Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
598675 | 2mwy RC | 25377 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 GLN 1 H GLN 1 1.807 0.000 0.855
2 HA GLN 1 HA GLN 1 1.845 -0.899 -1.784
3 HB2 GLN 1 1HB GLN 1 2.204 2.088 -1.691
4 HB3 GLN 1 2HB GLN 1 2.066 1.051 -3.105
5 HG2 GLN 1 1HG GLN 1 -0.137 1.646 -1.142
6 HG3 GLN 1 2HG GLN 1 0.048 2.368 -2.739
7 HE21 GLN 1 2HE2 GLN 1 -2.065 0.656 -1.502
8 HE22 GLN 1 1HE2 GLN 1 -2.279 -0.650 -2.612
9 H ILE 2 H ILE 2 3.312 1.142 0.662
10 HA ILE 2 HA ILE 2 5.850 1.541 -0.107
11 HB ILE 2 HB ILE 2 6.604 1.221 2.193
12 HG12 ILE 2 1HG1 ILE 2 4.252 0.535 3.567
13 HG13 ILE 2 2HG1 ILE 2 4.381 -0.627 2.251
14 HG21 ILE 2 1HG2 ILE 2 5.414 3.259 1.668
15 HG22 ILE 2 2HG2 ILE 2 3.869 2.469 1.976
16 HG23 ILE 2 3HG2 ILE 2 5.002 2.735 3.301
17 HD11 ILE 2 1HD1 ILE 2 5.682 -1.762 3.659
18 HD12 ILE 2 2HD1 ILE 2 6.926 -0.590 3.223
19 HD13 ILE 2 3HD1 ILE 2 5.965 -0.355 4.683
20 H ASN 3 H ASN 3 7.173 0.283 -1.238
21 HA ASN 3 HA ASN 3 7.403 -2.554 -0.476
22 HB2 ASN 3 1HB ASN 3 6.936 -1.342 -3.020
23 HB3 ASN 3 2HB ASN 3 8.517 -2.118 -3.059
24 HD21 ASN 3 2HD2 ASN 3 5.671 -3.074 -1.216
25 HD22 ASN 3 1HD2 ASN 3 5.459 -4.602 -1.994
26 H GLN 4 H GLN 4 9.626 -3.455 -1.269
27 HA GLN 4 HA GLN 4 11.630 -2.080 0.213
28 HB2 GLN 4 1HB GLN 4 12.118 -4.351 -1.706
29 HB3 GLN 4 2HB GLN 4 13.048 -3.920 -0.277
30 HG2 GLN 4 1HG GLN 4 11.906 -5.568 0.698
31 HG3 GLN 4 2HG GLN 4 10.608 -4.380 0.809
32 HE21 GLN 4 2HE2 GLN 4 8.723 -4.920 -0.027
33 HE22 GLN 4 1HE2 GLN 4 8.444 -6.185 -1.169
34 H VAL 5 H VAL 5 13.684 -1.338 -0.585
35 HA VAL 5 HA VAL 5 13.809 -0.677 -3.429
36 HB VAL 5 HB VAL 5 13.670 1.550 -3.235
37 HG11 VAL 5 1HG1 VAL 5 12.572 0.760 -0.542
38 HG12 VAL 5 2HG1 VAL 5 12.392 2.367 -1.248
39 HG13 VAL 5 3HG1 VAL 5 11.679 0.966 -2.049
40 HG21 VAL 5 1HG2 VAL 5 15.776 1.937 -2.286
41 HG22 VAL 5 2HG2 VAL 5 14.654 2.781 -1.218
42 HG23 VAL 5 3HG2 VAL 5 15.314 1.215 -0.745
43 H ARG 6 H ARG 6 15.958 0.225 -4.036
44 HA ARG 6 HA ARG 6 18.102 -0.584 -2.200
45 HB2 ARG 6 1HB ARG 6 17.652 -1.520 -5.014
46 HB3 ARG 6 2HB ARG 6 19.284 -1.417 -4.369
47 HG2 ARG 6 1HG ARG 6 18.766 -2.983 -2.634
48 HG3 ARG 6 2HG ARG 6 17.059 -2.981 -3.083
49 HD2 ARG 6 1HD ARG 6 17.449 -4.651 -4.492
50 HD3 ARG 6 2HD ARG 6 18.527 -3.602 -5.412
51 HE ARG 6 HE ARG 6 20.010 -4.539 -3.285
52 HH11 ARG 6 1HH1 ARG 6 18.300 -5.908 -5.991
53 HH12 ARG 6 2HH1 ARG 6 19.348 -7.281 -6.126
54 HH21 ARG 6 1HH2 ARG 6 21.396 -6.343 -3.452
55 HH22 ARG 6 2HH2 ARG 6 21.108 -7.528 -4.680
56 HA PRO 7 HA PRO 7 19.275 3.559 -3.477
57 HB2 PRO 7 1HB PRO 7 21.245 3.821 -1.628
58 HB3 PRO 7 2HB PRO 7 19.533 4.034 -1.244
59 HG2 PRO 7 1HG PRO 7 21.291 1.651 -0.806
60 HG3 PRO 7 2HG PRO 7 20.087 2.368 0.281
61 HD2 PRO 7 1HD PRO 7 19.578 0.162 -1.204
62 HD3 PRO 7 2HD PRO 7 18.322 1.349 -0.797
63 H LYS 8 H LYS 8 20.352 3.597 -5.359
64 HA LYS 8 HA LYS 8 22.489 1.906 -6.056
65 HB2 LYS 8 1HB LYS 8 22.049 4.612 -7.293
66 HB3 LYS 8 2HB LYS 8 22.644 3.142 -8.054
67 HG2 LYS 8 1HG LYS 8 20.333 2.170 -7.597
68 HG3 LYS 8 2HG LYS 8 19.835 3.830 -7.259
69 HD2 LYS 8 1HD LYS 8 19.919 4.432 -9.433
70 HD3 LYS 8 2HD LYS 8 21.348 3.447 -9.757
71 HE2 LYS 8 1HE LYS 8 19.410 1.565 -9.270
72 HE3 LYS 8 2HE LYS 8 18.515 2.828 -10.113
73 HZ1 LYS 8 1HZ LYS 8 19.295 1.581 -11.848
74 HZ2 LYS 8 2HZ LYS 8 20.743 1.174 -11.074
75 HZ3 LYS 8 3HZ LYS 8 20.537 2.723 -11.722
76 H LEU 9 H LEU 9 24.261 3.896 -7.229
77 HA LEU 9 HA LEU 9 26.109 4.139 -5.091
78 HB2 LEU 9 1HB LEU 9 26.022 4.888 -7.952
79 HB3 LEU 9 2HB LEU 9 27.166 5.764 -6.937
80 HG LEU 9 HG LEU 9 27.110 2.831 -7.588
81 HD11 LEU 9 1HD1 LEU 9 29.654 3.687 -7.860
82 HD12 LEU 9 2HD1 LEU 9 28.773 5.161 -8.261
83 HD13 LEU 9 3HD1 LEU 9 28.469 3.679 -9.166
84 HD21 LEU 9 1HD2 LEU 9 27.663 2.531 -5.416
85 HD22 LEU 9 2HD2 LEU 9 28.189 4.201 -5.202
86 HD23 LEU 9 3HD2 LEU 9 29.251 3.036 -5.993
87 HA PRO 10 HA PRO 10 25.319 8.881 -5.324
88 HB2 PRO 10 1HB PRO 10 23.373 9.770 -6.996
89 HB3 PRO 10 2HB PRO 10 25.051 9.547 -7.506
90 HG2 PRO 10 1HG PRO 10 22.695 7.744 -7.906
91 HG3 PRO 10 2HG PRO 10 23.974 8.186 -9.053
92 HD2 PRO 10 1HD PRO 10 23.970 5.834 -7.711
93 HD3 PRO 10 2HD PRO 10 25.468 6.672 -8.165
94 H LEU 11 H LEU 11 23.047 6.451 -4.996
95 HA LEU 11 HA LEU 11 21.116 8.184 -3.620
96 HB2 LEU 11 1HB LEU 11 20.927 5.348 -4.612
97 HB3 LEU 11 2HB LEU 11 19.693 6.110 -3.611
98 HG LEU 11 HG LEU 11 20.193 6.335 -6.481
99 HD11 LEU 11 1HD1 LEU 11 17.804 6.984 -6.430
100 HD12 LEU 11 2HD1 LEU 11 17.855 6.915 -4.669
101 HD13 LEU 11 3HD1 LEU 11 18.131 5.454 -5.617
102 HD21 LEU 11 1HD2 LEU 11 19.487 8.691 -6.617
103 HD22 LEU 11 2HD2 LEU 11 21.072 8.505 -5.865
104 HD23 LEU 11 3HD2 LEU 11 19.653 8.825 -4.866
105 H LEU 12 H LEU 12 23.443 5.650 -3.134
106 HA LEU 12 HA LEU 12 22.588 4.877 -0.531
107 HB2 LEU 12 1HB LEU 12 24.010 3.499 -2.036
108 HB3 LEU 12 2HB LEU 12 25.333 4.628 -1.752
109 HG LEU 12 HG LEU 12 25.640 3.909 0.441
110 HD11 LEU 12 1HD1 LEU 12 22.855 2.799 0.250
111 HD12 LEU 12 2HD1 LEU 12 23.477 4.026 1.354
112 HD13 LEU 12 3HD1 LEU 12 23.971 2.343 1.538
113 HD21 LEU 12 1HD2 LEU 12 24.797 1.237 -0.380
114 HD22 LEU 12 2HD2 LEU 12 26.402 1.849 0.022
115 HD23 LEU 12 3HD2 LEU 12 25.747 2.086 -1.599
116 H LYS 13 H LYS 13 25.192 7.000 -1.700
117 HA LYS 13 HA LYS 13 26.245 7.756 0.755
118 HB2 LYS 13 1HB LYS 13 26.792 9.952 -0.527
119 HB3 LYS 13 2HB LYS 13 27.509 8.440 -1.068
120 HG2 LYS 13 1HG LYS 13 26.609 8.682 -3.073
121 HG3 LYS 13 2HG LYS 13 24.994 8.816 -2.373
122 HD2 LYS 13 1HD LYS 13 25.056 10.891 -3.250
123 HD3 LYS 13 2HD LYS 13 25.999 11.267 -1.806
124 HE2 LYS 13 1HE LYS 13 27.265 10.323 -4.365
125 HE3 LYS 13 2HE LYS 13 26.952 12.027 -4.039
126 HZ1 LYS 13 1HZ LYS 13 28.227 10.969 -1.802
127 HZ2 LYS 13 2HZ LYS 13 28.837 12.094 -2.908
128 HZ3 LYS 13 3HZ LYS 13 29.097 10.440 -3.154
129 H ILE 14 H ILE 14 23.339 8.808 -0.860
130 HA ILE 14 HA ILE 14 22.854 11.178 0.562
131 HB ILE 14 HB ILE 14 20.716 9.294 -0.422
132 HG12 ILE 14 1HG1 ILE 14 22.504 11.185 -1.929
133 HG13 ILE 14 2HG1 ILE 14 22.104 9.514 -2.307
134 HG21 ILE 14 1HG2 ILE 14 19.850 11.103 0.890
135 HG22 ILE 14 2HG2 ILE 14 20.816 12.276 -0.004
136 HG23 ILE 14 3HG2 ILE 14 19.494 11.429 -0.806
137 HD11 ILE 14 1HD1 ILE 14 20.538 11.995 -2.792
138 HD12 ILE 14 2HD1 ILE 14 20.875 10.642 -3.871
139 HD13 ILE 14 3HD1 ILE 14 19.690 10.465 -2.577
140 H LEU 15 H LEU 15 21.576 7.899 1.145
141 HA LEU 15 HA LEU 15 20.353 8.601 3.616
142 HB2 LEU 15 1HB LEU 15 21.143 5.801 2.938
143 HB3 LEU 15 2HB LEU 15 19.707 6.384 3.777
144 HG LEU 15 HG LEU 15 20.259 6.468 0.816
145 HD11 LEU 15 1HD1 LEU 15 19.348 4.430 0.997
146 HD12 LEU 15 2HD1 LEU 15 17.831 5.305 1.203
147 HD13 LEU 15 3HD1 LEU 15 18.723 4.742 2.616
148 HD21 LEU 15 1HD2 LEU 15 17.611 7.290 1.668
149 HD22 LEU 15 2HD2 LEU 15 18.717 8.049 0.523
150 HD23 LEU 15 3HD2 LEU 15 18.870 8.381 2.249
151 H HIS 16 H HIS 16 23.463 7.241 2.708
152 HA HIS 16 HA HIS 16 24.342 6.377 5.211
153 HB2 HIS 16 1HB HIS 16 25.699 7.264 2.704
154 HB3 HIS 16 2HB HIS 16 26.672 7.076 4.160
155 HD1 HIS 16 HD1 HIS 16 27.940 5.016 3.394
156 HD2 HIS 16 HD2 HIS 16 23.815 4.543 3.255
157 HE1 HIS 16 HE1 HIS 16 27.558 2.567 2.971
158 H ALA 17 H ALA 17 24.774 9.542 3.643
159 HA ALA 17 HA ALA 17 26.164 10.735 5.794
160 HB1 ALA 17 1HB ALA 17 24.966 11.621 3.269
161 HB2 ALA 17 2HB ALA 17 25.010 12.850 4.534
162 HB3 ALA 17 3HB ALA 17 26.502 12.063 4.018
163 H ALA 18 H ALA 18 22.919 9.854 5.454
164 HA ALA 18 HA ALA 18 21.991 11.854 7.385
165 HB1 ALA 18 1HB ALA 18 19.821 10.269 6.734
166 HB2 ALA 18 2HB ALA 18 20.217 11.840 6.038
167 HB3 ALA 18 3HB ALA 18 20.743 10.362 5.233
168 H GLY 19 H GLY 19 23.515 9.024 7.574
169 HA2 GLY 19 1HA GLY 19 23.827 7.959 9.698
170 HA3 GLY 19 2HA GLY 19 22.153 8.325 10.087
171 H ALA 20 H ALA 20 22.650 7.177 6.918
172 HA ALA 20 HA ALA 20 21.409 4.632 7.652
173 HB1 ALA 20 1HB ALA 20 20.514 4.537 5.544
174 HB2 ALA 20 2HB ALA 20 20.617 6.283 5.773
175 HB3 ALA 20 3HB ALA 20 21.842 5.445 4.819
176 H GLN 21 H GLN 21 22.094 2.747 6.155
177 HA GLN 21 HA GLN 21 24.711 2.621 5.130
178 HB2 GLN 21 1HB GLN 21 24.765 2.657 7.866
179 HB3 GLN 21 2HB GLN 21 24.733 0.930 7.533
180 HG2 GLN 21 1HG GLN 21 26.927 1.052 7.269
181 HG3 GLN 21 2HG GLN 21 26.615 1.913 5.763
182 HE21 GLN 21 2HE2 GLN 21 26.182 4.319 6.109
183 HE22 GLN 21 1HE2 GLN 21 27.258 5.133 7.187
184 H GLY 22 H GLY 22 24.905 0.858 3.864
185 HA2 GLY 22 1HA GLY 22 24.515 -1.629 3.792
186 HA3 GLY 22 2HA GLY 22 22.848 -1.238 4.187
187 H GLU 23 H GLU 23 22.199 -2.341 2.270
188 HA GLU 23 HA GLU 23 22.317 -0.610 -0.079
189 HB2 GLU 23 1HB GLU 23 22.884 -3.575 -0.239
190 HB3 GLU 23 2HB GLU 23 22.847 -2.440 -1.581
191 HG2 GLU 23 1HG GLU 23 24.808 -1.333 -0.792
192 HG3 GLU 23 2HG GLU 23 24.788 -2.259 0.707
193 H MET 24 H MET 24 20.397 -1.782 2.064
194 HA MET 24 HA MET 24 18.214 -2.239 0.173
195 HB2 MET 24 1HB MET 24 18.174 -3.932 2.608
196 HB3 MET 24 2HB MET 24 17.567 -4.269 0.992
197 HG2 MET 24 1HG MET 24 19.321 -5.750 1.205
198 HG3 MET 24 2HG MET 24 20.048 -4.407 0.326
199 HE1 MET 24 1HE MET 24 23.139 -4.505 1.790
200 HE2 MET 24 2HE MET 24 22.601 -6.153 2.113
201 HE3 MET 24 3HE MET 24 22.084 -5.328 0.642
202 H PHE 25 H PHE 25 16.397 -1.183 0.709
203 HA PHE 25 HA PHE 25 15.711 -0.567 3.425
204 HB2 PHE 25 1HB PHE 25 16.367 1.752 1.599
205 HB3 PHE 25 2HB PHE 25 15.817 1.846 3.268
206 HD1 PHE 25 HD2 PHE 25 18.629 0.815 1.107
207 HD2 PHE 25 HD1 PHE 25 17.333 1.709 5.061
208 HE1 PHE 25 HE2 PHE 25 20.967 0.804 1.872
209 HE2 PHE 25 HE1 PHE 25 19.669 1.699 5.833
210 HZ PHE 25 HZ PHE 25 21.490 1.245 4.238
211 H THR 26 H THR 26 13.585 0.181 3.650
212 HA THR 26 HA THR 26 11.930 -0.266 1.285
213 HB THR 26 HB THR 26 10.267 0.235 3.498
214 HG1 THR 26 1HG THR 26 12.423 -1.509 4.170
215 HG21 THR 26 1HG2 THR 26 9.756 -2.172 3.296
216 HG22 THR 26 2HG2 THR 26 11.163 -2.366 2.251
217 HG23 THR 26 3HG2 THR 26 9.808 -1.367 1.728
218 H VAL 27 H VAL 27 9.770 1.125 1.459
219 HA VAL 27 HA VAL 27 10.457 3.748 0.744
220 HB VAL 27 HB VAL 27 7.697 3.132 1.711
221 HG11 VAL 27 1HG1 VAL 27 9.009 5.019 -0.069
222 HG12 VAL 27 2HG1 VAL 27 7.601 4.253 -0.806
223 HG13 VAL 27 3HG1 VAL 27 7.437 5.116 0.723
224 HG21 VAL 27 1HG2 VAL 27 7.749 1.194 0.558
225 HG22 VAL 27 2HG2 VAL 27 7.558 2.253 -0.839
226 HG23 VAL 27 3HG2 VAL 27 9.160 1.671 -0.387
227 H LYS 28 H LYS 28 9.406 2.360 3.791
228 HA LYS 28 HA LYS 28 8.919 4.831 5.114
229 HB2 LYS 28 1HB LYS 28 9.238 3.317 7.199
230 HB3 LYS 28 2HB LYS 28 7.865 3.032 6.138
231 HG2 LYS 28 1HG LYS 28 10.218 1.522 5.348
232 HG3 LYS 28 2HG LYS 28 9.683 1.153 6.989
233 HD2 LYS 28 1HD LYS 28 7.379 0.822 6.080
234 HD3 LYS 28 2HD LYS 28 8.048 1.010 4.457
235 HE2 LYS 28 1HE LYS 28 8.002 -1.296 4.754
236 HE3 LYS 28 2HE LYS 28 9.668 -0.872 5.146
237 HZ1 LYS 28 1HZ LYS 28 7.674 -0.977 7.300
238 HZ2 LYS 28 2HZ LYS 28 9.341 -1.256 7.366
239 HZ3 LYS 28 3HZ LYS 28 8.313 -2.425 6.703
240 H GLU 29 H GLU 29 11.713 2.680 4.876
241 HA GLU 29 HA GLU 29 13.328 4.074 6.742
242 HB2 GLU 29 1HB GLU 29 13.725 1.944 4.728
243 HB3 GLU 29 2HB GLU 29 15.154 2.877 5.148
244 HG2 GLU 29 1HG GLU 29 13.391 1.361 7.057
245 HG3 GLU 29 2HG GLU 29 15.000 0.889 6.513
246 H VAL 30 H VAL 30 12.953 4.274 3.234
247 HA VAL 30 HA VAL 30 15.052 6.126 2.798
248 HB VAL 30 HB VAL 30 12.585 5.600 1.134
249 HG11 VAL 30 1HG1 VAL 30 14.542 7.639 0.912
250 HG12 VAL 30 2HG1 VAL 30 14.802 6.492 -0.404
251 HG13 VAL 30 3HG1 VAL 30 13.226 7.255 -0.196
252 HG21 VAL 30 1HG2 VAL 30 15.114 4.180 1.505
253 HG22 VAL 30 2HG2 VAL 30 13.587 3.618 0.825
254 HG23 VAL 30 3HG2 VAL 30 14.723 4.516 -0.182
255 H MET 31 H MET 31 11.533 6.543 3.125
256 HA MET 31 HA MET 31 11.434 9.305 2.783
257 HB2 MET 31 1HB MET 31 9.260 8.872 3.017
258 HB3 MET 31 2HB MET 31 9.645 7.244 3.560
259 HG2 MET 31 1HG MET 31 8.277 8.206 5.219
260 HG3 MET 31 2HG MET 31 9.915 8.183 5.867
261 HE1 MET 31 1HE MET 31 8.128 11.966 3.969
262 HE2 MET 31 2HE MET 31 9.363 11.020 3.137
263 HE3 MET 31 3HE MET 31 7.790 10.302 3.492
264 H HIS 32 H HIS 32 12.143 7.382 5.646
265 HA HIS 32 HA HIS 32 12.103 9.548 7.486
266 HB2 HIS 32 1HB HIS 32 12.013 6.967 7.908
267 HB3 HIS 32 2HB HIS 32 13.769 7.092 7.917
268 HD1 HIS 32 HD1 HIS 32 11.099 7.028 10.190
269 HD2 HIS 32 HD2 HIS 32 14.498 9.392 9.838
270 HE1 HIS 32 HE1 HIS 32 11.467 8.020 12.471
271 H TYR 33 H TYR 33 14.554 8.147 5.414
272 HA TYR 33 HA TYR 33 16.751 9.531 6.618
273 HB2 TYR 33 1HB TYR 33 16.455 8.100 3.974
274 HB3 TYR 33 2HB TYR 33 17.966 8.814 4.527
275 HD1 TYR 33 HD1 TYR 33 18.115 8.104 7.319
276 HD2 TYR 33 HD2 TYR 33 16.676 5.800 4.045
277 HE1 TYR 33 HE1 TYR 33 18.644 6.039 8.547
278 HE2 TYR 33 HE2 TYR 33 17.199 3.729 5.264
279 HH TYR 33 HH TYR 33 17.837 3.629 8.530
280 H LEU 34 H LEU 34 14.646 10.089 3.842
281 HA LEU 34 HA LEU 34 15.951 12.171 2.595
282 HB2 LEU 34 1HB LEU 34 13.240 11.154 2.722
283 HB3 LEU 34 2HB LEU 34 13.276 12.902 2.502
284 HG LEU 34 HG LEU 34 13.106 11.776 0.363
285 HD11 LEU 34 1HD1 LEU 34 14.975 12.818 -0.768
286 HD12 LEU 34 2HD1 LEU 34 15.858 12.943 0.753
287 HD13 LEU 34 3HD1 LEU 34 14.380 13.873 0.513
288 HD21 LEU 34 1HD2 LEU 34 14.029 9.743 0.245
289 HD22 LEU 34 2HD2 LEU 34 15.196 10.095 1.520
290 HD23 LEU 34 3HD2 LEU 34 15.524 10.597 -0.140
291 H GLY 35 H GLY 35 13.394 12.531 5.065
292 HA2 GLY 35 1HA GLY 35 13.575 15.277 5.399
293 HA3 GLY 35 2HA GLY 35 13.052 14.158 6.649
294 H GLN 36 H GLN 36 15.320 12.752 7.200
295 HA GLN 36 HA GLN 36 16.715 14.488 8.905
296 HB2 GLN 36 1HB GLN 36 17.564 12.591 9.747
297 HB3 GLN 36 2HB GLN 36 16.519 11.759 8.604
298 HG2 GLN 36 1HG GLN 36 18.633 10.803 8.320
299 HG3 GLN 36 2HG GLN 36 18.437 11.905 6.959
300 HE21 GLN 36 2HE2 GLN 36 19.857 11.616 10.173
301 HE22 GLN 36 1HE2 GLN 36 21.177 12.692 9.884
302 H TYR 37 H TYR 37 17.442 13.297 5.674
303 HA TYR 37 HA TYR 37 20.107 14.187 5.526
304 HB2 TYR 37 1HB TYR 37 19.252 12.604 3.911
305 HB3 TYR 37 2HB TYR 37 18.049 13.761 3.352
306 HD1 TYR 37 HD1 TYR 37 21.736 13.286 3.623
307 HD2 TYR 37 HD2 TYR 37 18.523 15.131 1.531
308 HE1 TYR 37 HE1 TYR 37 23.317 14.096 1.921
309 HE2 TYR 37 HE2 TYR 37 20.094 15.945 -0.176
310 HH TYR 37 HH TYR 37 22.816 16.469 -0.071
311 H ILE 38 H ILE 38 17.075 15.728 4.493
312 HA ILE 38 HA ILE 38 18.207 18.079 3.471
313 HB ILE 38 HB ILE 38 15.493 17.799 4.765
314 HG12 ILE 38 1HG1 ILE 38 16.268 17.428 1.864
315 HG13 ILE 38 2HG1 ILE 38 15.922 16.113 2.983
316 HG21 ILE 38 1HG2 ILE 38 14.868 19.672 3.326
317 HG22 ILE 38 2HG2 ILE 38 16.183 20.111 4.414
318 HG23 ILE 38 3HG2 ILE 38 16.521 19.761 2.719
319 HD11 ILE 38 1HD1 ILE 38 14.037 16.663 1.496
320 HD12 ILE 38 2HD1 ILE 38 13.645 16.846 3.206
321 HD13 ILE 38 3HD1 ILE 38 13.970 18.270 2.218
322 H MET 39 H MET 39 16.995 17.314 6.718
323 HA MET 39 HA MET 39 17.450 19.881 7.814
324 HB2 MET 39 1HB MET 39 16.453 18.996 9.610
325 HB3 MET 39 2HB MET 39 16.296 17.509 8.684
326 HG2 MET 39 1HG MET 39 17.269 16.831 10.677
327 HG3 MET 39 2HG MET 39 18.624 16.932 9.556
328 HE1 MET 39 1HE MET 39 16.509 18.689 12.087
329 HE2 MET 39 2HE MET 39 17.612 19.675 13.046
330 HE3 MET 39 3HE MET 39 17.017 20.271 11.496
331 H VAL 40 H VAL 40 19.472 17.054 7.401
332 HA VAL 40 HA VAL 40 21.566 17.883 9.139
333 HB VAL 40 HB VAL 40 21.001 15.578 7.710
334 HG11 VAL 40 1HG1 VAL 40 23.567 16.768 6.662
335 HG12 VAL 40 2HG1 VAL 40 22.975 15.134 6.356
336 HG13 VAL 40 3HG1 VAL 40 22.091 16.526 5.729
337 HG21 VAL 40 1HG2 VAL 40 23.552 16.308 9.145
338 HG22 VAL 40 2HG2 VAL 40 22.069 15.738 9.910
339 HG23 VAL 40 3HG2 VAL 40 22.969 14.674 8.829
340 H LYS 41 H LYS 41 20.946 18.267 5.684
341 HA LYS 41 HA LYS 41 23.456 19.665 5.277
342 HB2 LYS 41 1HB LYS 41 21.238 18.709 3.520
343 HB3 LYS 41 2HB LYS 41 22.275 20.003 2.933
344 HG2 LYS 41 1HG LYS 41 23.145 17.251 3.791
345 HG3 LYS 41 2HG LYS 41 23.088 17.881 2.142
346 HD2 LYS 41 1HD LYS 41 25.218 18.481 2.431
347 HD3 LYS 41 2HD LYS 41 24.618 19.738 3.515
348 HE2 LYS 41 1HE LYS 41 25.153 18.549 5.407
349 HE3 LYS 41 2HE LYS 41 25.039 16.991 4.590
350 HZ1 LYS 41 1HZ LYS 41 27.220 17.027 4.311
351 HZ2 LYS 41 2HZ LYS 41 27.326 18.531 5.075
352 HZ3 LYS 41 3HZ LYS 41 27.106 18.448 3.400
353 H GLN 42 H GLN 42 20.284 20.426 6.199
354 HA GLN 42 HA GLN 42 19.256 22.400 6.678
355 HB2 GLN 42 1HB GLN 42 22.094 23.103 6.550
356 HB3 GLN 42 2HB GLN 42 21.026 24.450 6.176
357 HG2 GLN 42 1HG GLN 42 21.106 24.728 8.408
358 HG3 GLN 42 2HG GLN 42 19.801 23.544 8.363
359 HE21 GLN 42 2HE2 GLN 42 21.489 21.325 7.680
360 HE22 GLN 42 1HE2 GLN 42 22.398 20.929 9.095
361 H LEU 43 H LEU 43 18.224 21.670 4.556
362 HA LEU 43 HA LEU 43 18.484 23.861 2.607
363 HB2 LEU 43 1HB LEU 43 17.989 20.945 2.025
364 HB3 LEU 43 2HB LEU 43 17.903 22.240 0.832
365 HG LEU 43 HG LEU 43 20.434 21.782 2.361
366 HD11 LEU 43 1HD1 LEU 43 20.099 20.438 -0.257
367 HD12 LEU 43 2HD1 LEU 43 19.374 19.665 1.152
368 HD13 LEU 43 3HD1 LEU 43 21.105 20.002 1.125
369 HD21 LEU 43 1HD2 LEU 43 20.429 22.456 -0.495
370 HD22 LEU 43 2HD2 LEU 43 21.352 23.152 0.837
371 HD23 LEU 43 3HD2 LEU 43 19.687 23.664 0.554
372 H TYR 44 H TYR 44 16.750 24.542 4.280
373 HA TYR 44 HA TYR 44 14.220 24.341 2.987
374 HB2 TYR 44 1HB TYR 44 12.976 23.339 4.877
375 HB3 TYR 44 2HB TYR 44 14.118 22.210 4.156
376 HD1 TYR 44 HD1 TYR 44 16.529 22.258 5.321
377 HD2 TYR 44 HD2 TYR 44 12.885 23.431 7.177
378 HE1 TYR 44 HE1 TYR 44 17.533 21.857 7.530
379 HE2 TYR 44 HE2 TYR 44 13.878 23.034 9.392
380 HH TYR 44 HH TYR 44 15.743 22.546 10.513
381 H ASP 45 H ASP 45 12.538 25.614 4.137
382 HA ASP 45 HA ASP 45 13.705 28.027 5.178
383 HB2 ASP 45 1HB ASP 45 11.879 28.403 3.748
384 HB3 ASP 45 2HB ASP 45 10.901 27.160 4.523
385 H GLN 46 H GLN 46 14.481 27.868 7.207
386 HA GLN 46 HA GLN 46 13.692 26.266 9.270
387 HB2 GLN 46 1HB GLN 46 14.998 28.931 9.126
388 HB3 GLN 46 2HB GLN 46 14.402 28.416 10.698
389 HG2 GLN 46 1HG GLN 46 16.843 27.894 10.001
390 HG3 GLN 46 2HG GLN 46 15.890 26.677 10.848
391 HE21 GLN 46 2HE2 GLN 46 16.331 27.763 7.494
392 HE22 GLN 46 1HE2 GLN 46 16.533 26.181 6.830
393 H GLN 47 H GLN 47 12.149 29.185 8.133
394 HA GLN 47 HA GLN 47 10.447 29.545 10.391
395 HB2 GLN 47 1HB GLN 47 9.823 30.522 7.617
396 HB3 GLN 47 2HB GLN 47 9.407 31.259 9.159
397 HG2 GLN 47 1HG GLN 47 11.900 31.409 7.593
398 HG3 GLN 47 2HG GLN 47 11.107 32.626 8.590
399 HE21 GLN 47 2HE2 GLN 47 13.604 30.372 8.391
400 HE22 GLN 47 1HE2 GLN 47 14.148 30.455 10.028
401 H GLU 48 H GLU 48 10.229 27.747 7.395
402 HA GLU 48 HA GLU 48 7.740 26.536 8.374
403 HB2 GLU 48 1HB GLU 48 6.899 28.002 6.738
404 HB3 GLU 48 2HB GLU 48 8.250 27.708 5.653
405 HG2 GLU 48 1HG GLU 48 7.441 25.536 5.109
406 HG3 GLU 48 2HG GLU 48 6.205 25.623 6.363
407 H GLN 49 H GLN 49 8.797 24.673 9.000
408 HA GLN 49 HA GLN 49 10.748 23.287 7.594
409 HB2 GLN 49 1HB GLN 49 8.605 22.212 9.434
410 HB3 GLN 49 2HB GLN 49 10.005 21.295 8.894
411 HG2 GLN 49 1HG GLN 49 10.755 22.017 10.914
412 HG3 GLN 49 2HG GLN 49 11.321 23.335 9.890
413 HE21 GLN 49 2HE2 GLN 49 10.980 25.257 10.713
414 HE22 GLN 49 1HE2 GLN 49 9.666 25.717 11.735
415 H HIS 50 H HIS 50 7.272 23.309 7.196
416 HA HIS 50 HA HIS 50 7.049 21.014 5.567
417 HB2 HIS 50 1HB HIS 50 4.915 21.523 6.030
418 HB3 HIS 50 2HB HIS 50 5.333 23.183 6.444
419 HD1 HIS 50 HD1 HIS 50 4.421 24.911 4.926
420 HD2 HIS 50 HD2 HIS 50 4.636 21.192 3.088
421 HE1 HIS 50 HE1 HIS 50 3.361 25.216 2.666
422 H MET 51 H MET 51 8.552 23.946 4.984
423 HA MET 51 HA MET 51 8.252 23.645 2.069
424 HB2 MET 51 1HB MET 51 7.491 25.805 2.661
425 HB3 MET 51 2HB MET 51 8.827 26.058 3.776
426 HG2 MET 51 1HG MET 51 9.644 27.289 2.091
427 HG3 MET 51 2HG MET 51 10.196 25.726 1.495
428 HE1 MET 51 1HE MET 51 9.348 24.525 -0.525
429 HE2 MET 51 2HE MET 51 7.790 24.246 0.255
430 HE3 MET 51 3HE MET 51 7.852 24.885 -1.389
431 H VAL 52 H VAL 52 9.888 22.382 1.406
432 HA VAL 52 HA VAL 52 12.529 22.626 2.590
433 HB VAL 52 HB VAL 52 11.402 20.778 0.492
434 HG11 VAL 52 1HG1 VAL 52 13.668 21.188 -0.160
435 HG12 VAL 52 2HG1 VAL 52 14.234 21.000 1.501
436 HG13 VAL 52 3HG1 VAL 52 13.603 19.608 0.620
437 HG21 VAL 52 1HG2 VAL 52 12.662 19.716 2.918
438 HG22 VAL 52 2HG2 VAL 52 11.209 20.675 3.205
439 HG23 VAL 52 3HG2 VAL 52 11.143 19.271 2.139
440 H TYR 53 H TYR 53 14.407 23.178 1.452
441 HA TYR 53 HA TYR 53 13.938 24.665 -1.050
442 HB2 TYR 53 1HB TYR 53 15.431 25.376 1.411
443 HB3 TYR 53 2HB TYR 53 16.183 25.827 -0.115
444 HD1 TYR 53 HD1 TYR 53 12.537 25.708 0.450
445 HD2 TYR 53 HD2 TYR 53 15.977 28.190 0.117
446 HE1 TYR 53 HE1 TYR 53 11.087 27.691 0.326
447 HE2 TYR 53 HE2 TYR 53 14.537 30.180 -0.006
448 HH TYR 53 HH TYR 53 11.980 30.554 -0.793
449 H CYS 54 H CYS 54 14.419 22.728 -2.227
450 HA CYS 54 HA CYS 54 16.738 21.207 -1.983
451 HB2 CYS 54 1HB CYS 54 16.195 20.265 -4.052
452 HB3 CYS 54 2HB CYS 54 14.639 20.813 -3.441
453 HG CYS 54 HG CYS 54 14.492 21.421 -6.072
454 H GLY 55 H GLY 55 16.232 24.343 -3.394
455 HA2 GLY 55 1HA GLY 55 17.649 25.812 -4.455
456 HA3 GLY 55 2HA GLY 55 18.861 25.146 -3.371
457 H GLY 56 H GLY 56 20.301 23.586 -4.119
458 HA2 GLY 56 1HA GLY 56 20.076 22.666 -6.871
459 HA3 GLY 56 2HA GLY 56 21.417 23.752 -6.538
460 H ASP 57 H ASP 57 20.372 21.609 -4.039
461 HA ASP 57 HA ASP 57 22.941 20.303 -4.038
462 HB2 ASP 57 1HB ASP 57 21.079 20.919 -2.088
463 HB3 ASP 57 2HB ASP 57 20.919 19.173 -2.256
464 H LEU 58 H LEU 58 22.559 17.768 -3.299
465 HA LEU 58 HA LEU 58 22.271 16.331 -5.603
466 HB2 LEU 58 1HB LEU 58 22.278 15.729 -2.751
467 HB3 LEU 58 2HB LEU 58 21.366 14.557 -3.700
468 HG LEU 58 HG LEU 58 23.522 13.661 -3.533
469 HD11 LEU 58 1HD1 LEU 58 24.006 13.299 -5.716
470 HD12 LEU 58 2HD1 LEU 58 23.969 15.014 -6.126
471 HD13 LEU 58 3HD1 LEU 58 22.461 14.121 -5.933
472 HD21 LEU 58 1HD2 LEU 58 25.533 15.068 -4.243
473 HD22 LEU 58 2HD2 LEU 58 24.817 15.409 -2.668
474 HD23 LEU 58 3HD2 LEU 58 24.473 16.462 -4.041
475 H LEU 59 H LEU 59 19.751 16.696 -3.104
476 HA LEU 59 HA LEU 59 17.724 15.365 -4.502
477 HB2 LEU 59 1HB LEU 59 16.377 15.943 -2.783
478 HB3 LEU 59 2HB LEU 59 17.924 16.322 -2.030
479 HG LEU 59 HG LEU 59 16.203 18.374 -3.409
480 HD11 LEU 59 1HD1 LEU 59 15.155 17.207 -1.389
481 HD12 LEU 59 2HD1 LEU 59 15.251 18.967 -1.362
482 HD13 LEU 59 3HD1 LEU 59 16.407 18.008 -0.440
483 HD21 LEU 59 1HD2 LEU 59 17.924 19.324 -1.321
484 HD22 LEU 59 2HD2 LEU 59 17.877 19.780 -3.025
485 HD23 LEU 59 3HD2 LEU 59 18.859 18.410 -2.504
486 H GLY 60 H GLY 60 18.735 18.745 -4.527
487 HA2 GLY 60 1HA GLY 60 16.587 19.828 -5.957
488 HA3 GLY 60 2HA GLY 60 18.221 20.474 -5.945
489 H GLU 61 H GLU 61 19.579 18.332 -7.130
490 HA GLU 61 HA GLU 61 19.027 18.853 -9.878
491 HB2 GLU 61 1HB GLU 61 21.066 17.950 -10.281
492 HB3 GLU 61 2HB GLU 61 21.258 18.149 -8.545
493 HG2 GLU 61 1HG GLU 61 20.623 15.839 -8.182
494 HG3 GLU 61 2HG GLU 61 20.347 15.626 -9.910
495 H LEU 62 H LEU 62 18.716 15.978 -7.816
496 HA LEU 62 HA LEU 62 17.853 14.156 -9.712
497 HB2 LEU 62 1HB LEU 62 17.848 14.379 -6.842
498 HB3 LEU 62 2HB LEU 62 16.359 13.621 -7.404
499 HG LEU 62 HG LEU 62 18.016 11.944 -6.832
500 HD11 LEU 62 1HD1 LEU 62 16.459 11.484 -8.665
501 HD12 LEU 62 2HD1 LEU 62 18.011 10.683 -8.910
502 HD13 LEU 62 3HD1 LEU 62 17.621 12.145 -9.815
503 HD21 LEU 62 1HD2 LEU 62 20.000 13.382 -7.276
504 HD22 LEU 62 2HD2 LEU 62 19.742 13.128 -9.002
505 HD23 LEU 62 3HD2 LEU 62 20.124 11.760 -7.956
506 H LEU 63 H LEU 63 15.942 16.475 -7.831
507 HA LEU 63 HA LEU 63 13.470 15.673 -9.073
508 HB2 LEU 63 1HB LEU 63 14.317 17.500 -6.948
509 HB3 LEU 63 2HB LEU 63 12.957 18.088 -7.902
510 HG LEU 63 HG LEU 63 12.557 15.340 -7.104
511 HD11 LEU 63 1HD1 LEU 63 12.820 17.319 -4.851
512 HD12 LEU 63 2HD1 LEU 63 14.024 16.087 -5.227
513 HD13 LEU 63 3HD1 LEU 63 12.398 15.610 -4.741
514 HD21 LEU 63 1HD2 LEU 63 10.998 17.388 -7.809
515 HD22 LEU 63 2HD2 LEU 63 10.909 17.564 -6.056
516 HD23 LEU 63 3HD2 LEU 63 10.423 16.049 -6.817
517 H GLY 64 H GLY 64 15.601 18.516 -9.233
518 HA2 GLY 64 1HA GLY 64 16.066 19.759 -11.170
519 HA3 GLY 64 2HA GLY 64 14.706 18.983 -11.968
520 H ARG 65 H ARG 65 14.428 20.445 -8.807
521 HA ARG 65 HA ARG 65 12.965 22.701 -10.005
522 HB2 ARG 65 1HB ARG 65 12.104 21.402 -7.432
523 HB3 ARG 65 2HB ARG 65 11.195 22.499 -8.463
524 HG2 ARG 65 1HG ARG 65 11.997 19.995 -9.757
525 HG3 ARG 65 2HG ARG 65 10.880 19.808 -8.403
526 HD2 ARG 65 1HD ARG 65 9.204 20.424 -9.720
527 HD3 ARG 65 2HD ARG 65 9.973 21.994 -9.947
528 HE ARG 65 HE ARG 65 11.203 20.186 -11.675
529 HH11 ARG 65 1HH1 ARG 65 8.082 21.654 -11.199
530 HH12 ARG 65 2HH1 ARG 65 7.651 21.591 -12.876
531 HH21 ARG 65 1HH2 ARG 65 10.647 20.097 -13.885
532 HH22 ARG 65 2HH2 ARG 65 9.111 20.704 -14.403
533 H GLN 66 H GLN 66 12.302 24.050 -7.708
534 HA GLN 66 HA GLN 66 14.952 24.849 -6.723
535 HB2 GLN 66 1HB GLN 66 13.550 26.935 -5.992
536 HB3 GLN 66 2HB GLN 66 14.050 26.752 -7.668
537 HG2 GLN 66 1HG GLN 66 11.893 26.044 -8.331
538 HG3 GLN 66 2HG GLN 66 11.368 25.856 -6.658
539 HE21 GLN 66 2HE2 GLN 66 12.680 28.330 -8.835
540 HE22 GLN 66 1HE2 GLN 66 11.682 29.615 -8.254
541 H SER 67 H SER 67 11.636 24.201 -5.664
542 HA SER 67 HA SER 67 12.602 23.253 -3.117
543 HB2 SER 67 1HB SER 67 10.696 24.902 -2.110
544 HB3 SER 67 2HB SER 67 12.414 25.299 -2.146
545 HG SER 67 HG SER 67 10.450 26.607 -3.299
546 H PHE 68 H PHE 68 10.922 22.223 -1.847
547 HA PHE 68 HA PHE 68 8.377 21.765 -3.194
548 HB2 PHE 68 1HB PHE 68 8.617 19.303 -2.986
549 HB3 PHE 68 2HB PHE 68 9.780 20.007 -4.106
550 HD1 PHE 68 HD1 PHE 68 9.449 18.964 -0.547
551 HD2 PHE 68 HD2 PHE 68 12.013 19.464 -3.908
552 HE1 PHE 68 HE1 PHE 68 11.283 17.895 0.697
553 HE2 PHE 68 HE2 PHE 68 13.851 18.396 -2.669
554 HZ PHE 68 HZ PHE 68 13.487 17.609 -0.364
555 H SER 69 H SER 69 6.723 21.068 -1.833
556 HA SER 69 HA SER 69 7.135 21.682 0.956
557 HB2 SER 69 1HB SER 69 4.550 20.787 0.787
558 HB3 SER 69 2HB SER 69 5.054 22.456 0.523
559 HG SER 69 HG SER 69 4.626 22.250 -1.526
560 H VAL 70 H VAL 70 7.200 20.297 2.641
561 HA VAL 70 HA VAL 70 7.667 17.517 2.090
562 HB VAL 70 HB VAL 70 8.581 17.385 4.153
563 HG11 VAL 70 1HG1 VAL 70 8.360 20.380 4.204
564 HG12 VAL 70 2HG1 VAL 70 9.688 19.364 4.765
565 HG13 VAL 70 3HG1 VAL 70 9.376 19.535 3.038
566 HG21 VAL 70 1HG2 VAL 70 6.516 17.436 5.373
567 HG22 VAL 70 2HG2 VAL 70 7.656 18.525 6.165
568 HG23 VAL 70 3HG2 VAL 70 6.372 19.180 5.148
569 H LYS 71 H LYS 71 5.131 19.403 3.673
570 HA LYS 71 HA LYS 71 3.611 17.168 4.544
571 HB2 LYS 71 1HB LYS 71 3.532 19.874 5.002
572 HB3 LYS 71 2HB LYS 71 2.107 19.629 4.001
573 HG2 LYS 71 1HG LYS 71 1.248 17.994 5.555
574 HG3 LYS 71 2HG LYS 71 2.716 18.109 6.529
575 HD2 LYS 71 1HD LYS 71 1.144 20.584 5.977
576 HD3 LYS 71 2HD LYS 71 0.552 19.446 7.189
577 HE2 LYS 71 1HE LYS 71 2.833 19.560 8.247
578 HE3 LYS 71 2HE LYS 71 3.198 20.886 7.145
579 HZ1 LYS 71 1HZ LYS 71 0.830 21.620 8.232
580 HZ2 LYS 71 2HZ LYS 71 2.347 22.174 8.733
581 HZ3 LYS 71 3HZ LYS 71 1.610 20.882 9.538
582 H ASP 72 H ASP 72 4.193 18.377 1.487
583 HA ASP 72 HA ASP 72 1.728 17.139 0.446
584 HB2 ASP 72 1HB ASP 72 3.293 19.452 -0.720
585 HB3 ASP 72 2HB ASP 72 1.920 18.669 -1.498
586 HA PRO 73 HA PRO 73 5.129 14.507 -1.083
587 HB2 PRO 73 1HB PRO 73 3.590 12.278 -1.272
588 HB3 PRO 73 2HB PRO 73 4.343 12.801 0.239
589 HG2 PRO 73 1HG PRO 73 1.530 13.187 -0.707
590 HG3 PRO 73 2HG PRO 73 2.115 12.725 0.902
591 HD2 PRO 73 1HD PRO 73 1.344 15.250 0.302
592 HD3 PRO 73 2HD PRO 73 2.627 14.898 1.477
593 H SER 74 H SER 74 4.363 16.235 -2.891
594 HA SER 74 HA SER 74 2.922 14.850 -5.027
595 HB2 SER 74 1HB SER 74 3.438 17.664 -4.330
596 HB3 SER 74 2HB SER 74 3.546 17.306 -6.054
597 HG SER 74 HG SER 74 1.351 16.888 -4.315
598 HA PRO 75 HA PRO 75 6.969 15.922 -7.367
599 HB2 PRO 75 1HB PRO 75 8.878 17.350 -6.069
600 HB3 PRO 75 2HB PRO 75 7.560 18.106 -6.971
601 HG2 PRO 75 1HG PRO 75 7.817 17.640 -4.025
602 HG3 PRO 75 2HG PRO 75 7.233 19.078 -4.884
603 HD2 PRO 75 1HD PRO 75 5.557 17.270 -3.763
604 HD3 PRO 75 2HD PRO 75 5.141 18.175 -5.232
605 H LEU 76 H LEU 76 7.230 15.214 -3.945
606 HA LEU 76 HA LEU 76 9.726 13.966 -3.895
607 HB2 LEU 76 1HB LEU 76 8.336 14.579 -1.919
608 HB3 LEU 76 2HB LEU 76 7.302 13.198 -2.278
609 HG LEU 76 HG LEU 76 9.587 11.883 -2.081
610 HD11 LEU 76 1HD1 LEU 76 11.240 13.336 -1.595
611 HD12 LEU 76 2HD1 LEU 76 10.637 13.136 0.050
612 HD13 LEU 76 3HD1 LEU 76 10.139 14.530 -0.908
613 HD21 LEU 76 1HD2 LEU 76 7.359 12.300 -0.467
614 HD22 LEU 76 2HD2 LEU 76 8.742 12.514 0.607
615 HD23 LEU 76 3HD2 LEU 76 8.560 11.018 -0.309
616 H TYR 77 H TYR 77 6.505 12.527 -4.373
617 HA TYR 77 HA TYR 77 7.484 9.902 -4.824
618 HB2 TYR 77 1HB TYR 77 4.858 11.282 -5.212
619 HB3 TYR 77 2HB TYR 77 5.109 9.702 -5.946
620 HD1 TYR 77 HD2 TYR 77 5.814 7.780 -4.415
621 HD2 TYR 77 HD1 TYR 77 4.272 11.466 -2.952
622 HE1 TYR 77 HE2 TYR 77 5.264 6.695 -2.277
623 HE2 TYR 77 HE1 TYR 77 3.718 10.392 -0.810
624 HH TYR 77 HH TYR 77 3.961 6.944 -0.367
625 H ASP 78 H ASP 78 6.508 12.534 -6.982
626 HA ASP 78 HA ASP 78 6.644 11.247 -9.421
627 HB2 ASP 78 1HB ASP 78 6.300 13.853 -8.589
628 HB3 ASP 78 2HB ASP 78 7.814 13.930 -9.487
629 H MET 79 H MET 79 9.272 12.703 -7.545
630 HA MET 79 HA MET 79 11.279 12.136 -9.498
631 HB2 MET 79 1HB MET 79 12.206 13.737 -8.228
632 HB3 MET 79 2HB MET 79 11.137 13.395 -6.874
633 HG2 MET 79 1HG MET 79 12.585 11.528 -6.218
634 HG3 MET 79 2HG MET 79 13.666 11.915 -7.555
635 HE1 MET 79 1HE MET 79 13.610 13.727 -3.433
636 HE2 MET 79 2HE MET 79 12.073 13.339 -4.207
637 HE3 MET 79 3HE MET 79 13.284 12.078 -3.969
638 H LEU 80 H LEU 80 10.408 10.674 -6.372
639 HA LEU 80 HA LEU 80 12.320 8.678 -6.274
640 HB2 LEU 80 1HB LEU 80 9.468 8.692 -5.314
641 HB3 LEU 80 2HB LEU 80 10.605 7.398 -4.943
642 HG LEU 80 HG LEU 80 11.019 10.280 -4.162
643 HD11 LEU 80 1HD1 LEU 80 9.531 8.076 -2.858
644 HD12 LEU 80 2HD1 LEU 80 9.270 9.819 -2.792
645 HD13 LEU 80 3HD1 LEU 80 10.555 9.084 -1.835
646 HD21 LEU 80 1HD2 LEU 80 12.819 8.203 -4.327
647 HD22 LEU 80 2HD2 LEU 80 12.331 8.181 -2.632
648 HD23 LEU 80 3HD2 LEU 80 12.996 9.654 -3.339
649 H ARG 81 H ARG 81 9.363 8.839 -8.138
650 HA ARG 81 HA ARG 81 8.751 6.337 -8.860
651 HB2 ARG 81 1HB ARG 81 8.090 8.697 -9.887
652 HB3 ARG 81 2HB ARG 81 9.219 8.198 -11.141
653 HG2 ARG 81 1HG ARG 81 7.719 5.963 -10.909
654 HG3 ARG 81 2HG ARG 81 6.529 7.205 -10.512
655 HD2 ARG 81 1HD ARG 81 6.450 7.966 -12.619
656 HD3 ARG 81 2HD ARG 81 8.199 7.861 -12.819
657 HE ARG 81 HE ARG 81 7.164 5.267 -12.840
658 HH11 ARG 81 1HH1 ARG 81 7.070 8.164 -14.769
659 HH12 ARG 81 2HH1 ARG 81 6.836 7.318 -16.262
660 HH21 ARG 81 1HH2 ARG 81 6.857 4.142 -14.800
661 HH22 ARG 81 2HH2 ARG 81 6.714 5.030 -16.279
662 H LYS 82 H LYS 82 11.379 8.157 -10.444
663 HA LYS 82 HA LYS 82 12.499 5.595 -11.356
664 HB2 LYS 82 1HB LYS 82 13.209 6.613 -13.255
665 HB3 LYS 82 2HB LYS 82 11.923 7.748 -12.866
666 HG2 LYS 82 1HG LYS 82 14.814 8.095 -12.101
667 HG3 LYS 82 2HG LYS 82 14.033 8.851 -13.492
668 HD2 LYS 82 1HD LYS 82 13.252 9.238 -10.601
669 HD3 LYS 82 2HD LYS 82 14.161 10.386 -11.587
670 HE2 LYS 82 1HE LYS 82 12.089 10.150 -13.187
671 HE3 LYS 82 2HE LYS 82 11.279 9.631 -11.710
672 HZ1 LYS 82 1HZ LYS 82 10.963 11.804 -11.389
673 HZ2 LYS 82 2HZ LYS 82 12.159 12.259 -12.495
674 HZ3 LYS 82 3HZ LYS 82 12.585 11.848 -10.911
675 H ASN 83 H ASN 83 12.839 7.749 -8.911
676 HA ASN 83 HA ASN 83 15.753 7.705 -8.820
677 HB2 ASN 83 1HB ASN 83 15.219 9.759 -8.015
678 HB3 ASN 83 2HB ASN 83 13.614 9.250 -7.496
679 HD21 ASN 83 2HD2 ASN 83 13.641 10.081 -5.478
680 HD22 ASN 83 1HD2 ASN 83 14.724 9.568 -4.233
681 H LEU 84 H LEU 84 13.053 6.775 -6.683
682 HA LEU 84 HA LEU 84 14.765 5.218 -4.984
683 HB2 LEU 84 1HB LEU 84 12.243 6.352 -4.768
684 HB3 LEU 84 2HB LEU 84 11.935 4.617 -4.776
685 HG LEU 84 HG LEU 84 13.312 4.306 -2.832
686 HD11 LEU 84 1HD1 LEU 84 14.535 6.698 -3.669
687 HD12 LEU 84 2HD1 LEU 84 14.974 5.672 -2.304
688 HD13 LEU 84 3HD1 LEU 84 13.846 7.009 -2.075
689 HD21 LEU 84 1HD2 LEU 84 11.260 6.482 -2.706
690 HD22 LEU 84 2HD2 LEU 84 12.120 5.973 -1.252
691 HD23 LEU 84 3HD2 LEU 84 11.152 4.809 -2.158
692 H VAL 85 H VAL 85 15.709 3.574 -6.125
693 HA VAL 85 HA VAL 85 14.443 1.933 -8.014
694 HB VAL 85 HB VAL 85 16.898 1.582 -6.323
695 HG11 VAL 85 1HG1 VAL 85 17.280 -0.460 -7.884
696 HG12 VAL 85 2HG1 VAL 85 16.294 -0.649 -6.433
697 HG13 VAL 85 3HG1 VAL 85 15.521 -0.468 -8.008
698 HG21 VAL 85 1HG2 VAL 85 17.824 2.644 -8.038
699 HG22 VAL 85 2HG2 VAL 85 17.379 1.297 -9.086
700 HG23 VAL 85 3HG2 VAL 85 16.283 2.665 -8.896
701 H THR 86 H THR 86 12.534 1.024 -7.428
702 HA THR 86 HA THR 86 12.406 -0.512 -4.936
703 HB THR 86 HB THR 86 10.039 -0.487 -5.126
704 HG1 THR 86 1HG THR 86 10.584 -0.190 -7.790
705 HG21 THR 86 1HG2 THR 86 9.824 1.669 -4.569
706 HG22 THR 86 2HG2 THR 86 10.251 2.207 -6.194
707 HG23 THR 86 3HG2 THR 86 11.518 1.854 -5.019
708 H LEU 87 H LEU 87 11.312 -2.631 -4.996
709 HA LEU 87 HA LEU 87 11.904 -4.078 -7.495
710 HB2 LEU 87 1HB LEU 87 11.851 -5.662 -5.035
711 HB3 LEU 87 2HB LEU 87 12.987 -5.694 -6.382
712 HG LEU 87 HG LEU 87 13.053 -3.592 -4.227
713 HD11 LEU 87 1HD1 LEU 87 14.680 -6.124 -4.378
714 HD12 LEU 87 2HD1 LEU 87 13.351 -5.841 -3.256
715 HD13 LEU 87 3HD1 LEU 87 14.809 -4.854 -3.161
716 HD21 LEU 87 1HD2 LEU 87 14.486 -2.667 -5.660
717 HD22 LEU 87 2HD2 LEU 87 14.517 -4.106 -6.680
718 HD23 LEU 87 3HD2 LEU 87 15.578 -3.998 -5.274
719 H ALA 88 H ALA 88 10.708 -6.284 -7.494
720 HA ALA 88 HA ALA 88 8.767 -7.496 -7.426
721 HB1 ALA 88 1HB ALA 88 8.731 -6.359 -5.002
722 HB2 ALA 88 2HB ALA 88 7.303 -5.596 -5.701
723 HB3 ALA 88 3HB ALA 88 7.412 -7.354 -5.620
724 H THR 89 H THR 89 9.296 -5.531 -9.394
725 HA THR 89 HA THR 89 8.307 -4.368 -11.086
726 HB THR 89 HB THR 89 5.644 -5.158 -11.110
727 HG1 THR 89 1HG THR 89 5.797 -6.678 -9.541
728 HG21 THR 89 1HG2 THR 89 7.401 -5.143 -12.941
729 HG22 THR 89 2HG2 THR 89 6.266 -6.493 -12.966
730 HG23 THR 89 3HG2 THR 89 7.900 -6.725 -12.345
731 H1 SER 115 H SER 115 9.214 14.756 23.717
732 HA SER 115 HA SER 115 7.835 17.224 23.550
733 HB2 SER 115 1HB SER 115 9.259 17.748 25.198
734 HB3 SER 115 2HB SER 115 10.064 16.198 24.959
735 HG SER 115 HG SER 115 11.480 18.016 24.752
736 H GLN 116 H GLN 116 10.252 15.692 21.573
737 HA GLN 116 HA GLN 116 10.817 18.127 20.093
738 HB2 GLN 116 1HB GLN 116 11.825 15.295 19.872
739 HB3 GLN 116 2HB GLN 116 12.245 16.541 18.704
740 HG2 GLN 116 1HG GLN 116 12.965 16.382 21.608
741 HG3 GLN 116 2HG GLN 116 14.033 16.470 20.208
742 HE21 GLN 116 2HE2 GLN 116 13.356 18.526 18.802
743 HE22 GLN 116 1HE2 GLN 116 13.341 19.995 19.710
744 H GLU 117 H GLU 117 10.192 18.552 18.006
745 HA GLU 117 HA GLU 117 8.364 16.635 16.733
746 HB2 GLU 117 1HB GLU 117 7.513 19.275 16.090
747 HB3 GLU 117 2HB GLU 117 6.623 18.013 16.930
748 HG2 GLU 117 1HG GLU 117 7.836 18.771 19.029
749 HG3 GLU 117 2HG GLU 117 8.318 20.190 18.102
750 H THR 118 H THR 118 9.510 19.908 15.935
751 HA THR 118 HA THR 118 10.262 20.718 13.912
752 HB THR 118 HB THR 118 12.294 18.567 13.779
753 HG1 THR 118 1HG THR 118 12.661 18.621 15.857
754 HG21 THR 118 1HG2 THR 118 13.716 20.285 13.211
755 HG22 THR 118 2HG2 THR 118 12.850 21.470 14.189
756 HG23 THR 118 3HG2 THR 118 12.180 20.940 12.647
757 H PHE 119 H PHE 119 11.787 19.161 11.961
758 HA PHE 119 HA PHE 119 10.027 18.690 9.994
759 HB2 PHE 119 1HB PHE 119 12.673 18.252 10.231
760 HB3 PHE 119 2HB PHE 119 12.106 16.585 10.209
761 HD1 PHE 119 HD1 PHE 119 9.635 17.685 8.405
762 HD2 PHE 119 HD2 PHE 119 13.882 17.636 8.124
763 HE1 PHE 119 HE1 PHE 119 9.471 17.774 5.951
764 HE2 PHE 119 HE2 PHE 119 13.725 17.726 5.670
765 HZ PHE 119 HZ PHE 119 11.517 17.796 4.581
766 H SER 120 H SER 120 10.873 16.353 12.517
767 HA SER 120 HA SER 120 9.540 14.119 11.645
768 HB2 SER 120 1HB SER 120 10.750 14.914 14.021
769 HB3 SER 120 2HB SER 120 9.091 14.544 14.492
770 HG SER 120 HG SER 120 11.000 12.859 13.272
771 H ASP 121 H ASP 121 8.194 16.904 13.367
772 HA ASP 121 HA ASP 121 5.636 16.027 13.866
773 HB2 ASP 121 1HB ASP 121 6.766 18.307 14.383
774 HB3 ASP 121 2HB ASP 121 6.113 18.805 12.825
775 H LEU 122 H LEU 122 6.497 18.001 11.020
776 HA LEU 122 HA LEU 122 4.096 17.236 9.649
777 HB2 LEU 122 1HB LEU 122 6.405 18.509 8.258
778 HB3 LEU 122 2HB LEU 122 4.677 18.776 8.038
779 HG LEU 122 HG LEU 122 6.391 19.810 10.294
780 HD11 LEU 122 1HD1 LEU 122 5.913 21.987 9.369
781 HD12 LEU 122 2HD1 LEU 122 4.910 21.266 8.110
782 HD13 LEU 122 3HD1 LEU 122 6.648 20.966 8.133
783 HD21 LEU 122 1HD2 LEU 122 3.744 19.128 10.477
784 HD22 LEU 122 2HD2 LEU 122 3.669 20.833 10.030
785 HD23 LEU 122 3HD2 LEU 122 4.562 20.336 11.468
786 H TRP 123 H TRP 123 7.563 16.716 8.990
787 HA TRP 123 HA TRP 123 7.609 15.217 6.791
788 HB2 TRP 123 1HB TRP 123 9.528 15.671 8.407
789 HB3 TRP 123 2HB TRP 123 9.017 14.222 9.268
790 HD1 TRP 123 HD1 TRP 123 10.485 12.239 8.633
791 HE1 TRP 123 HE1 TRP 123 11.651 11.401 6.497
792 HE3 TRP 123 HE3 TRP 123 9.107 15.982 5.435
793 HZ2 TRP 123 HZ2 TRP 123 11.948 12.218 3.812
794 HZ3 TRP 123 HZ3 TRP 123 9.874 15.879 3.099
795 HH2 TRP 123 HH2 TRP 123 11.265 14.036 2.307
796 H LYS 124 H LYS 124 6.987 13.746 9.983
797 HA LYS 124 HA LYS 124 6.483 11.173 9.310
798 HB2 LYS 124 1HB LYS 124 6.323 12.243 11.604
799 HB3 LYS 124 2HB LYS 124 4.678 12.701 11.184
800 HG2 LYS 124 1HG LYS 124 3.885 10.621 11.473
801 HG3 LYS 124 2HG LYS 124 5.322 9.863 10.785
802 HD2 LYS 124 1HD LYS 124 5.488 11.195 13.455
803 HD3 LYS 124 2HD LYS 124 4.776 9.585 13.326
804 HE2 LYS 124 1HE LYS 124 6.894 8.951 12.042
805 HE3 LYS 124 2HE LYS 124 7.569 10.461 12.652
806 HZ1 LYS 124 1HZ LYS 124 7.606 9.692 14.787
807 HZ2 LYS 124 2HZ LYS 124 7.876 8.243 13.959
808 HZ3 LYS 124 3HZ LYS 124 6.334 8.601 14.553
809 H LEU 125 H LEU 125 4.201 13.867 8.997
810 HA LEU 125 HA LEU 125 1.887 12.647 8.301
811 HB2 LEU 125 1HB LEU 125 2.503 15.142 8.336
812 HB3 LEU 125 2HB LEU 125 2.929 14.917 6.641
813 HG LEU 125 HG LEU 125 0.217 14.074 7.528
814 HD11 LEU 125 1HD1 LEU 125 -0.360 16.076 8.286
815 HD12 LEU 125 2HD1 LEU 125 -0.026 16.732 6.684
816 HD13 LEU 125 3HD1 LEU 125 1.235 16.730 7.916
817 HD21 LEU 125 1HD2 LEU 125 1.545 15.070 5.045
818 HD22 LEU 125 2HD2 LEU 125 -0.202 15.231 5.231
819 HD23 LEU 125 3HD2 LEU 125 0.549 13.635 5.289
820 H LEU 126 H LEU 126 4.613 13.255 6.104
821 HA LEU 126 HA LEU 126 3.656 12.408 3.715
822 HB2 LEU 126 1HB LEU 126 6.305 12.147 5.035
823 HB3 LEU 126 2HB LEU 126 6.041 11.267 3.531
824 HG LEU 126 HG LEU 126 5.175 13.836 2.958
825 HD11 LEU 126 1HD1 LEU 126 7.569 13.900 4.773
826 HD12 LEU 126 2HD1 LEU 126 6.082 14.842 4.883
827 HD13 LEU 126 3HD1 LEU 126 7.237 15.165 3.590
828 HD21 LEU 126 1HD2 LEU 126 7.991 13.154 2.370
829 HD22 LEU 126 2HD2 LEU 126 6.699 13.684 1.292
830 HD23 LEU 126 3HD2 LEU 126 6.766 12.005 1.830
831 HA PRO 127 HA PRO 127 2.272 8.278 4.925
832 HB2 PRO 127 1HB PRO 127 0.688 7.941 2.747
833 HB3 PRO 127 2HB PRO 127 0.184 8.864 4.167
834 HG2 PRO 127 1HG PRO 127 1.265 9.847 1.554
835 HG3 PRO 127 2HG PRO 127 -0.082 10.481 2.517
836 HD2 PRO 127 1HD PRO 127 2.380 11.608 2.538
837 HD3 PRO 127 2HD PRO 127 1.315 11.613 3.959
838 H GLU 128 H GLU 128 4.341 7.332 4.600
839 HA GLU 128 HA GLU 128 5.819 6.940 2.391
840 HB2 GLU 128 1HB GLU 128 6.088 4.475 3.339
841 HB3 GLU 128 2HB GLU 128 6.752 5.869 4.181
842 HG2 GLU 128 1HG GLU 128 3.988 5.184 4.892
843 HG3 GLU 128 2HG GLU 128 5.200 3.980 5.327
844 H ASN 129 H ASN 129 2.740 5.411 3.070
845 HA ASN 129 HA ASN 129 2.910 3.708 0.726
846 HB2 ASN 129 1HB ASN 129 0.352 4.029 2.213
847 HB3 ASN 129 2HB ASN 129 1.103 2.572 1.567
848 HD21 ASN 129 2HD2 ASN 129 0.935 4.771 4.239
849 HD22 ASN 129 1HD2 ASN 129 1.814 3.796 5.363
Start of MODEL 2
1 H1 GLN 1 H GLN 1 3.073 3.306 -2.402
2 HA GLN 1 HA GLN 1 4.647 1.579 -3.478
3 HB2 GLN 1 1HB GLN 1 6.138 4.176 -3.630
4 HB3 GLN 1 2HB GLN 1 7.020 2.662 -3.472
5 HG2 GLN 1 1HG GLN 1 6.984 2.932 -5.744
6 HG3 GLN 1 2HG GLN 1 5.562 1.919 -5.494
7 HE21 GLN 1 2HE2 GLN 1 6.751 4.953 -6.544
8 HE22 GLN 1 1HE2 GLN 1 5.239 5.631 -7.032
9 H ILE 2 H ILE 2 4.662 0.384 -1.684
10 HA ILE 2 HA ILE 2 6.114 1.429 0.651
11 HB ILE 2 HB ILE 2 3.588 -0.223 0.777
12 HG12 ILE 2 1HG1 ILE 2 3.066 2.057 0.147
13 HG13 ILE 2 2HG1 ILE 2 2.617 1.812 1.832
14 HG21 ILE 2 1HG2 ILE 2 4.493 -0.862 2.729
15 HG22 ILE 2 2HG2 ILE 2 5.664 0.456 2.733
16 HG23 ILE 2 3HG2 ILE 2 4.012 0.742 3.279
17 HD11 ILE 2 1HD1 ILE 2 4.492 3.677 0.662
18 HD12 ILE 2 2HD1 ILE 2 3.740 3.674 2.258
19 HD13 ILE 2 3HD1 ILE 2 5.210 2.742 1.973
20 H ASN 3 H ASN 3 7.227 -0.166 -1.365
21 HA ASN 3 HA ASN 3 7.516 -2.767 -0.011
22 HB2 ASN 3 1HB ASN 3 6.913 -2.201 -2.700
23 HB3 ASN 3 2HB ASN 3 8.585 -2.754 -2.692
24 HD21 ASN 3 2HD2 ASN 3 8.292 -4.454 -0.399
25 HD22 ASN 3 1HD2 ASN 3 7.371 -5.826 -0.905
26 H GLN 4 H GLN 4 9.812 -3.671 -1.177
27 HA GLN 4 HA GLN 4 11.802 -2.230 0.278
28 HB2 GLN 4 1HB GLN 4 12.145 -4.507 -1.681
29 HB3 GLN 4 2HB GLN 4 13.346 -3.945 -0.526
30 HG2 GLN 4 1HG GLN 4 12.481 -5.784 0.540
31 HG3 GLN 4 2HG GLN 4 11.528 -4.477 1.241
32 HE21 GLN 4 2HE2 GLN 4 9.668 -5.492 1.690
33 HE22 GLN 4 1HE2 GLN 4 8.670 -6.283 0.523
34 H VAL 5 H VAL 5 14.044 -2.021 -0.992
35 HA VAL 5 HA VAL 5 13.783 -0.977 -3.665
36 HB VAL 5 HB VAL 5 14.576 1.285 -3.145
37 HG11 VAL 5 1HG1 VAL 5 12.124 0.691 -3.316
38 HG12 VAL 5 2HG1 VAL 5 12.081 0.742 -1.553
39 HG13 VAL 5 3HG1 VAL 5 12.499 2.191 -2.468
40 HG21 VAL 5 1HG2 VAL 5 15.135 2.025 -1.085
41 HG22 VAL 5 2HG2 VAL 5 13.880 1.079 -0.285
42 HG23 VAL 5 3HG2 VAL 5 15.390 0.308 -0.771
43 H ARG 6 H ARG 6 15.945 0.060 -4.348
44 HA ARG 6 HA ARG 6 18.216 -1.133 -2.936
45 HB2 ARG 6 1HB ARG 6 17.127 -2.194 -5.314
46 HB3 ARG 6 2HB ARG 6 18.618 -1.381 -5.772
47 HG2 ARG 6 1HG ARG 6 19.750 -2.669 -3.925
48 HG3 ARG 6 2HG ARG 6 18.265 -3.613 -3.795
49 HD2 ARG 6 1HD ARG 6 19.227 -4.940 -5.327
50 HD3 ARG 6 2HD ARG 6 18.724 -3.699 -6.473
51 HE ARG 6 HE ARG 6 21.261 -3.082 -5.369
52 HH11 ARG 6 1HH1 ARG 6 19.690 -5.177 -7.663
53 HH12 ARG 6 2HH1 ARG 6 21.099 -5.365 -8.654
54 HH21 ARG 6 1HH2 ARG 6 23.123 -3.322 -6.665
55 HH22 ARG 6 2HH2 ARG 6 23.051 -4.310 -8.084
56 HA PRO 7 HA PRO 7 19.212 3.189 -3.997
57 HB2 PRO 7 1HB PRO 7 20.901 3.527 -1.899
58 HB3 PRO 7 2HB PRO 7 19.148 3.699 -1.758
59 HG2 PRO 7 1HG PRO 7 20.887 1.369 -1.043
60 HG3 PRO 7 2HG PRO 7 19.527 2.067 -0.145
61 HD2 PRO 7 1HD PRO 7 19.283 -0.170 -1.650
62 HD3 PRO 7 2HD PRO 7 17.954 0.988 -1.439
63 H LYS 8 H LYS 8 20.501 3.127 -5.756
64 HA LYS 8 HA LYS 8 22.841 1.542 -5.980
65 HB2 LYS 8 1HB LYS 8 22.300 3.994 -7.635
66 HB3 LYS 8 2HB LYS 8 23.131 2.517 -8.105
67 HG2 LYS 8 1HG LYS 8 20.521 1.775 -7.351
68 HG3 LYS 8 2HG LYS 8 20.376 3.200 -8.382
69 HD2 LYS 8 1HD LYS 8 20.319 1.174 -9.723
70 HD3 LYS 8 2HD LYS 8 21.780 2.100 -10.074
71 HE2 LYS 8 1HE LYS 8 23.137 0.613 -8.851
72 HE3 LYS 8 2HE LYS 8 21.747 -0.140 -8.071
73 HZ1 LYS 8 1HZ LYS 8 22.918 -1.332 -10.024
74 HZ2 LYS 8 2HZ LYS 8 22.026 -0.274 -10.996
75 HZ3 LYS 8 3HZ LYS 8 21.228 -1.335 -9.948
76 H LEU 9 H LEU 9 24.761 3.188 -7.067
77 HA LEU 9 HA LEU 9 26.240 3.996 -4.876
78 HB2 LEU 9 1HB LEU 9 26.366 4.529 -7.793
79 HB3 LEU 9 2HB LEU 9 27.350 5.539 -6.735
80 HG LEU 9 HG LEU 9 27.541 2.576 -7.199
81 HD11 LEU 9 1HD1 LEU 9 29.102 4.969 -7.880
82 HD12 LEU 9 2HD1 LEU 9 28.995 3.409 -8.694
83 HD13 LEU 9 3HD1 LEU 9 30.042 3.599 -7.288
84 HD21 LEU 9 1HD2 LEU 9 27.948 2.405 -4.991
85 HD22 LEU 9 2HD2 LEU 9 28.247 4.133 -4.803
86 HD23 LEU 9 3HD2 LEU 9 29.517 3.080 -5.428
87 HA PRO 10 HA PRO 10 24.957 8.578 -5.677
88 HB2 PRO 10 1HB PRO 10 22.983 9.032 -7.485
89 HB3 PRO 10 2HB PRO 10 24.694 8.966 -7.926
90 HG2 PRO 10 1HG PRO 10 22.590 6.852 -8.179
91 HG3 PRO 10 2HG PRO 10 23.848 7.322 -9.337
92 HD2 PRO 10 1HD PRO 10 24.077 5.147 -7.740
93 HD3 PRO 10 2HD PRO 10 25.479 6.111 -8.249
94 H LEU 11 H LEU 11 22.997 5.936 -5.118
95 HA LEU 11 HA LEU 11 20.875 7.581 -3.910
96 HB2 LEU 11 1HB LEU 11 20.901 4.969 -5.262
97 HB3 LEU 11 2HB LEU 11 19.905 5.052 -3.811
98 HG LEU 11 HG LEU 11 18.355 6.394 -4.785
99 HD11 LEU 11 1HD1 LEU 11 20.653 7.566 -6.303
100 HD12 LEU 11 2HD1 LEU 11 19.534 8.350 -5.188
101 HD13 LEU 11 3HD1 LEU 11 18.988 7.876 -6.796
102 HD21 LEU 11 1HD2 LEU 11 18.047 5.805 -7.163
103 HD22 LEU 11 2HD2 LEU 11 18.408 4.405 -6.153
104 HD23 LEU 11 3HD2 LEU 11 19.665 5.103 -7.175
105 H LEU 12 H LEU 12 23.459 5.417 -3.271
106 HA LEU 12 HA LEU 12 22.561 4.570 -0.681
107 HB2 LEU 12 1HB LEU 12 24.463 3.698 -2.441
108 HB3 LEU 12 2HB LEU 12 25.440 4.483 -1.202
109 HG LEU 12 HG LEU 12 23.839 1.991 -1.072
110 HD11 LEU 12 1HD1 LEU 12 26.227 2.666 0.580
111 HD12 LEU 12 2HD1 LEU 12 26.426 2.360 -1.145
112 HD13 LEU 12 3HD1 LEU 12 25.729 1.118 -0.104
113 HD21 LEU 12 1HD2 LEU 12 23.953 2.283 1.494
114 HD22 LEU 12 2HD2 LEU 12 22.631 3.041 0.606
115 HD23 LEU 12 3HD2 LEU 12 24.008 4.009 1.133
116 H LYS 13 H LYS 13 24.773 7.030 -1.921
117 HA LYS 13 HA LYS 13 25.753 7.894 0.583
118 HB2 LYS 13 1HB LYS 13 25.684 9.035 -2.177
119 HB3 LYS 13 2HB LYS 13 26.108 10.095 -0.839
120 HG2 LYS 13 1HG LYS 13 27.981 8.727 -0.260
121 HG3 LYS 13 2HG LYS 13 27.499 7.491 -1.424
122 HD2 LYS 13 1HD LYS 13 29.035 8.549 -2.713
123 HD3 LYS 13 2HD LYS 13 27.661 9.599 -3.070
124 HE2 LYS 13 1HE LYS 13 28.574 11.346 -2.003
125 HE3 LYS 13 2HE LYS 13 29.126 10.352 -0.655
126 HZ1 LYS 13 1HZ LYS 13 31.001 11.286 -1.807
127 HZ2 LYS 13 2HZ LYS 13 30.474 10.655 -3.284
128 HZ3 LYS 13 3HZ LYS 13 30.984 9.613 -2.054
129 H ILE 14 H ILE 14 22.829 8.555 -1.166
130 HA ILE 14 HA ILE 14 22.077 10.977 0.030
131 HB ILE 14 HB ILE 14 20.196 8.782 -0.837
132 HG12 ILE 14 1HG1 ILE 14 21.832 9.278 -2.609
133 HG13 ILE 14 2HG1 ILE 14 20.220 9.832 -3.050
134 HG21 ILE 14 1HG2 ILE 14 18.763 10.800 -1.398
135 HG22 ILE 14 2HG2 ILE 14 18.985 10.440 0.313
136 HG23 ILE 14 3HG2 ILE 14 19.901 11.746 -0.439
137 HD11 ILE 14 1HD1 ILE 14 21.200 11.754 -3.573
138 HD12 ILE 14 2HD1 ILE 14 21.329 12.033 -1.836
139 HD13 ILE 14 3HD1 ILE 14 22.682 11.327 -2.718
140 H LEU 15 H LEU 15 21.078 7.659 0.887
141 HA LEU 15 HA LEU 15 19.783 8.471 3.289
142 HB2 LEU 15 1HB LEU 15 20.778 5.710 2.623
143 HB3 LEU 15 2HB LEU 15 19.475 6.149 3.726
144 HG LEU 15 HG LEU 15 18.152 5.554 2.014
145 HD11 LEU 15 1HD1 LEU 15 17.371 7.359 0.798
146 HD12 LEU 15 2HD1 LEU 15 18.981 8.046 0.585
147 HD13 LEU 15 3HD1 LEU 15 18.184 8.140 2.155
148 HD21 LEU 15 1HD2 LEU 15 20.661 5.751 0.472
149 HD22 LEU 15 2HD2 LEU 15 19.164 5.929 -0.444
150 HD23 LEU 15 3HD2 LEU 15 19.446 4.473 0.511
151 H HIS 16 H HIS 16 22.957 7.117 2.536
152 HA HIS 16 HA HIS 16 23.869 6.595 5.105
153 HB2 HIS 16 1HB HIS 16 25.218 7.323 2.536
154 HB3 HIS 16 2HB HIS 16 26.172 7.264 4.015
155 HD1 HIS 16 HD1 HIS 16 27.496 5.218 3.141
156 HD2 HIS 16 HD2 HIS 16 23.410 4.569 3.521
157 HE1 HIS 16 HE1 HIS 16 27.191 2.729 2.954
158 H ALA 17 H ALA 17 23.967 9.621 3.263
159 HA ALA 17 HA ALA 17 25.449 11.162 5.046
160 HB1 ALA 17 1HB ALA 17 25.038 12.051 2.902
161 HB2 ALA 17 2HB ALA 17 23.290 11.908 3.092
162 HB3 ALA 17 3HB ALA 17 24.183 13.106 4.029
163 H ALA 18 H ALA 18 21.962 10.542 4.940
164 HA ALA 18 HA ALA 18 21.318 12.264 7.110
165 HB1 ALA 18 1HB ALA 18 19.898 10.735 5.238
166 HB2 ALA 18 2HB ALA 18 19.418 10.133 6.825
167 HB3 ALA 18 3HB ALA 18 19.244 11.846 6.441
168 H GLY 19 H GLY 19 22.848 9.257 6.977
169 HA2 GLY 19 1HA GLY 19 23.811 8.619 9.195
170 HA3 GLY 19 2HA GLY 19 22.166 8.729 9.804
171 H ALA 20 H ALA 20 21.658 7.536 6.876
172 HA ALA 20 HA ALA 20 21.087 4.924 7.765
173 HB1 ALA 20 1HB ALA 20 20.275 4.509 5.632
174 HB2 ALA 20 2HB ALA 20 20.090 6.256 5.789
175 HB3 ALA 20 3HB ALA 20 21.440 5.592 4.869
176 H GLN 21 H GLN 21 21.915 2.966 6.433
177 HA GLN 21 HA GLN 21 24.548 2.963 5.427
178 HB2 GLN 21 1HB GLN 21 24.571 3.209 8.145
179 HB3 GLN 21 2HB GLN 21 24.641 1.462 7.956
180 HG2 GLN 21 1HG GLN 21 26.834 1.721 7.747
181 HG3 GLN 21 2HG GLN 21 26.491 2.345 6.134
182 HE21 GLN 21 2HE2 GLN 21 25.854 4.748 6.175
183 HE22 GLN 21 1HE2 GLN 21 26.871 5.770 7.127
184 H GLY 22 H GLY 22 24.700 1.240 4.145
185 HA2 GLY 22 1HA GLY 22 24.487 -1.344 4.419
186 HA3 GLY 22 2HA GLY 22 22.780 -0.944 4.540
187 H GLU 23 H GLU 23 22.326 -2.184 2.681
188 HA GLU 23 HA GLU 23 22.801 -0.722 0.203
189 HB2 GLU 23 1HB GLU 23 23.347 -3.687 0.416
190 HB3 GLU 23 2HB GLU 23 23.516 -2.687 -1.020
191 HG2 GLU 23 1HG GLU 23 25.275 -1.391 0.183
192 HG3 GLU 23 2HG GLU 23 25.178 -2.577 1.483
193 H MET 24 H MET 24 20.591 -1.640 2.166
194 HA MET 24 HA MET 24 18.593 -2.014 0.137
195 HB2 MET 24 1HB MET 24 17.729 -4.101 1.509
196 HB3 MET 24 2HB MET 24 18.890 -4.288 0.201
197 HG2 MET 24 1HG MET 24 20.082 -3.805 2.833
198 HG3 MET 24 2HG MET 24 19.176 -5.310 2.693
199 HE1 MET 24 1HE MET 24 23.110 -5.896 2.431
200 HE2 MET 24 2HE MET 24 22.898 -4.148 2.343
201 HE3 MET 24 3HE MET 24 21.964 -5.092 3.504
202 H PHE 25 H PHE 25 16.616 -1.304 0.795
203 HA PHE 25 HA PHE 25 15.889 -1.117 3.562
204 HB2 PHE 25 1HB PHE 25 16.280 1.489 2.084
205 HB3 PHE 25 2HB PHE 25 15.812 1.275 3.767
206 HD1 PHE 25 HD1 PHE 25 18.589 0.860 1.366
207 HD2 PHE 25 HD2 PHE 25 17.429 1.028 5.458
208 HE1 PHE 25 HE1 PHE 25 20.956 0.967 2.029
209 HE2 PHE 25 HE2 PHE 25 19.794 1.136 6.128
210 HZ PHE 25 HZ PHE 25 21.561 1.106 4.413
211 H THR 26 H THR 26 13.746 -0.007 3.821
212 HA THR 26 HA THR 26 12.055 -0.703 1.537
213 HB THR 26 HB THR 26 10.450 0.085 3.728
214 HG1 THR 26 1HG THR 26 11.356 -0.835 5.451
215 HG21 THR 26 1HG2 THR 26 9.593 -1.598 2.404
216 HG22 THR 26 2HG2 THR 26 10.157 -2.523 3.796
217 HG23 THR 26 3HG2 THR 26 11.128 -2.463 2.325
218 H VAL 27 H VAL 27 9.996 0.719 1.389
219 HA VAL 27 HA VAL 27 10.682 3.218 0.422
220 HB VAL 27 HB VAL 27 7.951 2.736 1.566
221 HG11 VAL 27 1HG1 VAL 27 7.341 4.426 0.245
222 HG12 VAL 27 2HG1 VAL 27 9.062 4.737 0.011
223 HG13 VAL 27 3HG1 VAL 27 8.179 3.740 -1.146
224 HG21 VAL 27 1HG2 VAL 27 9.253 1.313 -0.721
225 HG22 VAL 27 2HG2 VAL 27 8.218 0.669 0.553
226 HG23 VAL 27 3HG2 VAL 27 7.519 1.637 -0.745
227 H LYS 28 H LYS 28 9.341 2.376 3.600
228 HA LYS 28 HA LYS 28 9.185 5.019 4.578
229 HB2 LYS 28 1HB LYS 28 9.059 2.293 5.744
230 HB3 LYS 28 2HB LYS 28 9.447 3.604 6.850
231 HG2 LYS 28 1HG LYS 28 7.214 3.723 7.055
232 HG3 LYS 28 2HG LYS 28 7.340 4.684 5.580
233 HD2 LYS 28 1HD LYS 28 5.598 2.987 5.374
234 HD3 LYS 28 2HD LYS 28 6.916 2.679 4.240
235 HE2 LYS 28 1HE LYS 28 7.619 0.809 5.356
236 HE3 LYS 28 2HE LYS 28 7.027 1.383 6.914
237 HZ1 LYS 28 1HZ LYS 28 5.187 0.215 6.627
238 HZ2 LYS 28 2HZ LYS 28 5.786 -0.391 5.166
239 HZ3 LYS 28 3HZ LYS 28 4.848 1.017 5.176
240 H GLU 29 H GLU 29 11.686 2.520 4.870
241 HA GLU 29 HA GLU 29 13.415 3.963 6.554
242 HB2 GLU 29 1HB GLU 29 14.041 1.814 4.522
243 HB3 GLU 29 2HB GLU 29 15.166 2.399 5.740
244 HG2 GLU 29 1HG GLU 29 12.512 1.128 6.360
245 HG3 GLU 29 2HG GLU 29 14.048 0.263 6.321
246 H VAL 30 H VAL 30 13.113 3.825 3.042
247 HA VAL 30 HA VAL 30 15.434 5.338 2.453
248 HB VAL 30 HB VAL 30 12.926 4.997 0.803
249 HG11 VAL 30 1HG1 VAL 30 15.612 6.175 0.215
250 HG12 VAL 30 2HG1 VAL 30 14.666 5.420 -1.068
251 HG13 VAL 30 3HG1 VAL 30 14.009 6.795 -0.180
252 HG21 VAL 30 1HG2 VAL 30 14.448 2.976 1.587
253 HG22 VAL 30 2HG2 VAL 30 13.772 3.052 -0.040
254 HG23 VAL 30 3HG2 VAL 30 15.447 3.528 0.242
255 H MET 31 H MET 31 12.017 6.222 2.823
256 HA MET 31 HA MET 31 12.393 8.973 2.226
257 HB2 MET 31 1HB MET 31 10.175 8.723 2.070
258 HB3 MET 31 2HB MET 31 10.210 7.238 3.011
259 HG2 MET 31 1HG MET 31 9.905 8.358 5.024
260 HG3 MET 31 2HG MET 31 10.402 9.907 4.345
261 HE1 MET 31 1HE MET 31 8.811 11.495 2.918
262 HE2 MET 31 2HE MET 31 8.902 10.203 1.721
263 HE3 MET 31 3HE MET 31 7.338 10.896 2.153
264 H HIS 32 H HIS 32 12.210 7.141 5.253
265 HA HIS 32 HA HIS 32 12.211 9.194 7.089
266 HB2 HIS 32 1HB HIS 32 12.244 6.565 7.363
267 HB3 HIS 32 2HB HIS 32 13.968 6.832 7.604
268 HD1 HIS 32 HD1 HIS 32 11.048 6.445 9.507
269 HD2 HIS 32 HD2 HIS 32 14.247 9.090 9.685
270 HE1 HIS 32 HE1 HIS 32 11.037 7.356 11.851
271 H TYR 33 H TYR 33 14.859 7.986 5.146
272 HA TYR 33 HA TYR 33 16.904 9.399 6.565
273 HB2 TYR 33 1HB TYR 33 16.886 8.116 3.828
274 HB3 TYR 33 2HB TYR 33 18.317 8.800 4.591
275 HD1 TYR 33 HD2 TYR 33 18.245 7.894 7.303
276 HD2 TYR 33 HD1 TYR 33 17.061 5.816 3.784
277 HE1 TYR 33 HE2 TYR 33 18.671 5.751 8.432
278 HE2 TYR 33 HE1 TYR 33 17.482 3.667 4.904
279 HH TYR 33 HH TYR 33 18.680 2.746 6.730
280 H LEU 34 H LEU 34 14.904 10.028 3.745
281 HA LEU 34 HA LEU 34 16.199 12.166 2.596
282 HB2 LEU 34 1HB LEU 34 13.522 11.096 2.623
283 HB3 LEU 34 2HB LEU 34 13.490 12.857 2.552
284 HG LEU 34 HG LEU 34 13.376 11.814 0.328
285 HD11 LEU 34 1HD1 LEU 34 15.460 13.027 -0.598
286 HD12 LEU 34 2HD1 LEU 34 15.711 13.530 1.074
287 HD13 LEU 34 3HD1 LEU 34 14.223 13.969 0.236
288 HD21 LEU 34 1HD2 LEU 34 14.606 10.022 -0.113
289 HD22 LEU 34 2HD2 LEU 34 15.513 10.226 1.387
290 HD23 LEU 34 3HD2 LEU 34 16.045 11.042 -0.085
291 H GLY 35 H GLY 35 13.632 12.409 5.071
292 HA2 GLY 35 1HA GLY 35 13.769 15.141 5.506
293 HA3 GLY 35 2HA GLY 35 13.279 13.968 6.720
294 H GLN 36 H GLN 36 15.591 12.587 7.182
295 HA GLN 36 HA GLN 36 16.957 14.264 8.960
296 HB2 GLN 36 1HB GLN 36 17.773 11.605 7.781
297 HB3 GLN 36 2HB GLN 36 18.606 12.392 9.115
298 HG2 GLN 36 1HG GLN 36 15.690 11.685 9.209
299 HG3 GLN 36 2HG GLN 36 16.964 10.581 9.725
300 HE21 GLN 36 2HE2 GLN 36 18.690 12.085 11.062
301 HE22 GLN 36 1HE2 GLN 36 17.947 12.844 12.424
302 H TYR 37 H TYR 37 17.711 13.262 5.666
303 HA TYR 37 HA TYR 37 20.328 14.288 5.551
304 HB2 TYR 37 1HB TYR 37 19.553 12.738 3.869
305 HB3 TYR 37 2HB TYR 37 18.282 13.849 3.368
306 HD1 TYR 37 HD2 TYR 37 21.986 13.521 3.562
307 HD2 TYR 37 HD1 TYR 37 18.670 15.368 1.640
308 HE1 TYR 37 HE2 TYR 37 23.504 14.493 1.889
309 HE2 TYR 37 HE1 TYR 37 20.179 16.344 -0.039
310 HH TYR 37 HH TYR 37 23.028 15.346 -0.751
311 H ILE 38 H ILE 38 17.213 15.724 4.623
312 HA ILE 38 HA ILE 38 18.211 18.165 3.679
313 HB ILE 38 HB ILE 38 15.544 17.705 5.019
314 HG12 ILE 38 1HG1 ILE 38 16.288 17.471 2.095
315 HG13 ILE 38 2HG1 ILE 38 15.982 16.112 3.171
316 HG21 ILE 38 1HG2 ILE 38 14.968 19.560 3.269
317 HG22 ILE 38 2HG2 ILE 38 15.688 19.990 4.820
318 HG23 ILE 38 3HG2 ILE 38 16.693 19.910 3.373
319 HD11 ILE 38 1HD1 ILE 38 13.741 17.748 3.406
320 HD12 ILE 38 2HD1 ILE 38 14.131 17.725 1.686
321 HD13 ILE 38 3HD1 ILE 38 13.864 16.211 2.551
322 H MET 39 H MET 39 17.075 17.235 6.914
323 HA MET 39 HA MET 39 17.454 19.768 8.102
324 HB2 MET 39 1HB MET 39 16.538 18.774 9.885
325 HB3 MET 39 2HB MET 39 16.413 17.323 8.899
326 HG2 MET 39 1HG MET 39 17.453 16.608 10.850
327 HG3 MET 39 2HG MET 39 18.771 16.784 9.694
328 HE1 MET 39 1HE MET 39 17.273 20.159 11.755
329 HE2 MET 39 2HE MET 39 16.613 18.569 12.136
330 HE3 MET 39 3HE MET 39 17.712 19.362 13.266
331 H VAL 40 H VAL 40 19.580 17.030 7.578
332 HA VAL 40 HA VAL 40 21.672 17.898 9.295
333 HB VAL 40 HB VAL 40 21.173 15.613 7.812
334 HG11 VAL 40 1HG1 VAL 40 22.184 16.664 5.840
335 HG12 VAL 40 2HG1 VAL 40 23.672 16.928 6.751
336 HG13 VAL 40 3HG1 VAL 40 23.128 15.286 6.404
337 HG21 VAL 40 1HG2 VAL 40 22.295 15.804 10.003
338 HG22 VAL 40 2HG2 VAL 40 23.157 14.741 8.890
339 HG23 VAL 40 3HG2 VAL 40 23.749 16.376 9.185
340 H LYS 41 H LYS 41 20.959 18.370 5.872
341 HA LYS 41 HA LYS 41 23.411 19.861 5.446
342 HB2 LYS 41 1HB LYS 41 21.201 18.842 3.736
343 HB3 LYS 41 2HB LYS 41 22.076 20.256 3.162
344 HG2 LYS 41 1HG LYS 41 23.217 17.548 3.803
345 HG3 LYS 41 2HG LYS 41 23.071 18.303 2.214
346 HD2 LYS 41 1HD LYS 41 25.155 19.043 2.517
347 HD3 LYS 41 2HD LYS 41 24.480 20.162 3.704
348 HE2 LYS 41 1HE LYS 41 25.950 19.179 5.096
349 HE3 LYS 41 2HE LYS 41 24.717 17.924 5.203
350 HZ1 LYS 41 1HZ LYS 41 27.196 17.928 3.595
351 HZ2 LYS 41 2HZ LYS 41 25.915 16.885 3.234
352 HZ3 LYS 41 3HZ LYS 41 26.683 16.791 4.739
353 H GLN 42 H GLN 42 20.245 20.493 6.486
354 HA GLN 42 HA GLN 42 19.154 22.411 7.040
355 HB2 GLN 42 1HB GLN 42 21.979 23.258 6.862
356 HB3 GLN 42 2HB GLN 42 20.791 24.549 6.748
357 HG2 GLN 42 1HG GLN 42 20.888 24.562 8.973
358 HG3 GLN 42 2HG GLN 42 19.855 23.137 8.873
359 HE21 GLN 42 2HE2 GLN 42 21.675 21.270 7.966
360 HE22 GLN 42 1HE2 GLN 42 22.858 20.988 9.193
361 H LEU 43 H LEU 43 18.436 21.590 4.676
362 HA LEU 43 HA LEU 43 18.562 23.948 2.913
363 HB2 LEU 43 1HB LEU 43 19.567 21.781 2.075
364 HB3 LEU 43 2HB LEU 43 17.927 21.135 2.056
365 HG LEU 43 HG LEU 43 17.315 22.371 0.224
366 HD11 LEU 43 1HD1 LEU 43 18.699 24.409 -0.494
367 HD12 LEU 43 2HD1 LEU 43 19.380 24.344 1.131
368 HD13 LEU 43 3HD1 LEU 43 17.645 24.571 0.912
369 HD21 LEU 43 1HD2 LEU 43 19.850 21.143 0.098
370 HD22 LEU 43 2HD2 LEU 43 19.951 22.629 -0.847
371 HD23 LEU 43 3HD2 LEU 43 18.712 21.430 -1.219
372 H TYR 44 H TYR 44 16.781 24.474 4.625
373 HA TYR 44 HA TYR 44 14.265 24.200 3.262
374 HB2 TYR 44 1HB TYR 44 13.049 23.241 5.186
375 HB3 TYR 44 2HB TYR 44 14.241 22.122 4.533
376 HD1 TYR 44 HD2 TYR 44 16.518 22.009 5.730
377 HD2 TYR 44 HD1 TYR 44 13.049 23.762 7.460
378 HE1 TYR 44 HE2 TYR 44 17.513 21.757 7.966
379 HE2 TYR 44 HE1 TYR 44 14.035 23.517 9.700
380 HH TYR 44 HH TYR 44 15.702 22.576 10.885
381 H ASP 45 H ASP 45 12.531 25.455 4.371
382 HA ASP 45 HA ASP 45 13.592 27.970 5.251
383 HB2 ASP 45 1HB ASP 45 11.692 28.150 3.873
384 HB3 ASP 45 2HB ASP 45 10.814 26.917 4.774
385 H GLN 46 H GLN 46 14.391 28.086 7.257
386 HA GLN 46 HA GLN 46 13.809 26.534 9.443
387 HB2 GLN 46 1HB GLN 46 14.903 29.277 9.091
388 HB3 GLN 46 2HB GLN 46 14.415 28.804 10.713
389 HG2 GLN 46 1HG GLN 46 16.860 28.429 9.905
390 HG3 GLN 46 2HG GLN 46 16.051 27.217 10.896
391 HE21 GLN 46 2HE2 GLN 46 16.234 28.068 7.451
392 HE22 GLN 46 1HE2 GLN 46 16.515 26.457 6.895
393 H GLN 47 H GLN 47 11.911 29.065 8.066
394 HA GLN 47 HA GLN 47 10.302 29.549 10.392
395 HB2 GLN 47 1HB GLN 47 9.987 30.295 7.486
396 HB3 GLN 47 2HB GLN 47 8.810 30.735 8.717
397 HG2 GLN 47 1HG GLN 47 10.749 32.366 7.993
398 HG3 GLN 47 2HG GLN 47 10.158 32.298 9.652
399 HE21 GLN 47 2HE2 GLN 47 12.634 30.996 7.499
400 HE22 GLN 47 1HE2 GLN 47 13.847 30.809 8.714
401 H GLU 48 H GLU 48 10.101 27.502 7.547
402 HA GLU 48 HA GLU 48 7.804 26.142 8.770
403 HB2 GLU 48 1HB GLU 48 8.033 27.198 5.973
404 HB3 GLU 48 2HB GLU 48 7.051 25.776 6.298
405 HG2 GLU 48 1HG GLU 48 5.655 27.012 7.805
406 HG3 GLU 48 2HG GLU 48 6.703 28.424 7.681
407 H GLN 49 H GLN 49 9.144 24.478 9.474
408 HA GLN 49 HA GLN 49 11.112 23.163 8.048
409 HB2 GLN 49 1HB GLN 49 9.204 22.137 10.147
410 HB3 GLN 49 2HB GLN 49 10.534 21.175 9.515
411 HG2 GLN 49 1HG GLN 49 11.618 22.031 11.284
412 HG3 GLN 49 2HG GLN 49 11.876 23.389 10.190
413 HE21 GLN 49 2HE2 GLN 49 11.956 24.987 11.686
414 HE22 GLN 49 1HE2 GLN 49 10.622 25.442 12.684
415 H HIS 50 H HIS 50 7.715 23.102 7.583
416 HA HIS 50 HA HIS 50 7.750 20.618 6.074
417 HB2 HIS 50 1HB HIS 50 5.307 21.199 5.693
418 HB3 HIS 50 2HB HIS 50 5.781 20.923 7.367
419 HD1 HIS 50 HD1 HIS 50 4.406 22.461 8.729
420 HD2 HIS 50 HD2 HIS 50 5.880 24.316 5.316
421 HE1 HIS 50 HE1 HIS 50 3.690 24.865 8.908
422 H MET 51 H MET 51 9.203 23.150 5.259
423 HA MET 51 HA MET 51 8.219 23.168 2.497
424 HB2 MET 51 1HB MET 51 7.834 25.305 4.222
425 HB3 MET 51 2HB MET 51 9.270 25.760 3.315
426 HG2 MET 51 1HG MET 51 7.173 24.689 1.618
427 HG3 MET 51 2HG MET 51 6.659 26.109 2.527
428 HE1 MET 51 1HE MET 51 9.349 24.583 0.243
429 HE2 MET 51 2HE MET 51 10.231 25.978 -0.378
430 HE3 MET 51 3HE MET 51 10.441 25.478 1.301
431 H VAL 52 H VAL 52 9.963 21.815 1.964
432 HA VAL 52 HA VAL 52 12.665 22.477 2.591
433 HB VAL 52 HB VAL 52 11.513 20.574 0.550
434 HG11 VAL 52 1HG1 VAL 52 14.371 21.048 1.374
435 HG12 VAL 52 2HG1 VAL 52 13.824 19.611 0.510
436 HG13 VAL 52 3HG1 VAL 52 13.676 21.201 -0.239
437 HG21 VAL 52 1HG2 VAL 52 11.554 20.381 3.280
438 HG22 VAL 52 2HG2 VAL 52 11.464 19.020 2.162
439 HG23 VAL 52 3HG2 VAL 52 13.023 19.521 2.818
440 H TYR 53 H TYR 53 14.333 22.957 0.987
441 HA TYR 53 HA TYR 53 13.349 24.473 -1.330
442 HB2 TYR 53 1HB TYR 53 14.834 25.485 0.985
443 HB3 TYR 53 2HB TYR 53 15.578 25.892 -0.557
444 HD1 TYR 53 HD2 TYR 53 13.484 26.487 -2.357
445 HD2 TYR 53 HD1 TYR 53 13.628 27.255 1.825
446 HE1 TYR 53 HE2 TYR 53 11.882 28.331 -2.647
447 HE2 TYR 53 HE1 TYR 53 12.025 29.100 1.548
448 HH TYR 53 HH TYR 53 10.066 29.520 -0.637
449 H CYS 54 H CYS 54 13.976 22.629 -2.566
450 HA CYS 54 HA CYS 54 16.364 21.309 -2.611
451 HB2 CYS 54 1HB CYS 54 15.474 20.366 -4.435
452 HB3 CYS 54 2HB CYS 54 14.156 21.526 -4.318
453 HG CYS 54 HG CYS 54 17.009 22.335 -5.995
454 H GLY 55 H GLY 55 15.633 24.423 -4.141
455 HA2 GLY 55 1HA GLY 55 17.003 26.055 -4.993
456 HA3 GLY 55 2HA GLY 55 18.174 25.503 -3.804
457 H GLY 56 H GLY 56 19.684 23.856 -4.406
458 HA2 GLY 56 1HA GLY 56 19.829 23.010 -7.162
459 HA3 GLY 56 2HA GLY 56 21.036 24.211 -6.730
460 H ASP 57 H ASP 57 19.936 21.932 -4.357
461 HA ASP 57 HA ASP 57 22.617 20.850 -4.153
462 HB2 ASP 57 1HB ASP 57 20.725 21.443 -2.283
463 HB3 ASP 57 2HB ASP 57 20.502 19.703 -2.450
464 H LEU 58 H LEU 58 22.516 18.344 -3.465
465 HA LEU 58 HA LEU 58 22.304 16.859 -5.747
466 HB2 LEU 58 1HB LEU 58 22.105 16.115 -2.856
467 HB3 LEU 58 2HB LEU 58 21.913 14.886 -4.105
468 HG LEU 58 HG LEU 58 24.354 16.483 -3.398
469 HD11 LEU 58 1HD1 LEU 58 24.058 13.534 -3.889
470 HD12 LEU 58 2HD1 LEU 58 23.774 14.268 -2.311
471 HD13 LEU 58 3HD1 LEU 58 25.365 14.385 -3.064
472 HD21 LEU 58 1HD2 LEU 58 24.299 16.702 -5.751
473 HD22 LEU 58 2HD2 LEU 58 23.751 15.040 -5.968
474 HD23 LEU 58 3HD2 LEU 58 25.394 15.362 -5.412
475 H LEU 59 H LEU 59 19.853 16.960 -3.156
476 HA LEU 59 HA LEU 59 17.932 15.402 -4.451
477 HB2 LEU 59 1HB LEU 59 16.554 15.921 -2.723
478 HB3 LEU 59 2HB LEU 59 18.094 16.402 -2.014
479 HG LEU 59 HG LEU 59 16.198 18.326 -3.352
480 HD11 LEU 59 1HD1 LEU 59 16.529 18.218 -0.402
481 HD12 LEU 59 2HD1 LEU 59 15.467 17.036 -1.168
482 HD13 LEU 59 3HD1 LEU 59 15.158 18.761 -1.371
483 HD21 LEU 59 1HD2 LEU 59 18.867 18.578 -2.671
484 HD22 LEU 59 2HD2 LEU 59 18.013 19.327 -1.322
485 HD23 LEU 59 3HD2 LEU 59 17.732 19.895 -2.968
486 H GLY 60 H GLY 60 18.619 18.849 -4.651
487 HA2 GLY 60 1HA GLY 60 16.290 19.587 -6.083
488 HA3 GLY 60 2HA GLY 60 17.791 20.498 -6.019
489 H GLU 61 H GLU 61 19.571 18.766 -7.182
490 HA GLU 61 HA GLU 61 19.071 19.174 -9.925
491 HB2 GLU 61 1HB GLU 61 21.079 17.277 -8.702
492 HB3 GLU 61 2HB GLU 61 21.134 17.970 -10.316
493 HG2 GLU 61 1HG GLU 61 21.231 19.627 -7.812
494 HG3 GLU 61 2HG GLU 61 22.668 19.007 -8.624
495 H LEU 62 H LEU 62 18.766 16.335 -7.853
496 HA LEU 62 HA LEU 62 18.238 14.466 -9.903
497 HB2 LEU 62 1HB LEU 62 18.877 13.613 -7.806
498 HB3 LEU 62 2HB LEU 62 17.631 14.532 -6.963
499 HG LEU 62 HG LEU 62 15.935 13.063 -8.129
500 HD11 LEU 62 1HD1 LEU 62 18.389 12.016 -9.277
501 HD12 LEU 62 2HD1 LEU 62 16.717 11.808 -9.794
502 HD13 LEU 62 3HD1 LEU 62 17.389 10.761 -8.545
503 HD21 LEU 62 1HD2 LEU 62 16.336 11.156 -6.586
504 HD22 LEU 62 2HD2 LEU 62 16.435 12.734 -5.805
505 HD23 LEU 62 3HD2 LEU 62 17.910 11.852 -6.200
506 H LEU 63 H LEU 63 16.044 16.252 -7.740
507 HA LEU 63 HA LEU 63 13.641 15.271 -8.760
508 HB2 LEU 63 1HB LEU 63 14.491 17.362 -6.994
509 HB3 LEU 63 2HB LEU 63 13.213 17.960 -8.048
510 HG LEU 63 HG LEU 63 12.448 15.407 -7.016
511 HD11 LEU 63 1HD1 LEU 63 14.139 16.176 -5.236
512 HD12 LEU 63 2HD1 LEU 63 12.537 15.662 -4.708
513 HD13 LEU 63 3HD1 LEU 63 12.921 17.380 -4.812
514 HD21 LEU 63 1HD2 LEU 63 11.255 17.730 -7.735
515 HD22 LEU 63 2HD2 LEU 63 11.168 17.841 -5.976
516 HD23 LEU 63 3HD2 LEU 63 10.468 16.452 -6.809
517 H GLY 64 H GLY 64 15.329 18.302 -9.598
518 HA2 GLY 64 1HA GLY 64 15.577 18.950 -11.913
519 HA3 GLY 64 2HA GLY 64 14.049 18.150 -12.249
520 H ARG 65 H ARG 65 13.471 19.624 -9.434
521 HA ARG 65 HA ARG 65 12.286 21.946 -10.768
522 HB2 ARG 65 1HB ARG 65 11.749 21.047 -7.943
523 HB3 ARG 65 2HB ARG 65 10.751 22.072 -8.966
524 HG2 ARG 65 1HG ARG 65 11.191 19.110 -9.177
525 HG3 ARG 65 2HG ARG 65 9.683 19.975 -8.876
526 HD2 ARG 65 1HD ARG 65 9.549 20.736 -11.090
527 HD3 ARG 65 2HD ARG 65 11.242 20.365 -11.410
528 HE ARG 65 HE ARG 65 10.208 17.939 -10.889
529 HH11 ARG 65 1HH1 ARG 65 9.199 20.520 -12.996
530 HH12 ARG 65 2HH1 ARG 65 8.468 19.462 -14.157
531 HH21 ARG 65 1HH2 ARG 65 9.250 16.535 -12.411
532 HH22 ARG 65 2HH2 ARG 65 8.497 17.196 -13.823
533 H GLN 66 H GLN 66 11.942 23.508 -8.417
534 HA GLN 66 HA GLN 66 14.719 24.381 -7.966
535 HB2 GLN 66 1HB GLN 66 12.204 26.058 -7.947
536 HB3 GLN 66 2HB GLN 66 13.840 26.650 -7.692
537 HG2 GLN 66 1HG GLN 66 13.913 27.061 -9.866
538 HG3 GLN 66 2HG GLN 66 13.985 25.316 -10.109
539 HE21 GLN 66 2HE2 GLN 66 11.826 28.078 -9.910
540 HE22 GLN 66 1HE2 GLN 66 10.553 27.388 -10.853
541 H SER 67 H SER 67 11.531 24.013 -6.484
542 HA SER 67 HA SER 67 12.749 23.468 -3.927
543 HB2 SER 67 1HB SER 67 11.813 25.255 -2.686
544 HB3 SER 67 2HB SER 67 12.522 26.015 -4.111
545 HG SER 67 HG SER 67 10.250 26.576 -3.438
546 H PHE 68 H PHE 68 11.311 22.508 -2.435
547 HA PHE 68 HA PHE 68 8.568 22.032 -3.296
548 HB2 PHE 68 1HB PHE 68 8.752 19.614 -3.126
549 HB3 PHE 68 2HB PHE 68 9.902 20.211 -4.318
550 HD1 PHE 68 HD1 PHE 68 9.629 19.154 -0.769
551 HD2 PHE 68 HD2 PHE 68 12.151 19.657 -4.161
552 HE1 PHE 68 HE1 PHE 68 11.449 17.999 0.417
553 HE2 PHE 68 HE2 PHE 68 13.974 18.501 -2.980
554 HZ PHE 68 HZ PHE 68 13.624 17.670 -0.689
555 H SER 69 H SER 69 7.212 21.168 -1.623
556 HA SER 69 HA SER 69 8.242 21.794 1.056
557 HB2 SER 69 1HB SER 69 5.407 21.419 1.055
558 HB3 SER 69 2HB SER 69 6.318 22.899 1.353
559 HG SER 69 HG SER 69 5.008 23.261 -0.402
560 H VAL 70 H VAL 70 8.003 20.381 2.765
561 HA VAL 70 HA VAL 70 7.967 17.604 2.108
562 HB VAL 70 HB VAL 70 8.794 17.238 4.178
563 HG11 VAL 70 1HG1 VAL 70 9.073 20.168 4.603
564 HG12 VAL 70 2HG1 VAL 70 10.275 18.884 4.749
565 HG13 VAL 70 3HG1 VAL 70 9.785 19.459 3.154
566 HG21 VAL 70 1HG2 VAL 70 6.721 19.186 5.130
567 HG22 VAL 70 2HG2 VAL 70 6.855 17.461 5.468
568 HG23 VAL 70 3HG2 VAL 70 7.990 18.594 6.201
569 H LYS 71 H LYS 71 5.640 19.870 3.391
570 HA LYS 71 HA LYS 71 3.775 17.893 4.291
571 HB2 LYS 71 1HB LYS 71 2.196 19.846 4.400
572 HB3 LYS 71 2HB LYS 71 3.679 20.044 5.324
573 HG2 LYS 71 1HG LYS 71 4.499 21.664 3.928
574 HG3 LYS 71 2HG LYS 71 3.575 21.088 2.539
575 HD2 LYS 71 1HD LYS 71 2.234 22.836 2.973
576 HD3 LYS 71 2HD LYS 71 1.588 21.813 4.259
577 HE2 LYS 71 1HE LYS 71 3.189 22.802 5.833
578 HE3 LYS 71 2HE LYS 71 3.812 23.833 4.545
579 HZ1 LYS 71 1HZ LYS 71 1.075 24.210 4.583
580 HZ2 LYS 71 2HZ LYS 71 2.264 25.297 5.099
581 HZ3 LYS 71 3HZ LYS 71 1.556 24.231 6.205
582 H ASP 72 H ASP 72 4.703 18.924 1.252
583 HA ASP 72 HA ASP 72 2.140 18.052 0.085
584 HB2 ASP 72 1HB ASP 72 3.532 20.474 -0.323
585 HB3 ASP 72 2HB ASP 72 3.739 19.529 -1.795
586 HA PRO 73 HA PRO 73 5.200 14.865 -1.121
587 HB2 PRO 73 1HB PRO 73 3.378 12.853 -1.201
588 HB3 PRO 73 2HB PRO 73 4.170 13.374 0.291
589 HG2 PRO 73 1HG PRO 73 1.450 14.065 -0.750
590 HG3 PRO 73 2HG PRO 73 1.942 13.642 0.900
591 HD2 PRO 73 1HD PRO 73 1.527 16.200 0.114
592 HD3 PRO 73 2HD PRO 73 2.731 15.761 1.343
593 H SER 74 H SER 74 4.458 16.663 -3.010
594 HA SER 74 HA SER 74 3.056 15.196 -5.118
595 HB2 SER 74 1HB SER 74 3.539 18.034 -4.509
596 HB3 SER 74 2HB SER 74 3.700 17.622 -6.217
597 HG SER 74 HG SER 74 1.595 16.557 -5.948
598 HA PRO 75 HA PRO 75 7.147 16.201 -7.414
599 HB2 PRO 75 1HB PRO 75 9.036 17.657 -6.116
600 HB3 PRO 75 2HB PRO 75 7.738 18.394 -7.064
601 HG2 PRO 75 1HG PRO 75 7.935 18.005 -4.102
602 HG3 PRO 75 2HG PRO 75 7.374 19.421 -5.010
603 HD2 PRO 75 1HD PRO 75 5.670 17.648 -3.875
604 HD3 PRO 75 2HD PRO 75 5.286 18.515 -5.376
605 H LEU 76 H LEU 76 7.329 15.574 -3.973
606 HA LEU 76 HA LEU 76 9.825 14.306 -3.866
607 HB2 LEU 76 1HB LEU 76 8.607 14.992 -1.878
608 HB3 LEU 76 2HB LEU 76 7.345 13.810 -2.224
609 HG LEU 76 HG LEU 76 9.524 12.202 -2.074
610 HD11 LEU 76 1HD1 LEU 76 11.188 13.587 -1.352
611 HD12 LEU 76 2HD1 LEU 76 10.514 13.089 0.200
612 HD13 LEU 76 3HD1 LEU 76 10.080 14.654 -0.487
613 HD21 LEU 76 1HD2 LEU 76 7.279 12.931 -0.377
614 HD22 LEU 76 2HD2 LEU 76 8.653 12.314 0.540
615 HD23 LEU 76 3HD2 LEU 76 7.946 11.342 -0.753
616 H TYR 77 H TYR 77 6.587 12.824 -4.103
617 HA TYR 77 HA TYR 77 7.564 10.205 -4.541
618 HB2 TYR 77 1HB TYR 77 4.894 11.529 -4.917
619 HB3 TYR 77 2HB TYR 77 5.156 9.874 -5.457
620 HD1 TYR 77 HD1 TYR 77 5.920 8.161 -3.740
621 HD2 TYR 77 HD2 TYR 77 4.430 11.998 -2.664
622 HE1 TYR 77 HE1 TYR 77 5.477 7.343 -1.463
623 HE2 TYR 77 HE2 TYR 77 3.985 11.192 -0.383
624 HH TYR 77 HH TYR 77 4.924 9.313 1.122
625 H ASP 78 H ASP 78 6.558 12.798 -6.712
626 HA ASP 78 HA ASP 78 6.521 11.415 -9.120
627 HB2 ASP 78 1HB ASP 78 6.048 13.963 -8.462
628 HB3 ASP 78 2HB ASP 78 7.670 14.160 -9.120
629 H MET 79 H MET 79 9.242 12.806 -7.356
630 HA MET 79 HA MET 79 11.153 12.232 -9.414
631 HB2 MET 79 1HB MET 79 12.152 13.832 -8.196
632 HB3 MET 79 2HB MET 79 11.146 13.506 -6.792
633 HG2 MET 79 1HG MET 79 12.603 11.658 -6.165
634 HG3 MET 79 2HG MET 79 13.603 11.959 -7.584
635 HE1 MET 79 1HE MET 79 13.395 12.362 -3.944
636 HE2 MET 79 2HE MET 79 13.754 14.048 -3.568
637 HE3 MET 79 3HE MET 79 12.198 13.614 -4.279
638 H LEU 80 H LEU 80 10.432 10.810 -6.230
639 HA LEU 80 HA LEU 80 12.317 8.780 -6.241
640 HB2 LEU 80 1HB LEU 80 9.526 8.751 -5.103
641 HB3 LEU 80 2HB LEU 80 10.784 7.580 -4.714
642 HG LEU 80 HG LEU 80 10.982 10.534 -4.139
643 HD11 LEU 80 1HD1 LEU 80 9.221 8.921 -2.917
644 HD12 LEU 80 2HD1 LEU 80 10.060 10.239 -2.101
645 HD13 LEU 80 3HD1 LEU 80 10.655 8.586 -1.948
646 HD21 LEU 80 1HD2 LEU 80 13.086 10.131 -3.565
647 HD22 LEU 80 2HD2 LEU 80 12.917 8.501 -4.217
648 HD23 LEU 80 3HD2 LEU 80 12.589 8.808 -2.510
649 H ARG 81 H ARG 81 9.257 8.997 -7.911
650 HA ARG 81 HA ARG 81 8.518 6.505 -8.545
651 HB2 ARG 81 1HB ARG 81 7.856 8.855 -9.571
652 HB3 ARG 81 2HB ARG 81 8.912 8.328 -10.874
653 HG2 ARG 81 1HG ARG 81 7.425 6.129 -10.641
654 HG3 ARG 81 2HG ARG 81 6.262 7.316 -10.050
655 HD2 ARG 81 1HD ARG 81 7.506 8.392 -12.360
656 HD3 ARG 81 2HD ARG 81 7.017 6.739 -12.732
657 HE ARG 81 HE ARG 81 4.829 7.408 -12.657
658 HH11 ARG 81 1HH1 ARG 81 6.819 9.844 -11.165
659 HH12 ARG 81 2HH1 ARG 81 5.530 10.991 -11.016
660 HH21 ARG 81 1HH2 ARG 81 3.123 8.910 -12.465
661 HH22 ARG 81 2HH2 ARG 81 3.427 10.458 -11.754
662 H LYS 82 H LYS 82 11.107 8.205 -10.316
663 HA LYS 82 HA LYS 82 12.082 5.590 -11.246
664 HB2 LYS 82 1HB LYS 82 12.721 6.553 -13.200
665 HB3 LYS 82 2HB LYS 82 11.487 7.728 -12.763
666 HG2 LYS 82 1HG LYS 82 14.427 8.011 -12.175
667 HG3 LYS 82 2HG LYS 82 13.577 8.772 -13.523
668 HD2 LYS 82 1HD LYS 82 12.979 9.206 -10.596
669 HD3 LYS 82 2HD LYS 82 13.870 10.317 -11.638
670 HE2 LYS 82 1HE LYS 82 11.714 10.150 -13.124
671 HE3 LYS 82 2HE LYS 82 10.962 9.649 -11.610
672 HZ1 LYS 82 1HZ LYS 82 10.726 11.828 -11.267
673 HZ2 LYS 82 2HZ LYS 82 11.877 12.253 -12.432
674 HZ3 LYS 82 3HZ LYS 82 12.371 11.824 -10.872
675 H ASN 83 H ASN 83 12.640 7.761 -8.861
676 HA ASN 83 HA ASN 83 15.553 7.591 -8.941
677 HB2 ASN 83 1HB ASN 83 15.169 9.699 -8.189
678 HB3 ASN 83 2HB ASN 83 13.573 9.294 -7.562
679 HD21 ASN 83 2HD2 ASN 83 13.766 10.206 -5.586
680 HD22 ASN 83 1HD2 ASN 83 14.888 9.678 -4.383
681 H LEU 84 H LEU 84 12.924 6.862 -6.645
682 HA LEU 84 HA LEU 84 14.624 5.337 -4.926
683 HB2 LEU 84 1HB LEU 84 12.441 6.579 -4.362
684 HB3 LEU 84 2HB LEU 84 11.632 5.143 -4.987
685 HG LEU 84 HG LEU 84 11.873 4.104 -3.043
686 HD11 LEU 84 1HD1 LEU 84 14.779 4.898 -2.995
687 HD12 LEU 84 2HD1 LEU 84 14.137 3.478 -3.819
688 HD13 LEU 84 3HD1 LEU 84 14.013 3.610 -2.065
689 HD21 LEU 84 1HD2 LEU 84 13.285 6.566 -2.031
690 HD22 LEU 84 2HD2 LEU 84 12.392 5.377 -1.082
691 HD23 LEU 84 3HD2 LEU 84 11.536 6.428 -2.211
692 H VAL 85 H VAL 85 15.567 3.653 -6.009
693 HA VAL 85 HA VAL 85 14.572 1.983 -7.914
694 HB VAL 85 HB VAL 85 16.457 1.418 -5.644
695 HG11 VAL 85 1HG1 VAL 85 17.006 -0.722 -6.789
696 HG12 VAL 85 2HG1 VAL 85 15.400 -0.698 -6.058
697 HG13 VAL 85 3HG1 VAL 85 15.580 -0.497 -7.801
698 HG21 VAL 85 1HG2 VAL 85 16.669 2.545 -8.245
699 HG22 VAL 85 2HG2 VAL 85 17.940 2.291 -7.049
700 HG23 VAL 85 3HG2 VAL 85 17.569 1.029 -8.223
701 H THR 86 H THR 86 13.183 0.307 -8.048
702 HA THR 86 HA THR 86 12.028 -0.761 -5.567
703 HB THR 86 HB THR 86 9.791 -0.826 -6.812
704 HG1 THR 86 1HG THR 86 9.570 0.721 -8.461
705 HG21 THR 86 1HG2 THR 86 11.070 1.687 -5.777
706 HG22 THR 86 2HG2 THR 86 9.911 0.625 -4.977
707 HG23 THR 86 3HG2 THR 86 9.388 1.662 -6.304
708 H LEU 87 H LEU 87 11.542 -2.914 -5.594
709 HA LEU 87 HA LEU 87 12.216 -4.365 -8.067
710 HB2 LEU 87 1HB LEU 87 12.383 -5.316 -5.211
711 HB3 LEU 87 2HB LEU 87 12.817 -6.254 -6.639
712 HG LEU 87 HG LEU 87 14.425 -4.079 -6.925
713 HD11 LEU 87 1HD1 LEU 87 14.330 -4.663 -3.970
714 HD12 LEU 87 2HD1 LEU 87 13.685 -3.208 -4.730
715 HD13 LEU 87 3HD1 LEU 87 15.414 -3.545 -4.800
716 HD21 LEU 87 1HD2 LEU 87 15.209 -6.303 -7.206
717 HD22 LEU 87 2HD2 LEU 87 14.915 -6.692 -5.512
718 HD23 LEU 87 3HD2 LEU 87 16.201 -5.565 -5.948
719 H ALA 88 H ALA 88 9.701 -3.460 -8.024
720 HA ALA 88 HA ALA 88 8.106 -5.845 -7.347
721 HB1 ALA 88 1HB ALA 88 7.564 -2.970 -6.871
722 HB2 ALA 88 2HB ALA 88 6.202 -3.988 -7.341
723 HB3 ALA 88 3HB ALA 88 7.141 -4.382 -5.901
724 H THR 89 H THR 89 9.535 -4.812 -9.846
725 HA THR 89 HA THR 89 9.163 -4.600 -12.094
726 HB THR 89 HB THR 89 6.799 -6.269 -12.248
727 HG1 THR 89 1HG THR 89 8.813 -7.785 -11.147
728 HG21 THR 89 1HG2 THR 89 8.790 -7.790 -13.197
729 HG22 THR 89 2HG2 THR 89 9.589 -6.219 -13.240
730 HG23 THR 89 3HG2 THR 89 8.079 -6.465 -14.117
731 H1 SER 115 H SER 115 12.771 21.318 21.675
732 HA SER 115 HA SER 115 15.048 20.850 21.383
733 HB2 SER 115 1HB SER 115 15.615 18.976 22.863
734 HB3 SER 115 2HB SER 115 14.321 19.951 23.560
735 HG SER 115 HG SER 115 13.039 18.291 23.451
736 H GLN 116 H GLN 116 15.581 20.563 19.253
737 HA GLN 116 HA GLN 116 16.265 19.482 17.373
738 HB2 GLN 116 1HB GLN 116 17.636 18.225 19.004
739 HB3 GLN 116 2HB GLN 116 16.333 17.058 19.177
740 HG2 GLN 116 1HG GLN 116 17.033 15.927 17.413
741 HG3 GLN 116 2HG GLN 116 16.996 17.375 16.408
742 HE21 GLN 116 2HE2 GLN 116 18.874 18.711 16.351
743 HE22 GLN 116 1HE2 GLN 116 20.434 18.040 16.670
744 H GLU 117 H GLU 117 13.348 19.357 18.424
745 HA GLU 117 HA GLU 117 12.432 17.243 16.587
746 HB2 GLU 117 1HB GLU 117 10.839 18.469 18.839
747 HB3 GLU 117 2HB GLU 117 10.427 17.049 17.888
748 HG2 GLU 117 1HG GLU 117 12.984 16.685 19.129
749 HG3 GLU 117 2HG GLU 117 11.783 17.146 20.334
750 H THR 118 H THR 118 10.723 17.692 15.170
751 HA THR 118 HA THR 118 9.100 19.825 14.911
752 HB THR 118 HB THR 118 10.708 21.506 14.982
753 HG1 THR 118 1HG THR 118 9.365 21.458 12.974
754 HG21 THR 118 1HG2 THR 118 12.592 20.697 12.945
755 HG22 THR 118 2HG2 THR 118 12.489 19.492 14.228
756 HG23 THR 118 3HG2 THR 118 12.884 21.166 14.619
757 H PHE 119 H PHE 119 11.656 18.738 12.668
758 HA PHE 119 HA PHE 119 9.920 18.466 10.465
759 HB2 PHE 119 1HB PHE 119 12.526 18.616 10.567
760 HB3 PHE 119 2HB PHE 119 12.445 16.864 10.712
761 HD1 PHE 119 HD1 PHE 119 9.680 17.478 8.877
762 HD2 PHE 119 HD2 PHE 119 13.911 17.748 8.509
763 HE1 PHE 119 HE1 PHE 119 9.476 17.287 6.432
764 HE2 PHE 119 HE2 PHE 119 13.715 17.559 6.064
765 HZ PHE 119 HZ PHE 119 11.495 17.329 5.022
766 H SER 120 H SER 120 11.069 16.167 12.882
767 HA SER 120 HA SER 120 10.083 13.821 11.708
768 HB2 SER 120 1HB SER 120 11.557 14.328 13.908
769 HB3 SER 120 2HB SER 120 9.999 14.006 14.668
770 HG SER 120 HG SER 120 10.349 11.976 14.317
771 H ASP 121 H ASP 121 8.454 16.434 13.189
772 HA ASP 121 HA ASP 121 6.121 15.015 14.035
773 HB2 ASP 121 1HB ASP 121 6.921 17.292 14.873
774 HB3 ASP 121 2HB ASP 121 6.259 17.956 13.382
775 H LEU 122 H LEU 122 6.737 17.229 11.307
776 HA LEU 122 HA LEU 122 4.265 16.443 10.029
777 HB2 LEU 122 1HB LEU 122 6.050 18.645 9.886
778 HB3 LEU 122 2HB LEU 122 5.943 17.931 8.279
779 HG LEU 122 HG LEU 122 3.330 18.285 9.499
780 HD11 LEU 122 1HD1 LEU 122 5.163 20.649 9.256
781 HD12 LEU 122 2HD1 LEU 122 4.142 20.180 10.614
782 HD13 LEU 122 3HD1 LEU 122 3.410 20.803 9.136
783 HD21 LEU 122 1HD2 LEU 122 2.877 19.357 7.347
784 HD22 LEU 122 2HD2 LEU 122 3.694 17.808 7.138
785 HD23 LEU 122 3HD2 LEU 122 4.598 19.313 6.962
786 H TRP 123 H TRP 123 7.740 16.147 9.356
787 HA TRP 123 HA TRP 123 7.859 14.974 6.949
788 HB2 TRP 123 1HB TRP 123 9.782 15.312 8.525
789 HB3 TRP 123 2HB TRP 123 9.302 13.829 9.346
790 HD1 TRP 123 HD1 TRP 123 10.850 11.925 8.655
791 HE1 TRP 123 HE1 TRP 123 11.986 11.156 6.478
792 HE3 TRP 123 HE3 TRP 123 9.252 15.655 5.545
793 HZ2 TRP 123 HZ2 TRP 123 12.179 12.017 3.796
794 HZ3 TRP 123 HZ3 TRP 123 9.958 15.609 3.189
795 HH2 TRP 123 HH2 TRP 123 11.392 13.827 2.334
796 H LYS 124 H LYS 124 7.328 13.070 9.922
797 HA LYS 124 HA LYS 124 6.862 10.612 8.764
798 HB2 LYS 124 1HB LYS 124 6.736 11.642 11.317
799 HB3 LYS 124 2HB LYS 124 5.069 11.170 11.012
800 HG2 LYS 124 1HG LYS 124 5.727 8.910 10.564
801 HG3 LYS 124 2HG LYS 124 7.436 9.345 10.648
802 HD2 LYS 124 1HD LYS 124 7.424 8.957 12.835
803 HD3 LYS 124 2HD LYS 124 6.199 10.209 13.051
804 HE2 LYS 124 1HE LYS 124 4.673 8.179 12.131
805 HE3 LYS 124 2HE LYS 124 5.927 7.275 12.978
806 HZ1 LYS 124 1HZ LYS 124 4.021 7.819 14.399
807 HZ2 LYS 124 2HZ LYS 124 4.321 9.468 14.175
808 HZ3 LYS 124 3HZ LYS 124 5.456 8.503 14.976
809 H LEU 125 H LEU 125 4.570 13.252 9.312
810 HA LEU 125 HA LEU 125 2.174 12.113 8.726
811 HB2 LEU 125 1HB LEU 125 2.827 14.582 9.178
812 HB3 LEU 125 2HB LEU 125 2.907 14.705 7.422
813 HG LEU 125 HG LEU 125 0.486 13.763 7.503
814 HD11 LEU 125 1HD1 LEU 125 0.930 14.680 10.327
815 HD12 LEU 125 2HD1 LEU 125 0.248 13.157 9.756
816 HD13 LEU 125 3HD1 LEU 125 -0.671 14.653 9.587
817 HD21 LEU 125 1HD2 LEU 125 1.379 16.126 6.946
818 HD22 LEU 125 2HD2 LEU 125 0.774 16.554 8.546
819 HD23 LEU 125 3HD2 LEU 125 -0.332 15.924 7.324
820 H LEU 126 H LEU 126 4.782 12.775 6.501
821 HA LEU 126 HA LEU 126 3.721 12.777 4.037
822 HB2 LEU 126 1HB LEU 126 6.095 11.346 5.140
823 HB3 LEU 126 2HB LEU 126 5.643 11.091 3.456
824 HG LEU 126 HG LEU 126 5.834 13.911 4.232
825 HD11 LEU 126 1HD1 LEU 126 7.774 13.815 5.307
826 HD12 LEU 126 2HD1 LEU 126 8.500 13.259 3.798
827 HD13 LEU 126 3HD1 LEU 126 7.940 12.087 4.991
828 HD21 LEU 126 1HD2 LEU 126 6.266 14.134 2.053
829 HD22 LEU 126 2HD2 LEU 126 5.820 12.433 1.913
830 HD23 LEU 126 3HD2 LEU 126 7.515 12.890 2.085
831 HA PRO 127 HA PRO 127 1.082 9.203 3.882
832 HB2 PRO 127 1HB PRO 127 0.340 9.501 1.287
833 HB3 PRO 127 2HB PRO 127 -0.319 10.491 2.595
834 HG2 PRO 127 1HG PRO 127 1.855 11.138 0.642
835 HG3 PRO 127 2HG PRO 127 0.521 12.158 1.208
836 HD2 PRO 127 1HD PRO 127 3.038 12.378 2.182
837 HD3 PRO 127 2HD PRO 127 1.600 12.696 3.173
838 H GLU 128 H GLU 128 3.404 8.151 4.030
839 HA GLU 128 HA GLU 128 4.954 7.280 2.020
840 HB2 GLU 128 1HB GLU 128 3.971 5.928 4.487
841 HB3 GLU 128 2HB GLU 128 4.851 4.959 3.314
842 HG2 GLU 128 1HG GLU 128 6.028 7.549 4.158
843 HG3 GLU 128 2HG GLU 128 6.072 6.198 5.289
844 H ASN 129 H ASN 129 1.914 5.669 2.951
845 HA ASN 129 HA ASN 129 1.840 3.661 1.087
846 HB2 ASN 129 1HB ASN 129 -0.431 5.342 2.162
847 HB3 ASN 129 2HB ASN 129 -0.671 3.881 1.207
848 HD21 ASN 129 2HD2 ASN 129 -1.181 2.225 2.422
849 HD22 ASN 129 1HD2 ASN 129 -0.553 1.875 3.993
Start of MODEL 3
1 H1 GLN 1 H GLN 1 1.008 -0.064 1.545
2 HA GLN 1 HA GLN 1 1.712 -1.309 -0.354
3 HB2 GLN 1 1HB GLN 1 1.742 1.421 -1.640
4 HB3 GLN 1 2HB GLN 1 2.420 -0.009 -2.407
5 HG2 GLN 1 1HG GLN 1 -0.437 0.604 -1.771
6 HG3 GLN 1 2HG GLN 1 0.291 0.186 -3.320
7 HE21 GLN 1 2HE2 GLN 1 1.495 -2.046 -3.135
8 HE22 GLN 1 1HE2 GLN 1 0.527 -3.316 -2.476
9 H ILE 2 H ILE 2 3.151 -0.958 1.789
10 HA ILE 2 HA ILE 2 5.554 0.529 1.455
11 HB ILE 2 HB ILE 2 4.899 -1.743 3.332
12 HG12 ILE 2 1HG1 ILE 2 3.547 0.022 4.004
13 HG13 ILE 2 2HG1 ILE 2 4.999 0.305 4.958
14 HG21 ILE 2 1HG2 ILE 2 6.878 -1.086 4.591
15 HG22 ILE 2 2HG2 ILE 2 7.310 -1.579 2.955
16 HG23 ILE 2 3HG2 ILE 2 7.259 0.133 3.375
17 HD11 ILE 2 1HD1 ILE 2 4.521 2.403 4.158
18 HD12 ILE 2 2HD1 ILE 2 5.685 1.822 2.968
19 HD13 ILE 2 3HD1 ILE 2 3.961 1.799 2.599
20 H ASN 3 H ASN 3 6.460 -0.054 -0.525
21 HA ASN 3 HA ASN 3 7.202 -2.834 -0.965
22 HB2 ASN 3 1HB ASN 3 6.646 -0.605 -2.642
23 HB3 ASN 3 2HB ASN 3 8.311 -1.096 -2.944
24 HD21 ASN 3 2HD2 ASN 3 8.002 -3.843 -2.404
25 HD22 ASN 3 1HD2 ASN 3 7.051 -4.531 -3.672
26 H GLN 4 H GLN 4 9.554 -2.788 -2.211
27 HA GLN 4 HA GLN 4 11.396 -1.948 -0.094
28 HB2 GLN 4 1HB GLN 4 11.956 -3.812 -2.402
29 HB3 GLN 4 2HB GLN 4 12.935 -3.580 -0.959
30 HG2 GLN 4 1HG GLN 4 11.877 -5.533 -0.446
31 HG3 GLN 4 2HG GLN 4 10.769 -4.366 0.273
32 HE21 GLN 4 2HE2 GLN 4 9.046 -5.806 0.136
33 HE22 GLN 4 1HE2 GLN 4 8.276 -6.174 -1.366
34 H VAL 5 H VAL 5 13.743 -1.618 -1.151
35 HA VAL 5 HA VAL 5 13.591 0.047 -3.537
36 HB VAL 5 HB VAL 5 14.603 1.978 -2.547
37 HG11 VAL 5 1HG1 VAL 5 12.409 1.218 -0.640
38 HG12 VAL 5 2HG1 VAL 5 12.804 2.813 -1.284
39 HG13 VAL 5 3HG1 VAL 5 12.096 1.587 -2.336
40 HG21 VAL 5 1HG2 VAL 5 15.816 1.913 -0.685
41 HG22 VAL 5 2HG2 VAL 5 14.439 1.332 0.251
42 HG23 VAL 5 3HG2 VAL 5 15.484 0.183 -0.584
43 H ARG 6 H ARG 6 15.857 0.887 -4.096
44 HA ARG 6 HA ARG 6 18.013 -0.814 -3.135
45 HB2 ARG 6 1HB ARG 6 16.638 -1.667 -5.322
46 HB3 ARG 6 2HB ARG 6 17.881 -0.679 -6.078
47 HG2 ARG 6 1HG ARG 6 19.398 -2.266 -5.791
48 HG3 ARG 6 2HG ARG 6 19.044 -2.362 -4.065
49 HD2 ARG 6 1HD ARG 6 17.540 -4.075 -4.330
50 HD3 ARG 6 2HD ARG 6 17.147 -3.615 -5.986
51 HE ARG 6 HE ARG 6 19.765 -4.430 -6.066
52 HH11 ARG 6 1HH1 ARG 6 16.733 -5.844 -5.103
53 HH12 ARG 6 2HH1 ARG 6 17.207 -7.459 -5.512
54 HH21 ARG 6 1HH2 ARG 6 20.401 -6.552 -6.609
55 HH22 ARG 6 2HH2 ARG 6 19.294 -7.861 -6.368
56 HA PRO 7 HA PRO 7 19.341 3.522 -3.923
57 HB2 PRO 7 1HB PRO 7 20.939 3.653 -1.733
58 HB3 PRO 7 2HB PRO 7 19.203 3.980 -1.676
59 HG2 PRO 7 1HG PRO 7 20.685 1.484 -0.943
60 HG3 PRO 7 2HG PRO 7 19.347 2.281 -0.095
61 HD2 PRO 7 1HD PRO 7 18.984 0.113 -1.676
62 HD3 PRO 7 2HD PRO 7 17.755 1.383 -1.498
63 H LYS 8 H LYS 8 20.686 3.325 -5.641
64 HA LYS 8 HA LYS 8 22.892 1.561 -5.774
65 HB2 LYS 8 1HB LYS 8 21.559 2.794 -7.664
66 HB3 LYS 8 2HB LYS 8 22.753 4.062 -7.417
67 HG2 LYS 8 1HG LYS 8 24.261 2.961 -8.606
68 HG3 LYS 8 2HG LYS 8 24.042 1.503 -7.636
69 HD2 LYS 8 1HD LYS 8 22.494 0.612 -9.078
70 HD3 LYS 8 2HD LYS 8 21.971 2.193 -9.663
71 HE2 LYS 8 1HE LYS 8 23.374 2.076 -11.384
72 HE3 LYS 8 2HE LYS 8 24.736 1.770 -10.308
73 HZ1 LYS 8 1HZ LYS 8 23.433 -0.022 -12.039
74 HZ2 LYS 8 2HZ LYS 8 23.242 -0.575 -10.452
75 HZ3 LYS 8 3HZ LYS 8 24.792 -0.293 -11.068
76 H LEU 9 H LEU 9 25.104 2.730 -6.536
77 HA LEU 9 HA LEU 9 26.464 3.489 -4.306
78 HB2 LEU 9 1HB LEU 9 27.596 4.988 -6.414
79 HB3 LEU 9 2HB LEU 9 28.131 3.443 -5.758
80 HG LEU 9 HG LEU 9 26.025 3.603 -7.893
81 HD11 LEU 9 1HD1 LEU 9 27.661 3.444 -9.585
82 HD12 LEU 9 2HD1 LEU 9 28.963 3.240 -8.414
83 HD13 LEU 9 3HD1 LEU 9 28.149 4.797 -8.563
84 HD21 LEU 9 1HD2 LEU 9 27.936 1.382 -7.763
85 HD22 LEU 9 2HD2 LEU 9 26.186 1.366 -7.979
86 HD23 LEU 9 3HD2 LEU 9 26.874 1.525 -6.363
87 HA PRO 10 HA PRO 10 25.762 8.176 -5.239
88 HB2 PRO 10 1HB PRO 10 23.933 8.808 -7.143
89 HB3 PRO 10 2HB PRO 10 25.644 8.547 -7.503
90 HG2 PRO 10 1HG PRO 10 23.334 6.670 -7.823
91 HG3 PRO 10 2HG PRO 10 24.686 6.978 -8.927
92 HD2 PRO 10 1HD PRO 10 24.604 4.823 -7.290
93 HD3 PRO 10 2HD PRO 10 26.124 5.617 -7.747
94 H LEU 11 H LEU 11 23.491 5.775 -4.747
95 HA LEU 11 HA LEU 11 21.540 7.672 -3.619
96 HB2 LEU 11 1HB LEU 11 21.274 5.133 -5.062
97 HB3 LEU 11 2HB LEU 11 20.262 5.265 -3.626
98 HG LEU 11 HG LEU 11 18.939 6.893 -4.539
99 HD11 LEU 11 1HD1 LEU 11 21.367 7.676 -6.103
100 HD12 LEU 11 2HD1 LEU 11 20.410 8.634 -4.975
101 HD13 LEU 11 3HD1 LEU 11 19.765 8.246 -6.569
102 HD21 LEU 11 1HD2 LEU 11 19.828 4.905 -6.480
103 HD22 LEU 11 2HD2 LEU 11 19.121 6.342 -7.218
104 HD23 LEU 11 3HD2 LEU 11 18.197 5.411 -6.038
105 H LEU 12 H LEU 12 23.852 5.287 -2.889
106 HA LEU 12 HA LEU 12 22.718 4.423 -0.397
107 HB2 LEU 12 1HB LEU 12 24.713 3.513 -2.069
108 HB3 LEU 12 2HB LEU 12 25.601 4.116 -0.672
109 HG LEU 12 HG LEU 12 23.776 1.783 -0.907
110 HD11 LEU 12 1HD1 LEU 12 25.787 1.622 1.110
111 HD12 LEU 12 2HD1 LEU 12 26.501 2.263 -0.369
112 HD13 LEU 12 3HD1 LEU 12 25.650 0.719 -0.399
113 HD21 LEU 12 1HD2 LEU 12 23.732 1.876 1.690
114 HD22 LEU 12 2HD2 LEU 12 22.534 2.780 0.764
115 HD23 LEU 12 3HD2 LEU 12 23.929 3.612 1.451
116 H LYS 13 H LYS 13 25.213 6.725 -1.390
117 HA LYS 13 HA LYS 13 26.072 7.439 1.198
118 HB2 LYS 13 1HB LYS 13 26.786 9.604 -0.029
119 HB3 LYS 13 2HB LYS 13 27.531 8.082 -0.499
120 HG2 LYS 13 1HG LYS 13 26.803 8.289 -2.581
121 HG3 LYS 13 2HG LYS 13 25.146 8.561 -2.037
122 HD2 LYS 13 1HD LYS 13 25.304 10.780 -2.317
123 HD3 LYS 13 2HD LYS 13 26.911 10.846 -1.591
124 HE2 LYS 13 1HE LYS 13 27.551 9.662 -3.890
125 HE3 LYS 13 2HE LYS 13 26.110 10.521 -4.429
126 HZ1 LYS 13 1HZ LYS 13 27.683 12.269 -2.900
127 HZ2 LYS 13 2HZ LYS 13 27.289 12.374 -4.541
128 HZ3 LYS 13 3HZ LYS 13 28.680 11.541 -4.056
129 H ILE 14 H ILE 14 23.321 8.368 -0.698
130 HA ILE 14 HA ILE 14 22.676 10.800 0.548
131 HB ILE 14 HB ILE 14 20.718 8.790 -0.564
132 HG12 ILE 14 1HG1 ILE 14 22.566 9.345 -2.149
133 HG13 ILE 14 2HG1 ILE 14 20.982 9.872 -2.707
134 HG21 ILE 14 1HG2 ILE 14 20.568 11.752 -0.056
135 HG22 ILE 14 2HG2 ILE 14 19.416 10.882 -1.068
136 HG23 ILE 14 3HG2 ILE 14 19.566 10.479 0.642
137 HD11 ILE 14 1HD1 ILE 14 22.185 11.979 -1.217
138 HD12 ILE 14 2HD1 ILE 14 23.326 11.395 -2.428
139 HD13 ILE 14 3HD1 ILE 14 21.722 11.939 -2.918
140 H LEU 15 H LEU 15 21.361 7.541 1.175
141 HA LEU 15 HA LEU 15 19.969 8.354 3.522
142 HB2 LEU 15 1HB LEU 15 20.779 5.565 2.721
143 HB3 LEU 15 2HB LEU 15 19.500 6.016 3.848
144 HG LEU 15 HG LEU 15 18.140 5.678 2.102
145 HD11 LEU 15 1HD1 LEU 15 17.593 7.609 0.911
146 HD12 LEU 15 2HD1 LEU 15 19.263 8.175 0.879
147 HD13 LEU 15 3HD1 LEU 15 18.348 8.212 2.387
148 HD21 LEU 15 1HD2 LEU 15 19.152 4.631 0.420
149 HD22 LEU 15 2HD2 LEU 15 20.667 5.490 0.702
150 HD23 LEU 15 3HD2 LEU 15 19.413 6.219 -0.302
151 H HIS 16 H HIS 16 23.109 6.902 2.894
152 HA HIS 16 HA HIS 16 23.798 6.124 5.478
153 HB2 HIS 16 1HB HIS 16 25.389 6.988 3.087
154 HB3 HIS 16 2HB HIS 16 26.204 6.692 4.620
155 HD1 HIS 16 HD1 HIS 16 27.414 4.713 3.307
156 HD2 HIS 16 HD2 HIS 16 23.333 4.239 3.931
157 HE1 HIS 16 HE1 HIS 16 26.950 2.276 2.898
158 H ALA 17 H ALA 17 24.323 9.243 3.855
159 HA ALA 17 HA ALA 17 25.644 10.521 5.973
160 HB1 ALA 17 1HB ALA 17 25.888 11.848 4.182
161 HB2 ALA 17 2HB ALA 17 24.359 11.333 3.468
162 HB3 ALA 17 3HB ALA 17 24.373 12.574 4.721
163 H ALA 18 H ALA 18 22.235 10.044 5.300
164 HA ALA 18 HA ALA 18 21.323 11.863 7.321
165 HB1 ALA 18 1HB ALA 18 19.675 11.653 5.778
166 HB2 ALA 18 2HB ALA 18 20.066 9.969 5.426
167 HB3 ALA 18 3HB ALA 18 19.153 10.377 6.879
168 H GLY 19 H GLY 19 22.712 8.822 7.435
169 HA2 GLY 19 1HA GLY 19 23.188 8.007 9.710
170 HA3 GLY 19 2HA GLY 19 21.498 8.315 10.082
171 H ALA 20 H ALA 20 22.126 7.021 6.977
172 HA ALA 20 HA ALA 20 20.897 4.501 7.788
173 HB1 ALA 20 1HB ALA 20 20.194 5.962 5.764
174 HB2 ALA 20 2HB ALA 20 21.565 5.199 4.958
175 HB3 ALA 20 3HB ALA 20 20.249 4.208 5.587
176 H GLN 21 H GLN 21 21.743 2.582 6.303
177 HA GLN 21 HA GLN 21 24.400 2.385 5.540
178 HB2 GLN 21 1HB GLN 21 24.325 2.711 8.256
179 HB3 GLN 21 2HB GLN 21 24.346 0.959 8.109
180 HG2 GLN 21 1HG GLN 21 26.549 1.120 7.946
181 HG3 GLN 21 2HG GLN 21 26.288 1.778 6.332
182 HE21 GLN 21 2HE2 GLN 21 25.793 4.191 6.343
183 HE22 GLN 21 1HE2 GLN 21 26.793 5.166 7.360
184 H GLY 22 H GLY 22 24.601 0.563 4.392
185 HA2 GLY 22 1HA GLY 22 24.180 -1.986 4.786
186 HA3 GLY 22 2HA GLY 22 22.504 -1.464 4.694
187 H GLU 23 H GLU 23 21.575 -1.575 2.765
188 HA GLU 23 HA GLU 23 22.768 -0.753 0.355
189 HB2 GLU 23 1HB GLU 23 23.319 -3.485 1.154
190 HB3 GLU 23 2HB GLU 23 22.440 -3.432 -0.368
191 HG2 GLU 23 1HG GLU 23 24.128 -2.277 -1.453
192 HG3 GLU 23 2HG GLU 23 24.839 -1.703 0.054
193 H MET 24 H MET 24 20.369 -2.756 1.956
194 HA MET 24 HA MET 24 18.421 -1.954 -0.104
195 HB2 MET 24 1HB MET 24 17.200 -4.108 0.705
196 HB3 MET 24 2HB MET 24 18.532 -4.245 -0.435
197 HG2 MET 24 1HG MET 24 18.904 -4.533 2.528
198 HG3 MET 24 2HG MET 24 18.497 -5.889 1.479
199 HE1 MET 24 1HE MET 24 20.654 -4.258 -1.097
200 HE2 MET 24 2HE MET 24 21.492 -5.808 -1.032
201 HE3 MET 24 3HE MET 24 19.730 -5.754 -0.954
202 H PHE 25 H PHE 25 16.411 -1.268 0.579
203 HA PHE 25 HA PHE 25 15.686 -1.368 3.372
204 HB2 PHE 25 1HB PHE 25 16.114 1.324 2.063
205 HB3 PHE 25 2HB PHE 25 15.561 1.031 3.708
206 HD1 PHE 25 HD2 PHE 25 18.448 0.496 1.437
207 HD2 PHE 25 HD1 PHE 25 17.087 0.879 5.451
208 HE1 PHE 25 HE2 PHE 25 20.780 0.533 2.220
209 HE2 PHE 25 HE1 PHE 25 19.418 0.917 6.241
210 HZ PHE 25 HZ PHE 25 21.268 0.743 4.625
211 H THR 26 H THR 26 13.562 -0.159 3.723
212 HA THR 26 HA THR 26 11.813 -0.791 1.465
213 HB THR 26 HB THR 26 10.139 -0.085 3.525
214 HG1 THR 26 1HG THR 26 12.343 -1.497 4.658
215 HG21 THR 26 1HG2 THR 26 10.565 -2.806 3.888
216 HG22 THR 26 2HG2 THR 26 11.041 -2.511 2.216
217 HG23 THR 26 3HG2 THR 26 9.427 -2.063 2.766
218 H VAL 27 H VAL 27 9.776 0.684 1.394
219 HA VAL 27 HA VAL 27 10.513 3.180 0.435
220 HB VAL 27 HB VAL 27 7.782 2.768 1.596
221 HG11 VAL 27 1HG1 VAL 27 8.768 4.022 -0.964
222 HG12 VAL 27 2HG1 VAL 27 7.095 3.987 -0.404
223 HG13 VAL 27 3HG1 VAL 27 8.311 4.889 0.501
224 HG21 VAL 27 1HG2 VAL 27 7.334 1.671 -0.736
225 HG22 VAL 27 2HG2 VAL 27 9.043 1.243 -0.639
226 HG23 VAL 27 3HG2 VAL 27 7.923 0.693 0.608
227 H LYS 28 H LYS 28 9.266 2.289 3.630
228 HA LYS 28 HA LYS 28 9.122 4.921 4.652
229 HB2 LYS 28 1HB LYS 28 9.052 2.177 5.791
230 HB3 LYS 28 2HB LYS 28 9.429 3.491 6.897
231 HG2 LYS 28 1HG LYS 28 7.252 3.824 7.112
232 HG3 LYS 28 2HG LYS 28 7.232 4.389 5.440
233 HD2 LYS 28 1HD LYS 28 5.574 2.594 5.920
234 HD3 LYS 28 2HD LYS 28 6.717 2.186 4.639
235 HE2 LYS 28 1HE LYS 28 6.136 0.493 6.593
236 HE3 LYS 28 2HE LYS 28 7.746 0.578 5.880
237 HZ1 LYS 28 1HZ LYS 28 7.066 2.232 8.223
238 HZ2 LYS 28 2HZ LYS 28 8.584 1.700 7.700
239 HZ3 LYS 28 3HZ LYS 28 7.510 0.612 8.424
240 H GLU 29 H GLU 29 11.588 2.379 5.026
241 HA GLU 29 HA GLU 29 13.371 3.721 6.650
242 HB2 GLU 29 1HB GLU 29 13.723 1.642 4.519
243 HB3 GLU 29 2HB GLU 29 15.134 2.342 5.299
244 HG2 GLU 29 1HG GLU 29 14.346 1.601 7.463
245 HG3 GLU 29 2HG GLU 29 12.871 0.971 6.733
246 H VAL 30 H VAL 30 13.304 3.695 3.089
247 HA VAL 30 HA VAL 30 15.453 5.460 2.710
248 HB VAL 30 HB VAL 30 13.077 4.854 0.952
249 HG11 VAL 30 1HG1 VAL 30 13.623 6.613 -0.292
250 HG12 VAL 30 2HG1 VAL 30 15.027 6.960 0.720
251 HG13 VAL 30 3HG1 VAL 30 15.166 5.829 -0.627
252 HG21 VAL 30 1HG2 VAL 30 15.956 3.962 0.826
253 HG22 VAL 30 2HG2 VAL 30 14.595 2.982 1.370
254 HG23 VAL 30 3HG2 VAL 30 14.683 3.514 -0.308
255 H MET 31 H MET 31 11.949 6.078 2.795
256 HA MET 31 HA MET 31 12.056 8.833 2.340
257 HB2 MET 31 1HB MET 31 9.830 8.682 2.517
258 HB3 MET 31 2HB MET 31 10.066 6.964 2.810
259 HG2 MET 31 1HG MET 31 8.689 7.678 4.547
260 HG3 MET 31 2HG MET 31 10.295 7.575 5.265
261 HE1 MET 31 1HE MET 31 9.151 10.526 2.835
262 HE2 MET 31 2HE MET 31 7.688 9.909 3.602
263 HE3 MET 31 3HE MET 31 8.277 11.524 3.998
264 H HIS 32 H HIS 32 12.418 6.964 5.294
265 HA HIS 32 HA HIS 32 12.240 9.067 7.143
266 HB2 HIS 32 1HB HIS 32 12.347 6.481 7.503
267 HB3 HIS 32 2HB HIS 32 14.088 6.742 7.574
268 HD1 HIS 32 HD1 HIS 32 11.363 6.406 9.755
269 HD2 HIS 32 HD2 HIS 32 14.569 9.043 9.573
270 HE1 HIS 32 HE1 HIS 32 11.579 7.363 12.071
271 H TYR 33 H TYR 33 14.906 7.892 5.183
272 HA TYR 33 HA TYR 33 16.903 9.468 6.496
273 HB2 TYR 33 1HB TYR 33 16.912 8.060 3.820
274 HB3 TYR 33 2HB TYR 33 18.319 8.829 4.544
275 HD1 TYR 33 HD1 TYR 33 18.485 8.039 7.217
276 HD2 TYR 33 HD2 TYR 33 16.991 5.766 3.945
277 HE1 TYR 33 HE1 TYR 33 18.999 5.964 8.432
278 HE2 TYR 33 HE2 TYR 33 17.500 3.684 5.152
279 HH TYR 33 HH TYR 33 18.719 2.827 6.911
280 H LEU 34 H LEU 34 14.755 9.905 3.771
281 HA LEU 34 HA LEU 34 15.926 11.993 2.418
282 HB2 LEU 34 1HB LEU 34 13.255 10.920 2.729
283 HB3 LEU 34 2HB LEU 34 13.231 12.666 2.494
284 HG LEU 34 HG LEU 34 12.952 11.519 0.379
285 HD11 LEU 34 1HD1 LEU 34 14.728 12.590 -0.877
286 HD12 LEU 34 2HD1 LEU 34 15.690 12.763 0.590
287 HD13 LEU 34 3HD1 LEU 34 14.174 13.647 0.421
288 HD21 LEU 34 1HD2 LEU 34 15.630 10.258 0.961
289 HD22 LEU 34 2HD2 LEU 34 14.728 10.117 -0.548
290 HD23 LEU 34 3HD2 LEU 34 14.074 9.427 0.939
291 H GLY 35 H GLY 35 13.514 12.355 5.031
292 HA2 GLY 35 1HA GLY 35 13.677 15.111 5.308
293 HA3 GLY 35 2HA GLY 35 13.236 14.006 6.602
294 H GLN 36 H GLN 36 15.550 12.634 7.046
295 HA GLN 36 HA GLN 36 17.000 14.369 8.682
296 HB2 GLN 36 1HB GLN 36 17.763 11.673 7.553
297 HB3 GLN 36 2HB GLN 36 18.671 12.508 8.806
298 HG2 GLN 36 1HG GLN 36 16.147 12.526 9.835
299 HG3 GLN 36 2HG GLN 36 16.188 10.985 8.980
300 HE21 GLN 36 2HE2 GLN 36 17.894 12.944 11.360
301 HE22 GLN 36 1HE2 GLN 36 18.572 11.617 12.235
302 H TYR 37 H TYR 37 17.622 13.250 5.395
303 HA TYR 37 HA TYR 37 20.217 14.327 5.144
304 HB2 TYR 37 1HB TYR 37 19.243 12.624 3.615
305 HB3 TYR 37 2HB TYR 37 18.181 13.863 2.955
306 HD1 TYR 37 HD2 TYR 37 21.822 13.270 3.568
307 HD2 TYR 37 HD1 TYR 37 18.848 14.940 1.025
308 HE1 TYR 37 HE2 TYR 37 23.564 13.890 1.948
309 HE2 TYR 37 HE1 TYR 37 20.582 15.564 -0.603
310 HH TYR 37 HH TYR 37 24.004 14.796 -0.027
311 H ILE 38 H ILE 38 17.031 15.613 4.246
312 HA ILE 38 HA ILE 38 17.887 18.007 3.096
313 HB ILE 38 HB ILE 38 15.337 17.525 4.641
314 HG12 ILE 38 1HG1 ILE 38 15.888 17.292 1.675
315 HG13 ILE 38 2HG1 ILE 38 15.709 15.932 2.777
316 HG21 ILE 38 1HG2 ILE 38 15.942 19.601 2.541
317 HG22 ILE 38 2HG2 ILE 38 14.429 19.398 3.423
318 HG23 ILE 38 3HG2 ILE 38 15.885 19.908 4.276
319 HD11 ILE 38 1HD1 ILE 38 13.612 17.939 2.001
320 HD12 ILE 38 2HD1 ILE 38 13.661 16.221 1.605
321 HD13 ILE 38 3HD1 ILE 38 13.406 16.734 3.272
322 H MET 39 H MET 39 16.992 17.297 6.462
323 HA MET 39 HA MET 39 17.430 19.920 7.426
324 HB2 MET 39 1HB MET 39 16.529 19.051 9.272
325 HB3 MET 39 2HB MET 39 16.503 17.484 8.474
326 HG2 MET 39 1HG MET 39 18.632 16.907 9.390
327 HG3 MET 39 2HG MET 39 18.851 18.534 10.030
328 HE1 MET 39 1HE MET 39 15.300 18.496 11.277
329 HE2 MET 39 2HE MET 39 16.225 18.847 12.737
330 HE3 MET 39 3HE MET 39 16.711 19.553 11.195
331 H VAL 40 H VAL 40 19.509 17.118 7.035
332 HA VAL 40 HA VAL 40 21.694 18.064 8.560
333 HB VAL 40 HB VAL 40 21.117 15.725 7.198
334 HG11 VAL 40 1HG1 VAL 40 22.015 16.702 5.132
335 HG12 VAL 40 2HG1 VAL 40 23.555 16.987 5.946
336 HG13 VAL 40 3HG1 VAL 40 22.983 15.338 5.692
337 HG21 VAL 40 1HG2 VAL 40 23.272 14.946 8.123
338 HG22 VAL 40 2HG2 VAL 40 23.697 16.620 8.482
339 HG23 VAL 40 3HG2 VAL 40 22.322 15.867 9.290
340 H LYS 41 H LYS 41 20.798 18.418 5.167
341 HA LYS 41 HA LYS 41 23.224 19.905 4.576
342 HB2 LYS 41 1HB LYS 41 20.981 18.759 2.995
343 HB3 LYS 41 2HB LYS 41 21.800 20.164 2.323
344 HG2 LYS 41 1HG LYS 41 23.141 17.597 3.148
345 HG3 LYS 41 2HG LYS 41 22.730 18.057 1.494
346 HD2 LYS 41 1HD LYS 41 24.770 18.962 1.392
347 HD3 LYS 41 2HD LYS 41 24.134 20.238 2.432
348 HE2 LYS 41 1HE LYS 41 25.664 19.658 3.938
349 HE3 LYS 41 2HE LYS 41 24.780 18.149 4.161
350 HZ1 LYS 41 1HZ LYS 41 26.878 17.413 3.644
351 HZ2 LYS 41 2HZ LYS 41 27.186 18.666 2.551
352 HZ3 LYS 41 3HZ LYS 41 26.151 17.400 2.116
353 H GLN 42 H GLN 42 20.074 20.531 5.677
354 HA GLN 42 HA GLN 42 19.011 22.469 6.228
355 HB2 GLN 42 1HB GLN 42 21.785 23.262 5.922
356 HB3 GLN 42 2HB GLN 42 20.691 24.560 5.463
357 HG2 GLN 42 1HG GLN 42 20.817 25.031 7.658
358 HG3 GLN 42 2HG GLN 42 19.533 23.827 7.751
359 HE21 GLN 42 2HE2 GLN 42 21.361 21.629 7.150
360 HE22 GLN 42 1HE2 GLN 42 22.267 21.355 8.595
361 H LEU 43 H LEU 43 17.772 21.697 4.277
362 HA LEU 43 HA LEU 43 17.792 23.814 2.233
363 HB2 LEU 43 1HB LEU 43 17.506 20.847 1.860
364 HB3 LEU 43 2HB LEU 43 16.940 22.002 0.655
365 HG LEU 43 HG LEU 43 19.788 22.041 1.586
366 HD11 LEU 43 1HD1 LEU 43 19.079 19.717 0.840
367 HD12 LEU 43 2HD1 LEU 43 20.441 20.447 -0.008
368 HD13 LEU 43 3HD1 LEU 43 18.846 20.421 -0.760
369 HD21 LEU 43 1HD2 LEU 43 19.999 22.788 -0.865
370 HD22 LEU 43 2HD2 LEU 43 19.298 23.917 0.294
371 HD23 LEU 43 3HD2 LEU 43 18.251 23.009 -0.798
372 H TYR 44 H TYR 44 16.225 24.409 4.161
373 HA TYR 44 HA TYR 44 13.571 24.096 3.103
374 HB2 TYR 44 1HB TYR 44 12.592 23.211 5.207
375 HB3 TYR 44 2HB TYR 44 13.663 22.060 4.415
376 HD1 TYR 44 HD2 TYR 44 16.174 22.147 5.258
377 HD2 TYR 44 HD1 TYR 44 12.822 23.536 7.482
378 HE1 TYR 44 HE2 TYR 44 17.463 21.909 7.339
379 HE2 TYR 44 HE1 TYR 44 14.103 23.303 9.569
380 HH TYR 44 HH TYR 44 17.135 23.234 9.867
381 H ASP 45 H ASP 45 11.999 25.458 4.224
382 HA ASP 45 HA ASP 45 13.193 27.941 5.033
383 HB2 ASP 45 1HB ASP 45 10.936 27.399 3.704
384 HB3 ASP 45 2HB ASP 45 10.265 27.503 5.330
385 H GLN 46 H GLN 46 14.044 28.049 7.018
386 HA GLN 46 HA GLN 46 13.504 26.554 9.235
387 HB2 GLN 46 1HB GLN 46 14.601 29.276 8.804
388 HB3 GLN 46 2HB GLN 46 14.104 28.879 10.444
389 HG2 GLN 46 1HG GLN 46 16.551 28.435 9.602
390 HG3 GLN 46 2HG GLN 46 15.749 27.337 10.724
391 HE21 GLN 46 2HE2 GLN 46 15.903 27.860 7.213
392 HE22 GLN 46 1HE2 GLN 46 16.124 26.196 6.805
393 H GLN 47 H GLN 47 11.635 29.194 7.951
394 HA GLN 47 HA GLN 47 10.016 29.514 10.312
395 HB2 GLN 47 1HB GLN 47 9.049 30.508 7.688
396 HB3 GLN 47 2HB GLN 47 9.074 31.307 9.255
397 HG2 GLN 47 1HG GLN 47 11.326 30.996 7.296
398 HG3 GLN 47 2HG GLN 47 10.577 32.483 7.876
399 HE21 GLN 47 2HE2 GLN 47 13.169 30.447 8.200
400 HE22 GLN 47 1HE2 GLN 47 13.747 30.976 9.740
401 H GLU 48 H GLU 48 9.813 27.786 7.268
402 HA GLU 48 HA GLU 48 7.395 26.446 8.266
403 HB2 GLU 48 1HB GLU 48 7.847 27.712 5.590
404 HB3 GLU 48 2HB GLU 48 6.805 26.302 5.715
405 HG2 GLU 48 1HG GLU 48 5.448 27.505 7.394
406 HG3 GLU 48 2HG GLU 48 6.452 28.931 7.134
407 H GLN 49 H GLN 49 8.824 24.770 8.956
408 HA GLN 49 HA GLN 49 10.683 23.433 7.395
409 HB2 GLN 49 1HB GLN 49 8.891 22.119 9.438
410 HB3 GLN 49 2HB GLN 49 10.501 21.609 8.947
411 HG2 GLN 49 1HG GLN 49 10.406 24.339 9.967
412 HG3 GLN 49 2HG GLN 49 9.904 23.122 11.141
413 HE21 GLN 49 2HE2 GLN 49 12.153 24.620 11.552
414 HE22 GLN 49 1HE2 GLN 49 13.555 23.620 11.413
415 H HIS 50 H HIS 50 7.281 23.490 7.113
416 HA HIS 50 HA HIS 50 6.970 20.952 5.820
417 HB2 HIS 50 1HB HIS 50 4.703 21.740 5.293
418 HB3 HIS 50 2HB HIS 50 5.094 22.007 6.989
419 HD1 HIS 50 HD1 HIS 50 4.110 24.145 7.716
420 HD2 HIS 50 HD2 HIS 50 5.567 24.369 3.831
421 HE1 HIS 50 HE1 HIS 50 3.714 26.518 6.985
422 H MET 51 H MET 51 8.548 23.636 4.855
423 HA MET 51 HA MET 51 7.992 23.088 2.016
424 HB2 MET 51 1HB MET 51 8.140 25.682 3.465
425 HB3 MET 51 2HB MET 51 8.827 25.620 1.848
426 HG2 MET 51 1HG MET 51 6.217 24.385 1.942
427 HG3 MET 51 2HG MET 51 6.176 26.048 2.522
428 HE1 MET 51 1HE MET 51 8.451 24.248 0.258
429 HE2 MET 51 2HE MET 51 7.998 24.681 -1.390
430 HE3 MET 51 3HE MET 51 9.044 25.749 -0.453
431 H VAL 52 H VAL 52 9.711 22.066 1.230
432 HA VAL 52 HA VAL 52 12.354 22.514 2.335
433 HB VAL 52 HB VAL 52 11.486 20.696 0.083
434 HG11 VAL 52 1HG1 VAL 52 14.017 20.449 1.668
435 HG12 VAL 52 2HG1 VAL 52 13.613 19.750 0.099
436 HG13 VAL 52 3HG1 VAL 52 13.935 21.479 0.240
437 HG21 VAL 52 1HG2 VAL 52 10.990 20.485 2.827
438 HG22 VAL 52 2HG2 VAL 52 10.811 19.223 1.608
439 HG23 VAL 52 3HG2 VAL 52 12.324 19.378 2.501
440 H TYR 53 H TYR 53 14.054 23.486 1.324
441 HA TYR 53 HA TYR 53 13.450 24.857 -1.213
442 HB2 TYR 53 1HB TYR 53 14.861 25.734 1.257
443 HB3 TYR 53 2HB TYR 53 15.465 26.339 -0.281
444 HD1 TYR 53 HD1 TYR 53 13.220 26.928 -1.887
445 HD2 TYR 53 HD2 TYR 53 13.583 27.316 2.334
446 HE1 TYR 53 HE1 TYR 53 11.468 28.653 -1.901
447 HE2 TYR 53 HE2 TYR 53 11.830 29.041 2.332
448 HH TYR 53 HH TYR 53 10.396 30.200 -0.691
449 H CYS 54 H CYS 54 14.287 22.384 -1.605
450 HA CYS 54 HA CYS 54 16.838 21.552 -1.535
451 HB2 CYS 54 1HB CYS 54 16.483 20.394 -3.652
452 HB3 CYS 54 2HB CYS 54 15.023 20.329 -2.671
453 HG CYS 54 HG CYS 54 13.522 21.090 -4.598
454 H GLY 55 H GLY 55 15.636 24.228 -3.424
455 HA2 GLY 55 1HA GLY 55 16.705 25.817 -4.691
456 HA3 GLY 55 2HA GLY 55 18.112 25.475 -3.694
457 H GLY 56 H GLY 56 19.745 24.176 -4.479
458 HA2 GLY 56 1HA GLY 56 19.387 23.033 -7.162
459 HA3 GLY 56 2HA GLY 56 20.689 24.184 -6.900
460 H ASP 57 H ASP 57 20.090 22.319 -4.157
461 HA ASP 57 HA ASP 57 22.625 21.091 -4.219
462 HB2 ASP 57 1HB ASP 57 20.621 21.473 -2.321
463 HB3 ASP 57 2HB ASP 57 20.733 19.724 -2.489
464 H LEU 58 H LEU 58 22.696 18.583 -3.703
465 HA LEU 58 HA LEU 58 22.391 17.196 -6.036
466 HB2 LEU 58 1HB LEU 58 22.805 16.506 -3.234
467 HB3 LEU 58 2HB LEU 58 21.999 15.233 -4.147
468 HG LEU 58 HG LEU 58 23.841 14.964 -5.594
469 HD11 LEU 58 1HD1 LEU 58 24.319 17.721 -4.988
470 HD12 LEU 58 2HD1 LEU 58 24.976 16.734 -6.293
471 HD13 LEU 58 3HD1 LEU 58 25.793 16.788 -4.731
472 HD21 LEU 58 1HD2 LEU 58 25.195 15.524 -2.976
473 HD22 LEU 58 2HD2 LEU 58 25.523 14.243 -4.144
474 HD23 LEU 58 3HD2 LEU 58 24.059 14.188 -3.161
475 H LEU 59 H LEU 59 20.140 17.038 -3.272
476 HA LEU 59 HA LEU 59 18.209 15.451 -4.538
477 HB2 LEU 59 1HB LEU 59 16.677 16.252 -2.795
478 HB3 LEU 59 2HB LEU 59 18.232 15.734 -2.148
479 HG LEU 59 HG LEU 59 18.560 18.454 -2.516
480 HD11 LEU 59 1HD1 LEU 59 15.854 18.018 -1.272
481 HD12 LEU 59 2HD1 LEU 59 16.092 18.569 -2.930
482 HD13 LEU 59 3HD1 LEU 59 16.668 19.551 -1.584
483 HD21 LEU 59 1HD2 LEU 59 17.860 18.226 0.114
484 HD22 LEU 59 2HD2 LEU 59 19.448 17.842 -0.553
485 HD23 LEU 59 3HD2 LEU 59 18.261 16.560 -0.306
486 H GLY 60 H GLY 60 18.623 18.957 -4.399
487 HA2 GLY 60 1HA GLY 60 16.183 19.715 -5.543
488 HA3 GLY 60 2HA GLY 60 17.671 20.648 -5.624
489 H GLU 61 H GLU 61 19.309 19.094 -7.132
490 HA GLU 61 HA GLU 61 18.334 19.577 -9.751
491 HB2 GLU 61 1HB GLU 61 20.717 17.888 -8.983
492 HB3 GLU 61 2HB GLU 61 20.434 18.689 -10.522
493 HG2 GLU 61 1HG GLU 61 21.084 19.948 -7.876
494 HG3 GLU 61 2HG GLU 61 22.036 19.975 -9.359
495 H LEU 62 H LEU 62 18.600 16.701 -7.749
496 HA LEU 62 HA LEU 62 18.049 14.799 -9.761
497 HB2 LEU 62 1HB LEU 62 18.687 14.740 -7.075
498 HB3 LEU 62 2HB LEU 62 17.049 14.092 -7.123
499 HG LEU 62 HG LEU 62 18.676 12.298 -7.186
500 HD11 LEU 62 1HD1 LEU 62 17.969 11.220 -9.320
501 HD12 LEU 62 2HD1 LEU 62 17.214 12.746 -9.780
502 HD13 LEU 62 3HD1 LEU 62 16.641 11.873 -8.360
503 HD21 LEU 62 1HD2 LEU 62 19.751 12.631 -9.806
504 HD22 LEU 62 2HD2 LEU 62 20.603 12.483 -8.268
505 HD23 LEU 62 3HD2 LEU 62 20.108 14.072 -8.853
506 H LEU 63 H LEU 63 15.991 16.725 -7.660
507 HA LEU 63 HA LEU 63 13.574 15.375 -8.426
508 HB2 LEU 63 1HB LEU 63 14.372 17.346 -6.507
509 HB3 LEU 63 2HB LEU 63 12.967 17.927 -7.398
510 HG LEU 63 HG LEU 63 12.852 15.169 -6.302
511 HD11 LEU 63 1HD1 LEU 63 12.502 17.617 -4.579
512 HD12 LEU 63 2HD1 LEU 63 13.846 16.481 -4.472
513 HD13 LEU 63 3HD1 LEU 63 12.207 15.943 -4.106
514 HD21 LEU 63 1HD2 LEU 63 10.924 17.451 -6.676
515 HD22 LEU 63 2HD2 LEU 63 10.506 15.953 -5.844
516 HD23 LEU 63 3HD2 LEU 63 10.973 15.917 -7.545
517 H GLY 64 H GLY 64 15.208 18.383 -9.311
518 HA2 GLY 64 1HA GLY 64 15.094 19.253 -11.532
519 HA3 GLY 64 2HA GLY 64 13.521 18.491 -11.715
520 H ARG 65 H ARG 65 13.161 19.670 -8.798
521 HA ARG 65 HA ARG 65 12.115 22.235 -9.781
522 HB2 ARG 65 1HB ARG 65 11.288 21.218 -7.124
523 HB3 ARG 65 2HB ARG 65 10.339 22.016 -8.371
524 HG2 ARG 65 1HG ARG 65 11.108 19.124 -8.179
525 HG3 ARG 65 2HG ARG 65 9.493 19.834 -8.230
526 HD2 ARG 65 1HD ARG 65 11.375 19.227 -10.420
527 HD3 ARG 65 2HD ARG 65 9.613 19.194 -10.397
528 HE ARG 65 HE ARG 65 11.260 21.331 -11.279
529 HH11 ARG 65 1HH1 ARG 65 8.260 20.638 -9.656
530 HH12 ARG 65 2HH1 ARG 65 7.506 22.122 -10.137
531 HH21 ARG 65 1HH2 ARG 65 10.279 23.288 -11.919
532 HH22 ARG 65 2HH2 ARG 65 8.655 23.628 -11.426
533 H GLN 66 H GLN 66 12.350 24.126 -8.505
534 HA GLN 66 HA GLN 66 14.913 24.377 -7.293
535 HB2 GLN 66 1HB GLN 66 12.620 26.345 -7.247
536 HB3 GLN 66 2HB GLN 66 14.313 26.702 -6.933
537 HG2 GLN 66 1HG GLN 66 14.653 25.746 -9.341
538 HG3 GLN 66 2HG GLN 66 12.942 26.134 -9.512
539 HE21 GLN 66 2HE2 GLN 66 16.046 27.293 -9.785
540 HE22 GLN 66 1HE2 GLN 66 15.700 28.984 -9.847
541 H SER 67 H SER 67 11.628 24.104 -6.074
542 HA SER 67 HA SER 67 12.623 23.364 -3.470
543 HB2 SER 67 1HB SER 67 11.564 25.090 -2.198
544 HB3 SER 67 2HB SER 67 12.516 25.895 -3.446
545 HG SER 67 HG SER 67 10.052 26.347 -2.981
546 H PHE 68 H PHE 68 11.238 22.036 -2.407
547 HA PHE 68 HA PHE 68 8.522 21.746 -3.504
548 HB2 PHE 68 1HB PHE 68 8.686 19.331 -3.304
549 HB3 PHE 68 2HB PHE 68 9.997 19.926 -4.318
550 HD1 PHE 68 HD1 PHE 68 9.164 18.702 -0.933
551 HD2 PHE 68 HD2 PHE 68 12.246 19.555 -3.742
552 HE1 PHE 68 HE1 PHE 68 10.792 17.553 0.510
553 HE2 PHE 68 HE2 PHE 68 13.879 18.407 -2.304
554 HZ PHE 68 HZ PHE 68 13.153 17.403 -0.175
555 H SER 69 H SER 69 6.948 20.874 -2.035
556 HA SER 69 HA SER 69 7.517 21.639 0.730
557 HB2 SER 69 1HB SER 69 4.929 21.139 -0.751
558 HB3 SER 69 2HB SER 69 5.007 21.459 0.981
559 HG SER 69 HG SER 69 4.751 23.269 -0.730
560 H VAL 70 H VAL 70 7.371 20.263 2.442
561 HA VAL 70 HA VAL 70 7.598 17.454 1.886
562 HB VAL 70 HB VAL 70 8.456 17.234 3.966
563 HG11 VAL 70 1HG1 VAL 70 9.860 18.969 4.388
564 HG12 VAL 70 2HG1 VAL 70 9.251 19.505 2.821
565 HG13 VAL 70 3HG1 VAL 70 8.576 20.174 4.307
566 HG21 VAL 70 1HG2 VAL 70 6.378 17.468 5.145
567 HG22 VAL 70 2HG2 VAL 70 7.597 18.443 5.966
568 HG23 VAL 70 3HG2 VAL 70 6.399 19.218 4.929
569 H LYS 71 H LYS 71 5.209 19.556 3.424
570 HA LYS 71 HA LYS 71 3.482 17.509 4.317
571 HB2 LYS 71 1HB LYS 71 3.588 20.213 4.646
572 HB3 LYS 71 2HB LYS 71 2.228 20.062 3.542
573 HG2 LYS 71 1HG LYS 71 1.134 18.526 5.092
574 HG3 LYS 71 2HG LYS 71 2.501 18.669 6.199
575 HD2 LYS 71 1HD LYS 71 1.161 21.169 5.306
576 HD3 LYS 71 2HD LYS 71 0.315 20.146 6.470
577 HE2 LYS 71 1HE LYS 71 2.443 20.171 7.837
578 HE3 LYS 71 2HE LYS 71 3.021 21.435 6.753
579 HZ1 LYS 71 1HZ LYS 71 0.989 21.557 8.830
580 HZ2 LYS 71 2HZ LYS 71 0.655 22.426 7.418
581 HZ3 LYS 71 3HZ LYS 71 2.065 22.748 8.295
582 H ASP 72 H ASP 72 4.241 18.514 1.212
583 HA ASP 72 HA ASP 72 1.769 17.306 0.156
584 HB2 ASP 72 1HB ASP 72 1.867 19.742 -0.290
585 HB3 ASP 72 2HB ASP 72 3.394 19.507 -1.136
586 HA PRO 73 HA PRO 73 5.166 14.585 -1.215
587 HB2 PRO 73 1HB PRO 73 3.600 12.373 -1.373
588 HB3 PRO 73 2HB PRO 73 4.325 12.930 0.139
589 HG2 PRO 73 1HG PRO 73 1.540 13.325 -0.886
590 HG3 PRO 73 2HG PRO 73 2.081 12.905 0.750
591 HD2 PRO 73 1HD PRO 73 1.360 15.421 0.056
592 HD3 PRO 73 2HD PRO 73 2.609 15.087 1.272
593 H SER 74 H SER 74 4.404 16.291 -3.078
594 HA SER 74 HA SER 74 3.043 14.828 -5.215
595 HB2 SER 74 1HB SER 74 3.478 17.668 -4.570
596 HB3 SER 74 2HB SER 74 3.633 17.275 -6.282
597 HG SER 74 HG SER 74 1.558 16.324 -6.171
598 HA PRO 75 HA PRO 75 7.117 15.944 -7.485
599 HB2 PRO 75 1HB PRO 75 8.962 17.445 -6.176
600 HB3 PRO 75 2HB PRO 75 7.648 18.150 -7.125
601 HG2 PRO 75 1HG PRO 75 7.846 17.755 -4.164
602 HG3 PRO 75 2HG PRO 75 7.249 19.159 -5.068
603 HD2 PRO 75 1HD PRO 75 5.591 17.337 -3.945
604 HD3 PRO 75 2HD PRO 75 5.188 18.199 -5.444
605 H LEU 76 H LEU 76 7.329 15.333 -4.038
606 HA LEU 76 HA LEU 76 9.846 14.143 -3.903
607 HB2 LEU 76 1HB LEU 76 8.519 14.741 -1.942
608 HB3 LEU 76 2HB LEU 76 7.361 13.473 -2.333
609 HG LEU 76 HG LEU 76 9.627 12.015 -2.141
610 HD11 LEU 76 1HD1 LEU 76 10.052 14.519 -0.620
611 HD12 LEU 76 2HD1 LEU 76 11.219 13.437 -1.378
612 HD13 LEU 76 3HD1 LEU 76 10.496 13.007 0.172
613 HD21 LEU 76 1HD2 LEU 76 7.258 12.090 -0.892
614 HD22 LEU 76 2HD2 LEU 76 8.302 12.605 0.434
615 HD23 LEU 76 3HD2 LEU 76 8.593 11.061 -0.370
616 H TYR 77 H TYR 77 6.676 12.574 -4.347
617 HA TYR 77 HA TYR 77 7.729 9.981 -4.738
618 HB2 TYR 77 1HB TYR 77 5.082 11.284 -5.242
619 HB3 TYR 77 2HB TYR 77 5.393 9.686 -5.912
620 HD1 TYR 77 HD1 TYR 77 6.123 7.844 -4.284
621 HD2 TYR 77 HD2 TYR 77 4.400 11.523 -3.019
622 HE1 TYR 77 HE1 TYR 77 5.538 6.821 -2.125
623 HE2 TYR 77 HE2 TYR 77 3.811 10.510 -0.856
624 HH TYR 77 HH TYR 77 5.097 7.961 0.393
625 H ASP 78 H ASP 78 7.037 12.642 -6.913
626 HA ASP 78 HA ASP 78 7.167 11.275 -9.353
627 HB2 ASP 78 1HB ASP 78 6.675 13.841 -8.651
628 HB3 ASP 78 2HB ASP 78 8.310 14.003 -9.286
629 H MET 79 H MET 79 9.723 12.865 -7.467
630 HA MET 79 HA MET 79 11.800 12.244 -9.308
631 HB2 MET 79 1HB MET 79 12.077 14.092 -7.786
632 HB3 MET 79 2HB MET 79 11.869 13.037 -6.395
633 HG2 MET 79 1HG MET 79 13.965 11.845 -7.606
634 HG3 MET 79 2HG MET 79 14.233 13.525 -8.065
635 HE1 MET 79 1HE MET 79 12.587 12.706 -4.327
636 HE2 MET 79 2HE MET 79 13.089 11.306 -5.276
637 HE3 MET 79 3HE MET 79 14.017 11.788 -3.855
638 H LEU 80 H LEU 80 10.853 10.836 -6.177
639 HA LEU 80 HA LEU 80 12.776 8.836 -6.042
640 HB2 LEU 80 1HB LEU 80 9.927 8.764 -5.062
641 HB3 LEU 80 2HB LEU 80 11.201 7.654 -4.564
642 HG LEU 80 HG LEU 80 11.312 10.627 -4.087
643 HD11 LEU 80 1HD1 LEU 80 9.363 9.522 -2.968
644 HD12 LEU 80 2HD1 LEU 80 10.533 10.255 -1.872
645 HD13 LEU 80 3HD1 LEU 80 10.518 8.507 -2.103
646 HD21 LEU 80 1HD2 LEU 80 13.084 10.114 -2.580
647 HD22 LEU 80 2HD2 LEU 80 13.443 9.311 -4.109
648 HD23 LEU 80 3HD2 LEU 80 12.809 8.381 -2.751
649 H ARG 81 H ARG 81 9.658 8.872 -7.690
650 HA ARG 81 HA ARG 81 9.131 6.341 -8.358
651 HB2 ARG 81 1HB ARG 81 8.266 8.666 -9.333
652 HB3 ARG 81 2HB ARG 81 9.284 8.190 -10.686
653 HG2 ARG 81 1HG ARG 81 7.914 5.901 -10.276
654 HG3 ARG 81 2HG ARG 81 6.717 7.096 -9.773
655 HD2 ARG 81 1HD ARG 81 6.398 7.832 -11.869
656 HD3 ARG 81 2HD ARG 81 8.119 7.773 -12.251
657 HE ARG 81 HE ARG 81 7.377 5.161 -12.199
658 HH11 ARG 81 1HH1 ARG 81 6.212 7.981 -13.874
659 HH12 ARG 81 2HH1 ARG 81 5.662 7.094 -15.257
660 HH21 ARG 81 1HH2 ARG 81 6.658 3.981 -14.014
661 HH22 ARG 81 2HH2 ARG 81 5.916 4.818 -15.335
662 H LYS 82 H LYS 82 11.486 8.293 -10.196
663 HA LYS 82 HA LYS 82 12.691 5.784 -11.153
664 HB2 LYS 82 1HB LYS 82 13.097 6.762 -13.156
665 HB3 LYS 82 2HB LYS 82 11.791 7.830 -12.662
666 HG2 LYS 82 1HG LYS 82 14.723 8.386 -12.262
667 HG3 LYS 82 2HG LYS 82 13.726 9.044 -13.562
668 HD2 LYS 82 1HD LYS 82 13.279 9.476 -10.608
669 HD3 LYS 82 2HD LYS 82 13.994 10.644 -11.722
670 HE2 LYS 82 1HE LYS 82 11.762 10.233 -13.055
671 HE3 LYS 82 2HE LYS 82 11.169 9.726 -11.474
672 HZ1 LYS 82 1HZ LYS 82 11.559 12.339 -12.452
673 HZ2 LYS 82 2HZ LYS 82 12.549 12.107 -11.101
674 HZ3 LYS 82 3HZ LYS 82 10.881 11.850 -10.981
675 H ASN 83 H ASN 83 13.110 8.055 -8.835
676 HA ASN 83 HA ASN 83 16.025 8.174 -9.048
677 HB2 ASN 83 1HB ASN 83 14.847 10.265 -8.536
678 HB3 ASN 83 2HB ASN 83 14.144 9.526 -7.100
679 HD21 ASN 83 2HD2 ASN 83 15.075 10.243 -5.339
680 HD22 ASN 83 1HD2 ASN 83 16.759 10.567 -5.131
681 H LEU 84 H LEU 84 13.522 7.222 -6.704
682 HA LEU 84 HA LEU 84 15.538 5.732 -5.191
683 HB2 LEU 84 1HB LEU 84 13.492 7.330 -4.360
684 HB3 LEU 84 2HB LEU 84 12.770 5.728 -4.223
685 HG LEU 84 HG LEU 84 13.630 5.862 -2.138
686 HD11 LEU 84 1HD1 LEU 84 15.327 4.387 -1.996
687 HD12 LEU 84 2HD1 LEU 84 16.356 5.296 -3.103
688 HD13 LEU 84 3HD1 LEU 84 15.080 4.257 -3.738
689 HD21 LEU 84 1HD2 LEU 84 14.555 7.826 -1.647
690 HD22 LEU 84 2HD2 LEU 84 15.135 8.047 -3.298
691 HD23 LEU 84 3HD2 LEU 84 16.098 7.127 -2.140
692 H VAL 85 H VAL 85 15.864 3.876 -6.349
693 HA VAL 85 HA VAL 85 14.256 2.329 -7.832
694 HB VAL 85 HB VAL 85 16.365 1.543 -5.858
695 HG11 VAL 85 1HG1 VAL 85 14.454 -0.270 -7.257
696 HG12 VAL 85 2HG1 VAL 85 16.129 -0.780 -7.039
697 HG13 VAL 85 3HG1 VAL 85 15.135 -0.389 -5.635
698 HG21 VAL 85 1HG2 VAL 85 17.370 0.694 -8.059
699 HG22 VAL 85 2HG2 VAL 85 16.090 1.617 -8.846
700 HG23 VAL 85 3HG2 VAL 85 17.267 2.438 -7.821
701 H THR 86 H THR 86 12.660 0.809 -7.594
702 HA THR 86 HA THR 86 11.730 0.094 -4.931
703 HB THR 86 HB THR 86 9.324 0.653 -5.730
704 HG1 THR 86 1HG THR 86 9.167 1.871 -7.457
705 HG21 THR 86 1HG2 THR 86 10.224 1.759 -3.827
706 HG22 THR 86 2HG2 THR 86 9.589 3.020 -4.883
707 HG23 THR 86 3HG2 THR 86 11.324 2.715 -4.819
708 H LEU 87 H LEU 87 11.288 -2.005 -4.921
709 HA LEU 87 HA LEU 87 10.910 -3.403 -7.446
710 HB2 LEU 87 1HB LEU 87 11.154 -4.518 -4.657
711 HB3 LEU 87 2HB LEU 87 11.226 -5.431 -6.163
712 HG LEU 87 HG LEU 87 13.265 -3.668 -6.519
713 HD11 LEU 87 1HD1 LEU 87 12.831 -2.901 -4.130
714 HD12 LEU 87 2HD1 LEU 87 14.487 -3.346 -4.545
715 HD13 LEU 87 3HD1 LEU 87 13.475 -4.466 -3.632
716 HD21 LEU 87 1HD2 LEU 87 13.505 -6.316 -5.099
717 HD22 LEU 87 2HD2 LEU 87 14.722 -5.526 -6.101
718 HD23 LEU 87 3HD2 LEU 87 13.237 -6.137 -6.833
719 H ALA 88 H ALA 88 8.817 -2.921 -8.055
720 HA ALA 88 HA ALA 88 6.738 -4.220 -6.444
721 HB1 ALA 88 1HB ALA 88 5.317 -2.417 -6.406
722 HB2 ALA 88 2HB ALA 88 6.879 -1.613 -6.245
723 HB3 ALA 88 3HB ALA 88 6.068 -1.657 -7.810
724 H THR 89 H THR 89 4.616 -3.387 -8.175
725 HA THR 89 HA THR 89 5.342 -4.440 -10.800
726 HB THR 89 HB THR 89 2.903 -5.606 -9.531
727 HG1 THR 89 1HG THR 89 4.451 -7.413 -8.962
728 HG21 THR 89 1HG2 THR 89 2.890 -6.707 -11.467
729 HG22 THR 89 2HG2 THR 89 4.426 -7.458 -11.033
730 HG23 THR 89 3HG2 THR 89 4.409 -5.943 -11.935
731 H1 SER 115 H SER 115 5.571 20.680 23.821
732 HA SER 115 HA SER 115 6.969 22.737 23.008
733 HB2 SER 115 1HB SER 115 8.800 21.456 24.792
734 HB3 SER 115 2HB SER 115 7.652 22.749 25.140
735 HG SER 115 HG SER 115 7.567 20.241 25.966
736 H GLN 116 H GLN 116 7.251 20.488 21.078
737 HA GLN 116 HA GLN 116 9.825 21.159 20.092
738 HB2 GLN 116 1HB GLN 116 10.184 19.391 21.993
739 HB3 GLN 116 2HB GLN 116 9.630 18.250 20.775
740 HG2 GLN 116 1HG GLN 116 11.612 18.231 19.799
741 HG3 GLN 116 2HG GLN 116 11.622 19.989 19.665
742 HE21 GLN 116 2HE2 GLN 116 11.855 20.962 22.057
743 HE22 GLN 116 1HE2 GLN 116 13.247 20.368 22.891
744 H GLU 117 H GLU 117 7.564 21.490 18.811
745 HA GLU 117 HA GLU 117 7.125 19.170 17.075
746 HB2 GLU 117 1HB GLU 117 5.178 20.500 16.227
747 HB3 GLU 117 2HB GLU 117 5.091 20.092 17.934
748 HG2 GLU 117 1HG GLU 117 5.212 22.237 18.594
749 HG3 GLU 117 2HG GLU 117 6.339 22.681 17.313
750 H THR 118 H THR 118 7.918 19.087 15.078
751 HA THR 118 HA THR 118 8.221 21.310 13.365
752 HB THR 118 HB THR 118 10.149 21.637 15.031
753 HG1 THR 118 1HG THR 118 10.720 22.816 13.377
754 HG21 THR 118 1HG2 THR 118 10.682 19.053 14.682
755 HG22 THR 118 2HG2 THR 118 11.946 20.227 15.047
756 HG23 THR 118 3HG2 THR 118 11.686 19.698 13.385
757 H PHE 119 H PHE 119 10.512 20.311 11.925
758 HA PHE 119 HA PHE 119 9.346 18.579 10.140
759 HB2 PHE 119 1HB PHE 119 11.581 19.891 9.997
760 HB3 PHE 119 2HB PHE 119 12.297 18.437 10.684
761 HD1 PHE 119 HD2 PHE 119 9.547 18.761 8.207
762 HD2 PHE 119 HD1 PHE 119 13.550 17.525 8.961
763 HE1 PHE 119 HE2 PHE 119 9.657 17.759 5.963
764 HE2 PHE 119 HE1 PHE 119 13.666 16.522 6.717
765 HZ PHE 119 HZ PHE 119 11.718 16.637 5.215
766 H SER 120 H SER 120 10.995 17.838 13.133
767 HA SER 120 HA SER 120 11.312 15.057 12.698
768 HB2 SER 120 1HB SER 120 11.996 16.894 14.711
769 HB3 SER 120 2HB SER 120 10.959 15.702 15.494
770 HG SER 120 HG SER 120 12.937 14.812 15.595
771 H ASP 121 H ASP 121 8.653 17.027 13.749
772 HA ASP 121 HA ASP 121 7.092 14.626 14.412
773 HB2 ASP 121 1HB ASP 121 7.302 16.614 16.042
774 HB3 ASP 121 2HB ASP 121 6.215 17.456 14.940
775 H LEU 122 H LEU 122 7.582 16.921 11.991
776 HA LEU 122 HA LEU 122 4.888 16.559 10.886
777 HB2 LEU 122 1HB LEU 122 6.453 18.798 11.090
778 HB3 LEU 122 2HB LEU 122 6.738 18.290 9.426
779 HG LEU 122 HG LEU 122 4.100 18.199 9.366
780 HD11 LEU 122 1HD1 LEU 122 2.966 19.327 10.936
781 HD12 LEU 122 2HD1 LEU 122 4.207 20.571 11.086
782 HD13 LEU 122 3HD1 LEU 122 4.392 19.035 11.932
783 HD21 LEU 122 1HD2 LEU 122 4.721 19.684 7.824
784 HD22 LEU 122 2HD2 LEU 122 6.096 20.228 8.786
785 HD23 LEU 122 3HD2 LEU 122 4.495 20.914 9.068
786 H TRP 123 H TRP 123 8.302 16.428 9.885
787 HA TRP 123 HA TRP 123 8.218 15.564 7.355
788 HB2 TRP 123 1HB TRP 123 10.315 15.741 8.567
789 HB3 TRP 123 2HB TRP 123 9.895 14.347 9.559
790 HD1 TRP 123 HD1 TRP 123 11.331 12.363 8.849
791 HE1 TRP 123 HE1 TRP 123 12.148 11.371 6.619
792 HE3 TRP 123 HE3 TRP 123 9.369 15.834 5.650
793 HZ2 TRP 123 HZ2 TRP 123 11.984 11.981 3.867
794 HZ3 TRP 123 HZ3 TRP 123 9.744 15.557 3.234
795 HH2 TRP 123 HH2 TRP 123 11.026 13.670 2.363
796 H LYS 124 H LYS 124 7.995 13.275 10.086
797 HA LYS 124 HA LYS 124 7.450 10.980 8.663
798 HB2 LYS 124 1HB LYS 124 6.552 10.060 10.683
799 HB3 LYS 124 2HB LYS 124 7.863 11.143 11.130
800 HG2 LYS 124 1HG LYS 124 6.092 12.904 11.534
801 HG3 LYS 124 2HG LYS 124 4.908 11.603 11.390
802 HD2 LYS 124 1HD LYS 124 7.170 11.076 13.205
803 HD3 LYS 124 2HD LYS 124 6.060 12.350 13.717
804 HE2 LYS 124 1HE LYS 124 4.288 10.476 12.972
805 HE3 LYS 124 2HE LYS 124 5.628 9.437 13.453
806 HZ1 LYS 124 1HZ LYS 124 5.026 11.570 15.307
807 HZ2 LYS 124 2HZ LYS 124 5.347 9.937 15.603
808 HZ3 LYS 124 3HZ LYS 124 3.794 10.422 15.139
809 H LEU 125 H LEU 125 5.218 13.516 9.682
810 HA LEU 125 HA LEU 125 2.760 12.526 9.313
811 HB2 LEU 125 1HB LEU 125 3.493 14.951 9.651
812 HB3 LEU 125 2HB LEU 125 3.540 15.054 7.892
813 HG LEU 125 HG LEU 125 1.020 14.059 9.073
814 HD11 LEU 125 1HD1 LEU 125 2.111 16.791 9.587
815 HD12 LEU 125 2HD1 LEU 125 1.201 15.725 10.657
816 HD13 LEU 125 3HD1 LEU 125 0.380 16.562 9.340
817 HD21 LEU 125 1HD2 LEU 125 1.402 16.235 7.048
818 HD22 LEU 125 2HD2 LEU 125 0.054 15.113 7.236
819 HD23 LEU 125 3HD2 LEU 125 1.600 14.538 6.610
820 H LEU 126 H LEU 126 5.094 13.094 6.757
821 HA LEU 126 HA LEU 126 3.589 12.942 4.484
822 HB2 LEU 126 1HB LEU 126 6.328 12.264 5.226
823 HB3 LEU 126 2HB LEU 126 5.728 11.334 3.855
824 HG LEU 126 HG LEU 126 5.084 13.610 2.849
825 HD11 LEU 126 1HD1 LEU 126 5.293 15.194 4.484
826 HD12 LEU 126 2HD1 LEU 126 6.878 15.323 3.723
827 HD13 LEU 126 3HD1 LEU 126 6.692 14.412 5.221
828 HD21 LEU 126 1HD2 LEU 126 7.121 12.014 2.386
829 HD22 LEU 126 2HD2 LEU 126 8.040 13.343 3.093
830 HD23 LEU 126 3HD2 LEU 126 7.044 13.621 1.664
831 HA PRO 127 HA PRO 127 1.757 8.974 4.099
832 HB2 PRO 127 1HB PRO 127 2.223 8.317 1.506
833 HB3 PRO 127 2HB PRO 127 1.077 9.574 1.988
834 HG2 PRO 127 1HG PRO 127 3.895 9.852 1.017
835 HG3 PRO 127 2HG PRO 127 2.463 10.806 0.586
836 HD2 PRO 127 1HD PRO 127 4.310 11.672 2.367
837 HD3 PRO 127 2HD PRO 127 2.589 12.090 2.496
838 H GLU 128 H GLU 128 3.822 8.405 5.536
839 HA GLU 128 HA GLU 128 5.246 6.235 4.139
840 HB2 GLU 128 1HB GLU 128 7.131 6.578 5.639
841 HB3 GLU 128 2HB GLU 128 6.757 8.067 4.784
842 HG2 GLU 128 1HG GLU 128 5.292 8.460 6.982
843 HG3 GLU 128 2HG GLU 128 6.548 7.422 7.655
844 H ASN 129 H ASN 129 4.030 4.497 4.679
845 HA ASN 129 HA ASN 129 3.509 2.697 6.013
846 HB2 ASN 129 1HB ASN 129 4.563 2.466 7.991
847 HB3 ASN 129 2HB ASN 129 5.325 4.008 7.612
848 HD21 ASN 129 2HD2 ASN 129 2.407 2.655 9.090
849 HD22 ASN 129 1HD2 ASN 129 2.260 3.862 10.317
Start of MODEL 4
1 H1 GLN 1 H GLN 1 1.147 1.176 0.370
2 HA GLN 1 HA GLN 1 1.517 0.498 -1.938
3 HB2 GLN 1 1HB GLN 1 2.573 3.302 -2.305
4 HB3 GLN 1 2HB GLN 1 2.350 2.077 -3.547
5 HG2 GLN 1 1HG GLN 1 -0.090 2.714 -2.080
6 HG3 GLN 1 2HG GLN 1 0.597 4.082 -2.955
7 HE21 GLN 1 2HE2 GLN 1 1.309 3.490 -5.246
8 HE22 GLN 1 1HE2 GLN 1 0.190 2.545 -6.162
9 H ILE 2 H ILE 2 3.015 0.994 0.732
10 HA ILE 2 HA ILE 2 5.647 1.480 0.559
11 HB ILE 2 HB ILE 2 4.290 -0.805 1.969
12 HG12 ILE 2 1HG1 ILE 2 3.716 1.303 2.907
13 HG13 ILE 2 2HG1 ILE 2 4.946 0.622 3.966
14 HG21 ILE 2 1HG2 ILE 2 6.386 -1.102 3.247
15 HG22 ILE 2 2HG2 ILE 2 6.546 -1.541 1.547
16 HG23 ILE 2 3HG2 ILE 2 7.192 -0.005 2.126
17 HD11 ILE 2 1HD1 ILE 2 5.495 2.886 3.707
18 HD12 ILE 2 2HD1 ILE 2 6.620 2.008 2.671
19 HD13 ILE 2 3HD1 ILE 2 5.232 2.835 1.964
20 H ASN 3 H ASN 3 7.560 0.249 0.138
21 HA ASN 3 HA ASN 3 7.481 -2.260 -1.200
22 HB2 ASN 3 1HB ASN 3 7.110 0.071 -2.823
23 HB3 ASN 3 2HB ASN 3 8.675 -0.641 -3.203
24 HD21 ASN 3 2HD2 ASN 3 8.070 -3.320 -2.722
25 HD22 ASN 3 1HD2 ASN 3 6.955 -3.856 -3.928
26 H GLN 4 H GLN 4 9.765 -2.531 -2.400
27 HA GLN 4 HA GLN 4 11.749 -1.685 -0.410
28 HB2 GLN 4 1HB GLN 4 12.242 -3.802 -2.475
29 HB3 GLN 4 2HB GLN 4 12.966 -3.618 -0.883
30 HG2 GLN 4 1HG GLN 4 10.115 -4.423 -1.417
31 HG3 GLN 4 2HG GLN 4 11.431 -5.520 -1.001
32 HE21 GLN 4 2HE2 GLN 4 8.815 -4.225 0.250
33 HE22 GLN 4 1HE2 GLN 4 9.292 -4.009 1.897
34 H VAL 5 H VAL 5 13.899 -1.107 -1.138
35 HA VAL 5 HA VAL 5 14.096 -0.197 -3.912
36 HB VAL 5 HB VAL 5 14.862 2.009 -3.302
37 HG11 VAL 5 1HG1 VAL 5 12.794 2.868 -3.111
38 HG12 VAL 5 2HG1 VAL 5 12.277 1.182 -3.197
39 HG13 VAL 5 3HG1 VAL 5 12.450 1.975 -1.630
40 HG21 VAL 5 1HG2 VAL 5 14.102 1.958 -0.495
41 HG22 VAL 5 2HG2 VAL 5 15.459 0.890 -0.854
42 HG23 VAL 5 3HG2 VAL 5 15.553 2.603 -1.262
43 H ARG 6 H ARG 6 16.382 0.724 -4.299
44 HA ARG 6 HA ARG 6 18.399 -0.602 -2.648
45 HB2 ARG 6 1HB ARG 6 17.562 -1.515 -5.238
46 HB3 ARG 6 2HB ARG 6 19.227 -0.955 -5.328
47 HG2 ARG 6 1HG ARG 6 19.686 -2.413 -3.313
48 HG3 ARG 6 2HG ARG 6 18.089 -3.114 -3.579
49 HD2 ARG 6 1HD ARG 6 18.747 -4.247 -5.419
50 HD3 ARG 6 2HD ARG 6 19.831 -2.961 -5.950
51 HE ARG 6 HE ARG 6 20.799 -4.313 -3.627
52 HH11 ARG 6 1HH1 ARG 6 20.565 -4.487 -7.096
53 HH12 ARG 6 2HH1 ARG 6 21.967 -5.490 -7.271
54 HH21 ARG 6 1HH2 ARG 6 22.647 -5.634 -3.844
55 HH22 ARG 6 2HH2 ARG 6 23.150 -6.142 -5.420
56 HA PRO 7 HA PRO 7 19.864 3.597 -3.502
57 HB2 PRO 7 1HB PRO 7 21.569 3.655 -1.390
58 HB3 PRO 7 2HB PRO 7 19.837 3.968 -1.235
59 HG2 PRO 7 1HG PRO 7 21.366 1.457 -0.672
60 HG3 PRO 7 2HG PRO 7 20.068 2.212 0.272
61 HD2 PRO 7 1HD PRO 7 19.637 0.103 -1.371
62 HD3 PRO 7 2HD PRO 7 18.413 1.356 -1.084
63 H LYS 8 H LYS 8 21.170 3.583 -5.241
64 HA LYS 8 HA LYS 8 23.345 1.800 -5.602
65 HB2 LYS 8 1HB LYS 8 22.485 4.321 -7.007
66 HB3 LYS 8 2HB LYS 8 23.944 3.456 -7.471
67 HG2 LYS 8 1HG LYS 8 21.344 1.999 -7.302
68 HG3 LYS 8 2HG LYS 8 21.712 2.997 -8.711
69 HD2 LYS 8 1HD LYS 8 23.408 1.625 -9.410
70 HD3 LYS 8 2HD LYS 8 23.774 1.066 -7.776
71 HE2 LYS 8 1HE LYS 8 22.705 -0.808 -8.369
72 HE3 LYS 8 2HE LYS 8 21.229 0.132 -8.161
73 HZ1 LYS 8 1HZ LYS 8 22.637 0.174 -10.744
74 HZ2 LYS 8 2HZ LYS 8 20.999 0.436 -10.416
75 HZ3 LYS 8 3HZ LYS 8 21.632 -1.131 -10.359
76 H LEU 9 H LEU 9 25.603 2.641 -6.087
77 HA LEU 9 HA LEU 9 26.981 3.372 -3.924
78 HB2 LEU 9 1HB LEU 9 28.164 4.885 -6.007
79 HB3 LEU 9 2HB LEU 9 28.655 3.318 -5.368
80 HG LEU 9 HG LEU 9 26.539 3.542 -7.485
81 HD11 LEU 9 1HD1 LEU 9 29.454 3.135 -8.079
82 HD12 LEU 9 2HD1 LEU 9 28.697 4.726 -8.134
83 HD13 LEU 9 3HD1 LEU 9 28.131 3.444 -9.204
84 HD21 LEU 9 1HD2 LEU 9 28.235 1.284 -7.718
85 HD22 LEU 9 2HD2 LEU 9 26.526 1.334 -7.283
86 HD23 LEU 9 3HD2 LEU 9 27.760 1.430 -6.025
87 HA PRO 10 HA PRO 10 26.533 8.116 -4.687
88 HB2 PRO 10 1HB PRO 10 24.796 8.919 -6.613
89 HB3 PRO 10 2HB PRO 10 26.499 8.578 -6.938
90 HG2 PRO 10 1HG PRO 10 24.100 6.845 -7.390
91 HG3 PRO 10 2HG PRO 10 25.498 7.119 -8.446
92 HD2 PRO 10 1HD PRO 10 25.252 4.912 -6.898
93 HD3 PRO 10 2HD PRO 10 26.826 5.637 -7.283
94 H LEU 11 H LEU 11 23.778 5.998 -4.946
95 HA LEU 11 HA LEU 11 21.973 7.892 -3.694
96 HB2 LEU 11 1HB LEU 11 21.740 5.443 -5.187
97 HB3 LEU 11 2HB LEU 11 20.810 5.343 -3.693
98 HG LEU 11 HG LEU 11 19.701 6.200 -5.899
99 HD11 LEU 11 1HD1 LEU 11 18.776 8.089 -4.018
100 HD12 LEU 11 2HD1 LEU 11 19.261 6.652 -3.118
101 HD13 LEU 11 3HD1 LEU 11 18.081 6.519 -4.422
102 HD21 LEU 11 1HD2 LEU 11 19.983 8.398 -6.486
103 HD22 LEU 11 2HD2 LEU 11 21.623 7.986 -5.984
104 HD23 LEU 11 3HD2 LEU 11 20.560 8.867 -4.886
105 H LEU 12 H LEU 12 24.267 5.637 -2.692
106 HA LEU 12 HA LEU 12 22.982 4.792 -0.269
107 HB2 LEU 12 1HB LEU 12 24.769 3.525 -1.508
108 HB3 LEU 12 2HB LEU 12 25.922 4.717 -0.913
109 HG LEU 12 HG LEU 12 25.846 3.913 1.244
110 HD11 LEU 12 1HD1 LEU 12 23.440 4.098 1.548
111 HD12 LEU 12 2HD1 LEU 12 24.031 2.555 2.163
112 HD13 LEU 12 3HD1 LEU 12 23.195 2.623 0.612
113 HD21 LEU 12 1HD2 LEU 12 26.893 2.216 -0.033
114 HD22 LEU 12 2HD2 LEU 12 25.345 1.583 -0.594
115 HD23 LEU 12 3HD2 LEU 12 25.815 1.395 1.096
116 H LYS 13 H LYS 13 25.726 6.959 -0.970
117 HA LYS 13 HA LYS 13 26.222 7.871 1.585
118 HB2 LYS 13 1HB LYS 13 27.421 9.633 0.617
119 HB3 LYS 13 2HB LYS 13 27.467 8.374 -0.611
120 HG2 LYS 13 1HG LYS 13 26.845 10.021 -1.990
121 HG3 LYS 13 2HG LYS 13 25.232 9.716 -1.341
122 HD2 LYS 13 1HD LYS 13 25.187 11.838 -0.670
123 HD3 LYS 13 2HD LYS 13 26.452 11.434 0.494
124 HE2 LYS 13 1HE LYS 13 28.003 11.780 -1.619
125 HE3 LYS 13 2HE LYS 13 26.652 12.779 -2.153
126 HZ1 LYS 13 1HZ LYS 13 28.442 13.159 0.147
127 HZ2 LYS 13 2HZ LYS 13 26.875 13.792 0.205
128 HZ3 LYS 13 3HZ LYS 13 27.940 14.280 -1.016
129 H ILE 14 H ILE 14 23.651 8.759 -0.607
130 HA ILE 14 HA ILE 14 22.794 11.130 0.608
131 HB ILE 14 HB ILE 14 20.999 9.095 -0.709
132 HG12 ILE 14 1HG1 ILE 14 22.937 11.076 -1.857
133 HG13 ILE 14 2HG1 ILE 14 22.637 9.409 -2.337
134 HG21 ILE 14 1HG2 ILE 14 19.789 10.850 0.419
135 HG22 ILE 14 2HG2 ILE 14 20.785 12.081 -0.357
136 HG23 ILE 14 3HG2 ILE 14 19.685 11.099 -1.324
137 HD11 ILE 14 1HD1 ILE 14 21.099 11.874 -3.006
138 HD12 ILE 14 2HD1 ILE 14 21.715 10.609 -4.070
139 HD13 ILE 14 3HD1 ILE 14 20.313 10.297 -3.046
140 H LEU 15 H LEU 15 21.574 7.811 1.076
141 HA LEU 15 HA LEU 15 19.863 8.519 3.230
142 HB2 LEU 15 1HB LEU 15 20.971 5.777 2.696
143 HB3 LEU 15 2HB LEU 15 19.448 6.203 3.475
144 HG LEU 15 HG LEU 15 20.121 6.455 0.546
145 HD11 LEU 15 1HD1 LEU 15 17.948 4.830 1.830
146 HD12 LEU 15 2HD1 LEU 15 19.565 4.186 1.548
147 HD13 LEU 15 3HD1 LEU 15 18.580 4.723 0.187
148 HD21 LEU 15 1HD2 LEU 15 18.740 8.340 1.380
149 HD22 LEU 15 2HD2 LEU 15 17.546 7.170 1.944
150 HD23 LEU 15 3HD2 LEU 15 17.899 7.310 0.221
151 H HIS 16 H HIS 16 23.120 7.156 3.041
152 HA HIS 16 HA HIS 16 23.535 6.522 5.704
153 HB2 HIS 16 1HB HIS 16 25.337 7.371 3.473
154 HB3 HIS 16 2HB HIS 16 25.998 7.256 5.102
155 HD1 HIS 16 HD1 HIS 16 27.495 5.288 4.152
156 HD2 HIS 16 HD2 HIS 16 23.410 4.536 4.253
157 HE1 HIS 16 HE1 HIS 16 27.263 2.799 3.878
158 H ALA 17 H ALA 17 24.080 9.629 4.066
159 HA ALA 17 HA ALA 17 25.078 11.034 6.273
160 HB1 ALA 17 1HB ALA 17 25.339 11.971 4.106
161 HB2 ALA 17 2HB ALA 17 23.596 11.981 3.830
162 HB3 ALA 17 3HB ALA 17 24.306 13.070 5.021
163 H ALA 18 H ALA 18 21.931 9.895 5.620
164 HA ALA 18 HA ALA 18 20.691 11.799 7.469
165 HB1 ALA 18 1HB ALA 18 18.987 11.648 6.056
166 HB2 ALA 18 2HB ALA 18 19.777 10.341 5.174
167 HB3 ALA 18 3HB ALA 18 18.761 9.976 6.568
168 H GLY 19 H GLY 19 22.542 9.465 8.142
169 HA2 GLY 19 1HA GLY 19 22.686 8.295 10.162
170 HA3 GLY 19 2HA GLY 19 20.961 8.535 10.399
171 H ALA 20 H ALA 20 21.456 7.458 7.296
172 HA ALA 20 HA ALA 20 20.338 4.886 7.887
173 HB1 ALA 20 1HB ALA 20 19.956 6.391 5.813
174 HB2 ALA 20 2HB ALA 20 21.425 5.631 5.202
175 HB3 ALA 20 3HB ALA 20 20.023 4.640 5.607
176 H GLN 21 H GLN 21 21.410 3.037 6.363
177 HA GLN 21 HA GLN 21 24.131 2.801 6.045
178 HB2 GLN 21 1HB GLN 21 23.528 2.939 8.779
179 HB3 GLN 21 2HB GLN 21 23.848 1.239 8.461
180 HG2 GLN 21 1HG GLN 21 25.932 2.046 9.011
181 HG3 GLN 21 2HG GLN 21 25.957 2.103 7.250
182 HE21 GLN 21 2HE2 GLN 21 25.496 4.170 6.240
183 HE22 GLN 21 1HE2 GLN 21 25.953 5.625 7.051
184 H GLY 22 H GLY 22 23.987 1.309 4.500
185 HA2 GLY 22 1HA GLY 22 23.823 -1.317 4.659
186 HA3 GLY 22 2HA GLY 22 22.118 -0.919 4.807
187 H GLU 23 H GLU 23 22.193 -2.373 2.824
188 HA GLU 23 HA GLU 23 22.608 -0.701 0.432
189 HB2 GLU 23 1HB GLU 23 22.786 -3.714 0.547
190 HB3 GLU 23 2HB GLU 23 23.147 -2.686 -0.832
191 HG2 GLU 23 1HG GLU 23 24.876 -1.641 0.885
192 HG3 GLU 23 2HG GLU 23 24.754 -3.252 1.589
193 H MET 24 H MET 24 20.360 -2.197 2.375
194 HA MET 24 HA MET 24 18.372 -2.166 0.205
195 HB2 MET 24 1HB MET 24 18.139 -4.061 2.522
196 HB3 MET 24 2HB MET 24 17.349 -4.135 0.953
197 HG2 MET 24 1HG MET 24 20.315 -4.443 1.247
198 HG3 MET 24 2HG MET 24 19.209 -5.803 1.426
199 HE1 MET 24 1HE MET 24 21.527 -4.382 -1.415
200 HE2 MET 24 2HE MET 24 21.529 -5.746 -0.297
201 HE3 MET 24 3HE MET 24 21.153 -6.003 -2.002
202 H PHE 25 H PHE 25 16.401 -1.271 0.680
203 HA PHE 25 HA PHE 25 15.608 -0.644 3.363
204 HB2 PHE 25 1HB PHE 25 16.318 1.660 1.536
205 HB3 PHE 25 2HB PHE 25 15.647 1.780 3.160
206 HD1 PHE 25 HD1 PHE 25 18.636 1.072 1.182
207 HD2 PHE 25 HD2 PHE 25 17.021 1.393 5.107
208 HE1 PHE 25 HE1 PHE 25 20.914 1.121 2.112
209 HE2 PHE 25 HE2 PHE 25 19.295 1.444 6.043
210 HZ PHE 25 HZ PHE 25 21.246 1.308 4.545
211 H THR 26 H THR 26 13.470 0.163 3.496
212 HA THR 26 HA THR 26 11.899 -0.393 1.091
213 HB THR 26 HB THR 26 9.968 -0.111 2.847
214 HG1 THR 26 1HG THR 26 11.568 0.627 4.468
215 HG21 THR 26 1HG2 THR 26 10.398 -2.214 1.793
216 HG22 THR 26 2HG2 THR 26 10.292 -2.506 3.529
217 HG23 THR 26 3HG2 THR 26 11.867 -2.451 2.738
218 H VAL 27 H VAL 27 9.817 0.981 0.941
219 HA VAL 27 HA VAL 27 10.452 3.558 0.195
220 HB VAL 27 HB VAL 27 7.756 2.566 1.132
221 HG11 VAL 27 1HG1 VAL 27 8.127 5.084 0.959
222 HG12 VAL 27 2HG1 VAL 27 8.272 4.825 -0.780
223 HG13 VAL 27 3HG1 VAL 27 6.775 4.405 0.053
224 HG21 VAL 27 1HG2 VAL 27 8.625 2.811 -1.722
225 HG22 VAL 27 2HG2 VAL 27 9.015 1.367 -0.788
226 HG23 VAL 27 3HG2 VAL 27 7.331 1.833 -1.029
227 H LYS 28 H LYS 28 9.109 2.440 3.280
228 HA LYS 28 HA LYS 28 8.814 4.995 4.443
229 HB2 LYS 28 1HB LYS 28 8.927 3.622 6.627
230 HB3 LYS 28 2HB LYS 28 7.607 3.305 5.508
231 HG2 LYS 28 1HG LYS 28 9.849 1.632 4.878
232 HG3 LYS 28 2HG LYS 28 9.423 1.468 6.583
233 HD2 LYS 28 1HD LYS 28 7.100 1.016 5.957
234 HD3 LYS 28 2HD LYS 28 7.524 1.187 4.252
235 HE2 LYS 28 1HE LYS 28 7.394 -1.181 5.351
236 HE3 LYS 28 2HE LYS 28 8.676 -0.803 4.200
237 HZ1 LYS 28 1HZ LYS 28 10.137 -0.314 6.087
238 HZ2 LYS 28 2HZ LYS 28 9.585 -1.912 6.116
239 HZ3 LYS 28 3HZ LYS 28 8.910 -0.766 7.161
240 H GLU 29 H GLU 29 11.459 2.648 4.475
241 HA GLU 29 HA GLU 29 13.100 4.006 6.320
242 HB2 GLU 29 1HB GLU 29 13.651 1.983 4.165
243 HB3 GLU 29 2HB GLU 29 14.958 2.684 5.108
244 HG2 GLU 29 1HG GLU 29 13.737 1.911 7.168
245 HG3 GLU 29 2HG GLU 29 12.669 1.009 6.094
246 H VAL 30 H VAL 30 12.794 4.209 2.812
247 HA VAL 30 HA VAL 30 15.017 5.916 2.391
248 HB VAL 30 HB VAL 30 12.557 5.766 0.653
249 HG11 VAL 30 1HG1 VAL 30 13.809 6.694 -1.016
250 HG12 VAL 30 2HG1 VAL 30 14.568 7.460 0.380
251 HG13 VAL 30 3HG1 VAL 30 15.327 6.062 -0.381
252 HG21 VAL 30 1HG2 VAL 30 13.049 3.687 0.023
253 HG22 VAL 30 2HG2 VAL 30 14.756 4.081 -0.181
254 HG23 VAL 30 3HG2 VAL 30 14.143 3.610 1.404
255 H MET 31 H MET 31 11.534 6.557 2.714
256 HA MET 31 HA MET 31 11.633 9.327 2.360
257 HB2 MET 31 1HB MET 31 9.424 9.167 2.665
258 HB3 MET 31 2HB MET 31 9.667 7.443 2.915
259 HG2 MET 31 1HG MET 31 8.403 8.155 4.745
260 HG3 MET 31 2HG MET 31 10.048 7.999 5.357
261 HE1 MET 31 1HE MET 31 9.314 11.466 3.203
262 HE2 MET 31 2HE MET 31 7.959 10.344 3.335
263 HE3 MET 31 3HE MET 31 7.930 11.871 4.219
264 H HIS 32 H HIS 32 12.227 7.340 5.189
265 HA HIS 32 HA HIS 32 12.228 9.448 7.089
266 HB2 HIS 32 1HB HIS 32 12.116 6.849 7.421
267 HB3 HIS 32 2HB HIS 32 13.873 6.969 7.455
268 HD1 HIS 32 HD1 HIS 32 11.175 6.840 9.692
269 HD2 HIS 32 HD2 HIS 32 14.582 9.206 9.456
270 HE1 HIS 32 HE1 HIS 32 11.517 7.759 12.008
271 H TYR 33 H TYR 33 14.657 8.092 4.965
272 HA TYR 33 HA TYR 33 16.875 9.401 6.212
273 HB2 TYR 33 1HB TYR 33 16.596 8.144 3.476
274 HB3 TYR 33 2HB TYR 33 18.112 8.710 4.168
275 HD1 TYR 33 HD1 TYR 33 17.866 7.770 6.955
276 HD2 TYR 33 HD2 TYR 33 16.860 5.834 3.302
277 HE1 TYR 33 HE1 TYR 33 18.196 5.582 8.031
278 HE2 TYR 33 HE2 TYR 33 17.185 3.641 4.368
279 HH TYR 33 HH TYR 33 17.068 2.765 6.850
280 H LEU 34 H LEU 34 14.780 10.084 3.454
281 HA LEU 34 HA LEU 34 16.104 12.193 2.283
282 HB2 LEU 34 1HB LEU 34 13.379 11.211 2.387
283 HB3 LEU 34 2HB LEU 34 13.438 12.965 2.232
284 HG LEU 34 HG LEU 34 13.249 11.996 0.048
285 HD11 LEU 34 1HD1 LEU 34 15.098 13.015 -1.037
286 HD12 LEU 34 2HD1 LEU 34 16.120 12.832 0.388
287 HD13 LEU 34 3HD1 LEU 34 14.767 13.962 0.414
288 HD21 LEU 34 1HD2 LEU 34 14.084 9.768 0.533
289 HD22 LEU 34 2HD2 LEU 34 15.714 10.405 0.752
290 HD23 LEU 34 3HD2 LEU 34 14.951 10.463 -0.837
291 H GLY 35 H GLY 35 13.567 12.498 4.782
292 HA2 GLY 35 1HA GLY 35 13.785 15.228 5.214
293 HA3 GLY 35 2HA GLY 35 13.259 14.070 6.427
294 H GLN 36 H GLN 36 15.520 12.618 6.898
295 HA GLN 36 HA GLN 36 16.943 14.259 8.667
296 HB2 GLN 36 1HB GLN 36 17.627 11.551 7.518
297 HB3 GLN 36 2HB GLN 36 18.535 12.321 8.812
298 HG2 GLN 36 1HG GLN 36 15.885 12.414 9.649
299 HG3 GLN 36 2HG GLN 36 16.080 10.819 8.924
300 HE21 GLN 36 2HE2 GLN 36 17.573 13.046 11.226
301 HE22 GLN 36 1HE2 GLN 36 18.188 11.823 12.281
302 H TYR 37 H TYR 37 17.679 13.177 5.390
303 HA TYR 37 HA TYR 37 20.327 14.108 5.268
304 HB2 TYR 37 1HB TYR 37 19.468 12.567 3.605
305 HB3 TYR 37 2HB TYR 37 18.278 13.750 3.072
306 HD1 TYR 37 HD1 TYR 37 21.963 13.259 3.374
307 HD2 TYR 37 HD2 TYR 37 18.775 15.155 1.288
308 HE1 TYR 37 HE1 TYR 37 23.564 14.111 1.713
309 HE2 TYR 37 HE2 TYR 37 20.368 16.011 -0.379
310 HH TYR 37 HH TYR 37 23.094 16.531 -0.221
311 H ILE 38 H ILE 38 17.273 15.653 4.313
312 HA ILE 38 HA ILE 38 18.370 18.045 3.350
313 HB ILE 38 HB ILE 38 15.677 17.677 4.668
314 HG12 ILE 38 1HG1 ILE 38 16.412 17.489 1.739
315 HG13 ILE 38 2HG1 ILE 38 16.123 16.102 2.783
316 HG21 ILE 38 1HG2 ILE 38 14.998 19.628 3.410
317 HG22 ILE 38 2HG2 ILE 38 16.394 20.020 4.413
318 HG23 ILE 38 3HG2 ILE 38 16.600 19.749 2.682
319 HD11 ILE 38 1HD1 ILE 38 13.832 16.778 3.105
320 HD12 ILE 38 2HD1 ILE 38 14.105 18.244 2.163
321 HD13 ILE 38 3HD1 ILE 38 14.191 16.665 1.382
322 H MET 39 H MET 39 17.170 17.197 6.585
323 HA MET 39 HA MET 39 17.641 19.723 7.751
324 HB2 MET 39 1HB MET 39 16.612 18.771 9.487
325 HB3 MET 39 2HB MET 39 16.558 17.272 8.570
326 HG2 MET 39 1HG MET 39 18.621 16.535 9.543
327 HG3 MET 39 2HG MET 39 18.844 18.088 10.345
328 HE1 MET 39 1HE MET 39 15.797 18.136 12.774
329 HE2 MET 39 2HE MET 39 16.554 19.043 11.465
330 HE3 MET 39 3HE MET 39 15.189 17.977 11.126
331 H VAL 40 H VAL 40 19.661 16.896 7.279
332 HA VAL 40 HA VAL 40 21.773 17.697 9.001
333 HB VAL 40 HB VAL 40 21.198 15.421 7.535
334 HG11 VAL 40 1HG1 VAL 40 22.254 16.417 5.557
335 HG12 VAL 40 2HG1 VAL 40 23.748 16.633 6.471
336 HG13 VAL 40 3HG1 VAL 40 23.144 15.010 6.136
337 HG21 VAL 40 1HG2 VAL 40 22.281 15.478 9.703
338 HG22 VAL 40 2HG2 VAL 40 23.245 14.527 8.574
339 HG23 VAL 40 3HG2 VAL 40 23.736 16.170 8.986
340 H LYS 41 H LYS 41 21.108 18.170 5.568
341 HA LYS 41 HA LYS 41 23.616 19.573 5.161
342 HB2 LYS 41 1HB LYS 41 21.356 18.706 3.400
343 HB3 LYS 41 2HB LYS 41 22.450 19.964 2.838
344 HG2 LYS 41 1HG LYS 41 23.225 17.176 3.671
345 HG3 LYS 41 2HG LYS 41 23.144 17.794 2.019
346 HD2 LYS 41 1HD LYS 41 25.099 18.454 4.192
347 HD3 LYS 41 2HD LYS 41 25.410 17.936 2.533
348 HE2 LYS 41 1HE LYS 41 24.514 20.100 1.735
349 HE3 LYS 41 2HE LYS 41 24.322 20.609 3.412
350 HZ1 LYS 41 1HZ LYS 41 26.446 21.246 2.086
351 HZ2 LYS 41 2HZ LYS 41 26.953 19.684 2.491
352 HZ3 LYS 41 3HZ LYS 41 26.572 20.791 3.711
353 H GLN 42 H GLN 42 20.467 20.316 6.160
354 HA GLN 42 HA GLN 42 19.424 22.272 6.669
355 HB2 GLN 42 1HB GLN 42 22.275 23.045 6.496
356 HB3 GLN 42 2HB GLN 42 21.112 24.360 6.385
357 HG2 GLN 42 1HG GLN 42 21.226 24.369 8.611
358 HG3 GLN 42 2HG GLN 42 20.145 22.980 8.510
359 HE21 GLN 42 2HE2 GLN 42 21.995 21.110 7.525
360 HE22 GLN 42 1HE2 GLN 42 23.132 20.764 8.778
361 H LEU 43 H LEU 43 18.737 21.427 4.291
362 HA LEU 43 HA LEU 43 19.004 23.721 2.466
363 HB2 LEU 43 1HB LEU 43 19.758 21.380 1.756
364 HB3 LEU 43 2HB LEU 43 18.042 20.985 1.690
365 HG LEU 43 HG LEU 43 17.673 22.309 -0.168
366 HD11 LEU 43 1HD1 LEU 43 20.143 23.811 0.649
367 HD12 LEU 43 2HD1 LEU 43 18.487 24.404 0.523
368 HD13 LEU 43 3HD1 LEU 43 19.395 24.007 -0.936
369 HD21 LEU 43 1HD2 LEU 43 20.543 21.666 -0.721
370 HD22 LEU 43 2HD2 LEU 43 19.144 21.541 -1.787
371 HD23 LEU 43 3HD2 LEU 43 19.365 20.377 -0.480
372 H TYR 44 H TYR 44 17.227 23.946 4.572
373 HA TYR 44 HA TYR 44 14.717 24.169 3.116
374 HB2 TYR 44 1HB TYR 44 13.408 23.114 4.895
375 HB3 TYR 44 2HB TYR 44 14.564 21.976 4.213
376 HD1 TYR 44 HD1 TYR 44 16.973 22.156 5.515
377 HD2 TYR 44 HD2 TYR 44 13.140 22.970 7.172
378 HE1 TYR 44 HE1 TYR 44 17.856 21.698 7.765
379 HE2 TYR 44 HE2 TYR 44 14.012 22.516 9.427
380 HH TYR 44 HH TYR 44 17.427 21.695 9.945
381 H ASP 45 H ASP 45 13.076 25.408 4.431
382 HA ASP 45 HA ASP 45 14.419 27.678 5.646
383 HB2 ASP 45 1HB ASP 45 11.891 27.209 4.275
384 HB3 ASP 45 2HB ASP 45 11.687 28.175 5.734
385 H GLN 46 H GLN 46 14.605 27.974 7.763
386 HA GLN 46 HA GLN 46 13.701 26.102 9.652
387 HB2 GLN 46 1HB GLN 46 14.411 28.935 10.360
388 HB3 GLN 46 2HB GLN 46 14.688 27.468 11.290
389 HG2 GLN 46 1HG GLN 46 16.121 28.332 8.791
390 HG3 GLN 46 2HG GLN 46 16.775 28.250 10.426
391 HE21 GLN 46 2HE2 GLN 46 15.197 26.191 8.009
392 HE22 GLN 46 1HE2 GLN 46 16.155 24.789 8.326
393 H GLN 47 H GLN 47 12.386 29.187 8.582
394 HA GLN 47 HA GLN 47 10.446 29.544 10.562
395 HB2 GLN 47 1HB GLN 47 9.211 30.773 8.629
396 HB3 GLN 47 2HB GLN 47 10.747 31.402 9.209
397 HG2 GLN 47 1HG GLN 47 10.837 29.473 6.968
398 HG3 GLN 47 2HG GLN 47 10.202 31.083 6.630
399 HE21 GLN 47 2HE2 GLN 47 12.943 29.220 6.808
400 HE22 GLN 47 1HE2 GLN 47 14.126 30.478 6.864
401 H GLU 48 H GLU 48 10.537 27.427 7.808
402 HA GLU 48 HA GLU 48 8.020 26.229 8.685
403 HB2 GLU 48 1HB GLU 48 8.474 27.590 6.107
404 HB3 GLU 48 2HB GLU 48 7.719 26.007 5.993
405 HG2 GLU 48 1HG GLU 48 6.719 28.436 7.442
406 HG3 GLU 48 2HG GLU 48 5.970 27.580 6.095
407 H GLN 49 H GLN 49 9.032 24.394 9.391
408 HA GLN 49 HA GLN 49 11.121 23.043 8.143
409 HB2 GLN 49 1HB GLN 49 8.937 22.093 9.987
410 HB3 GLN 49 2HB GLN 49 10.209 21.021 9.416
411 HG2 GLN 49 1HG GLN 49 11.280 21.669 11.263
412 HG3 GLN 49 2HG GLN 49 11.669 23.110 10.326
413 HE21 GLN 49 2HE2 GLN 49 11.397 24.889 11.445
414 HE22 GLN 49 1HE2 GLN 49 10.162 25.185 12.616
415 H HIS 50 H HIS 50 7.760 23.154 7.370
416 HA HIS 50 HA HIS 50 7.829 20.769 5.727
417 HB2 HIS 50 1HB HIS 50 5.508 21.181 5.302
418 HB3 HIS 50 2HB HIS 50 5.791 21.497 7.011
419 HD1 HIS 50 HD1 HIS 50 4.340 23.383 7.663
420 HD2 HIS 50 HD2 HIS 50 6.050 23.977 3.923
421 HE1 HIS 50 HE1 HIS 50 3.592 25.672 6.937
422 H MET 51 H MET 51 9.290 23.537 5.294
423 HA MET 51 HA MET 51 8.599 23.740 2.436
424 HB2 MET 51 1HB MET 51 9.010 25.783 4.490
425 HB3 MET 51 2HB MET 51 9.959 26.063 3.036
426 HG2 MET 51 1HG MET 51 7.123 25.364 2.632
427 HG3 MET 51 2HG MET 51 7.453 26.933 3.362
428 HE1 MET 51 1HE MET 51 10.068 25.310 1.187
429 HE2 MET 51 2HE MET 51 8.728 24.667 0.238
430 HE3 MET 51 3HE MET 51 9.778 25.909 -0.447
431 H VAL 52 H VAL 52 10.077 22.306 1.618
432 HA VAL 52 HA VAL 52 12.868 22.481 2.402
433 HB VAL 52 HB VAL 52 11.405 20.671 0.485
434 HG11 VAL 52 1HG1 VAL 52 13.491 20.876 -0.544
435 HG12 VAL 52 2HG1 VAL 52 14.346 20.969 0.997
436 HG13 VAL 52 3HG1 VAL 52 13.654 19.437 0.462
437 HG21 VAL 52 1HG2 VAL 52 11.390 20.490 3.112
438 HG22 VAL 52 2HG2 VAL 52 11.530 19.051 2.101
439 HG23 VAL 52 3HG2 VAL 52 12.969 19.750 2.845
440 H TYR 53 H TYR 53 14.423 23.509 1.307
441 HA TYR 53 HA TYR 53 13.726 24.652 -1.318
442 HB2 TYR 53 1HB TYR 53 15.214 25.756 1.019
443 HB3 TYR 53 2HB TYR 53 15.711 26.260 -0.593
444 HD1 TYR 53 HD2 TYR 53 13.538 26.846 -2.146
445 HD2 TYR 53 HD1 TYR 53 13.763 27.181 2.090
446 HE1 TYR 53 HE2 TYR 53 11.729 28.511 -2.187
447 HE2 TYR 53 HE1 TYR 53 11.953 28.846 2.060
448 HH TYR 53 HH TYR 53 10.342 29.792 0.793
449 H CYS 54 H CYS 54 14.486 22.554 -2.168
450 HA CYS 54 HA CYS 54 17.053 21.549 -1.909
451 HB2 CYS 54 1HB CYS 54 16.637 20.736 -4.346
452 HB3 CYS 54 2HB CYS 54 15.590 20.152 -3.058
453 HG CYS 54 HG CYS 54 14.848 22.019 -5.728
454 H GLY 55 H GLY 55 15.884 24.228 -3.841
455 HA2 GLY 55 1HA GLY 55 16.990 25.833 -5.052
456 HA3 GLY 55 2HA GLY 55 18.388 25.456 -4.056
457 H GLY 56 H GLY 56 19.791 23.704 -4.747
458 HA2 GLY 56 1HA GLY 56 19.488 22.675 -7.429
459 HA3 GLY 56 2HA GLY 56 20.756 23.881 -7.269
460 H ASP 57 H ASP 57 20.070 21.828 -4.576
461 HA ASP 57 HA ASP 57 22.734 20.748 -4.662
462 HB2 ASP 57 1HB ASP 57 21.035 21.337 -2.627
463 HB3 ASP 57 2HB ASP 57 20.801 19.595 -2.749
464 H LEU 58 H LEU 58 22.615 18.223 -3.791
465 HA LEU 58 HA LEU 58 22.370 16.658 -6.016
466 HB2 LEU 58 1HB LEU 58 22.221 16.057 -3.098
467 HB3 LEU 58 2HB LEU 58 21.908 14.770 -4.260
468 HG LEU 58 HG LEU 58 24.081 14.481 -4.676
469 HD11 LEU 58 1HD1 LEU 58 24.231 17.478 -4.801
470 HD12 LEU 58 2HD1 LEU 58 24.335 16.316 -6.122
471 HD13 LEU 58 3HD1 LEU 58 25.656 16.451 -4.961
472 HD21 LEU 58 1HD2 LEU 58 24.232 14.538 -2.300
473 HD22 LEU 58 2HD2 LEU 58 24.278 16.301 -2.283
474 HD23 LEU 58 3HD2 LEU 58 25.640 15.389 -2.936
475 H LEU 59 H LEU 59 19.931 16.891 -3.423
476 HA LEU 59 HA LEU 59 17.980 15.340 -4.714
477 HB2 LEU 59 1HB LEU 59 16.631 15.838 -2.957
478 HB3 LEU 59 2HB LEU 59 18.188 16.280 -2.258
479 HG LEU 59 HG LEU 59 16.358 18.289 -3.552
480 HD11 LEU 59 1HD1 LEU 59 15.372 16.990 -1.559
481 HD12 LEU 59 2HD1 LEU 59 15.340 18.753 -1.518
482 HD13 LEU 59 3HD1 LEU 59 16.556 17.872 -0.594
483 HD21 LEU 59 1HD2 LEU 59 17.852 19.839 -2.925
484 HD22 LEU 59 2HD2 LEU 59 18.979 18.485 -2.846
485 HD23 LEU 59 3HD2 LEU 59 18.174 19.049 -1.381
486 H GLY 60 H GLY 60 18.585 18.828 -4.724
487 HA2 GLY 60 1HA GLY 60 16.294 19.629 -6.124
488 HA3 GLY 60 2HA GLY 60 17.823 20.496 -6.102
489 H GLU 61 H GLU 61 19.448 18.551 -7.323
490 HA GLU 61 HA GLU 61 18.828 19.054 -10.062
491 HB2 GLU 61 1HB GLU 61 20.991 18.570 -10.409
492 HB3 GLU 61 2HB GLU 61 21.126 18.497 -8.658
493 HG2 GLU 61 1HG GLU 61 22.126 16.534 -9.450
494 HG3 GLU 61 2HG GLU 61 20.544 16.046 -8.845
495 H LEU 62 H LEU 62 18.648 16.239 -7.950
496 HA LEU 62 HA LEU 62 18.111 14.301 -9.906
497 HB2 LEU 62 1HB LEU 62 18.357 14.368 -7.145
498 HB3 LEU 62 2HB LEU 62 16.695 13.846 -7.416
499 HG LEU 62 HG LEU 62 18.072 11.907 -7.161
500 HD11 LEU 62 1HD1 LEU 62 17.443 10.713 -9.058
501 HD12 LEU 62 2HD1 LEU 62 17.656 12.103 -10.122
502 HD13 LEU 62 3HD1 LEU 62 16.292 12.048 -9.006
503 HD21 LEU 62 1HD2 LEU 62 19.725 12.556 -9.549
504 HD22 LEU 62 2HD2 LEU 62 20.098 11.538 -8.158
505 HD23 LEU 62 3HD2 LEU 62 20.145 13.295 -8.004
506 H LEU 63 H LEU 63 15.941 16.380 -8.028
507 HA LEU 63 HA LEU 63 13.559 15.290 -9.174
508 HB2 LEU 63 1HB LEU 63 14.269 17.313 -7.212
509 HB3 LEU 63 2HB LEU 63 12.908 17.801 -8.220
510 HG LEU 63 HG LEU 63 12.753 15.087 -7.070
511 HD11 LEU 63 1HD1 LEU 63 12.000 15.939 -4.891
512 HD12 LEU 63 2HD1 LEU 63 12.522 17.557 -5.359
513 HD13 LEU 63 3HD1 LEU 63 13.709 16.265 -5.184
514 HD21 LEU 63 1HD2 LEU 63 10.718 17.291 -7.000
515 HD22 LEU 63 2HD2 LEU 63 10.462 15.546 -6.994
516 HD23 LEU 63 3HD2 LEU 63 11.015 16.351 -8.463
517 H GLY 64 H GLY 64 15.396 18.297 -9.662
518 HA2 GLY 64 1HA GLY 64 15.719 19.295 -11.788
519 HA3 GLY 64 2HA GLY 64 14.304 18.435 -12.378
520 H ARG 65 H ARG 65 14.128 20.071 -9.334
521 HA ARG 65 HA ARG 65 12.589 22.239 -10.605
522 HB2 ARG 65 1HB ARG 65 11.957 21.147 -7.874
523 HB3 ARG 65 2HB ARG 65 10.951 22.145 -8.914
524 HG2 ARG 65 1HG ARG 65 11.700 19.546 -10.050
525 HG3 ARG 65 2HG ARG 65 10.680 19.471 -8.612
526 HD2 ARG 65 1HD ARG 65 8.954 19.807 -9.985
527 HD3 ARG 65 2HD ARG 65 9.522 21.471 -10.118
528 HE ARG 65 HE ARG 65 10.907 19.888 -11.974
529 HH11 ARG 65 1HH1 ARG 65 7.710 21.130 -11.375
530 HH12 ARG 65 2HH1 ARG 65 7.270 21.170 -13.051
531 HH21 ARG 65 1HH2 ARG 65 10.340 19.936 -14.183
532 HH22 ARG 65 2HH2 ARG 65 8.767 20.490 -14.647
533 H GLN 66 H GLN 66 12.072 23.476 -8.021
534 HA GLN 66 HA GLN 66 14.779 24.461 -7.401
535 HB2 GLN 66 1HB GLN 66 13.319 26.594 -6.751
536 HB3 GLN 66 2HB GLN 66 13.936 26.340 -8.379
537 HG2 GLN 66 1HG GLN 66 11.854 25.651 -9.186
538 HG3 GLN 66 2HG GLN 66 11.219 25.378 -7.564
539 HE21 GLN 66 2HE2 GLN 66 10.694 27.193 -6.271
540 HE22 GLN 66 1HE2 GLN 66 10.330 28.720 -6.993
541 H SER 67 H SER 67 11.503 23.964 -6.150
542 HA SER 67 HA SER 67 12.566 23.203 -3.579
543 HB2 SER 67 1HB SER 67 10.684 25.003 -2.696
544 HB3 SER 67 2HB SER 67 12.426 25.277 -2.697
545 HG SER 67 HG SER 67 10.493 26.477 -4.170
546 H PHE 68 H PHE 68 10.984 22.226 -2.204
547 HA PHE 68 HA PHE 68 8.332 21.785 -3.333
548 HB2 PHE 68 1HB PHE 68 8.528 19.334 -3.097
549 HB3 PHE 68 2HB PHE 68 9.653 19.974 -4.291
550 HD1 PHE 68 HD1 PHE 68 9.466 19.005 -0.702
551 HD2 PHE 68 HD2 PHE 68 11.883 19.384 -4.185
552 HE1 PHE 68 HE1 PHE 68 11.327 17.907 0.474
553 HE2 PHE 68 HE2 PHE 68 13.748 18.287 -3.015
554 HZ PHE 68 HZ PHE 68 13.471 17.546 -0.682
555 H SER 69 H SER 69 6.790 21.056 -1.824
556 HA SER 69 HA SER 69 7.471 21.722 0.922
557 HB2 SER 69 1HB SER 69 4.773 20.937 0.796
558 HB3 SER 69 2HB SER 69 5.403 22.583 0.849
559 HG SER 69 HG SER 69 4.864 22.816 -1.162
560 H VAL 70 H VAL 70 7.520 20.328 2.608
561 HA VAL 70 HA VAL 70 7.765 17.531 2.033
562 HB VAL 70 HB VAL 70 8.704 17.304 4.090
563 HG11 VAL 70 1HG1 VAL 70 9.696 19.318 2.892
564 HG12 VAL 70 2HG1 VAL 70 8.815 20.307 4.059
565 HG13 VAL 70 3HG1 VAL 70 10.040 19.165 4.614
566 HG21 VAL 70 1HG2 VAL 70 6.791 17.568 5.447
567 HG22 VAL 70 2HG2 VAL 70 7.983 18.703 6.079
568 HG23 VAL 70 3HG2 VAL 70 6.662 19.285 5.066
569 H LYS 71 H LYS 71 5.373 19.589 3.592
570 HA LYS 71 HA LYS 71 3.763 17.487 4.617
571 HB2 LYS 71 1HB LYS 71 3.809 20.234 4.867
572 HB3 LYS 71 2HB LYS 71 2.340 19.954 3.943
573 HG2 LYS 71 1HG LYS 71 1.642 18.317 5.691
574 HG3 LYS 71 2HG LYS 71 3.041 18.823 6.641
575 HD2 LYS 71 1HD LYS 71 0.804 20.621 5.702
576 HD3 LYS 71 2HD LYS 71 0.997 19.987 7.339
577 HE2 LYS 71 1HE LYS 71 2.256 21.750 7.825
578 HE3 LYS 71 2HE LYS 71 3.449 21.179 6.660
579 HZ1 LYS 71 1HZ LYS 71 2.930 22.808 5.265
580 HZ2 LYS 71 2HZ LYS 71 2.040 23.514 6.518
581 HZ3 LYS 71 3HZ LYS 71 1.269 22.515 5.392
582 H ASP 72 H ASP 72 4.167 18.828 1.488
583 HA ASP 72 HA ASP 72 1.724 17.471 0.554
584 HB2 ASP 72 1HB ASP 72 1.795 19.917 0.132
585 HB3 ASP 72 2HB ASP 72 3.261 19.687 -0.817
586 HA PRO 73 HA PRO 73 5.083 14.803 -1.023
587 HB2 PRO 73 1HB PRO 73 3.556 12.558 -1.061
588 HB3 PRO 73 2HB PRO 73 4.374 13.138 0.394
589 HG2 PRO 73 1HG PRO 73 1.516 13.471 -0.432
590 HG3 PRO 73 2HG PRO 73 2.181 13.070 1.162
591 HD2 PRO 73 1HD PRO 73 1.360 15.567 0.512
592 HD3 PRO 73 2HD PRO 73 2.699 15.265 1.637
593 H SER 74 H SER 74 4.223 16.459 -2.852
594 HA SER 74 HA SER 74 2.691 14.993 -4.868
595 HB2 SER 74 1HB SER 74 3.228 17.832 -4.298
596 HB3 SER 74 2HB SER 74 3.255 17.412 -6.011
597 HG SER 74 HG SER 74 1.172 17.029 -5.961
598 HA PRO 75 HA PRO 75 6.618 15.990 -7.433
599 HB2 PRO 75 1HB PRO 75 8.578 17.473 -6.282
600 HB3 PRO 75 2HB PRO 75 7.215 18.190 -7.148
601 HG2 PRO 75 1HG PRO 75 7.613 17.837 -4.202
602 HG3 PRO 75 2HG PRO 75 6.981 19.239 -5.086
603 HD2 PRO 75 1HD PRO 75 5.370 17.468 -3.820
604 HD3 PRO 75 2HD PRO 75 4.880 18.315 -5.301
605 H LEU 76 H LEU 76 7.043 15.412 -4.004
606 HA LEU 76 HA LEU 76 9.546 14.176 -4.026
607 HB2 LEU 76 1HB LEU 76 8.317 14.850 -1.998
608 HB3 LEU 76 2HB LEU 76 7.184 13.528 -2.268
609 HG LEU 76 HG LEU 76 9.388 12.077 -2.153
610 HD11 LEU 76 1HD1 LEU 76 11.142 13.466 -1.820
611 HD12 LEU 76 2HD1 LEU 76 10.655 13.281 -0.136
612 HD13 LEU 76 3HD1 LEU 76 10.158 14.708 -1.045
613 HD21 LEU 76 1HD2 LEU 76 7.483 13.048 -0.145
614 HD22 LEU 76 2HD2 LEU 76 8.975 12.378 0.516
615 HD23 LEU 76 3HD2 LEU 76 7.967 11.401 -0.552
616 H TYR 77 H TYR 77 6.311 12.724 -4.325
617 HA TYR 77 HA TYR 77 7.268 10.079 -4.700
618 HB2 TYR 77 1HB TYR 77 4.637 11.456 -5.038
619 HB3 TYR 77 2HB TYR 77 4.852 9.859 -5.748
620 HD1 TYR 77 HD1 TYR 77 5.556 7.954 -4.218
621 HD2 TYR 77 HD2 TYR 77 4.178 11.701 -2.749
622 HE1 TYR 77 HE1 TYR 77 5.078 6.917 -2.040
623 HE2 TYR 77 HE2 TYR 77 3.697 10.675 -0.566
624 HH TYR 77 HH TYR 77 3.665 8.801 0.621
625 H ASP 78 H ASP 78 6.322 12.664 -6.912
626 HA ASP 78 HA ASP 78 6.362 11.251 -9.308
627 HB2 ASP 78 1HB ASP 78 5.982 13.878 -8.588
628 HB3 ASP 78 2HB ASP 78 7.486 13.953 -9.501
629 H MET 79 H MET 79 9.008 12.714 -7.489
630 HA MET 79 HA MET 79 10.982 12.148 -9.490
631 HB2 MET 79 1HB MET 79 11.358 14.008 -8.013
632 HB3 MET 79 2HB MET 79 11.203 12.980 -6.596
633 HG2 MET 79 1HG MET 79 13.236 11.781 -7.990
634 HG3 MET 79 2HG MET 79 13.506 13.495 -8.296
635 HE1 MET 79 1HE MET 79 12.402 11.061 -5.592
636 HE2 MET 79 2HE MET 79 13.207 11.608 -4.120
637 HE3 MET 79 3HE MET 79 11.815 12.494 -4.746
638 H LEU 80 H LEU 80 10.131 10.735 -6.341
639 HA LEU 80 HA LEU 80 12.074 8.772 -6.194
640 HB2 LEU 80 1HB LEU 80 9.216 8.761 -5.253
641 HB3 LEU 80 2HB LEU 80 10.369 7.489 -4.853
642 HG LEU 80 HG LEU 80 10.730 10.390 -4.114
643 HD11 LEU 80 1HD1 LEU 80 10.030 8.266 -2.145
644 HD12 LEU 80 2HD1 LEU 80 8.748 9.023 -3.090
645 HD13 LEU 80 3HD1 LEU 80 9.784 10.011 -2.060
646 HD21 LEU 80 1HD2 LEU 80 12.090 8.404 -2.516
647 HD22 LEU 80 2HD2 LEU 80 12.738 9.816 -3.352
648 HD23 LEU 80 3HD2 LEU 80 12.547 8.289 -4.216
649 H ARG 81 H ARG 81 9.037 8.780 -7.972
650 HA ARG 81 HA ARG 81 8.543 6.256 -8.675
651 HB2 ARG 81 1HB ARG 81 8.624 8.729 -10.365
652 HB3 ARG 81 2HB ARG 81 8.235 7.181 -11.103
653 HG2 ARG 81 1HG ARG 81 6.232 7.005 -10.015
654 HG3 ARG 81 2HG ARG 81 6.759 8.000 -8.656
655 HD2 ARG 81 1HD ARG 81 5.430 9.535 -9.656
656 HD3 ARG 81 2HD ARG 81 6.885 9.827 -10.608
657 HE ARG 81 HE ARG 81 5.697 9.155 -12.424
658 HH11 ARG 81 1HH1 ARG 81 4.371 7.580 -9.617
659 HH12 ARG 81 2HH1 ARG 81 3.127 6.762 -10.503
660 HH21 ARG 81 1HH2 ARG 81 4.064 8.083 -13.601
661 HH22 ARG 81 2HH2 ARG 81 2.954 7.048 -12.769
662 H LYS 82 H LYS 82 10.987 8.192 -10.413
663 HA LYS 82 HA LYS 82 12.251 5.674 -11.262
664 HB2 LYS 82 1HB LYS 82 12.838 6.647 -13.243
665 HB3 LYS 82 2HB LYS 82 11.402 7.598 -12.892
666 HG2 LYS 82 1HG LYS 82 14.243 8.415 -12.317
667 HG3 LYS 82 2HG LYS 82 13.237 9.006 -13.641
668 HD2 LYS 82 1HD LYS 82 12.646 9.342 -10.700
669 HD3 LYS 82 2HD LYS 82 13.303 10.587 -11.765
670 HE2 LYS 82 1HE LYS 82 10.982 9.548 -13.004
671 HE3 LYS 82 2HE LYS 82 10.580 9.861 -11.316
672 HZ1 LYS 82 1HZ LYS 82 10.659 12.049 -11.640
673 HZ2 LYS 82 2HZ LYS 82 10.611 11.710 -13.296
674 HZ3 LYS 82 3HZ LYS 82 12.096 11.976 -12.530
675 H ASN 83 H ASN 83 12.543 7.986 -8.967
676 HA ASN 83 HA ASN 83 15.451 8.191 -9.055
677 HB2 ASN 83 1HB ASN 83 14.411 10.244 -8.486
678 HB3 ASN 83 2HB ASN 83 13.335 9.468 -7.329
679 HD21 ASN 83 2HD2 ASN 83 14.194 8.746 -5.338
680 HD22 ASN 83 1HD2 ASN 83 15.645 9.431 -4.699
681 H LEU 84 H LEU 84 12.935 7.087 -6.789
682 HA LEU 84 HA LEU 84 14.821 5.880 -5.010
683 HB2 LEU 84 1HB LEU 84 12.070 6.512 -4.991
684 HB3 LEU 84 2HB LEU 84 12.201 4.777 -4.714
685 HG LEU 84 HG LEU 84 13.518 6.938 -3.071
686 HD11 LEU 84 1HD1 LEU 84 11.872 6.688 -1.508
687 HD12 LEU 84 2HD1 LEU 84 11.479 5.046 -2.018
688 HD13 LEU 84 3HD1 LEU 84 10.937 6.422 -2.980
689 HD21 LEU 84 1HD2 LEU 84 13.438 4.348 -1.852
690 HD22 LEU 84 2HD2 LEU 84 14.828 5.378 -2.194
691 HD23 LEU 84 3HD2 LEU 84 14.247 4.246 -3.416
692 H VAL 85 H VAL 85 16.047 4.358 -6.048
693 HA VAL 85 HA VAL 85 15.506 2.559 -7.961
694 HB VAL 85 HB VAL 85 17.085 2.143 -5.433
695 HG11 VAL 85 1HG1 VAL 85 16.803 0.254 -7.766
696 HG12 VAL 85 2HG1 VAL 85 18.058 0.139 -6.530
697 HG13 VAL 85 3HG1 VAL 85 16.362 -0.055 -6.087
698 HG21 VAL 85 1HG2 VAL 85 18.789 2.025 -7.566
699 HG22 VAL 85 2HG2 VAL 85 17.588 3.192 -8.118
700 HG23 VAL 85 3HG2 VAL 85 18.458 3.469 -6.609
701 H THR 86 H THR 86 14.522 0.584 -8.213
702 HA THR 86 HA THR 86 13.067 -0.540 -5.931
703 HB THR 86 HB THR 86 11.090 -0.921 -7.498
704 HG1 THR 86 1HG THR 86 10.956 0.626 -9.214
705 HG21 THR 86 1HG2 THR 86 11.890 1.725 -6.353
706 HG22 THR 86 2HG2 THR 86 10.653 0.595 -5.802
707 HG23 THR 86 3HG2 THR 86 10.375 1.575 -7.242
708 H LEU 87 H LEU 87 12.495 -2.754 -6.163
709 HA LEU 87 HA LEU 87 13.961 -4.141 -8.310
710 HB2 LEU 87 1HB LEU 87 13.499 -5.806 -6.016
711 HB3 LEU 87 2HB LEU 87 15.016 -5.390 -6.812
712 HG LEU 87 HG LEU 87 13.671 -3.723 -4.686
713 HD11 LEU 87 1HD1 LEU 87 16.236 -4.975 -4.079
714 HD12 LEU 87 2HD1 LEU 87 14.919 -6.126 -4.302
715 HD13 LEU 87 3HD1 LEU 87 14.775 -4.843 -3.100
716 HD21 LEU 87 1HD2 LEU 87 15.306 -2.196 -4.939
717 HD22 LEU 87 2HD2 LEU 87 15.407 -2.866 -6.568
718 HD23 LEU 87 3HD2 LEU 87 16.528 -3.410 -5.319
719 H ALA 88 H ALA 88 11.118 -4.146 -6.228
720 HA ALA 88 HA ALA 88 9.925 -6.320 -7.773
721 HB1 ALA 88 1HB ALA 88 8.872 -6.840 -5.890
722 HB2 ALA 88 2HB ALA 88 9.763 -5.547 -5.086
723 HB3 ALA 88 3HB ALA 88 8.173 -5.224 -5.778
724 H THR 89 H THR 89 8.356 -6.042 -9.244
725 HA THR 89 HA THR 89 7.212 -4.870 -10.865
726 HB THR 89 HB THR 89 5.854 -3.471 -8.581
727 HG1 THR 89 1HG THR 89 4.892 -5.344 -7.973
728 HG21 THR 89 1HG2 THR 89 5.039 -4.569 -11.256
729 HG22 THR 89 2HG2 THR 89 4.866 -2.927 -10.636
730 HG23 THR 89 3HG2 THR 89 3.848 -4.221 -10.003
731 H1 SER 115 H SER 115 7.035 11.270 19.981
732 HA SER 115 HA SER 115 5.432 13.655 20.632
733 HB2 SER 115 1HB SER 115 7.475 12.213 22.321
734 HB3 SER 115 2HB SER 115 6.993 13.878 22.644
735 HG SER 115 HG SER 115 5.819 11.996 23.700
736 H GLN 116 H GLN 116 6.602 13.777 18.290
737 HA GLN 116 HA GLN 116 9.268 14.929 18.576
738 HB2 GLN 116 1HB GLN 116 7.662 14.495 16.055
739 HB3 GLN 116 2HB GLN 116 9.374 14.882 16.161
740 HG2 GLN 116 1HG GLN 116 8.575 12.463 17.609
741 HG3 GLN 116 2HG GLN 116 8.362 12.388 15.861
742 HE21 GLN 116 2HE2 GLN 116 10.813 14.169 17.649
743 HE22 GLN 116 1HE2 GLN 116 12.166 13.291 17.029
744 H GLU 117 H GLU 117 9.353 16.783 16.594
745 HA GLU 117 HA GLU 117 7.196 18.659 16.761
746 HB2 GLU 117 1HB GLU 117 8.437 18.888 18.977
747 HB3 GLU 117 2HB GLU 117 9.782 19.526 18.043
748 HG2 GLU 117 1HG GLU 117 7.149 20.774 17.579
749 HG3 GLU 117 2HG GLU 117 7.898 21.061 19.149
750 H THR 118 H THR 118 10.599 18.092 16.011
751 HA THR 118 HA THR 118 10.777 20.201 14.088
752 HB THR 118 HB THR 118 12.658 17.923 13.871
753 HG1 THR 118 1HG THR 118 12.431 19.539 16.207
754 HG21 THR 118 1HG2 THR 118 13.425 20.752 14.416
755 HG22 THR 118 2HG2 THR 118 12.708 20.358 12.854
756 HG23 THR 118 3HG2 THR 118 14.192 19.558 13.370
757 H PHE 119 H PHE 119 12.201 18.658 12.067
758 HA PHE 119 HA PHE 119 10.370 18.366 10.105
759 HB2 PHE 119 1HB PHE 119 13.016 17.904 10.235
760 HB3 PHE 119 2HB PHE 119 12.442 16.242 10.135
761 HD1 PHE 119 HD1 PHE 119 9.925 17.458 8.470
762 HD2 PHE 119 HD2 PHE 119 14.161 17.397 8.062
763 HE1 PHE 119 HE1 PHE 119 9.690 17.688 6.032
764 HE2 PHE 119 HE2 PHE 119 13.933 17.629 5.623
765 HZ PHE 119 HZ PHE 119 11.695 17.775 4.605
766 H SER 120 H SER 120 11.253 15.882 12.466
767 HA SER 120 HA SER 120 9.872 13.716 11.481
768 HB2 SER 120 1HB SER 120 10.606 14.617 14.231
769 HB3 SER 120 2HB SER 120 9.487 13.264 14.072
770 HG SER 120 HG SER 120 11.272 12.581 12.444
771 H ASP 121 H ASP 121 8.630 16.451 13.327
772 HA ASP 121 HA ASP 121 6.085 15.567 13.928
773 HB2 ASP 121 1HB ASP 121 7.053 17.729 14.672
774 HB3 ASP 121 2HB ASP 121 6.836 18.361 13.043
775 H LEU 122 H LEU 122 6.847 17.633 11.119
776 HA LEU 122 HA LEU 122 4.385 16.906 9.823
777 HB2 LEU 122 1HB LEU 122 6.655 18.329 8.487
778 HB3 LEU 122 2HB LEU 122 4.924 18.489 8.198
779 HG LEU 122 HG LEU 122 5.562 19.296 10.884
780 HD11 LEU 122 1HD1 LEU 122 6.843 21.339 10.246
781 HD12 LEU 122 2HD1 LEU 122 7.125 20.605 8.668
782 HD13 LEU 122 3HD1 LEU 122 7.759 19.837 10.123
783 HD21 LEU 122 1HD2 LEU 122 3.597 19.843 9.298
784 HD22 LEU 122 2HD2 LEU 122 4.670 21.089 8.658
785 HD23 LEU 122 3HD2 LEU 122 4.212 21.109 10.361
786 H TRP 123 H TRP 123 7.835 16.447 9.055
787 HA TRP 123 HA TRP 123 7.829 15.078 6.764
788 HB2 TRP 123 1HB TRP 123 9.793 15.468 8.335
789 HB3 TRP 123 2HB TRP 123 9.320 13.978 9.146
790 HD1 TRP 123 HD1 TRP 123 10.757 12.023 8.371
791 HE1 TRP 123 HE1 TRP 123 11.871 11.296 6.168
792 HE3 TRP 123 HE3 TRP 123 9.311 15.927 5.405
793 HZ2 TRP 123 HZ2 TRP 123 12.106 12.251 3.522
794 HZ3 TRP 123 HZ3 TRP 123 10.023 15.945 3.049
795 HH2 TRP 123 HH2 TRP 123 11.392 14.144 2.130
796 H LYS 124 H LYS 124 7.304 13.442 9.892
797 HA LYS 124 HA LYS 124 6.779 10.903 9.027
798 HB2 LYS 124 1HB LYS 124 6.851 11.703 11.410
799 HB3 LYS 124 2HB LYS 124 5.207 12.292 11.202
800 HG2 LYS 124 1HG LYS 124 4.453 10.014 10.727
801 HG3 LYS 124 2HG LYS 124 6.103 9.427 10.953
802 HD2 LYS 124 1HD LYS 124 4.569 10.918 13.074
803 HD3 LYS 124 2HD LYS 124 4.572 9.158 12.936
804 HE2 LYS 124 1HE LYS 124 7.091 9.280 13.057
805 HE3 LYS 124 2HE LYS 124 6.905 10.978 13.492
806 HZ1 LYS 124 1HZ LYS 124 5.318 10.003 15.284
807 HZ2 LYS 124 2HZ LYS 124 6.990 9.987 15.538
808 HZ3 LYS 124 3HZ LYS 124 6.198 8.580 15.032
809 H LEU 125 H LEU 125 4.517 13.625 9.139
810 HA LEU 125 HA LEU 125 2.127 12.493 8.573
811 HB2 LEU 125 1HB LEU 125 2.741 14.959 8.739
812 HB3 LEU 125 2HB LEU 125 3.106 14.870 7.017
813 HG LEU 125 HG LEU 125 0.687 14.036 6.756
814 HD11 LEU 125 1HD1 LEU 125 0.747 14.886 9.603
815 HD12 LEU 125 2HD1 LEU 125 -0.144 13.576 8.831
816 HD13 LEU 125 3HD1 LEU 125 -0.692 15.242 8.649
817 HD21 LEU 125 1HD2 LEU 125 1.134 16.116 5.846
818 HD22 LEU 125 2HD2 LEU 125 1.557 16.824 7.405
819 HD23 LEU 125 3HD2 LEU 125 -0.130 16.481 7.021
820 H LEU 126 H LEU 126 4.651 13.212 6.177
821 HA LEU 126 HA LEU 126 3.465 12.543 3.836
822 HB2 LEU 126 1HB LEU 126 6.097 12.777 4.766
823 HB3 LEU 126 2HB LEU 126 6.016 11.215 3.954
824 HG LEU 126 HG LEU 126 5.502 12.193 1.884
825 HD11 LEU 126 1HD1 LEU 126 3.818 13.728 2.269
826 HD12 LEU 126 2HD1 LEU 126 5.171 14.762 1.811
827 HD13 LEU 126 3HD1 LEU 126 4.736 14.582 3.510
828 HD21 LEU 126 1HD2 LEU 126 7.774 12.506 2.122
829 HD22 LEU 126 2HD2 LEU 126 7.586 13.672 3.431
830 HD23 LEU 126 3HD2 LEU 126 7.223 14.144 1.771
831 HA PRO 127 HA PRO 127 2.100 8.365 4.893
832 HB2 PRO 127 1HB PRO 127 0.311 8.208 2.857
833 HB3 PRO 127 2HB PRO 127 -0.035 9.039 4.378
834 HG2 PRO 127 1HG PRO 127 0.820 10.182 1.747
835 HG3 PRO 127 2HG PRO 127 -0.416 10.771 2.873
836 HD2 PRO 127 1HD PRO 127 2.064 11.850 2.737
837 HD3 PRO 127 2HD PRO 127 1.137 11.775 4.249
838 H GLU 128 H GLU 128 4.231 7.588 4.255
839 HA GLU 128 HA GLU 128 5.247 7.275 1.739
840 HB2 GLU 128 1HB GLU 128 5.395 4.968 3.645
841 HB3 GLU 128 2HB GLU 128 6.643 5.621 2.594
842 HG2 GLU 128 1HG GLU 128 7.425 6.425 4.546
843 HG3 GLU 128 2HG GLU 128 6.301 7.733 4.180
844 H ASN 129 H ASN 129 2.497 5.695 3.109
845 HA ASN 129 HA ASN 129 0.841 4.511 2.042
846 HB2 ASN 129 1HB ASN 129 2.169 5.570 -0.107
847 HB3 ASN 129 2HB ASN 129 2.349 3.842 -0.394
848 HD21 ASN 129 2HD2 ASN 129 0.649 6.199 -1.476
849 HD22 ASN 129 1HD2 ASN 129 -0.923 5.497 -1.621
Start of MODEL 5
1 H1 GLN 1 H GLN 1 2.130 1.145 -1.679
2 HA GLN 1 HA GLN 1 3.916 0.561 -3.507
3 HB2 GLN 1 1HB GLN 1 4.095 3.565 -3.218
4 HB3 GLN 1 2HB GLN 1 5.219 2.551 -4.112
5 HG2 GLN 1 1HG GLN 1 3.891 2.450 -5.900
6 HG3 GLN 1 2HG GLN 1 2.441 2.207 -4.927
7 HE21 GLN 1 2HE2 GLN 1 1.506 3.632 -6.569
8 HE22 GLN 1 1HE2 GLN 1 1.628 5.341 -6.347
9 H ILE 2 H ILE 2 4.201 -0.511 -1.397
10 HA ILE 2 HA ILE 2 6.289 0.853 0.162
11 HB ILE 2 HB ILE 2 3.985 -0.747 1.272
12 HG12 ILE 2 1HG1 ILE 2 3.670 1.711 0.733
13 HG13 ILE 2 2HG1 ILE 2 3.357 1.252 2.403
14 HG21 ILE 2 1HG2 ILE 2 5.454 -1.462 2.802
15 HG22 ILE 2 2HG2 ILE 2 6.669 -0.279 2.322
16 HG23 ILE 2 3HG2 ILE 2 5.379 0.183 3.431
17 HD11 ILE 2 1HD1 ILE 2 4.920 2.630 3.158
18 HD12 ILE 2 2HD1 ILE 2 6.110 2.038 1.999
19 HD13 ILE 2 3HD1 ILE 2 4.978 3.306 1.530
20 H ASN 3 H ASN 3 7.417 -0.546 -1.569
21 HA ASN 3 HA ASN 3 7.734 -3.299 -0.582
22 HB2 ASN 3 1HB ASN 3 7.477 -2.223 -3.216
23 HB3 ASN 3 2HB ASN 3 9.078 -2.942 -3.065
24 HD21 ASN 3 2HD2 ASN 3 6.112 -3.923 -1.444
25 HD22 ASN 3 1HD2 ASN 3 6.020 -5.489 -2.167
26 H GLN 4 H GLN 4 10.124 -4.048 -1.426
27 HA GLN 4 HA GLN 4 11.910 -2.763 0.361
28 HB2 GLN 4 1HB GLN 4 12.765 -4.619 -1.846
29 HB3 GLN 4 2HB GLN 4 13.489 -4.400 -0.259
30 HG2 GLN 4 1HG GLN 4 12.419 -6.346 0.134
31 HG3 GLN 4 2HG GLN 4 11.093 -5.248 0.514
32 HE21 GLN 4 2HE2 GLN 4 9.246 -5.485 -0.547
33 HE22 GLN 4 1HE2 GLN 4 9.014 -6.460 -1.954
34 H VAL 5 H VAL 5 14.281 -2.376 -0.630
35 HA VAL 5 HA VAL 5 14.194 -0.868 -3.107
36 HB VAL 5 HB VAL 5 13.720 0.520 -0.766
37 HG11 VAL 5 1HG1 VAL 5 16.530 1.213 -1.552
38 HG12 VAL 5 2HG1 VAL 5 15.627 1.698 -0.115
39 HG13 VAL 5 3HG1 VAL 5 16.195 0.037 -0.282
40 HG21 VAL 5 1HG2 VAL 5 15.057 1.869 -3.069
41 HG22 VAL 5 2HG2 VAL 5 13.503 1.073 -3.311
42 HG23 VAL 5 3HG2 VAL 5 13.652 2.376 -2.132
43 H ARG 6 H ARG 6 16.459 0.220 -3.423
44 HA ARG 6 HA ARG 6 18.675 -1.063 -2.141
45 HB2 ARG 6 1HB ARG 6 17.809 -2.827 -3.725
46 HB3 ARG 6 2HB ARG 6 18.221 -1.742 -5.047
47 HG2 ARG 6 1HG ARG 6 20.566 -1.785 -3.726
48 HG3 ARG 6 2HG ARG 6 19.955 -3.396 -3.341
49 HD2 ARG 6 1HD ARG 6 19.422 -3.350 -5.961
50 HD3 ARG 6 2HD ARG 6 20.795 -2.244 -5.936
51 HE ARG 6 HE ARG 6 22.165 -4.028 -5.552
52 HH11 ARG 6 1HH1 ARG 6 18.897 -4.936 -4.770
53 HH12 ARG 6 2HH1 ARG 6 19.287 -6.601 -4.495
54 HH21 ARG 6 1HH2 ARG 6 22.691 -6.218 -5.193
55 HH22 ARG 6 2HH2 ARG 6 21.446 -7.329 -4.735
56 HA PRO 7 HA PRO 7 19.675 3.058 -3.841
57 HB2 PRO 7 1HB PRO 7 21.367 3.706 -1.819
58 HB3 PRO 7 2HB PRO 7 19.614 3.908 -1.708
59 HG2 PRO 7 1HG PRO 7 21.338 1.706 -0.641
60 HG3 PRO 7 2HG PRO 7 19.983 2.543 0.138
61 HD2 PRO 7 1HD PRO 7 19.725 0.101 -1.004
62 HD3 PRO 7 2HD PRO 7 18.403 1.287 -0.975
63 H LYS 8 H LYS 8 21.245 3.383 -5.286
64 HA LYS 8 HA LYS 8 23.377 1.492 -5.581
65 HB2 LYS 8 1HB LYS 8 22.045 2.962 -7.361
66 HB3 LYS 8 2HB LYS 8 23.386 4.065 -7.083
67 HG2 LYS 8 1HG LYS 8 24.726 2.862 -8.371
68 HG3 LYS 8 2HG LYS 8 24.356 1.387 -7.475
69 HD2 LYS 8 1HD LYS 8 22.257 1.187 -8.807
70 HD3 LYS 8 2HD LYS 8 22.796 2.562 -9.774
71 HE2 LYS 8 1HE LYS 8 24.749 1.338 -10.496
72 HE3 LYS 8 2HE LYS 8 24.337 -0.009 -9.435
73 HZ1 LYS 8 1HZ LYS 8 22.115 0.435 -11.014
74 HZ2 LYS 8 2HZ LYS 8 23.200 -0.858 -11.118
75 HZ3 LYS 8 3HZ LYS 8 23.437 0.523 -12.066
76 H LEU 9 H LEU 9 25.542 2.913 -6.396
77 HA LEU 9 HA LEU 9 26.869 3.506 -4.014
78 HB2 LEU 9 1HB LEU 9 28.392 3.032 -5.609
79 HB3 LEU 9 2HB LEU 9 27.432 3.767 -6.892
80 HG LEU 9 HG LEU 9 28.199 5.996 -6.132
81 HD11 LEU 9 1HD1 LEU 9 30.387 5.750 -4.676
82 HD12 LEU 9 2HD1 LEU 9 29.541 4.325 -4.075
83 HD13 LEU 9 3HD1 LEU 9 28.796 5.917 -3.933
84 HD21 LEU 9 1HD2 LEU 9 29.363 4.515 -7.879
85 HD22 LEU 9 2HD2 LEU 9 30.593 4.263 -6.641
86 HD23 LEU 9 3HD2 LEU 9 30.253 5.892 -7.229
87 HA PRO 10 HA PRO 10 26.414 8.193 -5.087
88 HB2 PRO 10 1HB PRO 10 24.723 8.854 -7.105
89 HB3 PRO 10 2HB PRO 10 26.438 8.513 -7.362
90 HG2 PRO 10 1HG PRO 10 24.070 6.727 -7.770
91 HG3 PRO 10 2HG PRO 10 25.494 6.951 -8.803
92 HD2 PRO 10 1HD PRO 10 25.227 4.842 -7.126
93 HD3 PRO 10 2HD PRO 10 26.804 5.560 -7.514
94 H LEU 11 H LEU 11 24.020 5.902 -4.668
95 HA LEU 11 HA LEU 11 22.067 7.899 -3.741
96 HB2 LEU 11 1HB LEU 11 21.833 5.279 -5.031
97 HB3 LEU 11 2HB LEU 11 20.754 5.508 -3.657
98 HG LEU 11 HG LEU 11 19.852 7.535 -4.747
99 HD11 LEU 11 1HD1 LEU 11 22.123 7.497 -6.245
100 HD12 LEU 11 2HD1 LEU 11 20.671 8.418 -6.635
101 HD13 LEU 11 3HD1 LEU 11 20.940 6.840 -7.375
102 HD21 LEU 11 1HD2 LEU 11 18.423 6.389 -6.199
103 HD22 LEU 11 2HD2 LEU 11 18.947 5.159 -5.049
104 HD23 LEU 11 3HD2 LEU 11 19.669 5.227 -6.657
105 H LEU 12 H LEU 12 24.118 5.279 -2.788
106 HA LEU 12 HA LEU 12 22.911 4.615 -0.332
107 HB2 LEU 12 1HB LEU 12 24.984 3.637 -1.761
108 HB3 LEU 12 2HB LEU 12 25.852 4.487 -0.484
109 HG LEU 12 HG LEU 12 24.268 1.999 -0.377
110 HD11 LEU 12 1HD1 LEU 12 26.563 3.089 1.246
111 HD12 LEU 12 2HD1 LEU 12 26.698 2.027 -0.154
112 HD13 LEU 12 3HD1 LEU 12 25.926 1.446 1.321
113 HD21 LEU 12 1HD2 LEU 12 24.067 4.153 1.697
114 HD22 LEU 12 2HD2 LEU 12 23.959 2.449 2.140
115 HD23 LEU 12 3HD2 LEU 12 22.793 3.144 1.012
116 H LYS 13 H LYS 13 25.495 6.914 -1.135
117 HA LYS 13 HA LYS 13 26.086 7.784 1.443
118 HB2 LYS 13 1HB LYS 13 26.680 9.989 0.190
119 HB3 LYS 13 2HB LYS 13 27.589 8.524 -0.160
120 HG2 LYS 13 1HG LYS 13 27.010 8.604 -2.295
121 HG3 LYS 13 2HG LYS 13 25.297 8.702 -1.880
122 HD2 LYS 13 1HD LYS 13 25.227 10.920 -2.218
123 HD3 LYS 13 2HD LYS 13 26.774 11.184 -1.410
124 HE2 LYS 13 1HE LYS 13 27.696 10.028 -3.607
125 HE3 LYS 13 2HE LYS 13 26.185 10.644 -4.274
126 HZ1 LYS 13 1HZ LYS 13 28.567 12.044 -3.732
127 HZ2 LYS 13 2HZ LYS 13 27.324 12.699 -2.791
128 HZ3 LYS 13 3HZ LYS 13 27.154 12.608 -4.472
129 H ILE 14 H ILE 14 23.423 8.580 -0.662
130 HA ILE 14 HA ILE 14 22.547 10.939 0.585
131 HB ILE 14 HB ILE 14 20.762 8.883 -0.713
132 HG12 ILE 14 1HG1 ILE 14 22.598 10.944 -1.913
133 HG13 ILE 14 2HG1 ILE 14 22.437 9.241 -2.329
134 HG21 ILE 14 1HG2 ILE 14 19.521 10.594 0.409
135 HG22 ILE 14 2HG2 ILE 14 20.526 11.857 -0.299
136 HG23 ILE 14 3HG2 ILE 14 19.446 10.911 -1.324
137 HD11 ILE 14 1HD1 ILE 14 20.009 9.978 -3.003
138 HD12 ILE 14 2HD1 ILE 14 20.776 11.560 -3.142
139 HD13 ILE 14 3HD1 ILE 14 21.374 10.202 -4.095
140 H LEU 15 H LEU 15 21.396 7.591 1.026
141 HA LEU 15 HA LEU 15 19.688 8.204 3.194
142 HB2 LEU 15 1HB LEU 15 20.939 5.617 2.298
143 HB3 LEU 15 2HB LEU 15 19.760 5.729 3.603
144 HG LEU 15 HG LEU 15 18.712 4.977 1.543
145 HD11 LEU 15 1HD1 LEU 15 17.894 7.807 2.176
146 HD12 LEU 15 2HD1 LEU 15 17.455 6.394 3.136
147 HD13 LEU 15 3HD1 LEU 15 16.888 6.540 1.472
148 HD21 LEU 15 1HD2 LEU 15 19.507 7.631 0.356
149 HD22 LEU 15 2HD2 LEU 15 18.628 6.323 -0.436
150 HD23 LEU 15 3HD2 LEU 15 20.320 6.104 0.011
151 H HIS 16 H HIS 16 23.011 6.996 3.025
152 HA HIS 16 HA HIS 16 23.433 6.470 5.721
153 HB2 HIS 16 1HB HIS 16 25.230 7.262 3.460
154 HB3 HIS 16 2HB HIS 16 25.882 7.187 5.094
155 HD1 HIS 16 HD1 HIS 16 27.364 5.159 4.636
156 HD2 HIS 16 HD2 HIS 16 23.342 4.482 3.850
157 HE1 HIS 16 HE1 HIS 16 27.153 2.675 4.305
158 H ALA 17 H ALA 17 23.995 9.495 3.935
159 HA ALA 17 HA ALA 17 24.884 10.990 6.154
160 HB1 ALA 17 1HB ALA 17 25.438 12.209 4.363
161 HB2 ALA 17 2HB ALA 17 24.141 11.526 3.381
162 HB3 ALA 17 3HB ALA 17 23.804 12.864 4.480
163 H ALA 18 H ALA 18 21.814 9.822 5.361
164 HA ALA 18 HA ALA 18 20.413 11.918 6.846
165 HB1 ALA 18 1HB ALA 18 18.468 10.175 6.132
166 HB2 ALA 18 2HB ALA 18 19.005 11.529 5.138
167 HB3 ALA 18 3HB ALA 18 19.643 9.912 4.844
168 H GLY 19 H GLY 19 22.168 9.443 7.769
169 HA2 GLY 19 1HA GLY 19 22.177 8.680 10.026
170 HA3 GLY 19 2HA GLY 19 20.431 8.873 10.066
171 H ALA 20 H ALA 20 21.455 7.420 7.205
172 HA ALA 20 HA ALA 20 20.472 4.834 8.144
173 HB1 ALA 20 1HB ALA 20 19.830 6.176 5.928
174 HB2 ALA 20 2HB ALA 20 21.177 5.227 5.297
175 HB3 ALA 20 3HB ALA 20 19.790 4.415 6.023
176 H GLN 21 H GLN 21 21.588 2.930 6.842
177 HA GLN 21 HA GLN 21 24.250 2.958 6.128
178 HB2 GLN 21 1HB GLN 21 24.038 3.505 8.850
179 HB3 GLN 21 2HB GLN 21 24.462 1.799 8.784
180 HG2 GLN 21 1HG GLN 21 26.572 2.374 8.485
181 HG3 GLN 21 2HG GLN 21 26.130 3.091 6.936
182 HE21 GLN 21 2HE2 GLN 21 25.642 5.327 6.861
183 HE22 GLN 21 1HE2 GLN 21 26.252 6.408 8.062
184 H GLY 22 H GLY 22 24.443 1.131 5.024
185 HA2 GLY 22 1HA GLY 22 24.403 -1.426 5.781
186 HA3 GLY 22 2HA GLY 22 22.681 -1.105 5.633
187 H GLU 23 H GLU 23 21.753 -1.282 3.684
188 HA GLU 23 HA GLU 23 22.917 -0.700 1.221
189 HB2 GLU 23 1HB GLU 23 23.689 -3.272 2.299
190 HB3 GLU 23 2HB GLU 23 22.803 -3.466 0.793
191 HG2 GLU 23 1HG GLU 23 24.368 -2.212 -0.419
192 HG3 GLU 23 2HG GLU 23 25.099 -1.556 1.044
193 H MET 24 H MET 24 20.645 -2.647 3.039
194 HA MET 24 HA MET 24 18.737 -2.471 0.803
195 HB2 MET 24 1HB MET 24 17.890 -4.212 2.953
196 HB3 MET 24 2HB MET 24 18.107 -4.571 1.245
197 HG2 MET 24 1HG MET 24 19.597 -6.016 2.208
198 HG3 MET 24 2HG MET 24 20.631 -4.634 1.854
199 HE1 MET 24 1HE MET 24 22.442 -5.347 5.028
200 HE2 MET 24 2HE MET 24 22.305 -5.732 3.313
201 HE3 MET 24 3HE MET 24 22.463 -4.053 3.830
202 H PHE 25 H PHE 25 16.710 -1.618 1.123
203 HA PHE 25 HA PHE 25 15.754 -0.881 3.723
204 HB2 PHE 25 1HB PHE 25 16.535 1.341 1.824
205 HB3 PHE 25 2HB PHE 25 15.736 1.537 3.381
206 HD1 PHE 25 HD1 PHE 25 18.878 0.511 1.741
207 HD2 PHE 25 HD2 PHE 25 16.968 1.576 5.392
208 HE1 PHE 25 HE1 PHE 25 21.074 0.669 2.840
209 HE2 PHE 25 HE2 PHE 25 19.160 1.736 6.497
210 HZ PHE 25 HZ PHE 25 21.217 1.283 5.220
211 H THR 26 H THR 26 13.608 0.014 3.669
212 HA THR 26 HA THR 26 12.170 -0.779 1.245
213 HB THR 26 HB THR 26 10.271 -0.084 3.156
214 HG1 THR 26 1HG THR 26 11.966 -1.802 4.548
215 HG21 THR 26 1HG2 THR 26 11.468 -2.717 2.323
216 HG22 THR 26 2HG2 THR 26 9.966 -1.974 1.773
217 HG23 THR 26 3HG2 THR 26 10.086 -2.609 3.413
218 H VAL 27 H VAL 27 9.980 0.595 1.098
219 HA VAL 27 HA VAL 27 10.708 3.112 0.103
220 HB VAL 27 HB VAL 27 7.894 2.570 0.963
221 HG11 VAL 27 1HG1 VAL 27 7.789 3.452 -1.579
222 HG12 VAL 27 2HG1 VAL 27 7.813 4.519 -0.173
223 HG13 VAL 27 3HG1 VAL 27 9.304 4.189 -1.057
224 HG21 VAL 27 1HG2 VAL 27 7.740 1.365 -1.339
225 HG22 VAL 27 2HG2 VAL 27 9.460 1.063 -1.091
226 HG23 VAL 27 3HG2 VAL 27 8.283 0.469 0.080
227 H LYS 28 H LYS 28 9.206 2.169 3.166
228 HA LYS 28 HA LYS 28 8.710 4.758 4.141
229 HB2 LYS 28 1HB LYS 28 8.961 2.046 5.351
230 HB3 LYS 28 2HB LYS 28 9.026 3.434 6.430
231 HG2 LYS 28 1HG LYS 28 6.813 3.399 6.458
232 HG3 LYS 28 2HG LYS 28 6.849 3.933 4.776
233 HD2 LYS 28 1HD LYS 28 5.463 1.902 5.157
234 HD3 LYS 28 2HD LYS 28 6.768 1.664 3.993
235 HE2 LYS 28 1HE LYS 28 7.867 0.207 5.326
236 HE3 LYS 28 2HE LYS 28 7.425 1.062 6.803
237 HZ1 LYS 28 1HZ LYS 28 6.247 -1.237 5.679
238 HZ2 LYS 28 2HZ LYS 28 5.089 -0.007 5.751
239 HZ3 LYS 28 3HZ LYS 28 5.902 -0.486 7.155
240 H GLU 29 H GLU 29 11.509 2.612 4.518
241 HA GLU 29 HA GLU 29 12.976 4.249 6.264
242 HB2 GLU 29 1HB GLU 29 13.500 1.905 4.580
243 HB3 GLU 29 2HB GLU 29 14.903 2.939 4.810
244 HG2 GLU 29 1HG GLU 29 13.223 1.866 7.061
245 HG3 GLU 29 2HG GLU 29 14.687 1.088 6.459
246 H VAL 30 H VAL 30 13.285 3.875 2.731
247 HA VAL 30 HA VAL 30 15.225 5.788 2.272
248 HB VAL 30 HB VAL 30 12.880 5.187 0.464
249 HG11 VAL 30 1HG1 VAL 30 15.575 6.432 -0.023
250 HG12 VAL 30 2HG1 VAL 30 14.569 5.780 -1.318
251 HG13 VAL 30 3HG1 VAL 30 13.984 7.123 -0.336
252 HG21 VAL 30 1HG2 VAL 30 13.837 3.249 -0.154
253 HG22 VAL 30 2HG2 VAL 30 15.471 3.902 -0.046
254 HG23 VAL 30 3HG2 VAL 30 14.643 3.353 1.411
255 H MET 31 H MET 31 11.704 6.216 2.428
256 HA MET 31 HA MET 31 11.721 8.981 1.827
257 HB2 MET 31 1HB MET 31 9.543 8.524 1.681
258 HB3 MET 31 2HB MET 31 9.781 6.977 2.483
259 HG2 MET 31 1HG MET 31 8.155 8.227 3.700
260 HG3 MET 31 2HG MET 31 9.628 8.132 4.663
261 HE1 MET 31 1HE MET 31 10.117 10.435 1.705
262 HE2 MET 31 2HE MET 31 8.354 10.401 1.685
263 HE3 MET 31 3HE MET 31 9.202 11.893 2.092
264 H HIS 32 H HIS 32 11.727 7.186 4.881
265 HA HIS 32 HA HIS 32 11.512 9.414 6.589
266 HB2 HIS 32 1HB HIS 32 11.374 6.805 7.039
267 HB3 HIS 32 2HB HIS 32 13.075 7.017 7.441
268 HD1 HIS 32 HD1 HIS 32 9.965 6.890 9.052
269 HD2 HIS 32 HD2 HIS 32 13.246 9.420 9.371
270 HE1 HIS 32 HE1 HIS 32 9.759 7.976 11.311
271 H TYR 33 H TYR 33 14.220 7.974 4.929
272 HA TYR 33 HA TYR 33 16.238 9.322 6.448
273 HB2 TYR 33 1HB TYR 33 16.253 7.798 3.850
274 HB3 TYR 33 2HB TYR 33 17.690 8.624 4.443
275 HD1 TYR 33 HD2 TYR 33 18.162 8.081 7.057
276 HD2 TYR 33 HD1 TYR 33 16.104 5.553 4.323
277 HE1 TYR 33 HE2 TYR 33 18.708 6.133 8.456
278 HE2 TYR 33 HE1 TYR 33 16.644 3.598 5.714
279 HH TYR 33 HH TYR 33 17.515 3.702 8.771
280 H LEU 34 H LEU 34 14.366 10.028 3.592
281 HA LEU 34 HA LEU 34 15.854 11.974 2.346
282 HB2 LEU 34 1HB LEU 34 13.085 11.192 2.447
283 HB3 LEU 34 2HB LEU 34 13.229 12.944 2.323
284 HG LEU 34 HG LEU 34 12.974 11.927 0.129
285 HD11 LEU 34 1HD1 LEU 34 14.211 13.935 0.115
286 HD12 LEU 34 2HD1 LEU 34 15.107 12.808 -0.903
287 HD13 LEU 34 3HD1 LEU 34 15.656 13.140 0.740
288 HD21 LEU 34 1HD2 LEU 34 14.785 10.501 -0.775
289 HD22 LEU 34 2HD2 LEU 34 13.891 9.739 0.541
290 HD23 LEU 34 3HD2 LEU 34 15.489 10.424 0.840
291 H GLY 35 H GLY 35 13.452 12.513 4.932
292 HA2 GLY 35 1HA GLY 35 13.789 15.243 5.247
293 HA3 GLY 35 2HA GLY 35 13.319 14.149 6.539
294 H GLN 36 H GLN 36 15.571 12.639 6.890
295 HA GLN 36 HA GLN 36 17.160 14.281 8.504
296 HB2 GLN 36 1HB GLN 36 17.674 11.532 7.369
297 HB3 GLN 36 2HB GLN 36 18.730 12.306 8.542
298 HG2 GLN 36 1HG GLN 36 16.194 12.509 9.650
299 HG3 GLN 36 2HG GLN 36 16.245 10.897 8.940
300 HE21 GLN 36 2HE2 GLN 36 18.341 13.059 10.822
301 HE22 GLN 36 1HE2 GLN 36 18.909 11.841 11.908
302 H TYR 37 H TYR 37 17.699 13.037 5.234
303 HA TYR 37 HA TYR 37 20.323 13.950 4.898
304 HB2 TYR 37 1HB TYR 37 19.318 12.368 3.351
305 HB3 TYR 37 2HB TYR 37 18.134 13.567 2.846
306 HD1 TYR 37 HD2 TYR 37 21.808 12.949 2.938
307 HD2 TYR 37 HD1 TYR 37 18.572 14.919 1.002
308 HE1 TYR 37 HE2 TYR 37 23.334 13.697 1.160
309 HE2 TYR 37 HE1 TYR 37 20.089 15.672 -0.782
310 HH TYR 37 HH TYR 37 23.433 15.553 -0.522
311 H ILE 38 H ILE 38 17.235 15.505 4.070
312 HA ILE 38 HA ILE 38 18.285 17.846 2.960
313 HB ILE 38 HB ILE 38 15.700 17.580 4.499
314 HG12 ILE 38 1HG1 ILE 38 16.005 17.387 1.512
315 HG13 ILE 38 2HG1 ILE 38 16.163 15.963 2.534
316 HG21 ILE 38 1HG2 ILE 38 14.960 19.519 3.365
317 HG22 ILE 38 2HG2 ILE 38 16.564 19.898 3.992
318 HG23 ILE 38 3HG2 ILE 38 16.354 19.508 2.285
319 HD11 ILE 38 1HD1 ILE 38 13.962 15.798 2.087
320 HD12 ILE 38 2HD1 ILE 38 13.841 16.900 3.459
321 HD13 ILE 38 3HD1 ILE 38 13.773 17.530 1.813
322 H MET 39 H MET 39 17.235 17.196 6.300
323 HA MET 39 HA MET 39 17.856 19.730 7.334
324 HB2 MET 39 1HB MET 39 17.003 18.862 9.209
325 HB3 MET 39 2HB MET 39 16.784 17.359 8.323
326 HG2 MET 39 1HG MET 39 18.936 16.560 9.077
327 HG3 MET 39 2HG MET 39 19.243 18.092 9.893
328 HE1 MET 39 1HE MET 39 17.018 19.041 11.210
329 HE2 MET 39 2HE MET 39 15.646 17.986 10.874
330 HE3 MET 39 3HE MET 39 16.304 18.084 12.508
331 H VAL 40 H VAL 40 19.818 16.879 6.791
332 HA VAL 40 HA VAL 40 22.065 17.745 8.314
333 HB VAL 40 HB VAL 40 21.354 15.393 7.024
334 HG11 VAL 40 1HG1 VAL 40 23.180 14.870 5.522
335 HG12 VAL 40 2HG1 VAL 40 22.310 16.289 4.935
336 HG13 VAL 40 3HG1 VAL 40 23.863 16.480 5.750
337 HG21 VAL 40 1HG2 VAL 40 22.553 15.499 9.105
338 HG22 VAL 40 2HG2 VAL 40 23.496 14.548 7.958
339 HG23 VAL 40 3HG2 VAL 40 23.956 16.214 8.310
340 H LYS 41 H LYS 41 21.088 18.073 4.949
341 HA LYS 41 HA LYS 41 23.582 19.364 4.219
342 HB2 LYS 41 1HB LYS 41 21.144 18.450 2.764
343 HB3 LYS 41 2HB LYS 41 22.116 19.721 2.032
344 HG2 LYS 41 1HG LYS 41 23.054 16.968 2.810
345 HG3 LYS 41 2HG LYS 41 22.785 17.572 1.173
346 HD2 LYS 41 1HD LYS 41 24.940 18.151 1.163
347 HD3 LYS 41 2HD LYS 41 24.507 19.428 2.303
348 HE2 LYS 41 1HE LYS 41 25.270 18.244 4.123
349 HE3 LYS 41 2HE LYS 41 25.045 16.683 3.335
350 HZ1 LYS 41 1HZ LYS 41 27.079 16.755 2.430
351 HZ2 LYS 41 2HZ LYS 41 27.414 17.883 3.645
352 HZ3 LYS 41 3HZ LYS 41 27.004 18.411 2.090
353 H GLN 42 H GLN 42 20.626 20.274 5.563
354 HA GLN 42 HA GLN 42 19.723 22.290 6.104
355 HB2 GLN 42 1HB GLN 42 22.545 22.936 5.517
356 HB3 GLN 42 2HB GLN 42 21.428 24.293 5.455
357 HG2 GLN 42 1HG GLN 42 22.526 23.964 7.656
358 HG3 GLN 42 2HG GLN 42 20.764 23.950 7.713
359 HE21 GLN 42 2HE2 GLN 42 22.636 21.276 6.506
360 HE22 GLN 42 1HE2 GLN 42 22.298 20.191 7.807
361 H LEU 43 H LEU 43 18.482 21.511 4.067
362 HA LEU 43 HA LEU 43 18.524 23.723 2.126
363 HB2 LEU 43 1HB LEU 43 17.897 20.843 1.499
364 HB3 LEU 43 2HB LEU 43 17.914 22.185 0.358
365 HG LEU 43 HG LEU 43 20.441 21.674 1.801
366 HD11 LEU 43 1HD1 LEU 43 19.428 19.801 -0.333
367 HD12 LEU 43 2HD1 LEU 43 19.695 19.394 1.361
368 HD13 LEU 43 3HD1 LEU 43 21.061 19.828 0.334
369 HD21 LEU 43 1HD2 LEU 43 19.564 22.482 -0.948
370 HD22 LEU 43 2HD2 LEU 43 21.221 21.965 -0.637
371 HD23 LEU 43 3HD2 LEU 43 20.560 23.365 0.209
372 H TYR 44 H TYR 44 16.959 24.197 4.121
373 HA TYR 44 HA TYR 44 14.310 24.027 3.028
374 HB2 TYR 44 1HB TYR 44 13.286 22.958 5.007
375 HB3 TYR 44 2HB TYR 44 14.378 21.872 4.157
376 HD1 TYR 44 HD2 TYR 44 16.931 22.108 5.086
377 HD2 TYR 44 HD1 TYR 44 13.379 22.866 7.302
378 HE1 TYR 44 HE2 TYR 44 18.156 21.696 7.178
379 HE2 TYR 44 HE1 TYR 44 14.594 22.457 9.401
380 HH TYR 44 HH TYR 44 16.788 22.397 10.277
381 H ASP 45 H ASP 45 12.734 25.257 4.341
382 HA ASP 45 HA ASP 45 13.963 27.660 5.339
383 HB2 ASP 45 1HB ASP 45 12.024 28.044 4.063
384 HB3 ASP 45 2HB ASP 45 11.119 26.783 4.895
385 H GLN 46 H GLN 46 14.693 27.820 7.347
386 HA GLN 46 HA GLN 46 14.133 26.042 9.428
387 HB2 GLN 46 1HB GLN 46 15.451 28.694 9.205
388 HB3 GLN 46 2HB GLN 46 14.956 28.183 10.814
389 HG2 GLN 46 1HG GLN 46 17.171 27.477 10.607
390 HG3 GLN 46 2HG GLN 46 16.204 26.025 10.351
391 HE21 GLN 46 2HE2 GLN 46 15.439 26.196 7.790
392 HE22 GLN 46 1HE2 GLN 46 16.806 26.195 6.735
393 H GLN 47 H GLN 47 12.359 28.738 8.257
394 HA GLN 47 HA GLN 47 10.839 29.087 10.703
395 HB2 GLN 47 1HB GLN 47 10.085 30.315 8.076
396 HB3 GLN 47 2HB GLN 47 9.872 30.953 9.701
397 HG2 GLN 47 1HG GLN 47 12.277 30.978 7.951
398 HG3 GLN 47 2HG GLN 47 11.565 32.274 8.913
399 HE21 GLN 47 2HE2 GLN 47 13.895 29.809 8.783
400 HE22 GLN 47 1HE2 GLN 47 14.504 29.971 10.391
401 H GLU 48 H GLU 48 10.654 27.279 7.786
402 HA GLU 48 HA GLU 48 8.137 26.112 8.665
403 HB2 GLU 48 1HB GLU 48 8.469 27.174 5.855
404 HB3 GLU 48 2HB GLU 48 7.058 26.351 6.503
405 HG2 GLU 48 1HG GLU 48 6.773 28.217 8.110
406 HG3 GLU 48 2HG GLU 48 8.102 29.054 7.310
407 H GLN 49 H GLN 49 9.576 24.344 9.111
408 HA GLN 49 HA GLN 49 11.263 23.093 7.305
409 HB2 GLN 49 1HB GLN 49 9.582 21.577 9.292
410 HB3 GLN 49 2HB GLN 49 11.202 21.196 8.724
411 HG2 GLN 49 1HG GLN 49 11.205 23.787 9.928
412 HG3 GLN 49 2HG GLN 49 10.459 22.625 11.024
413 HE21 GLN 49 2HE2 GLN 49 12.961 23.987 11.356
414 HE22 GLN 49 1HE2 GLN 49 14.189 22.774 11.445
415 H HIS 50 H HIS 50 7.860 23.297 7.264
416 HA HIS 50 HA HIS 50 7.356 20.891 5.789
417 HB2 HIS 50 1HB HIS 50 5.108 21.572 5.717
418 HB3 HIS 50 2HB HIS 50 5.699 22.213 7.247
419 HD1 HIS 50 HD1 HIS 50 5.486 24.682 7.603
420 HD2 HIS 50 HD2 HIS 50 4.870 23.588 3.643
421 HE1 HIS 50 HE1 HIS 50 4.686 26.767 6.446
422 H MET 51 H MET 51 9.018 23.542 4.937
423 HA MET 51 HA MET 51 8.213 23.305 2.115
424 HB2 MET 51 1HB MET 51 8.915 25.776 3.684
425 HB3 MET 51 2HB MET 51 9.032 25.732 1.930
426 HG2 MET 51 1HG MET 51 6.481 24.750 2.920
427 HG3 MET 51 2HG MET 51 6.814 26.414 3.394
428 HE1 MET 51 1HE MET 51 7.182 25.110 -0.995
429 HE2 MET 51 2HE MET 51 8.594 25.476 -0.004
430 HE3 MET 51 3HE MET 51 7.551 24.116 0.415
431 H VAL 52 H VAL 52 9.832 21.814 1.657
432 HA VAL 52 HA VAL 52 12.539 22.107 2.409
433 HB VAL 52 HB VAL 52 11.292 20.544 0.147
434 HG11 VAL 52 1HG1 VAL 52 13.600 19.279 0.519
435 HG12 VAL 52 2HG1 VAL 52 13.431 20.607 -0.630
436 HG13 VAL 52 3HG1 VAL 52 14.120 20.903 0.967
437 HG21 VAL 52 1HG2 VAL 52 12.452 18.966 2.229
438 HG22 VAL 52 2HG2 VAL 52 11.345 20.141 2.938
439 HG23 VAL 52 3HG2 VAL 52 10.774 19.033 1.691
440 H TYR 53 H TYR 53 14.277 22.998 1.383
441 HA TYR 53 HA TYR 53 13.699 24.595 -1.026
442 HB2 TYR 53 1HB TYR 53 15.134 25.255 1.484
443 HB3 TYR 53 2HB TYR 53 15.840 25.870 -0.006
444 HD1 TYR 53 HD2 TYR 53 12.219 25.414 0.570
445 HD2 TYR 53 HD1 TYR 53 15.441 28.186 0.366
446 HE1 TYR 53 HE2 TYR 53 10.611 27.275 0.582
447 HE2 TYR 53 HE1 TYR 53 13.842 30.055 0.378
448 HH TYR 53 HH TYR 53 10.861 29.917 1.368
449 H CYS 54 H CYS 54 14.327 22.733 -2.286
450 HA CYS 54 HA CYS 54 16.733 21.380 -2.151
451 HB2 CYS 54 1HB CYS 54 16.207 20.508 -4.210
452 HB3 CYS 54 2HB CYS 54 14.632 21.143 -3.748
453 HG CYS 54 HG CYS 54 14.411 22.260 -6.056
454 H GLY 55 H GLY 55 16.001 24.462 -3.726
455 HA2 GLY 55 1HA GLY 55 17.372 26.128 -4.507
456 HA3 GLY 55 2HA GLY 55 18.585 25.496 -3.403
457 H GLY 56 H GLY 56 19.929 23.709 -4.162
458 HA2 GLY 56 1HA GLY 56 19.964 23.140 -6.995
459 HA3 GLY 56 2HA GLY 56 21.289 24.161 -6.456
460 H ASP 57 H ASP 57 20.022 21.813 -4.264
461 HA ASP 57 HA ASP 57 22.565 20.450 -4.210
462 HB2 ASP 57 1HB ASP 57 20.410 20.842 -2.400
463 HB3 ASP 57 2HB ASP 57 20.594 19.106 -2.630
464 H LEU 58 H LEU 58 22.343 17.923 -3.907
465 HA LEU 58 HA LEU 58 21.961 16.768 -6.352
466 HB2 LEU 58 1HB LEU 58 21.931 15.706 -3.571
467 HB3 LEU 58 2HB LEU 58 21.456 14.633 -4.886
468 HG LEU 58 HG LEU 58 23.840 14.429 -4.183
469 HD11 LEU 58 1HD1 LEU 58 23.102 13.714 -6.392
470 HD12 LEU 58 2HD1 LEU 58 24.732 14.382 -6.455
471 HD13 LEU 58 3HD1 LEU 58 23.364 15.342 -7.017
472 HD21 LEU 58 1HD2 LEU 58 24.408 16.675 -3.651
473 HD22 LEU 58 2HD2 LEU 58 23.951 17.241 -5.258
474 HD23 LEU 58 3HD2 LEU 58 25.374 16.218 -5.054
475 H LEU 59 H LEU 59 19.605 16.799 -3.681
476 HA LEU 59 HA LEU 59 17.551 15.457 -5.035
477 HB2 LEU 59 1HB LEU 59 16.270 15.886 -3.213
478 HB3 LEU 59 2HB LEU 59 17.858 16.213 -2.524
479 HG LEU 59 HG LEU 59 16.053 18.364 -3.617
480 HD11 LEU 59 1HD1 LEU 59 16.416 17.872 -0.699
481 HD12 LEU 59 2HD1 LEU 59 15.216 16.940 -1.594
482 HD13 LEU 59 3HD1 LEU 59 15.111 18.699 -1.550
483 HD21 LEU 59 1HD2 LEU 59 17.857 19.170 -1.555
484 HD22 LEU 59 2HD2 LEU 59 17.761 19.724 -3.227
485 HD23 LEU 59 3HD2 LEU 59 18.756 18.326 -2.816
486 H GLY 60 H GLY 60 18.390 18.883 -4.872
487 HA2 GLY 60 1HA GLY 60 16.102 19.926 -6.114
488 HA3 GLY 60 2HA GLY 60 17.689 20.681 -6.113
489 H GLU 61 H GLU 61 19.172 18.838 -7.534
490 HA GLU 61 HA GLU 61 18.475 19.507 -10.197
491 HB2 GLU 61 1HB GLU 61 20.535 18.733 -10.748
492 HB3 GLU 61 2HB GLU 61 20.784 18.813 -9.010
493 HG2 GLU 61 1HG GLU 61 20.283 16.455 -8.797
494 HG3 GLU 61 2HG GLU 61 19.937 16.353 -10.523
495 H LEU 62 H LEU 62 18.379 16.448 -8.394
496 HA LEU 62 HA LEU 62 17.473 14.811 -10.466
497 HB2 LEU 62 1HB LEU 62 17.806 14.638 -7.621
498 HB3 LEU 62 2HB LEU 62 16.284 13.885 -8.094
499 HG LEU 62 HG LEU 62 18.161 12.287 -7.943
500 HD11 LEU 62 1HD1 LEU 62 16.180 12.077 -9.536
501 HD12 LEU 62 2HD1 LEU 62 17.598 11.082 -9.869
502 HD13 LEU 62 3HD1 LEU 62 17.308 12.546 -10.809
503 HD21 LEU 62 1HD2 LEU 62 19.904 13.909 -8.704
504 HD22 LEU 62 2HD2 LEU 62 19.281 13.724 -10.344
505 HD23 LEU 62 3HD2 LEU 62 19.971 12.337 -9.501
506 H LEU 63 H LEU 63 15.720 16.909 -8.252
507 HA LEU 63 HA LEU 63 13.130 16.010 -9.120
508 HB2 LEU 63 1HB LEU 63 14.192 17.653 -7.041
509 HB3 LEU 63 2HB LEU 63 12.947 18.556 -7.901
510 HG LEU 63 HG LEU 63 12.404 15.782 -6.906
511 HD11 LEU 63 1HD1 LEU 63 11.981 18.286 -5.290
512 HD12 LEU 63 2HD1 LEU 63 13.317 17.164 -5.035
513 HD13 LEU 63 3HD1 LEU 63 11.655 16.622 -4.807
514 HD21 LEU 63 1HD2 LEU 63 10.946 17.372 -8.478
515 HD22 LEU 63 2HD2 LEU 63 10.417 17.976 -6.907
516 HD23 LEU 63 3HD2 LEU 63 10.226 16.268 -7.306
517 H GLY 64 H GLY 64 15.321 18.637 -9.905
518 HA2 GLY 64 1HA GLY 64 15.374 19.921 -11.835
519 HA3 GLY 64 2HA GLY 64 13.897 19.128 -12.363
520 H ARG 65 H ARG 65 13.361 20.173 -9.284
521 HA ARG 65 HA ARG 65 11.977 22.563 -10.271
522 HB2 ARG 65 1HB ARG 65 11.578 21.307 -7.567
523 HB3 ARG 65 2HB ARG 65 10.478 22.343 -8.466
524 HG2 ARG 65 1HG ARG 65 11.123 19.454 -8.930
525 HG3 ARG 65 2HG ARG 65 9.556 20.202 -8.615
526 HD2 ARG 65 1HD ARG 65 9.486 21.173 -10.775
527 HD3 ARG 65 2HD ARG 65 11.181 20.795 -11.075
528 HE ARG 65 HE ARG 65 10.098 18.359 -10.724
529 HH11 ARG 65 1HH1 ARG 65 9.181 21.075 -12.699
530 HH12 ARG 65 2HH1 ARG 65 8.464 20.100 -13.938
531 HH21 ARG 65 1HH2 ARG 65 9.157 17.063 -12.349
532 HH22 ARG 65 2HH2 ARG 65 8.450 17.817 -13.737
533 H GLN 66 H GLN 66 11.650 23.644 -7.590
534 HA GLN 66 HA GLN 66 14.394 24.573 -7.060
535 HB2 GLN 66 1HB GLN 66 11.989 26.350 -6.755
536 HB3 GLN 66 2HB GLN 66 13.684 26.806 -6.855
537 HG2 GLN 66 1HG GLN 66 13.355 25.609 -9.251
538 HG3 GLN 66 2HG GLN 66 11.740 26.264 -8.987
539 HE21 GLN 66 2HE2 GLN 66 11.493 28.138 -9.946
540 HE22 GLN 66 1HE2 GLN 66 12.680 29.385 -10.080
541 H SER 67 H SER 67 11.132 24.143 -5.757
542 HA SER 67 HA SER 67 12.223 23.331 -3.213
543 HB2 SER 67 1HB SER 67 11.564 25.081 -1.888
544 HB3 SER 67 2HB SER 67 11.868 25.981 -3.374
545 HG SER 67 HG SER 67 9.861 26.580 -2.730
546 H PHE 68 H PHE 68 10.750 22.191 -1.939
547 HA PHE 68 HA PHE 68 8.034 21.866 -2.984
548 HB2 PHE 68 1HB PHE 68 8.243 19.387 -2.742
549 HB3 PHE 68 2HB PHE 68 9.242 20.060 -4.025
550 HD1 PHE 68 HD2 PHE 68 9.282 18.678 -0.611
551 HD2 PHE 68 HD1 PHE 68 11.602 19.884 -3.970
552 HE1 PHE 68 HE2 PHE 68 11.263 17.603 0.376
553 HE2 PHE 68 HE1 PHE 68 13.586 18.809 -2.989
554 HZ PHE 68 HZ PHE 68 13.419 17.668 -0.813
555 H SER 69 H SER 69 6.503 21.214 -1.463
556 HA SER 69 HA SER 69 7.236 21.786 1.279
557 HB2 SER 69 1HB SER 69 4.546 21.002 1.214
558 HB3 SER 69 2HB SER 69 5.168 22.652 1.231
559 HG SER 69 HG SER 69 4.551 21.070 -1.042
560 H VAL 70 H VAL 70 7.350 20.365 2.933
561 HA VAL 70 HA VAL 70 7.569 17.575 2.308
562 HB VAL 70 HB VAL 70 8.629 17.340 4.291
563 HG11 VAL 70 1HG1 VAL 70 9.903 19.233 4.856
564 HG12 VAL 70 2HG1 VAL 70 9.483 19.454 3.157
565 HG13 VAL 70 3HG1 VAL 70 8.609 20.342 4.405
566 HG21 VAL 70 1HG2 VAL 70 6.503 19.135 5.417
567 HG22 VAL 70 2HG2 VAL 70 6.811 17.434 5.765
568 HG23 VAL 70 3HG2 VAL 70 7.918 18.670 6.361
569 H LYS 71 H LYS 71 5.189 19.639 3.828
570 HA LYS 71 HA LYS 71 3.625 17.521 4.937
571 HB2 LYS 71 1HB LYS 71 3.705 20.171 5.386
572 HB3 LYS 71 2HB LYS 71 2.334 20.112 4.286
573 HG2 LYS 71 1HG LYS 71 1.182 19.813 6.192
574 HG3 LYS 71 2HG LYS 71 1.653 18.128 5.959
575 HD2 LYS 71 1HD LYS 71 2.077 18.853 8.253
576 HD3 LYS 71 2HD LYS 71 3.585 18.464 7.421
577 HE2 LYS 71 1HE LYS 71 4.363 20.518 7.764
578 HE3 LYS 71 2HE LYS 71 2.927 21.232 7.033
579 HZ1 LYS 71 1HZ LYS 71 3.572 21.614 9.557
580 HZ2 LYS 71 2HZ LYS 71 2.658 20.204 9.748
581 HZ3 LYS 71 3HZ LYS 71 1.963 21.571 9.035
582 H ASP 72 H ASP 72 4.095 18.621 1.799
583 HA ASP 72 HA ASP 72 1.579 17.361 0.924
584 HB2 ASP 72 1HB ASP 72 1.581 19.807 0.526
585 HB3 ASP 72 2HB ASP 72 3.036 19.628 -0.451
586 HA PRO 73 HA PRO 73 4.925 14.763 -0.778
587 HB2 PRO 73 1HB PRO 73 3.417 12.507 -0.839
588 HB3 PRO 73 2HB PRO 73 4.255 13.063 0.614
589 HG2 PRO 73 1HG PRO 73 1.381 13.388 -0.157
590 HG3 PRO 73 2HG PRO 73 2.075 12.960 1.417
591 HD2 PRO 73 1HD PRO 73 1.222 15.462 0.833
592 HD3 PRO 73 2HD PRO 73 2.583 15.149 1.930
593 H SER 74 H SER 74 3.925 16.482 -2.530
594 HA SER 74 HA SER 74 2.449 14.995 -4.573
595 HB2 SER 74 1HB SER 74 2.805 17.840 -3.902
596 HB3 SER 74 2HB SER 74 2.829 17.488 -5.630
597 HG SER 74 HG SER 74 0.827 16.343 -4.039
598 HA PRO 75 HA PRO 75 6.251 16.349 -7.162
599 HB2 PRO 75 1HB PRO 75 8.132 17.913 -5.984
600 HB3 PRO 75 2HB PRO 75 6.708 18.572 -6.798
601 HG2 PRO 75 1HG PRO 75 7.185 18.131 -3.876
602 HG3 PRO 75 2HG PRO 75 6.447 19.521 -4.692
603 HD2 PRO 75 1HD PRO 75 4.979 17.600 -3.472
604 HD3 PRO 75 2HD PRO 75 4.407 18.470 -4.910
605 H LEU 76 H LEU 76 6.779 15.667 -3.766
606 HA LEU 76 HA LEU 76 9.356 14.599 -3.883
607 HB2 LEU 76 1HB LEU 76 8.225 15.101 -1.791
608 HB3 LEU 76 2HB LEU 76 7.047 13.829 -2.104
609 HG LEU 76 HG LEU 76 9.327 12.389 -2.161
610 HD11 LEU 76 1HD1 LEU 76 10.994 13.769 -1.517
611 HD12 LEU 76 2HD1 LEU 76 10.395 13.369 0.092
612 HD13 LEU 76 3HD1 LEU 76 9.905 14.877 -0.681
613 HD21 LEU 76 1HD2 LEU 76 8.275 12.915 0.547
614 HD22 LEU 76 2HD2 LEU 76 8.476 11.392 -0.320
615 HD23 LEU 76 3HD2 LEU 76 7.096 12.433 -0.672
616 H TYR 77 H TYR 77 6.245 12.855 -3.978
617 HA TYR 77 HA TYR 77 7.348 10.331 -4.526
618 HB2 TYR 77 1HB TYR 77 4.626 11.542 -4.804
619 HB3 TYR 77 2HB TYR 77 4.938 9.969 -5.529
620 HD1 TYR 77 HD1 TYR 77 5.839 8.120 -4.007
621 HD2 TYR 77 HD2 TYR 77 4.130 11.723 -2.524
622 HE1 TYR 77 HE1 TYR 77 5.460 7.038 -1.830
623 HE2 TYR 77 HE2 TYR 77 3.748 10.652 -0.344
624 HH TYR 77 HH TYR 77 4.740 8.723 0.959
625 H ASP 78 H ASP 78 6.207 12.908 -6.652
626 HA ASP 78 HA ASP 78 6.267 11.581 -9.088
627 HB2 ASP 78 1HB ASP 78 5.755 14.141 -8.309
628 HB3 ASP 78 2HB ASP 78 7.290 14.346 -9.149
629 H MET 79 H MET 79 8.898 13.122 -7.301
630 HA MET 79 HA MET 79 10.851 12.692 -9.342
631 HB2 MET 79 1HB MET 79 11.182 14.486 -7.769
632 HB3 MET 79 2HB MET 79 11.110 13.372 -6.411
633 HG2 MET 79 1HG MET 79 13.149 12.273 -7.707
634 HG3 MET 79 2HG MET 79 13.315 13.923 -8.304
635 HE1 MET 79 1HE MET 79 11.997 13.506 -4.380
636 HE2 MET 79 2HE MET 79 12.335 12.009 -5.249
637 HE3 MET 79 3HE MET 79 13.416 12.545 -3.962
638 H LEU 80 H LEU 80 10.171 11.121 -6.221
639 HA LEU 80 HA LEU 80 12.167 9.197 -6.280
640 HB2 LEU 80 1HB LEU 80 9.371 8.932 -5.183
641 HB3 LEU 80 2HB LEU 80 10.731 7.884 -4.784
642 HG LEU 80 HG LEU 80 10.576 10.830 -4.152
643 HD11 LEU 80 1HD1 LEU 80 9.057 10.005 -2.665
644 HD12 LEU 80 2HD1 LEU 80 10.543 9.710 -1.762
645 HD13 LEU 80 3HD1 LEU 80 9.776 8.394 -2.651
646 HD21 LEU 80 1HD2 LEU 80 12.720 10.713 -3.585
647 HD22 LEU 80 2HD2 LEU 80 12.779 9.115 -4.330
648 HD23 LEU 80 3HD2 LEU 80 12.436 9.273 -2.606
649 H ARG 81 H ARG 81 9.114 9.310 -7.972
650 HA ARG 81 HA ARG 81 8.612 6.743 -8.689
651 HB2 ARG 81 1HB ARG 81 7.180 7.701 -10.115
652 HB3 ARG 81 2HB ARG 81 7.857 9.251 -9.634
653 HG2 ARG 81 1HG ARG 81 9.419 9.189 -11.469
654 HG3 ARG 81 2HG ARG 81 8.876 7.570 -11.914
655 HD2 ARG 81 1HD ARG 81 6.729 9.554 -11.727
656 HD3 ARG 81 2HD ARG 81 7.926 9.900 -12.975
657 HE ARG 81 HE ARG 81 7.207 7.213 -13.194
658 HH11 ARG 81 1HH1 ARG 81 5.774 10.362 -13.580
659 HH12 ARG 81 2HH1 ARG 81 4.640 9.843 -14.783
660 HH21 ARG 81 1HH2 ARG 81 5.719 6.517 -14.776
661 HH22 ARG 81 2HH2 ARG 81 4.609 7.655 -15.462
662 H LYS 82 H LYS 82 10.943 8.887 -10.314
663 HA LYS 82 HA LYS 82 12.101 6.524 -11.628
664 HB2 LYS 82 1HB LYS 82 12.509 7.788 -13.450
665 HB3 LYS 82 2HB LYS 82 11.313 8.875 -12.757
666 HG2 LYS 82 1HG LYS 82 14.288 9.088 -12.342
667 HG3 LYS 82 2HG LYS 82 13.347 10.037 -13.496
668 HD2 LYS 82 1HD LYS 82 13.036 10.035 -10.493
669 HD3 LYS 82 2HD LYS 82 13.738 11.323 -11.475
670 HE2 LYS 82 1HE LYS 82 11.250 10.863 -12.615
671 HE3 LYS 82 2HE LYS 82 10.961 10.744 -10.880
672 HZ1 LYS 82 1HZ LYS 82 10.689 12.986 -11.348
673 HZ2 LYS 82 2HZ LYS 82 11.996 13.039 -12.420
674 HZ3 LYS 82 3HZ LYS 82 12.272 12.915 -10.756
675 H ASN 83 H ASN 83 12.548 8.369 -8.964
676 HA ASN 83 HA ASN 83 15.472 8.389 -9.114
677 HB2 ASN 83 1HB ASN 83 14.969 10.416 -8.200
678 HB3 ASN 83 2HB ASN 83 13.442 9.853 -7.527
679 HD21 ASN 83 2HD2 ASN 83 13.752 10.700 -5.514
680 HD22 ASN 83 1HD2 ASN 83 14.950 10.118 -4.414
681 H LEU 84 H LEU 84 12.892 7.312 -6.906
682 HA LEU 84 HA LEU 84 14.518 5.884 -5.139
683 HB2 LEU 84 1HB LEU 84 11.795 6.382 -5.448
684 HB3 LEU 84 2HB LEU 84 11.942 4.627 -5.516
685 HG LEU 84 HG LEU 84 11.505 5.114 -3.268
686 HD11 LEU 84 1HD1 LEU 84 13.456 3.597 -3.705
687 HD12 LEU 84 2HD1 LEU 84 13.432 4.351 -2.111
688 HD13 LEU 84 3HD1 LEU 84 14.509 4.969 -3.363
689 HD21 LEU 84 1HD2 LEU 84 11.757 7.441 -3.127
690 HD22 LEU 84 2HD2 LEU 84 13.448 7.377 -3.623
691 HD23 LEU 84 3HD2 LEU 84 12.973 6.792 -2.028
692 H VAL 85 H VAL 85 14.963 3.659 -4.937
693 HA VAL 85 HA VAL 85 14.836 2.168 -7.478
694 HB VAL 85 HB VAL 85 17.107 2.465 -7.213
695 HG11 VAL 85 1HG1 VAL 85 18.299 2.562 -5.134
696 HG12 VAL 85 2HG1 VAL 85 16.881 3.606 -5.010
697 HG13 VAL 85 3HG1 VAL 85 16.879 2.018 -4.241
698 HG21 VAL 85 1HG2 VAL 85 17.058 0.079 -5.450
699 HG22 VAL 85 2HG2 VAL 85 16.220 -0.030 -6.997
700 HG23 VAL 85 3HG2 VAL 85 17.939 0.360 -6.951
701 H THR 86 H THR 86 12.827 1.230 -6.887
702 HA THR 86 HA THR 86 12.864 -0.565 -4.568
703 HB THR 86 HB THR 86 10.433 -0.798 -4.937
704 HG1 THR 86 1HG THR 86 9.493 0.696 -6.491
705 HG21 THR 86 1HG2 THR 86 9.879 1.691 -4.539
706 HG22 THR 86 2HG2 THR 86 11.624 1.939 -4.618
707 HG23 THR 86 3HG2 THR 86 10.938 0.876 -3.389
708 H LEU 87 H LEU 87 12.204 -2.760 -4.771
709 HA LEU 87 HA LEU 87 12.681 -3.870 -7.457
710 HB2 LEU 87 1HB LEU 87 13.056 -5.279 -4.823
711 HB3 LEU 87 2HB LEU 87 13.550 -5.842 -6.419
712 HG LEU 87 HG LEU 87 15.006 -3.620 -6.329
713 HD11 LEU 87 1HD1 LEU 87 15.394 -2.729 -4.318
714 HD12 LEU 87 2HD1 LEU 87 15.463 -4.304 -3.529
715 HD13 LEU 87 3HD1 LEU 87 13.904 -3.535 -3.827
716 HD21 LEU 87 1HD2 LEU 87 15.838 -6.107 -4.847
717 HD22 LEU 87 2HD2 LEU 87 16.873 -4.968 -5.710
718 HD23 LEU 87 3HD2 LEU 87 15.750 -5.993 -6.605
719 H ALA 88 H ALA 88 10.605 -3.982 -8.220
720 HA ALA 88 HA ALA 88 9.060 -6.183 -7.801
721 HB1 ALA 88 1HB ALA 88 8.714 -4.297 -5.639
722 HB2 ALA 88 2HB ALA 88 7.193 -4.607 -6.477
723 HB3 ALA 88 3HB ALA 88 8.117 -5.949 -5.801
724 H THR 89 H THR 89 9.278 -5.434 -10.088
725 HA THR 89 HA THR 89 6.790 -4.422 -11.013
726 HB THR 89 HB THR 89 8.275 -2.342 -10.314
727 HG1 THR 89 1HG THR 89 7.009 -1.190 -11.712
728 HG21 THR 89 1HG2 THR 89 10.186 -3.091 -11.738
729 HG22 THR 89 2HG2 THR 89 9.608 -1.468 -12.114
730 HG23 THR 89 3HG2 THR 89 9.173 -2.822 -13.155
731 H1 SER 115 H SER 115 1.023 24.454 10.447
732 HA SER 115 HA SER 115 1.991 25.519 8.681
733 HB2 SER 115 1HB SER 115 0.782 27.840 10.145
734 HB3 SER 115 2HB SER 115 1.874 28.139 8.792
735 HG SER 115 HG SER 115 -0.446 27.941 8.296
736 H GLN 116 H GLN 116 3.340 25.006 11.354
737 HA GLN 116 HA GLN 116 5.921 25.819 10.643
738 HB2 GLN 116 1HB GLN 116 4.925 28.046 11.342
739 HB3 GLN 116 2HB GLN 116 4.852 27.402 12.977
740 HG2 GLN 116 1HG GLN 116 7.050 27.653 13.313
741 HG3 GLN 116 2HG GLN 116 7.464 27.141 11.678
742 HE21 GLN 116 2HE2 GLN 116 6.199 28.925 10.116
743 HE22 GLN 116 1HE2 GLN 116 6.795 30.521 10.402
744 H GLU 117 H GLU 117 6.074 23.566 11.146
745 HA GLU 117 HA GLU 117 6.417 23.084 14.029
746 HB2 GLU 117 1HB GLU 117 4.850 21.536 12.042
747 HB3 GLU 117 2HB GLU 117 5.805 20.605 13.187
748 HG2 GLU 117 1HG GLU 117 4.575 21.302 14.995
749 HG3 GLU 117 2HG GLU 117 4.045 22.783 14.199
750 H THR 118 H THR 118 7.624 20.808 14.224
751 HA THR 118 HA THR 118 10.158 21.220 12.889
752 HB THR 118 HB THR 118 9.235 19.441 15.120
753 HG1 THR 118 1HG THR 118 10.138 21.048 16.146
754 HG21 THR 118 1HG2 THR 118 10.578 17.917 13.904
755 HG22 THR 118 2HG2 THR 118 11.623 18.573 15.164
756 HG23 THR 118 3HG2 THR 118 11.762 19.161 13.507
757 H PHE 119 H PHE 119 11.238 19.700 11.606
758 HA PHE 119 HA PHE 119 9.896 18.469 9.594
759 HB2 PHE 119 1HB PHE 119 12.547 18.622 10.377
760 HB3 PHE 119 2HB PHE 119 12.227 16.891 10.375
761 HD1 PHE 119 HD2 PHE 119 10.021 17.370 8.108
762 HD2 PHE 119 HD1 PHE 119 14.159 18.261 8.552
763 HE1 PHE 119 HE2 PHE 119 10.290 17.324 5.663
764 HE2 PHE 119 HE1 PHE 119 14.435 18.218 6.107
765 HZ PHE 119 HZ PHE 119 12.499 17.748 4.659
766 H SER 120 H SER 120 11.147 16.744 12.457
767 HA SER 120 HA SER 120 10.048 14.260 11.921
768 HB2 SER 120 1HB SER 120 11.377 15.497 14.097
769 HB3 SER 120 2HB SER 120 9.924 14.738 14.748
770 HG SER 120 HG SER 120 11.783 13.336 14.645
771 H ASP 121 H ASP 121 8.500 17.155 12.962
772 HA ASP 121 HA ASP 121 6.155 15.909 14.043
773 HB2 ASP 121 1HB ASP 121 7.232 18.510 13.991
774 HB3 ASP 121 2HB ASP 121 5.688 18.611 13.149
775 H LEU 122 H LEU 122 6.744 17.803 11.077
776 HA LEU 122 HA LEU 122 4.232 16.960 9.941
777 HB2 LEU 122 1HB LEU 122 5.548 18.115 7.880
778 HB3 LEU 122 2HB LEU 122 4.584 18.990 9.068
779 HG LEU 122 HG LEU 122 7.519 18.575 9.502
780 HD11 LEU 122 1HD1 LEU 122 6.941 21.158 8.399
781 HD12 LEU 122 2HD1 LEU 122 6.463 19.894 7.266
782 HD13 LEU 122 3HD1 LEU 122 8.118 19.954 7.874
783 HD21 LEU 122 1HD2 LEU 122 5.881 20.963 10.248
784 HD22 LEU 122 2HD2 LEU 122 7.339 20.321 11.007
785 HD23 LEU 122 3HD2 LEU 122 5.796 19.491 11.215
786 H TRP 123 H TRP 123 7.666 16.488 9.123
787 HA TRP 123 HA TRP 123 7.647 14.981 6.927
788 HB2 TRP 123 1HB TRP 123 9.603 15.462 8.523
789 HB3 TRP 123 2HB TRP 123 9.151 13.963 9.331
790 HD1 TRP 123 HD1 TRP 123 10.636 12.040 8.566
791 HE1 TRP 123 HE1 TRP 123 11.763 11.329 6.364
792 HE3 TRP 123 HE3 TRP 123 9.106 15.902 5.585
793 HZ2 TRP 123 HZ2 TRP 123 11.977 12.279 3.715
794 HZ3 TRP 123 HZ3 TRP 123 9.816 15.926 3.229
795 HH2 TRP 123 HH2 TRP 123 11.222 14.152 2.316
796 H LYS 124 H LYS 124 7.195 13.494 10.141
797 HA LYS 124 HA LYS 124 6.606 10.927 9.353
798 HB2 LYS 124 1HB LYS 124 6.855 11.843 11.717
799 HB3 LYS 124 2HB LYS 124 5.164 12.315 11.610
800 HG2 LYS 124 1HG LYS 124 5.318 9.612 10.817
801 HG3 LYS 124 2HG LYS 124 6.282 9.785 12.285
802 HD2 LYS 124 1HD LYS 124 3.589 11.059 12.173
803 HD3 LYS 124 2HD LYS 124 3.696 9.312 12.406
804 HE2 LYS 124 1HE LYS 124 5.575 10.650 14.113
805 HE3 LYS 124 2HE LYS 124 3.967 11.334 14.340
806 HZ1 LYS 124 1HZ LYS 124 3.773 9.605 15.747
807 HZ2 LYS 124 2HZ LYS 124 4.958 8.677 14.975
808 HZ3 LYS 124 3HZ LYS 124 3.392 8.745 14.341
809 H LEU 125 H LEU 125 4.391 13.680 9.611
810 HA LEU 125 HA LEU 125 1.951 12.583 9.250
811 HB2 LEU 125 1HB LEU 125 2.745 15.064 9.244
812 HB3 LEU 125 2HB LEU 125 2.722 14.875 7.492
813 HG LEU 125 HG LEU 125 0.319 14.341 9.227
814 HD11 LEU 125 1HD1 LEU 125 0.395 16.810 7.642
815 HD12 LEU 125 2HD1 LEU 125 1.465 16.788 9.043
816 HD13 LEU 125 3HD1 LEU 125 -0.264 16.508 9.250
817 HD21 LEU 125 1HD2 LEU 125 -0.243 13.393 7.251
818 HD22 LEU 125 2HD2 LEU 125 0.912 14.357 6.331
819 HD23 LEU 125 3HD2 LEU 125 -0.626 15.062 6.830
820 H LEU 126 H LEU 126 4.428 12.962 6.769
821 HA LEU 126 HA LEU 126 3.208 12.485 4.433
822 HB2 LEU 126 1HB LEU 126 5.763 11.517 5.577
823 HB3 LEU 126 2HB LEU 126 5.216 10.761 4.081
824 HG LEU 126 HG LEU 126 4.974 13.464 3.562
825 HD11 LEU 126 1HD1 LEU 126 6.156 14.178 5.481
826 HD12 LEU 126 2HD1 LEU 126 7.283 14.295 4.130
827 HD13 LEU 126 3HD1 LEU 126 7.401 12.947 5.262
828 HD21 LEU 126 1HD2 LEU 126 5.866 12.446 1.782
829 HD22 LEU 126 2HD2 LEU 126 6.665 11.220 2.766
830 HD23 LEU 126 3HD2 LEU 126 7.423 12.796 2.533
831 HA PRO 127 HA PRO 127 0.889 8.751 4.708
832 HB2 PRO 127 1HB PRO 127 0.696 8.181 2.061
833 HB3 PRO 127 2HB PRO 127 -0.219 9.481 2.832
834 HG2 PRO 127 1HG PRO 127 2.309 9.633 1.237
835 HG3 PRO 127 2HG PRO 127 0.886 10.688 1.180
836 HD2 PRO 127 1HD PRO 127 3.148 11.365 2.504
837 HD3 PRO 127 2HD PRO 127 1.537 11.878 3.043
838 H GLU 128 H GLU 128 4.054 8.918 3.393
839 HA GLU 128 HA GLU 128 5.742 7.375 3.390
840 HB2 GLU 128 1HB GLU 128 3.963 5.110 4.135
841 HB3 GLU 128 2HB GLU 128 5.595 5.479 4.672
842 HG2 GLU 128 1HG GLU 128 4.160 7.559 5.712
843 HG3 GLU 128 2HG GLU 128 3.025 6.216 5.832
844 H ASN 129 H ASN 129 2.696 5.828 2.365
845 HA ASN 129 HA ASN 129 4.056 4.567 0.129
846 HB2 ASN 129 1HB ASN 129 2.311 3.112 0.058
847 HB3 ASN 129 2HB ASN 129 2.029 3.704 1.692
848 HD21 ASN 129 2HD2 ASN 129 0.696 5.815 1.695
849 HD22 ASN 129 1HD2 ASN 129 -0.719 5.790 0.704
Start of MODEL 6
1 H1 GLN 1 H GLN 1 1.542 0.495 3.443
2 HA GLN 1 HA GLN 1 1.720 -1.521 1.624
3 HB2 GLN 1 1HB GLN 1 2.026 0.051 -0.501
4 HB3 GLN 1 2HB GLN 1 0.475 -0.668 -0.089
5 HG2 GLN 1 1HG GLN 1 -0.434 1.312 0.560
6 HG3 GLN 1 2HG GLN 1 1.115 1.987 1.063
7 HE21 GLN 1 2HE2 GLN 1 0.072 0.561 -2.005
8 HE22 GLN 1 1HE2 GLN 1 0.420 1.951 -2.970
9 H ILE 2 H ILE 2 3.645 -1.655 2.827
10 HA ILE 2 HA ILE 2 5.660 0.415 2.357
11 HB ILE 2 HB ILE 2 5.657 -1.951 4.232
12 HG12 ILE 2 1HG1 ILE 2 4.285 -0.384 5.244
13 HG13 ILE 2 2HG1 ILE 2 5.859 0.088 5.876
14 HG21 ILE 2 1HG2 ILE 2 7.721 -0.592 5.124
15 HG22 ILE 2 2HG2 ILE 2 7.901 -1.759 3.815
16 HG23 ILE 2 3HG2 ILE 2 7.799 -0.036 3.452
17 HD11 ILE 2 1HD1 ILE 2 4.200 1.419 3.776
18 HD12 ILE 2 2HD1 ILE 2 4.880 2.094 5.257
19 HD13 ILE 2 3HD1 ILE 2 5.934 1.715 3.895
20 H ASN 3 H ASN 3 6.485 0.089 0.349
21 HA ASN 3 HA ASN 3 7.217 -2.583 -0.522
22 HB2 ASN 3 1HB ASN 3 6.199 -1.095 -2.158
23 HB3 ASN 3 2HB ASN 3 7.460 0.105 -1.891
24 HD21 ASN 3 2HD2 ASN 3 7.761 -3.396 -2.198
25 HD22 ASN 3 1HD2 ASN 3 8.753 -3.365 -3.613
26 H GLN 4 H GLN 4 9.355 -3.135 -1.219
27 HA GLN 4 HA GLN 4 11.372 -2.243 0.595
28 HB2 GLN 4 1HB GLN 4 11.737 -3.978 -1.849
29 HB3 GLN 4 2HB GLN 4 12.796 -3.877 -0.449
30 HG2 GLN 4 1HG GLN 4 11.709 -5.753 0.139
31 HG3 GLN 4 2HG GLN 4 10.535 -4.602 0.775
32 HE21 GLN 4 2HE2 GLN 4 8.512 -4.781 0.112
33 HE22 GLN 4 1HE2 GLN 4 7.973 -5.689 -1.255
34 H VAL 5 H VAL 5 13.687 -1.962 -0.559
35 HA VAL 5 HA VAL 5 13.521 -0.148 -2.828
36 HB VAL 5 HB VAL 5 13.485 0.944 -0.297
37 HG11 VAL 5 1HG1 VAL 5 15.899 0.110 -0.149
38 HG12 VAL 5 2HG1 VAL 5 16.275 1.380 -1.315
39 HG13 VAL 5 3HG1 VAL 5 15.593 1.798 0.257
40 HG21 VAL 5 1HG2 VAL 5 13.180 1.840 -2.781
41 HG22 VAL 5 2HG2 VAL 5 13.420 2.928 -1.413
42 HG23 VAL 5 3HG2 VAL 5 14.779 2.511 -2.458
43 H ARG 6 H ARG 6 15.854 0.709 -3.299
44 HA ARG 6 HA ARG 6 17.973 -1.094 -2.522
45 HB2 ARG 6 1HB ARG 6 16.506 -1.963 -4.611
46 HB3 ARG 6 2HB ARG 6 17.653 -0.938 -5.463
47 HG2 ARG 6 1HG ARG 6 19.492 -2.213 -4.736
48 HG3 ARG 6 2HG ARG 6 18.526 -3.051 -3.519
49 HD2 ARG 6 1HD ARG 6 17.771 -4.560 -4.993
50 HD3 ARG 6 2HD ARG 6 17.499 -3.341 -6.238
51 HE ARG 6 HE ARG 6 20.273 -3.904 -5.862
52 HH11 ARG 6 1HH1 ARG 6 17.355 -5.032 -7.390
53 HH12 ARG 6 2HH1 ARG 6 18.188 -5.878 -8.652
54 HH21 ARG 6 1HH2 ARG 6 21.381 -5.014 -7.518
55 HH22 ARG 6 2HH2 ARG 6 20.478 -5.867 -8.724
56 HA PRO 7 HA PRO 7 19.460 3.162 -3.276
57 HB2 PRO 7 1HB PRO 7 21.357 3.059 -1.337
58 HB3 PRO 7 2HB PRO 7 19.665 3.452 -1.007
59 HG2 PRO 7 1HG PRO 7 21.106 0.849 -0.673
60 HG3 PRO 7 2HG PRO 7 19.945 1.632 0.415
61 HD2 PRO 7 1HD PRO 7 19.251 -0.392 -1.245
62 HD3 PRO 7 2HD PRO 7 18.126 0.909 -0.803
63 H LYS 8 H LYS 8 20.578 3.119 -5.146
64 HA LYS 8 HA LYS 8 22.656 1.259 -5.713
65 HB2 LYS 8 1HB LYS 8 22.436 3.833 -7.207
66 HB3 LYS 8 2HB LYS 8 22.740 2.210 -7.813
67 HG2 LYS 8 1HG LYS 8 20.297 1.750 -7.079
68 HG3 LYS 8 2HG LYS 8 20.146 3.509 -7.104
69 HD2 LYS 8 1HD LYS 8 21.291 2.018 -9.442
70 HD3 LYS 8 2HD LYS 8 19.546 2.190 -9.237
71 HE2 LYS 8 1HE LYS 8 21.242 4.624 -9.016
72 HE3 LYS 8 2HE LYS 8 20.969 3.942 -10.619
73 HZ1 LYS 8 1HZ LYS 8 18.521 3.984 -9.975
74 HZ2 LYS 8 2HZ LYS 8 19.254 5.466 -10.331
75 HZ3 LYS 8 3HZ LYS 8 18.980 5.024 -8.722
76 H LEU 9 H LEU 9 24.472 3.134 -7.003
77 HA LEU 9 HA LEU 9 26.278 3.528 -4.847
78 HB2 LEU 9 1HB LEU 9 27.472 3.181 -6.734
79 HB3 LEU 9 2HB LEU 9 26.273 3.960 -7.764
80 HG LEU 9 HG LEU 9 27.127 6.163 -7.016
81 HD11 LEU 9 1HD1 LEU 9 28.040 5.438 -4.856
82 HD12 LEU 9 2HD1 LEU 9 29.235 6.296 -5.827
83 HD13 LEU 9 3HD1 LEU 9 29.300 4.538 -5.701
84 HD21 LEU 9 1HD2 LEU 9 29.029 6.165 -8.426
85 HD22 LEU 9 2HD2 LEU 9 27.930 4.947 -9.073
86 HD23 LEU 9 3HD2 LEU 9 29.338 4.454 -8.131
87 HA PRO 10 HA PRO 10 25.500 8.237 -5.558
88 HB2 PRO 10 1HB PRO 10 23.478 8.938 -7.229
89 HB3 PRO 10 2HB PRO 10 25.136 8.673 -7.784
90 HG2 PRO 10 1HG PRO 10 22.782 6.826 -7.896
91 HG3 PRO 10 2HG PRO 10 24.007 7.153 -9.135
92 HD2 PRO 10 1HD PRO 10 24.082 4.953 -7.559
93 HD3 PRO 10 2HD PRO 10 25.551 5.747 -8.160
94 H LEU 11 H LEU 11 23.260 5.843 -4.894
95 HA LEU 11 HA LEU 11 21.386 7.703 -3.607
96 HB2 LEU 11 1HB LEU 11 21.148 4.791 -4.331
97 HB3 LEU 11 2HB LEU 11 19.957 5.649 -3.355
98 HG LEU 11 HG LEU 11 20.396 5.669 -6.263
99 HD11 LEU 11 1HD1 LEU 11 18.304 5.260 -4.421
100 HD12 LEU 11 2HD1 LEU 11 18.243 5.158 -6.180
101 HD13 LEU 11 3HD1 LEU 11 17.882 6.683 -5.373
102 HD21 LEU 11 1HD2 LEU 11 21.151 7.917 -5.783
103 HD22 LEU 11 2HD2 LEU 11 19.734 8.207 -4.773
104 HD23 LEU 11 3HD2 LEU 11 19.545 7.968 -6.511
105 H LEU 12 H LEU 12 23.274 4.761 -2.983
106 HA LEU 12 HA LEU 12 22.678 4.301 -0.349
107 HB2 LEU 12 1HB LEU 12 24.199 2.965 -1.830
108 HB3 LEU 12 2HB LEU 12 25.459 4.151 -1.496
109 HG LEU 12 HG LEU 12 25.767 3.415 0.664
110 HD11 LEU 12 1HD1 LEU 12 23.019 2.180 0.566
111 HD12 LEU 12 2HD1 LEU 12 23.472 3.660 1.410
112 HD13 LEU 12 3HD1 LEU 12 24.127 2.110 1.936
113 HD21 LEU 12 1HD2 LEU 12 24.815 0.755 -0.132
114 HD22 LEU 12 2HD2 LEU 12 26.425 1.290 0.352
115 HD23 LEU 12 3HD2 LEU 12 25.870 1.549 -1.303
116 H LYS 13 H LYS 13 24.872 6.717 -1.679
117 HA LYS 13 HA LYS 13 25.974 7.573 0.779
118 HB2 LYS 13 1HB LYS 13 25.615 9.310 -1.658
119 HB3 LYS 13 2HB LYS 13 26.866 9.418 -0.427
120 HG2 LYS 13 1HG LYS 13 28.162 7.922 -1.453
121 HG3 LYS 13 2HG LYS 13 26.808 6.841 -1.790
122 HD2 LYS 13 1HD LYS 13 27.354 7.451 -3.924
123 HD3 LYS 13 2HD LYS 13 26.200 8.730 -3.538
124 HE2 LYS 13 1HE LYS 13 27.802 10.174 -4.098
125 HE3 LYS 13 2HE LYS 13 28.611 9.709 -2.602
126 HZ1 LYS 13 1HZ LYS 13 30.248 9.322 -4.124
127 HZ2 LYS 13 2HZ LYS 13 29.178 8.876 -5.356
128 HZ3 LYS 13 3HZ LYS 13 29.520 7.795 -4.100
129 H ILE 14 H ILE 14 23.013 8.326 -0.895
130 HA ILE 14 HA ILE 14 22.349 10.734 0.378
131 HB ILE 14 HB ILE 14 20.412 8.607 -0.535
132 HG12 ILE 14 1HG1 ILE 14 22.080 9.236 -2.282
133 HG13 ILE 14 2HG1 ILE 14 20.428 9.674 -2.704
134 HG21 ILE 14 1HG2 ILE 14 20.160 11.540 0.051
135 HG22 ILE 14 2HG2 ILE 14 19.011 10.696 -0.984
136 HG23 ILE 14 3HG2 ILE 14 19.213 10.199 0.696
137 HD11 ILE 14 1HD1 ILE 14 22.534 11.321 -2.949
138 HD12 ILE 14 2HD1 ILE 14 20.877 11.873 -2.701
139 HD13 ILE 14 3HD1 ILE 14 21.983 11.757 -1.332
140 H LEU 15 H LEU 15 21.272 7.424 1.163
141 HA LEU 15 HA LEU 15 20.038 8.202 3.607
142 HB2 LEU 15 1HB LEU 15 20.951 5.443 2.820
143 HB3 LEU 15 2HB LEU 15 19.711 5.863 4.000
144 HG LEU 15 HG LEU 15 18.282 5.387 2.343
145 HD11 LEU 15 1HD1 LEU 15 18.396 7.953 2.537
146 HD12 LEU 15 2HD1 LEU 15 17.538 7.246 1.168
147 HD13 LEU 15 3HD1 LEU 15 19.167 7.887 0.952
148 HD21 LEU 15 1HD2 LEU 15 20.421 4.637 1.019
149 HD22 LEU 15 2HD2 LEU 15 20.096 6.100 0.089
150 HD23 LEU 15 3HD2 LEU 15 18.872 4.834 0.198
151 H HIS 16 H HIS 16 23.207 6.970 2.732
152 HA HIS 16 HA HIS 16 24.161 6.262 5.252
153 HB2 HIS 16 1HB HIS 16 25.400 7.080 2.678
154 HB3 HIS 16 2HB HIS 16 26.422 7.146 4.111
155 HD1 HIS 16 HD1 HIS 16 27.884 5.149 3.778
156 HD2 HIS 16 HD2 HIS 16 23.857 4.260 3.278
157 HE1 HIS 16 HE1 HIS 16 27.773 2.649 3.537
158 H ALA 17 H ALA 17 24.373 9.394 3.576
159 HA ALA 17 HA ALA 17 25.757 10.788 5.559
160 HB1 ALA 17 1HB ALA 17 25.655 12.367 4.008
161 HB2 ALA 17 2HB ALA 17 24.493 11.399 3.100
162 HB3 ALA 17 3HB ALA 17 23.926 12.561 4.299
163 H ALA 18 H ALA 18 22.275 10.318 5.098
164 HA ALA 18 HA ALA 18 21.455 11.982 7.235
165 HB1 ALA 18 1HB ALA 18 19.321 10.564 7.060
166 HB2 ALA 18 2HB ALA 18 19.801 11.521 5.658
167 HB3 ALA 18 3HB ALA 18 20.117 9.786 5.692
168 H GLY 19 H GLY 19 23.021 8.999 7.228
169 HA2 GLY 19 1HA GLY 19 23.823 8.231 9.412
170 HA3 GLY 19 2HA GLY 19 22.208 8.543 10.032
171 H ALA 20 H ALA 20 22.564 7.104 6.904
172 HA ALA 20 HA ALA 20 21.394 4.633 7.949
173 HB1 ALA 20 1HB ALA 20 21.730 5.216 5.035
174 HB2 ALA 20 2HB ALA 20 20.498 4.253 5.851
175 HB3 ALA 20 3HB ALA 20 20.458 6.013 5.962
176 H GLN 21 H GLN 21 22.075 2.708 6.296
177 HA GLN 21 HA GLN 21 24.673 2.515 5.349
178 HB2 GLN 21 1HB GLN 21 24.793 2.763 8.066
179 HB3 GLN 21 2HB GLN 21 24.765 1.015 7.878
180 HG2 GLN 21 1HG GLN 21 26.968 1.182 7.627
181 HG3 GLN 21 2HG GLN 21 26.603 1.764 6.003
182 HE21 GLN 21 2HE2 GLN 21 26.088 4.189 5.962
183 HE22 GLN 21 1HE2 GLN 21 27.173 5.198 6.849
184 H GLY 22 H GLY 22 24.511 0.883 3.969
185 HA2 GLY 22 1HA GLY 22 24.251 -1.714 4.232
186 HA3 GLY 22 2HA GLY 22 22.580 -1.251 4.519
187 H GLU 23 H GLU 23 22.202 -2.657 2.635
188 HA GLU 23 HA GLU 23 22.417 -1.092 0.160
189 HB2 GLU 23 1HB GLU 23 22.718 -4.085 0.154
190 HB3 GLU 23 2HB GLU 23 23.093 -2.945 -1.131
191 HG2 GLU 23 1HG GLU 23 25.018 -2.157 0.015
192 HG3 GLU 23 2HG GLU 23 24.579 -3.035 1.479
193 H MET 24 H MET 24 20.383 -2.200 2.344
194 HA MET 24 HA MET 24 18.222 -2.503 0.406
195 HB2 MET 24 1HB MET 24 17.404 -4.349 2.193
196 HB3 MET 24 2HB MET 24 18.289 -4.745 0.726
197 HG2 MET 24 1HG MET 24 19.816 -4.131 3.203
198 HG3 MET 24 2HG MET 24 19.020 -5.696 3.051
199 HE1 MET 24 1HE MET 24 22.839 -4.553 2.359
200 HE2 MET 24 2HE MET 24 21.774 -5.106 3.651
201 HE3 MET 24 3HE MET 24 22.698 -6.276 2.708
202 H PHE 25 H PHE 25 16.358 -1.548 1.032
203 HA PHE 25 HA PHE 25 15.725 -1.042 3.780
204 HB2 PHE 25 1HB PHE 25 16.308 1.363 2.044
205 HB3 PHE 25 2HB PHE 25 15.820 1.369 3.736
206 HD1 PHE 25 HD2 PHE 25 18.560 0.493 1.422
207 HD2 PHE 25 HD1 PHE 25 17.402 1.146 5.466
208 HE1 PHE 25 HE2 PHE 25 20.925 0.471 2.100
209 HE2 PHE 25 HE1 PHE 25 19.765 1.126 6.149
210 HZ PHE 25 HZ PHE 25 21.530 0.787 4.466
211 H THR 26 H THR 26 13.637 0.006 4.039
212 HA THR 26 HA THR 26 11.892 -0.576 1.764
213 HB THR 26 HB THR 26 10.256 0.130 3.893
214 HG1 THR 26 1HG THR 26 12.173 -1.650 4.958
215 HG21 THR 26 1HG2 THR 26 10.078 -2.448 4.114
216 HG22 THR 26 2HG2 THR 26 11.201 -2.477 2.754
217 HG23 THR 26 3HG2 THR 26 9.631 -1.691 2.585
218 H VAL 27 H VAL 27 9.813 0.920 1.847
219 HA VAL 27 HA VAL 27 10.535 3.411 0.861
220 HB VAL 27 HB VAL 27 7.868 3.067 2.171
221 HG11 VAL 27 1HG1 VAL 27 7.233 4.086 -0.113
222 HG12 VAL 27 2HG1 VAL 27 8.036 5.113 1.077
223 HG13 VAL 27 3HG1 VAL 27 8.955 4.430 -0.265
224 HG21 VAL 27 1HG2 VAL 27 8.928 1.502 -0.153
225 HG22 VAL 27 2HG2 VAL 27 7.985 0.943 1.230
226 HG23 VAL 27 3HG2 VAL 27 7.213 1.897 -0.037
227 H LYS 28 H LYS 28 9.559 2.479 4.126
228 HA LYS 28 HA LYS 28 9.487 5.121 5.171
229 HB2 LYS 28 1HB LYS 28 9.274 2.383 6.219
230 HB3 LYS 28 2HB LYS 28 9.978 3.533 7.348
231 HG2 LYS 28 1HG LYS 28 7.952 4.246 7.862
232 HG3 LYS 28 2HG LYS 28 7.723 4.778 6.195
233 HD2 LYS 28 1HD LYS 28 5.984 3.180 7.086
234 HD3 LYS 28 2HD LYS 28 6.756 2.704 5.572
235 HE2 LYS 28 1HE LYS 28 6.448 0.994 7.554
236 HE3 LYS 28 2HE LYS 28 7.886 0.968 6.535
237 HZ1 LYS 28 1HZ LYS 28 7.909 2.630 8.950
238 HZ2 LYS 28 2HZ LYS 28 9.186 1.827 8.184
239 HZ3 LYS 28 3HZ LYS 28 8.081 0.956 9.124
240 H GLU 29 H GLU 29 11.908 2.518 5.395
241 HA GLU 29 HA GLU 29 13.811 3.834 6.912
242 HB2 GLU 29 1HB GLU 29 14.093 1.771 4.733
243 HB3 GLU 29 2HB GLU 29 15.474 2.361 5.647
244 HG2 GLU 29 1HG GLU 29 14.407 1.601 7.722
245 HG3 GLU 29 2HG GLU 29 13.059 0.969 6.780
246 H VAL 30 H VAL 30 13.218 4.002 3.439
247 HA VAL 30 HA VAL 30 15.505 5.627 2.879
248 HB VAL 30 HB VAL 30 13.023 5.276 1.195
249 HG11 VAL 30 1HG1 VAL 30 15.737 6.422 0.707
250 HG12 VAL 30 2HG1 VAL 30 14.852 5.666 -0.619
251 HG13 VAL 30 3HG1 VAL 30 14.156 7.042 0.236
252 HG21 VAL 30 1HG2 VAL 30 13.631 3.158 0.911
253 HG22 VAL 30 2HG2 VAL 30 15.130 3.728 0.177
254 HG23 VAL 30 3HG2 VAL 30 15.068 3.390 1.907
255 H MET 31 H MET 31 12.004 6.332 2.835
256 HA MET 31 HA MET 31 12.148 9.062 2.449
257 HB2 MET 31 1HB MET 31 9.919 8.996 2.726
258 HB3 MET 31 2HB MET 31 10.131 7.259 2.898
259 HG2 MET 31 1HG MET 31 8.810 7.881 4.713
260 HG3 MET 31 2HG MET 31 10.431 7.698 5.381
261 HE1 MET 31 1HE MET 31 9.172 11.578 3.696
262 HE2 MET 31 2HE MET 31 8.391 10.024 3.399
263 HE3 MET 31 3HE MET 31 7.765 11.102 4.648
264 H HIS 32 H HIS 32 12.479 7.224 5.434
265 HA HIS 32 HA HIS 32 12.375 9.342 7.259
266 HB2 HIS 32 1HB HIS 32 12.447 6.775 7.662
267 HB3 HIS 32 2HB HIS 32 14.196 6.986 7.659
268 HD1 HIS 32 HD1 HIS 32 11.556 6.751 9.953
269 HD2 HIS 32 HD2 HIS 32 14.822 9.296 9.607
270 HE1 HIS 32 HE1 HIS 32 11.894 7.728 12.246
271 H TYR 33 H TYR 33 15.004 8.121 5.276
272 HA TYR 33 HA TYR 33 17.029 9.700 6.540
273 HB2 TYR 33 1HB TYR 33 16.972 8.213 3.909
274 HB3 TYR 33 2HB TYR 33 18.395 9.039 4.534
275 HD1 TYR 33 HD2 TYR 33 18.606 8.372 7.271
276 HD2 TYR 33 HD1 TYR 33 17.184 5.929 4.091
277 HE1 TYR 33 HE2 TYR 33 19.214 6.362 8.551
278 HE2 TYR 33 HE1 TYR 33 17.787 3.912 5.363
279 HH TYR 33 HH TYR 33 18.732 4.049 8.684
280 H LEU 34 H LEU 34 14.805 10.143 3.894
281 HA LEU 34 HA LEU 34 16.001 12.212 2.494
282 HB2 LEU 34 1HB LEU 34 13.331 11.126 2.802
283 HB3 LEU 34 2HB LEU 34 13.306 12.869 2.538
284 HG LEU 34 HG LEU 34 13.048 11.593 0.455
285 HD11 LEU 34 1HD1 LEU 34 15.496 13.288 0.823
286 HD12 LEU 34 2HD1 LEU 34 13.931 13.738 0.147
287 HD13 LEU 34 3HD1 LEU 34 15.010 12.678 -0.759
288 HD21 LEU 34 1HD2 LEU 34 15.890 10.686 0.832
289 HD22 LEU 34 2HD2 LEU 34 14.744 10.202 -0.419
290 HD23 LEU 34 3HD2 LEU 34 14.502 9.681 1.249
291 H GLY 35 H GLY 35 13.563 12.577 5.082
292 HA2 GLY 35 1HA GLY 35 13.699 15.332 5.344
293 HA3 GLY 35 2HA GLY 35 13.266 14.233 6.645
294 H GLN 36 H GLN 36 15.601 12.889 7.096
295 HA GLN 36 HA GLN 36 17.033 14.684 8.703
296 HB2 GLN 36 1HB GLN 36 17.922 11.985 7.672
297 HB3 GLN 36 2HB GLN 36 18.621 12.847 9.036
298 HG2 GLN 36 1HG GLN 36 15.891 12.688 9.586
299 HG3 GLN 36 2HG GLN 36 16.337 11.108 8.943
300 HE21 GLN 36 2HE2 GLN 36 18.160 13.428 10.898
301 HE22 GLN 36 1HE2 GLN 36 18.456 12.351 12.216
302 H TYR 37 H TYR 37 17.734 13.362 5.498
303 HA TYR 37 HA TYR 37 20.317 14.381 5.193
304 HB2 TYR 37 1HB TYR 37 19.342 12.723 3.669
305 HB3 TYR 37 2HB TYR 37 18.209 13.929 3.069
306 HD1 TYR 37 HD1 TYR 37 21.884 13.377 3.449
307 HD2 TYR 37 HD2 TYR 37 18.748 15.099 1.147
308 HE1 TYR 37 HE1 TYR 37 23.518 14.050 1.738
309 HE2 TYR 37 HE2 TYR 37 20.373 15.776 -0.571
310 HH TYR 37 HH TYR 37 22.500 15.482 -1.311
311 H ILE 38 H ILE 38 17.189 15.802 4.283
312 HA ILE 38 HA ILE 38 18.188 18.165 3.156
313 HB ILE 38 HB ILE 38 15.557 17.822 4.599
314 HG12 ILE 38 1HG1 ILE 38 16.131 17.477 1.651
315 HG13 ILE 38 2HG1 ILE 38 16.016 16.136 2.785
316 HG21 ILE 38 1HG2 ILE 38 16.500 19.819 2.550
317 HG22 ILE 38 2HG2 ILE 38 14.821 19.626 3.049
318 HG23 ILE 38 3HG2 ILE 38 16.035 20.139 4.220
319 HD11 ILE 38 1HD1 ILE 38 13.838 16.080 2.440
320 HD12 ILE 38 2HD1 ILE 38 13.702 17.698 3.131
321 HD13 ILE 38 3HD1 ILE 38 13.941 17.497 1.395
322 H MET 39 H MET 39 17.075 17.492 6.468
323 HA MET 39 HA MET 39 17.542 20.076 7.483
324 HB2 MET 39 1HB MET 39 16.628 19.202 9.326
325 HB3 MET 39 2HB MET 39 16.524 17.672 8.466
326 HG2 MET 39 1HG MET 39 18.665 16.988 9.344
327 HG3 MET 39 2HG MET 39 18.873 18.554 10.125
328 HE1 MET 39 1HE MET 39 15.236 18.301 10.916
329 HE2 MET 39 2HE MET 39 15.781 18.474 12.584
330 HE3 MET 39 3HE MET 39 16.528 19.437 11.308
331 H VAL 40 H VAL 40 19.608 17.247 7.166
332 HA VAL 40 HA VAL 40 21.756 18.208 8.740
333 HB VAL 40 HB VAL 40 21.192 15.836 7.433
334 HG11 VAL 40 1HG1 VAL 40 23.097 15.384 5.993
335 HG12 VAL 40 2HG1 VAL 40 22.158 16.739 5.363
336 HG13 VAL 40 3HG1 VAL 40 23.676 17.036 6.212
337 HG21 VAL 40 1HG2 VAL 40 23.810 16.666 8.680
338 HG22 VAL 40 2HG2 VAL 40 22.378 16.150 9.571
339 HG23 VAL 40 3HG2 VAL 40 23.208 15.018 8.503
340 H LYS 41 H LYS 41 20.970 18.464 5.311
341 HA LYS 41 HA LYS 41 23.436 19.859 4.711
342 HB2 LYS 41 1HB LYS 41 21.083 18.908 3.133
343 HB3 LYS 41 2HB LYS 41 22.099 20.173 2.453
344 HG2 LYS 41 1HG LYS 41 23.127 17.509 3.403
345 HG3 LYS 41 2HG LYS 41 22.704 17.878 1.729
346 HD2 LYS 41 1HD LYS 41 24.726 18.743 1.414
347 HD3 LYS 41 2HD LYS 41 24.411 19.940 2.672
348 HE2 LYS 41 1HE LYS 41 25.543 18.765 4.264
349 HE3 LYS 41 2HE LYS 41 25.164 17.204 3.538
350 HZ1 LYS 41 1HZ LYS 41 27.327 17.319 2.964
351 HZ2 LYS 41 2HZ LYS 41 27.383 19.009 3.004
352 HZ3 LYS 41 3HZ LYS 41 26.727 18.216 1.661
353 H GLN 42 H GLN 42 20.336 20.660 5.838
354 HA GLN 42 HA GLN 42 19.356 22.648 6.356
355 HB2 GLN 42 1HB GLN 42 22.189 23.340 6.016
356 HB3 GLN 42 2HB GLN 42 21.088 24.686 5.757
357 HG2 GLN 42 1HG GLN 42 21.415 24.908 7.986
358 HG3 GLN 42 2HG GLN 42 20.043 23.801 8.014
359 HE21 GLN 42 2HE2 GLN 42 21.582 21.523 7.133
360 HE22 GLN 42 1HE2 GLN 42 22.555 21.034 8.474
361 H LEU 43 H LEU 43 18.339 21.785 4.188
362 HA LEU 43 HA LEU 43 18.423 24.017 2.267
363 HB2 LEU 43 1HB LEU 43 17.801 21.151 1.589
364 HB3 LEU 43 2HB LEU 43 18.006 22.495 0.468
365 HG LEU 43 HG LEU 43 20.333 21.857 2.174
366 HD11 LEU 43 1HD1 LEU 43 19.517 19.618 1.626
367 HD12 LEU 43 2HD1 LEU 43 21.021 19.985 0.782
368 HD13 LEU 43 3HD1 LEU 43 19.486 20.048 -0.084
369 HD21 LEU 43 1HD2 LEU 43 20.034 22.388 -0.779
370 HD22 LEU 43 2HD2 LEU 43 21.536 22.372 0.144
371 HD23 LEU 43 3HD2 LEU 43 20.328 23.621 0.447
372 H TYR 44 H TYR 44 16.738 24.589 4.070
373 HA TYR 44 HA TYR 44 14.179 24.438 2.859
374 HB2 TYR 44 1HB TYR 44 12.982 23.198 4.584
375 HB3 TYR 44 2HB TYR 44 14.224 22.183 3.859
376 HD1 TYR 44 HD1 TYR 44 16.620 22.537 5.172
377 HD2 TYR 44 HD2 TYR 44 12.728 22.912 6.850
378 HE1 TYR 44 HE1 TYR 44 17.542 22.064 7.403
379 HE2 TYR 44 HE2 TYR 44 13.639 22.442 9.085
380 HH TYR 44 HH TYR 44 17.054 22.303 9.686
381 H ASP 45 H ASP 45 12.475 25.449 4.323
382 HA ASP 45 HA ASP 45 13.638 27.815 5.511
383 HB2 ASP 45 1HB ASP 45 11.258 27.253 4.166
384 HB3 ASP 45 2HB ASP 45 10.762 27.573 5.826
385 H GLN 46 H GLN 46 14.317 27.774 7.545
386 HA GLN 46 HA GLN 46 13.699 25.846 9.453
387 HB2 GLN 46 1HB GLN 46 14.910 28.569 9.544
388 HB3 GLN 46 2HB GLN 46 14.431 27.825 11.064
389 HG2 GLN 46 1HG GLN 46 16.850 27.525 10.043
390 HG3 GLN 46 2HG GLN 46 16.056 26.255 10.974
391 HE21 GLN 46 2HE2 GLN 46 16.178 27.433 7.625
392 HE22 GLN 46 1HE2 GLN 46 16.294 25.869 6.900
393 H GLN 47 H GLN 47 11.942 28.648 8.476
394 HA GLN 47 HA GLN 47 10.340 28.842 10.854
395 HB2 GLN 47 1HB GLN 47 9.444 29.994 8.252
396 HB3 GLN 47 2HB GLN 47 9.339 30.671 9.871
397 HG2 GLN 47 1HG GLN 47 11.686 30.605 8.015
398 HG3 GLN 47 2HG GLN 47 10.912 31.994 8.776
399 HE21 GLN 47 2HE2 GLN 47 13.425 29.772 8.949
400 HE22 GLN 47 1HE2 GLN 47 13.987 30.145 10.539
401 H GLU 48 H GLU 48 10.054 27.328 7.697
402 HA GLU 48 HA GLU 48 7.657 25.929 8.663
403 HB2 GLU 48 1HB GLU 48 8.037 27.292 6.004
404 HB3 GLU 48 2HB GLU 48 6.855 26.010 6.230
405 HG2 GLU 48 1HG GLU 48 6.932 28.703 7.554
406 HG3 GLU 48 2HG GLU 48 5.709 28.064 6.458
407 H GLN 49 H GLN 49 8.956 24.128 9.133
408 HA GLN 49 HA GLN 49 10.820 22.930 7.463
409 HB2 GLN 49 1HB GLN 49 8.995 21.796 9.571
410 HB3 GLN 49 2HB GLN 49 10.150 20.788 8.709
411 HG2 GLN 49 1HG GLN 49 11.537 21.320 10.371
412 HG3 GLN 49 2HG GLN 49 11.732 22.844 9.506
413 HE21 GLN 49 2HE2 GLN 49 12.275 23.742 11.576
414 HE22 GLN 49 1HE2 GLN 49 11.022 24.206 12.670
415 H HIS 50 H HIS 50 7.409 23.071 7.170
416 HA HIS 50 HA HIS 50 7.060 20.723 5.581
417 HB2 HIS 50 1HB HIS 50 4.824 21.438 5.276
418 HB3 HIS 50 2HB HIS 50 5.260 21.955 6.902
419 HD1 HIS 50 HD1 HIS 50 4.732 24.313 7.426
420 HD2 HIS 50 HD2 HIS 50 5.111 23.685 3.337
421 HE1 HIS 50 HE1 HIS 50 4.144 26.510 6.352
422 H MET 51 H MET 51 8.680 23.511 4.954
423 HA MET 51 HA MET 51 8.141 23.322 2.063
424 HB2 MET 51 1HB MET 51 7.969 25.579 3.751
425 HB3 MET 51 2HB MET 51 9.409 25.803 2.766
426 HG2 MET 51 1HG MET 51 6.994 24.913 1.335
427 HG3 MET 51 2HG MET 51 6.943 26.540 2.011
428 HE1 MET 51 1HE MET 51 9.185 24.067 0.477
429 HE2 MET 51 2HE MET 51 9.294 24.630 -1.191
430 HE3 MET 51 3HE MET 51 10.544 25.072 -0.026
431 H VAL 52 H VAL 52 9.746 21.854 1.582
432 HA VAL 52 HA VAL 52 12.444 22.208 2.519
433 HB VAL 52 HB VAL 52 11.177 20.297 0.570
434 HG11 VAL 52 1HG1 VAL 52 13.385 19.169 0.452
435 HG12 VAL 52 2HG1 VAL 52 13.363 20.754 -0.323
436 HG13 VAL 52 3HG1 VAL 52 14.098 20.559 1.269
437 HG21 VAL 52 1HG2 VAL 52 11.243 18.767 2.246
438 HG22 VAL 52 2HG2 VAL 52 12.721 19.430 2.944
439 HG23 VAL 52 3HG2 VAL 52 11.173 20.221 3.241
440 H TYR 53 H TYR 53 14.150 23.085 1.469
441 HA TYR 53 HA TYR 53 13.583 24.402 -1.099
442 HB2 TYR 53 1HB TYR 53 15.327 25.107 1.227
443 HB3 TYR 53 2HB TYR 53 15.765 25.690 -0.375
444 HD1 TYR 53 HD1 TYR 53 13.489 26.592 -1.678
445 HD2 TYR 53 HD2 TYR 53 14.237 26.669 2.510
446 HE1 TYR 53 HE1 TYR 53 11.903 28.456 -1.435
447 HE2 TYR 53 HE2 TYR 53 12.652 28.533 2.765
448 HH TYR 53 HH TYR 53 11.705 30.461 0.509
449 H CYS 54 H CYS 54 14.042 21.958 -1.696
450 HA CYS 54 HA CYS 54 16.558 20.849 -1.717
451 HB2 CYS 54 1HB CYS 54 15.817 19.802 -3.939
452 HB3 CYS 54 2HB CYS 54 14.807 19.504 -2.529
453 HG CYS 54 HG CYS 54 14.116 21.234 -5.334
454 H GLY 55 H GLY 55 15.168 23.028 -4.171
455 HA2 GLY 55 1HA GLY 55 17.072 23.209 -6.050
456 HA3 GLY 55 2HA GLY 55 16.265 24.642 -5.432
457 H GLY 56 H GLY 56 19.176 22.766 -5.443
458 HA2 GLY 56 1HA GLY 56 21.079 24.539 -5.172
459 HA3 GLY 56 2HA GLY 56 20.453 24.585 -3.531
460 H ASP 57 H ASP 57 19.855 21.562 -4.086
461 HA ASP 57 HA ASP 57 22.596 20.617 -3.566
462 HB2 ASP 57 1HB ASP 57 20.401 20.585 -1.783
463 HB3 ASP 57 2HB ASP 57 20.656 18.920 -2.299
464 H LEU 58 H LEU 58 22.572 18.074 -3.689
465 HA LEU 58 HA LEU 58 22.293 17.320 -6.310
466 HB2 LEU 58 1HB LEU 58 22.994 16.078 -3.890
467 HB3 LEU 58 2HB LEU 58 21.760 15.057 -4.624
468 HG LEU 58 HG LEU 58 23.166 15.014 -6.703
469 HD11 LEU 58 1HD1 LEU 58 25.364 15.795 -6.715
470 HD12 LEU 58 2HD1 LEU 58 25.400 16.003 -4.965
471 HD13 LEU 58 3HD1 LEU 58 24.450 17.103 -5.963
472 HD21 LEU 58 1HD2 LEU 58 23.176 13.116 -5.254
473 HD22 LEU 58 2HD2 LEU 58 24.276 13.910 -4.128
474 HD23 LEU 58 3HD2 LEU 58 24.844 13.438 -5.730
475 H LEU 59 H LEU 59 19.957 16.795 -3.683
476 HA LEU 59 HA LEU 59 18.031 15.434 -5.199
477 HB2 LEU 59 1HB LEU 59 16.786 15.469 -3.326
478 HB3 LEU 59 2HB LEU 59 18.294 16.020 -2.598
479 HG LEU 59 HG LEU 59 16.116 17.879 -3.541
480 HD11 LEU 59 1HD1 LEU 59 16.651 16.822 -0.769
481 HD12 LEU 59 2HD1 LEU 59 15.244 16.464 -1.770
482 HD13 LEU 59 3HD1 LEU 59 15.511 18.104 -1.179
483 HD21 LEU 59 1HD2 LEU 59 17.623 19.461 -3.164
484 HD22 LEU 59 2HD2 LEU 59 18.809 18.254 -2.667
485 HD23 LEU 59 3HD2 LEU 59 17.710 18.953 -1.477
486 H GLY 60 H GLY 60 18.633 18.867 -4.721
487 HA2 GLY 60 1HA GLY 60 16.225 19.811 -5.877
488 HA3 GLY 60 2HA GLY 60 17.709 20.734 -5.690
489 H GLU 61 H GLU 61 19.509 19.852 -7.276
490 HA GLU 61 HA GLU 61 18.781 20.584 -9.844
491 HB2 GLU 61 1HB GLU 61 20.926 19.266 -10.490
492 HB3 GLU 61 2HB GLU 61 21.064 20.675 -9.447
493 HG2 GLU 61 1HG GLU 61 22.029 19.460 -7.878
494 HG3 GLU 61 2HG GLU 61 20.642 18.374 -7.825
495 H LEU 62 H LEU 62 19.048 17.338 -8.449
496 HA LEU 62 HA LEU 62 18.561 15.871 -10.780
497 HB2 LEU 62 1HB LEU 62 19.310 14.557 -9.062
498 HB3 LEU 62 2HB LEU 62 18.297 15.359 -7.864
499 HG LEU 62 HG LEU 62 16.437 14.051 -8.386
500 HD11 LEU 62 1HD1 LEU 62 15.961 13.825 -10.551
501 HD12 LEU 62 2HD1 LEU 62 16.996 12.398 -10.514
502 HD13 LEU 62 3HD1 LEU 62 17.655 13.952 -11.025
503 HD21 LEU 62 1HD2 LEU 62 18.876 12.306 -8.703
504 HD22 LEU 62 2HD2 LEU 62 17.252 11.718 -8.348
505 HD23 LEU 62 3HD2 LEU 62 18.086 12.757 -7.192
506 H LEU 63 H LEU 63 16.263 16.818 -8.222
507 HA LEU 63 HA LEU 63 13.945 15.820 -9.331
508 HB2 LEU 63 1HB LEU 63 14.652 17.712 -7.296
509 HB3 LEU 63 2HB LEU 63 13.264 18.307 -8.204
510 HG LEU 63 HG LEU 63 13.266 15.521 -7.110
511 HD11 LEU 63 1HD1 LEU 63 13.816 16.741 -5.167
512 HD12 LEU 63 2HD1 LEU 63 12.069 16.506 -5.114
513 HD13 LEU 63 3HD1 LEU 63 12.734 18.066 -5.600
514 HD21 LEU 63 1HD2 LEU 63 11.522 16.201 -8.692
515 HD22 LEU 63 2HD2 LEU 63 11.086 17.540 -7.630
516 HD23 LEU 63 3HD2 LEU 63 10.860 15.876 -7.089
517 H GLY 64 H GLY 64 15.358 19.052 -9.829
518 HA2 GLY 64 1HA GLY 64 15.381 19.992 -12.065
519 HA3 GLY 64 2HA GLY 64 13.840 19.198 -12.355
520 H ARG 65 H ARG 65 13.354 20.192 -9.382
521 HA ARG 65 HA ARG 65 12.114 22.692 -10.259
522 HB2 ARG 65 1HB ARG 65 11.706 21.368 -7.588
523 HB3 ARG 65 2HB ARG 65 10.641 22.487 -8.428
524 HG2 ARG 65 1HG ARG 65 11.135 19.588 -9.000
525 HG3 ARG 65 2HG ARG 65 9.612 20.402 -8.635
526 HD2 ARG 65 1HD ARG 65 9.578 21.466 -10.762
527 HD3 ARG 65 2HD ARG 65 11.234 20.969 -11.106
528 HE ARG 65 HE ARG 65 10.454 18.909 -11.752
529 HH11 ARG 65 1HH1 ARG 65 7.929 20.645 -10.099
530 HH12 ARG 65 2HH1 ARG 65 6.694 19.501 -10.511
531 HH21 ARG 65 1HH2 ARG 65 8.837 17.397 -12.301
532 HH22 ARG 65 2HH2 ARG 65 7.212 17.654 -11.762
533 H GLN 66 H GLN 66 11.877 23.704 -7.539
534 HA GLN 66 HA GLN 66 14.667 24.456 -6.984
535 HB2 GLN 66 1HB GLN 66 13.730 26.763 -6.422
536 HB3 GLN 66 2HB GLN 66 13.844 26.344 -8.126
537 HG2 GLN 66 1HG GLN 66 11.321 26.034 -6.526
538 HG3 GLN 66 2HG GLN 66 11.733 27.501 -7.412
539 HE21 GLN 66 2HE2 GLN 66 12.309 27.118 -9.750
540 HE22 GLN 66 1HE2 GLN 66 11.321 25.998 -10.619
541 H SER 67 H SER 67 11.365 24.170 -5.779
542 HA SER 67 HA SER 67 12.346 23.379 -3.186
543 HB2 SER 67 1HB SER 67 11.319 25.109 -1.890
544 HB3 SER 67 2HB SER 67 12.291 25.911 -3.124
545 HG SER 67 HG SER 67 10.483 26.470 -4.205
546 H PHE 68 H PHE 68 10.947 22.044 -2.162
547 HA PHE 68 HA PHE 68 8.199 21.873 -3.192
548 HB2 PHE 68 1HB PHE 68 8.359 19.388 -3.019
549 HB3 PHE 68 2HB PHE 68 9.406 20.075 -4.256
550 HD1 PHE 68 HD1 PHE 68 9.500 19.092 -0.660
551 HD2 PHE 68 HD2 PHE 68 11.586 19.359 -4.361
552 HE1 PHE 68 HE1 PHE 68 11.432 17.952 0.350
553 HE2 PHE 68 HE2 PHE 68 13.520 18.218 -3.357
554 HZ PHE 68 HZ PHE 68 13.445 17.512 -0.999
555 H SER 69 H SER 69 6.626 21.308 -1.712
556 HA SER 69 HA SER 69 7.331 21.748 1.057
557 HB2 SER 69 1HB SER 69 4.654 21.248 -0.268
558 HB3 SER 69 2HB SER 69 4.873 21.652 1.435
559 HG SER 69 HG SER 69 4.727 23.627 0.718
560 H VAL 70 H VAL 70 7.348 20.279 2.675
561 HA VAL 70 HA VAL 70 7.532 17.511 1.993
562 HB VAL 70 HB VAL 70 8.459 17.207 4.028
563 HG11 VAL 70 1HG1 VAL 70 8.429 20.198 4.283
564 HG12 VAL 70 2HG1 VAL 70 9.700 19.063 4.742
565 HG13 VAL 70 3HG1 VAL 70 9.371 19.378 3.038
566 HG21 VAL 70 1HG2 VAL 70 6.267 18.970 5.080
567 HG22 VAL 70 2HG2 VAL 70 6.527 17.248 5.362
568 HG23 VAL 70 3HG2 VAL 70 7.604 18.434 6.098
569 H LYS 71 H LYS 71 5.080 19.564 3.411
570 HA LYS 71 HA LYS 71 3.414 17.487 4.398
571 HB2 LYS 71 1HB LYS 71 3.432 20.282 4.483
572 HB3 LYS 71 2HB LYS 71 1.956 19.869 3.621
573 HG2 LYS 71 1HG LYS 71 0.976 19.464 5.560
574 HG3 LYS 71 2HG LYS 71 2.104 18.133 5.829
575 HD2 LYS 71 1HD LYS 71 2.400 19.470 7.710
576 HD3 LYS 71 2HD LYS 71 3.723 19.967 6.652
577 HE2 LYS 71 1HE LYS 71 2.985 22.049 7.028
578 HE3 LYS 71 2HE LYS 71 1.711 21.646 5.878
579 HZ1 LYS 71 1HZ LYS 71 0.990 20.702 8.427
580 HZ2 LYS 71 2HZ LYS 71 0.218 21.869 7.477
581 HZ3 LYS 71 3HZ LYS 71 1.433 22.330 8.560
582 H ASP 72 H ASP 72 4.003 18.741 1.264
583 HA ASP 72 HA ASP 72 1.640 17.318 0.226
584 HB2 ASP 72 1HB ASP 72 1.608 19.753 -0.213
585 HB3 ASP 72 2HB ASP 72 3.144 19.606 -1.061
586 HA PRO 73 HA PRO 73 5.186 14.796 -1.178
587 HB2 PRO 73 1HB PRO 73 3.771 12.480 -1.250
588 HB3 PRO 73 2HB PRO 73 4.503 13.113 0.229
589 HG2 PRO 73 1HG PRO 73 1.667 13.300 -0.711
590 HG3 PRO 73 2HG PRO 73 2.286 12.947 0.912
591 HD2 PRO 73 1HD PRO 73 1.374 15.395 0.202
592 HD3 PRO 73 2HD PRO 73 2.680 15.169 1.382
593 H SER 74 H SER 74 4.299 16.398 -3.053
594 HA SER 74 HA SER 74 2.945 14.824 -5.115
595 HB2 SER 74 1HB SER 74 3.243 17.692 -4.534
596 HB3 SER 74 2HB SER 74 3.394 17.281 -6.243
597 HG SER 74 HG SER 74 1.189 17.242 -4.614
598 HA PRO 75 HA PRO 75 6.899 16.093 -7.519
599 HB2 PRO 75 1HB PRO 75 8.715 17.682 -6.276
600 HB3 PRO 75 2HB PRO 75 7.347 18.323 -7.193
601 HG2 PRO 75 1HG PRO 75 7.644 17.966 -4.236
602 HG3 PRO 75 2HG PRO 75 6.964 19.335 -5.135
603 HD2 PRO 75 1HD PRO 75 5.414 17.457 -3.951
604 HD3 PRO 75 2HD PRO 75 4.935 18.287 -5.445
605 H LEU 76 H LEU 76 7.222 15.515 -4.077
606 HA LEU 76 HA LEU 76 9.793 14.431 -4.006
607 HB2 LEU 76 1HB LEU 76 8.579 14.987 -1.994
608 HB3 LEU 76 2HB LEU 76 7.364 13.761 -2.352
609 HG LEU 76 HG LEU 76 9.611 12.244 -2.253
610 HD11 LEU 76 1HD1 LEU 76 11.246 13.587 -1.462
611 HD12 LEU 76 2HD1 LEU 76 10.504 13.192 0.087
612 HD13 LEU 76 3HD1 LEU 76 10.114 14.713 -0.714
613 HD21 LEU 76 1HD2 LEU 76 8.596 11.270 -0.479
614 HD22 LEU 76 2HD2 LEU 76 7.264 12.313 -0.976
615 HD23 LEU 76 3HD2 LEU 76 8.321 12.803 0.349
616 H TYR 77 H TYR 77 6.697 12.662 -4.172
617 HA TYR 77 HA TYR 77 7.830 10.136 -4.614
618 HB2 TYR 77 1HB TYR 77 5.117 11.320 -5.077
619 HB3 TYR 77 2HB TYR 77 5.477 9.711 -5.694
620 HD1 TYR 77 HD1 TYR 77 6.402 7.997 -3.988
621 HD2 TYR 77 HD2 TYR 77 4.408 11.588 -2.876
622 HE1 TYR 77 HE1 TYR 77 5.917 7.036 -1.776
623 HE2 TYR 77 HE2 TYR 77 3.919 10.638 -0.661
624 HH TYR 77 HH TYR 77 3.750 7.829 0.138
625 H ASP 78 H ASP 78 6.879 12.690 -6.837
626 HA ASP 78 HA ASP 78 7.025 11.278 -9.241
627 HB2 ASP 78 1HB ASP 78 6.461 13.856 -8.555
628 HB3 ASP 78 2HB ASP 78 8.029 14.047 -9.335
629 H MET 79 H MET 79 9.547 12.810 -7.316
630 HA MET 79 HA MET 79 11.612 12.399 -9.255
631 HB2 MET 79 1HB MET 79 11.918 14.187 -7.711
632 HB3 MET 79 2HB MET 79 11.651 13.132 -6.330
633 HG2 MET 79 1HG MET 79 13.816 12.049 -7.758
634 HG3 MET 79 2HG MET 79 14.089 13.787 -7.661
635 HE1 MET 79 1HE MET 79 13.994 14.839 -4.349
636 HE2 MET 79 2HE MET 79 12.634 14.619 -5.450
637 HE3 MET 79 3HE MET 79 12.671 13.759 -3.910
638 H LEU 80 H LEU 80 10.861 10.866 -6.124
639 HA LEU 80 HA LEU 80 12.833 8.924 -6.137
640 HB2 LEU 80 1HB LEU 80 10.047 8.914 -5.009
641 HB3 LEU 80 2HB LEU 80 11.173 7.582 -4.754
642 HG LEU 80 HG LEU 80 12.427 8.746 -3.256
643 HD11 LEU 80 1HD1 LEU 80 12.960 10.516 -4.955
644 HD12 LEU 80 2HD1 LEU 80 12.875 11.076 -3.285
645 HD13 LEU 80 3HD1 LEU 80 11.535 11.388 -4.388
646 HD21 LEU 80 1HD2 LEU 80 10.988 10.149 -1.832
647 HD22 LEU 80 2HD2 LEU 80 10.197 8.649 -2.319
648 HD23 LEU 80 3HD2 LEU 80 9.771 10.169 -3.109
649 H ARG 81 H ARG 81 9.786 9.022 -7.849
650 HA ARG 81 HA ARG 81 9.171 6.526 -8.556
651 HB2 ARG 81 1HB ARG 81 8.487 8.889 -9.578
652 HB3 ARG 81 2HB ARG 81 9.558 8.361 -10.868
653 HG2 ARG 81 1HG ARG 81 8.042 6.145 -10.531
654 HG3 ARG 81 2HG ARG 81 6.885 7.413 -10.122
655 HD2 ARG 81 1HD ARG 81 6.759 8.149 -12.241
656 HD3 ARG 81 2HD ARG 81 8.493 7.968 -12.507
657 HE ARG 81 HE ARG 81 7.137 5.455 -12.405
658 HH11 ARG 81 1HH1 ARG 81 7.897 8.167 -14.451
659 HH12 ARG 81 2HH1 ARG 81 7.765 7.261 -15.922
660 HH21 ARG 81 1HH2 ARG 81 6.959 4.252 -14.335
661 HH22 ARG 81 2HH2 ARG 81 7.230 5.035 -15.855
662 H LYS 82 H LYS 82 11.741 8.346 -10.233
663 HA LYS 82 HA LYS 82 12.844 5.780 -11.158
664 HB2 LYS 82 1HB LYS 82 13.487 6.781 -13.092
665 HB3 LYS 82 2HB LYS 82 12.196 7.901 -12.678
666 HG2 LYS 82 1HG LYS 82 15.110 8.298 -12.029
667 HG3 LYS 82 2HG LYS 82 14.251 9.041 -13.381
668 HD2 LYS 82 1HD LYS 82 13.581 9.411 -10.461
669 HD3 LYS 82 2HD LYS 82 14.456 10.568 -11.467
670 HE2 LYS 82 1HE LYS 82 12.352 10.374 -13.005
671 HE3 LYS 82 2HE LYS 82 11.574 9.782 -11.538
672 HZ1 LYS 82 1HZ LYS 82 12.386 12.453 -12.233
673 HZ2 LYS 82 2HZ LYS 82 12.873 11.991 -10.681
674 HZ3 LYS 82 3HZ LYS 82 11.237 11.931 -11.107
675 H ASN 83 H ASN 83 13.256 7.979 -8.761
676 HA ASN 83 HA ASN 83 16.174 7.923 -8.767
677 HB2 ASN 83 1HB ASN 83 15.716 10.003 -7.998
678 HB3 ASN 83 2HB ASN 83 14.098 9.556 -7.467
679 HD21 ASN 83 2HD2 ASN 83 17.195 10.348 -6.501
680 HD22 ASN 83 1HD2 ASN 83 17.080 9.882 -4.842
681 H LEU 84 H LEU 84 13.529 7.089 -6.526
682 HA LEU 84 HA LEU 84 15.332 5.468 -4.933
683 HB2 LEU 84 1HB LEU 84 12.973 6.885 -4.440
684 HB3 LEU 84 2HB LEU 84 12.544 5.186 -4.255
685 HG LEU 84 HG LEU 84 13.999 4.892 -2.451
686 HD11 LEU 84 1HD1 LEU 84 15.491 7.048 -3.724
687 HD12 LEU 84 2HD1 LEU 84 16.056 5.719 -2.713
688 HD13 LEU 84 3HD1 LEU 84 15.422 7.185 -1.967
689 HD21 LEU 84 1HD2 LEU 84 12.789 6.071 -1.008
690 HD22 LEU 84 2HD2 LEU 84 12.091 6.921 -2.387
691 HD23 LEU 84 3HD2 LEU 84 13.498 7.590 -1.559
692 H VAL 85 H VAL 85 15.896 3.692 -6.123
693 HA VAL 85 HA VAL 85 14.482 2.181 -7.874
694 HB VAL 85 HB VAL 85 16.593 1.480 -5.895
695 HG11 VAL 85 1HG1 VAL 85 15.548 -0.539 -5.633
696 HG12 VAL 85 2HG1 VAL 85 14.777 -0.472 -7.219
697 HG13 VAL 85 3HG1 VAL 85 16.491 -0.868 -7.086
698 HG21 VAL 85 1HG2 VAL 85 16.418 2.169 -8.646
699 HG22 VAL 85 2HG2 VAL 85 17.861 1.868 -7.677
700 HG23 VAL 85 3HG2 VAL 85 17.076 0.537 -8.527
701 H THR 86 H THR 86 12.849 0.742 -7.854
702 HA THR 86 HA THR 86 11.813 -0.163 -5.255
703 HB THR 86 HB THR 86 9.483 0.072 -6.264
704 HG1 THR 86 1HG THR 86 10.265 0.487 -8.430
705 HG21 THR 86 1HG2 THR 86 9.987 1.548 -4.519
706 HG22 THR 86 2HG2 THR 86 9.486 2.611 -5.834
707 HG23 THR 86 3HG2 THR 86 11.199 2.405 -5.471
708 H LEU 87 H LEU 87 11.391 -2.280 -5.166
709 HA LEU 87 HA LEU 87 11.632 -3.837 -7.628
710 HB2 LEU 87 1HB LEU 87 11.298 -5.389 -5.215
711 HB3 LEU 87 2HB LEU 87 12.616 -5.395 -6.386
712 HG LEU 87 HG LEU 87 12.344 -3.542 -4.019
713 HD11 LEU 87 1HD1 LEU 87 14.127 -5.906 -4.563
714 HD12 LEU 87 2HD1 LEU 87 12.931 -5.733 -3.279
715 HD13 LEU 87 3HD1 LEU 87 14.393 -4.747 -3.261
716 HD21 LEU 87 1HD2 LEU 87 13.930 -2.252 -4.891
717 HD22 LEU 87 2HD2 LEU 87 13.681 -3.098 -6.418
718 HD23 LEU 87 3HD2 LEU 87 14.930 -3.646 -5.299
719 H ALA 88 H ALA 88 9.868 -4.481 -8.652
720 HA ALA 88 HA ALA 88 7.751 -5.196 -9.093
721 HB1 ALA 88 1HB ALA 88 8.511 -6.711 -7.031
722 HB2 ALA 88 2HB ALA 88 7.155 -5.873 -6.275
723 HB3 ALA 88 3HB ALA 88 6.903 -6.810 -7.747
724 H THR 89 H THR 89 6.338 -3.663 -9.595
725 HA THR 89 HA THR 89 5.010 -1.805 -9.447
726 HB THR 89 HB THR 89 4.085 -2.628 -6.740
727 HG1 THR 89 1HG THR 89 3.357 -4.163 -9.007
728 HG21 THR 89 1HG2 THR 89 2.522 -2.154 -9.272
729 HG22 THR 89 2HG2 THR 89 3.022 -0.849 -8.196
730 HG23 THR 89 3HG2 THR 89 1.939 -2.110 -7.609
731 H1 SER 115 H SER 115 2.036 25.562 16.825
732 HA SER 115 HA SER 115 2.413 28.088 17.999
733 HB2 SER 115 1HB SER 115 3.569 27.225 20.120
734 HB3 SER 115 2HB SER 115 1.806 27.213 20.112
735 HG SER 115 HG SER 115 1.835 25.115 20.241
736 H GLN 116 H GLN 116 3.918 24.863 17.855
737 HA GLN 116 HA GLN 116 6.255 26.116 16.580
738 HB2 GLN 116 1HB GLN 116 6.128 24.502 19.012
739 HB3 GLN 116 2HB GLN 116 7.273 23.875 17.833
740 HG2 GLN 116 1HG GLN 116 7.728 26.624 17.902
741 HG3 GLN 116 2HG GLN 116 7.498 26.145 19.583
742 HE21 GLN 116 2HE2 GLN 116 8.922 24.417 16.843
743 HE22 GLN 116 1HE2 GLN 116 10.469 24.177 17.573
744 H GLU 117 H GLU 117 7.421 24.780 15.104
745 HA GLU 117 HA GLU 117 6.006 22.360 14.225
746 HB2 GLU 117 1HB GLU 117 7.182 24.077 12.112
747 HB3 GLU 117 2HB GLU 117 5.751 23.056 12.067
748 HG2 GLU 117 1HG GLU 117 4.835 24.894 13.732
749 HG3 GLU 117 2HG GLU 117 6.044 25.880 12.913
750 H THR 118 H THR 118 7.285 20.704 13.561
751 HA THR 118 HA THR 118 10.160 21.201 13.238
752 HB THR 118 HB THR 118 8.873 19.392 15.239
753 HG1 THR 118 1HG THR 118 11.391 20.400 15.677
754 HG21 THR 118 1HG2 THR 118 11.525 18.866 13.893
755 HG22 THR 118 2HG2 THR 118 10.103 17.822 13.873
756 HG23 THR 118 3HG2 THR 118 10.981 18.089 15.379
757 H PHE 119 H PHE 119 11.233 19.777 11.876
758 HA PHE 119 HA PHE 119 9.979 18.793 9.675
759 HB2 PHE 119 1HB PHE 119 12.551 18.891 10.439
760 HB3 PHE 119 2HB PHE 119 12.269 17.164 10.637
761 HD1 PHE 119 HD1 PHE 119 10.071 17.519 8.250
762 HD2 PHE 119 HD2 PHE 119 14.252 18.152 8.736
763 HE1 PHE 119 HE1 PHE 119 10.399 17.190 5.833
764 HE2 PHE 119 HE2 PHE 119 14.586 17.825 6.321
765 HZ PHE 119 HZ PHE 119 12.658 17.344 4.865
766 H SER 120 H SER 120 11.011 16.749 12.413
767 HA SER 120 HA SER 120 9.830 14.385 11.578
768 HB2 SER 120 1HB SER 120 11.228 15.230 13.825
769 HB3 SER 120 2HB SER 120 9.664 14.731 14.469
770 HG SER 120 HG SER 120 11.552 13.131 14.020
771 H ASP 121 H ASP 121 8.361 17.240 12.779
772 HA ASP 121 HA ASP 121 5.954 16.077 13.768
773 HB2 ASP 121 1HB ASP 121 7.066 18.549 13.950
774 HB3 ASP 121 2HB ASP 121 5.828 18.838 12.731
775 H LEU 122 H LEU 122 6.536 18.026 10.834
776 HA LEU 122 HA LEU 122 4.070 17.123 9.653
777 HB2 LEU 122 1HB LEU 122 6.232 18.574 8.177
778 HB3 LEU 122 2HB LEU 122 4.488 18.637 7.932
779 HG LEU 122 HG LEU 122 5.545 19.670 10.506
780 HD11 LEU 122 1HD1 LEU 122 5.593 21.889 8.881
781 HD12 LEU 122 2HD1 LEU 122 6.402 20.660 7.910
782 HD13 LEU 122 3HD1 LEU 122 7.001 21.042 9.524
783 HD21 LEU 122 1HD2 LEU 122 3.565 21.016 8.731
784 HD22 LEU 122 2HD2 LEU 122 3.643 20.955 10.492
785 HD23 LEU 122 3HD2 LEU 122 3.094 19.546 9.584
786 H TRP 123 H TRP 123 7.529 16.656 9.005
787 HA TRP 123 HA TRP 123 7.647 15.252 6.742
788 HB2 TRP 123 1HB TRP 123 9.515 15.621 8.420
789 HB3 TRP 123 2HB TRP 123 8.950 14.169 9.242
790 HD1 TRP 123 HD1 TRP 123 10.483 12.218 8.653
791 HE1 TRP 123 HE1 TRP 123 11.674 11.370 6.535
792 HE3 TRP 123 HE3 TRP 123 9.090 15.912 5.405
793 HZ2 TRP 123 HZ2 TRP 123 11.983 12.163 3.843
794 HZ3 TRP 123 HZ3 TRP 123 9.876 15.793 3.077
795 HH2 TRP 123 HH2 TRP 123 11.293 13.957 2.314
796 H LYS 124 H LYS 124 6.927 13.637 9.844
797 HA LYS 124 HA LYS 124 6.388 11.112 8.969
798 HB2 LYS 124 1HB LYS 124 5.998 12.519 11.331
799 HB3 LYS 124 2HB LYS 124 4.382 11.977 10.898
800 HG2 LYS 124 1HG LYS 124 5.652 9.684 10.525
801 HG3 LYS 124 2HG LYS 124 6.767 10.404 11.688
802 HD2 LYS 124 1HD LYS 124 5.283 9.288 13.067
803 HD3 LYS 124 2HD LYS 124 4.604 10.917 13.041
804 HE2 LYS 124 1HE LYS 124 2.726 10.221 12.051
805 HE3 LYS 124 2HE LYS 124 3.612 9.259 10.869
806 HZ1 LYS 124 1HZ LYS 124 2.190 8.378 13.123
807 HZ2 LYS 124 2HZ LYS 124 3.819 7.975 13.335
808 HZ3 LYS 124 3HZ LYS 124 2.992 7.451 11.956
809 H LEU 125 H LEU 125 4.179 13.879 8.928
810 HA LEU 125 HA LEU 125 1.789 12.874 8.272
811 HB2 LEU 125 1HB LEU 125 3.150 15.106 6.771
812 HB3 LEU 125 2HB LEU 125 1.414 14.800 6.801
813 HG LEU 125 HG LEU 125 3.028 15.489 9.251
814 HD11 LEU 125 1HD1 LEU 125 3.067 17.293 7.529
815 HD12 LEU 125 2HD1 LEU 125 2.272 17.743 9.036
816 HD13 LEU 125 3HD1 LEU 125 1.306 17.341 7.617
817 HD21 LEU 125 1HD2 LEU 125 1.149 15.168 10.390
818 HD22 LEU 125 2HD2 LEU 125 0.459 14.446 8.936
819 HD23 LEU 125 3HD2 LEU 125 0.227 16.164 9.264
820 H LEU 126 H LEU 126 4.477 13.200 5.973
821 HA LEU 126 HA LEU 126 3.439 12.467 3.613
822 HB2 LEU 126 1HB LEU 126 5.995 12.233 4.864
823 HB3 LEU 126 2HB LEU 126 5.693 10.787 3.903
824 HG LEU 126 HG LEU 126 5.690 11.953 1.908
825 HD11 LEU 126 1HD1 LEU 126 5.609 14.548 1.981
826 HD12 LEU 126 2HD1 LEU 126 4.891 14.301 3.572
827 HD13 LEU 126 3HD1 LEU 126 4.116 13.623 2.141
828 HD21 LEU 126 1HD2 LEU 126 7.688 12.915 3.851
829 HD22 LEU 126 2HD2 LEU 126 7.543 13.851 2.363
830 HD23 LEU 126 3HD2 LEU 126 7.907 12.127 2.288
831 HA PRO 127 HA PRO 127 1.391 8.591 4.132
832 HB2 PRO 127 1HB PRO 127 1.170 7.928 1.508
833 HB3 PRO 127 2HB PRO 127 0.171 9.170 2.273
834 HG2 PRO 127 1HG PRO 127 2.630 9.485 0.595
835 HG3 PRO 127 2HG PRO 127 1.121 10.416 0.554
836 HD2 PRO 127 1HD PRO 127 3.356 11.319 1.787
837 HD3 PRO 127 2HD PRO 127 1.723 11.711 2.363
838 H GLU 128 H GLU 128 4.554 8.985 3.207
839 HA GLU 128 HA GLU 128 5.576 6.879 1.964
840 HB2 GLU 128 1HB GLU 128 7.383 6.782 3.784
841 HB3 GLU 128 2HB GLU 128 7.132 8.317 2.964
842 HG2 GLU 128 1HG GLU 128 7.022 9.213 4.990
843 HG3 GLU 128 2HG GLU 128 5.421 8.485 5.101
844 H ASN 129 H ASN 129 4.150 6.720 5.189
845 HA ASN 129 HA ASN 129 4.803 4.031 5.730
846 HB2 ASN 129 1HB ASN 129 3.862 5.925 7.286
847 HB3 ASN 129 2HB ASN 129 2.298 5.281 6.797
848 HD21 ASN 129 2HD2 ASN 129 4.705 5.079 9.036
849 HD22 ASN 129 1HD2 ASN 129 4.363 3.512 9.680
Start of MODEL 7
1 H1 GLN 1 H GLN 1 1.948 0.263 1.410
2 HA GLN 1 HA GLN 1 2.445 -1.074 -0.748
3 HB2 GLN 1 1HB GLN 1 2.995 1.703 -1.761
4 HB3 GLN 1 2HB GLN 1 2.908 0.200 -2.670
5 HG2 GLN 1 1HG GLN 1 0.403 0.314 -1.680
6 HG3 GLN 1 2HG GLN 1 0.772 2.032 -1.828
7 HE21 GLN 1 2HE2 GLN 1 -0.460 2.556 -3.539
8 HE22 GLN 1 1HE2 GLN 1 -0.288 1.873 -5.117
9 H ILE 2 H ILE 2 3.950 -1.637 0.927
10 HA ILE 2 HA ILE 2 6.273 0.107 1.234
11 HB ILE 2 HB ILE 2 5.708 -2.524 2.603
12 HG12 ILE 2 1HG1 ILE 2 4.036 -1.270 3.533
13 HG13 ILE 2 2HG1 ILE 2 5.363 -0.723 4.552
14 HG21 ILE 2 1HG2 ILE 2 7.901 -2.304 3.062
15 HG22 ILE 2 2HG2 ILE 2 7.914 -0.582 2.685
16 HG23 ILE 2 3HG2 ILE 2 7.335 -1.136 4.256
17 HD11 ILE 2 1HD1 ILE 2 4.031 0.689 2.279
18 HD12 ILE 2 2HD1 ILE 2 4.284 1.233 3.938
19 HD13 ILE 2 3HD1 ILE 2 5.645 1.148 2.820
20 H ASN 3 H ASN 3 6.780 -0.320 -1.095
21 HA ASN 3 HA ASN 3 7.809 -2.938 -1.749
22 HB2 ASN 3 1HB ASN 3 6.755 -0.960 -3.269
23 HB3 ASN 3 2HB ASN 3 8.472 -0.644 -3.497
24 HD21 ASN 3 2HD2 ASN 3 9.604 -3.053 -3.571
25 HD22 ASN 3 1HD2 ASN 3 8.982 -3.995 -4.879
26 H GLN 4 H GLN 4 9.897 -3.582 -1.782
27 HA GLN 4 HA GLN 4 11.803 -2.147 -0.253
28 HB2 GLN 4 1HB GLN 4 12.562 -4.368 -2.118
29 HB3 GLN 4 2HB GLN 4 13.210 -3.987 -0.528
30 HG2 GLN 4 1HG GLN 4 10.603 -5.307 -1.206
31 HG3 GLN 4 2HG GLN 4 11.951 -5.953 -0.271
32 HE21 GLN 4 2HE2 GLN 4 9.043 -4.188 -0.197
33 HE22 GLN 4 1HE2 GLN 4 9.032 -3.822 1.491
34 H VAL 5 H VAL 5 13.989 -1.563 -1.021
35 HA VAL 5 HA VAL 5 14.180 -0.831 -3.836
36 HB VAL 5 HB VAL 5 14.159 1.410 -3.621
37 HG11 VAL 5 1HG1 VAL 5 12.658 2.232 -1.859
38 HG12 VAL 5 2HG1 VAL 5 12.047 0.757 -2.611
39 HG13 VAL 5 3HG1 VAL 5 12.809 0.687 -1.022
40 HG21 VAL 5 1HG2 VAL 5 16.216 1.538 -2.382
41 HG22 VAL 5 2HG2 VAL 5 15.044 2.630 -1.645
42 HG23 VAL 5 3HG2 VAL 5 15.396 1.075 -0.891
43 H ARG 6 H ARG 6 16.372 0.132 -4.320
44 HA ARG 6 HA ARG 6 18.442 -0.783 -2.456
45 HB2 ARG 6 1HB ARG 6 17.761 -2.084 -4.895
46 HB3 ARG 6 2HB ARG 6 19.330 -1.321 -5.113
47 HG2 ARG 6 1HG ARG 6 20.055 -2.441 -2.985
48 HG3 ARG 6 2HG ARG 6 18.542 -3.348 -3.040
49 HD2 ARG 6 1HD ARG 6 19.675 -3.559 -5.600
50 HD3 ARG 6 2HD ARG 6 20.996 -3.808 -4.459
51 HE ARG 6 HE ARG 6 18.629 -5.314 -3.836
52 HH11 ARG 6 1HH1 ARG 6 21.590 -5.257 -5.666
53 HH12 ARG 6 2HH1 ARG 6 21.698 -6.982 -5.791
54 HH21 ARG 6 1HH2 ARG 6 18.760 -7.586 -3.994
55 HH22 ARG 6 2HH2 ARG 6 20.087 -8.305 -4.841
56 HA PRO 7 HA PRO 7 19.605 3.406 -3.686
57 HB2 PRO 7 1HB PRO 7 21.303 3.776 -1.601
58 HB3 PRO 7 2HB PRO 7 19.552 3.965 -1.458
59 HG2 PRO 7 1HG PRO 7 21.273 1.637 -0.698
60 HG3 PRO 7 2HG PRO 7 19.922 2.366 0.189
61 HD2 PRO 7 1HD PRO 7 19.655 0.098 -1.267
62 HD3 PRO 7 2HD PRO 7 18.337 1.272 -1.078
63 H LYS 8 H LYS 8 20.907 3.348 -5.428
64 HA LYS 8 HA LYS 8 23.170 1.702 -5.726
65 HB2 LYS 8 1HB LYS 8 22.611 4.293 -7.176
66 HB3 LYS 8 2HB LYS 8 23.636 2.975 -7.728
67 HG2 LYS 8 1HG LYS 8 21.324 1.649 -7.406
68 HG3 LYS 8 2HG LYS 8 20.705 3.256 -7.794
69 HD2 LYS 8 1HD LYS 8 20.912 2.197 -9.872
70 HD3 LYS 8 2HD LYS 8 22.352 3.211 -9.756
71 HE2 LYS 8 1HE LYS 8 23.610 1.227 -8.945
72 HE3 LYS 8 2HE LYS 8 22.172 0.247 -9.226
73 HZ1 LYS 8 1HZ LYS 8 22.358 0.469 -11.499
74 HZ2 LYS 8 2HZ LYS 8 23.982 0.370 -11.034
75 HZ3 LYS 8 3HZ LYS 8 23.300 1.872 -11.408
76 H LEU 9 H LEU 9 25.397 2.635 -6.228
77 HA LEU 9 HA LEU 9 26.682 3.494 -4.016
78 HB2 LEU 9 1HB LEU 9 27.983 4.831 -6.129
79 HB3 LEU 9 2HB LEU 9 28.402 3.286 -5.391
80 HG LEU 9 HG LEU 9 26.388 3.447 -7.609
81 HD11 LEU 9 1HD1 LEU 9 28.707 4.529 -8.115
82 HD12 LEU 9 2HD1 LEU 9 27.989 3.393 -9.257
83 HD13 LEU 9 3HD1 LEU 9 29.259 2.854 -8.159
84 HD21 LEU 9 1HD2 LEU 9 26.337 1.249 -7.325
85 HD22 LEU 9 2HD2 LEU 9 27.487 1.390 -5.995
86 HD23 LEU 9 3HD2 LEU 9 28.069 1.157 -7.644
87 HA PRO 10 HA PRO 10 26.208 8.150 -5.232
88 HB2 PRO 10 1HB PRO 10 24.443 8.739 -7.209
89 HB3 PRO 10 2HB PRO 10 26.149 8.394 -7.516
90 HG2 PRO 10 1HG PRO 10 23.774 6.591 -7.780
91 HG3 PRO 10 2HG PRO 10 25.160 6.783 -8.870
92 HD2 PRO 10 1HD PRO 10 24.960 4.730 -7.116
93 HD3 PRO 10 2HD PRO 10 26.520 5.439 -7.583
94 H LEU 11 H LEU 11 23.631 5.898 -4.999
95 HA LEU 11 HA LEU 11 21.817 7.923 -3.892
96 HB2 LEU 11 1HB LEU 11 21.425 5.162 -4.976
97 HB3 LEU 11 2HB LEU 11 20.223 5.877 -3.904
98 HG LEU 11 HG LEU 11 20.986 6.683 -6.688
99 HD11 LEU 11 1HD1 LEU 11 18.401 6.060 -5.275
100 HD12 LEU 11 2HD1 LEU 11 19.194 5.115 -6.535
101 HD13 LEU 11 3HD1 LEU 11 18.502 6.690 -6.920
102 HD21 LEU 11 1HD2 LEU 11 19.677 8.383 -4.578
103 HD22 LEU 11 2HD2 LEU 11 19.500 8.686 -6.307
104 HD23 LEU 11 3HD2 LEU 11 21.095 8.760 -5.556
105 H LEU 12 H LEU 12 24.096 5.697 -2.913
106 HA LEU 12 HA LEU 12 22.812 4.769 -0.518
107 HB2 LEU 12 1HB LEU 12 24.986 3.970 -1.983
108 HB3 LEU 12 2HB LEU 12 25.734 4.709 -0.569
109 HG LEU 12 HG LEU 12 24.151 2.212 -0.801
110 HD11 LEU 12 1HD1 LEU 12 26.733 2.663 -0.394
111 HD12 LEU 12 2HD1 LEU 12 25.895 1.290 0.327
112 HD13 LEU 12 3HD1 LEU 12 26.193 2.742 1.283
113 HD21 LEU 12 1HD2 LEU 12 23.918 2.455 1.799
114 HD22 LEU 12 2HD2 LEU 12 22.682 3.103 0.720
115 HD23 LEU 12 3HD2 LEU 12 23.891 4.178 1.424
116 H LYS 13 H LYS 13 25.508 7.012 -1.161
117 HA LYS 13 HA LYS 13 25.970 7.885 1.414
118 HB2 LYS 13 1HB LYS 13 27.122 9.704 0.486
119 HB3 LYS 13 2HB LYS 13 27.224 8.459 -0.752
120 HG2 LYS 13 1HG LYS 13 26.579 10.112 -2.118
121 HG3 LYS 13 2HG LYS 13 24.965 9.728 -1.515
122 HD2 LYS 13 1HD LYS 13 24.799 11.810 -0.753
123 HD3 LYS 13 2HD LYS 13 26.127 11.478 0.361
124 HE2 LYS 13 1HE LYS 13 27.170 13.140 -0.726
125 HE3 LYS 13 2HE LYS 13 27.470 11.919 -1.962
126 HZ1 LYS 13 1HZ LYS 13 25.957 14.281 -2.162
127 HZ2 LYS 13 2HZ LYS 13 24.931 12.962 -2.422
128 HZ3 LYS 13 3HZ LYS 13 26.318 13.154 -3.371
129 H ILE 14 H ILE 14 23.413 8.795 -0.796
130 HA ILE 14 HA ILE 14 22.489 11.109 0.461
131 HB ILE 14 HB ILE 14 20.749 9.051 -0.895
132 HG12 ILE 14 1HG1 ILE 14 22.647 11.093 -1.994
133 HG13 ILE 14 2HG1 ILE 14 22.362 9.439 -2.524
134 HG21 ILE 14 1HG2 ILE 14 19.374 11.019 -1.471
135 HG22 ILE 14 2HG2 ILE 14 19.491 10.751 0.268
136 HG23 ILE 14 3HG2 ILE 14 20.446 12.023 -0.494
137 HD11 ILE 14 1HD1 ILE 14 21.438 10.709 -4.216
138 HD12 ILE 14 2HD1 ILE 14 20.039 10.308 -3.221
139 HD13 ILE 14 3HD1 ILE 14 20.779 11.904 -3.099
140 H LEU 15 H LEU 15 21.339 7.758 0.878
141 HA LEU 15 HA LEU 15 19.621 8.409 3.050
142 HB2 LEU 15 1HB LEU 15 20.743 5.691 2.425
143 HB3 LEU 15 2HB LEU 15 19.236 6.077 3.253
144 HG LEU 15 HG LEU 15 19.858 6.268 0.319
145 HD11 LEU 15 1HD1 LEU 15 18.914 4.251 0.414
146 HD12 LEU 15 2HD1 LEU 15 17.398 5.104 0.696
147 HD13 LEU 15 3HD1 LEU 15 18.337 4.502 2.062
148 HD21 LEU 15 1HD2 LEU 15 18.695 8.215 0.422
149 HD22 LEU 15 2HD2 LEU 15 17.883 7.782 1.927
150 HD23 LEU 15 3HD2 LEU 15 17.330 7.099 0.397
151 H HIS 16 H HIS 16 22.917 7.200 2.795
152 HA HIS 16 HA HIS 16 23.334 6.476 5.460
153 HB2 HIS 16 1HB HIS 16 25.117 7.328 3.217
154 HB3 HIS 16 2HB HIS 16 25.794 7.214 4.839
155 HD1 HIS 16 HD1 HIS 16 27.272 5.204 4.214
156 HD2 HIS 16 HD2 HIS 16 23.207 4.535 3.677
157 HE1 HIS 16 HE1 HIS 16 27.040 2.725 3.857
158 H ALA 17 H ALA 17 23.938 9.586 3.841
159 HA ALA 17 HA ALA 17 24.910 10.957 6.085
160 HB1 ALA 17 1HB ALA 17 25.217 11.826 3.855
161 HB2 ALA 17 2HB ALA 17 23.475 12.023 3.657
162 HB3 ALA 17 3HB ALA 17 24.346 13.008 4.833
163 H ALA 18 H ALA 18 21.799 9.813 5.421
164 HA ALA 18 HA ALA 18 20.506 11.792 7.151
165 HB1 ALA 18 1HB ALA 18 18.532 10.059 6.368
166 HB2 ALA 18 2HB ALA 18 18.940 11.579 5.571
167 HB3 ALA 18 3HB ALA 18 19.617 10.063 4.978
168 H GLY 19 H GLY 19 22.347 9.441 7.912
169 HA2 GLY 19 1HA GLY 19 22.466 8.380 10.001
170 HA3 GLY 19 2HA GLY 19 20.737 8.624 10.199
171 H ALA 20 H ALA 20 21.424 7.395 7.153
172 HA ALA 20 HA ALA 20 20.417 4.777 7.945
173 HB1 ALA 20 1HB ALA 20 19.543 6.193 5.975
174 HB2 ALA 20 2HB ALA 20 20.968 5.602 5.120
175 HB3 ALA 20 3HB ALA 20 19.774 4.460 5.735
176 H GLN 21 H GLN 21 21.359 2.886 6.611
177 HA GLN 21 HA GLN 21 24.059 2.954 5.790
178 HB2 GLN 21 1HB GLN 21 23.904 3.085 8.499
179 HB3 GLN 21 2HB GLN 21 23.955 1.344 8.260
180 HG2 GLN 21 1HG GLN 21 26.166 1.608 8.270
181 HG3 GLN 21 2HG GLN 21 25.951 2.173 6.614
182 HE21 GLN 21 2HE2 GLN 21 25.253 4.597 6.582
183 HE22 GLN 21 1HE2 GLN 21 26.240 5.640 7.542
184 H GLY 22 H GLY 22 24.466 1.209 4.562
185 HA2 GLY 22 1HA GLY 22 24.258 -1.329 4.588
186 HA3 GLY 22 2HA GLY 22 22.535 -1.016 4.729
187 H GLU 23 H GLU 23 22.120 -2.144 2.799
188 HA GLU 23 HA GLU 23 22.576 -0.527 0.411
189 HB2 GLU 23 1HB GLU 23 23.150 -3.494 0.485
190 HB3 GLU 23 2HB GLU 23 23.275 -2.443 -0.919
191 HG2 GLU 23 1HG GLU 23 25.147 -1.316 -0.033
192 HG3 GLU 23 2HG GLU 23 24.906 -2.020 1.565
193 H MET 24 H MET 24 20.371 -1.593 2.322
194 HA MET 24 HA MET 24 18.432 -2.026 0.195
195 HB2 MET 24 1HB MET 24 18.479 -3.906 2.550
196 HB3 MET 24 2HB MET 24 17.517 -4.029 1.083
197 HG2 MET 24 1HG MET 24 20.514 -4.194 1.079
198 HG3 MET 24 2HG MET 24 19.475 -5.602 1.284
199 HE1 MET 24 1HE MET 24 21.572 -4.153 -1.622
200 HE2 MET 24 2HE MET 24 21.570 -5.597 -0.610
201 HE3 MET 24 3HE MET 24 21.070 -5.703 -2.298
202 H PHE 25 H PHE 25 16.461 -1.168 0.640
203 HA PHE 25 HA PHE 25 15.583 -0.626 3.314
204 HB2 PHE 25 1HB PHE 25 16.206 1.751 1.553
205 HB3 PHE 25 2HB PHE 25 15.551 1.791 3.187
206 HD1 PHE 25 HD2 PHE 25 18.544 1.289 1.155
207 HD2 PHE 25 HD1 PHE 25 16.963 1.389 5.106
208 HE1 PHE 25 HE2 PHE 25 20.828 1.407 2.063
209 HE2 PHE 25 HE1 PHE 25 19.244 1.508 6.020
210 HZ PHE 25 HZ PHE 25 21.181 1.516 4.498
211 H THR 26 H THR 26 13.410 0.066 3.414
212 HA THR 26 HA THR 26 11.905 -0.550 0.995
213 HB THR 26 HB THR 26 10.123 0.069 3.094
214 HG1 THR 26 1HG THR 26 10.941 -0.927 4.842
215 HG21 THR 26 1HG2 THR 26 10.115 -2.613 3.067
216 HG22 THR 26 2HG2 THR 26 10.994 -2.315 1.568
217 HG23 THR 26 3HG2 THR 26 9.380 -1.641 1.793
218 H VAL 27 H VAL 27 9.664 0.797 1.061
219 HA VAL 27 HA VAL 27 10.267 3.332 0.072
220 HB VAL 27 HB VAL 27 7.577 2.759 1.260
221 HG11 VAL 27 1HG1 VAL 27 7.220 3.736 -1.256
222 HG12 VAL 27 2HG1 VAL 27 7.284 4.720 0.208
223 HG13 VAL 27 3HG1 VAL 27 8.729 4.517 -0.783
224 HG21 VAL 27 1HG2 VAL 27 8.859 1.381 -1.071
225 HG22 VAL 27 2HG2 VAL 27 7.910 0.691 0.246
226 HG23 VAL 27 3HG2 VAL 27 7.113 1.630 -1.017
227 H LYS 28 H LYS 28 9.169 2.337 3.284
228 HA LYS 28 HA LYS 28 8.940 4.993 4.301
229 HB2 LYS 28 1HB LYS 28 8.803 2.243 5.418
230 HB3 LYS 28 2HB LYS 28 9.173 3.542 6.544
231 HG2 LYS 28 1HG LYS 28 7.006 3.953 6.699
232 HG3 LYS 28 2HG LYS 28 7.018 4.457 5.007
233 HD2 LYS 28 1HD LYS 28 5.332 2.693 5.548
234 HD3 LYS 28 2HD LYS 28 6.469 2.247 4.274
235 HE2 LYS 28 1HE LYS 28 7.394 0.600 5.503
236 HE3 LYS 28 2HE LYS 28 7.299 1.526 7.001
237 HZ1 LYS 28 1HZ LYS 28 5.319 0.641 7.520
238 HZ2 LYS 28 2HZ LYS 28 5.776 -0.596 6.461
239 HZ3 LYS 28 3HZ LYS 28 4.758 0.644 5.924
240 H GLU 29 H GLU 29 11.371 2.424 4.707
241 HA GLU 29 HA GLU 29 13.122 3.852 6.354
242 HB2 GLU 29 1HB GLU 29 13.840 1.737 4.317
243 HB3 GLU 29 2HB GLU 29 14.816 2.228 5.695
244 HG2 GLU 29 1HG GLU 29 12.519 0.420 5.559
245 HG3 GLU 29 2HG GLU 29 13.880 0.451 6.678
246 H VAL 30 H VAL 30 12.725 3.828 2.872
247 HA VAL 30 HA VAL 30 15.126 5.288 2.317
248 HB VAL 30 HB VAL 30 12.681 4.809 0.608
249 HG11 VAL 30 1HG1 VAL 30 15.362 6.000 -0.082
250 HG12 VAL 30 2HG1 VAL 30 14.186 5.445 -1.276
251 HG13 VAL 30 3HG1 VAL 30 13.783 6.778 -0.193
252 HG21 VAL 30 1HG2 VAL 30 14.335 2.914 1.428
253 HG22 VAL 30 2HG2 VAL 30 13.692 2.933 -0.214
254 HG23 VAL 30 3HG2 VAL 30 15.319 3.536 0.103
255 H MET 31 H MET 31 11.671 6.132 2.418
256 HA MET 31 HA MET 31 12.001 8.859 1.801
257 HB2 MET 31 1HB MET 31 9.782 8.658 1.697
258 HB3 MET 31 2HB MET 31 9.853 7.107 2.522
259 HG2 MET 31 1HG MET 31 8.406 8.531 3.754
260 HG3 MET 31 2HG MET 31 9.888 8.328 4.684
261 HE1 MET 31 1HE MET 31 9.466 12.051 2.028
262 HE2 MET 31 2HE MET 31 10.412 10.622 1.611
263 HE3 MET 31 3HE MET 31 8.654 10.518 1.709
264 H HIS 32 H HIS 32 11.902 7.125 4.882
265 HA HIS 32 HA HIS 32 11.848 9.286 6.625
266 HB2 HIS 32 1HB HIS 32 11.839 6.666 7.022
267 HB3 HIS 32 2HB HIS 32 13.557 6.933 7.302
268 HD1 HIS 32 HD1 HIS 32 10.619 6.614 9.156
269 HD2 HIS 32 HD2 HIS 32 13.752 9.341 9.250
270 HE1 HIS 32 HE1 HIS 32 10.536 7.654 11.444
271 H TYR 33 H TYR 33 14.470 7.999 4.724
272 HA TYR 33 HA TYR 33 16.556 9.364 6.125
273 HB2 TYR 33 1HB TYR 33 16.521 8.162 3.349
274 HB3 TYR 33 2HB TYR 33 17.961 8.715 4.196
275 HD1 TYR 33 HD1 TYR 33 17.319 7.678 6.940
276 HD2 TYR 33 HD2 TYR 33 16.968 5.866 3.106
277 HE1 TYR 33 HE1 TYR 33 17.567 5.460 7.973
278 HE2 TYR 33 HE2 TYR 33 17.214 3.643 4.129
279 HH TYR 33 HH TYR 33 17.420 3.245 7.636
280 H LEU 34 H LEU 34 14.518 10.071 3.357
281 HA LEU 34 HA LEU 34 15.846 12.177 2.186
282 HB2 LEU 34 1HB LEU 34 13.169 11.157 2.236
283 HB3 LEU 34 2HB LEU 34 13.131 12.919 2.267
284 HG LEU 34 HG LEU 34 12.953 12.154 -0.006
285 HD11 LEU 34 1HD1 LEU 34 14.074 14.087 -0.251
286 HD12 LEU 34 2HD1 LEU 34 15.398 13.031 -0.741
287 HD13 LEU 34 3HD1 LEU 34 15.320 13.637 0.913
288 HD21 LEU 34 1HD2 LEU 34 15.428 10.577 0.645
289 HD22 LEU 34 2HD2 LEU 34 14.937 10.932 -1.012
290 HD23 LEU 34 3HD2 LEU 34 13.879 9.989 0.039
291 H GLY 35 H GLY 35 13.427 12.425 4.802
292 HA2 GLY 35 1HA GLY 35 13.594 15.159 5.237
293 HA3 GLY 35 2HA GLY 35 13.174 13.981 6.472
294 H GLN 36 H GLN 36 15.497 12.589 6.797
295 HA GLN 36 HA GLN 36 16.982 14.265 8.483
296 HB2 GLN 36 1HB GLN 36 17.602 11.558 7.306
297 HB3 GLN 36 2HB GLN 36 18.647 12.353 8.476
298 HG2 GLN 36 1HG GLN 36 16.042 12.419 9.539
299 HG3 GLN 36 2HG GLN 36 16.304 10.789 8.920
300 HE21 GLN 36 2HE2 GLN 36 17.961 13.290 10.812
301 HE22 GLN 36 1HE2 GLN 36 18.676 12.201 11.946
302 H TYR 37 H TYR 37 17.674 13.059 5.220
303 HA TYR 37 HA TYR 37 20.241 14.095 4.930
304 HB2 TYR 37 1HB TYR 37 19.289 12.525 3.329
305 HB3 TYR 37 2HB TYR 37 18.094 13.719 2.832
306 HD1 TYR 37 HD2 TYR 37 21.749 13.049 2.906
307 HD2 TYR 37 HD1 TYR 37 18.572 15.237 1.110
308 HE1 TYR 37 HE2 TYR 37 23.297 13.871 1.180
309 HE2 TYR 37 HE1 TYR 37 20.111 16.063 -0.621
310 HH TYR 37 HH TYR 37 23.517 15.056 -0.682
311 H ILE 38 H ILE 38 17.124 15.572 4.056
312 HA ILE 38 HA ILE 38 18.125 17.979 3.055
313 HB ILE 38 HB ILE 38 15.503 17.553 4.493
314 HG12 ILE 38 1HG1 ILE 38 16.047 17.466 1.522
315 HG13 ILE 38 2HG1 ILE 38 15.972 16.027 2.534
316 HG21 ILE 38 1HG2 ILE 38 16.423 19.709 2.600
317 HG22 ILE 38 2HG2 ILE 38 14.755 19.481 3.120
318 HG23 ILE 38 3HG2 ILE 38 15.997 19.896 4.300
319 HD11 ILE 38 1HD1 ILE 38 13.636 17.361 3.131
320 HD12 ILE 38 2HD1 ILE 38 13.836 17.613 1.397
321 HD13 ILE 38 3HD1 ILE 38 13.809 15.976 2.053
322 H MET 39 H MET 39 17.033 17.171 6.343
323 HA MET 39 HA MET 39 17.553 19.708 7.460
324 HB2 MET 39 1HB MET 39 16.584 18.780 9.243
325 HB3 MET 39 2HB MET 39 16.497 17.269 8.347
326 HG2 MET 39 1HG MET 39 18.584 16.535 9.261
327 HG3 MET 39 2HG MET 39 18.849 18.101 10.025
328 HE1 MET 39 1HE MET 39 15.276 18.137 11.229
329 HE2 MET 39 2HE MET 39 16.225 18.351 12.700
330 HE3 MET 39 3HE MET 39 16.737 19.125 11.199
331 H VAL 40 H VAL 40 19.544 16.842 7.027
332 HA VAL 40 HA VAL 40 21.711 17.650 8.649
333 HB VAL 40 HB VAL 40 21.099 15.391 7.169
334 HG11 VAL 40 1HG1 VAL 40 23.623 16.614 6.058
335 HG12 VAL 40 2HG1 VAL 40 22.998 15.001 5.707
336 HG13 VAL 40 3HG1 VAL 40 22.105 16.428 5.180
337 HG21 VAL 40 1HG2 VAL 40 23.647 16.151 8.592
338 HG22 VAL 40 2HG2 VAL 40 22.228 15.379 9.299
339 HG23 VAL 40 3HG2 VAL 40 23.211 14.507 8.123
340 H LYS 41 H LYS 41 20.932 18.186 5.253
341 HA LYS 41 HA LYS 41 23.430 19.595 4.791
342 HB2 LYS 41 1HB LYS 41 21.143 18.702 3.091
343 HB3 LYS 41 2HB LYS 41 22.156 20.017 2.512
344 HG2 LYS 41 1HG LYS 41 23.060 17.237 3.231
345 HG3 LYS 41 2HG LYS 41 22.934 17.925 1.611
346 HD2 LYS 41 1HD LYS 41 24.900 18.548 3.783
347 HD3 LYS 41 2HD LYS 41 25.201 18.121 2.097
348 HE2 LYS 41 1HE LYS 41 24.014 20.330 1.540
349 HE3 LYS 41 2HE LYS 41 24.256 20.731 3.240
350 HZ1 LYS 41 1HZ LYS 41 26.026 21.265 1.322
351 HZ2 LYS 41 2HZ LYS 41 26.603 19.763 1.840
352 HZ3 LYS 41 3HZ LYS 41 26.447 21.035 2.944
353 H GLN 42 H GLN 42 20.284 20.307 5.850
354 HA GLN 42 HA GLN 42 19.244 22.252 6.410
355 HB2 GLN 42 1HB GLN 42 22.091 22.986 6.284
356 HB3 GLN 42 2HB GLN 42 20.979 24.335 6.090
357 HG2 GLN 42 1HG GLN 42 20.979 24.416 8.313
358 HG3 GLN 42 2HG GLN 42 19.903 23.023 8.223
359 HE21 GLN 42 2HE2 GLN 42 21.884 21.183 7.305
360 HE22 GLN 42 1HE2 GLN 42 22.939 20.860 8.634
361 H LEU 43 H LEU 43 18.212 21.665 4.251
362 HA LEU 43 HA LEU 43 18.508 23.958 2.428
363 HB2 LEU 43 1HB LEU 43 17.987 21.082 1.693
364 HB3 LEU 43 2HB LEU 43 17.890 22.436 0.570
365 HG LEU 43 HG LEU 43 20.449 22.059 2.022
366 HD11 LEU 43 1HD1 LEU 43 19.697 19.767 1.318
367 HD12 LEU 43 2HD1 LEU 43 21.220 20.312 0.617
368 HD13 LEU 43 3HD1 LEU 43 19.744 20.344 -0.348
369 HD21 LEU 43 1HD2 LEU 43 20.653 23.802 0.577
370 HD22 LEU 43 2HD2 LEU 43 19.463 23.154 -0.552
371 HD23 LEU 43 3HD2 LEU 43 21.098 22.492 -0.517
372 H TYR 44 H TYR 44 16.783 24.614 4.091
373 HA TYR 44 HA TYR 44 14.241 24.441 2.798
374 HB2 TYR 44 1HB TYR 44 12.983 23.407 4.597
375 HB3 TYR 44 2HB TYR 44 14.246 22.305 4.060
376 HD1 TYR 44 HD2 TYR 44 13.104 24.473 6.787
377 HD2 TYR 44 HD1 TYR 44 16.109 21.748 5.504
378 HE1 TYR 44 HE2 TYR 44 13.914 24.286 9.102
379 HE2 TYR 44 HE1 TYR 44 16.927 21.553 7.815
380 HH TYR 44 HH TYR 44 16.377 21.961 10.004
381 H ASP 45 H ASP 45 12.539 25.641 4.118
382 HA ASP 45 HA ASP 45 13.709 28.121 4.999
383 HB2 ASP 45 1HB ASP 45 11.279 27.366 3.839
384 HB3 ASP 45 2HB ASP 45 10.854 27.912 5.459
385 H GLN 46 H GLN 46 14.405 28.422 7.001
386 HA GLN 46 HA GLN 46 13.924 26.721 9.160
387 HB2 GLN 46 1HB GLN 46 15.061 29.457 8.848
388 HB3 GLN 46 2HB GLN 46 14.639 28.923 10.470
389 HG2 GLN 46 1HG GLN 46 17.038 28.531 9.416
390 HG3 GLN 46 2HG GLN 46 16.308 27.404 10.558
391 HE21 GLN 46 2HE2 GLN 46 16.263 28.054 7.067
392 HE22 GLN 46 1HE2 GLN 46 16.403 26.401 6.585
393 H GLN 47 H GLN 47 11.931 29.105 7.791
394 HA GLN 47 HA GLN 47 10.437 29.660 10.208
395 HB2 GLN 47 1HB GLN 47 9.427 30.368 7.488
396 HB3 GLN 47 2HB GLN 47 9.298 31.264 8.995
397 HG2 GLN 47 1HG GLN 47 11.602 31.086 7.101
398 HG3 GLN 47 2HG GLN 47 10.784 32.514 7.733
399 HE21 GLN 47 2HE2 GLN 47 13.376 30.377 8.093
400 HE22 GLN 47 1HE2 GLN 47 13.985 30.979 9.593
401 H GLU 48 H GLU 48 10.245 27.543 7.452
402 HA GLU 48 HA GLU 48 7.960 26.202 8.682
403 HB2 GLU 48 1HB GLU 48 8.036 27.138 5.811
404 HB3 GLU 48 2HB GLU 48 6.871 25.978 6.435
405 HG2 GLU 48 1HG GLU 48 5.739 27.556 7.652
406 HG3 GLU 48 2HG GLU 48 7.140 28.619 7.781
407 H GLN 49 H GLN 49 9.236 24.459 9.215
408 HA GLN 49 HA GLN 49 11.154 23.226 7.629
409 HB2 GLN 49 1HB GLN 49 9.368 22.151 9.804
410 HB3 GLN 49 2HB GLN 49 10.591 21.157 9.024
411 HG2 GLN 49 1HG GLN 49 11.960 21.885 10.615
412 HG3 GLN 49 2HG GLN 49 12.006 23.395 9.708
413 HE21 GLN 49 2HE2 GLN 49 11.797 25.075 10.984
414 HE22 GLN 49 1HE2 GLN 49 10.773 25.188 12.370
415 H HIS 50 H HIS 50 7.764 23.271 7.272
416 HA HIS 50 HA HIS 50 7.578 20.798 5.793
417 HB2 HIS 50 1HB HIS 50 5.242 21.452 5.414
418 HB3 HIS 50 2HB HIS 50 5.670 21.580 7.118
419 HD1 HIS 50 HD1 HIS 50 5.052 23.715 8.207
420 HD2 HIS 50 HD2 HIS 50 5.346 24.107 4.081
421 HE1 HIS 50 HE1 HIS 50 4.322 26.068 7.701
422 H MET 51 H MET 51 9.091 23.497 5.036
423 HA MET 51 HA MET 51 8.308 23.361 2.200
424 HB2 MET 51 1HB MET 51 8.308 25.633 3.956
425 HB3 MET 51 2HB MET 51 9.493 25.881 2.681
426 HG2 MET 51 1HG MET 51 6.947 24.844 1.714
427 HG3 MET 51 2HG MET 51 6.819 26.412 2.508
428 HE1 MET 51 1HE MET 51 9.190 24.452 0.126
429 HE2 MET 51 2HE MET 51 9.874 25.738 -0.869
430 HE3 MET 51 3HE MET 51 10.284 25.634 0.844
431 H VAL 52 H VAL 52 9.918 22.053 1.471
432 HA VAL 52 HA VAL 52 12.642 22.327 2.307
433 HB VAL 52 HB VAL 52 11.490 20.802 -0.033
434 HG11 VAL 52 1HG1 VAL 52 13.732 19.487 0.519
435 HG12 VAL 52 2HG1 VAL 52 13.692 20.845 -0.607
436 HG13 VAL 52 3HG1 VAL 52 14.235 21.091 1.053
437 HG21 VAL 52 1HG2 VAL 52 12.410 19.128 2.069
438 HG22 VAL 52 2HG2 VAL 52 11.329 20.337 2.762
439 HG23 VAL 52 3HG2 VAL 52 10.770 19.307 1.444
440 H TYR 53 H TYR 53 14.351 23.256 1.256
441 HA TYR 53 HA TYR 53 13.766 24.735 -1.220
442 HB2 TYR 53 1HB TYR 53 14.801 25.746 1.366
443 HB3 TYR 53 2HB TYR 53 15.589 26.361 -0.082
444 HD1 TYR 53 HD2 TYR 53 13.605 26.822 -2.013
445 HD2 TYR 53 HD1 TYR 53 13.257 27.229 2.208
446 HE1 TYR 53 HE2 TYR 53 11.779 28.439 -2.325
447 HE2 TYR 53 HE1 TYR 53 11.429 28.846 1.908
448 HH TYR 53 HH TYR 53 10.685 30.461 0.059
449 H CYS 54 H CYS 54 14.779 22.665 -2.014
450 HA CYS 54 HA CYS 54 17.353 21.840 -1.587
451 HB2 CYS 54 1HB CYS 54 17.328 20.929 -3.853
452 HB3 CYS 54 2HB CYS 54 15.768 20.685 -3.076
453 HG CYS 54 HG CYS 54 16.524 22.384 -5.840
454 H GLY 55 H GLY 55 16.276 24.418 -3.779
455 HA2 GLY 55 1HA GLY 55 17.413 26.188 -4.698
456 HA3 GLY 55 2HA GLY 55 18.588 25.980 -3.408
457 H GLY 56 H GLY 56 18.198 23.152 -5.204
458 HA2 GLY 56 1HA GLY 56 19.284 22.758 -7.396
459 HA3 GLY 56 2HA GLY 56 20.560 23.833 -6.845
460 H ASP 57 H ASP 57 20.144 22.485 -4.095
461 HA ASP 57 HA ASP 57 22.357 20.872 -4.058
462 HB2 ASP 57 1HB ASP 57 20.458 21.640 -2.209
463 HB3 ASP 57 2HB ASP 57 20.265 19.889 -2.263
464 H LEU 58 H LEU 58 22.204 18.424 -3.359
465 HA LEU 58 HA LEU 58 21.758 16.890 -5.572
466 HB2 LEU 58 1HB LEU 58 21.589 16.122 -2.667
467 HB3 LEU 58 2HB LEU 58 21.560 14.947 -3.981
468 HG LEU 58 HG LEU 58 23.767 14.932 -3.200
469 HD11 LEU 58 1HD1 LEU 58 23.995 16.919 -5.432
470 HD12 LEU 58 2HD1 LEU 58 23.392 15.286 -5.713
471 HD13 LEU 58 3HD1 LEU 58 25.018 15.528 -5.073
472 HD21 LEU 58 1HD2 LEU 58 24.239 17.843 -3.474
473 HD22 LEU 58 2HD2 LEU 58 24.923 16.683 -2.335
474 HD23 LEU 58 3HD2 LEU 58 23.292 17.308 -2.086
475 H LEU 59 H LEU 59 19.518 17.159 -2.808
476 HA LEU 59 HA LEU 59 17.446 15.636 -3.862
477 HB2 LEU 59 1HB LEU 59 15.978 16.897 -2.320
478 HB3 LEU 59 2HB LEU 59 17.439 16.272 -1.559
479 HG LEU 59 HG LEU 59 17.714 19.019 -2.516
480 HD11 LEU 59 1HD1 LEU 59 15.744 18.440 -0.309
481 HD12 LEU 59 2HD1 LEU 59 15.342 19.075 -1.904
482 HD13 LEU 59 3HD1 LEU 59 16.330 20.030 -0.799
483 HD21 LEU 59 1HD2 LEU 59 19.411 18.493 -1.114
484 HD22 LEU 59 2HD2 LEU 59 18.444 17.340 -0.195
485 HD23 LEU 59 3HD2 LEU 59 18.272 19.070 0.102
486 H GLY 60 H GLY 60 18.270 19.014 -4.385
487 HA2 GLY 60 1HA GLY 60 15.874 19.768 -5.693
488 HA3 GLY 60 2HA GLY 60 17.420 20.595 -5.819
489 H GLU 61 H GLU 61 18.983 18.590 -6.938
490 HA GLU 61 HA GLU 61 18.310 18.843 -9.671
491 HB2 GLU 61 1HB GLU 61 20.412 18.133 -10.023
492 HB3 GLU 61 2HB GLU 61 20.587 18.221 -8.276
493 HG2 GLU 61 1HG GLU 61 21.402 16.113 -8.883
494 HG3 GLU 61 2HG GLU 61 19.800 15.819 -8.211
495 H LEU 62 H LEU 62 17.949 16.220 -7.344
496 HA LEU 62 HA LEU 62 17.110 14.265 -9.228
497 HB2 LEU 62 1HB LEU 62 17.732 14.332 -6.512
498 HB3 LEU 62 2HB LEU 62 16.034 13.863 -6.576
499 HG LEU 62 HG LEU 62 17.045 11.811 -6.603
500 HD11 LEU 62 1HD1 LEU 62 16.693 10.867 -8.689
501 HD12 LEU 62 2HD1 LEU 62 17.288 12.288 -9.546
502 HD13 LEU 62 3HD1 LEU 62 15.713 12.332 -8.754
503 HD21 LEU 62 1HD2 LEU 62 19.283 11.938 -6.585
504 HD22 LEU 62 2HD2 LEU 62 19.314 13.307 -7.697
505 HD23 LEU 62 3HD2 LEU 62 19.151 11.665 -8.322
506 H LEU 63 H LEU 63 15.412 16.583 -7.183
507 HA LEU 63 HA LEU 63 12.799 15.632 -7.708
508 HB2 LEU 63 1HB LEU 63 14.001 18.076 -6.549
509 HB3 LEU 63 2HB LEU 63 12.347 18.209 -7.144
510 HG LEU 63 HG LEU 63 12.821 17.636 -4.639
511 HD11 LEU 63 1HD1 LEU 63 10.744 16.653 -6.504
512 HD12 LEU 63 2HD1 LEU 63 10.601 17.701 -5.093
513 HD13 LEU 63 3HD1 LEU 63 10.767 15.958 -4.883
514 HD21 LEU 63 1HD2 LEU 63 12.835 14.863 -5.806
515 HD22 LEU 63 2HD2 LEU 63 13.040 15.338 -4.120
516 HD23 LEU 63 3HD2 LEU 63 14.302 15.700 -5.299
517 H GLY 64 H GLY 64 14.726 18.248 -9.156
518 HA2 GLY 64 1HA GLY 64 14.679 18.712 -11.494
519 HA3 GLY 64 2HA GLY 64 13.069 18.010 -11.570
520 H ARG 65 H ARG 65 13.193 19.915 -8.870
521 HA ARG 65 HA ARG 65 12.160 22.250 -10.341
522 HB2 ARG 65 1HB ARG 65 11.238 21.660 -7.564
523 HB3 ARG 65 2HB ARG 65 10.401 22.491 -8.868
524 HG2 ARG 65 1HG ARG 65 10.769 19.540 -8.477
525 HG3 ARG 65 2HG ARG 65 9.266 20.459 -8.567
526 HD2 ARG 65 1HD ARG 65 9.188 20.217 -10.775
527 HD3 ARG 65 2HD ARG 65 10.816 20.873 -10.946
528 HE ARG 65 HE ARG 65 11.156 18.280 -10.105
529 HH11 ARG 65 1HH1 ARG 65 9.630 19.867 -12.801
530 HH12 ARG 65 2HH1 ARG 65 9.901 18.552 -13.896
531 HH21 ARG 65 1HH2 ARG 65 11.518 16.542 -11.536
532 HH22 ARG 65 2HH2 ARG 65 10.974 16.661 -13.175
533 H GLN 66 H GLN 66 11.791 23.726 -7.854
534 HA GLN 66 HA GLN 66 14.614 24.280 -7.214
535 HB2 GLN 66 1HB GLN 66 13.570 26.644 -6.686
536 HB3 GLN 66 2HB GLN 66 14.031 26.203 -8.325
537 HG2 GLN 66 1HG GLN 66 11.753 25.691 -8.885
538 HG3 GLN 66 2HG GLN 66 11.246 25.950 -7.217
539 HE21 GLN 66 2HE2 GLN 66 12.421 27.493 -10.125
540 HE22 GLN 66 1HE2 GLN 66 11.897 29.089 -9.723
541 H SER 67 H SER 67 11.340 23.995 -6.006
542 HA SER 67 HA SER 67 12.328 23.445 -3.355
543 HB2 SER 67 1HB SER 67 11.514 25.267 -2.204
544 HB3 SER 67 2HB SER 67 11.959 26.050 -3.720
545 HG SER 67 HG SER 67 9.387 25.216 -2.877
546 H PHE 68 H PHE 68 10.839 22.355 -2.067
547 HA PHE 68 HA PHE 68 8.160 21.910 -3.147
548 HB2 PHE 68 1HB PHE 68 8.434 19.435 -2.775
549 HB3 PHE 68 2HB PHE 68 9.370 20.084 -4.117
550 HD1 PHE 68 HD1 PHE 68 9.557 18.846 -0.654
551 HD2 PHE 68 HD2 PHE 68 11.738 20.002 -4.121
552 HE1 PHE 68 HE1 PHE 68 11.603 17.882 0.316
553 HE2 PHE 68 HE2 PHE 68 13.787 19.040 -3.158
554 HZ PHE 68 HZ PHE 68 13.721 17.977 -0.937
555 H SER 69 H SER 69 6.670 21.014 -1.612
556 HA SER 69 HA SER 69 7.371 21.746 1.129
557 HB2 SER 69 1HB SER 69 4.609 20.898 0.394
558 HB3 SER 69 2HB SER 69 5.140 22.170 1.493
559 HG SER 69 HG SER 69 4.188 22.721 -0.701
560 H VAL 70 H VAL 70 7.442 20.338 2.797
561 HA VAL 70 HA VAL 70 7.644 17.544 2.203
562 HB VAL 70 HB VAL 70 8.599 17.294 4.249
563 HG11 VAL 70 1HG1 VAL 70 9.958 19.135 4.773
564 HG12 VAL 70 2HG1 VAL 70 9.590 19.318 3.057
565 HG13 VAL 70 3HG1 VAL 70 8.736 20.294 4.252
566 HG21 VAL 70 1HG2 VAL 70 7.895 18.787 6.229
567 HG22 VAL 70 2HG2 VAL 70 6.509 19.210 5.223
568 HG23 VAL 70 3HG2 VAL 70 6.782 17.530 5.687
569 H LYS 71 H LYS 71 5.229 19.636 3.620
570 HA LYS 71 HA LYS 71 3.618 17.530 4.697
571 HB2 LYS 71 1HB LYS 71 3.709 20.210 5.098
572 HB3 LYS 71 2HB LYS 71 2.322 20.099 4.022
573 HG2 LYS 71 1HG LYS 71 1.153 18.694 5.528
574 HG3 LYS 71 2HG LYS 71 2.592 18.451 6.522
575 HD2 LYS 71 1HD LYS 71 1.602 21.229 6.114
576 HD3 LYS 71 2HD LYS 71 0.710 20.173 7.211
577 HE2 LYS 71 1HE LYS 71 3.102 19.683 8.173
578 HE3 LYS 71 2HE LYS 71 3.490 21.232 7.427
579 HZ1 LYS 71 1HZ LYS 71 2.095 20.714 9.837
580 HZ2 LYS 71 2HZ LYS 71 1.122 21.616 8.789
581 HZ3 LYS 71 3HZ LYS 71 2.653 22.189 9.224
582 H ASP 72 H ASP 72 4.313 18.293 1.595
583 HA ASP 72 HA ASP 72 1.804 17.109 0.643
584 HB2 ASP 72 1HB ASP 72 1.713 19.572 0.290
585 HB3 ASP 72 2HB ASP 72 3.169 19.454 -0.695
586 HA PRO 73 HA PRO 73 5.288 14.697 -1.040
587 HB2 PRO 73 1HB PRO 73 3.870 12.388 -1.214
588 HB3 PRO 73 2HB PRO 73 4.639 12.933 0.281
589 HG2 PRO 73 1HG PRO 73 1.780 13.174 -0.575
590 HG3 PRO 73 2HG PRO 73 2.440 12.725 1.009
591 HD2 PRO 73 1HD PRO 73 1.512 15.211 0.467
592 HD3 PRO 73 2HD PRO 73 2.847 14.916 1.599
593 H SER 74 H SER 74 4.394 16.395 -2.805
594 HA SER 74 HA SER 74 2.947 14.972 -4.911
595 HB2 SER 74 1HB SER 74 2.006 17.053 -4.900
596 HB3 SER 74 2HB SER 74 3.459 17.822 -4.261
597 HG SER 74 HG SER 74 2.969 18.369 -6.472
598 HA PRO 75 HA PRO 75 6.891 16.225 -7.342
599 HB2 PRO 75 1HB PRO 75 8.799 17.666 -6.056
600 HB3 PRO 75 2HB PRO 75 7.438 18.413 -6.901
601 HG2 PRO 75 1HG PRO 75 7.786 17.874 -3.977
602 HG3 PRO 75 2HG PRO 75 7.144 19.319 -4.780
603 HD2 PRO 75 1HD PRO 75 5.545 17.438 -3.666
604 HD3 PRO 75 2HD PRO 75 5.066 18.372 -5.099
605 H LEU 76 H LEU 76 7.254 15.422 -3.953
606 HA LEU 76 HA LEU 76 9.783 14.243 -3.997
607 HB2 LEU 76 1HB LEU 76 8.456 14.752 -1.966
608 HB3 LEU 76 2HB LEU 76 7.406 13.390 -2.351
609 HG LEU 76 HG LEU 76 9.652 12.034 -2.251
610 HD11 LEU 76 1HD1 LEU 76 10.824 13.261 -0.148
611 HD12 LEU 76 2HD1 LEU 76 10.358 14.654 -1.123
612 HD13 LEU 76 3HD1 LEU 76 11.383 13.397 -1.815
613 HD21 LEU 76 1HD2 LEU 76 7.532 12.132 -0.695
614 HD22 LEU 76 2HD2 LEU 76 8.659 12.911 0.416
615 HD23 LEU 76 3HD2 LEU 76 8.996 11.288 -0.188
616 H TYR 77 H TYR 77 6.634 12.569 -4.158
617 HA TYR 77 HA TYR 77 7.589 10.037 -4.737
618 HB2 TYR 77 1HB TYR 77 5.007 11.447 -5.245
619 HB3 TYR 77 2HB TYR 77 5.273 9.887 -6.014
620 HD1 TYR 77 HD2 TYR 77 5.751 7.884 -4.563
621 HD2 TYR 77 HD1 TYR 77 4.433 11.597 -2.959
622 HE1 TYR 77 HE2 TYR 77 5.078 6.743 -2.491
623 HE2 TYR 77 HE1 TYR 77 3.758 10.467 -0.881
624 HH TYR 77 HH TYR 77 3.045 7.933 -0.313
625 H ASP 78 H ASP 78 6.839 12.698 -6.937
626 HA ASP 78 HA ASP 78 7.102 11.367 -9.365
627 HB2 ASP 78 1HB ASP 78 6.530 13.908 -8.683
628 HB3 ASP 78 2HB ASP 78 8.194 14.122 -9.218
629 H MET 79 H MET 79 9.526 12.446 -7.115
630 HA MET 79 HA MET 79 11.713 12.148 -8.971
631 HB2 MET 79 1HB MET 79 11.949 13.798 -7.240
632 HB3 MET 79 2HB MET 79 11.618 12.608 -5.989
633 HG2 MET 79 1HG MET 79 13.862 11.824 -7.628
634 HG3 MET 79 2HG MET 79 14.100 13.417 -6.914
635 HE1 MET 79 1HE MET 79 12.550 13.427 -4.451
636 HE2 MET 79 2HE MET 79 13.311 12.541 -3.130
637 HE3 MET 79 3HE MET 79 14.234 13.742 -4.033
638 H LEU 80 H LEU 80 10.577 10.404 -6.082
639 HA LEU 80 HA LEU 80 12.461 8.362 -6.085
640 HB2 LEU 80 1HB LEU 80 9.605 8.467 -5.171
641 HB3 LEU 80 2HB LEU 80 10.585 7.015 -4.982
642 HG LEU 80 HG LEU 80 12.142 8.240 -3.556
643 HD11 LEU 80 1HD1 LEU 80 11.703 10.502 -2.847
644 HD12 LEU 80 2HD1 LEU 80 10.248 10.567 -3.841
645 HD13 LEU 80 3HD1 LEU 80 11.833 10.452 -4.605
646 HD21 LEU 80 1HD2 LEU 80 9.964 7.152 -2.724
647 HD22 LEU 80 2HD2 LEU 80 9.391 8.806 -2.509
648 HD23 LEU 80 3HD2 LEU 80 10.821 8.248 -1.639
649 H ARG 81 H ARG 81 9.611 8.803 -8.050
650 HA ARG 81 HA ARG 81 8.985 6.351 -8.994
651 HB2 ARG 81 1HB ARG 81 8.099 7.370 -10.878
652 HB3 ARG 81 2HB ARG 81 8.199 8.718 -9.752
653 HG2 ARG 81 1HG ARG 81 10.284 9.441 -10.798
654 HG3 ARG 81 2HG ARG 81 10.186 8.087 -11.925
655 HD2 ARG 81 1HD ARG 81 7.707 9.433 -12.024
656 HD3 ARG 81 2HD ARG 81 8.966 10.665 -12.094
657 HE ARG 81 HE ARG 81 9.581 9.886 -14.168
658 HH11 ARG 81 1HH1 ARG 81 7.394 7.632 -12.667
659 HH12 ARG 81 2HH1 ARG 81 7.171 6.690 -14.103
660 HH21 ARG 81 1HH2 ARG 81 9.296 8.654 -16.066
661 HH22 ARG 81 2HH2 ARG 81 8.254 7.272 -16.036
662 H LYS 82 H LYS 82 11.673 8.337 -10.223
663 HA LYS 82 HA LYS 82 12.773 5.928 -11.506
664 HB2 LYS 82 1HB LYS 82 13.485 7.208 -13.221
665 HB3 LYS 82 2HB LYS 82 12.306 8.368 -12.621
666 HG2 LYS 82 1HG LYS 82 15.251 8.320 -11.995
667 HG3 LYS 82 2HG LYS 82 14.410 9.466 -13.043
668 HD2 LYS 82 1HD LYS 82 13.403 9.197 -10.271
669 HD3 LYS 82 2HD LYS 82 14.972 9.979 -10.477
670 HE2 LYS 82 1HE LYS 82 12.426 11.116 -10.805
671 HE3 LYS 82 2HE LYS 82 13.989 11.853 -11.151
672 HZ1 LYS 82 1HZ LYS 82 12.622 10.112 -13.112
673 HZ2 LYS 82 2HZ LYS 82 13.867 11.224 -13.383
674 HZ3 LYS 82 3HZ LYS 82 12.307 11.772 -13.026
675 H ASN 83 H ASN 83 13.062 7.639 -8.735
676 HA ASN 83 HA ASN 83 15.978 7.387 -8.564
677 HB2 ASN 83 1HB ASN 83 15.524 9.474 -7.724
678 HB3 ASN 83 2HB ASN 83 13.933 9.007 -7.130
679 HD21 ASN 83 2HD2 ASN 83 13.835 9.206 -5.023
680 HD22 ASN 83 1HD2 ASN 83 15.078 8.789 -3.898
681 H LEU 84 H LEU 84 13.090 6.624 -6.616
682 HA LEU 84 HA LEU 84 14.483 4.884 -4.852
683 HB2 LEU 84 1HB LEU 84 12.313 6.094 -4.402
684 HB3 LEU 84 2HB LEU 84 11.526 4.883 -5.413
685 HG LEU 84 HG LEU 84 13.159 3.891 -3.146
686 HD11 LEU 84 1HD1 LEU 84 11.555 5.961 -2.547
687 HD12 LEU 84 2HD1 LEU 84 11.850 4.607 -1.457
688 HD13 LEU 84 3HD1 LEU 84 10.394 4.637 -2.450
689 HD21 LEU 84 1HD2 LEU 84 12.168 2.105 -4.101
690 HD22 LEU 84 2HD2 LEU 84 10.858 3.064 -4.791
691 HD23 LEU 84 3HD2 LEU 84 10.803 2.587 -3.093
692 H VAL 85 H VAL 85 15.565 3.284 -5.933
693 HA VAL 85 HA VAL 85 14.792 1.800 -8.103
694 HB VAL 85 HB VAL 85 16.616 1.325 -5.833
695 HG11 VAL 85 1HG1 VAL 85 15.579 -0.948 -7.521
696 HG12 VAL 85 2HG1 VAL 85 17.032 -1.023 -6.523
697 HG13 VAL 85 3HG1 VAL 85 15.456 -0.781 -5.770
698 HG21 VAL 85 1HG2 VAL 85 16.881 0.869 -8.804
699 HG22 VAL 85 2HG2 VAL 85 17.307 2.358 -7.961
700 HG23 VAL 85 3HG2 VAL 85 18.190 0.870 -7.622
701 H THR 86 H THR 86 13.825 -0.255 -8.383
702 HA THR 86 HA THR 86 12.228 -1.282 -6.156
703 HB THR 86 HB THR 86 10.273 -1.550 -7.759
704 HG1 THR 86 1HG THR 86 11.630 0.515 -9.179
705 HG21 THR 86 1HG2 THR 86 11.202 1.097 -6.695
706 HG22 THR 86 2HG2 THR 86 9.947 0.026 -6.070
707 HG23 THR 86 3HG2 THR 86 9.663 0.953 -7.543
708 H LEU 87 H LEU 87 12.523 -3.400 -5.999
709 HA LEU 87 HA LEU 87 13.538 -4.873 -8.313
710 HB2 LEU 87 1HB LEU 87 13.257 -6.253 -5.730
711 HB3 LEU 87 2HB LEU 87 14.597 -6.248 -6.875
712 HG LEU 87 HG LEU 87 14.002 -4.254 -4.701
713 HD11 LEU 87 1HD1 LEU 87 15.212 -6.257 -4.032
714 HD12 LEU 87 2HD1 LEU 87 16.260 -4.840 -3.972
715 HD13 LEU 87 3HD1 LEU 87 16.397 -5.981 -5.309
716 HD21 LEU 87 1HD2 LEU 87 14.802 -2.678 -6.068
717 HD22 LEU 87 2HD2 LEU 87 15.368 -3.860 -7.249
718 HD23 LEU 87 3HD2 LEU 87 16.365 -3.465 -5.848
719 H ALA 88 H ALA 88 10.852 -4.813 -6.047
720 HA ALA 88 HA ALA 88 9.582 -7.026 -7.510
721 HB1 ALA 88 1HB ALA 88 9.647 -6.261 -4.720
722 HB2 ALA 88 2HB ALA 88 7.996 -6.463 -5.306
723 HB3 ALA 88 3HB ALA 88 9.154 -7.784 -5.462
724 H THR 89 H THR 89 8.281 -6.370 -9.086
725 HA THR 89 HA THR 89 7.115 -3.750 -9.133
726 HB THR 89 HB THR 89 6.084 -5.800 -11.004
727 HG1 THR 89 1HG THR 89 7.991 -6.439 -11.635
728 HG21 THR 89 1HG2 THR 89 7.329 -3.089 -11.470
729 HG22 THR 89 2HG2 THR 89 5.612 -3.359 -11.175
730 HG23 THR 89 3HG2 THR 89 6.376 -4.032 -12.614
731 H1 SER 115 H SER 115 8.222 9.728 17.288
732 HA SER 115 HA SER 115 6.182 11.531 16.695
733 HB2 SER 115 1HB SER 115 5.752 9.920 19.146
734 HB3 SER 115 2HB SER 115 5.489 11.657 19.303
735 HG SER 115 HG SER 115 3.885 11.563 17.836
736 H GLN 116 H GLN 116 8.370 12.421 16.312
737 HA GLN 116 HA GLN 116 9.577 13.533 18.753
738 HB2 GLN 116 1HB GLN 116 10.712 12.323 16.444
739 HB3 GLN 116 2HB GLN 116 11.196 14.014 16.451
740 HG2 GLN 116 1HG GLN 116 12.699 13.630 18.022
741 HG3 GLN 116 2HG GLN 116 11.476 12.929 19.081
742 HE21 GLN 116 2HE2 GLN 116 10.877 10.645 18.560
743 HE22 GLN 116 1HE2 GLN 116 12.156 9.576 18.106
744 H GLU 117 H GLU 117 10.994 15.625 17.639
745 HA GLU 117 HA GLU 117 8.812 17.462 16.938
746 HB2 GLU 117 1HB GLU 117 11.452 18.551 17.707
747 HB3 GLU 117 2HB GLU 117 9.839 19.088 18.152
748 HG2 GLU 117 1HG GLU 117 9.886 16.799 19.506
749 HG3 GLU 117 2HG GLU 117 11.618 17.126 19.465
750 H THR 118 H THR 118 10.596 19.554 16.082
751 HA THR 118 HA THR 118 11.131 20.374 13.994
752 HB THR 118 HB THR 118 13.118 18.208 13.630
753 HG1 THR 118 1HG THR 118 13.375 20.015 15.812
754 HG21 THR 118 1HG2 THR 118 14.492 19.921 12.933
755 HG22 THR 118 2HG2 THR 118 13.732 21.107 13.995
756 HG23 THR 118 3HG2 THR 118 12.909 20.583 12.526
757 H PHE 119 H PHE 119 12.430 18.810 11.885
758 HA PHE 119 HA PHE 119 10.463 18.370 10.114
759 HB2 PHE 119 1HB PHE 119 13.136 17.866 10.114
760 HB3 PHE 119 2HB PHE 119 12.493 16.229 10.034
761 HD1 PHE 119 HD2 PHE 119 9.926 17.443 8.519
762 HD2 PHE 119 HD1 PHE 119 14.135 17.456 7.885
763 HE1 PHE 119 HE2 PHE 119 9.557 17.707 6.101
764 HE2 PHE 119 HE1 PHE 119 13.773 17.722 5.466
765 HZ PHE 119 HZ PHE 119 11.482 17.846 4.571
766 H SER 120 H SER 120 11.548 16.022 12.530
767 HA SER 120 HA SER 120 10.136 13.791 11.797
768 HB2 SER 120 1HB SER 120 11.408 14.745 14.178
769 HB3 SER 120 2HB SER 120 9.873 13.997 14.618
770 HG SER 120 HG SER 120 12.106 12.772 14.061
771 H ASP 121 H ASP 121 8.953 16.585 13.620
772 HA ASP 121 HA ASP 121 6.445 15.700 14.340
773 HB2 ASP 121 1HB ASP 121 7.395 17.875 15.016
774 HB3 ASP 121 2HB ASP 121 7.168 18.476 13.375
775 H LEU 122 H LEU 122 7.077 17.697 11.449
776 HA LEU 122 HA LEU 122 4.560 16.968 10.281
777 HB2 LEU 122 1HB LEU 122 6.828 18.289 8.830
778 HB3 LEU 122 2HB LEU 122 5.096 18.442 8.537
779 HG LEU 122 HG LEU 122 6.306 19.450 11.087
780 HD11 LEU 122 1HD1 LEU 122 7.565 20.871 9.913
781 HD12 LEU 122 2HD1 LEU 122 6.049 21.670 9.501
782 HD13 LEU 122 3HD1 LEU 122 6.750 20.486 8.398
783 HD21 LEU 122 1HD2 LEU 122 3.720 19.310 10.045
784 HD22 LEU 122 2HD2 LEU 122 4.200 20.999 9.878
785 HD23 LEU 122 3HD2 LEU 122 4.255 20.218 11.459
786 H TRP 123 H TRP 123 7.944 16.461 9.268
787 HA TRP 123 HA TRP 123 7.781 14.969 7.080
788 HB2 TRP 123 1HB TRP 123 9.838 15.407 8.541
789 HB3 TRP 123 2HB TRP 123 9.412 13.923 9.390
790 HD1 TRP 123 HD1 TRP 123 10.743 11.927 8.534
791 HE1 TRP 123 HE1 TRP 123 11.747 11.194 6.280
792 HE3 TRP 123 HE3 TRP 123 9.265 15.889 5.661
793 HZ2 TRP 123 HZ2 TRP 123 11.893 12.167 3.634
794 HZ3 TRP 123 HZ3 TRP 123 9.878 15.911 3.278
795 HH2 TRP 123 HH2 TRP 123 11.165 14.088 2.288
796 H LYS 124 H LYS 124 7.431 13.492 10.310
797 HA LYS 124 HA LYS 124 6.823 10.920 9.584
798 HB2 LYS 124 1HB LYS 124 6.066 12.642 11.892
799 HB3 LYS 124 2HB LYS 124 5.209 11.119 11.699
800 HG2 LYS 124 1HG LYS 124 7.502 11.393 13.075
801 HG3 LYS 124 2HG LYS 124 6.986 9.890 12.307
802 HD2 LYS 124 1HD LYS 124 8.424 10.187 10.491
803 HD3 LYS 124 2HD LYS 124 8.617 11.912 10.808
804 HE2 LYS 124 1HE LYS 124 10.314 9.838 11.601
805 HE3 LYS 124 2HE LYS 124 10.392 11.530 12.091
806 HZ1 LYS 124 1HZ LYS 124 10.277 9.810 13.922
807 HZ2 LYS 124 2HZ LYS 124 8.661 9.575 13.482
808 HZ3 LYS 124 3HZ LYS 124 9.177 11.091 14.025
809 H LEU 125 H LEU 125 4.509 13.596 9.989
810 HA LEU 125 HA LEU 125 2.154 12.303 9.447
811 HB2 LEU 125 1HB LEU 125 2.882 14.887 9.807
812 HB3 LEU 125 2HB LEU 125 2.449 14.902 8.098
813 HG LEU 125 HG LEU 125 0.423 13.583 9.689
814 HD11 LEU 125 1HD1 LEU 125 0.815 14.907 11.528
815 HD12 LEU 125 2HD1 LEU 125 -0.324 15.902 10.620
816 HD13 LEU 125 3HD1 LEU 125 1.402 16.263 10.563
817 HD21 LEU 125 1HD2 LEU 125 0.306 16.098 8.033
818 HD22 LEU 125 2HD2 LEU 125 -1.035 15.040 8.471
819 HD23 LEU 125 3HD2 LEU 125 0.218 14.468 7.368
820 H LEU 126 H LEU 126 4.758 12.952 7.285
821 HA LEU 126 HA LEU 126 3.465 12.934 4.816
822 HB2 LEU 126 1HB LEU 126 5.926 13.366 5.374
823 HB3 LEU 126 2HB LEU 126 6.120 11.616 5.298
824 HG LEU 126 HG LEU 126 4.910 12.128 2.912
825 HD11 LEU 126 1HD1 LEU 126 4.928 14.395 2.743
826 HD12 LEU 126 2HD1 LEU 126 6.543 14.059 2.119
827 HD13 LEU 126 3HD1 LEU 126 6.335 14.577 3.791
828 HD21 LEU 126 1HD2 LEU 126 6.945 11.528 1.954
829 HD22 LEU 126 2HD2 LEU 126 7.031 10.829 3.571
830 HD23 LEU 126 3HD2 LEU 126 7.886 12.330 3.212
831 HA PRO 127 HA PRO 127 1.835 8.809 4.714
832 HB2 PRO 127 1HB PRO 127 1.015 8.863 2.126
833 HB3 PRO 127 2HB PRO 127 0.144 9.683 3.427
834 HG2 PRO 127 1HG PRO 127 2.069 10.811 1.431
835 HG3 PRO 127 2HG PRO 127 0.528 11.479 2.001
836 HD2 PRO 127 1HD PRO 127 2.922 12.337 2.933
837 HD3 PRO 127 2HD PRO 127 1.460 12.306 3.940
838 H GLU 128 H GLU 128 4.378 8.422 4.826
839 HA GLU 128 HA GLU 128 6.025 7.896 2.758
840 HB2 GLU 128 1HB GLU 128 5.639 5.903 4.990
841 HB3 GLU 128 2HB GLU 128 7.111 6.230 4.087
842 HG2 GLU 128 1HG GLU 128 6.871 8.622 5.056
843 HG3 GLU 128 2HG GLU 128 5.813 7.845 6.233
844 H ASN 129 H ASN 129 4.029 5.263 4.099
845 HA ASN 129 HA ASN 129 2.999 3.485 3.124
846 HB2 ASN 129 1HB ASN 129 2.790 5.625 1.131
847 HB3 ASN 129 2HB ASN 129 2.713 4.008 0.438
848 HD21 ASN 129 2HD2 ASN 129 1.233 2.488 1.680
849 HD22 ASN 129 1HD2 ASN 129 -0.296 3.139 2.156
Start of MODEL 8
1 H1 GLN 1 H GLN 1 1.137 0.520 1.117
2 HA GLN 1 HA GLN 1 3.134 1.700 -0.622
3 HB2 GLN 1 1HB GLN 1 1.350 2.826 1.042
4 HB3 GLN 1 2HB GLN 1 2.729 2.736 2.128
5 HG2 GLN 1 1HG GLN 1 2.937 4.833 1.185
6 HG3 GLN 1 2HG GLN 1 4.039 3.851 0.220
7 HE21 GLN 1 2HE2 GLN 1 1.560 6.060 0.124
8 HE22 GLN 1 1HE2 GLN 1 1.080 5.860 -1.523
9 H ILE 2 H ILE 2 4.050 -0.729 -0.013
10 HA ILE 2 HA ILE 2 6.284 -0.144 1.797
11 HB ILE 2 HB ILE 2 4.879 -2.813 1.778
12 HG12 ILE 2 1HG1 ILE 2 3.444 -1.020 2.735
13 HG13 ILE 2 2HG1 ILE 2 3.924 -2.223 3.926
14 HG21 ILE 2 1HG2 ILE 2 6.262 -2.739 4.072
15 HG22 ILE 2 2HG2 ILE 2 6.929 -3.357 2.562
16 HG23 ILE 2 3HG2 ILE 2 7.290 -1.710 3.076
17 HD11 ILE 2 1HD1 ILE 2 4.214 0.564 4.062
18 HD12 ILE 2 2HD1 ILE 2 4.782 -0.647 5.211
19 HD13 ILE 2 3HD1 ILE 2 5.837 -0.108 3.905
20 H ASN 3 H ASN 3 6.688 0.192 -0.777
21 HA ASN 3 HA ASN 3 7.613 -2.285 -1.994
22 HB2 ASN 3 1HB ASN 3 6.433 -0.218 -3.153
23 HB3 ASN 3 2HB ASN 3 8.083 0.392 -3.238
24 HD21 ASN 3 2HD2 ASN 3 9.496 -1.910 -3.674
25 HD22 ASN 3 1HD2 ASN 3 9.068 -2.570 -5.213
26 H GLN 4 H GLN 4 9.678 -2.934 -2.077
27 HA GLN 4 HA GLN 4 11.636 -1.681 -0.457
28 HB2 GLN 4 1HB GLN 4 12.151 -3.765 -2.576
29 HB3 GLN 4 2HB GLN 4 13.105 -3.441 -1.135
30 HG2 GLN 4 1HG GLN 4 11.997 -5.201 -0.309
31 HG3 GLN 4 2HG GLN 4 10.723 -4.018 -0.017
32 HE21 GLN 4 2HE2 GLN 4 8.793 -4.505 -0.766
33 HE22 GLN 4 1HE2 GLN 4 8.445 -5.623 -2.036
34 H VAL 5 H VAL 5 13.893 -1.228 -1.345
35 HA VAL 5 HA VAL 5 13.873 -0.017 -4.001
36 HB VAL 5 HB VAL 5 14.197 2.136 -3.392
37 HG11 VAL 5 1HG1 VAL 5 12.879 2.781 -1.452
38 HG12 VAL 5 2HG1 VAL 5 12.080 1.480 -2.337
39 HG13 VAL 5 3HG1 VAL 5 12.944 1.129 -0.839
40 HG21 VAL 5 1HG2 VAL 5 16.295 1.939 -2.343
41 HG22 VAL 5 2HG2 VAL 5 15.272 2.775 -1.176
42 HG23 VAL 5 3HG2 VAL 5 15.620 1.058 -0.973
43 H ARG 6 H ARG 6 16.137 0.916 -4.478
44 HA ARG 6 HA ARG 6 18.276 -0.497 -3.094
45 HB2 ARG 6 1HB ARG 6 17.167 -1.632 -5.343
46 HB3 ARG 6 2HB ARG 6 18.529 -0.734 -6.002
47 HG2 ARG 6 1HG ARG 6 20.083 -2.019 -4.914
48 HG3 ARG 6 2HG ARG 6 18.967 -2.468 -3.623
49 HD2 ARG 6 1HD ARG 6 17.706 -3.622 -5.664
50 HD3 ARG 6 2HD ARG 6 19.343 -3.651 -6.317
51 HE ARG 6 HE ARG 6 19.160 -4.646 -3.629
52 HH11 ARG 6 1HH1 ARG 6 18.870 -5.453 -7.003
53 HH12 ARG 6 2HH1 ARG 6 19.189 -7.139 -6.761
54 HH21 ARG 6 1HH2 ARG 6 19.582 -6.863 -3.297
55 HH22 ARG 6 2HH2 ARG 6 19.594 -7.940 -4.653
56 HA PRO 7 HA PRO 7 19.571 3.747 -4.150
57 HB2 PRO 7 1HB PRO 7 21.243 3.982 -2.024
58 HB3 PRO 7 2HB PRO 7 19.503 4.269 -1.913
59 HG2 PRO 7 1HG PRO 7 21.072 1.833 -1.162
60 HG3 PRO 7 2HG PRO 7 19.746 2.623 -0.289
61 HD2 PRO 7 1HD PRO 7 19.381 0.400 -1.792
62 HD3 PRO 7 2HD PRO 7 18.128 1.644 -1.607
63 H LYS 8 H LYS 8 21.049 3.951 -5.699
64 HA LYS 8 HA LYS 8 23.219 2.091 -5.985
65 HB2 LYS 8 1HB LYS 8 22.952 4.643 -7.547
66 HB3 LYS 8 2HB LYS 8 23.634 3.104 -8.059
67 HG2 LYS 8 1HG LYS 8 21.242 2.197 -7.782
68 HG3 LYS 8 2HG LYS 8 20.760 3.895 -7.793
69 HD2 LYS 8 1HD LYS 8 22.464 2.649 -9.943
70 HD3 LYS 8 2HD LYS 8 20.702 2.723 -10.028
71 HE2 LYS 8 1HE LYS 8 20.754 4.850 -10.682
72 HE3 LYS 8 2HE LYS 8 21.816 5.296 -9.348
73 HZ1 LYS 8 1HZ LYS 8 22.521 5.374 -11.928
74 HZ2 LYS 8 2HZ LYS 8 23.098 3.844 -11.496
75 HZ3 LYS 8 3HZ LYS 8 23.620 5.214 -10.652
76 H LEU 9 H LEU 9 25.274 3.675 -6.952
77 HA LEU 9 HA LEU 9 26.762 4.242 -4.699
78 HB2 LEU 9 1HB LEU 9 26.957 4.993 -7.565
79 HB3 LEU 9 2HB LEU 9 27.988 5.850 -6.421
80 HG LEU 9 HG LEU 9 28.000 2.926 -7.119
81 HD11 LEU 9 1HD1 LEU 9 29.710 5.263 -7.604
82 HD12 LEU 9 2HD1 LEU 9 29.524 3.775 -8.532
83 HD13 LEU 9 3HD1 LEU 9 30.561 3.801 -7.106
84 HD21 LEU 9 1HD2 LEU 9 28.376 2.551 -4.934
85 HD22 LEU 9 2HD2 LEU 9 28.764 4.239 -4.601
86 HD23 LEU 9 3HD2 LEU 9 29.985 3.173 -5.299
87 HA PRO 10 HA PRO 10 25.743 8.937 -5.168
88 HB2 PRO 10 1HB PRO 10 23.803 9.627 -6.937
89 HB3 PRO 10 2HB PRO 10 25.508 9.500 -7.383
90 HG2 PRO 10 1HG PRO 10 23.294 7.527 -7.787
91 HG3 PRO 10 2HG PRO 10 24.579 8.011 -8.908
92 HD2 PRO 10 1HD PRO 10 24.685 5.717 -7.473
93 HD3 PRO 10 2HD PRO 10 26.139 6.637 -7.911
94 H LEU 11 H LEU 11 23.554 6.383 -4.922
95 HA LEU 11 HA LEU 11 21.550 8.046 -3.558
96 HB2 LEU 11 1HB LEU 11 21.352 5.842 -5.334
97 HB3 LEU 11 2HB LEU 11 20.724 5.332 -3.768
98 HG LEU 11 HG LEU 11 19.080 7.092 -3.800
99 HD11 LEU 11 1HD1 LEU 11 19.534 8.014 -6.520
100 HD12 LEU 11 2HD1 LEU 11 20.850 8.431 -5.423
101 HD13 LEU 11 3HD1 LEU 11 19.201 8.931 -5.051
102 HD21 LEU 11 1HD2 LEU 11 18.215 5.216 -4.850
103 HD22 LEU 11 2HD2 LEU 11 19.296 5.367 -6.236
104 HD23 LEU 11 3HD2 LEU 11 17.944 6.485 -6.045
105 H LEU 12 H LEU 12 24.031 5.751 -3.050
106 HA LEU 12 HA LEU 12 23.058 4.725 -0.553
107 HB2 LEU 12 1HB LEU 12 24.989 3.964 -2.350
108 HB3 LEU 12 2HB LEU 12 25.940 4.581 -1.000
109 HG LEU 12 HG LEU 12 24.245 2.153 -1.185
110 HD11 LEU 12 1HD1 LEU 12 26.187 1.182 -0.739
111 HD12 LEU 12 2HD1 LEU 12 26.375 2.129 0.736
112 HD13 LEU 12 3HD1 LEU 12 26.952 2.770 -0.802
113 HD21 LEU 12 1HD2 LEU 12 24.414 3.928 1.219
114 HD22 LEU 12 2HD2 LEU 12 24.292 2.178 1.404
115 HD23 LEU 12 3HD2 LEU 12 23.023 3.067 0.559
116 H LYS 13 H LYS 13 25.476 7.129 -1.528
117 HA LYS 13 HA LYS 13 26.407 7.780 1.034
118 HB2 LYS 13 1HB LYS 13 27.501 9.575 0.039
119 HB3 LYS 13 2HB LYS 13 27.311 8.455 -1.303
120 HG2 LYS 13 1HG LYS 13 26.541 10.263 -2.378
121 HG3 LYS 13 2HG LYS 13 25.036 9.891 -1.535
122 HD2 LYS 13 1HD LYS 13 25.142 11.948 -0.680
123 HD3 LYS 13 2HD LYS 13 26.495 11.376 0.299
124 HE2 LYS 13 1HE LYS 13 26.805 12.492 -2.482
125 HE3 LYS 13 2HE LYS 13 26.925 13.473 -1.022
126 HZ1 LYS 13 1HZ LYS 13 28.706 11.890 -0.291
127 HZ2 LYS 13 2HZ LYS 13 29.108 12.862 -1.615
128 HZ3 LYS 13 3HZ LYS 13 28.688 11.241 -1.853
129 H ILE 14 H ILE 14 23.545 8.748 -0.703
130 HA ILE 14 HA ILE 14 22.853 11.043 0.740
131 HB ILE 14 HB ILE 14 20.886 9.041 -0.363
132 HG12 ILE 14 1HG1 ILE 14 22.601 11.086 -1.744
133 HG13 ILE 14 2HG1 ILE 14 22.304 9.411 -2.193
134 HG21 ILE 14 1HG2 ILE 14 19.848 10.748 0.967
135 HG22 ILE 14 2HG2 ILE 14 20.748 12.010 0.128
136 HG23 ILE 14 3HG2 ILE 14 19.519 11.083 -0.732
137 HD11 ILE 14 1HD1 ILE 14 21.078 10.543 -3.762
138 HD12 ILE 14 2HD1 ILE 14 19.857 10.233 -2.528
139 HD13 ILE 14 3HD1 ILE 14 20.616 11.821 -2.638
140 H LEU 15 H LEU 15 21.757 7.684 1.231
141 HA LEU 15 HA LEU 15 20.401 8.273 3.662
142 HB2 LEU 15 1HB LEU 15 21.397 5.559 2.854
143 HB3 LEU 15 2HB LEU 15 19.987 5.963 3.831
144 HG LEU 15 HG LEU 15 20.312 6.224 0.849
145 HD11 LEU 15 1HD1 LEU 15 19.590 4.089 1.184
146 HD12 LEU 15 2HD1 LEU 15 18.036 4.922 1.175
147 HD13 LEU 15 3HD1 LEU 15 18.788 4.477 2.706
148 HD21 LEU 15 1HD2 LEU 15 18.535 7.669 2.702
149 HD22 LEU 15 2HD2 LEU 15 17.753 6.943 1.298
150 HD23 LEU 15 3HD2 LEU 15 19.073 8.093 1.077
151 H HIS 16 H HIS 16 23.574 6.916 2.885
152 HA HIS 16 HA HIS 16 24.375 6.210 5.464
153 HB2 HIS 16 1HB HIS 16 25.864 6.996 2.981
154 HB3 HIS 16 2HB HIS 16 26.739 6.727 4.486
155 HD1 HIS 16 HD1 HIS 16 27.920 4.636 3.558
156 HD2 HIS 16 HD2 HIS 16 23.774 4.360 3.580
157 HE1 HIS 16 HE1 HIS 16 27.405 2.213 3.125
158 H ALA 17 H ALA 17 24.871 9.262 3.704
159 HA ALA 17 HA ALA 17 26.211 10.579 5.822
160 HB1 ALA 17 1HB ALA 17 24.636 11.987 3.690
161 HB2 ALA 17 2HB ALA 17 26.104 12.517 4.512
162 HB3 ALA 17 3HB ALA 17 26.174 11.197 3.344
163 H ALA 18 H ALA 18 23.025 9.620 5.539
164 HA ALA 18 HA ALA 18 22.049 11.782 7.278
165 HB1 ALA 18 1HB ALA 18 20.857 10.288 5.113
166 HB2 ALA 18 2HB ALA 18 19.873 10.199 6.574
167 HB3 ALA 18 3HB ALA 18 20.307 11.769 5.897
168 H GLY 19 H GLY 19 23.485 8.932 7.651
169 HA2 GLY 19 1HA GLY 19 23.670 7.939 9.822
170 HA3 GLY 19 2HA GLY 19 21.992 8.366 10.122
171 H ALA 20 H ALA 20 22.649 7.061 7.031
172 HA ALA 20 HA ALA 20 21.306 4.576 7.816
173 HB1 ALA 20 1HB ALA 20 20.433 4.442 5.708
174 HB2 ALA 20 2HB ALA 20 20.604 6.191 5.855
175 HB3 ALA 20 3HB ALA 20 21.808 5.259 4.965
176 H GLN 21 H GLN 21 21.992 2.661 6.303
177 HA GLN 21 HA GLN 21 24.662 2.483 5.419
178 HB2 GLN 21 1HB GLN 21 24.549 2.461 8.155
179 HB3 GLN 21 2HB GLN 21 24.493 0.744 7.781
180 HG2 GLN 21 1HG GLN 21 26.704 0.823 7.673
181 HG3 GLN 21 2HG GLN 21 26.504 1.692 6.152
182 HE21 GLN 21 2HE2 GLN 21 26.122 4.104 6.461
183 HE22 GLN 21 1HE2 GLN 21 27.142 4.894 7.610
184 H GLY 22 H GLY 22 24.853 0.767 4.100
185 HA2 GLY 22 1HA GLY 22 24.345 -1.747 4.062
186 HA3 GLY 22 2HA GLY 22 22.674 -1.215 4.177
187 H GLU 23 H GLU 23 22.225 -2.274 2.191
188 HA GLU 23 HA GLU 23 22.890 -0.621 -0.122
189 HB2 GLU 23 1HB GLU 23 23.200 -3.627 -0.146
190 HB3 GLU 23 2HB GLU 23 23.458 -2.542 -1.505
191 HG2 GLU 23 1HG GLU 23 25.607 -2.746 -0.883
192 HG3 GLU 23 2HG GLU 23 25.169 -1.460 0.240
193 H MET 24 H MET 24 20.546 -1.554 1.690
194 HA MET 24 HA MET 24 18.600 -1.576 -0.432
195 HB2 MET 24 1HB MET 24 17.520 -3.675 0.782
196 HB3 MET 24 2HB MET 24 18.671 -3.860 -0.535
197 HG2 MET 24 1HG MET 24 19.809 -3.706 2.180
198 HG3 MET 24 2HG MET 24 18.867 -5.146 1.802
199 HE1 MET 24 1HE MET 24 22.480 -6.138 1.852
200 HE2 MET 24 2HE MET 24 22.844 -4.422 1.671
201 HE3 MET 24 3HE MET 24 21.570 -4.943 2.776
202 H PHE 25 H PHE 25 16.563 -0.934 0.245
203 HA PHE 25 HA PHE 25 15.867 -0.772 3.021
204 HB2 PHE 25 1HB PHE 25 16.309 1.839 1.563
205 HB3 PHE 25 2HB PHE 25 15.800 1.631 3.236
206 HD1 PHE 25 HD1 PHE 25 18.621 1.186 0.896
207 HD2 PHE 25 HD2 PHE 25 17.372 1.328 4.963
208 HE1 PHE 25 HE1 PHE 25 20.974 1.244 1.613
209 HE2 PHE 25 HE2 PHE 25 19.723 1.387 5.686
210 HZ PHE 25 HZ PHE 25 21.527 1.346 4.011
211 H THR 26 H THR 26 13.706 0.023 3.358
212 HA THR 26 HA THR 26 12.022 -0.435 1.022
213 HB THR 26 HB THR 26 10.217 -0.108 2.970
214 HG1 THR 26 1HG THR 26 11.177 -1.056 4.900
215 HG21 THR 26 1HG2 THR 26 11.892 -2.548 2.395
216 HG22 THR 26 2HG2 THR 26 10.327 -2.119 1.704
217 HG23 THR 26 3HG2 THR 26 10.444 -2.587 3.400
218 H VAL 27 H VAL 27 10.051 0.941 0.774
219 HA VAL 27 HA VAL 27 10.625 3.533 0.144
220 HB VAL 27 HB VAL 27 8.597 3.015 -0.723
221 HG11 VAL 27 1HG1 VAL 27 6.811 1.820 0.699
222 HG12 VAL 27 2HG1 VAL 27 8.217 0.896 0.163
223 HG13 VAL 27 3HG1 VAL 27 8.134 1.498 1.819
224 HG21 VAL 27 1HG2 VAL 27 8.299 5.112 0.544
225 HG22 VAL 27 2HG2 VAL 27 6.796 4.206 0.371
226 HG23 VAL 27 3HG2 VAL 27 7.670 4.179 1.902
227 H LYS 28 H LYS 28 9.063 2.449 3.159
228 HA LYS 28 HA LYS 28 8.814 4.912 4.402
229 HB2 LYS 28 1HB LYS 28 9.585 2.534 6.037
230 HB3 LYS 28 2HB LYS 28 8.355 3.751 6.348
231 HG2 LYS 28 1HG LYS 28 6.980 2.051 5.801
232 HG3 LYS 28 2HG LYS 28 7.297 2.634 4.165
233 HD2 LYS 28 1HD LYS 28 7.829 0.471 3.791
234 HD3 LYS 28 2HD LYS 28 9.380 0.952 4.484
235 HE2 LYS 28 1HE LYS 28 7.250 -0.760 5.591
236 HE3 LYS 28 2HE LYS 28 8.996 -0.822 5.831
237 HZ1 LYS 28 1HZ LYS 28 8.576 1.335 7.173
238 HZ2 LYS 28 2HZ LYS 28 8.250 -0.164 7.884
239 HZ3 LYS 28 3HZ LYS 28 6.984 0.771 7.266
240 H GLU 29 H GLU 29 11.537 2.629 4.565
241 HA GLU 29 HA GLU 29 13.162 4.028 6.320
242 HB2 GLU 29 1HB GLU 29 13.627 2.035 4.168
243 HB3 GLU 29 2HB GLU 29 15.028 2.928 4.742
244 HG2 GLU 29 1HG GLU 29 14.598 0.725 5.861
245 HG3 GLU 29 2HG GLU 29 14.779 2.109 6.936
246 H VAL 30 H VAL 30 13.319 4.119 2.756
247 HA VAL 30 HA VAL 30 15.214 6.134 2.518
248 HB VAL 30 HB VAL 30 12.900 5.609 0.648
249 HG11 VAL 30 1HG1 VAL 30 15.477 6.546 -0.405
250 HG12 VAL 30 2HG1 VAL 30 13.832 7.006 -0.848
251 HG13 VAL 30 3HG1 VAL 30 14.598 7.721 0.572
252 HG21 VAL 30 1HG2 VAL 30 14.913 3.865 1.392
253 HG22 VAL 30 2HG2 VAL 30 13.924 3.758 -0.065
254 HG23 VAL 30 3HG2 VAL 30 15.494 4.559 -0.122
255 H MET 31 H MET 31 11.757 6.343 3.077
256 HA MET 31 HA MET 31 11.525 9.135 2.588
257 HB2 MET 31 1HB MET 31 9.339 8.738 2.856
258 HB3 MET 31 2HB MET 31 9.764 7.046 3.073
259 HG2 MET 31 1HG MET 31 8.397 7.580 4.892
260 HG3 MET 31 2HG MET 31 10.039 7.573 5.532
261 HE1 MET 31 1HE MET 31 8.396 10.439 3.316
262 HE2 MET 31 2HE MET 31 9.201 11.754 4.172
263 HE3 MET 31 3HE MET 31 10.155 10.456 3.452
264 H HIS 32 H HIS 32 12.334 7.197 5.388
265 HA HIS 32 HA HIS 32 12.084 9.322 7.286
266 HB2 HIS 32 1HB HIS 32 12.062 6.744 7.676
267 HB3 HIS 32 2HB HIS 32 13.815 6.907 7.720
268 HD1 HIS 32 HD1 HIS 32 11.114 6.737 9.944
269 HD2 HIS 32 HD2 HIS 32 14.448 9.202 9.687
270 HE1 HIS 32 HE1 HIS 32 11.415 7.703 12.247
271 H TYR 33 H TYR 33 14.668 8.034 5.298
272 HA TYR 33 HA TYR 33 16.761 9.485 6.599
273 HB2 TYR 33 1HB TYR 33 16.608 8.057 3.944
274 HB3 TYR 33 2HB TYR 33 18.068 8.853 4.522
275 HD1 TYR 33 HD1 TYR 33 18.289 8.164 7.282
276 HD2 TYR 33 HD2 TYR 33 16.866 5.769 4.066
277 HE1 TYR 33 HE1 TYR 33 18.906 6.135 8.528
278 HE2 TYR 33 HE2 TYR 33 17.478 3.733 5.303
279 HH TYR 33 HH TYR 33 18.776 2.970 7.064
280 H LEU 34 H LEU 34 14.676 10.039 3.823
281 HA LEU 34 HA LEU 34 15.940 12.142 2.578
282 HB2 LEU 34 1HB LEU 34 13.238 11.107 2.745
283 HB3 LEU 34 2HB LEU 34 13.258 12.858 2.547
284 HG LEU 34 HG LEU 34 13.053 11.689 0.405
285 HD11 LEU 34 1HD1 LEU 34 15.755 12.995 0.634
286 HD12 LEU 34 2HD1 LEU 34 14.233 13.885 0.625
287 HD13 LEU 34 3HD1 LEU 34 14.703 12.928 -0.780
288 HD21 LEU 34 1HD2 LEU 34 14.116 9.673 0.489
289 HD22 LEU 34 2HD2 LEU 34 15.481 10.302 1.413
290 HD23 LEU 34 3HD2 LEU 34 15.364 10.624 -0.318
291 H GLY 35 H GLY 35 13.447 12.453 5.120
292 HA2 GLY 35 1HA GLY 35 13.602 15.199 5.472
293 HA3 GLY 35 2HA GLY 35 13.132 14.063 6.727
294 H GLN 36 H GLN 36 15.431 12.683 7.199
295 HA GLN 36 HA GLN 36 16.853 14.416 8.881
296 HB2 GLN 36 1HB GLN 36 17.757 12.520 9.669
297 HB3 GLN 36 2HB GLN 36 16.695 11.687 8.541
298 HG2 GLN 36 1HG GLN 36 18.832 10.782 8.202
299 HG3 GLN 36 2HG GLN 36 18.552 11.873 6.846
300 HE21 GLN 36 2HE2 GLN 36 20.062 11.692 10.034
301 HE22 GLN 36 1HE2 GLN 36 21.352 12.785 9.682
302 H TYR 37 H TYR 37 17.515 13.268 5.618
303 HA TYR 37 HA TYR 37 20.153 14.216 5.403
304 HB2 TYR 37 1HB TYR 37 19.177 12.621 3.812
305 HB3 TYR 37 2HB TYR 37 18.075 13.864 3.231
306 HD1 TYR 37 HD2 TYR 37 21.695 13.060 3.543
307 HD2 TYR 37 HD1 TYR 37 18.702 15.258 1.466
308 HE1 TYR 37 HE2 TYR 37 23.369 13.759 1.881
309 HE2 TYR 37 HE1 TYR 37 20.367 15.962 -0.202
310 HH TYR 37 HH TYR 37 22.955 14.636 -0.889
311 H ILE 38 H ILE 38 17.053 15.718 4.542
312 HA ILE 38 HA ILE 38 18.105 18.099 3.487
313 HB ILE 38 HB ILE 38 15.442 17.642 4.838
314 HG12 ILE 38 1HG1 ILE 38 16.129 17.702 1.893
315 HG13 ILE 38 2HG1 ILE 38 15.945 16.224 2.831
316 HG21 ILE 38 1HG2 ILE 38 15.973 20.002 4.787
317 HG22 ILE 38 2HG2 ILE 38 16.377 19.901 3.074
318 HG23 ILE 38 3HG2 ILE 38 14.714 19.647 3.604
319 HD11 ILE 38 1HD1 ILE 38 13.966 17.624 1.464
320 HD12 ILE 38 2HD1 ILE 38 13.749 16.271 2.575
321 HD13 ILE 38 3HD1 ILE 38 13.657 17.927 3.174
322 H MET 39 H MET 39 17.088 17.244 6.773
323 HA MET 39 HA MET 39 17.549 19.822 7.874
324 HB2 MET 39 1HB MET 39 16.623 18.931 9.708
325 HB3 MET 39 2HB MET 39 16.385 17.472 8.756
326 HG2 MET 39 1HG MET 39 18.481 16.568 9.560
327 HG3 MET 39 2HG MET 39 18.798 18.052 10.456
328 HE1 MET 39 1HE MET 39 16.469 18.997 11.700
329 HE2 MET 39 2HE MET 39 15.140 17.969 11.166
330 HE3 MET 39 3HE MET 39 15.625 17.974 12.862
331 H VAL 40 H VAL 40 19.557 17.033 7.292
332 HA VAL 40 HA VAL 40 21.704 17.822 9.002
333 HB VAL 40 HB VAL 40 21.081 15.530 7.567
334 HG11 VAL 40 1HG1 VAL 40 22.137 16.493 5.574
335 HG12 VAL 40 2HG1 VAL 40 23.637 16.708 6.479
336 HG13 VAL 40 3HG1 VAL 40 23.019 15.086 6.166
337 HG21 VAL 40 1HG2 VAL 40 23.666 16.230 8.956
338 HG22 VAL 40 2HG2 VAL 40 22.195 15.660 9.746
339 HG23 VAL 40 3HG2 VAL 40 23.067 14.603 8.636
340 H LYS 41 H LYS 41 20.955 18.249 5.582
341 HA LYS 41 HA LYS 41 23.456 19.664 5.121
342 HB2 LYS 41 1HB LYS 41 21.310 18.520 3.431
343 HB3 LYS 41 2HB LYS 41 22.106 19.956 2.801
344 HG2 LYS 41 1HG LYS 41 23.436 17.373 3.592
345 HG3 LYS 41 2HG LYS 41 23.177 17.969 1.951
346 HD2 LYS 41 1HD LYS 41 25.279 18.752 2.177
347 HD3 LYS 41 2HD LYS 41 24.485 20.070 3.042
348 HE2 LYS 41 1HE LYS 41 25.442 19.493 4.972
349 HE3 LYS 41 2HE LYS 41 24.998 17.799 4.767
350 HZ1 LYS 41 1HZ LYS 41 27.049 18.362 2.964
351 HZ2 LYS 41 2HZ LYS 41 27.105 17.355 4.322
352 HZ3 LYS 41 3HZ LYS 41 27.521 18.989 4.463
353 H GLN 42 H GLN 42 20.303 20.372 6.108
354 HA GLN 42 HA GLN 42 19.322 22.357 6.671
355 HB2 GLN 42 1HB GLN 42 22.066 23.046 6.372
356 HB3 GLN 42 2HB GLN 42 21.111 24.305 5.601
357 HG2 GLN 42 1HG GLN 42 20.898 25.194 7.620
358 HG3 GLN 42 2HG GLN 42 19.785 23.873 7.972
359 HE21 GLN 42 2HE2 GLN 42 21.602 21.768 8.064
360 HE22 GLN 42 1HE2 GLN 42 22.617 21.971 9.447
361 H LEU 43 H LEU 43 18.665 21.074 4.307
362 HA LEU 43 HA LEU 43 18.394 23.208 2.317
363 HB2 LEU 43 1HB LEU 43 18.836 20.426 2.150
364 HB3 LEU 43 2HB LEU 43 17.236 20.732 1.478
365 HG LEU 43 HG LEU 43 18.555 20.870 -0.397
366 HD11 LEU 43 1HD1 LEU 43 18.468 23.066 -1.127
367 HD12 LEU 43 2HD1 LEU 43 18.902 23.717 0.452
368 HD13 LEU 43 3HD1 LEU 43 17.292 23.049 0.187
369 HD21 LEU 43 1HD2 LEU 43 20.788 21.704 -0.502
370 HD22 LEU 43 2HD2 LEU 43 20.681 20.633 0.896
371 HD23 LEU 43 3HD2 LEU 43 20.672 22.383 1.122
372 H TYR 44 H TYR 44 16.884 23.849 4.376
373 HA TYR 44 HA TYR 44 14.223 23.726 3.322
374 HB2 TYR 44 1HB TYR 44 13.145 22.676 5.225
375 HB3 TYR 44 2HB TYR 44 14.342 21.575 4.551
376 HD1 TYR 44 HD1 TYR 44 16.810 22.059 5.680
377 HD2 TYR 44 HD2 TYR 44 13.018 22.644 7.519
378 HE1 TYR 44 HE1 TYR 44 17.856 21.834 7.894
379 HE2 TYR 44 HE2 TYR 44 14.054 22.422 9.738
380 HH TYR 44 HH TYR 44 17.185 22.733 10.347
381 H ASP 45 H ASP 45 12.707 25.057 4.586
382 HA ASP 45 HA ASP 45 14.040 27.417 5.564
383 HB2 ASP 45 1HB ASP 45 12.069 27.634 4.134
384 HB3 ASP 45 2HB ASP 45 11.095 26.765 5.316
385 H GLN 46 H GLN 46 14.544 27.814 7.607
386 HA GLN 46 HA GLN 46 13.946 26.031 9.708
387 HB2 GLN 46 1HB GLN 46 15.290 28.665 9.459
388 HB3 GLN 46 2HB GLN 46 14.719 28.216 11.060
389 HG2 GLN 46 1HG GLN 46 17.141 27.577 10.097
390 HG3 GLN 46 2HG GLN 46 16.292 26.643 11.328
391 HE21 GLN 46 2HE2 GLN 46 16.206 26.932 7.787
392 HE22 GLN 46 1HE2 GLN 46 16.263 25.233 7.478
393 H GLN 47 H GLN 47 12.049 28.378 8.257
394 HA GLN 47 HA GLN 47 10.487 28.917 10.673
395 HB2 GLN 47 1HB GLN 47 9.669 30.055 8.059
396 HB3 GLN 47 2HB GLN 47 9.693 30.798 9.653
397 HG2 GLN 47 1HG GLN 47 11.996 30.400 7.768
398 HG3 GLN 47 2HG GLN 47 11.301 31.919 8.332
399 HE21 GLN 47 2HE2 GLN 47 13.771 29.753 8.741
400 HE22 GLN 47 1HE2 GLN 47 14.305 30.234 10.312
401 H GLU 48 H GLU 48 10.411 27.108 7.720
402 HA GLU 48 HA GLU 48 7.894 25.890 8.557
403 HB2 GLU 48 1HB GLU 48 7.046 25.988 6.197
404 HB3 GLU 48 2HB GLU 48 7.100 27.539 7.022
405 HG2 GLU 48 1HG GLU 48 9.159 28.105 5.862
406 HG3 GLU 48 2HG GLU 48 9.151 26.535 5.060
407 H GLN 49 H GLN 49 9.268 24.122 9.097
408 HA GLN 49 HA GLN 49 11.082 22.857 7.430
409 HB2 GLN 49 1HB GLN 49 9.271 21.318 9.272
410 HB3 GLN 49 2HB GLN 49 10.954 21.000 8.873
411 HG2 GLN 49 1HG GLN 49 10.835 23.572 10.034
412 HG3 GLN 49 2HG GLN 49 9.879 22.487 11.042
413 HE21 GLN 49 2HE2 GLN 49 12.424 23.787 11.600
414 HE22 GLN 49 1HE2 GLN 49 13.543 22.520 11.958
415 H HIS 50 H HIS 50 7.691 23.059 7.137
416 HA HIS 50 HA HIS 50 7.277 20.640 5.667
417 HB2 HIS 50 1HB HIS 50 5.060 21.516 5.209
418 HB3 HIS 50 2HB HIS 50 5.462 21.794 6.901
419 HD1 HIS 50 HD1 HIS 50 4.720 24.017 7.649
420 HD2 HIS 50 HD2 HIS 50 5.860 24.049 3.654
421 HE1 HIS 50 HE1 HIS 50 4.372 26.382 6.869
422 H MET 51 H MET 51 9.014 23.290 4.901
423 HA MET 51 HA MET 51 8.476 22.962 2.024
424 HB2 MET 51 1HB MET 51 8.406 25.367 3.628
425 HB3 MET 51 2HB MET 51 9.618 25.499 2.361
426 HG2 MET 51 1HG MET 51 6.678 24.976 2.051
427 HG3 MET 51 2HG MET 51 7.596 26.376 1.503
428 HE1 MET 51 1HE MET 51 10.198 24.706 0.641
429 HE2 MET 51 2HE MET 51 9.983 24.344 -1.072
430 HE3 MET 51 3HE MET 51 9.688 25.977 -0.471
431 H VAL 52 H VAL 52 10.189 22.458 0.803
432 HA VAL 52 HA VAL 52 12.852 22.603 2.057
433 HB VAL 52 HB VAL 52 11.879 20.690 -0.071
434 HG11 VAL 52 1HG1 VAL 52 14.395 20.115 1.303
435 HG12 VAL 52 2HG1 VAL 52 13.988 20.015 -0.411
436 HG13 VAL 52 3HG1 VAL 52 14.443 21.564 0.300
437 HG21 VAL 52 1HG2 VAL 52 10.959 19.748 1.776
438 HG22 VAL 52 2HG2 VAL 52 12.594 19.114 1.966
439 HG23 VAL 52 3HG2 VAL 52 12.088 20.536 2.878
440 H TYR 53 H TYR 53 14.467 23.644 1.031
441 HA TYR 53 HA TYR 53 13.843 24.829 -1.592
442 HB2 TYR 53 1HB TYR 53 15.263 25.867 0.813
443 HB3 TYR 53 2HB TYR 53 15.817 26.411 -0.766
444 HD1 TYR 53 HD2 TYR 53 13.530 26.862 -2.350
445 HD2 TYR 53 HD1 TYR 53 13.953 27.454 1.842
446 HE1 TYR 53 HE2 TYR 53 11.727 28.534 -2.410
447 HE2 TYR 53 HE1 TYR 53 12.150 29.127 1.794
448 HH TYR 53 HH TYR 53 10.245 29.741 0.415
449 H CYS 54 H CYS 54 14.721 22.367 -1.876
450 HA CYS 54 HA CYS 54 17.278 21.567 -1.763
451 HB2 CYS 54 1HB CYS 54 16.952 20.416 -3.946
452 HB3 CYS 54 2HB CYS 54 15.596 20.208 -2.843
453 HG CYS 54 HG CYS 54 13.776 21.158 -4.392
454 H GLY 55 H GLY 55 16.036 24.064 -3.901
455 HA2 GLY 55 1HA GLY 55 17.110 25.653 -5.162
456 HA3 GLY 55 2HA GLY 55 18.521 25.353 -4.158
457 H GLY 56 H GLY 56 19.980 23.641 -4.779
458 HA2 GLY 56 1HA GLY 56 19.675 22.552 -7.463
459 HA3 GLY 56 2HA GLY 56 21.003 23.681 -7.239
460 H ASP 57 H ASP 57 20.185 21.770 -4.518
461 HA ASP 57 HA ASP 57 22.745 20.483 -4.562
462 HB2 ASP 57 1HB ASP 57 20.666 20.975 -2.635
463 HB3 ASP 57 2HB ASP 57 21.126 19.275 -2.591
464 H LEU 58 H LEU 58 22.579 18.005 -3.757
465 HA LEU 58 HA LEU 58 22.141 16.450 -5.959
466 HB2 LEU 58 1HB LEU 58 22.159 15.852 -3.036
467 HB3 LEU 58 2HB LEU 58 21.733 14.576 -4.175
468 HG LEU 58 HG LEU 58 24.255 15.131 -3.292
469 HD11 LEU 58 1HD1 LEU 58 23.699 13.950 -5.997
470 HD12 LEU 58 2HD1 LEU 58 23.285 13.120 -4.498
471 HD13 LEU 58 3HD1 LEU 58 24.966 13.520 -4.849
472 HD21 LEU 58 1HD2 LEU 58 25.508 16.189 -4.995
473 HD22 LEU 58 2HD2 LEU 58 24.146 17.257 -4.653
474 HD23 LEU 58 3HD2 LEU 58 24.125 16.232 -6.089
475 H LEU 59 H LEU 59 19.882 16.762 -3.215
476 HA LEU 59 HA LEU 59 17.805 15.260 -4.328
477 HB2 LEU 59 1HB LEU 59 16.502 15.987 -2.574
478 HB3 LEU 59 2HB LEU 59 18.132 16.180 -1.934
479 HG LEU 59 HG LEU 59 16.644 18.475 -3.176
480 HD11 LEU 59 1HD1 LEU 59 15.568 17.183 -1.095
481 HD12 LEU 59 2HD1 LEU 59 15.488 18.934 -1.289
482 HD13 LEU 59 3HD1 LEU 59 16.707 18.218 -0.234
483 HD21 LEU 59 1HD2 LEU 59 18.739 18.504 -1.024
484 HD22 LEU 59 2HD2 LEU 59 18.210 19.826 -2.065
485 HD23 LEU 59 3HD2 LEU 59 19.155 18.496 -2.738
486 H GLY 60 H GLY 60 18.554 18.706 -4.575
487 HA2 GLY 60 1HA GLY 60 16.198 19.514 -5.881
488 HA3 GLY 60 2HA GLY 60 17.745 20.343 -5.964
489 H GLU 61 H GLU 61 19.302 18.401 -7.195
490 HA GLU 61 HA GLU 61 18.615 18.800 -9.909
491 HB2 GLU 61 1HB GLU 61 20.571 16.735 -8.916
492 HB3 GLU 61 2HB GLU 61 20.595 17.609 -10.441
493 HG2 GLU 61 1HG GLU 61 20.693 19.601 -8.523
494 HG3 GLU 61 2HG GLU 61 21.721 18.324 -7.877
495 H LEU 62 H LEU 62 18.371 16.007 -7.755
496 HA LEU 62 HA LEU 62 17.582 14.111 -9.661
497 HB2 LEU 62 1HB LEU 62 18.268 13.363 -7.520
498 HB3 LEU 62 2HB LEU 62 17.053 14.351 -6.711
499 HG LEU 62 HG LEU 62 15.292 12.890 -7.638
500 HD11 LEU 62 1HD1 LEU 62 15.713 11.507 -9.315
501 HD12 LEU 62 2HD1 LEU 62 16.865 10.625 -8.313
502 HD13 LEU 62 3HD1 LEU 62 17.410 11.989 -9.289
503 HD21 LEU 62 1HD2 LEU 62 17.090 10.960 -6.327
504 HD22 LEU 62 2HD2 LEU 62 15.454 11.463 -5.900
505 HD23 LEU 62 3HD2 LEU 62 16.831 12.477 -5.466
506 H LEU 63 H LEU 63 15.605 16.157 -7.521
507 HA LEU 63 HA LEU 63 13.116 15.274 -8.533
508 HB2 LEU 63 1HB LEU 63 14.052 17.082 -6.558
509 HB3 LEU 63 2HB LEU 63 12.913 17.951 -7.584
510 HG LEU 63 HG LEU 63 12.045 15.297 -6.607
511 HD11 LEU 63 1HD1 LEU 63 11.639 15.905 -4.409
512 HD12 LEU 63 2HD1 LEU 63 11.868 17.623 -4.734
513 HD13 LEU 63 3HD1 LEU 63 13.259 16.540 -4.697
514 HD21 LEU 63 1HD2 LEU 63 9.942 16.213 -6.757
515 HD22 LEU 63 2HD2 LEU 63 10.792 17.107 -8.017
516 HD23 LEU 63 3HD2 LEU 63 10.513 17.852 -6.443
517 H GLY 64 H GLY 64 15.302 17.874 -9.448
518 HA2 GLY 64 1HA GLY 64 15.449 18.838 -11.577
519 HA3 GLY 64 2HA GLY 64 13.893 18.128 -11.981
520 H ARG 65 H ARG 65 13.401 19.471 -9.063
521 HA ARG 65 HA ARG 65 12.398 21.959 -10.264
522 HB2 ARG 65 1HB ARG 65 11.492 21.153 -7.562
523 HB3 ARG 65 2HB ARG 65 10.582 21.856 -8.893
524 HG2 ARG 65 1HG ARG 65 11.325 18.984 -8.453
525 HG3 ARG 65 2HG ARG 65 9.718 19.697 -8.608
526 HD2 ARG 65 1HD ARG 65 11.655 18.903 -10.685
527 HD3 ARG 65 2HD ARG 65 9.892 18.894 -10.715
528 HE ARG 65 HE ARG 65 11.597 20.933 -11.711
529 HH11 ARG 65 1HH1 ARG 65 8.540 20.411 -10.129
530 HH12 ARG 65 2HH1 ARG 65 7.824 21.862 -10.747
531 HH21 ARG 65 1HH2 ARG 65 10.665 22.847 -12.532
532 HH22 ARG 65 2HH2 ARG 65 9.033 23.246 -12.115
533 H GLN 66 H GLN 66 12.205 23.784 -8.558
534 HA GLN 66 HA GLN 66 14.883 24.230 -7.536
535 HB2 GLN 66 1HB GLN 66 12.530 26.116 -7.415
536 HB3 GLN 66 2HB GLN 66 14.235 26.520 -7.272
537 HG2 GLN 66 1HG GLN 66 14.602 26.395 -9.516
538 HG3 GLN 66 2HG GLN 66 13.319 25.214 -9.772
539 HE21 GLN 66 2HE2 GLN 66 12.735 26.576 -11.576
540 HE22 GLN 66 1HE2 GLN 66 11.750 27.970 -11.307
541 H SER 67 H SER 67 11.626 23.761 -6.317
542 HA SER 67 HA SER 67 12.662 23.124 -3.702
543 HB2 SER 67 1HB SER 67 10.727 24.839 -2.855
544 HB3 SER 67 2HB SER 67 12.439 25.251 -2.943
545 HG SER 67 HG SER 67 10.348 26.205 -4.399
546 H PHE 68 H PHE 68 11.028 22.210 -2.289
547 HA PHE 68 HA PHE 68 8.450 21.586 -3.480
548 HB2 PHE 68 1HB PHE 68 8.738 19.154 -3.153
549 HB3 PHE 68 2HB PHE 68 9.862 19.799 -4.345
550 HD1 PHE 68 HD2 PHE 68 9.528 18.474 -0.937
551 HD2 PHE 68 HD1 PHE 68 12.218 19.777 -3.967
552 HE1 PHE 68 HE2 PHE 68 11.406 17.494 0.314
553 HE2 PHE 68 HE1 PHE 68 14.101 18.798 -2.722
554 HZ PHE 68 HZ PHE 68 13.696 17.656 -0.578
555 H SER 69 H SER 69 6.890 20.920 -1.986
556 HA SER 69 HA SER 69 7.563 21.565 0.782
557 HB2 SER 69 1HB SER 69 4.761 20.936 0.041
558 HB3 SER 69 2HB SER 69 5.398 22.235 1.050
559 HG SER 69 HG SER 69 4.664 23.181 -0.804
560 H VAL 70 H VAL 70 7.350 20.164 2.471
561 HA VAL 70 HA VAL 70 7.403 17.359 1.852
562 HB VAL 70 HB VAL 70 8.290 17.049 3.904
563 HG11 VAL 70 1HG1 VAL 70 9.763 18.721 4.391
564 HG12 VAL 70 2HG1 VAL 70 9.196 19.291 2.820
565 HG13 VAL 70 3HG1 VAL 70 8.534 19.982 4.302
566 HG21 VAL 70 1HG2 VAL 70 6.315 19.074 4.943
567 HG22 VAL 70 2HG2 VAL 70 6.262 17.322 5.140
568 HG23 VAL 70 3HG2 VAL 70 7.514 18.263 5.950
569 H LYS 71 H LYS 71 5.157 19.573 3.441
570 HA LYS 71 HA LYS 71 3.330 17.650 4.373
571 HB2 LYS 71 1HB LYS 71 3.553 20.291 4.728
572 HB3 LYS 71 2HB LYS 71 2.309 20.299 3.485
573 HG2 LYS 71 1HG LYS 71 0.777 19.192 4.831
574 HG3 LYS 71 2HG LYS 71 2.027 18.578 5.916
575 HD2 LYS 71 1HD LYS 71 1.582 21.525 5.661
576 HD3 LYS 71 2HD LYS 71 0.509 20.556 6.673
577 HE2 LYS 71 1HE LYS 71 2.836 19.640 7.576
578 HE3 LYS 71 2HE LYS 71 3.380 21.225 7.029
579 HZ1 LYS 71 1HZ LYS 71 2.705 21.854 9.057
580 HZ2 LYS 71 2HZ LYS 71 1.679 20.526 9.264
581 HZ3 LYS 71 3HZ LYS 71 1.159 21.864 8.369
582 H ASP 72 H ASP 72 4.102 18.568 1.229
583 HA ASP 72 HA ASP 72 1.566 17.454 0.220
584 HB2 ASP 72 1HB ASP 72 1.820 19.838 -0.351
585 HB3 ASP 72 2HB ASP 72 3.357 19.483 -1.133
586 HA PRO 73 HA PRO 73 4.683 14.385 -1.023
587 HB2 PRO 73 1HB PRO 73 2.893 12.356 -1.243
588 HB3 PRO 73 2HB PRO 73 3.601 12.850 0.300
589 HG2 PRO 73 1HG PRO 73 0.929 13.535 -0.864
590 HG3 PRO 73 2HG PRO 73 1.341 13.077 0.799
591 HD2 PRO 73 1HD PRO 73 0.936 15.649 0.053
592 HD3 PRO 73 2HD PRO 73 2.081 15.195 1.331
593 H SER 74 H SER 74 3.999 16.226 -2.902
594 HA SER 74 HA SER 74 2.739 14.785 -5.115
595 HB2 SER 74 1HB SER 74 3.110 17.612 -4.405
596 HB3 SER 74 2HB SER 74 3.388 17.258 -6.110
597 HG SER 74 HG SER 74 1.332 16.499 -6.293
598 HA PRO 75 HA PRO 75 6.924 15.949 -7.159
599 HB2 PRO 75 1HB PRO 75 8.714 17.385 -5.709
600 HB3 PRO 75 2HB PRO 75 7.456 18.136 -6.697
601 HG2 PRO 75 1HG PRO 75 7.502 17.638 -3.746
602 HG3 PRO 75 2HG PRO 75 6.964 19.079 -4.629
603 HD2 PRO 75 1HD PRO 75 5.235 17.238 -3.654
604 HD3 PRO 75 2HD PRO 75 4.916 18.154 -5.141
605 H LEU 76 H LEU 76 6.939 15.200 -3.737
606 HA LEU 76 HA LEU 76 9.446 13.963 -3.550
607 HB2 LEU 76 1HB LEU 76 8.080 14.579 -1.615
608 HB3 LEU 76 2HB LEU 76 6.910 13.334 -2.046
609 HG LEU 76 HG LEU 76 8.887 11.696 -1.754
610 HD11 LEU 76 1HD1 LEU 76 10.039 14.235 -0.843
611 HD12 LEU 76 2HD1 LEU 76 10.829 12.760 -1.400
612 HD13 LEU 76 3HD1 LEU 76 10.257 12.879 0.264
613 HD21 LEU 76 1HD2 LEU 76 7.759 13.091 0.670
614 HD22 LEU 76 2HD2 LEU 76 8.378 11.441 0.588
615 HD23 LEU 76 3HD2 LEU 76 6.906 11.875 -0.282
616 H TYR 77 H TYR 77 6.251 12.416 -3.927
617 HA TYR 77 HA TYR 77 7.311 9.845 -4.448
618 HB2 TYR 77 1HB TYR 77 4.604 11.092 -4.867
619 HB3 TYR 77 2HB TYR 77 4.942 9.442 -5.378
620 HD1 TYR 77 HD1 TYR 77 5.719 7.778 -3.621
621 HD2 TYR 77 HD2 TYR 77 4.065 11.572 -2.632
622 HE1 TYR 77 HE1 TYR 77 5.245 6.972 -1.346
623 HE2 TYR 77 HE2 TYR 77 3.588 10.776 -0.354
624 HH TYR 77 HH TYR 77 3.384 7.763 0.536
625 H ASP 78 H ASP 78 6.182 12.454 -6.552
626 HA ASP 78 HA ASP 78 6.259 11.161 -9.000
627 HB2 ASP 78 1HB ASP 78 5.652 13.658 -8.268
628 HB3 ASP 78 2HB ASP 78 7.273 13.957 -8.891
629 H MET 79 H MET 79 8.887 12.590 -7.137
630 HA MET 79 HA MET 79 10.854 12.220 -9.184
631 HB2 MET 79 1HB MET 79 11.774 13.771 -7.849
632 HB3 MET 79 2HB MET 79 10.747 13.328 -6.493
633 HG2 MET 79 1HG MET 79 12.253 11.498 -5.935
634 HG3 MET 79 2HG MET 79 13.275 11.915 -7.309
635 HE1 MET 79 1HE MET 79 13.289 13.730 -3.169
636 HE2 MET 79 2HE MET 79 11.728 13.492 -3.955
637 HE3 MET 79 3HE MET 79 12.806 12.119 -3.701
638 H LEU 80 H LEU 80 10.143 10.565 -6.113
639 HA LEU 80 HA LEU 80 12.108 8.628 -6.184
640 HB2 LEU 80 1HB LEU 80 9.270 8.341 -5.208
641 HB3 LEU 80 2HB LEU 80 10.599 7.254 -4.809
642 HG LEU 80 HG LEU 80 10.659 10.176 -4.103
643 HD11 LEU 80 1HD1 LEU 80 9.642 9.782 -2.054
644 HD12 LEU 80 2HD1 LEU 80 9.832 8.034 -2.182
645 HD13 LEU 80 3HD1 LEU 80 8.640 8.867 -3.181
646 HD21 LEU 80 1HD2 LEU 80 11.978 8.473 -2.262
647 HD22 LEU 80 2HD2 LEU 80 12.681 9.675 -3.344
648 HD23 LEU 80 3HD2 LEU 80 12.483 8.008 -3.887
649 H ARG 81 H ARG 81 9.070 8.765 -7.929
650 HA ARG 81 HA ARG 81 8.532 6.300 -8.790
651 HB2 ARG 81 1HB ARG 81 7.769 8.689 -9.668
652 HB3 ARG 81 2HB ARG 81 8.880 8.299 -10.974
653 HG2 ARG 81 1HG ARG 81 7.459 6.006 -10.830
654 HG3 ARG 81 2HG ARG 81 6.241 7.185 -10.339
655 HD2 ARG 81 1HD ARG 81 6.098 8.070 -12.397
656 HD3 ARG 81 2HD ARG 81 7.842 8.002 -12.650
657 HE ARG 81 HE ARG 81 7.500 6.109 -13.860
658 HH11 ARG 81 1HH1 ARG 81 4.868 6.452 -11.608
659 HH12 ARG 81 2HH1 ARG 81 4.024 5.051 -12.180
660 HH21 ARG 81 1HH2 ARG 81 6.399 4.263 -14.622
661 HH22 ARG 81 2HH2 ARG 81 4.896 3.807 -13.894
662 H LYS 82 H LYS 82 11.060 8.291 -10.332
663 HA LYS 82 HA LYS 82 12.237 5.822 -11.412
664 HB2 LYS 82 1HB LYS 82 12.856 6.961 -13.272
665 HB3 LYS 82 2HB LYS 82 11.551 8.034 -12.785
666 HG2 LYS 82 1HG LYS 82 14.450 8.429 -12.074
667 HG3 LYS 82 2HG LYS 82 13.616 9.226 -13.410
668 HD2 LYS 82 1HD LYS 82 12.900 9.455 -10.486
669 HD3 LYS 82 2HD LYS 82 13.737 10.677 -11.446
670 HE2 LYS 82 1HE LYS 82 11.630 10.445 -12.993
671 HE3 LYS 82 2HE LYS 82 10.881 9.817 -11.526
672 HZ1 LYS 82 1HZ LYS 82 11.634 12.515 -12.193
673 HZ2 LYS 82 2HZ LYS 82 12.126 12.041 -10.646
674 HZ3 LYS 82 3HZ LYS 82 10.493 11.955 -11.077
675 H ASN 83 H ASN 83 12.576 7.875 -8.874
676 HA ASN 83 HA ASN 83 15.487 7.935 -8.856
677 HB2 ASN 83 1HB ASN 83 15.000 9.873 -7.822
678 HB3 ASN 83 2HB ASN 83 13.344 9.373 -7.490
679 HD21 ASN 83 2HD2 ASN 83 16.549 8.239 -6.465
680 HD22 ASN 83 1HD2 ASN 83 16.209 8.287 -4.771
681 H LEU 84 H LEU 84 12.894 6.743 -6.718
682 HA LEU 84 HA LEU 84 14.710 5.177 -5.150
683 HB2 LEU 84 1HB LEU 84 12.271 6.202 -4.676
684 HB3 LEU 84 2HB LEU 84 11.823 4.551 -5.100
685 HG LEU 84 HG LEU 84 12.918 3.651 -3.246
686 HD11 LEU 84 1HD1 LEU 84 14.356 5.194 -1.774
687 HD12 LEU 84 2HD1 LEU 84 14.437 6.232 -3.197
688 HD13 LEU 84 3HD1 LEU 84 15.049 4.579 -3.275
689 HD21 LEU 84 1HD2 LEU 84 10.908 4.739 -2.547
690 HD22 LEU 84 2HD2 LEU 84 11.721 6.302 -2.456
691 HD23 LEU 84 3HD2 LEU 84 12.136 5.023 -1.314
692 H VAL 85 H VAL 85 15.747 3.683 -6.415
693 HA VAL 85 HA VAL 85 14.607 2.101 -8.413
694 HB VAL 85 HB VAL 85 17.030 1.750 -6.678
695 HG11 VAL 85 1HG1 VAL 85 16.741 -0.480 -6.939
696 HG12 VAL 85 2HG1 VAL 85 15.692 -0.291 -8.346
697 HG13 VAL 85 3HG1 VAL 85 17.441 -0.147 -8.523
698 HG21 VAL 85 1HG2 VAL 85 18.023 2.864 -8.322
699 HG22 VAL 85 2HG2 VAL 85 17.487 1.664 -9.498
700 HG23 VAL 85 3HG2 VAL 85 16.460 3.047 -9.119
701 H THR 86 H THR 86 12.565 1.436 -7.561
702 HA THR 86 HA THR 86 12.674 -0.626 -5.474
703 HB THR 86 HB THR 86 10.269 -0.378 -5.265
704 HG1 THR 86 1HG THR 86 9.100 0.628 -6.741
705 HG21 THR 86 1HG2 THR 86 10.746 1.280 -3.855
706 HG22 THR 86 2HG2 THR 86 10.566 2.422 -5.188
707 HG23 THR 86 3HG2 THR 86 12.150 1.740 -4.818
708 H LEU 87 H LEU 87 11.761 -2.669 -5.786
709 HA LEU 87 HA LEU 87 11.422 -3.428 -8.611
710 HB2 LEU 87 1HB LEU 87 11.811 -5.774 -7.264
711 HB3 LEU 87 2HB LEU 87 13.050 -4.871 -8.133
712 HG LEU 87 HG LEU 87 12.501 -4.485 -5.198
713 HD11 LEU 87 1HD1 LEU 87 14.928 -5.884 -5.665
714 HD12 LEU 87 2HD1 LEU 87 13.620 -6.765 -6.452
715 HD13 LEU 87 3HD1 LEU 87 13.521 -6.393 -4.731
716 HD21 LEU 87 1HD2 LEU 87 14.486 -3.487 -7.164
717 HD22 LEU 87 2HD2 LEU 87 15.052 -3.829 -5.529
718 HD23 LEU 87 3HD2 LEU 87 13.745 -2.673 -5.787
719 H ALA 88 H ALA 88 9.798 -4.945 -9.160
720 HA ALA 88 HA ALA 88 7.838 -6.134 -8.922
721 HB1 ALA 88 1HB ALA 88 7.379 -5.261 -6.123
722 HB2 ALA 88 2HB ALA 88 7.100 -6.828 -6.884
723 HB3 ALA 88 3HB ALA 88 8.736 -6.344 -6.435
724 H THR 89 H THR 89 5.704 -5.578 -9.282
725 HA THR 89 HA THR 89 4.085 -4.137 -10.024
726 HB THR 89 HB THR 89 4.347 -2.521 -7.538
727 HG1 THR 89 1HG THR 89 3.222 -5.079 -7.296
728 HG21 THR 89 1HG2 THR 89 1.843 -3.274 -7.528
729 HG22 THR 89 2HG2 THR 89 2.166 -3.701 -9.208
730 HG23 THR 89 3HG2 THR 89 2.386 -2.039 -8.663
731 H1 SER 115 H SER 115 7.655 19.488 23.271
732 HA SER 115 HA SER 115 5.974 21.804 22.664
733 HB2 SER 115 1HB SER 115 8.196 22.838 23.863
734 HB3 SER 115 2HB SER 115 6.754 22.314 24.731
735 HG SER 115 HG SER 115 7.837 20.700 25.531
736 H GLN 116 H GLN 116 9.422 20.943 22.325
737 HA GLN 116 HA GLN 116 10.344 22.881 20.708
738 HB2 GLN 116 1HB GLN 116 10.851 19.916 20.442
739 HB3 GLN 116 2HB GLN 116 11.790 21.144 19.603
740 HG2 GLN 116 1HG GLN 116 11.567 20.761 22.578
741 HG3 GLN 116 2HG GLN 116 12.971 20.430 21.565
742 HE21 GLN 116 2HE2 GLN 116 13.026 22.657 19.974
743 HE22 GLN 116 1HE2 GLN 116 13.358 24.052 20.938
744 H GLU 117 H GLU 117 9.407 19.855 19.108
745 HA GLU 117 HA GLU 117 8.148 19.452 17.240
746 HB2 GLU 117 1HB GLU 117 6.344 20.744 16.929
747 HB3 GLU 117 2HB GLU 117 6.933 21.695 18.285
748 HG2 GLU 117 1HG GLU 117 6.533 23.283 16.655
749 HG3 GLU 117 2HG GLU 117 8.268 23.001 16.524
750 H THR 118 H THR 118 8.639 19.368 15.083
751 HA THR 118 HA THR 118 9.967 21.386 13.633
752 HB THR 118 HB THR 118 11.814 20.623 15.220
753 HG1 THR 118 1HG THR 118 13.276 20.365 13.232
754 HG21 THR 118 1HG2 THR 118 12.361 18.355 13.406
755 HG22 THR 118 2HG2 THR 118 11.060 18.120 14.574
756 HG23 THR 118 3HG2 THR 118 12.682 18.531 15.131
757 H PHE 119 H PHE 119 11.600 19.525 12.063
758 HA PHE 119 HA PHE 119 9.850 18.819 10.073
759 HB2 PHE 119 1HB PHE 119 12.536 18.675 10.357
760 HB3 PHE 119 2HB PHE 119 12.127 16.964 10.437
761 HD1 PHE 119 HD2 PHE 119 9.576 17.831 8.555
762 HD2 PHE 119 HD1 PHE 119 13.823 17.930 8.301
763 HE1 PHE 119 HE2 PHE 119 9.427 17.753 6.100
764 HE2 PHE 119 HE1 PHE 119 13.681 17.853 5.845
765 HZ PHE 119 HZ PHE 119 11.481 17.763 4.742
766 H SER 120 H SER 120 10.610 17.079 12.995
767 HA SER 120 HA SER 120 9.593 14.554 12.264
768 HB2 SER 120 1HB SER 120 10.951 15.414 14.399
769 HB3 SER 120 2HB SER 120 9.329 15.462 15.089
770 HG SER 120 HG SER 120 9.132 13.308 14.814
771 H ASP 121 H ASP 121 8.067 17.484 13.388
772 HA ASP 121 HA ASP 121 5.556 16.310 14.053
773 HB2 ASP 121 1HB ASP 121 5.872 18.368 15.083
774 HB3 ASP 121 2HB ASP 121 6.546 19.106 13.632
775 H LEU 122 H LEU 122 6.868 17.877 11.171
776 HA LEU 122 HA LEU 122 4.367 17.456 9.734
777 HB2 LEU 122 1HB LEU 122 6.650 18.444 8.207
778 HB3 LEU 122 2HB LEU 122 5.019 19.096 8.359
779 HG LEU 122 HG LEU 122 7.387 19.598 10.149
780 HD11 LEU 122 1HD1 LEU 122 5.642 21.661 8.881
781 HD12 LEU 122 2HD1 LEU 122 6.893 20.863 7.928
782 HD13 LEU 122 3HD1 LEU 122 7.331 21.767 9.377
783 HD21 LEU 122 1HD2 LEU 122 4.675 19.428 10.924
784 HD22 LEU 122 2HD2 LEU 122 5.104 21.139 10.882
785 HD23 LEU 122 3HD2 LEU 122 6.046 20.016 11.864
786 H TRP 123 H TRP 123 7.814 16.744 9.143
787 HA TRP 123 HA TRP 123 7.721 15.124 7.003
788 HB2 TRP 123 1HB TRP 123 9.727 15.691 8.498
789 HB3 TRP 123 2HB TRP 123 9.283 14.266 9.433
790 HD1 TRP 123 HD1 TRP 123 10.634 12.215 8.756
791 HE1 TRP 123 HE1 TRP 123 11.724 11.342 6.594
792 HE3 TRP 123 HE3 TRP 123 9.274 15.985 5.582
793 HZ2 TRP 123 HZ2 TRP 123 11.976 12.146 3.900
794 HZ3 TRP 123 HZ3 TRP 123 9.981 15.857 3.228
795 HH2 TRP 123 HH2 TRP 123 11.304 13.977 2.407
796 H LYS 124 H LYS 124 7.169 13.970 10.330
797 HA LYS 124 HA LYS 124 6.726 11.346 10.040
798 HB2 LYS 124 1HB LYS 124 5.131 11.430 11.844
799 HB3 LYS 124 2HB LYS 124 6.373 12.640 12.137
800 HG2 LYS 124 1HG LYS 124 4.828 14.351 11.188
801 HG3 LYS 124 2HG LYS 124 3.579 13.105 11.121
802 HD2 LYS 124 1HD LYS 124 5.042 13.748 13.665
803 HD3 LYS 124 2HD LYS 124 3.609 14.648 13.163
804 HE2 LYS 124 1HE LYS 124 3.602 11.652 13.318
805 HE3 LYS 124 2HE LYS 124 3.301 12.643 14.744
806 HZ1 LYS 124 1HZ LYS 124 1.599 13.778 13.125
807 HZ2 LYS 124 2HZ LYS 124 1.190 12.378 13.980
808 HZ3 LYS 124 3HZ LYS 124 1.650 12.272 12.356
809 H LEU 125 H LEU 125 4.474 13.872 9.026
810 HA LEU 125 HA LEU 125 2.200 12.593 8.408
811 HB2 LEU 125 1HB LEU 125 2.911 14.979 7.848
812 HB3 LEU 125 2HB LEU 125 3.537 14.314 6.340
813 HG LEU 125 HG LEU 125 0.803 13.500 6.744
814 HD11 LEU 125 1HD1 LEU 125 0.518 15.494 8.044
815 HD12 LEU 125 2HD1 LEU 125 -0.198 15.753 6.454
816 HD13 LEU 125 3HD1 LEU 125 1.372 16.457 6.839
817 HD21 LEU 125 1HD2 LEU 125 0.545 14.389 4.523
818 HD22 LEU 125 2HD2 LEU 125 2.076 13.518 4.619
819 HD23 LEU 125 3HD2 LEU 125 2.060 15.282 4.662
820 H LEU 126 H LEU 126 5.156 12.447 6.450
821 HA LEU 126 HA LEU 126 4.094 10.785 4.427
822 HB2 LEU 126 1HB LEU 126 6.730 11.780 5.233
823 HB3 LEU 126 2HB LEU 126 6.762 10.211 4.430
824 HG LEU 126 HG LEU 126 6.171 11.077 2.411
825 HD11 LEU 126 1HD1 LEU 126 4.599 13.077 3.987
826 HD12 LEU 126 2HD1 LEU 126 4.043 11.918 2.779
827 HD13 LEU 126 3HD1 LEU 126 4.947 13.347 2.279
828 HD21 LEU 126 1HD2 LEU 126 8.113 12.228 2.474
829 HD22 LEU 126 2HD2 LEU 126 7.705 13.052 3.978
830 HD23 LEU 126 3HD2 LEU 126 7.032 13.621 2.450
831 HA PRO 127 HA PRO 127 4.213 6.724 6.082
832 HB2 PRO 127 1HB PRO 127 5.319 5.262 4.080
833 HB3 PRO 127 2HB PRO 127 3.686 5.934 3.990
834 HG2 PRO 127 1HG PRO 127 6.232 6.979 2.812
835 HG3 PRO 127 2HG PRO 127 4.620 6.880 2.081
836 HD2 PRO 127 1HD PRO 127 5.613 9.178 3.113
837 HD3 PRO 127 2HD PRO 127 3.882 8.785 3.147
838 H GLU 128 H GLU 128 6.099 7.912 7.430
839 HA GLU 128 HA GLU 128 8.762 7.088 6.974
840 HB2 GLU 128 1HB GLU 128 8.901 7.571 9.550
841 HB3 GLU 128 2HB GLU 128 8.658 8.887 8.409
842 HG2 GLU 128 1HG GLU 128 6.496 9.234 9.047
843 HG3 GLU 128 2HG GLU 128 6.263 7.563 9.561
844 H ASN 129 H ASN 129 6.137 5.730 8.915
845 HA ASN 129 HA ASN 129 6.045 3.816 10.195
846 HB2 ASN 129 1HB ASN 129 7.281 2.705 7.666
847 HB3 ASN 129 2HB ASN 129 6.314 1.813 8.837
848 HD21 ASN 129 2HD2 ASN 129 6.293 3.985 6.173
849 HD22 ASN 129 1HD2 ASN 129 4.580 4.046 5.955
Start of MODEL 9
1 H1 GLN 1 H GLN 1 1.496 -1.573 2.821
2 HA GLN 1 HA GLN 1 2.614 1.001 1.986
3 HB2 GLN 1 1HB GLN 1 2.347 0.126 4.868
4 HB3 GLN 1 2HB GLN 1 3.188 1.567 4.310
5 HG2 GLN 1 1HG GLN 1 0.809 2.030 3.207
6 HG3 GLN 1 2HG GLN 1 0.293 1.036 4.569
7 HE21 GLN 1 2HE2 GLN 1 2.071 3.934 3.675
8 HE22 GLN 1 1HE2 GLN 1 1.840 4.762 5.173
9 H ILE 2 H ILE 2 4.869 1.135 3.397
10 HA ILE 2 HA ILE 2 7.023 0.397 3.408
11 HB ILE 2 HB ILE 2 6.313 -2.440 3.772
12 HG12 ILE 2 1HG1 ILE 2 4.367 -1.579 4.843
13 HG13 ILE 2 2HG1 ILE 2 5.510 -1.954 6.128
14 HG21 ILE 2 1HG2 ILE 2 8.499 -0.965 4.254
15 HG22 ILE 2 2HG2 ILE 2 7.724 -0.867 5.834
16 HG23 ILE 2 3HG2 ILE 2 8.114 -2.441 5.139
17 HD11 ILE 2 1HD1 ILE 2 5.526 0.147 6.833
18 HD12 ILE 2 2HD1 ILE 2 5.788 0.771 5.204
19 HD13 ILE 2 3HD1 ILE 2 4.152 0.420 5.761
20 H ASN 3 H ASN 3 7.966 0.513 1.467
21 HA ASN 3 HA ASN 3 7.601 -1.759 -0.371
22 HB2 ASN 3 1HB ASN 3 6.838 0.851 -0.883
23 HB3 ASN 3 2HB ASN 3 8.411 0.732 -1.666
24 HD21 ASN 3 2HD2 ASN 3 5.659 -1.470 -1.235
25 HD22 ASN 3 1HD2 ASN 3 5.496 -1.865 -2.909
26 H GLN 4 H GLN 4 9.410 -2.870 -0.644
27 HA GLN 4 HA GLN 4 11.921 -1.990 0.329
28 HB2 GLN 4 1HB GLN 4 11.807 -4.190 -1.668
29 HB3 GLN 4 2HB GLN 4 12.676 -4.101 -0.142
30 HG2 GLN 4 1HG GLN 4 11.129 -5.525 0.593
31 HG3 GLN 4 2HG GLN 4 10.095 -4.102 0.706
32 HE21 GLN 4 2HE2 GLN 4 8.199 -4.272 -0.233
33 HE22 GLN 4 1HE2 GLN 4 7.797 -5.323 -1.543
34 H VAL 5 H VAL 5 13.727 -1.249 -0.721
35 HA VAL 5 HA VAL 5 13.516 -0.742 -3.607
36 HB VAL 5 HB VAL 5 14.277 1.505 -3.418
37 HG11 VAL 5 1HG1 VAL 5 12.347 2.465 -2.694
38 HG12 VAL 5 2HG1 VAL 5 11.820 0.781 -2.691
39 HG13 VAL 5 3HG1 VAL 5 12.326 1.551 -1.187
40 HG21 VAL 5 1HG2 VAL 5 14.271 2.026 -0.633
41 HG22 VAL 5 2HG2 VAL 5 15.307 0.627 -0.915
42 HG23 VAL 5 3HG2 VAL 5 15.618 2.140 -1.766
43 H ARG 6 H ARG 6 15.712 0.091 -4.451
44 HA ARG 6 HA ARG 6 17.968 -1.074 -3.000
45 HB2 ARG 6 1HB ARG 6 16.718 -2.312 -5.242
46 HB3 ARG 6 2HB ARG 6 18.297 -1.732 -5.753
47 HG2 ARG 6 1HG ARG 6 19.361 -2.965 -3.956
48 HG3 ARG 6 2HG ARG 6 17.784 -3.503 -3.373
49 HD2 ARG 6 1HD ARG 6 17.548 -5.038 -5.022
50 HD3 ARG 6 2HD ARG 6 18.388 -4.045 -6.212
51 HE ARG 6 HE ARG 6 19.512 -6.133 -4.703
52 HH11 ARG 6 1HH1 ARG 6 20.234 -2.904 -5.783
53 HH12 ARG 6 2HH1 ARG 6 21.949 -3.152 -5.798
54 HH21 ARG 6 1HH2 ARG 6 21.767 -6.473 -4.718
55 HH22 ARG 6 2HH2 ARG 6 22.820 -5.183 -5.192
56 HA PRO 7 HA PRO 7 19.017 3.035 -4.782
57 HB2 PRO 7 1HB PRO 7 20.529 3.801 -2.662
58 HB3 PRO 7 2HB PRO 7 18.774 3.998 -2.710
59 HG2 PRO 7 1HG PRO 7 20.404 1.867 -1.383
60 HG3 PRO 7 2HG PRO 7 18.986 2.737 -0.768
61 HD2 PRO 7 1HD PRO 7 18.829 0.236 -1.794
62 HD3 PRO 7 2HD PRO 7 17.509 1.413 -1.942
63 H LYS 8 H LYS 8 20.781 3.451 -5.986
64 HA LYS 8 HA LYS 8 22.922 1.510 -6.020
65 HB2 LYS 8 1HB LYS 8 22.181 3.865 -7.732
66 HB3 LYS 8 2HB LYS 8 23.753 3.095 -7.899
67 HG2 LYS 8 1HG LYS 8 22.875 1.523 -9.181
68 HG3 LYS 8 2HG LYS 8 21.741 1.078 -7.903
69 HD2 LYS 8 1HD LYS 8 20.640 1.717 -10.038
70 HD3 LYS 8 2HD LYS 8 20.155 2.715 -8.665
71 HE2 LYS 8 1HE LYS 8 21.126 4.578 -9.507
72 HE3 LYS 8 2HE LYS 8 22.466 3.684 -10.224
73 HZ1 LYS 8 1HZ LYS 8 20.289 4.726 -11.539
74 HZ2 LYS 8 2HZ LYS 8 20.012 3.058 -11.512
75 HZ3 LYS 8 3HZ LYS 8 21.444 3.667 -12.176
76 H LEU 9 H LEU 9 25.172 2.759 -6.625
77 HA LEU 9 HA LEU 9 26.327 3.513 -4.271
78 HB2 LEU 9 1HB LEU 9 26.980 3.974 -7.123
79 HB3 LEU 9 2HB LEU 9 27.858 4.935 -5.935
80 HG LEU 9 HG LEU 9 28.634 2.496 -6.855
81 HD11 LEU 9 1HD1 LEU 9 29.359 4.329 -4.760
82 HD12 LEU 9 2HD1 LEU 9 30.387 3.307 -5.764
83 HD13 LEU 9 3HD1 LEU 9 29.689 2.666 -4.276
84 HD21 LEU 9 1HD2 LEU 9 26.573 1.675 -5.442
85 HD22 LEU 9 2HD2 LEU 9 27.706 1.845 -4.101
86 HD23 LEU 9 3HD2 LEU 9 28.089 0.773 -5.449
87 HA PRO 10 HA PRO 10 25.495 8.172 -5.340
88 HB2 PRO 10 1HB PRO 10 23.547 8.653 -7.170
89 HB3 PRO 10 2HB PRO 10 25.249 8.459 -7.607
90 HG2 PRO 10 1HG PRO 10 23.019 6.468 -7.750
91 HG3 PRO 10 2HG PRO 10 24.300 6.800 -8.930
92 HD2 PRO 10 1HD PRO 10 24.400 4.700 -7.223
93 HD3 PRO 10 2HD PRO 10 25.857 5.548 -7.780
94 H LEU 11 H LEU 11 22.990 5.764 -5.202
95 HA LEU 11 HA LEU 11 21.135 7.581 -3.872
96 HB2 LEU 11 1HB LEU 11 20.774 4.649 -4.453
97 HB3 LEU 11 2HB LEU 11 19.527 5.816 -4.019
98 HG LEU 11 HG LEU 11 20.978 5.507 -6.631
99 HD11 LEU 11 1HD1 LEU 11 19.078 4.183 -6.646
100 HD12 LEU 11 2HD1 LEU 11 18.507 5.687 -7.369
101 HD13 LEU 11 3HD1 LEU 11 18.147 5.328 -5.680
102 HD21 LEU 11 1HD2 LEU 11 19.149 7.800 -5.977
103 HD22 LEU 11 2HD2 LEU 11 20.175 7.580 -7.394
104 HD23 LEU 11 3HD2 LEU 11 20.902 7.919 -5.823
105 H LEU 12 H LEU 12 23.538 5.284 -3.111
106 HA LEU 12 HA LEU 12 22.491 4.487 -0.562
107 HB2 LEU 12 1HB LEU 12 24.117 3.183 -1.998
108 HB3 LEU 12 2HB LEU 12 25.353 4.325 -1.476
109 HG LEU 12 HG LEU 12 25.461 3.453 0.639
110 HD11 LEU 12 1HD1 LEU 12 22.600 2.655 0.232
111 HD12 LEU 12 2HD1 LEU 12 23.289 3.737 1.442
112 HD13 LEU 12 3HD1 LEU 12 23.564 1.999 1.556
113 HD21 LEU 12 1HD2 LEU 12 25.200 0.938 0.466
114 HD22 LEU 12 2HD2 LEU 12 26.249 1.702 -0.729
115 HD23 LEU 12 3HD2 LEU 12 24.614 1.210 -1.175
116 H LYS 13 H LYS 13 24.854 6.851 -1.706
117 HA LYS 13 HA LYS 13 25.744 7.681 0.848
118 HB2 LYS 13 1HB LYS 13 26.422 9.792 -0.461
119 HB3 LYS 13 2HB LYS 13 27.161 8.264 -0.921
120 HG2 LYS 13 1HG LYS 13 26.403 8.460 -2.989
121 HG3 LYS 13 2HG LYS 13 24.747 8.664 -2.412
122 HD2 LYS 13 1HD LYS 13 24.824 10.918 -2.590
123 HD3 LYS 13 2HD LYS 13 26.517 11.003 -2.097
124 HE2 LYS 13 1HE LYS 13 25.469 10.197 -4.809
125 HE3 LYS 13 2HE LYS 13 26.277 11.711 -4.404
126 HZ1 LYS 13 1HZ LYS 13 28.073 10.604 -5.138
127 HZ2 LYS 13 2HZ LYS 13 27.402 9.076 -4.861
128 HZ3 LYS 13 3HZ LYS 13 28.087 9.944 -3.581
129 H ILE 14 H ILE 14 22.916 8.383 -0.998
130 HA ILE 14 HA ILE 14 22.224 10.881 0.095
131 HB ILE 14 HB ILE 14 20.304 8.738 -0.816
132 HG12 ILE 14 1HG1 ILE 14 22.156 9.310 -2.457
133 HG13 ILE 14 2HG1 ILE 14 20.514 9.559 -3.038
134 HG21 ILE 14 1HG2 ILE 14 18.993 10.837 -1.482
135 HG22 ILE 14 2HG2 ILE 14 19.059 10.415 0.229
136 HG23 ILE 14 3HG2 ILE 14 20.088 11.700 -0.402
137 HD11 ILE 14 1HD1 ILE 14 22.567 11.585 -2.263
138 HD12 ILE 14 2HD1 ILE 14 21.635 11.449 -3.755
139 HD13 ILE 14 3HD1 ILE 14 20.851 11.992 -2.272
140 H LEU 15 H LEU 15 21.029 7.633 0.967
141 HA LEU 15 HA LEU 15 19.699 8.562 3.310
142 HB2 LEU 15 1HB LEU 15 20.525 5.741 2.660
143 HB3 LEU 15 2HB LEU 15 19.263 6.249 3.779
144 HG LEU 15 HG LEU 15 17.883 5.765 2.081
145 HD11 LEU 15 1HD1 LEU 15 18.904 8.212 0.686
146 HD12 LEU 15 2HD1 LEU 15 18.049 8.322 2.224
147 HD13 LEU 15 3HD1 LEU 15 17.249 7.616 0.820
148 HD21 LEU 15 1HD2 LEU 15 18.803 4.707 0.362
149 HD22 LEU 15 2HD2 LEU 15 20.365 5.457 0.694
150 HD23 LEU 15 3HD2 LEU 15 19.202 6.268 -0.356
151 H HIS 16 H HIS 16 22.821 7.061 2.664
152 HA HIS 16 HA HIS 16 23.605 6.486 5.274
153 HB2 HIS 16 1HB HIS 16 25.122 7.161 2.772
154 HB3 HIS 16 2HB HIS 16 25.977 6.935 4.295
155 HD1 HIS 16 HD1 HIS 16 27.106 4.856 3.074
156 HD2 HIS 16 HD2 HIS 16 23.034 4.515 3.823
157 HE1 HIS 16 HE1 HIS 16 26.578 2.411 2.817
158 H ALA 17 H ALA 17 23.988 9.475 3.401
159 HA ALA 17 HA ALA 17 25.485 10.938 5.232
160 HB1 ALA 17 1HB ALA 17 23.388 11.943 3.312
161 HB2 ALA 17 2HB ALA 17 24.610 12.935 4.110
162 HB3 ALA 17 3HB ALA 17 25.097 11.694 2.955
163 H ALA 18 H ALA 18 22.013 10.373 5.073
164 HA ALA 18 HA ALA 18 21.382 12.220 7.175
165 HB1 ALA 18 1HB ALA 18 19.229 10.535 7.015
166 HB2 ALA 18 2HB ALA 18 19.457 12.000 6.059
167 HB3 ALA 18 3HB ALA 18 19.916 10.433 5.393
168 H GLY 19 H GLY 19 22.646 9.073 7.075
169 HA2 GLY 19 1HA GLY 19 23.472 8.426 9.380
170 HA3 GLY 19 2HA GLY 19 21.785 8.568 9.854
171 H ALA 20 H ALA 20 21.304 7.437 6.965
172 HA ALA 20 HA ALA 20 20.643 4.841 7.722
173 HB1 ALA 20 1HB ALA 20 21.308 5.532 4.884
174 HB2 ALA 20 2HB ALA 20 20.049 4.464 5.505
175 HB3 ALA 20 3HB ALA 20 19.887 6.212 5.677
176 H GLN 21 H GLN 21 21.537 2.908 6.279
177 HA GLN 21 HA GLN 21 24.207 2.757 5.543
178 HB2 GLN 21 1HB GLN 21 24.111 3.131 8.244
179 HB3 GLN 21 2HB GLN 21 24.134 1.376 8.142
180 HG2 GLN 21 1HG GLN 21 26.344 1.570 8.038
181 HG3 GLN 21 2HG GLN 21 26.097 2.100 6.375
182 HE21 GLN 21 2HE2 GLN 21 25.518 4.519 6.243
183 HE22 GLN 21 1HE2 GLN 21 26.522 5.571 7.175
184 H GLY 22 H GLY 22 24.181 1.071 4.220
185 HA2 GLY 22 1HA GLY 22 23.964 -1.527 4.609
186 HA3 GLY 22 2HA GLY 22 22.265 -1.087 4.698
187 H GLU 23 H GLU 23 21.776 -2.348 2.874
188 HA GLU 23 HA GLU 23 22.607 -1.111 0.336
189 HB2 GLU 23 1HB GLU 23 23.238 -3.713 1.183
190 HB3 GLU 23 2HB GLU 23 21.944 -3.903 0.008
191 HG2 GLU 23 1HG GLU 23 24.364 -2.227 -0.557
192 HG3 GLU 23 2HG GLU 23 24.337 -3.965 -0.849
193 H MET 24 H MET 24 20.162 -2.951 2.089
194 HA MET 24 HA MET 24 18.178 -2.156 0.065
195 HB2 MET 24 1HB MET 24 17.303 -4.132 2.031
196 HB3 MET 24 2HB MET 24 17.187 -4.163 0.276
197 HG2 MET 24 1HG MET 24 18.558 -5.946 0.640
198 HG3 MET 24 2HG MET 24 19.747 -4.664 0.416
199 HE1 MET 24 1HE MET 24 21.736 -6.529 2.880
200 HE2 MET 24 2HE MET 24 21.414 -6.044 1.216
201 HE3 MET 24 3HE MET 24 21.952 -4.847 2.395
202 H PHE 25 H PHE 25 16.135 -1.375 0.767
203 HA PHE 25 HA PHE 25 15.646 -0.802 3.532
204 HB2 PHE 25 1HB PHE 25 16.220 1.524 1.684
205 HB3 PHE 25 2HB PHE 25 15.673 1.638 3.354
206 HD1 PHE 25 HD1 PHE 25 17.178 1.153 5.194
207 HD2 PHE 25 HD2 PHE 25 18.498 0.965 1.152
208 HE1 PHE 25 HE1 PHE 25 19.516 1.161 5.961
209 HE2 PHE 25 HE2 PHE 25 20.838 0.971 1.912
210 HZ PHE 25 HZ PHE 25 21.350 1.069 4.319
211 H THR 26 H THR 26 13.558 0.135 3.897
212 HA THR 26 HA THR 26 11.714 -0.427 1.697
213 HB THR 26 HB THR 26 10.111 0.144 3.838
214 HG1 THR 26 1HG THR 26 12.305 -1.308 4.912
215 HG21 THR 26 1HG2 THR 26 9.957 -2.328 4.119
216 HG22 THR 26 2HG2 THR 26 11.353 -2.494 3.054
217 HG23 THR 26 3HG2 THR 26 9.853 -1.800 2.440
218 H VAL 27 H VAL 27 9.845 1.009 1.386
219 HA VAL 27 HA VAL 27 10.510 3.578 0.710
220 HB VAL 27 HB VAL 27 8.363 2.268 0.172
221 HG11 VAL 27 1HG1 VAL 27 6.465 2.581 1.539
222 HG12 VAL 27 2HG1 VAL 27 7.760 2.078 2.627
223 HG13 VAL 27 3HG1 VAL 27 7.289 3.775 2.541
224 HG21 VAL 27 1HG2 VAL 27 7.177 4.290 -0.386
225 HG22 VAL 27 2HG2 VAL 27 8.098 5.205 0.808
226 HG23 VAL 27 3HG2 VAL 27 8.905 4.556 -0.619
227 H LYS 28 H LYS 28 9.266 2.418 3.800
228 HA LYS 28 HA LYS 28 8.817 4.917 5.003
229 HB2 LYS 28 1HB LYS 28 8.725 2.182 5.775
230 HB3 LYS 28 2HB LYS 28 9.696 3.036 6.967
231 HG2 LYS 28 1HG LYS 28 7.944 4.338 7.667
232 HG3 LYS 28 2HG LYS 28 7.086 4.200 6.130
233 HD2 LYS 28 1HD LYS 28 6.157 2.934 8.173
234 HD3 LYS 28 2HD LYS 28 6.273 2.076 6.635
235 HE2 LYS 28 1HE LYS 28 8.328 1.017 7.339
236 HE3 LYS 28 2HE LYS 28 8.335 1.953 8.833
237 HZ1 LYS 28 1HZ LYS 28 5.894 0.707 8.788
238 HZ2 LYS 28 2HZ LYS 28 7.228 0.271 9.732
239 HZ3 LYS 28 3HZ LYS 28 6.972 -0.474 8.235
240 H GLU 29 H GLU 29 11.673 2.807 5.006
241 HA GLU 29 HA GLU 29 13.257 4.410 6.693
242 HB2 GLU 29 1HB GLU 29 13.718 2.159 4.830
243 HB3 GLU 29 2HB GLU 29 15.115 3.170 5.170
244 HG2 GLU 29 1HG GLU 29 14.820 1.147 6.636
245 HG3 GLU 29 2HG GLU 29 15.040 2.685 7.468
246 H VAL 30 H VAL 30 13.251 4.134 3.139
247 HA VAL 30 HA VAL 30 15.150 6.055 2.557
248 HB VAL 30 HB VAL 30 12.644 5.562 0.945
249 HG11 VAL 30 1HG1 VAL 30 13.509 6.998 -0.508
250 HG12 VAL 30 2HG1 VAL 30 14.886 7.272 0.561
251 HG13 VAL 30 3HG1 VAL 30 14.948 5.988 -0.646
252 HG21 VAL 30 1HG2 VAL 30 13.414 3.565 0.303
253 HG22 VAL 30 2HG2 VAL 30 15.064 4.162 0.123
254 HG23 VAL 30 3HG2 VAL 30 14.476 3.657 1.708
255 H MET 31 H MET 31 11.664 6.487 3.064
256 HA MET 31 HA MET 31 11.590 9.247 2.515
257 HB2 MET 31 1HB MET 31 9.411 8.822 2.712
258 HB3 MET 31 2HB MET 31 9.769 7.238 3.386
259 HG2 MET 31 1HG MET 31 8.360 8.373 4.918
260 HG3 MET 31 2HG MET 31 9.975 8.312 5.621
261 HE1 MET 31 1HE MET 31 8.481 10.589 2.812
262 HE2 MET 31 2HE MET 31 9.211 12.128 3.266
263 HE3 MET 31 3HE MET 31 10.236 10.761 2.825
264 H HIS 32 H HIS 32 12.133 7.440 5.501
265 HA HIS 32 HA HIS 32 12.139 9.687 7.228
266 HB2 HIS 32 1HB HIS 32 12.016 7.086 7.714
267 HB3 HIS 32 2HB HIS 32 13.762 7.262 7.867
268 HD1 HIS 32 HD1 HIS 32 10.984 7.124 9.947
269 HD2 HIS 32 HD2 HIS 32 14.190 9.755 9.696
270 HE1 HIS 32 HE1 HIS 32 11.111 8.246 12.195
271 H TYR 33 H TYR 33 14.542 8.234 5.176
272 HA TYR 33 HA TYR 33 16.796 9.501 6.401
273 HB2 TYR 33 1HB TYR 33 16.410 8.128 3.741
274 HB3 TYR 33 2HB TYR 33 17.949 8.818 4.244
275 HD1 TYR 33 HD1 TYR 33 18.047 8.082 7.088
276 HD2 TYR 33 HD2 TYR 33 16.748 5.825 3.723
277 HE1 TYR 33 HE1 TYR 33 18.593 6.002 8.280
278 HE2 TYR 33 HE2 TYR 33 17.290 3.738 4.907
279 HH TYR 33 HH TYR 33 17.706 3.487 8.094
280 H LEU 34 H LEU 34 14.769 10.176 3.579
281 HA LEU 34 HA LEU 34 16.135 12.271 2.438
282 HB2 LEU 34 1HB LEU 34 13.410 11.297 2.456
283 HB3 LEU 34 2HB LEU 34 13.470 13.052 2.310
284 HG LEU 34 HG LEU 34 13.348 12.078 0.118
285 HD11 LEU 34 1HD1 LEU 34 14.806 14.069 0.507
286 HD12 LEU 34 2HD1 LEU 34 15.233 13.110 -0.910
287 HD13 LEU 34 3HD1 LEU 34 16.187 12.973 0.567
288 HD21 LEU 34 1HD2 LEU 34 15.874 10.574 0.792
289 HD22 LEU 34 2HD2 LEU 34 14.987 10.526 -0.732
290 HD23 LEU 34 3HD2 LEU 34 14.261 9.862 0.733
291 H GLY 35 H GLY 35 13.592 12.557 4.930
292 HA2 GLY 35 1HA GLY 35 13.721 15.293 5.332
293 HA3 GLY 35 2HA GLY 35 13.270 14.131 6.571
294 H GLN 36 H GLN 36 15.603 12.773 6.993
295 HA GLN 36 HA GLN 36 16.992 14.456 8.733
296 HB2 GLN 36 1HB GLN 36 17.767 11.809 7.508
297 HB3 GLN 36 2HB GLN 36 18.718 12.610 8.751
298 HG2 GLN 36 1HG GLN 36 16.165 12.584 9.799
299 HG3 GLN 36 2HG GLN 36 16.305 11.026 8.985
300 HE21 GLN 36 2HE2 GLN 36 18.255 13.152 11.056
301 HE22 GLN 36 1HE2 GLN 36 18.861 11.891 12.070
302 H TYR 37 H TYR 37 17.842 13.344 5.473
303 HA TYR 37 HA TYR 37 20.369 14.511 5.301
304 HB2 TYR 37 1HB TYR 37 19.481 12.885 3.667
305 HB3 TYR 37 2HB TYR 37 18.365 14.108 3.069
306 HD1 TYR 37 HD2 TYR 37 22.023 13.588 3.619
307 HD2 TYR 37 HD1 TYR 37 18.984 15.365 1.230
308 HE1 TYR 37 HE2 TYR 37 23.734 14.365 2.031
309 HE2 TYR 37 HE1 TYR 37 20.686 16.146 -0.365
310 HH TYR 37 HH TYR 37 23.050 15.422 -1.034
311 H ILE 38 H ILE 38 17.192 15.832 4.430
312 HA ILE 38 HA ILE 38 18.063 18.282 3.404
313 HB ILE 38 HB ILE 38 15.482 17.558 4.786
314 HG12 ILE 38 1HG1 ILE 38 15.983 18.101 1.861
315 HG13 ILE 38 2HG1 ILE 38 16.137 16.493 2.560
316 HG21 ILE 38 1HG2 ILE 38 16.131 20.072 3.252
317 HG22 ILE 38 2HG2 ILE 38 14.555 19.630 3.907
318 HG23 ILE 38 3HG2 ILE 38 15.901 19.962 4.997
319 HD11 ILE 38 1HD1 ILE 38 13.645 17.513 3.384
320 HD12 ILE 38 2HD1 ILE 38 13.802 17.839 1.658
321 HD13 ILE 38 3HD1 ILE 38 13.972 16.191 2.263
322 H MET 39 H MET 39 16.983 17.472 6.701
323 HA MET 39 HA MET 39 17.465 20.033 7.785
324 HB2 MET 39 1HB MET 39 16.964 19.101 9.862
325 HB3 MET 39 2HB MET 39 16.079 18.072 8.744
326 HG2 MET 39 1HG MET 39 17.089 16.310 9.606
327 HG3 MET 39 2HG MET 39 18.632 16.935 9.029
328 HE1 MET 39 1HE MET 39 19.251 19.536 10.955
329 HE2 MET 39 2HE MET 39 20.278 18.550 11.995
330 HE3 MET 39 3HE MET 39 20.238 18.253 10.256
331 H VAL 40 H VAL 40 19.539 17.363 7.073
332 HA VAL 40 HA VAL 40 21.674 18.176 8.823
333 HB VAL 40 HB VAL 40 21.078 15.853 7.401
334 HG11 VAL 40 1HG1 VAL 40 23.055 15.419 6.052
335 HG12 VAL 40 2HG1 VAL 40 22.173 16.814 5.427
336 HG13 VAL 40 3HG1 VAL 40 23.647 17.049 6.367
337 HG21 VAL 40 1HG2 VAL 40 23.588 16.627 8.885
338 HG22 VAL 40 2HG2 VAL 40 22.119 15.956 9.593
339 HG23 VAL 40 3HG2 VAL 40 23.098 14.977 8.500
340 H LYS 41 H LYS 41 20.871 18.549 5.412
341 HA LYS 41 HA LYS 41 23.333 20.056 4.948
342 HB2 LYS 41 1HB LYS 41 21.290 18.759 3.205
343 HB3 LYS 41 2HB LYS 41 22.180 20.130 2.555
344 HG2 LYS 41 1HG LYS 41 23.310 17.529 3.556
345 HG3 LYS 41 2HG LYS 41 23.299 18.133 1.897
346 HD2 LYS 41 1HD LYS 41 25.398 18.789 2.412
347 HD3 LYS 41 2HD LYS 41 24.564 20.166 3.137
348 HE2 LYS 41 1HE LYS 41 25.780 19.590 4.949
349 HE3 LYS 41 2HE LYS 41 24.470 18.435 5.191
350 HZ1 LYS 41 1HZ LYS 41 27.211 17.975 4.282
351 HZ2 LYS 41 2HZ LYS 41 25.999 16.978 3.651
352 HZ3 LYS 41 3HZ LYS 41 26.249 17.050 5.322
353 H GLN 42 H GLN 42 20.333 20.692 6.099
354 HA GLN 42 HA GLN 42 19.141 22.600 6.434
355 HB2 GLN 42 1HB GLN 42 21.257 24.252 5.119
356 HB3 GLN 42 2HB GLN 42 20.277 24.615 6.533
357 HG2 GLN 42 1HG GLN 42 22.516 22.606 6.442
358 HG3 GLN 42 2HG GLN 42 22.635 24.243 7.085
359 HE21 GLN 42 2HE2 GLN 42 21.897 21.031 7.759
360 HE22 GLN 42 1HE2 GLN 42 21.245 21.249 9.344
361 H LEU 43 H LEU 43 18.803 21.103 4.013
362 HA LEU 43 HA LEU 43 18.387 23.061 1.910
363 HB2 LEU 43 1HB LEU 43 17.416 20.247 1.746
364 HB3 LEU 43 2HB LEU 43 18.046 21.291 0.474
365 HG LEU 43 HG LEU 43 19.757 20.089 2.645
366 HD11 LEU 43 1HD1 LEU 43 20.277 18.298 1.284
367 HD12 LEU 43 2HD1 LEU 43 19.688 19.097 -0.173
368 HD13 LEU 43 3HD1 LEU 43 18.543 18.476 1.016
369 HD21 LEU 43 1HD2 LEU 43 21.468 20.558 0.731
370 HD22 LEU 43 2HD2 LEU 43 20.959 21.863 1.802
371 HD23 LEU 43 3HD2 LEU 43 20.253 21.716 0.192
372 H TYR 44 H TYR 44 16.881 23.515 4.260
373 HA TYR 44 HA TYR 44 14.185 23.324 3.135
374 HB2 TYR 44 1HB TYR 44 13.224 22.658 5.268
375 HB3 TYR 44 2HB TYR 44 14.420 21.472 4.757
376 HD1 TYR 44 HD1 TYR 44 16.799 21.726 5.755
377 HD2 TYR 44 HD2 TYR 44 13.336 23.566 7.407
378 HE1 TYR 44 HE1 TYR 44 17.959 21.960 7.912
379 HE2 TYR 44 HE2 TYR 44 14.487 23.806 9.567
380 HH TYR 44 HH TYR 44 17.115 23.957 10.246
381 H ASP 45 H ASP 45 12.638 24.754 4.394
382 HA ASP 45 HA ASP 45 13.967 27.311 4.864
383 HB2 ASP 45 1HB ASP 45 11.523 26.530 3.645
384 HB3 ASP 45 2HB ASP 45 11.120 27.511 5.052
385 H GLN 46 H GLN 46 14.288 28.094 6.834
386 HA GLN 46 HA GLN 46 13.513 26.675 9.159
387 HB2 GLN 46 1HB GLN 46 14.533 29.513 8.957
388 HB3 GLN 46 2HB GLN 46 14.535 28.505 10.398
389 HG2 GLN 46 1HG GLN 46 16.711 28.337 9.677
390 HG3 GLN 46 2HG GLN 46 15.975 26.896 8.978
391 HE21 GLN 46 2HE2 GLN 46 15.634 26.794 6.763
392 HE22 GLN 46 1HE2 GLN 46 16.402 27.879 5.661
393 H GLN 47 H GLN 47 11.893 28.954 7.234
394 HA GLN 47 HA GLN 47 10.223 30.024 9.328
395 HB2 GLN 47 1HB GLN 47 10.078 30.235 6.318
396 HB3 GLN 47 2HB GLN 47 8.967 31.047 7.414
397 HG2 GLN 47 1HG GLN 47 11.016 32.318 6.456
398 HG3 GLN 47 2HG GLN 47 10.549 32.536 8.142
399 HE21 GLN 47 2HE2 GLN 47 12.608 30.470 6.124
400 HE22 GLN 47 1HE2 GLN 47 13.920 30.389 7.245
401 H GLU 48 H GLU 48 10.123 27.393 7.060
402 HA GLU 48 HA GLU 48 7.706 26.398 8.329
403 HB2 GLU 48 1HB GLU 48 7.890 27.016 5.383
404 HB3 GLU 48 2HB GLU 48 6.713 25.890 6.045
405 HG2 GLU 48 1HG GLU 48 5.419 27.726 6.088
406 HG3 GLU 48 2HG GLU 48 6.235 27.989 7.628
407 H GLN 49 H GLN 49 8.795 24.646 9.117
408 HA GLN 49 HA GLN 49 10.738 23.129 7.880
409 HB2 GLN 49 1HB GLN 49 8.618 22.334 9.872
410 HB3 GLN 49 2HB GLN 49 9.903 21.246 9.365
411 HG2 GLN 49 1HG GLN 49 10.955 22.079 11.158
412 HG3 GLN 49 2HG GLN 49 11.360 23.394 10.057
413 HE21 GLN 49 2HE2 GLN 49 11.059 25.319 10.888
414 HE22 GLN 49 1HE2 GLN 49 9.856 25.760 12.047
415 H HIS 50 H HIS 50 7.389 23.306 7.167
416 HA HIS 50 HA HIS 50 7.336 20.766 5.753
417 HB2 HIS 50 1HB HIS 50 4.992 21.300 5.293
418 HB3 HIS 50 2HB HIS 50 5.347 21.488 7.008
419 HD1 HIS 50 HD1 HIS 50 5.064 23.801 8.019
420 HD2 HIS 50 HD2 HIS 50 4.544 23.739 3.898
421 HE1 HIS 50 HE1 HIS 50 4.122 26.056 7.427
422 H MET 51 H MET 51 9.071 23.086 4.943
423 HA MET 51 HA MET 51 8.296 23.071 2.121
424 HB2 MET 51 1HB MET 51 8.903 25.528 3.761
425 HB3 MET 51 2HB MET 51 9.013 25.512 2.006
426 HG2 MET 51 1HG MET 51 6.540 24.904 3.608
427 HG3 MET 51 2HG MET 51 6.890 26.426 2.792
428 HE1 MET 51 1HE MET 51 8.419 24.054 0.384
429 HE2 MET 51 2HE MET 51 7.352 24.653 -0.885
430 HE3 MET 51 3HE MET 51 8.149 25.788 0.205
431 H VAL 52 H VAL 52 9.959 21.749 1.524
432 HA VAL 52 HA VAL 52 12.660 22.229 2.426
433 HB VAL 52 HB VAL 52 11.594 20.300 0.359
434 HG11 VAL 52 1HG1 VAL 52 14.299 20.222 1.668
435 HG12 VAL 52 2HG1 VAL 52 13.722 19.287 0.287
436 HG13 VAL 52 3HG1 VAL 52 14.017 21.018 0.121
437 HG21 VAL 52 1HG2 VAL 52 12.693 19.162 2.779
438 HG22 VAL 52 2HG2 VAL 52 11.355 20.256 3.129
439 HG23 VAL 52 3HG2 VAL 52 11.120 18.900 2.026
440 H TYR 53 H TYR 53 14.358 23.025 1.237
441 HA TYR 53 HA TYR 53 13.615 24.452 -1.225
442 HB2 TYR 53 1HB TYR 53 15.559 25.020 0.972
443 HB3 TYR 53 2HB TYR 53 15.905 25.635 -0.640
444 HD1 TYR 53 HD2 TYR 53 12.542 25.287 0.873
445 HD2 TYR 53 HD1 TYR 53 15.661 27.955 -0.248
446 HE1 TYR 53 HE2 TYR 53 11.049 27.197 1.287
447 HE2 TYR 53 HE1 TYR 53 14.177 29.872 0.164
448 HH TYR 53 HH TYR 53 12.128 30.531 0.710
449 H CYS 54 H CYS 54 14.043 21.834 -1.650
450 HA CYS 54 HA CYS 54 16.437 20.691 -2.014
451 HB2 CYS 54 1HB CYS 54 15.553 19.454 -3.828
452 HB3 CYS 54 2HB CYS 54 14.168 19.862 -2.822
453 HG CYS 54 HG CYS 54 12.810 20.752 -4.800
454 H GLY 55 H GLY 55 15.097 23.196 -4.145
455 HA2 GLY 55 1HA GLY 55 17.021 23.293 -6.106
456 HA3 GLY 55 2HA GLY 55 16.159 24.706 -5.517
457 H GLY 56 H GLY 56 19.118 22.907 -5.436
458 HA2 GLY 56 1HA GLY 56 20.948 24.767 -5.109
459 HA3 GLY 56 2HA GLY 56 20.296 24.737 -3.478
460 H ASP 57 H ASP 57 19.833 21.709 -4.151
461 HA ASP 57 HA ASP 57 22.606 20.847 -3.670
462 HB2 ASP 57 1HB ASP 57 20.540 20.799 -1.779
463 HB3 ASP 57 2HB ASP 57 20.687 19.136 -2.340
464 H LEU 58 H LEU 58 22.746 18.361 -3.878
465 HA LEU 58 HA LEU 58 22.328 17.597 -6.466
466 HB2 LEU 58 1HB LEU 58 22.463 15.925 -3.970
467 HB3 LEU 58 2HB LEU 58 22.424 15.223 -5.586
468 HG LEU 58 HG LEU 58 24.670 15.211 -5.215
469 HD11 LEU 58 1HD1 LEU 58 24.028 16.782 -7.136
470 HD12 LEU 58 2HD1 LEU 58 25.685 16.840 -6.537
471 HD13 LEU 58 3HD1 LEU 58 24.531 18.085 -6.058
472 HD21 LEU 58 1HD2 LEU 58 25.497 16.094 -3.358
473 HD22 LEU 58 2HD2 LEU 58 24.001 16.997 -3.121
474 HD23 LEU 58 3HD2 LEU 58 25.328 17.714 -4.036
475 H LEU 59 H LEU 59 20.220 16.808 -3.705
476 HA LEU 59 HA LEU 59 18.276 15.386 -5.095
477 HB2 LEU 59 1HB LEU 59 17.193 15.336 -3.138
478 HB3 LEU 59 2HB LEU 59 18.656 16.093 -2.511
479 HG LEU 59 HG LEU 59 16.223 17.635 -3.402
480 HD11 LEU 59 1HD1 LEU 59 15.578 16.244 -1.546
481 HD12 LEU 59 2HD1 LEU 59 15.767 17.906 -0.988
482 HD13 LEU 59 3HD1 LEU 59 17.020 16.714 -0.645
483 HD21 LEU 59 1HD2 LEU 59 17.818 18.950 -1.458
484 HD22 LEU 59 2HD2 LEU 59 17.507 19.421 -3.129
485 HD23 LEU 59 3HD2 LEU 59 18.882 18.383 -2.746
486 H GLY 60 H GLY 60 18.687 18.857 -4.672
487 HA2 GLY 60 1HA GLY 60 16.172 19.642 -5.705
488 HA3 GLY 60 2HA GLY 60 17.608 20.652 -5.616
489 H GLU 61 H GLU 61 19.357 19.350 -7.263
490 HA GLU 61 HA GLU 61 18.554 20.221 -9.805
491 HB2 GLU 61 1HB GLU 61 20.675 19.742 -10.451
492 HB3 GLU 61 2HB GLU 61 20.932 19.605 -8.718
493 HG2 GLU 61 1HG GLU 61 20.686 17.205 -8.833
494 HG3 GLU 61 2HG GLU 61 20.314 17.302 -10.554
495 H LEU 62 H LEU 62 18.729 16.961 -8.418
496 HA LEU 62 HA LEU 62 17.946 15.573 -10.739
497 HB2 LEU 62 1HB LEU 62 18.787 14.874 -8.241
498 HB3 LEU 62 2HB LEU 62 17.088 14.409 -8.189
499 HG LEU 62 HG LEU 62 18.778 12.622 -8.853
500 HD11 LEU 62 1HD1 LEU 62 16.886 11.652 -9.478
501 HD12 LEU 62 2HD1 LEU 62 17.071 12.382 -11.072
502 HD13 LEU 62 3HD1 LEU 62 16.152 13.219 -9.821
503 HD21 LEU 62 1HD2 LEU 62 19.961 12.763 -10.753
504 HD22 LEU 62 2HD2 LEU 62 19.679 14.498 -10.602
505 HD23 LEU 62 3HD2 LEU 62 18.639 13.521 -11.641
506 H LEU 63 H LEU 63 16.091 16.928 -8.052
507 HA LEU 63 HA LEU 63 13.580 15.896 -8.828
508 HB2 LEU 63 1HB LEU 63 14.622 17.621 -6.807
509 HB3 LEU 63 2HB LEU 63 13.205 18.380 -7.531
510 HG LEU 63 HG LEU 63 13.099 15.547 -6.555
511 HD11 LEU 63 1HD1 LEU 63 12.359 16.315 -4.395
512 HD12 LEU 63 2HD1 LEU 63 12.564 17.997 -4.883
513 HD13 LEU 63 3HD1 LEU 63 13.973 16.948 -4.719
514 HD21 LEU 63 1HD2 LEU 63 10.886 15.721 -6.885
515 HD22 LEU 63 2HD2 LEU 63 11.323 17.065 -7.941
516 HD23 LEU 63 3HD2 LEU 63 10.822 17.376 -6.278
517 H GLY 64 H GLY 64 15.314 18.853 -9.649
518 HA2 GLY 64 1HA GLY 64 15.058 20.054 -11.648
519 HA3 GLY 64 2HA GLY 64 13.543 19.212 -11.935
520 H ARG 65 H ARG 65 13.339 20.139 -8.827
521 HA ARG 65 HA ARG 65 11.973 22.645 -9.549
522 HB2 ARG 65 1HB ARG 65 11.468 21.084 -7.029
523 HB3 ARG 65 2HB ARG 65 10.427 22.262 -7.818
524 HG2 ARG 65 1HG ARG 65 11.002 19.438 -8.660
525 HG3 ARG 65 2HG ARG 65 9.455 20.151 -8.198
526 HD2 ARG 65 1HD ARG 65 9.282 21.354 -10.197
527 HD3 ARG 65 2HD ARG 65 10.997 21.166 -10.562
528 HE ARG 65 HE ARG 65 10.113 18.626 -10.604
529 HH11 ARG 65 1HH1 ARG 65 8.954 21.543 -12.110
530 HH12 ARG 65 2HH1 ARG 65 8.294 20.725 -13.488
531 HH21 ARG 65 1HH2 ARG 65 9.249 17.537 -12.413
532 HH22 ARG 65 2HH2 ARG 65 8.462 18.446 -13.658
533 H GLN 66 H GLN 66 11.999 24.375 -7.950
534 HA GLN 66 HA GLN 66 14.650 24.715 -6.851
535 HB2 GLN 66 1HB GLN 66 13.695 26.997 -6.203
536 HB3 GLN 66 2HB GLN 66 13.830 26.641 -7.920
537 HG2 GLN 66 1HG GLN 66 11.546 26.408 -8.187
538 HG3 GLN 66 2HG GLN 66 11.275 26.106 -6.472
539 HE21 GLN 66 2HE2 GLN 66 9.731 27.684 -6.243
540 HE22 GLN 66 1HE2 GLN 66 10.092 29.372 -6.316
541 H SER 67 H SER 67 11.366 24.299 -5.664
542 HA SER 67 HA SER 67 12.361 23.470 -3.091
543 HB2 SER 67 1HB SER 67 11.494 25.160 -1.742
544 HB3 SER 67 2HB SER 67 12.119 26.074 -3.115
545 HG SER 67 HG SER 67 9.878 25.816 -3.965
546 H PHE 68 H PHE 68 10.918 22.192 -1.985
547 HA PHE 68 HA PHE 68 8.226 21.901 -3.124
548 HB2 PHE 68 1HB PHE 68 8.383 19.503 -3.116
549 HB3 PHE 68 2HB PHE 68 9.766 20.129 -4.007
550 HD1 PHE 68 HD1 PHE 68 8.740 18.875 -0.667
551 HD2 PHE 68 HD2 PHE 68 11.926 19.507 -3.418
552 HE1 PHE 68 HE1 PHE 68 10.252 17.599 0.796
553 HE2 PHE 68 HE2 PHE 68 13.443 18.231 -1.960
554 HZ PHE 68 HZ PHE 68 12.606 17.274 0.149
555 H SER 69 H SER 69 6.658 20.985 -1.688
556 HA SER 69 HA SER 69 7.197 21.677 1.087
557 HB2 SER 69 1HB SER 69 4.525 20.661 0.556
558 HB3 SER 69 2HB SER 69 5.023 22.236 1.176
559 HG SER 69 HG SER 69 4.267 22.836 -0.716
560 H VAL 70 H VAL 70 7.287 20.268 2.752
561 HA VAL 70 HA VAL 70 7.669 17.489 2.158
562 HB VAL 70 HB VAL 70 8.585 17.290 4.225
563 HG11 VAL 70 1HG1 VAL 70 9.810 19.211 4.803
564 HG12 VAL 70 2HG1 VAL 70 9.489 19.375 3.076
565 HG13 VAL 70 3HG1 VAL 70 8.537 20.294 4.242
566 HG21 VAL 70 1HG2 VAL 70 6.396 19.115 5.173
567 HG22 VAL 70 2HG2 VAL 70 6.667 17.419 5.574
568 HG23 VAL 70 3HG2 VAL 70 7.747 18.658 6.210
569 H LYS 71 H LYS 71 5.142 19.432 3.633
570 HA LYS 71 HA LYS 71 3.610 17.221 4.590
571 HB2 LYS 71 1HB LYS 71 3.556 19.971 4.943
572 HB3 LYS 71 2HB LYS 71 2.085 19.645 4.037
573 HG2 LYS 71 1HG LYS 71 1.453 17.965 5.730
574 HG3 LYS 71 2HG LYS 71 2.892 18.399 6.657
575 HD2 LYS 71 1HD LYS 71 0.671 20.301 5.907
576 HD3 LYS 71 2HD LYS 71 0.846 19.517 7.479
577 HE2 LYS 71 1HE LYS 71 2.264 21.091 8.144
578 HE3 LYS 71 2HE LYS 71 3.317 20.765 6.768
579 HZ1 LYS 71 1HZ LYS 71 0.997 22.260 6.027
580 HZ2 LYS 71 2HZ LYS 71 2.630 22.601 5.749
581 HZ3 LYS 71 3HZ LYS 71 1.908 23.059 7.208
582 H ASP 72 H ASP 72 4.258 18.257 1.519
583 HA ASP 72 HA ASP 72 1.806 16.993 0.495
584 HB2 ASP 72 1HB ASP 72 3.187 19.406 -0.700
585 HB3 ASP 72 2HB ASP 72 1.796 18.573 -1.389
586 HA PRO 73 HA PRO 73 5.382 14.664 -1.149
587 HB2 PRO 73 1HB PRO 73 4.041 12.308 -1.289
588 HB3 PRO 73 2HB PRO 73 4.802 12.893 0.195
589 HG2 PRO 73 1HG PRO 73 1.931 13.028 -0.642
590 HG3 PRO 73 2HG PRO 73 2.617 12.618 0.941
591 HD2 PRO 73 1HD PRO 73 1.602 15.065 0.383
592 HD3 PRO 73 2HD PRO 73 2.955 14.826 1.507
593 H SER 74 H SER 74 4.431 16.309 -2.927
594 HA SER 74 HA SER 74 3.017 14.815 -5.008
595 HB2 SER 74 1HB SER 74 3.334 17.661 -4.324
596 HB3 SER 74 2HB SER 74 3.413 17.314 -6.051
597 HG SER 74 HG SER 74 1.390 16.433 -5.965
598 HA PRO 75 HA PRO 75 6.881 16.198 -7.492
599 HB2 PRO 75 1HB PRO 75 8.724 17.762 -6.257
600 HB3 PRO 75 2HB PRO 75 7.320 18.419 -7.106
601 HG2 PRO 75 1HG PRO 75 7.720 17.966 -4.174
602 HG3 PRO 75 2HG PRO 75 6.999 19.358 -5.003
603 HD2 PRO 75 1HD PRO 75 5.506 17.426 -3.831
604 HD3 PRO 75 2HD PRO 75 4.969 18.301 -5.280
605 H LEU 76 H LEU 76 7.347 15.532 -4.078
606 HA LEU 76 HA LEU 76 9.920 14.470 -4.124
607 HB2 LEU 76 1HB LEU 76 8.661 14.948 -2.077
608 HB3 LEU 76 2HB LEU 76 7.577 13.605 -2.434
609 HG LEU 76 HG LEU 76 9.894 12.272 -2.392
610 HD11 LEU 76 1HD1 LEU 76 10.417 14.838 -1.059
611 HD12 LEU 76 2HD1 LEU 76 11.535 13.674 -1.768
612 HD13 LEU 76 3HD1 LEU 76 10.891 13.403 -0.149
613 HD21 LEU 76 1HD2 LEU 76 9.095 11.326 -0.493
614 HD22 LEU 76 2HD2 LEU 76 7.666 12.269 -0.919
615 HD23 LEU 76 3HD2 LEU 76 8.798 12.879 0.290
616 H TYR 77 H TYR 77 6.856 12.640 -4.236
617 HA TYR 77 HA TYR 77 7.948 10.145 -4.764
618 HB2 TYR 77 1HB TYR 77 5.283 11.398 -5.251
619 HB3 TYR 77 2HB TYR 77 5.623 9.841 -5.998
620 HD1 TYR 77 HD2 TYR 77 6.385 7.936 -4.459
621 HD2 TYR 77 HD1 TYR 77 4.594 11.516 -3.020
622 HE1 TYR 77 HE2 TYR 77 5.814 6.797 -2.355
623 HE2 TYR 77 HE1 TYR 77 4.019 10.388 -0.911
624 HH TYR 77 HH TYR 77 3.624 7.687 -0.317
625 H ASP 78 H ASP 78 7.251 12.804 -6.934
626 HA ASP 78 HA ASP 78 7.436 11.444 -9.379
627 HB2 ASP 78 1HB ASP 78 6.821 13.964 -8.729
628 HB3 ASP 78 2HB ASP 78 8.496 14.218 -9.211
629 H MET 79 H MET 79 9.893 12.696 -7.218
630 HA MET 79 HA MET 79 12.044 12.306 -9.092
631 HB2 MET 79 1HB MET 79 12.596 13.989 -7.625
632 HB3 MET 79 2HB MET 79 11.804 13.208 -6.262
633 HG2 MET 79 1HG MET 79 13.635 11.572 -6.162
634 HG3 MET 79 2HG MET 79 14.435 12.415 -7.487
635 HE1 MET 79 1HE MET 79 13.689 14.231 -3.319
636 HE2 MET 79 2HE MET 79 12.451 13.537 -4.364
637 HE3 MET 79 3HE MET 79 13.639 12.489 -3.590
638 H LEU 80 H LEU 80 11.033 10.732 -6.059
639 HA LEU 80 HA LEU 80 12.943 8.715 -6.010
640 HB2 LEU 80 1HB LEU 80 10.125 8.851 -4.987
641 HB3 LEU 80 2HB LEU 80 11.126 7.419 -4.752
642 HG LEU 80 HG LEU 80 12.679 8.650 -3.402
643 HD11 LEU 80 1HD1 LEU 80 12.571 10.760 -4.682
644 HD12 LEU 80 2HD1 LEU 80 12.461 11.004 -2.940
645 HD13 LEU 80 3HD1 LEU 80 11.010 11.102 -3.936
646 HD21 LEU 80 1HD2 LEU 80 11.329 9.108 -1.511
647 HD22 LEU 80 2HD2 LEU 80 10.514 7.825 -2.407
648 HD23 LEU 80 3HD2 LEU 80 9.928 9.486 -2.514
649 H ARG 81 H ARG 81 9.993 8.984 -7.864
650 HA ARG 81 HA ARG 81 9.363 6.480 -8.631
651 HB2 ARG 81 1HB ARG 81 8.141 7.546 -10.168
652 HB3 ARG 81 2HB ARG 81 8.933 9.035 -9.669
653 HG2 ARG 81 1HG ARG 81 10.611 8.770 -11.376
654 HG3 ARG 81 2HG ARG 81 9.951 7.196 -11.824
655 HD2 ARG 81 1HD ARG 81 7.796 8.974 -11.938
656 HD3 ARG 81 2HD ARG 81 9.151 9.831 -12.672
657 HE ARG 81 HE ARG 81 9.077 8.373 -14.439
658 HH11 ARG 81 1HH1 ARG 81 7.182 7.098 -11.812
659 HH12 ARG 81 2HH1 ARG 81 6.507 5.808 -12.752
660 HH21 ARG 81 1HH2 ARG 81 8.196 6.678 -15.687
661 HH22 ARG 81 2HH2 ARG 81 7.086 5.570 -14.956
662 H LYS 82 H LYS 82 11.995 8.390 -10.081
663 HA LYS 82 HA LYS 82 13.039 5.926 -11.294
664 HB2 LYS 82 1HB LYS 82 13.754 7.157 -13.042
665 HB3 LYS 82 2HB LYS 82 12.614 8.356 -12.446
666 HG2 LYS 82 1HG LYS 82 15.535 8.256 -11.723
667 HG3 LYS 82 2HG LYS 82 14.832 9.293 -12.966
668 HD2 LYS 82 1HD LYS 82 14.200 9.339 -10.016
669 HD3 LYS 82 2HD LYS 82 15.126 10.545 -10.912
670 HE2 LYS 82 1HE LYS 82 12.750 10.346 -12.318
671 HE3 LYS 82 2HE LYS 82 12.252 10.232 -10.631
672 HZ1 LYS 82 1HZ LYS 82 13.693 12.266 -10.277
673 HZ2 LYS 82 2HZ LYS 82 12.248 12.501 -11.124
674 HZ3 LYS 82 3HZ LYS 82 13.717 12.430 -11.960
675 H ASN 83 H ASN 83 13.429 7.736 -8.579
676 HA ASN 83 HA ASN 83 16.335 7.444 -8.445
677 HB2 ASN 83 1HB ASN 83 14.699 9.444 -7.561
678 HB3 ASN 83 2HB ASN 83 14.918 8.502 -6.089
679 HD21 ASN 83 2HD2 ASN 83 16.031 10.342 -5.254
680 HD22 ASN 83 1HD2 ASN 83 17.686 10.618 -5.665
681 H LEU 84 H LEU 84 13.552 6.722 -6.328
682 HA LEU 84 HA LEU 84 15.102 4.693 -4.948
683 HB2 LEU 84 1HB LEU 84 12.708 6.250 -4.428
684 HB3 LEU 84 2HB LEU 84 12.494 4.547 -4.024
685 HG LEU 84 HG LEU 84 13.173 5.796 -2.067
686 HD11 LEU 84 1HD1 LEU 84 14.849 3.692 -3.239
687 HD12 LEU 84 2HD1 LEU 84 14.061 3.776 -1.664
688 HD13 LEU 84 3HD1 LEU 84 15.599 4.597 -1.925
689 HD21 LEU 84 1HD2 LEU 84 14.406 7.623 -2.472
690 HD22 LEU 84 2HD2 LEU 84 15.097 6.952 -3.949
691 HD23 LEU 84 3HD2 LEU 84 15.782 6.523 -2.381
692 H VAL 85 H VAL 85 15.220 2.694 -5.704
693 HA VAL 85 HA VAL 85 13.540 1.691 -7.756
694 HB VAL 85 HB VAL 85 15.862 0.750 -6.270
695 HG11 VAL 85 1HG1 VAL 85 15.438 -1.653 -6.644
696 HG12 VAL 85 2HG1 VAL 85 14.348 -0.949 -5.448
697 HG13 VAL 85 3HG1 VAL 85 13.775 -1.269 -7.086
698 HG21 VAL 85 1HG2 VAL 85 16.433 1.076 -8.425
699 HG22 VAL 85 2HG2 VAL 85 15.855 -0.578 -8.626
700 HG23 VAL 85 3HG2 VAL 85 14.797 0.779 -9.013
701 H THR 86 H THR 86 12.052 -0.045 -7.678
702 HA THR 86 HA THR 86 11.032 -0.822 -5.052
703 HB THR 86 HB THR 86 8.655 -0.465 -6.035
704 HG1 THR 86 1HG THR 86 8.808 0.344 -8.000
705 HG21 THR 86 1HG2 THR 86 10.459 1.695 -4.979
706 HG22 THR 86 2HG2 THR 86 9.233 0.762 -4.120
707 HG23 THR 86 3HG2 THR 86 8.749 1.989 -5.290
708 H LEU 87 H LEU 87 10.961 -2.964 -5.059
709 HA LEU 87 HA LEU 87 10.413 -4.358 -7.589
710 HB2 LEU 87 1HB LEU 87 11.299 -6.345 -6.117
711 HB3 LEU 87 2HB LEU 87 12.405 -5.231 -6.918
712 HG LEU 87 HG LEU 87 11.619 -4.556 -4.145
713 HD11 LEU 87 1HD1 LEU 87 13.701 -6.665 -4.598
714 HD12 LEU 87 2HD1 LEU 87 12.021 -7.081 -4.261
715 HD13 LEU 87 3HD1 LEU 87 12.951 -6.152 -3.086
716 HD21 LEU 87 1HD2 LEU 87 14.298 -4.356 -4.303
717 HD22 LEU 87 2HD2 LEU 87 13.191 -3.076 -4.799
718 HD23 LEU 87 3HD2 LEU 87 13.873 -4.168 -6.005
719 H ALA 88 H ALA 88 8.828 -5.913 -7.726
720 HA ALA 88 HA ALA 88 7.055 -7.236 -7.085
721 HB1 ALA 88 1HB ALA 88 8.360 -7.168 -4.779
722 HB2 ALA 88 2HB ALA 88 6.973 -6.183 -4.312
723 HB3 ALA 88 3HB ALA 88 6.728 -7.823 -4.911
724 H THR 89 H THR 89 4.859 -6.888 -7.163
725 HA THR 89 HA THR 89 3.460 -4.708 -6.148
726 HB THR 89 HB THR 89 3.247 -3.932 -8.852
727 HG1 THR 89 1HG THR 89 5.333 -3.507 -9.449
728 HG21 THR 89 1HG2 THR 89 2.976 -2.584 -6.735
729 HG22 THR 89 2HG2 THR 89 3.861 -1.782 -8.033
730 HG23 THR 89 3HG2 THR 89 4.735 -2.480 -6.670
731 H1 SER 115 H SER 115 4.557 14.027 20.778
732 HA SER 115 HA SER 115 6.382 12.446 21.379
733 HB2 SER 115 1HB SER 115 6.604 10.452 19.910
734 HB3 SER 115 2HB SER 115 5.129 10.423 20.876
735 HG SER 115 HG SER 115 5.433 10.487 18.170
736 H GLN 116 H GLN 116 8.378 12.624 20.351
737 HA GLN 116 HA GLN 116 9.914 13.693 19.050
738 HB2 GLN 116 1HB GLN 116 8.249 12.086 17.364
739 HB3 GLN 116 2HB GLN 116 8.721 13.534 16.484
740 HG2 GLN 116 1HG GLN 116 10.667 12.589 16.045
741 HG3 GLN 116 2HG GLN 116 11.037 12.607 17.768
742 HE21 GLN 116 2HE2 GLN 116 9.684 10.764 18.930
743 HE22 GLN 116 1HE2 GLN 116 9.894 9.203 18.220
744 H GLU 117 H GLU 117 9.762 15.199 16.751
745 HA GLU 117 HA GLU 117 7.731 17.144 16.722
746 HB2 GLU 117 1HB GLU 117 8.715 18.999 17.823
747 HB3 GLU 117 2HB GLU 117 8.824 17.651 18.947
748 HG2 GLU 117 1HG GLU 117 11.026 17.826 19.055
749 HG3 GLU 117 2HG GLU 117 11.174 17.777 17.299
750 H THR 118 H THR 118 9.293 19.400 16.012
751 HA THR 118 HA THR 118 10.051 20.292 14.040
752 HB THR 118 HB THR 118 12.197 18.264 13.831
753 HG1 THR 118 1HG THR 118 12.885 18.458 15.831
754 HG21 THR 118 1HG2 THR 118 13.532 20.089 13.345
755 HG22 THR 118 2HG2 THR 118 12.556 21.193 14.315
756 HG23 THR 118 3HG2 THR 118 11.964 20.634 12.751
757 H PHE 119 H PHE 119 11.648 18.846 12.049
758 HA PHE 119 HA PHE 119 9.901 18.333 10.080
759 HB2 PHE 119 1HB PHE 119 12.580 17.978 10.341
760 HB3 PHE 119 2HB PHE 119 12.047 16.306 10.195
761 HD1 PHE 119 HD2 PHE 119 9.576 17.389 8.434
762 HD2 PHE 119 HD1 PHE 119 13.820 17.632 8.221
763 HE1 PHE 119 HE2 PHE 119 9.434 17.648 5.992
764 HE2 PHE 119 HE1 PHE 119 13.685 17.893 5.778
765 HZ PHE 119 HZ PHE 119 11.491 17.901 4.660
766 H SER 120 H SER 120 10.845 16.011 12.576
767 HA SER 120 HA SER 120 9.630 13.722 11.664
768 HB2 SER 120 1HB SER 120 10.925 14.344 13.932
769 HB3 SER 120 2HB SER 120 9.275 14.320 14.555
770 HG SER 120 HG SER 120 10.161 12.208 12.937
771 H ASP 121 H ASP 121 8.146 16.405 13.436
772 HA ASP 121 HA ASP 121 5.633 15.398 13.907
773 HB2 ASP 121 1HB ASP 121 6.441 17.627 14.650
774 HB3 ASP 121 2HB ASP 121 6.256 18.217 13.001
775 H LEU 122 H LEU 122 6.428 17.435 11.085
776 HA LEU 122 HA LEU 122 4.063 16.580 9.696
777 HB2 LEU 122 1HB LEU 122 6.328 18.013 8.378
778 HB3 LEU 122 2HB LEU 122 4.596 18.152 8.081
779 HG LEU 122 HG LEU 122 5.290 19.030 10.752
780 HD11 LEU 122 1HD1 LEU 122 6.352 21.183 9.794
781 HD12 LEU 122 2HD1 LEU 122 6.805 20.158 8.433
782 HD13 LEU 122 3HD1 LEU 122 7.372 19.767 10.056
783 HD21 LEU 122 1HD2 LEU 122 3.601 20.434 10.349
784 HD22 LEU 122 2HD2 LEU 122 3.350 19.503 8.872
785 HD23 LEU 122 3HD2 LEU 122 4.303 20.987 8.829
786 H TRP 123 H TRP 123 7.549 16.287 8.994
787 HA TRP 123 HA TRP 123 7.643 14.799 6.784
788 HB2 TRP 123 1HB TRP 123 9.559 15.400 8.375
789 HB3 TRP 123 2HB TRP 123 9.196 13.887 9.201
790 HD1 TRP 123 HD1 TRP 123 10.711 11.987 8.435
791 HE1 TRP 123 HE1 TRP 123 11.924 11.343 6.258
792 HE3 TRP 123 HE3 TRP 123 9.169 15.857 5.471
793 HZ2 TRP 123 HZ2 TRP 123 12.192 12.343 3.632
794 HZ3 TRP 123 HZ3 TRP 123 9.949 15.940 3.139
795 HH2 TRP 123 HH2 TRP 123 11.430 14.218 2.241
796 H LYS 124 H LYS 124 7.177 13.317 9.996
797 HA LYS 124 HA LYS 124 6.832 10.699 9.261
798 HB2 LYS 124 1HB LYS 124 5.567 12.331 11.447
799 HB3 LYS 124 2HB LYS 124 5.186 10.624 11.255
800 HG2 LYS 124 1HG LYS 124 7.462 10.004 11.630
801 HG3 LYS 124 2HG LYS 124 7.979 11.691 11.598
802 HD2 LYS 124 1HD LYS 124 7.115 12.134 13.685
803 HD3 LYS 124 2HD LYS 124 5.913 10.847 13.577
804 HE2 LYS 124 1HE LYS 124 8.771 10.055 13.578
805 HE3 LYS 124 2HE LYS 124 8.095 10.652 15.093
806 HZ1 LYS 124 1HZ LYS 124 7.514 8.506 15.327
807 HZ2 LYS 124 2HZ LYS 124 7.551 8.183 13.667
808 HZ3 LYS 124 3HZ LYS 124 6.202 8.941 14.351
809 H LEU 125 H LEU 125 4.372 13.254 9.296
810 HA LEU 125 HA LEU 125 2.094 11.875 8.733
811 HB2 LEU 125 1HB LEU 125 2.626 14.446 8.878
812 HB3 LEU 125 2HB LEU 125 2.658 14.317 7.120
813 HG LEU 125 HG LEU 125 0.282 13.153 8.399
814 HD11 LEU 125 1HD1 LEU 125 -0.596 15.658 8.425
815 HD12 LEU 125 2HD1 LEU 125 1.084 15.968 8.860
816 HD13 LEU 125 3HD1 LEU 125 0.102 14.889 9.851
817 HD21 LEU 125 1HD2 LEU 125 0.778 13.514 5.919
818 HD22 LEU 125 2HD2 LEU 125 0.449 15.219 6.227
819 HD23 LEU 125 3HD2 LEU 125 -0.807 14.013 6.512
820 H LEU 126 H LEU 126 4.838 12.305 6.668
821 HA LEU 126 HA LEU 126 3.961 12.016 4.132
822 HB2 LEU 126 1HB LEU 126 6.293 10.913 5.593
823 HB3 LEU 126 2HB LEU 126 5.966 10.269 3.986
824 HG LEU 126 HG LEU 126 7.589 12.336 4.409
825 HD11 LEU 126 1HD1 LEU 126 5.858 12.657 2.033
826 HD12 LEU 126 2HD1 LEU 126 6.631 11.088 2.254
827 HD13 LEU 126 3HD1 LEU 126 7.615 12.548 2.156
828 HD21 LEU 126 1HD2 LEU 126 5.561 13.580 5.392
829 HD22 LEU 126 2HD2 LEU 126 5.043 13.759 3.715
830 HD23 LEU 126 3HD2 LEU 126 6.588 14.431 4.239
831 HA PRO 127 HA PRO 127 1.517 8.347 3.956
832 HB2 PRO 127 1HB PRO 127 1.529 8.008 1.262
833 HB3 PRO 127 2HB PRO 127 0.574 9.257 2.069
834 HG2 PRO 127 1HG PRO 127 3.224 9.489 0.697
835 HG3 PRO 127 2HG PRO 127 1.825 10.576 0.619
836 HD2 PRO 127 1HD PRO 127 3.984 11.089 2.171
837 HD3 PRO 127 2HD PRO 127 2.342 11.589 2.624
838 H GLU 128 H GLU 128 4.789 8.550 3.023
839 HA GLU 128 HA GLU 128 6.449 7.005 2.832
840 HB2 GLU 128 1HB GLU 128 4.361 5.135 3.965
841 HB3 GLU 128 2HB GLU 128 6.071 4.759 3.803
842 HG2 GLU 128 1HG GLU 128 6.688 6.206 5.490
843 HG3 GLU 128 2HG GLU 128 5.216 7.165 5.346
844 H ASN 129 H ASN 129 3.649 4.916 2.167
845 HA ASN 129 HA ASN 129 4.886 4.112 -0.345
846 HB2 ASN 129 1HB ASN 129 3.877 2.478 1.342
847 HB3 ASN 129 2HB ASN 129 2.303 3.057 0.803
848 HD21 ASN 129 2HD2 ASN 129 1.446 2.249 -1.007
849 HD22 ASN 129 1HD2 ASN 129 2.241 1.140 -2.066
Start of MODEL 10
1 H1 GLN 1 H GLN 1 2.422 1.193 0.866
2 HA GLN 1 HA GLN 1 2.120 -0.343 -1.184
3 HB2 GLN 1 1HB GLN 1 3.917 1.801 -2.075
4 HB3 GLN 1 2HB GLN 1 4.484 0.183 -2.468
5 HG2 GLN 1 1HG GLN 1 1.661 0.594 -3.061
6 HG3 GLN 1 2HG GLN 1 2.735 1.674 -3.949
7 HE21 GLN 1 2HE2 GLN 1 1.100 -0.981 -4.381
8 HE22 GLN 1 1HE2 GLN 1 2.172 -1.903 -5.374
9 H ILE 2 H ILE 2 4.879 0.958 0.593
10 HA ILE 2 HA ILE 2 6.541 -0.036 1.787
11 HB ILE 2 HB ILE 2 4.694 -2.423 1.865
12 HG12 ILE 2 1HG1 ILE 2 3.362 -0.773 2.792
13 HG13 ILE 2 2HG1 ILE 2 4.234 -1.334 4.214
14 HG21 ILE 2 1HG2 ILE 2 6.528 -3.326 2.807
15 HG22 ILE 2 2HG2 ILE 2 7.253 -1.756 3.150
16 HG23 ILE 2 3HG2 ILE 2 6.015 -2.409 4.223
17 HD11 ILE 2 1HD1 ILE 2 4.068 1.119 4.062
18 HD12 ILE 2 2HD1 ILE 2 5.733 0.537 4.088
19 HD13 ILE 2 3HD1 ILE 2 5.007 1.063 2.570
20 H ASN 3 H ASN 3 6.866 -0.126 -0.965
21 HA ASN 3 HA ASN 3 7.712 -2.808 -1.685
22 HB2 ASN 3 1HB ASN 3 6.650 -0.902 -3.203
23 HB3 ASN 3 2HB ASN 3 8.340 -0.444 -3.393
24 HD21 ASN 3 2HD2 ASN 3 9.605 -2.841 -3.429
25 HD22 ASN 3 1HD2 ASN 3 9.102 -3.759 -4.805
26 H GLN 4 H GLN 4 9.755 -3.550 -1.688
27 HA GLN 4 HA GLN 4 11.759 -2.162 -0.248
28 HB2 GLN 4 1HB GLN 4 12.314 -4.493 -2.062
29 HB3 GLN 4 2HB GLN 4 13.105 -4.066 -0.550
30 HG2 GLN 4 1HG GLN 4 10.396 -5.286 -0.954
31 HG3 GLN 4 2HG GLN 4 11.778 -5.941 -0.078
32 HE21 GLN 4 2HE2 GLN 4 8.873 -4.339 0.196
33 HE22 GLN 4 1HE2 GLN 4 9.037 -3.757 1.814
34 H VAL 5 H VAL 5 13.931 -1.656 -1.057
35 HA VAL 5 HA VAL 5 14.166 -1.094 -3.899
36 HB VAL 5 HB VAL 5 14.665 1.251 -3.644
37 HG11 VAL 5 1HG1 VAL 5 12.466 2.106 -3.080
38 HG12 VAL 5 2HG1 VAL 5 12.317 0.599 -3.987
39 HG13 VAL 5 3HG1 VAL 5 12.075 0.607 -2.240
40 HG21 VAL 5 1HG2 VAL 5 15.172 0.607 -0.992
41 HG22 VAL 5 2HG2 VAL 5 15.212 2.217 -1.711
42 HG23 VAL 5 3HG2 VAL 5 13.742 1.638 -0.928
43 H ARG 6 H ARG 6 16.369 -0.046 -4.348
44 HA ARG 6 HA ARG 6 18.389 -0.885 -2.396
45 HB2 ARG 6 1HB ARG 6 17.977 -2.664 -4.176
46 HB3 ARG 6 2HB ARG 6 18.659 -1.524 -5.329
47 HG2 ARG 6 1HG ARG 6 20.617 -1.486 -3.530
48 HG3 ARG 6 2HG ARG 6 19.982 -3.100 -3.205
49 HD2 ARG 6 1HD ARG 6 20.081 -3.358 -5.795
50 HD3 ARG 6 2HD ARG 6 21.216 -2.012 -5.700
51 HE ARG 6 HE ARG 6 21.994 -3.957 -3.846
52 HH11 ARG 6 1HH1 ARG 6 21.770 -3.514 -7.292
53 HH12 ARG 6 2HH1 ARG 6 23.080 -4.591 -7.647
54 HH21 ARG 6 1HH2 ARG 6 23.720 -5.378 -4.300
55 HH22 ARG 6 2HH2 ARG 6 24.187 -5.651 -5.944
56 HA PRO 7 HA PRO 7 19.513 3.300 -3.682
57 HB2 PRO 7 1HB PRO 7 21.119 3.755 -1.540
58 HB3 PRO 7 2HB PRO 7 19.359 3.912 -1.472
59 HG2 PRO 7 1HG PRO 7 21.094 1.639 -0.586
60 HG3 PRO 7 2HG PRO 7 19.694 2.361 0.228
61 HD2 PRO 7 1HD PRO 7 19.531 0.054 -1.180
62 HD3 PRO 7 2HD PRO 7 18.183 1.204 -1.072
63 H LYS 8 H LYS 8 20.816 2.986 -5.439
64 HA LYS 8 HA LYS 8 23.120 1.454 -5.602
65 HB2 LYS 8 1HB LYS 8 21.726 2.863 -7.390
66 HB3 LYS 8 2HB LYS 8 23.037 4.006 -7.133
67 HG2 LYS 8 1HG LYS 8 24.390 2.832 -8.431
68 HG3 LYS 8 2HG LYS 8 24.095 1.364 -7.496
69 HD2 LYS 8 1HD LYS 8 21.881 1.233 -8.805
70 HD3 LYS 8 2HD LYS 8 22.632 2.391 -9.905
71 HE2 LYS 8 1HE LYS 8 24.107 0.870 -10.714
72 HE3 LYS 8 2HE LYS 8 24.247 0.026 -9.172
73 HZ1 LYS 8 1HZ LYS 8 22.279 -0.337 -11.317
74 HZ2 LYS 8 2HZ LYS 8 21.807 -0.661 -9.726
75 HZ3 LYS 8 3HZ LYS 8 23.108 -1.499 -10.409
76 H LEU 9 H LEU 9 25.269 2.827 -6.367
77 HA LEU 9 HA LEU 9 26.564 3.526 -4.024
78 HB2 LEU 9 1HB LEU 9 27.103 3.943 -6.914
79 HB3 LEU 9 2HB LEU 9 28.073 4.855 -5.759
80 HG LEU 9 HG LEU 9 27.941 1.878 -6.149
81 HD11 LEU 9 1HD1 LEU 9 30.544 2.580 -5.948
82 HD12 LEU 9 2HD1 LEU 9 29.864 4.039 -6.669
83 HD13 LEU 9 3HD1 LEU 9 29.656 2.481 -7.469
84 HD21 LEU 9 1HD2 LEU 9 28.538 3.407 -3.709
85 HD22 LEU 9 2HD2 LEU 9 29.742 2.198 -4.156
86 HD23 LEU 9 3HD2 LEU 9 28.062 1.720 -3.908
87 HA PRO 10 HA PRO 10 25.944 8.195 -5.081
88 HB2 PRO 10 1HB PRO 10 24.249 8.806 -7.112
89 HB3 PRO 10 2HB PRO 10 25.977 8.525 -7.355
90 HG2 PRO 10 1HG PRO 10 23.676 6.661 -7.791
91 HG3 PRO 10 2HG PRO 10 25.100 6.937 -8.810
92 HD2 PRO 10 1HD PRO 10 24.892 4.813 -7.144
93 HD3 PRO 10 2HD PRO 10 26.446 5.587 -7.515
94 H LEU 11 H LEU 11 23.638 5.822 -4.671
95 HA LEU 11 HA LEU 11 21.627 7.753 -3.723
96 HB2 LEU 11 1HB LEU 11 21.345 4.916 -4.682
97 HB3 LEU 11 2HB LEU 11 20.059 5.778 -3.842
98 HG LEU 11 HG LEU 11 20.983 5.994 -6.631
99 HD11 LEU 11 1HD1 LEU 11 18.615 6.553 -6.964
100 HD12 LEU 11 2HD1 LEU 11 18.374 6.525 -5.218
101 HD13 LEU 11 3HD1 LEU 11 18.826 5.048 -6.069
102 HD21 LEU 11 1HD2 LEU 11 20.161 8.355 -6.763
103 HD22 LEU 11 2HD2 LEU 11 21.708 8.157 -5.938
104 HD23 LEU 11 3HD2 LEU 11 20.235 8.415 -5.002
105 H LEU 12 H LEU 12 23.858 5.351 -2.796
106 HA LEU 12 HA LEU 12 22.569 4.562 -0.359
107 HB2 LEU 12 1HB LEU 12 24.639 3.583 -1.875
108 HB3 LEU 12 2HB LEU 12 25.469 4.245 -0.469
109 HG LEU 12 HG LEU 12 23.662 1.900 -0.686
110 HD11 LEU 12 1HD1 LEU 12 25.354 0.811 0.342
111 HD12 LEU 12 2HD1 LEU 12 25.762 2.182 1.373
112 HD13 LEU 12 3HD1 LEU 12 26.297 2.153 -0.307
113 HD21 LEU 12 1HD2 LEU 12 22.327 2.996 0.858
114 HD22 LEU 12 2HD2 LEU 12 23.692 3.825 1.606
115 HD23 LEU 12 3HD2 LEU 12 23.446 2.100 1.886
116 H LYS 13 H LYS 13 25.139 6.827 -1.242
117 HA LYS 13 HA LYS 13 25.844 7.597 1.373
118 HB2 LYS 13 1HB LYS 13 27.147 9.247 0.391
119 HB3 LYS 13 2HB LYS 13 27.026 8.057 -0.899
120 HG2 LYS 13 1HG LYS 13 26.483 9.832 -2.152
121 HG3 LYS 13 2HG LYS 13 24.880 9.602 -1.450
122 HD2 LYS 13 1HD LYS 13 25.035 11.456 -0.168
123 HD3 LYS 13 2HD LYS 13 26.753 11.213 0.156
124 HE2 LYS 13 1HE LYS 13 27.302 12.051 -2.065
125 HE3 LYS 13 2HE LYS 13 25.588 12.253 -2.426
126 HZ1 LYS 13 1HZ LYS 13 25.507 14.164 -1.303
127 HZ2 LYS 13 2HZ LYS 13 27.195 14.164 -1.406
128 HZ3 LYS 13 3HZ LYS 13 26.433 13.578 -0.014
129 H ILE 14 H ILE 14 23.238 8.545 -0.731
130 HA ILE 14 HA ILE 14 22.515 10.978 0.447
131 HB ILE 14 HB ILE 14 20.578 8.974 -0.705
132 HG12 ILE 14 1HG1 ILE 14 22.527 10.828 -2.043
133 HG13 ILE 14 2HG1 ILE 14 22.188 9.138 -2.399
134 HG21 ILE 14 1HG2 ILE 14 19.351 11.027 -1.369
135 HG22 ILE 14 2HG2 ILE 14 19.494 10.824 0.377
136 HG23 ILE 14 3HG2 ILE 14 20.529 11.977 -0.464
137 HD11 ILE 14 1HD1 ILE 14 20.691 11.582 -3.198
138 HD12 ILE 14 2HD1 ILE 14 21.188 10.193 -4.166
139 HD13 ILE 14 3HD1 ILE 14 19.834 10.049 -3.045
140 H LEU 15 H LEU 15 21.167 7.731 1.059
141 HA LEU 15 HA LEU 15 19.632 8.586 3.299
142 HB2 LEU 15 1HB LEU 15 20.500 5.776 2.659
143 HB3 LEU 15 2HB LEU 15 19.114 6.277 3.626
144 HG LEU 15 HG LEU 15 17.947 5.852 1.762
145 HD11 LEU 15 1HD1 LEU 15 18.164 8.415 1.980
146 HD12 LEU 15 2HD1 LEU 15 17.478 7.740 0.503
147 HD13 LEU 15 3HD1 LEU 15 19.152 8.295 0.524
148 HD21 LEU 15 1HD2 LEU 15 19.287 6.204 -0.551
149 HD22 LEU 15 2HD2 LEU 15 19.283 4.696 0.363
150 HD23 LEU 15 3HD2 LEU 15 20.625 5.828 0.535
151 H HIS 16 H HIS 16 22.794 7.083 2.905
152 HA HIS 16 HA HIS 16 23.331 6.382 5.537
153 HB2 HIS 16 1HB HIS 16 25.061 7.202 3.230
154 HB3 HIS 16 2HB HIS 16 25.783 6.950 4.816
155 HD1 HIS 16 HD1 HIS 16 27.078 4.956 3.590
156 HD2 HIS 16 HD2 HIS 16 22.980 4.453 4.055
157 HE1 HIS 16 HE1 HIS 16 26.656 2.504 3.224
158 H ALA 17 H ALA 17 23.881 9.481 3.894
159 HA ALA 17 HA ALA 17 25.057 10.790 6.104
160 HB1 ALA 17 1HB ALA 17 24.246 12.883 4.800
161 HB2 ALA 17 2HB ALA 17 25.476 11.839 4.087
162 HB3 ALA 17 3HB ALA 17 23.799 11.716 3.555
163 H ALA 18 H ALA 18 21.865 9.828 5.513
164 HA ALA 18 HA ALA 18 20.730 11.869 7.279
165 HB1 ALA 18 1HB ALA 18 19.699 10.206 5.125
166 HB2 ALA 18 2HB ALA 18 18.655 10.216 6.548
167 HB3 ALA 18 3HB ALA 18 19.096 11.734 5.766
168 H GLY 19 H GLY 19 22.146 8.888 7.541
169 HA2 GLY 19 1HA GLY 19 22.328 8.086 9.876
170 HA3 GLY 19 2HA GLY 19 20.582 8.264 9.971
171 H ALA 20 H ALA 20 21.060 7.186 6.953
172 HA ALA 20 HA ALA 20 20.204 4.527 7.597
173 HB1 ALA 20 1HB ALA 20 21.056 5.334 4.850
174 HB2 ALA 20 2HB ALA 20 19.742 4.269 5.352
175 HB3 ALA 20 3HB ALA 20 19.588 6.014 5.552
176 H GLN 21 H GLN 21 21.271 2.643 6.377
177 HA GLN 21 HA GLN 21 24.018 2.683 5.778
178 HB2 GLN 21 1HB GLN 21 23.628 2.877 8.485
179 HB3 GLN 21 2HB GLN 21 23.803 1.141 8.265
180 HG2 GLN 21 1HG GLN 21 25.992 1.459 8.327
181 HG3 GLN 21 2HG GLN 21 25.846 2.221 6.744
182 HE21 GLN 21 2HE2 GLN 21 25.200 4.581 6.849
183 HE22 GLN 21 1HE2 GLN 21 25.997 5.543 8.042
184 H GLY 22 H GLY 22 24.354 0.991 4.493
185 HA2 GLY 22 1HA GLY 22 24.245 -1.564 4.583
186 HA3 GLY 22 2HA GLY 22 22.514 -1.301 4.732
187 H GLU 23 H GLU 23 22.040 -2.412 2.832
188 HA GLU 23 HA GLU 23 22.497 -0.851 0.408
189 HB2 GLU 23 1HB GLU 23 23.079 -3.813 0.582
190 HB3 GLU 23 2HB GLU 23 23.118 -2.846 -0.885
191 HG2 GLU 23 1HG GLU 23 24.858 -1.425 0.433
192 HG3 GLU 23 2HG GLU 23 25.019 -2.886 1.408
193 H MET 24 H MET 24 20.299 -1.854 2.360
194 HA MET 24 HA MET 24 18.325 -2.270 0.271
195 HB2 MET 24 1HB MET 24 18.518 -4.205 2.583
196 HB3 MET 24 2HB MET 24 17.369 -4.257 1.253
197 HG2 MET 24 1HG MET 24 20.341 -4.529 0.897
198 HG3 MET 24 2HG MET 24 19.247 -5.894 1.109
199 HE1 MET 24 1HE MET 24 21.323 -4.552 -1.309
200 HE2 MET 24 2HE MET 24 20.881 -6.257 -1.401
201 HE3 MET 24 3HE MET 24 20.569 -5.189 -2.771
202 H PHE 25 H PHE 25 16.391 -1.366 0.752
203 HA PHE 25 HA PHE 25 15.536 -0.887 3.445
204 HB2 PHE 25 1HB PHE 25 16.124 1.562 1.780
205 HB3 PHE 25 2HB PHE 25 15.617 1.501 3.465
206 HD1 PHE 25 HD2 PHE 25 18.411 0.810 1.157
207 HD2 PHE 25 HD1 PHE 25 17.187 1.257 5.209
208 HE1 PHE 25 HE2 PHE 25 20.768 0.848 1.861
209 HE2 PHE 25 HE1 PHE 25 19.542 1.296 5.920
210 HZ PHE 25 HZ PHE 25 21.336 1.090 4.245
211 H THR 26 H THR 26 13.411 0.122 3.542
212 HA THR 26 HA THR 26 11.855 -0.515 1.149
213 HB THR 26 HB THR 26 10.152 0.262 3.287
214 HG1 THR 26 1HG THR 26 11.397 -0.257 4.934
215 HG21 THR 26 1HG2 THR 26 9.166 -1.364 2.080
216 HG22 THR 26 2HG2 THR 26 9.997 -2.458 3.186
217 HG23 THR 26 3HG2 THR 26 10.705 -2.086 1.614
218 H VAL 27 H VAL 27 9.670 0.970 1.275
219 HA VAL 27 HA VAL 27 10.437 3.459 0.230
220 HB VAL 27 HB VAL 27 7.700 3.128 1.365
221 HG11 VAL 27 1HG1 VAL 27 7.548 3.863 -1.286
222 HG12 VAL 27 2HG1 VAL 27 7.510 4.957 0.098
223 HG13 VAL 27 3HG1 VAL 27 9.032 4.638 -0.734
224 HG21 VAL 27 1HG2 VAL 27 7.859 0.958 0.562
225 HG22 VAL 27 2HG2 VAL 27 7.200 1.831 -0.822
226 HG23 VAL 27 3HG2 VAL 27 8.915 1.421 -0.773
227 H LYS 28 H LYS 28 9.031 2.614 3.384
228 HA LYS 28 HA LYS 28 8.929 5.232 4.406
229 HB2 LYS 28 1HB LYS 28 9.049 3.938 6.668
230 HB3 LYS 28 2HB LYS 28 7.650 3.733 5.622
231 HG2 LYS 28 1HG LYS 28 9.791 1.837 5.064
232 HG3 LYS 28 2HG LYS 28 9.153 1.718 6.705
233 HD2 LYS 28 1HD LYS 28 6.836 1.796 5.525
234 HD3 LYS 28 2HD LYS 28 7.751 1.323 4.091
235 HE2 LYS 28 1HE LYS 28 7.023 -0.697 5.034
236 HE3 LYS 28 2HE LYS 28 8.710 -0.552 5.525
237 HZ1 LYS 28 1HZ LYS 28 7.602 -1.178 7.451
238 HZ2 LYS 28 2HZ LYS 28 6.281 -0.164 7.157
239 HZ3 LYS 28 3HZ LYS 28 7.764 0.496 7.632
240 H GLU 29 H GLU 29 11.454 2.767 4.479
241 HA GLU 29 HA GLU 29 13.196 4.088 6.256
242 HB2 GLU 29 1HB GLU 29 13.593 1.991 4.141
243 HB3 GLU 29 2HB GLU 29 14.964 2.663 5.012
244 HG2 GLU 29 1HG GLU 29 12.750 1.762 6.709
245 HG3 GLU 29 2HG GLU 29 13.553 0.490 5.790
246 H VAL 30 H VAL 30 13.210 3.950 2.694
247 HA VAL 30 HA VAL 30 15.354 5.711 2.305
248 HB VAL 30 HB VAL 30 13.001 5.230 0.472
249 HG11 VAL 30 1HG1 VAL 30 13.976 7.037 -0.519
250 HG12 VAL 30 2HG1 VAL 30 15.565 6.699 0.171
251 HG13 VAL 30 3HG1 VAL 30 14.982 5.762 -1.206
252 HG21 VAL 30 1HG2 VAL 30 15.294 3.596 1.220
253 HG22 VAL 30 2HG2 VAL 30 13.811 3.148 0.378
254 HG23 VAL 30 3HG2 VAL 30 15.159 3.844 -0.521
255 H MET 31 H MET 31 11.915 6.292 2.753
256 HA MET 31 HA MET 31 12.019 9.067 2.090
257 HB2 MET 31 1HB MET 31 9.822 8.681 2.002
258 HB3 MET 31 2HB MET 31 10.014 7.145 2.836
259 HG2 MET 31 1HG MET 31 8.490 8.499 4.072
260 HG3 MET 31 2HG MET 31 9.989 8.363 4.988
261 HE1 MET 31 1HE MET 31 8.576 10.576 2.056
262 HE2 MET 31 2HE MET 31 9.456 12.077 2.345
263 HE3 MET 31 3HE MET 31 10.333 10.612 1.904
264 H HIS 32 H HIS 32 12.032 7.239 5.126
265 HA HIS 32 HA HIS 32 11.936 9.378 6.907
266 HB2 HIS 32 1HB HIS 32 11.935 6.755 7.267
267 HB3 HIS 32 2HB HIS 32 13.652 7.020 7.551
268 HD1 HIS 32 HD1 HIS 32 10.671 6.720 9.376
269 HD2 HIS 32 HD2 HIS 32 13.884 9.347 9.560
270 HE1 HIS 32 HE1 HIS 32 10.596 7.712 11.685
271 H TYR 33 H TYR 33 14.589 8.100 5.030
272 HA TYR 33 HA TYR 33 16.641 9.501 6.452
273 HB2 TYR 33 1HB TYR 33 16.632 8.183 3.731
274 HB3 TYR 33 2HB TYR 33 18.065 8.854 4.502
275 HD1 TYR 33 HD2 TYR 33 17.982 7.983 7.212
276 HD2 TYR 33 HD1 TYR 33 16.739 5.881 3.728
277 HE1 TYR 33 HE2 TYR 33 18.362 5.848 8.372
278 HE2 TYR 33 HE1 TYR 33 17.114 3.740 4.879
279 HH TYR 33 HH TYR 33 17.676 3.541 8.253
280 H LEU 34 H LEU 34 14.631 10.148 3.655
281 HA LEU 34 HA LEU 34 15.965 12.227 2.445
282 HB2 LEU 34 1HB LEU 34 13.256 11.246 2.552
283 HB3 LEU 34 2HB LEU 34 13.281 13.005 2.452
284 HG LEU 34 HG LEU 34 13.085 12.104 0.240
285 HD11 LEU 34 1HD1 LEU 34 14.926 13.170 -0.832
286 HD12 LEU 34 2HD1 LEU 34 15.941 12.987 0.598
287 HD13 LEU 34 3HD1 LEU 34 14.561 14.084 0.632
288 HD21 LEU 34 1HD2 LEU 34 14.708 10.589 -0.719
289 HD22 LEU 34 2HD2 LEU 34 14.008 9.872 0.732
290 HD23 LEU 34 3HD2 LEU 34 15.626 10.574 0.786
291 H GLY 35 H GLY 35 13.528 12.540 5.038
292 HA2 GLY 35 1HA GLY 35 13.696 15.279 5.418
293 HA3 GLY 35 2HA GLY 35 13.276 14.127 6.678
294 H GLN 36 H GLN 36 15.606 12.745 7.027
295 HA GLN 36 HA GLN 36 17.084 14.458 8.683
296 HB2 GLN 36 1HB GLN 36 17.908 11.788 7.529
297 HB3 GLN 36 2HB GLN 36 18.666 12.590 8.898
298 HG2 GLN 36 1HG GLN 36 16.398 10.859 8.848
299 HG3 GLN 36 2HG GLN 36 17.265 11.526 10.230
300 HE21 GLN 36 2HE2 GLN 36 14.493 11.761 8.206
301 HE22 GLN 36 1HE2 GLN 36 13.680 13.000 9.093
302 H TYR 37 H TYR 37 17.778 13.193 5.444
303 HA TYR 37 HA TYR 37 20.344 14.226 5.133
304 HB2 TYR 37 1HB TYR 37 19.378 12.628 3.561
305 HB3 TYR 37 2HB TYR 37 18.198 13.825 3.038
306 HD1 TYR 37 HD2 TYR 37 21.845 13.118 3.139
307 HD2 TYR 37 HD1 TYR 37 18.700 15.309 1.293
308 HE1 TYR 37 HE2 TYR 37 23.409 13.892 1.406
309 HE2 TYR 37 HE1 TYR 37 20.255 16.089 -0.445
310 HH TYR 37 HH TYR 37 23.699 15.416 -0.265
311 H ILE 38 H ILE 38 17.215 15.697 4.313
312 HA ILE 38 HA ILE 38 18.221 18.089 3.249
313 HB ILE 38 HB ILE 38 15.599 17.706 4.699
314 HG12 ILE 38 1HG1 ILE 38 16.098 17.522 1.727
315 HG13 ILE 38 2HG1 ILE 38 16.094 16.111 2.779
316 HG21 ILE 38 1HG2 ILE 38 14.853 19.582 3.260
317 HG22 ILE 38 2HG2 ILE 38 16.110 20.037 4.408
318 HG23 ILE 38 3HG2 ILE 38 16.517 19.777 2.712
319 HD11 ILE 38 1HD1 ILE 38 13.789 16.556 3.393
320 HD12 ILE 38 2HD1 ILE 38 13.789 18.003 2.384
321 HD13 ILE 38 3HD1 ILE 38 13.959 16.411 1.644
322 H MET 39 H MET 39 17.137 17.312 6.547
323 HA MET 39 HA MET 39 17.644 19.864 7.635
324 HB2 MET 39 1HB MET 39 16.687 18.952 9.434
325 HB3 MET 39 2HB MET 39 16.596 17.435 8.550
326 HG2 MET 39 1HG MET 39 18.704 16.720 9.452
327 HG3 MET 39 2HG MET 39 18.942 18.284 10.228
328 HE1 MET 39 1HE MET 39 16.665 19.232 11.414
329 HE2 MET 39 2HE MET 39 15.312 18.144 11.100
330 HE3 MET 39 3HE MET 39 15.941 18.320 12.739
331 H VAL 40 H VAL 40 19.649 17.004 7.230
332 HA VAL 40 HA VAL 40 21.817 17.871 8.833
333 HB VAL 40 HB VAL 40 21.203 15.550 7.462
334 HG11 VAL 40 1HG1 VAL 40 23.706 16.729 6.261
335 HG12 VAL 40 2HG1 VAL 40 23.084 15.099 5.995
336 HG13 VAL 40 3HG1 VAL 40 22.177 16.497 5.414
337 HG21 VAL 40 1HG2 VAL 40 22.371 15.678 9.582
338 HG22 VAL 40 2HG2 VAL 40 23.296 14.698 8.445
339 HG23 VAL 40 3HG2 VAL 40 23.791 16.356 8.786
340 H LYS 41 H LYS 41 21.031 18.254 5.416
341 HA LYS 41 HA LYS 41 23.520 19.667 4.902
342 HB2 LYS 41 1HB LYS 41 21.237 18.720 3.205
343 HB3 LYS 41 2HB LYS 41 22.347 19.933 2.582
344 HG2 LYS 41 1HG LYS 41 23.031 17.146 3.488
345 HG3 LYS 41 2HG LYS 41 23.055 17.771 1.837
346 HD2 LYS 41 1HD LYS 41 24.912 18.382 4.112
347 HD3 LYS 41 2HD LYS 41 25.299 17.809 2.487
348 HE2 LYS 41 1HE LYS 41 24.242 20.541 3.212
349 HE3 LYS 41 2HE LYS 41 25.902 20.157 2.758
350 HZ1 LYS 41 1HZ LYS 41 23.827 19.357 0.881
351 HZ2 LYS 41 2HZ LYS 41 25.367 19.992 0.587
352 HZ3 LYS 41 3HZ LYS 41 24.098 21.020 1.028
353 H GLN 42 H GLN 42 20.436 20.404 6.016
354 HA GLN 42 HA GLN 42 19.380 22.364 6.482
355 HB2 GLN 42 1HB GLN 42 22.188 23.194 6.049
356 HB3 GLN 42 2HB GLN 42 20.982 24.470 5.948
357 HG2 GLN 42 1HG GLN 42 21.385 24.598 8.159
358 HG3 GLN 42 2HG GLN 42 20.174 23.318 8.211
359 HE21 GLN 42 2HE2 GLN 42 21.769 21.233 7.205
360 HE22 GLN 42 1HE2 GLN 42 22.956 20.840 8.396
361 H LEU 43 H LEU 43 18.694 21.284 4.126
362 HA LEU 43 HA LEU 43 18.715 23.487 2.180
363 HB2 LEU 43 1HB LEU 43 19.310 20.879 1.787
364 HB3 LEU 43 2HB LEU 43 17.591 20.879 1.401
365 HG LEU 43 HG LEU 43 18.361 22.957 -0.098
366 HD11 LEU 43 1HD1 LEU 43 20.722 22.692 0.658
367 HD12 LEU 43 2HD1 LEU 43 20.505 22.605 -1.089
368 HD13 LEU 43 3HD1 LEU 43 20.753 21.128 -0.157
369 HD21 LEU 43 1HD2 LEU 43 17.307 20.593 -0.605
370 HD22 LEU 43 2HD2 LEU 43 18.923 20.263 -1.229
371 HD23 LEU 43 3HD2 LEU 43 17.975 21.596 -1.893
372 H TYR 44 H TYR 44 17.091 24.056 4.203
373 HA TYR 44 HA TYR 44 14.502 24.097 2.957
374 HB2 TYR 44 1HB TYR 44 13.272 23.038 4.773
375 HB3 TYR 44 2HB TYR 44 14.441 21.907 4.099
376 HD1 TYR 44 HD2 TYR 44 16.879 22.220 5.355
377 HD2 TYR 44 HD1 TYR 44 13.039 22.906 7.054
378 HE1 TYR 44 HE2 TYR 44 17.812 21.842 7.599
379 HE2 TYR 44 HE1 TYR 44 13.961 22.530 9.304
380 HH TYR 44 HH TYR 44 17.402 22.144 9.837
381 H ASP 45 H ASP 45 12.908 25.325 4.352
382 HA ASP 45 HA ASP 45 14.245 27.669 5.383
383 HB2 ASP 45 1HB ASP 45 11.787 27.165 4.130
384 HB3 ASP 45 2HB ASP 45 11.377 27.678 5.764
385 H GLN 46 H GLN 46 14.936 27.737 7.411
386 HA GLN 46 HA GLN 46 14.241 25.968 9.444
387 HB2 GLN 46 1HB GLN 46 15.616 28.607 9.336
388 HB3 GLN 46 2HB GLN 46 15.098 28.019 10.910
389 HG2 GLN 46 1HG GLN 46 17.486 27.479 9.896
390 HG3 GLN 46 2HG GLN 46 16.627 26.358 10.950
391 HE21 GLN 46 2HE2 GLN 46 16.757 27.206 7.504
392 HE22 GLN 46 1HE2 GLN 46 16.764 25.577 6.929
393 H GLN 47 H GLN 47 12.748 28.951 8.428
394 HA GLN 47 HA GLN 47 11.134 29.267 10.774
395 HB2 GLN 47 1HB GLN 47 10.299 30.497 8.202
396 HB3 GLN 47 2HB GLN 47 10.368 31.198 9.813
397 HG2 GLN 47 1HG GLN 47 12.089 32.326 8.895
398 HG3 GLN 47 2HG GLN 47 12.976 30.890 9.403
399 HE21 GLN 47 2HE2 GLN 47 14.234 30.028 7.927
400 HE22 GLN 47 1HE2 GLN 47 14.040 30.157 6.215
401 H GLU 48 H GLU 48 10.846 27.576 7.754
402 HA GLU 48 HA GLU 48 8.259 26.517 8.642
403 HB2 GLU 48 1HB GLU 48 8.887 27.759 5.981
404 HB3 GLU 48 2HB GLU 48 7.648 26.519 6.117
405 HG2 GLU 48 1HG GLU 48 6.177 27.996 6.848
406 HG3 GLU 48 2HG GLU 48 7.257 28.493 8.149
407 H GLN 49 H GLN 49 9.392 24.644 9.280
408 HA GLN 49 HA GLN 49 11.185 23.172 7.768
409 HB2 GLN 49 1HB GLN 49 9.187 22.385 9.870
410 HB3 GLN 49 2HB GLN 49 10.199 21.177 9.089
411 HG2 GLN 49 1HG GLN 49 11.580 21.613 10.798
412 HG3 GLN 49 2HG GLN 49 12.074 22.969 9.787
413 HE21 GLN 49 2HE2 GLN 49 12.717 24.076 11.678
414 HE22 GLN 49 1HE2 GLN 49 11.554 24.843 12.700
415 H HIS 50 H HIS 50 7.667 23.199 7.670
416 HA HIS 50 HA HIS 50 7.279 20.949 6.043
417 HB2 HIS 50 1HB HIS 50 5.071 21.710 5.735
418 HB3 HIS 50 2HB HIS 50 5.532 22.324 7.320
419 HD1 HIS 50 HD1 HIS 50 4.912 24.682 7.674
420 HD2 HIS 50 HD2 HIS 50 5.574 23.856 3.656
421 HE1 HIS 50 HE1 HIS 50 4.423 26.828 6.457
422 H MET 51 H MET 51 8.736 23.912 5.335
423 HA MET 51 HA MET 51 8.227 23.624 2.455
424 HB2 MET 51 1HB MET 51 8.783 25.912 4.230
425 HB3 MET 51 2HB MET 51 9.615 25.955 2.681
426 HG2 MET 51 1HG MET 51 6.647 25.756 3.130
427 HG3 MET 51 2HG MET 51 7.539 27.149 2.522
428 HE1 MET 51 1HE MET 51 9.473 24.489 0.769
429 HE2 MET 51 2HE MET 51 9.051 25.293 -0.743
430 HE3 MET 51 3HE MET 51 9.538 26.248 0.658
431 H VAL 52 H VAL 52 9.664 22.101 1.783
432 HA VAL 52 HA VAL 52 12.455 22.280 2.604
433 HB VAL 52 HB VAL 52 10.871 20.238 1.076
434 HG11 VAL 52 1HG1 VAL 52 12.878 20.408 -0.204
435 HG12 VAL 52 2HG1 VAL 52 13.872 20.450 1.254
436 HG13 VAL 52 3HG1 VAL 52 13.015 18.973 0.812
437 HG21 VAL 52 1HG2 VAL 52 11.143 20.409 3.663
438 HG22 VAL 52 2HG2 VAL 52 11.277 18.841 2.868
439 HG23 VAL 52 3HG2 VAL 52 12.732 19.711 3.353
440 H TYR 53 H TYR 53 14.060 23.055 1.373
441 HA TYR 53 HA TYR 53 13.363 24.016 -1.315
442 HB2 TYR 53 1HB TYR 53 15.363 24.923 0.734
443 HB3 TYR 53 2HB TYR 53 15.559 25.358 -0.960
444 HD1 TYR 53 HD2 TYR 53 13.226 26.253 -2.036
445 HD2 TYR 53 HD1 TYR 53 14.344 26.498 2.062
446 HE1 TYR 53 HE2 TYR 53 11.681 28.143 -1.733
447 HE2 TYR 53 HE1 TYR 53 12.801 28.387 2.376
448 HH TYR 53 HH TYR 53 10.849 29.633 -0.321
449 H CYS 54 H CYS 54 13.718 22.125 -2.476
450 HA CYS 54 HA CYS 54 16.201 20.687 -2.257
451 HB2 CYS 54 1HB CYS 54 15.322 19.356 -4.149
452 HB3 CYS 54 2HB CYS 54 14.170 19.476 -2.824
453 HG CYS 54 HG CYS 54 14.038 21.147 -5.804
454 H GLY 55 H GLY 55 14.698 22.817 -4.675
455 HA2 GLY 55 1HA GLY 55 16.545 22.751 -6.690
456 HA3 GLY 55 2HA GLY 55 15.678 24.208 -6.229
457 H GLY 56 H GLY 56 18.673 22.465 -6.042
458 HA2 GLY 56 1HA GLY 56 20.468 24.403 -6.015
459 HA3 GLY 56 2HA GLY 56 19.894 24.518 -4.358
460 H ASP 57 H ASP 57 19.477 21.441 -4.663
461 HA ASP 57 HA ASP 57 22.294 20.696 -4.236
462 HB2 ASP 57 1HB ASP 57 20.553 20.881 -2.193
463 HB3 ASP 57 2HB ASP 57 20.218 19.230 -2.706
464 H LEU 58 H LEU 58 22.312 18.110 -4.051
465 HA LEU 58 HA LEU 58 21.965 17.107 -6.591
466 HB2 LEU 58 1HB LEU 58 21.973 15.650 -3.955
467 HB3 LEU 58 2HB LEU 58 22.070 14.848 -5.522
468 HG LEU 58 HG LEU 58 24.130 16.405 -4.048
469 HD11 LEU 58 1HD1 LEU 58 23.790 13.770 -5.277
470 HD12 LEU 58 2HD1 LEU 58 24.798 14.272 -3.920
471 HD13 LEU 58 3HD1 LEU 58 25.360 14.517 -5.573
472 HD21 LEU 58 1HD2 LEU 58 23.883 17.677 -6.111
473 HD22 LEU 58 2HD2 LEU 58 24.026 16.195 -7.056
474 HD23 LEU 58 3HD2 LEU 58 25.398 16.773 -6.109
475 H LEU 59 H LEU 59 19.821 16.567 -3.794
476 HA LEU 59 HA LEU 59 17.870 15.071 -5.085
477 HB2 LEU 59 1HB LEU 59 16.749 15.208 -3.149
478 HB3 LEU 59 2HB LEU 59 18.231 15.961 -2.565
479 HG LEU 59 HG LEU 59 15.865 17.517 -3.597
480 HD11 LEU 59 1HD1 LEU 59 16.491 16.456 -0.879
481 HD12 LEU 59 2HD1 LEU 59 14.945 16.553 -1.721
482 HD13 LEU 59 3HD1 LEU 59 15.675 18.011 -1.047
483 HD21 LEU 59 1HD2 LEU 59 17.556 18.846 -1.698
484 HD22 LEU 59 2HD2 LEU 59 17.151 19.309 -3.352
485 HD23 LEU 59 3HD2 LEU 59 18.520 18.239 -3.045
486 H GLY 60 H GLY 60 18.332 18.557 -4.959
487 HA2 GLY 60 1HA GLY 60 15.837 19.296 -6.064
488 HA3 GLY 60 2HA GLY 60 17.293 20.280 -6.066
489 H GLU 61 H GLU 61 19.026 18.899 -7.603
490 HA GLU 61 HA GLU 61 18.186 19.499 -10.210
491 HB2 GLU 61 1HB GLU 61 20.335 19.121 -10.757
492 HB3 GLU 61 2HB GLU 61 20.586 18.946 -9.026
493 HG2 GLU 61 1HG GLU 61 21.624 17.089 -9.994
494 HG3 GLU 61 2HG GLU 61 20.101 16.482 -9.346
495 H LEU 62 H LEU 62 18.261 16.463 -8.421
496 HA LEU 62 HA LEU 62 17.544 14.821 -10.638
497 HB2 LEU 62 1HB LEU 62 18.537 14.322 -8.187
498 HB3 LEU 62 2HB LEU 62 16.840 13.935 -7.911
499 HG LEU 62 HG LEU 62 16.949 12.308 -9.773
500 HD11 LEU 62 1HD1 LEU 62 18.723 13.246 -11.089
501 HD12 LEU 62 2HD1 LEU 62 19.196 11.628 -10.573
502 HD13 LEU 62 3HD1 LEU 62 19.871 13.043 -9.766
503 HD21 LEU 62 1HD2 LEU 62 18.206 12.125 -7.196
504 HD22 LEU 62 2HD2 LEU 62 19.021 11.071 -8.352
505 HD23 LEU 62 3HD2 LEU 62 17.285 10.910 -8.082
506 H LEU 63 H LEU 63 15.760 16.564 -8.175
507 HA LEU 63 HA LEU 63 13.242 15.344 -8.656
508 HB2 LEU 63 1HB LEU 63 14.315 17.412 -6.986
509 HB3 LEU 63 2HB LEU 63 12.825 17.975 -7.741
510 HG LEU 63 HG LEU 63 13.041 15.407 -6.177
511 HD11 LEU 63 1HD1 LEU 63 13.540 17.289 -4.717
512 HD12 LEU 63 2HD1 LEU 63 11.952 16.615 -4.351
513 HD13 LEU 63 3HD1 LEU 63 12.083 18.117 -5.266
514 HD21 LEU 63 1HD2 LEU 63 11.029 15.030 -7.036
515 HD22 LEU 63 2HD2 LEU 63 11.008 16.609 -7.822
516 HD23 LEU 63 3HD2 LEU 63 10.446 16.444 -6.158
517 H GLY 64 H GLY 64 14.832 18.239 -9.923
518 HA2 GLY 64 1HA GLY 64 14.495 19.055 -12.117
519 HA3 GLY 64 2HA GLY 64 12.961 18.200 -12.174
520 H ARG 65 H ARG 65 12.712 19.491 -9.290
521 HA ARG 65 HA ARG 65 11.308 21.848 -10.297
522 HB2 ARG 65 1HB ARG 65 11.217 20.879 -7.455
523 HB3 ARG 65 2HB ARG 65 10.007 21.790 -8.349
524 HG2 ARG 65 1HG ARG 65 10.675 18.873 -8.563
525 HG3 ARG 65 2HG ARG 65 9.139 19.622 -8.123
526 HD2 ARG 65 1HD ARG 65 8.722 20.311 -10.331
527 HD3 ARG 65 2HD ARG 65 10.393 20.036 -10.819
528 HE ARG 65 HE ARG 65 9.584 17.570 -10.121
529 HH11 ARG 65 1HH1 ARG 65 8.181 20.005 -12.176
530 HH12 ARG 65 2HH1 ARG 65 7.402 18.862 -13.219
531 HH21 ARG 65 1HH2 ARG 65 8.562 16.055 -11.487
532 HH22 ARG 65 2HH2 ARG 65 7.618 16.615 -12.825
533 H GLN 66 H GLN 66 11.311 23.156 -7.696
534 HA GLN 66 HA GLN 66 14.115 24.010 -7.483
535 HB2 GLN 66 1HB GLN 66 13.180 26.371 -7.171
536 HB3 GLN 66 2HB GLN 66 13.204 25.725 -8.806
537 HG2 GLN 66 1HG GLN 66 11.041 26.115 -8.991
538 HG3 GLN 66 2HG GLN 66 10.725 25.014 -7.650
539 HE21 GLN 66 2HE2 GLN 66 11.883 28.322 -8.213
540 HE22 GLN 66 1HE2 GLN 66 10.999 29.035 -6.912
541 H SER 67 H SER 67 10.901 23.960 -6.016
542 HA SER 67 HA SER 67 12.054 23.478 -3.420
543 HB2 SER 67 1HB SER 67 11.147 25.398 -2.293
544 HB3 SER 67 2HB SER 67 12.095 25.985 -3.660
545 HG SER 67 HG SER 67 10.339 26.984 -4.213
546 H PHE 68 H PHE 68 10.726 22.275 -2.186
547 HA PHE 68 HA PHE 68 7.877 22.162 -2.886
548 HB2 PHE 68 1HB PHE 68 7.867 19.746 -2.800
549 HB3 PHE 68 2HB PHE 68 9.080 20.266 -3.966
550 HD1 PHE 68 HD1 PHE 68 8.772 19.354 -0.365
551 HD2 PHE 68 HD2 PHE 68 11.169 19.311 -3.882
552 HE1 PHE 68 HE1 PHE 68 10.468 18.014 0.811
553 HE2 PHE 68 HE2 PHE 68 12.868 17.971 -2.712
554 HZ PHE 68 HZ PHE 68 12.519 17.320 -0.363
555 H SER 69 H SER 69 6.550 21.132 -1.188
556 HA SER 69 HA SER 69 7.635 21.779 1.467
557 HB2 SER 69 1HB SER 69 5.757 23.046 1.491
558 HB3 SER 69 2HB SER 69 5.001 22.121 0.193
559 HG SER 69 HG SER 69 4.426 20.551 1.712
560 H VAL 70 H VAL 70 7.700 20.291 3.064
561 HA VAL 70 HA VAL 70 7.578 17.545 2.412
562 HB VAL 70 HB VAL 70 8.432 17.134 4.481
563 HG11 VAL 70 1HG1 VAL 70 10.077 18.645 4.792
564 HG12 VAL 70 2HG1 VAL 70 9.398 19.379 3.338
565 HG13 VAL 70 3HG1 VAL 70 8.954 19.997 4.930
566 HG21 VAL 70 1HG2 VAL 70 7.812 18.622 6.489
567 HG22 VAL 70 2HG2 VAL 70 6.506 19.213 5.461
568 HG23 VAL 70 3HG2 VAL 70 6.598 17.501 5.873
569 H LYS 71 H LYS 71 5.296 19.753 3.884
570 HA LYS 71 HA LYS 71 3.501 17.768 4.854
571 HB2 LYS 71 1HB LYS 71 1.917 19.627 5.116
572 HB3 LYS 71 2HB LYS 71 3.501 20.032 5.764
573 HG2 LYS 71 1HG LYS 71 3.940 21.565 4.111
574 HG3 LYS 71 2HG LYS 71 2.833 20.806 2.965
575 HD2 LYS 71 1HD LYS 71 1.685 22.726 3.569
576 HD3 LYS 71 2HD LYS 71 0.997 21.518 4.657
577 HE2 LYS 71 1HE LYS 71 1.611 22.746 6.400
578 HE3 LYS 71 2HE LYS 71 3.298 22.594 5.911
579 HZ1 LYS 71 1HZ LYS 71 1.402 24.687 4.990
580 HZ2 LYS 71 2HZ LYS 71 3.009 24.534 4.486
581 HZ3 LYS 71 3HZ LYS 71 2.660 24.906 6.099
582 H ASP 72 H ASP 72 4.323 18.601 1.763
583 HA ASP 72 HA ASP 72 1.823 17.472 0.722
584 HB2 ASP 72 1HB ASP 72 1.303 19.559 0.001
585 HB3 ASP 72 2HB ASP 72 2.965 20.127 0.132
586 HA PRO 73 HA PRO 73 5.365 15.121 -0.959
587 HB2 PRO 73 1HB PRO 73 3.995 12.784 -1.128
588 HB3 PRO 73 2HB PRO 73 4.766 13.340 0.363
589 HG2 PRO 73 1HG PRO 73 1.895 13.522 -0.467
590 HG3 PRO 73 2HG PRO 73 2.579 13.083 1.109
591 HD2 PRO 73 1HD PRO 73 1.593 15.550 0.586
592 HD3 PRO 73 2HD PRO 73 2.945 15.279 1.704
593 H SER 74 H SER 74 4.549 16.762 -2.745
594 HA SER 74 HA SER 74 3.027 15.369 -4.819
595 HB2 SER 74 1HB SER 74 3.564 18.187 -4.151
596 HB3 SER 74 2HB SER 74 3.606 17.824 -5.877
597 HG SER 74 HG SER 74 1.510 18.157 -5.562
598 HA PRO 75 HA PRO 75 6.978 16.441 -7.316
599 HB2 PRO 75 1HB PRO 75 8.932 17.880 -6.098
600 HB3 PRO 75 2HB PRO 75 7.578 18.629 -6.951
601 HG2 PRO 75 1HG PRO 75 7.949 18.176 -4.016
602 HG3 PRO 75 2HG PRO 75 7.328 19.609 -4.857
603 HD2 PRO 75 1HD PRO 75 5.702 17.801 -3.666
604 HD3 PRO 75 2HD PRO 75 5.227 18.699 -5.122
605 H LEU 76 H LEU 76 7.414 15.788 -3.893
606 HA LEU 76 HA LEU 76 9.898 14.545 -3.923
607 HB2 LEU 76 1HB LEU 76 8.624 15.122 -1.893
608 HB3 LEU 76 2HB LEU 76 7.504 13.807 -2.245
609 HG LEU 76 HG LEU 76 9.774 12.403 -2.164
610 HD11 LEU 76 1HD1 LEU 76 10.814 13.517 0.055
611 HD12 LEU 76 2HD1 LEU 76 10.364 14.967 -0.842
612 HD13 LEU 76 3HD1 LEU 76 11.451 13.783 -1.568
613 HD21 LEU 76 1HD2 LEU 76 7.553 12.846 -0.485
614 HD22 LEU 76 2HD2 LEU 76 8.980 12.803 0.551
615 HD23 LEU 76 3HD2 LEU 76 8.628 11.448 -0.524
616 H TYR 77 H TYR 77 6.725 12.910 -4.021
617 HA TYR 77 HA TYR 77 7.622 10.347 -4.521
618 HB2 TYR 77 1HB TYR 77 5.086 11.806 -5.097
619 HB3 TYR 77 2HB TYR 77 5.321 10.231 -5.846
620 HD1 TYR 77 HD1 TYR 77 5.871 8.260 -4.303
621 HD2 TYR 77 HD2 TYR 77 4.340 11.968 -2.887
622 HE1 TYR 77 HE1 TYR 77 5.142 7.160 -2.227
623 HE2 TYR 77 HE2 TYR 77 3.608 10.879 -0.807
624 HH TYR 77 HH TYR 77 4.652 8.316 0.394
625 H ASP 78 H ASP 78 7.046 12.978 -6.796
626 HA ASP 78 HA ASP 78 7.306 11.544 -9.183
627 HB2 ASP 78 1HB ASP 78 6.722 14.097 -8.628
628 HB3 ASP 78 2HB ASP 78 8.415 14.302 -9.072
629 H MET 79 H MET 79 9.693 12.677 -6.919
630 HA MET 79 HA MET 79 11.914 12.273 -8.719
631 HB2 MET 79 1HB MET 79 12.676 13.818 -7.271
632 HB3 MET 79 2HB MET 79 11.508 13.367 -6.035
633 HG2 MET 79 1HG MET 79 12.927 11.469 -5.406
634 HG3 MET 79 2HG MET 79 14.106 11.965 -6.618
635 HE1 MET 79 1HE MET 79 12.008 13.146 -3.657
636 HE2 MET 79 2HE MET 79 13.288 12.266 -2.821
637 HE3 MET 79 3HE MET 79 13.155 14.016 -2.638
638 H LEU 80 H LEU 80 10.466 10.595 -5.964
639 HA LEU 80 HA LEU 80 12.399 8.561 -5.733
640 HB2 LEU 80 1HB LEU 80 9.493 8.692 -4.976
641 HB3 LEU 80 2HB LEU 80 10.500 7.288 -4.633
642 HG LEU 80 HG LEU 80 11.994 8.801 -3.300
643 HD11 LEU 80 1HD1 LEU 80 11.076 10.944 -2.572
644 HD12 LEU 80 2HD1 LEU 80 9.713 10.738 -3.670
645 HD13 LEU 80 3HD1 LEU 80 11.344 10.918 -4.315
646 HD21 LEU 80 1HD2 LEU 80 10.044 7.346 -2.440
647 HD22 LEU 80 2HD2 LEU 80 9.204 8.880 -2.212
648 HD23 LEU 80 3HD2 LEU 80 10.724 8.571 -1.370
649 H ARG 81 H ARG 81 9.556 8.907 -7.760
650 HA ARG 81 HA ARG 81 9.117 6.354 -8.643
651 HB2 ARG 81 1HB ARG 81 7.941 7.278 -10.382
652 HB3 ARG 81 2HB ARG 81 8.068 8.681 -9.330
653 HG2 ARG 81 1HG ARG 81 9.974 9.486 -10.628
654 HG3 ARG 81 2HG ARG 81 9.847 8.077 -11.683
655 HD2 ARG 81 1HD ARG 81 7.365 9.614 -11.345
656 HD3 ARG 81 2HD ARG 81 8.670 10.474 -12.162
657 HE ARG 81 HE ARG 81 8.407 7.911 -13.284
658 HH11 ARG 81 1HH1 ARG 81 6.726 10.954 -13.108
659 HH12 ARG 81 2HH1 ARG 81 5.944 10.759 -14.642
660 HH21 ARG 81 1HH2 ARG 81 7.384 7.643 -15.304
661 HH22 ARG 81 2HH2 ARG 81 6.318 8.875 -15.890
662 H LYS 82 H LYS 82 11.514 8.650 -9.918
663 HA LYS 82 HA LYS 82 12.772 6.433 -11.385
664 HB2 LYS 82 1HB LYS 82 13.317 7.881 -13.029
665 HB3 LYS 82 2HB LYS 82 12.047 8.875 -12.327
666 HG2 LYS 82 1HG LYS 82 14.981 9.082 -11.679
667 HG3 LYS 82 2HG LYS 82 14.090 10.149 -12.768
668 HD2 LYS 82 1HD LYS 82 12.997 9.802 -10.037
669 HD3 LYS 82 2HD LYS 82 14.499 10.717 -10.185
670 HE2 LYS 82 1HE LYS 82 11.885 11.634 -10.612
671 HE3 LYS 82 2HE LYS 82 13.391 12.496 -10.923
672 HZ1 LYS 82 1HZ LYS 82 13.383 11.850 -13.148
673 HZ2 LYS 82 2HZ LYS 82 11.768 12.245 -12.841
674 HZ3 LYS 82 3HZ LYS 82 12.244 10.623 -12.902
675 H ASN 83 H ASN 83 13.026 7.967 -8.514
676 HA ASN 83 HA ASN 83 15.962 7.922 -8.465
677 HB2 ASN 83 1HB ASN 83 14.905 9.998 -7.681
678 HB3 ASN 83 2HB ASN 83 14.009 9.089 -6.468
679 HD21 ASN 83 2HD2 ASN 83 15.249 10.917 -5.292
680 HD22 ASN 83 1HD2 ASN 83 16.759 10.443 -4.599
681 H LEU 84 H LEU 84 13.200 6.935 -6.435
682 HA LEU 84 HA LEU 84 14.709 5.266 -4.734
683 HB2 LEU 84 1HB LEU 84 12.140 6.204 -4.784
684 HB3 LEU 84 2HB LEU 84 11.916 4.491 -5.133
685 HG LEU 84 HG LEU 84 11.767 4.360 -2.886
686 HD11 LEU 84 1HD1 LEU 84 13.724 3.539 -1.936
687 HD12 LEU 84 2HD1 LEU 84 14.748 4.651 -2.843
688 HD13 LEU 84 3HD1 LEU 84 13.974 3.297 -3.666
689 HD21 LEU 84 1HD2 LEU 84 13.690 6.631 -2.455
690 HD22 LEU 84 2HD2 LEU 84 12.501 5.972 -1.332
691 HD23 LEU 84 3HD2 LEU 84 11.969 6.886 -2.744
692 H VAL 85 H VAL 85 15.983 3.819 -5.822
693 HA VAL 85 HA VAL 85 15.259 2.276 -8.030
694 HB VAL 85 HB VAL 85 17.337 1.960 -5.900
695 HG11 VAL 85 1HG1 VAL 85 17.115 -0.282 -6.133
696 HG12 VAL 85 2HG1 VAL 85 16.332 -0.153 -7.709
697 HG13 VAL 85 3HG1 VAL 85 18.084 0.014 -7.576
698 HG21 VAL 85 1HG2 VAL 85 17.177 3.166 -8.447
699 HG22 VAL 85 2HG2 VAL 85 18.580 3.047 -7.385
700 HG23 VAL 85 3HG2 VAL 85 18.278 1.795 -8.590
701 H THR 86 H THR 86 13.160 1.471 -7.705
702 HA THR 86 HA THR 86 12.803 -0.510 -5.577
703 HB THR 86 HB THR 86 10.451 -0.407 -6.002
704 HG1 THR 86 1HG THR 86 10.100 -0.240 -8.121
705 HG21 THR 86 1HG2 THR 86 10.427 1.469 -4.799
706 HG22 THR 86 2HG2 THR 86 10.515 2.391 -6.300
707 HG23 THR 86 3HG2 THR 86 11.994 1.948 -5.449
708 H LEU 87 H LEU 87 11.864 -2.589 -6.068
709 HA LEU 87 HA LEU 87 12.043 -3.494 -8.832
710 HB2 LEU 87 1HB LEU 87 13.366 -5.232 -6.829
711 HB3 LEU 87 2HB LEU 87 13.690 -5.042 -8.551
712 HG LEU 87 HG LEU 87 14.660 -2.743 -7.886
713 HD11 LEU 87 1HD1 LEU 87 15.720 -3.107 -5.500
714 HD12 LEU 87 2HD1 LEU 87 14.253 -4.053 -5.250
715 HD13 LEU 87 3HD1 LEU 87 14.138 -2.352 -5.700
716 HD21 LEU 87 1HD2 LEU 87 15.816 -5.448 -7.638
717 HD22 LEU 87 2HD2 LEU 87 16.761 -4.128 -6.948
718 HD23 LEU 87 3HD2 LEU 87 16.305 -4.090 -8.652
719 H ALA 88 H ALA 88 11.691 -4.789 -5.524
720 HA ALA 88 HA ALA 88 10.168 -6.967 -5.893
721 HB1 ALA 88 1HB ALA 88 10.271 -6.771 -3.678
722 HB2 ALA 88 2HB ALA 88 10.430 -5.016 -3.765
723 HB3 ALA 88 3HB ALA 88 8.831 -5.759 -3.794
724 H THR 89 H THR 89 8.797 -6.989 -7.638
725 HA THR 89 HA THR 89 6.998 -5.067 -8.447
726 HB THR 89 HB THR 89 5.978 -6.670 -9.787
727 HG1 THR 89 1HG THR 89 6.188 -9.002 -9.082
728 HG21 THR 89 1HG2 THR 89 8.653 -6.646 -9.727
729 HG22 THR 89 2HG2 THR 89 7.736 -7.681 -10.822
730 HG23 THR 89 3HG2 THR 89 8.382 -8.340 -9.320
731 H1 SER 115 H SER 115 2.078 26.276 14.467
732 HA SER 115 HA SER 115 2.321 27.115 11.651
733 HB2 SER 115 1HB SER 115 1.262 28.815 13.143
734 HB3 SER 115 2HB SER 115 2.743 28.843 14.101
735 HG SER 115 HG SER 115 2.202 29.977 11.656
736 H GLN 116 H GLN 116 3.881 25.627 14.178
737 HA GLN 116 HA GLN 116 6.440 25.849 12.837
738 HB2 GLN 116 1HB GLN 116 6.562 27.725 14.372
739 HB3 GLN 116 2HB GLN 116 6.078 26.697 15.715
740 HG2 GLN 116 1HG GLN 116 8.170 26.085 16.089
741 HG3 GLN 116 2HG GLN 116 8.393 25.612 14.405
742 HE21 GLN 116 2HE2 GLN 116 8.449 27.702 12.938
743 HE22 GLN 116 1HE2 GLN 116 9.591 28.889 13.460
744 H GLU 117 H GLU 117 6.325 23.665 12.416
745 HA GLU 117 HA GLU 117 6.448 21.903 14.776
746 HB2 GLU 117 1HB GLU 117 4.961 21.661 12.229
747 HB3 GLU 117 2HB GLU 117 5.738 20.193 12.807
748 HG2 GLU 117 1HG GLU 117 3.876 19.891 13.986
749 HG3 GLU 117 2HG GLU 117 4.530 21.117 15.070
750 H THR 118 H THR 118 8.169 20.594 14.968
751 HA THR 118 HA THR 118 10.450 21.003 13.349
752 HB THR 118 HB THR 118 9.889 18.826 15.371
753 HG1 THR 118 1HG THR 118 9.922 20.975 16.213
754 HG21 THR 118 1HG2 THR 118 11.672 18.151 13.851
755 HG22 THR 118 2HG2 THR 118 12.332 18.539 15.440
756 HG23 THR 118 3HG2 THR 118 12.496 19.687 14.112
757 H PHE 119 H PHE 119 11.583 19.468 12.043
758 HA PHE 119 HA PHE 119 10.224 18.344 9.984
759 HB2 PHE 119 1HB PHE 119 12.868 18.432 10.744
760 HB3 PHE 119 2HB PHE 119 12.532 16.704 10.743
761 HD1 PHE 119 HD1 PHE 119 10.314 17.235 8.485
762 HD2 PHE 119 HD2 PHE 119 14.474 18.027 8.911
763 HE1 PHE 119 HE1 PHE 119 10.570 17.188 6.039
764 HE2 PHE 119 HE2 PHE 119 14.737 17.983 6.466
765 HZ PHE 119 HZ PHE 119 12.784 17.563 5.026
766 H SER 120 H SER 120 11.378 16.519 12.823
767 HA SER 120 HA SER 120 10.237 14.069 12.169
768 HB2 SER 120 1HB SER 120 11.350 15.319 14.575
769 HB3 SER 120 2HB SER 120 10.116 14.108 14.923
770 HG SER 120 HG SER 120 12.655 13.800 13.919
771 H ASP 121 H ASP 121 8.779 16.954 13.391
772 HA ASP 121 HA ASP 121 6.407 15.743 14.424
773 HB2 ASP 121 1HB ASP 121 6.724 18.600 13.496
774 HB3 ASP 121 2HB ASP 121 5.567 17.973 14.667
775 H LEU 122 H LEU 122 7.073 17.613 11.462
776 HA LEU 122 HA LEU 122 4.512 16.877 10.338
777 HB2 LEU 122 1HB LEU 122 6.795 18.602 9.489
778 HB3 LEU 122 2HB LEU 122 5.619 18.070 8.288
779 HG LEU 122 HG LEU 122 4.846 19.555 10.792
780 HD11 LEU 122 1HD1 LEU 122 6.055 21.223 9.834
781 HD12 LEU 122 2HD1 LEU 122 4.559 21.415 8.922
782 HD13 LEU 122 3HD1 LEU 122 5.918 20.546 8.211
783 HD21 LEU 122 1HD2 LEU 122 3.435 18.362 8.552
784 HD22 LEU 122 2HD2 LEU 122 3.052 20.072 8.755
785 HD23 LEU 122 3HD2 LEU 122 2.817 18.951 10.096
786 H TRP 123 H TRP 123 7.924 16.377 9.433
787 HA TRP 123 HA TRP 123 7.814 14.876 7.231
788 HB2 TRP 123 1HB TRP 123 9.831 15.362 8.759
789 HB3 TRP 123 2HB TRP 123 9.421 13.847 9.560
790 HD1 TRP 123 HD1 TRP 123 10.861 11.931 8.696
791 HE1 TRP 123 HE1 TRP 123 11.913 11.270 6.442
792 HE3 TRP 123 HE3 TRP 123 9.248 15.868 5.861
793 HZ2 TRP 123 HZ2 TRP 123 12.043 12.284 3.811
794 HZ3 TRP 123 HZ3 TRP 123 9.880 15.947 3.485
795 HH2 TRP 123 HH2 TRP 123 11.249 14.192 2.483
796 H LYS 124 H LYS 124 7.427 13.435 10.472
797 HA LYS 124 HA LYS 124 6.932 10.847 9.899
798 HB2 LYS 124 1HB LYS 124 6.784 12.102 12.154
799 HB3 LYS 124 2HB LYS 124 5.080 12.302 11.769
800 HG2 LYS 124 1HG LYS 124 4.750 9.928 11.725
801 HG3 LYS 124 2HG LYS 124 6.482 9.642 11.910
802 HD2 LYS 124 1HD LYS 124 6.351 10.841 14.108
803 HD3 LYS 124 2HD LYS 124 4.595 10.856 13.924
804 HE2 LYS 124 1HE LYS 124 4.724 8.918 15.067
805 HE3 LYS 124 2HE LYS 124 5.103 8.246 13.482
806 HZ1 LYS 124 1HZ LYS 124 7.124 9.144 15.464
807 HZ2 LYS 124 2HZ LYS 124 7.437 8.394 13.980
808 HZ3 LYS 124 3HZ LYS 124 6.664 7.534 15.216
809 H LEU 125 H LEU 125 4.575 13.479 9.597
810 HA LEU 125 HA LEU 125 2.354 11.954 8.873
811 HB2 LEU 125 1HB LEU 125 2.684 14.523 9.359
812 HB3 LEU 125 2HB LEU 125 2.806 14.610 7.603
813 HG LEU 125 HG LEU 125 0.466 13.169 8.706
814 HD11 LEU 125 1HD1 LEU 125 0.970 16.089 9.100
815 HD12 LEU 125 2HD1 LEU 125 0.258 14.915 10.207
816 HD13 LEU 125 3HD1 LEU 125 -0.667 15.495 8.822
817 HD21 LEU 125 1HD2 LEU 125 1.268 13.998 6.230
818 HD22 LEU 125 2HD2 LEU 125 0.141 15.271 6.699
819 HD23 LEU 125 3HD2 LEU 125 -0.388 13.588 6.679
820 H LEU 126 H LEU 126 5.012 13.205 6.928
821 HA LEU 126 HA LEU 126 4.106 12.857 4.374
822 HB2 LEU 126 1HB LEU 126 6.437 13.560 5.320
823 HB3 LEU 126 2HB LEU 126 6.831 11.859 5.083
824 HG LEU 126 HG LEU 126 6.635 12.023 2.753
825 HD11 LEU 126 1HD1 LEU 126 5.843 14.277 1.756
826 HD12 LEU 126 2HD1 LEU 126 5.076 14.509 3.327
827 HD13 LEU 126 3HD1 LEU 126 4.643 13.119 2.332
828 HD21 LEU 126 1HD2 LEU 126 8.213 13.690 2.154
829 HD22 LEU 126 2HD2 LEU 126 8.619 13.173 3.791
830 HD23 LEU 126 3HD2 LEU 126 7.772 14.699 3.532
831 HA PRO 127 HA PRO 127 3.081 8.470 4.607
832 HB2 PRO 127 1HB PRO 127 1.620 8.470 2.319
833 HB3 PRO 127 2HB PRO 127 0.980 9.034 3.867
834 HG2 PRO 127 1HG PRO 127 2.070 10.623 1.576
835 HG3 PRO 127 2HG PRO 127 0.634 10.933 2.570
836 HD2 PRO 127 1HD PRO 127 2.983 12.223 2.961
837 HD3 PRO 127 2HD PRO 127 1.867 11.846 4.290
838 H GLU 128 H GLU 128 3.662 6.639 3.370
839 HA GLU 128 HA GLU 128 5.850 7.151 1.493
840 HB2 GLU 128 1HB GLU 128 5.976 4.498 1.853
841 HB3 GLU 128 2HB GLU 128 6.741 5.646 2.943
842 HG2 GLU 128 1HG GLU 128 5.111 5.383 4.572
843 HG3 GLU 128 2HG GLU 128 3.945 4.710 3.434
844 H ASN 129 H ASN 129 2.687 5.694 1.713
845 HA ASN 129 HA ASN 129 2.799 4.296 -0.768
846 HB2 ASN 129 1HB ASN 129 1.215 3.585 0.907
847 HB3 ASN 129 2HB ASN 129 0.465 5.178 0.940
848 HD21 ASN 129 2HD2 ASN 129 -1.305 3.390 0.601
849 HD22 ASN 129 1HD2 ASN 129 -1.794 3.186 -1.044
Start of MODEL 11
1 H1 GLN 1 H GLN 1 1.478 1.788 3.237
2 HA GLN 1 HA GLN 1 1.664 -0.446 2.151
3 HB2 GLN 1 1HB GLN 1 0.769 1.112 -0.008
4 HB3 GLN 1 2HB GLN 1 2.398 0.607 -0.434
5 HG2 GLN 1 1HG GLN 1 0.198 -1.253 0.436
6 HG3 GLN 1 2HG GLN 1 0.648 -0.931 -1.238
7 HE21 GLN 1 2HE2 GLN 1 0.703 -3.467 -0.497
8 HE22 GLN 1 1HE2 GLN 1 2.320 -4.035 -0.281
9 H ILE 2 H ILE 2 3.656 -1.266 2.365
10 HA ILE 2 HA ILE 2 5.929 0.594 2.115
11 HB ILE 2 HB ILE 2 5.968 -1.883 3.816
12 HG12 ILE 2 1HG1 ILE 2 4.071 -0.457 4.539
13 HG13 ILE 2 2HG1 ILE 2 5.350 -0.540 5.746
14 HG21 ILE 2 1HG2 ILE 2 8.010 -0.396 3.052
15 HG22 ILE 2 2HG2 ILE 2 7.479 0.609 4.400
16 HG23 ILE 2 3HG2 ILE 2 7.924 -1.075 4.677
17 HD11 ILE 2 1HD1 ILE 2 5.641 1.693 3.897
18 HD12 ILE 2 2HD1 ILE 2 4.157 1.740 4.851
19 HD13 ILE 2 3HD1 ILE 2 5.722 1.652 5.658
20 H ASN 3 H ASN 3 7.206 0.183 0.447
21 HA ASN 3 HA ASN 3 7.375 -2.578 -0.559
22 HB2 ASN 3 1HB ASN 3 7.254 0.053 -1.878
23 HB3 ASN 3 2HB ASN 3 8.458 -1.046 -2.546
24 HD21 ASN 3 2HD2 ASN 3 5.503 -2.121 -1.042
25 HD22 ASN 3 1HD2 ASN 3 4.753 -2.710 -2.483
26 H GLN 4 H GLN 4 9.571 -2.811 -1.875
27 HA GLN 4 HA GLN 4 11.678 -2.287 0.084
28 HB2 GLN 4 1HB GLN 4 11.894 -4.038 -2.358
29 HB3 GLN 4 2HB GLN 4 12.895 -4.066 -0.912
30 HG2 GLN 4 1HG GLN 4 10.118 -5.093 -1.304
31 HG3 GLN 4 2HG GLN 4 11.538 -5.924 -0.671
32 HE21 GLN 4 2HE2 GLN 4 8.776 -4.080 0.066
33 HE22 GLN 4 1HE2 GLN 4 9.016 -3.968 1.773
34 H VAL 5 H VAL 5 13.947 -2.096 -1.069
35 HA VAL 5 HA VAL 5 13.927 -0.497 -3.471
36 HB VAL 5 HB VAL 5 14.807 1.516 -2.584
37 HG11 VAL 5 1HG1 VAL 5 12.551 0.638 -0.783
38 HG12 VAL 5 2HG1 VAL 5 13.025 2.305 -1.119
39 HG13 VAL 5 3HG1 VAL 5 12.376 1.294 -2.411
40 HG21 VAL 5 1HG2 VAL 5 14.699 1.156 0.233
41 HG22 VAL 5 2HG2 VAL 5 15.673 -0.145 -0.453
42 HG23 VAL 5 3HG2 VAL 5 16.096 1.536 -0.775
43 H ARG 6 H ARG 6 16.243 0.351 -3.892
44 HA ARG 6 HA ARG 6 18.365 -1.167 -2.667
45 HB2 ARG 6 1HB ARG 6 17.088 -2.469 -4.671
46 HB3 ARG 6 2HB ARG 6 18.301 -1.588 -5.590
47 HG2 ARG 6 1HG ARG 6 20.075 -2.646 -4.465
48 HG3 ARG 6 2HG ARG 6 19.006 -3.267 -3.205
49 HD2 ARG 6 1HD ARG 6 18.310 -5.008 -4.470
50 HD3 ARG 6 2HD ARG 6 18.356 -4.075 -5.965
51 HE ARG 6 HE ARG 6 20.477 -4.845 -6.335
52 HH11 ARG 6 1HH1 ARG 6 19.643 -5.375 -2.996
53 HH12 ARG 6 2HH1 ARG 6 21.066 -6.302 -2.652
54 HH21 ARG 6 1HH2 ARG 6 22.354 -6.064 -5.894
55 HH22 ARG 6 2HH2 ARG 6 22.608 -6.692 -4.301
56 HA PRO 7 HA PRO 7 19.597 2.985 -4.245
57 HB2 PRO 7 1HB PRO 7 21.065 3.619 -2.050
58 HB3 PRO 7 2HB PRO 7 19.320 3.885 -2.149
59 HG2 PRO 7 1HG PRO 7 20.825 1.648 -0.847
60 HG3 PRO 7 2HG PRO 7 19.420 2.549 -0.248
61 HD2 PRO 7 1HD PRO 7 19.207 0.093 -1.367
62 HD3 PRO 7 2HD PRO 7 17.936 1.324 -1.515
63 H LYS 8 H LYS 8 21.154 2.809 -5.728
64 HA LYS 8 HA LYS 8 23.338 1.003 -5.519
65 HB2 LYS 8 1HB LYS 8 23.182 3.348 -7.405
66 HB3 LYS 8 2HB LYS 8 24.029 1.825 -7.638
67 HG2 LYS 8 1HG LYS 8 21.556 0.874 -7.386
68 HG3 LYS 8 2HG LYS 8 21.169 2.484 -7.996
69 HD2 LYS 8 1HD LYS 8 23.139 1.822 -9.695
70 HD3 LYS 8 2HD LYS 8 22.512 0.212 -9.332
71 HE2 LYS 8 1HE LYS 8 20.208 1.188 -9.837
72 HE3 LYS 8 2HE LYS 8 21.069 2.558 -10.536
73 HZ1 LYS 8 1HZ LYS 8 22.221 0.967 -12.006
74 HZ2 LYS 8 2HZ LYS 8 20.549 1.003 -12.257
75 HZ3 LYS 8 3HZ LYS 8 21.248 -0.276 -11.399
76 H LEU 9 H LEU 9 25.501 2.463 -6.492
77 HA LEU 9 HA LEU 9 26.784 3.283 -4.183
78 HB2 LEU 9 1HB LEU 9 27.271 3.658 -7.088
79 HB3 LEU 9 2HB LEU 9 28.206 4.643 -5.966
80 HG LEU 9 HG LEU 9 28.219 1.656 -6.289
81 HD11 LEU 9 1HD1 LEU 9 29.892 2.313 -7.636
82 HD12 LEU 9 2HD1 LEU 9 30.785 2.491 -6.126
83 HD13 LEU 9 3HD1 LEU 9 30.027 3.897 -6.873
84 HD21 LEU 9 1HD2 LEU 9 28.760 3.264 -3.888
85 HD22 LEU 9 2HD2 LEU 9 30.019 2.108 -4.320
86 HD23 LEU 9 3HD2 LEU 9 28.367 1.552 -4.047
87 HA PRO 10 HA PRO 10 25.918 7.889 -5.345
88 HB2 PRO 10 1HB PRO 10 24.166 8.363 -7.364
89 HB3 PRO 10 2HB PRO 10 25.903 8.163 -7.626
90 HG2 PRO 10 1HG PRO 10 23.693 6.175 -7.982
91 HG3 PRO 10 2HG PRO 10 25.087 6.497 -9.029
92 HD2 PRO 10 1HD PRO 10 25.009 4.408 -7.309
93 HD3 PRO 10 2HD PRO 10 26.517 5.249 -7.721
94 H LEU 11 H LEU 11 23.745 5.415 -4.836
95 HA LEU 11 HA LEU 11 21.645 7.263 -3.916
96 HB2 LEU 11 1HB LEU 11 21.583 4.628 -5.207
97 HB3 LEU 11 2HB LEU 11 20.483 4.805 -3.843
98 HG LEU 11 HG LEU 11 19.136 6.284 -4.942
99 HD11 LEU 11 1HD1 LEU 11 21.619 7.131 -6.383
100 HD12 LEU 11 2HD1 LEU 11 20.535 8.086 -5.372
101 HD13 LEU 11 3HD1 LEU 11 20.023 7.582 -6.982
102 HD21 LEU 11 1HD2 LEU 11 20.431 4.762 -7.202
103 HD22 LEU 11 2HD2 LEU 11 18.873 5.584 -7.283
104 HD23 LEU 11 3HD2 LEU 11 19.089 4.209 -6.199
105 H LEU 12 H LEU 12 23.989 4.964 -2.958
106 HA LEU 12 HA LEU 12 22.779 4.250 -0.456
107 HB2 LEU 12 1HB LEU 12 24.833 3.253 -1.994
108 HB3 LEU 12 2HB LEU 12 25.675 3.966 -0.619
109 HG LEU 12 HG LEU 12 23.885 1.597 -0.739
110 HD11 LEU 12 1HD1 LEU 12 26.245 2.200 1.025
111 HD12 LEU 12 2HD1 LEU 12 26.395 1.527 -0.598
112 HD13 LEU 12 3HD1 LEU 12 25.537 0.628 0.654
113 HD21 LEU 12 1HD2 LEU 12 22.585 2.723 0.814
114 HD22 LEU 12 2HD2 LEU 12 23.966 3.578 1.503
115 HD23 LEU 12 3HD2 LEU 12 23.738 1.859 1.832
116 H LYS 13 H LYS 13 25.236 6.551 -1.523
117 HA LYS 13 HA LYS 13 26.016 7.428 1.047
118 HB2 LYS 13 1HB LYS 13 27.230 9.104 -0.042
119 HB3 LYS 13 2HB LYS 13 27.181 7.799 -1.220
120 HG2 LYS 13 1HG LYS 13 24.970 9.177 -1.925
121 HG3 LYS 13 2HG LYS 13 25.989 10.482 -1.315
122 HD2 LYS 13 1HD LYS 13 27.589 8.767 -2.930
123 HD3 LYS 13 2HD LYS 13 26.120 9.165 -3.824
124 HE2 LYS 13 1HE LYS 13 26.638 11.378 -3.953
125 HE3 LYS 13 2HE LYS 13 27.492 11.380 -2.410
126 HZ1 LYS 13 1HZ LYS 13 29.205 11.612 -3.890
127 HZ2 LYS 13 2HZ LYS 13 28.480 10.651 -5.078
128 HZ3 LYS 13 3HZ LYS 13 29.182 9.929 -3.719
129 H ILE 14 H ILE 14 23.327 8.211 -1.008
130 HA ILE 14 HA ILE 14 22.599 10.697 0.060
131 HB ILE 14 HB ILE 14 20.715 8.576 -0.972
132 HG12 ILE 14 1HG1 ILE 14 22.601 9.091 -2.533
133 HG13 ILE 14 2HG1 ILE 14 21.017 9.521 -3.170
134 HG21 ILE 14 1HG2 ILE 14 19.358 10.575 -1.623
135 HG22 ILE 14 2HG2 ILE 14 19.509 10.321 0.115
136 HG23 ILE 14 3HG2 ILE 14 20.475 11.563 -0.682
137 HD11 ILE 14 1HD1 ILE 14 23.134 11.353 -2.089
138 HD12 ILE 14 2HD1 ILE 14 22.474 11.285 -3.724
139 HD13 ILE 14 3HD1 ILE 14 21.475 11.869 -2.393
140 H LEU 15 H LEU 15 21.324 7.464 0.876
141 HA LEU 15 HA LEU 15 19.847 8.409 3.119
142 HB2 LEU 15 1HB LEU 15 20.735 5.588 2.550
143 HB3 LEU 15 2HB LEU 15 19.408 6.095 3.592
144 HG LEU 15 HG LEU 15 18.130 5.584 1.824
145 HD11 LEU 15 1HD1 LEU 15 19.212 8.035 0.480
146 HD12 LEU 15 2HD1 LEU 15 18.251 8.139 1.955
147 HD13 LEU 15 3HD1 LEU 15 17.559 7.418 0.501
148 HD21 LEU 15 1HD2 LEU 15 19.476 6.023 -0.563
149 HD22 LEU 15 2HD2 LEU 15 19.232 4.473 0.242
150 HD23 LEU 15 3HD2 LEU 15 20.710 5.393 0.529
151 H HIS 16 H HIS 16 23.004 6.888 2.708
152 HA HIS 16 HA HIS 16 23.629 6.353 5.358
153 HB2 HIS 16 1HB HIS 16 25.288 7.037 2.955
154 HB3 HIS 16 2HB HIS 16 26.055 6.860 4.530
155 HD1 HIS 16 HD1 HIS 16 27.310 4.792 3.419
156 HD2 HIS 16 HD2 HIS 16 23.210 4.353 3.929
157 HE1 HIS 16 HE1 HIS 16 26.862 2.329 3.178
158 H ALA 17 H ALA 17 24.093 9.348 3.513
159 HA ALA 17 HA ALA 17 25.399 10.812 5.517
160 HB1 ALA 17 1HB ALA 17 25.588 11.985 3.610
161 HB2 ALA 17 2HB ALA 17 24.038 11.418 2.985
162 HB3 ALA 17 3HB ALA 17 24.089 12.744 4.147
163 H ALA 18 H ALA 18 22.013 10.137 4.960
164 HA ALA 18 HA ALA 18 21.073 12.088 6.858
165 HB1 ALA 18 1HB ALA 18 19.048 10.202 6.410
166 HB2 ALA 18 2HB ALA 18 19.226 11.791 5.664
167 HB3 ALA 18 3HB ALA 18 19.909 10.367 4.879
168 H GLY 19 H GLY 19 22.518 9.081 7.130
169 HA2 GLY 19 1HA GLY 19 23.004 8.472 9.494
170 HA3 GLY 19 2HA GLY 19 21.279 8.653 9.779
171 H ALA 20 H ALA 20 21.329 7.370 6.831
172 HA ALA 20 HA ALA 20 20.495 4.807 7.677
173 HB1 ALA 20 1HB ALA 20 21.392 5.431 4.882
174 HB2 ALA 20 2HB ALA 20 20.131 4.321 5.419
175 HB3 ALA 20 3HB ALA 20 19.880 6.063 5.534
176 H GLN 21 H GLN 21 21.522 2.829 6.382
177 HA GLN 21 HA GLN 21 24.245 2.672 5.890
178 HB2 GLN 21 1HB GLN 21 23.904 3.140 8.560
179 HB3 GLN 21 2HB GLN 21 23.963 1.383 8.518
180 HG2 GLN 21 1HG GLN 21 26.170 1.634 8.621
181 HG3 GLN 21 2HG GLN 21 26.062 2.057 6.913
182 HE21 GLN 21 2HE2 GLN 21 25.488 4.443 6.563
183 HE22 GLN 21 1HE2 GLN 21 26.377 5.574 7.520
184 H GLY 22 H GLY 22 24.073 1.058 4.474
185 HA2 GLY 22 1HA GLY 22 23.959 -1.569 4.940
186 HA3 GLY 22 2HA GLY 22 22.252 -1.154 4.972
187 H GLU 23 H GLU 23 21.727 -2.349 3.154
188 HA GLU 23 HA GLU 23 22.596 -1.144 0.624
189 HB2 GLU 23 1HB GLU 23 23.272 -3.769 1.522
190 HB3 GLU 23 2HB GLU 23 22.163 -3.917 0.167
191 HG2 GLU 23 1HG GLU 23 23.616 -2.548 -1.207
192 HG3 GLU 23 2HG GLU 23 24.712 -2.317 0.154
193 H MET 24 H MET 24 20.267 -3.188 2.321
194 HA MET 24 HA MET 24 18.272 -2.569 0.251
195 HB2 MET 24 1HB MET 24 17.060 -4.432 1.811
196 HB3 MET 24 2HB MET 24 18.009 -4.807 0.379
197 HG2 MET 24 1HG MET 24 19.239 -4.661 3.109
198 HG3 MET 24 2HG MET 24 18.492 -6.132 2.490
199 HE1 MET 24 1HE MET 24 22.020 -4.681 2.936
200 HE2 MET 24 2HE MET 24 21.190 -6.096 3.582
201 HE3 MET 24 3HE MET 24 22.521 -6.299 2.443
202 H PHE 25 H PHE 25 16.256 -1.739 0.815
203 HA PHE 25 HA PHE 25 15.558 -1.187 3.540
204 HB2 PHE 25 1HB PHE 25 16.263 1.150 1.752
205 HB3 PHE 25 2HB PHE 25 15.581 1.257 3.371
206 HD1 PHE 25 HD2 PHE 25 18.567 0.272 1.443
207 HD2 PHE 25 HD1 PHE 25 16.946 1.104 5.290
208 HE1 PHE 25 HE2 PHE 25 20.836 0.286 2.392
209 HE2 PHE 25 HE1 PHE 25 19.214 1.120 6.245
210 HZ PHE 25 HZ PHE 25 21.162 0.710 4.796
211 H THR 26 H THR 26 13.480 -0.029 3.705
212 HA THR 26 HA THR 26 11.763 -0.749 1.447
213 HB THR 26 HB THR 26 9.988 -0.008 3.316
214 HG1 THR 26 1HG THR 26 12.068 -1.124 4.888
215 HG21 THR 26 1HG2 THR 26 9.465 -2.184 3.256
216 HG22 THR 26 2HG2 THR 26 11.009 -2.654 3.968
217 HG23 THR 26 3HG2 THR 26 10.883 -2.388 2.229
218 H VAL 27 H VAL 27 9.883 0.726 1.017
219 HA VAL 27 HA VAL 27 10.714 3.193 0.094
220 HB VAL 27 HB VAL 27 8.562 1.919 -0.466
221 HG11 VAL 27 1HG1 VAL 27 7.728 1.806 1.852
222 HG12 VAL 27 2HG1 VAL 27 7.519 3.558 1.841
223 HG13 VAL 27 3HG1 VAL 27 6.568 2.549 0.751
224 HG21 VAL 27 1HG2 VAL 27 8.674 4.905 -0.132
225 HG22 VAL 27 2HG2 VAL 27 8.997 3.955 -1.582
226 HG23 VAL 27 3HG2 VAL 27 7.350 4.090 -0.965
227 H LYS 28 H LYS 28 9.041 2.437 3.132
228 HA LYS 28 HA LYS 28 8.854 5.108 4.040
229 HB2 LYS 28 1HB LYS 28 7.898 4.234 5.920
230 HB3 LYS 28 2HB LYS 28 7.729 2.840 4.863
231 HG2 LYS 28 1HG LYS 28 10.037 3.228 6.752
232 HG3 LYS 28 2HG LYS 28 8.570 2.332 7.157
233 HD2 LYS 28 1HD LYS 28 9.427 1.331 4.680
234 HD3 LYS 28 2HD LYS 28 10.880 1.476 5.672
235 HE2 LYS 28 1HE LYS 28 9.597 -0.720 5.805
236 HE3 LYS 28 2HE LYS 28 10.022 0.055 7.330
237 HZ1 LYS 28 1HZ LYS 28 7.890 0.292 7.862
238 HZ2 LYS 28 2HZ LYS 28 7.534 -0.768 6.593
239 HZ3 LYS 28 3HZ LYS 28 7.475 0.903 6.340
240 H GLU 29 H GLU 29 11.365 2.688 4.226
241 HA GLU 29 HA GLU 29 12.912 4.006 6.232
242 HB2 GLU 29 1HB GLU 29 13.083 1.586 4.666
243 HB3 GLU 29 2HB GLU 29 14.634 2.414 4.686
244 HG2 GLU 29 1HG GLU 29 13.333 2.250 7.299
245 HG3 GLU 29 2HG GLU 29 13.747 0.689 6.592
246 H VAL 30 H VAL 30 13.242 3.719 2.697
247 HA VAL 30 HA VAL 30 15.492 5.365 2.430
248 HB VAL 30 HB VAL 30 13.268 4.852 0.451
249 HG11 VAL 30 1HG1 VAL 30 15.320 6.763 0.329
250 HG12 VAL 30 2HG1 VAL 30 15.809 5.446 -0.739
251 HG13 VAL 30 3HG1 VAL 30 14.252 6.242 -0.974
252 HG21 VAL 30 1HG2 VAL 30 14.710 3.161 -0.468
253 HG22 VAL 30 2HG2 VAL 30 15.998 3.586 0.659
254 HG23 VAL 30 3HG2 VAL 30 14.509 2.854 1.257
255 H MET 31 H MET 31 12.041 6.126 2.427
256 HA MET 31 HA MET 31 12.340 8.860 1.731
257 HB2 MET 31 1HB MET 31 10.104 8.820 1.670
258 HB3 MET 31 2HB MET 31 10.213 7.112 2.074
259 HG2 MET 31 1HG MET 31 8.701 7.997 3.611
260 HG3 MET 31 2HG MET 31 10.213 7.842 4.504
261 HE1 MET 31 1HE MET 31 7.660 10.995 3.138
262 HE2 MET 31 2HE MET 31 9.113 11.647 2.380
263 HE3 MET 31 3HE MET 31 8.580 10.008 2.001
264 H HIS 32 H HIS 32 12.319 7.112 4.776
265 HA HIS 32 HA HIS 32 12.047 9.296 6.517
266 HB2 HIS 32 1HB HIS 32 12.060 6.692 6.946
267 HB3 HIS 32 2HB HIS 32 13.769 6.969 7.268
268 HD1 HIS 32 HD1 HIS 32 10.747 6.693 9.024
269 HD2 HIS 32 HD2 HIS 32 13.940 9.343 9.229
270 HE1 HIS 32 HE1 HIS 32 10.610 7.735 11.309
271 H TYR 33 H TYR 33 14.793 8.040 4.769
272 HA TYR 33 HA TYR 33 16.764 9.496 6.250
273 HB2 TYR 33 1HB TYR 33 16.865 8.114 3.564
274 HB3 TYR 33 2HB TYR 33 18.261 8.863 4.331
275 HD1 TYR 33 HD2 TYR 33 18.240 8.085 7.044
276 HD2 TYR 33 HD1 TYR 33 16.981 5.818 3.671
277 HE1 TYR 33 HE2 TYR 33 18.678 6.007 8.284
278 HE2 TYR 33 HE1 TYR 33 17.415 3.734 4.902
279 HH TYR 33 HH TYR 33 18.323 2.840 6.748
280 H LEU 34 H LEU 34 14.791 10.103 3.434
281 HA LEU 34 HA LEU 34 16.128 12.157 2.187
282 HB2 LEU 34 1HB LEU 34 13.431 11.173 2.300
283 HB3 LEU 34 2HB LEU 34 13.432 12.934 2.224
284 HG LEU 34 HG LEU 34 13.228 11.979 0.004
285 HD11 LEU 34 1HD1 LEU 34 15.474 12.943 -0.927
286 HD12 LEU 34 2HD1 LEU 34 15.699 13.474 0.739
287 HD13 LEU 34 3HD1 LEU 34 14.287 14.007 -0.172
288 HD21 LEU 34 1HD2 LEU 34 14.768 10.502 -0.956
289 HD22 LEU 34 2HD2 LEU 34 14.506 9.865 0.668
290 HD23 LEU 34 3HD2 LEU 34 15.966 10.787 0.307
291 H GLY 35 H GLY 35 13.693 12.533 4.774
292 HA2 GLY 35 1HA GLY 35 13.890 15.274 5.116
293 HA3 GLY 35 2HA GLY 35 13.459 14.145 6.392
294 H GLN 36 H GLN 36 15.774 12.746 6.765
295 HA GLN 36 HA GLN 36 17.265 14.456 8.404
296 HB2 GLN 36 1HB GLN 36 17.949 11.743 7.266
297 HB3 GLN 36 2HB GLN 36 18.908 12.561 8.493
298 HG2 GLN 36 1HG GLN 36 16.017 12.210 9.028
299 HG3 GLN 36 2HG GLN 36 17.042 10.778 9.092
300 HE21 GLN 36 2HE2 GLN 36 19.253 11.405 10.253
301 HE22 GLN 36 1HE2 GLN 36 19.028 12.125 11.807
302 H TYR 37 H TYR 37 17.855 13.292 5.121
303 HA TYR 37 HA TYR 37 20.457 14.299 4.820
304 HB2 TYR 37 1HB TYR 37 19.458 12.681 3.264
305 HB3 TYR 37 2HB TYR 37 18.322 13.907 2.711
306 HD1 TYR 37 HD1 TYR 37 21.953 13.124 2.904
307 HD2 TYR 37 HD2 TYR 37 18.891 15.336 0.947
308 HE1 TYR 37 HE1 TYR 37 23.570 13.839 1.194
309 HE2 TYR 37 HE2 TYR 37 20.499 16.056 -0.770
310 HH TYR 37 HH TYR 37 23.497 16.176 -0.544
311 H ILE 38 H ILE 38 17.310 15.741 4.026
312 HA ILE 38 HA ILE 38 18.274 18.133 2.931
313 HB ILE 38 HB ILE 38 15.690 17.745 4.446
314 HG12 ILE 38 1HG1 ILE 38 16.131 17.531 1.467
315 HG13 ILE 38 2HG1 ILE 38 16.134 16.133 2.536
316 HG21 ILE 38 1HG2 ILE 38 16.399 19.756 2.316
317 HG22 ILE 38 2HG2 ILE 38 14.876 19.637 3.195
318 HG23 ILE 38 3HG2 ILE 38 16.351 20.095 4.045
319 HD11 ILE 38 1HD1 ILE 38 13.844 18.023 2.058
320 HD12 ILE 38 2HD1 ILE 38 13.984 16.359 1.491
321 HD13 ILE 38 3HD1 ILE 38 13.834 16.694 3.216
322 H MET 39 H MET 39 17.250 17.387 6.257
323 HA MET 39 HA MET 39 17.757 19.939 7.323
324 HB2 MET 39 1HB MET 39 16.907 19.017 9.172
325 HB3 MET 39 2HB MET 39 16.773 17.510 8.277
326 HG2 MET 39 1HG MET 39 18.940 16.803 9.065
327 HG3 MET 39 2HG MET 39 19.178 18.349 9.877
328 HE1 MET 39 1HE MET 39 16.201 18.228 12.455
329 HE2 MET 39 2HE MET 39 16.894 19.210 11.164
330 HE3 MET 39 3HE MET 39 15.574 18.093 10.812
331 H VAL 40 H VAL 40 19.825 17.163 6.774
332 HA VAL 40 HA VAL 40 22.024 18.087 8.327
333 HB VAL 40 HB VAL 40 21.413 15.734 6.994
334 HG11 VAL 40 1HG1 VAL 40 22.334 16.671 4.921
335 HG12 VAL 40 2HG1 VAL 40 23.871 16.955 5.742
336 HG13 VAL 40 3HG1 VAL 40 23.287 15.307 5.506
337 HG21 VAL 40 1HG2 VAL 40 22.606 15.888 9.091
338 HG22 VAL 40 2HG2 VAL 40 23.549 14.937 7.944
339 HG23 VAL 40 3HG2 VAL 40 23.997 16.609 8.281
340 H LYS 41 H LYS 41 21.101 18.394 4.937
341 HA LYS 41 HA LYS 41 23.543 19.787 4.251
342 HB2 LYS 41 1HB LYS 41 21.126 18.853 2.776
343 HB3 LYS 41 2HB LYS 41 22.068 20.160 2.073
344 HG2 LYS 41 1HG LYS 41 23.090 17.424 2.805
345 HG3 LYS 41 2HG LYS 41 22.768 18.025 1.177
346 HD2 LYS 41 1HD LYS 41 24.903 18.671 1.126
347 HD3 LYS 41 2HD LYS 41 24.450 19.933 2.275
348 HE2 LYS 41 1HE LYS 41 25.432 18.879 4.017
349 HE3 LYS 41 2HE LYS 41 24.986 17.276 3.434
350 HZ1 LYS 41 1HZ LYS 41 27.474 18.296 3.373
351 HZ2 LYS 41 2HZ LYS 41 26.942 18.629 1.802
352 HZ3 LYS 41 3HZ LYS 41 26.927 17.039 2.380
353 H GLN 42 H GLN 42 20.507 20.590 5.537
354 HA GLN 42 HA GLN 42 19.585 22.578 6.155
355 HB2 GLN 42 1HB GLN 42 22.394 23.225 5.699
356 HB3 GLN 42 2HB GLN 42 21.328 24.593 5.409
357 HG2 GLN 42 1HG GLN 42 21.488 24.954 7.597
358 HG3 GLN 42 2HG GLN 42 20.360 23.609 7.761
359 HE21 GLN 42 2HE2 GLN 42 21.990 21.485 7.140
360 HE22 GLN 42 1HE2 GLN 42 23.210 21.323 8.352
361 H LEU 43 H LEU 43 18.300 21.851 4.163
362 HA LEU 43 HA LEU 43 18.329 24.054 2.210
363 HB2 LEU 43 1HB LEU 43 18.072 21.109 1.762
364 HB3 LEU 43 2HB LEU 43 17.308 22.241 0.648
365 HG LEU 43 HG LEU 43 19.459 21.479 -0.201
366 HD11 LEU 43 1HD1 LEU 43 19.664 23.470 -1.150
367 HD12 LEU 43 2HD1 LEU 43 20.382 24.129 0.320
368 HD13 LEU 43 3HD1 LEU 43 18.632 24.156 0.105
369 HD21 LEU 43 1HD2 LEU 43 20.856 22.908 2.023
370 HD22 LEU 43 2HD2 LEU 43 21.473 21.680 0.917
371 HD23 LEU 43 3HD2 LEU 43 20.370 21.224 2.217
372 H TYR 44 H TYR 44 16.823 24.615 4.203
373 HA TYR 44 HA TYR 44 14.157 24.531 3.191
374 HB2 TYR 44 1HB TYR 44 13.119 23.402 5.121
375 HB3 TYR 44 2HB TYR 44 14.179 22.321 4.223
376 HD1 TYR 44 HD1 TYR 44 16.739 22.449 5.151
377 HD2 TYR 44 HD2 TYR 44 13.214 23.210 7.410
378 HE1 TYR 44 HE1 TYR 44 17.958 21.919 7.221
379 HE2 TYR 44 HE2 TYR 44 14.424 22.683 9.486
380 HH TYR 44 HH TYR 44 17.869 22.204 9.535
381 H ASP 45 H ASP 45 12.611 25.574 4.844
382 HA ASP 45 HA ASP 45 13.977 27.919 5.908
383 HB2 ASP 45 1HB ASP 45 11.525 27.514 4.604
384 HB3 ASP 45 2HB ASP 45 11.107 27.943 6.261
385 H GLN 46 H GLN 46 14.370 28.217 7.999
386 HA GLN 46 HA GLN 46 13.819 26.237 9.926
387 HB2 GLN 46 1HB GLN 46 14.630 29.118 10.353
388 HB3 GLN 46 2HB GLN 46 14.730 27.835 11.552
389 HG2 GLN 46 1HG GLN 46 16.894 27.979 10.773
390 HG3 GLN 46 2HG GLN 46 16.231 26.646 9.829
391 HE21 GLN 46 2HE2 GLN 46 15.731 26.985 7.642
392 HE22 GLN 46 1HE2 GLN 46 16.426 28.291 6.750
393 H GLN 47 H GLN 47 11.831 28.597 8.622
394 HA GLN 47 HA GLN 47 10.180 28.842 11.026
395 HB2 GLN 47 1HB GLN 47 9.104 30.177 8.704
396 HB3 GLN 47 2HB GLN 47 9.609 30.856 10.245
397 HG2 GLN 47 1HG GLN 47 11.434 30.244 7.931
398 HG3 GLN 47 2HG GLN 47 10.806 31.837 8.349
399 HE21 GLN 47 2HE2 GLN 47 13.542 30.410 8.319
400 HE22 GLN 47 1HE2 GLN 47 14.245 30.887 9.823
401 H GLU 48 H GLU 48 10.259 27.323 7.904
402 HA GLU 48 HA GLU 48 7.797 25.897 8.570
403 HB2 GLU 48 1HB GLU 48 8.283 27.370 5.980
404 HB3 GLU 48 2HB GLU 48 7.045 26.137 6.173
405 HG2 GLU 48 1HG GLU 48 6.058 27.505 8.000
406 HG3 GLU 48 2HG GLU 48 7.223 28.770 7.614
407 H GLN 49 H GLN 49 9.315 24.198 9.028
408 HA GLN 49 HA GLN 49 11.218 23.157 7.323
409 HB2 GLN 49 1HB GLN 49 9.423 21.441 9.032
410 HB3 GLN 49 2HB GLN 49 11.094 21.136 8.578
411 HG2 GLN 49 1HG GLN 49 10.889 23.640 9.961
412 HG3 GLN 49 2HG GLN 49 10.144 22.353 10.908
413 HE21 GLN 49 2HE2 GLN 49 12.588 23.859 11.408
414 HE22 GLN 49 1HE2 GLN 49 13.856 22.692 11.525
415 H HIS 50 H HIS 50 7.821 23.170 6.957
416 HA HIS 50 HA HIS 50 7.757 20.920 5.127
417 HB2 HIS 50 1HB HIS 50 5.400 21.249 5.031
418 HB3 HIS 50 2HB HIS 50 5.868 21.499 6.710
419 HD1 HIS 50 HD1 HIS 50 6.000 24.057 7.493
420 HD2 HIS 50 HD2 HIS 50 4.098 23.354 3.867
421 HE1 HIS 50 HE1 HIS 50 4.688 26.147 7.006
422 H MET 51 H MET 51 9.311 23.469 4.618
423 HA MET 51 HA MET 51 8.246 23.937 1.918
424 HB2 MET 51 1HB MET 51 8.703 25.891 4.050
425 HB3 MET 51 2HB MET 51 9.492 26.314 2.537
426 HG2 MET 51 1HG MET 51 6.674 25.442 2.376
427 HG3 MET 51 2HG MET 51 6.989 27.008 3.120
428 HE1 MET 51 1HE MET 51 9.723 26.091 0.563
429 HE2 MET 51 2HE MET 51 8.474 24.904 0.188
430 HE3 MET 51 3HE MET 51 8.873 26.166 -0.980
431 H VAL 52 H VAL 52 10.153 22.062 2.364
432 HA VAL 52 HA VAL 52 12.787 22.561 2.498
433 HB VAL 52 HB VAL 52 11.506 20.866 0.349
434 HG11 VAL 52 1HG1 VAL 52 13.918 21.425 -0.006
435 HG12 VAL 52 2HG1 VAL 52 14.269 20.621 1.525
436 HG13 VAL 52 3HG1 VAL 52 13.585 19.704 0.182
437 HG21 VAL 52 1HG2 VAL 52 12.649 19.581 2.722
438 HG22 VAL 52 2HG2 VAL 52 11.232 20.579 3.045
439 HG23 VAL 52 3HG2 VAL 52 11.135 19.262 1.876
440 H TYR 53 H TYR 53 14.310 23.684 1.447
441 HA TYR 53 HA TYR 53 13.537 25.004 -1.071
442 HB2 TYR 53 1HB TYR 53 15.160 25.919 1.271
443 HB3 TYR 53 2HB TYR 53 15.504 26.585 -0.322
444 HD1 TYR 53 HD2 TYR 53 13.022 27.050 -1.584
445 HD2 TYR 53 HD1 TYR 53 13.949 27.396 2.554
446 HE1 TYR 53 HE2 TYR 53 11.182 28.659 -1.312
447 HE2 TYR 53 HE1 TYR 53 12.110 29.005 2.838
448 HH TYR 53 HH TYR 53 10.866 30.696 1.135
449 H CYS 54 H CYS 54 14.297 22.799 -1.896
450 HA CYS 54 HA CYS 54 16.763 21.738 -1.887
451 HB2 CYS 54 1HB CYS 54 16.195 20.667 -3.814
452 HB3 CYS 54 2HB CYS 54 14.621 21.371 -3.466
453 HG CYS 54 HG CYS 54 14.665 21.958 -6.032
454 H GLY 55 H GLY 55 15.839 24.674 -3.630
455 HA2 GLY 55 1HA GLY 55 17.105 26.359 -4.538
456 HA3 GLY 55 2HA GLY 55 18.369 25.861 -3.423
457 H GLY 56 H GLY 56 19.798 24.110 -4.100
458 HA2 GLY 56 1HA GLY 56 19.813 23.373 -6.896
459 HA3 GLY 56 2HA GLY 56 21.093 24.489 -6.442
460 H ASP 57 H ASP 57 19.989 22.220 -4.087
461 HA ASP 57 HA ASP 57 22.597 20.977 -4.031
462 HB2 ASP 57 1HB ASP 57 20.676 21.528 -2.115
463 HB3 ASP 57 2HB ASP 57 20.565 19.781 -2.310
464 H LEU 58 H LEU 58 22.510 18.477 -3.555
465 HA LEU 58 HA LEU 58 22.065 17.136 -5.892
466 HB2 LEU 58 1HB LEU 58 21.949 16.094 -3.070
467 HB3 LEU 58 2HB LEU 58 21.962 15.054 -4.493
468 HG LEU 58 HG LEU 58 24.164 16.653 -3.282
469 HD11 LEU 58 1HD1 LEU 58 24.947 14.617 -2.903
470 HD12 LEU 58 2HD1 LEU 58 24.962 14.285 -4.634
471 HD13 LEU 58 3HD1 LEU 58 23.524 13.923 -3.680
472 HD21 LEU 58 1HD2 LEU 58 25.443 16.524 -5.367
473 HD22 LEU 58 2HD2 LEU 58 24.020 17.551 -5.540
474 HD23 LEU 58 3HD2 LEU 58 24.014 15.917 -6.204
475 H LEU 59 H LEU 59 19.863 17.133 -3.086
476 HA LEU 59 HA LEU 59 17.811 15.647 -4.242
477 HB2 LEU 59 1HB LEU 59 16.360 16.614 -2.545
478 HB3 LEU 59 2HB LEU 59 17.914 16.137 -1.865
479 HG LEU 59 HG LEU 59 18.177 18.845 -2.554
480 HD11 LEU 59 1HD1 LEU 59 15.571 18.294 -1.143
481 HD12 LEU 59 2HD1 LEU 59 15.772 19.043 -2.726
482 HD13 LEU 59 3HD1 LEU 59 16.343 19.874 -1.280
483 HD21 LEU 59 1HD2 LEU 59 18.146 19.078 -0.017
484 HD22 LEU 59 2HD2 LEU 59 19.327 17.964 -0.706
485 HD23 LEU 59 3HD2 LEU 59 17.848 17.340 0.025
486 H GLY 60 H GLY 60 18.540 19.082 -4.450
487 HA2 GLY 60 1HA GLY 60 16.106 19.890 -5.650
488 HA3 GLY 60 2HA GLY 60 17.628 20.767 -5.718
489 H GLU 61 H GLU 61 19.259 19.057 -7.076
490 HA GLU 61 HA GLU 61 18.497 19.496 -9.749
491 HB2 GLU 61 1HB GLU 61 20.574 17.517 -8.812
492 HB3 GLU 61 2HB GLU 61 20.507 18.346 -10.361
493 HG2 GLU 61 1HG GLU 61 21.148 19.511 -7.671
494 HG3 GLU 61 2HG GLU 61 22.193 19.397 -9.086
495 H LEU 62 H LEU 62 18.303 16.661 -7.670
496 HA LEU 62 HA LEU 62 17.586 14.802 -9.673
497 HB2 LEU 62 1HB LEU 62 18.355 13.911 -7.647
498 HB3 LEU 62 2HB LEU 62 17.237 14.886 -6.696
499 HG LEU 62 HG LEU 62 15.370 13.507 -7.484
500 HD11 LEU 62 1HD1 LEU 62 16.533 11.231 -8.509
501 HD12 LEU 62 2HD1 LEU 62 17.402 12.533 -9.320
502 HD13 LEU 62 3HD1 LEU 62 15.644 12.448 -9.425
503 HD21 LEU 62 1HD2 LEU 62 17.377 11.536 -6.513
504 HD22 LEU 62 2HD2 LEU 62 15.721 11.823 -5.977
505 HD23 LEU 62 3HD2 LEU 62 17.008 12.932 -5.501
506 H LEU 63 H LEU 63 15.580 16.561 -7.308
507 HA LEU 63 HA LEU 63 13.100 15.650 -8.204
508 HB2 LEU 63 1HB LEU 63 14.099 17.680 -6.426
509 HB3 LEU 63 2HB LEU 63 12.720 18.287 -7.340
510 HG LEU 63 HG LEU 63 11.999 15.730 -6.398
511 HD11 LEU 63 1HD1 LEU 63 12.503 15.630 -4.165
512 HD12 LEU 63 2HD1 LEU 63 12.799 17.363 -4.039
513 HD13 LEU 63 3HD1 LEU 63 13.995 16.318 -4.806
514 HD21 LEU 63 1HD2 LEU 63 10.581 17.748 -6.807
515 HD22 LEU 63 2HD2 LEU 63 11.201 18.421 -5.299
516 HD23 LEU 63 3HD2 LEU 63 10.262 16.927 -5.279
517 H GLY 64 H GLY 64 15.002 18.470 -9.202
518 HA2 GLY 64 1HA GLY 64 15.024 19.282 -11.433
519 HA3 GLY 64 2HA GLY 64 13.453 18.538 -11.691
520 H ARG 65 H ARG 65 12.891 19.832 -8.868
521 HA ARG 65 HA ARG 65 11.940 22.357 -10.023
522 HB2 ARG 65 1HB ARG 65 11.051 21.217 -7.386
523 HB3 ARG 65 2HB ARG 65 10.209 22.354 -8.431
524 HG2 ARG 65 1HG ARG 65 10.557 19.397 -8.789
525 HG3 ARG 65 2HG ARG 65 9.062 20.325 -8.660
526 HD2 ARG 65 1HD ARG 65 9.337 21.248 -10.819
527 HD3 ARG 65 2HD ARG 65 11.011 20.702 -10.918
528 HE ARG 65 HE ARG 65 10.269 18.627 -11.567
529 HH11 ARG 65 1HH1 ARG 65 7.592 20.503 -10.370
530 HH12 ARG 65 2HH1 ARG 65 6.393 19.372 -10.902
531 HH21 ARG 65 1HH2 ARG 65 8.699 17.130 -12.272
532 HH22 ARG 65 2HH2 ARG 65 7.024 17.453 -11.983
533 H GLN 66 H GLN 66 11.752 24.174 -8.338
534 HA GLN 66 HA GLN 66 14.405 24.635 -7.298
535 HB2 GLN 66 1HB GLN 66 12.039 26.468 -6.973
536 HB3 GLN 66 2HB GLN 66 13.746 26.887 -7.002
537 HG2 GLN 66 1HG GLN 66 13.563 27.340 -9.154
538 HG3 GLN 66 2HG GLN 66 13.203 25.640 -9.456
539 HE21 GLN 66 2HE2 GLN 66 11.674 25.779 -10.981
540 HE22 GLN 66 1HE2 GLN 66 10.165 26.598 -10.794
541 H SER 67 H SER 67 11.174 24.082 -6.023
542 HA SER 67 HA SER 67 12.289 23.349 -3.461
543 HB2 SER 67 1HB SER 67 10.446 24.936 -2.393
544 HB3 SER 67 2HB SER 67 12.067 25.529 -2.753
545 HG SER 67 HG SER 67 9.647 26.054 -4.038
546 H PHE 68 H PHE 68 10.325 22.851 -1.906
547 HA PHE 68 HA PHE 68 7.856 22.093 -3.051
548 HB2 PHE 68 1HB PHE 68 8.095 19.669 -3.063
549 HB3 PHE 68 2HB PHE 68 9.273 20.392 -4.153
550 HD1 PHE 68 HD2 PHE 68 11.656 20.594 -3.409
551 HD2 PHE 68 HD1 PHE 68 8.766 18.329 -1.257
552 HE1 PHE 68 HE2 PHE 68 13.464 19.394 -2.251
553 HE2 PHE 68 HE1 PHE 68 10.570 17.125 -0.094
554 HZ PHE 68 HZ PHE 68 12.923 17.656 -0.592
555 H SER 69 H SER 69 6.429 21.109 -1.527
556 HA SER 69 HA SER 69 7.216 21.661 1.226
557 HB2 SER 69 1HB SER 69 4.500 20.762 1.004
558 HB3 SER 69 2HB SER 69 5.100 22.360 1.447
559 HG SER 69 HG SER 69 5.200 22.860 -0.774
560 H VAL 70 H VAL 70 7.405 20.157 2.798
561 HA VAL 70 HA VAL 70 7.669 17.412 2.021
562 HB VAL 70 HB VAL 70 8.610 17.017 4.093
563 HG11 VAL 70 1HG1 VAL 70 9.353 19.344 2.784
564 HG12 VAL 70 2HG1 VAL 70 9.260 19.813 4.483
565 HG13 VAL 70 3HG1 VAL 70 10.295 18.471 3.993
566 HG21 VAL 70 1HG2 VAL 70 6.866 17.479 5.583
567 HG22 VAL 70 2HG2 VAL 70 8.149 18.590 6.064
568 HG23 VAL 70 3HG2 VAL 70 6.788 19.176 5.109
569 H LYS 71 H LYS 71 5.324 19.305 3.836
570 HA LYS 71 HA LYS 71 3.822 17.123 4.836
571 HB2 LYS 71 1HB LYS 71 3.783 19.884 5.136
572 HB3 LYS 71 2HB LYS 71 2.258 19.530 4.335
573 HG2 LYS 71 1HG LYS 71 1.756 17.878 6.103
574 HG3 LYS 71 2HG LYS 71 3.242 18.354 6.926
575 HD2 LYS 71 1HD LYS 71 0.917 20.171 6.293
576 HD3 LYS 71 2HD LYS 71 1.283 19.480 7.875
577 HE2 LYS 71 1HE LYS 71 3.657 20.663 7.155
578 HE3 LYS 71 2HE LYS 71 2.454 21.780 6.512
579 HZ1 LYS 71 1HZ LYS 71 2.432 22.594 8.576
580 HZ2 LYS 71 2HZ LYS 71 3.169 21.226 9.246
581 HZ3 LYS 71 3HZ LYS 71 1.499 21.240 8.975
582 H ASP 72 H ASP 72 4.240 18.224 1.714
583 HA ASP 72 HA ASP 72 1.739 16.924 0.855
584 HB2 ASP 72 1HB ASP 72 1.614 19.352 0.476
585 HB3 ASP 72 2HB ASP 72 3.102 19.282 -0.463
586 HA PRO 73 HA PRO 73 5.071 14.412 -0.949
587 HB2 PRO 73 1HB PRO 73 3.538 12.184 -1.189
588 HB3 PRO 73 2HB PRO 73 4.334 12.645 0.320
589 HG2 PRO 73 1HG PRO 73 1.491 13.054 -0.525
590 HG3 PRO 73 2HG PRO 73 2.127 12.526 1.044
591 HD2 PRO 73 1HD PRO 73 1.326 15.071 0.578
592 HD3 PRO 73 2HD PRO 73 2.645 14.675 1.699
593 H SER 74 H SER 74 4.168 16.237 -2.635
594 HA SER 74 HA SER 74 2.735 14.894 -4.805
595 HB2 SER 74 1HB SER 74 3.118 17.693 -3.966
596 HB3 SER 74 2HB SER 74 3.186 17.434 -5.709
597 HG SER 74 HG SER 74 1.077 17.601 -5.433
598 HA PRO 75 HA PRO 75 6.641 16.324 -7.190
599 HB2 PRO 75 1HB PRO 75 8.503 17.794 -5.870
600 HB3 PRO 75 2HB PRO 75 7.116 18.517 -6.694
601 HG2 PRO 75 1HG PRO 75 7.488 17.915 -3.785
602 HG3 PRO 75 2HG PRO 75 6.796 19.357 -4.549
603 HD2 PRO 75 1HD PRO 75 5.263 17.397 -3.482
604 HD3 PRO 75 2HD PRO 75 4.751 18.350 -4.889
605 H LEU 76 H LEU 76 7.063 15.473 -3.814
606 HA LEU 76 HA LEU 76 9.622 14.369 -3.905
607 HB2 LEU 76 1HB LEU 76 8.226 14.805 -1.868
608 HB3 LEU 76 2HB LEU 76 7.319 13.344 -2.256
609 HG LEU 76 HG LEU 76 9.765 12.287 -2.186
610 HD11 LEU 76 1HD1 LEU 76 10.693 13.474 0.013
611 HD12 LEU 76 2HD1 LEU 76 9.967 14.877 -0.771
612 HD13 LEU 76 3HD1 LEU 76 11.203 13.940 -1.610
613 HD21 LEU 76 1HD2 LEU 76 8.500 11.175 -0.721
614 HD22 LEU 76 2HD2 LEU 76 7.584 12.618 -0.283
615 HD23 LEU 76 3HD2 LEU 76 9.136 12.289 0.489
616 H TYR 77 H TYR 77 6.529 12.592 -4.052
617 HA TYR 77 HA TYR 77 7.537 10.102 -4.679
618 HB2 TYR 77 1HB TYR 77 4.932 11.467 -5.160
619 HB3 TYR 77 2HB TYR 77 5.231 9.948 -5.999
620 HD1 TYR 77 HD2 TYR 77 5.857 7.914 -4.587
621 HD2 TYR 77 HD1 TYR 77 4.235 11.478 -2.923
622 HE1 TYR 77 HE2 TYR 77 5.201 6.667 -2.571
623 HE2 TYR 77 HE1 TYR 77 3.576 10.241 -0.902
624 HH TYR 77 HH TYR 77 4.462 8.028 0.272
625 H ASP 78 H ASP 78 6.806 12.798 -6.832
626 HA ASP 78 HA ASP 78 7.123 11.484 -9.280
627 HB2 ASP 78 1HB ASP 78 6.409 13.978 -8.606
628 HB3 ASP 78 2HB ASP 78 8.080 14.290 -9.068
629 H MET 79 H MET 79 9.462 12.640 -6.980
630 HA MET 79 HA MET 79 11.688 12.456 -8.808
631 HB2 MET 79 1HB MET 79 12.341 13.975 -7.273
632 HB3 MET 79 2HB MET 79 11.250 13.347 -6.045
633 HG2 MET 79 1HG MET 79 12.836 11.521 -5.603
634 HG3 MET 79 2HG MET 79 13.938 12.218 -6.788
635 HE1 MET 79 1HE MET 79 11.719 13.421 -3.759
636 HE2 MET 79 2HE MET 79 12.793 12.168 -3.135
637 HE3 MET 79 3HE MET 79 12.983 13.839 -2.602
638 H LEU 80 H LEU 80 10.313 10.531 -6.189
639 HA LEU 80 HA LEU 80 12.371 8.603 -6.062
640 HB2 LEU 80 1HB LEU 80 9.464 8.520 -5.297
641 HB3 LEU 80 2HB LEU 80 10.561 7.168 -5.024
642 HG LEU 80 HG LEU 80 11.960 8.719 -3.623
643 HD11 LEU 80 1HD1 LEU 80 9.536 10.492 -3.885
644 HD12 LEU 80 2HD1 LEU 80 11.149 10.832 -4.511
645 HD13 LEU 80 3HD1 LEU 80 10.880 10.741 -2.771
646 HD21 LEU 80 1HD2 LEU 80 10.065 7.087 -2.869
647 HD22 LEU 80 2HD2 LEU 80 9.211 8.578 -2.468
648 HD23 LEU 80 3HD2 LEU 80 10.768 8.223 -1.718
649 H ARG 81 H ARG 81 9.505 8.913 -8.061
650 HA ARG 81 HA ARG 81 9.206 6.390 -9.088
651 HB2 ARG 81 1HB ARG 81 7.864 7.358 -10.631
652 HB3 ARG 81 2HB ARG 81 8.119 8.799 -9.656
653 HG2 ARG 81 1HG ARG 81 9.982 9.434 -11.153
654 HG3 ARG 81 2HG ARG 81 9.601 8.038 -12.162
655 HD2 ARG 81 1HD ARG 81 7.192 9.458 -11.727
656 HD3 ARG 81 2HD ARG 81 8.426 10.636 -12.177
657 HE ARG 81 HE ARG 81 8.487 9.729 -14.288
658 HH11 ARG 81 1HH1 ARG 81 6.698 7.631 -12.162
659 HH12 ARG 81 2HH1 ARG 81 6.109 6.622 -13.441
660 HH21 ARG 81 1HH2 ARG 81 7.718 8.407 -15.981
661 HH22 ARG 81 2HH2 ARG 81 6.690 7.064 -15.612
662 H LYS 82 H LYS 82 11.475 8.889 -10.194
663 HA LYS 82 HA LYS 82 12.829 6.857 -11.833
664 HB2 LYS 82 1HB LYS 82 13.299 8.454 -13.359
665 HB3 LYS 82 2HB LYS 82 11.983 9.325 -12.583
666 HG2 LYS 82 1HG LYS 82 14.900 9.626 -11.896
667 HG3 LYS 82 2HG LYS 82 13.976 10.718 -12.930
668 HD2 LYS 82 1HD LYS 82 12.876 10.144 -10.236
669 HD3 LYS 82 2HD LYS 82 14.322 11.153 -10.319
670 HE2 LYS 82 1HE LYS 82 11.650 11.924 -10.733
671 HE3 LYS 82 2HE LYS 82 13.102 12.902 -10.936
672 HZ1 LYS 82 1HZ LYS 82 11.558 12.702 -12.916
673 HZ2 LYS 82 2HZ LYS 82 12.117 11.114 -13.075
674 HZ3 LYS 82 3HZ LYS 82 13.199 12.407 -13.204
675 H ASN 83 H ASN 83 13.023 8.190 -8.854
676 HA ASN 83 HA ASN 83 15.959 8.265 -8.811
677 HB2 ASN 83 1HB ASN 83 14.829 10.239 -7.886
678 HB3 ASN 83 2HB ASN 83 13.963 9.216 -6.744
679 HD21 ASN 83 2HD2 ASN 83 14.749 9.782 -4.830
680 HD22 ASN 83 1HD2 ASN 83 16.422 9.790 -4.398
681 H LEU 84 H LEU 84 13.254 7.044 -6.830
682 HA LEU 84 HA LEU 84 14.964 5.192 -5.444
683 HB2 LEU 84 1HB LEU 84 12.225 6.149 -5.238
684 HB3 LEU 84 2HB LEU 84 12.359 4.415 -4.951
685 HG LEU 84 HG LEU 84 12.434 5.724 -2.874
686 HD11 LEU 84 1HD1 LEU 84 13.610 3.994 -2.145
687 HD12 LEU 84 2HD1 LEU 84 15.089 4.849 -2.583
688 HD13 LEU 84 3HD1 LEU 84 14.325 3.760 -3.741
689 HD21 LEU 84 1HD2 LEU 84 13.753 7.501 -2.550
690 HD22 LEU 84 2HD2 LEU 84 13.938 7.509 -4.304
691 HD23 LEU 84 3HD2 LEU 84 15.148 6.718 -3.293
692 H VAL 85 H VAL 85 15.144 3.014 -5.727
693 HA VAL 85 HA VAL 85 14.302 1.970 -8.295
694 HB VAL 85 HB VAL 85 16.547 1.564 -6.816
695 HG11 VAL 85 1HG1 VAL 85 14.965 0.138 -5.310
696 HG12 VAL 85 2HG1 VAL 85 15.167 -1.074 -6.577
697 HG13 VAL 85 3HG1 VAL 85 16.575 -0.459 -5.710
698 HG21 VAL 85 1HG2 VAL 85 16.697 -0.586 -8.355
699 HG22 VAL 85 2HG2 VAL 85 15.252 0.126 -9.071
700 HG23 VAL 85 3HG2 VAL 85 16.758 1.043 -9.028
701 H THR 86 H THR 86 12.537 2.420 -5.761
702 HA THR 86 HA THR 86 11.546 0.261 -4.556
703 HB THR 86 HB THR 86 9.163 1.240 -5.218
704 HG1 THR 86 1HG THR 86 10.567 3.618 -5.541
705 HG21 THR 86 1HG2 THR 86 11.198 2.682 -3.514
706 HG22 THR 86 2HG2 THR 86 10.131 1.377 -2.996
707 HG23 THR 86 3HG2 THR 86 9.456 2.942 -3.449
708 H LEU 87 H LEU 87 11.595 -1.736 -5.440
709 HA LEU 87 HA LEU 87 10.209 -2.152 -8.000
710 HB2 LEU 87 1HB LEU 87 11.400 -4.371 -7.965
711 HB3 LEU 87 2HB LEU 87 12.417 -2.945 -8.159
712 HG LEU 87 HG LEU 87 12.081 -3.959 -5.400
713 HD11 LEU 87 1HD1 LEU 87 13.939 -5.618 -5.846
714 HD12 LEU 87 2HD1 LEU 87 13.533 -5.471 -7.555
715 HD13 LEU 87 3HD1 LEU 87 12.332 -6.073 -6.412
716 HD21 LEU 87 1HD2 LEU 87 14.521 -3.434 -5.382
717 HD22 LEU 87 2HD2 LEU 87 13.485 -2.060 -5.773
718 HD23 LEU 87 3HD2 LEU 87 14.365 -2.895 -7.054
719 H ALA 88 H ALA 88 8.129 -2.606 -7.622
720 HA ALA 88 HA ALA 88 7.156 -4.978 -6.781
721 HB1 ALA 88 1HB ALA 88 7.963 -3.368 -4.476
722 HB2 ALA 88 2HB ALA 88 6.313 -3.984 -4.383
723 HB3 ALA 88 3HB ALA 88 7.659 -5.101 -4.602
724 H THR 89 H THR 89 6.022 -3.867 -8.620
725 HA THR 89 HA THR 89 4.286 -2.663 -9.526
726 HB THR 89 HB THR 89 2.813 -3.648 -7.082
727 HG1 THR 89 1HG THR 89 4.036 -5.346 -8.073
728 HG21 THR 89 1HG2 THR 89 1.930 -2.156 -9.214
729 HG22 THR 89 2HG2 THR 89 0.918 -3.170 -8.185
730 HG23 THR 89 3HG2 THR 89 1.542 -3.803 -9.708
731 H1 SER 115 H SER 115 0.947 26.808 16.775
732 HA SER 115 HA SER 115 1.921 28.243 14.723
733 HB2 SER 115 1HB SER 115 1.449 29.033 17.104
734 HB3 SER 115 2HB SER 115 3.107 28.568 17.481
735 HG SER 115 HG SER 115 2.628 30.216 15.266
736 H GLN 116 H GLN 116 3.567 25.688 16.282
737 HA GLN 116 HA GLN 116 6.102 26.445 14.996
738 HB2 GLN 116 1HB GLN 116 5.950 25.969 17.533
739 HB3 GLN 116 2HB GLN 116 5.817 24.281 17.061
740 HG2 GLN 116 1HG GLN 116 8.002 24.123 16.762
741 HG3 GLN 116 2HG GLN 116 8.014 25.529 15.698
742 HE21 GLN 116 2HE2 GLN 116 7.659 27.649 17.007
743 HE22 GLN 116 1HE2 GLN 116 8.677 27.821 18.391
744 H GLU 117 H GLU 117 7.292 24.844 13.850
745 HA GLU 117 HA GLU 117 5.870 22.392 13.144
746 HB2 GLU 117 1HB GLU 117 7.054 23.795 10.834
747 HB3 GLU 117 2HB GLU 117 5.576 22.850 10.943
748 HG2 GLU 117 1HG GLU 117 4.404 24.712 11.924
749 HG3 GLU 117 2HG GLU 117 5.888 25.661 11.970
750 H THR 118 H THR 118 7.204 20.704 13.012
751 HA THR 118 HA THR 118 10.072 21.208 12.570
752 HB THR 118 HB THR 118 8.764 19.657 14.765
753 HG1 THR 118 1HG THR 118 10.041 20.906 15.953
754 HG21 THR 118 1HG2 THR 118 10.891 18.429 15.130
755 HG22 THR 118 2HG2 THR 118 11.459 19.011 13.565
756 HG23 THR 118 3HG2 THR 118 10.058 17.945 13.655
757 H PHE 119 H PHE 119 11.175 19.703 11.362
758 HA PHE 119 HA PHE 119 9.918 18.345 9.351
759 HB2 PHE 119 1HB PHE 119 12.548 18.673 10.180
760 HB3 PHE 119 2HB PHE 119 12.316 16.928 10.207
761 HD1 PHE 119 HD2 PHE 119 10.141 17.207 7.897
762 HD2 PHE 119 HD1 PHE 119 14.197 18.403 8.386
763 HE1 PHE 119 HE2 PHE 119 10.455 17.128 5.458
764 HE2 PHE 119 HE1 PHE 119 14.517 18.328 5.948
765 HZ PHE 119 HZ PHE 119 12.645 17.688 4.480
766 H SER 120 H SER 120 11.254 16.794 12.275
767 HA SER 120 HA SER 120 10.261 14.244 11.822
768 HB2 SER 120 1HB SER 120 11.140 15.754 14.232
769 HB3 SER 120 2HB SER 120 10.236 14.264 14.498
770 HG SER 120 HG SER 120 12.566 14.504 12.891
771 H ASP 121 H ASP 121 8.588 17.097 12.701
772 HA ASP 121 HA ASP 121 6.321 15.774 13.891
773 HB2 ASP 121 1HB ASP 121 7.274 18.462 13.659
774 HB3 ASP 121 2HB ASP 121 5.624 18.395 13.047
775 H LEU 122 H LEU 122 6.850 17.596 10.872
776 HA LEU 122 HA LEU 122 4.338 16.674 9.784
777 HB2 LEU 122 1HB LEU 122 6.575 18.332 8.638
778 HB3 LEU 122 2HB LEU 122 5.117 17.910 7.742
779 HG LEU 122 HG LEU 122 3.848 19.441 8.821
780 HD11 LEU 122 1HD1 LEU 122 5.584 19.275 11.276
781 HD12 LEU 122 2HD1 LEU 122 4.155 18.278 11.005
782 HD13 LEU 122 3HD1 LEU 122 3.996 20.029 11.130
783 HD21 LEU 122 1HD2 LEU 122 4.966 21.337 8.500
784 HD22 LEU 122 2HD2 LEU 122 6.410 20.355 8.252
785 HD23 LEU 122 3HD2 LEU 122 6.050 21.007 9.852
786 H TRP 123 H TRP 123 7.779 16.268 8.964
787 HA TRP 123 HA TRP 123 7.790 14.720 6.795
788 HB2 TRP 123 1HB TRP 123 9.732 15.281 8.397
789 HB3 TRP 123 2HB TRP 123 9.327 13.766 9.201
790 HD1 TRP 123 HD1 TRP 123 10.869 11.891 8.426
791 HE1 TRP 123 HE1 TRP 123 12.017 11.224 6.222
792 HE3 TRP 123 HE3 TRP 123 9.222 15.718 5.463
793 HZ2 TRP 123 HZ2 TRP 123 12.202 12.192 3.577
794 HZ3 TRP 123 HZ3 TRP 123 9.932 15.774 3.107
795 HH2 TRP 123 HH2 TRP 123 11.391 14.047 2.186
796 H LYS 124 H LYS 124 7.391 13.283 10.039
797 HA LYS 124 HA LYS 124 6.892 10.688 9.361
798 HB2 LYS 124 1HB LYS 124 5.710 10.451 11.440
799 HB3 LYS 124 2HB LYS 124 7.020 11.600 11.681
800 HG2 LYS 124 1HG LYS 124 5.254 12.600 12.779
801 HG3 LYS 124 2HG LYS 124 5.225 13.394 11.203
802 HD2 LYS 124 1HD LYS 124 3.111 12.751 10.959
803 HD3 LYS 124 2HD LYS 124 3.648 11.070 10.968
804 HE2 LYS 124 1HE LYS 124 2.103 11.115 12.693
805 HE3 LYS 124 2HE LYS 124 3.631 11.334 13.544
806 HZ1 LYS 124 1HZ LYS 124 3.229 13.692 13.642
807 HZ2 LYS 124 2HZ LYS 124 1.902 12.874 14.299
808 HZ3 LYS 124 3HZ LYS 124 1.804 13.535 12.745
809 H LEU 125 H LEU 125 4.562 13.357 9.373
810 HA LEU 125 HA LEU 125 2.229 11.982 8.852
811 HB2 LEU 125 1HB LEU 125 2.709 14.519 9.191
812 HB3 LEU 125 2HB LEU 125 2.810 14.547 7.432
813 HG LEU 125 HG LEU 125 0.514 13.799 7.253
814 HD11 LEU 125 1HD1 LEU 125 0.252 12.351 9.098
815 HD12 LEU 125 2HD1 LEU 125 -0.859 13.693 9.371
816 HD13 LEU 125 3HD1 LEU 125 0.667 13.619 10.250
817 HD21 LEU 125 1HD2 LEU 125 -0.344 15.786 8.972
818 HD22 LEU 125 2HD2 LEU 125 0.150 15.997 7.291
819 HD23 LEU 125 3HD2 LEU 125 1.316 16.247 8.591
820 H LEU 126 H LEU 126 4.723 13.030 6.574
821 HA LEU 126 HA LEU 126 3.553 12.540 4.158
822 HB2 LEU 126 1HB LEU 126 6.035 13.160 4.916
823 HB3 LEU 126 2HB LEU 126 6.292 11.463 4.514
824 HG LEU 126 HG LEU 126 5.726 11.818 2.244
825 HD11 LEU 126 1HD1 LEU 126 3.858 13.165 2.188
826 HD12 LEU 126 2HD1 LEU 126 5.101 14.249 1.565
827 HD13 LEU 126 3HD1 LEU 126 4.572 14.385 3.242
828 HD21 LEU 126 1HD2 LEU 126 7.151 14.346 2.443
829 HD22 LEU 126 2HD2 LEU 126 7.647 12.820 1.711
830 HD23 LEU 126 3HD2 LEU 126 7.860 13.079 3.443
831 HA PRO 127 HA PRO 127 2.485 8.201 4.778
832 HB2 PRO 127 1HB PRO 127 0.785 8.095 2.664
833 HB3 PRO 127 2HB PRO 127 0.326 8.767 4.233
834 HG2 PRO 127 1HG PRO 127 1.188 10.188 1.743
835 HG3 PRO 127 2HG PRO 127 -0.127 10.590 2.863
836 HD2 PRO 127 1HD PRO 127 2.271 11.847 2.919
837 HD3 PRO 127 2HD PRO 127 1.299 11.578 4.381
838 H GLU 128 H GLU 128 3.735 6.596 4.076
839 HA GLU 128 HA GLU 128 5.304 6.879 1.679
840 HB2 GLU 128 1HB GLU 128 5.227 4.264 3.060
841 HB3 GLU 128 2HB GLU 128 6.604 5.206 2.506
842 HG2 GLU 128 1HG GLU 128 6.951 5.513 4.696
843 HG3 GLU 128 2HG GLU 128 5.733 6.774 4.513
844 H ASN 129 H ASN 129 2.207 5.832 2.294
845 HA ASN 129 HA ASN 129 0.748 4.379 1.262
846 HB2 ASN 129 1HB ASN 129 2.144 5.765 -1.033
847 HB3 ASN 129 2HB ASN 129 0.687 4.795 -1.228
848 HD21 ASN 129 2HD2 ASN 129 -1.224 5.474 -0.073
849 HD22 ASN 129 1HD2 ASN 129 -1.465 7.153 0.255
Start of MODEL 12
1 H1 GLN 1 H GLN 1 5.089 4.758 -4.915
2 HA GLN 1 HA GLN 1 6.933 3.183 -5.382
3 HB2 GLN 1 1HB GLN 1 8.529 5.474 -4.227
4 HB3 GLN 1 2HB GLN 1 9.179 3.867 -4.521
5 HG2 GLN 1 1HG GLN 1 7.993 5.624 -6.654
6 HG3 GLN 1 2HG GLN 1 9.713 5.533 -6.281
7 HE21 GLN 1 2HE2 GLN 1 10.715 4.406 -7.777
8 HE22 GLN 1 1HE2 GLN 1 10.155 2.938 -8.496
9 H ILE 2 H ILE 2 6.273 1.693 -3.981
10 HA ILE 2 HA ILE 2 6.676 2.214 -1.113
11 HB ILE 2 HB ILE 2 4.443 0.420 -1.897
12 HG12 ILE 2 1HG1 ILE 2 4.016 2.303 -3.358
13 HG13 ILE 2 2HG1 ILE 2 2.887 2.363 -2.009
14 HG21 ILE 2 1HG2 ILE 2 3.458 1.684 0.125
15 HG22 ILE 2 2HG2 ILE 2 4.771 0.539 0.399
16 HG23 ILE 2 3HG2 ILE 2 5.104 2.271 0.362
17 HD11 ILE 2 1HD1 ILE 2 5.184 3.861 -1.296
18 HD12 ILE 2 2HD1 ILE 2 4.672 4.359 -2.910
19 HD13 ILE 2 3HD1 ILE 2 3.534 4.424 -1.564
20 H ASN 3 H ASN 3 6.649 0.128 0.172
21 HA ASN 3 HA ASN 3 7.307 -2.039 0.541
22 HB2 ASN 3 1HB ASN 3 6.450 -2.150 -2.116
23 HB3 ASN 3 2HB ASN 3 8.076 -2.825 -2.145
24 HD21 ASN 3 2HD2 ASN 3 5.582 -2.948 0.358
25 HD22 ASN 3 1HD2 ASN 3 5.461 -4.671 0.398
26 H GLN 4 H GLN 4 9.363 -3.501 -0.563
27 HA GLN 4 HA GLN 4 11.634 -2.111 0.403
28 HB2 GLN 4 1HB GLN 4 11.731 -4.582 -1.315
29 HB3 GLN 4 2HB GLN 4 12.865 -4.079 -0.069
30 HG2 GLN 4 1HG GLN 4 11.759 -5.656 1.105
31 HG3 GLN 4 2HG GLN 4 10.695 -4.292 1.444
32 HE21 GLN 4 2HE2 GLN 4 8.616 -4.534 1.020
33 HE22 GLN 4 1HE2 GLN 4 7.923 -5.764 0.025
34 H VAL 5 H VAL 5 13.484 -1.397 -0.702
35 HA VAL 5 HA VAL 5 13.204 -1.048 -3.607
36 HB VAL 5 HB VAL 5 14.090 1.251 -3.418
37 HG11 VAL 5 1HG1 VAL 5 11.746 1.539 -1.720
38 HG12 VAL 5 2HG1 VAL 5 11.999 2.031 -3.396
39 HG13 VAL 5 3HG1 VAL 5 11.505 0.378 -3.026
40 HG21 VAL 5 1HG2 VAL 5 14.490 2.330 -1.421
41 HG22 VAL 5 2HG2 VAL 5 13.443 1.249 -0.502
42 HG23 VAL 5 3HG2 VAL 5 15.027 0.693 -1.044
43 H ARG 6 H ARG 6 15.341 -0.148 -4.531
44 HA ARG 6 HA ARG 6 17.669 -1.175 -3.083
45 HB2 ARG 6 1HB ARG 6 16.448 -2.491 -5.292
46 HB3 ARG 6 2HB ARG 6 17.987 -1.840 -5.839
47 HG2 ARG 6 1HG ARG 6 19.202 -3.094 -4.283
48 HG3 ARG 6 2HG ARG 6 17.767 -3.447 -3.319
49 HD2 ARG 6 1HD ARG 6 17.162 -5.178 -4.625
50 HD3 ARG 6 2HD ARG 6 17.641 -4.355 -6.109
51 HE ARG 6 HE ARG 6 19.210 -6.193 -4.570
52 HH11 ARG 6 1HH1 ARG 6 19.339 -3.492 -6.762
53 HH12 ARG 6 2HH1 ARG 6 20.922 -3.878 -7.352
54 HH21 ARG 6 1HH2 ARG 6 21.294 -6.712 -5.338
55 HH22 ARG 6 2HH2 ARG 6 22.032 -5.711 -6.542
56 HA PRO 7 HA PRO 7 18.711 2.925 -4.743
57 HB2 PRO 7 1HB PRO 7 20.624 3.418 -2.881
58 HB3 PRO 7 2HB PRO 7 18.901 3.673 -2.579
59 HG2 PRO 7 1HG PRO 7 20.639 1.366 -1.795
60 HG3 PRO 7 2HG PRO 7 19.403 2.210 -0.843
61 HD2 PRO 7 1HD PRO 7 18.937 -0.164 -2.059
62 HD3 PRO 7 2HD PRO 7 17.672 1.062 -1.841
63 H LYS 8 H LYS 8 20.856 3.862 -5.379
64 HA LYS 8 HA LYS 8 22.632 1.721 -6.346
65 HB2 LYS 8 1HB LYS 8 21.292 3.438 -7.894
66 HB3 LYS 8 2HB LYS 8 22.705 4.433 -7.568
67 HG2 LYS 8 1HG LYS 8 23.658 3.399 -9.286
68 HG3 LYS 8 2HG LYS 8 23.790 1.989 -8.233
69 HD2 LYS 8 1HD LYS 8 22.565 0.915 -9.763
70 HD3 LYS 8 2HD LYS 8 21.195 1.850 -9.157
71 HE2 LYS 8 1HE LYS 8 23.025 2.780 -11.364
72 HE3 LYS 8 2HE LYS 8 21.509 1.924 -11.642
73 HZ1 LYS 8 1HZ LYS 8 20.764 3.916 -9.985
74 HZ2 LYS 8 2HZ LYS 8 20.624 3.958 -11.670
75 HZ3 LYS 8 3HZ LYS 8 21.958 4.674 -10.914
76 H LEU 9 H LEU 9 24.715 3.455 -7.180
77 HA LEU 9 HA LEU 9 26.223 3.618 -4.800
78 HB2 LEU 9 1HB LEU 9 27.634 3.361 -6.545
79 HB3 LEU 9 2HB LEU 9 26.614 4.286 -7.643
80 HG LEU 9 HG LEU 9 27.464 6.371 -6.605
81 HD11 LEU 9 1HD1 LEU 9 28.161 4.931 -4.490
82 HD12 LEU 9 2HD1 LEU 9 28.986 6.429 -4.919
83 HD13 LEU 9 3HD1 LEU 9 29.697 4.876 -5.354
84 HD21 LEU 9 1HD2 LEU 9 28.508 5.784 -8.617
85 HD22 LEU 9 2HD2 LEU 9 29.365 4.429 -7.882
86 HD23 LEU 9 3HD2 LEU 9 29.840 6.085 -7.501
87 HA PRO 10 HA PRO 10 25.768 8.408 -5.177
88 HB2 PRO 10 1HB PRO 10 24.004 9.360 -7.008
89 HB3 PRO 10 2HB PRO 10 25.703 9.047 -7.383
90 HG2 PRO 10 1HG PRO 10 23.297 7.354 -7.939
91 HG3 PRO 10 2HG PRO 10 24.680 7.712 -8.989
92 HD2 PRO 10 1HD PRO 10 24.454 5.388 -7.617
93 HD3 PRO 10 2HD PRO 10 26.023 6.143 -7.965
94 H LEU 11 H LEU 11 23.272 6.128 -5.129
95 HA LEU 11 HA LEU 11 21.362 7.970 -3.887
96 HB2 LEU 11 1HB LEU 11 21.073 5.785 -5.604
97 HB3 LEU 11 2HB LEU 11 20.483 5.227 -4.040
98 HG LEU 11 HG LEU 11 18.901 7.110 -3.984
99 HD11 LEU 11 1HD1 LEU 11 20.500 8.384 -5.689
100 HD12 LEU 11 2HD1 LEU 11 18.780 8.745 -5.549
101 HD13 LEU 11 3HD1 LEU 11 19.358 7.703 -6.848
102 HD21 LEU 11 1HD2 LEU 11 18.136 6.088 -6.566
103 HD22 LEU 11 2HD2 LEU 11 17.425 5.784 -4.981
104 HD23 LEU 11 3HD2 LEU 11 18.777 4.801 -5.545
105 H LEU 12 H LEU 12 23.640 5.520 -3.127
106 HA LEU 12 HA LEU 12 22.494 4.721 -0.629
107 HB2 LEU 12 1HB LEU 12 24.105 3.384 -2.041
108 HB3 LEU 12 2HB LEU 12 25.372 4.467 -1.469
109 HG LEU 12 HG LEU 12 25.379 3.565 0.642
110 HD11 LEU 12 1HD1 LEU 12 23.180 3.878 1.364
111 HD12 LEU 12 2HD1 LEU 12 23.424 2.134 1.461
112 HD13 LEU 12 3HD1 LEU 12 22.521 2.824 0.113
113 HD21 LEU 12 1HD2 LEU 12 24.444 1.293 -1.108
114 HD22 LEU 12 2HD2 LEU 12 25.264 1.118 0.443
115 HD23 LEU 12 3HD2 LEU 12 26.105 1.858 -0.920
116 H LYS 13 H LYS 13 25.304 6.735 -1.496
117 HA LYS 13 HA LYS 13 26.066 7.534 1.032
118 HB2 LYS 13 1HB LYS 13 27.187 9.377 0.001
119 HB3 LYS 13 2HB LYS 13 27.260 8.025 -1.122
120 HG2 LYS 13 1HG LYS 13 26.399 9.319 -2.692
121 HG3 LYS 13 2HG LYS 13 24.919 9.463 -1.740
122 HD2 LYS 13 1HD LYS 13 27.208 11.176 -0.954
123 HD3 LYS 13 2HD LYS 13 26.383 11.577 -2.462
124 HE2 LYS 13 1HE LYS 13 25.012 12.746 -1.114
125 HE3 LYS 13 2HE LYS 13 24.269 11.174 -0.822
126 HZ1 LYS 13 1HZ LYS 13 25.514 12.866 1.022
127 HZ2 LYS 13 2HZ LYS 13 26.448 11.460 0.912
128 HZ3 LYS 13 3HZ LYS 13 24.805 11.355 1.302
129 H ILE 14 H ILE 14 23.350 8.585 -0.876
130 HA ILE 14 HA ILE 14 22.756 10.983 0.469
131 HB ILE 14 HB ILE 14 20.713 9.131 -0.747
132 HG12 ILE 14 1HG1 ILE 14 22.698 10.980 -2.042
133 HG13 ILE 14 2HG1 ILE 14 22.293 9.321 -2.471
134 HG21 ILE 14 1HG2 ILE 14 20.810 12.114 -0.337
135 HG22 ILE 14 2HG2 ILE 14 19.567 11.273 -1.262
136 HG23 ILE 14 3HG2 ILE 14 19.743 10.963 0.465
137 HD11 ILE 14 1HD1 ILE 14 20.870 11.850 -3.117
138 HD12 ILE 14 2HD1 ILE 14 21.273 10.481 -4.154
139 HD13 ILE 14 3HD1 ILE 14 19.950 10.350 -2.996
140 H LEU 15 H LEU 15 21.373 7.724 0.908
141 HA LEU 15 HA LEU 15 19.878 8.443 3.216
142 HB2 LEU 15 1HB LEU 15 20.767 5.677 2.432
143 HB3 LEU 15 2HB LEU 15 19.384 6.119 3.431
144 HG LEU 15 HG LEU 15 19.688 6.505 0.457
145 HD11 LEU 15 1HD1 LEU 15 18.349 4.721 0.193
146 HD12 LEU 15 2HD1 LEU 15 17.372 5.112 1.607
147 HD13 LEU 15 3HD1 LEU 15 18.919 4.289 1.805
148 HD21 LEU 15 1HD2 LEU 15 18.551 8.408 1.721
149 HD22 LEU 15 2HD2 LEU 15 17.275 7.245 2.084
150 HD23 LEU 15 3HD2 LEU 15 17.646 7.654 0.409
151 H HIS 16 H HIS 16 23.072 7.074 2.695
152 HA HIS 16 HA HIS 16 23.639 6.242 5.301
153 HB2 HIS 16 1HB HIS 16 25.358 7.161 3.015
154 HB3 HIS 16 2HB HIS 16 26.076 6.770 4.575
155 HD1 HIS 16 HD1 HIS 16 27.316 4.824 3.248
156 HD2 HIS 16 HD2 HIS 16 23.194 4.431 3.589
157 HE1 HIS 16 HE1 HIS 16 26.821 2.423 2.688
158 H ALA 17 H ALA 17 24.293 9.367 3.729
159 HA ALA 17 HA ALA 17 25.495 10.619 5.927
160 HB1 ALA 17 1HB ALA 17 24.712 12.753 4.760
161 HB2 ALA 17 2HB ALA 17 25.772 11.673 3.854
162 HB3 ALA 17 3HB ALA 17 24.039 11.684 3.528
163 H ALA 18 H ALA 18 22.123 10.190 5.057
164 HA ALA 18 HA ALA 18 21.066 12.030 6.952
165 HB1 ALA 18 1HB ALA 18 20.009 10.052 5.070
166 HB2 ALA 18 2HB ALA 18 19.034 10.268 6.524
167 HB3 ALA 18 3HB ALA 18 19.404 11.653 5.497
168 H GLY 19 H GLY 19 22.483 8.974 7.275
169 HA2 GLY 19 1HA GLY 19 22.947 8.390 9.650
170 HA3 GLY 19 2HA GLY 19 21.230 8.637 9.931
171 H ALA 20 H ALA 20 21.794 7.216 6.933
172 HA ALA 20 HA ALA 20 20.782 4.671 7.909
173 HB1 ALA 20 1HB ALA 20 21.344 5.429 5.052
174 HB2 ALA 20 2HB ALA 20 20.285 4.151 5.650
175 HB3 ALA 20 3HB ALA 20 19.847 5.842 5.887
176 H GLN 21 H GLN 21 21.729 2.760 6.389
177 HA GLN 21 HA GLN 21 24.423 2.712 5.709
178 HB2 GLN 21 1HB GLN 21 24.282 3.013 8.397
179 HB3 GLN 21 2HB GLN 21 24.278 1.259 8.278
180 HG2 GLN 21 1HG GLN 21 26.505 1.541 8.352
181 HG3 GLN 21 2HG GLN 21 26.303 1.798 6.619
182 HE21 GLN 21 2HE2 GLN 21 25.524 4.232 6.249
183 HE22 GLN 21 1HE2 GLN 21 26.577 5.398 6.967
184 H GLY 22 H GLY 22 24.218 1.194 4.198
185 HA2 GLY 22 1HA GLY 22 24.163 -1.465 4.498
186 HA3 GLY 22 2HA GLY 22 22.453 -1.077 4.611
187 H GLU 23 H GLU 23 21.983 -2.249 2.728
188 HA GLU 23 HA GLU 23 22.744 -0.849 0.257
189 HB2 GLU 23 1HB GLU 23 23.517 -3.466 0.964
190 HB3 GLU 23 2HB GLU 23 22.259 -3.640 -0.252
191 HG2 GLU 23 1HG GLU 23 24.764 -1.997 -0.542
192 HG3 GLU 23 2HG GLU 23 24.485 -3.590 -1.245
193 H MET 24 H MET 24 20.437 -2.956 1.900
194 HA MET 24 HA MET 24 18.396 -2.200 -0.079
195 HB2 MET 24 1HB MET 24 17.665 -4.278 1.849
196 HB3 MET 24 2HB MET 24 17.510 -4.262 0.097
197 HG2 MET 24 1HG MET 24 18.999 -5.959 0.346
198 HG3 MET 24 2HG MET 24 20.111 -4.601 0.189
199 HE1 MET 24 1HE MET 24 21.863 -5.951 0.927
200 HE2 MET 24 2HE MET 24 22.314 -4.727 2.113
201 HE3 MET 24 3HE MET 24 22.236 -6.425 2.584
202 H PHE 25 H PHE 25 16.406 -1.389 0.591
203 HA PHE 25 HA PHE 25 15.775 -1.024 3.361
204 HB2 PHE 25 1HB PHE 25 16.471 1.431 1.735
205 HB3 PHE 25 2HB PHE 25 15.835 1.423 3.376
206 HD1 PHE 25 HD2 PHE 25 18.761 0.662 1.287
207 HD2 PHE 25 HD1 PHE 25 17.241 0.996 5.248
208 HE1 PHE 25 HE2 PHE 25 21.055 0.576 2.170
209 HE2 PHE 25 HE1 PHE 25 19.534 0.912 6.138
210 HZ PHE 25 HZ PHE 25 21.444 0.700 4.599
211 H THR 26 H THR 26 13.689 -0.018 3.680
212 HA THR 26 HA THR 26 11.951 -0.425 1.361
213 HB THR 26 HB THR 26 10.282 0.095 3.494
214 HG1 THR 26 1HG THR 26 12.038 -1.746 4.613
215 HG21 THR 26 1HG2 THR 26 9.861 -2.313 3.488
216 HG22 THR 26 2HG2 THR 26 11.367 -2.582 2.611
217 HG23 THR 26 3HG2 THR 26 10.045 -1.704 1.843
218 H VAL 27 H VAL 27 10.167 1.072 0.985
219 HA VAL 27 HA VAL 27 10.895 3.647 0.484
220 HB VAL 27 HB VAL 27 8.902 3.373 -0.510
221 HG11 VAL 27 1HG1 VAL 27 8.419 1.447 1.699
222 HG12 VAL 27 2HG1 VAL 27 7.023 2.049 0.803
223 HG13 VAL 27 3HG1 VAL 27 8.325 1.215 -0.046
224 HG21 VAL 27 1HG2 VAL 27 8.572 5.268 1.097
225 HG22 VAL 27 2HG2 VAL 27 7.084 4.492 0.556
226 HG23 VAL 27 3HG2 VAL 27 7.731 4.139 2.158
227 H LYS 28 H LYS 28 9.023 2.607 3.337
228 HA LYS 28 HA LYS 28 8.845 5.033 4.638
229 HB2 LYS 28 1HB LYS 28 8.722 2.200 5.434
230 HB3 LYS 28 2HB LYS 28 9.139 3.309 6.734
231 HG2 LYS 28 1HG LYS 28 6.849 3.227 6.893
232 HG3 LYS 28 2HG LYS 28 7.087 4.659 5.889
233 HD2 LYS 28 1HD LYS 28 5.299 3.163 5.050
234 HD3 LYS 28 2HD LYS 28 6.611 3.396 3.892
235 HE2 LYS 28 1HE LYS 28 5.698 1.015 4.259
236 HE3 LYS 28 2HE LYS 28 7.445 1.251 4.216
237 HZ1 LYS 28 1HZ LYS 28 6.836 -0.176 6.043
238 HZ2 LYS 28 2HZ LYS 28 5.776 0.989 6.658
239 HZ3 LYS 28 3HZ LYS 28 7.442 1.283 6.648
240 H GLU 29 H GLU 29 11.573 2.878 4.364
241 HA GLU 29 HA GLU 29 13.110 4.201 6.414
242 HB2 GLU 29 1HB GLU 29 13.898 2.164 4.324
243 HB3 GLU 29 2HB GLU 29 14.963 2.752 5.592
244 HG2 GLU 29 1HG GLU 29 13.309 1.901 7.261
245 HG3 GLU 29 2HG GLU 29 12.440 1.152 5.922
246 H VAL 30 H VAL 30 13.508 3.843 2.885
247 HA VAL 30 HA VAL 30 15.585 5.632 2.529
248 HB VAL 30 HB VAL 30 13.313 5.292 0.572
249 HG11 VAL 30 1HG1 VAL 30 15.448 5.434 -0.967
250 HG12 VAL 30 2HG1 VAL 30 14.657 6.892 -0.364
251 HG13 VAL 30 3HG1 VAL 30 16.114 6.287 0.425
252 HG21 VAL 30 1HG2 VAL 30 15.000 3.286 1.656
253 HG22 VAL 30 2HG2 VAL 30 13.821 3.141 0.352
254 HG23 VAL 30 3HG2 VAL 30 15.493 3.565 -0.014
255 H MET 31 H MET 31 12.156 6.258 2.917
256 HA MET 31 HA MET 31 12.282 9.009 2.159
257 HB2 MET 31 1HB MET 31 10.083 8.630 2.073
258 HB3 MET 31 2HB MET 31 10.260 7.127 2.968
259 HG2 MET 31 1HG MET 31 8.740 8.547 4.139
260 HG3 MET 31 2HG MET 31 10.230 8.422 5.071
261 HE1 MET 31 1HE MET 31 10.821 10.628 1.980
262 HE2 MET 31 2HE MET 31 9.065 10.460 1.970
263 HE3 MET 31 3HE MET 31 9.800 12.034 2.281
264 H HIS 32 H HIS 32 12.270 7.283 5.254
265 HA HIS 32 HA HIS 32 12.174 9.468 6.970
266 HB2 HIS 32 1HB HIS 32 12.169 6.875 7.427
267 HB3 HIS 32 2HB HIS 32 13.899 7.119 7.650
268 HD1 HIS 32 HD1 HIS 32 10.984 6.908 9.581
269 HD2 HIS 32 HD2 HIS 32 14.221 9.513 9.575
270 HE1 HIS 32 HE1 HIS 32 10.996 7.972 11.860
271 H TYR 33 H TYR 33 14.829 8.169 5.114
272 HA TYR 33 HA TYR 33 16.882 9.603 6.494
273 HB2 TYR 33 1HB TYR 33 16.875 8.299 3.765
274 HB3 TYR 33 2HB TYR 33 18.305 8.932 4.573
275 HD1 TYR 33 HD2 TYR 33 17.907 8.011 7.333
276 HD2 TYR 33 HD1 TYR 33 17.193 5.998 3.654
277 HE1 TYR 33 HE2 TYR 33 18.229 5.849 8.460
278 HE2 TYR 33 HE1 TYR 33 17.512 3.830 4.771
279 HH TYR 33 HH TYR 33 17.230 3.033 7.354
280 H LEU 34 H LEU 34 14.850 10.207 3.701
281 HA LEU 34 HA LEU 34 16.160 12.294 2.474
282 HB2 LEU 34 1HB LEU 34 13.485 11.253 2.555
283 HB3 LEU 34 2HB LEU 34 13.445 13.015 2.506
284 HG LEU 34 HG LEU 34 13.280 12.159 0.269
285 HD11 LEU 34 1HD1 LEU 34 16.080 12.964 0.090
286 HD12 LEU 34 2HD1 LEU 34 15.095 14.034 1.087
287 HD13 LEU 34 3HD1 LEU 34 14.635 13.716 -0.586
288 HD21 LEU 34 1HD2 LEU 34 14.803 10.663 -0.722
289 HD22 LEU 34 2HD2 LEU 34 14.426 9.971 0.856
290 HD23 LEU 34 3HD2 LEU 34 15.951 10.823 0.608
291 H GLY 35 H GLY 35 13.663 12.633 5.008
292 HA2 GLY 35 1HA GLY 35 13.861 15.374 5.377
293 HA3 GLY 35 2HA GLY 35 13.370 14.237 6.625
294 H GLN 36 H GLN 36 15.662 12.815 7.070
295 HA GLN 36 HA GLN 36 17.090 14.475 8.802
296 HB2 GLN 36 1HB GLN 36 17.919 11.832 7.590
297 HB3 GLN 36 2HB GLN 36 18.702 12.601 8.965
298 HG2 GLN 36 1HG GLN 36 16.026 12.508 9.673
299 HG3 GLN 36 2HG GLN 36 16.320 10.970 8.863
300 HE21 GLN 36 2HE2 GLN 36 18.370 13.003 10.916
301 HE22 GLN 36 1HE2 GLN 36 18.698 11.783 12.094
302 H TYR 37 H TYR 37 17.866 13.365 5.530
303 HA TYR 37 HA TYR 37 20.448 14.440 5.368
304 HB2 TYR 37 1HB TYR 37 19.528 12.820 3.747
305 HB3 TYR 37 2HB TYR 37 18.441 14.062 3.134
306 HD1 TYR 37 HD2 TYR 37 22.081 13.433 3.680
307 HD2 TYR 37 HD1 TYR 37 19.098 15.316 1.302
308 HE1 TYR 37 HE2 TYR 37 23.813 14.153 2.089
309 HE2 TYR 37 HE1 TYR 37 20.821 16.041 -0.296
310 HH TYR 37 HH TYR 37 23.052 15.460 -0.987
311 H ILE 38 H ILE 38 17.310 15.829 4.455
312 HA ILE 38 HA ILE 38 18.255 18.248 3.419
313 HB ILE 38 HB ILE 38 15.641 17.754 4.849
314 HG12 ILE 38 1HG1 ILE 38 16.256 17.667 1.889
315 HG13 ILE 38 2HG1 ILE 38 16.103 16.242 2.911
316 HG21 ILE 38 1HG2 ILE 38 14.846 19.670 3.476
317 HG22 ILE 38 2HG2 ILE 38 16.055 20.109 4.682
318 HG23 ILE 38 3HG2 ILE 38 16.517 19.955 2.987
319 HD11 ILE 38 1HD1 ILE 38 13.948 16.233 2.416
320 HD12 ILE 38 2HD1 ILE 38 13.783 17.711 3.364
321 HD13 ILE 38 3HD1 ILE 38 14.065 17.805 1.626
322 H MET 39 H MET 39 17.228 17.417 6.718
323 HA MET 39 HA MET 39 17.721 20.003 7.787
324 HB2 MET 39 1HB MET 39 17.163 19.102 9.864
325 HB3 MET 39 2HB MET 39 16.259 18.097 8.740
326 HG2 MET 39 1HG MET 39 17.203 16.303 9.610
327 HG3 MET 39 2HG MET 39 18.778 16.885 9.074
328 HE1 MET 39 1HE MET 39 20.327 18.564 10.684
329 HE2 MET 39 2HE MET 39 18.890 19.585 10.741
330 HE3 MET 39 3HE MET 39 19.715 19.138 12.236
331 H VAL 40 H VAL 40 19.715 17.256 7.132
332 HA VAL 40 HA VAL 40 21.839 17.925 8.922
333 HB VAL 40 HB VAL 40 21.230 15.732 7.331
334 HG11 VAL 40 1HG1 VAL 40 23.804 16.976 6.369
335 HG12 VAL 40 2HG1 VAL 40 23.205 15.371 5.948
336 HG13 VAL 40 3HG1 VAL 40 22.325 16.807 5.423
337 HG21 VAL 40 1HG2 VAL 40 23.249 14.753 8.347
338 HG22 VAL 40 2HG2 VAL 40 23.754 16.364 8.860
339 HG23 VAL 40 3HG2 VAL 40 22.279 15.651 9.515
340 H LYS 41 H LYS 41 21.164 18.539 5.510
341 HA LYS 41 HA LYS 41 23.658 20.019 5.215
342 HB2 LYS 41 1HB LYS 41 21.493 19.190 3.293
343 HB3 LYS 41 2HB LYS 41 22.755 20.326 2.833
344 HG2 LYS 41 1HG LYS 41 23.085 17.456 3.664
345 HG3 LYS 41 2HG LYS 41 23.412 18.171 2.084
346 HD2 LYS 41 1HD LYS 41 24.926 18.572 4.655
347 HD3 LYS 41 2HD LYS 41 25.515 17.883 3.140
348 HE2 LYS 41 1HE LYS 41 24.946 20.183 2.129
349 HE3 LYS 41 2HE LYS 41 24.899 20.743 3.800
350 HZ1 LYS 41 1HZ LYS 41 27.175 19.908 4.070
351 HZ2 LYS 41 2HZ LYS 41 27.074 21.104 2.878
352 HZ3 LYS 41 3HZ LYS 41 27.212 19.477 2.434
353 H GLN 42 H GLN 42 20.410 20.594 6.016
354 HA GLN 42 HA GLN 42 19.249 22.494 6.481
355 HB2 GLN 42 1HB GLN 42 22.057 23.353 6.542
356 HB3 GLN 42 2HB GLN 42 20.917 24.651 6.213
357 HG2 GLN 42 1HG GLN 42 20.874 24.782 8.456
358 HG3 GLN 42 2HG GLN 42 19.674 23.502 8.281
359 HE21 GLN 42 2HE2 GLN 42 21.683 21.539 7.479
360 HE22 GLN 42 1HE2 GLN 42 22.523 21.100 8.923
361 H LEU 43 H LEU 43 18.158 22.038 4.444
362 HA LEU 43 HA LEU 43 18.572 24.219 2.524
363 HB2 LEU 43 1HB LEU 43 18.273 21.292 1.924
364 HB3 LEU 43 2HB LEU 43 17.883 22.531 0.733
365 HG LEU 43 HG LEU 43 20.291 23.352 1.090
366 HD11 LEU 43 1HD1 LEU 43 21.744 22.165 2.310
367 HD12 LEU 43 2HD1 LEU 43 21.088 20.620 1.771
368 HD13 LEU 43 3HD1 LEU 43 20.308 21.498 3.086
369 HD21 LEU 43 1HD2 LEU 43 20.821 22.278 -0.813
370 HD22 LEU 43 2HD2 LEU 43 19.151 21.716 -0.741
371 HD23 LEU 43 3HD2 LEU 43 20.455 20.689 -0.143
372 H TYR 44 H TYR 44 16.750 24.518 4.435
373 HA TYR 44 HA TYR 44 14.256 24.430 2.955
374 HB2 TYR 44 1HB TYR 44 12.982 23.382 4.738
375 HB3 TYR 44 2HB TYR 44 14.277 22.304 4.226
376 HD1 TYR 44 HD2 TYR 44 16.308 22.060 5.662
377 HD2 TYR 44 HD1 TYR 44 12.863 24.187 6.968
378 HE1 TYR 44 HE2 TYR 44 17.091 21.888 7.987
379 HE2 TYR 44 HE1 TYR 44 13.636 24.022 9.297
380 HH TYR 44 HH TYR 44 16.565 23.471 10.226
381 H ASP 45 H ASP 45 12.498 25.606 4.212
382 HA ASP 45 HA ASP 45 13.571 28.123 5.083
383 HB2 ASP 45 1HB ASP 45 11.249 27.375 3.842
384 HB3 ASP 45 2HB ASP 45 10.694 27.662 5.489
385 H GLN 46 H GLN 46 14.296 28.432 7.076
386 HA GLN 46 HA GLN 46 13.867 26.760 9.258
387 HB2 GLN 46 1HB GLN 46 14.909 29.526 8.906
388 HB3 GLN 46 2HB GLN 46 14.501 29.009 10.536
389 HG2 GLN 46 1HG GLN 46 16.915 28.680 9.505
390 HG3 GLN 46 2HG GLN 46 16.215 27.540 10.653
391 HE21 GLN 46 2HE2 GLN 46 16.167 28.154 7.154
392 HE22 GLN 46 1HE2 GLN 46 16.370 26.502 6.691
393 H GLN 47 H GLN 47 11.809 29.106 7.888
394 HA GLN 47 HA GLN 47 10.282 29.556 10.312
395 HB2 GLN 47 1HB GLN 47 9.236 30.371 7.650
396 HB3 GLN 47 2HB GLN 47 9.201 31.233 9.182
397 HG2 GLN 47 1HG GLN 47 11.475 30.986 7.241
398 HG3 GLN 47 2HG GLN 47 10.639 32.445 7.772
399 HE21 GLN 47 2HE2 GLN 47 13.322 30.518 8.193
400 HE22 GLN 47 1HE2 GLN 47 13.875 31.152 9.701
401 H GLU 48 H GLU 48 10.138 27.591 7.432
402 HA GLU 48 HA GLU 48 7.806 26.211 8.551
403 HB2 GLU 48 1HB GLU 48 8.100 27.167 5.703
404 HB3 GLU 48 2HB GLU 48 6.917 25.966 6.203
405 HG2 GLU 48 1HG GLU 48 5.903 27.592 7.717
406 HG3 GLU 48 2HG GLU 48 7.086 28.797 7.210
407 H GLN 49 H GLN 49 9.036 24.469 9.191
408 HA GLN 49 HA GLN 49 11.057 23.220 7.742
409 HB2 GLN 49 1HB GLN 49 9.141 22.162 9.814
410 HB3 GLN 49 2HB GLN 49 10.429 21.177 9.134
411 HG2 GLN 49 1HG GLN 49 11.596 21.939 10.884
412 HG3 GLN 49 2HG GLN 49 11.828 23.359 9.865
413 HE21 GLN 49 2HE2 GLN 49 11.580 25.157 10.959
414 HE22 GLN 49 1HE2 GLN 49 10.426 25.443 12.213
415 H HIS 50 H HIS 50 7.703 23.275 7.165
416 HA HIS 50 HA HIS 50 7.624 20.780 5.700
417 HB2 HIS 50 1HB HIS 50 5.292 21.438 5.182
418 HB3 HIS 50 2HB HIS 50 5.631 21.465 6.910
419 HD1 HIS 50 HD1 HIS 50 5.417 23.689 8.114
420 HD2 HIS 50 HD2 HIS 50 4.962 24.007 3.997
421 HE1 HIS 50 HE1 HIS 50 4.572 26.023 7.710
422 H MET 51 H MET 51 9.203 23.403 4.995
423 HA MET 51 HA MET 51 8.528 23.291 2.134
424 HB2 MET 51 1HB MET 51 8.545 25.602 3.910
425 HB3 MET 51 2HB MET 51 9.590 25.824 2.513
426 HG2 MET 51 1HG MET 51 6.973 24.709 1.860
427 HG3 MET 51 2HG MET 51 6.910 26.313 2.586
428 HE1 MET 51 1HE MET 51 9.857 25.685 -0.844
429 HE2 MET 51 2HE MET 51 9.862 24.920 0.745
430 HE3 MET 51 3HE MET 51 8.778 24.329 -0.515
431 H VAL 52 H VAL 52 10.185 22.356 1.141
432 HA VAL 52 HA VAL 52 12.892 22.697 2.194
433 HB VAL 52 HB VAL 52 11.744 20.794 0.157
434 HG11 VAL 52 1HG1 VAL 52 14.623 21.082 1.010
435 HG12 VAL 52 2HG1 VAL 52 13.973 19.814 -0.030
436 HG13 VAL 52 3HG1 VAL 52 13.969 21.491 -0.575
437 HG21 VAL 52 1HG2 VAL 52 13.168 19.495 2.214
438 HG22 VAL 52 2HG2 VAL 52 12.147 20.707 2.987
439 HG23 VAL 52 3HG2 VAL 52 11.427 19.492 1.930
440 H TYR 53 H TYR 53 14.478 23.770 1.150
441 HA TYR 53 HA TYR 53 13.799 24.971 -1.455
442 HB2 TYR 53 1HB TYR 53 15.183 26.091 0.951
443 HB3 TYR 53 2HB TYR 53 15.597 26.709 -0.644
444 HD1 TYR 53 HD1 TYR 53 13.237 27.019 -2.109
445 HD2 TYR 53 HD2 TYR 53 13.745 27.477 2.090
446 HE1 TYR 53 HE1 TYR 53 11.284 28.512 -2.042
447 HE2 TYR 53 HE2 TYR 53 11.792 28.970 2.170
448 HH TYR 53 HH TYR 53 10.564 30.479 0.564
449 H CYS 54 H CYS 54 14.785 22.668 -1.921
450 HA CYS 54 HA CYS 54 17.423 22.017 -1.695
451 HB2 CYS 54 1HB CYS 54 16.011 21.652 -4.325
452 HB3 CYS 54 2HB CYS 54 17.149 20.572 -3.528
453 HG CYS 54 HG CYS 54 14.389 19.630 -3.656
454 H GLY 55 H GLY 55 15.989 24.366 -3.884
455 HA2 GLY 55 1HA GLY 55 16.938 26.016 -5.168
456 HA3 GLY 55 2HA GLY 55 18.367 25.845 -4.159
457 H GLY 56 H GLY 56 19.855 24.049 -4.712
458 HA2 GLY 56 1HA GLY 56 19.669 23.003 -7.413
459 HA3 GLY 56 2HA GLY 56 20.950 24.179 -7.158
460 H ASP 57 H ASP 57 20.107 22.182 -4.491
461 HA ASP 57 HA ASP 57 22.727 20.991 -4.494
462 HB2 ASP 57 1HB ASP 57 20.582 21.391 -2.588
463 HB3 ASP 57 2HB ASP 57 21.199 19.743 -2.509
464 H LEU 58 H LEU 58 22.719 18.533 -3.770
465 HA LEU 58 HA LEU 58 22.234 16.975 -5.959
466 HB2 LEU 58 1HB LEU 58 22.039 16.005 -3.114
467 HB3 LEU 58 2HB LEU 58 22.445 15.044 -4.534
468 HG LEU 58 HG LEU 58 24.538 15.326 -3.725
469 HD11 LEU 58 1HD1 LEU 58 24.286 16.605 -5.915
470 HD12 LEU 58 2HD1 LEU 58 25.718 16.941 -4.943
471 HD13 LEU 58 3HD1 LEU 58 24.361 18.068 -4.932
472 HD21 LEU 58 1HD2 LEU 58 23.257 17.282 -2.095
473 HD22 LEU 58 2HD2 LEU 58 24.759 17.960 -2.724
474 HD23 LEU 58 3HD2 LEU 58 24.785 16.442 -1.825
475 H LEU 59 H LEU 59 20.128 17.144 -3.084
476 HA LEU 59 HA LEU 59 18.068 15.550 -4.112
477 HB2 LEU 59 1HB LEU 59 16.808 16.203 -2.277
478 HB3 LEU 59 2HB LEU 59 18.472 16.357 -1.716
479 HG LEU 59 HG LEU 59 16.978 18.733 -2.771
480 HD11 LEU 59 1HD1 LEU 59 15.489 17.999 -1.111
481 HD12 LEU 59 2HD1 LEU 59 16.495 19.215 -0.324
482 HD13 LEU 59 3HD1 LEU 59 16.797 17.501 -0.038
483 HD21 LEU 59 1HD2 LEU 59 19.325 18.301 -0.939
484 HD22 LEU 59 2HD2 LEU 59 18.517 19.858 -1.122
485 HD23 LEU 59 3HD2 LEU 59 19.303 19.104 -2.509
486 H GLY 60 H GLY 60 18.674 19.014 -4.355
487 HA2 GLY 60 1HA GLY 60 16.191 19.768 -5.446
488 HA3 GLY 60 2HA GLY 60 17.700 20.647 -5.640
489 H GLU 61 H GLU 61 19.275 19.136 -7.125
490 HA GLU 61 HA GLU 61 18.294 19.420 -9.721
491 HB2 GLU 61 1HB GLU 61 20.265 18.028 -10.390
492 HB3 GLU 61 2HB GLU 61 20.658 19.389 -9.349
493 HG2 GLU 61 1HG GLU 61 20.690 17.840 -7.417
494 HG3 GLU 61 2HG GLU 61 20.438 16.501 -8.536
495 H LEU 62 H LEU 62 18.658 16.478 -7.756
496 HA LEU 62 HA LEU 62 17.755 14.624 -9.615
497 HB2 LEU 62 1HB LEU 62 18.684 13.702 -7.714
498 HB3 LEU 62 2HB LEU 62 17.756 14.739 -6.633
499 HG LEU 62 HG LEU 62 15.783 13.413 -6.956
500 HD11 LEU 62 1HD1 LEU 62 15.573 11.640 -8.472
501 HD12 LEU 62 2HD1 LEU 62 17.308 11.578 -8.777
502 HD13 LEU 62 3HD1 LEU 62 16.352 12.926 -9.393
503 HD21 LEU 62 1HD2 LEU 62 16.436 11.827 -5.522
504 HD22 LEU 62 2HD2 LEU 62 18.037 12.554 -5.658
505 HD23 LEU 62 3HD2 LEU 62 17.614 11.160 -6.653
506 H LEU 63 H LEU 63 15.860 16.303 -7.105
507 HA LEU 63 HA LEU 63 13.365 15.261 -7.771
508 HB2 LEU 63 1HB LEU 63 14.388 17.531 -6.239
509 HB3 LEU 63 2HB LEU 63 12.785 17.800 -6.920
510 HG LEU 63 HG LEU 63 13.167 16.753 -4.504
511 HD11 LEU 63 1HD1 LEU 63 11.048 16.333 -6.550
512 HD12 LEU 63 2HD1 LEU 63 10.990 17.219 -5.027
513 HD13 LEU 63 3HD1 LEU 63 10.941 15.456 -5.024
514 HD21 LEU 63 1HD2 LEU 63 12.634 14.207 -5.887
515 HD22 LEU 63 2HD2 LEU 63 13.509 14.527 -4.390
516 HD23 LEU 63 3HD2 LEU 63 14.301 14.779 -5.946
517 H GLY 64 H GLY 64 15.104 18.040 -9.082
518 HA2 GLY 64 1HA GLY 64 14.872 18.813 -11.298
519 HA3 GLY 64 2HA GLY 64 13.323 17.990 -11.399
520 H ARG 65 H ARG 65 12.779 19.283 -8.635
521 HA ARG 65 HA ARG 65 11.740 21.784 -9.765
522 HB2 ARG 65 1HB ARG 65 10.906 20.690 -7.103
523 HB3 ARG 65 2HB ARG 65 9.995 21.687 -8.229
524 HG2 ARG 65 1HG ARG 65 10.590 18.750 -8.422
525 HG3 ARG 65 2HG ARG 65 9.019 19.541 -8.280
526 HD2 ARG 65 1HD ARG 65 9.157 20.404 -10.486
527 HD3 ARG 65 2HD ARG 65 10.859 19.964 -10.622
528 HE ARG 65 HE ARG 65 10.237 17.816 -11.148
529 HH11 ARG 65 1HH1 ARG 65 7.482 19.570 -9.942
530 HH12 ARG 65 2HH1 ARG 65 6.343 18.340 -10.378
531 HH21 ARG 65 1HH2 ARG 65 8.747 16.189 -11.728
532 HH22 ARG 65 2HH2 ARG 65 7.064 16.417 -11.393
533 H GLN 66 H GLN 66 12.542 23.684 -9.155
534 HA GLN 66 HA GLN 66 14.834 24.103 -7.774
535 HB2 GLN 66 1HB GLN 66 12.498 26.009 -7.625
536 HB3 GLN 66 2HB GLN 66 14.209 26.407 -7.535
537 HG2 GLN 66 1HG GLN 66 14.050 26.877 -9.699
538 HG3 GLN 66 2HG GLN 66 14.022 25.132 -9.951
539 HE21 GLN 66 2HE2 GLN 66 11.899 27.886 -9.301
540 HE22 GLN 66 1HE2 GLN 66 10.562 27.299 -10.223
541 H SER 67 H SER 67 11.615 23.743 -6.410
542 HA SER 67 HA SER 67 12.742 23.130 -3.828
543 HB2 SER 67 1HB SER 67 10.831 24.964 -3.031
544 HB3 SER 67 2HB SER 67 12.575 25.223 -3.011
545 HG SER 67 HG SER 67 12.426 26.204 -5.016
546 H PHE 68 H PHE 68 11.249 22.130 -2.412
547 HA PHE 68 HA PHE 68 8.566 21.619 -3.451
548 HB2 PHE 68 1HB PHE 68 8.770 19.220 -3.217
549 HB3 PHE 68 2HB PHE 68 10.042 19.797 -4.289
550 HD1 PHE 68 HD1 PHE 68 9.446 19.031 -0.690
551 HD2 PHE 68 HD2 PHE 68 12.196 19.072 -3.939
552 HE1 PHE 68 HE1 PHE 68 11.129 17.927 0.725
553 HE2 PHE 68 HE2 PHE 68 13.883 17.968 -2.529
554 HZ PHE 68 HZ PHE 68 13.351 17.393 -0.194
555 H SER 69 H SER 69 7.088 20.800 -1.868
556 HA SER 69 HA SER 69 7.831 21.617 0.842
557 HB2 SER 69 1HB SER 69 5.145 21.130 -0.458
558 HB3 SER 69 2HB SER 69 5.347 21.510 1.252
559 HG SER 69 HG SER 69 4.923 23.333 -0.206
560 H VAL 70 H VAL 70 7.736 20.277 2.592
561 HA VAL 70 HA VAL 70 7.966 17.472 2.107
562 HB VAL 70 HB VAL 70 8.756 17.292 4.225
563 HG11 VAL 70 1HG1 VAL 70 10.038 19.163 4.820
564 HG12 VAL 70 2HG1 VAL 70 9.802 19.321 3.079
565 HG13 VAL 70 3HG1 VAL 70 8.839 20.293 4.193
566 HG21 VAL 70 1HG2 VAL 70 6.593 19.226 5.000
567 HG22 VAL 70 2HG2 VAL 70 6.773 17.533 5.458
568 HG23 VAL 70 3HG2 VAL 70 7.864 18.748 6.126
569 H LYS 71 H LYS 71 5.452 19.587 3.337
570 HA LYS 71 HA LYS 71 3.755 17.465 4.248
571 HB2 LYS 71 1HB LYS 71 3.848 20.137 4.736
572 HB3 LYS 71 2HB LYS 71 2.522 20.063 3.582
573 HG2 LYS 71 1HG LYS 71 1.268 18.619 4.981
574 HG3 LYS 71 2HG LYS 71 2.648 18.349 6.048
575 HD2 LYS 71 1HD LYS 71 1.680 21.137 5.654
576 HD3 LYS 71 2HD LYS 71 0.733 20.055 6.677
577 HE2 LYS 71 1HE LYS 71 3.034 19.540 7.784
578 HE3 LYS 71 2HE LYS 71 3.521 21.069 7.053
579 HZ1 LYS 71 1HZ LYS 71 2.589 22.090 8.764
580 HZ2 LYS 71 2HZ LYS 71 1.999 20.633 9.388
581 HZ3 LYS 71 3HZ LYS 71 1.074 21.513 8.278
582 H ASP 72 H ASP 72 4.670 18.305 1.231
583 HA ASP 72 HA ASP 72 2.131 17.365 0.071
584 HB2 ASP 72 1HB ASP 72 2.253 19.658 -0.540
585 HB3 ASP 72 2HB ASP 72 3.968 19.540 -0.924
586 HA PRO 73 HA PRO 73 5.371 14.346 -1.094
587 HB2 PRO 73 1HB PRO 73 3.666 12.234 -1.159
588 HB3 PRO 73 2HB PRO 73 4.420 12.814 0.330
589 HG2 PRO 73 1HG PRO 73 1.670 13.339 -0.730
590 HG3 PRO 73 2HG PRO 73 2.177 12.962 0.927
591 HD2 PRO 73 1HD PRO 73 1.622 15.484 0.112
592 HD3 PRO 73 2HD PRO 73 2.844 15.128 1.350
593 H SER 74 H SER 74 4.558 16.072 -3.009
594 HA SER 74 HA SER 74 3.230 14.521 -5.103
595 HB2 SER 74 1HB SER 74 2.284 16.592 -5.269
596 HB3 SER 74 2HB SER 74 3.695 17.406 -4.593
597 HG SER 74 HG SER 74 3.449 17.892 -6.800
598 HA PRO 75 HA PRO 75 7.301 15.655 -7.380
599 HB2 PRO 75 1HB PRO 75 9.135 17.168 -6.070
600 HB3 PRO 75 2HB PRO 75 7.824 17.864 -7.028
601 HG2 PRO 75 1HG PRO 75 8.009 17.484 -4.065
602 HG3 PRO 75 2HG PRO 75 7.412 18.882 -4.979
603 HD2 PRO 75 1HD PRO 75 5.753 17.061 -3.855
604 HD3 PRO 75 2HD PRO 75 5.356 17.914 -5.360
605 H LEU 76 H LEU 76 7.325 14.870 -4.005
606 HA LEU 76 HA LEU 76 9.910 13.718 -3.861
607 HB2 LEU 76 1HB LEU 76 8.469 14.425 -1.928
608 HB3 LEU 76 2HB LEU 76 7.503 12.978 -2.209
609 HG LEU 76 HG LEU 76 9.804 11.755 -1.919
610 HD11 LEU 76 1HD1 LEU 76 10.335 14.502 -0.976
611 HD12 LEU 76 2HD1 LEU 76 11.437 13.288 -1.626
612 HD13 LEU 76 3HD1 LEU 76 10.906 13.189 0.053
613 HD21 LEU 76 1HD2 LEU 76 9.011 11.101 0.084
614 HD22 LEU 76 2HD2 LEU 76 7.611 12.072 -0.375
615 HD23 LEU 76 3HD2 LEU 76 8.850 12.753 0.680
616 H TYR 77 H TYR 77 6.700 12.172 -4.071
617 HA TYR 77 HA TYR 77 7.737 9.578 -4.533
618 HB2 TYR 77 1HB TYR 77 5.019 10.821 -4.879
619 HB3 TYR 77 2HB TYR 77 5.329 9.159 -5.368
620 HD1 TYR 77 HD1 TYR 77 6.005 7.479 -3.652
621 HD2 TYR 77 HD2 TYR 77 4.742 11.401 -2.591
622 HE1 TYR 77 HE1 TYR 77 5.622 6.724 -1.343
623 HE2 TYR 77 HE2 TYR 77 4.357 10.658 -0.278
624 HH TYR 77 HH TYR 77 4.377 8.948 1.134
625 H ASP 78 H ASP 78 6.699 12.183 -6.656
626 HA ASP 78 HA ASP 78 6.647 10.769 -9.074
627 HB2 ASP 78 1HB ASP 78 6.041 13.297 -8.389
628 HB3 ASP 78 2HB ASP 78 7.615 13.575 -9.130
629 H MET 79 H MET 79 9.296 12.219 -7.283
630 HA MET 79 HA MET 79 11.213 11.815 -9.394
631 HB2 MET 79 1HB MET 79 11.638 13.654 -7.950
632 HB3 MET 79 2HB MET 79 11.451 12.661 -6.511
633 HG2 MET 79 1HG MET 79 13.626 12.105 -8.486
634 HG3 MET 79 2HG MET 79 13.811 13.352 -7.255
635 HE1 MET 79 1HE MET 79 13.889 11.456 -3.943
636 HE2 MET 79 2HE MET 79 14.540 12.854 -4.800
637 HE3 MET 79 3HE MET 79 12.795 12.616 -4.697
638 H LEU 80 H LEU 80 10.316 10.198 -6.389
639 HA LEU 80 HA LEU 80 12.424 8.308 -6.400
640 HB2 LEU 80 1HB LEU 80 9.693 8.212 -5.130
641 HB3 LEU 80 2HB LEU 80 10.977 7.044 -4.823
642 HG LEU 80 HG LEU 80 11.169 9.991 -4.207
643 HD11 LEU 80 1HD1 LEU 80 10.119 9.648 -2.284
644 HD12 LEU 80 2HD1 LEU 80 11.127 8.248 -1.921
645 HD13 LEU 80 3HD1 LEU 80 9.658 8.052 -2.877
646 HD21 LEU 80 1HD2 LEU 80 13.286 8.678 -4.644
647 HD22 LEU 80 2HD2 LEU 80 12.889 7.733 -3.209
648 HD23 LEU 80 3HD2 LEU 80 13.174 9.469 -3.072
649 H ARG 81 H ARG 81 9.271 8.411 -7.908
650 HA ARG 81 HA ARG 81 8.758 5.801 -8.522
651 HB2 ARG 81 1HB ARG 81 7.310 6.575 -10.121
652 HB3 ARG 81 2HB ARG 81 7.580 8.063 -9.223
653 HG2 ARG 81 1HG ARG 81 9.246 8.757 -10.867
654 HG3 ARG 81 2HG ARG 81 8.980 7.262 -11.766
655 HD2 ARG 81 1HD ARG 81 6.553 8.810 -11.179
656 HD3 ARG 81 2HD ARG 81 7.701 9.608 -12.253
657 HE ARG 81 HE ARG 81 6.020 7.410 -12.894
658 HH11 ARG 81 1HH1 ARG 81 9.164 8.769 -13.515
659 HH12 ARG 81 2HH1 ARG 81 9.311 8.045 -15.082
660 HH21 ARG 81 1HH2 ARG 81 6.202 6.451 -14.955
661 HH22 ARG 81 2HH2 ARG 81 7.625 6.727 -15.901
662 H LYS 82 H LYS 82 10.889 7.998 -10.330
663 HA LYS 82 HA LYS 82 11.954 5.672 -11.782
664 HB2 LYS 82 1HB LYS 82 12.198 6.970 -13.612
665 HB3 LYS 82 2HB LYS 82 11.031 8.012 -12.809
666 HG2 LYS 82 1HG LYS 82 14.026 8.303 -12.683
667 HG3 LYS 82 2HG LYS 82 12.929 9.277 -13.664
668 HD2 LYS 82 1HD LYS 82 12.353 9.112 -10.763
669 HD3 LYS 82 2HD LYS 82 13.777 10.037 -11.245
670 HE2 LYS 82 1HE LYS 82 11.098 10.873 -11.258
671 HE3 LYS 82 2HE LYS 82 12.501 11.741 -11.877
672 HZ1 LYS 82 1HZ LYS 82 10.589 11.341 -13.470
673 HZ2 LYS 82 2HZ LYS 82 11.080 9.723 -13.505
674 HZ3 LYS 82 3HZ LYS 82 12.136 10.938 -14.024
675 H ASN 83 H ASN 83 12.611 7.458 -9.131
676 HA ASN 83 HA ASN 83 15.522 7.416 -9.536
677 HB2 ASN 83 1HB ASN 83 14.528 9.578 -8.842
678 HB3 ASN 83 2HB ASN 83 13.924 8.810 -7.377
679 HD21 ASN 83 2HD2 ASN 83 15.123 9.099 -5.654
680 HD22 ASN 83 1HD2 ASN 83 16.826 9.388 -5.631
681 H LEU 84 H LEU 84 13.090 6.675 -7.037
682 HA LEU 84 HA LEU 84 14.980 4.945 -5.666
683 HB2 LEU 84 1HB LEU 84 12.907 6.540 -4.820
684 HB3 LEU 84 2HB LEU 84 12.219 4.920 -4.725
685 HG LEU 84 HG LEU 84 13.084 5.404 -2.584
686 HD11 LEU 84 1HD1 LEU 84 13.598 3.190 -2.984
687 HD12 LEU 84 2HD1 LEU 84 15.165 3.854 -2.522
688 HD13 LEU 84 3HD1 LEU 84 14.791 3.580 -4.224
689 HD21 LEU 84 1HD2 LEU 84 15.832 5.816 -2.891
690 HD22 LEU 84 2HD2 LEU 84 14.624 6.988 -2.363
691 HD23 LEU 84 3HD2 LEU 84 15.059 6.877 -4.069
692 H VAL 85 H VAL 85 15.279 3.020 -6.608
693 HA VAL 85 HA VAL 85 13.596 1.644 -8.296
694 HB VAL 85 HB VAL 85 15.859 0.847 -6.551
695 HG11 VAL 85 1HG1 VAL 85 14.424 -0.980 -6.051
696 HG12 VAL 85 2HG1 VAL 85 13.910 -1.120 -7.733
697 HG13 VAL 85 3HG1 VAL 85 15.561 -1.542 -7.276
698 HG21 VAL 85 1HG2 VAL 85 15.321 1.314 -9.329
699 HG22 VAL 85 2HG2 VAL 85 16.871 1.109 -8.513
700 HG23 VAL 85 3HG2 VAL 85 15.996 -0.301 -9.110
701 H THR 86 H THR 86 11.988 0.140 -8.085
702 HA THR 86 HA THR 86 11.122 -0.627 -5.397
703 HB THR 86 HB THR 86 8.708 -0.190 -6.185
704 HG1 THR 86 1HG THR 86 10.113 0.791 -8.274
705 HG21 THR 86 1HG2 THR 86 9.839 1.068 -4.392
706 HG22 THR 86 2HG2 THR 86 8.757 2.092 -5.337
707 HG23 THR 86 3HG2 THR 86 10.499 2.171 -5.599
708 H LEU 87 H LEU 87 10.918 -2.759 -5.373
709 HA LEU 87 HA LEU 87 10.335 -4.167 -7.878
710 HB2 LEU 87 1HB LEU 87 10.904 -6.011 -5.834
711 HB3 LEU 87 2HB LEU 87 11.915 -5.562 -7.206
712 HG LEU 87 HG LEU 87 11.956 -4.217 -4.505
713 HD11 LEU 87 1HD1 LEU 87 12.846 -6.675 -4.874
714 HD12 LEU 87 2HD1 LEU 87 13.736 -5.506 -3.900
715 HD13 LEU 87 3HD1 LEU 87 14.223 -5.817 -5.566
716 HD21 LEU 87 1HD2 LEU 87 14.302 -3.692 -5.892
717 HD22 LEU 87 2HD2 LEU 87 12.972 -2.570 -5.602
718 HD23 LEU 87 3HD2 LEU 87 13.026 -3.506 -7.096
719 H ALA 88 H ALA 88 9.314 -6.518 -7.022
720 HA ALA 88 HA ALA 88 7.319 -7.524 -6.574
721 HB1 ALA 88 1HB ALA 88 6.284 -6.880 -4.366
722 HB2 ALA 88 2HB ALA 88 7.975 -7.380 -4.303
723 HB3 ALA 88 3HB ALA 88 7.558 -5.668 -4.217
724 H THR 89 H THR 89 7.306 -5.148 -8.295
725 HA THR 89 HA THR 89 5.828 -3.789 -9.369
726 HB THR 89 HB THR 89 3.388 -4.935 -8.215
727 HG1 THR 89 1HG THR 89 5.294 -6.624 -9.501
728 HG21 THR 89 1HG2 THR 89 4.041 -3.683 -10.519
729 HG22 THR 89 2HG2 THR 89 2.633 -4.730 -10.338
730 HG23 THR 89 3HG2 THR 89 4.121 -5.366 -11.039
731 H1 SER 115 H SER 115 7.379 14.309 15.897
732 HA SER 115 HA SER 115 6.620 12.033 17.414
733 HB2 SER 115 1HB SER 115 8.155 11.528 15.032
734 HB3 SER 115 2HB SER 115 9.115 11.120 16.454
735 HG SER 115 HG SER 115 6.546 10.144 15.757
736 H GLN 116 H GLN 116 9.851 13.106 16.391
737 HA GLN 116 HA GLN 116 10.459 13.715 19.191
738 HB2 GLN 116 1HB GLN 116 12.032 12.823 16.856
739 HB3 GLN 116 2HB GLN 116 12.837 13.972 17.916
740 HG2 GLN 116 1HG GLN 116 13.460 12.156 19.052
741 HG3 GLN 116 2HG GLN 116 11.830 12.221 19.720
742 HE21 GLN 116 2HE2 GLN 116 10.164 11.102 18.268
743 HE22 GLN 116 1HE2 GLN 116 10.622 9.551 17.660
744 H GLU 117 H GLU 117 8.959 15.433 17.178
745 HA GLU 117 HA GLU 117 8.679 17.717 17.076
746 HB2 GLU 117 1HB GLU 117 9.818 19.045 18.493
747 HB3 GLU 117 2HB GLU 117 10.491 17.541 19.107
748 HG2 GLU 117 1HG GLU 117 12.267 17.919 17.226
749 HG3 GLU 117 2HG GLU 117 11.731 19.594 17.346
750 H THR 118 H THR 118 10.203 19.685 16.122
751 HA THR 118 HA THR 118 10.916 20.495 14.105
752 HB THR 118 HB THR 118 12.914 18.334 13.790
753 HG1 THR 118 1HG THR 118 14.050 18.990 15.647
754 HG21 THR 118 1HG2 THR 118 13.470 21.247 14.189
755 HG22 THR 118 2HG2 THR 118 12.762 20.687 12.675
756 HG23 THR 118 3HG2 THR 118 14.329 20.070 13.198
757 H PHE 119 H PHE 119 12.283 18.912 12.044
758 HA PHE 119 HA PHE 119 10.376 18.481 10.207
759 HB2 PHE 119 1HB PHE 119 13.041 17.954 10.301
760 HB3 PHE 119 2HB PHE 119 12.388 16.321 10.212
761 HD1 PHE 119 HD1 PHE 119 9.884 17.531 8.601
762 HD2 PHE 119 HD2 PHE 119 14.112 17.526 8.110
763 HE1 PHE 119 HE1 PHE 119 9.599 17.777 6.169
764 HE2 PHE 119 HE2 PHE 119 13.834 17.773 5.678
765 HZ PHE 119 HZ PHE 119 11.575 17.900 4.705
766 H SER 120 H SER 120 11.328 16.160 12.698
767 HA SER 120 HA SER 120 9.945 13.922 11.930
768 HB2 SER 120 1HB SER 120 11.255 14.749 14.235
769 HB3 SER 120 2HB SER 120 9.610 14.424 14.783
770 HG SER 120 HG SER 120 11.210 12.632 13.269
771 H ASP 121 H ASP 121 8.679 16.744 13.654
772 HA ASP 121 HA ASP 121 6.137 15.894 14.258
773 HB2 ASP 121 1HB ASP 121 7.102 18.101 14.882
774 HB3 ASP 121 2HB ASP 121 6.862 18.641 13.222
775 H LEU 122 H LEU 122 6.910 17.804 11.344
776 HA LEU 122 HA LEU 122 4.455 17.018 10.076
777 HB2 LEU 122 1HB LEU 122 6.763 18.340 8.693
778 HB3 LEU 122 2HB LEU 122 5.041 18.474 8.340
779 HG LEU 122 HG LEU 122 6.074 19.514 10.939
780 HD11 LEU 122 1HD1 LEU 122 6.806 20.511 8.285
781 HD12 LEU 122 2HD1 LEU 122 7.533 20.826 9.860
782 HD13 LEU 122 3HD1 LEU 122 6.104 21.725 9.355
783 HD21 LEU 122 1HD2 LEU 122 4.053 20.443 11.067
784 HD22 LEU 122 2HD2 LEU 122 3.606 19.427 9.696
785 HD23 LEU 122 3HD2 LEU 122 4.157 21.081 9.426
786 H TRP 123 H TRP 123 7.895 16.538 9.256
787 HA TRP 123 HA TRP 123 7.837 14.988 7.087
788 HB2 TRP 123 1HB TRP 123 9.833 15.537 8.603
789 HB3 TRP 123 2HB TRP 123 9.431 14.057 9.469
790 HD1 TRP 123 HD1 TRP 123 10.845 12.085 8.691
791 HE1 TRP 123 HE1 TRP 123 11.944 11.346 6.484
792 HE3 TRP 123 HE3 TRP 123 9.343 15.951 5.701
793 HZ2 TRP 123 HZ2 TRP 123 12.148 12.278 3.828
794 HZ3 TRP 123 HZ3 TRP 123 10.034 15.951 3.339
795 HH2 TRP 123 HH2 TRP 123 11.408 14.152 2.424
796 H LYS 124 H LYS 124 7.423 13.614 10.354
797 HA LYS 124 HA LYS 124 6.916 10.999 9.691
798 HB2 LYS 124 1HB LYS 124 7.115 11.897 12.004
799 HB3 LYS 124 2HB LYS 124 5.493 12.561 11.854
800 HG2 LYS 124 1HG LYS 124 5.543 9.750 11.197
801 HG3 LYS 124 2HG LYS 124 6.192 10.053 12.809
802 HD2 LYS 124 1HD LYS 124 3.985 9.910 13.346
803 HD3 LYS 124 2HD LYS 124 4.050 11.627 12.944
804 HE2 LYS 124 1HE LYS 124 2.717 11.365 11.169
805 HE3 LYS 124 2HE LYS 124 3.595 9.939 10.617
806 HZ1 LYS 124 1HZ LYS 124 1.557 9.949 12.777
807 HZ2 LYS 124 2HZ LYS 124 2.355 8.591 12.163
808 HZ3 LYS 124 3HZ LYS 124 1.278 9.453 11.184
809 H LEU 125 H LEU 125 4.598 13.682 9.795
810 HA LEU 125 HA LEU 125 2.248 12.327 9.318
811 HB2 LEU 125 1HB LEU 125 2.647 14.819 9.715
812 HB3 LEU 125 2HB LEU 125 2.900 14.932 7.975
813 HG LEU 125 HG LEU 125 0.362 13.875 9.206
814 HD11 LEU 125 1HD1 LEU 125 1.014 16.311 9.773
815 HD12 LEU 125 2HD1 LEU 125 -0.598 15.981 9.140
816 HD13 LEU 125 3HD1 LEU 125 0.650 16.630 8.077
817 HD21 LEU 125 1HD2 LEU 125 -0.182 14.978 6.749
818 HD22 LEU 125 2HD2 LEU 125 0.033 13.259 7.084
819 HD23 LEU 125 3HD2 LEU 125 1.392 14.222 6.502
820 H LEU 126 H LEU 126 4.754 13.257 7.027
821 HA LEU 126 HA LEU 126 3.668 12.977 4.593
822 HB2 LEU 126 1HB LEU 126 6.153 13.138 5.351
823 HB3 LEU 126 2HB LEU 126 6.132 11.385 5.170
824 HG LEU 126 HG LEU 126 5.171 12.038 2.775
825 HD11 LEU 126 1HD1 LEU 126 6.974 14.078 2.348
826 HD12 LEU 126 2HD1 LEU 126 6.197 14.527 3.866
827 HD13 LEU 126 3HD1 LEU 126 5.219 14.237 2.427
828 HD21 LEU 126 1HD2 LEU 126 7.250 10.740 3.439
829 HD22 LEU 126 2HD2 LEU 126 8.118 12.271 3.325
830 HD23 LEU 126 3HD2 LEU 126 7.315 11.604 1.903
831 HA PRO 127 HA PRO 127 1.642 9.014 4.687
832 HB2 PRO 127 1HB PRO 127 0.722 9.110 2.135
833 HB3 PRO 127 2HB PRO 127 -0.024 10.012 3.459
834 HG2 PRO 127 1HG PRO 127 1.901 10.959 1.372
835 HG3 PRO 127 2HG PRO 127 0.445 11.757 1.996
836 HD2 PRO 127 1HD PRO 127 2.937 12.424 2.818
837 HD3 PRO 127 2HD PRO 127 1.521 12.523 3.885
838 H GLU 128 H GLU 128 4.154 8.430 4.696
839 HA GLU 128 HA GLU 128 5.668 7.751 2.578
840 HB2 GLU 128 1HB GLU 128 6.118 5.535 3.996
841 HB3 GLU 128 2HB GLU 128 6.704 7.113 4.504
842 HG2 GLU 128 1HG GLU 128 4.009 6.515 5.442
843 HG3 GLU 128 2HG GLU 128 5.233 5.390 6.028
844 H ASN 129 H ASN 129 2.730 6.130 3.589
845 HA ASN 129 HA ASN 129 2.817 4.560 1.105
846 HB2 ASN 129 1HB ASN 129 1.719 2.682 2.337
847 HB3 ASN 129 2HB ASN 129 3.367 3.007 2.867
848 HD21 ASN 129 2HD2 ASN 129 0.253 2.466 3.858
849 HD22 ASN 129 1HD2 ASN 129 0.374 3.054 5.478
Start of MODEL 13
1 H1 GLN 1 H GLN 1 0.880 0.955 -0.692
2 HA GLN 1 HA GLN 1 1.497 -1.797 -0.594
3 HB2 GLN 1 1HB GLN 1 2.198 0.491 -2.348
4 HB3 GLN 1 2HB GLN 1 3.266 -0.905 -2.409
5 HG2 GLN 1 1HG GLN 1 0.400 -1.520 -2.557
6 HG3 GLN 1 2HG GLN 1 1.049 -0.606 -3.917
7 HE21 GLN 1 2HE2 GLN 1 1.352 -1.978 -5.521
8 HE22 GLN 1 1HE2 GLN 1 2.141 -3.511 -5.409
9 H ILE 2 H ILE 2 3.966 0.737 -0.867
10 HA ILE 2 HA ILE 2 5.996 1.009 0.127
11 HB ILE 2 HB ILE 2 4.948 -0.742 2.350
12 HG12 ILE 2 1HG1 ILE 2 3.542 1.328 1.649
13 HG13 ILE 2 2HG1 ILE 2 3.940 1.109 3.349
14 HG21 ILE 2 1HG2 ILE 2 7.267 -0.463 2.616
15 HG22 ILE 2 2HG2 ILE 2 7.202 1.231 2.130
16 HG23 ILE 2 3HG2 ILE 2 6.533 0.733 3.684
17 HD11 ILE 2 1HD1 ILE 2 5.769 2.708 3.123
18 HD12 ILE 2 2HD1 ILE 2 5.361 2.930 1.422
19 HD13 ILE 2 3HD1 ILE 2 4.219 3.418 2.674
20 H ASN 3 H ASN 3 7.129 -0.138 -1.445
21 HA ASN 3 HA ASN 3 7.683 -2.965 -0.866
22 HB2 ASN 3 1HB ASN 3 7.256 -1.490 -3.303
23 HB3 ASN 3 2HB ASN 3 8.844 -2.252 -3.336
24 HD21 ASN 3 2HD2 ASN 3 5.971 -3.426 -1.688
25 HD22 ASN 3 1HD2 ASN 3 5.790 -4.861 -2.633
26 H GLN 4 H GLN 4 9.993 -3.606 -1.629
27 HA GLN 4 HA GLN 4 11.826 -2.056 -0.034
28 HB2 GLN 4 1HB GLN 4 12.539 -4.438 -1.732
29 HB3 GLN 4 2HB GLN 4 13.341 -3.858 -0.278
30 HG2 GLN 4 1HG GLN 4 12.209 -5.486 0.742
31 HG3 GLN 4 2HG GLN 4 10.848 -4.368 0.662
32 HE21 GLN 4 2HE2 GLN 4 9.064 -5.307 0.010
33 HE22 GLN 4 1HE2 GLN 4 8.940 -6.579 -1.152
34 H VAL 5 H VAL 5 14.001 -1.486 -0.858
35 HA VAL 5 HA VAL 5 14.140 -0.934 -3.720
36 HB VAL 5 HB VAL 5 14.712 1.412 -3.407
37 HG11 VAL 5 1HG1 VAL 5 12.158 1.199 -1.907
38 HG12 VAL 5 2HG1 VAL 5 12.561 2.165 -3.328
39 HG13 VAL 5 3HG1 VAL 5 12.250 0.437 -3.495
40 HG21 VAL 5 1HG2 VAL 5 13.786 1.413 -0.587
41 HG22 VAL 5 2HG2 VAL 5 15.422 0.844 -0.915
42 HG23 VAL 5 3HG2 VAL 5 14.940 2.470 -1.400
43 H ARG 6 H ARG 6 16.329 0.149 -4.226
44 HA ARG 6 HA ARG 6 18.424 -0.789 -2.399
45 HB2 ARG 6 1HB ARG 6 17.798 -2.304 -4.513
46 HB3 ARG 6 2HB ARG 6 18.886 -1.175 -5.310
47 HG2 ARG 6 1HG ARG 6 20.463 -1.747 -3.300
48 HG3 ARG 6 2HG ARG 6 19.460 -3.196 -3.203
49 HD2 ARG 6 1HD ARG 6 21.000 -3.976 -4.671
50 HD3 ARG 6 2HD ARG 6 19.932 -3.187 -5.831
51 HE ARG 6 HE ARG 6 21.567 -1.627 -6.231
52 HH11 ARG 6 1HH1 ARG 6 22.362 -3.429 -3.361
53 HH12 ARG 6 2HH1 ARG 6 23.957 -2.766 -3.228
54 HH21 ARG 6 1HH2 ARG 6 23.664 -0.747 -6.068
55 HH22 ARG 6 2HH2 ARG 6 24.696 -1.239 -4.768
56 HA PRO 7 HA PRO 7 19.524 3.463 -3.445
57 HB2 PRO 7 1HB PRO 7 21.258 3.751 -1.376
58 HB3 PRO 7 2HB PRO 7 19.507 3.908 -1.191
59 HG2 PRO 7 1HG PRO 7 21.273 1.569 -0.582
60 HG3 PRO 7 2HG PRO 7 19.930 2.234 0.366
61 HD2 PRO 7 1HD PRO 7 19.664 0.038 -1.197
62 HD3 PRO 7 2HD PRO 7 18.334 1.183 -0.923
63 H LYS 8 H LYS 8 20.805 3.548 -5.194
64 HA LYS 8 HA LYS 8 23.101 1.942 -5.592
65 HB2 LYS 8 1HB LYS 8 22.311 4.515 -6.971
66 HB3 LYS 8 2HB LYS 8 23.514 3.370 -7.549
67 HG2 LYS 8 1HG LYS 8 20.917 2.153 -7.030
68 HG3 LYS 8 2HG LYS 8 20.874 3.416 -8.263
69 HD2 LYS 8 1HD LYS 8 23.033 2.142 -9.117
70 HD3 LYS 8 2HD LYS 8 22.278 0.792 -8.266
71 HE2 LYS 8 1HE LYS 8 20.226 1.136 -9.565
72 HE3 LYS 8 2HE LYS 8 20.995 2.473 -10.420
73 HZ1 LYS 8 1HZ LYS 8 22.354 -0.116 -10.440
74 HZ2 LYS 8 2HZ LYS 8 22.284 1.076 -11.637
75 HZ3 LYS 8 3HZ LYS 8 20.966 0.045 -11.394
76 H LEU 9 H LEU 9 25.279 2.980 -6.139
77 HA LEU 9 HA LEU 9 26.638 3.787 -3.981
78 HB2 LEU 9 1HB LEU 9 27.697 5.383 -6.056
79 HB3 LEU 9 2HB LEU 9 28.279 3.829 -5.463
80 HG LEU 9 HG LEU 9 26.115 3.978 -7.534
81 HD11 LEU 9 1HD1 LEU 9 28.076 5.331 -8.276
82 HD12 LEU 9 2HD1 LEU 9 27.736 3.924 -9.283
83 HD13 LEU 9 3HD1 LEU 9 29.066 3.880 -8.126
84 HD21 LEU 9 1HD2 LEU 9 27.160 1.896 -6.125
85 HD22 LEU 9 2HD2 LEU 9 28.154 1.874 -7.583
86 HD23 LEU 9 3HD2 LEU 9 26.398 1.761 -7.710
87 HA PRO 10 HA PRO 10 25.811 8.486 -4.742
88 HB2 PRO 10 1HB PRO 10 23.934 9.138 -6.591
89 HB3 PRO 10 2HB PRO 10 25.644 8.930 -6.990
90 HG2 PRO 10 1HG PRO 10 23.372 7.011 -7.333
91 HG3 PRO 10 2HG PRO 10 24.697 7.387 -8.450
92 HD2 PRO 10 1HD PRO 10 24.694 5.177 -6.886
93 HD3 PRO 10 2HD PRO 10 26.187 6.022 -7.341
94 H LEU 11 H LEU 11 23.277 6.120 -4.793
95 HA LEU 11 HA LEU 11 21.371 7.887 -3.482
96 HB2 LEU 11 1HB LEU 11 21.247 5.435 -4.984
97 HB3 LEU 11 2HB LEU 11 20.398 5.260 -3.450
98 HG LEU 11 HG LEU 11 18.788 6.820 -4.013
99 HD11 LEU 11 1HD1 LEU 11 19.167 8.304 -6.109
100 HD12 LEU 11 2HD1 LEU 11 20.871 7.942 -5.838
101 HD13 LEU 11 3HD1 LEU 11 19.930 8.744 -4.580
102 HD21 LEU 11 1HD2 LEU 11 18.012 5.287 -5.448
103 HD22 LEU 11 2HD2 LEU 11 19.595 5.031 -6.183
104 HD23 LEU 11 3HD2 LEU 11 18.590 6.386 -6.701
105 H LEU 12 H LEU 12 23.836 5.720 -2.632
106 HA LEU 12 HA LEU 12 22.729 4.841 -0.133
107 HB2 LEU 12 1HB LEU 12 24.746 3.959 -1.719
108 HB3 LEU 12 2HB LEU 12 25.650 4.803 -0.464
109 HG LEU 12 HG LEU 12 24.136 2.270 -0.340
110 HD11 LEU 12 1HD1 LEU 12 26.748 3.264 0.224
111 HD12 LEU 12 2HD1 LEU 12 26.171 1.598 0.219
112 HD13 LEU 12 3HD1 LEU 12 26.070 2.561 1.693
113 HD21 LEU 12 1HD2 LEU 12 22.733 3.204 1.208
114 HD22 LEU 12 2HD2 LEU 12 23.915 4.411 1.717
115 HD23 LEU 12 3HD2 LEU 12 24.078 2.737 2.249
116 H LYS 13 H LYS 13 25.225 7.187 -1.087
117 HA LYS 13 HA LYS 13 25.907 8.083 1.464
118 HB2 LYS 13 1HB LYS 13 26.469 10.267 0.181
119 HB3 LYS 13 2HB LYS 13 27.348 8.796 -0.216
120 HG2 LYS 13 1HG LYS 13 26.691 8.919 -2.324
121 HG3 LYS 13 2HG LYS 13 24.995 8.970 -1.835
122 HD2 LYS 13 1HD LYS 13 25.044 11.019 -2.770
123 HD3 LYS 13 2HD LYS 13 25.773 11.494 -1.234
124 HE2 LYS 13 1HE LYS 13 27.336 12.359 -2.640
125 HE3 LYS 13 2HE LYS 13 27.983 10.726 -2.496
126 HZ1 LYS 13 1HZ LYS 13 27.925 10.797 -4.721
127 HZ2 LYS 13 2HZ LYS 13 26.780 12.041 -4.776
128 HZ3 LYS 13 3HZ LYS 13 26.281 10.442 -4.537
129 H ILE 14 H ILE 14 23.129 8.756 -0.499
130 HA ILE 14 HA ILE 14 22.291 11.161 0.702
131 HB ILE 14 HB ILE 14 20.508 9.025 -0.469
132 HG12 ILE 14 1HG1 ILE 14 22.399 9.729 -1.972
133 HG13 ILE 14 2HG1 ILE 14 20.795 10.068 -2.610
134 HG21 ILE 14 1HG2 ILE 14 19.133 10.575 0.603
135 HG22 ILE 14 2HG2 ILE 14 20.154 11.937 0.146
136 HG23 ILE 14 3HG2 ILE 14 19.166 11.129 -1.071
137 HD11 ILE 14 1HD1 ILE 14 21.199 12.407 -1.498
138 HD12 ILE 14 2HD1 ILE 14 22.892 11.939 -1.656
139 HD13 ILE 14 3HD1 ILE 14 21.864 12.022 -3.086
140 H LEU 15 H LEU 15 21.229 7.811 1.314
141 HA LEU 15 HA LEU 15 19.660 8.512 3.581
142 HB2 LEU 15 1HB LEU 15 20.771 5.774 3.099
143 HB3 LEU 15 2HB LEU 15 19.232 6.232 3.827
144 HG LEU 15 HG LEU 15 19.970 6.304 0.905
145 HD11 LEU 15 1HD1 LEU 15 17.974 4.712 2.503
146 HD12 LEU 15 2HD1 LEU 15 19.398 4.104 1.660
147 HD13 LEU 15 3HD1 LEU 15 18.039 4.750 0.741
148 HD21 LEU 15 1HD2 LEU 15 18.136 7.537 0.410
149 HD22 LEU 15 2HD2 LEU 15 18.447 8.198 2.016
150 HD23 LEU 15 3HD2 LEU 15 17.224 6.944 1.799
151 H HIS 16 H HIS 16 22.953 7.359 3.130
152 HA HIS 16 HA HIS 16 23.577 6.727 5.777
153 HB2 HIS 16 1HB HIS 16 25.158 7.520 3.376
154 HB3 HIS 16 2HB HIS 16 25.966 7.534 4.940
155 HD1 HIS 16 HD1 HIS 16 27.474 5.545 4.318
156 HD2 HIS 16 HD2 HIS 16 23.410 4.693 4.158
157 HE1 HIS 16 HE1 HIS 16 27.318 3.042 4.132
158 H ALA 17 H ALA 17 23.988 9.800 4.032
159 HA ALA 17 HA ALA 17 25.140 11.297 6.057
160 HB1 ALA 17 1HB ALA 17 23.557 13.135 4.799
161 HB2 ALA 17 2HB ALA 17 25.145 12.606 4.242
162 HB3 ALA 17 3HB ALA 17 23.687 11.863 3.585
163 H ALA 18 H ALA 18 21.709 10.691 5.412
164 HA ALA 18 HA ALA 18 20.721 12.370 7.471
165 HB1 ALA 18 1HB ALA 18 18.843 10.332 7.039
166 HB2 ALA 18 2HB ALA 18 18.863 11.949 6.334
167 HB3 ALA 18 3HB ALA 18 19.634 10.608 5.486
168 H GLY 19 H GLY 19 22.431 9.507 7.638
169 HA2 GLY 19 1HA GLY 19 23.067 8.814 9.907
170 HA3 GLY 19 2HA GLY 19 21.373 8.977 10.346
171 H ALA 20 H ALA 20 21.350 7.714 7.332
172 HA ALA 20 HA ALA 20 20.589 5.120 8.253
173 HB1 ALA 20 1HB ALA 20 19.785 6.485 6.171
174 HB2 ALA 20 2HB ALA 20 21.134 5.674 5.375
175 HB3 ALA 20 3HB ALA 20 19.846 4.723 6.116
176 H GLN 21 H GLN 21 21.496 3.163 6.929
177 HA GLN 21 HA GLN 21 24.214 3.172 6.158
178 HB2 GLN 21 1HB GLN 21 24.009 3.337 8.860
179 HB3 GLN 21 2HB GLN 21 24.024 1.592 8.643
180 HG2 GLN 21 1HG GLN 21 26.241 1.813 8.703
181 HG3 GLN 21 2HG GLN 21 26.072 2.345 7.031
182 HE21 GLN 21 2HE2 GLN 21 25.414 4.786 6.945
183 HE22 GLN 21 1HE2 GLN 21 26.410 5.827 7.897
184 H GLY 22 H GLY 22 24.540 1.454 4.887
185 HA2 GLY 22 1HA GLY 22 24.319 -1.091 4.935
186 HA3 GLY 22 2HA GLY 22 22.600 -0.758 5.080
187 H GLU 23 H GLU 23 22.241 -1.943 3.145
188 HA GLU 23 HA GLU 23 22.629 -0.305 0.760
189 HB2 GLU 23 1HB GLU 23 23.338 -3.243 0.833
190 HB3 GLU 23 2HB GLU 23 23.404 -2.192 -0.575
191 HG2 GLU 23 1HG GLU 23 25.591 -2.159 0.010
192 HG3 GLU 23 2HG GLU 23 25.021 -0.801 0.978
193 H MET 24 H MET 24 20.473 -1.464 2.668
194 HA MET 24 HA MET 24 18.557 -1.989 0.541
195 HB2 MET 24 1HB MET 24 18.747 -3.852 2.908
196 HB3 MET 24 2HB MET 24 17.695 -4.007 1.507
197 HG2 MET 24 1HG MET 24 20.694 -4.114 1.351
198 HG3 MET 24 2HG MET 24 19.671 -5.535 1.542
199 HE1 MET 24 1HE MET 24 21.733 -5.346 -0.422
200 HE2 MET 24 2HE MET 24 21.169 -5.448 -2.089
201 HE3 MET 24 3HE MET 24 21.621 -3.886 -1.405
202 H PHE 25 H PHE 25 16.605 -1.111 0.943
203 HA PHE 25 HA PHE 25 15.634 -0.648 3.600
204 HB2 PHE 25 1HB PHE 25 16.284 1.787 1.932
205 HB3 PHE 25 2HB PHE 25 15.601 1.765 3.555
206 HD1 PHE 25 HD1 PHE 25 18.635 1.035 1.581
207 HD2 PHE 25 HD2 PHE 25 16.981 1.630 5.458
208 HE1 PHE 25 HE1 PHE 25 20.903 1.139 2.529
209 HE2 PHE 25 HE2 PHE 25 19.246 1.736 6.412
210 HZ PHE 25 HZ PHE 25 21.211 1.491 4.947
211 H THR 26 H THR 26 13.463 0.150 3.634
212 HA THR 26 HA THR 26 12.028 -0.485 1.175
213 HB THR 26 HB THR 26 10.220 0.215 3.254
214 HG1 THR 26 1HG THR 26 11.890 -0.144 4.743
215 HG21 THR 26 1HG2 THR 26 9.583 -1.393 1.664
216 HG22 THR 26 2HG2 THR 26 9.800 -2.312 3.153
217 HG23 THR 26 3HG2 THR 26 11.049 -2.342 1.908
218 H VAL 27 H VAL 27 9.783 0.911 1.222
219 HA VAL 27 HA VAL 27 10.500 3.442 0.231
220 HB VAL 27 HB VAL 27 7.722 2.927 1.207
221 HG11 VAL 27 1HG1 VAL 27 9.028 4.385 -1.052
222 HG12 VAL 27 2HG1 VAL 27 7.339 3.891 -1.176
223 HG13 VAL 27 3HG1 VAL 27 7.851 4.966 0.126
224 HG21 VAL 27 1HG2 VAL 27 7.462 1.748 -1.111
225 HG22 VAL 27 2HG2 VAL 27 9.175 1.389 -0.900
226 HG23 VAL 27 3HG2 VAL 27 8.004 0.829 0.294
227 H LYS 28 H LYS 28 8.902 2.518 3.273
228 HA LYS 28 HA LYS 28 8.669 5.122 4.310
229 HB2 LYS 28 1HB LYS 28 7.816 4.127 6.174
230 HB3 LYS 28 2HB LYS 28 7.706 2.752 5.082
231 HG2 LYS 28 1HG LYS 28 9.976 3.263 6.994
232 HG3 LYS 28 2HG LYS 28 8.629 2.159 7.281
233 HD2 LYS 28 1HD LYS 28 9.846 1.635 4.722
234 HD3 LYS 28 2HD LYS 28 11.056 1.589 6.007
235 HE2 LYS 28 1HE LYS 28 8.851 0.234 7.041
236 HE3 LYS 28 2HE LYS 28 8.968 -0.304 5.367
237 HZ1 LYS 28 1HZ LYS 28 11.500 -0.216 6.727
238 HZ2 LYS 28 2HZ LYS 28 10.816 -1.451 5.796
239 HZ3 LYS 28 3HZ LYS 28 10.405 -1.297 7.430
240 H GLU 29 H GLU 29 11.306 2.838 4.275
241 HA GLU 29 HA GLU 29 12.866 4.171 6.272
242 HB2 GLU 29 1HB GLU 29 13.346 1.962 4.315
243 HB3 GLU 29 2HB GLU 29 14.727 2.737 5.078
244 HG2 GLU 29 1HG GLU 29 12.773 2.110 7.066
245 HG3 GLU 29 2HG GLU 29 13.114 0.679 6.096
246 H VAL 30 H VAL 30 12.983 4.015 2.722
247 HA VAL 30 HA VAL 30 15.185 5.717 2.373
248 HB VAL 30 HB VAL 30 12.863 5.384 0.471
249 HG11 VAL 30 1HG1 VAL 30 15.378 6.812 0.348
250 HG12 VAL 30 2HG1 VAL 30 15.239 5.618 -0.945
251 HG13 VAL 30 3HG1 VAL 30 14.000 6.858 -0.752
252 HG21 VAL 30 1HG2 VAL 30 14.355 3.339 1.453
253 HG22 VAL 30 2HG2 VAL 30 13.607 3.352 -0.144
254 HG23 VAL 30 3HG2 VAL 30 15.301 3.805 0.040
255 H MET 31 H MET 31 11.719 6.395 2.576
256 HA MET 31 HA MET 31 11.913 9.155 1.973
257 HB2 MET 31 1HB MET 31 9.706 8.844 1.866
258 HB3 MET 31 2HB MET 31 9.852 7.286 2.668
259 HG2 MET 31 1HG MET 31 8.344 8.632 3.921
260 HG3 MET 31 2HG MET 31 9.834 8.468 4.847
261 HE1 MET 31 1HE MET 31 10.189 10.786 1.790
262 HE2 MET 31 2HE MET 31 8.434 10.720 1.953
263 HE3 MET 31 3HE MET 31 9.293 12.230 2.265
264 H HIS 32 H HIS 32 11.870 7.346 5.016
265 HA HIS 32 HA HIS 32 11.762 9.485 6.792
266 HB2 HIS 32 1HB HIS 32 11.749 6.874 7.169
267 HB3 HIS 32 2HB HIS 32 13.473 7.117 7.434
268 HD1 HIS 32 HD1 HIS 32 10.514 6.851 9.295
269 HD2 HIS 32 HD2 HIS 32 13.753 9.449 9.434
270 HE1 HIS 32 HE1 HIS 32 10.477 7.849 11.603
271 H TYR 33 H TYR 33 14.438 8.200 4.948
272 HA TYR 33 HA TYR 33 16.475 9.607 6.380
273 HB2 TYR 33 1HB TYR 33 16.503 8.329 3.639
274 HB3 TYR 33 2HB TYR 33 17.924 8.955 4.468
275 HD1 TYR 33 HD2 TYR 33 17.525 8.017 7.210
276 HD2 TYR 33 HD1 TYR 33 16.791 6.026 3.522
277 HE1 TYR 33 HE2 TYR 33 17.834 5.848 8.327
278 HE2 TYR 33 HE1 TYR 33 17.096 3.851 4.629
279 HH TYR 33 HH TYR 33 17.606 3.621 8.119
280 H LEU 34 H LEU 34 14.478 10.262 3.576
281 HA LEU 34 HA LEU 34 15.838 12.370 2.414
282 HB2 LEU 34 1HB LEU 34 13.131 11.346 2.421
283 HB3 LEU 34 2HB LEU 34 13.160 13.102 2.279
284 HG LEU 34 HG LEU 34 13.068 12.174 0.082
285 HD11 LEU 34 1HD1 LEU 34 14.877 13.264 -0.918
286 HD12 LEU 34 2HD1 LEU 34 15.953 12.915 0.434
287 HD13 LEU 34 3HD1 LEU 34 14.661 14.101 0.620
288 HD21 LEU 34 1HD2 LEU 34 13.787 10.047 -0.051
289 HD22 LEU 34 2HD2 LEU 34 15.020 10.274 1.190
290 HD23 LEU 34 3HD2 LEU 34 15.329 10.794 -0.468
291 H GLY 35 H GLY 35 13.289 12.598 4.904
292 HA2 GLY 35 1HA GLY 35 13.369 15.338 5.310
293 HA3 GLY 35 2HA GLY 35 12.925 14.165 6.542
294 H GLN 36 H GLN 36 15.262 12.840 6.997
295 HA GLN 36 HA GLN 36 16.633 14.595 8.707
296 HB2 GLN 36 1HB GLN 36 17.362 11.865 7.650
297 HB3 GLN 36 2HB GLN 36 18.315 12.714 8.860
298 HG2 GLN 36 1HG GLN 36 15.396 12.131 9.236
299 HG3 GLN 36 2HG GLN 36 16.658 10.988 9.692
300 HE21 GLN 36 2HE2 GLN 36 18.384 11.912 11.120
301 HE22 GLN 36 1HE2 GLN 36 17.875 12.982 12.378
302 H TYR 37 H TYR 37 17.479 13.309 5.515
303 HA TYR 37 HA TYR 37 20.050 14.320 5.289
304 HB2 TYR 37 1HB TYR 37 19.129 12.776 3.653
305 HB3 TYR 37 2HB TYR 37 17.952 13.978 3.137
306 HD1 TYR 37 HD2 TYR 37 21.631 13.425 3.378
307 HD2 TYR 37 HD1 TYR 37 18.442 15.366 1.338
308 HE1 TYR 37 HE2 TYR 37 23.219 14.246 1.689
309 HE2 TYR 37 HE1 TYR 37 20.021 16.192 -0.357
310 HH TYR 37 HH TYR 37 23.420 15.992 0.045
311 H ILE 38 H ILE 38 17.008 15.849 4.238
312 HA ILE 38 HA ILE 38 18.113 18.250 3.335
313 HB ILE 38 HB ILE 38 15.383 17.790 4.543
314 HG12 ILE 38 1HG1 ILE 38 16.122 17.945 1.622
315 HG13 ILE 38 2HG1 ILE 38 16.078 16.422 2.504
316 HG21 ILE 38 1HG2 ILE 38 16.550 20.100 3.020
317 HG22 ILE 38 2HG2 ILE 38 14.813 19.806 3.093
318 HG23 ILE 38 3HG2 ILE 38 15.717 20.114 4.575
319 HD11 ILE 38 1HD1 ILE 38 13.674 18.117 2.697
320 HD12 ILE 38 2HD1 ILE 38 14.006 17.384 1.128
321 HD13 ILE 38 3HD1 ILE 38 13.827 16.366 2.557
322 H MET 39 H MET 39 16.635 17.528 6.500
323 HA MET 39 HA MET 39 17.097 20.002 7.691
324 HB2 MET 39 1HB MET 39 16.162 19.039 9.488
325 HB3 MET 39 2HB MET 39 15.980 17.610 8.480
326 HG2 MET 39 1HG MET 39 18.112 16.754 9.301
327 HG3 MET 39 2HG MET 39 18.300 18.188 10.307
328 HE1 MET 39 1HE MET 39 15.148 17.777 12.679
329 HE2 MET 39 2HE MET 39 16.266 18.925 11.942
330 HE3 MET 39 3HE MET 39 14.902 18.302 11.013
331 H VAL 40 H VAL 40 19.177 17.154 7.471
332 HA VAL 40 HA VAL 40 21.248 18.231 9.118
333 HB VAL 40 HB VAL 40 20.691 15.729 8.102
334 HG11 VAL 40 1HG1 VAL 40 23.225 16.728 6.804
335 HG12 VAL 40 2HG1 VAL 40 22.635 15.064 6.794
336 HG13 VAL 40 3HG1 VAL 40 21.727 16.328 5.963
337 HG21 VAL 40 1HG2 VAL 40 21.791 16.190 10.212
338 HG22 VAL 40 2HG2 VAL 40 22.751 15.047 9.273
339 HG23 VAL 40 3HG2 VAL 40 23.238 16.740 9.367
340 H LYS 41 H LYS 41 20.516 18.279 5.698
341 HA LYS 41 HA LYS 41 23.094 19.347 4.954
342 HB2 LYS 41 1HB LYS 41 20.699 18.380 3.577
343 HB3 LYS 41 2HB LYS 41 21.415 19.793 2.812
344 HG2 LYS 41 1HG LYS 41 22.155 17.353 2.169
345 HG3 LYS 41 2HG LYS 41 23.312 18.686 2.214
346 HD2 LYS 41 1HD LYS 41 22.942 17.310 4.778
347 HD3 LYS 41 2HD LYS 41 23.623 16.301 3.500
348 HE2 LYS 41 1HE LYS 41 24.817 18.955 3.615
349 HE3 LYS 41 2HE LYS 41 25.019 18.047 5.112
350 HZ1 LYS 41 1HZ LYS 41 25.623 16.199 3.270
351 HZ2 LYS 41 2HZ LYS 41 26.766 17.176 4.043
352 HZ3 LYS 41 3HZ LYS 41 26.193 17.598 2.509
353 H GLN 42 H GLN 42 20.165 20.587 6.150
354 HA GLN 42 HA GLN 42 19.568 22.721 6.708
355 HB2 GLN 42 1HB GLN 42 21.237 24.174 7.064
356 HB3 GLN 42 2HB GLN 42 22.306 22.916 6.458
357 HG2 GLN 42 1HG GLN 42 21.220 24.320 4.238
358 HG3 GLN 42 2HG GLN 42 21.840 25.491 5.401
359 HE21 GLN 42 2HE2 GLN 42 22.616 23.489 2.864
360 HE22 GLN 42 1HE2 GLN 42 24.334 23.473 3.046
361 H LEU 43 H LEU 43 19.743 21.434 3.740
362 HA LEU 43 HA LEU 43 19.180 23.671 2.067
363 HB2 LEU 43 1HB LEU 43 19.852 21.068 1.637
364 HB3 LEU 43 2HB LEU 43 18.137 21.058 1.230
365 HG LEU 43 HG LEU 43 18.919 21.547 -0.826
366 HD11 LEU 43 1HD1 LEU 43 18.691 23.808 -1.339
367 HD12 LEU 43 2HD1 LEU 43 19.376 24.326 0.201
368 HD13 LEU 43 3HD1 LEU 43 17.761 23.619 0.148
369 HD21 LEU 43 1HD2 LEU 43 21.273 21.269 -0.073
370 HD22 LEU 43 2HD2 LEU 43 21.297 22.982 0.347
371 HD23 LEU 43 3HD2 LEU 43 21.066 22.488 -1.331
372 H TYR 44 H TYR 44 17.576 24.254 4.027
373 HA TYR 44 HA TYR 44 14.996 24.298 2.882
374 HB2 TYR 44 1HB TYR 44 13.746 22.891 4.318
375 HB3 TYR 44 2HB TYR 44 15.122 21.924 3.799
376 HD1 TYR 44 HD1 TYR 44 17.274 22.759 5.537
377 HD2 TYR 44 HD2 TYR 44 13.154 22.205 6.447
378 HE1 TYR 44 HE1 TYR 44 17.857 22.323 7.886
379 HE2 TYR 44 HE2 TYR 44 13.727 21.768 8.799
380 HH TYR 44 HH TYR 44 17.090 21.920 9.930
381 H ASP 45 H ASP 45 13.369 25.281 4.432
382 HA ASP 45 HA ASP 45 14.637 27.495 5.766
383 HB2 ASP 45 1HB ASP 45 12.686 28.072 4.572
384 HB3 ASP 45 2HB ASP 45 11.772 26.726 5.247
385 H GLN 46 H GLN 46 15.137 27.623 7.849
386 HA GLN 46 HA GLN 46 14.658 25.459 9.628
387 HB2 GLN 46 1HB GLN 46 16.003 28.103 9.782
388 HB3 GLN 46 2HB GLN 46 15.506 27.369 11.301
389 HG2 GLN 46 1HG GLN 46 17.881 26.933 10.155
390 HG3 GLN 46 2HG GLN 46 17.072 25.761 11.194
391 HE21 GLN 46 2HE2 GLN 46 16.806 26.761 7.795
392 HE22 GLN 46 1HE2 GLN 46 16.883 25.163 7.143
393 H GLN 47 H GLN 47 12.944 28.346 8.870
394 HA GLN 47 HA GLN 47 11.425 28.381 11.331
395 HB2 GLN 47 1HB GLN 47 10.654 29.918 8.878
396 HB3 GLN 47 2HB GLN 47 10.466 30.360 10.570
397 HG2 GLN 47 1HG GLN 47 12.865 30.553 8.816
398 HG3 GLN 47 2HG GLN 47 12.156 31.757 9.891
399 HE21 GLN 47 2HE2 GLN 47 14.501 29.346 9.530
400 HE22 GLN 47 1HE2 GLN 47 15.095 29.337 11.152
401 H GLU 48 H GLU 48 11.190 26.971 8.196
402 HA GLU 48 HA GLU 48 8.585 25.841 8.929
403 HB2 GLU 48 1HB GLU 48 9.230 26.885 6.167
404 HB3 GLU 48 2HB GLU 48 7.717 26.155 6.686
405 HG2 GLU 48 1HG GLU 48 8.697 28.578 8.103
406 HG3 GLU 48 2HG GLU 48 7.982 28.754 6.502
407 H GLN 49 H GLN 49 9.472 23.853 9.384
408 HA GLN 49 HA GLN 49 11.381 22.528 7.790
409 HB2 GLN 49 1HB GLN 49 9.389 21.524 9.818
410 HB3 GLN 49 2HB GLN 49 10.542 20.464 9.019
411 HG2 GLN 49 1HG GLN 49 11.838 20.924 10.779
412 HG3 GLN 49 2HG GLN 49 12.184 22.419 9.912
413 HE21 GLN 49 2HE2 GLN 49 12.178 24.074 11.240
414 HE22 GLN 49 1HE2 GLN 49 11.074 24.337 12.542
415 H HIS 50 H HIS 50 7.994 22.964 7.436
416 HA HIS 50 HA HIS 50 7.534 20.671 5.771
417 HB2 HIS 50 1HB HIS 50 5.384 21.191 6.109
418 HB3 HIS 50 2HB HIS 50 5.927 22.538 7.105
419 HD1 HIS 50 HD1 HIS 50 5.767 24.893 6.102
420 HD2 HIS 50 HD2 HIS 50 4.529 21.887 3.516
421 HE1 HIS 50 HE1 HIS 50 4.617 26.072 4.202
422 H MET 51 H MET 51 9.174 23.509 5.281
423 HA MET 51 HA MET 51 8.590 23.505 2.394
424 HB2 MET 51 1HB MET 51 9.456 25.697 4.258
425 HB3 MET 51 2HB MET 51 9.727 25.825 2.525
426 HG2 MET 51 1HG MET 51 7.057 25.453 3.863
427 HG3 MET 51 2HG MET 51 7.688 26.966 3.217
428 HE1 MET 51 1HE MET 51 9.081 24.573 0.760
429 HE2 MET 51 2HE MET 51 8.228 25.384 -0.554
430 HE3 MET 51 3HE MET 51 9.072 26.334 0.670
431 H VAL 52 H VAL 52 10.079 22.438 1.278
432 HA VAL 52 HA VAL 52 12.871 22.507 2.213
433 HB VAL 52 HB VAL 52 11.426 20.476 0.513
434 HG11 VAL 52 1HG1 VAL 52 14.356 20.561 1.226
435 HG12 VAL 52 2HG1 VAL 52 13.532 19.269 0.351
436 HG13 VAL 52 3HG1 VAL 52 13.680 20.871 -0.373
437 HG21 VAL 52 1HG2 VAL 52 12.850 20.167 3.152
438 HG22 VAL 52 2HG2 VAL 52 11.107 20.371 2.976
439 HG23 VAL 52 3HG2 VAL 52 11.899 18.945 2.306
440 H TYR 53 H TYR 53 14.392 23.424 0.981
441 HA TYR 53 HA TYR 53 13.589 24.428 -1.659
442 HB2 TYR 53 1HB TYR 53 15.486 25.383 0.436
443 HB3 TYR 53 2HB TYR 53 15.844 25.768 -1.244
444 HD1 TYR 53 HD1 TYR 53 13.508 26.530 -2.528
445 HD2 TYR 53 HD2 TYR 53 14.470 27.099 1.577
446 HE1 TYR 53 HE1 TYR 53 11.944 28.426 -2.431
447 HE2 TYR 53 HE2 TYR 53 12.909 28.996 1.686
448 HH TYR 53 HH TYR 53 10.562 29.572 -0.449
449 H CYS 54 H CYS 54 14.051 21.902 -1.980
450 HA CYS 54 HA CYS 54 16.507 20.766 -2.138
451 HB2 CYS 54 1HB CYS 54 15.627 19.670 -4.311
452 HB3 CYS 54 2HB CYS 54 14.732 19.407 -2.819
453 HG CYS 54 HG CYS 54 12.638 21.028 -3.397
454 H GLY 55 H GLY 55 15.066 22.738 -4.742
455 HA2 GLY 55 1HA GLY 55 16.980 22.776 -6.626
456 HA3 GLY 55 2HA GLY 55 16.121 24.238 -6.165
457 H GLY 56 H GLY 56 19.091 22.468 -5.962
458 HA2 GLY 56 1HA GLY 56 20.877 24.433 -5.819
459 HA3 GLY 56 2HA GLY 56 20.301 24.413 -4.158
460 H ASP 57 H ASP 57 19.888 21.483 -4.236
461 HA ASP 57 HA ASP 57 22.715 20.651 -4.147
462 HB2 ASP 57 1HB ASP 57 20.714 20.635 -2.077
463 HB3 ASP 57 2HB ASP 57 21.234 18.987 -2.417
464 H LEU 58 H LEU 58 22.559 18.019 -3.804
465 HA LEU 58 HA LEU 58 22.116 16.950 -6.289
466 HB2 LEU 58 1HB LEU 58 22.754 15.974 -3.696
467 HB3 LEU 58 2HB LEU 58 21.527 14.919 -4.393
468 HG LEU 58 HG LEU 58 23.716 14.025 -4.848
469 HD11 LEU 58 1HD1 LEU 58 22.068 15.082 -7.074
470 HD12 LEU 58 2HD1 LEU 58 22.447 13.418 -6.631
471 HD13 LEU 58 3HD1 LEU 58 23.644 14.400 -7.474
472 HD21 LEU 58 1HD2 LEU 58 24.422 16.753 -5.158
473 HD22 LEU 58 2HD2 LEU 58 24.775 15.926 -6.676
474 HD23 LEU 58 3HD2 LEU 58 25.474 15.338 -5.166
475 H LEU 59 H LEU 59 19.873 16.928 -3.531
476 HA LEU 59 HA LEU 59 17.800 15.494 -4.712
477 HB2 LEU 59 1HB LEU 59 16.368 16.422 -3.035
478 HB3 LEU 59 2HB LEU 59 17.946 16.099 -2.320
479 HG LEU 59 HG LEU 59 17.062 18.833 -3.229
480 HD11 LEU 59 1HD1 LEU 59 16.718 19.284 -0.811
481 HD12 LEU 59 2HD1 LEU 59 16.882 17.555 -0.507
482 HD13 LEU 59 3HD1 LEU 59 15.551 18.153 -1.497
483 HD21 LEU 59 1HD2 LEU 59 18.892 19.354 -1.436
484 HD22 LEU 59 2HD2 LEU 59 19.355 18.930 -3.084
485 HD23 LEU 59 3HD2 LEU 59 19.435 17.717 -1.805
486 H GLY 60 H GLY 60 18.574 18.935 -4.876
487 HA2 GLY 60 1HA GLY 60 16.211 19.754 -6.197
488 HA3 GLY 60 2HA GLY 60 17.736 20.627 -6.183
489 H GLU 61 H GLU 61 19.421 18.883 -7.458
490 HA GLU 61 HA GLU 61 18.803 19.353 -10.168
491 HB2 GLU 61 1HB GLU 61 20.917 18.645 -10.598
492 HB3 GLU 61 2HB GLU 61 21.086 18.838 -8.858
493 HG2 GLU 61 1HG GLU 61 20.688 16.472 -8.528
494 HG3 GLU 61 2HG GLU 61 20.429 16.256 -10.258
495 H LEU 62 H LEU 62 18.764 16.378 -8.228
496 HA LEU 62 HA LEU 62 18.040 14.602 -10.255
497 HB2 LEU 62 1HB LEU 62 18.674 14.295 -7.696
498 HB3 LEU 62 2HB LEU 62 16.921 14.208 -7.532
499 HG LEU 62 HG LEU 62 17.759 11.982 -7.669
500 HD11 LEU 62 1HD1 LEU 62 16.711 11.195 -9.799
501 HD12 LEU 62 2HD1 LEU 62 16.509 12.887 -10.254
502 HD13 LEU 62 3HD1 LEU 62 15.694 12.256 -8.823
503 HD21 LEU 62 1HD2 LEU 62 19.503 11.328 -8.901
504 HD22 LEU 62 2HD2 LEU 62 19.794 13.047 -9.170
505 HD23 LEU 62 3HD2 LEU 62 18.884 12.109 -10.356
506 H LEU 63 H LEU 63 15.958 16.344 -7.951
507 HA LEU 63 HA LEU 63 13.517 15.400 -8.997
508 HB2 LEU 63 1HB LEU 63 14.394 17.261 -6.994
509 HB3 LEU 63 2HB LEU 63 13.070 17.958 -7.925
510 HG LEU 63 HG LEU 63 12.764 15.200 -6.834
511 HD11 LEU 63 1HD1 LEU 63 13.635 16.483 -4.949
512 HD12 LEU 63 2HD1 LEU 63 11.930 16.093 -4.725
513 HD13 LEU 63 3HD1 LEU 63 12.405 17.719 -5.216
514 HD21 LEU 63 1HD2 LEU 63 10.412 16.140 -6.546
515 HD22 LEU 63 2HD2 LEU 63 10.983 15.890 -8.196
516 HD23 LEU 63 3HD2 LEU 63 10.969 17.513 -7.503
517 H GLY 64 H GLY 64 15.583 18.101 -9.851
518 HA2 GLY 64 1HA GLY 64 15.634 19.202 -11.908
519 HA3 GLY 64 2HA GLY 64 14.120 18.420 -12.338
520 H ARG 65 H ARG 65 13.309 19.463 -9.470
521 HA ARG 65 HA ARG 65 12.083 21.878 -10.508
522 HB2 ARG 65 1HB ARG 65 11.765 20.808 -7.714
523 HB3 ARG 65 2HB ARG 65 10.645 21.796 -8.641
524 HG2 ARG 65 1HG ARG 65 11.248 18.876 -8.937
525 HG3 ARG 65 2HG ARG 65 9.698 19.661 -8.625
526 HD2 ARG 65 1HD ARG 65 9.578 20.498 -10.842
527 HD3 ARG 65 2HD ARG 65 11.256 20.064 -11.167
528 HE ARG 65 HE ARG 65 10.589 17.908 -11.594
529 HH11 ARG 65 1HH1 ARG 65 7.982 19.663 -10.096
530 HH12 ARG 65 2HH1 ARG 65 6.808 18.421 -10.383
531 HH21 ARG 65 1HH2 ARG 65 9.052 16.266 -11.978
532 HH22 ARG 65 2HH2 ARG 65 7.418 16.490 -11.453
533 H GLN 66 H GLN 66 11.846 23.140 -7.894
534 HA GLN 66 HA GLN 66 14.611 24.037 -7.451
535 HB2 GLN 66 1HB GLN 66 12.161 25.738 -7.893
536 HB3 GLN 66 2HB GLN 66 13.621 26.362 -7.135
537 HG2 GLN 66 1HG GLN 66 14.134 24.984 -9.647
538 HG3 GLN 66 2HG GLN 66 13.064 26.375 -9.816
539 HE21 GLN 66 2HE2 GLN 66 16.153 25.375 -8.421
540 HE22 GLN 66 1HE2 GLN 66 16.944 26.896 -8.635
541 H SER 67 H SER 67 11.316 23.826 -6.200
542 HA SER 67 HA SER 67 12.322 23.311 -3.547
543 HB2 SER 67 1HB SER 67 11.510 25.182 -2.428
544 HB3 SER 67 2HB SER 67 12.117 25.896 -3.922
545 HG SER 67 HG SER 67 10.163 26.656 -4.074
546 H PHE 68 H PHE 68 10.835 22.276 -2.234
547 HA PHE 68 HA PHE 68 8.101 21.956 -3.210
548 HB2 PHE 68 1HB PHE 68 8.230 19.493 -2.972
549 HB3 PHE 68 2HB PHE 68 9.283 20.102 -4.245
550 HD1 PHE 68 HD1 PHE 68 9.420 19.334 -0.596
551 HD2 PHE 68 HD2 PHE 68 11.407 19.251 -4.359
552 HE1 PHE 68 HE1 PHE 68 11.331 18.183 0.442
553 HE2 PHE 68 HE2 PHE 68 13.320 18.099 -3.328
554 HZ PHE 68 HZ PHE 68 13.284 17.563 -0.924
555 H SER 69 H SER 69 6.623 21.210 -1.624
556 HA SER 69 HA SER 69 7.525 21.765 1.103
557 HB2 SER 69 1HB SER 69 4.656 21.330 0.319
558 HB3 SER 69 2HB SER 69 5.311 22.308 1.632
559 HG SER 69 HG SER 69 4.528 23.491 -0.253
560 H VAL 70 H VAL 70 7.510 20.289 2.709
561 HA VAL 70 HA VAL 70 7.374 17.523 2.027
562 HB VAL 70 HB VAL 70 8.302 17.095 4.058
563 HG11 VAL 70 1HG1 VAL 70 8.890 19.946 4.502
564 HG12 VAL 70 2HG1 VAL 70 9.984 18.575 4.312
565 HG13 VAL 70 3HG1 VAL 70 9.263 19.332 2.892
566 HG21 VAL 70 1HG2 VAL 70 6.562 17.470 5.541
567 HG22 VAL 70 2HG2 VAL 70 7.776 18.629 6.084
568 HG23 VAL 70 3HG2 VAL 70 6.417 19.172 5.101
569 H LYS 71 H LYS 71 5.189 19.806 3.507
570 HA LYS 71 HA LYS 71 3.388 17.915 4.622
571 HB2 LYS 71 1HB LYS 71 3.656 20.518 4.992
572 HB3 LYS 71 2HB LYS 71 2.454 20.603 3.712
573 HG2 LYS 71 1HG LYS 71 1.143 20.623 5.598
574 HG3 LYS 71 2HG LYS 71 1.148 18.907 5.183
575 HD2 LYS 71 1HD LYS 71 1.564 18.916 7.477
576 HD3 LYS 71 2HD LYS 71 3.171 18.747 6.767
577 HE2 LYS 71 1HE LYS 71 3.819 20.556 7.880
578 HE3 LYS 71 2HE LYS 71 2.656 21.510 6.961
579 HZ1 LYS 71 1HZ LYS 71 2.539 21.468 9.531
580 HZ2 LYS 71 2HZ LYS 71 1.751 19.989 9.309
581 HZ3 LYS 71 3HZ LYS 71 1.107 21.399 8.634
582 H ASP 72 H ASP 72 4.122 18.612 1.453
583 HA ASP 72 HA ASP 72 1.575 17.455 0.550
584 HB2 ASP 72 1HB ASP 72 1.566 19.874 0.064
585 HB3 ASP 72 2HB ASP 72 3.068 19.691 -0.838
586 HA PRO 73 HA PRO 73 4.918 14.775 -0.998
587 HB2 PRO 73 1HB PRO 73 3.361 12.553 -1.107
588 HB3 PRO 73 2HB PRO 73 4.142 13.107 0.379
589 HG2 PRO 73 1HG PRO 73 1.316 13.490 -0.532
590 HG3 PRO 73 2HG PRO 73 1.924 13.063 1.078
591 HD2 PRO 73 1HD PRO 73 1.160 15.578 0.429
592 HD3 PRO 73 2HD PRO 73 2.460 15.245 1.592
593 H SER 74 H SER 74 4.053 16.492 -2.815
594 HA SER 74 HA SER 74 2.631 15.023 -4.908
595 HB2 SER 74 1HB SER 74 3.225 17.542 -5.916
596 HB3 SER 74 2HB SER 74 1.698 17.053 -5.180
597 HG SER 74 HG SER 74 2.618 18.934 -4.207
598 HA PRO 75 HA PRO 75 6.601 16.230 -7.317
599 HB2 PRO 75 1HB PRO 75 8.482 17.720 -6.048
600 HB3 PRO 75 2HB PRO 75 7.128 18.433 -6.932
601 HG2 PRO 75 1HG PRO 75 7.441 17.980 -3.989
602 HG3 PRO 75 2HG PRO 75 6.799 19.397 -4.841
603 HD2 PRO 75 1HD PRO 75 5.199 17.538 -3.695
604 HD3 PRO 75 2HD PRO 75 4.733 18.426 -5.159
605 H LEU 76 H LEU 76 6.789 15.379 -3.958
606 HA LEU 76 HA LEU 76 9.377 14.248 -3.932
607 HB2 LEU 76 1HB LEU 76 8.023 14.846 -1.928
608 HB3 LEU 76 2HB LEU 76 7.003 13.446 -2.257
609 HG LEU 76 HG LEU 76 9.195 12.091 -2.060
610 HD11 LEU 76 1HD1 LEU 76 10.030 14.784 -1.193
611 HD12 LEU 76 2HD1 LEU 76 10.973 13.471 -1.896
612 HD13 LEU 76 3HD1 LEU 76 10.556 13.437 -0.183
613 HD21 LEU 76 1HD2 LEU 76 7.162 12.561 -0.367
614 HD22 LEU 76 2HD2 LEU 76 8.503 13.191 0.589
615 HD23 LEU 76 3HD2 LEU 76 8.532 11.521 0.022
616 H TYR 77 H TYR 77 6.189 12.658 -4.144
617 HA TYR 77 HA TYR 77 7.177 10.082 -4.645
618 HB2 TYR 77 1HB TYR 77 4.541 11.436 -5.067
619 HB3 TYR 77 2HB TYR 77 4.804 9.839 -5.759
620 HD1 TYR 77 HD2 TYR 77 5.389 7.931 -4.225
621 HD2 TYR 77 HD1 TYR 77 4.083 11.707 -2.764
622 HE1 TYR 77 HE2 TYR 77 4.842 6.898 -2.061
623 HE2 TYR 77 HE1 TYR 77 3.534 10.685 -0.595
624 HH TYR 77 HH TYR 77 4.569 8.309 0.632
625 H ASP 78 H ASP 78 6.383 12.743 -6.805
626 HA ASP 78 HA ASP 78 6.444 11.406 -9.246
627 HB2 ASP 78 1HB ASP 78 5.981 13.948 -8.563
628 HB3 ASP 78 2HB ASP 78 7.645 14.126 -9.113
629 H MET 79 H MET 79 9.085 12.744 -7.318
630 HA MET 79 HA MET 79 11.100 12.151 -9.263
631 HB2 MET 79 1HB MET 79 11.474 13.949 -7.698
632 HB3 MET 79 2HB MET 79 11.274 12.860 -6.332
633 HG2 MET 79 1HG MET 79 13.288 11.612 -7.516
634 HG3 MET 79 2HG MET 79 13.584 13.231 -8.146
635 HE1 MET 79 1HE MET 79 12.085 12.995 -4.278
636 HE2 MET 79 2HE MET 79 12.379 11.453 -5.083
637 HE3 MET 79 3HE MET 79 13.430 11.975 -3.765
638 H LEU 80 H LEU 80 10.172 10.700 -6.146
639 HA LEU 80 HA LEU 80 12.021 8.634 -6.087
640 HB2 LEU 80 1HB LEU 80 9.170 8.547 -5.109
641 HB3 LEU 80 2HB LEU 80 10.479 7.483 -4.595
642 HG LEU 80 HG LEU 80 10.431 10.462 -4.123
643 HD11 LEU 80 1HD1 LEU 80 8.813 9.938 -2.652
644 HD12 LEU 80 2HD1 LEU 80 10.162 9.352 -1.680
645 HD13 LEU 80 3HD1 LEU 80 9.219 8.222 -2.650
646 HD21 LEU 80 1HD2 LEU 80 12.469 8.486 -3.917
647 HD22 LEU 80 2HD2 LEU 80 12.042 9.023 -2.293
648 HD23 LEU 80 3HD2 LEU 80 12.545 10.200 -3.507
649 H ARG 81 H ARG 81 9.041 8.927 -7.890
650 HA ARG 81 HA ARG 81 8.379 6.393 -8.579
651 HB2 ARG 81 1HB ARG 81 7.074 7.430 -10.066
652 HB3 ARG 81 2HB ARG 81 7.867 8.933 -9.613
653 HG2 ARG 81 1HG ARG 81 9.470 8.677 -11.394
654 HG3 ARG 81 2HG ARG 81 8.806 7.094 -11.804
655 HD2 ARG 81 1HD ARG 81 6.656 8.924 -11.800
656 HD3 ARG 81 2HD ARG 81 7.976 9.682 -12.688
657 HE ARG 81 HE ARG 81 6.429 7.396 -13.495
658 HH11 ARG 81 1HH1 ARG 81 9.446 9.095 -13.864
659 HH12 ARG 81 2HH1 ARG 81 9.773 8.439 -15.434
660 HH21 ARG 81 1HH2 ARG 81 6.849 6.526 -15.562
661 HH22 ARG 81 2HH2 ARG 81 8.295 6.979 -16.399
662 H LYS 82 H LYS 82 10.920 8.318 -10.163
663 HA LYS 82 HA LYS 82 11.940 5.850 -11.391
664 HB2 LYS 82 1HB LYS 82 12.524 7.053 -13.205
665 HB3 LYS 82 2HB LYS 82 11.403 8.249 -12.568
666 HG2 LYS 82 1HG LYS 82 14.366 8.204 -12.029
667 HG3 LYS 82 2HG LYS 82 13.565 9.214 -13.236
668 HD2 LYS 82 1HD LYS 82 13.128 9.290 -10.251
669 HD3 LYS 82 2HD LYS 82 13.977 10.496 -11.220
670 HE2 LYS 82 1HE LYS 82 11.512 10.237 -12.461
671 HE3 LYS 82 2HE LYS 82 11.135 10.156 -10.740
672 HZ1 LYS 82 1HZ LYS 82 12.415 12.347 -12.246
673 HZ2 LYS 82 2HZ LYS 82 12.629 12.212 -10.574
674 HZ3 LYS 82 3HZ LYS 82 11.075 12.409 -11.214
675 H ASN 83 H ASN 83 12.428 7.692 -8.728
676 HA ASN 83 HA ASN 83 15.347 7.461 -8.750
677 HB2 ASN 83 1HB ASN 83 15.018 9.522 -7.854
678 HB3 ASN 83 2HB ASN 83 13.388 9.137 -7.309
679 HD21 ASN 83 2HD2 ASN 83 13.561 9.904 -5.267
680 HD22 ASN 83 1HD2 ASN 83 14.617 9.238 -4.073
681 H LEU 84 H LEU 84 12.645 6.722 -6.540
682 HA LEU 84 HA LEU 84 14.118 5.105 -4.788
683 HB2 LEU 84 1HB LEU 84 11.367 5.834 -5.203
684 HB3 LEU 84 2HB LEU 84 11.493 4.119 -4.817
685 HG LEU 84 HG LEU 84 12.286 4.522 -2.684
686 HD11 LEU 84 1HD1 LEU 84 14.031 5.891 -2.514
687 HD12 LEU 84 2HD1 LEU 84 12.865 7.204 -2.358
688 HD13 LEU 84 3HD1 LEU 84 13.546 6.813 -3.937
689 HD21 LEU 84 1HD2 LEU 84 9.982 5.800 -3.464
690 HD22 LEU 84 2HD2 LEU 84 10.858 7.061 -2.597
691 HD23 LEU 84 3HD2 LEU 84 10.500 5.528 -1.800
692 H VAL 85 H VAL 85 15.377 3.582 -5.783
693 HA VAL 85 HA VAL 85 14.791 1.959 -7.919
694 HB VAL 85 HB VAL 85 16.549 1.580 -5.531
695 HG11 VAL 85 1HG1 VAL 85 17.376 -0.539 -6.532
696 HG12 VAL 85 2HG1 VAL 85 15.731 -0.649 -5.902
697 HG13 VAL 85 3HG1 VAL 85 16.004 -0.504 -7.639
698 HG21 VAL 85 1HG2 VAL 85 18.276 1.999 -6.989
699 HG22 VAL 85 2HG2 VAL 85 17.392 1.385 -8.386
700 HG23 VAL 85 3HG2 VAL 85 16.991 2.965 -7.713
701 H THR 86 H THR 86 13.499 0.270 -8.294
702 HA THR 86 HA THR 86 12.229 -1.053 -5.986
703 HB THR 86 HB THR 86 10.226 -1.395 -7.486
704 HG1 THR 86 1HG THR 86 11.635 0.532 -9.043
705 HG21 THR 86 1HG2 THR 86 9.968 0.209 -5.786
706 HG22 THR 86 2HG2 THR 86 9.476 1.043 -7.261
707 HG23 THR 86 3HG2 THR 86 11.070 1.340 -6.569
708 H LEU 87 H LEU 87 12.562 -3.172 -5.894
709 HA LEU 87 HA LEU 87 13.352 -4.573 -8.363
710 HB2 LEU 87 1HB LEU 87 13.997 -5.596 -5.631
711 HB3 LEU 87 2HB LEU 87 14.809 -5.914 -7.162
712 HG LEU 87 HG LEU 87 15.352 -3.305 -6.931
713 HD11 LEU 87 1HD1 LEU 87 14.111 -3.708 -4.548
714 HD12 LEU 87 2HD1 LEU 87 15.304 -2.448 -4.862
715 HD13 LEU 87 3HD1 LEU 87 15.800 -3.966 -4.112
716 HD21 LEU 87 1HD2 LEU 87 17.163 -4.664 -7.281
717 HD22 LEU 87 2HD2 LEU 87 16.745 -5.751 -5.957
718 HD23 LEU 87 3HD2 LEU 87 17.452 -4.172 -5.612
719 H ALA 88 H ALA 88 10.950 -4.737 -8.628
720 HA ALA 88 HA ALA 88 10.063 -7.323 -8.154
721 HB1 ALA 88 1HB ALA 88 9.354 -7.318 -6.050
722 HB2 ALA 88 2HB ALA 88 9.675 -5.591 -5.891
723 HB3 ALA 88 3HB ALA 88 8.124 -6.144 -6.522
724 H THR 89 H THR 89 7.511 -7.405 -8.373
725 HA THR 89 HA THR 89 6.868 -6.359 -10.871
726 HB THR 89 HB THR 89 4.906 -7.199 -8.728
727 HG1 THR 89 1HG THR 89 5.813 -8.868 -10.814
728 HG21 THR 89 1HG2 THR 89 4.038 -7.920 -11.306
729 HG22 THR 89 2HG2 THR 89 4.575 -6.244 -11.416
730 HG23 THR 89 3HG2 THR 89 3.345 -6.700 -10.238
731 H1 SER 115 H SER 115 3.896 16.280 16.565
732 HA SER 115 HA SER 115 2.212 14.002 16.807
733 HB2 SER 115 1HB SER 115 3.170 14.502 14.201
734 HB3 SER 115 2HB SER 115 4.138 13.170 14.832
735 HG SER 115 HG SER 115 1.953 12.321 15.505
736 H GLN 116 H GLN 116 5.602 14.631 15.882
737 HA GLN 116 HA GLN 116 6.423 13.235 18.344
738 HB2 GLN 116 1HB GLN 116 7.095 12.684 15.598
739 HB3 GLN 116 2HB GLN 116 8.547 13.102 16.498
740 HG2 GLN 116 1HG GLN 116 8.558 10.915 16.980
741 HG3 GLN 116 2HG GLN 116 7.408 11.392 18.228
742 HE21 GLN 116 2HE2 GLN 116 5.115 11.258 17.656
743 HE22 GLN 116 1HE2 GLN 116 4.598 9.989 16.603
744 H GLU 117 H GLU 117 7.911 15.302 15.842
745 HA GLU 117 HA GLU 117 8.295 17.607 17.218
746 HB2 GLU 117 1HB GLU 117 10.764 17.212 17.984
747 HB3 GLU 117 2HB GLU 117 9.433 16.750 19.036
748 HG2 GLU 117 1HG GLU 117 9.934 14.577 18.924
749 HG3 GLU 117 2HG GLU 117 10.283 14.644 17.197
750 H THR 118 H THR 118 9.920 19.020 16.300
751 HA THR 118 HA THR 118 10.726 19.929 14.340
752 HB THR 118 HB THR 118 12.555 17.625 13.997
753 HG1 THR 118 1HG THR 118 13.665 18.441 15.989
754 HG21 THR 118 1HG2 THR 118 12.655 20.074 13.057
755 HG22 THR 118 2HG2 THR 118 14.130 19.254 13.570
756 HG23 THR 118 3HG2 THR 118 13.357 20.430 14.634
757 H PHE 119 H PHE 119 12.096 18.394 12.250
758 HA PHE 119 HA PHE 119 10.292 18.259 10.270
759 HB2 PHE 119 1HB PHE 119 12.891 17.512 10.479
760 HB3 PHE 119 2HB PHE 119 12.127 15.942 10.248
761 HD1 PHE 119 HD1 PHE 119 9.830 17.490 8.582
762 HD2 PHE 119 HD2 PHE 119 14.059 17.078 8.323
763 HE1 PHE 119 HE1 PHE 119 9.718 17.901 6.159
764 HE2 PHE 119 HE2 PHE 119 13.954 17.490 5.900
765 HZ PHE 119 HZ PHE 119 11.782 17.903 4.815
766 H SER 120 H SER 120 10.891 15.678 12.614
767 HA SER 120 HA SER 120 9.369 13.643 11.583
768 HB2 SER 120 1HB SER 120 10.716 13.948 13.882
769 HB3 SER 120 2HB SER 120 9.076 14.134 14.502
770 HG SER 120 HG SER 120 9.734 11.991 12.797
771 H ASP 121 H ASP 121 8.260 16.412 13.491
772 HA ASP 121 HA ASP 121 5.624 15.745 13.899
773 HB2 ASP 121 1HB ASP 121 6.701 17.785 14.787
774 HB3 ASP 121 2HB ASP 121 6.680 18.486 13.171
775 H LEU 122 H LEU 122 6.712 17.824 11.210
776 HA LEU 122 HA LEU 122 4.272 17.378 9.764
777 HB2 LEU 122 1HB LEU 122 6.730 18.570 8.551
778 HB3 LEU 122 2HB LEU 122 5.037 18.949 8.239
779 HG LEU 122 HG LEU 122 6.633 19.734 10.676
780 HD11 LEU 122 1HD1 LEU 122 5.393 21.836 9.119
781 HD12 LEU 122 2HD1 LEU 122 6.540 20.895 8.166
782 HD13 LEU 122 3HD1 LEU 122 7.062 21.666 9.664
783 HD21 LEU 122 1HD2 LEU 122 4.603 19.656 11.654
784 HD22 LEU 122 2HD2 LEU 122 3.740 19.686 10.115
785 HD23 LEU 122 3HD2 LEU 122 4.366 21.184 10.805
786 H TRP 123 H TRP 123 7.694 16.645 9.068
787 HA TRP 123 HA TRP 123 7.623 15.300 6.769
788 HB2 TRP 123 1HB TRP 123 9.574 15.517 8.406
789 HB3 TRP 123 2HB TRP 123 8.978 14.035 9.148
790 HD1 TRP 123 HD1 TRP 123 10.228 11.981 8.306
791 HE1 TRP 123 HE1 TRP 123 11.367 11.272 6.109
792 HE3 TRP 123 HE3 TRP 123 9.287 16.162 5.518
793 HZ2 TRP 123 HZ2 TRP 123 11.808 12.343 3.536
794 HZ3 TRP 123 HZ3 TRP 123 10.103 16.240 3.198
795 HH2 TRP 123 HH2 TRP 123 11.337 14.369 2.229
796 H LYS 124 H LYS 124 6.906 13.680 9.867
797 HA LYS 124 HA LYS 124 6.156 11.214 8.869
798 HB2 LYS 124 1HB LYS 124 5.243 12.739 11.300
799 HB3 LYS 124 2HB LYS 124 4.669 11.112 10.956
800 HG2 LYS 124 1HG LYS 124 7.538 11.234 10.771
801 HG3 LYS 124 2HG LYS 124 6.979 11.838 12.333
802 HD2 LYS 124 1HD LYS 124 7.195 9.566 12.728
803 HD3 LYS 124 2HD LYS 124 5.482 9.717 12.331
804 HE2 LYS 124 1HE LYS 124 7.051 9.330 9.947
805 HE3 LYS 124 2HE LYS 124 7.378 8.052 11.117
806 HZ1 LYS 124 1HZ LYS 124 5.343 7.192 10.865
807 HZ2 LYS 124 2HZ LYS 124 5.309 8.056 9.411
808 HZ3 LYS 124 3HZ LYS 124 4.582 8.702 10.795
809 H LEU 125 H LEU 125 4.163 14.106 9.343
810 HA LEU 125 HA LEU 125 1.649 13.282 8.887
811 HB2 LEU 125 1HB LEU 125 2.717 15.676 8.976
812 HB3 LEU 125 2HB LEU 125 2.613 15.560 7.220
813 HG LEU 125 HG LEU 125 0.682 16.710 7.838
814 HD11 LEU 125 1HD1 LEU 125 -1.147 15.230 7.309
815 HD12 LEU 125 2HD1 LEU 125 -0.170 13.821 7.721
816 HD13 LEU 125 3HD1 LEU 125 0.255 14.810 6.323
817 HD21 LEU 125 1HD2 LEU 125 0.900 16.263 10.265
818 HD22 LEU 125 2HD2 LEU 125 0.181 14.674 10.005
819 HD23 LEU 125 3HD2 LEU 125 -0.758 16.131 9.678
820 H LEU 126 H LEU 126 4.144 13.610 6.404
821 HA LEU 126 HA LEU 126 2.362 12.757 4.298
822 HB2 LEU 126 1HB LEU 126 4.144 13.117 2.822
823 HB3 LEU 126 2HB LEU 126 4.282 14.385 4.038
824 HG LEU 126 HG LEU 126 5.891 12.252 4.927
825 HD11 LEU 126 1HD1 LEU 126 5.597 11.868 2.255
826 HD12 LEU 126 2HD1 LEU 126 7.017 11.397 3.189
827 HD13 LEU 126 3HD1 LEU 126 7.011 12.922 2.303
828 HD21 LEU 126 1HD2 LEU 126 7.033 14.617 3.523
829 HD22 LEU 126 2HD2 LEU 126 7.505 13.874 5.051
830 HD23 LEU 126 3HD2 LEU 126 6.055 14.876 4.968
831 HA PRO 127 HA PRO 127 3.003 8.424 4.847
832 HB2 PRO 127 1HB PRO 127 2.135 7.604 2.409
833 HB3 PRO 127 2HB PRO 127 1.040 8.150 3.685
834 HG2 PRO 127 1HG PRO 127 2.082 9.650 1.313
835 HG3 PRO 127 2HG PRO 127 0.440 9.615 1.982
836 HD2 PRO 127 1HD PRO 127 2.163 11.648 2.459
837 HD3 PRO 127 2HD PRO 127 0.949 11.127 3.645
838 H GLU 128 H GLU 128 3.707 6.609 2.972
839 HA GLU 128 HA GLU 128 6.261 7.563 1.866
840 HB2 GLU 128 1HB GLU 128 6.289 4.785 2.802
841 HB3 GLU 128 2HB GLU 128 7.496 6.049 2.989
842 HG2 GLU 128 1HG GLU 128 6.909 5.728 5.162
843 HG3 GLU 128 2HG GLU 128 5.771 7.000 4.721
844 H ASN 129 H ASN 129 3.715 5.119 1.796
845 HA ASN 129 HA ASN 129 4.599 3.806 -0.552
846 HB2 ASN 129 1HB ASN 129 2.717 2.508 -0.351
847 HB3 ASN 129 2HB ASN 129 2.798 3.148 1.288
848 HD21 ASN 129 2HD2 ASN 129 1.083 3.130 -1.695
849 HD22 ASN 129 1HD2 ASN 129 -0.268 4.072 -1.172
Start of MODEL 14
1 H1 GLN 1 H GLN 1 3.620 2.862 -4.243
2 HA GLN 1 HA GLN 1 6.149 1.908 -4.823
3 HB2 GLN 1 1HB GLN 1 5.949 4.807 -5.008
4 HB3 GLN 1 2HB GLN 1 7.147 4.299 -3.826
5 HG2 GLN 1 1HG GLN 1 8.535 4.180 -5.560
6 HG3 GLN 1 2HG GLN 1 7.714 2.665 -5.930
7 HE21 GLN 1 2HE2 GLN 1 8.085 2.853 -8.126
8 HE22 GLN 1 1HE2 GLN 1 7.253 4.001 -9.113
9 H ILE 2 H ILE 2 5.306 0.633 -3.084
10 HA ILE 2 HA ILE 2 6.016 1.744 -0.473
11 HB ILE 2 HB ILE 2 3.434 0.255 -0.958
12 HG12 ILE 2 1HG1 ILE 2 3.411 2.601 -1.780
13 HG13 ILE 2 2HG1 ILE 2 2.309 2.339 -0.432
14 HG21 ILE 2 1HG2 ILE 2 3.222 1.294 1.520
15 HG22 ILE 2 2HG2 ILE 2 3.806 -0.336 1.184
16 HG23 ILE 2 3HG2 ILE 2 4.956 0.973 1.458
17 HD11 ILE 2 1HD1 ILE 2 5.071 3.444 -0.057
18 HD12 ILE 2 2HD1 ILE 2 3.672 4.463 -0.396
19 HD13 ILE 2 3HD1 ILE 2 3.712 3.478 1.066
20 H ASN 3 H ASN 3 7.439 -0.050 -2.147
21 HA ASN 3 HA ASN 3 7.317 -2.502 -0.518
22 HB2 ASN 3 1HB ASN 3 7.868 -2.197 -3.469
23 HB3 ASN 3 2HB ASN 3 8.296 -3.651 -2.573
24 HD21 ASN 3 2HD2 ASN 3 6.154 -3.898 -0.885
25 HD22 ASN 3 1HD2 ASN 3 4.726 -4.216 -1.805
26 H GLN 4 H GLN 4 9.576 -3.751 -1.140
27 HA GLN 4 HA GLN 4 11.564 -2.258 0.214
28 HB2 GLN 4 1HB GLN 4 12.077 -4.729 -1.430
29 HB3 GLN 4 2HB GLN 4 12.952 -4.169 -0.012
30 HG2 GLN 4 1HG GLN 4 11.725 -5.779 0.980
31 HG3 GLN 4 2HG GLN 4 10.553 -4.467 1.094
32 HE21 GLN 4 2HE2 GLN 4 8.587 -4.938 0.448
33 HE22 GLN 4 1HE2 GLN 4 8.150 -6.166 -0.686
34 H VAL 5 H VAL 5 13.254 -1.085 -0.506
35 HA VAL 5 HA VAL 5 13.673 -0.938 -3.420
36 HB VAL 5 HB VAL 5 14.094 1.434 -3.264
37 HG11 VAL 5 1HG1 VAL 5 11.923 1.863 -3.490
38 HG12 VAL 5 2HG1 VAL 5 11.606 0.229 -2.903
39 HG13 VAL 5 3HG1 VAL 5 11.628 1.585 -1.775
40 HG21 VAL 5 1HG2 VAL 5 14.971 1.216 -0.859
41 HG22 VAL 5 2HG2 VAL 5 14.098 2.686 -1.293
42 HG23 VAL 5 3HG2 VAL 5 13.287 1.418 -0.375
43 H ARG 6 H ARG 6 15.780 -0.662 -4.139
44 HA ARG 6 HA ARG 6 17.848 -1.162 -2.106
45 HB2 ARG 6 1HB ARG 6 17.344 -2.240 -4.775
46 HB3 ARG 6 2HB ARG 6 19.002 -1.697 -4.560
47 HG2 ARG 6 1HG ARG 6 18.985 -3.075 -2.408
48 HG3 ARG 6 2HG ARG 6 17.516 -3.814 -3.050
49 HD2 ARG 6 1HD ARG 6 18.627 -4.854 -4.768
50 HD3 ARG 6 2HD ARG 6 19.916 -3.652 -4.803
51 HE ARG 6 HE ARG 6 20.244 -4.889 -2.406
52 HH11 ARG 6 1HH1 ARG 6 20.011 -5.994 -5.699
53 HH12 ARG 6 2HH1 ARG 6 21.026 -7.376 -5.445
54 HH21 ARG 6 1HH2 ARG 6 21.581 -6.704 -2.058
55 HH22 ARG 6 2HH2 ARG 6 21.918 -7.779 -3.373
56 HA PRO 7 HA PRO 7 19.173 2.998 -3.053
57 HB2 PRO 7 1HB PRO 7 21.216 3.030 -1.266
58 HB3 PRO 7 2HB PRO 7 19.526 3.241 -0.796
59 HG2 PRO 7 1HG PRO 7 21.235 0.787 -0.666
60 HG3 PRO 7 2HG PRO 7 20.091 1.419 0.533
61 HD2 PRO 7 1HD PRO 7 19.470 -0.616 -1.143
62 HD3 PRO 7 2HD PRO 7 18.262 0.553 -0.571
63 H LYS 8 H LYS 8 20.109 3.052 -5.032
64 HA LYS 8 HA LYS 8 22.230 1.439 -5.905
65 HB2 LYS 8 1HB LYS 8 21.335 4.155 -6.883
66 HB3 LYS 8 2HB LYS 8 22.468 3.114 -7.734
67 HG2 LYS 8 1HG LYS 8 20.428 1.400 -7.430
68 HG3 LYS 8 2HG LYS 8 19.538 2.923 -7.479
69 HD2 LYS 8 1HD LYS 8 19.763 2.993 -9.689
70 HD3 LYS 8 2HD LYS 8 21.520 2.981 -9.520
71 HE2 LYS 8 1HE LYS 8 21.332 1.058 -10.690
72 HE3 LYS 8 2HE LYS 8 21.002 0.379 -9.096
73 HZ1 LYS 8 1HZ LYS 8 18.979 -0.189 -9.750
74 HZ2 LYS 8 2HZ LYS 8 19.358 0.318 -11.318
75 HZ3 LYS 8 3HZ LYS 8 18.622 1.391 -10.238
76 H LEU 9 H LEU 9 24.424 2.084 -6.438
77 HA LEU 9 HA LEU 9 26.025 2.801 -4.425
78 HB2 LEU 9 1HB LEU 9 27.145 4.131 -6.654
79 HB3 LEU 9 2HB LEU 9 27.556 2.547 -6.000
80 HG LEU 9 HG LEU 9 25.295 2.878 -7.944
81 HD11 LEU 9 1HD1 LEU 9 26.698 2.683 -9.786
82 HD12 LEU 9 2HD1 LEU 9 28.079 2.190 -8.807
83 HD13 LEU 9 3HD1 LEU 9 27.525 3.863 -8.769
84 HD21 LEU 9 1HD2 LEU 9 25.252 0.640 -7.978
85 HD22 LEU 9 2HD2 LEU 9 26.154 0.751 -6.467
86 HD23 LEU 9 3HD2 LEU 9 27.011 0.509 -7.990
87 HA PRO 10 HA PRO 10 25.815 7.528 -5.395
88 HB2 PRO 10 1HB PRO 10 23.939 8.355 -7.174
89 HB3 PRO 10 2HB PRO 10 25.575 7.885 -7.652
90 HG2 PRO 10 1HG PRO 10 23.039 6.299 -7.766
91 HG3 PRO 10 2HG PRO 10 24.332 6.428 -8.971
92 HD2 PRO 10 1HD PRO 10 24.114 4.317 -7.291
93 HD3 PRO 10 2HD PRO 10 25.681 4.916 -7.872
94 H LEU 11 H LEU 11 22.917 5.594 -5.270
95 HA LEU 11 HA LEU 11 21.394 7.664 -3.916
96 HB2 LEU 11 1HB LEU 11 20.791 4.855 -4.784
97 HB3 LEU 11 2HB LEU 11 19.695 5.756 -3.739
98 HG LEU 11 HG LEU 11 20.468 6.409 -6.578
99 HD11 LEU 11 1HD1 LEU 11 18.805 4.704 -6.479
100 HD12 LEU 11 2HD1 LEU 11 17.998 6.215 -6.898
101 HD13 LEU 11 3HD1 LEU 11 17.892 5.586 -5.254
102 HD21 LEU 11 1HD2 LEU 11 18.908 8.014 -4.563
103 HD22 LEU 11 2HD2 LEU 11 18.843 8.299 -6.303
104 HD23 LEU 11 3HD2 LEU 11 20.366 8.493 -5.433
105 H LEU 12 H LEU 12 23.610 5.280 -3.075
106 HA LEU 12 HA LEU 12 22.511 4.565 -0.523
107 HB2 LEU 12 1HB LEU 12 24.106 3.181 -1.915
108 HB3 LEU 12 2HB LEU 12 25.374 4.292 -1.404
109 HG LEU 12 HG LEU 12 25.433 3.463 0.730
110 HD11 LEU 12 1HD1 LEU 12 22.556 2.727 0.309
111 HD12 LEU 12 2HD1 LEU 12 23.254 3.833 1.491
112 HD13 LEU 12 3HD1 LEU 12 23.489 2.094 1.665
113 HD21 LEU 12 1HD2 LEU 12 26.208 1.646 -0.503
114 HD22 LEU 12 2HD2 LEU 12 24.601 1.250 -1.113
115 HD23 LEU 12 3HD2 LEU 12 25.008 0.930 0.573
116 H LYS 13 H LYS 13 24.997 6.802 -1.675
117 HA LYS 13 HA LYS 13 25.884 7.658 0.862
118 HB2 LYS 13 1HB LYS 13 25.904 9.486 -1.509
119 HB3 LYS 13 2HB LYS 13 27.127 9.266 -0.264
120 HG2 LYS 13 1HG LYS 13 28.236 7.983 -1.685
121 HG3 LYS 13 2HG LYS 13 26.936 6.796 -1.546
122 HD2 LYS 13 1HD LYS 13 26.969 7.123 -3.818
123 HD3 LYS 13 2HD LYS 13 25.775 8.330 -3.335
124 HE2 LYS 13 1HE LYS 13 27.126 9.576 -4.714
125 HE3 LYS 13 2HE LYS 13 27.870 9.887 -3.147
126 HZ1 LYS 13 1HZ LYS 13 29.387 7.959 -3.702
127 HZ2 LYS 13 2HZ LYS 13 29.627 9.383 -4.583
128 HZ3 LYS 13 3HZ LYS 13 28.813 8.079 -5.290
129 H ILE 14 H ILE 14 23.124 8.490 -1.066
130 HA ILE 14 HA ILE 14 22.499 10.997 0.024
131 HB ILE 14 HB ILE 14 20.525 8.916 -0.919
132 HG12 ILE 14 1HG1 ILE 14 22.351 9.381 -2.563
133 HG13 ILE 14 2HG1 ILE 14 20.753 9.850 -3.131
134 HG21 ILE 14 1HG2 ILE 14 19.206 10.968 -1.533
135 HG22 ILE 14 2HG2 ILE 14 19.387 10.675 0.195
136 HG23 ILE 14 3HG2 ILE 14 20.371 11.904 -0.599
137 HD11 ILE 14 1HD1 ILE 14 21.227 12.168 -2.626
138 HD12 ILE 14 2HD1 ILE 14 22.805 11.721 -1.975
139 HD13 ILE 14 3HD1 ILE 14 22.465 11.501 -3.691
140 H LEU 15 H LEU 15 21.196 7.792 0.901
141 HA LEU 15 HA LEU 15 19.840 8.771 3.207
142 HB2 LEU 15 1HB LEU 15 20.638 5.920 2.676
143 HB3 LEU 15 2HB LEU 15 19.305 6.502 3.671
144 HG LEU 15 HG LEU 15 18.055 5.962 1.888
145 HD11 LEU 15 1HD1 LEU 15 18.316 8.545 1.953
146 HD12 LEU 15 2HD1 LEU 15 17.508 7.785 0.583
147 HD13 LEU 15 3HD1 LEU 15 19.182 8.316 0.434
148 HD21 LEU 15 1HD2 LEU 15 19.230 6.136 -0.501
149 HD22 LEU 15 2HD2 LEU 15 19.384 4.718 0.536
150 HD23 LEU 15 3HD2 LEU 15 20.668 5.927 0.497
151 H HIS 16 H HIS 16 22.935 7.164 2.658
152 HA HIS 16 HA HIS 16 23.659 6.628 5.285
153 HB2 HIS 16 1HB HIS 16 25.245 7.250 2.812
154 HB3 HIS 16 2HB HIS 16 26.059 7.017 4.356
155 HD1 HIS 16 HD1 HIS 16 27.180 4.899 3.225
156 HD2 HIS 16 HD2 HIS 16 23.070 4.662 3.782
157 HE1 HIS 16 HE1 HIS 16 26.605 2.465 2.959
158 H ALA 17 H ALA 17 24.098 9.592 3.393
159 HA ALA 17 HA ALA 17 25.552 11.027 5.327
160 HB1 ALA 17 1HB ALA 17 24.109 12.924 3.908
161 HB2 ALA 17 2HB ALA 17 25.715 12.310 3.516
162 HB3 ALA 17 3HB ALA 17 24.289 11.577 2.784
163 H ALA 18 H ALA 18 22.255 10.139 5.181
164 HA ALA 18 HA ALA 18 21.449 12.232 7.063
165 HB1 ALA 18 1HB ALA 18 20.114 10.786 5.000
166 HB2 ALA 18 2HB ALA 18 19.295 10.484 6.533
167 HB3 ALA 18 3HB ALA 18 19.524 12.138 5.967
168 H GLY 19 H GLY 19 22.899 9.324 7.268
169 HA2 GLY 19 1HA GLY 19 23.293 8.541 9.572
170 HA3 GLY 19 2HA GLY 19 21.561 8.698 9.828
171 H ALA 20 H ALA 20 21.342 7.595 6.934
172 HA ALA 20 HA ALA 20 20.646 4.981 7.604
173 HB1 ALA 20 1HB ALA 20 20.159 4.660 5.369
174 HB2 ALA 20 2HB ALA 20 20.059 6.415 5.519
175 HB3 ALA 20 3HB ALA 20 21.498 5.670 4.823
176 H GLN 21 H GLN 21 21.645 3.068 6.229
177 HA GLN 21 HA GLN 21 24.329 2.912 5.610
178 HB2 GLN 21 1HB GLN 21 24.061 3.310 8.346
179 HB3 GLN 21 2HB GLN 21 24.316 1.577 8.196
180 HG2 GLN 21 1HG GLN 21 26.484 1.995 8.082
181 HG3 GLN 21 2HG GLN 21 26.195 2.706 6.495
182 HE21 GLN 21 2HE2 GLN 21 25.796 4.994 6.391
183 HE22 GLN 21 1HE2 GLN 21 26.480 6.040 7.583
184 H GLY 22 H GLY 22 24.337 1.183 4.343
185 HA2 GLY 22 1HA GLY 22 24.205 -1.388 4.742
186 HA3 GLY 22 2HA GLY 22 22.499 -1.024 4.949
187 H GLU 23 H GLU 23 21.979 -2.369 3.178
188 HA GLU 23 HA GLU 23 22.279 -1.013 0.610
189 HB2 GLU 23 1HB GLU 23 22.863 -3.960 0.932
190 HB3 GLU 23 2HB GLU 23 22.942 -3.029 -0.557
191 HG2 GLU 23 1HG GLU 23 24.813 -1.764 0.278
192 HG3 GLU 23 2HG GLU 23 24.693 -2.563 1.845
193 H MET 24 H MET 24 20.203 -1.880 2.752
194 HA MET 24 HA MET 24 18.160 -2.595 0.796
195 HB2 MET 24 1HB MET 24 17.322 -4.152 2.841
196 HB3 MET 24 2HB MET 24 18.268 -4.748 1.484
197 HG2 MET 24 1HG MET 24 19.568 -3.736 3.986
198 HG3 MET 24 2HG MET 24 19.005 -5.399 3.833
199 HE1 MET 24 1HE MET 24 22.892 -4.173 3.453
200 HE2 MET 24 2HE MET 24 21.593 -4.353 4.632
201 HE3 MET 24 3HE MET 24 22.457 -5.776 4.047
202 H PHE 25 H PHE 25 16.357 -1.443 1.084
203 HA PHE 25 HA PHE 25 15.423 -0.647 3.673
204 HB2 PHE 25 1HB PHE 25 16.286 1.566 1.805
205 HB3 PHE 25 2HB PHE 25 15.633 1.737 3.431
206 HD1 PHE 25 HD1 PHE 25 18.553 0.580 1.492
207 HD2 PHE 25 HD2 PHE 25 17.027 1.624 5.326
208 HE1 PHE 25 HE1 PHE 25 20.838 0.551 2.406
209 HE2 PHE 25 HE2 PHE 25 19.309 1.597 6.245
210 HZ PHE 25 HZ PHE 25 21.218 1.061 4.785
211 H THR 26 H THR 26 13.287 -0.016 3.650
212 HA THR 26 HA THR 26 11.862 -0.557 1.183
213 HB THR 26 HB THR 26 10.105 0.305 3.276
214 HG1 THR 26 1HG THR 26 10.740 -1.459 4.755
215 HG21 THR 26 1HG2 THR 26 10.055 -1.519 1.301
216 HG22 THR 26 2HG2 THR 26 8.967 -1.569 2.688
217 HG23 THR 26 3HG2 THR 26 10.416 -2.573 2.667
218 H VAL 27 H VAL 27 9.930 0.878 0.678
219 HA VAL 27 HA VAL 27 10.714 3.348 -0.201
220 HB VAL 27 HB VAL 27 7.881 2.962 0.701
221 HG11 VAL 27 1HG1 VAL 27 7.397 4.560 -0.795
222 HG12 VAL 27 2HG1 VAL 27 9.122 4.925 -0.731
223 HG13 VAL 27 3HG1 VAL 27 8.486 3.889 -2.009
224 HG21 VAL 27 1HG2 VAL 27 9.346 1.425 -1.404
225 HG22 VAL 27 2HG2 VAL 27 8.167 0.859 -0.221
226 HG23 VAL 27 3HG2 VAL 27 7.636 1.803 -1.612
227 H LYS 28 H LYS 28 9.136 2.580 2.879
228 HA LYS 28 HA LYS 28 8.939 5.257 3.783
229 HB2 LYS 28 1HB LYS 28 8.485 2.580 4.876
230 HB3 LYS 28 2HB LYS 28 9.059 3.731 6.075
231 HG2 LYS 28 1HG LYS 28 6.989 4.480 6.276
232 HG3 LYS 28 2HG LYS 28 7.073 5.065 4.613
233 HD2 LYS 28 1HD LYS 28 6.004 2.445 5.626
234 HD3 LYS 28 2HD LYS 28 5.166 3.686 4.691
235 HE2 LYS 28 1HE LYS 28 5.615 2.366 2.934
236 HE3 LYS 28 2HE LYS 28 7.233 3.059 3.035
237 HZ1 LYS 28 1HZ LYS 28 8.039 1.061 3.476
238 HZ2 LYS 28 2HZ LYS 28 6.494 0.389 3.321
239 HZ3 LYS 28 3HZ LYS 28 7.042 0.909 4.835
240 H GLU 29 H GLU 29 11.333 2.700 4.341
241 HA GLU 29 HA GLU 29 12.943 4.027 6.183
242 HB2 GLU 29 1HB GLU 29 13.560 1.948 4.095
243 HB3 GLU 29 2HB GLU 29 14.803 2.572 5.170
244 HG2 GLU 29 1HG GLU 29 12.265 1.203 6.033
245 HG3 GLU 29 2HG GLU 29 13.866 0.468 5.975
246 H VAL 30 H VAL 30 13.235 3.933 2.635
247 HA VAL 30 HA VAL 30 15.455 5.650 2.457
248 HB VAL 30 HB VAL 30 13.290 4.979 0.471
249 HG11 VAL 30 1HG1 VAL 30 13.889 6.877 -0.575
250 HG12 VAL 30 2HG1 VAL 30 15.386 7.033 0.346
251 HG13 VAL 30 3HG1 VAL 30 15.314 5.953 -1.048
252 HG21 VAL 30 1HG2 VAL 30 14.566 3.087 0.653
253 HG22 VAL 30 2HG2 VAL 30 15.472 3.948 -0.592
254 HG23 VAL 30 3HG2 VAL 30 16.026 3.979 1.082
255 H MET 31 H MET 31 11.979 6.323 2.060
256 HA MET 31 HA MET 31 12.193 9.064 1.582
257 HB2 MET 31 1HB MET 31 9.967 8.924 1.440
258 HB3 MET 31 2HB MET 31 10.122 7.223 1.862
259 HG2 MET 31 1HG MET 31 8.540 8.062 3.350
260 HG3 MET 31 2HG MET 31 10.031 7.978 4.285
261 HE1 MET 31 1HE MET 31 9.394 10.821 1.561
262 HE2 MET 31 2HE MET 31 7.806 10.254 2.080
263 HE3 MET 31 3HE MET 31 8.343 11.881 2.501
264 H HIS 32 H HIS 32 12.313 7.246 4.558
265 HA HIS 32 HA HIS 32 11.900 9.427 6.329
266 HB2 HIS 32 1HB HIS 32 11.868 6.810 6.725
267 HB3 HIS 32 2HB HIS 32 13.559 7.078 7.137
268 HD1 HIS 32 HD1 HIS 32 10.450 6.798 8.734
269 HD2 HIS 32 HD2 HIS 32 13.635 9.437 9.124
270 HE1 HIS 32 HE1 HIS 32 10.199 7.823 11.016
271 H TYR 33 H TYR 33 14.680 8.159 4.654
272 HA TYR 33 HA TYR 33 16.627 9.550 6.226
273 HB2 TYR 33 1HB TYR 33 16.728 8.120 3.577
274 HB3 TYR 33 2HB TYR 33 18.124 8.978 4.220
275 HD1 TYR 33 HD2 TYR 33 18.379 8.365 6.928
276 HD2 TYR 33 HD1 TYR 33 16.869 5.843 3.852
277 HE1 TYR 33 HE2 TYR 33 18.985 6.389 8.260
278 HE2 TYR 33 HE1 TYR 33 17.471 3.859 5.176
279 HH TYR 33 HH TYR 33 18.556 4.112 8.476
280 H LEU 34 H LEU 34 14.755 10.250 3.364
281 HA LEU 34 HA LEU 34 16.162 12.310 2.207
282 HB2 LEU 34 1HB LEU 34 13.442 11.374 2.221
283 HB3 LEU 34 2HB LEU 34 13.484 13.135 2.169
284 HG LEU 34 HG LEU 34 13.331 12.229 -0.070
285 HD11 LEU 34 1HD1 LEU 34 14.634 14.286 0.305
286 HD12 LEU 34 2HD1 LEU 34 15.213 13.359 -1.079
287 HD13 LEU 34 3HD1 LEU 34 16.097 13.312 0.447
288 HD21 LEU 34 1HD2 LEU 34 15.947 10.839 0.497
289 HD22 LEU 34 2HD2 LEU 34 15.043 10.817 -1.018
290 HD23 LEU 34 3HD2 LEU 34 14.374 10.044 0.420
291 H GLY 35 H GLY 35 13.728 12.610 4.799
292 HA2 GLY 35 1HA GLY 35 13.876 15.347 5.196
293 HA3 GLY 35 2HA GLY 35 13.485 14.184 6.454
294 H GLN 36 H GLN 36 15.828 12.823 6.770
295 HA GLN 36 HA GLN 36 17.312 14.535 8.416
296 HB2 GLN 36 1HB GLN 36 18.011 11.842 7.241
297 HB3 GLN 36 2HB GLN 36 18.986 12.660 8.455
298 HG2 GLN 36 1HG GLN 36 16.132 12.347 9.103
299 HG3 GLN 36 2HG GLN 36 17.076 10.860 9.021
300 HE21 GLN 36 2HE2 GLN 36 19.340 11.207 10.119
301 HE22 GLN 36 1HE2 GLN 36 19.258 11.873 11.711
302 H TYR 37 H TYR 37 17.861 13.435 5.107
303 HA TYR 37 HA TYR 37 20.451 14.468 4.783
304 HB2 TYR 37 1HB TYR 37 19.445 12.867 3.216
305 HB3 TYR 37 2HB TYR 37 18.286 14.087 2.703
306 HD1 TYR 37 HD2 TYR 37 21.922 13.325 2.804
307 HD2 TYR 37 HD1 TYR 37 18.811 15.572 0.967
308 HE1 TYR 37 HE2 TYR 37 23.500 14.088 1.079
309 HE2 TYR 37 HE1 TYR 37 20.380 16.341 -0.764
310 HH TYR 37 HH TYR 37 23.808 15.435 -0.668
311 H ILE 38 H ILE 38 17.275 15.895 4.087
312 HA ILE 38 HA ILE 38 18.204 18.315 3.012
313 HB ILE 38 HB ILE 38 15.642 17.883 4.551
314 HG12 ILE 38 1HG1 ILE 38 16.047 17.696 1.564
315 HG13 ILE 38 2HG1 ILE 38 16.078 16.290 2.622
316 HG21 ILE 38 1HG2 ILE 38 16.288 19.909 2.416
317 HG22 ILE 38 2HG2 ILE 38 14.796 19.781 3.347
318 HG23 ILE 38 3HG2 ILE 38 16.298 20.243 4.147
319 HD11 ILE 38 1HD1 ILE 38 13.912 16.323 1.806
320 HD12 ILE 38 2HD1 ILE 38 13.760 17.084 3.390
321 HD13 ILE 38 3HD1 ILE 38 13.785 18.077 1.933
322 H MET 39 H MET 39 17.243 17.485 6.335
323 HA MET 39 HA MET 39 17.729 20.026 7.444
324 HB2 MET 39 1HB MET 39 16.946 19.068 9.309
325 HB3 MET 39 2HB MET 39 16.748 17.600 8.362
326 HG2 MET 39 1HG MET 39 17.927 16.916 10.243
327 HG3 MET 39 2HG MET 39 19.160 17.073 8.994
328 HE1 MET 39 1HE MET 39 18.369 19.557 12.665
329 HE2 MET 39 2HE MET 39 17.816 20.444 11.245
330 HE3 MET 39 3HE MET 39 17.185 18.830 11.578
331 H VAL 40 H VAL 40 19.819 17.289 6.804
332 HA VAL 40 HA VAL 40 22.027 18.202 8.354
333 HB VAL 40 HB VAL 40 21.424 15.870 6.983
334 HG11 VAL 40 1HG1 VAL 40 22.302 16.854 4.915
335 HG12 VAL 40 2HG1 VAL 40 23.847 17.147 5.716
336 HG13 VAL 40 3HG1 VAL 40 23.284 15.495 5.460
337 HG21 VAL 40 1HG2 VAL 40 22.650 16.006 9.066
338 HG22 VAL 40 2HG2 VAL 40 23.576 15.074 7.889
339 HG23 VAL 40 3HG2 VAL 40 24.024 16.744 8.241
340 H LYS 41 H LYS 41 21.070 18.557 4.977
341 HA LYS 41 HA LYS 41 23.485 19.996 4.295
342 HB2 LYS 41 1HB LYS 41 21.058 19.073 2.824
343 HB3 LYS 41 2HB LYS 41 21.997 20.392 2.136
344 HG2 LYS 41 1HG LYS 41 23.112 17.695 2.880
345 HG3 LYS 41 2HG LYS 41 22.629 18.180 1.253
346 HD2 LYS 41 1HD LYS 41 24.712 18.928 0.977
347 HD3 LYS 41 2HD LYS 41 24.308 20.220 2.110
348 HE2 LYS 41 1HE LYS 41 25.036 18.748 3.968
349 HE3 LYS 41 2HE LYS 41 25.537 17.547 2.778
350 HZ1 LYS 41 1HZ LYS 41 26.689 19.978 2.056
351 HZ2 LYS 41 2HZ LYS 41 27.467 18.589 2.625
352 HZ3 LYS 41 3HZ LYS 41 26.961 19.780 3.714
353 H GLN 42 H GLN 42 20.443 20.736 5.615
354 HA GLN 42 HA GLN 42 19.480 22.696 6.256
355 HB2 GLN 42 1HB GLN 42 22.295 23.403 5.836
356 HB3 GLN 42 2HB GLN 42 21.190 24.760 5.663
357 HG2 GLN 42 1HG GLN 42 21.490 24.936 7.877
358 HG3 GLN 42 2HG GLN 42 20.246 23.688 7.935
359 HE21 GLN 42 2HE2 GLN 42 22.061 21.659 6.857
360 HE22 GLN 42 1HE2 GLN 42 23.110 21.224 8.159
361 H LEU 43 H LEU 43 18.225 22.049 4.232
362 HA LEU 43 HA LEU 43 18.216 24.352 2.411
363 HB2 LEU 43 1HB LEU 43 18.181 21.441 1.689
364 HB3 LEU 43 2HB LEU 43 17.493 22.659 0.617
365 HG LEU 43 HG LEU 43 20.178 23.374 1.408
366 HD11 LEU 43 1HD1 LEU 43 21.440 21.605 0.650
367 HD12 LEU 43 2HD1 LEU 43 20.103 20.897 -0.256
368 HD13 LEU 43 3HD1 LEU 43 20.140 20.772 1.502
369 HD21 LEU 43 1HD2 LEU 43 18.663 22.920 -1.138
370 HD22 LEU 43 2HD2 LEU 43 20.399 23.230 -1.154
371 HD23 LEU 43 3HD2 LEU 43 19.295 24.425 -0.471
372 H TYR 44 H TYR 44 16.549 24.719 4.248
373 HA TYR 44 HA TYR 44 13.950 24.196 3.105
374 HB2 TYR 44 1HB TYR 44 13.028 23.301 5.257
375 HB3 TYR 44 2HB TYR 44 14.137 22.206 4.439
376 HD1 TYR 44 HD2 TYR 44 16.575 22.177 5.255
377 HD2 TYR 44 HD1 TYR 44 13.384 23.890 7.489
378 HE1 TYR 44 HE2 TYR 44 17.926 22.010 7.303
379 HE2 TYR 44 HE1 TYR 44 14.727 23.728 9.543
380 HH TYR 44 HH TYR 44 18.050 23.089 9.520
381 H ASP 45 H ASP 45 12.207 25.284 4.467
382 HA ASP 45 HA ASP 45 13.224 27.903 5.262
383 HB2 ASP 45 1HB ASP 45 11.461 28.081 3.697
384 HB3 ASP 45 2HB ASP 45 10.488 26.873 4.534
385 H GLN 46 H GLN 46 13.870 27.902 7.338
386 HA GLN 46 HA GLN 46 13.032 26.332 9.421
387 HB2 GLN 46 1HB GLN 46 13.775 29.243 9.718
388 HB3 GLN 46 2HB GLN 46 13.962 27.968 10.915
389 HG2 GLN 46 1HG GLN 46 16.095 28.080 10.161
390 HG3 GLN 46 2HG GLN 46 15.455 26.898 9.021
391 HE21 GLN 46 2HE2 GLN 46 15.593 27.319 6.918
392 HE22 GLN 46 1HE2 GLN 46 16.066 28.831 6.230
393 H GLN 47 H GLN 47 11.357 28.962 7.943
394 HA GLN 47 HA GLN 47 9.538 29.401 10.132
395 HB2 GLN 47 1HB GLN 47 9.522 30.341 7.262
396 HB3 GLN 47 2HB GLN 47 8.309 30.804 8.448
397 HG2 GLN 47 1HG GLN 47 10.288 32.386 7.980
398 HG3 GLN 47 2HG GLN 47 9.781 32.110 9.645
399 HE21 GLN 47 2HE2 GLN 47 12.007 30.808 7.212
400 HE22 GLN 47 1HE2 GLN 47 13.301 30.496 8.313
401 H GLU 48 H GLU 48 9.626 27.473 7.222
402 HA GLU 48 HA GLU 48 7.116 26.202 8.052
403 HB2 GLU 48 1HB GLU 48 7.780 27.146 5.260
404 HB3 GLU 48 2HB GLU 48 6.471 26.032 5.628
405 HG2 GLU 48 1HG GLU 48 5.748 27.933 7.286
406 HG3 GLU 48 2HG GLU 48 6.707 28.938 6.201
407 H GLN 49 H GLN 49 8.465 24.532 8.875
408 HA GLN 49 HA GLN 49 10.467 23.163 7.598
409 HB2 GLN 49 1HB GLN 49 8.349 22.241 9.521
410 HB3 GLN 49 2HB GLN 49 9.563 21.128 8.906
411 HG2 GLN 49 1HG GLN 49 10.717 21.772 10.709
412 HG3 GLN 49 2HG GLN 49 11.133 23.167 9.715
413 HE21 GLN 49 2HE2 GLN 49 11.422 24.428 11.573
414 HE22 GLN 49 1HE2 GLN 49 10.078 25.030 12.477
415 H HIS 50 H HIS 50 7.111 23.198 6.836
416 HA HIS 50 HA HIS 50 7.253 20.788 5.214
417 HB2 HIS 50 1HB HIS 50 4.910 21.015 4.906
418 HB3 HIS 50 2HB HIS 50 5.218 21.449 6.585
419 HD1 HIS 50 HD1 HIS 50 4.703 23.842 7.298
420 HD2 HIS 50 HD2 HIS 50 4.157 23.176 3.234
421 HE1 HIS 50 HE1 HIS 50 3.505 25.879 6.439
422 H MET 51 H MET 51 8.896 23.149 4.567
423 HA MET 51 HA MET 51 8.109 23.363 1.767
424 HB2 MET 51 1HB MET 51 8.425 25.684 3.647
425 HB3 MET 51 2HB MET 51 8.746 25.872 1.928
426 HG2 MET 51 1HG MET 51 6.150 24.965 3.151
427 HG3 MET 51 2HG MET 51 6.488 26.566 2.498
428 HE1 MET 51 1HE MET 51 7.499 25.129 -1.215
429 HE2 MET 51 2HE MET 51 8.105 26.187 0.059
430 HE3 MET 51 3HE MET 51 8.435 24.455 0.120
431 H VAL 52 H VAL 52 9.927 21.926 1.550
432 HA VAL 52 HA VAL 52 12.547 22.660 2.362
433 HB VAL 52 HB VAL 52 11.627 20.702 0.254
434 HG11 VAL 52 1HG1 VAL 52 14.368 20.961 1.483
435 HG12 VAL 52 2HG1 VAL 52 13.860 19.806 0.249
436 HG13 VAL 52 3HG1 VAL 52 13.936 21.527 -0.130
437 HG21 VAL 52 1HG2 VAL 52 11.373 20.569 2.986
438 HG22 VAL 52 2HG2 VAL 52 11.379 19.191 1.886
439 HG23 VAL 52 3HG2 VAL 52 12.870 19.685 2.688
440 H TYR 53 H TYR 53 14.195 23.638 1.257
441 HA TYR 53 HA TYR 53 13.436 24.983 -1.251
442 HB2 TYR 53 1HB TYR 53 15.057 25.833 1.101
443 HB3 TYR 53 2HB TYR 53 15.523 26.447 -0.482
444 HD1 TYR 53 HD2 TYR 53 12.956 26.861 -1.805
445 HD2 TYR 53 HD1 TYR 53 14.077 27.607 2.231
446 HE1 TYR 53 HE2 TYR 53 11.219 28.595 -1.649
447 HE2 TYR 53 HE1 TYR 53 12.342 29.342 2.399
448 HH TYR 53 HH TYR 53 11.081 30.840 0.854
449 H CYS 54 H CYS 54 14.088 22.843 -2.206
450 HA CYS 54 HA CYS 54 16.480 21.624 -2.235
451 HB2 CYS 54 1HB CYS 54 15.783 20.653 -4.149
452 HB3 CYS 54 2HB CYS 54 14.316 21.591 -3.900
453 HG CYS 54 HG CYS 54 14.494 22.455 -6.322
454 H GLY 55 H GLY 55 15.764 24.695 -3.842
455 HA2 GLY 55 1HA GLY 55 17.141 26.325 -4.688
456 HA3 GLY 55 2HA GLY 55 18.330 25.747 -3.530
457 H GLY 56 H GLY 56 19.763 24.025 -4.178
458 HA2 GLY 56 1HA GLY 56 19.846 23.230 -6.947
459 HA3 GLY 56 2HA GLY 56 21.094 24.390 -6.518
460 H ASP 57 H ASP 57 19.997 22.143 -4.127
461 HA ASP 57 HA ASP 57 22.639 20.935 -4.064
462 HB2 ASP 57 1HB ASP 57 20.483 21.371 -2.167
463 HB3 ASP 57 2HB ASP 57 21.076 19.713 -2.104
464 H LEU 58 H LEU 58 22.428 18.453 -3.289
465 HA LEU 58 HA LEU 58 21.983 16.927 -5.509
466 HB2 LEU 58 1HB LEU 58 22.831 16.432 -2.982
467 HB3 LEU 58 2HB LEU 58 21.288 15.582 -2.987
468 HG LEU 58 HG LEU 58 23.433 15.109 -5.048
469 HD11 LEU 58 1HD1 LEU 58 23.856 13.010 -3.710
470 HD12 LEU 58 2HD1 LEU 58 22.974 13.778 -2.391
471 HD13 LEU 58 3HD1 LEU 58 24.456 14.512 -3.005
472 HD21 LEU 58 1HD2 LEU 58 21.430 14.300 -5.897
473 HD22 LEU 58 2HD2 LEU 58 20.842 13.800 -4.310
474 HD23 LEU 58 3HD2 LEU 58 22.123 12.884 -5.106
475 H LEU 59 H LEU 59 19.681 17.458 -2.848
476 HA LEU 59 HA LEU 59 17.589 15.904 -3.833
477 HB2 LEU 59 1HB LEU 59 16.171 17.070 -2.332
478 HB3 LEU 59 2HB LEU 59 17.750 16.928 -1.562
479 HG LEU 59 HG LEU 59 16.848 19.426 -2.980
480 HD11 LEU 59 1HD1 LEU 59 15.471 19.888 -1.308
481 HD12 LEU 59 2HD1 LEU 59 16.822 19.781 -0.180
482 HD13 LEU 59 3HD1 LEU 59 15.854 18.350 -0.535
483 HD21 LEU 59 1HD2 LEU 59 19.058 18.774 -1.042
484 HD22 LEU 59 2HD2 LEU 59 18.580 20.420 -1.458
485 HD23 LEU 59 3HD2 LEU 59 19.208 19.342 -2.705
486 H GLY 60 H GLY 60 18.431 19.278 -4.483
487 HA2 GLY 60 1HA GLY 60 16.138 19.948 -5.973
488 HA3 GLY 60 2HA GLY 60 17.700 20.747 -6.087
489 H GLU 61 H GLU 61 19.363 18.948 -7.124
490 HA GLU 61 HA GLU 61 18.797 18.945 -9.841
491 HB2 GLU 61 1HB GLU 61 20.652 17.228 -9.991
492 HB3 GLU 61 2HB GLU 61 21.061 18.731 -9.176
493 HG2 GLU 61 1HG GLU 61 20.793 17.657 -7.015
494 HG3 GLU 61 2HG GLU 61 20.325 16.153 -7.807
495 H LEU 62 H LEU 62 18.429 16.328 -7.475
496 HA LEU 62 HA LEU 62 17.622 14.318 -9.238
497 HB2 LEU 62 1HB LEU 62 17.787 14.700 -6.424
498 HB3 LEU 62 2HB LEU 62 16.206 14.017 -6.797
499 HG LEU 62 HG LEU 62 17.476 12.134 -6.398
500 HD11 LEU 62 1HD1 LEU 62 16.627 12.570 -8.969
501 HD12 LEU 62 2HD1 LEU 62 17.154 11.024 -8.306
502 HD13 LEU 62 3HD1 LEU 62 18.293 12.037 -9.192
503 HD21 LEU 62 1HD2 LEU 62 19.642 12.742 -6.058
504 HD22 LEU 62 2HD2 LEU 62 19.702 13.759 -7.498
505 HD23 LEU 62 3HD2 LEU 62 19.811 12.005 -7.651
506 H LEU 63 H LEU 63 15.509 16.262 -7.115
507 HA LEU 63 HA LEU 63 13.085 15.463 -8.193
508 HB2 LEU 63 1HB LEU 63 14.048 17.610 -6.495
509 HB3 LEU 63 2HB LEU 63 12.691 18.117 -7.499
510 HG LEU 63 HG LEU 63 11.832 15.711 -6.473
511 HD11 LEU 63 1HD1 LEU 63 13.960 16.062 -4.958
512 HD12 LEU 63 2HD1 LEU 63 12.450 15.441 -4.293
513 HD13 LEU 63 3HD1 LEU 63 12.873 17.140 -4.083
514 HD21 LEU 63 1HD2 LEU 63 10.358 17.521 -6.635
515 HD22 LEU 63 2HD2 LEU 63 11.392 18.568 -5.662
516 HD23 LEU 63 3HD2 LEU 63 10.517 17.238 -4.901
517 H GLY 64 H GLY 64 15.175 18.165 -9.156
518 HA2 GLY 64 1HA GLY 64 15.421 18.991 -11.335
519 HA3 GLY 64 2HA GLY 64 13.990 18.090 -11.815
520 H ARG 65 H ARG 65 13.858 20.057 -8.972
521 HA ARG 65 HA ARG 65 12.385 22.121 -10.470
522 HB2 ARG 65 1HB ARG 65 11.610 21.359 -7.675
523 HB3 ARG 65 2HB ARG 65 10.652 22.164 -8.910
524 HG2 ARG 65 1HG ARG 65 11.481 19.476 -9.668
525 HG3 ARG 65 2HG ARG 65 10.479 19.524 -8.216
526 HD2 ARG 65 1HD ARG 65 8.660 19.876 -9.439
527 HD3 ARG 65 2HD ARG 65 9.394 21.301 -10.174
528 HE ARG 65 HE ARG 65 10.463 19.069 -11.441
529 HH11 ARG 65 1HH1 ARG 65 7.370 20.623 -11.066
530 HH12 ARG 65 2HH1 ARG 65 6.768 20.087 -12.600
531 HH21 ARG 65 1HH2 ARG 65 9.682 18.357 -13.462
532 HH22 ARG 65 2HH2 ARG 65 8.084 18.797 -13.962
533 H GLN 66 H GLN 66 11.808 23.558 -7.990
534 HA GLN 66 HA GLN 66 14.514 24.558 -7.387
535 HB2 GLN 66 1HB GLN 66 13.078 26.740 -6.900
536 HB3 GLN 66 2HB GLN 66 13.680 26.365 -8.509
537 HG2 GLN 66 1HG GLN 66 11.586 25.647 -9.254
538 HG3 GLN 66 2HG GLN 66 10.959 25.492 -7.614
539 HE21 GLN 66 2HE2 GLN 66 9.216 26.815 -7.891
540 HE22 GLN 66 1HE2 GLN 66 9.344 28.517 -8.153
541 H SER 67 H SER 67 11.261 23.987 -6.158
542 HA SER 67 HA SER 67 12.310 23.526 -3.511
543 HB2 SER 67 1HB SER 67 11.339 25.283 -2.363
544 HB3 SER 67 2HB SER 67 11.775 26.088 -3.870
545 HG SER 67 HG SER 67 9.685 26.614 -3.569
546 H PHE 68 H PHE 68 10.928 22.323 -2.213
547 HA PHE 68 HA PHE 68 8.261 21.705 -3.225
548 HB2 PHE 68 1HB PHE 68 8.678 19.263 -2.998
549 HB3 PHE 68 2HB PHE 68 9.628 20.009 -4.279
550 HD1 PHE 68 HD1 PHE 68 12.044 20.636 -3.744
551 HD2 PHE 68 HD2 PHE 68 9.711 18.018 -1.332
552 HE1 PHE 68 HE1 PHE 68 14.102 19.721 -2.753
553 HE2 PHE 68 HE2 PHE 68 11.765 17.099 -0.337
554 HZ PHE 68 HZ PHE 68 13.964 17.951 -1.046
555 H SER 69 H SER 69 6.826 20.956 -1.663
556 HA SER 69 HA SER 69 7.615 21.556 1.067
557 HB2 SER 69 1HB SER 69 5.539 22.439 0.948
558 HB3 SER 69 2HB SER 69 5.100 21.445 -0.442
559 HG SER 69 HG SER 69 4.098 21.129 1.831
560 H VAL 70 H VAL 70 7.807 20.116 2.698
561 HA VAL 70 HA VAL 70 8.287 17.405 2.122
562 HB VAL 70 HB VAL 70 8.875 17.147 4.322
563 HG11 VAL 70 1HG1 VAL 70 10.048 19.052 5.014
564 HG12 VAL 70 2HG1 VAL 70 9.918 19.229 3.263
565 HG13 VAL 70 3HG1 VAL 70 8.851 20.148 4.326
566 HG21 VAL 70 1HG2 VAL 70 6.838 17.293 5.447
567 HG22 VAL 70 2HG2 VAL 70 7.793 18.596 6.153
568 HG23 VAL 70 3HG2 VAL 70 6.568 18.960 4.938
569 H LYS 71 H LYS 71 5.459 19.092 3.355
570 HA LYS 71 HA LYS 71 4.009 16.669 3.919
571 HB2 LYS 71 1HB LYS 71 3.764 19.340 4.664
572 HB3 LYS 71 2HB LYS 71 2.373 19.056 3.626
573 HG2 LYS 71 1HG LYS 71 1.495 18.471 5.644
574 HG3 LYS 71 2HG LYS 71 2.114 16.905 5.116
575 HD2 LYS 71 1HD LYS 71 2.794 17.181 7.373
576 HD3 LYS 71 2HD LYS 71 4.229 17.444 6.378
577 HE2 LYS 71 1HE LYS 71 4.464 19.300 7.623
578 HE3 LYS 71 2HE LYS 71 3.243 19.963 6.538
579 HZ1 LYS 71 1HZ LYS 71 1.968 18.553 8.609
580 HZ2 LYS 71 2HZ LYS 71 1.880 20.203 8.248
581 HZ3 LYS 71 3HZ LYS 71 3.077 19.630 9.297
582 H ASP 72 H ASP 72 4.899 18.047 1.104
583 HA ASP 72 HA ASP 72 2.412 17.296 -0.282
584 HB2 ASP 72 1HB ASP 72 4.405 19.432 -0.726
585 HB3 ASP 72 2HB ASP 72 3.835 18.616 -2.180
586 HA PRO 73 HA PRO 73 5.083 13.828 -1.447
587 HB2 PRO 73 1HB PRO 73 3.026 12.234 -2.222
588 HB3 PRO 73 2HB PRO 73 3.509 12.426 -0.533
589 HG2 PRO 73 1HG PRO 73 1.275 13.745 -2.025
590 HG3 PRO 73 2HG PRO 73 1.276 13.059 -0.390
591 HD2 PRO 73 1HD PRO 73 1.494 15.717 -0.853
592 HD3 PRO 73 2HD PRO 73 2.276 14.922 0.528
593 H SER 74 H SER 74 3.291 16.020 -3.193
594 HA SER 74 HA SER 74 3.105 14.792 -5.727
595 HB2 SER 74 1HB SER 74 1.806 16.683 -5.672
596 HB3 SER 74 2HB SER 74 2.965 17.581 -4.692
597 HG SER 74 HG SER 74 2.834 18.339 -6.868
598 HA PRO 75 HA PRO 75 7.232 17.006 -6.855
599 HB2 PRO 75 1HB PRO 75 8.558 18.305 -4.873
600 HB3 PRO 75 2HB PRO 75 7.327 19.083 -5.876
601 HG2 PRO 75 1HG PRO 75 7.081 17.940 -3.120
602 HG3 PRO 75 2HG PRO 75 6.426 19.457 -3.765
603 HD2 PRO 75 1HD PRO 75 4.919 17.225 -3.478
604 HD3 PRO 75 2HD PRO 75 4.643 18.404 -4.777
605 H LEU 76 H LEU 76 6.800 15.307 -3.878
606 HA LEU 76 HA LEU 76 9.506 14.445 -3.558
607 HB2 LEU 76 1HB LEU 76 7.713 14.560 -1.770
608 HB3 LEU 76 2HB LEU 76 7.052 13.086 -2.474
609 HG LEU 76 HG LEU 76 9.319 12.031 -2.033
610 HD11 LEU 76 1HD1 LEU 76 10.850 13.657 -1.598
611 HD12 LEU 76 2HD1 LEU 76 10.352 13.289 0.053
612 HD13 LEU 76 3HD1 LEU 76 9.684 14.695 -0.776
613 HD21 LEU 76 1HD2 LEU 76 7.059 12.218 -0.506
614 HD22 LEU 76 2HD2 LEU 76 8.316 12.722 0.624
615 HD23 LEU 76 3HD2 LEU 76 8.426 11.154 -0.178
616 H TYR 77 H TYR 77 6.557 12.672 -4.509
617 HA TYR 77 HA TYR 77 7.739 10.295 -5.256
618 HB2 TYR 77 1HB TYR 77 5.279 11.701 -6.272
619 HB3 TYR 77 2HB TYR 77 5.756 10.122 -6.886
620 HD1 TYR 77 HD1 TYR 77 6.540 8.551 -4.693
621 HD2 TYR 77 HD2 TYR 77 3.526 11.553 -4.791
622 HE1 TYR 77 HE1 TYR 77 5.408 7.468 -2.797
623 HE2 TYR 77 HE2 TYR 77 2.386 10.478 -2.895
624 HH TYR 77 HH TYR 77 2.354 7.939 -1.967
625 H ASP 78 H ASP 78 7.651 13.332 -6.952
626 HA ASP 78 HA ASP 78 8.253 12.481 -9.544
627 HB2 ASP 78 1HB ASP 78 7.610 14.811 -8.852
628 HB3 ASP 78 2HB ASP 78 9.249 15.021 -8.243
629 H MET 79 H MET 79 10.409 13.303 -6.848
630 HA MET 79 HA MET 79 12.796 12.777 -8.335
631 HB2 MET 79 1HB MET 79 13.180 14.261 -6.602
632 HB3 MET 79 2HB MET 79 12.152 13.381 -5.479
633 HG2 MET 79 1HG MET 79 13.855 11.606 -5.357
634 HG3 MET 79 2HG MET 79 14.892 12.563 -6.412
635 HE1 MET 79 1HE MET 79 13.700 12.137 -2.580
636 HE2 MET 79 2HE MET 79 13.533 13.855 -2.220
637 HE3 MET 79 3HE MET 79 12.536 13.116 -3.474
638 H LEU 80 H LEU 80 11.122 11.053 -5.702
639 HA LEU 80 HA LEU 80 12.796 8.828 -5.598
640 HB2 LEU 80 1HB LEU 80 9.870 9.152 -4.987
641 HB3 LEU 80 2HB LEU 80 10.741 7.648 -4.697
642 HG LEU 80 HG LEU 80 12.081 8.643 -3.014
643 HD11 LEU 80 1HD1 LEU 80 10.877 11.294 -3.796
644 HD12 LEU 80 2HD1 LEU 80 12.525 10.766 -4.135
645 HD13 LEU 80 3HD1 LEU 80 12.004 11.016 -2.468
646 HD21 LEU 80 1HD2 LEU 80 9.366 9.846 -2.559
647 HD22 LEU 80 2HD2 LEU 80 10.483 9.171 -1.373
648 HD23 LEU 80 3HD2 LEU 80 9.648 8.105 -2.504
649 H ARG 81 H ARG 81 10.258 9.654 -7.834
650 HA ARG 81 HA ARG 81 9.481 7.292 -8.927
651 HB2 ARG 81 1HB ARG 81 8.579 8.616 -10.487
652 HB3 ARG 81 2HB ARG 81 9.387 9.964 -9.700
653 HG2 ARG 81 1HG ARG 81 11.283 9.743 -11.179
654 HG3 ARG 81 2HG ARG 81 10.568 8.311 -11.921
655 HD2 ARG 81 1HD ARG 81 8.631 10.360 -12.040
656 HD3 ARG 81 2HD ARG 81 10.161 11.068 -12.557
657 HE ARG 81 HE ARG 81 9.694 8.558 -13.813
658 HH11 ARG 81 1HH1 ARG 81 8.805 11.923 -13.899
659 HH12 ARG 81 2HH1 ARG 81 8.406 11.909 -15.584
660 HH21 ARG 81 1HH2 ARG 81 9.172 8.527 -16.033
661 HH22 ARG 81 2HH2 ARG 81 8.614 9.977 -16.797
662 H LYS 82 H LYS 82 12.442 9.069 -9.792
663 HA LYS 82 HA LYS 82 13.421 6.663 -11.164
664 HB2 LYS 82 1HB LYS 82 14.481 8.004 -12.635
665 HB3 LYS 82 2HB LYS 82 13.381 9.240 -12.041
666 HG2 LYS 82 1HG LYS 82 16.154 8.749 -10.975
667 HG3 LYS 82 2HG LYS 82 15.721 9.996 -12.147
668 HD2 LYS 82 1HD LYS 82 14.696 9.753 -9.319
669 HD3 LYS 82 2HD LYS 82 15.843 10.951 -9.921
670 HE2 LYS 82 1HE LYS 82 13.669 11.171 -11.628
671 HE3 LYS 82 2HE LYS 82 12.943 10.924 -10.040
672 HZ1 LYS 82 1HZ LYS 82 14.556 12.732 -9.283
673 HZ2 LYS 82 2HZ LYS 82 13.212 13.210 -10.192
674 HZ3 LYS 82 3HZ LYS 82 14.732 13.099 -10.926
675 H ASN 83 H ASN 83 13.577 8.067 -8.207
676 HA ASN 83 HA ASN 83 16.399 7.439 -7.746
677 HB2 ASN 83 1HB ASN 83 16.192 9.360 -6.578
678 HB3 ASN 83 2HB ASN 83 14.437 9.233 -6.505
679 HD21 ASN 83 2HD2 ASN 83 14.088 9.635 -4.404
680 HD22 ASN 83 1HD2 ASN 83 14.713 8.682 -3.105
681 H LEU 84 H LEU 84 13.266 6.842 -6.144
682 HA LEU 84 HA LEU 84 14.184 4.814 -4.441
683 HB2 LEU 84 1HB LEU 84 11.646 5.966 -5.215
684 HB3 LEU 84 2HB LEU 84 11.516 4.225 -4.977
685 HG LEU 84 HG LEU 84 10.960 5.645 -2.980
686 HD11 LEU 84 1HD1 LEU 84 11.326 3.445 -2.425
687 HD12 LEU 84 2HD1 LEU 84 12.564 4.253 -1.464
688 HD13 LEU 84 3HD1 LEU 84 12.999 3.468 -2.983
689 HD21 LEU 84 1HD2 LEU 84 13.834 5.961 -2.389
690 HD22 LEU 84 2HD2 LEU 84 12.465 6.990 -1.966
691 HD23 LEU 84 3HD2 LEU 84 13.156 7.064 -3.587
692 H VAL 85 H VAL 85 14.932 2.868 -4.921
693 HA VAL 85 HA VAL 85 14.479 1.707 -7.530
694 HB VAL 85 HB VAL 85 16.169 0.935 -5.172
695 HG11 VAL 85 1HG1 VAL 85 15.231 -1.150 -5.942
696 HG12 VAL 85 2HG1 VAL 85 15.618 -0.746 -7.615
697 HG13 VAL 85 3HG1 VAL 85 16.914 -1.044 -6.456
698 HG21 VAL 85 1HG2 VAL 85 17.131 2.582 -6.611
699 HG22 VAL 85 2HG2 VAL 85 17.955 1.054 -6.920
700 HG23 VAL 85 3HG2 VAL 85 16.732 1.640 -8.047
701 H THR 86 H THR 86 13.521 -0.305 -7.937
702 HA THR 86 HA THR 86 11.847 -1.383 -5.767
703 HB THR 86 HB THR 86 10.133 -1.906 -7.575
704 HG1 THR 86 1HG THR 86 10.526 -1.217 -9.535
705 HG21 THR 86 1HG2 THR 86 9.486 -0.246 -6.073
706 HG22 THR 86 2HG2 THR 86 9.356 0.564 -7.634
707 HG23 THR 86 3HG2 THR 86 10.754 0.860 -6.600
708 H LEU 87 H LEU 87 12.288 -3.445 -5.386
709 HA LEU 87 HA LEU 87 13.401 -5.075 -7.572
710 HB2 LEU 87 1HB LEU 87 14.282 -6.512 -5.696
711 HB3 LEU 87 2HB LEU 87 15.019 -4.921 -5.875
712 HG LEU 87 HG LEU 87 12.790 -5.028 -3.966
713 HD11 LEU 87 1HD1 LEU 87 13.832 -6.266 -2.282
714 HD12 LEU 87 2HD1 LEU 87 15.374 -6.303 -3.135
715 HD13 LEU 87 3HD1 LEU 87 14.016 -7.260 -3.727
716 HD21 LEU 87 1HD2 LEU 87 15.538 -3.844 -4.129
717 HD22 LEU 87 2HD2 LEU 87 14.646 -3.865 -2.607
718 HD23 LEU 87 3HD2 LEU 87 13.979 -3.029 -4.010
719 H ALA 88 H ALA 88 10.622 -4.704 -7.328
720 HA ALA 88 HA ALA 88 9.810 -7.471 -6.838
721 HB1 ALA 88 1HB ALA 88 8.561 -5.053 -5.569
722 HB2 ALA 88 2HB ALA 88 7.678 -6.567 -5.776
723 HB3 ALA 88 3HB ALA 88 9.144 -6.528 -4.796
724 H THR 89 H THR 89 7.520 -7.833 -7.675
725 HA THR 89 HA THR 89 7.330 -6.562 -10.301
726 HB THR 89 HB THR 89 5.536 -8.418 -10.614
727 HG1 THR 89 1HG THR 89 5.322 -9.165 -8.535
728 HG21 THR 89 1HG2 THR 89 7.182 -9.917 -11.418
729 HG22 THR 89 2HG2 THR 89 8.374 -9.355 -10.245
730 HG23 THR 89 3HG2 THR 89 7.885 -8.307 -11.576
731 H1 SER 115 H SER 115 3.159 17.987 19.019
732 HA SER 115 HA SER 115 3.130 16.166 17.281
733 HB2 SER 115 1HB SER 115 0.573 15.881 18.303
734 HB3 SER 115 2HB SER 115 0.297 16.628 16.730
735 HG SER 115 HG SER 115 0.411 14.274 16.749
736 H GLN 116 H GLN 116 3.442 16.842 15.204
737 HA GLN 116 HA GLN 116 3.582 18.235 13.407
738 HB2 GLN 116 1HB GLN 116 1.004 18.715 14.451
739 HB3 GLN 116 2HB GLN 116 1.702 20.293 14.112
740 HG2 GLN 116 1HG GLN 116 2.149 18.392 11.964
741 HG3 GLN 116 2HG GLN 116 0.439 18.644 12.310
742 HE21 GLN 116 2HE2 GLN 116 3.197 20.852 12.493
743 HE22 GLN 116 1HE2 GLN 116 2.567 22.011 11.378
744 H GLU 117 H GLU 117 5.251 19.554 13.154
745 HA GLU 117 HA GLU 117 5.590 22.113 13.906
746 HB2 GLU 117 1HB GLU 117 5.917 20.357 16.223
747 HB3 GLU 117 2HB GLU 117 7.295 21.415 15.959
748 HG2 GLU 117 1HG GLU 117 6.150 23.276 16.503
749 HG3 GLU 117 2HG GLU 117 4.644 22.687 15.800
750 H THR 118 H THR 118 7.995 19.815 15.050
751 HA THR 118 HA THR 118 9.944 20.836 13.209
752 HB THR 118 HB THR 118 10.198 18.438 15.032
753 HG1 THR 118 1HG THR 118 11.412 20.698 15.900
754 HG21 THR 118 1HG2 THR 118 12.633 19.120 14.940
755 HG22 THR 118 2HG2 THR 118 12.196 20.182 13.601
756 HG23 THR 118 3HG2 THR 118 11.972 18.439 13.454
757 H PHE 119 H PHE 119 11.293 19.354 11.869
758 HA PHE 119 HA PHE 119 9.927 18.203 9.819
759 HB2 PHE 119 1HB PHE 119 12.587 18.486 10.464
760 HB3 PHE 119 2HB PHE 119 12.393 16.736 10.421
761 HD1 PHE 119 HD2 PHE 119 10.028 17.184 8.280
762 HD2 PHE 119 HD1 PHE 119 14.144 18.231 8.551
763 HE1 PHE 119 HE2 PHE 119 10.174 17.229 5.825
764 HE2 PHE 119 HE1 PHE 119 14.297 18.278 6.096
765 HZ PHE 119 HZ PHE 119 12.311 17.776 4.729
766 H SER 120 H SER 120 11.257 16.454 12.621
767 HA SER 120 HA SER 120 10.371 13.906 11.930
768 HB2 SER 120 1HB SER 120 11.699 15.053 14.096
769 HB3 SER 120 2HB SER 120 10.235 14.366 14.798
770 HG SER 120 HG SER 120 12.245 12.991 14.481
771 H ASP 121 H ASP 121 8.636 16.622 13.184
772 HA ASP 121 HA ASP 121 6.384 15.165 14.173
773 HB2 ASP 121 1HB ASP 121 6.496 18.070 13.339
774 HB3 ASP 121 2HB ASP 121 5.316 17.320 14.411
775 H LEU 122 H LEU 122 6.896 17.160 11.262
776 HA LEU 122 HA LEU 122 4.418 16.231 10.100
777 HB2 LEU 122 1HB LEU 122 5.588 17.541 8.081
778 HB3 LEU 122 2HB LEU 122 4.681 18.341 9.363
779 HG LEU 122 HG LEU 122 7.633 17.975 9.653
780 HD11 LEU 122 1HD1 LEU 122 7.040 20.552 8.581
781 HD12 LEU 122 2HD1 LEU 122 6.466 19.313 7.465
782 HD13 LEU 122 3HD1 LEU 122 8.154 19.325 7.977
783 HD21 LEU 122 1HD2 LEU 122 5.978 20.337 10.451
784 HD22 LEU 122 2HD2 LEU 122 7.482 19.738 11.150
785 HD23 LEU 122 3HD2 LEU 122 5.973 18.867 11.426
786 H TRP 123 H TRP 123 7.866 16.037 9.216
787 HA TRP 123 HA TRP 123 7.879 14.566 6.983
788 HB2 TRP 123 1HB TRP 123 9.857 15.227 8.484
789 HB3 TRP 123 2HB TRP 123 9.596 13.685 9.296
790 HD1 TRP 123 HD1 TRP 123 11.182 11.894 8.423
791 HE1 TRP 123 HE1 TRP 123 12.275 11.325 6.163
792 HE3 TRP 123 HE3 TRP 123 9.224 15.678 5.597
793 HZ2 TRP 123 HZ2 TRP 123 12.305 12.345 3.532
794 HZ3 TRP 123 HZ3 TRP 123 9.835 15.810 3.217
795 HH2 TRP 123 HH2 TRP 123 11.344 14.178 2.208
796 H LYS 124 H LYS 124 7.713 13.034 10.203
797 HA LYS 124 HA LYS 124 7.282 10.427 9.325
798 HB2 LYS 124 1HB LYS 124 7.348 11.783 11.798
799 HB3 LYS 124 2HB LYS 124 5.819 10.916 11.755
800 HG2 LYS 124 1HG LYS 124 6.872 8.837 11.550
801 HG3 LYS 124 2HG LYS 124 8.412 9.566 11.089
802 HD2 LYS 124 1HD LYS 124 8.732 8.919 13.313
803 HD3 LYS 124 2HD LYS 124 8.375 10.644 13.417
804 HE2 LYS 124 1HE LYS 124 5.887 9.428 13.535
805 HE3 LYS 124 2HE LYS 124 6.924 8.373 14.494
806 HZ1 LYS 124 1HZ LYS 124 6.821 11.309 14.880
807 HZ2 LYS 124 2HZ LYS 124 7.509 10.154 15.905
808 HZ3 LYS 124 3HZ LYS 124 5.828 10.237 15.732
809 H LEU 125 H LEU 125 5.005 13.056 9.860
810 HA LEU 125 HA LEU 125 2.623 11.591 9.685
811 HB2 LEU 125 1HB LEU 125 3.398 14.314 9.823
812 HB3 LEU 125 2HB LEU 125 2.272 14.147 8.477
813 HG LEU 125 HG LEU 125 0.873 12.835 10.323
814 HD11 LEU 125 1HD1 LEU 125 1.583 14.844 12.227
815 HD12 LEU 125 2HD1 LEU 125 3.007 13.886 11.825
816 HD13 LEU 125 3HD1 LEU 125 1.549 13.091 12.417
817 HD21 LEU 125 1HD2 LEU 125 -0.539 14.577 10.165
818 HD22 LEU 125 2HD2 LEU 125 0.641 15.193 9.007
819 HD23 LEU 125 3HD2 LEU 125 0.678 15.744 10.682
820 H LEU 126 H LEU 126 4.968 12.207 7.333
821 HA LEU 126 HA LEU 126 3.853 12.633 4.949
822 HB2 LEU 126 1HB LEU 126 6.006 10.890 5.881
823 HB3 LEU 126 2HB LEU 126 5.310 10.391 4.340
824 HG LEU 126 HG LEU 126 7.376 11.972 4.391
825 HD11 LEU 126 1HD1 LEU 126 6.673 12.963 2.296
826 HD12 LEU 126 2HD1 LEU 126 4.987 12.598 2.662
827 HD13 LEU 126 3HD1 LEU 126 6.133 11.287 2.387
828 HD21 LEU 126 1HD2 LEU 126 5.725 13.536 5.882
829 HD22 LEU 126 2HD2 LEU 126 5.496 14.220 4.272
830 HD23 LEU 126 3HD2 LEU 126 7.114 14.124 4.968
831 HA PRO 127 HA PRO 127 0.490 9.589 5.140
832 HB2 PRO 127 1HB PRO 127 -1.056 10.881 3.319
833 HB3 PRO 127 2HB PRO 127 -0.996 11.338 5.025
834 HG2 PRO 127 1HG PRO 127 0.419 12.559 2.687
835 HG3 PRO 127 2HG PRO 127 -0.397 13.359 4.043
836 HD2 PRO 127 1HD PRO 127 2.292 13.065 3.929
837 HD3 PRO 127 2HD PRO 127 1.395 13.060 5.461
838 H GLU 128 H GLU 128 2.778 10.378 2.839
839 HA GLU 128 HA GLU 128 3.535 9.352 0.955
840 HB2 GLU 128 1HB GLU 128 1.613 7.189 1.828
841 HB3 GLU 128 2HB GLU 128 2.787 7.013 0.532
842 HG2 GLU 128 1HG GLU 128 3.845 7.901 3.136
843 HG3 GLU 128 2HG GLU 128 3.237 6.249 3.056
844 H ASN 129 H ASN 129 0.195 8.141 0.894
845 HA ASN 129 HA ASN 129 -0.123 9.345 -1.757
846 HB2 ASN 129 1HB ASN 129 -0.820 6.846 -0.726
847 HB3 ASN 129 2HB ASN 129 -2.350 7.708 -0.863
848 HD21 ASN 129 2HD2 ASN 129 -1.875 5.499 -2.378
849 HD22 ASN 129 1HD2 ASN 129 -1.691 5.949 -4.036
Start of MODEL 15
1 H1 GLN 1 H GLN 1 1.406 0.407 2.309
2 HA GLN 1 HA GLN 1 0.992 -0.498 -0.243
3 HB2 GLN 1 1HB GLN 1 1.852 1.847 -1.317
4 HB3 GLN 1 2HB GLN 1 0.175 1.315 -1.304
5 HG2 GLN 1 1HG GLN 1 1.342 2.971 0.907
6 HG3 GLN 1 2HG GLN 1 0.654 3.689 -0.548
7 HE21 GLN 1 2HE2 GLN 1 -0.064 3.349 2.472
8 HE22 GLN 1 1HE2 GLN 1 -1.755 3.001 2.413
9 H ILE 2 H ILE 2 3.112 2.257 0.393
10 HA ILE 2 HA ILE 2 5.396 2.397 0.116
11 HB ILE 2 HB ILE 2 6.574 1.513 1.936
12 HG12 ILE 2 1HG1 ILE 2 4.743 -0.475 2.967
13 HG13 ILE 2 2HG1 ILE 2 5.220 -0.866 1.319
14 HG21 ILE 2 1HG2 ILE 2 4.830 1.560 3.848
15 HG22 ILE 2 2HG2 ILE 2 5.068 3.006 2.868
16 HG23 ILE 2 3HG2 ILE 2 3.684 1.956 2.567
17 HD11 ILE 2 1HD1 ILE 2 6.825 -1.939 2.562
18 HD12 ILE 2 2HD1 ILE 2 7.621 -0.410 2.190
19 HD13 ILE 2 3HD1 ILE 2 6.892 -0.661 3.776
20 H ASN 3 H ASN 3 7.408 0.483 0.477
21 HA ASN 3 HA ASN 3 7.204 -1.921 -0.828
22 HB2 ASN 3 1HB ASN 3 6.758 0.181 -2.660
23 HB3 ASN 3 2HB ASN 3 8.368 -0.443 -3.005
24 HD21 ASN 3 2HD2 ASN 3 5.255 -1.850 -2.032
25 HD22 ASN 3 1HD2 ASN 3 5.224 -3.056 -3.269
26 H GLN 4 H GLN 4 9.448 -2.279 -2.214
27 HA GLN 4 HA GLN 4 11.531 -1.493 -0.305
28 HB2 GLN 4 1HB GLN 4 11.863 -3.589 -2.429
29 HB3 GLN 4 2HB GLN 4 12.707 -3.432 -0.893
30 HG2 GLN 4 1HG GLN 4 9.955 -4.467 -1.434
31 HG3 GLN 4 2HG GLN 4 11.286 -5.234 -0.567
32 HE21 GLN 4 2HE2 GLN 4 8.474 -3.384 -0.312
33 HE22 GLN 4 1HE2 GLN 4 8.571 -3.016 1.373
34 H VAL 5 H VAL 5 13.790 -1.359 -1.356
35 HA VAL 5 HA VAL 5 13.885 -0.324 -4.039
36 HB VAL 5 HB VAL 5 14.645 1.907 -3.517
37 HG11 VAL 5 1HG1 VAL 5 12.220 1.511 -3.775
38 HG12 VAL 5 2HG1 VAL 5 12.084 1.355 -2.022
39 HG13 VAL 5 3HG1 VAL 5 12.582 2.889 -2.737
40 HG21 VAL 5 1HG2 VAL 5 13.906 1.969 -0.708
41 HG22 VAL 5 2HG2 VAL 5 15.252 0.875 -1.026
42 HG23 VAL 5 3HG2 VAL 5 15.359 2.568 -1.507
43 H ARG 6 H ARG 6 16.164 0.599 -4.474
44 HA ARG 6 HA ARG 6 18.196 -0.680 -2.800
45 HB2 ARG 6 1HB ARG 6 17.320 -1.822 -5.182
46 HB3 ARG 6 2HB ARG 6 18.803 -0.988 -5.627
47 HG2 ARG 6 1HG ARG 6 20.105 -2.276 -4.195
48 HG3 ARG 6 2HG ARG 6 18.712 -2.791 -3.241
49 HD2 ARG 6 1HD ARG 6 17.954 -4.230 -4.971
50 HD3 ARG 6 2HD ARG 6 19.095 -3.547 -6.128
51 HE ARG 6 HE ARG 6 19.603 -5.631 -4.254
52 HH11 ARG 6 1HH1 ARG 6 21.069 -2.940 -5.907
53 HH12 ARG 6 2HH1 ARG 6 22.670 -3.596 -5.829
54 HH21 ARG 6 1HH2 ARG 6 21.707 -6.505 -4.145
55 HH22 ARG 6 2HH2 ARG 6 23.032 -5.625 -4.827
56 HA PRO 7 HA PRO 7 19.600 3.530 -3.747
57 HB2 PRO 7 1HB PRO 7 21.237 3.690 -1.587
58 HB3 PRO 7 2HB PRO 7 19.496 3.984 -1.497
59 HG2 PRO 7 1HG PRO 7 21.040 1.517 -0.794
60 HG3 PRO 7 2HG PRO 7 19.703 2.288 0.080
61 HD2 PRO 7 1HD PRO 7 19.352 0.114 -1.496
62 HD3 PRO 7 2HD PRO 7 18.103 1.359 -1.295
63 H LYS 8 H LYS 8 20.956 3.458 -5.449
64 HA LYS 8 HA LYS 8 23.191 1.707 -5.630
65 HB2 LYS 8 1HB LYS 8 21.786 2.897 -7.501
66 HB3 LYS 8 2HB LYS 8 22.960 4.190 -7.288
67 HG2 LYS 8 1HG LYS 8 24.467 3.107 -8.497
68 HG3 LYS 8 2HG LYS 8 24.292 1.652 -7.514
69 HD2 LYS 8 1HD LYS 8 22.185 1.180 -8.849
70 HD3 LYS 8 2HD LYS 8 22.712 2.459 -9.945
71 HE2 LYS 8 1HE LYS 8 24.179 1.108 -10.935
72 HE3 LYS 8 2HE LYS 8 24.860 0.612 -9.387
73 HZ1 LYS 8 1HZ LYS 8 23.822 -1.186 -10.800
74 HZ2 LYS 8 2HZ LYS 8 22.322 -0.506 -10.418
75 HZ3 LYS 8 3HZ LYS 8 23.311 -1.116 -9.188
76 H LEU 9 H LEU 9 25.347 2.958 -6.456
77 HA LEU 9 HA LEU 9 26.737 3.755 -4.259
78 HB2 LEU 9 1HB LEU 9 27.756 5.305 -6.390
79 HB3 LEU 9 2HB LEU 9 28.366 3.779 -5.754
80 HG LEU 9 HG LEU 9 26.200 3.867 -7.833
81 HD11 LEU 9 1HD1 LEU 9 27.795 3.777 -9.567
82 HD12 LEU 9 2HD1 LEU 9 29.134 3.607 -8.433
83 HD13 LEU 9 3HD1 LEU 9 28.266 5.138 -8.549
84 HD21 LEU 9 1HD2 LEU 9 27.082 1.814 -6.342
85 HD22 LEU 9 2HD2 LEU 9 28.224 1.724 -7.683
86 HD23 LEU 9 3HD2 LEU 9 26.490 1.633 -7.994
87 HA PRO 10 HA PRO 10 25.847 8.420 -5.142
88 HB2 PRO 10 1HB PRO 10 23.957 8.999 -7.003
89 HB3 PRO 10 2HB PRO 10 25.668 8.801 -7.401
90 HG2 PRO 10 1HG PRO 10 23.418 6.846 -7.685
91 HG3 PRO 10 2HG PRO 10 24.735 7.208 -8.816
92 HD2 PRO 10 1HD PRO 10 24.763 5.041 -7.193
93 HD3 PRO 10 2HD PRO 10 26.245 5.891 -7.676
94 H LEU 11 H LEU 11 23.678 5.938 -4.612
95 HA LEU 11 HA LEU 11 21.678 7.756 -3.443
96 HB2 LEU 11 1HB LEU 11 21.480 5.245 -4.916
97 HB3 LEU 11 2HB LEU 11 20.542 5.255 -3.424
98 HG LEU 11 HG LEU 11 19.322 7.221 -4.187
99 HD11 LEU 11 1HD1 LEU 11 20.034 8.543 -5.820
100 HD12 LEU 11 2HD1 LEU 11 20.136 7.191 -6.947
101 HD13 LEU 11 3HD1 LEU 11 21.501 7.566 -5.895
102 HD21 LEU 11 1HD2 LEU 11 18.506 6.031 -6.455
103 HD22 LEU 11 2HD2 LEU 11 18.050 5.477 -4.844
104 HD23 LEU 11 3HD2 LEU 11 19.376 4.693 -5.705
105 H LEU 12 H LEU 12 24.094 5.459 -2.759
106 HA LEU 12 HA LEU 12 23.053 4.567 -0.238
107 HB2 LEU 12 1HB LEU 12 24.682 3.319 -1.717
108 HB3 LEU 12 2HB LEU 12 25.913 4.451 -1.162
109 HG LEU 12 HG LEU 12 26.027 3.516 0.927
110 HD11 LEU 12 1HD1 LEU 12 23.218 2.511 0.512
111 HD12 LEU 12 2HD1 LEU 12 23.743 3.808 1.585
112 HD13 LEU 12 3HD1 LEU 12 24.212 2.142 1.922
113 HD21 LEU 12 1HD2 LEU 12 25.295 1.389 -1.046
114 HD22 LEU 12 2HD2 LEU 12 25.668 0.969 0.626
115 HD23 LEU 12 3HD2 LEU 12 26.872 1.791 -0.368
116 H LYS 13 H LYS 13 25.633 6.805 -1.230
117 HA LYS 13 HA LYS 13 26.474 7.601 1.297
118 HB2 LYS 13 1HB LYS 13 27.027 9.815 0.042
119 HB3 LYS 13 2HB LYS 13 27.852 8.331 -0.418
120 HG2 LYS 13 1HG LYS 13 27.093 8.487 -2.491
121 HG3 LYS 13 2HG LYS 13 25.426 8.613 -1.924
122 HD2 LYS 13 1HD LYS 13 25.383 10.844 -2.185
123 HD3 LYS 13 2HD LYS 13 27.013 11.046 -1.538
124 HE2 LYS 13 1HE LYS 13 27.701 9.954 -3.829
125 HE3 LYS 13 2HE LYS 13 26.121 10.547 -4.339
126 HZ1 LYS 13 1HZ LYS 13 28.438 11.985 -4.278
127 HZ2 LYS 13 2HZ LYS 13 27.609 12.522 -2.906
128 HZ3 LYS 13 3HZ LYS 13 26.878 12.620 -4.428
129 H ILE 14 H ILE 14 23.693 8.594 -0.578
130 HA ILE 14 HA ILE 14 23.001 10.932 0.782
131 HB ILE 14 HB ILE 14 21.043 8.931 -0.342
132 HG12 ILE 14 1HG1 ILE 14 22.831 10.934 -1.682
133 HG13 ILE 14 2HG1 ILE 14 22.486 9.272 -2.146
134 HG21 ILE 14 1HG2 ILE 14 20.894 11.910 0.094
135 HG22 ILE 14 2HG2 ILE 14 19.682 10.956 -0.761
136 HG23 ILE 14 3HG2 ILE 14 19.985 10.666 0.952
137 HD11 ILE 14 1HD1 ILE 14 21.359 10.491 -3.740
138 HD12 ILE 14 2HD1 ILE 14 20.090 10.152 -2.563
139 HD13 ILE 14 3HD1 ILE 14 20.866 11.735 -2.592
140 H LEU 15 H LEU 15 21.799 7.619 1.336
141 HA LEU 15 HA LEU 15 20.399 8.320 3.713
142 HB2 LEU 15 1HB LEU 15 21.317 5.557 2.974
143 HB3 LEU 15 2HB LEU 15 19.916 6.020 3.939
144 HG LEU 15 HG LEU 15 20.262 6.182 0.957
145 HD11 LEU 15 1HD1 LEU 15 19.454 4.082 1.505
146 HD12 LEU 15 2HD1 LEU 15 17.979 4.997 1.195
147 HD13 LEU 15 3HD1 LEU 15 18.493 4.691 2.853
148 HD21 LEU 15 1HD2 LEU 15 17.810 7.117 1.222
149 HD22 LEU 15 2HD2 LEU 15 19.209 8.191 1.223
150 HD23 LEU 15 3HD2 LEU 15 18.456 7.721 2.748
151 H HIS 16 H HIS 16 23.562 6.908 3.040
152 HA HIS 16 HA HIS 16 24.274 6.200 5.649
153 HB2 HIS 16 1HB HIS 16 25.789 6.850 3.160
154 HB3 HIS 16 2HB HIS 16 26.677 6.750 4.677
155 HD1 HIS 16 HD1 HIS 16 27.878 4.577 4.426
156 HD2 HIS 16 HD2 HIS 16 23.834 4.259 3.531
157 HE1 HIS 16 HE1 HIS 16 27.453 2.120 4.100
158 H ALA 17 H ALA 17 24.898 9.218 3.870
159 HA ALA 17 HA ALA 17 26.233 10.545 5.961
160 HB1 ALA 17 1HB ALA 17 24.853 11.440 3.468
161 HB2 ALA 17 2HB ALA 17 25.402 12.632 4.647
162 HB3 ALA 17 3HB ALA 17 26.560 11.531 3.901
163 H ALA 18 H ALA 18 22.852 10.063 5.277
164 HA ALA 18 HA ALA 18 21.967 12.078 7.154
165 HB1 ALA 18 1HB ALA 18 19.782 10.489 6.593
166 HB2 ALA 18 2HB ALA 18 20.238 11.971 5.751
167 HB3 ALA 18 3HB ALA 18 20.746 10.404 5.118
168 H GLY 19 H GLY 19 23.277 9.073 7.501
169 HA2 GLY 19 1HA GLY 19 23.579 8.187 9.721
170 HA3 GLY 19 2HA GLY 19 21.955 8.731 10.111
171 H ALA 20 H ALA 20 22.698 7.098 7.116
172 HA ALA 20 HA ALA 20 21.111 4.802 8.054
173 HB1 ALA 20 1HB ALA 20 20.407 6.326 6.042
174 HB2 ALA 20 2HB ALA 20 21.564 5.331 5.156
175 HB3 ALA 20 3HB ALA 20 20.189 4.577 5.965
176 H GLN 21 H GLN 21 21.642 2.786 6.573
177 HA GLN 21 HA GLN 21 24.289 2.417 5.673
178 HB2 GLN 21 1HB GLN 21 24.151 2.447 8.429
179 HB3 GLN 21 2HB GLN 21 24.070 0.731 8.052
180 HG2 GLN 21 1HG GLN 21 26.274 0.743 7.894
181 HG3 GLN 21 2HG GLN 21 26.104 1.717 6.435
182 HE21 GLN 21 2HE2 GLN 21 25.910 4.089 6.810
183 HE22 GLN 21 1HE2 GLN 21 26.892 4.782 8.050
184 H GLY 22 H GLY 22 24.036 0.924 4.157
185 HA2 GLY 22 1HA GLY 22 23.548 -1.626 4.140
186 HA3 GLY 22 2HA GLY 22 21.915 -1.082 4.492
187 H GLU 23 H GLU 23 21.952 -2.522 2.359
188 HA GLU 23 HA GLU 23 22.043 -0.635 0.097
189 HB2 GLU 23 1HB GLU 23 22.375 -3.629 -0.097
190 HB3 GLU 23 2HB GLU 23 22.607 -2.444 -1.376
191 HG2 GLU 23 1HG GLU 23 24.447 -1.482 0.138
192 HG3 GLU 23 2HG GLU 23 24.345 -3.023 0.987
193 H MET 24 H MET 24 19.962 -1.943 2.131
194 HA MET 24 HA MET 24 17.847 -2.095 0.109
195 HB2 MET 24 1HB MET 24 16.818 -3.987 1.422
196 HB3 MET 24 2HB MET 24 18.280 -4.396 0.535
197 HG2 MET 24 1HG MET 24 18.305 -3.659 3.444
198 HG3 MET 24 2HG MET 24 18.076 -5.312 2.878
199 HE1 MET 24 1HE MET 24 21.281 -6.042 0.930
200 HE2 MET 24 2HE MET 24 19.530 -5.949 0.741
201 HE3 MET 24 3HE MET 24 20.553 -4.642 0.141
202 H PHE 25 H PHE 25 16.073 -0.970 0.638
203 HA PHE 25 HA PHE 25 15.315 -0.515 3.379
204 HB2 PHE 25 1HB PHE 25 16.061 1.878 1.689
205 HB3 PHE 25 2HB PHE 25 15.486 1.896 3.353
206 HD1 PHE 25 HD2 PHE 25 18.295 0.787 1.204
207 HD2 PHE 25 HD1 PHE 25 16.983 1.753 5.136
208 HE1 PHE 25 HE2 PHE 25 20.619 0.677 2.003
209 HE2 PHE 25 HE1 PHE 25 19.305 1.646 5.941
210 HZ PHE 25 HZ PHE 25 21.127 1.106 4.374
211 H THR 26 H THR 26 13.190 0.152 3.598
212 HA THR 26 HA THR 26 11.544 -0.222 1.253
213 HB THR 26 HB THR 26 9.785 0.479 3.217
214 HG1 THR 26 1HG THR 26 11.529 0.653 4.737
215 HG21 THR 26 1HG2 THR 26 10.227 -1.696 1.733
216 HG22 THR 26 2HG2 THR 26 9.130 -1.702 3.114
217 HG23 THR 26 3HG2 THR 26 10.773 -2.318 3.289
218 H VAL 27 H VAL 27 9.496 1.312 1.233
219 HA VAL 27 HA VAL 27 10.338 3.798 0.286
220 HB VAL 27 HB VAL 27 7.580 3.075 1.287
221 HG11 VAL 27 1HG1 VAL 27 8.692 5.394 -0.196
222 HG12 VAL 27 2HG1 VAL 27 7.096 4.802 -0.663
223 HG13 VAL 27 3HG1 VAL 27 7.393 5.329 0.994
224 HG21 VAL 27 1HG2 VAL 27 8.519 2.970 -1.562
225 HG22 VAL 27 2HG2 VAL 27 8.660 1.579 -0.487
226 HG23 VAL 27 3HG2 VAL 27 7.072 2.256 -0.849
227 H LYS 28 H LYS 28 9.101 2.847 3.451
228 HA LYS 28 HA LYS 28 8.938 5.488 4.498
229 HB2 LYS 28 1HB LYS 28 8.868 2.734 5.670
230 HB3 LYS 28 2HB LYS 28 9.043 4.121 6.737
231 HG2 LYS 28 1HG LYS 28 6.794 4.012 6.753
232 HG3 LYS 28 2HG LYS 28 6.965 4.959 5.273
233 HD2 LYS 28 1HD LYS 28 5.401 3.045 5.046
234 HD3 LYS 28 2HD LYS 28 6.760 2.976 3.921
235 HE2 LYS 28 1HE LYS 28 6.026 0.848 5.260
236 HE3 LYS 28 2HE LYS 28 7.734 1.197 4.994
237 HZ1 LYS 28 1HZ LYS 28 6.881 0.595 7.354
238 HZ2 LYS 28 2HZ LYS 28 6.418 2.220 7.414
239 HZ3 LYS 28 3HZ LYS 28 8.041 1.812 7.167
240 H GLU 29 H GLU 29 11.360 2.905 4.746
241 HA GLU 29 HA GLU 29 13.122 4.241 6.474
242 HB2 GLU 29 1HB GLU 29 13.359 1.969 4.558
243 HB3 GLU 29 2HB GLU 29 14.840 2.691 5.172
244 HG2 GLU 29 1HG GLU 29 12.621 1.623 6.900
245 HG3 GLU 29 2HG GLU 29 14.074 0.726 6.460
246 H VAL 30 H VAL 30 12.831 4.250 2.959
247 HA VAL 30 HA VAL 30 15.195 5.739 2.455
248 HB VAL 30 HB VAL 30 12.751 5.662 0.690
249 HG11 VAL 30 1HG1 VAL 30 15.412 5.562 -0.507
250 HG12 VAL 30 2HG1 VAL 30 14.026 6.580 -0.904
251 HG13 VAL 30 3HG1 VAL 30 15.107 7.034 0.415
252 HG21 VAL 30 1HG2 VAL 30 13.063 3.505 0.244
253 HG22 VAL 30 2HG2 VAL 30 14.792 3.746 -0.008
254 HG23 VAL 30 3HG2 VAL 30 14.171 3.446 1.615
255 H MET 31 H MET 31 11.765 6.668 2.649
256 HA MET 31 HA MET 31 12.178 9.417 2.176
257 HB2 MET 31 1HB MET 31 9.960 9.196 1.992
258 HB3 MET 31 2HB MET 31 9.972 7.686 2.894
259 HG2 MET 31 1HG MET 31 9.656 8.758 4.934
260 HG3 MET 31 2HG MET 31 10.167 10.319 4.298
261 HE1 MET 31 1HE MET 31 7.129 11.415 2.137
262 HE2 MET 31 2HE MET 31 8.723 11.844 2.760
263 HE3 MET 31 3HE MET 31 8.559 10.551 1.571
264 H HIS 32 H HIS 32 11.918 7.538 5.171
265 HA HIS 32 HA HIS 32 11.928 9.563 7.037
266 HB2 HIS 32 1HB HIS 32 11.840 6.979 7.337
267 HB3 HIS 32 2HB HIS 32 13.592 7.100 7.468
268 HD1 HIS 32 HD1 HIS 32 10.795 6.902 9.561
269 HD2 HIS 32 HD2 HIS 32 14.174 9.319 9.541
270 HE1 HIS 32 HE1 HIS 32 11.007 7.780 11.908
271 H TYR 33 H TYR 33 14.627 8.245 5.208
272 HA TYR 33 HA TYR 33 16.635 9.680 6.657
273 HB2 TYR 33 1HB TYR 33 16.681 8.247 3.998
274 HB3 TYR 33 2HB TYR 33 18.100 9.000 4.718
275 HD1 TYR 33 HD2 TYR 33 18.069 8.292 7.471
276 HD2 TYR 33 HD1 TYR 33 16.832 5.953 4.139
277 HE1 TYR 33 HE2 TYR 33 18.511 6.241 8.754
278 HE2 TYR 33 HE1 TYR 33 17.269 3.895 5.414
279 HH TYR 33 HH TYR 33 19.091 3.565 7.805
280 H LEU 34 H LEU 34 14.764 10.237 3.736
281 HA LEU 34 HA LEU 34 16.149 12.305 2.562
282 HB2 LEU 34 1HB LEU 34 13.492 11.244 2.466
283 HB3 LEU 34 2HB LEU 34 13.422 13.004 2.423
284 HG LEU 34 HG LEU 34 13.417 12.156 0.176
285 HD11 LEU 34 1HD1 LEU 34 15.318 13.332 -0.739
286 HD12 LEU 34 2HD1 LEU 34 16.142 13.274 0.819
287 HD13 LEU 34 3HD1 LEU 34 14.670 14.228 0.636
288 HD21 LEU 34 1HD2 LEU 34 15.866 10.645 1.049
289 HD22 LEU 34 2HD2 LEU 34 15.467 10.918 -0.647
290 HD23 LEU 34 3HD2 LEU 34 14.364 10.004 0.383
291 H GLY 35 H GLY 35 13.531 12.649 4.968
292 HA2 GLY 35 1HA GLY 35 13.630 15.394 5.293
293 HA3 GLY 35 2HA GLY 35 13.156 14.266 6.555
294 H GLN 36 H GLN 36 15.457 12.948 7.125
295 HA GLN 36 HA GLN 36 16.809 14.744 8.797
296 HB2 GLN 36 1HB GLN 36 17.711 12.882 9.656
297 HB3 GLN 36 2HB GLN 36 16.707 12.003 8.511
298 HG2 GLN 36 1HG GLN 36 18.878 11.139 8.274
299 HG3 GLN 36 2HG GLN 36 18.615 12.183 6.878
300 HE21 GLN 36 2HE2 GLN 36 20.006 12.159 10.127
301 HE22 GLN 36 1HE2 GLN 36 21.288 13.263 9.779
302 H TYR 37 H TYR 37 17.566 13.537 5.577
303 HA TYR 37 HA TYR 37 20.196 14.528 5.411
304 HB2 TYR 37 1HB TYR 37 19.230 12.861 3.849
305 HB3 TYR 37 2HB TYR 37 18.214 14.122 3.160
306 HD1 TYR 37 HD2 TYR 37 21.789 13.256 3.761
307 HD2 TYR 37 HD1 TYR 37 18.989 15.371 1.355
308 HE1 TYR 37 HE2 TYR 37 23.588 13.833 2.186
309 HE2 TYR 37 HE1 TYR 37 20.779 15.953 -0.227
310 HH TYR 37 HH TYR 37 23.941 14.542 -0.024
311 H ILE 38 H ILE 38 17.082 15.945 4.478
312 HA ILE 38 HA ILE 38 18.080 18.304 3.334
313 HB ILE 38 HB ILE 38 15.451 17.932 4.774
314 HG12 ILE 38 1HG1 ILE 38 16.133 17.598 1.845
315 HG13 ILE 38 2HG1 ILE 38 15.806 16.284 2.969
316 HG21 ILE 38 1HG2 ILE 38 16.162 20.287 4.359
317 HG22 ILE 38 2HG2 ILE 38 16.175 19.924 2.634
318 HG23 ILE 38 3HG2 ILE 38 14.667 19.828 3.544
319 HD11 ILE 38 1HD1 ILE 38 13.917 16.956 1.447
320 HD12 ILE 38 2HD1 ILE 38 13.540 16.896 3.169
321 HD13 ILE 38 3HD1 ILE 38 13.813 18.449 2.380
322 H MET 39 H MET 39 17.072 17.584 6.661
323 HA MET 39 HA MET 39 17.561 20.203 7.648
324 HB2 MET 39 1HB MET 39 16.542 19.389 9.459
325 HB3 MET 39 2HB MET 39 16.436 17.837 8.639
326 HG2 MET 39 1HG MET 39 18.523 17.131 9.614
327 HG3 MET 39 2HG MET 39 18.751 18.717 10.347
328 HE1 MET 39 1HE MET 39 15.099 18.641 11.118
329 HE2 MET 39 2HE MET 39 15.684 18.859 12.768
330 HE3 MET 39 3HE MET 39 16.456 19.721 11.436
331 H VAL 40 H VAL 40 19.535 17.364 7.201
332 HA VAL 40 HA VAL 40 21.685 18.175 8.886
333 HB VAL 40 HB VAL 40 21.050 15.864 7.492
334 HG11 VAL 40 1HG1 VAL 40 23.609 17.007 6.376
335 HG12 VAL 40 2HG1 VAL 40 22.983 15.381 6.094
336 HG13 VAL 40 3HG1 VAL 40 22.107 16.784 5.479
337 HG21 VAL 40 1HG2 VAL 40 23.027 14.941 8.574
338 HG22 VAL 40 2HG2 VAL 40 23.648 16.567 8.858
339 HG23 VAL 40 3HG2 VAL 40 22.174 16.033 9.665
340 H LYS 41 H LYS 41 20.963 18.547 5.452
341 HA LYS 41 HA LYS 41 23.481 19.909 4.962
342 HB2 LYS 41 1HB LYS 41 21.276 18.828 3.307
343 HB3 LYS 41 2HB LYS 41 22.103 20.240 2.663
344 HG2 LYS 41 1HG LYS 41 23.361 17.614 3.426
345 HG3 LYS 41 2HG LYS 41 23.110 18.235 1.793
346 HD2 LYS 41 1HD LYS 41 25.234 18.955 2.004
347 HD3 LYS 41 2HD LYS 41 24.495 20.279 2.908
348 HE2 LYS 41 1HE LYS 41 25.570 19.667 4.753
349 HE3 LYS 41 2HE LYS 41 24.889 18.044 4.649
350 HZ1 LYS 41 1HZ LYS 41 26.699 17.535 3.029
351 HZ2 LYS 41 2HZ LYS 41 27.231 17.833 4.607
352 HZ3 LYS 41 3HZ LYS 41 27.401 19.024 3.418
353 H GLN 42 H GLN 42 20.314 20.703 5.913
354 HA GLN 42 HA GLN 42 19.365 22.705 6.457
355 HB2 GLN 42 1HB GLN 42 22.157 23.309 6.285
356 HB3 GLN 42 2HB GLN 42 21.246 24.638 5.581
357 HG2 GLN 42 1HG GLN 42 21.041 25.390 7.660
358 HG3 GLN 42 2HG GLN 42 19.848 24.111 7.875
359 HE21 GLN 42 2HE2 GLN 42 21.656 21.933 7.796
360 HE22 GLN 42 1HE2 GLN 42 22.586 21.968 9.251
361 H LEU 43 H LEU 43 18.345 21.736 4.316
362 HA LEU 43 HA LEU 43 18.270 23.956 2.384
363 HB2 LEU 43 1HB LEU 43 17.936 21.050 1.675
364 HB3 LEU 43 2HB LEU 43 18.012 22.419 0.568
365 HG LEU 43 HG LEU 43 20.327 21.587 2.305
366 HD11 LEU 43 1HD1 LEU 43 19.946 20.875 -0.592
367 HD12 LEU 43 2HD1 LEU 43 19.555 19.776 0.730
368 HD13 LEU 43 3HD1 LEU 43 21.214 20.333 0.507
369 HD21 LEU 43 1HD2 LEU 43 20.943 23.644 1.608
370 HD22 LEU 43 2HD2 LEU 43 19.830 23.635 0.239
371 HD23 LEU 43 3HD2 LEU 43 21.368 22.777 0.132
372 H TYR 44 H TYR 44 16.527 24.338 4.185
373 HA TYR 44 HA TYR 44 13.991 23.729 2.957
374 HB2 TYR 44 1HB TYR 44 12.986 22.779 5.009
375 HB3 TYR 44 2HB TYR 44 14.249 21.750 4.345
376 HD1 TYR 44 HD2 TYR 44 16.657 22.180 5.365
377 HD2 TYR 44 HD1 TYR 44 12.997 23.201 7.280
378 HE1 TYR 44 HE2 TYR 44 17.800 22.171 7.543
379 HE2 TYR 44 HE1 TYR 44 14.130 23.196 9.463
380 HH TYR 44 HH TYR 44 16.111 22.254 10.507
381 H ASP 45 H ASP 45 12.204 24.589 4.686
382 HA ASP 45 HA ASP 45 13.091 27.320 5.317
383 HB2 ASP 45 1HB ASP 45 11.310 27.446 3.784
384 HB3 ASP 45 2HB ASP 45 10.414 26.158 4.586
385 H GLN 46 H GLN 46 13.683 27.471 7.386
386 HA GLN 46 HA GLN 46 12.898 25.820 9.479
387 HB2 GLN 46 1HB GLN 46 13.688 28.717 9.781
388 HB3 GLN 46 2HB GLN 46 13.888 27.425 10.958
389 HG2 GLN 46 1HG GLN 46 16.003 27.506 10.165
390 HG3 GLN 46 2HG GLN 46 15.323 26.369 9.002
391 HE21 GLN 46 2HE2 GLN 46 15.369 26.868 6.904
392 HE22 GLN 46 1HE2 GLN 46 15.880 28.385 6.255
393 H GLN 47 H GLN 47 11.464 28.810 8.293
394 HA GLN 47 HA GLN 47 9.637 29.197 10.406
395 HB2 GLN 47 1HB GLN 47 8.885 30.035 7.653
396 HB3 GLN 47 2HB GLN 47 8.793 30.929 9.164
397 HG2 GLN 47 1HG GLN 47 11.114 30.551 7.329
398 HG3 GLN 47 2HG GLN 47 10.453 32.037 8.010
399 HE21 GLN 47 2HE2 GLN 47 13.148 30.513 8.014
400 HE22 GLN 47 1HE2 GLN 47 13.651 30.629 9.663
401 H GLU 48 H GLU 48 9.580 27.176 7.566
402 HA GLU 48 HA GLU 48 7.112 25.947 8.534
403 HB2 GLU 48 1HB GLU 48 7.304 27.576 6.158
404 HB3 GLU 48 2HB GLU 48 6.865 25.927 5.736
405 HG2 GLU 48 1HG GLU 48 4.920 25.996 7.060
406 HG3 GLU 48 2HG GLU 48 5.434 27.474 7.871
407 H GLN 49 H GLN 49 8.214 24.106 9.117
408 HA GLN 49 HA GLN 49 10.208 22.797 7.717
409 HB2 GLN 49 1HB GLN 49 8.089 21.792 9.600
410 HB3 GLN 49 2HB GLN 49 9.278 20.705 8.895
411 HG2 GLN 49 1HG GLN 49 10.491 21.196 10.698
412 HG3 GLN 49 2HG GLN 49 10.868 22.690 9.841
413 HE21 GLN 49 2HE2 GLN 49 11.076 24.017 11.567
414 HE22 GLN 49 1HE2 GLN 49 9.787 24.407 12.649
415 H HIS 50 H HIS 50 6.885 23.078 6.958
416 HA HIS 50 HA HIS 50 6.698 20.708 5.347
417 HB2 HIS 50 1HB HIS 50 4.941 23.059 5.902
418 HB3 HIS 50 2HB HIS 50 4.610 22.080 4.476
419 HD1 HIS 50 HD1 HIS 50 4.054 22.214 8.073
420 HD2 HIS 50 HD2 HIS 50 4.078 19.282 5.130
421 HE1 HIS 50 HE1 HIS 50 2.861 20.243 9.079
422 H MET 51 H MET 51 8.508 23.343 4.927
423 HA MET 51 HA MET 51 8.206 23.283 1.997
424 HB2 MET 51 1HB MET 51 8.198 25.534 3.823
425 HB3 MET 51 2HB MET 51 9.486 25.685 2.635
426 HG2 MET 51 1HG MET 51 6.904 24.878 1.520
427 HG3 MET 51 2HG MET 51 6.914 26.473 2.268
428 HE1 MET 51 1HE MET 51 8.887 24.163 -0.269
429 HE2 MET 51 2HE MET 51 10.003 25.340 -0.963
430 HE3 MET 51 3HE MET 51 10.130 24.903 0.741
431 H VAL 52 H VAL 52 9.938 22.601 0.923
432 HA VAL 52 HA VAL 52 12.519 22.536 2.342
433 HB VAL 52 HB VAL 52 11.315 20.689 0.306
434 HG11 VAL 52 1HG1 VAL 52 13.471 21.199 -0.618
435 HG12 VAL 52 2HG1 VAL 52 14.245 20.988 0.954
436 HG13 VAL 52 3HG1 VAL 52 13.543 19.600 0.121
437 HG21 VAL 52 1HG2 VAL 52 11.916 18.983 1.901
438 HG22 VAL 52 2HG2 VAL 52 12.775 20.161 2.893
439 HG23 VAL 52 3HG2 VAL 52 11.022 20.258 2.728
440 H TYR 53 H TYR 53 14.425 23.042 1.194
441 HA TYR 53 HA TYR 53 13.999 24.539 -1.308
442 HB2 TYR 53 1HB TYR 53 15.379 25.338 1.199
443 HB3 TYR 53 2HB TYR 53 16.137 25.819 -0.315
444 HD1 TYR 53 HD1 TYR 53 14.149 26.660 -2.081
445 HD2 TYR 53 HD2 TYR 53 14.150 27.027 2.158
446 HE1 TYR 53 HE1 TYR 53 12.607 28.569 -2.252
447 HE2 TYR 53 HE2 TYR 53 12.607 28.936 1.999
448 HH TYR 53 HH TYR 53 11.160 29.880 -1.051
449 H CYS 54 H CYS 54 14.562 22.297 -2.107
450 HA CYS 54 HA CYS 54 17.066 21.131 -1.794
451 HB2 CYS 54 1HB CYS 54 16.626 20.078 -4.026
452 HB3 CYS 54 2HB CYS 54 15.304 19.911 -2.877
453 HG CYS 54 HG CYS 54 13.510 20.842 -4.445
454 H GLY 55 H GLY 55 16.061 23.836 -3.763
455 HA2 GLY 55 1HA GLY 55 17.235 25.278 -5.112
456 HA3 GLY 55 2HA GLY 55 18.585 24.943 -4.038
457 H GLY 56 H GLY 56 20.317 23.954 -4.865
458 HA2 GLY 56 1HA GLY 56 19.980 22.509 -7.419
459 HA3 GLY 56 2HA GLY 56 21.294 23.650 -7.175
460 H ASP 57 H ASP 57 20.398 21.763 -4.457
461 HA ASP 57 HA ASP 57 22.972 20.509 -4.384
462 HB2 ASP 57 1HB ASP 57 21.008 21.144 -2.508
463 HB3 ASP 57 2HB ASP 57 21.032 19.383 -2.537
464 H LEU 58 H LEU 58 22.852 18.037 -3.616
465 HA LEU 58 HA LEU 58 22.504 16.479 -5.832
466 HB2 LEU 58 1HB LEU 58 22.355 15.795 -2.914
467 HB3 LEU 58 2HB LEU 58 22.210 14.558 -4.160
468 HG LEU 58 HG LEU 58 24.475 14.695 -3.206
469 HD11 LEU 58 1HD1 LEU 58 24.656 15.664 -6.029
470 HD12 LEU 58 2HD1 LEU 58 23.896 14.115 -5.662
471 HD13 LEU 58 3HD1 LEU 58 25.579 14.399 -5.216
472 HD21 LEU 58 1HD2 LEU 58 24.471 17.109 -2.728
473 HD22 LEU 58 2HD2 LEU 58 24.550 17.439 -4.459
474 HD23 LEU 58 3HD2 LEU 58 25.886 16.612 -3.656
475 H LEU 59 H LEU 59 20.172 16.762 -3.148
476 HA LEU 59 HA LEU 59 18.163 15.188 -4.288
477 HB2 LEU 59 1HB LEU 59 16.865 15.821 -2.531
478 HB3 LEU 59 2HB LEU 59 18.451 16.264 -1.903
479 HG LEU 59 HG LEU 59 16.616 18.234 -3.250
480 HD11 LEU 59 1HD1 LEU 59 16.337 18.959 -0.753
481 HD12 LEU 59 2HD1 LEU 59 16.687 17.261 -0.434
482 HD13 LEU 59 3HD1 LEU 59 15.308 17.703 -1.441
483 HD21 LEU 59 1HD2 LEU 59 19.269 18.416 -2.672
484 HD22 LEU 59 2HD2 LEU 59 18.542 19.087 -1.212
485 HD23 LEU 59 3HD2 LEU 59 18.166 19.787 -2.787
486 H GLY 60 H GLY 60 18.813 18.655 -4.553
487 HA2 GLY 60 1HA GLY 60 16.488 19.420 -5.903
488 HA3 GLY 60 2HA GLY 60 18.041 20.233 -6.029
489 H GLU 61 H GLU 61 19.674 18.872 -7.414
490 HA GLU 61 HA GLU 61 18.837 18.946 -10.044
491 HB2 GLU 61 1HB GLU 61 20.856 17.516 -10.520
492 HB3 GLU 61 2HB GLU 61 21.171 18.968 -9.581
493 HG2 GLU 61 1HG GLU 61 22.397 17.435 -8.420
494 HG3 GLU 61 2HG GLU 61 20.870 17.360 -7.544
495 H LEU 62 H LEU 62 19.120 16.103 -7.928
496 HA LEU 62 HA LEU 62 18.383 14.131 -9.716
497 HB2 LEU 62 1HB LEU 62 18.849 14.296 -6.993
498 HB3 LEU 62 2HB LEU 62 17.180 13.739 -7.101
499 HG LEU 62 HG LEU 62 18.577 11.822 -6.903
500 HD11 LEU 62 1HD1 LEU 62 16.696 11.826 -8.601
501 HD12 LEU 62 2HD1 LEU 62 17.926 10.577 -8.792
502 HD13 LEU 62 3HD1 LEU 62 17.944 11.998 -9.835
503 HD21 LEU 62 1HD2 LEU 62 20.394 11.348 -8.478
504 HD22 LEU 62 2HD2 LEU 62 20.692 12.826 -7.563
505 HD23 LEU 62 3HD2 LEU 62 20.143 12.920 -9.237
506 H LEU 63 H LEU 63 16.288 16.169 -7.704
507 HA LEU 63 HA LEU 63 13.857 14.987 -8.567
508 HB2 LEU 63 1HB LEU 63 14.681 17.045 -6.776
509 HB3 LEU 63 2HB LEU 63 13.407 17.681 -7.814
510 HG LEU 63 HG LEU 63 13.027 15.068 -6.405
511 HD11 LEU 63 1HD1 LEU 63 13.720 16.515 -4.629
512 HD12 LEU 63 2HD1 LEU 63 11.967 16.341 -4.550
513 HD13 LEU 63 3HD1 LEU 63 12.678 17.813 -5.213
514 HD21 LEU 63 1HD2 LEU 63 10.914 15.268 -7.096
515 HD22 LEU 63 2HD2 LEU 63 11.512 16.523 -8.181
516 HD23 LEU 63 3HD2 LEU 63 10.826 16.963 -6.616
517 H GLY 64 H GLY 64 15.534 17.986 -9.504
518 HA2 GLY 64 1HA GLY 64 15.643 18.619 -11.832
519 HA3 GLY 64 2HA GLY 64 14.067 17.875 -12.059
520 H ARG 65 H ARG 65 13.646 19.337 -9.243
521 HA ARG 65 HA ARG 65 12.639 21.791 -10.508
522 HB2 ARG 65 1HB ARG 65 11.785 21.048 -7.764
523 HB3 ARG 65 2HB ARG 65 10.858 21.759 -9.079
524 HG2 ARG 65 1HG ARG 65 11.554 18.877 -8.633
525 HG3 ARG 65 2HG ARG 65 9.959 19.620 -8.764
526 HD2 ARG 65 1HD ARG 65 11.855 18.797 -10.875
527 HD3 ARG 65 2HD ARG 65 10.093 18.771 -10.861
528 HE ARG 65 HE ARG 65 11.746 20.809 -11.930
529 HH11 ARG 65 1HH1 ARG 65 8.756 20.302 -10.219
530 HH12 ARG 65 2HH1 ARG 65 8.016 21.748 -10.820
531 HH21 ARG 65 1HH2 ARG 65 10.781 22.716 -12.728
532 HH22 ARG 65 2HH2 ARG 65 9.168 23.120 -12.248
533 H GLN 66 H GLN 66 12.254 23.351 -8.271
534 HA GLN 66 HA GLN 66 15.027 23.916 -7.469
535 HB2 GLN 66 1HB GLN 66 12.710 25.848 -7.452
536 HB3 GLN 66 2HB GLN 66 14.418 26.224 -7.266
537 HG2 GLN 66 1HG GLN 66 14.233 26.778 -9.435
538 HG3 GLN 66 2HG GLN 66 14.490 25.049 -9.667
539 HE21 GLN 66 2HE2 GLN 66 13.095 24.063 -10.931
540 HE22 GLN 66 1HE2 GLN 66 11.489 24.590 -11.285
541 H SER 67 H SER 67 11.743 23.512 -6.315
542 HA SER 67 HA SER 67 12.711 22.939 -3.660
543 HB2 SER 67 1HB SER 67 10.950 24.638 -2.722
544 HB3 SER 67 2HB SER 67 12.552 25.210 -3.185
545 HG SER 67 HG SER 67 10.104 25.490 -4.554
546 H PHE 68 H PHE 68 10.523 22.805 -2.191
547 HA PHE 68 HA PHE 68 8.127 22.015 -3.369
548 HB2 PHE 68 1HB PHE 68 8.274 19.555 -3.180
549 HB3 PHE 68 2HB PHE 68 9.390 20.194 -4.383
550 HD1 PHE 68 HD1 PHE 68 9.197 19.025 -0.867
551 HD2 PHE 68 HD2 PHE 68 11.660 19.696 -4.273
552 HE1 PHE 68 HE1 PHE 68 11.057 17.868 0.254
553 HE2 PHE 68 HE2 PHE 68 13.523 18.539 -3.158
554 HZ PHE 68 HZ PHE 68 13.223 17.622 -0.892
555 H SER 69 H SER 69 6.584 21.370 -1.850
556 HA SER 69 HA SER 69 7.387 21.843 0.915
557 HB2 SER 69 1HB SER 69 4.730 21.794 -0.504
558 HB3 SER 69 2HB SER 69 4.831 21.787 1.256
559 HG SER 69 HG SER 69 5.006 23.861 -0.379
560 H VAL 70 H VAL 70 7.215 20.372 2.540
561 HA VAL 70 HA VAL 70 7.132 17.601 1.806
562 HB VAL 70 HB VAL 70 8.170 17.223 3.753
563 HG11 VAL 70 1HG1 VAL 70 8.158 20.191 4.220
564 HG12 VAL 70 2HG1 VAL 70 9.422 19.022 4.606
565 HG13 VAL 70 3HG1 VAL 70 9.093 19.445 2.925
566 HG21 VAL 70 1HG2 VAL 70 6.278 17.162 5.132
567 HG22 VAL 70 2HG2 VAL 70 7.361 18.302 5.929
568 HG23 VAL 70 3HG2 VAL 70 6.000 18.897 4.980
569 H LYS 71 H LYS 71 4.754 19.830 2.463
570 HA LYS 71 HA LYS 71 2.950 18.002 3.823
571 HB2 LYS 71 1HB LYS 71 3.184 20.657 4.016
572 HB3 LYS 71 2HB LYS 71 1.992 20.595 2.724
573 HG2 LYS 71 1HG LYS 71 0.540 19.222 4.155
574 HG3 LYS 71 2HG LYS 71 1.726 19.355 5.456
575 HD2 LYS 71 1HD LYS 71 0.939 21.925 4.294
576 HD3 LYS 71 2HD LYS 71 -0.387 21.048 5.062
577 HE2 LYS 71 1HE LYS 71 1.285 20.728 7.014
578 HE3 LYS 71 2HE LYS 71 2.163 22.060 6.264
579 HZ1 LYS 71 1HZ LYS 71 -0.642 22.119 7.235
580 HZ2 LYS 71 2HZ LYS 71 0.111 23.386 6.405
581 HZ3 LYS 71 3HZ LYS 71 0.682 22.913 7.926
582 H ASP 72 H ASP 72 3.704 19.013 0.625
583 HA ASP 72 HA ASP 72 1.289 17.658 -0.384
584 HB2 ASP 72 1HB ASP 72 2.911 19.891 -1.617
585 HB3 ASP 72 2HB ASP 72 1.654 19.006 -2.476
586 HA PRO 73 HA PRO 73 4.597 14.797 -1.597
587 HB2 PRO 73 1HB PRO 73 2.933 12.672 -1.888
588 HB3 PRO 73 2HB PRO 73 3.568 13.187 -0.321
589 HG2 PRO 73 1HG PRO 73 0.895 13.733 -1.554
590 HG3 PRO 73 2HG PRO 73 1.285 13.281 0.115
591 HD2 PRO 73 1HD PRO 73 0.755 15.833 -0.617
592 HD3 PRO 73 2HD PRO 73 1.888 15.430 0.689
593 H SER 74 H SER 74 3.939 16.594 -3.486
594 HA SER 74 HA SER 74 2.763 15.148 -5.741
595 HB2 SER 74 1HB SER 74 3.090 17.975 -5.011
596 HB3 SER 74 2HB SER 74 3.424 17.631 -6.708
597 HG SER 74 HG SER 74 1.041 17.495 -5.299
598 HA PRO 75 HA PRO 75 6.991 16.347 -7.667
599 HB2 PRO 75 1HB PRO 75 8.725 17.809 -6.174
600 HB3 PRO 75 2HB PRO 75 7.486 18.542 -7.199
601 HG2 PRO 75 1HG PRO 75 7.456 18.056 -4.246
602 HG3 PRO 75 2HG PRO 75 6.927 19.487 -5.150
603 HD2 PRO 75 1HD PRO 75 5.192 17.630 -4.215
604 HD3 PRO 75 2HD PRO 75 4.904 18.537 -5.714
605 H LEU 76 H LEU 76 6.928 15.620 -4.239
606 HA LEU 76 HA LEU 76 9.438 14.420 -3.964
607 HB2 LEU 76 1HB LEU 76 7.834 15.021 -2.132
608 HB3 LEU 76 2HB LEU 76 6.911 13.581 -2.557
609 HG LEU 76 HG LEU 76 9.198 12.367 -2.125
610 HD11 LEU 76 1HD1 LEU 76 10.338 13.514 -0.175
611 HD12 LEU 76 2HD1 LEU 76 9.498 14.981 -0.675
612 HD13 LEU 76 3HD1 LEU 76 10.634 14.198 -1.774
613 HD21 LEU 76 1HD2 LEU 76 8.162 13.092 0.473
614 HD22 LEU 76 2HD2 LEU 76 8.091 11.549 -0.378
615 HD23 LEU 76 3HD2 LEU 76 6.862 12.779 -0.677
616 H TYR 77 H TYR 77 6.292 12.823 -4.501
617 HA TYR 77 HA TYR 77 7.356 10.257 -4.926
618 HB2 TYR 77 1HB TYR 77 4.739 11.569 -5.566
619 HB3 TYR 77 2HB TYR 77 5.085 9.963 -6.198
620 HD1 TYR 77 HD1 TYR 77 5.680 8.128 -4.530
621 HD2 TYR 77 HD2 TYR 77 3.979 11.850 -3.366
622 HE1 TYR 77 HE1 TYR 77 4.976 7.132 -2.394
623 HE2 TYR 77 HE2 TYR 77 3.271 10.865 -1.227
624 HH TYR 77 HH TYR 77 3.711 7.427 -0.553
625 H ASP 78 H ASP 78 6.626 12.902 -7.140
626 HA ASP 78 HA ASP 78 6.892 11.611 -9.574
627 HB2 ASP 78 1HB ASP 78 6.441 14.168 -8.854
628 HB3 ASP 78 2HB ASP 78 8.119 14.303 -9.373
629 H MET 79 H MET 79 9.408 12.932 -7.467
630 HA MET 79 HA MET 79 11.544 12.323 -9.271
631 HB2 MET 79 1HB MET 79 12.235 13.990 -7.878
632 HB3 MET 79 2HB MET 79 11.289 13.396 -6.520
633 HG2 MET 79 1HG MET 79 13.612 11.777 -7.396
634 HG3 MET 79 2HG MET 79 13.931 13.296 -6.561
635 HE1 MET 79 1HE MET 79 13.447 13.718 -3.991
636 HE2 MET 79 2HE MET 79 11.770 13.715 -4.536
637 HE3 MET 79 3HE MET 79 12.237 12.783 -3.113
638 H LEU 80 H LEU 80 10.399 10.876 -6.225
639 HA LEU 80 HA LEU 80 12.227 8.799 -6.043
640 HB2 LEU 80 1HB LEU 80 9.317 8.702 -5.264
641 HB3 LEU 80 2HB LEU 80 10.602 7.667 -4.645
642 HG LEU 80 HG LEU 80 10.640 10.645 -4.246
643 HD11 LEU 80 1HD1 LEU 80 9.479 8.637 -2.327
644 HD12 LEU 80 2HD1 LEU 80 8.509 9.663 -3.383
645 HD13 LEU 80 3HD1 LEU 80 9.538 10.392 -2.151
646 HD21 LEU 80 1HD2 LEU 80 11.730 8.872 -2.207
647 HD22 LEU 80 2HD2 LEU 80 12.456 10.270 -3.001
648 HD23 LEU 80 3HD2 LEU 80 12.510 8.687 -3.778
649 H ARG 81 H ARG 81 9.234 9.009 -7.894
650 HA ARG 81 HA ARG 81 8.651 6.520 -8.667
651 HB2 ARG 81 1HB ARG 81 8.837 9.036 -10.286
652 HB3 ARG 81 2HB ARG 81 8.393 7.524 -11.067
653 HG2 ARG 81 1HG ARG 81 6.399 7.358 -9.910
654 HG3 ARG 81 2HG ARG 81 6.943 8.429 -8.618
655 HD2 ARG 81 1HD ARG 81 5.739 9.998 -9.668
656 HD3 ARG 81 2HD ARG 81 7.084 10.057 -10.807
657 HE ARG 81 HE ARG 81 5.685 9.205 -12.385
658 HH11 ARG 81 1HH1 ARG 81 4.454 8.338 -9.245
659 HH12 ARG 81 2HH1 ARG 81 3.025 7.583 -9.870
660 HH21 ARG 81 1HH2 ARG 81 3.807 8.214 -13.219
661 HH22 ARG 81 2HH2 ARG 81 2.658 7.513 -12.130
662 H LYS 82 H LYS 82 11.180 8.420 -10.320
663 HA LYS 82 HA LYS 82 12.360 5.887 -11.243
664 HB2 LYS 82 1HB LYS 82 12.996 6.903 -13.184
665 HB3 LYS 82 2HB LYS 82 11.606 7.911 -12.805
666 HG2 LYS 82 1HG LYS 82 14.471 8.571 -12.153
667 HG3 LYS 82 2HG LYS 82 13.540 9.233 -13.499
668 HD2 LYS 82 1HD LYS 82 12.889 9.554 -10.569
669 HD3 LYS 82 2HD LYS 82 13.607 10.786 -11.609
670 HE2 LYS 82 1HE LYS 82 11.298 9.886 -12.931
671 HE3 LYS 82 2HE LYS 82 10.844 10.095 -11.241
672 HZ1 LYS 82 1HZ LYS 82 11.498 12.077 -13.223
673 HZ2 LYS 82 2HZ LYS 82 12.285 12.319 -11.746
674 HZ3 LYS 82 3HZ LYS 82 10.597 12.228 -11.799
675 H ASN 83 H ASN 83 12.712 8.104 -8.863
676 HA ASN 83 HA ASN 83 15.625 8.207 -8.913
677 HB2 ASN 83 1HB ASN 83 14.529 10.259 -8.288
678 HB3 ASN 83 2HB ASN 83 13.583 9.435 -7.052
679 HD21 ASN 83 2HD2 ASN 83 14.558 8.844 -5.123
680 HD22 ASN 83 1HD2 ASN 83 16.083 9.486 -4.628
681 H LEU 84 H LEU 84 13.040 7.070 -6.746
682 HA LEU 84 HA LEU 84 14.923 5.666 -5.068
683 HB2 LEU 84 1HB LEU 84 12.218 6.546 -4.880
684 HB3 LEU 84 2HB LEU 84 12.270 4.815 -4.558
685 HG LEU 84 HG LEU 84 13.842 6.932 -3.091
686 HD11 LEU 84 1HD1 LEU 84 11.182 6.344 -2.831
687 HD12 LEU 84 2HD1 LEU 84 12.206 7.039 -1.575
688 HD13 LEU 84 3HD1 LEU 84 11.924 5.299 -1.620
689 HD21 LEU 84 1HD2 LEU 84 15.171 5.265 -2.468
690 HD22 LEU 84 2HD2 LEU 84 14.172 4.079 -3.308
691 HD23 LEU 84 3HD2 LEU 84 13.787 4.542 -1.649
692 H VAL 85 H VAL 85 15.894 4.064 -6.250
693 HA VAL 85 HA VAL 85 15.021 2.413 -8.171
694 HB VAL 85 HB VAL 85 16.787 1.849 -5.823
695 HG11 VAL 85 1HG1 VAL 85 15.688 -0.264 -6.152
696 HG12 VAL 85 2HG1 VAL 85 15.940 -0.169 -7.897
697 HG13 VAL 85 3HG1 VAL 85 17.320 -0.363 -6.814
698 HG21 VAL 85 1HG2 VAL 85 17.914 3.070 -7.437
699 HG22 VAL 85 2HG2 VAL 85 18.354 1.411 -7.844
700 HG23 VAL 85 3HG2 VAL 85 17.108 2.245 -8.772
701 H THR 86 H THR 86 13.713 0.668 -8.442
702 HA THR 86 HA THR 86 12.364 -0.454 -6.093
703 HB THR 86 HB THR 86 10.210 -0.459 -7.475
704 HG1 THR 86 1HG THR 86 10.168 0.685 -9.275
705 HG21 THR 86 1HG2 THR 86 11.447 1.945 -6.194
706 HG22 THR 86 2HG2 THR 86 10.130 0.923 -5.619
707 HG23 THR 86 3HG2 THR 86 9.851 2.068 -6.931
708 H LEU 87 H LEU 87 11.936 -2.605 -6.222
709 HA LEU 87 HA LEU 87 12.566 -3.942 -8.771
710 HB2 LEU 87 1HB LEU 87 13.033 -5.081 -6.024
711 HB3 LEU 87 2HB LEU 87 13.543 -5.763 -7.568
712 HG LEU 87 HG LEU 87 14.880 -3.461 -7.689
713 HD11 LEU 87 1HD1 LEU 87 14.313 -3.920 -4.790
714 HD12 LEU 87 2HD1 LEU 87 14.317 -2.413 -5.707
715 HD13 LEU 87 3HD1 LEU 87 15.841 -3.201 -5.299
716 HD21 LEU 87 1HD2 LEU 87 15.591 -6.058 -6.377
717 HD22 LEU 87 2HD2 LEU 87 16.768 -4.750 -6.496
718 HD23 LEU 87 3HD2 LEU 87 16.066 -5.441 -7.960
719 H ALA 88 H ALA 88 10.908 -4.466 -5.657
720 HA ALA 88 HA ALA 88 8.795 -5.236 -5.216
721 HB1 ALA 88 1HB ALA 88 7.956 -5.920 -7.913
722 HB2 ALA 88 2HB ALA 88 7.220 -4.827 -6.740
723 HB3 ALA 88 3HB ALA 88 8.525 -4.256 -7.779
724 H THR 89 H THR 89 9.152 -7.125 -4.216
725 HA THR 89 HA THR 89 9.653 -9.501 -5.887
726 HB THR 89 HB THR 89 10.545 -10.533 -3.751
727 HG1 THR 89 1HG THR 89 10.880 -7.874 -2.849
728 HG21 THR 89 1HG2 THR 89 12.324 -8.242 -4.242
729 HG22 THR 89 2HG2 THR 89 11.808 -9.107 -5.690
730 HG23 THR 89 3HG2 THR 89 12.633 -9.972 -4.394
731 H1 SER 115 H SER 115 8.169 17.866 25.469
732 HA SER 115 HA SER 115 6.184 19.239 23.949
733 HB2 SER 115 1HB SER 115 8.140 20.746 25.627
734 HB3 SER 115 2HB SER 115 6.392 20.938 25.492
735 HG SER 115 HG SER 115 6.491 19.928 27.360
736 H GLN 116 H GLN 116 8.982 18.272 22.862
737 HA GLN 116 HA GLN 116 9.444 20.710 21.279
738 HB2 GLN 116 1HB GLN 116 11.243 19.671 23.088
739 HB3 GLN 116 2HB GLN 116 11.781 18.971 21.567
740 HG2 GLN 116 1HG GLN 116 12.686 20.884 20.922
741 HG3 GLN 116 2HG GLN 116 11.197 21.769 21.247
742 HE21 GLN 116 2HE2 GLN 116 10.812 22.396 23.497
743 HE22 GLN 116 1HE2 GLN 116 12.167 22.817 24.482
744 H GLU 117 H GLU 117 8.871 20.336 19.250
745 HA GLU 117 HA GLU 117 9.728 17.855 17.964
746 HB2 GLU 117 1HB GLU 117 7.438 17.776 16.822
747 HB3 GLU 117 2HB GLU 117 7.529 17.225 18.489
748 HG2 GLU 117 1HG GLU 117 6.062 18.744 19.153
749 HG3 GLU 117 2HG GLU 117 6.953 20.045 18.366
750 H THR 118 H THR 118 9.413 17.974 15.554
751 HA THR 118 HA THR 118 8.998 20.446 14.252
752 HB THR 118 HB THR 118 11.231 20.846 15.433
753 HG1 THR 118 1HG THR 118 10.723 22.209 13.771
754 HG21 THR 118 1HG2 THR 118 13.101 19.689 14.874
755 HG22 THR 118 2HG2 THR 118 12.574 19.431 13.211
756 HG23 THR 118 3HG2 THR 118 11.932 18.422 14.507
757 H PHE 119 H PHE 119 11.017 19.990 12.191
758 HA PHE 119 HA PHE 119 9.675 18.548 10.337
759 HB2 PHE 119 1HB PHE 119 11.832 19.881 10.048
760 HB3 PHE 119 2HB PHE 119 12.683 18.411 10.511
761 HD1 PHE 119 HD2 PHE 119 9.613 18.565 8.467
762 HD2 PHE 119 HD1 PHE 119 13.828 17.978 8.500
763 HE1 PHE 119 HE2 PHE 119 9.519 17.780 6.137
764 HE2 PHE 119 HE1 PHE 119 13.741 17.193 6.170
765 HZ PHE 119 HZ PHE 119 11.584 17.093 4.985
766 H SER 120 H SER 120 11.549 17.282 12.971
767 HA SER 120 HA SER 120 11.929 14.654 12.029
768 HB2 SER 120 1HB SER 120 12.823 15.975 14.184
769 HB3 SER 120 2HB SER 120 11.507 15.079 14.943
770 HG SER 120 HG SER 120 13.780 14.114 14.675
771 H ASP 121 H ASP 121 9.317 16.150 13.885
772 HA ASP 121 HA ASP 121 7.836 13.656 13.996
773 HB2 ASP 121 1HB ASP 121 7.943 15.607 15.776
774 HB3 ASP 121 2HB ASP 121 6.642 16.277 14.796
775 H LEU 122 H LEU 122 7.781 16.698 12.252
776 HA LEU 122 HA LEU 122 5.238 16.269 11.022
777 HB2 LEU 122 1HB LEU 122 6.481 18.478 11.373
778 HB3 LEU 122 2HB LEU 122 7.418 18.033 9.948
779 HG LEU 122 HG LEU 122 5.281 17.946 8.661
780 HD11 LEU 122 1HD1 LEU 122 3.888 19.577 10.668
781 HD12 LEU 122 2HD1 LEU 122 4.055 17.868 11.069
782 HD13 LEU 122 3HD1 LEU 122 3.266 18.347 9.567
783 HD21 LEU 122 1HD2 LEU 122 5.166 20.678 9.589
784 HD22 LEU 122 2HD2 LEU 122 5.726 20.036 8.044
785 HD23 LEU 122 3HD2 LEU 122 6.833 20.129 9.415
786 H TRP 123 H TRP 123 8.581 16.101 9.794
787 HA TRP 123 HA TRP 123 8.272 15.355 7.236
788 HB2 TRP 123 1HB TRP 123 10.465 15.489 8.285
789 HB3 TRP 123 2HB TRP 123 10.133 14.037 9.225
790 HD1 TRP 123 HD1 TRP 123 11.224 11.948 8.254
791 HE1 TRP 123 HE1 TRP 123 11.960 11.156 5.918
792 HE3 TRP 123 HE3 TRP 123 9.665 15.967 5.505
793 HZ2 TRP 123 HZ2 TRP 123 11.889 12.108 3.262
794 HZ3 TRP 123 HZ3 TRP 123 10.037 15.948 3.073
795 HH2 TRP 123 HH2 TRP 123 11.127 14.058 1.977
796 H LYS 124 H LYS 124 8.252 12.975 9.897
797 HA LYS 124 HA LYS 124 7.555 10.748 8.389
798 HB2 LYS 124 1HB LYS 124 7.950 11.317 11.093
799 HB3 LYS 124 2HB LYS 124 6.303 10.707 11.007
800 HG2 LYS 124 1HG LYS 124 7.329 8.791 9.614
801 HG3 LYS 124 2HG LYS 124 8.862 9.332 10.303
802 HD2 LYS 124 1HD LYS 124 8.079 7.634 11.743
803 HD3 LYS 124 2HD LYS 124 7.738 9.154 12.573
804 HE2 LYS 124 1HE LYS 124 5.437 9.049 11.998
805 HE3 LYS 124 2HE LYS 124 5.713 7.728 10.863
806 HZ1 LYS 124 1HZ LYS 124 6.631 6.653 13.119
807 HZ2 LYS 124 2HZ LYS 124 5.032 6.489 12.591
808 HZ3 LYS 124 3HZ LYS 124 5.424 7.659 13.748
809 H LEU 125 H LEU 125 5.534 13.274 9.759
810 HA LEU 125 HA LEU 125 3.032 12.068 9.449
811 HB2 LEU 125 1HB LEU 125 3.917 14.447 10.397
812 HB3 LEU 125 2HB LEU 125 3.168 14.952 8.884
813 HG LEU 125 HG LEU 125 1.489 13.180 10.498
814 HD11 LEU 125 1HD1 LEU 125 2.770 14.551 12.212
815 HD12 LEU 125 2HD1 LEU 125 1.010 14.646 12.269
816 HD13 LEU 125 3HD1 LEU 125 1.940 15.958 11.546
817 HD21 LEU 125 1HD2 LEU 125 1.058 15.912 9.293
818 HD22 LEU 125 2HD2 LEU 125 -0.193 14.844 9.929
819 HD23 LEU 125 3HD2 LEU 125 0.725 14.374 8.497
820 H LEU 126 H LEU 126 5.256 13.058 7.099
821 HA LEU 126 HA LEU 126 4.004 14.080 4.976
822 HB2 LEU 126 1HB LEU 126 6.056 11.997 5.280
823 HB3 LEU 126 2HB LEU 126 5.253 12.031 3.712
824 HG LEU 126 HG LEU 126 6.223 14.636 4.684
825 HD11 LEU 126 1HD1 LEU 126 8.235 13.878 5.301
826 HD12 LEU 126 2HD1 LEU 126 8.516 13.665 3.573
827 HD13 LEU 126 3HD1 LEU 126 7.979 12.301 4.554
828 HD21 LEU 126 1HD2 LEU 126 6.902 13.397 2.065
829 HD22 LEU 126 2HD2 LEU 126 6.492 15.068 2.454
830 HD23 LEU 126 3HD2 LEU 126 5.225 13.843 2.379
831 HA PRO 127 HA PRO 127 0.416 11.439 4.516
832 HB2 PRO 127 1HB PRO 127 -0.759 12.960 2.599
833 HB3 PRO 127 2HB PRO 127 -0.809 13.373 4.317
834 HG2 PRO 127 1HG PRO 127 0.978 14.438 2.165
835 HG3 PRO 127 2HG PRO 127 0.144 15.314 3.462
836 HD2 PRO 127 1HD PRO 127 2.770 14.665 3.595
837 HD3 PRO 127 2HD PRO 127 1.733 14.751 5.034
838 H GLU 128 H GLU 128 2.378 10.107 3.502
839 HA GLU 128 HA GLU 128 3.095 9.962 0.921
840 HB2 GLU 128 1HB GLU 128 2.646 7.337 1.278
841 HB3 GLU 128 2HB GLU 128 3.991 8.192 2.021
842 HG2 GLU 128 1HG GLU 128 3.040 8.167 4.105
843 HG3 GLU 128 2HG GLU 128 1.398 8.045 3.474
844 H ASN 129 H ASN 129 -0.085 9.202 2.182
845 HA ASN 129 HA ASN 129 -1.415 9.681 -0.223
846 HB2 ASN 129 1HB ASN 129 -0.136 7.249 -0.368
847 HB3 ASN 129 2HB ASN 129 -1.751 6.793 0.164
848 HD21 ASN 129 2HD2 ASN 129 -3.345 8.565 -1.093
849 HD22 ASN 129 1HD2 ASN 129 -3.220 8.382 -2.806
Start of MODEL 16
1 H1 GLN 1 H GLN 1 2.986 1.863 1.746
2 HA GLN 1 HA GLN 1 2.058 -0.246 -0.064
3 HB2 GLN 1 1HB GLN 1 3.620 2.113 -0.794
4 HB3 GLN 1 2HB GLN 1 4.397 0.605 -1.259
5 HG2 GLN 1 1HG GLN 1 1.720 0.321 -1.998
6 HG3 GLN 1 2HG GLN 1 2.169 1.962 -2.458
7 HE21 GLN 1 2HE2 GLN 1 3.193 -1.406 -2.710
8 HE22 GLN 1 1HE2 GLN 1 3.956 -1.246 -4.252
9 H ILE 2 H ILE 2 4.986 1.162 1.406
10 HA ILE 2 HA ILE 2 6.713 0.217 2.548
11 HB ILE 2 HB ILE 2 4.994 -2.250 2.794
12 HG12 ILE 2 1HG1 ILE 2 3.573 -0.745 3.779
13 HG13 ILE 2 2HG1 ILE 2 4.631 -1.059 5.151
14 HG21 ILE 2 1HG2 ILE 2 7.021 -2.923 3.590
15 HG22 ILE 2 2HG2 ILE 2 7.506 -1.293 4.052
16 HG23 ILE 2 3HG2 ILE 2 6.369 -2.192 5.057
17 HD11 ILE 2 1HD1 ILE 2 5.974 0.961 4.266
18 HD12 ILE 2 2HD1 ILE 2 4.496 1.337 3.381
19 HD13 ILE 2 3HD1 ILE 2 4.469 1.238 5.141
20 H ASN 3 H ASN 3 6.841 0.125 -0.206
21 HA ASN 3 HA ASN 3 7.661 -2.545 -0.996
22 HB2 ASN 3 1HB ASN 3 6.467 -0.657 -2.428
23 HB3 ASN 3 2HB ASN 3 8.130 -0.162 -2.731
24 HD21 ASN 3 2HD2 ASN 3 9.424 -2.557 -2.846
25 HD22 ASN 3 1HD2 ASN 3 8.853 -3.467 -4.199
26 H GLN 4 H GLN 4 9.702 -3.270 -1.111
27 HA GLN 4 HA GLN 4 11.791 -1.834 0.155
28 HB2 GLN 4 1HB GLN 4 12.191 -4.230 -1.623
29 HB3 GLN 4 2HB GLN 4 13.143 -3.736 -0.229
30 HG2 GLN 4 1HG GLN 4 11.980 -5.322 0.830
31 HG3 GLN 4 2HG GLN 4 10.726 -4.086 0.921
32 HE21 GLN 4 2HE2 GLN 4 8.800 -4.631 0.200
33 HE22 GLN 4 1HE2 GLN 4 8.450 -5.920 -0.896
34 H VAL 5 H VAL 5 13.778 -1.104 -0.740
35 HA VAL 5 HA VAL 5 13.809 -0.654 -3.636
36 HB VAL 5 HB VAL 5 14.447 1.682 -3.369
37 HG11 VAL 5 1HG1 VAL 5 11.933 1.345 -1.773
38 HG12 VAL 5 2HG1 VAL 5 12.314 2.545 -3.009
39 HG13 VAL 5 3HG1 VAL 5 12.004 0.870 -3.469
40 HG21 VAL 5 1HG2 VAL 5 15.326 1.167 -0.958
41 HG22 VAL 5 2HG2 VAL 5 14.716 2.773 -1.360
42 HG23 VAL 5 3HG2 VAL 5 13.693 1.635 -0.482
43 H ARG 6 H ARG 6 15.986 0.382 -4.274
44 HA ARG 6 HA ARG 6 18.158 -0.622 -2.570
45 HB2 ARG 6 1HB ARG 6 17.372 -2.017 -4.747
46 HB3 ARG 6 2HB ARG 6 18.529 -0.921 -5.490
47 HG2 ARG 6 1HG ARG 6 20.304 -1.738 -4.188
48 HG3 ARG 6 2HG ARG 6 19.210 -2.553 -3.067
49 HD2 ARG 6 1HD ARG 6 18.482 -3.804 -5.292
50 HD3 ARG 6 2HD ARG 6 20.119 -3.364 -5.776
51 HE ARG 6 HE ARG 6 20.433 -4.475 -3.312
52 HH11 ARG 6 1HH1 ARG 6 18.950 -5.513 -6.285
53 HH12 ARG 6 2HH1 ARG 6 19.271 -7.193 -6.011
54 HH21 ARG 6 1HH2 ARG 6 20.861 -6.684 -2.939
55 HH22 ARG 6 2HH2 ARG 6 20.357 -7.859 -4.107
56 HA PRO 7 HA PRO 7 19.347 3.616 -3.502
57 HB2 PRO 7 1HB PRO 7 21.308 3.716 -1.627
58 HB3 PRO 7 2HB PRO 7 19.596 3.914 -1.237
59 HG2 PRO 7 1HG PRO 7 21.329 1.488 -0.975
60 HG3 PRO 7 2HG PRO 7 20.124 2.130 0.157
61 HD2 PRO 7 1HD PRO 7 19.605 0.050 -1.497
62 HD3 PRO 7 2HD PRO 7 18.358 1.215 -1.006
63 H LYS 8 H LYS 8 20.358 3.609 -5.449
64 HA LYS 8 HA LYS 8 22.517 2.015 -6.212
65 HB2 LYS 8 1HB LYS 8 22.107 4.782 -7.309
66 HB3 LYS 8 2HB LYS 8 22.654 3.335 -8.147
67 HG2 LYS 8 1HG LYS 8 20.303 2.417 -7.652
68 HG3 LYS 8 2HG LYS 8 19.880 4.100 -7.327
69 HD2 LYS 8 1HD LYS 8 21.288 3.345 -9.861
70 HD3 LYS 8 2HD LYS 8 19.540 3.146 -9.714
71 HE2 LYS 8 1HE LYS 8 20.244 5.723 -8.731
72 HE3 LYS 8 2HE LYS 8 21.010 5.499 -10.303
73 HZ1 LYS 8 1HZ LYS 8 18.563 4.571 -10.795
74 HZ2 LYS 8 2HZ LYS 8 19.018 6.180 -11.045
75 HZ3 LYS 8 3HZ LYS 8 18.199 5.743 -9.631
76 H LEU 9 H LEU 9 24.312 4.022 -7.278
77 HA LEU 9 HA LEU 9 26.105 4.208 -5.066
78 HB2 LEU 9 1HB LEU 9 26.957 5.883 -7.192
79 HB3 LEU 9 2HB LEU 9 27.593 4.316 -6.699
80 HG LEU 9 HG LEU 9 25.323 4.711 -8.646
81 HD11 LEU 9 1HD1 LEU 9 26.840 4.324 -10.402
82 HD12 LEU 9 2HD1 LEU 9 28.131 3.861 -9.294
83 HD13 LEU 9 3HD1 LEU 9 27.604 5.542 -9.380
84 HD21 LEU 9 1HD2 LEU 9 26.796 2.206 -8.694
85 HD22 LEU 9 2HD2 LEU 9 25.057 2.497 -8.649
86 HD23 LEU 9 3HD2 LEU 9 25.989 2.491 -7.152
87 HA PRO 10 HA PRO 10 25.403 8.964 -5.482
88 HB2 PRO 10 1HB PRO 10 23.425 9.802 -7.142
89 HB3 PRO 10 2HB PRO 10 25.090 9.549 -7.681
90 HG2 PRO 10 1HG PRO 10 22.714 7.748 -7.959
91 HG3 PRO 10 2HG PRO 10 23.969 8.137 -9.150
92 HD2 PRO 10 1HD PRO 10 23.981 5.838 -7.720
93 HD3 PRO 10 2HD PRO 10 25.473 6.648 -8.239
94 H LEU 11 H LEU 11 22.971 6.604 -5.207
95 HA LEU 11 HA LEU 11 21.126 8.385 -3.807
96 HB2 LEU 11 1HB LEU 11 20.945 5.531 -4.727
97 HB3 LEU 11 2HB LEU 11 19.747 6.248 -3.651
98 HG LEU 11 HG LEU 11 20.273 6.805 -6.542
99 HD11 LEU 11 1HD1 LEU 11 18.265 5.893 -6.826
100 HD12 LEU 11 2HD1 LEU 11 17.553 6.885 -5.555
101 HD13 LEU 11 3HD1 LEU 11 18.361 5.373 -5.143
102 HD21 LEU 11 1HD2 LEU 11 20.382 8.995 -5.595
103 HD22 LEU 11 2HD2 LEU 11 18.987 8.678 -4.563
104 HD23 LEU 11 3HD2 LEU 11 18.783 8.795 -6.312
105 H LEU 12 H LEU 12 23.190 5.580 -3.238
106 HA LEU 12 HA LEU 12 22.447 5.027 -0.604
107 HB2 LEU 12 1HB LEU 12 23.890 3.616 -2.071
108 HB3 LEU 12 2HB LEU 12 25.207 4.751 -1.782
109 HG LEU 12 HG LEU 12 25.501 4.053 0.406
110 HD11 LEU 12 1HD1 LEU 12 23.222 4.308 1.169
111 HD12 LEU 12 2HD1 LEU 12 23.845 2.734 1.664
112 HD13 LEU 12 3HD1 LEU 12 22.737 2.853 0.297
113 HD21 LEU 12 1HD2 LEU 12 24.526 1.403 -0.426
114 HD22 LEU 12 2HD2 LEU 12 26.126 1.908 0.121
115 HD23 LEU 12 3HD2 LEU 12 25.631 2.196 -1.548
116 H LYS 13 H LYS 13 24.858 7.275 -1.890
117 HA LYS 13 HA LYS 13 25.964 8.073 0.567
118 HB2 LYS 13 1HB LYS 13 26.092 8.914 -2.203
119 HB3 LYS 13 2HB LYS 13 26.082 10.301 -1.122
120 HG2 LYS 13 1HG LYS 13 27.900 8.819 0.140
121 HG3 LYS 13 2HG LYS 13 28.126 8.198 -1.497
122 HD2 LYS 13 1HD LYS 13 28.006 11.148 -1.045
123 HD3 LYS 13 2HD LYS 13 29.491 10.271 -0.670
124 HE2 LYS 13 1HE LYS 13 28.569 9.393 -3.206
125 HE3 LYS 13 2HE LYS 13 28.532 11.155 -3.198
126 HZ1 LYS 13 1HZ LYS 13 30.668 10.346 -3.946
127 HZ2 LYS 13 2HZ LYS 13 30.875 9.462 -2.519
128 HZ3 LYS 13 3HZ LYS 13 30.845 11.152 -2.469
129 H ILE 14 H ILE 14 23.050 9.016 -1.099
130 HA ILE 14 HA ILE 14 22.512 11.435 0.198
131 HB ILE 14 HB ILE 14 20.458 9.413 -0.699
132 HG12 ILE 14 1HG1 ILE 14 22.108 9.915 -2.478
133 HG13 ILE 14 2HG1 ILE 14 20.501 10.520 -2.865
134 HG21 ILE 14 1HG2 ILE 14 19.560 11.217 0.672
135 HG22 ILE 14 2HG2 ILE 14 20.313 12.408 -0.387
136 HG23 ILE 14 3HG2 ILE 14 19.025 11.372 -1.001
137 HD11 ILE 14 1HD1 ILE 14 21.206 12.763 -2.142
138 HD12 ILE 14 2HD1 ILE 14 22.829 12.134 -1.854
139 HD13 ILE 14 3HD1 ILE 14 22.163 12.141 -3.486
140 H LEU 15 H LEU 15 21.295 8.174 0.986
141 HA LEU 15 HA LEU 15 20.102 8.994 3.433
142 HB2 LEU 15 1HB LEU 15 20.934 6.201 2.685
143 HB3 LEU 15 2HB LEU 15 19.678 6.681 3.824
144 HG LEU 15 HG LEU 15 18.294 6.196 2.125
145 HD11 LEU 15 1HD1 LEU 15 18.457 8.771 2.334
146 HD12 LEU 15 2HD1 LEU 15 17.582 8.071 0.973
147 HD13 LEU 15 3HD1 LEU 15 19.220 8.683 0.747
148 HD21 LEU 15 1HD2 LEU 15 20.756 5.947 0.719
149 HD22 LEU 15 2HD2 LEU 15 19.611 6.817 -0.302
150 HD23 LEU 15 3HD2 LEU 15 19.190 5.229 0.342
151 H HIS 16 H HIS 16 23.188 7.503 2.587
152 HA HIS 16 HA HIS 16 24.126 6.844 5.108
153 HB2 HIS 16 1HB HIS 16 25.428 7.600 2.534
154 HB3 HIS 16 2HB HIS 16 26.431 7.540 3.980
155 HD1 HIS 16 HD1 HIS 16 27.732 5.485 3.147
156 HD2 HIS 16 HD2 HIS 16 23.640 4.857 3.495
157 HE1 HIS 16 HE1 HIS 16 27.414 2.998 2.949
158 H ALA 17 H ALA 17 24.400 9.941 3.390
159 HA ALA 17 HA ALA 17 25.922 11.330 5.252
160 HB1 ALA 17 1HB ALA 17 23.789 12.309 3.364
161 HB2 ALA 17 2HB ALA 17 24.834 13.378 4.301
162 HB3 ALA 17 3HB ALA 17 25.534 12.287 3.106
163 H ALA 18 H ALA 18 22.408 10.897 5.092
164 HA ALA 18 HA ALA 18 21.816 12.559 7.314
165 HB1 ALA 18 1HB ALA 18 20.313 11.469 5.380
166 HB2 ALA 18 2HB ALA 18 19.969 10.342 6.693
167 HB3 ALA 18 3HB ALA 18 19.650 12.064 6.902
168 H GLY 19 H GLY 19 23.118 9.417 7.059
169 HA2 GLY 19 1HA GLY 19 24.080 8.728 9.302
170 HA3 GLY 19 2HA GLY 19 22.421 8.845 9.871
171 H ALA 20 H ALA 20 21.880 7.776 6.934
172 HA ALA 20 HA ALA 20 21.227 5.165 7.668
173 HB1 ALA 20 1HB ALA 20 20.599 4.817 5.446
174 HB2 ALA 20 2HB ALA 20 20.391 6.552 5.682
175 HB3 ALA 20 3HB ALA 20 21.809 5.943 4.831
176 H GLN 21 H GLN 21 22.082 3.253 6.190
177 HA GLN 21 HA GLN 21 24.733 3.123 5.371
178 HB2 GLN 21 1HB GLN 21 24.733 3.469 8.064
179 HB3 GLN 21 2HB GLN 21 24.706 1.713 7.964
180 HG2 GLN 21 1HG GLN 21 26.921 1.874 7.827
181 HG3 GLN 21 2HG GLN 21 26.638 2.342 6.151
182 HE21 GLN 21 2HE2 GLN 21 25.991 4.802 6.041
183 HE22 GLN 21 1HE2 GLN 21 27.088 5.854 6.862
184 H GLY 22 H GLY 22 24.465 1.558 3.925
185 HA2 GLY 22 1HA GLY 22 24.358 -1.077 4.249
186 HA3 GLY 22 2HA GLY 22 22.667 -0.666 4.493
187 H GLU 23 H GLU 23 22.371 -2.104 2.621
188 HA GLU 23 HA GLU 23 22.600 -0.566 0.129
189 HB2 GLU 23 1HB GLU 23 24.055 -2.899 0.697
190 HB3 GLU 23 2HB GLU 23 22.762 -3.404 -0.381
191 HG2 GLU 23 1HG GLU 23 23.471 -1.966 -2.089
192 HG3 GLU 23 2HG GLU 23 24.503 -1.043 -0.997
193 H MET 24 H MET 24 20.552 -1.722 2.287
194 HA MET 24 HA MET 24 18.450 -2.130 0.296
195 HB2 MET 24 1HB MET 24 18.190 -3.873 2.649
196 HB3 MET 24 2HB MET 24 17.850 -4.206 0.956
197 HG2 MET 24 1HG MET 24 19.587 -5.642 1.387
198 HG3 MET 24 2HG MET 24 20.426 -4.249 0.706
199 HE1 MET 24 1HE MET 24 23.123 -5.210 3.215
200 HE2 MET 24 2HE MET 24 22.347 -5.850 1.766
201 HE3 MET 24 3HE MET 24 22.878 -4.168 1.813
202 H PHE 25 H PHE 25 16.593 -1.115 0.792
203 HA PHE 25 HA PHE 25 15.813 -0.545 3.491
204 HB2 PHE 25 1HB PHE 25 16.491 1.818 1.733
205 HB3 PHE 25 2HB PHE 25 15.922 1.861 3.398
206 HD1 PHE 25 HD2 PHE 25 18.767 0.913 1.241
207 HD2 PHE 25 HD1 PHE 25 17.420 1.692 5.203
208 HE1 PHE 25 HE2 PHE 25 21.097 0.902 2.032
209 HE2 PHE 25 HE1 PHE 25 19.748 1.683 6.000
210 HZ PHE 25 HZ PHE 25 21.590 1.286 4.414
211 H THR 26 H THR 26 13.685 0.276 3.649
212 HA THR 26 HA THR 26 12.106 -0.187 1.231
213 HB THR 26 HB THR 26 10.407 0.335 3.439
214 HG1 THR 26 1HG THR 26 11.402 -1.656 4.627
215 HG21 THR 26 1HG2 THR 26 11.196 -2.273 2.133
216 HG22 THR 26 2HG2 THR 26 9.932 -1.179 1.574
217 HG23 THR 26 3HG2 THR 26 9.760 -2.007 3.121
218 H VAL 27 H VAL 27 9.883 1.216 1.524
219 HA VAL 27 HA VAL 27 10.475 3.764 0.616
220 HB VAL 27 HB VAL 27 7.915 3.457 2.079
221 HG11 VAL 27 1HG1 VAL 27 7.258 5.003 0.618
222 HG12 VAL 27 2HG1 VAL 27 8.937 5.101 0.085
223 HG13 VAL 27 3HG1 VAL 27 7.806 4.037 -0.752
224 HG21 VAL 27 1HG2 VAL 27 7.097 2.069 0.061
225 HG22 VAL 27 2HG2 VAL 27 8.796 1.636 -0.133
226 HG23 VAL 27 3HG2 VAL 27 7.951 1.243 1.365
227 H LYS 28 H LYS 28 9.332 2.837 3.863
228 HA LYS 28 HA LYS 28 9.467 5.399 4.993
229 HB2 LYS 28 1HB LYS 28 10.040 3.026 6.700
230 HB3 LYS 28 2HB LYS 28 8.966 4.387 6.995
231 HG2 LYS 28 1HG LYS 28 7.419 2.765 6.655
232 HG3 LYS 28 2HG LYS 28 7.630 3.301 4.987
233 HD2 LYS 28 1HD LYS 28 7.952 1.106 4.589
234 HD3 LYS 28 2HD LYS 28 9.587 1.442 5.164
235 HE2 LYS 28 1HE LYS 28 8.897 -0.458 6.360
236 HE3 LYS 28 2HE LYS 28 8.712 0.885 7.487
237 HZ1 LYS 28 1HZ LYS 28 6.741 -0.900 6.483
238 HZ2 LYS 28 2HZ LYS 28 6.308 0.704 6.168
239 HZ3 LYS 28 3HZ LYS 28 6.630 0.211 7.754
240 H GLU 29 H GLU 29 11.821 2.728 5.097
241 HA GLU 29 HA GLU 29 13.781 3.974 6.616
242 HB2 GLU 29 1HB GLU 29 14.171 2.024 4.338
243 HB3 GLU 29 2HB GLU 29 15.366 2.408 5.569
244 HG2 GLU 29 1HG GLU 29 12.768 0.947 5.895
245 HG3 GLU 29 2HG GLU 29 14.402 0.362 6.204
246 H VAL 30 H VAL 30 13.106 4.213 3.170
247 HA VAL 30 HA VAL 30 15.450 5.719 2.539
248 HB VAL 30 HB VAL 30 12.864 5.463 0.998
249 HG11 VAL 30 1HG1 VAL 30 13.727 6.744 -0.618
250 HG12 VAL 30 2HG1 VAL 30 14.870 7.297 0.607
251 HG13 VAL 30 3HG1 VAL 30 15.315 5.989 -0.490
252 HG21 VAL 30 1HG2 VAL 30 15.282 4.061 0.088
253 HG22 VAL 30 2HG2 VAL 30 14.580 3.451 1.586
254 HG23 VAL 30 3HG2 VAL 30 13.602 3.525 0.120
255 H MET 31 H MET 31 12.003 6.649 2.638
256 HA MET 31 HA MET 31 12.333 9.378 2.337
257 HB2 MET 31 1HB MET 31 10.112 9.100 2.317
258 HB3 MET 31 2HB MET 31 10.226 7.592 3.215
259 HG2 MET 31 1HG MET 31 9.970 8.629 5.254
260 HG3 MET 31 2HG MET 31 10.524 10.188 4.648
261 HE1 MET 31 1HE MET 31 9.395 11.055 2.510
262 HE2 MET 31 2HE MET 31 7.654 11.085 2.236
263 HE3 MET 31 3HE MET 31 8.366 12.099 3.491
264 H HIS 32 H HIS 32 12.258 7.488 5.345
265 HA HIS 32 HA HIS 32 12.422 9.517 7.199
266 HB2 HIS 32 1HB HIS 32 12.323 6.920 7.491
267 HB3 HIS 32 2HB HIS 32 14.078 7.044 7.561
268 HD1 HIS 32 HD1 HIS 32 11.338 6.870 9.743
269 HD2 HIS 32 HD2 HIS 32 14.745 9.246 9.614
270 HE1 HIS 32 HE1 HIS 32 11.634 7.749 12.080
271 H TYR 33 H TYR 33 14.941 8.215 5.143
272 HA TYR 33 HA TYR 33 17.097 9.539 6.479
273 HB2 TYR 33 1HB TYR 33 16.847 8.175 3.802
274 HB3 TYR 33 2HB TYR 33 18.335 8.960 4.319
275 HD1 TYR 33 HD2 TYR 33 18.512 8.241 7.139
276 HD2 TYR 33 HD1 TYR 33 17.262 5.893 3.819
277 HE1 TYR 33 HE2 TYR 33 19.174 6.200 8.341
278 HE2 TYR 33 HE1 TYR 33 17.920 3.845 5.012
279 HH TYR 33 HH TYR 33 18.170 3.279 7.695
280 H LEU 34 H LEU 34 15.083 10.235 3.667
281 HA LEU 34 HA LEU 34 16.453 12.415 2.629
282 HB2 LEU 34 1HB LEU 34 13.578 11.609 2.659
283 HB3 LEU 34 2HB LEU 34 14.038 13.175 1.994
284 HG LEU 34 HG LEU 34 15.735 11.293 0.784
285 HD11 LEU 34 1HD1 LEU 34 14.158 9.559 1.564
286 HD12 LEU 34 2HD1 LEU 34 14.228 9.688 -0.193
287 HD13 LEU 34 3HD1 LEU 34 12.865 10.377 0.687
288 HD21 LEU 34 1HD2 LEU 34 13.253 12.634 -0.285
289 HD22 LEU 34 2HD2 LEU 34 14.579 11.973 -1.242
290 HD23 LEU 34 3HD2 LEU 34 14.855 13.366 -0.195
291 H GLY 35 H GLY 35 13.688 12.512 4.890
292 HA2 GLY 35 1HA GLY 35 13.634 15.222 5.386
293 HA3 GLY 35 2HA GLY 35 13.177 14.001 6.565
294 H GLN 36 H GLN 36 15.559 12.780 7.114
295 HA GLN 36 HA GLN 36 16.755 14.627 8.897
296 HB2 GLN 36 1HB GLN 36 17.716 11.900 8.013
297 HB3 GLN 36 2HB GLN 36 18.341 12.802 9.388
298 HG2 GLN 36 1HG GLN 36 15.463 12.499 9.502
299 HG3 GLN 36 2HG GLN 36 16.299 10.948 9.421
300 HE21 GLN 36 2HE2 GLN 36 18.416 11.069 10.866
301 HE22 GLN 36 1HE2 GLN 36 18.114 11.578 12.489
302 H TYR 37 H TYR 37 17.628 13.423 5.718
303 HA TYR 37 HA TYR 37 20.281 14.353 5.647
304 HB2 TYR 37 1HB TYR 37 19.492 12.763 4.005
305 HB3 TYR 37 2HB TYR 37 18.292 13.907 3.413
306 HD1 TYR 37 HD1 TYR 37 21.991 13.860 4.002
307 HD2 TYR 37 HD2 TYR 37 18.789 14.900 1.400
308 HE1 TYR 37 HE1 TYR 37 23.611 14.694 2.350
309 HE2 TYR 37 HE2 TYR 37 20.401 15.735 -0.259
310 HH TYR 37 HH TYR 37 23.725 15.102 -0.074
311 H ILE 38 H ILE 38 17.224 15.888 4.748
312 HA ILE 38 HA ILE 38 18.385 18.262 3.713
313 HB ILE 38 HB ILE 38 15.616 17.994 4.878
314 HG12 ILE 38 1HG1 ILE 38 16.155 17.657 1.961
315 HG13 ILE 38 2HG1 ILE 38 16.469 16.292 3.027
316 HG21 ILE 38 1HG2 ILE 38 16.402 20.277 4.381
317 HG22 ILE 38 2HG2 ILE 38 16.687 19.794 2.710
318 HG23 ILE 38 3HG2 ILE 38 15.048 19.790 3.361
319 HD11 ILE 38 1HD1 ILE 38 14.314 15.873 2.417
320 HD12 ILE 38 2HD1 ILE 38 14.047 16.819 3.882
321 HD13 ILE 38 3HD1 ILE 38 13.896 17.582 2.299
322 H MET 39 H MET 39 17.034 17.404 6.879
323 HA MET 39 HA MET 39 17.360 19.960 8.044
324 HB2 MET 39 1HB MET 39 16.317 19.012 9.784
325 HB3 MET 39 2HB MET 39 16.224 17.551 8.811
326 HG2 MET 39 1HG MET 39 17.127 16.829 10.820
327 HG3 MET 39 2HG MET 39 18.527 16.990 9.762
328 HE1 MET 39 1HE MET 39 17.139 19.477 13.224
329 HE2 MET 39 2HE MET 39 17.049 20.486 11.781
330 HE3 MET 39 3HE MET 39 16.189 18.946 11.836
331 H VAL 40 H VAL 40 19.510 17.265 7.565
332 HA VAL 40 HA VAL 40 21.497 18.168 9.435
333 HB VAL 40 HB VAL 40 21.031 15.791 8.047
334 HG11 VAL 40 1HG1 VAL 40 22.283 16.669 6.142
335 HG12 VAL 40 2HG1 VAL 40 23.663 16.993 7.192
336 HG13 VAL 40 3HG1 VAL 40 23.141 15.332 6.907
337 HG21 VAL 40 1HG2 VAL 40 21.891 16.035 10.328
338 HG22 VAL 40 2HG2 VAL 40 22.894 14.944 9.371
339 HG23 VAL 40 3HG2 VAL 40 23.436 16.593 9.684
340 H LYS 41 H LYS 41 21.005 18.359 5.943
341 HA LYS 41 HA LYS 41 23.510 19.747 5.529
342 HB2 LYS 41 1HB LYS 41 21.345 18.665 3.814
343 HB3 LYS 41 2HB LYS 41 22.232 20.044 3.177
344 HG2 LYS 41 1HG LYS 41 23.358 17.380 4.005
345 HG3 LYS 41 2HG LYS 41 23.254 18.042 2.372
346 HD2 LYS 41 1HD LYS 41 25.383 18.670 2.752
347 HD3 LYS 41 2HD LYS 41 24.636 20.004 3.635
348 HE2 LYS 41 1HE LYS 41 25.658 19.321 5.483
349 HE3 LYS 41 2HE LYS 41 24.760 17.806 5.402
350 HZ1 LYS 41 1HZ LYS 41 26.511 16.911 3.973
351 HZ2 LYS 41 2HZ LYS 41 27.120 17.384 5.479
352 HZ3 LYS 41 3HZ LYS 41 27.382 18.354 4.118
353 H GLN 42 H GLN 42 20.328 20.572 6.381
354 HA GLN 42 HA GLN 42 19.361 22.583 6.847
355 HB2 GLN 42 1HB GLN 42 22.160 23.169 6.786
356 HB3 GLN 42 2HB GLN 42 21.291 24.493 6.020
357 HG2 GLN 42 1HG GLN 42 21.031 25.275 8.086
358 HG3 GLN 42 2HG GLN 42 19.783 24.041 8.245
359 HE21 GLN 42 2HE2 GLN 42 21.495 21.796 8.295
360 HE22 GLN 42 1HE2 GLN 42 22.352 21.815 9.794
361 H LEU 43 H LEU 43 18.809 21.393 4.446
362 HA LEU 43 HA LEU 43 18.718 23.645 2.549
363 HB2 LEU 43 1HB LEU 43 18.138 20.849 1.708
364 HB3 LEU 43 2HB LEU 43 18.817 22.185 0.780
365 HG LEU 43 HG LEU 43 20.347 20.749 2.940
366 HD11 LEU 43 1HD1 LEU 43 20.713 20.234 0.016
367 HD12 LEU 43 2HD1 LEU 43 19.533 19.316 0.950
368 HD13 LEU 43 3HD1 LEU 43 21.238 19.270 1.396
369 HD21 LEU 43 1HD2 LEU 43 20.826 23.118 1.588
370 HD22 LEU 43 2HD2 LEU 43 21.807 21.929 0.731
371 HD23 LEU 43 3HD2 LEU 43 22.010 22.153 2.469
372 H TYR 44 H TYR 44 16.888 24.130 4.233
373 HA TYR 44 HA TYR 44 14.414 23.600 2.877
374 HB2 TYR 44 1HB TYR 44 13.250 22.597 4.789
375 HB3 TYR 44 2HB TYR 44 14.578 21.575 4.251
376 HD1 TYR 44 HD1 TYR 44 16.849 21.931 5.525
377 HD2 TYR 44 HD2 TYR 44 13.041 23.064 7.047
378 HE1 TYR 44 HE1 TYR 44 17.761 21.905 7.809
379 HE2 TYR 44 HE2 TYR 44 13.942 23.043 9.335
380 HH TYR 44 HH TYR 44 16.956 23.239 10.127
381 H ASP 45 H ASP 45 12.539 24.564 4.320
382 HA ASP 45 HA ASP 45 13.413 27.254 5.004
383 HB2 ASP 45 1HB ASP 45 11.530 27.272 3.591
384 HB3 ASP 45 2HB ASP 45 10.729 25.992 4.497
385 H GLN 46 H GLN 46 14.277 27.270 7.017
386 HA GLN 46 HA GLN 46 13.574 25.736 9.200
387 HB2 GLN 46 1HB GLN 46 14.481 28.609 9.375
388 HB3 GLN 46 2HB GLN 46 14.725 27.337 10.565
389 HG2 GLN 46 1HG GLN 46 16.775 27.319 9.616
390 HG3 GLN 46 2HG GLN 46 15.970 26.190 8.527
391 HE21 GLN 46 2HE2 GLN 46 15.907 26.643 6.424
392 HE22 GLN 46 1HE2 GLN 46 16.412 28.133 5.710
393 H GLN 47 H GLN 47 12.105 28.694 8.009
394 HA GLN 47 HA GLN 47 10.476 29.210 10.264
395 HB2 GLN 47 1HB GLN 47 9.527 29.999 7.559
396 HB3 GLN 47 2HB GLN 47 9.593 30.937 9.045
397 HG2 GLN 47 1HG GLN 47 11.748 30.417 7.045
398 HG3 GLN 47 2HG GLN 47 11.177 31.950 7.702
399 HE21 GLN 47 2HE2 GLN 47 13.822 30.334 7.580
400 HE22 GLN 47 1HE2 GLN 47 14.453 30.516 9.178
401 H GLU 48 H GLU 48 10.157 27.096 7.516
402 HA GLU 48 HA GLU 48 7.800 25.898 8.722
403 HB2 GLU 48 1HB GLU 48 7.732 27.518 6.275
404 HB3 GLU 48 2HB GLU 48 7.011 25.924 6.095
405 HG2 GLU 48 1HG GLU 48 5.255 26.420 7.406
406 HG3 GLU 48 2HG GLU 48 6.216 27.406 8.506
407 H GLN 49 H GLN 49 8.931 24.021 9.059
408 HA GLN 49 HA GLN 49 10.711 22.766 7.359
409 HB2 GLN 49 1HB GLN 49 8.804 21.649 9.406
410 HB3 GLN 49 2HB GLN 49 9.940 20.628 8.535
411 HG2 GLN 49 1HG GLN 49 11.222 21.055 10.335
412 HG3 GLN 49 2HG GLN 49 11.639 22.489 9.400
413 HE21 GLN 49 2HE2 GLN 49 11.985 23.952 10.954
414 HE22 GLN 49 1HE2 GLN 49 10.823 24.429 12.140
415 H HIS 50 H HIS 50 7.323 23.115 7.029
416 HA HIS 50 HA HIS 50 6.788 20.830 5.434
417 HB2 HIS 50 1HB HIS 50 4.663 21.749 5.074
418 HB3 HIS 50 2HB HIS 50 5.122 22.380 6.653
419 HD1 HIS 50 HD1 HIS 50 4.369 24.716 6.849
420 HD2 HIS 50 HD2 HIS 50 5.701 23.853 3.010
421 HE1 HIS 50 HE1 HIS 50 4.162 26.868 5.566
422 H MET 51 H MET 51 8.690 23.475 4.823
423 HA MET 51 HA MET 51 8.363 23.144 1.914
424 HB2 MET 51 1HB MET 51 8.012 25.496 3.394
425 HB3 MET 51 2HB MET 51 9.587 25.665 2.630
426 HG2 MET 51 1HG MET 51 7.579 24.657 0.799
427 HG3 MET 51 2HG MET 51 7.138 26.215 1.494
428 HE1 MET 51 1HE MET 51 10.250 24.798 -1.218
429 HE2 MET 51 2HE MET 51 11.263 25.423 0.083
430 HE3 MET 51 3HE MET 51 10.028 24.212 0.432
431 H VAL 52 H VAL 52 10.005 21.771 1.467
432 HA VAL 52 HA VAL 52 12.605 22.083 2.695
433 HB VAL 52 HB VAL 52 11.482 20.144 0.689
434 HG11 VAL 52 1HG1 VAL 52 13.736 20.615 -0.053
435 HG12 VAL 52 2HG1 VAL 52 14.354 20.375 1.583
436 HG13 VAL 52 3HG1 VAL 52 13.674 19.016 0.687
437 HG21 VAL 52 1HG2 VAL 52 12.825 19.522 3.295
438 HG22 VAL 52 2HG2 VAL 52 11.130 20.005 3.239
439 HG23 VAL 52 3HG2 VAL 52 11.663 18.556 2.385
440 H TYR 53 H TYR 53 14.576 22.300 1.440
441 HA TYR 53 HA TYR 53 14.202 23.803 -1.065
442 HB2 TYR 53 1HB TYR 53 15.621 24.577 1.410
443 HB3 TYR 53 2HB TYR 53 16.477 24.906 -0.092
444 HD1 TYR 53 HD2 TYR 53 14.595 25.821 -1.967
445 HD2 TYR 53 HD1 TYR 53 14.586 26.455 2.241
446 HE1 TYR 53 HE2 TYR 53 13.261 27.863 -2.283
447 HE2 TYR 53 HE1 TYR 53 13.251 28.498 1.936
448 HH TYR 53 HH TYR 53 12.962 30.214 -0.147
449 H CYS 54 H CYS 54 15.369 23.097 -2.733
450 HA CYS 54 HA CYS 54 17.391 21.037 -2.226
451 HB2 CYS 54 1HB CYS 54 16.871 20.109 -4.263
452 HB3 CYS 54 2HB CYS 54 15.325 20.854 -3.874
453 HG CYS 54 HG CYS 54 15.677 21.335 -6.542
454 H GLY 55 H GLY 55 16.892 24.086 -3.947
455 HA2 GLY 55 1HA GLY 55 18.382 25.627 -4.768
456 HA3 GLY 55 2HA GLY 55 19.517 24.987 -3.589
457 H GLY 56 H GLY 56 20.810 23.125 -4.205
458 HA2 GLY 56 1HA GLY 56 20.901 22.397 -7.005
459 HA3 GLY 56 2HA GLY 56 22.260 23.372 -6.468
460 H ASP 57 H ASP 57 20.783 21.200 -4.222
461 HA ASP 57 HA ASP 57 23.247 19.684 -4.059
462 HB2 ASP 57 1HB ASP 57 21.061 20.306 -2.290
463 HB3 ASP 57 2HB ASP 57 21.325 18.565 -2.328
464 H LEU 58 H LEU 58 22.804 17.209 -3.535
465 HA LEU 58 HA LEU 58 22.308 15.899 -5.881
466 HB2 LEU 58 1HB LEU 58 22.164 15.054 -3.023
467 HB3 LEU 58 2HB LEU 58 21.661 13.927 -4.281
468 HG LEU 58 HG LEU 58 23.879 13.355 -3.836
469 HD11 LEU 58 1HD1 LEU 58 23.230 13.939 -6.287
470 HD12 LEU 58 2HD1 LEU 58 24.910 13.593 -5.881
471 HD13 LEU 58 3HD1 LEU 58 24.377 15.262 -6.078
472 HD21 LEU 58 1HD2 LEU 58 24.206 15.657 -2.628
473 HD22 LEU 58 2HD2 LEU 58 24.923 16.129 -4.169
474 HD23 LEU 58 3HD2 LEU 58 25.593 14.772 -3.262
475 H LEU 59 H LEU 59 19.983 16.418 -3.238
476 HA LEU 59 HA LEU 59 17.806 15.120 -4.426
477 HB2 LEU 59 1HB LEU 59 16.577 15.898 -2.683
478 HB3 LEU 59 2HB LEU 59 18.194 16.151 -2.028
479 HG LEU 59 HG LEU 59 16.599 18.314 -3.390
480 HD11 LEU 59 1HD1 LEU 59 16.942 18.225 -0.440
481 HD12 LEU 59 2HD1 LEU 59 15.695 17.213 -1.169
482 HD13 LEU 59 3HD1 LEU 59 15.666 18.959 -1.411
483 HD21 LEU 59 1HD2 LEU 59 18.454 19.511 -3.198
484 HD22 LEU 59 2HD2 LEU 59 19.295 18.106 -2.541
485 HD23 LEU 59 3HD2 LEU 59 18.472 19.228 -1.457
486 H GLY 60 H GLY 60 18.991 18.426 -4.729
487 HA2 GLY 60 1HA GLY 60 16.764 19.450 -6.154
488 HA3 GLY 60 2HA GLY 60 18.376 20.149 -6.120
489 H GLU 61 H GLU 61 19.850 18.069 -7.235
490 HA GLU 61 HA GLU 61 19.374 18.511 -9.997
491 HB2 GLU 61 1HB GLU 61 21.163 16.405 -8.780
492 HB3 GLU 61 2HB GLU 61 21.287 17.106 -10.388
493 HG2 GLU 61 1HG GLU 61 21.646 18.650 -7.831
494 HG3 GLU 61 2HG GLU 61 22.963 17.961 -8.778
495 H LEU 62 H LEU 62 18.639 15.883 -7.794
496 HA LEU 62 HA LEU 62 17.877 14.015 -9.812
497 HB2 LEU 62 1HB LEU 62 18.037 14.103 -6.933
498 HB3 LEU 62 2HB LEU 62 16.534 13.345 -7.456
499 HG LEU 62 HG LEU 62 18.162 11.632 -7.092
500 HD11 LEU 62 1HD1 LEU 62 16.649 11.493 -9.093
501 HD12 LEU 62 2HD1 LEU 62 18.114 10.516 -9.183
502 HD13 LEU 62 3HD1 LEU 62 18.013 12.037 -10.070
503 HD21 LEU 62 1HD2 LEU 62 20.067 13.398 -7.591
504 HD22 LEU 62 2HD2 LEU 62 20.000 12.657 -9.190
505 HD23 LEU 62 3HD2 LEU 62 20.339 11.664 -7.771
506 H LEU 63 H LEU 63 16.149 16.350 -7.808
507 HA LEU 63 HA LEU 63 13.573 15.567 -8.857
508 HB2 LEU 63 1HB LEU 63 14.559 17.133 -6.670
509 HB3 LEU 63 2HB LEU 63 13.389 18.076 -7.591
510 HG LEU 63 HG LEU 63 12.700 15.299 -6.723
511 HD11 LEU 63 1HD1 LEU 63 11.859 16.112 -4.620
512 HD12 LEU 63 2HD1 LEU 63 12.393 17.750 -4.995
513 HD13 LEU 63 3HD1 LEU 63 13.582 16.474 -4.733
514 HD21 LEU 63 1HD2 LEU 63 10.521 15.964 -7.047
515 HD22 LEU 63 2HD2 LEU 63 11.354 16.896 -8.292
516 HD23 LEU 63 3HD2 LEU 63 10.885 17.668 -6.776
517 H GLY 64 H GLY 64 16.084 17.739 -9.711
518 HA2 GLY 64 1HA GLY 64 16.306 19.197 -11.470
519 HA3 GLY 64 2HA GLY 64 14.860 18.464 -12.147
520 H ARG 65 H ARG 65 14.308 19.639 -9.041
521 HA ARG 65 HA ARG 65 13.032 22.045 -10.159
522 HB2 ARG 65 1HB ARG 65 12.340 20.748 -7.528
523 HB3 ARG 65 2HB ARG 65 11.390 21.902 -8.454
524 HG2 ARG 65 1HG ARG 65 11.875 19.000 -9.035
525 HG3 ARG 65 2HG ARG 65 10.341 19.825 -8.751
526 HD2 ARG 65 1HD ARG 65 10.418 20.901 -10.849
527 HD3 ARG 65 2HD ARG 65 12.117 20.490 -11.082
528 HE ARG 65 HE ARG 65 10.951 18.071 -10.950
529 HH11 ARG 65 1HH1 ARG 65 10.216 20.935 -12.788
530 HH12 ARG 65 2HH1 ARG 65 9.542 20.063 -14.125
531 HH21 ARG 65 1HH2 ARG 65 10.066 16.911 -12.704
532 HH22 ARG 65 2HH2 ARG 65 9.457 17.774 -14.075
533 H GLN 66 H GLN 66 12.560 23.515 -7.945
534 HA GLN 66 HA GLN 66 15.273 24.237 -7.084
535 HB2 GLN 66 1HB GLN 66 13.830 26.378 -6.359
536 HB3 GLN 66 2HB GLN 66 14.520 26.190 -7.966
537 HG2 GLN 66 1HG GLN 66 11.748 25.251 -7.328
538 HG3 GLN 66 2HG GLN 66 12.084 26.920 -7.784
539 HE21 GLN 66 2HE2 GLN 66 13.311 27.193 -9.835
540 HE22 GLN 66 1HE2 GLN 66 12.926 26.132 -11.143
541 H SER 67 H SER 67 11.957 23.899 -5.861
542 HA SER 67 HA SER 67 12.952 22.934 -3.331
543 HB2 SER 67 1HB SER 67 12.121 24.637 -1.925
544 HB3 SER 67 2HB SER 67 12.943 25.505 -3.221
545 HG SER 67 HG SER 67 10.832 25.683 -4.226
546 H PHE 68 H PHE 68 11.475 21.688 -2.258
547 HA PHE 68 HA PHE 68 8.760 21.566 -3.389
548 HB2 PHE 68 1HB PHE 68 8.831 19.095 -3.028
549 HB3 PHE 68 2HB PHE 68 9.961 19.662 -4.254
550 HD1 PHE 68 HD1 PHE 68 9.624 18.281 -0.881
551 HD2 PHE 68 HD2 PHE 68 12.337 19.543 -3.908
552 HE1 PHE 68 HE1 PHE 68 11.466 17.165 0.309
553 HE2 PHE 68 HE2 PHE 68 14.182 18.428 -2.724
554 HZ PHE 68 HZ PHE 68 13.748 17.236 -0.613
555 H SER 69 H SER 69 7.091 21.019 -1.963
556 HA SER 69 HA SER 69 7.690 21.618 0.824
557 HB2 SER 69 1HB SER 69 4.960 21.167 -0.386
558 HB3 SER 69 2HB SER 69 5.359 22.032 1.098
559 HG SER 69 HG SER 69 5.900 22.815 -1.571
560 H VAL 70 H VAL 70 7.307 20.256 2.529
561 HA VAL 70 HA VAL 70 7.330 17.442 1.948
562 HB VAL 70 HB VAL 70 8.133 17.162 4.027
563 HG11 VAL 70 1HG1 VAL 70 8.213 20.155 4.253
564 HG12 VAL 70 2HG1 VAL 70 9.393 18.974 4.826
565 HG13 VAL 70 3HG1 VAL 70 9.214 19.277 3.097
566 HG21 VAL 70 1HG2 VAL 70 5.996 19.073 4.943
567 HG22 VAL 70 2HG2 VAL 70 6.060 17.325 5.168
568 HG23 VAL 70 3HG2 VAL 70 7.189 18.367 6.033
569 H LYS 71 H LYS 71 5.009 19.769 3.174
570 HA LYS 71 HA LYS 71 3.083 17.885 4.069
571 HB2 LYS 71 1HB LYS 71 3.288 20.408 4.610
572 HB3 LYS 71 2HB LYS 71 2.405 20.652 3.108
573 HG2 LYS 71 1HG LYS 71 0.557 20.469 4.324
574 HG3 LYS 71 2HG LYS 71 0.912 18.743 4.421
575 HD2 LYS 71 1HD LYS 71 0.501 19.668 6.638
576 HD3 LYS 71 2HD LYS 71 2.173 19.124 6.488
577 HE2 LYS 71 1HE LYS 71 2.995 21.306 6.365
578 HE3 LYS 71 2HE LYS 71 1.418 21.974 5.948
579 HZ1 LYS 71 1HZ LYS 71 1.158 20.742 8.426
580 HZ2 LYS 71 2HZ LYS 71 1.108 22.398 8.084
581 HZ3 LYS 71 3HZ LYS 71 2.576 21.663 8.495
582 H ASP 72 H ASP 72 3.971 19.062 0.967
583 HA ASP 72 HA ASP 72 1.524 17.921 -0.210
584 HB2 ASP 72 1HB ASP 72 1.981 20.329 -0.700
585 HB3 ASP 72 2HB ASP 72 3.472 19.841 -1.500
586 HA PRO 73 HA PRO 73 4.665 14.783 -1.255
587 HB2 PRO 73 1HB PRO 73 2.866 12.761 -1.470
588 HB3 PRO 73 2HB PRO 73 3.542 13.285 0.077
589 HG2 PRO 73 1HG PRO 73 0.903 13.961 -1.163
590 HG3 PRO 73 2HG PRO 73 1.273 13.539 0.519
591 HD2 PRO 73 1HD PRO 73 0.903 16.095 -0.295
592 HD3 PRO 73 2HD PRO 73 2.016 15.663 1.020
593 H SER 74 H SER 74 4.077 16.569 -3.196
594 HA SER 74 HA SER 74 2.823 15.111 -5.400
595 HB2 SER 74 1HB SER 74 3.285 17.943 -4.760
596 HB3 SER 74 2HB SER 74 3.579 17.529 -6.449
597 HG SER 74 HG SER 74 1.255 17.912 -5.259
598 HA PRO 75 HA PRO 75 7.087 16.066 -7.383
599 HB2 PRO 75 1HB PRO 75 8.892 17.496 -5.944
600 HB3 PRO 75 2HB PRO 75 7.679 18.251 -6.985
601 HG2 PRO 75 1HG PRO 75 7.647 17.857 -4.018
602 HG3 PRO 75 2HG PRO 75 7.174 19.281 -4.963
603 HD2 PRO 75 1HD PRO 75 5.367 17.530 -3.963
604 HD3 PRO 75 2HD PRO 75 5.108 18.403 -5.487
605 H LEU 76 H LEU 76 7.019 15.451 -3.933
606 HA LEU 76 HA LEU 76 9.476 14.147 -3.641
607 HB2 LEU 76 1HB LEU 76 7.964 14.879 -1.801
608 HB3 LEU 76 2HB LEU 76 6.914 13.516 -2.184
609 HG LEU 76 HG LEU 76 8.970 12.052 -1.712
610 HD11 LEU 76 1HD1 LEU 76 9.904 14.729 -0.814
611 HD12 LEU 76 2HD1 LEU 76 10.800 13.413 -1.571
612 HD13 LEU 76 3HD1 LEU 76 10.358 13.312 0.133
613 HD21 LEU 76 1HD2 LEU 76 8.068 11.641 0.303
614 HD22 LEU 76 2HD2 LEU 76 6.866 12.835 -0.187
615 HD23 LEU 76 3HD2 LEU 76 8.224 13.316 0.831
616 H TYR 77 H TYR 77 6.250 12.717 -4.165
617 HA TYR 77 HA TYR 77 7.241 10.084 -4.533
618 HB2 TYR 77 1HB TYR 77 4.607 11.422 -5.077
619 HB3 TYR 77 2HB TYR 77 4.897 9.766 -5.597
620 HD1 TYR 77 HD2 TYR 77 5.543 8.053 -3.830
621 HD2 TYR 77 HD1 TYR 77 3.997 11.896 -2.860
622 HE1 TYR 77 HE2 TYR 77 4.948 7.241 -1.586
623 HE2 TYR 77 HE1 TYR 77 3.398 11.095 -0.613
624 HH TYR 77 HH TYR 77 4.031 9.336 0.943
625 H ASP 78 H ASP 78 6.276 12.651 -6.772
626 HA ASP 78 HA ASP 78 6.466 11.259 -9.166
627 HB2 ASP 78 1HB ASP 78 5.821 13.783 -8.556
628 HB3 ASP 78 2HB ASP 78 7.466 14.060 -9.120
629 H MET 79 H MET 79 8.993 12.816 -7.256
630 HA MET 79 HA MET 79 11.061 12.366 -9.175
631 HB2 MET 79 1HB MET 79 11.309 14.165 -7.592
632 HB3 MET 79 2HB MET 79 11.149 13.056 -6.236
633 HG2 MET 79 1HG MET 79 13.264 11.983 -7.557
634 HG3 MET 79 2HG MET 79 13.478 13.700 -7.886
635 HE1 MET 79 1HE MET 79 13.181 11.826 -3.711
636 HE2 MET 79 2HE MET 79 11.770 12.692 -4.320
637 HE3 MET 79 3HE MET 79 12.383 11.282 -5.187
638 H LEU 80 H LEU 80 10.199 10.813 -6.090
639 HA LEU 80 HA LEU 80 12.186 8.873 -6.046
640 HB2 LEU 80 1HB LEU 80 9.351 8.736 -5.035
641 HB3 LEU 80 2HB LEU 80 10.603 7.560 -4.644
642 HG LEU 80 HG LEU 80 10.794 10.487 -3.954
643 HD11 LEU 80 1HD1 LEU 80 9.444 10.180 -2.225
644 HD12 LEU 80 2HD1 LEU 80 10.397 8.798 -1.686
645 HD13 LEU 80 3HD1 LEU 80 9.073 8.564 -2.827
646 HD21 LEU 80 1HD2 LEU 80 12.887 9.088 -4.135
647 HD22 LEU 80 2HD2 LEU 80 12.268 8.140 -2.782
648 HD23 LEU 80 3HD2 LEU 80 12.609 9.859 -2.573
649 H ARG 81 H ARG 81 9.055 8.867 -7.673
650 HA ARG 81 HA ARG 81 8.612 6.347 -8.436
651 HB2 ARG 81 1HB ARG 81 7.660 8.679 -9.314
652 HB3 ARG 81 2HB ARG 81 8.680 8.287 -10.692
653 HG2 ARG 81 1HG ARG 81 7.383 5.939 -10.343
654 HG3 ARG 81 2HG ARG 81 6.154 7.087 -9.806
655 HD2 ARG 81 1HD ARG 81 7.370 8.088 -12.181
656 HD3 ARG 81 2HD ARG 81 6.900 6.411 -12.453
657 HE ARG 81 HE ARG 81 5.168 8.618 -12.343
658 HH11 ARG 81 1HH1 ARG 81 5.414 5.341 -11.193
659 HH12 ARG 81 2HH1 ARG 81 3.700 5.094 -11.136
660 HH21 ARG 81 1HH2 ARG 81 2.909 8.305 -12.272
661 HH22 ARG 81 2HH2 ARG 81 2.276 6.781 -11.751
662 H LYS 82 H LYS 82 10.881 8.452 -10.212
663 HA LYS 82 HA LYS 82 12.165 6.027 -11.276
664 HB2 LYS 82 1HB LYS 82 12.522 7.098 -13.241
665 HB3 LYS 82 2HB LYS 82 11.182 8.098 -12.697
666 HG2 LYS 82 1HG LYS 82 14.095 8.743 -12.292
667 HG3 LYS 82 2HG LYS 82 13.067 9.415 -13.560
668 HD2 LYS 82 1HD LYS 82 12.625 9.715 -10.589
669 HD3 LYS 82 2HD LYS 82 13.287 10.951 -11.661
670 HE2 LYS 82 1HE LYS 82 11.062 10.508 -12.995
671 HE3 LYS 82 2HE LYS 82 10.500 9.920 -11.431
672 HZ1 LYS 82 1HZ LYS 82 10.783 12.580 -12.311
673 HZ2 LYS 82 2HZ LYS 82 11.795 12.336 -10.979
674 HZ3 LYS 82 3HZ LYS 82 10.140 12.011 -10.853
675 H ASN 83 H ASN 83 12.524 8.218 -8.872
676 HA ASN 83 HA ASN 83 15.429 8.454 -9.101
677 HB2 ASN 83 1HB ASN 83 14.194 10.476 -8.485
678 HB3 ASN 83 2HB ASN 83 13.507 9.647 -7.091
679 HD21 ASN 83 2HD2 ASN 83 14.356 10.738 -5.437
680 HD22 ASN 83 1HD2 ASN 83 16.048 10.938 -5.146
681 H LEU 84 H LEU 84 12.992 7.309 -6.773
682 HA LEU 84 HA LEU 84 15.047 5.931 -5.244
683 HB2 LEU 84 1HB LEU 84 12.679 7.146 -4.563
684 HB3 LEU 84 2HB LEU 84 12.265 5.434 -4.512
685 HG LEU 84 HG LEU 84 12.879 6.106 -2.311
686 HD11 LEU 84 1HD1 LEU 84 13.658 3.961 -2.566
687 HD12 LEU 84 2HD1 LEU 84 15.133 4.804 -2.093
688 HD13 LEU 84 3HD1 LEU 84 14.843 4.419 -3.789
689 HD21 LEU 84 1HD2 LEU 84 15.520 6.825 -2.294
690 HD22 LEU 84 2HD2 LEU 84 14.157 7.935 -2.161
691 HD23 LEU 84 3HD2 LEU 84 14.912 7.649 -3.730
692 H VAL 85 H VAL 85 15.739 4.090 -6.142
693 HA VAL 85 HA VAL 85 14.675 2.453 -7.981
694 HB VAL 85 HB VAL 85 16.318 1.797 -5.566
695 HG11 VAL 85 1HG1 VAL 85 14.957 -0.170 -5.830
696 HG12 VAL 85 2HG1 VAL 85 15.264 -0.196 -7.568
697 HG13 VAL 85 3HG1 VAL 85 16.578 -0.511 -6.434
698 HG21 VAL 85 1HG2 VAL 85 16.858 1.584 -8.526
699 HG22 VAL 85 2HG2 VAL 85 17.335 2.935 -7.497
700 HG23 VAL 85 3HG2 VAL 85 18.025 1.335 -7.228
701 H THR 86 H THR 86 13.118 0.928 -8.181
702 HA THR 86 HA THR 86 11.611 0.140 -5.788
703 HB THR 86 HB THR 86 9.499 0.313 -7.214
704 HG1 THR 86 1HG THR 86 10.970 2.248 -8.669
705 HG21 THR 86 1HG2 THR 86 9.462 2.895 -6.888
706 HG22 THR 86 2HG2 THR 86 11.031 2.643 -6.125
707 HG23 THR 86 3HG2 THR 86 9.598 1.847 -5.478
708 H LEU 87 H LEU 87 11.515 -1.997 -5.665
709 HA LEU 87 HA LEU 87 11.713 -3.563 -8.150
710 HB2 LEU 87 1HB LEU 87 12.306 -4.482 -5.344
711 HB3 LEU 87 2HB LEU 87 12.631 -5.354 -6.840
712 HG LEU 87 HG LEU 87 14.092 -3.120 -7.255
713 HD11 LEU 87 1HD1 LEU 87 15.153 -2.369 -5.299
714 HD12 LEU 87 2HD1 LEU 87 14.469 -3.672 -4.327
715 HD13 LEU 87 3HD1 LEU 87 13.430 -2.375 -4.918
716 HD21 LEU 87 1HD2 LEU 87 14.734 -5.553 -7.386
717 HD22 LEU 87 2HD2 LEU 87 15.119 -5.463 -5.667
718 HD23 LEU 87 3HD2 LEU 87 15.999 -4.460 -6.822
719 H ALA 88 H ALA 88 10.124 -4.933 -8.703
720 HA ALA 88 HA ALA 88 8.079 -5.934 -8.728
721 HB1 ALA 88 1HB ALA 88 8.178 -6.295 -5.770
722 HB2 ALA 88 2HB ALA 88 7.657 -7.419 -7.026
723 HB3 ALA 88 3HB ALA 88 9.375 -7.107 -6.779
724 H THR 89 H THR 89 6.549 -4.477 -9.231
725 HA THR 89 HA THR 89 5.753 -2.359 -7.492
726 HB THR 89 HB THR 89 4.316 -3.406 -9.938
727 HG1 THR 89 1HG THR 89 6.494 -1.647 -9.593
728 HG21 THR 89 1HG2 THR 89 3.963 -1.047 -8.167
729 HG22 THR 89 2HG2 THR 89 2.761 -1.993 -9.045
730 HG23 THR 89 3HG2 THR 89 3.745 -0.806 -9.900
731 H1 SER 115 H SER 115 0.984 25.315 10.786
732 HA SER 115 HA SER 115 1.953 25.020 8.017
733 HB2 SER 115 1HB SER 115 1.000 27.333 9.390
734 HB3 SER 115 2HB SER 115 2.722 27.551 9.080
735 HG SER 115 HG SER 115 0.785 26.819 7.137
736 H GLN 116 H GLN 116 2.872 25.723 11.360
737 HA GLN 116 HA GLN 116 5.674 25.163 10.668
738 HB2 GLN 116 1HB GLN 116 4.964 26.196 13.359
739 HB3 GLN 116 2HB GLN 116 6.344 26.574 12.335
740 HG2 GLN 116 1HG GLN 116 4.336 27.652 10.885
741 HG3 GLN 116 2HG GLN 116 3.714 27.863 12.521
742 HE21 GLN 116 2HE2 GLN 116 6.987 28.000 11.167
743 HE22 GLN 116 1HE2 GLN 116 7.337 29.598 11.723
744 H GLU 117 H GLU 117 6.514 23.272 11.229
745 HA GLU 117 HA GLU 117 5.992 21.994 13.709
746 HB2 GLU 117 1HB GLU 117 5.164 19.878 12.177
747 HB3 GLU 117 2HB GLU 117 4.111 20.907 13.137
748 HG2 GLU 117 1HG GLU 117 4.758 21.800 10.389
749 HG3 GLU 117 2HG GLU 117 3.675 20.420 10.570
750 H THR 118 H THR 118 7.737 20.842 14.224
751 HA THR 118 HA THR 118 10.013 20.703 12.676
752 HB THR 118 HB THR 118 9.180 18.830 14.899
753 HG1 THR 118 1HG THR 118 9.425 21.184 15.303
754 HG21 THR 118 1HG2 THR 118 11.940 19.350 13.787
755 HG22 THR 118 2HG2 THR 118 10.988 17.895 13.490
756 HG23 THR 118 3HG2 THR 118 11.529 18.276 15.124
757 H PHE 119 H PHE 119 11.048 19.034 11.521
758 HA PHE 119 HA PHE 119 9.623 17.719 9.607
759 HB2 PHE 119 1HB PHE 119 12.329 17.667 10.567
760 HB3 PHE 119 2HB PHE 119 11.820 16.028 10.174
761 HD1 PHE 119 HD2 PHE 119 9.869 16.875 7.953
762 HD2 PHE 119 HD1 PHE 119 13.912 17.895 8.808
763 HE1 PHE 119 HE2 PHE 119 10.256 17.329 5.567
764 HE2 PHE 119 HE1 PHE 119 14.305 18.352 6.423
765 HZ PHE 119 HZ PHE 119 12.476 18.068 4.798
766 H SER 120 H SER 120 10.881 16.181 12.570
767 HA SER 120 HA SER 120 9.759 13.681 12.243
768 HB2 SER 120 1HB SER 120 10.974 15.161 14.386
769 HB3 SER 120 2HB SER 120 9.585 14.270 15.006
770 HG SER 120 HG SER 120 11.189 12.817 15.090
771 H ASP 121 H ASP 121 8.201 16.656 12.930
772 HA ASP 121 HA ASP 121 5.817 15.469 14.053
773 HB2 ASP 121 1HB ASP 121 6.938 18.075 13.927
774 HB3 ASP 121 2HB ASP 121 5.364 18.143 13.140
775 H LEU 122 H LEU 122 6.547 17.289 11.072
776 HA LEU 122 HA LEU 122 4.053 16.454 9.873
777 HB2 LEU 122 1HB LEU 122 5.438 18.686 9.588
778 HB3 LEU 122 2HB LEU 122 6.217 17.763 8.305
779 HG LEU 122 HG LEU 122 3.977 17.420 7.275
780 HD11 LEU 122 1HD1 LEU 122 2.768 19.644 8.730
781 HD12 LEU 122 2HD1 LEU 122 2.999 18.195 9.707
782 HD13 LEU 122 3HD1 LEU 122 2.069 18.110 8.211
783 HD21 LEU 122 1HD2 LEU 122 5.667 19.435 6.934
784 HD22 LEU 122 2HD2 LEU 122 4.294 20.359 7.545
785 HD23 LEU 122 3HD2 LEU 122 4.115 19.364 6.099
786 H TRP 123 H TRP 123 7.512 15.994 9.156
787 HA TRP 123 HA TRP 123 7.533 14.460 6.966
788 HB2 TRP 123 1HB TRP 123 9.443 15.008 8.656
789 HB3 TRP 123 2HB TRP 123 9.051 13.434 9.344
790 HD1 TRP 123 HD1 TRP 123 10.465 11.537 8.394
791 HE1 TRP 123 HE1 TRP 123 11.726 11.087 6.195
792 HE3 TRP 123 HE3 TRP 123 9.209 15.791 5.852
793 HZ2 TRP 123 HZ2 TRP 123 12.135 12.367 3.713
794 HZ3 TRP 123 HZ3 TRP 123 10.077 16.102 3.571
795 HH2 TRP 123 HH2 TRP 123 11.510 14.424 2.525
796 H LYS 124 H LYS 124 7.045 13.054 10.211
797 HA LYS 124 HA LYS 124 6.551 10.449 9.509
798 HB2 LYS 124 1HB LYS 124 5.846 12.180 11.773
799 HB3 LYS 124 2HB LYS 124 4.750 10.823 11.545
800 HG2 LYS 124 1HG LYS 124 6.376 9.258 11.984
801 HG3 LYS 124 2HG LYS 124 7.693 10.345 11.537
802 HD2 LYS 124 1HD LYS 124 7.973 10.802 13.696
803 HD3 LYS 124 2HD LYS 124 6.381 11.563 13.699
804 HE2 LYS 124 1HE LYS 124 7.115 8.745 14.434
805 HE3 LYS 124 2HE LYS 124 6.312 9.964 15.423
806 HZ1 LYS 124 1HZ LYS 124 5.201 8.162 13.444
807 HZ2 LYS 124 2HZ LYS 124 4.603 9.743 13.387
808 HZ3 LYS 124 3HZ LYS 124 4.481 8.844 14.815
809 H LEU 125 H LEU 125 4.287 13.163 9.482
810 HA LEU 125 HA LEU 125 1.879 11.989 9.089
811 HB2 LEU 125 1HB LEU 125 2.488 14.460 9.045
812 HB3 LEU 125 2HB LEU 125 2.809 14.239 7.326
813 HG LEU 125 HG LEU 125 0.484 13.643 6.946
814 HD11 LEU 125 1HD1 LEU 125 -1.040 14.197 9.026
815 HD12 LEU 125 2HD1 LEU 125 0.395 13.688 9.916
816 HD13 LEU 125 3HD1 LEU 125 -0.373 12.583 8.776
817 HD21 LEU 125 1HD2 LEU 125 -0.361 15.946 8.219
818 HD22 LEU 125 2HD2 LEU 125 0.345 15.840 6.606
819 HD23 LEU 125 3HD2 LEU 125 1.370 16.199 7.996
820 H LEU 126 H LEU 126 4.319 12.529 6.560
821 HA LEU 126 HA LEU 126 2.882 11.459 4.418
822 HB2 LEU 126 1HB LEU 126 5.699 12.054 5.013
823 HB3 LEU 126 2HB LEU 126 5.439 10.825 3.777
824 HG LEU 126 HG LEU 126 3.816 12.670 2.793
825 HD11 LEU 126 1HD1 LEU 126 4.133 14.799 3.438
826 HD12 LEU 126 2HD1 LEU 126 5.859 14.571 3.714
827 HD13 LEU 126 3HD1 LEU 126 4.697 14.061 4.938
828 HD21 LEU 126 1HD2 LEU 126 5.588 13.349 1.325
829 HD22 LEU 126 2HD2 LEU 126 5.812 11.645 1.723
830 HD23 LEU 126 3HD2 LEU 126 6.810 12.873 2.504
831 HA PRO 127 HA PRO 127 2.795 7.218 5.898
832 HB2 PRO 127 1HB PRO 127 1.088 6.341 3.977
833 HB3 PRO 127 2HB PRO 127 0.550 7.228 5.408
834 HG2 PRO 127 1HG PRO 127 1.027 8.230 2.627
835 HG3 PRO 127 2HG PRO 127 -0.307 8.598 3.736
836 HD2 PRO 127 1HD PRO 127 1.784 10.277 3.364
837 HD3 PRO 127 2HD PRO 127 0.933 10.141 4.916
838 H GLU 128 H GLU 128 5.142 7.643 4.837
839 HA GLU 128 HA GLU 128 6.732 7.047 3.264
840 HB2 GLU 128 1HB GLU 128 6.396 4.363 3.002
841 HB3 GLU 128 2HB GLU 128 7.158 5.138 4.384
842 HG2 GLU 128 1HG GLU 128 4.225 4.498 4.251
843 HG3 GLU 128 2HG GLU 128 5.434 3.411 4.932
844 H ASN 129 H ASN 129 4.600 4.464 2.254
845 HA ASN 129 HA ASN 129 3.787 3.869 0.214
846 HB2 ASN 129 1HB ASN 129 2.989 6.597 0.682
847 HB3 ASN 129 2HB ASN 129 3.250 6.338 -1.040
848 HD21 ASN 129 2HD2 ASN 129 1.796 4.640 1.719
849 HD22 ASN 129 1HD2 ASN 129 0.377 4.133 0.874
Start of MODEL 17
1 H1 GLN 1 H GLN 1 2.811 0.170 3.056
2 HA GLN 1 HA GLN 1 1.895 -1.947 1.225
3 HB2 GLN 1 1HB GLN 1 2.792 0.849 0.649
4 HB3 GLN 1 2HB GLN 1 3.088 -0.413 -0.540
5 HG2 GLN 1 1HG GLN 1 1.024 0.835 -0.976
6 HG3 GLN 1 2HG GLN 1 0.733 -0.881 -0.699
7 HE21 GLN 1 2HE2 GLN 1 -0.119 2.245 0.156
8 HE22 GLN 1 1HE2 GLN 1 -1.070 1.881 1.552
9 H ILE 2 H ILE 2 4.662 -0.073 2.392
10 HA ILE 2 HA ILE 2 6.886 -0.545 2.529
11 HB ILE 2 HB ILE 2 6.497 -3.472 2.428
12 HG12 ILE 2 1HG1 ILE 2 4.412 -2.992 3.460
13 HG13 ILE 2 2HG1 ILE 2 5.512 -3.397 4.773
14 HG21 ILE 2 1HG2 ILE 2 7.581 -2.551 4.869
15 HG22 ILE 2 2HG2 ILE 2 8.418 -3.325 3.525
16 HG23 ILE 2 3HG2 ILE 2 8.275 -1.568 3.581
17 HD11 ILE 2 1HD1 ILE 2 3.911 -1.137 4.546
18 HD12 ILE 2 2HD1 ILE 2 5.178 -1.434 5.736
19 HD13 ILE 2 3HD1 ILE 2 5.553 -0.571 4.245
20 H ASN 3 H ASN 3 7.975 -0.034 0.735
21 HA ASN 3 HA ASN 3 8.007 -2.000 -1.461
22 HB2 ASN 3 1HB ASN 3 7.114 0.606 -1.625
23 HB3 ASN 3 2HB ASN 3 8.774 0.727 -2.201
24 HD21 ASN 3 2HD2 ASN 3 6.102 -1.590 -2.534
25 HD22 ASN 3 1HD2 ASN 3 6.207 -1.720 -4.254
26 H GLN 4 H GLN 4 9.914 -2.922 -1.784
27 HA GLN 4 HA GLN 4 12.237 -2.149 -0.355
28 HB2 GLN 4 1HB GLN 4 12.327 -3.928 -2.768
29 HB3 GLN 4 2HB GLN 4 13.270 -4.024 -1.286
30 HG2 GLN 4 1HG GLN 4 10.453 -4.887 -1.785
31 HG3 GLN 4 2HG GLN 4 11.803 -5.810 -1.126
32 HE21 GLN 4 2HE2 GLN 4 9.053 -4.028 -0.414
33 HE22 GLN 4 1HE2 GLN 4 9.278 -3.876 1.291
34 H VAL 5 H VAL 5 14.354 -1.695 -1.389
35 HA VAL 5 HA VAL 5 14.254 -0.354 -3.965
36 HB VAL 5 HB VAL 5 15.137 1.747 -3.186
37 HG11 VAL 5 1HG1 VAL 5 12.813 1.190 -1.372
38 HG12 VAL 5 2HG1 VAL 5 13.195 2.665 -2.262
39 HG13 VAL 5 3HG1 VAL 5 12.626 1.235 -3.124
40 HG21 VAL 5 1HG2 VAL 5 16.123 2.041 -1.210
41 HG22 VAL 5 2HG2 VAL 5 14.721 1.417 -0.340
42 HG23 VAL 5 3HG2 VAL 5 15.945 0.305 -0.954
43 H ARG 6 H ARG 6 16.517 0.571 -4.477
44 HA ARG 6 HA ARG 6 18.675 -0.912 -3.198
45 HB2 ARG 6 1HB ARG 6 17.480 -1.879 -5.530
46 HB3 ARG 6 2HB ARG 6 18.947 -1.082 -6.081
47 HG2 ARG 6 1HG ARG 6 20.204 -2.422 -4.376
48 HG3 ARG 6 2HG ARG 6 18.713 -3.323 -4.091
49 HD2 ARG 6 1HD ARG 6 18.713 -4.228 -6.248
50 HD3 ARG 6 2HD ARG 6 19.853 -3.025 -6.849
51 HE ARG 6 HE ARG 6 21.567 -4.355 -6.135
52 HH11 ARG 6 1HH1 ARG 6 18.630 -5.355 -4.554
53 HH12 ARG 6 2HH1 ARG 6 19.345 -6.754 -3.825
54 HH21 ARG 6 1HH2 ARG 6 22.520 -6.194 -5.179
55 HH22 ARG 6 2HH2 ARG 6 21.558 -7.230 -4.180
56 HA PRO 7 HA PRO 7 19.842 3.408 -4.308
57 HB2 PRO 7 1HB PRO 7 21.208 3.856 -2.005
58 HB3 PRO 7 2HB PRO 7 19.461 4.085 -2.146
59 HG2 PRO 7 1HG PRO 7 20.983 1.769 -1.013
60 HG3 PRO 7 2HG PRO 7 19.531 2.569 -0.384
61 HD2 PRO 7 1HD PRO 7 19.432 0.233 -1.749
62 HD3 PRO 7 2HD PRO 7 18.131 1.439 -1.824
63 H LYS 8 H LYS 8 21.512 3.572 -5.652
64 HA LYS 8 HA LYS 8 23.745 1.770 -5.525
65 HB2 LYS 8 1HB LYS 8 23.552 4.218 -7.270
66 HB3 LYS 8 2HB LYS 8 24.454 2.738 -7.569
67 HG2 LYS 8 1HG LYS 8 21.507 2.529 -7.299
68 HG3 LYS 8 2HG LYS 8 22.157 3.255 -8.770
69 HD2 LYS 8 1HD LYS 8 23.323 0.688 -7.804
70 HD3 LYS 8 2HD LYS 8 21.746 0.658 -8.596
71 HE2 LYS 8 1HE LYS 8 23.046 2.188 -10.345
72 HE3 LYS 8 2HE LYS 8 24.425 1.299 -9.700
73 HZ1 LYS 8 1HZ LYS 8 23.487 -0.739 -10.366
74 HZ2 LYS 8 2HZ LYS 8 23.306 0.295 -11.692
75 HZ3 LYS 8 3HZ LYS 8 21.980 -0.045 -10.697
76 H LEU 9 H LEU 9 25.781 3.571 -6.423
77 HA LEU 9 HA LEU 9 26.977 4.255 -3.992
78 HB2 LEU 9 1HB LEU 9 28.569 4.060 -5.583
79 HB3 LEU 9 2HB LEU 9 27.533 4.716 -6.849
80 HG LEU 9 HG LEU 9 27.970 6.991 -5.968
81 HD11 LEU 9 1HD1 LEU 9 29.880 5.528 -4.153
82 HD12 LEU 9 2HD1 LEU 9 28.477 6.483 -3.673
83 HD13 LEU 9 3HD1 LEU 9 29.872 7.273 -4.410
84 HD21 LEU 9 1HD2 LEU 9 29.744 7.180 -7.323
85 HD22 LEU 9 2HD2 LEU 9 29.520 5.453 -7.601
86 HD23 LEU 9 3HD2 LEU 9 30.694 6.010 -6.407
87 HA PRO 10 HA PRO 10 25.868 8.863 -4.900
88 HB2 PRO 10 1HB PRO 10 24.167 9.363 -6.956
89 HB3 PRO 10 2HB PRO 10 25.921 9.282 -7.158
90 HG2 PRO 10 1HG PRO 10 23.851 7.196 -7.727
91 HG3 PRO 10 2HG PRO 10 25.262 7.666 -8.694
92 HD2 PRO 10 1HD PRO 10 25.246 5.469 -7.111
93 HD3 PRO 10 2HD PRO 10 26.714 6.421 -7.408
94 H LEU 11 H LEU 11 23.733 6.241 -4.824
95 HA LEU 11 HA LEU 11 21.515 7.897 -3.838
96 HB2 LEU 11 1HB LEU 11 21.601 5.664 -5.538
97 HB3 LEU 11 2HB LEU 11 20.887 5.100 -4.028
98 HG LEU 11 HG LEU 11 19.358 7.212 -4.322
99 HD11 LEU 11 1HD1 LEU 11 20.269 6.658 -7.141
100 HD12 LEU 11 2HD1 LEU 11 20.497 8.152 -6.232
101 HD13 LEU 11 3HD1 LEU 11 18.874 7.643 -6.700
102 HD21 LEU 11 1HD2 LEU 11 17.819 5.783 -5.734
103 HD22 LEU 11 2HD2 LEU 11 18.414 5.049 -4.245
104 HD23 LEU 11 3HD2 LEU 11 19.126 4.600 -5.795
105 H LEU 12 H LEU 12 23.918 5.622 -2.890
106 HA LEU 12 HA LEU 12 22.639 4.789 -0.460
107 HB2 LEU 12 1HB LEU 12 24.323 3.430 -1.673
108 HB3 LEU 12 2HB LEU 12 25.548 4.620 -1.235
109 HG LEU 12 HG LEU 12 25.518 3.992 1.018
110 HD11 LEU 12 1HD1 LEU 12 23.713 2.143 1.640
111 HD12 LEU 12 2HD1 LEU 12 22.806 2.983 0.382
112 HD13 LEU 12 3HD1 LEU 12 23.388 3.870 1.791
113 HD21 LEU 12 1HD2 LEU 12 26.709 2.333 -0.121
114 HD22 LEU 12 2HD2 LEU 12 25.245 1.614 -0.794
115 HD23 LEU 12 3HD2 LEU 12 25.608 1.435 0.924
116 H LYS 13 H LYS 13 25.411 6.907 -1.191
117 HA LYS 13 HA LYS 13 25.981 7.766 1.372
118 HB2 LYS 13 1HB LYS 13 27.231 9.480 0.406
119 HB3 LYS 13 2HB LYS 13 27.181 8.266 -0.865
120 HG2 LYS 13 1HG LYS 13 26.568 9.966 -2.175
121 HG3 LYS 13 2HG LYS 13 24.975 9.744 -1.447
122 HD2 LYS 13 1HD LYS 13 25.137 11.895 -0.848
123 HD3 LYS 13 2HD LYS 13 26.263 11.330 0.388
124 HE2 LYS 13 1HE LYS 13 27.227 11.973 -2.373
125 HE3 LYS 13 2HE LYS 13 26.971 13.258 -1.194
126 HZ1 LYS 13 1HZ LYS 13 28.779 12.666 -0.042
127 HZ2 LYS 13 2HZ LYS 13 29.246 11.857 -1.452
128 HZ3 LYS 13 3HZ LYS 13 28.484 11.008 -0.202
129 H ILE 14 H ILE 14 23.356 8.675 -0.722
130 HA ILE 14 HA ILE 14 22.593 11.077 0.527
131 HB ILE 14 HB ILE 14 20.700 9.124 -0.772
132 HG12 ILE 14 1HG1 ILE 14 22.693 11.022 -1.980
133 HG13 ILE 14 2HG1 ILE 14 22.376 9.342 -2.399
134 HG21 ILE 14 1HG2 ILE 14 20.659 12.118 -0.430
135 HG22 ILE 14 2HG2 ILE 14 19.505 11.205 -1.400
136 HG23 ILE 14 3HG2 ILE 14 19.593 10.944 0.342
137 HD11 ILE 14 1HD1 ILE 14 20.907 11.804 -3.185
138 HD12 ILE 14 2HD1 ILE 14 21.423 10.432 -4.166
139 HD13 ILE 14 3HD1 ILE 14 20.035 10.274 -3.089
140 H LEU 15 H LEU 15 21.304 7.778 0.953
141 HA LEU 15 HA LEU 15 19.649 8.493 3.154
142 HB2 LEU 15 1HB LEU 15 20.612 5.703 2.712
143 HB3 LEU 15 2HB LEU 15 19.030 6.269 3.244
144 HG LEU 15 HG LEU 15 20.138 6.263 0.443
145 HD11 LEU 15 1HD1 LEU 15 18.434 4.721 -0.044
146 HD12 LEU 15 2HD1 LEU 15 17.599 5.036 1.476
147 HD13 LEU 15 3HD1 LEU 15 19.136 4.171 1.478
148 HD21 LEU 15 1HD2 LEU 15 18.997 8.330 0.626
149 HD22 LEU 15 2HD2 LEU 15 17.685 7.605 1.557
150 HD23 LEU 15 3HD2 LEU 15 17.877 7.210 -0.152
151 H HIS 16 H HIS 16 22.906 7.215 2.842
152 HA HIS 16 HA HIS 16 23.339 6.441 5.495
153 HB2 HIS 16 1HB HIS 16 25.155 7.344 3.281
154 HB3 HIS 16 2HB HIS 16 25.802 7.036 4.890
155 HD1 HIS 16 HD1 HIS 16 27.102 5.174 3.284
156 HD2 HIS 16 HD2 HIS 16 23.127 4.476 4.271
157 HE1 HIS 16 HE1 HIS 16 26.736 2.716 2.899
158 H ALA 17 H ALA 17 23.997 9.552 3.898
159 HA ALA 17 HA ALA 17 25.054 10.883 6.118
160 HB1 ALA 17 1HB ALA 17 25.268 12.556 4.670
161 HB2 ALA 17 2HB ALA 17 24.482 11.525 3.474
162 HB3 ALA 17 3HB ALA 17 23.524 12.657 4.428
163 H ALA 18 H ALA 18 21.883 9.827 5.524
164 HA ALA 18 HA ALA 18 20.696 11.785 7.348
165 HB1 ALA 18 1HB ALA 18 19.721 10.196 5.142
166 HB2 ALA 18 2HB ALA 18 18.711 9.995 6.575
167 HB3 ALA 18 3HB ALA 18 19.001 11.607 5.920
168 H GLY 19 H GLY 19 22.538 9.422 8.026
169 HA2 GLY 19 1HA GLY 19 22.706 8.357 10.115
170 HA3 GLY 19 2HA GLY 19 20.976 8.565 10.336
171 H ALA 20 H ALA 20 21.335 7.431 7.285
172 HA ALA 20 HA ALA 20 20.425 4.805 8.016
173 HB1 ALA 20 1HB ALA 20 19.888 4.505 5.780
174 HB2 ALA 20 2HB ALA 20 19.707 6.247 5.994
175 HB3 ALA 20 3HB ALA 20 21.155 5.598 5.224
176 H GLN 21 H GLN 21 21.408 2.934 6.588
177 HA GLN 21 HA GLN 21 24.096 2.877 5.895
178 HB2 GLN 21 1HB GLN 21 23.957 3.211 8.588
179 HB3 GLN 21 2HB GLN 21 23.991 1.456 8.479
180 HG2 GLN 21 1HG GLN 21 26.210 1.763 8.517
181 HG3 GLN 21 2HG GLN 21 25.991 2.059 6.793
182 HE21 GLN 21 2HE2 GLN 21 25.255 4.459 6.410
183 HE22 GLN 21 1HE2 GLN 21 26.258 5.637 7.180
184 H GLY 22 H GLY 22 24.008 1.279 4.467
185 HA2 GLY 22 1HA GLY 22 23.849 -1.375 4.899
186 HA3 GLY 22 2HA GLY 22 22.154 -0.920 4.812
187 H GLU 23 H GLU 23 21.870 -2.199 2.948
188 HA GLU 23 HA GLU 23 22.959 -0.959 0.510
189 HB2 GLU 23 1HB GLU 23 22.698 -3.886 1.171
190 HB3 GLU 23 2HB GLU 23 22.813 -3.315 -0.488
191 HG2 GLU 23 1HG GLU 23 24.986 -2.460 -0.147
192 HG3 GLU 23 2HG GLU 23 24.859 -2.640 1.602
193 H MET 24 H MET 24 20.336 -2.785 2.001
194 HA MET 24 HA MET 24 18.563 -1.886 -0.174
195 HB2 MET 24 1HB MET 24 17.842 -4.181 1.602
196 HB3 MET 24 2HB MET 24 17.349 -3.855 -0.054
197 HG2 MET 24 1HG MET 24 20.009 -4.883 0.894
198 HG3 MET 24 2HG MET 24 18.801 -5.738 -0.064
199 HE1 MET 24 1HE MET 24 22.005 -5.149 -0.447
200 HE2 MET 24 2HE MET 24 21.250 -6.222 -1.625
201 HE3 MET 24 3HE MET 24 22.189 -4.832 -2.172
202 H PHE 25 H PHE 25 16.385 -1.316 0.421
203 HA PHE 25 HA PHE 25 15.678 -0.977 3.178
204 HB2 PHE 25 1HB PHE 25 16.205 1.511 1.540
205 HB3 PHE 25 2HB PHE 25 15.567 1.461 3.180
206 HD1 PHE 25 HD2 PHE 25 18.548 0.799 1.109
207 HD2 PHE 25 HD1 PHE 25 16.998 1.267 5.046
208 HE1 PHE 25 HE2 PHE 25 20.840 0.892 1.997
209 HE2 PHE 25 HE1 PHE 25 19.288 1.362 5.940
210 HZ PHE 25 HZ PHE 25 21.213 1.173 4.415
211 H THR 26 H THR 26 13.519 -0.129 3.452
212 HA THR 26 HA THR 26 11.830 -0.789 1.177
213 HB THR 26 HB THR 26 10.044 -0.176 3.092
214 HG1 THR 26 1HG THR 26 11.879 -1.404 4.753
215 HG21 THR 26 1HG2 THR 26 10.657 -2.722 3.840
216 HG22 THR 26 2HG2 THR 26 11.446 -2.622 2.266
217 HG23 THR 26 3HG2 THR 26 9.718 -2.298 2.410
218 H VAL 27 H VAL 27 9.629 0.665 1.397
219 HA VAL 27 HA VAL 27 10.304 3.139 0.233
220 HB VAL 27 HB VAL 27 8.199 2.055 -0.291
221 HG11 VAL 27 1HG1 VAL 27 6.510 1.586 1.215
222 HG12 VAL 27 2HG1 VAL 27 7.955 1.255 2.172
223 HG13 VAL 27 3HG1 VAL 27 7.082 2.773 2.386
224 HG21 VAL 27 1HG2 VAL 27 8.491 4.789 0.429
225 HG22 VAL 27 2HG2 VAL 27 7.446 4.081 -0.802
226 HG23 VAL 27 3HG2 VAL 27 6.856 4.277 0.848
227 H LYS 28 H LYS 28 8.854 2.411 3.408
228 HA LYS 28 HA LYS 28 8.866 5.068 4.342
229 HB2 LYS 28 1HB LYS 28 8.943 3.707 6.646
230 HB3 LYS 28 2HB LYS 28 7.490 3.827 5.663
231 HG2 LYS 28 1HG LYS 28 7.885 1.544 6.422
232 HG3 LYS 28 2HG LYS 28 7.959 1.666 4.663
233 HD2 LYS 28 1HD LYS 28 10.150 1.127 4.591
234 HD3 LYS 28 2HD LYS 28 10.524 2.026 6.064
235 HE2 LYS 28 1HE LYS 28 10.893 -0.293 6.504
236 HE3 LYS 28 2HE LYS 28 9.435 0.196 7.366
237 HZ1 LYS 28 1HZ LYS 28 9.670 -1.462 4.936
238 HZ2 LYS 28 2HZ LYS 28 8.223 -0.668 5.305
239 HZ3 LYS 28 3HZ LYS 28 8.861 -1.808 6.380
240 H GLU 29 H GLU 29 11.325 2.619 4.211
241 HA GLU 29 HA GLU 29 13.067 3.809 6.140
242 HB2 GLU 29 1HB GLU 29 13.437 1.706 4.018
243 HB3 GLU 29 2HB GLU 29 14.788 2.293 4.979
244 HG2 GLU 29 1HG GLU 29 12.286 1.091 6.136
245 HG3 GLU 29 2HG GLU 29 13.769 0.193 5.818
246 H VAL 30 H VAL 30 12.820 3.892 2.613
247 HA VAL 30 HA VAL 30 15.154 5.475 2.219
248 HB VAL 30 HB VAL 30 12.777 5.043 0.404
249 HG11 VAL 30 1HG1 VAL 30 15.253 5.680 -0.922
250 HG12 VAL 30 2HG1 VAL 30 13.673 6.453 -1.063
251 HG13 VAL 30 3HG1 VAL 30 14.796 6.962 0.199
252 HG21 VAL 30 1HG2 VAL 30 15.427 3.809 -0.092
253 HG22 VAL 30 2HG2 VAL 30 14.447 3.132 1.209
254 HG23 VAL 30 3HG2 VAL 30 13.809 3.195 -0.434
255 H MET 31 H MET 31 11.731 6.190 2.639
256 HA MET 31 HA MET 31 11.932 8.957 2.003
257 HB2 MET 31 1HB MET 31 9.721 8.648 1.952
258 HB3 MET 31 2HB MET 31 9.872 7.109 2.790
259 HG2 MET 31 1HG MET 31 8.418 8.532 4.041
260 HG3 MET 31 2HG MET 31 9.921 8.327 4.937
261 HE1 MET 31 1HE MET 31 9.751 12.044 2.282
262 HE2 MET 31 2HE MET 31 10.480 10.484 1.901
263 HE3 MET 31 3HE MET 31 8.724 10.647 1.953
264 H HIS 32 H HIS 32 11.928 7.133 5.042
265 HA HIS 32 HA HIS 32 11.921 9.248 6.837
266 HB2 HIS 32 1HB HIS 32 11.854 6.676 7.241
267 HB3 HIS 32 2HB HIS 32 13.607 6.812 7.328
268 HD1 HIS 32 HD1 HIS 32 10.839 6.710 9.481
269 HD2 HIS 32 HD2 HIS 32 14.238 9.092 9.305
270 HE1 HIS 32 HE1 HIS 32 11.102 7.678 11.787
271 H TYR 33 H TYR 33 14.547 7.924 4.930
272 HA TYR 33 HA TYR 33 16.618 9.355 6.288
273 HB2 TYR 33 1HB TYR 33 16.587 8.020 3.574
274 HB3 TYR 33 2HB TYR 33 18.026 8.655 4.365
275 HD1 TYR 33 HD1 TYR 33 17.592 7.771 7.150
276 HD2 TYR 33 HD2 TYR 33 16.946 5.718 3.480
277 HE1 TYR 33 HE1 TYR 33 17.909 5.622 8.303
278 HE2 TYR 33 HE2 TYR 33 17.260 3.563 4.623
279 HH TYR 33 HH TYR 33 18.144 3.413 8.050
280 H LEU 34 H LEU 34 14.568 9.954 3.510
281 HA LEU 34 HA LEU 34 15.888 12.009 2.243
282 HB2 LEU 34 1HB LEU 34 13.211 10.996 2.359
283 HB3 LEU 34 2HB LEU 34 13.173 12.758 2.324
284 HG LEU 34 HG LEU 34 12.973 11.923 0.083
285 HD11 LEU 34 1HD1 LEU 34 15.436 12.735 -0.693
286 HD12 LEU 34 2HD1 LEU 34 15.353 13.418 0.930
287 HD13 LEU 34 3HD1 LEU 34 14.117 13.823 -0.260
288 HD21 LEU 34 1HD2 LEU 34 14.737 10.560 -0.946
289 HD22 LEU 34 2HD2 LEU 34 13.948 9.722 0.390
290 HD23 LEU 34 3HD2 LEU 34 15.544 10.439 0.617
291 H GLY 35 H GLY 35 13.438 12.408 4.815
292 HA2 GLY 35 1HA GLY 35 13.675 15.150 5.150
293 HA3 GLY 35 2HA GLY 35 13.193 14.033 6.418
294 H GLN 36 H GLN 36 15.469 12.589 6.847
295 HA GLN 36 HA GLN 36 16.959 14.282 8.509
296 HB2 GLN 36 1HB GLN 36 17.612 11.541 7.421
297 HB3 GLN 36 2HB GLN 36 18.544 12.349 8.674
298 HG2 GLN 36 1HG GLN 36 15.910 12.455 9.562
299 HG3 GLN 36 2HG GLN 36 16.101 10.840 8.880
300 HE21 GLN 36 2HE2 GLN 36 17.817 13.134 10.972
301 HE22 GLN 36 1HE2 GLN 36 18.386 11.950 12.093
302 H TYR 37 H TYR 37 17.577 13.086 5.247
303 HA TYR 37 HA TYR 37 20.218 14.001 4.993
304 HB2 TYR 37 1HB TYR 37 19.291 12.421 3.408
305 HB3 TYR 37 2HB TYR 37 18.081 13.591 2.893
306 HD1 TYR 37 HD1 TYR 37 21.760 13.033 3.011
307 HD2 TYR 37 HD2 TYR 37 18.519 15.012 1.094
308 HE1 TYR 37 HE1 TYR 37 23.293 13.836 1.262
309 HE2 TYR 37 HE2 TYR 37 20.041 15.819 -0.661
310 HH TYR 37 HH TYR 37 23.133 16.058 -0.444
311 H ILE 38 H ILE 38 17.143 15.536 4.080
312 HA ILE 38 HA ILE 38 18.221 17.894 3.025
313 HB ILE 38 HB ILE 38 15.569 17.592 4.436
314 HG12 ILE 38 1HG1 ILE 38 16.207 17.278 1.496
315 HG13 ILE 38 2HG1 ILE 38 15.942 15.937 2.605
316 HG21 ILE 38 1HG2 ILE 38 14.881 19.475 3.009
317 HG22 ILE 38 2HG2 ILE 38 16.189 19.910 4.107
318 HG23 ILE 38 3HG2 ILE 38 16.533 19.601 2.406
319 HD11 ILE 38 1HD1 ILE 38 13.666 16.682 2.988
320 HD12 ILE 38 2HD1 ILE 38 13.927 18.065 1.924
321 HD13 ILE 38 3HD1 ILE 38 13.964 16.428 1.268
322 H MET 39 H MET 39 17.079 17.166 6.313
323 HA MET 39 HA MET 39 17.600 19.712 7.397
324 HB2 MET 39 1HB MET 39 16.656 18.809 9.208
325 HB3 MET 39 2HB MET 39 16.534 17.300 8.314
326 HG2 MET 39 1HG MET 39 18.645 16.553 9.195
327 HG3 MET 39 2HG MET 39 18.896 18.104 9.993
328 HE1 MET 39 1HE MET 39 15.849 18.104 12.480
329 HE2 MET 39 2HE MET 39 16.599 19.043 11.190
330 HE3 MET 39 3HE MET 39 15.258 17.956 10.824
331 H VAL 40 H VAL 40 19.618 16.884 6.923
332 HA VAL 40 HA VAL 40 21.783 17.749 8.552
333 HB VAL 40 HB VAL 40 21.165 15.419 7.184
334 HG11 VAL 40 1HG1 VAL 40 23.078 14.960 5.754
335 HG12 VAL 40 2HG1 VAL 40 22.171 16.347 5.147
336 HG13 VAL 40 3HG1 VAL 40 23.686 16.595 6.016
337 HG21 VAL 40 1HG2 VAL 40 23.247 14.568 8.196
338 HG22 VAL 40 2HG2 VAL 40 23.730 16.226 8.552
339 HG23 VAL 40 3HG2 VAL 40 22.298 15.541 9.320
340 H LYS 41 H LYS 41 20.995 18.093 5.131
341 HA LYS 41 HA LYS 41 23.489 19.446 4.553
342 HB2 LYS 41 1HB LYS 41 21.109 18.588 2.962
343 HB3 LYS 41 2HB LYS 41 22.158 19.839 2.307
344 HG2 LYS 41 1HG LYS 41 23.135 17.141 3.212
345 HG3 LYS 41 2HG LYS 41 22.686 17.525 1.548
346 HD2 LYS 41 1HD LYS 41 24.771 18.237 1.233
347 HD3 LYS 41 2HD LYS 41 24.418 19.571 2.335
348 HE2 LYS 41 1HE LYS 41 25.260 18.356 4.200
349 HE3 LYS 41 2HE LYS 41 25.359 16.865 3.264
350 HZ1 LYS 41 1HZ LYS 41 27.406 17.403 2.671
351 HZ2 LYS 41 2HZ LYS 41 27.325 18.814 3.600
352 HZ3 LYS 41 3HZ LYS 41 26.868 18.847 1.971
353 H GLN 42 H GLN 42 20.417 20.292 5.716
354 HA GLN 42 HA GLN 42 19.487 22.291 6.284
355 HB2 GLN 42 1HB GLN 42 22.330 22.925 5.932
356 HB3 GLN 42 2HB GLN 42 21.260 24.301 5.696
357 HG2 GLN 42 1HG GLN 42 21.347 24.552 7.899
358 HG3 GLN 42 2HG GLN 42 20.275 23.155 7.984
359 HE21 GLN 42 2HE2 GLN 42 21.943 21.110 7.330
360 HE22 GLN 42 1HE2 GLN 42 23.179 20.948 8.526
361 H LEU 43 H LEU 43 18.408 21.505 4.129
362 HA LEU 43 HA LEU 43 18.550 23.748 2.223
363 HB2 LEU 43 1HB LEU 43 17.762 20.921 1.550
364 HB3 LEU 43 2HB LEU 43 18.015 22.258 0.430
365 HG LEU 43 HG LEU 43 20.308 21.369 2.108
366 HD11 LEU 43 1HD1 LEU 43 20.122 19.972 -0.442
367 HD12 LEU 43 2HD1 LEU 43 18.892 19.475 0.719
368 HD13 LEU 43 3HD1 LEU 43 20.599 19.376 1.148
369 HD21 LEU 43 1HD2 LEU 43 20.017 22.365 -0.724
370 HD22 LEU 43 2HD2 LEU 43 21.543 21.976 0.070
371 HD23 LEU 43 3HD2 LEU 43 20.550 23.306 0.669
372 H TYR 44 H TYR 44 16.941 24.429 4.035
373 HA TYR 44 HA TYR 44 14.366 24.473 2.903
374 HB2 TYR 44 1HB TYR 44 13.099 23.186 4.525
375 HB3 TYR 44 2HB TYR 44 14.299 22.149 3.763
376 HD1 TYR 44 HD1 TYR 44 16.695 22.340 5.135
377 HD2 TYR 44 HD2 TYR 44 12.785 22.757 6.760
378 HE1 TYR 44 HE1 TYR 44 17.553 21.701 7.349
379 HE2 TYR 44 HE2 TYR 44 13.633 22.120 8.979
380 HH TYR 44 HH TYR 44 15.868 22.179 10.182
381 H ASP 45 H ASP 45 12.739 25.463 4.486
382 HA ASP 45 HA ASP 45 14.058 27.679 5.795
383 HB2 ASP 45 1HB ASP 45 11.524 27.229 4.573
384 HB3 ASP 45 2HB ASP 45 11.241 27.722 6.240
385 H GLN 46 H GLN 46 14.649 27.646 7.850
386 HA GLN 46 HA GLN 46 14.042 25.572 9.637
387 HB2 GLN 46 1HB GLN 46 14.872 28.327 10.516
388 HB3 GLN 46 2HB GLN 46 15.261 26.780 11.256
389 HG2 GLN 46 1HG GLN 46 16.333 27.889 8.675
390 HG3 GLN 46 2HG GLN 46 17.214 27.621 10.178
391 HE21 GLN 46 2HE2 GLN 46 15.254 25.853 7.810
392 HE22 GLN 46 1HE2 GLN 46 16.215 24.419 7.829
393 H GLN 47 H GLN 47 12.270 28.360 8.756
394 HA GLN 47 HA GLN 47 10.686 28.412 11.188
395 HB2 GLN 47 1HB GLN 47 9.994 29.932 8.699
396 HB3 GLN 47 2HB GLN 47 9.715 30.371 10.379
397 HG2 GLN 47 1HG GLN 47 11.410 31.799 9.777
398 HG3 GLN 47 2HG GLN 47 12.294 30.472 10.529
399 HE21 GLN 47 2HE2 GLN 47 13.741 29.350 9.356
400 HE22 GLN 47 1HE2 GLN 47 14.089 29.644 7.690
401 H GLU 48 H GLU 48 10.505 27.154 7.947
402 HA GLU 48 HA GLU 48 7.946 25.888 8.635
403 HB2 GLU 48 1HB GLU 48 7.281 27.657 7.194
404 HB3 GLU 48 2HB GLU 48 8.618 27.359 6.092
405 HG2 GLU 48 1HG GLU 48 7.610 25.210 5.473
406 HG3 GLU 48 2HG GLU 48 6.253 25.554 6.544
407 H GLN 49 H GLN 49 8.985 23.940 9.047
408 HA GLN 49 HA GLN 49 10.900 22.734 7.387
409 HB2 GLN 49 1HB GLN 49 8.942 21.532 9.345
410 HB3 GLN 49 2HB GLN 49 10.217 20.613 8.556
411 HG2 GLN 49 1HG GLN 49 11.231 21.122 10.531
412 HG3 GLN 49 2HG GLN 49 11.755 22.486 9.545
413 HE21 GLN 49 2HE2 GLN 49 12.083 23.684 11.458
414 HE22 GLN 49 1HE2 GLN 49 10.754 24.389 12.308
415 H HIS 50 H HIS 50 7.483 23.023 7.095
416 HA HIS 50 HA HIS 50 7.016 20.776 5.421
417 HB2 HIS 50 1HB HIS 50 4.913 21.394 5.857
418 HB3 HIS 50 2HB HIS 50 5.481 22.913 6.544
419 HD1 HIS 50 HD1 HIS 50 4.870 24.983 5.304
420 HD2 HIS 50 HD2 HIS 50 4.473 21.575 2.961
421 HE1 HIS 50 HE1 HIS 50 3.812 25.761 3.160
422 H MET 51 H MET 51 8.802 23.511 4.889
423 HA MET 51 HA MET 51 8.385 23.339 1.977
424 HB2 MET 51 1HB MET 51 8.510 25.650 3.762
425 HB3 MET 51 2HB MET 51 9.616 25.775 2.400
426 HG2 MET 51 1HG MET 51 6.637 25.388 2.298
427 HG3 MET 51 2HG MET 51 7.552 26.812 1.810
428 HE1 MET 51 1HE MET 51 9.710 24.814 -1.053
429 HE2 MET 51 2HE MET 51 9.693 26.325 -0.144
430 HE3 MET 51 3HE MET 51 10.011 24.801 0.685
431 H VAL 52 H VAL 52 10.030 22.351 1.024
432 HA VAL 52 HA VAL 52 12.677 22.420 2.273
433 HB VAL 52 HB VAL 52 11.593 20.695 0.044
434 HG11 VAL 52 1HG1 VAL 52 13.761 19.422 0.438
435 HG12 VAL 52 2HG1 VAL 52 13.881 20.949 -0.439
436 HG13 VAL 52 3HG1 VAL 52 14.333 20.871 1.264
437 HG21 VAL 52 1HG2 VAL 52 11.164 20.475 2.731
438 HG22 VAL 52 2HG2 VAL 52 11.106 19.138 1.583
439 HG23 VAL 52 3HG2 VAL 52 12.580 19.448 2.500
440 H TYR 53 H TYR 53 14.435 23.328 1.337
441 HA TYR 53 HA TYR 53 14.030 24.652 -1.266
442 HB2 TYR 53 1HB TYR 53 15.456 25.603 1.209
443 HB3 TYR 53 2HB TYR 53 15.798 26.294 -0.373
444 HD1 TYR 53 HD1 TYR 53 13.321 26.658 -1.677
445 HD2 TYR 53 HD2 TYR 53 14.162 27.022 2.478
446 HE1 TYR 53 HE1 TYR 53 11.408 28.183 -1.430
447 HE2 TYR 53 HE2 TYR 53 12.250 28.548 2.737
448 HH TYR 53 HH TYR 53 9.826 28.825 0.680
449 H CYS 54 H CYS 54 14.884 22.771 -2.306
450 HA CYS 54 HA CYS 54 17.333 21.570 -1.771
451 HB2 CYS 54 1HB CYS 54 17.231 20.657 -3.984
452 HB3 CYS 54 2HB CYS 54 15.583 20.746 -3.374
453 HG CYS 54 HG CYS 54 14.973 21.583 -5.772
454 H GLY 55 H GLY 55 16.593 24.345 -3.855
455 HA2 GLY 55 1HA GLY 55 17.936 26.022 -4.665
456 HA3 GLY 55 2HA GLY 55 19.066 25.609 -3.384
457 H GLY 56 H GLY 56 18.381 22.938 -5.316
458 HA2 GLY 56 1HA GLY 56 19.410 22.449 -7.486
459 HA3 GLY 56 2HA GLY 56 20.756 23.466 -6.992
460 H ASP 57 H ASP 57 20.333 22.134 -4.216
461 HA ASP 57 HA ASP 57 22.482 20.424 -4.244
462 HB2 ASP 57 1HB ASP 57 20.453 21.164 -2.381
463 HB3 ASP 57 2HB ASP 57 20.642 19.413 -2.318
464 H LEU 58 H LEU 58 22.154 17.985 -3.445
465 HA LEU 58 HA LEU 58 21.622 16.437 -5.630
466 HB2 LEU 58 1HB LEU 58 21.905 15.973 -2.761
467 HB3 LEU 58 2HB LEU 58 20.924 14.755 -3.574
468 HG LEU 58 HG LEU 58 23.472 14.371 -3.287
469 HD11 LEU 58 1HD1 LEU 58 21.940 12.950 -4.582
470 HD12 LEU 58 2HD1 LEU 58 23.530 13.080 -5.333
471 HD13 LEU 58 3HD1 LEU 58 22.172 13.999 -5.981
472 HD21 LEU 58 1HD2 LEU 58 23.655 15.831 -5.885
473 HD22 LEU 58 2HD2 LEU 58 24.933 15.377 -4.758
474 HD23 LEU 58 3HD2 LEU 58 23.849 16.714 -4.370
475 H LEU 59 H LEU 59 19.375 16.978 -2.914
476 HA LEU 59 HA LEU 59 17.210 15.569 -3.959
477 HB2 LEU 59 1HB LEU 59 15.892 16.602 -2.324
478 HB3 LEU 59 2HB LEU 59 17.507 16.511 -1.625
479 HG LEU 59 HG LEU 59 16.450 19.005 -2.935
480 HD11 LEU 59 1HD1 LEU 59 15.698 17.825 -0.400
481 HD12 LEU 59 2HD1 LEU 59 15.027 19.223 -1.240
482 HD13 LEU 59 3HD1 LEU 59 16.437 19.414 -0.197
483 HD21 LEU 59 1HD2 LEU 59 18.859 18.234 -1.385
484 HD22 LEU 59 2HD2 LEU 59 18.191 19.844 -1.115
485 HD23 LEU 59 3HD2 LEU 59 18.689 19.355 -2.736
486 H GLY 60 H GLY 60 18.325 18.837 -4.573
487 HA2 GLY 60 1HA GLY 60 15.995 19.764 -5.901
488 HA3 GLY 60 2HA GLY 60 17.604 20.457 -6.036
489 H GLU 61 H GLU 61 19.048 18.420 -7.142
490 HA GLU 61 HA GLU 61 18.372 18.622 -9.866
491 HB2 GLU 61 1HB GLU 61 20.183 16.507 -8.717
492 HB3 GLU 61 2HB GLU 61 20.266 17.265 -10.300
493 HG2 GLU 61 1HG GLU 61 20.510 19.392 -8.573
494 HG3 GLU 61 2HG GLU 61 21.404 18.106 -7.766
495 H LEU 62 H LEU 62 17.898 16.048 -7.497
496 HA LEU 62 HA LEU 62 16.919 14.123 -9.337
497 HB2 LEU 62 1HB LEU 62 17.238 14.378 -6.454
498 HB3 LEU 62 2HB LEU 62 15.785 13.488 -6.904
499 HG LEU 62 HG LEU 62 17.465 11.871 -6.564
500 HD11 LEU 62 1HD1 LEU 62 16.083 11.791 -8.727
501 HD12 LEU 62 2HD1 LEU 62 17.494 10.741 -8.598
502 HD13 LEU 62 3HD1 LEU 62 17.587 12.232 -9.536
503 HD21 LEU 62 1HD2 LEU 62 19.579 12.172 -8.170
504 HD22 LEU 62 2HD2 LEU 62 19.531 12.799 -6.522
505 HD23 LEU 62 3HD2 LEU 62 19.200 13.871 -7.884
506 H LEU 63 H LEU 63 15.372 16.555 -7.301
507 HA LEU 63 HA LEU 63 12.706 15.739 -7.882
508 HB2 LEU 63 1HB LEU 63 14.013 18.023 -6.532
509 HB3 LEU 63 2HB LEU 63 12.388 18.300 -7.155
510 HG LEU 63 HG LEU 63 12.818 17.485 -4.678
511 HD11 LEU 63 1HD1 LEU 63 10.576 16.052 -5.157
512 HD12 LEU 63 2HD1 LEU 63 10.644 17.054 -6.607
513 HD13 LEU 63 3HD1 LEU 63 10.621 17.810 -5.014
514 HD21 LEU 63 1HD2 LEU 63 13.941 15.380 -5.868
515 HD22 LEU 63 2HD2 LEU 63 12.272 14.811 -5.828
516 HD23 LEU 63 3HD2 LEU 63 13.088 15.260 -4.329
517 H GLY 64 H GLY 64 14.938 18.075 -9.287
518 HA2 GLY 64 1HA GLY 64 14.908 18.760 -11.537
519 HA3 GLY 64 2HA GLY 64 13.252 18.186 -11.666
520 H ARG 65 H ARG 65 12.904 19.742 -8.972
521 HA ARG 65 HA ARG 65 12.246 22.276 -10.298
522 HB2 ARG 65 1HB ARG 65 11.274 21.490 -7.570
523 HB3 ARG 65 2HB ARG 65 10.533 22.577 -8.737
524 HG2 ARG 65 1HG ARG 65 10.607 19.577 -8.779
525 HG3 ARG 65 2HG ARG 65 9.201 20.641 -8.710
526 HD2 ARG 65 1HD ARG 65 9.503 21.332 -10.957
527 HD3 ARG 65 2HD ARG 65 11.106 20.604 -11.037
528 HE ARG 65 HE ARG 65 10.132 18.565 -11.456
529 HH11 ARG 65 1HH1 ARG 65 7.705 20.826 -10.399
530 HH12 ARG 65 2HH1 ARG 65 6.378 19.783 -10.789
531 HH21 ARG 65 1HH2 ARG 65 8.393 17.183 -11.972
532 HH22 ARG 65 2HH2 ARG 65 6.770 17.710 -11.682
533 H GLN 66 H GLN 66 12.001 23.921 -8.101
534 HA GLN 66 HA GLN 66 14.812 24.224 -7.301
535 HB2 GLN 66 1HB GLN 66 13.868 26.616 -6.709
536 HB3 GLN 66 2HB GLN 66 14.319 26.200 -8.357
537 HG2 GLN 66 1HG GLN 66 12.010 25.772 -8.921
538 HG3 GLN 66 2HG GLN 66 11.523 26.070 -7.253
539 HE21 GLN 66 2HE2 GLN 66 11.709 27.396 -10.249
540 HE22 GLN 66 1HE2 GLN 66 11.684 29.072 -9.828
541 H SER 67 H SER 67 11.540 23.987 -6.103
542 HA SER 67 HA SER 67 12.513 23.376 -3.459
543 HB2 SER 67 1HB SER 67 11.593 25.158 -2.264
544 HB3 SER 67 2HB SER 67 12.255 25.961 -3.687
545 HG SER 67 HG SER 67 10.110 25.795 -4.599
546 H PHE 68 H PHE 68 11.106 22.117 -2.317
547 HA PHE 68 HA PHE 68 8.400 21.757 -3.397
548 HB2 PHE 68 1HB PHE 68 8.644 19.294 -3.073
549 HB3 PHE 68 2HB PHE 68 9.689 19.943 -4.333
550 HD1 PHE 68 HD2 PHE 68 9.564 18.490 -0.980
551 HD2 PHE 68 HD1 PHE 68 12.082 19.991 -4.066
552 HE1 PHE 68 HE2 PHE 68 11.516 17.480 0.126
553 HE2 PHE 68 HE1 PHE 68 14.038 18.982 -2.965
554 HZ PHE 68 HZ PHE 68 13.756 17.726 -0.865
555 H SER 69 H SER 69 6.827 21.178 -1.907
556 HA SER 69 HA SER 69 7.519 21.750 0.859
557 HB2 SER 69 1HB SER 69 4.753 21.141 0.596
558 HB3 SER 69 2HB SER 69 5.500 22.716 0.859
559 HG SER 69 HG SER 69 4.147 22.129 -1.189
560 H VAL 70 H VAL 70 7.406 20.332 2.528
561 HA VAL 70 HA VAL 70 7.474 17.535 1.906
562 HB VAL 70 HB VAL 70 8.436 17.258 3.918
563 HG11 VAL 70 1HG1 VAL 70 9.350 19.438 2.937
564 HG12 VAL 70 2HG1 VAL 70 8.426 20.246 4.204
565 HG13 VAL 70 3HG1 VAL 70 9.694 19.097 4.632
566 HG21 VAL 70 1HG2 VAL 70 7.585 18.518 5.989
567 HG22 VAL 70 2HG2 VAL 70 6.230 19.000 4.968
568 HG23 VAL 70 3HG2 VAL 70 6.536 17.291 5.277
569 H LYS 71 H LYS 71 5.115 19.760 3.180
570 HA LYS 71 HA LYS 71 3.349 17.806 4.265
571 HB2 LYS 71 1HB LYS 71 3.507 20.447 4.573
572 HB3 LYS 71 2HB LYS 71 2.306 20.420 3.288
573 HG2 LYS 71 1HG LYS 71 1.359 20.497 5.584
574 HG3 LYS 71 2HG LYS 71 0.804 19.131 4.615
575 HD2 LYS 71 1HD LYS 71 1.488 18.695 7.056
576 HD3 LYS 71 2HD LYS 71 2.098 17.602 5.812
577 HE2 LYS 71 1HE LYS 71 4.196 18.909 5.750
578 HE3 LYS 71 2HE LYS 71 3.582 19.910 7.065
579 HZ1 LYS 71 1HZ LYS 71 4.998 17.571 7.306
580 HZ2 LYS 71 2HZ LYS 71 3.410 17.142 7.701
581 HZ3 LYS 71 3HZ LYS 71 4.183 18.389 8.544
582 H ASP 72 H ASP 72 4.012 18.910 1.089
583 HA ASP 72 HA ASP 72 1.573 17.592 0.091
584 HB2 ASP 72 1HB ASP 72 3.229 19.806 -1.130
585 HB3 ASP 72 2HB ASP 72 1.954 18.951 -1.994
586 HA PRO 73 HA PRO 73 4.872 14.710 -1.159
587 HB2 PRO 73 1HB PRO 73 3.220 12.561 -1.300
588 HB3 PRO 73 2HB PRO 73 3.932 13.127 0.216
589 HG2 PRO 73 1HG PRO 73 1.191 13.609 -0.886
590 HG3 PRO 73 2HG PRO 73 1.676 13.210 0.772
591 HD2 PRO 73 1HD PRO 73 1.076 15.734 -0.002
592 HD3 PRO 73 2HD PRO 73 2.282 15.381 1.252
593 H SER 74 H SER 74 4.070 16.452 -3.056
594 HA SER 74 HA SER 74 2.806 14.921 -5.204
595 HB2 SER 74 1HB SER 74 1.832 16.982 -5.344
596 HB3 SER 74 2HB SER 74 3.221 17.803 -4.634
597 HG SER 74 HG SER 74 2.810 16.995 -7.302
598 HA PRO 75 HA PRO 75 6.898 16.156 -7.388
599 HB2 PRO 75 1HB PRO 75 8.678 17.689 -6.028
600 HB3 PRO 75 2HB PRO 75 7.370 18.371 -7.002
601 HG2 PRO 75 1HG PRO 75 7.510 17.960 -4.040
602 HG3 PRO 75 2HG PRO 75 6.902 19.356 -4.948
603 HD2 PRO 75 1HD PRO 75 5.260 17.490 -3.876
604 HD3 PRO 75 2HD PRO 75 4.872 18.353 -5.378
605 H LEU 76 H LEU 76 6.928 15.393 -3.993
606 HA LEU 76 HA LEU 76 9.513 14.279 -3.818
607 HB2 LEU 76 1HB LEU 76 8.244 14.876 -1.847
608 HB3 LEU 76 2HB LEU 76 7.010 13.683 -2.248
609 HG LEU 76 HG LEU 76 8.939 11.968 -2.013
610 HD11 LEU 76 1HD1 LEU 76 10.158 14.462 -1.012
611 HD12 LEU 76 2HD1 LEU 76 10.908 13.031 -1.719
612 HD13 LEU 76 3HD1 LEU 76 10.405 13.018 -0.029
613 HD21 LEU 76 1HD2 LEU 76 7.195 11.808 -0.485
614 HD22 LEU 76 2HD2 LEU 76 7.513 13.404 0.196
615 HD23 LEU 76 3HD2 LEU 76 8.606 12.063 0.543
616 H TYR 77 H TYR 77 6.349 12.669 -4.170
617 HA TYR 77 HA TYR 77 7.439 10.096 -4.603
618 HB2 TYR 77 1HB TYR 77 4.738 11.327 -5.051
619 HB3 TYR 77 2HB TYR 77 5.077 9.697 -5.622
620 HD1 TYR 77 HD1 TYR 77 5.734 7.934 -3.960
621 HD2 TYR 77 HD2 TYR 77 4.291 11.755 -2.767
622 HE1 TYR 77 HE1 TYR 77 5.243 7.043 -1.720
623 HE2 TYR 77 HE2 TYR 77 3.797 10.875 -0.524
624 HH TYR 77 HH TYR 77 3.320 8.654 0.517
625 H ASP 78 H ASP 78 6.293 12.616 -6.812
626 HA ASP 78 HA ASP 78 6.458 11.259 -9.216
627 HB2 ASP 78 1HB ASP 78 5.806 13.773 -8.561
628 HB3 ASP 78 2HB ASP 78 7.426 14.070 -9.184
629 H MET 79 H MET 79 9.019 12.738 -7.310
630 HA MET 79 HA MET 79 11.037 12.340 -9.316
631 HB2 MET 79 1HB MET 79 11.515 14.130 -7.901
632 HB3 MET 79 2HB MET 79 11.039 13.245 -6.458
633 HG2 MET 79 1HG MET 79 13.403 12.344 -8.036
634 HG3 MET 79 2HG MET 79 13.546 13.715 -6.939
635 HE1 MET 79 1HE MET 79 14.003 13.487 -4.444
636 HE2 MET 79 2HE MET 79 12.241 13.394 -4.419
637 HE3 MET 79 3HE MET 79 13.197 12.267 -3.456
638 H LEU 80 H LEU 80 10.286 10.821 -6.184
639 HA LEU 80 HA LEU 80 12.292 8.903 -6.173
640 HB2 LEU 80 1HB LEU 80 9.485 8.700 -5.094
641 HB3 LEU 80 2HB LEU 80 10.806 7.606 -4.686
642 HG LEU 80 HG LEU 80 10.832 10.562 -4.095
643 HD11 LEU 80 1HD1 LEU 80 9.056 8.991 -2.946
644 HD12 LEU 80 2HD1 LEU 80 9.947 10.200 -2.023
645 HD13 LEU 80 3HD1 LEU 80 10.449 8.510 -1.979
646 HD21 LEU 80 1HD2 LEU 80 12.792 8.464 -3.957
647 HD22 LEU 80 2HD2 LEU 80 12.465 9.108 -2.347
648 HD23 LEU 80 3HD2 LEU 80 12.974 10.191 -3.644
649 H ARG 81 H ARG 81 9.205 8.929 -7.835
650 HA ARG 81 HA ARG 81 8.770 6.344 -8.519
651 HB2 ARG 81 1HB ARG 81 7.268 7.270 -9.887
652 HB3 ARG 81 2HB ARG 81 7.964 8.839 -9.508
653 HG2 ARG 81 1HG ARG 81 9.439 8.701 -11.402
654 HG3 ARG 81 2HG ARG 81 8.904 7.054 -11.741
655 HD2 ARG 81 1HD ARG 81 6.570 8.585 -11.629
656 HD3 ARG 81 2HD ARG 81 7.728 9.567 -12.525
657 HE ARG 81 HE ARG 81 7.630 8.059 -14.252
658 HH11 ARG 81 1HH1 ARG 81 6.147 6.680 -11.420
659 HH12 ARG 81 2HH1 ARG 81 5.505 5.310 -12.263
660 HH21 ARG 81 1HH2 ARG 81 6.791 6.259 -15.374
661 HH22 ARG 81 2HH2 ARG 81 5.873 5.071 -14.512
662 H LYS 82 H LYS 82 10.986 8.538 -10.239
663 HA LYS 82 HA LYS 82 12.202 6.192 -11.529
664 HB2 LYS 82 1HB LYS 82 12.513 7.431 -13.384
665 HB3 LYS 82 2HB LYS 82 11.314 8.505 -12.674
666 HG2 LYS 82 1HG LYS 82 14.293 8.791 -12.341
667 HG3 LYS 82 2HG LYS 82 13.307 9.690 -13.497
668 HD2 LYS 82 1HD LYS 82 13.071 9.761 -10.490
669 HD3 LYS 82 2HD LYS 82 13.706 11.041 -11.526
670 HE2 LYS 82 1HE LYS 82 11.206 10.487 -12.586
671 HE3 LYS 82 2HE LYS 82 10.962 10.389 -10.843
672 HZ1 LYS 82 1HZ LYS 82 10.642 12.607 -11.217
673 HZ2 LYS 82 2HZ LYS 82 11.766 12.689 -12.478
674 HZ3 LYS 82 3HZ LYS 82 12.298 12.607 -10.874
675 H ASN 83 H ASN 83 12.641 8.100 -8.908
676 HA ASN 83 HA ASN 83 15.562 8.195 -9.121
677 HB2 ASN 83 1HB ASN 83 14.816 10.270 -8.357
678 HB3 ASN 83 2HB ASN 83 13.560 9.558 -7.349
679 HD21 ASN 83 2HD2 ASN 83 13.959 9.296 -5.262
680 HD22 ASN 83 1HD2 ASN 83 15.506 9.453 -4.509
681 H LEU 84 H LEU 84 13.082 7.218 -6.749
682 HA LEU 84 HA LEU 84 14.835 5.811 -5.063
683 HB2 LEU 84 1HB LEU 84 12.489 6.601 -4.557
684 HB3 LEU 84 2HB LEU 84 11.916 5.199 -5.459
685 HG LEU 84 HG LEU 84 12.499 3.726 -3.807
686 HD11 LEU 84 1HD1 LEU 84 14.191 4.377 -2.002
687 HD12 LEU 84 2HD1 LEU 84 14.630 5.704 -3.076
688 HD13 LEU 84 3HD1 LEU 84 14.805 4.036 -3.620
689 HD21 LEU 84 1HD2 LEU 84 11.650 6.328 -2.698
690 HD22 LEU 84 2HD2 LEU 84 12.246 5.137 -1.541
691 HD23 LEU 84 3HD2 LEU 84 10.885 4.742 -2.592
692 H VAL 85 H VAL 85 16.161 4.386 -6.113
693 HA VAL 85 HA VAL 85 15.622 2.672 -8.175
694 HB VAL 85 HB VAL 85 17.402 2.189 -5.785
695 HG11 VAL 85 1HG1 VAL 85 18.535 0.649 -7.600
696 HG12 VAL 85 2HG1 VAL 85 17.240 0.044 -6.565
697 HG13 VAL 85 3HG1 VAL 85 16.885 0.554 -8.216
698 HG21 VAL 85 1HG2 VAL 85 18.169 2.994 -8.581
699 HG22 VAL 85 2HG2 VAL 85 17.845 4.163 -7.301
700 HG23 VAL 85 3HG2 VAL 85 19.170 3.012 -7.129
701 H THR 86 H THR 86 13.560 1.792 -8.094
702 HA THR 86 HA THR 86 13.111 -0.230 -5.996
703 HB THR 86 HB THR 86 10.699 -0.005 -6.451
704 HG1 THR 86 1HG THR 86 10.274 0.852 -8.347
705 HG21 THR 86 1HG2 THR 86 11.005 1.351 -4.678
706 HG22 THR 86 2HG2 THR 86 10.754 2.651 -5.842
707 HG23 THR 86 3HG2 THR 86 12.391 2.158 -5.411
708 H LEU 87 H LEU 87 12.605 -2.294 -6.573
709 HA LEU 87 HA LEU 87 12.724 -2.907 -9.449
710 HB2 LEU 87 1HB LEU 87 13.230 -4.870 -7.238
711 HB3 LEU 87 2HB LEU 87 13.700 -4.979 -8.933
712 HG LEU 87 HG LEU 87 15.231 -2.976 -8.425
713 HD11 LEU 87 1HD1 LEU 87 14.360 -3.800 -5.691
714 HD12 LEU 87 2HD1 LEU 87 14.608 -2.185 -6.354
715 HD13 LEU 87 3HD1 LEU 87 15.996 -3.193 -5.948
716 HD21 LEU 87 1HD2 LEU 87 15.650 -5.649 -8.514
717 HD22 LEU 87 2HD2 LEU 87 16.253 -5.272 -6.900
718 HD23 LEU 87 3HD2 LEU 87 16.926 -4.449 -8.308
719 H ALA 88 H ALA 88 10.303 -2.103 -8.173
720 HA ALA 88 HA ALA 88 8.752 -4.528 -7.773
721 HB1 ALA 88 1HB ALA 88 6.979 -2.403 -7.813
722 HB2 ALA 88 2HB ALA 88 7.704 -3.140 -6.383
723 HB3 ALA 88 3HB ALA 88 8.450 -1.722 -7.118
724 H THR 89 H THR 89 6.335 -3.977 -8.836
725 HA THR 89 HA THR 89 6.727 -3.436 -11.686
726 HB THR 89 HB THR 89 5.250 -5.901 -10.761
727 HG1 THR 89 1HG THR 89 7.139 -7.020 -11.540
728 HG21 THR 89 1HG2 THR 89 5.850 -6.440 -13.266
729 HG22 THR 89 2HG2 THR 89 5.946 -4.684 -13.395
730 HG23 THR 89 3HG2 THR 89 4.447 -5.449 -12.870
731 H1 SER 115 H SER 115 2.270 21.136 18.718
732 HA SER 115 HA SER 115 1.530 19.873 16.179
733 HB2 SER 115 1HB SER 115 0.230 22.442 16.422
734 HB3 SER 115 2HB SER 115 -0.475 20.870 16.045
735 HG SER 115 HG SER 115 -0.129 20.603 18.499
736 H GLN 116 H GLN 116 2.923 20.451 14.661
737 HA GLN 116 HA GLN 116 4.341 21.697 13.381
738 HB2 GLN 116 1HB GLN 116 3.710 24.125 15.036
739 HB3 GLN 116 2HB GLN 116 4.176 24.040 13.342
740 HG2 GLN 116 1HG GLN 116 1.542 23.193 14.524
741 HG3 GLN 116 2HG GLN 116 1.847 24.620 13.534
742 HE21 GLN 116 2HE2 GLN 116 3.153 23.885 11.434
743 HE22 GLN 116 1HE2 GLN 116 2.367 22.627 10.550
744 H GLU 117 H GLU 117 6.474 21.545 13.552
745 HA GLU 117 HA GLU 117 8.079 22.868 15.401
746 HB2 GLU 117 1HB GLU 117 6.802 20.755 16.638
747 HB3 GLU 117 2HB GLU 117 8.363 20.071 16.204
748 HG2 GLU 117 1HG GLU 117 9.249 22.320 17.259
749 HG3 GLU 117 2HG GLU 117 7.706 22.249 18.108
750 H THR 118 H THR 118 10.100 20.848 15.724
751 HA THR 118 HA THR 118 11.688 21.187 13.556
752 HB THR 118 HB THR 118 11.596 18.595 15.108
753 HG1 THR 118 1HG THR 118 13.390 20.539 15.884
754 HG21 THR 118 1HG2 THR 118 14.093 18.724 14.683
755 HG22 THR 118 2HG2 THR 118 13.735 19.998 13.517
756 HG23 THR 118 3HG2 THR 118 13.087 18.375 13.278
757 H PHE 119 H PHE 119 12.428 19.582 11.907
758 HA PHE 119 HA PHE 119 10.493 19.014 10.053
759 HB2 PHE 119 1HB PHE 119 13.154 18.850 10.011
760 HB3 PHE 119 2HB PHE 119 12.800 17.135 10.191
761 HD1 PHE 119 HD2 PHE 119 10.032 17.997 8.571
762 HD2 PHE 119 HD1 PHE 119 14.227 17.947 7.857
763 HE1 PHE 119 HE2 PHE 119 9.614 17.832 6.152
764 HE2 PHE 119 HE1 PHE 119 13.817 17.782 5.436
765 HZ PHE 119 HZ PHE 119 11.508 17.723 4.581
766 H SER 120 H SER 120 11.455 17.114 12.810
767 HA SER 120 HA SER 120 10.301 14.655 12.044
768 HB2 SER 120 1HB SER 120 11.702 15.654 14.276
769 HB3 SER 120 2HB SER 120 10.168 15.047 14.898
770 HG SER 120 HG SER 120 11.530 13.321 14.855
771 H ASP 121 H ASP 121 8.985 17.557 13.463
772 HA ASP 121 HA ASP 121 6.524 16.435 14.339
773 HB2 ASP 121 1HB ASP 121 7.339 18.547 15.248
774 HB3 ASP 121 2HB ASP 121 7.244 19.293 13.655
775 H LEU 122 H LEU 122 7.588 17.976 11.351
776 HA LEU 122 HA LEU 122 4.932 17.648 10.182
777 HB2 LEU 122 1HB LEU 122 7.374 19.189 9.496
778 HB3 LEU 122 2HB LEU 122 6.321 18.694 8.172
779 HG LEU 122 HG LEU 122 4.774 20.243 8.664
780 HD11 LEU 122 1HD1 LEU 122 4.321 20.924 11.102
781 HD12 LEU 122 2HD1 LEU 122 5.310 19.526 11.523
782 HD13 LEU 122 3HD1 LEU 122 3.837 19.311 10.577
783 HD21 LEU 122 1HD2 LEU 122 6.900 21.497 8.642
784 HD22 LEU 122 2HD2 LEU 122 6.974 21.362 10.399
785 HD23 LEU 122 3HD2 LEU 122 5.664 22.266 9.637
786 H TRP 123 H TRP 123 8.290 16.913 9.220
787 HA TRP 123 HA TRP 123 8.002 15.366 7.064
788 HB2 TRP 123 1HB TRP 123 10.128 15.792 8.399
789 HB3 TRP 123 2HB TRP 123 9.684 14.394 9.374
790 HD1 TRP 123 HD1 TRP 123 10.886 12.279 8.617
791 HE1 TRP 123 HE1 TRP 123 11.774 11.346 6.388
792 HE3 TRP 123 HE3 TRP 123 9.476 16.094 5.519
793 HZ2 TRP 123 HZ2 TRP 123 11.865 12.124 3.677
794 HZ3 TRP 123 HZ3 TRP 123 10.002 15.922 3.121
795 HH2 TRP 123 HH2 TRP 123 11.172 13.977 2.221
796 H LYS 124 H LYS 124 7.582 14.118 10.374
797 HA LYS 124 HA LYS 124 7.001 11.509 9.936
798 HB2 LYS 124 1HB LYS 124 5.718 11.508 11.947
799 HB3 LYS 124 2HB LYS 124 6.987 12.710 12.147
800 HG2 LYS 124 1HG LYS 124 5.334 14.463 11.530
801 HG3 LYS 124 2HG LYS 124 4.085 13.216 11.530
802 HD2 LYS 124 1HD LYS 124 5.751 13.280 13.946
803 HD3 LYS 124 2HD LYS 124 4.775 14.728 13.688
804 HE2 LYS 124 1HE LYS 124 2.764 13.454 13.627
805 HE3 LYS 124 2HE LYS 124 3.656 11.935 13.571
806 HZ1 LYS 124 1HZ LYS 124 2.941 12.151 15.770
807 HZ2 LYS 124 2HZ LYS 124 3.346 13.791 15.852
808 HZ3 LYS 124 3HZ LYS 124 4.566 12.620 15.818
809 H LEU 125 H LEU 125 4.723 14.207 9.572
810 HA LEU 125 HA LEU 125 2.438 12.757 8.949
811 HB2 LEU 125 1HB LEU 125 3.057 15.390 9.147
812 HB3 LEU 125 2HB LEU 125 2.828 15.230 7.407
813 HG LEU 125 HG LEU 125 0.808 14.661 9.571
814 HD11 LEU 125 1HD1 LEU 125 1.158 17.027 9.037
815 HD12 LEU 125 2HD1 LEU 125 -0.437 16.468 8.535
816 HD13 LEU 125 3HD1 LEU 125 0.838 16.684 7.336
817 HD21 LEU 125 1HD2 LEU 125 0.406 14.398 6.600
818 HD22 LEU 125 2HD2 LEU 125 -0.715 13.964 7.890
819 HD23 LEU 125 3HD2 LEU 125 0.763 13.030 7.654
820 H LEU 126 H LEU 126 5.162 13.661 6.929
821 HA LEU 126 HA LEU 126 4.174 13.209 4.401
822 HB2 LEU 126 1HB LEU 126 6.512 13.949 5.167
823 HB3 LEU 126 2HB LEU 126 6.886 12.228 5.226
824 HG LEU 126 HG LEU 126 6.588 12.003 2.873
825 HD11 LEU 126 1HD1 LEU 126 5.088 14.491 3.179
826 HD12 LEU 126 2HD1 LEU 126 4.928 13.206 1.982
827 HD13 LEU 126 3HD1 LEU 126 6.148 14.462 1.770
828 HD21 LEU 126 1HD2 LEU 126 8.329 13.408 2.031
829 HD22 LEU 126 2HD2 LEU 126 8.723 12.994 3.700
830 HD23 LEU 126 3HD2 LEU 126 8.071 14.588 3.317
831 HA PRO 127 HA PRO 127 2.988 8.906 4.821
832 HB2 PRO 127 1HB PRO 127 1.786 8.753 2.392
833 HB3 PRO 127 2HB PRO 127 1.014 9.491 3.801
834 HG2 PRO 127 1HG PRO 127 2.433 10.803 1.514
835 HG3 PRO 127 2HG PRO 127 0.918 11.271 2.307
836 HD2 PRO 127 1HD PRO 127 3.278 12.484 2.845
837 HD3 PRO 127 2HD PRO 127 2.005 12.288 4.067
838 H GLU 128 H GLU 128 3.549 6.935 3.773
839 HA GLU 128 HA GLU 128 5.991 7.156 2.175
840 HB2 GLU 128 1HB GLU 128 6.714 5.283 3.197
841 HB3 GLU 128 2HB GLU 128 5.442 5.626 4.361
842 HG2 GLU 128 1HG GLU 128 3.925 4.188 2.969
843 HG3 GLU 128 2HG GLU 128 5.350 3.712 2.048
844 H ASN 129 H ASN 129 2.760 5.770 2.110
845 HA ASN 129 HA ASN 129 1.590 4.667 0.483
846 HB2 ASN 129 1HB ASN 129 2.909 6.999 -0.798
847 HB3 ASN 129 2HB ASN 129 2.172 5.817 -1.876
848 HD21 ASN 129 2HD2 ASN 129 0.214 6.373 -2.453
849 HD22 ASN 129 1HD2 ASN 129 -0.956 7.177 -1.469
Start of MODEL 18
1 H1 GLN 1 H GLN 1 1.797 -1.122 1.668
2 HA GLN 1 HA GLN 1 1.723 -0.602 -0.992
3 HB2 GLN 1 1HB GLN 1 0.878 1.869 0.531
4 HB3 GLN 1 2HB GLN 1 1.345 1.840 -1.164
5 HG2 GLN 1 1HG GLN 1 -0.574 0.729 -1.811
6 HG3 GLN 1 2HG GLN 1 -0.876 0.098 -0.193
7 HE21 GLN 1 2HE2 GLN 1 -0.818 3.069 -2.094
8 HE22 GLN 1 1HE2 GLN 1 -2.044 3.885 -1.190
9 H ILE 2 H ILE 2 3.601 -1.415 0.835
10 HA ILE 2 HA ILE 2 5.610 0.734 0.655
11 HB ILE 2 HB ILE 2 6.670 -0.108 2.681
12 HG12 ILE 2 1HG1 ILE 2 4.695 -1.703 3.871
13 HG13 ILE 2 2HG1 ILE 2 4.867 -2.329 2.235
14 HG21 ILE 2 1HG2 ILE 2 4.498 0.273 4.207
15 HG22 ILE 2 2HG2 ILE 2 5.343 1.581 3.382
16 HG23 ILE 2 3HG2 ILE 2 3.890 0.882 2.668
17 HD11 ILE 2 1HD1 ILE 2 6.620 -3.471 2.943
18 HD12 ILE 2 2HD1 ILE 2 7.470 -1.941 3.162
19 HD13 ILE 2 3HD1 ILE 2 6.583 -2.658 4.507
20 H ASN 3 H ASN 3 6.774 0.132 -1.084
21 HA ASN 3 HA ASN 3 7.570 -2.669 -1.372
22 HB2 ASN 3 1HB ASN 3 7.219 -0.390 -3.210
23 HB3 ASN 3 2HB ASN 3 8.613 -1.409 -3.555
24 HD21 ASN 3 2HD2 ASN 3 5.768 -2.679 -2.029
25 HD22 ASN 3 1HD2 ASN 3 5.213 -3.608 -3.376
26 H GLN 4 H GLN 4 9.859 -3.016 -2.189
27 HA GLN 4 HA GLN 4 11.666 -1.750 -0.314
28 HB2 GLN 4 1HB GLN 4 12.529 -3.752 -2.369
29 HB3 GLN 4 2HB GLN 4 13.142 -3.499 -0.741
30 HG2 GLN 4 1HG GLN 4 11.989 -5.428 -0.424
31 HG3 GLN 4 2HG GLN 4 10.716 -4.261 -0.069
32 HE21 GLN 4 2HE2 GLN 4 8.897 -4.333 -1.217
33 HE22 GLN 4 1HE2 GLN 4 8.638 -5.314 -2.615
34 H VAL 5 H VAL 5 14.001 -1.406 -1.290
35 HA VAL 5 HA VAL 5 13.941 -0.147 -3.910
36 HB VAL 5 HB VAL 5 14.754 1.998 -3.166
37 HG11 VAL 5 1HG1 VAL 5 12.324 1.680 -3.298
38 HG12 VAL 5 2HG1 VAL 5 12.298 1.226 -1.593
39 HG13 VAL 5 3HG1 VAL 5 12.765 2.860 -2.065
40 HG21 VAL 5 1HG2 VAL 5 15.591 2.425 -1.136
41 HG22 VAL 5 2HG2 VAL 5 14.231 1.657 -0.316
42 HG23 VAL 5 3HG2 VAL 5 15.575 0.677 -0.902
43 H ARG 6 H ARG 6 16.191 0.819 -4.390
44 HA ARG 6 HA ARG 6 18.363 -0.512 -2.992
45 HB2 ARG 6 1HB ARG 6 17.342 -1.959 -4.951
46 HB3 ARG 6 2HB ARG 6 18.299 -0.878 -5.955
47 HG2 ARG 6 1HG ARG 6 20.299 -1.673 -5.142
48 HG3 ARG 6 2HG ARG 6 19.580 -2.245 -3.636
49 HD2 ARG 6 1HD ARG 6 18.409 -4.009 -4.904
50 HD3 ARG 6 2HD ARG 6 19.214 -3.458 -6.373
51 HE ARG 6 HE ARG 6 21.018 -4.129 -4.235
52 HH11 ARG 6 1HH1 ARG 6 19.208 -5.341 -6.951
53 HH12 ARG 6 2HH1 ARG 6 20.242 -6.708 -7.197
54 HH21 ARG 6 1HH2 ARG 6 22.387 -5.926 -4.549
55 HH22 ARG 6 2HH2 ARG 6 22.050 -7.041 -5.829
56 HA PRO 7 HA PRO 7 19.480 3.723 -4.351
57 HB2 PRO 7 1HB PRO 7 20.976 4.256 -2.149
58 HB3 PRO 7 2HB PRO 7 19.222 4.466 -2.192
59 HG2 PRO 7 1HG PRO 7 20.832 2.200 -1.081
60 HG3 PRO 7 2HG PRO 7 19.412 3.008 -0.391
61 HD2 PRO 7 1HD PRO 7 19.255 0.628 -1.674
62 HD3 PRO 7 2HD PRO 7 17.940 1.821 -1.709
63 H LYS 8 H LYS 8 20.985 3.644 -5.901
64 HA LYS 8 HA LYS 8 23.233 1.923 -5.864
65 HB2 LYS 8 1HB LYS 8 22.652 4.353 -7.565
66 HB3 LYS 8 2HB LYS 8 23.963 3.219 -7.859
67 HG2 LYS 8 1HG LYS 8 21.013 2.632 -7.956
68 HG3 LYS 8 2HG LYS 8 22.129 2.715 -9.321
69 HD2 LYS 8 1HD LYS 8 23.419 0.847 -8.109
70 HD3 LYS 8 2HD LYS 8 21.944 0.640 -7.161
71 HE2 LYS 8 1HE LYS 8 20.798 0.575 -9.510
72 HE3 LYS 8 2HE LYS 8 22.418 0.164 -10.072
73 HZ1 LYS 8 1HZ LYS 8 21.774 -1.912 -9.594
74 HZ2 LYS 8 2HZ LYS 8 20.535 -1.419 -8.553
75 HZ3 LYS 8 3HZ LYS 8 22.129 -1.497 -7.992
76 H LEU 9 H LEU 9 25.452 3.163 -6.537
77 HA LEU 9 HA LEU 9 26.671 3.977 -4.247
78 HB2 LEU 9 1HB LEU 9 27.855 5.507 -6.305
79 HB3 LEU 9 2HB LEU 9 28.410 3.984 -5.614
80 HG LEU 9 HG LEU 9 26.409 4.063 -7.853
81 HD11 LEU 9 1HD1 LEU 9 28.518 5.325 -8.427
82 HD12 LEU 9 2HD1 LEU 9 28.136 3.948 -9.459
83 HD13 LEU 9 3HD1 LEU 9 29.382 3.801 -8.220
84 HD21 LEU 9 1HD2 LEU 9 26.651 1.833 -7.919
85 HD22 LEU 9 2HD2 LEU 9 27.246 2.022 -6.269
86 HD23 LEU 9 3HD2 LEU 9 28.386 1.908 -7.611
87 HA PRO 10 HA PRO 10 25.857 8.635 -5.240
88 HB2 PRO 10 1HB PRO 10 24.107 9.196 -7.237
89 HB3 PRO 10 2HB PRO 10 25.841 8.993 -7.509
90 HG2 PRO 10 1HG PRO 10 23.615 7.037 -7.934
91 HG3 PRO 10 2HG PRO 10 25.011 7.387 -8.971
92 HD2 PRO 10 1HD PRO 10 24.919 5.236 -7.329
93 HD3 PRO 10 2HD PRO 10 26.433 6.080 -7.713
94 H LEU 11 H LEU 11 23.647 6.159 -4.851
95 HA LEU 11 HA LEU 11 21.574 7.990 -3.842
96 HB2 LEU 11 1HB LEU 11 21.477 5.464 -5.301
97 HB3 LEU 11 2HB LEU 11 20.430 5.494 -3.884
98 HG LEU 11 HG LEU 11 19.200 7.355 -4.747
99 HD11 LEU 11 1HD1 LEU 11 20.459 8.853 -5.853
100 HD12 LEU 11 2HD1 LEU 11 19.977 7.923 -7.271
101 HD13 LEU 11 3HD1 LEU 11 21.539 7.622 -6.509
102 HD21 LEU 11 1HD2 LEU 11 18.118 5.647 -5.727
103 HD22 LEU 11 2HD2 LEU 11 19.599 4.946 -6.382
104 HD23 LEU 11 3HD2 LEU 11 18.818 6.294 -7.211
105 H LEU 12 H LEU 12 23.923 5.683 -2.970
106 HA LEU 12 HA LEU 12 22.699 4.830 -0.517
107 HB2 LEU 12 1HB LEU 12 24.778 3.933 -2.084
108 HB3 LEU 12 2HB LEU 12 25.598 4.586 -0.667
109 HG LEU 12 HG LEU 12 23.835 2.207 -0.921
110 HD11 LEU 12 1HD1 LEU 12 25.663 1.161 -0.219
111 HD12 LEU 12 2HD1 LEU 12 25.827 2.236 1.169
112 HD13 LEU 12 3HD1 LEU 12 26.519 2.693 -0.387
113 HD21 LEU 12 1HD2 LEU 12 22.510 3.213 0.680
114 HD22 LEU 12 2HD2 LEU 12 23.860 4.089 1.402
115 HD23 LEU 12 3HD2 LEU 12 23.689 2.354 1.671
116 H LYS 13 H LYS 13 25.222 7.143 -1.425
117 HA LYS 13 HA LYS 13 25.945 7.924 1.176
118 HB2 LYS 13 1HB LYS 13 27.176 9.629 0.181
119 HB3 LYS 13 2HB LYS 13 27.090 8.421 -1.095
120 HG2 LYS 13 1HG LYS 13 26.490 10.178 -2.355
121 HG3 LYS 13 2HG LYS 13 24.894 9.871 -1.667
122 HD2 LYS 13 1HD LYS 13 25.062 12.090 -1.186
123 HD3 LYS 13 2HD LYS 13 25.852 11.443 0.254
124 HE2 LYS 13 1HE LYS 13 27.196 13.228 -0.615
125 HE3 LYS 13 2HE LYS 13 28.037 11.706 -0.902
126 HZ1 LYS 13 1HZ LYS 13 26.327 12.952 -2.967
127 HZ2 LYS 13 2HZ LYS 13 27.519 11.769 -3.165
128 HZ3 LYS 13 3HZ LYS 13 27.960 13.361 -2.801
129 H ILE 14 H ILE 14 23.308 8.872 -0.905
130 HA ILE 14 HA ILE 14 22.545 11.264 0.311
131 HB ILE 14 HB ILE 14 20.650 9.215 -0.838
132 HG12 ILE 14 1HG1 ILE 14 22.522 11.155 -2.153
133 HG13 ILE 14 2HG1 ILE 14 22.186 9.479 -2.572
134 HG21 ILE 14 1HG2 ILE 14 20.479 12.210 -0.544
135 HG22 ILE 14 2HG2 ILE 14 19.315 11.215 -1.416
136 HG23 ILE 14 3HG2 ILE 14 19.526 11.006 0.322
137 HD11 ILE 14 1HD1 ILE 14 21.161 10.641 -4.273
138 HD12 ILE 14 2HD1 ILE 14 19.825 10.368 -3.154
139 HD13 ILE 14 3HD1 ILE 14 20.624 11.938 -3.206
140 H LEU 15 H LEU 15 21.269 7.988 0.927
141 HA LEU 15 HA LEU 15 19.758 8.802 3.198
142 HB2 LEU 15 1HB LEU 15 20.665 6.022 2.473
143 HB3 LEU 15 2HB LEU 15 19.332 6.457 3.541
144 HG LEU 15 HG LEU 15 18.056 6.056 1.745
145 HD11 LEU 15 1HD1 LEU 15 17.502 7.961 0.512
146 HD12 LEU 15 2HD1 LEU 15 19.152 8.580 0.552
147 HD13 LEU 15 3HD1 LEU 15 18.170 8.595 2.016
148 HD21 LEU 15 1HD2 LEU 15 20.650 6.019 0.408
149 HD22 LEU 15 2HD2 LEU 15 19.333 6.571 -0.627
150 HD23 LEU 15 3HD2 LEU 15 19.232 4.997 0.166
151 H HIS 16 H HIS 16 22.936 7.346 2.742
152 HA HIS 16 HA HIS 16 23.537 6.638 5.353
153 HB2 HIS 16 1HB HIS 16 25.210 7.533 3.031
154 HB3 HIS 16 2HB HIS 16 25.963 7.271 4.602
155 HD1 HIS 16 HD1 HIS 16 27.278 5.332 3.297
156 HD2 HIS 16 HD2 HIS 16 23.209 4.719 3.868
157 HE1 HIS 16 HE1 HIS 16 26.906 2.876 2.902
158 H ALA 17 H ALA 17 23.930 9.776 3.749
159 HA ALA 17 HA ALA 17 25.168 11.108 5.896
160 HB1 ALA 17 1HB ALA 17 24.412 13.183 4.753
161 HB2 ALA 17 2HB ALA 17 25.247 12.049 3.691
162 HB3 ALA 17 3HB ALA 17 23.489 12.179 3.634
163 H ALA 18 H ALA 18 21.837 10.342 5.226
164 HA ALA 18 HA ALA 18 20.812 12.145 7.247
165 HB1 ALA 18 1HB ALA 18 19.710 10.570 5.081
166 HB2 ALA 18 2HB ALA 18 18.765 10.408 6.562
167 HB3 ALA 18 3HB ALA 18 19.063 12.005 5.877
168 H GLY 19 H GLY 19 22.482 9.388 7.479
169 HA2 GLY 19 1HA GLY 19 22.762 8.489 9.735
170 HA3 GLY 19 2HA GLY 19 21.013 8.550 9.900
171 H ALA 20 H ALA 20 20.959 7.561 6.975
172 HA ALA 20 HA ALA 20 20.409 4.879 7.515
173 HB1 ALA 20 1HB ALA 20 21.266 5.728 4.783
174 HB2 ALA 20 2HB ALA 20 19.961 4.643 5.266
175 HB3 ALA 20 3HB ALA 20 19.785 6.384 5.481
176 H GLN 21 H GLN 21 21.530 3.049 6.222
177 HA GLN 21 HA GLN 21 24.242 3.104 5.603
178 HB2 GLN 21 1HB GLN 21 24.056 3.512 8.253
179 HB3 GLN 21 2HB GLN 21 24.049 1.753 8.236
180 HG2 GLN 21 1HG GLN 21 26.293 2.856 8.512
181 HG3 GLN 21 2HG GLN 21 26.171 1.648 7.234
182 HE21 GLN 21 2HE2 GLN 21 25.229 5.061 7.377
183 HE22 GLN 21 1HE2 GLN 21 26.176 5.558 6.020
184 H GLY 22 H GLY 22 24.449 1.413 4.302
185 HA2 GLY 22 1HA GLY 22 24.390 -1.188 4.660
186 HA3 GLY 22 2HA GLY 22 22.660 -0.877 4.661
187 H GLU 23 H GLU 23 22.216 -2.033 2.808
188 HA GLU 23 HA GLU 23 22.942 -0.684 0.328
189 HB2 GLU 23 1HB GLU 23 23.278 -3.670 0.632
190 HB3 GLU 23 2HB GLU 23 23.644 -2.702 -0.789
191 HG2 GLU 23 1HG GLU 23 25.348 -1.494 0.630
192 HG3 GLU 23 2HG GLU 23 25.095 -2.754 1.837
193 H MET 24 H MET 24 20.556 -1.405 2.160
194 HA MET 24 HA MET 24 18.669 -1.703 0.024
195 HB2 MET 24 1HB MET 24 17.619 -3.737 1.353
196 HB3 MET 24 2HB MET 24 18.826 -3.987 0.099
197 HG2 MET 24 1HG MET 24 19.870 -3.582 2.821
198 HG3 MET 24 2HG MET 24 18.959 -5.066 2.554
199 HE1 MET 24 1HE MET 24 22.742 -4.225 2.688
200 HE2 MET 24 2HE MET 24 21.549 -5.137 3.613
201 HE3 MET 24 3HE MET 24 22.729 -5.987 2.614
202 H PHE 25 H PHE 25 16.613 -1.045 0.600
203 HA PHE 25 HA PHE 25 15.834 -0.715 3.339
204 HB2 PHE 25 1HB PHE 25 16.250 1.806 1.726
205 HB3 PHE 25 2HB PHE 25 15.725 1.689 3.403
206 HD1 PHE 25 HD2 PHE 25 18.567 1.480 1.116
207 HD2 PHE 25 HD1 PHE 25 17.301 1.221 5.171
208 HE1 PHE 25 HE2 PHE 25 20.908 1.639 1.853
209 HE2 PHE 25 HE1 PHE 25 19.641 1.381 5.915
210 HZ PHE 25 HZ PHE 25 21.448 1.589 4.255
211 H THR 26 H THR 26 13.659 0.203 3.541
212 HA THR 26 HA THR 26 12.040 -0.519 1.219
213 HB THR 26 HB THR 26 10.422 0.239 3.449
214 HG1 THR 26 1HG THR 26 12.343 -1.752 4.113
215 HG21 THR 26 1HG2 THR 26 9.386 -1.377 2.265
216 HG22 THR 26 2HG2 THR 26 10.276 -2.476 3.319
217 HG23 THR 26 3HG2 THR 26 10.905 -2.087 1.718
218 H VAL 27 H VAL 27 9.923 0.832 1.060
219 HA VAL 27 HA VAL 27 10.507 3.331 0.061
220 HB VAL 27 HB VAL 27 8.444 2.603 -0.632
221 HG11 VAL 27 1HG1 VAL 27 7.577 0.890 0.498
222 HG12 VAL 27 2HG1 VAL 27 8.342 1.403 2.003
223 HG13 VAL 27 3HG1 VAL 27 6.786 2.084 1.526
224 HG21 VAL 27 1HG2 VAL 27 6.796 4.149 0.099
225 HG22 VAL 27 2HG2 VAL 27 7.567 4.329 1.675
226 HG23 VAL 27 3HG2 VAL 27 8.353 4.967 0.231
227 H LYS 28 H LYS 28 9.036 2.616 3.230
228 HA LYS 28 HA LYS 28 8.944 5.240 4.174
229 HB2 LYS 28 1HB LYS 28 9.512 3.043 6.103
230 HB3 LYS 28 2HB LYS 28 8.332 4.344 6.200
231 HG2 LYS 28 1HG LYS 28 6.895 2.647 5.829
232 HG3 LYS 28 2HG LYS 28 7.297 2.989 4.144
233 HD2 LYS 28 1HD LYS 28 7.781 0.795 4.050
234 HD3 LYS 28 2HD LYS 28 9.291 1.272 4.830
235 HE2 LYS 28 1HE LYS 28 8.070 -0.660 5.894
236 HE3 LYS 28 2HE LYS 28 8.481 0.673 6.972
237 HZ1 LYS 28 1HZ LYS 28 6.340 1.132 7.343
238 HZ2 LYS 28 2HZ LYS 28 6.038 -0.426 6.758
239 HZ3 LYS 28 3HZ LYS 28 5.889 0.907 5.728
240 H GLU 29 H GLU 29 11.493 2.793 4.471
241 HA GLU 29 HA GLU 29 13.225 4.201 6.140
242 HB2 GLU 29 1HB GLU 29 13.849 2.221 3.943
243 HB3 GLU 29 2HB GLU 29 15.021 2.788 5.125
244 HG2 GLU 29 1HG GLU 29 12.885 0.810 5.388
245 HG3 GLU 29 2HG GLU 29 14.410 0.963 6.258
246 H VAL 30 H VAL 30 13.184 4.067 2.580
247 HA VAL 30 HA VAL 30 15.299 5.819 2.111
248 HB VAL 30 HB VAL 30 12.829 5.402 0.421
249 HG11 VAL 30 1HG1 VAL 30 13.633 6.990 -0.908
250 HG12 VAL 30 2HG1 VAL 30 15.049 7.193 0.125
251 HG13 VAL 30 3HG1 VAL 30 15.066 5.996 -1.170
252 HG21 VAL 30 1HG2 VAL 30 13.859 3.602 -0.568
253 HG22 VAL 30 2HG2 VAL 30 15.479 4.149 -0.134
254 HG23 VAL 30 3HG2 VAL 30 14.430 3.437 1.092
255 H MET 31 H MET 31 11.809 6.529 2.244
256 HA MET 31 HA MET 31 12.026 9.296 1.848
257 HB2 MET 31 1HB MET 31 9.810 9.059 1.794
258 HB3 MET 31 2HB MET 31 9.960 7.423 2.421
259 HG2 MET 31 1HG MET 31 8.487 8.616 3.847
260 HG3 MET 31 2HG MET 31 10.001 8.381 4.717
261 HE1 MET 31 1HE MET 31 10.449 11.175 1.990
262 HE2 MET 31 2HE MET 31 8.743 10.727 1.969
263 HE3 MET 31 3HE MET 31 9.227 12.332 2.519
264 H HIS 32 H HIS 32 12.060 7.352 4.801
265 HA HIS 32 HA HIS 32 11.949 9.394 6.686
266 HB2 HIS 32 1HB HIS 32 11.989 6.782 6.948
267 HB3 HIS 32 2HB HIS 32 13.723 7.023 7.138
268 HD1 HIS 32 HD1 HIS 32 10.858 6.650 9.127
269 HD2 HIS 32 HD2 HIS 32 14.099 9.247 9.240
270 HE1 HIS 32 HE1 HIS 32 10.935 7.528 11.483
271 H TYR 33 H TYR 33 14.628 8.241 4.748
272 HA TYR 33 HA TYR 33 16.642 9.672 6.193
273 HB2 TYR 33 1HB TYR 33 16.680 8.443 3.430
274 HB3 TYR 33 2HB TYR 33 18.091 9.094 4.256
275 HD1 TYR 33 HD2 TYR 33 17.936 8.106 6.934
276 HD2 TYR 33 HD1 TYR 33 16.839 6.144 3.321
277 HE1 TYR 33 HE2 TYR 33 18.317 5.926 8.009
278 HE2 TYR 33 HE1 TYR 33 17.215 3.959 4.386
279 HH TYR 33 HH TYR 33 18.676 3.678 7.537
280 H LEU 34 H LEU 34 14.627 10.310 3.393
281 HA LEU 34 HA LEU 34 15.896 12.462 2.245
282 HB2 LEU 34 1HB LEU 34 13.204 11.403 2.326
283 HB3 LEU 34 2HB LEU 34 13.205 13.162 2.212
284 HG LEU 34 HG LEU 34 13.058 12.310 0.002
285 HD11 LEU 34 1HD1 LEU 34 15.966 12.989 0.320
286 HD12 LEU 34 2HD1 LEU 34 14.689 14.191 0.500
287 HD13 LEU 34 3HD1 LEU 34 14.894 13.346 -1.034
288 HD21 LEU 34 1HD2 LEU 34 15.551 10.692 0.483
289 HD22 LEU 34 2HD2 LEU 34 14.501 10.668 -0.933
290 HD23 LEU 34 3HD2 LEU 34 13.921 10.030 0.606
291 H GLY 35 H GLY 35 13.463 12.603 4.853
292 HA2 GLY 35 1HA GLY 35 13.496 15.341 5.288
293 HA3 GLY 35 2HA GLY 35 13.139 14.144 6.524
294 H GLN 36 H GLN 36 15.519 12.869 6.858
295 HA GLN 36 HA GLN 36 16.933 14.642 8.515
296 HB2 GLN 36 1HB GLN 36 17.698 11.942 7.400
297 HB3 GLN 36 2HB GLN 36 18.644 12.800 8.609
298 HG2 GLN 36 1HG GLN 36 15.752 12.251 9.094
299 HG3 GLN 36 2HG GLN 36 16.949 10.980 9.337
300 HE21 GLN 36 2HE2 GLN 36 18.976 11.937 10.552
301 HE22 GLN 36 1HE2 GLN 36 18.585 12.781 12.007
302 H TYR 37 H TYR 37 17.579 13.465 5.246
303 HA TYR 37 HA TYR 37 20.144 14.495 4.907
304 HB2 TYR 37 1HB TYR 37 18.913 12.949 3.340
305 HB3 TYR 37 2HB TYR 37 18.030 14.354 2.753
306 HD1 TYR 37 HD2 TYR 37 21.606 13.477 3.436
307 HD2 TYR 37 HD1 TYR 37 18.786 15.193 0.752
308 HE1 TYR 37 HE2 TYR 37 23.418 13.941 1.838
309 HE2 TYR 37 HE1 TYR 37 20.590 15.661 -0.854
310 HH TYR 37 HH TYR 37 23.961 14.794 -0.133
311 H ILE 38 H ILE 38 17.026 15.993 4.056
312 HA ILE 38 HA ILE 38 18.045 18.425 3.133
313 HB ILE 38 HB ILE 38 15.390 17.900 4.474
314 HG12 ILE 38 1HG1 ILE 38 15.872 18.180 1.520
315 HG13 ILE 38 2HG1 ILE 38 16.091 16.628 2.321
316 HG21 ILE 38 1HG2 ILE 38 16.475 20.268 2.995
317 HG22 ILE 38 2HG2 ILE 38 14.745 19.935 3.035
318 HG23 ILE 38 3HG2 ILE 38 15.624 20.215 4.538
319 HD11 ILE 38 1HD1 ILE 38 13.919 16.559 1.496
320 HD12 ILE 38 2HD1 ILE 38 13.715 16.964 3.201
321 HD13 ILE 38 3HD1 ILE 38 13.585 18.224 1.973
322 H MET 39 H MET 39 16.928 17.508 6.380
323 HA MET 39 HA MET 39 17.368 20.015 7.585
324 HB2 MET 39 1HB MET 39 16.446 18.994 9.344
325 HB3 MET 39 2HB MET 39 16.389 17.521 8.386
326 HG2 MET 39 1HG MET 39 18.524 16.821 9.246
327 HG3 MET 39 2HG MET 39 18.713 18.346 10.107
328 HE1 MET 39 1HE MET 39 15.168 17.149 9.920
329 HE2 MET 39 2HE MET 39 14.828 17.008 11.645
330 HE3 MET 39 3HE MET 39 15.436 18.528 10.986
331 H VAL 40 H VAL 40 19.450 17.205 7.130
332 HA VAL 40 HA VAL 40 21.599 18.179 8.723
333 HB VAL 40 HB VAL 40 21.020 15.776 7.478
334 HG11 VAL 40 1HG1 VAL 40 21.991 16.610 5.387
335 HG12 VAL 40 2HG1 VAL 40 23.508 16.937 6.227
336 HG13 VAL 40 3HG1 VAL 40 22.932 15.278 6.058
337 HG21 VAL 40 1HG2 VAL 40 23.075 14.991 8.544
338 HG22 VAL 40 2HG2 VAL 40 23.616 16.658 8.742
339 HG23 VAL 40 3HG2 VAL 40 22.187 16.086 9.604
340 H LYS 41 H LYS 41 20.817 18.332 5.285
341 HA LYS 41 HA LYS 41 23.288 19.631 4.588
342 HB2 LYS 41 1HB LYS 41 20.855 18.724 3.161
343 HB3 LYS 41 2HB LYS 41 21.717 20.078 2.441
344 HG2 LYS 41 1HG LYS 41 22.766 17.319 3.003
345 HG3 LYS 41 2HG LYS 41 22.542 18.099 1.436
346 HD2 LYS 41 1HD LYS 41 24.738 18.560 1.621
347 HD3 LYS 41 2HD LYS 41 24.186 19.873 2.663
348 HE2 LYS 41 1HE LYS 41 25.456 18.995 4.266
349 HE3 LYS 41 2HE LYS 41 24.305 17.662 4.338
350 HZ1 LYS 41 1HZ LYS 41 25.942 17.065 2.225
351 HZ2 LYS 41 2HZ LYS 41 25.989 16.360 3.761
352 HZ3 LYS 41 3HZ LYS 41 26.996 17.671 3.402
353 H GLN 42 H GLN 42 20.307 20.622 5.879
354 HA GLN 42 HA GLN 42 19.534 22.673 6.507
355 HB2 GLN 42 1HB GLN 42 22.334 23.075 6.141
356 HB3 GLN 42 2HB GLN 42 21.489 24.471 5.484
357 HG2 GLN 42 1HG GLN 42 21.478 25.244 7.565
358 HG3 GLN 42 2HG GLN 42 20.202 24.065 7.866
359 HE21 GLN 42 2HE2 GLN 42 21.991 21.794 7.575
360 HE22 GLN 42 1HE2 GLN 42 22.946 21.742 9.013
361 H LEU 43 H LEU 43 18.564 21.628 4.200
362 HA LEU 43 HA LEU 43 18.390 23.950 2.394
363 HB2 LEU 43 1HB LEU 43 17.685 21.151 1.591
364 HB3 LEU 43 2HB LEU 43 18.083 22.529 0.567
365 HG LEU 43 HG LEU 43 20.175 21.386 2.368
366 HD11 LEU 43 1HD1 LEU 43 19.193 19.460 1.209
367 HD12 LEU 43 2HD1 LEU 43 20.831 19.803 0.653
368 HD13 LEU 43 3HD1 LEU 43 19.448 20.271 -0.337
369 HD21 LEU 43 1HD2 LEU 43 20.329 23.526 0.919
370 HD22 LEU 43 2HD2 LEU 43 20.502 22.401 -0.428
371 HD23 LEU 43 3HD2 LEU 43 21.666 22.376 0.897
372 H TYR 44 H TYR 44 16.772 24.592 4.120
373 HA TYR 44 HA TYR 44 14.174 24.358 3.110
374 HB2 TYR 44 1HB TYR 44 13.068 22.989 4.766
375 HB3 TYR 44 2HB TYR 44 14.359 22.050 4.026
376 HD1 TYR 44 HD2 TYR 44 16.739 22.606 5.388
377 HD2 TYR 44 HD1 TYR 44 12.802 22.516 7.000
378 HE1 TYR 44 HE2 TYR 44 17.667 22.123 7.614
379 HE2 TYR 44 HE1 TYR 44 13.720 22.034 9.230
380 HH TYR 44 HH TYR 44 15.777 22.273 10.466
381 H ASP 45 H ASP 45 12.551 25.408 4.520
382 HA ASP 45 HA ASP 45 13.719 27.682 5.828
383 HB2 ASP 45 1HB ASP 45 11.336 27.202 4.507
384 HB3 ASP 45 2HB ASP 45 10.840 27.341 6.192
385 H GLN 46 H GLN 46 14.307 27.759 7.884
386 HA GLN 46 HA GLN 46 13.823 25.687 9.727
387 HB2 GLN 46 1HB GLN 46 15.029 28.404 9.851
388 HB3 GLN 46 2HB GLN 46 14.562 27.653 11.371
389 HG2 GLN 46 1HG GLN 46 16.968 27.346 10.256
390 HG3 GLN 46 2HG GLN 46 16.212 26.128 11.283
391 HE21 GLN 46 2HE2 GLN 46 16.100 27.133 7.877
392 HE22 GLN 46 1HE2 GLN 46 16.211 25.537 7.227
393 H GLN 47 H GLN 47 12.118 28.640 9.007
394 HA GLN 47 HA GLN 47 10.498 28.558 11.388
395 HB2 GLN 47 1HB GLN 47 9.882 30.149 8.910
396 HB3 GLN 47 2HB GLN 47 9.450 30.510 10.576
397 HG2 GLN 47 1HG GLN 47 11.152 31.986 10.277
398 HG3 GLN 47 2HG GLN 47 12.055 30.602 10.890
399 HE21 GLN 47 2HE2 GLN 47 13.626 29.757 9.677
400 HE22 GLN 47 1HE2 GLN 47 13.989 30.227 8.055
401 H GLU 48 H GLU 48 10.259 27.458 8.080
402 HA GLU 48 HA GLU 48 7.684 26.200 8.748
403 HB2 GLU 48 1HB GLU 48 8.460 27.709 6.271
404 HB3 GLU 48 2HB GLU 48 7.224 26.460 6.206
405 HG2 GLU 48 1HG GLU 48 5.731 27.672 7.437
406 HG3 GLU 48 2HG GLU 48 6.989 28.579 8.275
407 H GLN 49 H GLN 49 9.104 24.393 9.319
408 HA GLN 49 HA GLN 49 10.853 23.090 7.624
409 HB2 GLN 49 1HB GLN 49 9.031 22.072 9.790
410 HB3 GLN 49 2HB GLN 49 10.092 20.986 8.903
411 HG2 GLN 49 1HG GLN 49 11.430 21.463 10.670
412 HG3 GLN 49 2HG GLN 49 11.913 22.763 9.581
413 HE21 GLN 49 2HE2 GLN 49 12.582 23.482 11.863
414 HE22 GLN 49 1HE2 GLN 49 11.449 24.493 12.686
415 H HIS 50 H HIS 50 7.449 23.376 7.382
416 HA HIS 50 HA HIS 50 6.902 21.026 5.890
417 HB2 HIS 50 1HB HIS 50 4.754 21.867 5.616
418 HB3 HIS 50 2HB HIS 50 5.273 22.673 7.093
419 HD1 HIS 50 HD1 HIS 50 4.777 25.086 7.118
420 HD2 HIS 50 HD2 HIS 50 5.327 23.672 3.250
421 HE1 HIS 50 HE1 HIS 50 4.373 27.062 5.616
422 H MET 51 H MET 51 8.752 23.667 5.122
423 HA MET 51 HA MET 51 8.400 23.167 2.243
424 HB2 MET 51 1HB MET 51 8.263 25.691 3.715
425 HB3 MET 51 2HB MET 51 9.400 25.735 2.374
426 HG2 MET 51 1HG MET 51 6.462 25.123 2.275
427 HG3 MET 51 2HG MET 51 7.308 26.497 1.568
428 HE1 MET 51 1HE MET 51 9.656 24.129 -0.842
429 HE2 MET 51 2HE MET 51 9.489 25.814 -0.351
430 HE3 MET 51 3HE MET 51 9.895 24.583 0.846
431 H VAL 52 H VAL 52 10.184 22.450 1.290
432 HA VAL 52 HA VAL 52 12.740 22.717 2.699
433 HB VAL 52 HB VAL 52 13.040 20.597 2.112
434 HG11 VAL 52 1HG1 VAL 52 10.742 20.649 0.181
435 HG12 VAL 52 2HG1 VAL 52 11.344 19.299 1.144
436 HG13 VAL 52 3HG1 VAL 52 10.494 20.632 1.926
437 HG21 VAL 52 1HG2 VAL 52 12.790 21.516 -0.751
438 HG22 VAL 52 2HG2 VAL 52 14.262 21.569 0.218
439 HG23 VAL 52 3HG2 VAL 52 13.537 20.016 -0.200
440 H TYR 53 H TYR 53 14.648 23.342 1.584
441 HA TYR 53 HA TYR 53 14.184 24.844 -0.905
442 HB2 TYR 53 1HB TYR 53 15.630 25.714 1.586
443 HB3 TYR 53 2HB TYR 53 15.993 26.435 0.022
444 HD1 TYR 53 HD1 TYR 53 13.478 26.808 -1.270
445 HD2 TYR 53 HD2 TYR 53 14.405 27.190 2.865
446 HE1 TYR 53 HE1 TYR 53 11.590 28.360 -0.996
447 HE2 TYR 53 HE2 TYR 53 12.518 28.742 3.151
448 HH TYR 53 HH TYR 53 11.206 30.417 1.213
449 H CYS 54 H CYS 54 14.979 22.677 -1.698
450 HA CYS 54 HA CYS 54 17.832 22.224 -1.380
451 HB2 CYS 54 1HB CYS 54 17.495 20.134 -2.334
452 HB3 CYS 54 2HB CYS 54 15.955 20.419 -1.532
453 HG CYS 54 HG CYS 54 16.236 21.332 -4.781
454 H GLY 55 H GLY 55 16.597 24.585 -2.843
455 HA2 GLY 55 1HA GLY 55 17.036 24.343 -5.604
456 HA3 GLY 55 2HA GLY 55 17.074 25.848 -4.698
457 H GLY 56 H GLY 56 18.997 23.122 -5.815
458 HA2 GLY 56 1HA GLY 56 21.164 23.789 -6.827
459 HA3 GLY 56 2HA GLY 56 21.410 24.777 -5.394
460 H ASP 57 H ASP 57 19.918 21.722 -4.923
461 HA ASP 57 HA ASP 57 22.469 20.640 -3.918
462 HB2 ASP 57 1HB ASP 57 20.129 21.179 -2.479
463 HB3 ASP 57 2HB ASP 57 20.137 19.432 -2.698
464 H LEU 58 H LEU 58 22.612 18.272 -3.887
465 HA LEU 58 HA LEU 58 22.271 17.097 -6.328
466 HB2 LEU 58 1HB LEU 58 22.391 15.893 -3.581
467 HB3 LEU 58 2HB LEU 58 22.302 14.892 -5.029
468 HG LEU 58 HG LEU 58 24.446 15.431 -5.695
469 HD11 LEU 58 1HD1 LEU 58 25.668 17.380 -5.093
470 HD12 LEU 58 2HD1 LEU 58 24.504 17.798 -3.836
471 HD13 LEU 58 3HD1 LEU 58 24.041 17.898 -5.534
472 HD21 LEU 58 1HD2 LEU 58 24.291 15.356 -2.705
473 HD22 LEU 58 2HD2 LEU 58 25.846 15.489 -3.527
474 HD23 LEU 58 3HD2 LEU 58 24.805 14.097 -3.828
475 H LEU 59 H LEU 59 20.100 16.698 -3.529
476 HA LEU 59 HA LEU 59 18.202 15.069 -4.727
477 HB2 LEU 59 1HB LEU 59 16.625 15.972 -3.046
478 HB3 LEU 59 2HB LEU 59 18.166 15.449 -2.369
479 HG LEU 59 HG LEU 59 18.088 18.296 -3.023
480 HD11 LEU 59 1HD1 LEU 59 15.865 18.380 -2.379
481 HD12 LEU 59 2HD1 LEU 59 16.720 18.701 -0.870
482 HD13 LEU 59 3HD1 LEU 59 16.056 17.097 -1.183
483 HD21 LEU 59 1HD2 LEU 59 18.846 16.603 -0.657
484 HD22 LEU 59 2HD2 LEU 59 18.896 18.366 -0.621
485 HD23 LEU 59 3HD2 LEU 59 19.905 17.477 -1.763
486 H GLY 60 H GLY 60 18.586 18.564 -4.869
487 HA2 GLY 60 1HA GLY 60 16.094 19.143 -6.083
488 HA3 GLY 60 2HA GLY 60 17.517 20.173 -6.112
489 H GLU 61 H GLU 61 19.346 18.864 -7.523
490 HA GLU 61 HA GLU 61 18.613 19.242 -10.170
491 HB2 GLU 61 1HB GLU 61 20.674 17.852 -10.692
492 HB3 GLU 61 2HB GLU 61 20.921 19.255 -9.661
493 HG2 GLU 61 1HG GLU 61 20.975 17.846 -7.698
494 HG3 GLU 61 2HG GLU 61 20.626 16.425 -8.680
495 H LEU 62 H LEU 62 18.737 16.239 -8.293
496 HA LEU 62 HA LEU 62 18.055 14.502 -10.406
497 HB2 LEU 62 1HB LEU 62 18.756 14.231 -7.757
498 HB3 LEU 62 2HB LEU 62 17.082 13.683 -7.783
499 HG LEU 62 HG LEU 62 18.855 11.900 -8.035
500 HD11 LEU 62 1HD1 LEU 62 16.468 11.628 -8.660
501 HD12 LEU 62 2HD1 LEU 62 17.570 10.642 -9.621
502 HD13 LEU 62 3HD1 LEU 62 16.884 12.116 -10.304
503 HD21 LEU 62 1HD2 LEU 62 20.167 11.737 -9.896
504 HD22 LEU 62 2HD2 LEU 62 20.077 13.493 -9.749
505 HD23 LEU 62 3HD2 LEU 62 19.045 12.650 -10.906
506 H LEU 63 H LEU 63 16.084 16.176 -7.985
507 HA LEU 63 HA LEU 63 13.618 15.040 -8.845
508 HB2 LEU 63 1HB LEU 63 14.527 16.806 -6.793
509 HB3 LEU 63 2HB LEU 63 13.148 17.539 -7.609
510 HG LEU 63 HG LEU 63 12.894 14.709 -6.741
511 HD11 LEU 63 1HD1 LEU 63 13.946 15.753 -4.809
512 HD12 LEU 63 2HD1 LEU 63 12.251 15.392 -4.486
513 HD13 LEU 63 3HD1 LEU 63 12.746 17.046 -4.841
514 HD21 LEU 63 1HD2 LEU 63 11.086 17.109 -6.926
515 HD22 LEU 63 2HD2 LEU 63 10.594 15.581 -6.194
516 HD23 LEU 63 3HD2 LEU 63 11.045 15.639 -7.899
517 H GLY 64 H GLY 64 15.600 17.578 -10.013
518 HA2 GLY 64 1HA GLY 64 15.352 18.692 -12.048
519 HA3 GLY 64 2HA GLY 64 13.698 18.106 -12.141
520 H ARG 65 H ARG 65 13.646 19.204 -9.178
521 HA ARG 65 HA ARG 65 12.810 21.896 -10.008
522 HB2 ARG 65 1HB ARG 65 12.108 20.606 -7.384
523 HB3 ARG 65 2HB ARG 65 11.272 21.901 -8.231
524 HG2 ARG 65 1HG ARG 65 11.294 18.970 -8.868
525 HG3 ARG 65 2HG ARG 65 9.917 20.001 -8.470
526 HD2 ARG 65 1HD ARG 65 9.996 21.086 -10.559
527 HD3 ARG 65 2HD ARG 65 11.604 20.457 -10.913
528 HE ARG 65 HE ARG 65 10.651 18.501 -11.649
529 HH11 ARG 65 1HH1 ARG 65 8.269 20.401 -9.964
530 HH12 ARG 65 2HH1 ARG 65 6.940 19.397 -10.441
531 HH21 ARG 65 1HH2 ARG 65 8.909 17.171 -12.284
532 HH22 ARG 65 2HH2 ARG 65 7.306 17.559 -11.760
533 H GLN 66 H GLN 66 12.713 22.749 -7.185
534 HA GLN 66 HA GLN 66 15.551 22.879 -6.486
535 HB2 GLN 66 1HB GLN 66 14.648 25.461 -6.000
536 HB3 GLN 66 2HB GLN 66 15.733 24.957 -7.289
537 HG2 GLN 66 1HG GLN 66 13.837 24.652 -8.784
538 HG3 GLN 66 2HG GLN 66 12.734 25.122 -7.491
539 HE21 GLN 66 2HE2 GLN 66 12.335 27.223 -7.153
540 HE22 GLN 66 1HE2 GLN 66 13.095 28.521 -8.003
541 H SER 67 H SER 67 12.209 23.592 -5.597
542 HA SER 67 HA SER 67 12.832 22.850 -2.842
543 HB2 SER 67 1HB SER 67 12.664 24.938 -2.048
544 HB3 SER 67 2HB SER 67 12.370 25.550 -3.676
545 HG SER 67 HG SER 67 10.212 25.370 -3.366
546 H PHE 68 H PHE 68 11.131 21.931 -1.730
547 HA PHE 68 HA PHE 68 8.538 21.773 -3.084
548 HB2 PHE 68 1HB PHE 68 8.626 19.254 -2.267
549 HB3 PHE 68 2HB PHE 68 9.285 19.731 -3.829
550 HD1 PHE 68 HD1 PHE 68 10.107 18.743 -0.393
551 HD2 PHE 68 HD2 PHE 68 11.638 19.676 -4.253
552 HE1 PHE 68 HE1 PHE 68 12.292 17.817 0.254
553 HE2 PHE 68 HE2 PHE 68 13.826 18.751 -3.613
554 HZ PHE 68 HZ PHE 68 14.155 17.819 -1.357
555 H SER 69 H SER 69 7.096 20.246 -1.497
556 HA SER 69 HA SER 69 7.371 21.471 1.169
557 HB2 SER 69 1HB SER 69 4.712 20.577 0.814
558 HB3 SER 69 2HB SER 69 5.287 22.242 0.885
559 HG SER 69 HG SER 69 4.888 22.398 -1.162
560 H VAL 70 H VAL 70 7.376 20.191 2.928
561 HA VAL 70 HA VAL 70 7.707 17.372 2.581
562 HB VAL 70 HB VAL 70 8.575 17.366 4.655
563 HG11 VAL 70 1HG1 VAL 70 9.646 19.357 5.226
564 HG12 VAL 70 2HG1 VAL 70 9.328 19.537 3.500
565 HG13 VAL 70 3HG1 VAL 70 8.297 20.351 4.678
566 HG21 VAL 70 1HG2 VAL 70 7.546 18.497 6.602
567 HG22 VAL 70 2HG2 VAL 70 6.312 19.160 5.530
568 HG23 VAL 70 3HG2 VAL 70 6.432 17.416 5.765
569 H LYS 71 H LYS 71 5.187 19.440 3.958
570 HA LYS 71 HA LYS 71 3.539 17.283 4.828
571 HB2 LYS 71 1HB LYS 71 3.585 20.007 5.249
572 HB3 LYS 71 2HB LYS 71 2.158 19.797 4.244
573 HG2 LYS 71 1HG LYS 71 1.258 18.186 5.825
574 HG3 LYS 71 2HG LYS 71 2.706 18.341 6.823
575 HD2 LYS 71 1HD LYS 71 1.036 20.735 6.133
576 HD3 LYS 71 2HD LYS 71 0.604 19.682 7.482
577 HE2 LYS 71 1HE LYS 71 2.928 20.023 8.364
578 HE3 LYS 71 2HE LYS 71 3.154 21.244 7.112
579 HZ1 LYS 71 1HZ LYS 71 0.859 21.424 8.948
580 HZ2 LYS 71 2HZ LYS 71 1.641 22.656 8.094
581 HZ3 LYS 71 3HZ LYS 71 2.383 21.963 9.447
582 H ASP 72 H ASP 72 4.283 18.416 1.786
583 HA ASP 72 HA ASP 72 1.834 17.217 0.674
584 HB2 ASP 72 1HB ASP 72 3.320 19.584 -0.487
585 HB3 ASP 72 2HB ASP 72 1.868 18.837 -1.147
586 HA PRO 73 HA PRO 73 5.460 14.879 -0.905
587 HB2 PRO 73 1HB PRO 73 4.168 12.491 -0.936
588 HB3 PRO 73 2HB PRO 73 4.951 13.141 0.509
589 HG2 PRO 73 1HG PRO 73 2.059 13.188 -0.261
590 HG3 PRO 73 2HG PRO 73 2.791 12.844 1.317
591 HD2 PRO 73 1HD PRO 73 1.709 15.250 0.705
592 HD3 PRO 73 2HD PRO 73 3.094 15.077 1.803
593 H SER 74 H SER 74 4.623 16.379 -2.764
594 HA SER 74 HA SER 74 3.046 14.886 -4.723
595 HB2 SER 74 1HB SER 74 3.625 17.728 -4.227
596 HB3 SER 74 2HB SER 74 3.645 17.270 -5.930
597 HG SER 74 HG SER 74 1.534 16.867 -4.077
598 HA PRO 75 HA PRO 75 6.965 15.755 -7.349
599 HB2 PRO 75 1HB PRO 75 8.970 17.212 -6.242
600 HB3 PRO 75 2HB PRO 75 7.615 17.945 -7.108
601 HG2 PRO 75 1HG PRO 75 8.032 17.633 -4.160
602 HG3 PRO 75 2HG PRO 75 7.425 19.034 -5.062
603 HD2 PRO 75 1HD PRO 75 5.786 17.323 -3.751
604 HD3 PRO 75 2HD PRO 75 5.302 18.155 -5.242
605 H LEU 76 H LEU 76 7.419 15.234 -3.913
606 HA LEU 76 HA LEU 76 9.889 13.950 -3.919
607 HB2 LEU 76 1HB LEU 76 8.519 14.668 -1.929
608 HB3 LEU 76 2HB LEU 76 7.559 13.208 -2.163
609 HG LEU 76 HG LEU 76 9.812 11.964 -1.930
610 HD11 LEU 76 1HD1 LEU 76 10.823 13.943 -0.103
611 HD12 LEU 76 2HD1 LEU 76 10.742 14.589 -1.741
612 HD13 LEU 76 3HD1 LEU 76 11.643 13.107 -1.421
613 HD21 LEU 76 1HD2 LEU 76 7.786 12.536 -0.200
614 HD22 LEU 76 2HD2 LEU 76 9.193 13.123 0.688
615 HD23 LEU 76 3HD2 LEU 76 9.131 11.447 0.142
616 H TYR 77 H TYR 77 6.645 12.481 -4.102
617 HA TYR 77 HA TYR 77 7.576 9.846 -4.502
618 HB2 TYR 77 1HB TYR 77 4.951 11.235 -4.882
619 HB3 TYR 77 2HB TYR 77 5.164 9.607 -5.517
620 HD1 TYR 77 HD2 TYR 77 5.975 7.805 -3.858
621 HD2 TYR 77 HD1 TYR 77 4.368 11.554 -2.647
622 HE1 TYR 77 HE2 TYR 77 5.486 6.871 -1.636
623 HE2 TYR 77 HE1 TYR 77 3.876 10.630 -0.421
624 HH TYR 77 HH TYR 77 4.028 8.867 0.916
625 H ASP 78 H ASP 78 6.475 12.344 -6.768
626 HA ASP 78 HA ASP 78 6.560 10.920 -9.131
627 HB2 ASP 78 1HB ASP 78 5.990 13.460 -8.560
628 HB3 ASP 78 2HB ASP 78 7.626 13.702 -9.166
629 H MET 79 H MET 79 9.212 12.437 -7.365
630 HA MET 79 HA MET 79 11.178 11.910 -9.368
631 HB2 MET 79 1HB MET 79 11.572 13.712 -7.838
632 HB3 MET 79 2HB MET 79 11.394 12.648 -6.449
633 HG2 MET 79 1HG MET 79 13.430 11.477 -7.879
634 HG3 MET 79 2HG MET 79 13.721 13.202 -8.092
635 HE1 MET 79 1HE MET 79 11.988 11.818 -4.708
636 HE2 MET 79 2HE MET 79 12.777 10.494 -5.565
637 HE3 MET 79 3HE MET 79 13.431 11.065 -4.029
638 H LEU 80 H LEU 80 10.423 10.412 -6.227
639 HA LEU 80 HA LEU 80 12.353 8.418 -6.255
640 HB2 LEU 80 1HB LEU 80 9.559 8.309 -5.129
641 HB3 LEU 80 2HB LEU 80 10.855 7.180 -4.738
642 HG LEU 80 HG LEU 80 11.031 10.133 -4.177
643 HD11 LEU 80 1HD1 LEU 80 10.010 9.904 -2.172
644 HD12 LEU 80 2HD1 LEU 80 10.505 8.222 -1.985
645 HD13 LEU 80 3HD1 LEU 80 9.144 8.629 -3.030
646 HD21 LEU 80 1HD2 LEU 80 13.106 8.675 -4.313
647 HD22 LEU 80 2HD2 LEU 80 12.499 7.857 -2.873
648 HD23 LEU 80 3HD2 LEU 80 12.871 9.580 -2.818
649 H ARG 81 H ARG 81 9.150 8.480 -7.733
650 HA ARG 81 HA ARG 81 8.607 5.965 -8.449
651 HB2 ARG 81 1HB ARG 81 7.673 8.313 -9.302
652 HB3 ARG 81 2HB ARG 81 8.614 7.884 -10.724
653 HG2 ARG 81 1HG ARG 81 7.284 5.574 -10.304
654 HG3 ARG 81 2HG ARG 81 6.111 6.744 -9.697
655 HD2 ARG 81 1HD ARG 81 5.658 7.527 -11.748
656 HD3 ARG 81 2HD ARG 81 7.355 7.518 -12.226
657 HE ARG 81 HE ARG 81 6.442 4.873 -12.130
658 HH11 ARG 81 1HH1 ARG 81 5.973 7.784 -13.981
659 HH12 ARG 81 2HH1 ARG 81 5.565 6.946 -15.441
660 HH21 ARG 81 1HH2 ARG 81 5.906 3.758 -14.047
661 HH22 ARG 81 2HH2 ARG 81 5.527 4.655 -15.477
662 H LYS 82 H LYS 82 10.837 7.997 -10.355
663 HA LYS 82 HA LYS 82 12.009 5.531 -11.454
664 HB2 LYS 82 1HB LYS 82 12.293 6.573 -13.446
665 HB3 LYS 82 2HB LYS 82 11.006 7.612 -12.847
666 HG2 LYS 82 1HG LYS 82 13.951 8.188 -12.596
667 HG3 LYS 82 2HG LYS 82 12.877 8.873 -13.817
668 HD2 LYS 82 1HD LYS 82 12.592 9.212 -10.831
669 HD3 LYS 82 2HD LYS 82 13.232 10.420 -11.947
670 HE2 LYS 82 1HE LYS 82 10.933 10.024 -13.165
671 HE3 LYS 82 2HE LYS 82 10.434 9.465 -11.570
672 HZ1 LYS 82 1HZ LYS 82 11.814 11.850 -11.208
673 HZ2 LYS 82 2HZ LYS 82 10.160 11.570 -10.994
674 HZ3 LYS 82 3HZ LYS 82 10.739 12.108 -12.489
675 H ASN 83 H ASN 83 12.538 7.735 -9.094
676 HA ASN 83 HA ASN 83 15.432 7.904 -9.469
677 HB2 ASN 83 1HB ASN 83 14.278 9.957 -8.807
678 HB3 ASN 83 2HB ASN 83 13.636 9.154 -7.378
679 HD21 ASN 83 2HD2 ASN 83 14.621 9.863 -5.641
680 HD22 ASN 83 1HD2 ASN 83 16.315 10.167 -5.479
681 H LEU 84 H LEU 84 13.092 6.831 -7.011
682 HA LEU 84 HA LEU 84 15.198 5.394 -5.600
683 HB2 LEU 84 1HB LEU 84 12.804 6.650 -4.842
684 HB3 LEU 84 2HB LEU 84 12.560 4.927 -4.563
685 HG LEU 84 HG LEU 84 13.326 5.861 -2.525
686 HD11 LEU 84 1HD1 LEU 84 14.420 3.902 -2.463
687 HD12 LEU 84 2HD1 LEU 84 15.856 4.907 -2.652
688 HD13 LEU 84 3HD1 LEU 84 15.134 4.129 -4.060
689 HD21 LEU 84 1HD2 LEU 84 14.470 7.763 -2.545
690 HD22 LEU 84 2HD2 LEU 84 14.845 7.575 -4.258
691 HD23 LEU 84 3HD2 LEU 84 15.896 6.852 -3.039
692 H VAL 85 H VAL 85 15.738 3.503 -6.493
693 HA VAL 85 HA VAL 85 14.417 1.906 -8.229
694 HB VAL 85 HB VAL 85 16.493 1.424 -6.213
695 HG11 VAL 85 1HG1 VAL 85 14.748 -0.832 -7.179
696 HG12 VAL 85 2HG1 VAL 85 16.375 -1.063 -6.536
697 HG13 VAL 85 3HG1 VAL 85 15.110 -0.382 -5.513
698 HG21 VAL 85 1HG2 VAL 85 16.654 -0.085 -8.671
699 HG22 VAL 85 2HG2 VAL 85 16.277 1.610 -8.983
700 HG23 VAL 85 3HG2 VAL 85 17.717 1.182 -8.058
701 H THR 86 H THR 86 12.970 0.199 -8.168
702 HA THR 86 HA THR 86 11.662 -0.397 -5.615
703 HB THR 86 HB THR 86 9.427 -0.324 -6.838
704 HG1 THR 86 1HG THR 86 11.044 1.160 -8.655
705 HG21 THR 86 1HG2 THR 86 9.395 2.274 -6.701
706 HG22 THR 86 2HG2 THR 86 11.035 2.086 -6.081
707 HG23 THR 86 3HG2 THR 86 9.682 1.335 -5.237
708 H LEU 87 H LEU 87 11.089 -2.489 -5.382
709 HA LEU 87 HA LEU 87 11.405 -4.238 -7.732
710 HB2 LEU 87 1HB LEU 87 11.572 -5.622 -5.208
711 HB3 LEU 87 2HB LEU 87 12.714 -5.587 -6.550
712 HG LEU 87 HG LEU 87 12.571 -3.521 -4.356
713 HD11 LEU 87 1HD1 LEU 87 14.224 -4.611 -3.220
714 HD12 LEU 87 2HD1 LEU 87 14.833 -5.427 -4.659
715 HD13 LEU 87 3HD1 LEU 87 13.354 -5.994 -3.884
716 HD21 LEU 87 1HD2 LEU 87 13.828 -2.294 -5.711
717 HD22 LEU 87 2HD2 LEU 87 13.859 -3.579 -6.920
718 HD23 LEU 87 3HD2 LEU 87 15.067 -3.547 -5.634
719 H ALA 88 H ALA 88 10.046 -6.124 -7.835
720 HA ALA 88 HA ALA 88 8.017 -7.155 -7.825
721 HB1 ALA 88 1HB ALA 88 8.315 -7.921 -5.678
722 HB2 ALA 88 2HB ALA 88 8.338 -6.299 -4.985
723 HB3 ALA 88 3HB ALA 88 6.813 -7.012 -5.510
724 H THR 89 H THR 89 7.060 -5.795 -9.362
725 HA THR 89 HA THR 89 5.944 -3.295 -8.945
726 HB THR 89 HB THR 89 6.218 -4.596 -11.152
727 HG1 THR 89 1HG THR 89 4.111 -2.871 -10.434
728 HG21 THR 89 1HG2 THR 89 4.358 -6.269 -10.010
729 HG22 THR 89 2HG2 THR 89 4.760 -6.202 -11.726
730 HG23 THR 89 3HG2 THR 89 3.382 -5.293 -11.106
731 H1 SER 115 H SER 115 10.465 29.323 16.326
732 HA SER 115 HA SER 115 11.478 27.366 17.183
733 HB2 SER 115 1HB SER 115 10.597 29.333 19.220
734 HB3 SER 115 2HB SER 115 11.182 27.786 19.832
735 HG SER 115 HG SER 115 12.786 29.527 19.473
736 H GLN 116 H GLN 116 9.195 26.334 16.263
737 HA GLN 116 HA GLN 116 8.641 24.247 18.140
738 HB2 GLN 116 1HB GLN 116 7.108 26.158 18.834
739 HB3 GLN 116 2HB GLN 116 6.272 25.916 17.306
740 HG2 GLN 116 1HG GLN 116 5.091 24.254 18.156
741 HG3 GLN 116 2HG GLN 116 6.556 23.408 18.652
742 HE21 GLN 116 2HE2 GLN 116 7.529 24.110 20.702
743 HE22 GLN 116 1HE2 GLN 116 6.479 24.604 21.982
744 H GLU 117 H GLU 117 7.725 22.435 17.178
745 HA GLU 117 HA GLU 117 7.080 21.024 15.507
746 HB2 GLU 117 1HB GLU 117 5.443 21.811 14.204
747 HB3 GLU 117 2HB GLU 117 5.746 23.390 14.915
748 HG2 GLU 117 1HG GLU 117 7.396 23.820 13.108
749 HG3 GLU 117 2HG GLU 117 6.907 22.299 12.364
750 H THR 118 H THR 118 7.942 20.066 13.616
751 HA THR 118 HA THR 118 9.860 21.315 11.956
752 HB THR 118 HB THR 118 10.995 20.827 14.351
753 HG1 THR 118 1HG THR 118 12.961 20.918 13.193
754 HG21 THR 118 1HG2 THR 118 11.954 18.454 12.818
755 HG22 THR 118 2HG2 THR 118 10.485 18.308 13.783
756 HG23 THR 118 3HG2 THR 118 12.004 18.769 14.552
757 H PHE 119 H PHE 119 11.375 19.315 11.048
758 HA PHE 119 HA PHE 119 9.813 17.850 9.368
759 HB2 PHE 119 1HB PHE 119 12.576 17.718 10.277
760 HB3 PHE 119 2HB PHE 119 11.944 16.131 9.852
761 HD1 PHE 119 HD2 PHE 119 10.042 17.034 7.680
762 HD2 PHE 119 HD1 PHE 119 14.097 18.025 8.511
763 HE1 PHE 119 HE2 PHE 119 10.406 17.527 5.298
764 HE2 PHE 119 HE1 PHE 119 14.467 18.522 6.129
765 HZ PHE 119 HZ PHE 119 12.620 18.272 4.519
766 H SER 120 H SER 120 11.024 16.782 12.535
767 HA SER 120 HA SER 120 9.939 14.215 12.523
768 HB2 SER 120 1HB SER 120 11.464 15.618 14.272
769 HB3 SER 120 2HB SER 120 9.920 15.623 15.126
770 HG SER 120 HG SER 120 11.383 13.782 15.518
771 H ASP 121 H ASP 121 8.426 17.291 12.973
772 HA ASP 121 HA ASP 121 6.014 16.177 14.132
773 HB2 ASP 121 1HB ASP 121 7.071 18.552 14.517
774 HB3 ASP 121 2HB ASP 121 6.184 18.966 13.053
775 H LEU 122 H LEU 122 6.967 17.719 11.075
776 HA LEU 122 HA LEU 122 4.402 17.097 9.876
777 HB2 LEU 122 1HB LEU 122 6.798 18.168 8.426
778 HB3 LEU 122 2HB LEU 122 5.092 18.372 8.034
779 HG LEU 122 HG LEU 122 6.630 19.711 10.254
780 HD11 LEU 122 1HD1 LEU 122 5.510 20.573 7.624
781 HD12 LEU 122 2HD1 LEU 122 7.083 20.916 8.342
782 HD13 LEU 122 3HD1 LEU 122 5.641 21.730 8.948
783 HD21 LEU 122 1HD2 LEU 122 4.140 20.883 10.122
784 HD22 LEU 122 2HD2 LEU 122 4.697 19.765 11.367
785 HD23 LEU 122 3HD2 LEU 122 3.787 19.161 9.981
786 H TRP 123 H TRP 123 7.801 16.373 9.061
787 HA TRP 123 HA TRP 123 7.595 14.638 7.036
788 HB2 TRP 123 1HB TRP 123 9.635 15.266 8.581
789 HB3 TRP 123 2HB TRP 123 9.263 13.723 9.345
790 HD1 TRP 123 HD1 TRP 123 10.462 11.712 8.319
791 HE1 TRP 123 HE1 TRP 123 11.598 11.189 6.069
792 HE3 TRP 123 HE3 TRP 123 9.369 16.043 5.832
793 HZ2 TRP 123 HZ2 TRP 123 11.980 12.446 3.571
794 HZ3 TRP 123 HZ3 TRP 123 10.157 16.303 3.515
795 HH2 TRP 123 HH2 TRP 123 11.436 14.541 2.410
796 H LYS 124 H LYS 124 7.282 13.598 10.435
797 HA LYS 124 HA LYS 124 6.726 10.962 10.158
798 HB2 LYS 124 1HB LYS 124 5.482 11.061 12.210
799 HB3 LYS 124 2HB LYS 124 6.790 12.233 12.308
800 HG2 LYS 124 1HG LYS 124 5.001 13.399 13.176
801 HG3 LYS 124 2HG LYS 124 5.018 13.928 11.491
802 HD2 LYS 124 1HD LYS 124 2.912 13.247 11.289
803 HD3 LYS 124 2HD LYS 124 3.439 11.592 11.600
804 HE2 LYS 124 1HE LYS 124 3.385 12.497 14.112
805 HE3 LYS 124 2HE LYS 124 2.169 13.563 13.412
806 HZ1 LYS 124 1HZ LYS 124 1.983 10.794 14.065
807 HZ2 LYS 124 2HZ LYS 124 1.549 11.076 12.454
808 HZ3 LYS 124 3HZ LYS 124 0.752 11.896 13.701
809 H LEU 125 H LEU 125 4.455 13.622 9.624
810 HA LEU 125 HA LEU 125 2.081 12.316 9.316
811 HB2 LEU 125 1HB LEU 125 3.171 14.533 7.588
812 HB3 LEU 125 2HB LEU 125 1.479 14.046 7.655
813 HG LEU 125 HG LEU 125 3.059 15.204 9.951
814 HD11 LEU 125 1HD1 LEU 125 1.418 16.399 7.815
815 HD12 LEU 125 2HD1 LEU 125 2.727 17.094 8.770
816 HD13 LEU 125 3HD1 LEU 125 1.104 16.979 9.451
817 HD21 LEU 125 1HD2 LEU 125 0.211 15.316 10.227
818 HD22 LEU 125 2HD2 LEU 125 1.405 14.565 11.286
819 HD23 LEU 125 3HD2 LEU 125 0.716 13.650 9.944
820 H LEU 126 H LEU 126 4.628 12.651 6.865
821 HA LEU 126 HA LEU 126 3.395 11.463 4.709
822 HB2 LEU 126 1HB LEU 126 6.184 11.768 5.622
823 HB3 LEU 126 2HB LEU 126 5.901 10.524 4.406
824 HG LEU 126 HG LEU 126 4.611 12.604 3.270
825 HD11 LEU 126 1HD1 LEU 126 6.602 14.393 3.621
826 HD12 LEU 126 2HD1 LEU 126 6.476 13.724 5.247
827 HD13 LEU 126 3HD1 LEU 126 5.062 14.445 4.479
828 HD21 LEU 126 1HD2 LEU 126 7.314 12.890 2.519
829 HD22 LEU 126 2HD2 LEU 126 6.050 11.963 1.709
830 HD23 LEU 126 3HD2 LEU 126 7.068 11.191 2.926
831 HA PRO 127 HA PRO 127 2.664 7.411 6.527
832 HB2 PRO 127 1HB PRO 127 1.028 6.566 4.533
833 HB3 PRO 127 2HB PRO 127 0.483 7.628 5.837
834 HG2 PRO 127 1HG PRO 127 1.300 8.325 3.042
835 HG3 PRO 127 2HG PRO 127 -0.067 8.934 3.993
836 HD2 PRO 127 1HD PRO 127 2.231 10.332 3.684
837 HD3 PRO 127 2HD PRO 127 1.247 10.426 5.159
838 H GLU 128 H GLU 128 4.309 8.361 3.737
839 HA GLU 128 HA GLU 128 6.020 7.322 2.618
840 HB2 GLU 128 1HB GLU 128 5.302 4.689 3.871
841 HB3 GLU 128 2HB GLU 128 6.868 5.246 3.300
842 HG2 GLU 128 1HG GLU 128 7.387 5.883 5.347
843 HG3 GLU 128 2HG GLU 128 6.034 7.013 5.342
844 H ASN 129 H ASN 129 2.797 6.694 2.449
845 HA ASN 129 HA ASN 129 2.981 5.784 -0.270
846 HB2 ASN 129 1HB ASN 129 1.557 3.769 0.081
847 HB3 ASN 129 2HB ASN 129 3.153 3.626 0.811
848 HD21 ASN 129 2HD2 ASN 129 -0.211 4.407 1.508
849 HD22 ASN 129 1HD2 ASN 129 -0.182 3.876 3.152
Start of MODEL 19
1 H1 GLN 1 H GLN 1 1.532 -0.688 1.095
2 HA GLN 1 HA GLN 1 1.456 -3.384 -0.051
3 HB2 GLN 1 1HB GLN 1 1.565 -0.906 -1.536
4 HB3 GLN 1 2HB GLN 1 3.005 -1.872 -1.830
5 HG2 GLN 1 1HG GLN 1 0.440 -3.314 -1.938
6 HG3 GLN 1 2HG GLN 1 0.722 -2.129 -3.212
7 HE21 GLN 1 2HE2 GLN 1 0.535 -4.998 -3.442
8 HE22 GLN 1 1HE2 GLN 1 2.037 -5.542 -4.102
9 H ILE 2 H ILE 2 3.696 -0.612 0.138
10 HA ILE 2 HA ILE 2 5.779 -0.412 1.046
11 HB ILE 2 HB ILE 2 5.450 -3.132 2.293
12 HG12 ILE 2 1HG1 ILE 2 3.486 -2.050 3.004
13 HG13 ILE 2 2HG1 ILE 2 4.632 -1.753 4.307
14 HG21 ILE 2 1HG2 ILE 2 7.018 -0.683 3.089
15 HG22 ILE 2 2HG2 ILE 2 6.926 -2.181 4.014
16 HG23 ILE 2 3HG2 ILE 2 7.674 -2.175 2.417
17 HD11 ILE 2 1HD1 ILE 2 3.974 0.368 4.116
18 HD12 ILE 2 2HD1 ILE 2 5.032 0.412 2.705
19 HD13 ILE 2 3HD1 ILE 2 3.305 0.117 2.504
20 H ASN 3 H ASN 3 7.009 -0.485 -0.769
21 HA ASN 3 HA ASN 3 7.899 -3.135 -1.695
22 HB2 ASN 3 1HB ASN 3 6.678 -1.362 -3.241
23 HB3 ASN 3 2HB ASN 3 8.299 -0.683 -3.353
24 HD21 ASN 3 2HD2 ASN 3 9.850 -2.928 -3.333
25 HD22 ASN 3 1HD2 ASN 3 9.538 -3.865 -4.751
26 H GLN 4 H GLN 4 10.001 -3.652 -1.578
27 HA GLN 4 HA GLN 4 11.785 -2.025 -0.094
28 HB2 GLN 4 1HB GLN 4 12.016 -4.622 -1.563
29 HB3 GLN 4 2HB GLN 4 13.476 -3.812 -1.012
30 HG2 GLN 4 1HG GLN 4 12.825 -5.418 0.628
31 HG3 GLN 4 2HG GLN 4 12.553 -3.803 1.282
32 HE21 GLN 4 2HE2 GLN 4 10.651 -5.842 -0.906
33 HE22 GLN 4 1HE2 GLN 4 9.218 -5.841 0.060
34 H VAL 5 H VAL 5 14.072 -1.600 -0.945
35 HA VAL 5 HA VAL 5 14.214 -0.919 -3.762
36 HB VAL 5 HB VAL 5 14.216 1.339 -3.637
37 HG11 VAL 5 1HG1 VAL 5 12.694 0.592 -1.146
38 HG12 VAL 5 2HG1 VAL 5 12.650 2.192 -1.889
39 HG13 VAL 5 3HG1 VAL 5 12.053 0.790 -2.777
40 HG21 VAL 5 1HG2 VAL 5 16.178 1.616 -2.332
41 HG22 VAL 5 2HG2 VAL 5 14.929 2.604 -1.575
42 HG23 VAL 5 3HG2 VAL 5 15.369 1.048 -0.871
43 H ARG 6 H ARG 6 16.400 0.202 -4.208
44 HA ARG 6 HA ARG 6 18.490 -0.558 -2.328
45 HB2 ARG 6 1HB ARG 6 18.324 -1.644 -5.144
46 HB3 ARG 6 2HB ARG 6 19.761 -1.735 -4.134
47 HG2 ARG 6 1HG ARG 6 18.798 -3.263 -2.678
48 HG3 ARG 6 2HG ARG 6 17.157 -2.852 -3.179
49 HD2 ARG 6 1HD ARG 6 17.504 -4.899 -4.207
50 HD3 ARG 6 2HD ARG 6 17.895 -3.754 -5.488
51 HE ARG 6 HE ARG 6 20.001 -4.610 -5.498
52 HH11 ARG 6 1HH1 ARG 6 18.592 -5.208 -2.371
53 HH12 ARG 6 2HH1 ARG 6 19.953 -6.105 -1.784
54 HH21 ARG 6 1HH2 ARG 6 21.799 -5.790 -4.736
55 HH22 ARG 6 2HH2 ARG 6 21.777 -6.434 -3.130
56 HA PRO 7 HA PRO 7 19.532 3.469 -4.116
57 HB2 PRO 7 1HB PRO 7 21.162 4.190 -2.068
58 HB3 PRO 7 2HB PRO 7 19.402 4.340 -1.994
59 HG2 PRO 7 1HG PRO 7 21.170 2.203 -0.867
60 HG3 PRO 7 2HG PRO 7 19.774 3.007 -0.125
61 HD2 PRO 7 1HD PRO 7 19.613 0.546 -1.243
62 HD3 PRO 7 2HD PRO 7 18.256 1.691 -1.255
63 H LYS 8 H LYS 8 20.960 3.445 -5.728
64 HA LYS 8 HA LYS 8 23.231 1.755 -5.815
65 HB2 LYS 8 1HB LYS 8 22.765 4.208 -7.511
66 HB3 LYS 8 2HB LYS 8 23.735 2.797 -7.913
67 HG2 LYS 8 1HG LYS 8 20.866 2.346 -7.338
68 HG3 LYS 8 2HG LYS 8 21.277 3.163 -8.848
69 HD2 LYS 8 1HD LYS 8 23.068 1.085 -8.786
70 HD3 LYS 8 2HD LYS 8 21.623 0.368 -8.068
71 HE2 LYS 8 1HE LYS 8 21.320 -0.036 -10.329
72 HE3 LYS 8 2HE LYS 8 20.389 1.439 -10.074
73 HZ1 LYS 8 1HZ LYS 8 22.554 2.607 -10.757
74 HZ2 LYS 8 2HZ LYS 8 21.608 1.897 -11.966
75 HZ3 LYS 8 3HZ LYS 8 22.997 1.109 -11.408
76 H LEU 9 H LEU 9 25.278 3.296 -6.824
77 HA LEU 9 HA LEU 9 26.698 4.050 -4.580
78 HB2 LEU 9 1HB LEU 9 26.961 4.574 -7.488
79 HB3 LEU 9 2HB LEU 9 27.938 5.552 -6.395
80 HG LEU 9 HG LEU 9 28.040 2.582 -6.844
81 HD11 LEU 9 1HD1 LEU 9 29.588 3.349 -8.276
82 HD12 LEU 9 2HD1 LEU 9 30.579 3.525 -6.828
83 HD13 LEU 9 3HD1 LEU 9 29.707 4.915 -7.473
84 HD21 LEU 9 1HD2 LEU 9 28.711 4.122 -4.426
85 HD22 LEU 9 2HD2 LEU 9 29.960 3.015 -4.996
86 HD23 LEU 9 3HD2 LEU 9 28.347 2.407 -4.619
87 HA PRO 10 HA PRO 10 25.657 8.685 -5.405
88 HB2 PRO 10 1HB PRO 10 23.811 9.243 -7.317
89 HB3 PRO 10 2HB PRO 10 25.539 9.101 -7.662
90 HG2 PRO 10 1HG PRO 10 23.357 7.088 -8.052
91 HG3 PRO 10 2HG PRO 10 24.699 7.508 -9.133
92 HD2 PRO 10 1HD PRO 10 24.738 5.314 -7.546
93 HD3 PRO 10 2HD PRO 10 26.209 6.214 -7.967
94 H LEU 11 H LEU 11 23.546 6.134 -4.986
95 HA LEU 11 HA LEU 11 21.448 7.871 -3.867
96 HB2 LEU 11 1HB LEU 11 21.405 5.289 -5.277
97 HB3 LEU 11 2HB LEU 11 20.335 5.400 -3.881
98 HG LEU 11 HG LEU 11 18.914 6.833 -4.912
99 HD11 LEU 11 1HD1 LEU 11 20.212 8.739 -5.176
100 HD12 LEU 11 2HD1 LEU 11 19.740 8.344 -6.829
101 HD13 LEU 11 3HD1 LEU 11 21.355 7.934 -6.252
102 HD21 LEU 11 1HD2 LEU 11 18.714 6.325 -7.314
103 HD22 LEU 11 2HD2 LEU 11 18.975 4.878 -6.339
104 HD23 LEU 11 3HD2 LEU 11 20.306 5.567 -7.270
105 H LEU 12 H LEU 12 23.933 5.680 -3.106
106 HA LEU 12 HA LEU 12 22.846 4.722 -0.629
107 HB2 LEU 12 1HB LEU 12 24.865 3.908 -2.256
108 HB3 LEU 12 2HB LEU 12 25.765 4.704 -0.967
109 HG LEU 12 HG LEU 12 24.255 2.165 -0.946
110 HD11 LEU 12 1HD1 LEU 12 26.779 2.512 -0.835
111 HD12 LEU 12 2HD1 LEU 12 26.058 1.418 0.344
112 HD13 LEU 12 3HD1 LEU 12 26.511 3.054 0.821
113 HD21 LEU 12 1HD2 LEU 12 24.114 2.447 1.618
114 HD22 LEU 12 2HD2 LEU 12 22.848 3.154 0.613
115 HD23 LEU 12 3HD2 LEU 12 24.127 4.176 1.268
116 H LYS 13 H LYS 13 25.163 7.223 -1.580
117 HA LYS 13 HA LYS 13 25.907 8.008 1.022
118 HB2 LYS 13 1HB LYS 13 26.477 10.218 -0.186
119 HB3 LYS 13 2HB LYS 13 27.336 8.760 -0.664
120 HG2 LYS 13 1HG LYS 13 26.636 8.968 -2.753
121 HG3 LYS 13 2HG LYS 13 24.952 9.046 -2.231
122 HD2 LYS 13 1HD LYS 13 25.048 11.128 -3.092
123 HD3 LYS 13 2HD LYS 13 25.799 11.521 -1.544
124 HE2 LYS 13 1HE LYS 13 28.017 10.977 -2.654
125 HE3 LYS 13 2HE LYS 13 27.138 10.980 -4.183
126 HZ1 LYS 13 1HZ LYS 13 26.339 13.295 -3.237
127 HZ2 LYS 13 2HZ LYS 13 27.774 13.139 -4.117
128 HZ3 LYS 13 3HZ LYS 13 27.823 13.211 -2.428
129 H ILE 14 H ILE 14 23.128 8.710 -0.932
130 HA ILE 14 HA ILE 14 22.266 11.075 0.331
131 HB ILE 14 HB ILE 14 20.508 8.956 -0.907
132 HG12 ILE 14 1HG1 ILE 14 22.405 9.740 -2.374
133 HG13 ILE 14 2HG1 ILE 14 20.796 10.051 -3.016
134 HG21 ILE 14 1HG2 ILE 14 19.040 10.912 -1.388
135 HG22 ILE 14 2HG2 ILE 14 19.224 10.553 0.328
136 HG23 ILE 14 3HG2 ILE 14 20.110 11.897 -0.391
137 HD11 ILE 14 1HD1 ILE 14 22.676 12.018 -1.745
138 HD12 ILE 14 2HD1 ILE 14 22.116 11.975 -3.417
139 HD13 ILE 14 3HD1 ILE 14 20.991 12.377 -2.120
140 H LEU 15 H LEU 15 21.233 7.700 0.849
141 HA LEU 15 HA LEU 15 19.635 8.313 3.115
142 HB2 LEU 15 1HB LEU 15 20.845 5.643 2.434
143 HB3 LEU 15 2HB LEU 15 19.403 5.955 3.398
144 HG LEU 15 HG LEU 15 19.711 6.296 0.418
145 HD11 LEU 15 1HD1 LEU 15 19.333 3.997 1.578
146 HD12 LEU 15 2HD1 LEU 15 18.361 4.445 0.177
147 HD13 LEU 15 3HD1 LEU 15 17.687 4.591 1.800
148 HD21 LEU 15 1HD2 LEU 15 17.966 7.648 2.238
149 HD22 LEU 15 2HD2 LEU 15 17.024 6.570 1.208
150 HD23 LEU 15 3HD2 LEU 15 18.073 7.790 0.483
151 H HIS 16 H HIS 16 22.937 7.117 2.708
152 HA HIS 16 HA HIS 16 23.535 6.523 5.357
153 HB2 HIS 16 1HB HIS 16 25.169 7.368 2.998
154 HB3 HIS 16 2HB HIS 16 25.935 7.288 4.582
155 HD1 HIS 16 HD1 HIS 16 27.406 5.283 4.016
156 HD2 HIS 16 HD2 HIS 16 23.350 4.561 3.482
157 HE1 HIS 16 HE1 HIS 16 27.205 2.800 3.674
158 H ALA 17 H ALA 17 23.959 9.597 3.617
159 HA ALA 17 HA ALA 17 25.015 11.056 5.771
160 HB1 ALA 17 1HB ALA 17 25.345 12.232 3.870
161 HB2 ALA 17 2HB ALA 17 23.823 11.706 3.149
162 HB3 ALA 17 3HB ALA 17 23.829 12.996 4.351
163 H ALA 18 H ALA 18 21.903 9.828 5.289
164 HA ALA 18 HA ALA 18 20.670 11.820 7.056
165 HB1 ALA 18 1HB ALA 18 18.681 10.056 6.317
166 HB2 ALA 18 2HB ALA 18 19.014 11.623 5.578
167 HB3 ALA 18 3HB ALA 18 19.702 10.156 4.882
168 H GLY 19 H GLY 19 22.414 9.162 7.478
169 HA2 GLY 19 1HA GLY 19 22.617 8.238 9.696
170 HA3 GLY 19 2HA GLY 19 20.873 8.370 9.862
171 H ALA 20 H ALA 20 21.248 7.304 6.827
172 HA ALA 20 HA ALA 20 20.394 4.667 7.433
173 HB1 ALA 20 1HB ALA 20 20.087 4.384 5.165
174 HB2 ALA 20 2HB ALA 20 19.958 6.136 5.330
175 HB3 ALA 20 3HB ALA 20 21.456 5.413 4.743
176 H GLN 21 H GLN 21 21.613 2.905 5.867
177 HA GLN 21 HA GLN 21 24.353 2.848 5.629
178 HB2 GLN 21 1HB GLN 21 23.659 2.877 8.345
179 HB3 GLN 21 2HB GLN 21 24.096 1.209 7.997
180 HG2 GLN 21 1HG GLN 21 26.106 2.133 8.635
181 HG3 GLN 21 2HG GLN 21 26.182 2.233 6.876
182 HE21 GLN 21 2HE2 GLN 21 25.629 4.290 5.895
183 HE22 GLN 21 1HE2 GLN 21 25.964 5.751 6.753
184 H GLY 22 H GLY 22 24.702 1.206 4.292
185 HA2 GLY 22 1HA GLY 22 24.617 -1.332 4.257
186 HA3 GLY 22 2HA GLY 22 22.884 -1.114 4.447
187 H GLU 23 H GLU 23 22.359 -2.133 2.522
188 HA GLU 23 HA GLU 23 22.772 -0.489 0.146
189 HB2 GLU 23 1HB GLU 23 23.291 -3.466 0.135
190 HB3 GLU 23 2HB GLU 23 23.426 -2.372 -1.235
191 HG2 GLU 23 1HG GLU 23 25.136 -1.171 0.416
192 HG3 GLU 23 2HG GLU 23 25.270 -2.818 1.030
193 H MET 24 H MET 24 20.609 -1.549 2.103
194 HA MET 24 HA MET 24 18.601 -1.918 0.032
195 HB2 MET 24 1HB MET 24 17.610 -3.876 1.174
196 HB3 MET 24 2HB MET 24 19.213 -4.208 0.532
197 HG2 MET 24 1HG MET 24 18.740 -3.444 3.396
198 HG3 MET 24 2HG MET 24 18.703 -5.113 2.830
199 HE1 MET 24 1HE MET 24 21.587 -4.538 0.539
200 HE2 MET 24 2HE MET 24 22.153 -5.843 1.582
201 HE3 MET 24 3HE MET 24 20.466 -5.792 1.068
202 H PHE 25 H PHE 25 16.601 -1.148 0.593
203 HA PHE 25 HA PHE 25 15.880 -0.593 3.312
204 HB2 PHE 25 1HB PHE 25 16.348 1.772 1.487
205 HB3 PHE 25 2HB PHE 25 15.774 1.824 3.150
206 HD1 PHE 25 HD1 PHE 25 17.322 1.100 4.990
207 HD2 PHE 25 HD2 PHE 25 18.638 1.739 0.993
208 HE1 PHE 25 HE1 PHE 25 19.643 1.283 5.787
209 HE2 PHE 25 HE2 PHE 25 20.961 1.922 1.783
210 HZ PHE 25 HZ PHE 25 21.466 1.693 4.183
211 H THR 26 H THR 26 13.704 0.106 3.534
212 HA THR 26 HA THR 26 12.072 -0.549 1.197
213 HB THR 26 HB THR 26 10.457 -0.043 3.493
214 HG1 THR 26 1HG THR 26 11.572 -0.881 5.079
215 HG21 THR 26 1HG2 THR 26 9.612 -1.582 1.996
216 HG22 THR 26 2HG2 THR 26 10.245 -2.647 3.251
217 HG23 THR 26 3HG2 THR 26 11.169 -2.379 1.774
218 H VAL 27 H VAL 27 9.785 0.709 1.471
219 HA VAL 27 HA VAL 27 10.236 3.300 0.537
220 HB VAL 27 HB VAL 27 7.642 2.621 1.860
221 HG11 VAL 27 1HG1 VAL 27 8.631 4.466 -0.150
222 HG12 VAL 27 2HG1 VAL 27 7.209 3.575 -0.697
223 HG13 VAL 27 3HG1 VAL 27 7.143 4.515 0.795
224 HG21 VAL 27 1HG2 VAL 27 7.081 1.477 -0.387
225 HG22 VAL 27 2HG2 VAL 27 8.826 1.268 -0.536
226 HG23 VAL 27 3HG2 VAL 27 7.968 0.561 0.832
227 H LYS 28 H LYS 28 9.392 2.141 3.769
228 HA LYS 28 HA LYS 28 9.066 4.715 4.924
229 HB2 LYS 28 1HB LYS 28 9.123 1.933 5.846
230 HB3 LYS 28 2HB LYS 28 9.766 3.075 7.019
231 HG2 LYS 28 1HG LYS 28 7.702 3.578 7.625
232 HG3 LYS 28 2HG LYS 28 7.391 4.200 6.003
233 HD2 LYS 28 1HD LYS 28 6.874 1.445 7.085
234 HD3 LYS 28 2HD LYS 28 5.726 2.580 6.370
235 HE2 LYS 28 1HE LYS 28 6.002 1.393 4.493
236 HE3 LYS 28 2HE LYS 28 7.541 2.240 4.352
237 HZ1 LYS 28 1HZ LYS 28 8.355 0.166 4.276
238 HZ2 LYS 28 2HZ LYS 28 7.009 -0.525 5.031
239 HZ3 LYS 28 3HZ LYS 28 8.210 0.220 5.960
240 H GLU 29 H GLU 29 11.750 2.375 5.006
241 HA GLU 29 HA GLU 29 13.507 3.950 6.523
242 HB2 GLU 29 1HB GLU 29 14.160 1.855 4.443
243 HB3 GLU 29 2HB GLU 29 15.283 2.486 5.640
244 HG2 GLU 29 1HG GLU 29 13.629 1.656 7.388
245 HG3 GLU 29 2HG GLU 29 12.871 0.760 6.072
246 H VAL 30 H VAL 30 12.929 3.772 3.050
247 HA VAL 30 HA VAL 30 15.100 5.428 2.281
248 HB VAL 30 HB VAL 30 12.516 4.808 0.844
249 HG11 VAL 30 1HG1 VAL 30 13.565 5.655 -1.161
250 HG12 VAL 30 2HG1 VAL 30 13.548 6.917 0.073
251 HG13 VAL 30 3HG1 VAL 30 15.037 6.035 -0.268
252 HG21 VAL 30 1HG2 VAL 30 14.348 3.014 1.440
253 HG22 VAL 30 2HG2 VAL 30 13.571 3.028 -0.143
254 HG23 VAL 30 3HG2 VAL 30 15.177 3.728 0.057
255 H MET 31 H MET 31 11.682 6.067 2.957
256 HA MET 31 HA MET 31 11.791 8.827 2.283
257 HB2 MET 31 1HB MET 31 9.586 8.498 2.384
258 HB3 MET 31 2HB MET 31 9.817 6.951 3.187
259 HG2 MET 31 1HG MET 31 8.428 8.290 4.569
260 HG3 MET 31 2HG MET 31 10.006 8.171 5.344
261 HE1 MET 31 1HE MET 31 9.627 10.956 2.258
262 HE2 MET 31 2HE MET 31 8.187 10.022 2.662
263 HE3 MET 31 3HE MET 31 8.279 11.730 3.093
264 H HIS 32 H HIS 32 12.046 7.038 5.328
265 HA HIS 32 HA HIS 32 12.095 9.192 7.092
266 HB2 HIS 32 1HB HIS 32 12.143 6.570 7.471
267 HB3 HIS 32 2HB HIS 32 13.876 6.850 7.607
268 HD1 HIS 32 HD1 HIS 32 11.121 6.479 9.707
269 HD2 HIS 32 HD2 HIS 32 14.203 9.261 9.543
270 HE1 HIS 32 HE1 HIS 32 11.221 7.507 11.999
271 H TYR 33 H TYR 33 14.557 7.956 4.962
272 HA TYR 33 HA TYR 33 16.744 9.323 6.199
273 HB2 TYR 33 1HB TYR 33 16.442 8.093 3.453
274 HB3 TYR 33 2HB TYR 33 17.949 8.752 4.080
275 HD1 TYR 33 HD2 TYR 33 17.810 7.780 6.894
276 HD2 TYR 33 HD1 TYR 33 16.919 5.812 3.229
277 HE1 TYR 33 HE2 TYR 33 18.325 5.614 7.939
278 HE2 TYR 33 HE1 TYR 33 17.430 3.640 4.264
279 HH TYR 33 HH TYR 33 17.469 3.023 7.319
280 H LEU 34 H LEU 34 14.487 10.037 3.603
281 HA LEU 34 HA LEU 34 15.695 12.183 2.374
282 HB2 LEU 34 1HB LEU 34 13.010 11.157 2.657
283 HB3 LEU 34 2HB LEU 34 13.014 12.919 2.597
284 HG LEU 34 HG LEU 34 12.655 11.970 0.388
285 HD11 LEU 34 1HD1 LEU 34 13.757 13.699 -0.452
286 HD12 LEU 34 2HD1 LEU 34 15.303 12.888 -0.202
287 HD13 LEU 34 3HD1 LEU 34 14.603 13.867 1.087
288 HD21 LEU 34 1HD2 LEU 34 13.662 9.867 0.423
289 HD22 LEU 34 2HD2 LEU 34 15.202 10.508 0.997
290 HD23 LEU 34 3HD2 LEU 34 14.686 10.807 -0.664
291 H GLY 35 H GLY 35 13.383 12.409 5.091
292 HA2 GLY 35 1HA GLY 35 13.615 15.130 5.564
293 HA3 GLY 35 2HA GLY 35 13.210 13.941 6.793
294 H GLN 36 H GLN 36 15.525 12.501 7.011
295 HA GLN 36 HA GLN 36 17.075 14.088 8.709
296 HB2 GLN 36 1HB GLN 36 17.693 11.460 7.358
297 HB3 GLN 36 2HB GLN 36 18.732 12.191 8.574
298 HG2 GLN 36 1HG GLN 36 16.113 12.142 9.628
299 HG3 GLN 36 2HG GLN 36 16.435 10.555 8.931
300 HE21 GLN 36 2HE2 GLN 36 18.502 12.916 10.581
301 HE22 GLN 36 1HE2 GLN 36 19.049 11.834 11.812
302 H TYR 37 H TYR 37 17.621 13.104 5.351
303 HA TYR 37 HA TYR 37 20.189 14.166 5.042
304 HB2 TYR 37 1HB TYR 37 19.165 12.650 3.408
305 HB3 TYR 37 2HB TYR 37 17.998 13.893 2.973
306 HD1 TYR 37 HD2 TYR 37 21.662 13.223 3.054
307 HD2 TYR 37 HD1 TYR 37 18.471 15.374 1.238
308 HE1 TYR 37 HE2 TYR 37 23.215 14.075 1.347
309 HE2 TYR 37 HE1 TYR 37 20.015 16.231 -0.474
310 HH TYR 37 HH TYR 37 22.605 16.641 -0.577
311 H ILE 38 H ILE 38 17.017 15.638 4.410
312 HA ILE 38 HA ILE 38 17.931 18.099 3.448
313 HB ILE 38 HB ILE 38 15.409 17.586 5.029
314 HG12 ILE 38 1HG1 ILE 38 15.813 17.570 2.032
315 HG13 ILE 38 2HG1 ILE 38 15.715 16.119 3.023
316 HG21 ILE 38 1HG2 ILE 38 14.661 19.646 4.442
317 HG22 ILE 38 2HG2 ILE 38 16.388 19.997 4.451
318 HG23 ILE 38 3HG2 ILE 38 15.564 19.665 2.928
319 HD11 ILE 38 1HD1 ILE 38 13.614 17.646 1.876
320 HD12 ILE 38 2HD1 ILE 38 13.521 16.146 2.799
321 HD13 ILE 38 3HD1 ILE 38 13.460 17.699 3.631
322 H MET 39 H MET 39 17.039 17.146 6.759
323 HA MET 39 HA MET 39 17.646 19.648 7.931
324 HB2 MET 39 1HB MET 39 17.227 18.634 9.987
325 HB3 MET 39 2HB MET 39 16.256 17.679 8.874
326 HG2 MET 39 1HG MET 39 17.265 15.853 9.589
327 HG3 MET 39 2HG MET 39 18.796 16.473 8.976
328 HE1 MET 39 1HE MET 39 19.011 19.086 10.761
329 HE2 MET 39 2HE MET 39 19.932 18.576 12.177
330 HE3 MET 39 3HE MET 39 20.447 18.080 10.564
331 H VAL 40 H VAL 40 19.588 16.943 6.994
332 HA VAL 40 HA VAL 40 21.834 17.545 8.663
333 HB VAL 40 HB VAL 40 21.107 15.410 7.032
334 HG11 VAL 40 1HG1 VAL 40 22.100 16.548 5.106
335 HG12 VAL 40 2HG1 VAL 40 23.632 16.679 5.973
336 HG13 VAL 40 3HG1 VAL 40 23.001 15.092 5.529
337 HG21 VAL 40 1HG2 VAL 40 22.276 15.241 9.148
338 HG22 VAL 40 2HG2 VAL 40 23.175 14.384 7.896
339 HG23 VAL 40 3HG2 VAL 40 23.716 15.972 8.439
340 H LYS 41 H LYS 41 20.909 18.283 5.337
341 HA LYS 41 HA LYS 41 23.385 19.749 4.891
342 HB2 LYS 41 1HB LYS 41 21.170 18.742 3.197
343 HB3 LYS 41 2HB LYS 41 21.954 20.221 2.657
344 HG2 LYS 41 1HG LYS 41 23.302 17.583 3.197
345 HG3 LYS 41 2HG LYS 41 22.970 18.291 1.614
346 HD2 LYS 41 1HD LYS 41 24.889 19.408 1.699
347 HD3 LYS 41 2HD LYS 41 24.372 20.209 3.184
348 HE2 LYS 41 1HE LYS 41 26.499 19.030 3.480
349 HE3 LYS 41 2HE LYS 41 25.232 18.356 4.504
350 HZ1 LYS 41 1HZ LYS 41 25.624 16.388 3.606
351 HZ2 LYS 41 2HZ LYS 41 26.805 17.044 2.588
352 HZ3 LYS 41 3HZ LYS 41 25.193 16.977 2.079
353 H GLN 42 H GLN 42 20.285 20.341 6.082
354 HA GLN 42 HA GLN 42 19.206 22.237 6.729
355 HB2 GLN 42 1HB GLN 42 22.012 23.126 6.411
356 HB3 GLN 42 2HB GLN 42 20.796 24.396 6.431
357 HG2 GLN 42 1HG GLN 42 21.069 24.317 8.644
358 HG3 GLN 42 2HG GLN 42 20.016 22.906 8.552
359 HE21 GLN 42 2HE2 GLN 42 21.904 21.176 7.318
360 HE22 GLN 42 1HE2 GLN 42 23.104 20.788 8.499
361 H LEU 43 H LEU 43 18.515 21.410 4.292
362 HA LEU 43 HA LEU 43 18.510 23.821 2.603
363 HB2 LEU 43 1HB LEU 43 18.320 20.902 1.978
364 HB3 LEU 43 2HB LEU 43 17.673 22.095 0.854
365 HG LEU 43 HG LEU 43 20.096 21.140 0.563
366 HD11 LEU 43 1HD1 LEU 43 18.921 23.784 0.050
367 HD12 LEU 43 2HD1 LEU 43 19.670 22.635 -1.059
368 HD13 LEU 43 3HD1 LEU 43 20.679 23.700 -0.079
369 HD21 LEU 43 1HD2 LEU 43 20.659 21.849 2.946
370 HD22 LEU 43 2HD2 LEU 43 20.704 23.498 2.322
371 HD23 LEU 43 3HD2 LEU 43 21.812 22.283 1.684
372 H TYR 44 H TYR 44 16.815 24.187 4.532
373 HA TYR 44 HA TYR 44 14.224 23.961 3.250
374 HB2 TYR 44 1HB TYR 44 13.121 23.027 5.239
375 HB3 TYR 44 2HB TYR 44 14.314 21.911 4.584
376 HD1 TYR 44 HD2 TYR 44 16.588 21.790 5.717
377 HD2 TYR 44 HD1 TYR 44 13.236 23.732 7.475
378 HE1 TYR 44 HE2 TYR 44 17.667 21.643 7.922
379 HE2 TYR 44 HE1 TYR 44 14.305 23.591 9.686
380 HH TYR 44 HH TYR 44 17.487 22.060 10.092
381 H ASP 45 H ASP 45 12.557 25.247 4.410
382 HA ASP 45 HA ASP 45 13.666 27.777 5.189
383 HB2 ASP 45 1HB ASP 45 11.716 27.951 3.890
384 HB3 ASP 45 2HB ASP 45 10.870 26.729 4.835
385 H GLN 46 H GLN 46 14.511 27.986 7.162
386 HA GLN 46 HA GLN 46 14.037 26.464 9.401
387 HB2 GLN 46 1HB GLN 46 15.104 29.196 8.936
388 HB3 GLN 46 2HB GLN 46 14.657 28.786 10.587
389 HG2 GLN 46 1HG GLN 46 17.084 28.377 9.702
390 HG3 GLN 46 2HG GLN 46 16.313 27.237 10.803
391 HE21 GLN 46 2HE2 GLN 46 16.373 27.857 7.305
392 HE22 GLN 46 1HE2 GLN 46 16.625 26.210 6.847
393 H GLN 47 H GLN 47 12.142 29.087 8.120
394 HA GLN 47 HA GLN 47 10.561 29.438 10.498
395 HB2 GLN 47 1HB GLN 47 9.715 30.363 7.773
396 HB3 GLN 47 2HB GLN 47 9.424 31.114 9.336
397 HG2 GLN 47 1HG GLN 47 11.834 31.214 7.600
398 HG3 GLN 47 2HG GLN 47 11.003 32.512 8.457
399 HE21 GLN 47 2HE2 GLN 47 13.573 30.317 8.499
400 HE22 GLN 47 1HE2 GLN 47 14.142 30.635 10.099
401 H GLU 48 H GLU 48 10.464 27.434 7.683
402 HA GLU 48 HA GLU 48 7.989 26.216 8.676
403 HB2 GLU 48 1HB GLU 48 8.515 26.914 5.781
404 HB3 GLU 48 2HB GLU 48 7.144 25.983 6.369
405 HG2 GLU 48 1HG GLU 48 6.204 27.843 7.448
406 HG3 GLU 48 2HG GLU 48 7.696 28.773 7.318
407 H GLN 49 H GLN 49 9.141 24.468 9.470
408 HA GLN 49 HA GLN 49 11.162 23.064 8.178
409 HB2 GLN 49 1HB GLN 49 9.110 22.207 10.209
410 HB3 GLN 49 2HB GLN 49 10.355 21.111 9.623
411 HG2 GLN 49 1HG GLN 49 11.470 21.884 11.413
412 HG3 GLN 49 2HG GLN 49 11.891 23.191 10.307
413 HE21 GLN 49 2HE2 GLN 49 11.910 24.994 11.449
414 HE22 GLN 49 1HE2 GLN 49 10.672 25.519 12.533
415 H HIS 50 H HIS 50 7.745 23.053 7.641
416 HA HIS 50 HA HIS 50 7.676 20.563 6.211
417 HB2 HIS 50 1HB HIS 50 5.379 21.198 5.637
418 HB3 HIS 50 2HB HIS 50 5.681 21.417 7.358
419 HD1 HIS 50 HD1 HIS 50 4.322 23.370 8.036
420 HD2 HIS 50 HD2 HIS 50 6.269 24.017 4.423
421 HE1 HIS 50 HE1 HIS 50 3.814 25.754 7.416
422 H MET 51 H MET 51 9.131 23.362 5.470
423 HA MET 51 HA MET 51 8.571 23.093 2.589
424 HB2 MET 51 1HB MET 51 8.493 25.395 4.261
425 HB3 MET 51 2HB MET 51 9.845 25.582 3.152
426 HG2 MET 51 1HG MET 51 7.383 24.636 1.892
427 HG3 MET 51 2HG MET 51 7.263 26.239 2.613
428 HE1 MET 51 1HE MET 51 10.356 25.037 -0.572
429 HE2 MET 51 2HE MET 51 10.812 25.001 1.131
430 HE3 MET 51 3HE MET 51 9.520 23.953 0.541
431 H VAL 52 H VAL 52 10.192 22.312 1.425
432 HA VAL 52 HA VAL 52 12.925 22.512 2.508
433 HB VAL 52 HB VAL 52 11.664 20.436 0.723
434 HG11 VAL 52 1HG1 VAL 52 13.876 19.383 0.578
435 HG12 VAL 52 2HG1 VAL 52 13.854 20.973 -0.188
436 HG13 VAL 52 3HG1 VAL 52 14.583 20.771 1.405
437 HG21 VAL 52 1HG2 VAL 52 11.853 20.589 3.454
438 HG22 VAL 52 2HG2 VAL 52 11.637 19.106 2.525
439 HG23 VAL 52 3HG2 VAL 52 13.253 19.604 3.027
440 H TYR 53 H TYR 53 14.448 23.545 1.372
441 HA TYR 53 HA TYR 53 13.725 24.509 -1.313
442 HB2 TYR 53 1HB TYR 53 15.125 25.734 0.979
443 HB3 TYR 53 2HB TYR 53 15.836 26.064 -0.597
444 HD1 TYR 53 HD1 TYR 53 13.857 26.587 -2.439
445 HD2 TYR 53 HD2 TYR 53 13.702 27.369 1.740
446 HE1 TYR 53 HE1 TYR 53 12.177 28.339 -2.836
447 HE2 TYR 53 HE2 TYR 53 12.020 29.122 1.356
448 HH TYR 53 HH TYR 53 10.869 29.877 -1.921
449 H CYS 54 H CYS 54 14.668 23.424 -2.900
450 HA CYS 54 HA CYS 54 17.288 22.189 -2.432
451 HB2 CYS 54 1HB CYS 54 16.139 21.494 -4.976
452 HB3 CYS 54 2HB CYS 54 16.516 20.452 -3.610
453 HG CYS 54 HG CYS 54 13.639 20.970 -4.815
454 H GLY 55 H GLY 55 15.591 24.476 -4.478
455 HA2 GLY 55 1HA GLY 55 16.335 25.769 -6.256
456 HA3 GLY 55 2HA GLY 55 17.594 26.158 -5.094
457 H GLY 56 H GLY 56 19.635 25.268 -5.315
458 HA2 GLY 56 1HA GLY 56 20.055 23.636 -7.741
459 HA3 GLY 56 2HA GLY 56 21.082 25.013 -7.370
460 H ASP 57 H ASP 57 19.825 22.294 -5.438
461 HA ASP 57 HA ASP 57 22.608 21.707 -4.664
462 HB2 ASP 57 1HB ASP 57 20.440 22.396 -3.016
463 HB3 ASP 57 2HB ASP 57 20.669 20.663 -2.795
464 H LEU 58 H LEU 58 22.493 19.335 -3.536
465 HA LEU 58 HA LEU 58 22.371 17.507 -5.604
466 HB2 LEU 58 1HB LEU 58 22.021 16.972 -2.658
467 HB3 LEU 58 2HB LEU 58 22.426 15.765 -3.877
468 HG LEU 58 HG LEU 58 24.134 17.813 -2.582
469 HD11 LEU 58 1HD1 LEU 58 24.011 14.992 -2.835
470 HD12 LEU 58 2HD1 LEU 58 25.154 15.966 -1.910
471 HD13 LEU 58 3HD1 LEU 58 25.510 15.543 -3.585
472 HD21 LEU 58 1HD2 LEU 58 25.751 17.599 -4.503
473 HD22 LEU 58 2HD2 LEU 58 24.337 18.610 -4.804
474 HD23 LEU 58 3HD2 LEU 58 24.407 16.973 -5.459
475 H LEU 59 H LEU 59 19.992 17.883 -2.972
476 HA LEU 59 HA LEU 59 18.122 16.056 -3.950
477 HB2 LEU 59 1HB LEU 59 16.480 17.333 -2.566
478 HB3 LEU 59 2HB LEU 59 17.930 16.808 -1.713
479 HG LEU 59 HG LEU 59 18.084 19.529 -2.802
480 HD11 LEU 59 1HD1 LEU 59 15.686 19.366 -2.139
481 HD12 LEU 59 2HD1 LEU 59 16.615 20.550 -1.221
482 HD13 LEU 59 3HD1 LEU 59 16.218 18.991 -0.500
483 HD21 LEU 59 1HD2 LEU 59 19.549 18.127 -1.082
484 HD22 LEU 59 2HD2 LEU 59 18.425 18.854 0.065
485 HD23 LEU 59 3HD2 LEU 59 19.402 19.882 -0.985
486 H GLY 60 H GLY 60 18.610 19.466 -4.677
487 HA2 GLY 60 1HA GLY 60 16.205 19.861 -6.120
488 HA3 GLY 60 2HA GLY 60 17.653 20.850 -6.241
489 H GLU 61 H GLU 61 19.473 18.952 -7.159
490 HA GLU 61 HA GLU 61 18.897 18.964 -9.929
491 HB2 GLU 61 1HB GLU 61 21.080 18.489 -10.157
492 HB3 GLU 61 2HB GLU 61 21.168 18.699 -8.414
493 HG2 GLU 61 1HG GLU 61 22.245 16.670 -8.854
494 HG3 GLU 61 2HG GLU 61 20.658 16.229 -8.225
495 H LEU 62 H LEU 62 18.733 16.472 -7.444
496 HA LEU 62 HA LEU 62 18.250 14.293 -9.181
497 HB2 LEU 62 1HB LEU 62 18.992 13.849 -6.969
498 HB3 LEU 62 2HB LEU 62 17.647 14.748 -6.270
499 HG LEU 62 HG LEU 62 16.105 13.027 -6.795
500 HD11 LEU 62 1HD1 LEU 62 18.248 11.468 -8.205
501 HD12 LEU 62 2HD1 LEU 62 17.176 12.577 -9.059
502 HD13 LEU 62 3HD1 LEU 62 16.506 11.191 -8.198
503 HD21 LEU 62 1HD2 LEU 62 18.456 12.519 -5.257
504 HD22 LEU 62 2HD2 LEU 62 17.927 11.017 -6.016
505 HD23 LEU 62 3HD2 LEU 62 16.812 11.932 -5.000
506 H LEU 63 H LEU 63 16.054 16.355 -7.291
507 HA LEU 63 HA LEU 63 13.679 15.102 -8.198
508 HB2 LEU 63 1HB LEU 63 14.401 17.206 -6.426
509 HB3 LEU 63 2HB LEU 63 13.163 17.811 -7.525
510 HG LEU 63 HG LEU 63 12.615 15.192 -6.278
511 HD11 LEU 63 1HD1 LEU 63 13.430 16.078 -4.301
512 HD12 LEU 63 2HD1 LEU 63 11.724 16.518 -4.246
513 HD13 LEU 63 3HD1 LEU 63 12.930 17.719 -4.709
514 HD21 LEU 63 1HD2 LEU 63 11.163 17.589 -7.230
515 HD22 LEU 63 2HD2 LEU 63 10.431 16.680 -5.907
516 HD23 LEU 63 3HD2 LEU 63 10.791 15.878 -7.437
517 H GLY 64 H GLY 64 15.661 17.708 -9.430
518 HA2 GLY 64 1HA GLY 64 15.707 18.537 -11.600
519 HA3 GLY 64 2HA GLY 64 14.281 17.578 -11.966
520 H ARG 65 H ARG 65 13.700 19.259 -9.166
521 HA ARG 65 HA ARG 65 12.255 21.344 -10.656
522 HB2 ARG 65 1HB ARG 65 11.718 20.507 -7.811
523 HB3 ARG 65 2HB ARG 65 10.668 21.412 -8.893
524 HG2 ARG 65 1HG ARG 65 11.359 18.491 -9.000
525 HG3 ARG 65 2HG ARG 65 9.777 19.232 -8.745
526 HD2 ARG 65 1HD ARG 65 9.605 19.906 -10.979
527 HD3 ARG 65 2HD ARG 65 11.333 19.698 -11.266
528 HE ARG 65 HE ARG 65 10.540 17.194 -10.698
529 HH11 ARG 65 1HH1 ARG 65 9.298 19.609 -12.877
530 HH12 ARG 65 2HH1 ARG 65 8.691 18.454 -14.018
531 HH21 ARG 65 1HH2 ARG 65 9.745 15.665 -12.192
532 HH22 ARG 65 2HH2 ARG 65 8.945 16.211 -13.626
533 H GLN 66 H GLN 66 11.716 23.110 -8.631
534 HA GLN 66 HA GLN 66 14.370 24.256 -8.159
535 HB2 GLN 66 1HB GLN 66 12.643 26.228 -7.456
536 HB3 GLN 66 2HB GLN 66 13.284 26.008 -9.079
537 HG2 GLN 66 1HG GLN 66 10.721 24.733 -8.180
538 HG3 GLN 66 2HG GLN 66 10.786 26.358 -8.861
539 HE21 GLN 66 2HE2 GLN 66 9.681 23.668 -9.757
540 HE22 GLN 66 1HE2 GLN 66 10.256 23.507 -11.377
541 H SER 67 H SER 67 11.290 23.704 -6.470
542 HA SER 67 HA SER 67 12.690 23.138 -4.015
543 HB2 SER 67 1HB SER 67 10.870 24.991 -3.056
544 HB3 SER 67 2HB SER 67 12.608 25.242 -3.217
545 HG SER 67 HG SER 67 11.719 26.883 -4.341
546 H PHE 68 H PHE 68 11.376 22.138 -2.444
547 HA PHE 68 HA PHE 68 8.586 21.634 -3.152
548 HB2 PHE 68 1HB PHE 68 8.807 19.235 -2.952
549 HB3 PHE 68 2HB PHE 68 9.948 19.809 -4.164
550 HD1 PHE 68 HD2 PHE 68 9.644 18.675 -0.658
551 HD2 PHE 68 HD1 PHE 68 12.253 19.433 -3.934
552 HE1 PHE 68 HE2 PHE 68 11.476 17.559 0.547
553 HE2 PHE 68 HE1 PHE 68 14.089 18.318 -2.735
554 HZ PHE 68 HZ PHE 68 13.702 17.380 -0.490
555 H SER 69 H SER 69 7.324 20.759 -1.397
556 HA SER 69 HA SER 69 8.415 21.551 1.209
557 HB2 SER 69 1HB SER 69 6.284 22.142 1.858
558 HB3 SER 69 2HB SER 69 6.151 22.411 0.120
559 HG SER 69 HG SER 69 4.966 20.494 1.714
560 H VAL 70 H VAL 70 8.119 20.236 3.053
561 HA VAL 70 HA VAL 70 8.386 17.429 2.519
562 HB VAL 70 HB VAL 70 9.256 17.254 4.589
563 HG11 VAL 70 1HG1 VAL 70 10.542 19.066 5.087
564 HG12 VAL 70 2HG1 VAL 70 9.956 19.573 3.501
565 HG13 VAL 70 3HG1 VAL 70 9.195 20.197 4.965
566 HG21 VAL 70 1HG2 VAL 70 6.915 18.908 5.441
567 HG22 VAL 70 2HG2 VAL 70 7.355 17.267 5.912
568 HG23 VAL 70 3HG2 VAL 70 8.262 18.639 6.547
569 H LYS 71 H LYS 71 5.778 19.508 3.165
570 HA LYS 71 HA LYS 71 4.095 17.402 4.278
571 HB2 LYS 71 1HB LYS 71 2.415 19.143 4.557
572 HB3 LYS 71 2HB LYS 71 3.952 19.666 5.234
573 HG2 LYS 71 1HG LYS 71 4.338 21.176 3.494
574 HG3 LYS 71 2HG LYS 71 3.128 20.423 2.453
575 HD2 LYS 71 1HD LYS 71 1.807 22.104 3.144
576 HD3 LYS 71 2HD LYS 71 1.621 21.131 4.606
577 HE2 LYS 71 1HE LYS 71 3.263 22.382 5.758
578 HE3 LYS 71 2HE LYS 71 3.820 23.156 4.276
579 HZ1 LYS 71 1HZ LYS 71 1.235 23.872 4.338
580 HZ2 LYS 71 2HZ LYS 71 2.501 24.817 4.942
581 HZ3 LYS 71 3HZ LYS 71 1.600 23.842 5.990
582 H ASP 72 H ASP 72 4.965 18.613 1.263
583 HA ASP 72 HA ASP 72 2.481 17.612 0.035
584 HB2 ASP 72 1HB ASP 72 2.694 19.150 -1.674
585 HB3 ASP 72 2HB ASP 72 3.384 20.058 -0.331
586 HA PRO 73 HA PRO 73 5.438 14.323 -1.029
587 HB2 PRO 73 1HB PRO 73 3.517 12.447 -1.429
588 HB3 PRO 73 2HB PRO 73 4.139 12.858 0.173
589 HG2 PRO 73 1HG PRO 73 1.628 13.772 -1.176
590 HG3 PRO 73 2HG PRO 73 1.872 13.257 0.504
591 HD2 PRO 73 1HD PRO 73 1.728 15.864 -0.215
592 HD3 PRO 73 2HD PRO 73 2.731 15.300 1.137
593 H SER 74 H SER 74 3.529 16.267 -2.781
594 HA SER 74 HA SER 74 2.944 14.847 -5.129
595 HB2 SER 74 1HB SER 74 2.976 17.628 -4.272
596 HB3 SER 74 2HB SER 74 3.486 17.454 -5.951
597 HG SER 74 HG SER 74 1.558 16.563 -6.458
598 HA PRO 75 HA PRO 75 7.091 16.429 -6.990
599 HB2 PRO 75 1HB PRO 75 8.775 17.806 -5.366
600 HB3 PRO 75 2HB PRO 75 7.505 18.586 -6.315
601 HG2 PRO 75 1HG PRO 75 7.507 17.820 -3.422
602 HG3 PRO 75 2HG PRO 75 6.920 19.310 -4.184
603 HD2 PRO 75 1HD PRO 75 5.260 17.308 -3.430
604 HD3 PRO 75 2HD PRO 75 4.931 18.343 -4.834
605 H LEU 76 H LEU 76 6.965 15.256 -3.717
606 HA LEU 76 HA LEU 76 9.570 14.118 -3.629
607 HB2 LEU 76 1HB LEU 76 8.119 14.657 -1.656
608 HB3 LEU 76 2HB LEU 76 7.141 13.252 -2.074
609 HG LEU 76 HG LEU 76 9.505 12.043 -1.893
610 HD11 LEU 76 1HD1 LEU 76 10.416 13.204 0.334
611 HD12 LEU 76 2HD1 LEU 76 9.831 14.636 -0.513
612 HD13 LEU 76 3HD1 LEU 76 11.032 13.591 -1.272
613 HD21 LEU 76 1HD2 LEU 76 8.460 11.011 -0.225
614 HD22 LEU 76 2HD2 LEU 76 7.193 12.231 -0.351
615 HD23 LEU 76 3HD2 LEU 76 8.522 12.453 0.789
616 H TYR 77 H TYR 77 6.370 12.568 -3.951
617 HA TYR 77 HA TYR 77 7.318 10.013 -4.558
618 HB2 TYR 77 1HB TYR 77 4.723 11.424 -5.119
619 HB3 TYR 77 2HB TYR 77 5.003 9.785 -5.697
620 HD1 TYR 77 HD1 TYR 77 6.149 8.270 -3.690
621 HD2 TYR 77 HD2 TYR 77 3.465 11.535 -3.200
622 HE1 TYR 77 HE1 TYR 77 5.472 7.377 -1.500
623 HE2 TYR 77 HE2 TYR 77 2.782 10.652 -1.008
624 HH TYR 77 HH TYR 77 4.416 8.590 0.735
625 H ASP 78 H ASP 78 6.537 12.739 -6.664
626 HA ASP 78 HA ASP 78 6.704 11.506 -9.139
627 HB2 ASP 78 1HB ASP 78 6.241 14.027 -8.372
628 HB3 ASP 78 2HB ASP 78 7.920 14.208 -8.874
629 H MET 79 H MET 79 9.309 12.876 -7.159
630 HA MET 79 HA MET 79 11.379 12.350 -9.023
631 HB2 MET 79 1HB MET 79 12.379 13.727 -7.574
632 HB3 MET 79 2HB MET 79 11.141 13.438 -6.360
633 HG2 MET 79 1HG MET 79 12.332 11.390 -5.679
634 HG3 MET 79 2HG MET 79 13.600 11.774 -6.842
635 HE1 MET 79 1HE MET 79 13.325 11.898 -3.006
636 HE2 MET 79 2HE MET 79 12.759 13.552 -2.779
637 HE3 MET 79 3HE MET 79 11.797 12.413 -3.722
638 H LEU 80 H LEU 80 10.186 10.589 -6.183
639 HA LEU 80 HA LEU 80 12.075 8.511 -6.242
640 HB2 LEU 80 1HB LEU 80 9.219 8.353 -5.296
641 HB3 LEU 80 2HB LEU 80 10.544 7.288 -4.831
642 HG LEU 80 HG LEU 80 10.508 10.232 -4.197
643 HD11 LEU 80 1HD1 LEU 80 8.641 8.573 -3.224
644 HD12 LEU 80 2HD1 LEU 80 9.338 9.900 -2.296
645 HD13 LEU 80 3HD1 LEU 80 9.943 8.259 -2.077
646 HD21 LEU 80 1HD2 LEU 80 11.929 8.426 -2.429
647 HD22 LEU 80 2HD2 LEU 80 12.489 9.889 -3.239
648 HD23 LEU 80 3HD2 LEU 80 12.526 8.342 -4.087
649 H ARG 81 H ARG 81 9.023 8.961 -7.926
650 HA ARG 81 HA ARG 81 8.507 6.432 -8.869
651 HB2 ARG 81 1HB ARG 81 7.003 7.437 -10.223
652 HB3 ARG 81 2HB ARG 81 7.445 8.884 -9.326
653 HG2 ARG 81 1HG ARG 81 9.115 9.406 -11.077
654 HG3 ARG 81 2HG ARG 81 8.534 8.015 -11.993
655 HD2 ARG 81 1HD ARG 81 6.276 9.553 -11.261
656 HD3 ARG 81 2HD ARG 81 7.486 10.666 -11.898
657 HE ARG 81 HE ARG 81 7.218 9.730 -13.980
658 HH11 ARG 81 1HH1 ARG 81 5.646 7.746 -11.591
659 HH12 ARG 81 2HH1 ARG 81 4.843 6.748 -12.758
660 HH21 ARG 81 1HH2 ARG 81 6.166 8.424 -15.527
661 HH22 ARG 81 2HH2 ARG 81 5.140 7.135 -14.996
662 H LYS 82 H LYS 82 10.703 8.847 -10.267
663 HA LYS 82 HA LYS 82 11.773 6.763 -12.046
664 HB2 LYS 82 1HB LYS 82 12.101 8.333 -13.637
665 HB3 LYS 82 2HB LYS 82 10.910 9.245 -12.718
666 HG2 LYS 82 1HG LYS 82 13.893 9.475 -12.373
667 HG3 LYS 82 2HG LYS 82 12.892 10.573 -13.327
668 HD2 LYS 82 1HD LYS 82 12.062 10.091 -10.525
669 HD3 LYS 82 2HD LYS 82 13.531 11.038 -10.771
670 HE2 LYS 82 1HE LYS 82 10.879 11.929 -10.910
671 HE3 LYS 82 2HE LYS 82 12.338 12.826 -11.329
672 HZ1 LYS 82 1HZ LYS 82 10.535 12.623 -13.088
673 HZ2 LYS 82 2HZ LYS 82 11.031 11.016 -13.265
674 HZ3 LYS 82 3HZ LYS 82 12.120 12.275 -13.568
675 H ASN 83 H ASN 83 12.380 8.103 -9.129
676 HA ASN 83 HA ASN 83 15.296 8.136 -9.454
677 HB2 ASN 83 1HB ASN 83 14.340 10.092 -8.345
678 HB3 ASN 83 2HB ASN 83 13.566 9.058 -7.148
679 HD21 ASN 83 2HD2 ASN 83 14.581 9.819 -5.368
680 HD22 ASN 83 1HD2 ASN 83 16.279 9.668 -5.086
681 H LEU 84 H LEU 84 12.830 6.836 -7.232
682 HA LEU 84 HA LEU 84 14.540 5.122 -5.822
683 HB2 LEU 84 1HB LEU 84 11.768 5.711 -5.900
684 HB3 LEU 84 2HB LEU 84 11.946 3.960 -5.993
685 HG LEU 84 HG LEU 84 11.622 4.747 -3.692
686 HD11 LEU 84 1HD1 LEU 84 12.782 2.705 -3.888
687 HD12 LEU 84 2HD1 LEU 84 13.699 3.670 -2.732
688 HD13 LEU 84 3HD1 LEU 84 14.269 3.508 -4.392
689 HD21 LEU 84 1HD2 LEU 84 13.573 6.692 -4.488
690 HD22 LEU 84 2HD2 LEU 84 14.144 5.813 -3.069
691 HD23 LEU 84 3HD2 LEU 84 12.583 6.635 -3.030
692 H VAL 85 H VAL 85 15.719 3.531 -6.642
693 HA VAL 85 HA VAL 85 15.094 2.257 -9.124
694 HB VAL 85 HB VAL 85 17.390 2.540 -7.581
695 HG11 VAL 85 1HG1 VAL 85 16.816 -0.403 -7.849
696 HG12 VAL 85 2HG1 VAL 85 18.201 0.368 -7.073
697 HG13 VAL 85 3HG1 VAL 85 16.599 0.492 -6.345
698 HG21 VAL 85 1HG2 VAL 85 17.778 2.566 -9.821
699 HG22 VAL 85 2HG2 VAL 85 18.250 0.898 -9.495
700 HG23 VAL 85 3HG2 VAL 85 16.649 1.250 -10.145
701 H THR 86 H THR 86 13.866 1.845 -6.080
702 HA THR 86 HA THR 86 12.948 0.075 -4.913
703 HB THR 86 HB THR 86 11.041 -0.770 -5.979
704 HG1 THR 86 1HG THR 86 10.917 -0.985 -8.263
705 HG21 THR 86 1HG2 THR 86 10.855 1.609 -5.869
706 HG22 THR 86 2HG2 THR 86 10.213 1.108 -7.433
707 HG23 THR 86 3HG2 THR 86 11.826 1.811 -7.326
708 H LEU 87 H LEU 87 12.061 -2.434 -6.035
709 HA LEU 87 HA LEU 87 14.657 -3.806 -6.140
710 HB2 LEU 87 1HB LEU 87 11.921 -4.782 -5.342
711 HB3 LEU 87 2HB LEU 87 13.338 -5.821 -5.478
712 HG LEU 87 HG LEU 87 12.554 -3.948 -3.344
713 HD11 LEU 87 1HD1 LEU 87 14.100 -6.514 -3.567
714 HD12 LEU 87 2HD1 LEU 87 12.522 -6.243 -2.829
715 HD13 LEU 87 3HD1 LEU 87 13.975 -5.608 -2.058
716 HD21 LEU 87 1HD2 LEU 87 14.820 -3.431 -2.686
717 HD22 LEU 87 2HD2 LEU 87 14.517 -2.804 -4.306
718 HD23 LEU 87 3HD2 LEU 87 15.456 -4.283 -4.094
719 H ALA 88 H ALA 88 11.358 -4.179 -7.452
720 HA ALA 88 HA ALA 88 12.506 -5.525 -9.794
721 HB1 ALA 88 1HB ALA 88 9.771 -5.692 -10.052
722 HB2 ALA 88 2HB ALA 88 10.827 -6.934 -9.381
723 HB3 ALA 88 3HB ALA 88 10.020 -5.790 -8.309
724 H THR 89 H THR 89 12.166 -4.799 -11.868
725 HA THR 89 HA THR 89 12.004 -2.059 -12.318
726 HB THR 89 HB THR 89 11.379 -2.845 -14.745
727 HG1 THR 89 1HG THR 89 10.779 -4.951 -14.302
728 HG21 THR 89 1HG2 THR 89 13.643 -2.118 -13.736
729 HG22 THR 89 2HG2 THR 89 13.654 -3.051 -15.233
730 HG23 THR 89 3HG2 THR 89 14.008 -3.843 -13.697
731 H1 SER 115 H SER 115 5.986 18.871 18.481
732 HA SER 115 HA SER 115 6.807 18.485 20.567
733 HB2 SER 115 1HB SER 115 4.659 16.816 20.322
734 HB3 SER 115 2HB SER 115 5.939 15.674 20.730
735 HG SER 115 HG SER 115 5.750 18.034 22.214
736 H GLN 116 H GLN 116 7.579 16.395 17.980
737 HA GLN 116 HA GLN 116 9.947 15.385 19.402
738 HB2 GLN 116 1HB GLN 116 8.288 14.315 17.167
739 HB3 GLN 116 2HB GLN 116 9.997 13.903 17.204
740 HG2 GLN 116 1HG GLN 116 8.809 13.534 19.796
741 HG3 GLN 116 2HG GLN 116 7.916 12.646 18.563
742 HE21 GLN 116 2HE2 GLN 116 11.322 13.369 19.270
743 HE22 GLN 116 1HE2 GLN 116 11.879 11.743 19.098
744 H GLU 117 H GLU 117 10.934 17.514 19.101
745 HA GLU 117 HA GLU 117 12.573 18.760 18.113
746 HB2 GLU 117 1HB GLU 117 13.250 16.467 17.165
747 HB3 GLU 117 2HB GLU 117 12.437 16.977 15.692
748 HG2 GLU 117 1HG GLU 117 13.928 19.003 15.703
749 HG3 GLU 117 2HG GLU 117 14.835 18.226 16.998
750 H THR 118 H THR 118 10.558 17.621 15.398
751 HA THR 118 HA THR 118 8.852 19.656 15.009
752 HB THR 118 HB THR 118 10.333 21.434 14.991
753 HG1 THR 118 1HG THR 118 9.143 20.975 12.836
754 HG21 THR 118 1HG2 THR 118 12.533 21.117 14.852
755 HG22 THR 118 2HG2 THR 118 12.384 20.726 13.139
756 HG23 THR 118 3HG2 THR 118 12.253 19.451 14.350
757 H PHE 119 H PHE 119 11.472 18.690 12.789
758 HA PHE 119 HA PHE 119 9.937 18.286 10.543
759 HB2 PHE 119 1HB PHE 119 12.551 18.096 11.006
760 HB3 PHE 119 2HB PHE 119 12.173 16.377 11.034
761 HD1 PHE 119 HD2 PHE 119 9.772 17.269 8.948
762 HD2 PHE 119 HD1 PHE 119 14.026 17.348 9.062
763 HE1 PHE 119 HE2 PHE 119 9.835 17.218 6.489
764 HE2 PHE 119 HE1 PHE 119 14.096 17.299 6.603
765 HZ PHE 119 HZ PHE 119 11.999 17.232 5.313
766 H SER 120 H SER 120 10.762 15.911 13.051
767 HA SER 120 HA SER 120 9.473 13.707 11.899
768 HB2 SER 120 1HB SER 120 11.011 14.050 14.099
769 HB3 SER 120 2HB SER 120 9.426 13.890 14.855
770 HG SER 120 HG SER 120 9.314 11.859 14.232
771 H ASP 121 H ASP 121 8.185 16.527 13.284
772 HA ASP 121 HA ASP 121 5.722 15.452 14.245
773 HB2 ASP 121 1HB ASP 121 6.754 17.657 14.940
774 HB3 ASP 121 2HB ASP 121 6.234 18.301 13.385
775 H LEU 122 H LEU 122 6.540 17.360 11.345
776 HA LEU 122 HA LEU 122 3.978 16.659 10.152
777 HB2 LEU 122 1HB LEU 122 6.169 18.312 8.925
778 HB3 LEU 122 2HB LEU 122 4.463 18.274 8.483
779 HG LEU 122 HG LEU 122 4.594 19.081 11.187
780 HD11 LEU 122 1HD1 LEU 122 6.489 20.634 9.431
781 HD12 LEU 122 2HD1 LEU 122 6.949 19.625 10.802
782 HD13 LEU 122 3HD1 LEU 122 5.978 21.074 11.060
783 HD21 LEU 122 1HD2 LEU 122 3.578 21.108 10.324
784 HD22 LEU 122 2HD2 LEU 122 2.893 19.694 9.523
785 HD23 LEU 122 3HD2 LEU 122 4.085 20.691 8.687
786 H TRP 123 H TRP 123 7.434 16.173 9.590
787 HA TRP 123 HA TRP 123 7.519 14.990 7.152
788 HB2 TRP 123 1HB TRP 123 9.447 15.329 8.743
789 HB3 TRP 123 2HB TRP 123 8.951 13.846 9.554
790 HD1 TRP 123 HD1 TRP 123 10.452 11.914 8.843
791 HE1 TRP 123 HE1 TRP 123 11.590 11.154 6.663
792 HE3 TRP 123 HE3 TRP 123 8.955 15.720 5.776
793 HZ2 TRP 123 HZ2 TRP 123 11.822 12.049 3.996
794 HZ3 TRP 123 HZ3 TRP 123 9.679 15.694 3.424
795 HH2 TRP 123 HH2 TRP 123 11.083 13.896 2.555
796 H LYS 124 H LYS 124 6.689 13.335 10.190
797 HA LYS 124 HA LYS 124 6.360 10.767 9.377
798 HB2 LYS 124 1HB LYS 124 5.066 12.466 11.408
799 HB3 LYS 124 2HB LYS 124 4.150 11.036 10.950
800 HG2 LYS 124 1HG LYS 124 6.223 9.692 11.410
801 HG3 LYS 124 2HG LYS 124 6.924 11.156 12.103
802 HD2 LYS 124 1HD LYS 124 5.837 10.830 14.017
803 HD3 LYS 124 2HD LYS 124 4.292 10.717 13.171
804 HE2 LYS 124 1HE LYS 124 4.914 8.330 12.624
805 HE3 LYS 124 2HE LYS 124 6.253 8.508 13.756
806 HZ1 LYS 124 1HZ LYS 124 3.352 8.624 14.336
807 HZ2 LYS 124 2HZ LYS 124 4.515 9.177 15.432
808 HZ3 LYS 124 3HZ LYS 124 4.500 7.551 14.964
809 H LEU 125 H LEU 125 4.231 13.471 8.685
810 HA LEU 125 HA LEU 125 1.940 12.296 7.812
811 HB2 LEU 125 1HB LEU 125 3.483 14.623 6.720
812 HB3 LEU 125 2HB LEU 125 1.954 14.125 5.999
813 HG LEU 125 HG LEU 125 0.715 14.903 7.751
814 HD11 LEU 125 1HD1 LEU 125 1.894 13.441 9.396
815 HD12 LEU 125 2HD1 LEU 125 1.392 15.006 10.035
816 HD13 LEU 125 3HD1 LEU 125 3.080 14.729 9.607
817 HD21 LEU 125 1HD2 LEU 125 2.166 16.928 8.763
818 HD22 LEU 125 2HD2 LEU 125 1.431 16.961 7.160
819 HD23 LEU 125 3HD2 LEU 125 3.135 16.540 7.340
820 H LEU 126 H LEU 126 5.073 11.988 6.420
821 HA LEU 126 HA LEU 126 3.950 10.713 4.022
822 HB2 LEU 126 1HB LEU 126 6.746 11.689 4.581
823 HB3 LEU 126 2HB LEU 126 6.223 10.910 3.089
824 HG LEU 126 HG LEU 126 4.525 12.895 2.988
825 HD11 LEU 126 1HD1 LEU 126 4.953 14.774 4.192
826 HD12 LEU 126 2HD1 LEU 126 6.674 14.421 4.346
827 HD13 LEU 126 3HD1 LEU 126 5.506 13.571 5.357
828 HD21 LEU 126 1HD2 LEU 126 6.715 12.315 1.629
829 HD22 LEU 126 2HD2 LEU 126 7.321 13.751 2.454
830 HD23 LEU 126 3HD2 LEU 126 5.887 13.859 1.431
831 HA PRO 127 HA PRO 127 5.369 7.212 6.723
832 HB2 PRO 127 1HB PRO 127 3.185 5.665 6.264
833 HB3 PRO 127 2HB PRO 127 3.247 6.885 7.543
834 HG2 PRO 127 1HG PRO 127 2.026 7.060 4.815
835 HG3 PRO 127 2HG PRO 127 1.381 7.623 6.369
836 HD2 PRO 127 1HD PRO 127 2.556 9.291 4.588
837 HD3 PRO 127 2HD PRO 127 2.652 9.546 6.343
838 H GLU 128 H GLU 128 4.157 7.483 3.458
839 HA GLU 128 HA GLU 128 6.093 6.240 2.096
840 HB2 GLU 128 1HB GLU 128 5.029 3.867 1.798
841 HB3 GLU 128 2HB GLU 128 6.100 4.190 3.155
842 HG2 GLU 128 1HG GLU 128 4.519 3.619 4.584
843 HG3 GLU 128 2HG GLU 128 3.435 4.839 3.917
844 H ASN 129 H ASN 129 2.631 6.448 2.515
845 HA ASN 129 HA ASN 129 2.350 6.732 -0.404
846 HB2 ASN 129 1HB ASN 129 0.640 5.248 1.562
847 HB3 ASN 129 2HB ASN 129 -0.093 5.936 0.116
848 HD21 ASN 129 2HD2 ASN 129 -0.384 4.417 -1.335
849 HD22 ASN 129 1HD2 ASN 129 0.735 3.165 -1.741
Start of MODEL 20
1 H1 GLN 1 H GLN 1 2.213 -2.684 1.017
2 HA GLN 1 HA GLN 1 1.213 -1.333 -1.201
3 HB2 GLN 1 1HB GLN 1 1.273 0.463 1.222
4 HB3 GLN 1 2HB GLN 1 0.753 0.875 -0.407
5 HG2 GLN 1 1HG GLN 1 -1.289 -0.050 -0.142
6 HG3 GLN 1 2HG GLN 1 -0.697 -1.325 0.921
7 HE21 GLN 1 2HE2 GLN 1 -2.421 -0.971 2.343
8 HE22 GLN 1 1HE2 GLN 1 -2.452 0.389 3.409
9 H ILE 2 H ILE 2 3.393 -1.300 1.542
10 HA ILE 2 HA ILE 2 5.323 0.486 0.724
11 HB ILE 2 HB ILE 2 6.896 -0.674 2.096
12 HG12 ILE 2 1HG1 ILE 2 5.419 -3.023 2.844
13 HG13 ILE 2 2HG1 ILE 2 5.617 -2.990 1.095
14 HG21 ILE 2 1HG2 ILE 2 5.825 -0.312 4.038
15 HG22 ILE 2 2HG2 ILE 2 4.500 0.211 2.999
16 HG23 ILE 2 3HG2 ILE 2 4.519 -1.430 3.645
17 HD11 ILE 2 1HD1 ILE 2 7.570 -3.487 3.194
18 HD12 ILE 2 2HD1 ILE 2 7.588 -3.941 1.489
19 HD13 ILE 2 3HD1 ILE 2 8.117 -2.332 1.979
20 H ASN 3 H ASN 3 7.707 -0.550 0.246
21 HA ASN 3 HA ASN 3 7.819 -2.605 -1.697
22 HB2 ASN 3 1HB ASN 3 6.713 -0.486 -2.846
23 HB3 ASN 3 2HB ASN 3 8.391 0.033 -2.973
24 HD21 ASN 3 2HD2 ASN 3 9.674 -2.334 -3.423
25 HD22 ASN 3 1HD2 ASN 3 9.175 -2.989 -4.942
26 H GLN 4 H GLN 4 9.844 -3.354 -1.761
27 HA GLN 4 HA GLN 4 11.881 -2.133 -0.208
28 HB2 GLN 4 1HB GLN 4 12.331 -4.307 -2.243
29 HB3 GLN 4 2HB GLN 4 13.226 -4.003 -0.759
30 HG2 GLN 4 1HG GLN 4 11.980 -5.749 -0.054
31 HG3 GLN 4 2HG GLN 4 10.845 -4.453 0.317
32 HE21 GLN 4 2HE2 GLN 4 8.869 -4.624 -0.470
33 HE22 GLN 4 1HE2 GLN 4 8.376 -5.673 -1.750
34 H VAL 5 H VAL 5 14.046 -1.571 -0.999
35 HA VAL 5 HA VAL 5 14.194 -0.693 -3.777
36 HB VAL 5 HB VAL 5 14.390 1.541 -3.421
37 HG11 VAL 5 1HG1 VAL 5 12.801 2.333 -1.749
38 HG12 VAL 5 2HG1 VAL 5 12.177 0.911 -2.587
39 HG13 VAL 5 3HG1 VAL 5 12.834 0.758 -0.958
40 HG21 VAL 5 1HG2 VAL 5 15.406 0.929 -0.648
41 HG22 VAL 5 2HG2 VAL 5 16.358 1.447 -2.040
42 HG23 VAL 5 3HG2 VAL 5 15.201 2.555 -1.302
43 H ARG 6 H ARG 6 16.436 0.326 -4.179
44 HA ARG 6 HA ARG 6 18.510 -0.799 -2.461
45 HB2 ARG 6 1HB ARG 6 17.714 -2.266 -4.589
46 HB3 ARG 6 2HB ARG 6 18.938 -1.258 -5.351
47 HG2 ARG 6 1HG ARG 6 20.391 -2.798 -4.665
48 HG3 ARG 6 2HG ARG 6 20.194 -2.087 -3.062
49 HD2 ARG 6 1HD ARG 6 18.735 -3.747 -2.364
50 HD3 ARG 6 2HD ARG 6 18.298 -4.193 -4.013
51 HE ARG 6 HE ARG 6 20.494 -5.206 -2.474
52 HH11 ARG 6 1HH1 ARG 6 19.330 -4.582 -5.696
53 HH12 ARG 6 2HH1 ARG 6 20.328 -5.791 -6.431
54 HH21 ARG 6 1HH2 ARG 6 21.813 -6.801 -3.431
55 HH22 ARG 6 2HH2 ARG 6 21.740 -7.054 -5.142
56 HA PRO 7 HA PRO 7 19.679 3.411 -3.750
57 HB2 PRO 7 1HB PRO 7 21.161 3.898 -1.529
58 HB3 PRO 7 2HB PRO 7 19.405 4.091 -1.573
59 HG2 PRO 7 1HG PRO 7 21.034 1.812 -0.518
60 HG3 PRO 7 2HG PRO 7 19.603 2.585 0.188
61 HD2 PRO 7 1HD PRO 7 19.476 0.241 -1.160
62 HD3 PRO 7 2HD PRO 7 18.149 1.420 -1.168
63 H LYS 8 H LYS 8 21.125 3.185 -5.372
64 HA LYS 8 HA LYS 8 23.451 1.579 -5.250
65 HB2 LYS 8 1HB LYS 8 23.122 3.914 -7.116
66 HB3 LYS 8 2HB LYS 8 23.961 2.394 -7.399
67 HG2 LYS 8 1HG LYS 8 21.551 1.389 -7.068
68 HG3 LYS 8 2HG LYS 8 21.059 3.019 -7.537
69 HD2 LYS 8 1HD LYS 8 22.795 2.648 -9.469
70 HD3 LYS 8 2HD LYS 8 22.517 0.942 -9.110
71 HE2 LYS 8 1HE LYS 8 20.083 2.568 -9.325
72 HE3 LYS 8 2HE LYS 8 21.016 2.442 -10.816
73 HZ1 LYS 8 1HZ LYS 8 20.910 0.061 -10.682
74 HZ2 LYS 8 2HZ LYS 8 19.340 0.682 -10.581
75 HZ3 LYS 8 3HZ LYS 8 20.121 0.126 -9.187
76 H LEU 9 H LEU 9 25.304 3.477 -6.455
77 HA LEU 9 HA LEU 9 26.680 4.297 -4.139
78 HB2 LEU 9 1HB LEU 9 27.008 4.685 -7.063
79 HB3 LEU 9 2HB LEU 9 27.896 5.766 -5.992
80 HG LEU 9 HG LEU 9 28.167 2.787 -6.284
81 HD11 LEU 9 1HD1 LEU 9 29.714 3.564 -7.713
82 HD12 LEU 9 2HD1 LEU 9 30.651 3.860 -6.249
83 HD13 LEU 9 3HD1 LEU 9 29.730 5.171 -6.986
84 HD21 LEU 9 1HD2 LEU 9 28.419 2.738 -4.048
85 HD22 LEU 9 2HD2 LEU 9 28.675 4.480 -3.931
86 HD23 LEU 9 3HD2 LEU 9 30.004 3.422 -4.408
87 HA PRO 10 HA PRO 10 25.392 8.809 -5.261
88 HB2 PRO 10 1HB PRO 10 23.555 9.140 -7.233
89 HB3 PRO 10 2HB PRO 10 25.295 9.083 -7.540
90 HG2 PRO 10 1HG PRO 10 23.246 6.922 -7.844
91 HG3 PRO 10 2HG PRO 10 24.582 7.358 -8.926
92 HD2 PRO 10 1HD PRO 10 24.720 5.267 -7.211
93 HD3 PRO 10 2HD PRO 10 26.143 6.230 -7.660
94 H LEU 11 H LEU 11 23.437 6.164 -4.712
95 HA LEU 11 HA LEU 11 21.242 7.844 -3.692
96 HB2 LEU 11 1HB LEU 11 21.253 4.995 -4.661
97 HB3 LEU 11 2HB LEU 11 19.910 5.700 -3.763
98 HG LEU 11 HG LEU 11 20.696 6.040 -6.585
99 HD11 LEU 11 1HD1 LEU 11 17.994 6.677 -5.624
100 HD12 LEU 11 2HD1 LEU 11 18.546 5.036 -5.288
101 HD13 LEU 11 3HD1 LEU 11 18.517 5.634 -6.947
102 HD21 LEU 11 1HD2 LEU 11 21.168 8.272 -5.866
103 HD22 LEU 11 2HD2 LEU 11 19.686 8.335 -4.912
104 HD23 LEU 11 3HD2 LEU 11 19.600 8.278 -6.673
105 H LEU 12 H LEU 12 23.690 5.550 -2.914
106 HA LEU 12 HA LEU 12 22.600 4.750 -0.385
107 HB2 LEU 12 1HB LEU 12 24.108 3.283 -1.570
108 HB3 LEU 12 2HB LEU 12 25.373 4.511 -1.542
109 HG LEU 12 HG LEU 12 25.759 4.206 0.763
110 HD11 LEU 12 1HD1 LEU 12 23.180 2.656 0.782
111 HD12 LEU 12 2HD1 LEU 12 23.553 4.152 1.639
112 HD13 LEU 12 3HD1 LEU 12 24.334 2.644 2.116
113 HD21 LEU 12 1HD2 LEU 12 26.927 2.454 -0.034
114 HD22 LEU 12 2HD2 LEU 12 25.550 1.801 -0.922
115 HD23 LEU 12 3HD2 LEU 12 25.702 1.508 0.811
116 H LYS 13 H LYS 13 25.343 6.820 -1.334
117 HA LYS 13 HA LYS 13 26.110 7.701 1.164
118 HB2 LYS 13 1HB LYS 13 27.398 9.241 0.074
119 HB3 LYS 13 2HB LYS 13 26.998 8.208 -1.292
120 HG2 LYS 13 1HG LYS 13 25.230 9.723 -1.959
121 HG3 LYS 13 2HG LYS 13 25.542 10.739 -0.549
122 HD2 LYS 13 1HD LYS 13 28.020 10.528 -1.740
123 HD3 LYS 13 2HD LYS 13 26.918 10.623 -3.116
124 HE2 LYS 13 1HE LYS 13 27.232 12.848 -2.749
125 HE3 LYS 13 2HE LYS 13 25.873 12.577 -1.659
126 HZ1 LYS 13 1HZ LYS 13 27.292 13.647 -0.267
127 HZ2 LYS 13 2HZ LYS 13 28.686 13.074 -1.034
128 HZ3 LYS 13 3HZ LYS 13 27.818 12.062 0.008
129 H ILE 14 H ILE 14 23.437 8.793 -0.836
130 HA ILE 14 HA ILE 14 22.779 11.136 0.545
131 HB ILE 14 HB ILE 14 20.812 9.269 -0.778
132 HG12 ILE 14 1HG1 ILE 14 22.811 11.186 -1.910
133 HG13 ILE 14 2HG1 ILE 14 22.331 9.598 -2.498
134 HG21 ILE 14 1HG2 ILE 14 20.715 12.264 -0.483
135 HG22 ILE 14 2HG2 ILE 14 19.441 11.198 -1.074
136 HG23 ILE 14 3HG2 ILE 14 19.922 11.141 0.622
137 HD11 ILE 14 1HD1 ILE 14 21.043 12.244 -2.911
138 HD12 ILE 14 2HD1 ILE 14 21.384 10.957 -4.068
139 HD13 ILE 14 3HD1 ILE 14 20.046 10.790 -2.933
140 H LEU 15 H LEU 15 21.422 7.859 0.919
141 HA LEU 15 HA LEU 15 19.836 8.522 3.173
142 HB2 LEU 15 1HB LEU 15 20.864 5.786 2.459
143 HB3 LEU 15 2HB LEU 15 19.414 6.188 3.377
144 HG LEU 15 HG LEU 15 19.879 6.343 0.421
145 HD11 LEU 15 1HD1 LEU 15 18.667 4.489 0.489
146 HD12 LEU 15 2HD1 LEU 15 17.315 5.432 1.116
147 HD13 LEU 15 3HD1 LEU 15 18.439 4.655 2.230
148 HD21 LEU 15 1HD2 LEU 15 18.094 8.032 2.088
149 HD22 LEU 15 2HD2 LEU 15 17.456 7.401 0.570
150 HD23 LEU 15 3HD2 LEU 15 18.909 8.401 0.569
151 H HIS 16 H HIS 16 23.109 7.320 2.780
152 HA HIS 16 HA HIS 16 23.617 6.498 5.401
153 HB2 HIS 16 1HB HIS 16 25.242 7.285 3.065
154 HB3 HIS 16 2HB HIS 16 26.043 7.441 4.625
155 HD1 HIS 16 HD1 HIS 16 27.607 5.480 4.488
156 HD2 HIS 16 HD2 HIS 16 23.666 4.444 3.676
157 HE1 HIS 16 HE1 HIS 16 27.582 2.968 4.376
158 H ALA 17 H ALA 17 24.160 9.669 3.882
159 HA ALA 17 HA ALA 17 25.164 10.948 6.178
160 HB1 ALA 17 1HB ALA 17 25.501 12.589 4.725
161 HB2 ALA 17 2HB ALA 17 24.632 11.652 3.508
162 HB3 ALA 17 3HB ALA 17 23.763 12.809 4.516
163 H ALA 18 H ALA 18 21.938 10.183 5.166
164 HA ALA 18 HA ALA 18 20.670 12.037 6.984
165 HB1 ALA 18 1HB ALA 18 19.834 10.292 4.824
166 HB2 ALA 18 2HB ALA 18 18.744 10.212 6.208
167 HB3 ALA 18 3HB ALA 18 19.086 11.764 5.443
168 H GLY 19 H GLY 19 22.385 9.359 7.551
169 HA2 GLY 19 1HA GLY 19 22.541 8.454 9.759
170 HA3 GLY 19 2HA GLY 19 20.817 8.735 9.958
171 H ALA 20 H ALA 20 21.667 7.413 6.943
172 HA ALA 20 HA ALA 20 20.508 4.852 7.737
173 HB1 ALA 20 1HB ALA 20 21.218 5.539 4.918
174 HB2 ALA 20 2HB ALA 20 19.909 4.529 5.532
175 HB3 ALA 20 3HB ALA 20 19.811 6.283 5.678
176 H GLN 21 H GLN 21 21.452 2.898 6.522
177 HA GLN 21 HA GLN 21 24.188 2.872 5.811
178 HB2 GLN 21 1HB GLN 21 23.914 3.077 8.508
179 HB3 GLN 21 2HB GLN 21 23.931 1.330 8.312
180 HG2 GLN 21 1HG GLN 21 26.145 1.534 8.408
181 HG3 GLN 21 2HG GLN 21 26.019 2.080 6.736
182 HE21 GLN 21 2HE2 GLN 21 25.383 4.521 6.644
183 HE22 GLN 21 1HE2 GLN 21 26.354 5.553 7.632
184 H GLY 22 H GLY 22 23.852 1.479 4.181
185 HA2 GLY 22 1HA GLY 22 23.885 -1.174 4.272
186 HA3 GLY 22 2HA GLY 22 22.183 -0.877 4.594
187 H GLU 23 H GLU 23 21.957 -2.184 2.599
188 HA GLU 23 HA GLU 23 22.090 -0.434 0.236
189 HB2 GLU 23 1HB GLU 23 23.494 -2.844 0.605
190 HB3 GLU 23 2HB GLU 23 22.179 -3.220 -0.498
191 HG2 GLU 23 1HG GLU 23 22.970 -1.832 -2.139
192 HG3 GLU 23 2HG GLU 23 23.827 -0.795 -1.001
193 H MET 24 H MET 24 20.102 -1.871 2.355
194 HA MET 24 HA MET 24 17.946 -2.081 0.372
195 HB2 MET 24 1HB MET 24 17.373 -3.880 2.495
196 HB3 MET 24 2HB MET 24 17.625 -4.246 0.794
197 HG2 MET 24 1HG MET 24 19.896 -3.935 2.730
198 HG3 MET 24 2HG MET 24 19.078 -5.472 2.458
199 HE1 MET 24 1HE MET 24 22.714 -5.293 0.607
200 HE2 MET 24 2HE MET 24 22.274 -4.090 1.820
201 HE3 MET 24 3HE MET 24 21.925 -5.796 2.103
202 H PHE 25 H PHE 25 16.100 -1.070 0.925
203 HA PHE 25 HA PHE 25 15.371 -0.562 3.651
204 HB2 PHE 25 1HB PHE 25 16.064 1.830 1.936
205 HB3 PHE 25 2HB PHE 25 15.487 1.854 3.599
206 HD1 PHE 25 HD1 PHE 25 18.343 1.133 1.416
207 HD2 PHE 25 HD2 PHE 25 16.962 1.410 5.433
208 HE1 PHE 25 HE1 PHE 25 20.669 1.082 2.216
209 HE2 PHE 25 HE2 PHE 25 19.285 1.359 6.239
210 HZ PHE 25 HZ PHE 25 21.143 1.196 4.630
211 H THR 26 H THR 26 13.221 -0.132 3.858
212 HA THR 26 HA THR 26 11.583 -0.512 1.533
213 HB THR 26 HB THR 26 9.822 0.199 3.505
214 HG1 THR 26 1HG THR 26 11.430 -1.392 5.040
215 HG21 THR 26 1HG2 THR 26 9.274 -2.062 3.594
216 HG22 THR 26 2HG2 THR 26 10.952 -2.577 3.416
217 HG23 THR 26 3HG2 THR 26 10.080 -1.917 2.033
218 H VAL 27 H VAL 27 9.416 1.005 1.747
219 HA VAL 27 HA VAL 27 10.192 3.478 0.637
220 HB VAL 27 HB VAL 27 7.468 3.338 1.756
221 HG11 VAL 27 1HG1 VAL 27 7.848 3.545 -1.132
222 HG12 VAL 27 2HG1 VAL 27 6.998 4.618 -0.019
223 HG13 VAL 27 3HG1 VAL 27 8.746 4.752 -0.213
224 HG21 VAL 27 1HG2 VAL 27 7.516 1.050 1.345
225 HG22 VAL 27 2HG2 VAL 27 6.862 1.710 -0.155
226 HG23 VAL 27 3HG2 VAL 27 8.556 1.225 -0.069
227 H LYS 28 H LYS 28 8.790 2.662 3.801
228 HA LYS 28 HA LYS 28 8.709 5.289 4.805
229 HB2 LYS 28 1HB LYS 28 8.262 4.325 6.917
230 HB3 LYS 28 2HB LYS 28 7.549 3.229 5.740
231 HG2 LYS 28 1HG LYS 28 10.292 2.786 6.873
232 HG3 LYS 28 2HG LYS 28 8.832 2.192 7.668
233 HD2 LYS 28 1HD LYS 28 8.346 1.249 5.237
234 HD3 LYS 28 2HD LYS 28 10.106 1.328 5.124
235 HE2 LYS 28 1HE LYS 28 8.638 -0.026 7.379
236 HE3 LYS 28 2HE LYS 28 9.170 -0.866 5.923
237 HZ1 LYS 28 1HZ LYS 28 10.875 -1.214 7.439
238 HZ2 LYS 28 2HZ LYS 28 10.816 0.364 8.042
239 HZ3 LYS 28 3HZ LYS 28 11.457 0.070 6.505
240 H GLU 29 H GLU 29 11.246 2.866 4.737
241 HA GLU 29 HA GLU 29 12.994 4.251 6.525
242 HB2 GLU 29 1HB GLU 29 13.252 1.910 4.683
243 HB3 GLU 29 2HB GLU 29 14.711 2.664 5.311
244 HG2 GLU 29 1HG GLU 29 12.469 1.662 7.046
245 HG3 GLU 29 2HG GLU 29 13.885 0.705 6.615
246 H VAL 30 H VAL 30 12.812 3.921 2.995
247 HA VAL 30 HA VAL 30 15.075 5.493 2.405
248 HB VAL 30 HB VAL 30 12.621 4.963 0.725
249 HG11 VAL 30 1HG1 VAL 30 13.440 6.338 -0.811
250 HG12 VAL 30 2HG1 VAL 30 14.732 6.797 0.301
251 HG13 VAL 30 3HG1 VAL 30 14.965 5.452 -0.818
252 HG21 VAL 30 1HG2 VAL 30 14.181 3.053 1.564
253 HG22 VAL 30 2HG2 VAL 30 13.688 3.101 -0.129
254 HG23 VAL 30 3HG2 VAL 30 15.289 3.674 0.340
255 H MET 31 H MET 31 11.658 6.303 2.796
256 HA MET 31 HA MET 31 11.897 9.011 1.989
257 HB2 MET 31 1HB MET 31 9.680 8.755 2.028
258 HB3 MET 31 2HB MET 31 9.827 7.265 2.951
259 HG2 MET 31 1HG MET 31 8.437 8.783 4.158
260 HG3 MET 31 2HG MET 31 9.964 8.609 5.019
261 HE1 MET 31 1HE MET 31 8.929 10.609 1.854
262 HE2 MET 31 2HE MET 31 9.737 12.150 2.141
263 HE3 MET 31 3HE MET 31 10.690 10.681 1.923
264 H HIS 32 H HIS 32 11.966 7.409 5.149
265 HA HIS 32 HA HIS 32 12.047 9.661 6.779
266 HB2 HIS 32 1HB HIS 32 11.973 7.077 7.325
267 HB3 HIS 32 2HB HIS 32 13.715 7.282 7.482
268 HD1 HIS 32 HD1 HIS 32 10.847 7.244 9.505
269 HD2 HIS 32 HD2 HIS 32 14.178 9.719 9.310
270 HE1 HIS 32 HE1 HIS 32 10.966 8.388 11.741
271 H TYR 33 H TYR 33 14.525 8.219 4.807
272 HA TYR 33 HA TYR 33 16.730 9.553 6.036
273 HB2 TYR 33 1HB TYR 33 16.457 8.256 3.318
274 HB3 TYR 33 2HB TYR 33 17.972 8.843 3.994
275 HD1 TYR 33 HD1 TYR 33 17.605 7.948 6.834
276 HD2 TYR 33 HD2 TYR 33 16.871 5.948 3.151
277 HE1 TYR 33 HE1 TYR 33 17.951 5.782 7.948
278 HE2 TYR 33 HE2 TYR 33 17.213 3.777 4.254
279 HH TYR 33 HH TYR 33 17.373 3.445 7.649
280 H LEU 34 H LEU 34 14.564 10.262 3.365
281 HA LEU 34 HA LEU 34 15.886 12.308 2.086
282 HB2 LEU 34 1HB LEU 34 13.174 11.381 2.314
283 HB3 LEU 34 2HB LEU 34 13.215 13.141 2.254
284 HG LEU 34 HG LEU 34 12.894 12.306 0.035
285 HD11 LEU 34 1HD1 LEU 34 15.446 12.927 -0.769
286 HD12 LEU 34 2HD1 LEU 34 15.317 13.727 0.797
287 HD13 LEU 34 3HD1 LEU 34 14.145 14.080 -0.473
288 HD21 LEU 34 1HD2 LEU 34 15.335 10.623 0.572
289 HD22 LEU 34 2HD2 LEU 34 14.628 10.857 -1.027
290 HD23 LEU 34 3HD2 LEU 34 13.695 10.063 0.243
291 H GLY 35 H GLY 35 13.557 12.710 4.765
292 HA2 GLY 35 1HA GLY 35 13.864 15.440 5.139
293 HA3 GLY 35 2HA GLY 35 13.417 14.308 6.408
294 H GLN 36 H GLN 36 15.680 12.813 6.710
295 HA GLN 36 HA GLN 36 17.273 14.429 8.344
296 HB2 GLN 36 1HB GLN 36 17.801 11.713 7.138
297 HB3 GLN 36 2HB GLN 36 18.858 12.468 8.323
298 HG2 GLN 36 1HG GLN 36 16.371 12.636 9.492
299 HG3 GLN 36 2HG GLN 36 16.346 11.066 8.690
300 HE21 GLN 36 2HE2 GLN 36 18.758 12.983 10.459
301 HE22 GLN 36 1HE2 GLN 36 19.238 11.711 11.524
302 H TYR 37 H TYR 37 17.764 13.300 5.030
303 HA TYR 37 HA TYR 37 20.387 14.231 4.692
304 HB2 TYR 37 1HB TYR 37 19.302 12.674 3.131
305 HB3 TYR 37 2HB TYR 37 18.201 13.948 2.618
306 HD1 TYR 37 HD2 TYR 37 21.852 13.198 2.840
307 HD2 TYR 37 HD1 TYR 37 18.741 15.220 0.758
308 HE1 TYR 37 HE2 TYR 37 23.462 13.885 1.113
309 HE2 TYR 37 HE1 TYR 37 20.342 15.912 -0.976
310 HH TYR 37 HH TYR 37 23.366 16.112 -0.712
311 H ILE 38 H ILE 38 17.269 15.794 4.045
312 HA ILE 38 HA ILE 38 18.284 18.171 2.947
313 HB ILE 38 HB ILE 38 15.721 17.761 4.493
314 HG12 ILE 38 1HG1 ILE 38 16.202 17.774 1.506
315 HG13 ILE 38 2HG1 ILE 38 16.017 16.317 2.476
316 HG21 ILE 38 1HG2 ILE 38 16.494 20.133 4.278
317 HG22 ILE 38 2HG2 ILE 38 16.378 19.946 2.529
318 HG23 ILE 38 3HG2 ILE 38 14.933 19.794 3.529
319 HD11 ILE 38 1HD1 ILE 38 14.009 17.535 1.163
320 HD12 ILE 38 2HD1 ILE 38 13.789 16.532 2.597
321 HD13 ILE 38 3HD1 ILE 38 13.859 18.287 2.751
322 H MET 39 H MET 39 17.449 17.319 6.289
323 HA MET 39 HA MET 39 18.075 19.871 7.369
324 HB2 MET 39 1HB MET 39 17.372 19.007 9.337
325 HB3 MET 39 2HB MET 39 16.773 17.701 8.323
326 HG2 MET 39 1HG MET 39 18.791 16.416 8.763
327 HG3 MET 39 2HG MET 39 19.419 17.730 9.754
328 HE1 MET 39 1HE MET 39 15.859 18.056 10.682
329 HE2 MET 39 2HE MET 39 16.297 17.760 12.364
330 HE3 MET 39 3HE MET 39 17.287 18.830 11.371
331 H VAL 40 H VAL 40 19.945 17.052 6.589
332 HA VAL 40 HA VAL 40 22.214 17.705 8.202
333 HB VAL 40 HB VAL 40 21.427 15.484 6.739
334 HG11 VAL 40 1HG1 VAL 40 22.388 16.474 4.713
335 HG12 VAL 40 2HG1 VAL 40 23.948 16.614 5.527
336 HG13 VAL 40 3HG1 VAL 40 23.259 15.022 5.206
337 HG21 VAL 40 1HG2 VAL 40 23.486 14.476 7.624
338 HG22 VAL 40 2HG2 VAL 40 24.093 16.084 8.019
339 HG23 VAL 40 3HG2 VAL 40 22.660 15.458 8.834
340 H LYS 41 H LYS 41 21.290 18.257 4.841
341 HA LYS 41 HA LYS 41 23.801 19.634 4.302
342 HB2 LYS 41 1HB LYS 41 21.456 18.829 2.596
343 HB3 LYS 41 2HB LYS 41 22.687 19.934 1.999
344 HG2 LYS 41 1HG LYS 41 23.260 17.169 3.040
345 HG3 LYS 41 2HG LYS 41 23.030 17.568 1.336
346 HD2 LYS 41 1HD LYS 41 25.294 17.747 1.419
347 HD3 LYS 41 2HD LYS 41 24.888 19.386 1.932
348 HE2 LYS 41 1HE LYS 41 26.114 18.998 3.751
349 HE3 LYS 41 2HE LYS 41 24.831 17.910 4.276
350 HZ1 LYS 41 1HZ LYS 41 26.525 16.447 4.323
351 HZ2 LYS 41 2HZ LYS 41 27.457 17.293 3.194
352 HZ3 LYS 41 3HZ LYS 41 26.193 16.299 2.671
353 H GLN 42 H GLN 42 20.691 20.360 5.411
354 HA GLN 42 HA GLN 42 19.740 22.341 6.028
355 HB2 GLN 42 1HB GLN 42 22.495 23.011 5.659
356 HB3 GLN 42 2HB GLN 42 21.509 24.313 5.006
357 HG2 GLN 42 1HG GLN 42 21.425 25.081 7.087
358 HG3 GLN 42 2HG GLN 42 20.281 23.776 7.395
359 HE21 GLN 42 2HE2 GLN 42 22.044 21.617 7.280
360 HE22 GLN 42 1HE2 GLN 42 23.104 21.699 8.641
361 H LEU 43 H LEU 43 18.378 21.530 4.162
362 HA LEU 43 HA LEU 43 18.227 23.652 2.138
363 HB2 LEU 43 1HB LEU 43 18.023 20.685 1.672
364 HB3 LEU 43 2HB LEU 43 17.479 21.890 0.507
365 HG LEU 43 HG LEU 43 19.588 21.212 -0.253
366 HD11 LEU 43 1HD1 LEU 43 20.563 23.225 -0.489
367 HD12 LEU 43 2HD1 LEU 43 20.636 23.514 1.249
368 HD13 LEU 43 3HD1 LEU 43 19.133 23.797 0.371
369 HD21 LEU 43 1HD2 LEU 43 21.456 21.670 1.741
370 HD22 LEU 43 2HD2 LEU 43 20.890 20.100 1.170
371 HD23 LEU 43 3HD2 LEU 43 20.129 20.857 2.571
372 H TYR 44 H TYR 44 16.746 23.797 4.381
373 HA TYR 44 HA TYR 44 14.052 23.420 3.347
374 HB2 TYR 44 1HB TYR 44 13.249 22.418 5.453
375 HB3 TYR 44 2HB TYR 44 14.421 21.386 4.641
376 HD1 TYR 44 HD2 TYR 44 16.966 21.978 5.414
377 HD2 TYR 44 HD1 TYR 44 13.448 22.544 7.739
378 HE1 TYR 44 HE2 TYR 44 18.316 21.889 7.468
379 HE2 TYR 44 HE1 TYR 44 14.789 22.458 9.800
380 HH TYR 44 HH TYR 44 16.812 21.961 10.661
381 H ASP 45 H ASP 45 12.423 24.497 4.836
382 HA ASP 45 HA ASP 45 13.526 27.076 5.645
383 HB2 ASP 45 1HB ASP 45 11.678 27.321 4.188
384 HB3 ASP 45 2HB ASP 45 10.734 26.111 5.054
385 H GLN 46 H GLN 46 14.344 26.888 7.669
386 HA GLN 46 HA GLN 46 13.526 25.299 9.744
387 HB2 GLN 46 1HB GLN 46 14.488 28.134 10.123
388 HB3 GLN 46 2HB GLN 46 14.686 26.779 11.226
389 HG2 GLN 46 1HG GLN 46 16.752 26.778 10.317
390 HG3 GLN 46 2HG GLN 46 15.946 25.755 9.128
391 HE21 GLN 46 2HE2 GLN 46 15.993 26.353 7.068
392 HE22 GLN 46 1HE2 GLN 46 16.524 27.889 6.482
393 H GLN 47 H GLN 47 12.216 28.426 8.776
394 HA GLN 47 HA GLN 47 10.505 28.773 11.000
395 HB2 GLN 47 1HB GLN 47 9.695 29.884 8.368
396 HB3 GLN 47 2HB GLN 47 9.767 30.662 9.944
397 HG2 GLN 47 1HG GLN 47 11.949 30.231 7.952
398 HG3 GLN 47 2HG GLN 47 11.437 31.719 8.746
399 HE21 GLN 47 2HE2 GLN 47 14.029 30.105 8.518
400 HE22 GLN 47 1HE2 GLN 47 14.610 30.047 10.144
401 H GLU 48 H GLU 48 10.217 26.989 8.021
402 HA GLU 48 HA GLU 48 7.707 25.850 8.985
403 HB2 GLU 48 1HB GLU 48 8.008 27.536 6.594
404 HB3 GLU 48 2HB GLU 48 7.180 26.011 6.307
405 HG2 GLU 48 1HG GLU 48 5.331 26.695 7.337
406 HG3 GLU 48 2HG GLU 48 6.231 27.379 8.689
407 H GLN 49 H GLN 49 8.812 23.937 9.393
408 HA GLN 49 HA GLN 49 10.609 22.628 7.751
409 HB2 GLN 49 1HB GLN 49 8.623 21.642 9.776
410 HB3 GLN 49 2HB GLN 49 9.616 20.506 8.872
411 HG2 GLN 49 1HG GLN 49 11.223 20.793 10.356
412 HG3 GLN 49 2HG GLN 49 11.368 22.470 9.830
413 HE21 GLN 49 2HE2 GLN 49 11.746 23.452 11.730
414 HE22 GLN 49 1HE2 GLN 49 10.657 23.445 13.071
415 H HIS 50 H HIS 50 7.280 23.155 7.255
416 HA HIS 50 HA HIS 50 6.875 20.897 5.499
417 HB2 HIS 50 1HB HIS 50 4.660 21.468 5.495
418 HB3 HIS 50 2HB HIS 50 5.142 22.285 6.979
419 HD1 HIS 50 HD1 HIS 50 4.957 24.806 7.035
420 HD2 HIS 50 HD2 HIS 50 4.279 23.213 3.258
421 HE1 HIS 50 HE1 HIS 50 4.083 26.713 5.648
422 H MET 51 H MET 51 8.858 23.250 5.055
423 HA MET 51 HA MET 51 8.222 23.540 2.206
424 HB2 MET 51 1HB MET 51 7.527 25.629 3.173
425 HB3 MET 51 2HB MET 51 9.026 25.766 4.081
426 HG2 MET 51 1HG MET 51 9.589 27.140 2.399
427 HG3 MET 51 2HG MET 51 10.025 25.630 1.603
428 HE1 MET 51 1HE MET 51 8.757 24.463 -0.156
429 HE2 MET 51 2HE MET 51 7.210 24.330 0.680
430 HE3 MET 51 3HE MET 51 7.278 25.012 -0.945
431 H VAL 52 H VAL 52 9.794 22.185 1.482
432 HA VAL 52 HA VAL 52 12.521 22.477 2.478
433 HB VAL 52 HB VAL 52 11.280 20.489 0.577
434 HG11 VAL 52 1HG1 VAL 52 13.604 20.997 -0.067
435 HG12 VAL 52 2HG1 VAL 52 14.128 20.581 1.566
436 HG13 VAL 52 3HG1 VAL 52 13.414 19.347 0.527
437 HG21 VAL 52 1HG2 VAL 52 10.979 20.484 3.191
438 HG22 VAL 52 2HG2 VAL 52 11.271 18.985 2.308
439 HG23 VAL 52 3HG2 VAL 52 12.597 19.783 3.153
440 H TYR 53 H TYR 53 14.085 23.524 1.425
441 HA TYR 53 HA TYR 53 13.492 24.523 -1.278
442 HB2 TYR 53 1HB TYR 53 15.143 25.623 0.979
443 HB3 TYR 53 2HB TYR 53 15.406 26.162 -0.676
444 HD1 TYR 53 HD1 TYR 53 12.771 26.401 -1.800
445 HD2 TYR 53 HD2 TYR 53 14.078 27.309 2.145
446 HE1 TYR 53 HE1 TYR 53 10.931 28.017 -1.570
447 HE2 TYR 53 HE2 TYR 53 12.241 28.927 2.387
448 HH TYR 53 HH TYR 53 10.563 29.973 1.368
449 H CYS 54 H CYS 54 14.343 23.131 -2.706
450 HA CYS 54 HA CYS 54 16.666 21.580 -2.258
451 HB2 CYS 54 1HB CYS 54 16.198 20.614 -4.264
452 HB3 CYS 54 2HB CYS 54 14.652 21.422 -4.032
453 HG CYS 54 HG CYS 54 15.480 21.686 -6.710
454 H GLY 55 H GLY 55 16.094 24.618 -3.984
455 HA2 GLY 55 1HA GLY 55 17.543 26.231 -4.735
456 HA3 GLY 55 2HA GLY 55 18.646 25.653 -3.495
457 H GLY 56 H GLY 56 20.070 23.868 -4.035
458 HA2 GLY 56 1HA GLY 56 20.340 23.090 -6.799
459 HA3 GLY 56 2HA GLY 56 21.589 24.203 -6.260
460 H ASP 57 H ASP 57 20.232 21.974 -3.989
461 HA ASP 57 HA ASP 57 22.816 20.709 -3.671
462 HB2 ASP 57 1HB ASP 57 20.512 21.168 -2.023
463 HB3 ASP 57 2HB ASP 57 20.893 19.448 -2.021
464 H LEU 58 H LEU 58 22.528 18.202 -3.056
465 HA LEU 58 HA LEU 58 22.353 16.781 -5.381
466 HB2 LEU 58 1HB LEU 58 23.161 16.055 -3.058
467 HB3 LEU 58 2HB LEU 58 21.488 15.584 -2.768
468 HG LEU 58 HG LEU 58 23.232 14.483 -4.971
469 HD11 LEU 58 1HD1 LEU 58 23.153 12.406 -3.561
470 HD12 LEU 58 2HD1 LEU 58 22.533 13.408 -2.249
471 HD13 LEU 58 3HD1 LEU 58 24.136 13.721 -2.914
472 HD21 LEU 58 1HD2 LEU 58 20.446 13.862 -4.025
473 HD22 LEU 58 2HD2 LEU 58 21.399 12.733 -4.988
474 HD23 LEU 58 3HD2 LEU 58 20.978 14.315 -5.644
475 H LEU 59 H LEU 59 19.758 17.136 -2.968
476 HA LEU 59 HA LEU 59 17.814 15.660 -4.332
477 HB2 LEU 59 1HB LEU 59 16.240 16.590 -2.851
478 HB3 LEU 59 2HB LEU 59 17.747 16.465 -1.947
479 HG LEU 59 HG LEU 59 16.862 19.034 -3.235
480 HD11 LEU 59 1HD1 LEU 59 16.455 19.121 -0.442
481 HD12 LEU 59 2HD1 LEU 59 15.618 17.694 -1.051
482 HD13 LEU 59 3HD1 LEU 59 15.259 19.282 -1.728
483 HD21 LEU 59 1HD2 LEU 59 18.997 19.457 -2.645
484 HD22 LEU 59 2HD2 LEU 59 19.046 18.147 -1.464
485 HD23 LEU 59 3HD2 LEU 59 18.287 19.685 -1.046
486 H GLY 60 H GLY 60 18.684 19.080 -4.522
487 HA2 GLY 60 1HA GLY 60 16.557 19.963 -6.114
488 HA3 GLY 60 2HA GLY 60 18.152 20.699 -6.058
489 H GLU 61 H GLU 61 19.798 18.883 -7.135
490 HA GLU 61 HA GLU 61 19.338 19.132 -9.891
491 HB2 GLU 61 1HB GLU 61 21.263 17.535 -10.116
492 HB3 GLU 61 2HB GLU 61 21.586 18.941 -9.111
493 HG2 GLU 61 1HG GLU 61 21.243 17.602 -7.107
494 HG3 GLU 61 2HG GLU 61 20.893 16.191 -8.103
495 H LEU 62 H LEU 62 18.998 16.343 -7.724
496 HA LEU 62 HA LEU 62 18.359 14.393 -9.579
497 HB2 LEU 62 1HB LEU 62 18.493 14.524 -6.861
498 HB3 LEU 62 2HB LEU 62 16.764 14.301 -7.119
499 HG LEU 62 HG LEU 62 17.510 12.134 -6.849
500 HD11 LEU 62 1HD1 LEU 62 16.842 11.171 -8.763
501 HD12 LEU 62 2HD1 LEU 62 18.048 12.016 -9.733
502 HD13 LEU 62 3HD1 LEU 62 16.550 12.831 -9.283
503 HD21 LEU 62 1HD2 LEU 62 19.597 11.305 -7.336
504 HD22 LEU 62 2HD2 LEU 62 19.970 13.003 -7.040
505 HD23 LEU 62 3HD2 LEU 62 19.838 12.404 -8.694
506 H LEU 63 H LEU 63 16.114 16.531 -7.824
507 HA LEU 63 HA LEU 63 13.819 15.618 -9.243
508 HB2 LEU 63 1HB LEU 63 14.435 17.601 -7.187
509 HB3 LEU 63 2HB LEU 63 13.140 18.093 -8.277
510 HG LEU 63 HG LEU 63 12.988 15.384 -7.056
511 HD11 LEU 63 1HD1 LEU 63 11.980 16.257 -5.035
512 HD12 LEU 63 2HD1 LEU 63 12.286 17.910 -5.567
513 HD13 LEU 63 3HD1 LEU 63 13.637 16.842 -5.188
514 HD21 LEU 63 1HD2 LEU 63 10.692 15.664 -7.324
515 HD22 LEU 63 2HD2 LEU 63 11.371 16.455 -8.747
516 HD23 LEU 63 3HD2 LEU 63 10.815 17.423 -7.381
517 H GLY 64 H GLY 64 15.485 18.780 -9.298
518 HA2 GLY 64 1HA GLY 64 16.153 19.795 -11.382
519 HA3 GLY 64 2HA GLY 64 14.816 18.963 -12.162
520 H ARG 65 H ARG 65 14.117 20.343 -9.112
521 HA ARG 65 HA ARG 65 12.805 22.623 -10.442
522 HB2 ARG 65 1HB ARG 65 11.845 21.199 -7.955
523 HB3 ARG 65 2HB ARG 65 11.008 22.471 -8.835
524 HG2 ARG 65 1HG ARG 65 9.901 20.613 -9.580
525 HG3 ARG 65 2HG ARG 65 11.142 20.784 -10.823
526 HD2 ARG 65 1HD ARG 65 12.495 19.094 -9.782
527 HD3 ARG 65 2HD ARG 65 11.405 19.014 -8.398
528 HE ARG 65 HE ARG 65 11.117 17.642 -10.863
529 HH11 ARG 65 1HH1 ARG 65 9.292 19.232 -8.361
530 HH12 ARG 65 2HH1 ARG 65 7.859 18.296 -8.632
531 HH21 ARG 65 1HH2 ARG 65 9.237 16.403 -11.228
532 HH22 ARG 65 2HH2 ARG 65 7.829 16.687 -10.262
533 H GLN 66 H GLN 66 11.988 24.033 -8.247
534 HA GLN 66 HA GLN 66 14.544 25.010 -7.223
535 HB2 GLN 66 1HB GLN 66 11.869 26.333 -6.842
536 HB3 GLN 66 2HB GLN 66 13.466 27.066 -6.788
537 HG2 GLN 66 1HG GLN 66 13.535 26.234 -9.295
538 HG3 GLN 66 2HG GLN 66 11.784 26.340 -9.119
539 HE21 GLN 66 2HE2 GLN 66 11.455 28.070 -10.427
540 HE22 GLN 66 1HE2 GLN 66 12.048 29.657 -10.092
541 H SER 67 H SER 67 11.288 24.255 -5.990
542 HA SER 67 HA SER 67 12.459 23.197 -3.553
543 HB2 SER 67 1HB SER 67 11.669 24.742 -2.068
544 HB3 SER 67 2HB SER 67 11.829 25.813 -3.460
545 HG SER 67 HG SER 67 9.703 25.586 -2.169
546 H PHE 68 H PHE 68 10.403 22.678 -2.013
547 HA PHE 68 HA PHE 68 8.001 21.926 -3.315
548 HB2 PHE 68 1HB PHE 68 8.322 19.447 -3.141
549 HB3 PHE 68 2HB PHE 68 9.314 20.213 -4.377
550 HD1 PHE 68 HD2 PHE 68 9.494 19.238 -0.781
551 HD2 PHE 68 HD1 PHE 68 11.531 19.636 -4.498
552 HE1 PHE 68 HE2 PHE 68 11.506 18.232 0.217
553 HE2 PHE 68 HE1 PHE 68 13.545 18.630 -3.505
554 HZ PHE 68 HZ PHE 68 13.535 17.928 -1.145
555 H SER 69 H SER 69 6.441 21.202 -1.876
556 HA SER 69 HA SER 69 7.030 21.707 0.904
557 HB2 SER 69 1HB SER 69 4.403 20.731 0.691
558 HB3 SER 69 2HB SER 69 4.906 22.417 0.810
559 HG SER 69 HG SER 69 3.581 21.681 -1.093
560 H VAL 70 H VAL 70 7.172 20.256 2.530
561 HA VAL 70 HA VAL 70 7.605 17.501 1.847
562 HB VAL 70 HB VAL 70 8.626 17.294 3.849
563 HG11 VAL 70 1HG1 VAL 70 8.460 20.218 4.318
564 HG12 VAL 70 2HG1 VAL 70 9.866 19.152 4.285
565 HG13 VAL 70 3HG1 VAL 70 9.118 19.676 2.775
566 HG21 VAL 70 1HG2 VAL 70 6.452 19.010 5.040
567 HG22 VAL 70 2HG2 VAL 70 6.612 17.258 5.162
568 HG23 VAL 70 3HG2 VAL 70 7.784 18.308 5.958
569 H LYS 71 H LYS 71 5.150 19.317 3.631
570 HA LYS 71 HA LYS 71 3.672 17.080 4.525
571 HB2 LYS 71 1HB LYS 71 3.567 19.795 4.946
572 HB3 LYS 71 2HB LYS 71 2.109 19.506 4.005
573 HG2 LYS 71 1HG LYS 71 1.468 17.751 5.636
574 HG3 LYS 71 2HG LYS 71 2.870 18.201 6.609
575 HD2 LYS 71 1HD LYS 71 0.723 20.154 5.803
576 HD3 LYS 71 2HD LYS 71 0.678 19.233 7.308
577 HE2 LYS 71 1HE LYS 71 2.407 20.402 8.235
578 HE3 LYS 71 2HE LYS 71 3.158 20.739 6.676
579 HZ1 LYS 71 1HZ LYS 71 2.277 22.754 6.832
580 HZ2 LYS 71 2HZ LYS 71 1.342 22.332 8.177
581 HZ3 LYS 71 3HZ LYS 71 0.751 22.057 6.616
582 H ASP 72 H ASP 72 4.130 18.289 1.439
583 HA ASP 72 HA ASP 72 1.655 17.002 0.487
584 HB2 ASP 72 1HB ASP 72 1.601 19.404 0.053
585 HB3 ASP 72 2HB ASP 72 3.163 19.311 -0.757
586 HA PRO 73 HA PRO 73 4.982 14.348 -1.127
587 HB2 PRO 73 1HB PRO 73 3.396 12.157 -1.362
588 HB3 PRO 73 2HB PRO 73 4.155 12.634 0.162
589 HG2 PRO 73 1HG PRO 73 1.354 13.098 -0.786
590 HG3 PRO 73 2HG PRO 73 1.924 12.594 0.816
591 HD2 PRO 73 1HD PRO 73 1.208 15.146 0.260
592 HD3 PRO 73 2HD PRO 73 2.479 14.744 1.433
593 H SER 74 H SER 74 4.113 16.175 -2.869
594 HA SER 74 HA SER 74 2.765 14.785 -5.063
595 HB2 SER 74 1HB SER 74 3.070 17.591 -4.244
596 HB3 SER 74 2HB SER 74 3.245 17.326 -5.978
597 HG SER 74 HG SER 74 1.052 16.579 -4.340
598 HA PRO 75 HA PRO 75 6.748 16.220 -7.323
599 HB2 PRO 75 1HB PRO 75 8.564 17.687 -5.938
600 HB3 PRO 75 2HB PRO 75 7.209 18.411 -6.810
601 HG2 PRO 75 1HG PRO 75 7.477 17.808 -3.890
602 HG3 PRO 75 2HG PRO 75 6.815 19.252 -4.678
603 HD2 PRO 75 1HD PRO 75 5.242 17.294 -3.666
604 HD3 PRO 75 2HD PRO 75 4.781 18.249 -5.090
605 H LEU 76 H LEU 76 7.048 15.368 -3.934
606 HA LEU 76 HA LEU 76 9.609 14.252 -3.949
607 HB2 LEU 76 1HB LEU 76 8.169 14.717 -1.951
608 HB3 LEU 76 2HB LEU 76 7.257 13.262 -2.348
609 HG LEU 76 HG LEU 76 9.606 12.111 -2.184
610 HD11 LEU 76 1HD1 LEU 76 11.189 13.665 -1.769
611 HD12 LEU 76 2HD1 LEU 76 10.668 13.427 -0.101
612 HD13 LEU 76 3HD1 LEU 76 10.049 14.791 -1.031
613 HD21 LEU 76 1HD2 LEU 76 7.418 12.270 -0.567
614 HD22 LEU 76 2HD2 LEU 76 8.703 12.811 0.513
615 HD23 LEU 76 3HD2 LEU 76 8.818 11.238 -0.276
616 H TYR 77 H TYR 77 6.506 12.497 -4.154
617 HA TYR 77 HA TYR 77 7.556 10.003 -4.771
618 HB2 TYR 77 1HB TYR 77 4.910 11.315 -5.233
619 HB3 TYR 77 2HB TYR 77 5.231 9.763 -5.999
620 HD1 TYR 77 HD2 TYR 77 5.934 7.819 -4.494
621 HD2 TYR 77 HD1 TYR 77 4.236 11.420 -2.993
622 HE1 TYR 77 HE2 TYR 77 5.336 6.661 -2.408
623 HE2 TYR 77 HE1 TYR 77 3.634 10.272 -0.903
624 HH TYR 77 HH TYR 77 3.204 7.955 -0.133
625 H ASP 78 H ASP 78 6.507 12.590 -6.963
626 HA ASP 78 HA ASP 78 6.841 11.319 -9.391
627 HB2 ASP 78 1HB ASP 78 6.187 13.846 -8.636
628 HB3 ASP 78 2HB ASP 78 7.791 14.113 -9.312
629 H MET 79 H MET 79 9.249 12.487 -7.176
630 HA MET 79 HA MET 79 11.409 12.354 -9.084
631 HB2 MET 79 1HB MET 79 11.706 13.973 -7.393
632 HB3 MET 79 2HB MET 79 11.262 12.845 -6.119
633 HG2 MET 79 1HG MET 79 13.524 11.805 -7.486
634 HG3 MET 79 2HG MET 79 13.835 13.493 -7.087
635 HE1 MET 79 1HE MET 79 11.778 13.106 -3.937
636 HE2 MET 79 2HE MET 79 13.328 13.722 -3.365
637 HE3 MET 79 3HE MET 79 12.646 14.318 -4.879
638 H LEU 80 H LEU 80 10.435 10.489 -6.211
639 HA LEU 80 HA LEU 80 12.418 8.567 -6.241
640 HB2 LEU 80 1HB LEU 80 9.543 8.483 -5.401
641 HB3 LEU 80 2HB LEU 80 10.569 7.057 -5.271
642 HG LEU 80 HG LEU 80 12.058 8.260 -3.751
643 HD11 LEU 80 1HD1 LEU 80 11.628 10.517 -4.701
644 HD12 LEU 80 2HD1 LEU 80 11.554 10.456 -2.940
645 HD13 LEU 80 3HD1 LEU 80 10.065 10.516 -3.884
646 HD21 LEU 80 1HD2 LEU 80 10.002 7.005 -2.971
647 HD22 LEU 80 2HD2 LEU 80 9.224 8.579 -2.792
648 HD23 LEU 80 3HD2 LEU 80 10.664 8.193 -1.848
649 H ARG 81 H ARG 81 9.506 8.786 -8.194
650 HA ARG 81 HA ARG 81 9.087 6.382 -9.263
651 HB2 ARG 81 1HB ARG 81 9.282 9.055 -10.608
652 HB3 ARG 81 2HB ARG 81 8.944 7.616 -11.562
653 HG2 ARG 81 1HG ARG 81 6.884 7.283 -10.577
654 HG3 ARG 81 2HG ARG 81 7.308 8.211 -9.137
655 HD2 ARG 81 1HD ARG 81 5.960 9.728 -10.176
656 HD3 ARG 81 2HD ARG 81 7.505 10.171 -10.901
657 HE ARG 81 HE ARG 81 6.749 9.391 -12.925
658 HH11 ARG 81 1HH1 ARG 81 4.599 8.345 -10.395
659 HH12 ARG 81 2HH1 ARG 81 3.390 7.756 -11.487
660 HH21 ARG 81 1HH2 ARG 81 5.165 8.619 -14.373
661 HH22 ARG 81 2HH2 ARG 81 3.713 7.911 -13.749
662 H LYS 82 H LYS 82 11.636 8.526 -10.547
663 HA LYS 82 HA LYS 82 12.975 6.142 -11.634
664 HB2 LYS 82 1HB LYS 82 13.724 7.385 -13.403
665 HB3 LYS 82 2HB LYS 82 12.246 8.269 -13.045
666 HG2 LYS 82 1HG LYS 82 15.018 9.014 -12.133
667 HG3 LYS 82 2HG LYS 82 14.103 9.784 -13.431
668 HD2 LYS 82 1HD LYS 82 13.279 9.680 -10.529
669 HD3 LYS 82 2HD LYS 82 14.006 11.071 -11.338
670 HE2 LYS 82 1HE LYS 82 11.796 10.209 -12.894
671 HE3 LYS 82 2HE LYS 82 11.268 10.308 -11.215
672 HZ1 LYS 82 1HZ LYS 82 11.695 12.400 -13.029
673 HZ2 LYS 82 2HZ LYS 82 12.814 12.567 -11.772
674 HZ3 LYS 82 3HZ LYS 82 11.160 12.494 -11.426
675 H ASN 83 H ASN 83 13.084 8.117 -9.025
676 HA ASN 83 HA ASN 83 15.987 8.314 -8.860
677 HB2 ASN 83 1HB ASN 83 15.063 10.264 -8.013
678 HB3 ASN 83 2HB ASN 83 13.699 9.424 -7.281
679 HD21 ASN 83 2HD2 ASN 83 14.098 8.174 -5.363
680 HD22 ASN 83 1HD2 ASN 83 15.375 8.632 -4.293
681 H LEU 84 H LEU 84 13.324 6.921 -6.945
682 HA LEU 84 HA LEU 84 15.187 5.343 -5.385
683 HB2 LEU 84 1HB LEU 84 13.572 5.528 -3.883
684 HB3 LEU 84 2HB LEU 84 12.525 6.292 -5.078
685 HG LEU 84 HG LEU 84 12.744 3.315 -4.634
686 HD11 LEU 84 1HD1 LEU 84 11.125 3.417 -3.098
687 HD12 LEU 84 2HD1 LEU 84 10.234 4.656 -3.980
688 HD13 LEU 84 3HD1 LEU 84 11.579 5.114 -2.935
689 HD21 LEU 84 1HD2 LEU 84 10.337 4.097 -5.890
690 HD22 LEU 84 2HD2 LEU 84 11.651 3.127 -6.554
691 HD23 LEU 84 3HD2 LEU 84 11.659 4.879 -6.756
692 H VAL 85 H VAL 85 15.340 3.104 -5.386
693 HA VAL 85 HA VAL 85 14.621 1.842 -7.906
694 HB VAL 85 HB VAL 85 16.617 1.358 -5.810
695 HG11 VAL 85 1HG1 VAL 85 15.305 -0.633 -5.435
696 HG12 VAL 85 2HG1 VAL 85 15.263 -0.971 -7.166
697 HG13 VAL 85 3HG1 VAL 85 16.789 -1.061 -6.285
698 HG21 VAL 85 1HG2 VAL 85 18.006 1.262 -7.572
699 HG22 VAL 85 2HG2 VAL 85 16.939 0.194 -8.484
700 HG23 VAL 85 3HG2 VAL 85 16.643 1.933 -8.468
701 H THR 86 H THR 86 13.532 -0.176 -8.036
702 HA THR 86 HA THR 86 12.143 -1.161 -5.685
703 HB THR 86 HB THR 86 9.967 -1.115 -7.209
704 HG1 THR 86 1HG THR 86 11.385 1.234 -7.991
705 HG21 THR 86 1HG2 THR 86 9.281 0.955 -6.042
706 HG22 THR 86 2HG2 THR 86 10.959 1.217 -5.566
707 HG23 THR 86 3HG2 THR 86 10.082 -0.192 -4.969
708 H LEU 87 H LEU 87 12.412 -3.285 -5.766
709 HA LEU 87 HA LEU 87 12.604 -4.604 -8.380
710 HB2 LEU 87 1HB LEU 87 13.292 -6.533 -6.638
711 HB3 LEU 87 2HB LEU 87 14.435 -5.396 -7.351
712 HG LEU 87 HG LEU 87 13.129 -4.951 -4.673
713 HD11 LEU 87 1HD1 LEU 87 15.707 -5.589 -4.117
714 HD12 LEU 87 2HD1 LEU 87 15.352 -6.707 -5.433
715 HD13 LEU 87 3HD1 LEU 87 14.347 -6.703 -3.984
716 HD21 LEU 87 1HD2 LEU 87 14.188 -3.003 -4.701
717 HD22 LEU 87 2HD2 LEU 87 14.668 -3.319 -6.368
718 HD23 LEU 87 3HD2 LEU 87 15.725 -3.800 -5.040
719 H ALA 88 H ALA 88 10.348 -4.656 -8.778
720 HA ALA 88 HA ALA 88 9.064 -6.994 -7.732
721 HB1 ALA 88 1HB ALA 88 8.344 -4.338 -6.687
722 HB2 ALA 88 2HB ALA 88 6.992 -5.357 -7.180
723 HB3 ALA 88 3HB ALA 88 8.138 -5.937 -5.972
724 H THR 89 H THR 89 6.582 -6.845 -8.545
725 HA THR 89 HA THR 89 6.810 -6.604 -11.408
726 HB THR 89 HB THR 89 4.140 -7.122 -10.263
727 HG1 THR 89 1HG THR 89 5.246 -9.422 -9.959
728 HG21 THR 89 1HG2 THR 89 5.443 -9.129 -11.951
729 HG22 THR 89 2HG2 THR 89 5.373 -7.522 -12.674
730 HG23 THR 89 3HG2 THR 89 3.890 -8.318 -12.149
731 H1 SER 115 H SER 115 2.944 14.993 17.739
732 HA SER 115 HA SER 115 5.142 15.508 19.021
733 HB2 SER 115 1HB SER 115 5.150 14.502 16.167
734 HB3 SER 115 2HB SER 115 6.525 14.380 17.264
735 HG SER 115 HG SER 115 5.155 13.155 18.666
736 H GLN 116 H GLN 116 4.820 17.986 18.932
737 HA GLN 116 HA GLN 116 6.027 19.382 16.747
738 HB2 GLN 116 1HB GLN 116 4.394 20.089 18.856
739 HB3 GLN 116 2HB GLN 116 5.933 20.820 19.291
740 HG2 GLN 116 1HG GLN 116 4.230 21.328 16.883
741 HG3 GLN 116 2HG GLN 116 4.802 22.471 18.097
742 HE21 GLN 116 2HE2 GLN 116 7.486 21.671 18.180
743 HE22 GLN 116 1HE2 GLN 116 8.231 22.112 16.685
744 H GLU 117 H GLU 117 8.122 19.594 16.358
745 HA GLU 117 HA GLU 117 10.028 20.155 18.397
746 HB2 GLU 117 1HB GLU 117 9.636 17.620 18.549
747 HB3 GLU 117 2HB GLU 117 10.469 17.523 17.004
748 HG2 GLU 117 1HG GLU 117 12.023 17.073 18.767
749 HG3 GLU 117 2HG GLU 117 12.426 18.621 18.026
750 H THR 118 H THR 118 9.683 18.776 15.136
751 HA THR 118 HA THR 118 10.823 20.957 13.808
752 HB THR 118 HB THR 118 12.870 20.015 15.052
753 HG1 THR 118 1HG THR 118 13.711 21.237 13.552
754 HG21 THR 118 1HG2 THR 118 12.058 17.651 13.879
755 HG22 THR 118 2HG2 THR 118 13.637 17.959 14.601
756 HG23 THR 118 3HG2 THR 118 13.405 18.167 12.866
757 H PHE 119 H PHE 119 12.270 19.354 11.819
758 HA PHE 119 HA PHE 119 10.444 18.918 9.903
759 HB2 PHE 119 1HB PHE 119 13.085 18.425 10.064
760 HB3 PHE 119 2HB PHE 119 12.485 16.770 10.071
761 HD1 PHE 119 HD1 PHE 119 9.984 17.917 8.332
762 HD2 PHE 119 HD2 PHE 119 14.218 17.758 7.927
763 HE1 PHE 119 HE1 PHE 119 9.749 17.992 5.884
764 HE2 PHE 119 HE2 PHE 119 13.990 17.834 5.478
765 HZ PHE 119 HZ PHE 119 11.753 17.951 4.454
766 H SER 120 H SER 120 11.287 16.595 12.435
767 HA SER 120 HA SER 120 9.897 14.375 11.611
768 HB2 SER 120 1HB SER 120 11.010 15.329 14.072
769 HB3 SER 120 2HB SER 120 9.435 14.608 14.403
770 HG SER 120 HG SER 120 11.783 13.427 13.587
771 H ASP 121 H ASP 121 8.640 17.200 13.337
772 HA ASP 121 HA ASP 121 6.070 16.368 13.874
773 HB2 ASP 121 1HB ASP 121 7.080 18.550 14.561
774 HB3 ASP 121 2HB ASP 121 6.835 19.133 12.917
775 H LEU 122 H LEU 122 6.957 18.326 11.024
776 HA LEU 122 HA LEU 122 4.513 17.666 9.681
777 HB2 LEU 122 1HB LEU 122 6.956 19.241 9.012
778 HB3 LEU 122 2HB LEU 122 5.852 18.774 7.720
779 HG LEU 122 HG LEU 122 4.405 20.388 8.241
780 HD11 LEU 122 1HD1 LEU 122 3.795 20.897 10.654
781 HD12 LEU 122 2HD1 LEU 122 4.811 19.523 11.089
782 HD13 LEU 122 3HD1 LEU 122 3.402 19.286 10.056
783 HD21 LEU 122 1HD2 LEU 122 5.337 22.330 9.103
784 HD22 LEU 122 2HD2 LEU 122 6.751 21.423 8.566
785 HD23 LEU 122 3HD2 LEU 122 6.322 21.457 10.277
786 H TRP 123 H TRP 123 7.938 17.006 8.931
787 HA TRP 123 HA TRP 123 7.852 15.475 6.755
788 HB2 TRP 123 1HB TRP 123 9.842 15.892 8.303
789 HB3 TRP 123 2HB TRP 123 9.322 14.459 9.185
790 HD1 TRP 123 HD1 TRP 123 10.696 12.426 8.500
791 HE1 TRP 123 HE1 TRP 123 11.766 11.556 6.326
792 HE3 TRP 123 HE3 TRP 123 9.344 16.222 5.353
793 HZ2 TRP 123 HZ2 TRP 123 12.006 12.372 3.635
794 HZ3 TRP 123 HZ3 TRP 123 10.034 16.101 2.995
795 HH2 TRP 123 HH2 TRP 123 11.338 14.215 2.155
796 H LYS 124 H LYS 124 7.306 14.074 9.993
797 HA LYS 124 HA LYS 124 6.687 11.507 9.358
798 HB2 LYS 124 1HB LYS 124 5.635 13.365 11.450
799 HB3 LYS 124 2HB LYS 124 4.893 11.780 11.274
800 HG2 LYS 124 1HG LYS 124 7.859 12.021 11.525
801 HG3 LYS 124 2HG LYS 124 6.832 12.116 12.958
802 HD2 LYS 124 1HD LYS 124 5.914 9.938 12.507
803 HD3 LYS 124 2HD LYS 124 6.762 9.855 10.961
804 HE2 LYS 124 1HE LYS 124 8.535 8.976 11.966
805 HE3 LYS 124 2HE LYS 124 8.667 10.394 13.005
806 HZ1 LYS 124 1HZ LYS 124 7.931 9.232 14.726
807 HZ2 LYS 124 2HZ LYS 124 8.034 7.833 13.781
808 HZ3 LYS 124 3HZ LYS 124 6.574 8.683 13.877
809 H LEU 125 H LEU 125 4.496 14.285 9.159
810 HA LEU 125 HA LEU 125 2.093 13.189 8.623
811 HB2 LEU 125 1HB LEU 125 2.836 15.640 8.528
812 HB3 LEU 125 2HB LEU 125 3.176 15.336 6.826
813 HG LEU 125 HG LEU 125 0.955 16.432 7.383
814 HD11 LEU 125 1HD1 LEU 125 -0.011 15.529 5.509
815 HD12 LEU 125 2HD1 LEU 125 0.487 13.885 5.907
816 HD13 LEU 125 3HD1 LEU 125 1.668 15.038 5.285
817 HD21 LEU 125 1HD2 LEU 125 0.653 14.620 9.277
818 HD22 LEU 125 2HD2 LEU 125 -0.084 13.705 7.962
819 HD23 LEU 125 3HD2 LEU 125 -0.732 15.283 8.410
820 H LEU 126 H LEU 126 4.747 13.487 6.289
821 HA LEU 126 HA LEU 126 3.690 12.704 3.952
822 HB2 LEU 126 1HB LEU 126 6.262 12.105 5.286
823 HB3 LEU 126 2HB LEU 126 5.865 11.143 3.864
824 HG LEU 126 HG LEU 126 5.397 13.680 2.969
825 HD11 LEU 126 1HD1 LEU 126 7.084 15.145 3.698
826 HD12 LEU 126 2HD1 LEU 126 7.922 13.873 4.586
827 HD13 LEU 126 3HD1 LEU 126 6.374 14.483 5.170
828 HD21 LEU 126 1HD2 LEU 126 8.061 13.205 2.362
829 HD22 LEU 126 2HD2 LEU 126 6.657 12.673 1.436
830 HD23 LEU 126 3HD2 LEU 126 7.383 11.601 2.635
831 HA PRO 127 HA PRO 127 1.664 8.832 4.578
832 HB2 PRO 127 1HB PRO 127 1.406 8.120 1.971
833 HB3 PRO 127 2HB PRO 127 0.413 9.371 2.728
834 HG2 PRO 127 1HG PRO 127 2.844 9.666 1.007
835 HG3 PRO 127 2HG PRO 127 1.331 10.589 0.972
836 HD2 PRO 127 1HD PRO 127 3.580 11.524 2.154
837 HD3 PRO 127 2HD PRO 127 1.954 11.920 2.747
838 H GLU 128 H GLU 128 4.661 9.170 2.840
839 HA GLU 128 HA GLU 128 6.443 7.782 2.565
840 HB2 GLU 128 1HB GLU 128 5.493 5.597 4.268
841 HB3 GLU 128 2HB GLU 128 6.976 6.535 4.362
842 HG2 GLU 128 1HG GLU 128 5.318 8.397 5.234
843 HG3 GLU 128 2HG GLU 128 4.355 6.987 5.671
844 H ASN 129 H ASN 129 3.902 5.373 3.205
845 HA ASN 129 HA ASN 129 3.288 3.515 2.023
846 HB2 ASN 129 1HB ASN 129 1.835 4.504 0.624
847 HB3 ASN 129 2HB ASN 129 2.906 5.877 0.366
848 HD21 ASN 129 2HD2 ASN 129 2.346 2.529 -0.592
849 HD22 ASN 129 1HD2 ASN 129 2.975 2.695 -2.193