 HA ARG 43 HA ARG 43 13.819 3.682 -11.433
288 HB2 ARG 43 2HB ARG 43 12.747 2.501 -8.843
289 HB3 ARG 43 3HB ARG 43 12.013 2.231 -10.433
290 HG2 ARG 43 2HG ARG 43 14.133 1.269 -11.269
291 HG3 ARG 43 3HG ARG 43 14.881 1.505 -9.675
292 HD2 ARG 43 2HD ARG 43 12.367 -0.148 -10.169
293 HD3 ARG 43 3HD ARG 43 13.991 -0.827 -10.091
294 HE ARG 43 HE ARG 43 14.142 -0.189 -7.760
295 HH11 ARG 43 1HH1 ARG 43 10.910 0.156 -9.173
296 HH12 ARG 43 2HH1 ARG 43 10.119 0.157 -7.611
297 HH21 ARG 43 1HH2 ARG 43 13.076 -0.237 -5.775
298 HH22 ARG 43 2HH2 ARG 43 11.330 -0.058 -5.708
299 H ASP 44 H ASP 44 12.899 5.356 -8.447
300 HA ASP 44 HA ASP 44 11.011 6.991 -9.981
301 HB2 ASP 44 2HB ASP 44 10.149 5.121 -7.783
302 HB3 ASP 44 3HB ASP 44 9.287 6.638 -8.088
303 H ILE 45 H ILE 45 10.239 8.884 -8.930
304 HA ILE 45 HA ILE 45 11.853 9.731 -6.572
305 HB ILE 45 HB ILE 45 11.307 11.217 -9.171
306 HG12 ILE 45 2HG1 ILE 45 13.891 11.670 -8.605
307 HG13 ILE 45 3HG1 ILE 45 13.719 10.153 -7.706
308 HG21 ILE 45 1HG2 ILE 45 12.348 13.189 -8.074
309 HG22 ILE 45 2HG2 ILE 45 10.795 12.768 -7.351
310 HG23 ILE 45 3HG2 ILE 45 12.312 12.329 -6.519
311 HD11 ILE 45 1HD1 ILE 45 13.055 10.585 -10.659
312 HD12 ILE 45 2HD1 ILE 45 14.505 9.769 -10.028
313 HD13 ILE 45 3HD1 ILE 45 12.902 9.042 -9.791
314 H ASP 46 H ASP 46 10.800 11.280 -5.196
315 HA ASP 46 HA ASP 46 7.925 11.723 -5.646
316 HB2 ASP 46 2HB ASP 46 8.219 9.457 -4.552
317 HB3 ASP 46 3HB ASP 46 8.995 10.268 -3.190
318 H LEU 47 H LEU 47 9.909 13.615 -5.755
319 HA LEU 47 HA LEU 47 10.420 14.881 -3.221
320 HB2 LEU 47 2HB LEU 47 11.851 15.312 -5.134
321 HB3 LEU 47 3HB LEU 47 10.463 15.850 -6.099
322 HG LEU 47 HG LEU 47 10.151 17.787 -4.551
323 HD11 LEU 47 1HD1 LEU 47 11.141 16.812 -2.511
324 HD12 LEU 47 2HD1 LEU 47 12.734 16.758 -3.301
325 HD13 LEU 47 3HD1 LEU 47 11.965 18.321 -2.949
326 HD21 LEU 47 1HD2 LEU 47 11.516 18.014 -6.601
327 HD22 LEU 47 2HD2 LEU 47 12.147 19.033 -5.293
328 HD23 LEU 47 3HD2 LEU 47 12.959 17.503 -5.697
329 H LYS 48 H LYS 48 8.798 15.553 -1.925
330 HA LYS 48 HA LYS 48 6.410 16.837 -3.088
331 HB2 LYS 48 2HB LYS 48 7.089 16.280 -0.178
332 HB3 LYS 48 3HB LYS 48 5.496 16.628 -0.879
333 HG2 LYS 48 2HG LYS 48 5.721 14.474 -2.220
334 HG3 LYS 48 3HG LYS 48 7.201 14.132 -1.292
335 HD2 LYS 48 2HD LYS 48 5.778 14.443 0.820
336 HD3 LYS 48 3HD LYS 48 4.357 14.381 -0.239
337 HE2 LYS 48 2HE LYS 48 6.515 12.238 0.006
338 HE3 LYS 48 3HE LYS 48 4.894 12.145 0.715
339 HZ1 LYS 48 1HZ LYS 48 5.128 10.959 -1.381
340 HZ2 LYS 48 2HZ LYS 48 3.957 12.111 -1.440
341 HZ3 LYS 48 3HZ LYS 48 5.419 12.360 -2.168
342 H ASN 49 H ASN 49 5.870 19.022 -2.606
343 HA ASN 49 HA ASN 49 7.750 20.644 -1.057
344 HB2 ASN 49 2HB ASN 49 8.222 22.176 -2.998
345 HB3 ASN 49 3HB ASN 49 8.987 20.591 -3.089
346 HD21 ASN 49 1HD2 ASN 49 7.810 20.887 -6.476
347 HD22 ASN 49 2HD2 ASN 49 9.147 21.309 -5.428
348 H ARG 50 H ARG 50 4.677 19.928 -1.574
349 HA ARG 50 HA ARG 50 3.800 22.732 -1.081
350 HB2 ARG 50 2HB ARG 50 2.514 20.731 -2.975
351 HB3 ARG 50 3HB ARG 50 1.734 22.224 -2.435
352 HG2 ARG 50 2HG ARG 50 4.381 22.102 -3.944
353 HG3 ARG 50 3HG ARG 50 2.803 22.438 -4.677
354 HD2 ARG 50 2HD ARG 50 2.552 24.404 -3.151
355 HD3 ARG 50 3HD ARG 50 4.196 24.119 -2.550
356 HE ARG 50 HE ARG 50 3.410 25.101 -5.231
357 HH11 ARG 50 1HH1 ARG 50 5.993 24.108 -3.030
358 HH12 ARG 50 2HH1 ARG 50 7.246 24.903 -3.954
359 HH21 ARG 50 1HH2 ARG 50 5.072 26.104 -6.430
360 HH22 ARG 50 2HH2 ARG 50 6.730 26.018 -5.880
361 H ARG 51 H ARG 51 3.948 19.566 0.008
362 HA ARG 51 HA ARG 51 2.085 20.114 2.169
363 HB2 ARG 51 2HB ARG 51 0.542 19.358 0.368
364 HB3 ARG 51 3HB ARG 51 1.484 17.866 0.193
365 HG2 ARG 51 2HG ARG 51 0.877 17.163 2.445
366 HG3 ARG 51 3HG ARG 51 0.121 18.739 2.779
367 HD2 ARG 51 2HD ARG 51 -1.537 18.338 1.004
368 HD3 ARG 51 3HD ARG 51 -0.759 16.784 0.628
369 HE ARG 51 HE ARG 51 -1.734 17.173 3.392
370 HH11 ARG 51 1HH1 ARG 51 -2.267 15.786 0.182
371 HH12 ARG 51 2HH1 ARG 51 -3.371 14.563 0.758
372 HH21 ARG 51 1HH2 ARG 51 -3.210 15.589 4.119
373 HH22 ARG 51 2HH2 ARG 51 -3.947 14.487 2.977
374 H GLY 52 H GLY 52 2.228 18.459 3.860
375 HA2 GLY 52 2HA GLY 52 3.287 16.728 4.995
376 HA3 GLY 52 3HA GLY 52 4.314 16.419 3.581
377 H GLY 53 H GLY 53 4.094 19.741 4.570
378 HA2 GLY 53 2HA GLY 53 5.466 21.017 6.008
379 HA3 GLY 53 3HA GLY 53 6.476 19.593 6.306
380 HA PRO 54 HA PRO 54 8.794 22.481 3.513
381 HB2 PRO 54 2HB PRO 54 11.028 21.144 4.995
382 HB3 PRO 54 3HB PRO 54 10.810 22.882 4.606
383 HG2 PRO 54 2HG PRO 54 10.372 21.913 7.119
384 HG3 PRO 54 3HG PRO 54 9.332 23.198 6.416
385 HD2 PRO 54 2HD PRO 54 8.776 20.240 6.681
386 HD3 PRO 54 3HD PRO 54 7.666 21.622 6.900
387 HA PRO 55 HA PRO 55 9.740 19.725 0.326
388 HB2 PRO 55 2HB PRO 55 12.538 20.796 0.128
389 HB3 PRO 55 3HB PRO 55 11.279 20.666 -1.148
390 HG2 PRO 55 2HG PRO 55 11.859 23.059 0.020
391 HG3 PRO 55 3HG PRO 55 10.171 22.607 -0.382
392 HD2 PRO 55 2HD PRO 55 11.559 22.526 2.296
393 HD3 PRO 55 3HD PRO 55 9.878 23.006 1.896
394 H PHE 56 H PHE 56 10.202 17.607 0.273
395 HA PHE 56 HA PHE 56 12.746 16.493 1.125
396 HB2 PHE 56 2HB PHE 56 12.018 15.296 3.007
397 HB3 PHE 56 3HB PHE 56 11.298 16.875 3.279
398 HD1 PHE 56 HD1 PHE 56 10.737 13.470 3.462
399 HD2 PHE 56 HD2 PHE 56 8.794 17.061 2.105
400 HE1 PHE 56 HE1 PHE 56 8.528 12.394 3.774
401 HE2 PHE 56 HE2 PHE 56 6.586 15.960 2.368
402 HZ PHE 56 HZ PHE 56 6.455 13.611 3.177
403 H ALA 57 H ALA 57 12.493 13.965 0.755
404 HA ALA 57 HA ALA 57 10.421 13.460 -1.295
405 HB1 ALA 57 1HB ALA 57 13.411 13.253 -1.825
406 HB2 ALA 57 2HB ALA 57 12.107 12.865 -2.972
407 HB3 ALA 57 3HB ALA 57 12.351 14.541 -2.444
408 H PHE 58 H PHE 58 10.320 11.269 -2.029
409 HA PHE 58 HA PHE 58 11.618 9.304 -0.240
410 HB2 PHE 58 2HB PHE 58 8.787 9.342 -1.249
411 HB3 PHE 58 3HB PHE 58 9.582 7.856 -0.725
412 HD1 PHE 58 HD1 PHE 58 10.789 7.981 1.632
413 HD2 PHE 58 HD2 PHE 58 7.592 10.530 0.330
414 HE1 PHE 58 HE1 PHE 58 10.245 8.491 3.992
415 HE2 PHE 58 HE2 PHE 58 7.058 11.074 2.693
416 HZ PHE 58 HZ PHE 58 8.373 10.029 4.531
417 H VAL 59 H VAL 59 13.262 9.723 -2.075
418 HA VAL 59 HA VAL 59 12.803 8.723 -4.681
419 HB VAL 59 HB VAL 59 15.327 8.892 -2.988
420 HG11 VAL 59 1HG1 VAL 59 15.646 7.292 -4.848
421 HG12 VAL 59 2HG1 VAL 59 14.994 8.487 -5.995
422 HG13 VAL 59 3HG1 VAL 59 16.528 8.800 -5.154
423 HG21 VAL 59 1HG2 VAL 59 14.221 11.061 -3.397
424 HG22 VAL 59 2HG2 VAL 59 15.722 10.944 -4.334
425 HG23 VAL 59 3HG2 VAL 59 14.160 10.704 -5.144
426 H GLU 60 H GLU 60 13.129 6.682 -5.634
427 HA GLU 60 HA GLU 60 13.248 4.442 -3.667
428 HB2 GLU 60 2HB GLU 60 10.983 4.828 -4.485
429 HB3 GLU 60 3HB GLU 60 11.541 4.702 -6.166
430 HG2 GLU 60 2HG GLU 60 12.124 2.400 -5.905
431 HG3 GLU 60 3HG GLU 60 11.955 2.478 -4.138
432 H PHE 61 H PHE 61 14.867 3.111 -3.919
433 HA PHE 61 HA PHE 61 16.514 3.339 -6.325
434 HB2 PHE 61 2HB PHE 61 16.991 2.354 -3.539
435 HB3 PHE 61 3HB PHE 61 18.105 1.947 -4.846
436 HD1 PHE 61 HD1 PHE 61 16.337 4.989 -3.497
437 HD2 PHE 61 HD2 PHE 61 19.917 3.315 -5.183
438 HE1 PHE 61 HE1 PHE 61 17.443 7.193 -3.326
439 HE2 PHE 61 HE2 PHE 61 21.041 5.520 -4.981
440 HZ PHE 61 HZ PHE 61 19.790 7.468 -4.068
441 H GLU 62 H GLU 62 17.737 1.460 -7.154
442 HA GLU 62 HA GLU 62 15.972 -0.684 -7.938
443 HB2 GLU 62 2HB GLU 62 17.676 0.030 -9.464
444 HB3 GLU 62 3HB GLU 62 18.935 -0.108 -8.228
445 HG2 GLU 62 2HG GLU 62 19.145 -1.965 -9.754
446 HG3 GLU 62 3HG GLU 62 18.627 -2.574 -8.183
447 H ASP 63 H ASP 63 18.508 -0.238 -5.487
448 HA ASP 63 HA ASP 63 17.558 -2.595 -4.058
449 HB2 ASP 63 2HB ASP 63 20.335 -2.366 -5.215
450 HB3 ASP 63 3HB ASP 63 20.052 -3.271 -3.724
451 HA PRO 64 HA PRO 64 18.301 0.037 -0.652
452 HB2 PRO 64 2HB PRO 64 18.520 -1.774 1.406
453 HB3 PRO 64 3HB PRO 64 16.974 -1.410 0.581
454 HG2 PRO 64 2HG PRO 64 18.854 -3.734 0.112
455 HG3 PRO 64 3HG PRO 64 17.062 -3.750 0.228
456 HD2 PRO 64 2HD PRO 64 18.406 -3.747 -2.166
457 HD3 PRO 64 3HD PRO 64 16.819 -2.945 -1.958
458 H ARG 65 H ARG 65 20.615 -2.383 -1.649
459 HA ARG 65 HA ARG 65 22.665 -1.656 0.288
460 HB2 ARG 65 2HB ARG 65 22.822 -3.226 -2.317
461 HB3 ARG 65 3HB ARG 65 24.096 -3.129 -1.087
462 HG2 ARG 65 2HG ARG 65 21.332 -4.346 -0.729
463 HG3 ARG 65 3HG ARG 65 22.880 -5.213 -0.823
464 HD2 ARG 65 2HD ARG 65 22.001 -3.288 1.366
465 HD3 ARG 65 3HD ARG 65 22.161 -5.038 1.511
466 HE ARG 65 HE ARG 65 24.335 -3.046 1.479
467 HH11 ARG 65 1HH1 ARG 65 23.450 -6.468 1.279
468 HH12 ARG 65 2HH1 ARG 65 25.041 -7.020 1.736
469 HH21 ARG 65 1HH2 ARG 65 26.375 -3.781 2.052
470 HH22 ARG 65 2HH2 ARG 65 26.709 -5.499 2.178
471 H ASP 66 H ASP 66 21.485 -0.215 -2.608
472 HA ASP 66 HA ASP 66 24.008 0.988 -3.377
473 HB2 ASP 66 2HB ASP 66 21.135 1.563 -4.148
474 HB3 ASP 66 3HB ASP 66 22.537 2.394 -4.840
475 H ALA 67 H ALA 67 21.878 1.539 -0.802
476 HA ALA 67 HA ALA 67 22.054 4.405 -0.652
477 HB1 ALA 67 1HB ALA 67 21.505 2.308 1.495
478 HB2 ALA 67 2HB ALA 67 21.171 4.047 1.635
479 HB3 ALA 67 3HB ALA 67 20.280 3.066 0.452
480 H GLU 68 H GLU 68 24.392 1.941 -0.173
481 HA GLU 68 HA GLU 68 25.809 3.061 2.052
482 HB2 GLU 68 2HB GLU 68 26.721 1.266 -0.234
483 HB3 GLU 68 3HB GLU 68 27.667 1.602 1.235
484 HG2 GLU 68 2HG GLU 68 25.857 0.655 2.621
485 HG3 GLU 68 3HG GLU 68 24.901 0.319 1.166
486 H ASP 69 H ASP 69 25.516 4.032 -1.248
487 HA ASP 69 HA ASP 69 27.772 5.948 -0.873
488 HB2 ASP 69 2HB ASP 69 26.863 4.494 -3.374
489 HB3 ASP 69 3HB ASP 69 27.938 5.893 -3.388
490 H ALA 70 H ALA 70 24.483 5.409 -2.125
491 HA ALA 70 HA ALA 70 24.276 8.137 -3.128
492 HB1 ALA 70 1HB ALA 70 22.183 5.950 -2.836
493 HB2 ALA 70 2HB ALA 70 22.052 7.426 -3.826
494 HB3 ALA 70 3HB ALA 70 23.233 6.169 -4.251
495 H VAL 71 H VAL 71 23.968 6.752 -0.021
496 HA VAL 71 HA VAL 71 22.169 8.977 0.799
497 HB VAL 71 HB VAL 71 22.021 6.098 1.772
498 HG11 VAL 71 1HG1 VAL 71 20.060 6.803 3.021
499 HG12 VAL 71 2HG1 VAL 71 21.440 7.822 3.496
500 HG13 VAL 71 3HG1 VAL 71 20.189 8.448 2.383
501 HG21 VAL 71 1HG2 VAL 71 19.800 6.091 0.675
502 HG22 VAL 71 2HG2 VAL 71 20.119 7.717 0.024
503 HG23 VAL 71 3HG2 VAL 71 21.102 6.330 -0.505
504 H SER 72 H SER 72 24.527 6.475 1.881
505 HA SER 72 HA SER 72 24.999 7.739 4.415
506 HB2 SER 72 2HB SER 72 25.425 5.351 3.983
507 HB3 SER 72 3HB SER 72 26.669 5.780 2.793
508 HG SER 72 HG SER 72 27.539 5.305 4.867
509 H GLY 73 H GLY 73 25.969 8.550 1.211
510 HA2 GLY 73 2HA GLY 73 28.555 9.692 1.874
511 HA3 GLY 73 3HA GLY 73 27.676 9.834 0.346
512 H ARG 74 H ARG 74 25.392 10.767 2.541
513 HA ARG 74 HA ARG 74 26.369 13.564 2.749
514 HB2 ARG 74 2HB ARG 74 23.707 12.762 1.523
515 HB3 ARG 74 3HB ARG 74 24.266 14.420 1.823
516 HG2 ARG 74 2HG ARG 74 26.226 13.975 0.298
517 HG3 ARG 74 3HG ARG 74 25.513 12.396 -0.086
518 HD2 ARG 74 2HD ARG 74 24.290 15.138 -0.591
519 HD3 ARG 74 3HD ARG 74 24.891 14.010 -1.814
520 HE ARG 74 HE ARG 74 22.293 14.005 -0.587
521 HH11 ARG 74 1HH1 ARG 74 24.784 11.828 -1.840
522 HH12 ARG 74 2HH1 ARG 74 23.649 10.530 -2.144
523 HH21 ARG 74 1HH2 ARG 74 20.838 12.296 -1.028
524 HH22 ARG 74 2HH2 ARG 74 21.447 10.783 -1.666
525 H ASP 75 H ASP 75 25.292 10.987 4.428
526 HA ASP 75 HA ASP 75 23.118 12.072 5.931
527 HB2 ASP 75 2HB ASP 75 23.477 9.699 5.821
528 HB3 ASP 75 3HB ASP 75 25.111 9.858 6.470
529 H GLY 76 H GLY 76 23.098 13.639 7.449
530 HA2 GLY 76 2HA GLY 76 23.777 15.019 9.135
531 HA3 GLY 76 3HA GLY 76 25.033 13.819 9.525
532 H TYR 77 H TYR 77 24.673 15.608 6.412
533 HA TYR 77 HA TYR 77 27.501 16.163 6.549
534 HB2 TYR 77 2HB TYR 77 26.745 15.475 4.445
535 HB3 TYR 77 3HB TYR 77 25.398 16.621 4.455
536 HD1 TYR 77 HD1 TYR 77 29.136 16.466 4.391
537 HD2 TYR 77 HD2 TYR 77 25.600 18.724 3.445
538 HE1 TYR 77 HE1 TYR 77 30.530 18.139 3.190
539 HE2 TYR 77 HE2 TYR 77 26.988 20.399 2.243
540 HH TYR 77 HH TYR 77 30.548 20.080 1.982
541 H ASP 78 H ASP 78 28.590 17.971 6.740
542 HA ASP 78 HA ASP 78 27.467 20.048 8.347
543 HB2 ASP 78 2HB ASP 78 29.765 19.361 8.578
544 HB3 ASP 78 3HB ASP 78 30.112 19.784 6.896
545 H TYR 79 H TYR 79 25.645 20.770 7.041
546 HA TYR 79 HA TYR 79 26.203 22.299 4.613
547 HB2 TYR 79 2HB TYR 79 24.168 20.902 4.989
548 HB3 TYR 79 3HB TYR 79 23.688 21.980 6.300
549 HD1 TYR 79 HD1 TYR 79 24.532 21.930 2.669
550 HD2 TYR 79 HD2 TYR 79 22.365 23.848 5.831
551 HE1 TYR 79 HE1 TYR 79 23.411 23.394 0.993
552 HE2 TYR 79 HE2 TYR 79 21.220 25.318 4.173
553 HH TYR 79 HH TYR 79 21.000 25.871 1.963
554 H ASP 80 H ASP 80 24.892 24.554 4.700
555 HA ASP 80 HA ASP 80 26.396 26.262 6.395
556 HB2 ASP 80 2HB ASP 80 24.002 26.706 4.593
557 HB3 ASP 80 3HB ASP 80 24.837 28.006 5.453
558 H GLY 81 H GLY 81 26.070 25.763 8.561
559 HA2 GLY 81 2HA GLY 81 25.166 26.359 10.598
560 HA3 GLY 81 3HA GLY 81 23.800 27.117 9.761
561 H TYR 82 H TYR 82 23.974 24.073 8.446
562 HA TYR 82 HA TYR 82 22.420 22.774 10.601
563 HB2 TYR 82 2HB TYR 82 21.448 23.290 7.789
564 HB3 TYR 82 3HB TYR 82 20.749 22.063 8.847
565 HD1 TYR 82 HD1 TYR 82 19.288 22.631 10.665
566 HD2 TYR 82 HD2 TYR 82 21.300 25.693 8.418
567 HE1 TYR 82 HE1 TYR 82 17.822 24.342 11.703
568 HE2 TYR 82 HE2 TYR 82 19.834 27.420 9.450
569 HH TYR 82 HH TYR 82 17.274 26.565 11.811
570 H ARG 83 H ARG 83 21.737 20.440 9.849
571 HA ARG 83 HA ARG 83 23.998 19.169 8.389
572 HB2 ARG 83 2HB ARG 83 22.491 18.321 10.885
573 HB3 ARG 83 3HB ARG 83 23.576 17.268 9.966
574 HG2 ARG 83 2HG ARG 83 24.351 19.894 11.325
575 HG3 ARG 83 3HG ARG 83 24.696 18.269 11.942
576 HD2 ARG 83 2HD ARG 83 25.998 17.797 9.858
577 HD3 ARG 83 3HD ARG 83 25.740 19.473 9.342
578 HE ARG 83 HE ARG 83 26.938 20.154 11.451
579 HH11 ARG 83 1HH1 ARG 83 27.522 16.975 9.995
580 HH12 ARG 83 2HH1 ARG 83 29.130 16.839 10.663
581 HH21 ARG 83 1HH2 ARG 83 29.042 19.935 12.307
582 HH22 ARG 83 2HH2 ARG 83 29.983 18.503 11.962
583 H LEU 84 H LEU 84 23.425 17.678 6.882
584 HA LEU 84 HA LEU 84 20.726 17.590 5.906
585 HB2 LEU 84 2HB LEU 84 23.305 16.129 5.343
586 HB3 LEU 84 3HB LEU 84 21.798 15.504 4.671
587 HG LEU 84 HG LEU 84 23.041 16.975 3.106
588 HD11 LEU 84 1HD1 LEU 84 20.589 16.677 2.929
589 HD12 LEU 84 2HD1 LEU 84 20.346 18.110 3.962
590 HD13 LEU 84 3HD1 LEU 84 21.122 18.282 2.377
591 HD21 LEU 84 1HD2 LEU 84 23.916 18.576 4.827
592 HD22 LEU 84 2HD2 LEU 84 23.126 19.376 3.447
593 HD23 LEU 84 3HD2 LEU 84 22.270 19.233 4.996
594 H ARG 85 H ARG 85 19.224 15.885 5.905
595 HA ARG 85 HA ARG 85 19.730 13.679 7.849
596 HB2 ARG 85 2HB ARG 85 17.115 15.098 7.207
597 HB3 ARG 85 3HB ARG 85 17.229 13.554 8.066
598 HG2 ARG 85 2HG ARG 85 17.047 15.090 9.787
599 HG3 ARG 85 3HG ARG 85 18.784 14.756 9.723
600 HD2 ARG 85 2HD ARG 85 19.181 16.849 8.535
601 HD3 ARG 85 3HD ARG 85 17.444 17.105 8.314
602 HE ARG 85 HE ARG 85 17.284 17.921 10.479
603 HH11 ARG 85 1HH1 ARG 85 20.391 16.280 10.089
604 HH12 ARG 85 2HH1 ARG 85 20.985 16.788 11.654
605 HH21 ARG 85 1HH2 ARG 85 18.069 18.579 12.475
606 HH22 ARG 85 2HH2 ARG 85 19.676 18.134 13.004
607 H VAL 86 H VAL 86 20.757 13.400 5.373
608 HA VAL 86 HA VAL 86 18.881 12.056 3.599
609 HB VAL 86 HB VAL 86 21.923 12.245 3.696
610 HG11 VAL 86 1HG1 VAL 86 21.829 11.392 1.357
611 HG12 VAL 86 2HG1 VAL 86 21.281 10.193 2.544
612 HG13 VAL 86 3HG1 VAL 86 20.087 11.083 1.558
613 HG21 VAL 86 1HG2 VAL 86 19.885 13.528 1.831
614 HG22 VAL 86 2HG2 VAL 86 20.643 14.358 3.211
615 HG23 VAL 86 3HG2 VAL 86 21.639 13.811 1.843
616 H GLU 87 H GLU 87 17.894 10.407 4.764
617 HA GLU 87 HA GLU 87 19.543 8.024 5.114
618 HB2 GLU 87 2HB GLU 87 18.822 7.624 7.433
619 HB3 GLU 87 3HB GLU 87 19.766 9.125 7.320
620 HG2 GLU 87 2HG GLU 87 17.687 10.453 7.320
621 HG3 GLU 87 3HG GLU 87 16.712 8.975 7.348
622 H PHE 88 H PHE 88 18.241 6.059 5.415
623 HA PHE 88 HA PHE 88 15.646 6.375 4.110
624 HB2 PHE 88 2HB PHE 88 15.727 3.802 4.152
625 HB3 PHE 88 3HB PHE 88 16.792 4.710 3.074
626 HD1 PHE 88 HD1 PHE 88 19.152 4.584 3.228
627 HD2 PHE 88 HD2 PHE 88 16.689 2.840 6.288
628 HE1 PHE 88 HE1 PHE 88 21.144 3.446 4.180
629 HE2 PHE 88 HE2 PHE 88 18.674 1.701 7.241
630 HZ PHE 88 HZ PHE 88 20.906 2.008 6.189
631 HA PRO 89 HA PRO 89 13.118 5.868 7.663
632 HB2 PRO 89 2HB PRO 89 10.859 4.797 6.473
633 HB3 PRO 89 3HB PRO 89 11.305 6.535 6.410
634 HG2 PRO 89 2HG PRO 89 11.683 4.400 4.313
635 HG3 PRO 89 3HG PRO 89 11.238 6.118 4.099
636 HD2 PRO 89 2HD PRO 89 13.792 5.141 3.718
637 HD3 PRO 89 3HD PRO 89 13.450 6.820 4.236
638 H5' A 90 1H5* A 90 16.231 19.181 9.333
639 H5'' A 90 2H5* A 90 15.394 20.048 8.028
640 H4' A 90 H4* A 90 15.358 20.944 10.948
641 H3' A 90 H3* A 90 13.981 18.715 9.731
642 H2' A 90 1H2* A 90 11.879 19.538 9.241
643 HO2' A 90 2HO* A 90 11.521 20.066 11.486
644 H1' A 90 H1* A 90 12.231 22.214 8.951
645 H8 A 90 H8 A 90 12.370 18.971 7.425
646 H61 A 90 1H6 A 90 14.610 21.501 2.235
647 H62 A 90 2H6 A 90 13.778 20.115 2.906
648 H2 A 90 H2 A 90 15.106 24.450 5.529
649 HO5' A 90 H5T A 90 17.376 21.110 9.770
650 H5' A 91 1H5* A 91 15.385 16.281 10.610
651 H5'' A 91 2H5* A 91 13.757 16.861 10.201
652 H4' A 91 H4* A 91 13.755 14.486 9.938
653 H3' A 91 H3* A 91 12.150 15.715 12.071
654 H2' A 91 1H2* A 91 12.029 13.938 13.571
655 HO2' A 91 2HO* A 91 11.261 12.496 11.895
656 H1' A 91 H1* A 91 14.394 12.641 13.198
657 H8 A 91 H8 A 91 12.702 14.912 15.142
658 H61 A 91 1H6 A 91 17.919 17.734 16.955
659 H62 A 91 2H6 A 91 16.215 17.520 17.297
660 H2 A 91 H2 A 91 18.845 15.309 13.342
661 H5' C 92 1H5* C 92 10.382 15.152 6.779
662 H5'' C 92 2H5* C 92 8.842 15.655 7.494
663 H4' C 92 H4* C 92 8.321 14.062 5.779
664 H3' C 92 H3* C 92 7.427 13.676 8.326
665 H2' C 92 1H2* C 92 9.256 12.232 8.965
666 HO2' C 92 2HO* C 92 7.022 10.745 8.101
667 H1' C 92 H1* C 92 8.933 10.794 6.334
668 H41 C 92 1H4 C 92 14.372 8.094 8.226
669 H42 C 92 2H4 C 92 14.867 9.520 9.113
670 H5 C 92 H5 C 92 13.453 11.529 9.272
671 H6 C 92 H6 C 92 11.329 12.515 8.566
672 H5' A 93 1H5* A 93 5.266 13.641 4.834
673 H5'' A 93 2H5* A 93 3.659 13.953 5.515
674 H4' A 93 H4* A 93 3.506 13.651 3.083
675 H3' A 93 H3* A 93 1.883 12.379 4.935
676 H2' A 93 1H2* A 93 2.971 10.302 4.913
677 HO2' A 93 2HO* A 93 1.828 8.918 3.466
678 H1' A 93 H1* A 93 3.425 10.456 1.932
679 H8 A 93 H8 A 93 4.699 9.423 5.367
680 H61 A 93 1H6 A 93 8.133 5.249 2.325
681 H62 A 93 2H6 A 93 7.593 5.779 3.904
682 H2 A 93 H2 A 93 6.233 7.931 -0.664
683 H5' A 94 1H5* A 94 1.966 13.679 0.497
684 H5'' A 94 2H5* A 94 1.430 15.374 0.560
685 H4' A 94 H4* A 94 -0.030 13.231 -1.028
686 H3' A 94 H3* A 94 2.576 14.057 -1.611
687 H2' A 94 1H2* A 94 2.028 16.345 -1.892
688 HO2' A 94 2HO* A 94 1.534 15.086 -4.401
689 H1' A 94 H1* A 94 -0.525 15.473 -3.278
690 H8 A 94 H8 A 94 1.434 18.302 -3.205
691 H61 A 94 1H6 A 94 -3.243 21.915 -1.335
692 H62 A 94 2H6 A 94 -1.630 21.890 -2.018
693 H2 A 94 H2 A 94 -4.405 17.668 -0.630
694 H5' A 95 1H5* A 95 -0.928 10.296 -3.929
695 H5'' A 95 2H5* A 95 -1.113 12.056 -4.048
696 H4' A 95 H4* A 95 -3.262 11.031 -3.491
697 H3' A 95 H3* A 95 -2.092 13.161 -2.074
698 HO3' A 95 H3T A 95 -4.344 13.487 -1.516
699 H2' A 95 1H2* A 95 -1.639 11.908 -0.112
700 HO2' A 95 2HO* A 95 -3.464 12.149 1.317
701 H1' A 95 H1* A 95 -4.179 10.334 -0.629
702 H8 A 95 H8 A 95 -1.834 10.954 1.958
703 H61 A 95 1H6 A 95 -1.456 4.902 3.233
704 H62 A 95 2H6 A 95 -1.112 6.515 3.820
705 H2 A 95 H2 A 95 -3.317 5.342 -0.780
Start of MODEL 20
1 H VAL 6 H1 VAL 6 -3.277 9.418 -8.499
2 HA VAL 6 HA VAL 6 -2.530 7.259 -9.089
3 HB VAL 6 HB VAL 6 -0.767 8.155 -10.661
4 HG11 VAL 6 1HG1 VAL 6 1.486 8.500 -9.763
5 HG12 VAL 6 2HG1 VAL 6 0.366 9.666 -9.025
6 HG13 VAL 6 3HG1 VAL 6 0.906 8.235 -8.111
7 HG21 VAL 6 1HG2 VAL 6 -1.017 5.749 -10.056
8 HG22 VAL 6 2HG2 VAL 6 0.663 6.203 -10.395
9 HG23 VAL 6 3HG2 VAL 6 0.131 5.984 -8.715
10 H ILE 7 H ILE 7 -1.762 5.774 -7.503
11 HA ILE 7 HA ILE 7 -1.847 6.821 -4.814
12 HB ILE 7 HB ILE 7 -1.344 4.101 -6.049
13 HG12 ILE 7 2HG1 ILE 7 -3.404 3.496 -4.825
14 HG13 ILE 7 3HG1 ILE 7 -3.516 5.136 -4.165
15 HG21 ILE 7 1HG2 ILE 7 -1.250 4.837 -3.101
16 HG22 ILE 7 2HG2 ILE 7 -1.333 3.179 -3.734
17 HG23 ILE 7 3HG2 ILE 7 0.090 4.185 -4.073
18 HD11 ILE 7 1HD1 ILE 7 -3.593 4.483 -7.140
19 HD12 ILE 7 2HD1 ILE 7 -5.033 4.711 -6.121
20 HD13 ILE 7 3HD1 ILE 7 -3.918 6.064 -6.375
21 H ARG 8 H ARG 8 -0.220 7.291 -3.405
22 HA ARG 8 HA ARG 8 2.499 6.343 -3.910
23 HB2 ARG 8 2HB ARG 8 2.456 8.311 -5.358
24 HB3 ARG 8 3HB ARG 8 1.777 9.299 -4.056
25 HG2 ARG 8 2HG ARG 8 4.203 9.696 -4.329
26 HG3 ARG 8 3HG ARG 8 3.837 9.030 -2.733
27 HD2 ARG 8 2HD ARG 8 5.826 7.962 -3.694
28 HD3 ARG 8 3HD ARG 8 4.526 6.778 -3.501
29 HE ARG 8 HE ARG 8 4.037 7.157 -5.960
30 HH11 ARG 8 1HH1 ARG 8 7.287 7.633 -4.617
31 HH12 ARG 8 2HH1 ARG 8 8.064 7.347 -6.163
32 HH21 ARG 8 1HH2 ARG 8 5.122 6.811 -7.945
33 HH22 ARG 8 2HH2 ARG 8 6.870 6.915 -8.004
34 H GLY 9 H GLY 9 3.461 5.941 -2.016
35 HA2 GLY 9 2HA GLY 9 3.971 5.967 0.209
36 HA3 GLY 9 3HA GLY 9 3.503 7.670 0.189
37 HA PRO 10 HA PRO 10 -0.709 5.925 1.321
38 HB2 PRO 10 2HB PRO 10 -1.438 3.322 0.866
39 HB3 PRO 10 3HB PRO 10 -1.517 4.580 -0.408
40 HG2 PRO 10 2HG PRO 10 0.673 2.536 0.068
41 HG3 PRO 10 3HG PRO 10 -0.121 2.988 -1.476
42 HD2 PRO 10 2HD PRO 10 2.285 4.032 -0.712
43 HD3 PRO 10 3HD PRO 10 1.073 4.994 -1.619
44 H ALA 11 H ALA 11 2.019 3.753 1.843
45 HA ALA 11 HA ALA 11 1.576 3.704 4.701
46 HB1 ALA 11 1HB ALA 11 1.341 1.231 4.860
47 HB2 ALA 11 2HB ALA 11 -0.039 1.963 4.016
48 HB3 ALA 11 3HB ALA 11 1.234 1.137 3.086
49 H GLY 12 H GLY 12 3.276 2.242 5.757
50 HA2 GLY 12 2HA GLY 12 5.851 2.751 4.453
51 HA3 GLY 12 3HA GLY 12 5.578 2.154 6.104
52 H ASN 13 H ASN 13 3.683 0.352 3.935
53 HA ASN 13 HA ASN 13 5.298 -2.000 4.401
54 HB2 ASN 13 2HB ASN 13 3.502 -3.150 3.147
55 HB3 ASN 13 3HB ASN 13 2.879 -2.127 4.443
56 HD21 ASN 13 1HD2 ASN 13 0.582 -1.360 1.750
57 HD22 ASN 13 2HD2 ASN 13 0.896 -2.565 2.984
58 H ASN 14 H ASN 14 5.670 0.449 2.155
59 HA ASN 14 HA ASN 14 6.298 -1.089 -0.198
60 HB2 ASN 14 2HB ASN 14 7.022 1.726 0.705
61 HB3 ASN 14 3HB ASN 14 7.441 1.062 -0.884
62 HD21 ASN 14 1HD2 ASN 14 3.775 2.602 -0.299
63 HD22 ASN 14 2HD2 ASN 14 5.096 2.788 0.838
64 H ASP 15 H ASP 15 8.590 -0.953 -1.175
65 HA ASP 15 HA ASP 15 10.661 -1.396 0.883
66 HB2 ASP 15 2HB ASP 15 11.395 -3.460 -0.385
67 HB3 ASP 15 3HB ASP 15 9.926 -3.594 0.591
68 H CYS 16 H CYS 16 12.864 -1.735 -0.094
69 HA CYS 16 HA CYS 16 14.609 -0.763 -1.126
70 HB2 CYS 16 2HB CYS 16 12.718 -0.754 -3.505
71 HB3 CYS 16 3HB CYS 16 14.473 -0.468 -3.589
72 HG CYS 16 HG CYS 16 15.267 -2.686 -2.703
73 H ARG 17 H ARG 17 12.111 1.020 -0.144
74 HA ARG 17 HA ARG 17 13.101 3.535 -1.357
75 HB2 ARG 17 2HB ARG 17 10.592 2.853 0.207
76 HB3 ARG 17 3HB ARG 17 11.094 4.525 -0.127
77 HG2 ARG 17 2HG ARG 17 11.194 3.985 -2.558
78 HG3 ARG 17 3HG ARG 17 10.529 2.377 -2.206
79 HD2 ARG 17 2HD ARG 17 8.514 3.430 -1.225
80 HD3 ARG 17 3HD ARG 17 9.167 5.040 -1.586
81 HE ARG 17 HE ARG 17 9.244 3.950 -4.036
82 HH11 ARG 17 1HH1 ARG 17 6.681 3.951 -1.613
83 HH12 ARG 17 2HH1 ARG 17 5.403 3.734 -2.793
84 HH21 ARG 17 1HH2 ARG 17 7.601 3.667 -5.538
85 HH22 ARG 17 2HH2 ARG 17 5.924 3.613 -5.035
86 H ILE 18 H ILE 18 13.825 5.256 -0.179
87 HA ILE 18 HA ILE 18 14.209 4.894 2.747
88 HB ILE 18 HB ILE 18 16.446 5.718 2.657
89 HG12 ILE 18 2HG1 ILE 18 16.234 5.936 -0.365
90 HG13 ILE 18 3HG1 ILE 18 16.045 7.315 0.735
91 HG21 ILE 18 1HG2 ILE 18 16.091 3.295 2.196
92 HG22 ILE 18 2HG2 ILE 18 16.212 3.637 0.452
93 HG23 ILE 18 3HG2 ILE 18 17.607 3.930 1.519
94 HD11 ILE 18 1HD1 ILE 18 18.333 7.250 -0.067
95 HD12 ILE 18 2HD1 ILE 18 18.304 6.881 1.670
96 HD13 ILE 18 3HD1 ILE 18 18.520 5.569 0.488
97 H TYR 19 H TYR 19 15.227 7.249 3.458
98 HA TYR 19 HA TYR 19 13.349 9.232 2.315
99 HB2 TYR 19 2HB TYR 19 12.264 8.902 4.227
100 HB3 TYR 19 3HB TYR 19 13.685 8.351 5.103
101 HD1 TYR 19 HD1 TYR 19 15.345 9.972 5.976
102 HD2 TYR 19 HD2 TYR 19 11.570 11.225 4.344
103 HE1 TYR 19 HE1 TYR 19 15.583 12.160 7.120
104 HE2 TYR 19 HE2 TYR 19 11.793 13.412 5.511
105 HH TYR 19 HH TYR 19 13.170 14.765 6.767
106 H VAL 20 H VAL 20 13.845 11.368 2.191
107 HA VAL 20 HA VAL 20 16.590 12.165 2.920
108 HB VAL 20 HB VAL 20 15.389 12.595 0.157
109 HG11 VAL 20 1HG1 VAL 20 18.107 13.289 1.353
110 HG12 VAL 20 2HG1 VAL 20 17.665 13.473 -0.360
111 HG13 VAL 20 3HG1 VAL 20 16.839 14.448 0.875
112 HG21 VAL 20 1HG2 VAL 20 17.642 10.772 1.092
113 HG22 VAL 20 2HG2 VAL 20 16.084 10.271 0.392
114 HG23 VAL 20 3HG2 VAL 20 17.264 11.137 -0.611
115 H GLY 21 H GLY 21 16.759 14.310 3.533
116 HA2 GLY 21 2HA GLY 21 14.345 16.015 3.272
117 HA3 GLY 21 3HA GLY 21 14.945 15.627 4.890
118 H ASN 22 H ASN 22 14.794 18.210 4.253
119 HA ASN 22 HA ASN 22 15.890 20.170 4.077
120 HB2 ASN 22 2HB ASN 22 17.357 18.923 5.800
121 HB3 ASN 22 3HB ASN 22 18.495 18.681 4.468
122 HD21 ASN 22 1HD2 ASN 22 19.972 21.750 5.365
123 HD22 ASN 22 2HD2 ASN 22 20.150 20.013 5.232
124 H LEU 23 H LEU 23 15.412 18.581 1.637
125 HA LEU 23 HA LEU 23 17.648 18.789 -0.126
126 HB2 LEU 23 2HB LEU 23 14.641 18.712 -0.569
127 HB3 LEU 23 3HB LEU 23 15.811 18.724 -1.904
128 HG LEU 23 HG LEU 23 15.825 16.649 0.330
129 HD11 LEU 23 1HD1 LEU 23 14.649 16.484 -2.474
130 HD12 LEU 23 2HD1 LEU 23 14.783 15.137 -1.314
131 HD13 LEU 23 3HD1 LEU 23 13.721 16.522 -0.956
132 HD21 LEU 23 1HD2 LEU 23 17.158 16.836 -2.408
133 HD22 LEU 23 2HD2 LEU 23 17.977 16.889 -0.829
134 HD23 LEU 23 3HD2 LEU 23 17.184 15.391 -1.374
135 HA PRO 24 HA PRO 24 17.600 23.194 -0.704
136 HB2 PRO 24 2HB PRO 24 19.298 23.373 -2.852
137 HB3 PRO 24 3HB PRO 24 19.862 22.992 -1.196
138 HG2 PRO 24 2HG PRO 24 19.297 21.087 -3.484
139 HG3 PRO 24 3HG PRO 24 20.683 21.081 -2.348
140 HD2 PRO 24 2HD PRO 24 18.472 19.461 -2.060
141 HD3 PRO 24 3HD PRO 24 19.416 20.070 -0.666
142 HA PRO 25 HA PRO 25 14.559 23.637 -3.934
143 HB2 PRO 25 2HB PRO 25 14.449 26.365 -4.120
144 HB3 PRO 25 3HB PRO 25 13.810 25.465 -2.708
145 HG2 PRO 25 2HG PRO 25 16.473 26.882 -2.992
146 HG3 PRO 25 3HG PRO 25 15.333 26.908 -1.604
147 HD2 PRO 25 2HD PRO 25 17.560 25.289 -1.719
148 HD3 PRO 25 3HD PRO 25 16.063 24.827 -0.845
149 H ASP 26 H ASP 26 17.882 24.586 -4.205
150 HA ASP 26 HA ASP 26 17.646 25.727 -6.862
151 HB2 ASP 26 2HB ASP 26 19.997 25.072 -5.072
152 HB3 ASP 26 3HB ASP 26 20.170 25.740 -6.704
153 H ILE 27 H ILE 27 17.469 22.550 -5.883
154 HA ILE 27 HA ILE 27 19.249 21.327 -7.773
155 HB ILE 27 HB ILE 27 18.378 20.187 -5.742
156 HG12 ILE 27 2HG1 ILE 27 17.790 18.024 -6.765
157 HG13 ILE 27 3HG1 ILE 27 17.532 18.816 -8.330
158 HG21 ILE 27 1HG2 ILE 27 15.729 20.106 -7.256
159 HG22 ILE 27 2HG2 ILE 27 16.071 19.361 -5.678
160 HG23 ILE 27 3HG2 ILE 27 16.059 21.129 -5.838
161 HD11 ILE 27 1HD1 ILE 27 19.771 17.732 -8.159
162 HD12 ILE 27 2HD1 ILE 27 19.901 19.485 -8.413
163 HD13 ILE 27 3HD1 ILE 27 20.170 18.800 -6.791
164 H ARG 28 H ARG 28 18.829 20.422 -9.827
165 HA ARG 28 HA ARG 28 16.730 21.830 -11.316
166 HB2 ARG 28 2HB ARG 28 18.964 21.717 -12.251
167 HB3 ARG 28 3HB ARG 28 18.967 19.944 -12.136
168 HG2 ARG 28 2HG ARG 28 17.206 19.775 -13.808
169 HG3 ARG 28 3HG ARG 28 17.023 21.549 -13.846
170 HD2 ARG 28 2HD ARG 28 19.296 21.801 -14.689
171 HD3 ARG 28 3HD ARG 28 19.594 20.061 -14.520
172 HE ARG 28 HE ARG 28 17.706 21.317 -16.474
173 HH11 ARG 28 1HH1 ARG 28 19.785 18.614 -15.482
174 HH12 ARG 28 2HH1 ARG 28 19.601 17.776 -17.000
175 HH21 ARG 28 1HH2 ARG 28 17.486 20.184 -18.436
176 HH22 ARG 28 2HH2 ARG 28 18.287 18.648 -18.660
177 H THR 29 H THR 29 15.137 20.780 -12.615
178 HA THR 29 HA THR 29 13.842 18.689 -11.221
179 HB THR 29 HB THR 29 12.984 19.391 -13.984
180 HG1 THR 29 1HG THR 29 12.173 21.339 -13.169
181 HG21 THR 29 1HG2 THR 29 10.778 19.412 -12.865
182 HG22 THR 29 2HG2 THR 29 11.627 17.887 -12.532
183 HG23 THR 29 3HG2 THR 29 11.568 19.157 -11.290
184 H LYS 30 H LYS 30 16.530 18.059 -12.706
185 HA LYS 30 HA LYS 30 15.670 15.342 -13.443
186 HB2 LYS 30 2HB LYS 30 15.529 16.666 -15.562
187 HB3 LYS 30 3HB LYS 30 17.217 17.163 -15.337
188 HG2 LYS 30 2HG LYS 30 17.105 15.351 -16.946
189 HG3 LYS 30 3HG LYS 30 17.920 14.776 -15.478
190 HD2 LYS 30 2HD LYS 30 15.779 13.760 -14.705
191 HD3 LYS 30 3HD LYS 30 14.986 14.316 -16.196
192 HE2 LYS 30 2HE LYS 30 17.344 12.398 -16.019
193 HE3 LYS 30 3HE LYS 30 15.665 11.935 -16.330
194 HZ1 LYS 30 1HZ LYS 30 17.313 13.651 -18.063
195 HZ2 LYS 30 2HZ LYS 30 16.881 12.090 -18.364
196 HZ3 LYS 30 3HZ LYS 30 15.735 13.263 -18.334
197 H ASP 31 H ASP 31 18.242 17.693 -12.692
198 HA ASP 31 HA ASP 31 20.342 15.768 -12.493
199 HB2 ASP 31 2HB ASP 31 19.906 18.360 -10.976
200 HB3 ASP 31 3HB ASP 31 21.407 17.423 -10.985
201 H ILE 32 H ILE 32 17.508 16.349 -10.618
202 HA ILE 32 HA ILE 32 18.412 15.373 -8.081
203 HB ILE 32 HB ILE 32 16.437 16.820 -8.449
204 HG12 ILE 32 2HG1 ILE 32 15.605 14.164 -7.219
205 HG13 ILE 32 3HG1 ILE 32 16.742 15.281 -6.438
206 HG21 ILE 32 1HG2 ILE 32 15.618 15.727 -10.535
207 HG22 ILE 32 2HG2 ILE 32 15.132 14.304 -9.584
208 HG23 ILE 32 3HG2 ILE 32 14.339 15.871 -9.311
209 HD11 ILE 32 1HD1 ILE 32 13.857 15.883 -7.213
210 HD12 ILE 32 2HD1 ILE 32 14.496 15.677 -5.573
211 HD13 ILE 32 3HD1 ILE 32 15.003 17.079 -6.547
212 H GLU 33 H GLU 33 17.727 13.721 -11.086
213 HA GLU 33 HA GLU 33 17.835 11.188 -9.527
214 HB2 GLU 33 2HB GLU 33 16.322 10.129 -11.094
215 HB3 GLU 33 3HB GLU 33 15.548 11.528 -10.332
216 HG2 GLU 33 2HG GLU 33 16.014 12.890 -12.341
217 HG3 GLU 33 3HG GLU 33 16.825 11.510 -13.102
218 H ASP 34 H ASP 34 19.253 13.149 -11.974
219 HA ASP 34 HA ASP 34 20.496 10.954 -13.395
220 HB2 ASP 34 2HB ASP 34 20.981 13.928 -13.310
221 HB3 ASP 34 3HB ASP 34 22.065 12.821 -14.172
222 H VAL 35 H VAL 35 21.628 13.150 -10.767
223 HA VAL 35 HA VAL 35 24.174 11.802 -10.634
224 HB VAL 35 HB VAL 35 23.664 14.189 -9.905
225 HG11 VAL 35 1HG1 VAL 35 21.659 13.617 -8.509
226 HG12 VAL 35 2HG1 VAL 35 22.735 12.781 -7.362
227 HG13 VAL 35 3HG1 VAL 35 22.894 14.531 -7.618
228 HG21 VAL 35 1HG2 VAL 35 25.794 13.019 -9.421
229 HG22 VAL 35 2HG2 VAL 35 25.326 14.100 -8.094
230 HG23 VAL 35 3HG2 VAL 35 25.085 12.344 -7.934
231 H PHE 36 H PHE 36 21.025 11.331 -9.137
232 HA PHE 36 HA PHE 36 22.023 9.449 -7.183
233 HB2 PHE 36 2HB PHE 36 19.295 10.344 -8.047
234 HB3 PHE 36 3HB PHE 36 19.495 8.954 -6.986
235 HD1 PHE 36 HD1 PHE 36 19.808 12.605 -7.252
236 HD2 PHE 36 HD2 PHE 36 20.442 9.193 -4.717
237 HE1 PHE 36 HE1 PHE 36 20.017 14.105 -5.290
238 HE2 PHE 36 HE2 PHE 36 20.666 10.693 -2.754
239 HZ PHE 36 HZ PHE 36 20.453 13.149 -3.036
240 H SER 37 H SER 37 20.794 9.160 -10.481
241 HA SER 37 HA SER 37 20.540 6.290 -10.398
242 HB2 SER 37 2HB SER 37 19.424 7.624 -12.110
243 HB3 SER 37 3HB SER 37 20.986 8.227 -12.705
244 HG SER 37 HG SER 37 20.201 6.453 -13.924
245 H LYS 38 H LYS 38 23.218 8.577 -10.924
246 HA LYS 38 HA LYS 38 25.067 6.573 -11.874
247 HB2 LYS 38 2HB LYS 38 25.321 8.974 -12.375
248 HB3 LYS 38 3HB LYS 38 25.472 9.335 -10.652
249 HG2 LYS 38 2HG LYS 38 27.671 9.317 -11.742
250 HG3 LYS 38 3HG LYS 38 27.560 8.057 -10.509
251 HD2 LYS 38 2HD LYS 38 28.667 7.228 -12.563
252 HD3 LYS 38 3HD LYS 38 27.164 6.348 -12.241
253 HE2 LYS 38 2HE LYS 38 27.345 6.898 -14.627
254 HE3 LYS 38 3HE LYS 38 25.970 7.738 -13.893
255 HZ1 LYS 38 1HZ LYS 38 28.608 8.920 -14.433
256 HZ2 LYS 38 2HZ LYS 38 27.236 9.180 -15.303
257 HZ3 LYS 38 3HZ LYS 38 27.339 9.705 -13.747
258 H TYR 39 H TYR 39 24.040 7.754 -8.689
259 HA TYR 39 HA TYR 39 26.254 6.409 -7.369
260 HB2 TYR 39 2HB TYR 39 24.101 8.256 -6.529
261 HB3 TYR 39 3HB TYR 39 24.749 7.160 -5.312
262 HD1 TYR 39 HD1 TYR 39 26.496 7.879 -4.042
263 HD2 TYR 39 HD2 TYR 39 26.083 9.432 -8.030
264 HE1 TYR 39 HE1 TYR 39 28.458 9.347 -3.667
265 HE2 TYR 39 HE2 TYR 39 28.035 10.916 -7.664
266 HH TYR 39 HH TYR 39 29.655 11.605 -6.187
267 H GLY 40 H GLY 40 23.064 5.359 -8.290
268 HA2 GLY 40 2HA GLY 40 23.588 2.790 -7.107
269 HA3 GLY 40 3HA GLY 40 22.430 3.696 -6.122
270 H ALA 41 H ALA 41 22.455 4.219 -9.617
271 HA ALA 41 HA ALA 41 20.835 3.884 -11.167
272 HB1 ALA 41 1HB ALA 41 21.910 1.666 -11.131
273 HB2 ALA 41 2HB ALA 41 20.741 1.122 -9.898
274 HB3 ALA 41 3HB ALA 41 20.181 1.556 -11.530
275 H ILE 42 H ILE 42 19.983 5.001 -8.579
276 HA ILE 42 HA ILE 42 17.527 4.076 -7.643
277 HB ILE 42 HB ILE 42 18.808 6.779 -7.952
278 HG12 ILE 42 2HG1 ILE 42 17.855 5.344 -5.454
279 HG13 ILE 42 3HG1 ILE 42 19.387 4.917 -6.230
280 HG21 ILE 42 1HG2 ILE 42 16.053 6.289 -6.736
281 HG22 ILE 42 2HG2 ILE 42 16.984 7.801 -6.645
282 HG23 ILE 42 3HG2 ILE 42 16.391 7.231 -8.212
283 HD11 ILE 42 1HD1 ILE 42 19.698 6.591 -4.413
284 HD12 ILE 42 2HD1 ILE 42 20.224 7.192 -5.996
285 HD13 ILE 42 3HD1 ILE 42 18.669 7.725 -5.311
286 H ARG 43 H ARG 43 15.410 4.208 -8.266
287 HA ARG 43 HA ARG 43 15.066 4.794 -11.168
288 HB2 ARG 43 2HB ARG 43 13.573 2.929 -9.289
289 HB3 ARG 43 3HB ARG 43 13.146 3.196 -10.985
290 HG2 ARG 43 2HG ARG 43 15.802 2.093 -9.988
291 HG3 ARG 43 3HG ARG 43 14.496 1.154 -10.735
292 HD2 ARG 43 2HD ARG 43 14.694 2.614 -12.770
293 HD3 ARG 43 3HD ARG 43 16.129 3.364 -12.046
294 HE ARG 43 HE ARG 43 17.048 0.953 -11.963
295 HH11 ARG 43 1HH1 ARG 43 14.855 2.148 -14.472
296 HH12 ARG 43 2HH1 ARG 43 15.432 1.012 -15.671
297 HH21 ARG 43 1HH2 ARG 43 17.782 -0.480 -13.530
298 HH22 ARG 43 2HH2 ARG 43 17.099 -0.477 -15.143
299 H ASP 44 H ASP 44 13.963 5.874 -8.001
300 HA ASP 44 HA ASP 44 12.308 7.835 -9.460
301 HB2 ASP 44 2HB ASP 44 10.895 5.736 -8.990
302 HB3 ASP 44 3HB ASP 44 11.044 6.140 -7.274
303 H ILE 45 H ILE 45 11.678 9.620 -8.184
304 HA ILE 45 HA ILE 45 12.761 9.806 -5.419
305 HB ILE 45 HB ILE 45 12.767 12.050 -7.469
306 HG12 ILE 45 2HG1 ILE 45 14.403 10.284 -8.136
307 HG13 ILE 45 3HG1 ILE 45 15.109 11.865 -7.757
308 HG21 ILE 45 1HG2 ILE 45 12.587 12.791 -5.182
309 HG22 ILE 45 2HG2 ILE 45 13.955 11.773 -4.685
310 HG23 ILE 45 3HG2 ILE 45 14.219 13.158 -5.771
311 HD11 ILE 45 1HD1 ILE 45 15.844 11.074 -5.563
312 HD12 ILE 45 2HD1 ILE 45 15.019 9.516 -5.813
313 HD13 ILE 45 3HD1 ILE 45 16.422 9.956 -6.813
314 H ASP 46 H ASP 46 10.952 10.004 -4.148
315 HA ASP 46 HA ASP 46 8.521 11.158 -5.306
316 HB2 ASP 46 2HB ASP 46 8.418 9.169 -3.846
317 HB3 ASP 46 3HB ASP 46 9.091 10.126 -2.512
318 H LEU 47 H LEU 47 10.411 13.109 -5.470
319 HA LEU 47 HA LEU 47 10.662 14.844 -3.268
320 HB2 LEU 47 2HB LEU 47 11.876 15.229 -5.336
321 HB3 LEU 47 3HB LEU 47 10.361 15.417 -6.237
322 HG LEU 47 HG LEU 47 9.816 17.438 -4.849
323 HD11 LEU 47 1HD1 LEU 47 11.183 16.900 -2.855
324 HD12 LEU 47 2HD1 LEU 47 12.661 17.038 -3.828
325 HD13 LEU 47 3HD1 LEU 47 11.651 18.472 -3.541
326 HD21 LEU 47 1HD2 LEU 47 11.434 18.917 -5.953
327 HD22 LEU 47 2HD2 LEU 47 12.503 17.536 -6.282
328 HD23 LEU 47 3HD2 LEU 47 10.903 17.631 -7.060
329 H LYS 48 H LYS 48 9.205 15.878 -2.049
330 HA LYS 48 HA LYS 48 6.576 16.586 -3.208
331 HB2 LYS 48 2HB LYS 48 6.395 14.264 -2.424
332 HB3 LYS 48 3HB LYS 48 6.978 14.753 -0.818
333 HG2 LYS 48 2HG LYS 48 4.988 15.989 -0.367
334 HG3 LYS 48 3HG LYS 48 4.523 16.004 -2.079
335 HD2 LYS 48 2HD LYS 48 3.125 14.435 -0.862
336 HD3 LYS 48 3HD LYS 48 4.144 13.562 -2.012
337 HE2 LYS 48 2HE LYS 48 4.886 13.907 0.923
338 HE3 LYS 48 3HE LYS 48 3.891 12.563 0.350
339 HZ1 LYS 48 1HZ LYS 48 5.674 11.896 -1.091
340 HZ2 LYS 48 2HZ LYS 48 6.621 13.141 -0.585
341 HZ3 LYS 48 3HZ LYS 48 6.192 11.950 0.463
342 H ASN 49 H ASN 49 5.488 18.208 -2.123
343 HA ASN 49 HA ASN 49 7.181 19.969 -0.535
344 HB2 ASN 49 2HB ASN 49 4.277 20.175 -1.428
345 HB3 ASN 49 3HB ASN 49 5.206 21.485 -0.684
346 HD21 ASN 49 1HD2 ASN 49 5.243 21.843 -4.434
347 HD22 ASN 49 2HD2 ASN 49 3.978 21.693 -3.231
348 H ARG 50 H ARG 50 6.079 21.120 1.397
349 HA ARG 50 HA ARG 50 4.580 19.197 3.096
350 HB2 ARG 50 2HB ARG 50 7.033 20.746 4.012
351 HB3 ARG 50 3HB ARG 50 6.042 19.634 4.981
352 HG2 ARG 50 2HG ARG 50 6.674 17.805 3.322
353 HG3 ARG 50 3HG ARG 50 7.829 18.954 2.606
354 HD2 ARG 50 2HD ARG 50 9.035 17.611 4.203
355 HD3 ARG 50 3HD ARG 50 8.863 19.231 4.889
356 HE ARG 50 HE ARG 50 7.237 16.825 5.655
357 HH11 ARG 50 1HH1 ARG 50 8.594 19.997 6.486
358 HH12 ARG 50 2HH1 ARG 50 8.079 19.876 8.155
359 HH21 ARG 50 1HH2 ARG 50 6.556 16.754 7.773
360 HH22 ARG 50 2HH2 ARG 50 6.959 18.050 8.893
361 H ARG 51 H ARG 51 3.782 20.336 5.123
362 HA ARG 51 HA ARG 51 2.357 22.726 4.394
363 HB2 ARG 51 2HB ARG 51 1.493 21.020 5.950
364 HB3 ARG 51 3HB ARG 51 2.797 21.386 7.094
365 HG2 ARG 51 2HG ARG 51 1.946 23.661 7.408
366 HG3 ARG 51 3HG ARG 51 0.722 23.407 6.142
367 HD2 ARG 51 2HD ARG 51 -0.280 21.586 7.497
368 HD3 ARG 51 3HD ARG 51 0.935 21.857 8.754
369 HE ARG 51 HE ARG 51 -0.157 23.830 9.405
370 HH11 ARG 51 1HH1 ARG 51 -1.627 22.476 6.492
371 HH12 ARG 51 2HH1 ARG 51 -3.052 23.485 6.591
372 HH21 ARG 51 1HH2 ARG 51 -2.022 25.148 9.512
373 HH22 ARG 51 2HH2 ARG 51 -3.269 25.006 8.295
374 H GLY 52 H GLY 52 5.518 22.142 5.724
375 HA2 GLY 52 2HA GLY 52 6.219 24.927 5.583
376 HA3 GLY 52 3HA GLY 52 6.033 24.403 7.265
377 H GLY 53 H GLY 53 8.497 25.258 6.497
378 HA2 GLY 53 2HA GLY 53 10.707 24.595 6.683
379 HA3 GLY 53 3HA GLY 53 10.163 22.933 6.926
380 HA PRO 54 HA PRO 54 12.123 23.360 2.687
381 HB2 PRO 54 2HB PRO 54 14.049 21.412 3.024
382 HB3 PRO 54 3HB PRO 54 14.287 23.132 3.475
383 HG2 PRO 54 2HG PRO 54 13.531 20.799 5.248
384 HG3 PRO 54 3HG PRO 54 14.720 22.101 5.569
385 HD2 PRO 54 2HD PRO 54 12.172 22.141 6.579
386 HD3 PRO 54 3HD PRO 54 13.035 23.637 6.117
387 HA PRO 55 HA PRO 55 9.927 19.802 1.194
388 HB2 PRO 55 2HB PRO 55 11.281 19.216 -1.128
389 HB3 PRO 55 3HB PRO 55 10.204 20.639 -0.949
390 HG2 PRO 55 2HG PRO 55 13.224 20.530 -0.750
391 HG3 PRO 55 3HG PRO 55 12.198 21.746 -1.574
392 HD2 PRO 55 2HD PRO 55 13.260 22.134 0.929
393 HD3 PRO 55 3HD PRO 55 11.681 22.817 0.441
394 H PHE 56 H PHE 56 10.242 17.465 0.555
395 HA PHE 56 HA PHE 56 12.785 16.242 1.443
396 HB2 PHE 56 2HB PHE 56 11.864 15.098 3.253
397 HB3 PHE 56 3HB PHE 56 11.101 16.676 3.416
398 HD1 PHE 56 HD1 PHE 56 8.769 16.741 1.818
399 HD2 PHE 56 HD2 PHE 56 10.532 13.321 3.741
400 HE1 PHE 56 HE1 PHE 56 6.556 15.618 1.864
401 HE2 PHE 56 HE2 PHE 56 8.317 12.228 3.840
402 HZ PHE 56 HZ PHE 56 6.325 13.367 2.883
403 H ALA 57 H ALA 57 12.452 13.726 1.064
404 HA ALA 57 HA ALA 57 10.454 13.135 -1.000
405 HB1 ALA 57 1HB ALA 57 13.431 13.098 -1.639
406 HB2 ALA 57 2HB ALA 57 12.109 12.641 -2.730
407 HB3 ALA 57 3HB ALA 57 12.293 14.337 -2.208
408 H PHE 58 H PHE 58 10.291 10.923 -1.511
409 HA PHE 58 HA PHE 58 11.975 9.101 0.137
410 HB2 PHE 58 2HB PHE 58 9.210 8.679 -1.010
411 HB3 PHE 58 3HB PHE 58 10.198 7.404 -0.294
412 HD1 PHE 58 HD1 PHE 58 7.895 10.073 0.347
413 HD2 PHE 58 HD2 PHE 58 10.944 7.634 2.142
414 HE1 PHE 58 HE1 PHE 58 7.100 10.738 2.607
415 HE2 PHE 58 HE2 PHE 58 10.118 8.252 4.394
416 HZ PHE 58 HZ PHE 58 8.205 9.812 4.629
417 H VAL 59 H VAL 59 13.678 8.421 -0.950
418 HA VAL 59 HA VAL 59 13.663 8.264 -3.867
419 HB VAL 59 HB VAL 59 15.721 7.578 -1.725
420 HG11 VAL 59 1HG1 VAL 59 16.011 7.763 -4.747
421 HG12 VAL 59 2HG1 VAL 59 17.353 7.589 -3.585
422 HG13 VAL 59 3HG1 VAL 59 16.161 6.284 -3.769
423 HG21 VAL 59 1HG2 VAL 59 15.161 9.964 -1.832
424 HG22 VAL 59 2HG2 VAL 59 16.785 9.683 -2.506
425 HG23 VAL 59 3HG2 VAL 59 15.405 9.967 -3.591
426 H GLU 60 H GLU 60 13.672 6.376 -5.123
427 HA GLU 60 HA GLU 60 13.268 3.834 -3.605
428 HB2 GLU 60 2HB GLU 60 11.200 4.623 -4.672
429 HB3 GLU 60 3HB GLU 60 12.028 4.696 -6.241
430 HG2 GLU 60 2HG GLU 60 12.404 2.305 -6.255
431 HG3 GLU 60 3HG GLU 60 11.811 2.157 -4.588
432 H PHE 61 H PHE 61 14.820 2.429 -3.859
433 HA PHE 61 HA PHE 61 16.787 2.762 -5.998
434 HB2 PHE 61 2HB PHE 61 16.677 1.161 -3.452
435 HB3 PHE 61 3HB PHE 61 17.891 0.833 -4.686
436 HD1 PHE 61 HD1 PHE 61 16.539 3.610 -2.573
437 HD2 PHE 61 HD2 PHE 61 19.870 2.052 -4.798
438 HE1 PHE 61 HE1 PHE 61 17.977 5.419 -1.688
439 HE2 PHE 61 HE2 PHE 61 21.314 3.852 -3.902
440 HZ PHE 61 HZ PHE 61 20.372 5.531 -2.322
441 H GLU 62 H GLU 62 17.626 1.091 -7.323
442 HA GLU 62 HA GLU 62 15.701 -1.003 -8.086
443 HB2 GLU 62 2HB GLU 62 16.922 0.141 -9.851
444 HB3 GLU 62 3HB GLU 62 18.476 -0.227 -9.075
445 HG2 GLU 62 2HG GLU 62 18.138 -2.623 -9.430
446 HG3 GLU 62 3HG GLU 62 16.514 -2.322 -10.085
447 H ASP 63 H ASP 63 18.657 -0.540 -6.221
448 HA ASP 63 HA ASP 63 18.360 -3.179 -4.999
449 HB2 ASP 63 2HB ASP 63 19.691 -3.760 -6.938
450 HB3 ASP 63 3HB ASP 63 20.816 -2.436 -6.615
451 HA PRO 64 HA PRO 64 19.348 -0.100 -1.883
452 HB2 PRO 64 2HB PRO 64 19.180 -2.506 -0.107
453 HB3 PRO 64 3HB PRO 64 18.362 -0.916 0.056
454 HG2 PRO 64 2HG PRO 64 17.005 -3.125 -0.796
455 HG3 PRO 64 3HG PRO 64 16.692 -1.511 -1.509
456 HD2 PRO 64 2HD PRO 64 18.349 -3.772 -2.621
457 HD3 PRO 64 3HD PRO 64 17.226 -2.657 -3.460
458 H ARG 65 H ARG 65 21.226 -2.873 -2.772
459 HA ARG 65 HA ARG 65 23.230 -2.769 -0.742
460 HB2 ARG 65 2HB ARG 65 22.913 -4.678 -2.228
461 HB3 ARG 65 3HB ARG 65 23.342 -3.699 -3.640
462 HG2 ARG 65 2HG ARG 65 25.324 -3.839 -1.379
463 HG3 ARG 65 3HG ARG 65 25.105 -5.275 -2.394
464 HD2 ARG 65 2HD ARG 65 25.561 -3.960 -4.420
465 HD3 ARG 65 3HD ARG 65 25.770 -2.492 -3.458
466 HE ARG 65 HE ARG 65 27.643 -4.745 -3.700
467 HH11 ARG 65 1HH1 ARG 65 26.744 -1.823 -1.925
468 HH12 ARG 65 2HH1 ARG 65 28.363 -1.558 -1.311
469 HH21 ARG 65 1HH2 ARG 65 29.757 -4.364 -2.865
470 HH22 ARG 65 2HH2 ARG 65 30.044 -2.987 -1.828
471 H ASP 66 H ASP 66 22.577 -0.735 -3.533
472 HA ASP 66 HA ASP 66 25.252 0.338 -3.669
473 HB2 ASP 66 2HB ASP 66 22.625 1.186 -4.919
474 HB3 ASP 66 3HB ASP 66 24.164 2.009 -5.208
475 H ALA 67 H ALA 67 23.089 0.676 -1.240
476 HA ALA 67 HA ALA 67 23.030 3.503 -0.815
477 HB1 ALA 67 1HB ALA 67 22.820 1.177 1.143
478 HB2 ALA 67 2HB ALA 67 22.346 2.853 1.481
479 HB3 ALA 67 3HB ALA 67 21.470 1.911 0.250
480 H GLU 68 H GLU 68 25.667 1.370 -0.768
481 HA GLU 68 HA GLU 68 27.119 2.279 1.501
482 HB2 GLU 68 2HB GLU 68 27.629 0.234 0.247
483 HB3 GLU 68 3HB GLU 68 28.070 1.190 -1.185
484 HG2 GLU 68 2HG GLU 68 29.932 2.215 0.014
485 HG3 GLU 68 3HG GLU 68 29.446 1.415 1.521
486 H ASP 69 H ASP 69 26.514 3.741 -1.639
487 HA ASP 69 HA ASP 69 28.349 5.977 -0.902
488 HB2 ASP 69 2HB ASP 69 27.668 4.799 -3.606
489 HB3 ASP 69 3HB ASP 69 28.411 6.389 -3.406
490 H ALA 70 H ALA 70 25.182 5.040 -2.158
491 HA ALA 70 HA ALA 70 24.390 7.767 -2.770
492 HB1 ALA 70 1HB ALA 70 23.600 5.771 -4.043
493 HB2 ALA 70 2HB ALA 70 22.771 5.190 -2.587
494 HB3 ALA 70 3HB ALA 70 22.256 6.713 -3.360
495 H VAL 71 H VAL 71 24.654 6.028 0.144
496 HA VAL 71 HA VAL 71 22.700 7.865 1.417
497 HB VAL 71 HB VAL 71 22.940 4.883 1.959
498 HG11 VAL 71 1HG1 VAL 71 21.094 6.986 3.161
499 HG12 VAL 71 2HG1 VAL 71 21.018 5.232 3.470
500 HG13 VAL 71 3HG1 VAL 71 22.433 6.165 4.000
501 HG21 VAL 71 1HG2 VAL 71 21.757 5.303 -0.129
502 HG22 VAL 71 2HG2 VAL 71 20.595 4.818 1.128
503 HG23 VAL 71 3HG2 VAL 71 20.736 6.527 0.666
504 H SER 72 H SER 72 25.428 5.562 1.869
505 HA SER 72 HA SER 72 26.070 6.735 4.473
506 HB2 SER 72 2HB SER 72 27.462 4.644 2.761
507 HB3 SER 72 3HB SER 72 27.952 5.113 4.408
508 HG SER 72 HG SER 72 25.473 4.003 3.604
509 H GLY 73 H GLY 73 26.526 7.798 1.332
510 HA2 GLY 73 2HA GLY 73 29.312 8.597 1.480
511 HA3 GLY 73 3HA GLY 73 28.109 9.092 0.273
512 H ARG 74 H ARG 74 26.177 10.065 2.329
513 HA ARG 74 HA ARG 74 27.528 12.098 3.899
514 HB2 ARG 74 2HB ARG 74 27.701 13.129 1.671
515 HB3 ARG 74 3HB ARG 74 25.950 12.944 1.432
516 HG2 ARG 74 2HG ARG 74 25.509 14.437 3.347
517 HG3 ARG 74 3HG ARG 74 27.258 14.580 3.649
518 HD2 ARG 74 2HD ARG 74 25.820 15.430 1.100
519 HD3 ARG 74 3HD ARG 74 26.341 16.524 2.385
520 HE ARG 74 HE ARG 74 28.068 15.107 0.437
521 HH11 ARG 74 1HH1 ARG 74 27.827 17.236 3.252
522 HH12 ARG 74 2HH1 ARG 74 29.461 17.837 3.075
523 HH21 ARG 74 1HH2 ARG 74 30.197 15.918 0.235
524 HH22 ARG 74 2HH2 ARG 74 30.787 17.095 1.380
525 H ASP 75 H ASP 75 26.319 12.534 5.623
526 HA ASP 75 HA ASP 75 23.445 12.845 5.459
527 HB2 ASP 75 2HB ASP 75 22.957 11.155 7.235
528 HB3 ASP 75 3HB ASP 75 23.340 10.498 5.639
529 H GLY 76 H GLY 76 22.541 13.842 7.350
530 HA2 GLY 76 2HA GLY 76 22.594 15.206 9.187
531 HA3 GLY 76 3HA GLY 76 23.854 14.128 9.818
532 H TYR 77 H TYR 77 23.914 16.350 6.948
533 HA TYR 77 HA TYR 77 26.528 17.233 7.940
534 HB2 TYR 77 2HB TYR 77 26.695 16.400 5.775
535 HB3 TYR 77 3HB TYR 77 25.256 17.265 5.230
536 HD1 TYR 77 HD1 TYR 77 28.663 17.958 6.643
537 HD2 TYR 77 HD2 TYR 77 25.525 19.225 3.990
538 HE1 TYR 77 HE1 TYR 77 30.085 19.840 5.864
539 HE2 TYR 77 HE2 TYR 77 26.932 21.113 3.217
540 HH TYR 77 HH TYR 77 28.948 22.185 3.404
541 H ASP 78 H ASP 78 27.142 19.210 8.413
542 HA ASP 78 HA ASP 78 25.160 21.048 9.343
543 HB2 ASP 78 2HB ASP 78 27.254 20.787 10.489
544 HB3 ASP 78 3HB ASP 78 28.168 21.229 9.040
545 H TYR 79 H TYR 79 23.834 21.744 7.634
546 HA TYR 79 HA TYR 79 24.998 23.118 5.317
547 HB2 TYR 79 2HB TYR 79 22.870 21.665 5.431
548 HB3 TYR 79 3HB TYR 79 22.116 23.011 6.298
549 HD1 TYR 79 HD1 TYR 79 24.015 22.233 3.164
550 HD2 TYR 79 HD2 TYR 79 20.997 24.643 5.043
551 HE1 TYR 79 HE1 TYR 79 23.481 23.265 0.962
552 HE2 TYR 79 HE2 TYR 79 20.443 25.674 2.849
553 HH TYR 79 HH TYR 79 22.166 24.767 -0.155
554 H ASP 80 H ASP 80 23.558 25.309 4.933
555 HA ASP 80 HA ASP 80 24.495 27.205 6.834
556 HB2 ASP 80 2HB ASP 80 22.648 27.381 4.441
557 HB3 ASP 80 3HB ASP 80 23.163 28.784 5.390
558 H GLY 81 H GLY 81 23.500 26.303 8.802
559 HA2 GLY 81 2HA GLY 81 22.077 26.945 10.537
560 HA3 GLY 81 3HA GLY 81 20.997 27.730 9.370
561 H TYR 82 H TYR 82 21.788 24.660 8.221
562 HA TYR 82 HA TYR 82 19.553 23.324 9.634
563 HB2 TYR 82 2HB TYR 82 19.854 23.627 6.643
564 HB3 TYR 82 3HB TYR 82 18.812 22.422 7.396
565 HD1 TYR 82 HD1 TYR 82 16.706 22.999 8.399
566 HD2 TYR 82 HD2 TYR 82 19.349 26.045 6.922
567 HE1 TYR 82 HE1 TYR 82 14.875 24.664 8.578
568 HE2 TYR 82 HE2 TYR 82 17.522 27.725 7.087
569 HH TYR 82 HH TYR 82 14.242 26.847 8.245
570 H ARG 83 H ARG 83 19.427 20.909 8.533
571 HA ARG 83 HA ARG 83 22.193 19.820 8.409
572 HB2 ARG 83 2HB ARG 83 20.905 19.849 10.789
573 HB3 ARG 83 3HB ARG 83 20.148 18.407 10.088
574 HG2 ARG 83 2HG ARG 83 22.055 17.645 11.308
575 HG3 ARG 83 3HG ARG 83 22.527 17.574 9.598
576 HD2 ARG 83 2HD ARG 83 23.656 19.776 9.836
577 HD3 ARG 83 3HD ARG 83 23.133 19.854 11.527
578 HE ARG 83 HE ARG 83 24.828 17.574 10.634
579 HH11 ARG 83 1HH1 ARG 83 24.472 20.535 12.532
580 HH12 ARG 83 2HH1 ARG 83 25.915 20.240 13.473
581 HH21 ARG 83 1HH2 ARG 83 26.688 17.210 11.869
582 HH22 ARG 83 2HH2 ARG 83 27.177 18.364 13.089
583 H LEU 84 H LEU 84 22.365 18.366 6.807
584 HA LEU 84 HA LEU 84 20.073 17.661 5.190
585 HB2 LEU 84 2HB LEU 84 22.998 16.856 5.245
586 HB3 LEU 84 3HB LEU 84 21.841 15.991 4.230
587 HG LEU 84 HG LEU 84 21.181 18.163 3.165
588 HD11 LEU 84 1HD1 LEU 84 23.555 19.200 4.776
589 HD12 LEU 84 2HD1 LEU 84 22.799 20.063 3.416
590 HD13 LEU 84 3HD1 LEU 84 21.870 19.750 4.894
591 HD21 LEU 84 1HD2 LEU 84 22.812 16.631 2.131
592 HD22 LEU 84 2HD2 LEU 84 23.240 18.329 1.805
593 HD23 LEU 84 3HD2 LEU 84 24.127 17.412 3.040
594 H ARG 85 H ARG 85 19.010 15.670 4.972
595 HA ARG 85 HA ARG 85 19.801 13.547 6.917
596 HB2 ARG 85 2HB ARG 85 16.947 14.376 6.298
597 HB3 ARG 85 3HB ARG 85 17.478 13.057 7.367
598 HG2 ARG 85 2HG ARG 85 18.714 14.779 8.755
599 HG3 ARG 85 3HG ARG 85 17.987 16.043 7.748
600 HD2 ARG 85 2HD ARG 85 16.651 15.804 9.744
601 HD3 ARG 85 3HD ARG 85 15.720 15.174 8.373
602 HE ARG 85 HE ARG 85 16.236 12.902 9.119
603 HH11 ARG 85 1HH1 ARG 85 16.932 15.491 11.431
604 HH12 ARG 85 2HH1 ARG 85 16.880 14.419 12.813
605 HH21 ARG 85 1HH2 ARG 85 16.236 11.531 10.931
606 HH22 ARG 85 2HH2 ARG 85 16.478 12.186 12.530
607 H VAL 86 H VAL 86 20.252 11.726 5.986
608 HA VAL 86 HA VAL 86 18.718 10.869 3.608
609 HB VAL 86 HB VAL 86 21.745 10.630 3.756
610 HG11 VAL 86 1HG1 VAL 86 19.745 10.218 1.488
611 HG12 VAL 86 2HG1 VAL 86 21.508 9.989 1.394
612 HG13 VAL 86 3HG1 VAL 86 20.525 8.919 2.415
613 HG21 VAL 86 1HG2 VAL 86 21.196 13.008 3.497
614 HG22 VAL 86 2HG2 VAL 86 21.806 12.343 1.972
615 HG23 VAL 86 3HG2 VAL 86 20.057 12.618 2.186
616 H GLU 87 H GLU 87 17.603 9.564 5.114
617 HA GLU 87 HA GLU 87 19.036 7.061 5.757
618 HB2 GLU 87 2HB GLU 87 18.261 7.099 8.094
619 HB3 GLU 87 3HB GLU 87 19.303 8.503 7.767
620 HG2 GLU 87 2HG GLU 87 17.289 9.911 7.430
621 HG3 GLU 87 3HG GLU 87 16.246 8.516 7.744
622 H PHE 88 H PHE 88 17.544 5.305 6.395
623 HA PHE 88 HA PHE 88 15.130 5.446 4.816
624 HB2 PHE 88 2HB PHE 88 14.854 3.049 5.754
625 HB3 PHE 88 3HB PHE 88 16.119 3.422 4.578
626 HD1 PHE 88 HD1 PHE 88 18.468 3.421 5.168
627 HD2 PHE 88 HD2 PHE 88 15.441 2.572 8.104
628 HE1 PHE 88 HE1 PHE 88 20.201 2.516 6.696
629 HE2 PHE 88 HE2 PHE 88 17.175 1.665 9.628
630 HZ PHE 88 HZ PHE 88 19.556 1.630 8.921
631 HA PRO 89 HA PRO 89 12.112 6.422 7.819
632 HB2 PRO 89 2HB PRO 89 9.943 4.978 6.928
633 HB3 PRO 89 3HB PRO 89 10.550 6.465 6.129
634 HG2 PRO 89 2HG PRO 89 11.071 3.583 5.376
635 HG3 PRO 89 3HG PRO 89 10.693 4.973 4.301
636 HD2 PRO 89 2HD PRO 89 13.244 4.058 4.702
637 HD3 PRO 89 3HD PRO 89 12.882 5.790 4.426
638 H5' A 90 1H5* A 90 6.132 15.551 9.315
639 H5'' A 90 2H5* A 90 6.019 14.145 10.393
640 H4' A 90 H4* A 90 5.966 17.033 11.381
641 H3' A 90 H3* A 90 8.200 16.055 10.228
642 H2' A 90 1H2* A 90 8.329 13.938 11.180
643 HO2' A 90 2HO* A 90 9.457 15.596 13.204
644 H1' A 90 H1* A 90 7.470 14.547 13.931
645 H8 A 90 H8 A 90 8.358 11.935 12.190
646 H61 A 90 1H6 A 90 2.944 8.944 12.512
647 H62 A 90 2H6 A 90 4.655 8.793 12.171
648 H2 A 90 H2 A 90 2.222 13.224 13.546
649 HO5' A 90 H5T A 90 3.987 14.840 9.547
650 H5' A 91 1H5* A 91 11.109 17.565 11.684
651 H5'' A 91 2H5* A 91 11.404 19.270 11.279
652 H4' A 91 H4* A 91 12.091 18.592 8.976
653 H3' A 91 H3* A 91 10.681 16.310 9.246
654 H2' A 91 1H2* A 91 11.672 15.352 11.123
655 HO2' A 91 2HO* A 91 13.401 14.629 8.991
656 H1' A 91 H1* A 91 14.484 16.036 10.677
657 H8 A 91 H8 A 91 12.848 14.516 12.959
658 H61 A 91 1H6 A 91 13.411 18.721 17.468
659 H62 A 91 2H6 A 91 13.031 17.052 17.100
660 H2 A 91 H2 A 91 14.333 20.721 13.597
661 H5' C 92 1H5* C 92 9.129 15.836 7.604
662 H5'' C 92 2H5* C 92 10.283 14.582 8.094
663 H4' C 92 H4* C 92 8.331 14.353 5.758
664 H3' C 92 H3* C 92 7.659 14.297 8.412
665 H2' C 92 1H2* C 92 9.293 12.712 9.055
666 HO2' C 92 2HO* C 92 6.988 11.192 8.318
667 H1' C 92 H1* C 92 8.620 11.033 6.637
668 H41 C 92 1H4 C 92 13.872 8.011 8.573
669 H42 C 92 2H4 C 92 14.545 9.470 9.272
670 H5 C 92 H5 C 92 13.369 11.620 9.228
671 H6 C 92 H6 C 92 11.336 12.750 8.491
672 H5' A 93 1H5* A 93 3.251 12.874 5.571
673 H5'' A 93 2H5* A 93 4.512 11.651 5.304
674 H4' A 93 H4* A 93 3.780 13.549 3.071
675 H3' A 93 H3* A 93 1.689 12.273 4.232
676 H2' A 93 1H2* A 93 2.608 10.103 4.293
677 HO2' A 93 2HO* A 93 1.682 8.924 2.538
678 H1' A 93 H1* A 93 3.702 10.289 1.508
679 H8 A 93 H8 A 93 4.331 9.342 5.157
680 H61 A 93 1H6 A 93 7.867 4.814 2.781
681 H62 A 93 2H6 A 93 7.184 5.469 4.255
682 H2 A 93 H2 A 93 6.504 7.448 -0.548
683 H5' A 94 1H5* A 94 -0.729 13.769 4.450
684 H5'' A 94 2H5* A 94 -0.415 12.137 3.827
685 H4' A 94 H4* A 94 -2.676 12.033 4.392
686 H3' A 94 H3* A 94 -2.041 11.750 1.746
687 H2' A 94 1H2* A 94 -2.464 13.813 0.827
688 HO2' A 94 2HO* A 94 -5.110 12.912 1.355
689 H1' A 94 H1* A 94 -4.485 14.942 2.572
690 H8 A 94 H8 A 94 -2.475 15.935 0.233
691 H61 A 94 1H6 A 94 0.861 19.859 3.672
692 H62 A 94 2H6 A 94 0.427 19.399 2.037
693 H2 A 94 H2 A 94 -1.284 17.111 6.421
694 H5' A 95 1H5* A 95 -3.627 10.388 -0.125
695 H5'' A 95 2H5* A 95 -4.398 8.803 0.107
696 H4' A 95 H4* A 95 -1.465 9.106 -0.684
697 H3' A 95 H3* A 95 -3.322 10.077 -2.345
698 HO3' A 95 H3T A 95 -2.140 9.090 -4.063
699 H2' A 95 1H2* A 95 -4.964 8.407 -2.197
700 HO2' A 95 2HO* A 95 -4.395 8.370 -4.389
701 H1' A 95 H1* A 95 -3.203 6.029 -2.233
702 H8 A 95 H8 A 95 -6.387 6.511 -2.183
703 H61 A 95 1H6 A 95 -7.467 4.431 3.552
704 H62 A 95 2H6 A 95 -8.188 4.834 2.002
705 H2 A 95 H2 A 95 -3.119 5.312 3.209
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