NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
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|
14199 |
1wh3   |
10087 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 GLY 1 H GLY 1 -12.486 11.556 -11.005
2 HA2 GLY 1 1HA GLY 1 -11.233 10.771 -8.451
3 HA3 GLY 1 2HA GLY 1 -12.912 10.471 -8.874
4 H SER 2 H SER 2 -11.559 8.377 -7.944
5 HA SER 2 HA SER 2 -11.312 6.681 -10.311
6 HB2 SER 2 1HB SER 2 -9.206 7.012 -8.180
7 HB3 SER 2 2HB SER 2 -9.312 5.550 -9.161
8 HG SER 2 HG SER 2 -8.983 8.200 -10.126
9 H SER 3 H SER 3 -11.276 4.330 -9.694
10 HA SER 3 HA SER 3 -12.279 3.607 -7.101
11 HB2 SER 3 1HB SER 3 -14.250 4.536 -8.597
12 HB3 SER 3 2HB SER 3 -14.169 2.929 -9.319
13 HG SER 3 HG SER 3 -14.239 3.196 -6.524
14 H GLY 4 H GLY 4 -12.832 1.224 -7.032
15 HA2 GLY 4 1HA GLY 4 -12.105 -0.548 -9.081
16 HA3 GLY 4 2HA GLY 4 -10.688 -0.265 -8.081
17 H SER 5 H SER 5 -13.332 -2.212 -8.515
18 HA SER 5 HA SER 5 -14.331 -2.791 -6.018
19 HB2 SER 5 1HB SER 5 -14.841 -5.031 -6.880
20 HB3 SER 5 2HB SER 5 -15.176 -3.803 -8.101
21 HG SER 5 HG SER 5 -12.629 -4.911 -8.111
22 H SER 6 H SER 6 -11.263 -3.739 -7.425
23 HA SER 6 HA SER 6 -10.609 -5.291 -5.024
24 HB2 SER 6 1HB SER 6 -10.250 -6.217 -7.387
25 HB3 SER 6 2HB SER 6 -8.913 -5.073 -7.510
26 HG SER 6 HG SER 6 -8.426 -6.186 -5.290
27 H GLY 7 H GLY 7 -9.076 -4.667 -3.599
28 HA2 GLY 7 1HA GLY 7 -7.089 -3.507 -2.968
29 HA3 GLY 7 2HA GLY 7 -7.371 -2.375 -4.282
30 H ILE 8 H ILE 8 -6.760 -1.561 -1.681
31 HA ILE 8 HA ILE 8 -9.326 -0.487 -0.714
32 HB ILE 8 HB ILE 8 -8.290 -0.132 1.435
33 HG12 ILE 8 1HG1 ILE 8 -5.768 -1.466 0.500
34 HG13 ILE 8 2HG1 ILE 8 -5.978 0.269 0.296
35 HG21 ILE 8 1HG2 ILE 8 -7.733 -2.495 2.032
36 HG22 ILE 8 2HG2 ILE 8 -9.246 -2.298 1.148
37 HG23 ILE 8 3HG2 ILE 8 -7.808 -2.884 0.313
38 HD11 ILE 8 1HD1 ILE 8 -5.662 -1.326 2.783
39 HD12 ILE 8 2HD1 ILE 8 -4.894 0.188 2.303
40 HD13 ILE 8 3HD1 ILE 8 -6.574 0.183 2.841
41 H GLN 9 H GLN 9 -9.422 1.724 -0.070
42 HA GLN 9 HA GLN 9 -7.475 3.414 -1.490
43 HB2 GLN 9 1HB GLN 9 -9.897 3.445 -2.238
44 HB3 GLN 9 2HB GLN 9 -10.279 4.192 -0.693
45 HG2 GLN 9 1HG GLN 9 -8.714 6.031 -1.256
46 HG3 GLN 9 2HG GLN 9 -8.501 5.305 -2.848
47 HE21 GLN 9 1HE2 GLN 9 -9.684 6.190 -4.368
48 HE22 GLN 9 2HE2 GLN 9 -11.229 6.934 -4.162
49 H VAL 10 H VAL 10 -6.089 4.432 -0.217
50 HA VAL 10 HA VAL 10 -6.946 5.166 2.506
51 HB VAL 10 HB VAL 10 -4.612 5.109 3.173
52 HG11 VAL 10 1HG1 VAL 10 -4.206 2.583 2.403
53 HG12 VAL 10 2HG1 VAL 10 -5.401 3.030 3.622
54 HG13 VAL 10 3HG1 VAL 10 -5.904 2.742 1.956
55 HG21 VAL 10 1HG2 VAL 10 -3.898 4.060 0.450
56 HG22 VAL 10 2HG2 VAL 10 -3.793 5.774 0.851
57 HG23 VAL 10 3HG2 VAL 10 -2.821 4.600 1.738
58 H PHE 11 H PHE 11 -6.430 7.208 3.315
59 HA PHE 11 HA PHE 11 -5.923 9.220 1.243
60 HB2 PHE 11 1HB PHE 11 -7.064 9.545 4.026
61 HB3 PHE 11 2HB PHE 11 -6.893 10.828 2.833
62 HD1 PHE 11 1HD PHE 11 -8.276 10.809 0.791
63 HD2 PHE 11 2HD PHE 11 -8.861 8.000 3.935
64 HE1 PHE 11 1HE PHE 11 -10.502 10.271 -0.109
65 HE2 PHE 11 2HE PHE 11 -11.088 7.457 3.040
66 HZ PHE 11 HZ PHE 11 -11.911 8.593 1.015
67 H VAL 12 H VAL 12 -3.957 10.052 1.105
68 HA VAL 12 HA VAL 12 -2.140 9.849 3.387
69 HB VAL 12 HB VAL 12 -1.578 10.631 0.523
70 HG11 VAL 12 1HG1 VAL 12 0.699 9.752 2.050
71 HG12 VAL 12 2HG1 VAL 12 0.466 11.248 1.142
72 HG13 VAL 12 3HG1 VAL 12 -0.070 11.140 2.819
73 HG21 VAL 12 1HG2 VAL 12 -2.203 8.315 0.652
74 HG22 VAL 12 2HG2 VAL 12 -0.456 8.413 0.431
75 HG23 VAL 12 3HG2 VAL 12 -1.125 8.055 2.023
76 H LYS 13 H LYS 13 -2.502 11.507 4.760
77 HA LYS 13 HA LYS 13 -3.037 14.178 3.804
78 HB2 LYS 13 1HB LYS 13 -3.920 13.023 5.966
79 HB3 LYS 13 2HB LYS 13 -2.374 13.503 6.652
80 HG2 LYS 13 1HG LYS 13 -2.848 15.814 6.280
81 HG3 LYS 13 2HG LYS 13 -4.302 15.419 5.361
82 HD2 LYS 13 1HD LYS 13 -5.405 14.601 7.305
83 HD3 LYS 13 2HD LYS 13 -3.914 14.655 8.249
84 HE2 LYS 13 1HE LYS 13 -3.949 16.977 8.398
85 HE3 LYS 13 2HE LYS 13 -5.033 17.145 7.018
86 HZ1 LYS 13 1HZ LYS 13 -5.840 17.347 9.535
87 HZ2 LYS 13 2HZ LYS 13 -6.085 15.690 9.305
88 HZ3 LYS 13 3HZ LYS 13 -6.847 16.806 8.288
89 H ASN 14 H ASN 14 -1.428 15.354 2.997
90 HA ASN 14 HA ASN 14 1.312 14.919 3.703
91 HB2 ASN 14 1HB ASN 14 1.600 17.074 2.292
92 HB3 ASN 14 2HB ASN 14 1.033 15.614 1.488
93 HD21 ASN 14 1HD2 ASN 14 -0.007 16.686 -0.147
94 HD22 ASN 14 2HD2 ASN 14 -1.445 17.612 0.099
95 HA PRO 15 HA PRO 15 1.801 17.714 7.052
96 HB2 PRO 15 1HB PRO 15 4.331 18.603 6.630
97 HB3 PRO 15 2HB PRO 15 3.969 16.969 7.201
98 HG2 PRO 15 1HG PRO 15 4.620 17.909 4.434
99 HG3 PRO 15 2HG PRO 15 5.199 16.469 5.292
100 HD2 PRO 15 1HD PRO 15 3.217 16.368 3.449
101 HD3 PRO 15 2HD PRO 15 3.276 15.277 4.849
102 H ASP 16 H ASP 16 1.411 18.752 3.949
103 HA ASP 16 HA ASP 16 2.053 21.549 4.400
104 HB2 ASP 16 1HB ASP 16 2.364 20.330 2.179
105 HB3 ASP 16 2HB ASP 16 0.611 20.394 2.015
106 H GLY 17 H GLY 17 -0.882 19.723 3.494
107 HA2 GLY 17 1HA GLY 17 -2.670 20.537 5.313
108 HA3 GLY 17 2HA GLY 17 -2.550 21.964 4.295
109 H GLY 18 H GLY 18 -2.544 18.497 3.485
110 HA2 GLY 18 1HA GLY 18 -5.192 18.586 2.389
111 HA3 GLY 18 2HA GLY 18 -3.956 18.644 1.141
112 H SER 19 H SER 19 -5.532 16.583 0.898
113 HA SER 19 HA SER 19 -3.850 14.332 1.678
114 HB2 SER 19 1HB SER 19 -5.723 14.633 3.388
115 HB3 SER 19 2HB SER 19 -6.836 14.183 2.096
116 HG SER 19 HG SER 19 -4.644 12.522 2.516
117 H TYR 20 H TYR 20 -3.856 12.658 0.224
118 HA TYR 20 HA TYR 20 -5.604 12.966 -2.128
119 HB2 TYR 20 1HB TYR 20 -2.793 11.892 -2.273
120 HB3 TYR 20 2HB TYR 20 -3.823 12.435 -3.593
121 HD1 TYR 20 2HD TYR 20 -4.699 15.024 -3.027
122 HD2 TYR 20 1HD TYR 20 -0.982 13.265 -1.931
123 HE1 TYR 20 2HE TYR 20 -3.683 17.261 -2.903
124 HE2 TYR 20 1HE TYR 20 0.043 15.497 -1.803
125 HH TYR 20 HH TYR 20 -1.508 18.303 -3.002
126 H ALA 21 H ALA 21 -6.705 11.208 -2.733
127 HA ALA 21 HA ALA 21 -6.555 8.829 -1.134
128 HB1 ALA 21 1HB ALA 21 -8.357 8.034 -2.727
129 HB2 ALA 21 2HB ALA 21 -8.724 9.483 -1.790
130 HB3 ALA 21 3HB ALA 21 -8.254 9.624 -3.484
131 H TYR 22 H TYR 22 -5.055 7.328 -1.450
132 HA TYR 22 HA TYR 22 -3.998 6.901 -4.152
133 HB2 TYR 22 1HB TYR 22 -2.940 6.354 -1.400
134 HB3 TYR 22 2HB TYR 22 -2.305 5.461 -2.777
135 HD1 TYR 22 2HD TYR 22 -2.737 8.858 -1.369
136 HD2 TYR 22 1HD TYR 22 -0.749 6.450 -4.259
137 HE1 TYR 22 2HE TYR 22 -1.218 10.726 -1.871
138 HE2 TYR 22 1HE TYR 22 0.777 8.311 -4.768
139 HH TYR 22 HH TYR 22 1.380 10.387 -4.272
140 H ALA 23 H ALA 23 -3.711 4.751 -4.955
141 HA ALA 23 HA ALA 23 -5.636 2.827 -3.821
142 HB1 ALA 23 1HB ALA 23 -4.904 3.343 -6.697
143 HB2 ALA 23 2HB ALA 23 -5.848 1.953 -6.158
144 HB3 ALA 23 3HB ALA 23 -6.469 3.586 -5.921
145 H ILE 24 H ILE 24 -4.775 1.021 -3.053
146 HA ILE 24 HA ILE 24 -2.591 -0.298 -4.396
147 HB ILE 24 HB ILE 24 -1.289 1.226 -3.062
148 HG12 ILE 24 1HG1 ILE 24 -1.211 -1.347 -1.509
149 HG13 ILE 24 2HG1 ILE 24 -0.743 -1.306 -3.206
150 HG21 ILE 24 1HG2 ILE 24 -1.717 1.833 -0.929
151 HG22 ILE 24 2HG2 ILE 24 -3.345 1.295 -1.338
152 HG23 ILE 24 3HG2 ILE 24 -2.255 0.220 -0.463
153 HD11 ILE 24 1HD1 ILE 24 1.292 -0.938 -2.331
154 HD12 ILE 24 2HD1 ILE 24 0.729 0.733 -2.272
155 HD13 ILE 24 3HD1 ILE 24 0.647 -0.277 -0.829
156 H ASN 25 H ASN 25 -2.536 -2.464 -3.984
157 HA ASN 25 HA ASN 25 -4.803 -3.683 -2.858
158 HB2 ASN 25 1HB ASN 25 -2.152 -4.662 -3.837
159 HB3 ASN 25 2HB ASN 25 -3.183 -5.766 -2.933
160 HD21 ASN 25 1HD2 ASN 25 -4.043 -7.095 -4.363
161 HD22 ASN 25 2HD2 ASN 25 -4.838 -6.630 -5.825
162 HA PRO 26 HA PRO 26 -3.879 -3.789 1.443
163 HB2 PRO 26 1HB PRO 26 -5.396 -5.924 2.161
164 HB3 PRO 26 2HB PRO 26 -6.086 -4.349 1.751
165 HG2 PRO 26 1HG PRO 26 -5.835 -6.806 0.058
166 HG3 PRO 26 2HG PRO 26 -7.207 -5.694 0.220
167 HD2 PRO 26 1HD PRO 26 -5.487 -5.591 -1.868
168 HD3 PRO 26 2HD PRO 26 -6.283 -4.145 -1.215
169 H ASN 27 H ASN 27 -3.268 -6.497 -0.641
170 HA ASN 27 HA ASN 27 -1.806 -7.971 1.389
171 HB2 ASN 27 1HB ASN 27 -1.256 -9.367 -0.806
172 HB3 ASN 27 2HB ASN 27 -2.808 -9.513 0.015
173 HD21 ASN 27 1HD2 ASN 27 -1.149 -8.420 -2.796
174 HD22 ASN 27 2HD2 ASN 27 -2.546 -7.988 -3.716
175 H SER 28 H SER 28 -1.194 -5.667 -1.093
176 HA SER 28 HA SER 28 1.467 -6.242 -1.731
177 HB2 SER 28 1HB SER 28 -0.045 -4.570 -2.880
178 HB3 SER 28 2HB SER 28 0.285 -3.466 -1.545
179 HG SER 28 HG SER 28 2.140 -4.556 -3.391
180 H PHE 29 H PHE 29 3.290 -4.616 -1.155
181 HA PHE 29 HA PHE 29 3.529 -4.655 1.753
182 HB2 PHE 29 1HB PHE 29 5.642 -4.041 -0.323
183 HB3 PHE 29 2HB PHE 29 5.911 -4.340 1.391
184 HD1 PHE 29 2HD PHE 29 4.995 -6.658 2.253
185 HD2 PHE 29 1HD PHE 29 5.948 -5.770 -1.799
186 HE1 PHE 29 2HE PHE 29 5.260 -9.060 1.793
187 HE2 PHE 29 1HE PHE 29 6.214 -8.171 -2.266
188 HZ PHE 29 HZ PHE 29 5.871 -9.820 -0.468
189 H ILE 30 H ILE 30 4.099 -2.849 2.980
190 HA ILE 30 HA ILE 30 2.843 -0.472 2.488
191 HB ILE 30 HB ILE 30 5.275 -1.059 4.155
192 HG12 ILE 30 1HG1 ILE 30 3.005 -1.941 4.795
193 HG13 ILE 30 2HG1 ILE 30 3.756 -0.905 6.003
194 HG21 ILE 30 1HG2 ILE 30 4.172 1.546 3.391
195 HG22 ILE 30 2HG2 ILE 30 4.372 1.315 5.127
196 HG23 ILE 30 3HG2 ILE 30 5.754 1.131 4.048
197 HD11 ILE 30 1HD1 ILE 30 1.572 -0.170 5.971
198 HD12 ILE 30 2HD1 ILE 30 2.375 0.975 4.897
199 HD13 ILE 30 3HD1 ILE 30 1.427 -0.350 4.223
200 H LEU 31 H LEU 31 6.336 -1.046 2.029
201 HA LEU 31 HA LEU 31 7.177 1.314 1.029
202 HB2 LEU 31 1HB LEU 31 8.326 -1.052 1.216
203 HB3 LEU 31 2HB LEU 31 7.959 -1.115 -0.507
204 HG LEU 31 HG LEU 31 9.236 1.035 -0.756
205 HD11 LEU 31 1HD1 LEU 31 9.043 1.268 1.908
206 HD12 LEU 31 2HD1 LEU 31 10.311 2.038 0.955
207 HD13 LEU 31 3HD1 LEU 31 10.635 0.518 1.789
208 HD21 LEU 31 1HD2 LEU 31 11.051 -0.168 -1.280
209 HD22 LEU 31 2HD2 LEU 31 10.091 -1.554 -0.763
210 HD23 LEU 31 3HD2 LEU 31 11.226 -0.800 0.358
211 H GLY 32 H GLY 32 5.427 -1.167 -0.808
212 HA2 GLY 32 1HA GLY 32 5.515 -0.146 -3.347
213 HA3 GLY 32 2HA GLY 32 4.107 -0.961 -2.683
214 H LEU 33 H LEU 33 3.227 0.810 -0.797
215 HA LEU 33 HA LEU 33 1.803 2.674 -2.346
216 HB2 LEU 33 1HB LEU 33 0.796 1.944 -0.355
217 HB3 LEU 33 2HB LEU 33 2.219 2.340 0.607
218 HG LEU 33 HG LEU 33 1.733 4.752 0.214
219 HD11 LEU 33 1HD1 LEU 33 0.438 4.499 -1.846
220 HD12 LEU 33 2HD1 LEU 33 -0.460 5.390 -0.618
221 HD13 LEU 33 3HD1 LEU 33 -0.847 3.700 -0.939
222 HD21 LEU 33 1HD2 LEU 33 1.051 4.035 2.302
223 HD22 LEU 33 2HD2 LEU 33 -0.163 2.937 1.646
224 HD23 LEU 33 3HD2 LEU 33 -0.445 4.679 1.627
225 H LYS 34 H LYS 34 4.504 3.125 -0.077
226 HA LYS 34 HA LYS 34 4.771 5.857 -0.159
227 HB2 LYS 34 1HB LYS 34 6.688 3.606 0.203
228 HB3 LYS 34 2HB LYS 34 7.355 5.214 -0.049
229 HG2 LYS 34 1HG LYS 34 7.232 5.138 2.234
230 HG3 LYS 34 2HG LYS 34 5.683 5.886 1.842
231 HD2 LYS 34 1HD LYS 34 4.488 3.954 2.306
232 HD3 LYS 34 2HD LYS 34 5.894 2.911 2.083
233 HE2 LYS 34 1HE LYS 34 5.825 4.918 4.303
234 HE3 LYS 34 2HE LYS 34 5.008 3.366 4.479
235 HZ1 LYS 34 1HZ LYS 34 7.892 3.890 4.111
236 HZ2 LYS 34 2HZ LYS 34 7.227 2.369 3.788
237 HZ3 LYS 34 3HZ LYS 34 7.127 3.023 5.345
238 H GLN 35 H GLN 35 6.387 3.540 -2.337
239 HA GLN 35 HA GLN 35 7.778 5.190 -3.972
240 HB2 GLN 35 1HB GLN 35 7.520 2.668 -4.142
241 HB3 GLN 35 2HB GLN 35 6.061 2.969 -5.075
242 HG2 GLN 35 1HG GLN 35 7.857 2.552 -6.586
243 HG3 GLN 35 2HG GLN 35 7.422 4.257 -6.695
244 HE21 GLN 35 1HE2 GLN 35 9.063 5.600 -6.749
245 HE22 GLN 35 2HE2 GLN 35 10.631 5.328 -6.077
246 H GLN 36 H GLN 36 4.332 4.390 -4.390
247 HA GLN 36 HA GLN 36 3.806 5.915 -6.633
248 HB2 GLN 36 1HB GLN 36 2.089 5.177 -4.274
249 HB3 GLN 36 2HB GLN 36 1.451 6.107 -5.624
250 HG2 GLN 36 1HG GLN 36 2.286 4.217 -7.109
251 HG3 GLN 36 2HG GLN 36 2.483 3.293 -5.620
252 HE21 GLN 36 1HE2 GLN 36 0.771 2.285 -4.793
253 HE22 GLN 36 2HE2 GLN 36 -0.855 2.462 -5.349
254 H ILE 37 H ILE 37 4.098 6.916 -3.284
255 HA ILE 37 HA ILE 37 3.139 9.583 -3.755
256 HB ILE 37 HB ILE 37 4.684 8.483 -1.403
257 HG12 ILE 37 1HG1 ILE 37 1.738 9.072 -1.454
258 HG13 ILE 37 2HG1 ILE 37 2.347 7.525 -2.030
259 HG21 ILE 37 1HG2 ILE 37 3.089 11.029 -1.669
260 HG22 ILE 37 2HG2 ILE 37 3.870 10.444 -0.202
261 HG23 ILE 37 3HG2 ILE 37 4.847 10.915 -1.592
262 HD11 ILE 37 1HD1 ILE 37 3.594 7.613 0.323
263 HD12 ILE 37 2HD1 ILE 37 2.184 8.600 0.711
264 HD13 ILE 37 3HD1 ILE 37 1.971 6.953 0.117
265 H GLU 38 H GLU 38 6.181 7.952 -3.955
266 HA GLU 38 HA GLU 38 7.776 10.350 -3.835
267 HB2 GLU 38 1HB GLU 38 8.765 8.293 -3.058
268 HB3 GLU 38 2HB GLU 38 8.445 7.506 -4.597
269 HG2 GLU 38 1HG GLU 38 9.945 9.389 -5.571
270 HG3 GLU 38 2HG GLU 38 10.511 9.542 -3.909
271 H ASP 39 H ASP 39 6.239 8.417 -6.283
272 HA ASP 39 HA ASP 39 7.653 9.774 -8.438
273 HB2 ASP 39 1HB ASP 39 5.757 7.461 -8.281
274 HB3 ASP 39 2HB ASP 39 5.966 8.303 -9.814
275 H GLN 40 H GLN 40 4.701 9.986 -6.688
276 HA GLN 40 HA GLN 40 3.404 11.605 -8.734
277 HB2 GLN 40 1HB GLN 40 2.490 10.608 -6.036
278 HB3 GLN 40 2HB GLN 40 1.529 11.686 -7.041
279 HG2 GLN 40 1HG GLN 40 2.524 9.036 -8.034
280 HG3 GLN 40 2HG GLN 40 1.004 9.209 -7.158
281 HE21 GLN 40 1HE2 GLN 40 1.091 8.219 -9.724
282 HE22 GLN 40 2HE2 GLN 40 0.348 9.349 -10.799
283 H GLN 41 H GLN 41 4.545 11.927 -5.386
284 HA GLN 41 HA GLN 41 4.118 14.803 -5.469
285 HB2 GLN 41 1HB GLN 41 5.249 13.081 -3.257
286 HB3 GLN 41 2HB GLN 41 4.786 14.772 -3.119
287 HG2 GLN 41 1HG GLN 41 2.453 13.959 -3.854
288 HG3 GLN 41 2HG GLN 41 3.045 12.360 -3.408
289 HE21 GLN 41 1HE2 GLN 41 1.338 12.396 -1.826
290 HE22 GLN 41 2HE2 GLN 41 1.585 13.199 -0.317
291 H GLY 42 H GLY 42 6.698 12.490 -5.738
292 HA2 GLY 42 1HA GLY 42 8.780 12.952 -6.736
293 HA3 GLY 42 2HA GLY 42 8.528 14.662 -6.417
294 H LEU 43 H LEU 43 7.707 13.425 -3.593
295 HA LEU 43 HA LEU 43 10.205 14.083 -2.363
296 HB2 LEU 43 1HB LEU 43 7.713 14.296 -1.514
297 HB3 LEU 43 2HB LEU 43 8.042 12.690 -0.868
298 HG LEU 43 HG LEU 43 9.924 14.927 -0.257
299 HD11 LEU 43 1HD1 LEU 43 8.206 16.111 0.577
300 HD12 LEU 43 2HD1 LEU 43 8.304 14.955 1.904
301 HD13 LEU 43 3HD1 LEU 43 7.124 14.719 0.615
302 HD21 LEU 43 1HD2 LEU 43 10.222 12.432 0.322
303 HD22 LEU 43 2HD2 LEU 43 8.992 12.727 1.551
304 HD23 LEU 43 3HD2 LEU 43 10.506 13.632 1.583
305 HA PRO 44 HA PRO 44 12.063 10.084 -2.378
306 HB2 PRO 44 1HB PRO 44 13.859 10.475 -0.380
307 HB3 PRO 44 2HB PRO 44 14.046 11.177 -1.992
308 HG2 PRO 44 1HG PRO 44 13.012 12.442 0.517
309 HG3 PRO 44 2HG PRO 44 14.119 13.108 -0.697
310 HD2 PRO 44 1HD PRO 44 11.488 13.742 -0.621
311 HD3 PRO 44 2HD PRO 44 12.407 13.661 -2.138
312 H LYS 45 H LYS 45 11.692 8.166 -1.409
313 HA LYS 45 HA LYS 45 9.777 7.856 0.575
314 HB2 LYS 45 1HB LYS 45 11.982 5.956 -0.244
315 HB3 LYS 45 2HB LYS 45 10.596 5.512 0.744
316 HG2 LYS 45 1HG LYS 45 9.111 5.697 -1.022
317 HG3 LYS 45 2HG LYS 45 10.195 6.731 -1.955
318 HD2 LYS 45 1HD LYS 45 10.043 4.451 -2.879
319 HD3 LYS 45 2HD LYS 45 11.681 4.859 -2.363
320 HE2 LYS 45 1HE LYS 45 9.823 3.457 -0.487
321 HE3 LYS 45 2HE LYS 45 10.659 2.545 -1.743
322 HZ1 LYS 45 1HZ LYS 45 12.287 2.413 -0.238
323 HZ2 LYS 45 2HZ LYS 45 11.693 3.697 0.689
324 HZ3 LYS 45 3HZ LYS 45 12.648 4.008 -0.672
325 H LYS 46 H LYS 46 13.309 7.488 0.894
326 HA LYS 46 HA LYS 46 13.595 6.886 3.512
327 HB2 LYS 46 1HB LYS 46 15.745 7.879 3.462
328 HB3 LYS 46 2HB LYS 46 15.421 7.357 1.814
329 HG2 LYS 46 1HG LYS 46 14.573 9.791 1.491
330 HG3 LYS 46 2HG LYS 46 15.527 10.119 2.940
331 HD2 LYS 46 1HD LYS 46 16.916 10.550 1.048
332 HD3 LYS 46 2HD LYS 46 17.479 9.050 1.788
333 HE2 LYS 46 1HE LYS 46 16.553 7.733 0.088
334 HE3 LYS 46 2HE LYS 46 15.506 9.035 -0.473
335 HZ1 LYS 46 1HZ LYS 46 17.058 9.565 -1.938
336 HZ2 LYS 46 2HZ LYS 46 18.099 8.374 -1.338
337 HZ3 LYS 46 3HZ LYS 46 18.131 9.933 -0.682
338 H GLN 47 H GLN 47 12.539 9.948 2.205
339 HA GLN 47 HA GLN 47 12.665 11.275 4.780
340 HB2 GLN 47 1HB GLN 47 11.754 12.138 2.042
341 HB3 GLN 47 2HB GLN 47 11.524 13.147 3.464
342 HG2 GLN 47 1HG GLN 47 14.163 12.164 2.402
343 HG3 GLN 47 2HG GLN 47 13.512 13.793 2.229
344 HE21 GLN 47 1HE2 GLN 47 15.182 11.598 4.243
345 HE22 GLN 47 2HE2 GLN 47 15.436 12.661 5.581
346 H GLN 48 H GLN 48 10.059 10.636 2.426
347 HA GLN 48 HA GLN 48 7.918 11.296 4.052
348 HB2 GLN 48 1HB GLN 48 6.571 10.389 2.430
349 HB3 GLN 48 2HB GLN 48 8.065 10.570 1.520
350 HG2 GLN 48 1HG GLN 48 8.576 8.173 2.152
351 HG3 GLN 48 2HG GLN 48 6.906 8.070 2.706
352 HE21 GLN 48 1HE2 GLN 48 8.496 9.530 -0.112
353 HE22 GLN 48 2HE2 GLN 48 7.503 8.750 -1.290
354 H GLN 49 H GLN 49 7.237 10.489 5.913
355 HA GLN 49 HA GLN 49 7.573 7.610 6.415
356 HB2 GLN 49 1HB GLN 49 9.276 8.668 7.718
357 HB3 GLN 49 2HB GLN 49 8.156 9.893 8.299
358 HG2 GLN 49 1HG GLN 49 6.875 7.938 9.352
359 HG3 GLN 49 2HG GLN 49 8.345 7.008 9.068
360 HE21 GLN 49 1HE2 GLN 49 10.019 7.227 10.429
361 HE22 GLN 49 2HE2 GLN 49 10.062 8.317 11.769
362 H LEU 50 H LEU 50 5.591 6.783 6.453
363 HA LEU 50 HA LEU 50 3.353 8.380 7.421
364 HB2 LEU 50 1HB LEU 50 3.323 5.600 6.263
365 HB3 LEU 50 2HB LEU 50 1.940 6.665 6.504
366 HG LEU 50 HG LEU 50 4.184 7.390 4.644
367 HD11 LEU 50 1HD1 LEU 50 2.837 6.477 2.814
368 HD12 LEU 50 2HD1 LEU 50 1.704 5.807 3.987
369 HD13 LEU 50 3HD1 LEU 50 3.365 5.217 3.930
370 HD21 LEU 50 1HD2 LEU 50 1.740 8.330 3.723
371 HD22 LEU 50 2HD2 LEU 50 2.991 9.265 4.541
372 HD23 LEU 50 3HD2 LEU 50 1.670 8.555 5.471
373 H GLU 51 H GLU 51 2.444 8.136 9.360
374 HA GLU 51 HA GLU 51 3.175 5.760 10.943
375 HB2 GLU 51 1HB GLU 51 4.016 8.191 11.580
376 HB3 GLU 51 2HB GLU 51 2.409 8.314 12.281
377 HG2 GLU 51 1HG GLU 51 3.095 5.991 13.344
378 HG3 GLU 51 2HG GLU 51 4.714 6.642 13.097
379 H PHE 52 H PHE 52 1.584 4.694 12.029
380 HA PHE 52 HA PHE 52 -1.151 5.760 11.782
381 HB2 PHE 52 1HB PHE 52 -0.530 3.817 10.214
382 HB3 PHE 52 2HB PHE 52 -0.519 2.818 11.663
383 HD1 PHE 52 2HD PHE 52 -2.773 5.530 10.443
384 HD2 PHE 52 1HD PHE 52 -2.385 1.491 11.727
385 HE1 PHE 52 2HE PHE 52 -5.209 5.241 10.256
386 HE2 PHE 52 1HE PHE 52 -4.821 1.194 11.542
387 HZ PHE 52 HZ PHE 52 -6.236 3.071 10.807
388 H GLN 53 H GLN 53 -2.403 5.675 13.566
389 HA GLN 53 HA GLN 53 -2.763 5.693 15.835
390 HB2 GLN 53 1HB GLN 53 -2.062 2.790 15.368
391 HB3 GLN 53 2HB GLN 53 -2.911 3.410 16.778
392 HG2 GLN 53 1HG GLN 53 -4.723 4.195 15.308
393 HG3 GLN 53 2HG GLN 53 -3.883 3.484 13.931
394 HE21 GLN 53 1HE2 GLN 53 -3.708 1.219 13.796
395 HE22 GLN 53 2HE2 GLN 53 -4.791 0.184 14.656
396 H GLY 54 H GLY 54 0.050 6.196 14.981
397 HA2 GLY 54 1HA GLY 54 1.915 6.817 16.221
398 HA3 GLY 54 2HA GLY 54 1.219 6.009 17.618
399 H GLN 55 H GLN 55 1.901 4.667 14.412
400 HA GLN 55 HA GLN 55 4.075 3.072 15.548
401 HB2 GLN 55 1HB GLN 55 3.157 1.019 15.091
402 HB3 GLN 55 2HB GLN 55 1.703 1.915 15.512
403 HG2 GLN 55 1HG GLN 55 1.404 2.358 13.051
404 HG3 GLN 55 2HG GLN 55 2.694 1.189 12.773
405 HE21 GLN 55 1HE2 GLN 55 -0.007 1.001 11.877
406 HE22 GLN 55 2HE2 GLN 55 -0.693 -0.410 12.602
407 H VAL 56 H VAL 56 5.718 2.686 14.158
408 HA VAL 56 HA VAL 56 5.637 4.037 11.600
409 HB VAL 56 HB VAL 56 7.905 2.469 12.835
410 HG11 VAL 56 1HG1 VAL 56 7.579 4.022 10.353
411 HG12 VAL 56 2HG1 VAL 56 9.057 4.335 11.265
412 HG13 VAL 56 3HG1 VAL 56 8.680 2.697 10.730
413 HG21 VAL 56 1HG2 VAL 56 8.503 5.167 12.998
414 HG22 VAL 56 2HG2 VAL 56 6.805 5.078 13.470
415 HG23 VAL 56 3HG2 VAL 56 8.011 4.121 14.331
416 H LEU 57 H LEU 57 4.854 3.044 9.868
417 HA LEU 57 HA LEU 57 4.592 0.207 9.691
418 HB2 LEU 57 1HB LEU 57 4.328 2.158 7.421
419 HB3 LEU 57 2HB LEU 57 3.564 0.579 7.591
420 HG LEU 57 HG LEU 57 2.920 3.006 9.265
421 HD11 LEU 57 1HD1 LEU 57 0.711 2.231 7.743
422 HD12 LEU 57 2HD1 LEU 57 2.076 2.233 6.627
423 HD13 LEU 57 3HD1 LEU 57 1.690 3.685 7.549
424 HD21 LEU 57 1HD2 LEU 57 2.024 0.170 9.276
425 HD22 LEU 57 2HD2 LEU 57 0.837 1.427 9.627
426 HD23 LEU 57 3HD2 LEU 57 2.287 1.279 10.622
427 H GLN 58 H GLN 58 6.139 -1.172 9.158
428 HA GLN 58 HA GLN 58 8.649 -0.330 8.113
429 HB2 GLN 58 1HB GLN 58 7.509 -3.115 8.407
430 HB3 GLN 58 2HB GLN 58 9.193 -2.734 8.073
431 HG2 GLN 58 1HG GLN 58 7.631 -2.277 10.585
432 HG3 GLN 58 2HG GLN 58 9.123 -3.188 10.358
433 HE21 GLN 58 1HE2 GLN 58 10.836 -1.628 9.198
434 HE22 GLN 58 2HE2 GLN 58 11.098 -0.155 10.063
435 H ASP 59 H ASP 59 9.488 -2.027 6.256
436 HA ASP 59 HA ASP 59 7.832 -1.340 3.937
437 HB2 ASP 59 1HB ASP 59 10.615 -2.442 3.738
438 HB3 ASP 59 2HB ASP 59 9.765 -1.363 2.636
439 H TRP 60 H TRP 60 9.278 -4.055 5.616
440 HA TRP 60 HA TRP 60 8.375 -5.940 3.594
441 HB2 TRP 60 1HB TRP 60 9.651 -7.558 4.696
442 HB3 TRP 60 2HB TRP 60 10.577 -6.082 4.955
443 HD1 TRP 60 HD TRP 60 8.446 -8.647 6.818
444 HE1 TRP 60 1HE TRP 60 8.803 -8.336 9.348
445 HE3 TRP 60 3HE TRP 60 11.189 -4.334 6.727
446 HZ2 TRP 60 2HZ TRP 60 10.078 -6.505 11.076
447 HZ3 TRP 60 3HZ TRP 60 11.938 -3.367 8.862
448 HH2 TRP 60 HH TRP 60 11.392 -4.431 10.991
449 H LEU 61 H LEU 61 6.800 -4.285 5.839
450 HA LEU 61 HA LEU 61 5.179 -6.535 6.805
451 HB2 LEU 61 1HB LEU 61 5.731 -3.790 7.791
452 HB3 LEU 61 2HB LEU 61 4.145 -4.478 8.135
453 HG LEU 61 HG LEU 61 5.150 -6.300 9.356
454 HD11 LEU 61 1HD1 LEU 61 7.178 -6.487 7.936
455 HD12 LEU 61 2HD1 LEU 61 7.515 -6.531 9.666
456 HD13 LEU 61 3HD1 LEU 61 7.827 -5.060 8.745
457 HD21 LEU 61 1HD2 LEU 61 6.499 -4.845 11.057
458 HD22 LEU 61 2HD2 LEU 61 4.770 -4.578 10.833
459 HD23 LEU 61 3HD2 LEU 61 5.936 -3.507 10.054
460 H GLY 62 H GLY 62 3.625 -7.020 5.378
461 HA2 GLY 62 1HA GLY 62 2.511 -5.371 3.450
462 HA3 GLY 62 2HA GLY 62 1.717 -6.789 4.121
463 H LEU 63 H LEU 63 0.323 -4.516 3.280
464 HA LEU 63 HA LEU 63 -0.263 -2.675 5.310
465 HB2 LEU 63 1HB LEU 63 -1.681 -3.637 2.871
466 HB3 LEU 63 2HB LEU 63 -2.554 -2.632 4.026
467 HG LEU 63 HG LEU 63 -0.513 -1.024 3.726
468 HD11 LEU 63 1HD1 LEU 63 0.905 -1.378 2.043
469 HD12 LEU 63 2HD1 LEU 63 -0.386 -1.854 0.939
470 HD13 LEU 63 3HD1 LEU 63 0.308 -3.038 2.047
471 HD21 LEU 63 1HD2 LEU 63 -3.064 -1.082 2.784
472 HD22 LEU 63 2HD2 LEU 63 -2.139 -0.959 1.287
473 HD23 LEU 63 3HD2 LEU 63 -1.936 0.253 2.553
474 H GLY 64 H GLY 64 -1.139 -5.978 4.934
475 HA2 GLY 64 1HA GLY 64 -3.435 -5.818 6.701
476 HA3 GLY 64 2HA GLY 64 -2.772 -7.276 5.978
477 H ILE 65 H ILE 65 -0.125 -7.080 6.843
478 HA ILE 65 HA ILE 65 -0.018 -8.429 9.160
479 HB ILE 65 HB ILE 65 1.945 -6.265 8.390
480 HG12 ILE 65 1HG1 ILE 65 1.574 -7.937 6.616
481 HG13 ILE 65 2HG1 ILE 65 3.191 -8.065 7.300
482 HG21 ILE 65 1HG2 ILE 65 2.212 -6.963 10.709
483 HG22 ILE 65 2HG2 ILE 65 2.282 -8.651 10.203
484 HG23 ILE 65 3HG2 ILE 65 3.558 -7.533 9.723
485 HD11 ILE 65 1HD1 ILE 65 0.845 -9.846 7.913
486 HD12 ILE 65 2HD1 ILE 65 2.258 -10.256 6.940
487 HD13 ILE 65 3HD1 ILE 65 2.435 -9.958 8.669
488 H TYR 66 H TYR 66 -0.278 -4.918 8.885
489 HA TYR 66 HA TYR 66 -0.224 -4.556 11.755
490 HB2 TYR 66 1HB TYR 66 -0.465 -2.723 9.394
491 HB3 TYR 66 2HB TYR 66 -0.869 -2.140 11.005
492 HD1 TYR 66 2HD TYR 66 0.986 -2.710 12.840
493 HD2 TYR 66 1HD TYR 66 1.697 -2.413 8.655
494 HE1 TYR 66 2HE TYR 66 3.365 -2.268 13.281
495 HE2 TYR 66 1HE TYR 66 4.078 -1.972 9.085
496 HH TYR 66 HH TYR 66 5.459 -1.037 11.009
497 H GLY 67 H GLY 67 -2.605 -4.291 9.135
498 HA2 GLY 67 1HA GLY 67 -4.847 -5.185 9.644
499 HA3 GLY 67 2HA GLY 67 -4.719 -4.377 11.199
500 H ILE 68 H ILE 68 -3.685 -2.948 8.168
501 HA ILE 68 HA ILE 68 -5.325 -0.644 8.627
502 HB ILE 68 HB ILE 68 -3.633 -1.385 6.237
503 HG12 ILE 68 1HG1 ILE 68 -3.015 0.663 8.358
504 HG13 ILE 68 2HG1 ILE 68 -2.536 -1.021 8.533
505 HG21 ILE 68 1HG2 ILE 68 -3.811 0.955 5.592
506 HG22 ILE 68 2HG2 ILE 68 -5.404 0.202 5.658
507 HG23 ILE 68 3HG2 ILE 68 -4.876 1.265 6.963
508 HD11 ILE 68 1HD1 ILE 68 -1.115 -0.900 6.645
509 HD12 ILE 68 2HD1 ILE 68 -1.760 0.675 6.180
510 HD13 ILE 68 3HD1 ILE 68 -0.780 0.518 7.638
511 H GLN 69 H GLN 69 -7.184 -0.031 7.640
512 HA GLN 69 HA GLN 69 -8.359 -1.927 5.713
513 HB2 GLN 69 1HB GLN 69 -10.568 -1.325 6.631
514 HB3 GLN 69 2HB GLN 69 -9.524 -2.063 7.839
515 HG2 GLN 69 1HG GLN 69 -9.146 -0.011 8.920
516 HG3 GLN 69 2HG GLN 69 -9.804 0.911 7.568
517 HE21 GLN 69 1HE2 GLN 69 -11.982 1.197 7.396
518 HE22 GLN 69 2HE2 GLN 69 -13.107 0.712 8.614
519 H ASP 70 H ASP 70 -10.350 -0.756 4.605
520 HA ASP 70 HA ASP 70 -9.215 1.389 3.088
521 HB2 ASP 70 1HB ASP 70 -11.028 1.146 1.645
522 HB3 ASP 70 2HB ASP 70 -10.855 -0.474 2.314
523 H SER 71 H SER 71 -10.342 3.451 2.706
524 HA SER 71 HA SER 71 -11.185 5.439 3.423
525 HB2 SER 71 1HB SER 71 -12.899 3.450 4.827
526 HB3 SER 71 2HB SER 71 -12.967 5.119 5.392
527 HG SER 71 HG SER 71 -13.713 5.762 3.447
528 H ASP 72 H ASP 72 -8.835 4.165 4.704
529 HA ASP 72 HA ASP 72 -8.940 5.274 7.410
530 HB2 ASP 72 1HB ASP 72 -7.191 3.312 6.005
531 HB3 ASP 72 2HB ASP 72 -6.485 4.244 7.322
532 H THR 73 H THR 73 -7.163 6.622 8.171
533 HA THR 73 HA THR 73 -6.203 8.417 6.044
534 HB THR 73 HB THR 73 -6.692 9.004 8.970
535 HG1 THR 73 1HG THR 73 -8.514 9.924 8.295
536 HG21 THR 73 1HG2 THR 73 -6.364 11.421 7.832
537 HG22 THR 73 2HG2 THR 73 -5.247 10.473 6.850
538 HG23 THR 73 3HG2 THR 73 -5.053 10.527 8.602
539 H LEU 74 H LEU 74 -4.068 8.992 5.934
540 HA LEU 74 HA LEU 74 -2.246 7.722 7.867
541 HB2 LEU 74 1HB LEU 74 -1.892 7.949 4.883
542 HB3 LEU 74 2HB LEU 74 -0.661 7.371 6.003
543 HG LEU 74 HG LEU 74 -3.322 6.030 5.530
544 HD11 LEU 74 1HD1 LEU 74 -0.726 5.840 4.158
545 HD12 LEU 74 2HD1 LEU 74 -2.347 5.440 3.590
546 HD13 LEU 74 3HD1 LEU 74 -1.465 4.304 4.611
547 HD21 LEU 74 1HD2 LEU 74 -1.663 4.173 6.597
548 HD22 LEU 74 2HD2 LEU 74 -2.810 5.138 7.527
549 HD23 LEU 74 3HD2 LEU 74 -1.118 5.629 7.430
550 H ILE 75 H ILE 75 -0.862 9.070 8.809
551 HA ILE 75 HA ILE 75 -0.753 11.832 7.927
552 HB ILE 75 HB ILE 75 0.565 10.530 10.312
553 HG12 ILE 75 1HG1 ILE 75 -1.856 10.375 10.477
554 HG13 ILE 75 2HG1 ILE 75 -1.268 11.594 11.601
555 HG21 ILE 75 1HG2 ILE 75 1.733 12.527 9.781
556 HG22 ILE 75 2HG2 ILE 75 0.232 13.407 9.496
557 HG23 ILE 75 3HG2 ILE 75 0.664 12.905 11.131
558 HD11 ILE 75 1HD1 ILE 75 -2.536 12.110 8.923
559 HD12 ILE 75 2HD1 ILE 75 -3.281 12.348 10.504
560 HD13 ILE 75 3HD1 ILE 75 -1.912 13.345 10.015
561 H LEU 76 H LEU 76 0.932 12.810 6.964
562 HA LEU 76 HA LEU 76 3.322 11.171 6.440
563 HB2 LEU 76 1HB LEU 76 2.221 11.645 4.399
564 HB3 LEU 76 2HB LEU 76 1.988 13.336 4.838
565 HG LEU 76 HG LEU 76 4.457 13.649 4.667
566 HD11 LEU 76 1HD1 LEU 76 4.513 10.882 4.672
567 HD12 LEU 76 2HD1 LEU 76 5.864 11.961 4.325
568 HD13 LEU 76 3HD1 LEU 76 4.888 11.317 3.004
569 HD21 LEU 76 1HD2 LEU 76 3.020 14.310 2.841
570 HD22 LEU 76 2HD2 LEU 76 3.008 12.662 2.212
571 HD23 LEU 76 3HD2 LEU 76 4.502 13.601 2.199
572 H SER 77 H SER 77 5.227 11.842 7.188
573 HA SER 77 HA SER 77 5.629 14.672 7.805
574 HB2 SER 77 1HB SER 77 6.131 12.443 9.794
575 HB3 SER 77 2HB SER 77 6.563 14.137 10.024
576 HG SER 77 HG SER 77 3.916 13.567 9.372
577 H LYS 78 H LYS 78 7.501 15.329 6.998
578 HA LYS 78 HA LYS 78 9.379 13.467 5.902
579 HB2 LYS 78 1HB LYS 78 10.580 15.402 5.121
580 HB3 LYS 78 2HB LYS 78 8.860 15.677 4.874
581 HG2 LYS 78 1HG LYS 78 8.973 16.893 7.155
582 HG3 LYS 78 2HG LYS 78 10.711 16.943 6.849
583 HD2 LYS 78 1HD LYS 78 8.629 17.946 4.912
584 HD3 LYS 78 2HD LYS 78 9.459 18.971 6.086
585 HE2 LYS 78 1HE LYS 78 11.562 18.592 5.060
586 HE3 LYS 78 2HE LYS 78 10.922 17.281 4.071
587 HZ1 LYS 78 1HZ LYS 78 11.268 19.622 3.050
588 HZ2 LYS 78 2HZ LYS 78 9.794 19.983 3.797
589 HZ3 LYS 78 3HZ LYS 78 9.882 18.737 2.655
590 H LYS 79 H LYS 79 11.338 12.844 6.658
591 HA LYS 79 HA LYS 79 11.870 12.819 9.381
592 HB2 LYS 79 1HB LYS 79 13.931 12.606 7.182
593 HB3 LYS 79 2HB LYS 79 14.062 11.965 8.815
594 HG2 LYS 79 1HG LYS 79 11.785 11.058 7.140
595 HG3 LYS 79 2HG LYS 79 13.397 10.442 6.768
596 HD2 LYS 79 1HD LYS 79 13.613 9.767 9.159
597 HD3 LYS 79 2HD LYS 79 11.929 10.240 9.396
598 HE2 LYS 79 1HE LYS 79 11.632 8.022 8.965
599 HE3 LYS 79 2HE LYS 79 11.573 8.641 7.316
600 HZ1 LYS 79 1HZ LYS 79 13.882 8.062 7.028
601 HZ2 LYS 79 2HZ LYS 79 13.019 6.698 7.531
602 HZ3 LYS 79 3HZ LYS 79 13.994 7.533 8.631
603 H LYS 80 H LYS 80 12.178 14.548 10.623
604 HA LYS 80 HA LYS 80 13.157 17.034 9.706
605 HB2 LYS 80 1HB LYS 80 12.563 15.845 12.382
606 HB3 LYS 80 2HB LYS 80 13.489 17.338 12.311
607 HG2 LYS 80 1HG LYS 80 10.793 16.954 11.028
608 HG3 LYS 80 2HG LYS 80 11.051 17.668 12.622
609 HD2 LYS 80 1HD LYS 80 12.466 19.404 11.573
610 HD3 LYS 80 2HD LYS 80 12.097 18.713 9.991
611 HE2 LYS 80 1HE LYS 80 9.692 19.123 10.429
612 HE3 LYS 80 2HE LYS 80 10.134 19.914 11.941
613 HZ1 LYS 80 1HZ LYS 80 10.177 21.752 10.696
614 HZ2 LYS 80 2HZ LYS 80 10.279 20.903 9.237
615 HZ3 LYS 80 3HZ LYS 80 11.677 21.196 10.145
616 H GLY 81 H GLY 81 15.148 16.804 8.713
617 HA2 GLY 81 1HA GLY 81 17.455 17.328 9.929
618 HA3 GLY 81 2HA GLY 81 17.345 15.595 10.198
619 H SER 82 H SER 82 19.492 16.436 8.865
620 HA SER 82 HA SER 82 19.170 15.179 6.301
621 HB2 SER 82 1HB SER 82 20.094 17.102 5.005
622 HB3 SER 82 2HB SER 82 18.489 17.417 5.664
623 HG SER 82 HG SER 82 20.913 18.594 6.259
624 H GLY 83 H GLY 83 20.947 14.034 5.884
625 HA2 GLY 83 1HA GLY 83 23.287 14.424 7.562
626 HA3 GLY 83 2HA GLY 83 22.999 13.080 6.467
627 HA PRO 84 HA PRO 84 25.834 16.508 4.664
628 HB2 PRO 84 1HB PRO 84 28.271 15.511 5.324
629 HB3 PRO 84 2HB PRO 84 27.397 16.663 6.340
630 HG2 PRO 84 1HG PRO 84 27.606 13.688 6.600
631 HG3 PRO 84 2HG PRO 84 27.701 14.931 7.861
632 HD2 PRO 84 1HD PRO 84 25.457 13.485 7.406
633 HD3 PRO 84 2HD PRO 84 25.411 15.165 7.979
634 H SER 85 H SER 85 25.330 13.178 4.553
635 HA SER 85 HA SER 85 26.921 12.893 2.093
636 HB2 SER 85 1HB SER 85 26.000 10.921 4.162
637 HB3 SER 85 2HB SER 85 26.379 10.376 2.528
638 HG SER 85 HG SER 85 28.409 10.531 3.010
639 H SER 86 H SER 86 25.634 13.532 0.457
640 HA SER 86 HA SER 86 22.936 12.358 0.301
641 HB2 SER 86 1HB SER 86 23.976 14.901 -0.974
642 HB3 SER 86 2HB SER 86 22.345 14.257 -1.162
643 HG SER 86 HG SER 86 22.404 15.840 0.462
644 H GLY 87 H GLY 87 22.714 10.795 -1.146
645 HA2 GLY 87 1HA GLY 87 24.552 10.763 -3.458
646 HA3 GLY 87 2HA GLY 87 23.886 9.321 -2.707
Start of MODEL 2
1 H1 GLY 1 H GLY 1 0.878 -12.311 -11.385
2 HA2 GLY 1 1HA GLY 1 -0.628 -10.237 -10.271
3 HA3 GLY 1 2HA GLY 1 -1.122 -10.401 -11.949
4 H SER 2 H SER 2 -3.213 -10.893 -10.870
5 HA SER 2 HA SER 2 -3.564 -13.755 -10.752
6 HB2 SER 2 1HB SER 2 -4.656 -13.761 -8.544
7 HB3 SER 2 2HB SER 2 -2.969 -13.264 -8.420
8 HG SER 2 HG SER 2 -3.905 -11.699 -7.315
9 H SER 3 H SER 3 -5.884 -14.348 -10.583
10 HA SER 3 HA SER 3 -7.470 -12.449 -12.118
11 HB2 SER 3 1HB SER 3 -8.980 -14.323 -12.521
12 HB3 SER 3 2HB SER 3 -7.319 -14.814 -12.851
13 HG SER 3 HG SER 3 -8.886 -15.409 -10.567
14 H GLY 4 H GLY 4 -8.790 -11.082 -11.128
15 HA2 GLY 4 1HA GLY 4 -10.498 -10.359 -9.742
16 HA3 GLY 4 2HA GLY 4 -10.580 -11.976 -9.059
17 H SER 5 H SER 5 -9.478 -8.781 -8.631
18 HA SER 5 HA SER 5 -8.809 -9.240 -5.908
19 HB2 SER 5 1HB SER 5 -6.602 -9.066 -7.910
20 HB3 SER 5 2HB SER 5 -6.382 -8.253 -6.361
21 HG SER 5 HG SER 5 -6.038 -10.797 -6.875
22 H SER 6 H SER 6 -9.572 -7.485 -4.956
23 HA SER 6 HA SER 6 -9.447 -4.923 -6.396
24 HB2 SER 6 1HB SER 6 -11.381 -4.230 -5.212
25 HB3 SER 6 2HB SER 6 -11.701 -5.898 -5.684
26 HG SER 6 HG SER 6 -12.208 -5.420 -3.465
27 H GLY 7 H GLY 7 -8.462 -3.173 -5.515
28 HA2 GLY 7 1HA GLY 7 -6.830 -3.661 -3.144
29 HA3 GLY 7 2HA GLY 7 -6.655 -2.324 -4.270
30 H ILE 8 H ILE 8 -6.451 -1.534 -1.814
31 HA ILE 8 HA ILE 8 -9.115 -0.598 -0.977
32 HB ILE 8 HB ILE 8 -8.181 -0.219 1.239
33 HG12 ILE 8 1HG1 ILE 8 -5.642 -1.588 0.404
34 HG13 ILE 8 2HG1 ILE 8 -5.812 0.154 0.219
35 HG21 ILE 8 1HG2 ILE 8 -9.082 -2.472 0.500
36 HG22 ILE 8 2HG2 ILE 8 -7.402 -2.995 0.394
37 HG23 ILE 8 3HG2 ILE 8 -8.065 -2.466 1.940
38 HD11 ILE 8 1HD1 ILE 8 -6.455 -1.043 2.856
39 HD12 ILE 8 2HD1 ILE 8 -4.762 -0.908 2.378
40 HD13 ILE 8 3HD1 ILE 8 -5.772 0.534 2.461
41 H GLN 9 H GLN 9 -9.345 1.588 -0.286
42 HA GLN 9 HA GLN 9 -7.458 3.396 -1.625
43 HB2 GLN 9 1HB GLN 9 -9.857 3.451 -2.320
44 HB3 GLN 9 2HB GLN 9 -10.273 3.979 -0.695
45 HG2 GLN 9 1HG GLN 9 -8.935 5.992 -0.996
46 HG3 GLN 9 2HG GLN 9 -8.495 5.461 -2.618
47 HE21 GLN 9 1HE2 GLN 9 -10.543 4.827 -3.940
48 HE22 GLN 9 2HE2 GLN 9 -11.807 6.004 -3.918
49 H VAL 10 H VAL 10 -6.058 4.435 -0.385
50 HA VAL 10 HA VAL 10 -6.758 4.929 2.433
51 HB VAL 10 HB VAL 10 -4.318 5.149 2.824
52 HG11 VAL 10 1HG1 VAL 10 -4.188 2.524 1.721
53 HG12 VAL 10 2HG1 VAL 10 -4.421 3.008 3.402
54 HG13 VAL 10 3HG1 VAL 10 -5.815 2.801 2.341
55 HG21 VAL 10 1HG2 VAL 10 -3.960 4.047 0.047
56 HG22 VAL 10 2HG2 VAL 10 -3.817 5.763 0.425
57 HG23 VAL 10 3HG2 VAL 10 -2.715 4.603 1.166
58 H PHE 11 H PHE 11 -6.253 6.943 3.375
59 HA PHE 11 HA PHE 11 -6.073 9.136 1.422
60 HB2 PHE 11 1HB PHE 11 -7.393 8.920 4.116
61 HB3 PHE 11 2HB PHE 11 -7.009 10.490 3.419
62 HD1 PHE 11 1HD PHE 11 -8.045 11.157 1.255
63 HD2 PHE 11 2HD PHE 11 -9.251 7.671 3.380
64 HE1 PHE 11 1HE PHE 11 -10.136 11.095 -0.040
65 HE2 PHE 11 2HE PHE 11 -11.343 7.603 2.088
66 HZ PHE 11 HZ PHE 11 -11.788 9.316 0.374
67 H VAL 12 H VAL 12 -4.000 9.738 1.254
68 HA VAL 12 HA VAL 12 -2.281 9.783 3.604
69 HB VAL 12 HB VAL 12 -1.632 10.447 0.728
70 HG11 VAL 12 1HG1 VAL 12 -0.068 10.493 3.238
71 HG12 VAL 12 2HG1 VAL 12 0.727 9.815 1.816
72 HG13 VAL 12 3HG1 VAL 12 0.102 11.464 1.776
73 HG21 VAL 12 1HG2 VAL 12 -1.487 7.917 2.321
74 HG22 VAL 12 2HG2 VAL 12 -2.111 8.175 0.692
75 HG23 VAL 12 3HG2 VAL 12 -0.372 8.199 0.984
76 H LYS 13 H LYS 13 -2.627 11.508 4.875
77 HA LYS 13 HA LYS 13 -3.273 14.098 3.775
78 HB2 LYS 13 1HB LYS 13 -4.252 13.252 5.909
79 HB3 LYS 13 2HB LYS 13 -2.653 13.344 6.637
80 HG2 LYS 13 1HG LYS 13 -2.616 15.696 6.501
81 HG3 LYS 13 2HG LYS 13 -4.005 15.730 5.413
82 HD2 LYS 13 1HD LYS 13 -5.503 15.171 7.129
83 HD3 LYS 13 2HD LYS 13 -4.211 14.606 8.191
84 HE2 LYS 13 1HE LYS 13 -4.638 16.642 9.137
85 HE3 LYS 13 2HE LYS 13 -3.403 17.105 7.968
86 HZ1 LYS 13 1HZ LYS 13 -6.325 17.289 7.476
87 HZ2 LYS 13 2HZ LYS 13 -5.091 17.859 6.469
88 HZ3 LYS 13 3HZ LYS 13 -5.357 18.585 7.973
89 H ASN 14 H ASN 14 -1.754 15.367 2.950
90 HA ASN 14 HA ASN 14 1.024 15.035 3.579
91 HB2 ASN 14 1HB ASN 14 1.423 16.768 1.954
92 HB3 ASN 14 2HB ASN 14 0.172 15.701 1.321
93 HD21 ASN 14 1HD2 ASN 14 0.220 17.948 0.082
94 HD22 ASN 14 2HD2 ASN 14 -1.011 19.044 0.600
95 HA PRO 15 HA PRO 15 1.464 17.898 6.880
96 HB2 PRO 15 1HB PRO 15 3.987 18.795 6.436
97 HB3 PRO 15 2HB PRO 15 3.638 17.174 7.048
98 HG2 PRO 15 1HG PRO 15 4.282 18.047 4.258
99 HG3 PRO 15 2HG PRO 15 4.872 16.634 5.152
100 HD2 PRO 15 1HD PRO 15 2.891 16.471 3.313
101 HD3 PRO 15 2HD PRO 15 2.959 15.417 4.740
102 H ASP 16 H ASP 16 1.414 18.878 3.642
103 HA ASP 16 HA ASP 16 1.899 21.680 4.089
104 HB2 ASP 16 1HB ASP 16 2.461 20.862 1.925
105 HB3 ASP 16 2HB ASP 16 0.881 20.111 1.722
106 H GLY 17 H GLY 17 -0.954 19.660 3.439
107 HA2 GLY 17 1HA GLY 17 -2.819 20.545 5.046
108 HA3 GLY 17 2HA GLY 17 -2.685 21.958 4.009
109 H GLY 18 H GLY 18 -3.008 18.417 3.676
110 HA2 GLY 18 1HA GLY 18 -5.477 18.499 2.357
111 HA3 GLY 18 2HA GLY 18 -4.216 18.505 1.133
112 H SER 19 H SER 19 -5.773 16.444 0.908
113 HA SER 19 HA SER 19 -4.118 14.216 1.779
114 HB2 SER 19 1HB SER 19 -6.075 12.925 2.593
115 HB3 SER 19 2HB SER 19 -5.765 14.359 3.572
116 HG SER 19 HG SER 19 -7.858 13.828 1.791
117 H TYR 20 H TYR 20 -3.853 12.814 0.169
118 HA TYR 20 HA TYR 20 -5.729 12.941 -2.097
119 HB2 TYR 20 1HB TYR 20 -2.955 11.805 -2.286
120 HB3 TYR 20 2HB TYR 20 -3.965 12.476 -3.562
121 HD1 TYR 20 1HD TYR 20 -1.701 13.269 -0.787
122 HD2 TYR 20 2HD TYR 20 -4.068 14.863 -3.943
123 HE1 TYR 20 1HE TYR 20 -0.558 15.434 -0.543
124 HE2 TYR 20 2HE TYR 20 -2.931 17.032 -3.708
125 HH TYR 20 HH TYR 20 -1.055 18.040 -2.817
126 H ALA 21 H ALA 21 -6.616 11.094 -2.919
127 HA ALA 21 HA ALA 21 -6.527 8.757 -1.200
128 HB1 ALA 21 1HB ALA 21 -8.141 8.690 -3.670
129 HB2 ALA 21 2HB ALA 21 -8.563 8.224 -2.021
130 HB3 ALA 21 3HB ALA 21 -8.573 9.925 -2.487
131 H TYR 22 H TYR 22 -4.967 7.312 -1.513
132 HA TYR 22 HA TYR 22 -3.914 6.885 -4.211
133 HB2 TYR 22 1HB TYR 22 -2.885 6.263 -1.457
134 HB3 TYR 22 2HB TYR 22 -2.209 5.462 -2.871
135 HD1 TYR 22 2HD TYR 22 -2.743 8.762 -1.281
136 HD2 TYR 22 1HD TYR 22 -0.667 6.574 -4.281
137 HE1 TYR 22 2HE TYR 22 -1.267 10.693 -1.659
138 HE2 TYR 22 1HE TYR 22 0.816 8.498 -4.668
139 HH TYR 22 HH TYR 22 0.415 11.521 -2.842
140 H ALA 23 H ALA 23 -3.633 4.753 -5.047
141 HA ALA 23 HA ALA 23 -5.574 2.819 -3.961
142 HB1 ALA 23 1HB ALA 23 -5.025 2.149 -6.632
143 HB2 ALA 23 2HB ALA 23 -6.515 2.825 -5.970
144 HB3 ALA 23 3HB ALA 23 -5.262 3.897 -6.597
145 H ILE 24 H ILE 24 -4.722 1.034 -3.138
146 HA ILE 24 HA ILE 24 -2.520 -0.310 -4.426
147 HB ILE 24 HB ILE 24 -1.192 1.175 -3.117
148 HG12 ILE 24 1HG1 ILE 24 -1.274 -1.266 -1.371
149 HG13 ILE 24 2HG1 ILE 24 -0.789 -1.402 -3.057
150 HG21 ILE 24 1HG2 ILE 24 -3.381 1.112 -1.340
151 HG22 ILE 24 2HG2 ILE 24 -1.971 0.552 -0.442
152 HG23 ILE 24 3HG2 ILE 24 -1.936 2.119 -1.251
153 HD11 ILE 24 1HD1 ILE 24 0.617 -0.180 -0.768
154 HD12 ILE 24 2HD1 ILE 24 1.249 -1.086 -2.143
155 HD13 ILE 24 3HD1 ILE 24 0.798 0.608 -2.335
156 H ASN 25 H ASN 25 -2.498 -2.470 -4.004
157 HA ASN 25 HA ASN 25 -4.789 -3.612 -2.773
158 HB2 ASN 25 1HB ASN 25 -2.280 -4.705 -3.997
159 HB3 ASN 25 2HB ASN 25 -3.341 -5.775 -3.086
160 HD21 ASN 25 1HD2 ASN 25 -3.371 -3.396 -5.702
161 HD22 ASN 25 2HD2 ASN 25 -4.603 -4.174 -6.630
162 HA PRO 26 HA PRO 26 -3.483 -3.962 1.413
163 HB2 PRO 26 1HB PRO 26 -4.982 -6.094 2.174
164 HB3 PRO 26 2HB PRO 26 -5.666 -4.488 1.897
165 HG2 PRO 26 1HG PRO 26 -5.632 -6.870 0.085
166 HG3 PRO 26 2HG PRO 26 -6.955 -5.738 0.419
167 HD2 PRO 26 1HD PRO 26 -5.429 -5.577 -1.812
168 HD3 PRO 26 2HD PRO 26 -6.126 -4.146 -1.027
169 H ASN 27 H ASN 27 -3.176 -6.624 -0.809
170 HA ASN 27 HA ASN 27 -1.671 -8.305 0.966
171 HB2 ASN 27 1HB ASN 27 -2.157 -8.390 -2.014
172 HB3 ASN 27 2HB ASN 27 -1.187 -9.589 -1.164
173 HD21 ASN 27 1HD2 ASN 27 -2.202 -10.945 0.364
174 HD22 ASN 27 2HD2 ASN 27 -3.904 -11.233 0.306
175 H SER 28 H SER 28 -0.950 -5.877 -1.449
176 HA SER 28 HA SER 28 1.792 -6.436 -1.781
177 HB2 SER 28 1HB SER 28 0.263 -4.893 -3.178
178 HB3 SER 28 2HB SER 28 0.632 -3.663 -1.970
179 HG SER 28 HG SER 28 2.075 -3.616 -3.762
180 H PHE 29 H PHE 29 3.626 -5.356 -0.925
181 HA PHE 29 HA PHE 29 3.594 -5.041 1.870
182 HB2 PHE 29 1HB PHE 29 5.700 -4.048 -0.061
183 HB3 PHE 29 2HB PHE 29 5.918 -4.369 1.657
184 HD1 PHE 29 2HD PHE 29 5.303 -6.829 2.392
185 HD2 PHE 29 1HD PHE 29 6.348 -5.654 -1.564
186 HE1 PHE 29 2HE PHE 29 5.947 -9.147 1.877
187 HE2 PHE 29 1HE PHE 29 6.993 -7.971 -2.085
188 HZ PHE 29 HZ PHE 29 6.794 -9.720 -0.363
189 H ILE 30 H ILE 30 4.573 -3.017 2.931
190 HA ILE 30 HA ILE 30 2.752 -0.877 2.565
191 HB ILE 30 HB ILE 30 5.281 -1.083 4.195
192 HG12 ILE 30 1HG1 ILE 30 3.359 -2.494 4.883
193 HG13 ILE 30 2HG1 ILE 30 3.760 -1.269 6.082
194 HG21 ILE 30 1HG2 ILE 30 3.824 0.988 5.263
195 HG22 ILE 30 2HG2 ILE 30 5.268 1.148 4.265
196 HG23 ILE 30 3HG2 ILE 30 3.670 1.248 3.525
197 HD11 ILE 30 1HD1 ILE 30 1.376 -1.437 5.852
198 HD12 ILE 30 2HD1 ILE 30 1.916 0.120 5.223
199 HD13 ILE 30 3HD1 ILE 30 1.490 -1.181 4.111
200 H LEU 31 H LEU 31 6.213 -1.228 1.844
201 HA LEU 31 HA LEU 31 6.907 1.252 1.002
202 HB2 LEU 31 1HB LEU 31 8.441 -0.626 0.989
203 HB3 LEU 31 2HB LEU 31 7.568 -1.356 -0.357
204 HG LEU 31 HG LEU 31 8.220 0.870 -1.584
205 HD11 LEU 31 1HD1 LEU 31 9.172 1.952 0.391
206 HD12 LEU 31 2HD1 LEU 31 10.381 1.736 -0.874
207 HD13 LEU 31 3HD1 LEU 31 10.366 0.661 0.524
208 HD21 LEU 31 1HD2 LEU 31 9.537 -1.703 -1.226
209 HD22 LEU 31 2HD2 LEU 31 10.638 -0.430 -1.755
210 HD23 LEU 31 3HD2 LEU 31 9.195 -0.799 -2.701
211 H GLY 32 H GLY 32 5.112 -1.147 -0.902
212 HA2 GLY 32 1HA GLY 32 4.957 0.029 -3.351
213 HA3 GLY 32 2HA GLY 32 3.605 -0.822 -2.619
214 H LEU 33 H LEU 33 3.133 0.976 -0.476
215 HA LEU 33 HA LEU 33 1.515 2.893 -1.823
216 HB2 LEU 33 1HB LEU 33 0.721 1.983 0.225
217 HB3 LEU 33 2HB LEU 33 2.189 2.458 1.076
218 HG LEU 33 HG LEU 33 1.556 4.769 1.010
219 HD11 LEU 33 1HD1 LEU 33 -0.519 3.798 -0.902
220 HD12 LEU 33 2HD1 LEU 33 0.557 5.190 -1.019
221 HD13 LEU 33 3HD1 LEU 33 -0.828 5.237 0.070
222 HD21 LEU 33 1HD2 LEU 33 -1.028 3.468 1.721
223 HD22 LEU 33 2HD2 LEU 33 -0.110 4.703 2.584
224 HD23 LEU 33 3HD2 LEU 33 0.428 3.023 2.612
225 H LYS 34 H LYS 34 4.471 3.111 0.124
226 HA LYS 34 HA LYS 34 4.714 5.910 0.082
227 HB2 LYS 34 1HB LYS 34 6.606 3.640 0.542
228 HB3 LYS 34 2HB LYS 34 7.254 5.264 0.349
229 HG2 LYS 34 1HG LYS 34 7.020 5.027 2.646
230 HG3 LYS 34 2HG LYS 34 5.582 5.935 2.174
231 HD2 LYS 34 1HD LYS 34 4.173 4.168 2.559
232 HD3 LYS 34 2HD LYS 34 5.422 2.963 2.238
233 HE2 LYS 34 1HE LYS 34 4.596 3.311 4.666
234 HE3 LYS 34 2HE LYS 34 6.324 3.144 4.362
235 HZ1 LYS 34 1HZ LYS 34 5.802 4.975 5.884
236 HZ2 LYS 34 2HZ LYS 34 4.900 5.732 4.670
237 HZ3 LYS 34 3HZ LYS 34 6.567 5.523 4.478
238 H GLN 35 H GLN 35 6.266 3.448 -1.975
239 HA GLN 35 HA GLN 35 7.767 5.013 -3.625
240 HB2 GLN 35 1HB GLN 35 7.388 2.458 -3.648
241 HB3 GLN 35 2HB GLN 35 6.078 2.805 -4.769
242 HG2 GLN 35 1HG GLN 35 7.797 2.380 -6.214
243 HG3 GLN 35 2HG GLN 35 7.911 4.133 -6.059
244 HE21 GLN 35 1HE2 GLN 35 9.767 4.995 -5.393
245 HE22 GLN 35 2HE2 GLN 35 11.121 4.105 -4.793
246 H GLN 36 H GLN 36 4.287 4.418 -3.868
247 HA GLN 36 HA GLN 36 3.813 5.728 -6.286
248 HB2 GLN 36 1HB GLN 36 2.153 5.061 -3.899
249 HB3 GLN 36 2HB GLN 36 1.494 6.183 -5.082
250 HG2 GLN 36 1HG GLN 36 2.072 4.399 -6.820
251 HG3 GLN 36 2HG GLN 36 2.252 3.310 -5.445
252 HE21 GLN 36 1HE2 GLN 36 0.443 2.749 -4.235
253 HE22 GLN 36 2HE2 GLN 36 -1.165 2.999 -4.816
254 H ILE 37 H ILE 37 4.140 6.981 -3.020
255 HA ILE 37 HA ILE 37 3.246 9.615 -3.600
256 HB ILE 37 HB ILE 37 5.036 8.638 -1.372
257 HG12 ILE 37 1HG1 ILE 37 2.146 9.388 -1.087
258 HG13 ILE 37 2HG1 ILE 37 2.578 7.786 -1.676
259 HG21 ILE 37 1HG2 ILE 37 5.322 11.013 -1.689
260 HG22 ILE 37 2HG2 ILE 37 3.576 11.253 -1.714
261 HG23 ILE 37 3HG2 ILE 37 4.372 10.727 -0.231
262 HD11 ILE 37 1HD1 ILE 37 2.295 8.525 0.949
263 HD12 ILE 37 2HD1 ILE 37 3.117 7.079 0.360
264 HD13 ILE 37 3HD1 ILE 37 4.043 8.537 0.717
265 H GLU 38 H GLU 38 6.400 8.041 -3.619
266 HA GLU 38 HA GLU 38 7.891 10.433 -4.053
267 HB2 GLU 38 1HB GLU 38 9.063 8.605 -3.096
268 HB3 GLU 38 2HB GLU 38 8.542 7.509 -4.368
269 HG2 GLU 38 1HG GLU 38 10.187 9.874 -5.104
270 HG3 GLU 38 2HG GLU 38 10.968 8.497 -4.329
271 H ASP 39 H ASP 39 6.175 8.223 -6.091
272 HA ASP 39 HA ASP 39 7.446 9.203 -8.517
273 HB2 ASP 39 1HB ASP 39 5.403 7.082 -7.920
274 HB3 ASP 39 2HB ASP 39 5.641 7.657 -9.569
275 H GLN 40 H GLN 40 4.798 9.983 -6.537
276 HA GLN 40 HA GLN 40 3.420 11.392 -8.711
277 HB2 GLN 40 1HB GLN 40 2.544 10.710 -5.902
278 HB3 GLN 40 2HB GLN 40 1.598 11.693 -7.011
279 HG2 GLN 40 1HG GLN 40 2.473 8.887 -7.634
280 HG3 GLN 40 2HG GLN 40 0.942 9.278 -6.854
281 HE21 GLN 40 1HE2 GLN 40 -0.720 9.413 -8.165
282 HE22 GLN 40 2HE2 GLN 40 -0.671 9.838 -9.839
283 H GLN 41 H GLN 41 4.373 11.974 -5.321
284 HA GLN 41 HA GLN 41 4.187 14.825 -5.657
285 HB2 GLN 41 1HB GLN 41 5.356 13.244 -3.361
286 HB3 GLN 41 2HB GLN 41 4.923 14.948 -3.338
287 HG2 GLN 41 1HG GLN 41 2.840 12.924 -3.999
288 HG3 GLN 41 2HG GLN 41 3.331 13.150 -2.321
289 HE21 GLN 41 1HE2 GLN 41 3.004 15.189 -1.345
290 HE22 GLN 41 2HE2 GLN 41 1.818 16.288 -1.955
291 H GLY 42 H GLY 42 6.741 12.412 -5.584
292 HA2 GLY 42 1HA GLY 42 8.772 12.747 -6.804
293 HA3 GLY 42 2HA GLY 42 8.606 14.476 -6.537
294 H LEU 43 H LEU 43 7.867 13.767 -3.647
295 HA LEU 43 HA LEU 43 10.343 14.299 -2.488
296 HB2 LEU 43 1HB LEU 43 7.867 14.371 -1.570
297 HB3 LEU 43 2HB LEU 43 8.302 12.783 -0.942
298 HG LEU 43 HG LEU 43 10.078 15.115 -0.370
299 HD11 LEU 43 1HD1 LEU 43 7.827 14.491 1.481
300 HD12 LEU 43 2HD1 LEU 43 7.547 15.570 0.115
301 HD13 LEU 43 3HD1 LEU 43 8.777 15.969 1.315
302 HD21 LEU 43 1HD2 LEU 43 10.592 12.690 0.198
303 HD22 LEU 43 2HD2 LEU 43 9.294 12.805 1.387
304 HD23 LEU 43 3HD2 LEU 43 10.705 13.857 1.515
305 HA PRO 44 HA PRO 44 12.416 10.408 -2.577
306 HB2 PRO 44 1HB PRO 44 14.249 10.893 -0.634
307 HB3 PRO 44 2HB PRO 44 14.348 11.608 -2.247
308 HG2 PRO 44 1HG PRO 44 13.323 12.808 0.296
309 HG3 PRO 44 2HG PRO 44 14.354 13.537 -0.949
310 HD2 PRO 44 1HD PRO 44 11.696 14.025 -0.790
311 HD3 PRO 44 2HD PRO 44 12.571 13.998 -2.334
312 H LYS 45 H LYS 45 12.549 8.481 -1.433
313 HA LYS 45 HA LYS 45 10.611 8.094 0.614
314 HB2 LYS 45 1HB LYS 45 12.787 6.156 -0.164
315 HB3 LYS 45 2HB LYS 45 11.219 5.787 0.541
316 HG2 LYS 45 1HG LYS 45 11.264 7.181 -2.077
317 HG3 LYS 45 2HG LYS 45 11.712 5.474 -2.036
318 HD2 LYS 45 1HD LYS 45 9.182 6.548 -0.804
319 HD3 LYS 45 2HD LYS 45 9.273 5.954 -2.463
320 HE2 LYS 45 1HE LYS 45 8.618 4.037 -1.417
321 HE3 LYS 45 2HE LYS 45 10.366 3.862 -1.267
322 HZ1 LYS 45 1HZ LYS 45 9.136 5.339 0.883
323 HZ2 LYS 45 2HZ LYS 45 10.271 4.087 0.941
324 HZ3 LYS 45 3HZ LYS 45 8.626 3.729 0.781
325 H LYS 46 H LYS 46 13.981 8.824 0.605
326 HA LYS 46 HA LYS 46 14.552 7.871 3.242
327 HB2 LYS 46 1HB LYS 46 16.624 9.267 2.993
328 HB3 LYS 46 2HB LYS 46 16.384 8.077 1.721
329 HG2 LYS 46 1HG LYS 46 15.824 9.693 0.143
330 HG3 LYS 46 2HG LYS 46 15.474 10.908 1.375
331 HD2 LYS 46 1HD LYS 46 17.526 11.634 0.656
332 HD3 LYS 46 2HD LYS 46 18.017 10.559 1.967
333 HE2 LYS 46 1HE LYS 46 18.085 8.751 0.102
334 HE3 LYS 46 2HE LYS 46 18.152 10.130 -0.992
335 HZ1 LYS 46 1HZ LYS 46 20.364 9.390 -0.461
336 HZ2 LYS 46 2HZ LYS 46 20.066 9.534 1.198
337 HZ3 LYS 46 3HZ LYS 46 20.113 10.916 0.224
338 H GLN 47 H GLN 47 12.489 10.171 2.349
339 HA GLN 47 HA GLN 47 13.029 11.803 4.739
340 HB2 GLN 47 1HB GLN 47 12.248 12.668 1.976
341 HB3 GLN 47 2HB GLN 47 11.783 13.639 3.367
342 HG2 GLN 47 1HG GLN 47 14.271 13.554 3.996
343 HG3 GLN 47 2HG GLN 47 14.522 13.028 2.332
344 HE21 GLN 47 1HE2 GLN 47 15.796 15.182 2.743
345 HE22 GLN 47 2HE2 GLN 47 14.985 16.602 2.187
346 H GLN 48 H GLN 48 10.587 10.575 2.494
347 HA GLN 48 HA GLN 48 8.339 11.409 3.992
348 HB2 GLN 48 1HB GLN 48 7.067 10.305 2.427
349 HB3 GLN 48 2HB GLN 48 8.559 10.523 1.522
350 HG2 GLN 48 1HG GLN 48 9.230 8.225 2.232
351 HG3 GLN 48 2HG GLN 48 7.615 8.032 2.914
352 HE21 GLN 48 1HE2 GLN 48 9.108 9.148 -0.109
353 HE22 GLN 48 2HE2 GLN 48 8.017 8.313 -1.155
354 H GLN 49 H GLN 49 7.344 10.546 5.709
355 HA GLN 49 HA GLN 49 7.891 7.780 6.466
356 HB2 GLN 49 1HB GLN 49 9.532 9.360 7.616
357 HB3 GLN 49 2HB GLN 49 8.147 9.992 8.497
358 HG2 GLN 49 1HG GLN 49 7.703 7.650 9.279
359 HG3 GLN 49 2HG GLN 49 9.255 7.201 8.574
360 HE21 GLN 49 1HE2 GLN 49 7.804 9.530 10.812
361 HE22 GLN 49 2HE2 GLN 49 9.141 9.576 11.906
362 H LEU 50 H LEU 50 5.925 6.922 6.553
363 HA LEU 50 HA LEU 50 3.668 8.537 7.460
364 HB2 LEU 50 1HB LEU 50 3.776 5.785 6.235
365 HB3 LEU 50 2HB LEU 50 2.297 6.640 6.671
366 HG LEU 50 HG LEU 50 4.276 7.608 4.611
367 HD11 LEU 50 1HD1 LEU 50 2.984 6.676 2.934
368 HD12 LEU 50 2HD1 LEU 50 1.585 6.464 3.985
369 HD13 LEU 50 3HD1 LEU 50 2.987 5.409 4.160
370 HD21 LEU 50 1HD2 LEU 50 1.801 8.677 5.798
371 HD22 LEU 50 2HD2 LEU 50 1.919 8.785 4.041
372 HD23 LEU 50 3HD2 LEU 50 3.163 9.517 5.056
373 H GLU 51 H GLU 51 2.417 8.052 9.230
374 HA GLU 51 HA GLU 51 3.231 5.777 10.894
375 HB2 GLU 51 1HB GLU 51 3.012 8.654 11.774
376 HB3 GLU 51 2HB GLU 51 2.978 7.309 12.906
377 HG2 GLU 51 1HG GLU 51 5.190 6.697 12.415
378 HG3 GLU 51 2HG GLU 51 5.230 7.697 10.964
379 H PHE 52 H PHE 52 1.598 4.784 11.988
380 HA PHE 52 HA PHE 52 -1.078 5.996 11.809
381 HB2 PHE 52 1HB PHE 52 -0.644 4.129 10.126
382 HB3 PHE 52 2HB PHE 52 -0.571 3.038 11.505
383 HD1 PHE 52 2HD PHE 52 -2.810 5.802 10.363
384 HD2 PHE 52 1HD PHE 52 -2.476 1.825 11.842
385 HE1 PHE 52 2HE PHE 52 -5.260 5.581 10.311
386 HE2 PHE 52 1HE PHE 52 -4.926 1.597 11.792
387 HZ PHE 52 HZ PHE 52 -6.321 3.477 11.027
388 H GLN 53 H GLN 53 -1.784 6.382 13.794
389 HA GLN 53 HA GLN 53 -2.366 6.083 15.975
390 HB2 GLN 53 1HB GLN 53 -1.423 3.230 15.696
391 HB3 GLN 53 2HB GLN 53 -2.558 3.872 16.877
392 HG2 GLN 53 1HG GLN 53 -3.015 3.644 13.911
393 HG3 GLN 53 2HG GLN 53 -3.713 2.616 15.161
394 HE21 GLN 53 1HE2 GLN 53 -5.001 4.324 13.158
395 HE22 GLN 53 2HE2 GLN 53 -6.011 5.410 14.044
396 H GLY 54 H GLY 54 0.300 6.915 15.161
397 HA2 GLY 54 1HA GLY 54 2.201 7.575 16.288
398 HA3 GLY 54 2HA GLY 54 1.561 6.791 17.725
399 H GLN 55 H GLN 55 2.139 5.237 14.616
400 HA GLN 55 HA GLN 55 4.412 3.797 15.793
401 HB2 GLN 55 1HB GLN 55 3.572 1.709 15.310
402 HB3 GLN 55 2HB GLN 55 2.094 2.561 15.736
403 HG2 GLN 55 1HG GLN 55 1.881 3.033 13.225
404 HG3 GLN 55 2HG GLN 55 3.088 1.763 13.029
405 HE21 GLN 55 1HE2 GLN 55 0.835 1.259 11.823
406 HE22 GLN 55 2HE2 GLN 55 -0.137 0.117 12.681
407 H VAL 56 H VAL 56 5.932 2.968 14.291
408 HA VAL 56 HA VAL 56 5.879 4.380 11.715
409 HB VAL 56 HB VAL 56 8.238 3.149 13.147
410 HG11 VAL 56 1HG1 VAL 56 9.220 4.969 11.365
411 HG12 VAL 56 2HG1 VAL 56 9.134 3.228 11.094
412 HG13 VAL 56 3HG1 VAL 56 7.862 4.282 10.476
413 HG21 VAL 56 1HG2 VAL 56 7.561 6.069 12.832
414 HG22 VAL 56 2HG2 VAL 56 7.215 5.129 14.284
415 HG23 VAL 56 3HG2 VAL 56 8.883 5.368 13.764
416 H LEU 57 H LEU 57 5.209 3.181 10.066
417 HA LEU 57 HA LEU 57 5.247 0.324 10.108
418 HB2 LEU 57 1HB LEU 57 4.813 1.995 7.658
419 HB3 LEU 57 2HB LEU 57 4.141 0.413 8.045
420 HG LEU 57 HG LEU 57 3.390 2.934 9.515
421 HD11 LEU 57 1HD1 LEU 57 1.620 1.659 7.486
422 HD12 LEU 57 2HD1 LEU 57 2.882 2.767 6.951
423 HD13 LEU 57 3HD1 LEU 57 1.644 3.319 8.080
424 HD21 LEU 57 1HD2 LEU 57 2.700 1.252 10.889
425 HD22 LEU 57 2HD2 LEU 57 2.543 0.087 9.574
426 HD23 LEU 57 3HD2 LEU 57 1.307 1.325 9.809
427 H GLN 58 H GLN 58 6.297 -1.034 8.513
428 HA GLN 58 HA GLN 58 8.956 0.002 7.804
429 HB2 GLN 58 1HB GLN 58 8.096 -2.881 8.081
430 HB3 GLN 58 2HB GLN 58 9.737 -2.289 7.858
431 HG2 GLN 58 1HG GLN 58 8.092 -1.499 10.234
432 HG3 GLN 58 2HG GLN 58 9.021 -2.997 10.202
433 HE21 GLN 58 1HE2 GLN 58 9.409 -0.833 11.993
434 HE22 GLN 58 2HE2 GLN 58 10.992 -0.201 11.716
435 H ASP 59 H ASP 59 9.940 -0.965 5.824
436 HA ASP 59 HA ASP 59 8.108 -0.669 3.622
437 HB2 ASP 59 1HB ASP 59 10.965 -1.537 3.314
438 HB3 ASP 59 2HB ASP 59 9.990 -0.529 2.248
439 H TRP 60 H TRP 60 9.858 -3.285 5.173
440 HA TRP 60 HA TRP 60 9.274 -5.230 3.162
441 HB2 TRP 60 1HB TRP 60 10.452 -6.722 4.468
442 HB3 TRP 60 2HB TRP 60 11.122 -5.198 5.044
443 HD1 TRP 60 HD TRP 60 8.496 -7.840 6.085
444 HE1 TRP 60 1HE TRP 60 8.296 -7.798 8.650
445 HE3 TRP 60 3HE TRP 60 11.577 -3.882 7.073
446 HZ2 TRP 60 2HZ TRP 60 9.309 -6.285 10.808
447 HZ3 TRP 60 3HZ TRP 60 11.907 -3.201 9.414
448 HH2 TRP 60 HH TRP 60 10.796 -4.379 11.242
449 H LEU 61 H LEU 61 7.684 -4.089 6.051
450 HA LEU 61 HA LEU 61 5.877 -6.248 6.365
451 HB2 LEU 61 1HB LEU 61 5.718 -3.367 7.231
452 HB3 LEU 61 2HB LEU 61 4.549 -4.601 7.700
453 HG LEU 61 HG LEU 61 7.486 -4.761 8.355
454 HD11 LEU 61 1HD1 LEU 61 6.201 -2.761 9.327
455 HD12 LEU 61 2HD1 LEU 61 7.094 -3.800 10.437
456 HD13 LEU 61 3HD1 LEU 61 5.344 -3.963 10.292
457 HD21 LEU 61 1HD2 LEU 61 5.357 -6.108 9.918
458 HD22 LEU 61 2HD2 LEU 61 7.002 -6.630 9.554
459 HD23 LEU 61 3HD2 LEU 61 5.741 -6.768 8.328
460 H GLY 62 H GLY 62 3.409 -5.757 6.260
461 HA2 GLY 62 1HA GLY 62 2.834 -4.497 3.648
462 HA3 GLY 62 2HA GLY 62 2.113 -6.026 4.131
463 H LEU 63 H LEU 63 0.425 -4.100 3.363
464 HA LEU 63 HA LEU 63 -0.444 -2.332 5.382
465 HB2 LEU 63 1HB LEU 63 -1.825 -3.516 2.988
466 HB3 LEU 63 2HB LEU 63 -2.605 -2.352 4.057
467 HG LEU 63 HG LEU 63 -0.456 -0.920 3.475
468 HD11 LEU 63 1HD1 LEU 63 0.679 -2.559 2.148
469 HD12 LEU 63 2HD1 LEU 63 0.133 -1.262 1.086
470 HD13 LEU 63 3HD1 LEU 63 -0.744 -2.791 1.132
471 HD21 LEU 63 1HD2 LEU 63 -2.761 -1.242 1.556
472 HD22 LEU 63 2HD2 LEU 63 -1.745 0.186 1.758
473 HD23 LEU 63 3HD2 LEU 63 -2.818 -0.325 3.062
474 H GLY 64 H GLY 64 -1.737 -5.493 4.349
475 HA2 GLY 64 1HA GLY 64 -3.704 -5.645 6.376
476 HA3 GLY 64 2HA GLY 64 -3.092 -6.996 5.434
477 H ILE 65 H ILE 65 -0.311 -6.436 6.337
478 HA ILE 65 HA ILE 65 -0.143 -8.243 8.432
479 HB ILE 65 HB ILE 65 1.805 -6.041 7.738
480 HG12 ILE 65 1HG1 ILE 65 1.164 -7.764 5.955
481 HG13 ILE 65 2HG1 ILE 65 2.879 -7.585 6.309
482 HG21 ILE 65 1HG2 ILE 65 2.968 -6.668 9.520
483 HG22 ILE 65 2HG2 ILE 65 1.782 -7.917 9.898
484 HG23 ILE 65 3HG2 ILE 65 3.127 -8.277 8.815
485 HD11 ILE 65 1HD1 ILE 65 1.390 -9.647 7.820
486 HD12 ILE 65 2HD1 ILE 65 1.705 -9.947 6.110
487 HD13 ILE 65 3HD1 ILE 65 3.047 -9.652 7.215
488 H TYR 66 H TYR 66 -0.201 -4.699 8.544
489 HA TYR 66 HA TYR 66 -0.007 -4.619 11.410
490 HB2 TYR 66 1HB TYR 66 -0.342 -2.604 9.232
491 HB3 TYR 66 2HB TYR 66 -0.771 -2.140 10.874
492 HD1 TYR 66 2HD TYR 66 0.995 -2.342 12.683
493 HD2 TYR 66 1HD TYR 66 1.905 -2.646 8.537
494 HE1 TYR 66 2HE TYR 66 3.360 -1.878 13.174
495 HE2 TYR 66 1HE TYR 66 4.273 -2.183 9.017
496 HH TYR 66 HH TYR 66 5.618 -2.402 12.011
497 H GLY 67 H GLY 67 -2.588 -4.045 9.032
498 HA2 GLY 67 1HA GLY 67 -4.771 -5.079 9.718
499 HA3 GLY 67 2HA GLY 67 -4.532 -4.250 11.248
500 H ILE 68 H ILE 68 -3.506 -2.559 8.453
501 HA ILE 68 HA ILE 68 -5.273 -0.406 8.918
502 HB ILE 68 HB ILE 68 -3.742 -0.952 6.374
503 HG12 ILE 68 1HG1 ILE 68 -2.750 0.744 8.649
504 HG13 ILE 68 2HG1 ILE 68 -2.444 -0.989 8.622
505 HG21 ILE 68 1HG2 ILE 68 -4.087 1.230 5.792
506 HG22 ILE 68 2HG2 ILE 68 -5.583 0.911 6.668
507 HG23 ILE 68 3HG2 ILE 68 -4.261 1.765 7.463
508 HD11 ILE 68 1HD1 ILE 68 -0.536 -0.077 7.681
509 HD12 ILE 68 2HD1 ILE 68 -1.487 -0.562 6.276
510 HD13 ILE 68 3HD1 ILE 68 -1.442 1.131 6.770
511 H GLN 69 H GLN 69 -7.102 0.274 7.854
512 HA GLN 69 HA GLN 69 -8.345 -1.701 6.055
513 HB2 GLN 69 1HB GLN 69 -10.524 -0.870 6.884
514 HB3 GLN 69 2HB GLN 69 -9.541 -1.585 8.155
515 HG2 GLN 69 1HG GLN 69 -8.823 0.738 8.768
516 HG3 GLN 69 2HG GLN 69 -10.042 1.333 7.642
517 HE21 GLN 69 1HE2 GLN 69 -11.572 2.175 8.888
518 HE22 GLN 69 2HE2 GLN 69 -12.367 1.363 10.189
519 H ASP 70 H ASP 70 -10.240 -0.552 4.795
520 HA ASP 70 HA ASP 70 -8.996 1.332 3.064
521 HB2 ASP 70 1HB ASP 70 -11.153 1.356 1.882
522 HB3 ASP 70 2HB ASP 70 -10.631 -0.290 2.233
523 H SER 71 H SER 71 -10.046 3.421 2.452
524 HA SER 71 HA SER 71 -10.471 5.583 3.039
525 HB2 SER 71 1HB SER 71 -12.589 5.963 3.970
526 HB3 SER 71 2HB SER 71 -12.746 4.356 3.260
527 HG SER 71 HG SER 71 -13.495 4.710 5.528
528 H ASP 72 H ASP 72 -8.442 4.161 4.586
529 HA ASP 72 HA ASP 72 -8.692 5.153 7.296
530 HB2 ASP 72 1HB ASP 72 -6.362 4.201 7.528
531 HB3 ASP 72 2HB ASP 72 -7.609 3.038 7.082
532 H THR 73 H THR 73 -7.055 6.536 8.271
533 HA THR 73 HA THR 73 -6.132 8.588 6.373
534 HB THR 73 HB THR 73 -6.665 8.872 9.337
535 HG1 THR 73 1HG THR 73 -8.186 9.462 7.023
536 HG21 THR 73 1HG2 THR 73 -6.479 11.309 8.833
537 HG22 THR 73 2HG2 THR 73 -5.902 10.885 7.221
538 HG23 THR 73 3HG2 THR 73 -4.965 10.426 8.642
539 H LEU 74 H LEU 74 -4.020 8.783 6.052
540 HA LEU 74 HA LEU 74 -2.185 7.737 8.108
541 HB2 LEU 74 1HB LEU 74 -1.753 7.877 5.128
542 HB3 LEU 74 2HB LEU 74 -0.609 7.249 6.311
543 HG LEU 74 HG LEU 74 -3.315 6.002 6.043
544 HD11 LEU 74 1HD1 LEU 74 -2.653 4.617 4.277
545 HD12 LEU 74 2HD1 LEU 74 -0.966 5.114 4.401
546 HD13 LEU 74 3HD1 LEU 74 -2.171 6.238 3.774
547 HD21 LEU 74 1HD2 LEU 74 -2.136 4.035 6.825
548 HD22 LEU 74 2HD2 LEU 74 -1.842 5.389 7.916
549 HD23 LEU 74 3HD2 LEU 74 -0.600 4.901 6.762
550 H ILE 75 H ILE 75 -0.786 9.127 8.971
551 HA ILE 75 HA ILE 75 -0.733 11.859 7.997
552 HB ILE 75 HB ILE 75 0.831 10.787 10.335
553 HG12 ILE 75 1HG1 ILE 75 -1.454 10.089 10.703
554 HG13 ILE 75 2HG1 ILE 75 -1.116 11.470 11.741
555 HG21 ILE 75 1HG2 ILE 75 0.998 13.188 9.215
556 HG22 ILE 75 2HG2 ILE 75 -0.397 13.485 10.251
557 HG23 ILE 75 3HG2 ILE 75 1.129 12.955 10.959
558 HD11 ILE 75 1HD1 ILE 75 -2.122 12.659 9.497
559 HD12 ILE 75 2HD1 ILE 75 -3.059 11.167 9.597
560 HD13 ILE 75 3HD1 ILE 75 -3.031 12.285 10.961
561 H LEU 76 H LEU 76 0.832 12.731 6.803
562 HA LEU 76 HA LEU 76 3.281 11.159 6.369
563 HB2 LEU 76 1HB LEU 76 2.270 11.381 4.299
564 HB3 LEU 76 2HB LEU 76 1.700 13.013 4.641
565 HG LEU 76 HG LEU 76 4.195 13.666 4.548
566 HD11 LEU 76 1HD1 LEU 76 4.971 11.290 4.563
567 HD12 LEU 76 2HD1 LEU 76 5.627 12.270 3.252
568 HD13 LEU 76 3HD1 LEU 76 4.322 11.128 2.931
569 HD21 LEU 76 1HD2 LEU 76 3.462 14.605 2.679
570 HD22 LEU 76 2HD2 LEU 76 2.153 13.427 2.579
571 HD23 LEU 76 3HD2 LEU 76 3.709 13.084 1.821
572 H SER 77 H SER 77 5.127 11.922 7.145
573 HA SER 77 HA SER 77 5.508 14.810 7.408
574 HB2 SER 77 1HB SER 77 5.824 12.824 9.667
575 HB3 SER 77 2HB SER 77 6.481 14.460 9.706
576 HG SER 77 HG SER 77 3.766 14.083 9.108
577 H LYS 78 H LYS 78 7.452 15.416 6.713
578 HA LYS 78 HA LYS 78 9.322 13.478 5.765
579 HB2 LYS 78 1HB LYS 78 10.686 15.437 5.133
580 HB3 LYS 78 2HB LYS 78 9.023 15.575 4.577
581 HG2 LYS 78 1HG LYS 78 8.548 17.306 5.978
582 HG3 LYS 78 2HG LYS 78 9.717 16.788 7.195
583 HD2 LYS 78 1HD LYS 78 10.554 18.793 6.214
584 HD3 LYS 78 2HD LYS 78 11.534 17.460 5.600
585 HE2 LYS 78 1HE LYS 78 10.489 17.520 3.497
586 HE3 LYS 78 2HE LYS 78 9.150 18.498 4.097
587 HZ1 LYS 78 1HZ LYS 78 11.941 19.488 4.015
588 HZ2 LYS 78 2HZ LYS 78 10.525 20.387 4.234
589 HZ3 LYS 78 3HZ LYS 78 10.862 19.695 2.728
590 H LYS 79 H LYS 79 11.330 12.937 6.544
591 HA LYS 79 HA LYS 79 11.706 13.030 9.347
592 HB2 LYS 79 1HB LYS 79 13.884 12.416 7.362
593 HB3 LYS 79 2HB LYS 79 13.672 11.772 8.985
594 HG2 LYS 79 1HG LYS 79 11.427 10.851 7.922
595 HG3 LYS 79 2HG LYS 79 12.376 10.981 6.440
596 HD2 LYS 79 1HD LYS 79 14.168 9.652 7.545
597 HD3 LYS 79 2HD LYS 79 13.092 9.429 8.927
598 HE2 LYS 79 1HE LYS 79 11.606 8.110 7.708
599 HE3 LYS 79 2HE LYS 79 12.216 8.688 6.158
600 HZ1 LYS 79 1HZ LYS 79 13.800 7.019 8.031
601 HZ2 LYS 79 2HZ LYS 79 14.200 7.432 6.441
602 HZ3 LYS 79 3HZ LYS 79 12.903 6.389 6.742
603 H LYS 80 H LYS 80 12.905 14.334 10.623
604 HA LYS 80 HA LYS 80 13.676 16.889 9.634
605 HB2 LYS 80 1HB LYS 80 14.145 15.556 12.305
606 HB3 LYS 80 2HB LYS 80 14.544 17.233 11.958
607 HG2 LYS 80 1HG LYS 80 12.359 17.896 11.933
608 HG3 LYS 80 2HG LYS 80 11.767 16.307 11.443
609 HD2 LYS 80 1HD LYS 80 13.010 16.731 14.139
610 HD3 LYS 80 2HD LYS 80 11.309 17.106 13.852
611 HE2 LYS 80 1HE LYS 80 12.567 14.436 13.244
612 HE3 LYS 80 2HE LYS 80 11.752 14.812 14.762
613 HZ1 LYS 80 1HZ LYS 80 9.744 15.331 13.452
614 HZ2 LYS 80 2HZ LYS 80 10.226 13.716 13.305
615 HZ3 LYS 80 3HZ LYS 80 10.539 14.810 12.053
616 H GLY 81 H GLY 81 15.610 14.298 11.157
617 HA2 GLY 81 1HA GLY 81 18.035 15.487 10.049
618 HA3 GLY 81 2HA GLY 81 17.959 14.174 11.215
619 H SER 82 H SER 82 19.593 14.248 8.877
620 HA SER 82 HA SER 82 18.365 12.102 7.273
621 HB2 SER 82 1HB SER 82 19.836 12.786 5.432
622 HB3 SER 82 2HB SER 82 18.840 14.139 5.969
623 HG SER 82 HG SER 82 21.578 13.772 6.132
624 H GLY 83 H GLY 83 20.242 10.789 6.133
625 HA2 GLY 83 1HA GLY 83 22.489 10.324 7.936
626 HA3 GLY 83 2HA GLY 83 21.349 9.000 7.748
627 HA PRO 84 HA PRO 84 24.644 9.215 4.285
628 HB2 PRO 84 1HB PRO 84 26.397 7.368 5.226
629 HB3 PRO 84 2HB PRO 84 26.542 9.095 5.575
630 HG2 PRO 84 1HG PRO 84 25.407 6.908 7.275
631 HG3 PRO 84 2HG PRO 84 26.470 8.249 7.740
632 HD2 PRO 84 1HD PRO 84 23.799 8.285 8.186
633 HD3 PRO 84 2HD PRO 84 24.730 9.758 7.845
634 H SER 85 H SER 85 23.168 6.664 6.178
635 HA SER 85 HA SER 85 23.541 4.400 4.748
636 HB2 SER 85 1HB SER 85 21.466 3.596 5.571
637 HB3 SER 85 2HB SER 85 22.021 4.763 6.771
638 HG SER 85 HG SER 85 19.719 4.817 5.828
639 H SER 86 H SER 86 23.242 3.737 2.728
640 HA SER 86 HA SER 86 21.927 5.487 0.835
641 HB2 SER 86 1HB SER 86 23.429 2.884 0.496
642 HB3 SER 86 2HB SER 86 22.724 3.789 -0.843
643 HG SER 86 HG SER 86 24.697 4.735 0.967
644 H GLY 87 H GLY 87 20.534 4.386 -0.898
645 HA2 GLY 87 1HA GLY 87 19.086 2.086 -0.588
646 HA3 GLY 87 2HA GLY 87 18.261 3.250 0.437
Start of MODEL 3
1 H1 GLY 1 H GLY 1 -4.236 2.013 -19.072
2 HA2 GLY 1 1HA GLY 1 -3.698 -0.020 -17.550
3 HA3 GLY 1 2HA GLY 1 -4.919 0.718 -16.524
4 H SER 2 H SER 2 -5.786 -1.553 -16.932
5 HA SER 2 HA SER 2 -7.502 -1.485 -19.328
6 HB2 SER 2 1HB SER 2 -5.994 -3.764 -18.085
7 HB3 SER 2 2HB SER 2 -7.478 -4.078 -18.986
8 HG SER 2 HG SER 2 -4.997 -3.461 -19.902
9 H SER 3 H SER 3 -9.385 -3.179 -18.961
10 HA SER 3 HA SER 3 -10.950 -2.134 -16.830
11 HB2 SER 3 1HB SER 3 -11.973 -2.828 -18.944
12 HB3 SER 3 2HB SER 3 -11.473 -4.495 -18.654
13 HG SER 3 HG SER 3 -13.024 -4.728 -17.214
14 H GLY 4 H GLY 4 -10.571 -2.645 -14.773
15 HA2 GLY 4 1HA GLY 4 -11.116 -4.977 -13.536
16 HA3 GLY 4 2HA GLY 4 -9.450 -5.213 -14.045
17 H SER 5 H SER 5 -11.589 -3.254 -12.057
18 HA SER 5 HA SER 5 -9.360 -1.921 -10.766
19 HB2 SER 5 1HB SER 5 -12.352 -1.778 -10.379
20 HB3 SER 5 2HB SER 5 -11.214 -0.909 -9.350
21 HG SER 5 HG SER 5 -10.381 -0.143 -11.536
22 H SER 6 H SER 6 -8.591 -2.316 -8.745
23 HA SER 6 HA SER 6 -9.915 -4.030 -6.878
24 HB2 SER 6 1HB SER 6 -8.875 -5.603 -8.632
25 HB3 SER 6 2HB SER 6 -7.321 -5.125 -7.951
26 HG SER 6 HG SER 6 -9.473 -6.413 -6.631
27 H GLY 7 H GLY 7 -8.707 -4.272 -4.871
28 HA2 GLY 7 1HA GLY 7 -6.735 -3.727 -3.563
29 HA3 GLY 7 2HA GLY 7 -6.496 -2.335 -4.609
30 H ILE 8 H ILE 8 -6.363 -1.693 -2.101
31 HA ILE 8 HA ILE 8 -9.035 -0.799 -1.257
32 HB ILE 8 HB ILE 8 -8.124 -0.480 0.960
33 HG12 ILE 8 1HG1 ILE 8 -5.498 -1.667 0.150
34 HG13 ILE 8 2HG1 ILE 8 -5.771 0.055 -0.093
35 HG21 ILE 8 1HG2 ILE 8 -8.120 -3.024 -0.416
36 HG22 ILE 8 2HG2 ILE 8 -7.024 -3.027 0.965
37 HG23 ILE 8 3HG2 ILE 8 -8.724 -2.611 1.188
38 HD11 ILE 8 1HD1 ILE 8 -4.710 -0.125 1.982
39 HD12 ILE 8 2HD1 ILE 8 -6.412 0.137 2.361
40 HD13 ILE 8 3HD1 ILE 8 -5.722 -1.481 2.478
41 H GLN 9 H GLN 9 -9.277 1.364 -0.436
42 HA GLN 9 HA GLN 9 -7.466 3.256 -1.771
43 HB2 GLN 9 1HB GLN 9 -9.763 3.395 -2.544
44 HB3 GLN 9 2HB GLN 9 -10.339 3.574 -0.893
45 HG2 GLN 9 1HG GLN 9 -9.010 5.695 -0.760
46 HG3 GLN 9 2HG GLN 9 -8.717 5.533 -2.491
47 HE21 GLN 9 1HE2 GLN 9 -10.022 6.698 -3.687
48 HE22 GLN 9 2HE2 GLN 9 -11.658 7.112 -3.317
49 H VAL 10 H VAL 10 -6.052 4.225 -0.490
50 HA VAL 10 HA VAL 10 -6.843 4.815 2.289
51 HB VAL 10 HB VAL 10 -4.562 4.576 2.986
52 HG11 VAL 10 1HG1 VAL 10 -4.240 2.138 1.732
53 HG12 VAL 10 2HG1 VAL 10 -5.154 2.436 3.212
54 HG13 VAL 10 3HG1 VAL 10 -5.979 2.419 1.652
55 HG21 VAL 10 1HG2 VAL 10 -2.802 3.856 1.377
56 HG22 VAL 10 2HG2 VAL 10 -3.938 4.166 0.065
57 HG23 VAL 10 3HG2 VAL 10 -3.400 5.491 1.096
58 H PHE 11 H PHE 11 -6.510 6.844 3.073
59 HA PHE 11 HA PHE 11 -5.828 8.889 1.107
60 HB2 PHE 11 1HB PHE 11 -7.006 9.133 3.883
61 HB3 PHE 11 2HB PHE 11 -6.749 10.473 2.770
62 HD1 PHE 11 1HD PHE 11 -8.022 10.525 0.615
63 HD2 PHE 11 2HD PHE 11 -8.918 7.778 3.740
64 HE1 PHE 11 1HE PHE 11 -10.243 10.135 -0.370
65 HE2 PHE 11 2HE PHE 11 -11.140 7.384 2.761
66 HZ PHE 11 HZ PHE 11 -11.805 8.562 0.703
67 H VAL 12 H VAL 12 -3.957 9.951 1.102
68 HA VAL 12 HA VAL 12 -2.156 9.596 3.404
69 HB VAL 12 HB VAL 12 -1.455 10.260 0.541
70 HG11 VAL 12 1HG1 VAL 12 0.081 10.265 3.052
71 HG12 VAL 12 2HG1 VAL 12 0.852 9.452 1.689
72 HG13 VAL 12 3HG1 VAL 12 0.360 11.140 1.546
73 HG21 VAL 12 1HG2 VAL 12 -1.628 8.071 0.183
74 HG22 VAL 12 2HG2 VAL 12 -0.274 7.848 1.292
75 HG23 VAL 12 3HG2 VAL 12 -1.930 7.756 1.892
76 H LYS 13 H LYS 13 -2.244 11.309 4.706
77 HA LYS 13 HA LYS 13 -2.785 13.960 3.667
78 HB2 LYS 13 1HB LYS 13 -3.871 13.739 5.678
79 HB3 LYS 13 2HB LYS 13 -2.621 12.709 6.363
80 HG2 LYS 13 1HG LYS 13 -1.195 14.593 6.755
81 HG3 LYS 13 2HG LYS 13 -2.304 15.665 5.897
82 HD2 LYS 13 1HD LYS 13 -3.341 14.107 8.212
83 HD3 LYS 13 2HD LYS 13 -2.308 15.502 8.532
84 HE2 LYS 13 1HE LYS 13 -3.802 16.943 7.306
85 HE3 LYS 13 2HE LYS 13 -4.786 15.566 6.814
86 HZ1 LYS 13 1HZ LYS 13 -5.989 15.911 8.625
87 HZ2 LYS 13 2HZ LYS 13 -4.922 17.092 9.196
88 HZ3 LYS 13 3HZ LYS 13 -4.658 15.463 9.568
89 H ASN 14 H ASN 14 -1.229 15.227 2.920
90 HA ASN 14 HA ASN 14 1.545 14.686 3.522
91 HB2 ASN 14 1HB ASN 14 1.972 16.578 1.941
92 HB3 ASN 14 2HB ASN 14 1.006 15.278 1.248
93 HD21 ASN 14 1HD2 ASN 14 0.676 17.257 -0.214
94 HD22 ASN 14 2HD2 ASN 14 -0.723 18.209 0.130
95 HA PRO 15 HA PRO 15 2.153 17.628 6.723
96 HB2 PRO 15 1HB PRO 15 4.694 18.439 6.213
97 HB3 PRO 15 2HB PRO 15 4.308 16.844 6.869
98 HG2 PRO 15 1HG PRO 15 4.926 17.634 4.048
99 HG3 PRO 15 2HG PRO 15 5.491 16.225 4.965
100 HD2 PRO 15 1HD PRO 15 3.473 16.079 3.165
101 HD3 PRO 15 2HD PRO 15 3.536 15.056 4.614
102 H ASP 16 H ASP 16 2.051 18.533 3.469
103 HA ASP 16 HA ASP 16 2.642 21.328 3.831
104 HB2 ASP 16 1HB ASP 16 1.514 19.726 1.537
105 HB3 ASP 16 2HB ASP 16 1.669 21.479 1.473
106 H GLY 17 H GLY 17 -0.302 19.405 3.276
107 HA2 GLY 17 1HA GLY 17 -2.083 20.396 4.932
108 HA3 GLY 17 2HA GLY 17 -1.936 21.768 3.843
109 H GLY 18 H GLY 18 -3.084 18.497 4.214
110 HA2 GLY 18 1HA GLY 18 -5.330 18.397 2.919
111 HA3 GLY 18 2HA GLY 18 -4.273 18.579 1.527
112 H SER 19 H SER 19 -5.741 16.440 1.375
113 HA SER 19 HA SER 19 -3.854 14.266 1.829
114 HB2 SER 19 1HB SER 19 -5.644 14.484 3.737
115 HB3 SER 19 2HB SER 19 -6.721 13.755 2.546
116 HG SER 19 HG SER 19 -4.772 12.604 4.037
117 H TYR 20 H TYR 20 -3.942 12.674 0.296
118 HA TYR 20 HA TYR 20 -5.960 13.020 -1.825
119 HB2 TYR 20 1HB TYR 20 -3.247 11.848 -2.347
120 HB3 TYR 20 2HB TYR 20 -4.358 12.617 -3.476
121 HD1 TYR 20 2HD TYR 20 -4.744 15.146 -3.200
122 HD2 TYR 20 1HD TYR 20 -1.493 13.068 -1.408
123 HE1 TYR 20 2HE TYR 20 -3.528 17.270 -2.956
124 HE2 TYR 20 1HE TYR 20 -0.268 15.186 -1.157
125 HH TYR 20 HH TYR 20 -1.570 18.221 -2.431
126 H ALA 21 H ALA 21 -6.550 11.095 -3.007
127 HA ALA 21 HA ALA 21 -6.588 8.746 -1.264
128 HB1 ALA 21 1HB ALA 21 -8.148 8.971 -3.807
129 HB2 ALA 21 2HB ALA 21 -8.528 8.075 -2.336
130 HB3 ALA 21 3HB ALA 21 -8.669 9.833 -2.359
131 H TYR 22 H TYR 22 -5.272 7.094 -1.623
132 HA TYR 22 HA TYR 22 -4.084 6.796 -4.300
133 HB2 TYR 22 1HB TYR 22 -3.048 6.094 -1.558
134 HB3 TYR 22 2HB TYR 22 -2.327 5.440 -3.025
135 HD1 TYR 22 2HD TYR 22 -3.163 8.650 -1.338
136 HD2 TYR 22 1HD TYR 22 -0.707 6.660 -4.186
137 HE1 TYR 22 2HE TYR 22 -1.785 10.675 -1.556
138 HE2 TYR 22 1HE TYR 22 0.678 8.680 -4.412
139 HH TYR 22 HH TYR 22 1.153 10.785 -2.700
140 H ALA 23 H ALA 23 -3.513 4.523 -4.894
141 HA ALA 23 HA ALA 23 -5.545 2.629 -3.909
142 HB1 ALA 23 1HB ALA 23 -6.408 2.984 -5.981
143 HB2 ALA 23 2HB ALA 23 -4.848 3.419 -6.680
144 HB3 ALA 23 3HB ALA 23 -5.241 1.725 -6.387
145 H ILE 24 H ILE 24 -4.677 0.895 -2.999
146 HA ILE 24 HA ILE 24 -2.430 -0.458 -4.194
147 HB ILE 24 HB ILE 24 -1.191 1.145 -2.895
148 HG12 ILE 24 1HG1 ILE 24 -1.134 -1.326 -1.189
149 HG13 ILE 24 2HG1 ILE 24 -0.637 -1.400 -2.876
150 HG21 ILE 24 1HG2 ILE 24 -3.362 1.020 -1.148
151 HG22 ILE 24 2HG2 ILE 24 -1.993 0.392 -0.233
152 HG23 ILE 24 3HG2 ILE 24 -1.903 1.993 -0.968
153 HD11 ILE 24 1HD1 ILE 24 0.807 -0.461 -0.580
154 HD12 ILE 24 2HD1 ILE 24 1.380 -0.782 -2.217
155 HD13 ILE 24 3HD1 ILE 24 0.707 0.796 -1.813
156 H ASN 25 H ASN 25 -2.765 -2.569 -3.999
157 HA ASN 25 HA ASN 25 -4.930 -3.691 -2.669
158 HB2 ASN 25 1HB ASN 25 -2.356 -4.895 -3.677
159 HB3 ASN 25 2HB ASN 25 -3.624 -5.878 -2.950
160 HD21 ASN 25 1HD2 ASN 25 -2.672 -3.989 -5.684
161 HD22 ASN 25 2HD2 ASN 25 -3.980 -4.443 -6.717
162 HA PRO 26 HA PRO 26 -3.760 -4.044 1.550
163 HB2 PRO 26 1HB PRO 26 -5.104 -6.297 2.250
164 HB3 PRO 26 2HB PRO 26 -5.908 -4.752 1.950
165 HG2 PRO 26 1HG PRO 26 -5.608 -7.114 0.137
166 HG3 PRO 26 2HG PRO 26 -7.032 -6.097 0.423
167 HD2 PRO 26 1HD PRO 26 -5.443 -5.800 -1.749
168 HD3 PRO 26 2HD PRO 26 -6.285 -4.435 -0.988
169 H ASN 27 H ASN 27 -3.054 -6.562 -0.711
170 HA ASN 27 HA ASN 27 -1.422 -8.060 1.171
171 HB2 ASN 27 1HB ASN 27 -1.946 -8.461 -1.782
172 HB3 ASN 27 2HB ASN 27 -0.984 -9.543 -0.780
173 HD21 ASN 27 1HD2 ASN 27 -2.406 -11.242 -1.260
174 HD22 ASN 27 2HD2 ASN 27 -3.954 -11.362 -0.502
175 H SER 28 H SER 28 -1.073 -5.580 -1.185
176 HA SER 28 HA SER 28 1.637 -5.970 -1.880
177 HB2 SER 28 1HB SER 28 0.056 -4.508 -3.135
178 HB3 SER 28 2HB SER 28 0.106 -3.359 -1.798
179 HG SER 28 HG SER 28 2.447 -3.334 -2.169
180 H PHE 29 H PHE 29 3.520 -5.107 -1.060
181 HA PHE 29 HA PHE 29 3.683 -4.771 1.726
182 HB2 PHE 29 1HB PHE 29 5.705 -3.951 -0.371
183 HB3 PHE 29 2HB PHE 29 6.028 -4.195 1.343
184 HD1 PHE 29 2HD PHE 29 5.102 -6.616 2.177
185 HD2 PHE 29 1HD PHE 29 6.411 -5.626 -1.751
186 HE1 PHE 29 2HE PHE 29 5.592 -8.988 1.746
187 HE2 PHE 29 1HE PHE 29 6.902 -7.997 -2.188
188 HZ PHE 29 HZ PHE 29 6.494 -9.681 -0.438
189 H ILE 30 H ILE 30 4.153 -2.945 2.989
190 HA ILE 30 HA ILE 30 2.686 -0.652 2.474
191 HB ILE 30 HB ILE 30 5.018 -1.107 4.322
192 HG12 ILE 30 1HG1 ILE 30 2.604 -2.130 4.567
193 HG13 ILE 30 2HG1 ILE 30 3.445 -1.485 5.972
194 HG21 ILE 30 1HG2 ILE 30 3.621 1.400 3.637
195 HG22 ILE 30 2HG2 ILE 30 3.874 1.089 5.354
196 HG23 ILE 30 3HG2 ILE 30 5.252 1.140 4.254
197 HD11 ILE 30 1HD1 ILE 30 1.746 0.398 4.463
198 HD12 ILE 30 2HD1 ILE 30 0.928 -0.870 5.377
199 HD13 ILE 30 3HD1 ILE 30 2.017 0.248 6.198
200 H LEU 31 H LEU 31 5.911 -1.486 1.493
201 HA LEU 31 HA LEU 31 6.882 1.100 0.926
202 HB2 LEU 31 1HB LEU 31 8.329 -0.855 1.091
203 HB3 LEU 31 2HB LEU 31 7.577 -1.545 -0.346
204 HG LEU 31 HG LEU 31 8.446 0.710 -1.435
205 HD11 LEU 31 1HD1 LEU 31 9.423 1.081 1.069
206 HD12 LEU 31 2HD1 LEU 31 10.101 1.803 -0.389
207 HD13 LEU 31 3HD1 LEU 31 10.801 0.325 0.269
208 HD21 LEU 31 1HD2 LEU 31 10.750 -0.952 -1.272
209 HD22 LEU 31 2HD2 LEU 31 9.589 -0.798 -2.591
210 HD23 LEU 31 3HD2 LEU 31 9.318 -1.980 -1.310
211 H GLY 32 H GLY 32 5.014 -1.216 -0.973
212 HA2 GLY 32 1HA GLY 32 5.178 0.044 -3.467
213 HA3 GLY 32 2HA GLY 32 3.854 -0.983 -2.938
214 H LEU 33 H LEU 33 3.703 1.152 -0.628
215 HA LEU 33 HA LEU 33 1.704 2.756 -2.006
216 HB2 LEU 33 1HB LEU 33 0.884 1.929 0.006
217 HB3 LEU 33 2HB LEU 33 2.394 2.242 0.860
218 HG LEU 33 HG LEU 33 1.915 4.622 0.886
219 HD11 LEU 33 1HD1 LEU 33 0.520 5.573 -0.547
220 HD12 LEU 33 2HD1 LEU 33 -0.822 4.610 0.072
221 HD13 LEU 33 3HD1 LEU 33 0.179 3.986 -1.239
222 HD21 LEU 33 1HD2 LEU 33 -0.368 2.900 1.841
223 HD22 LEU 33 2HD2 LEU 33 -0.107 4.576 2.322
224 HD23 LEU 33 3HD2 LEU 33 1.082 3.342 2.743
225 H LYS 34 H LYS 34 4.760 3.149 -0.306
226 HA LYS 34 HA LYS 34 4.759 5.985 -0.283
227 HB2 LYS 34 1HB LYS 34 6.828 3.861 0.110
228 HB3 LYS 34 2HB LYS 34 7.347 5.527 -0.107
229 HG2 LYS 34 1HG LYS 34 7.201 5.418 2.169
230 HG3 LYS 34 2HG LYS 34 5.582 5.998 1.771
231 HD2 LYS 34 1HD LYS 34 5.246 4.265 3.324
232 HD3 LYS 34 2HD LYS 34 4.887 3.546 1.753
233 HE2 LYS 34 1HE LYS 34 6.227 1.920 2.643
234 HE3 LYS 34 2HE LYS 34 7.441 2.911 1.836
235 HZ1 LYS 34 1HZ LYS 34 7.237 4.050 4.285
236 HZ2 LYS 34 2HZ LYS 34 8.435 2.953 3.815
237 HZ3 LYS 34 3HZ LYS 34 7.063 2.404 4.637
238 H GLN 35 H GLN 35 6.249 3.600 -2.456
239 HA GLN 35 HA GLN 35 7.665 5.211 -4.144
240 HB2 GLN 35 1HB GLN 35 7.462 2.712 -4.271
241 HB3 GLN 35 2HB GLN 35 5.916 2.933 -5.078
242 HG2 GLN 35 1HG GLN 35 7.924 2.494 -6.550
243 HG3 GLN 35 2HG GLN 35 6.910 3.872 -6.976
244 HE21 GLN 35 1HE2 GLN 35 9.687 3.179 -4.871
245 HE22 GLN 35 2HE2 GLN 35 10.594 4.579 -5.321
246 H GLN 36 H GLN 36 4.184 4.538 -4.297
247 HA GLN 36 HA GLN 36 3.612 5.967 -6.625
248 HB2 GLN 36 1HB GLN 36 2.011 5.167 -4.228
249 HB3 GLN 36 2HB GLN 36 1.301 6.256 -5.412
250 HG2 GLN 36 1HG GLN 36 1.818 4.558 -7.166
251 HG3 GLN 36 2HG GLN 36 2.303 3.460 -5.874
252 HE21 GLN 36 1HE2 GLN 36 0.683 2.914 -4.270
253 HE22 GLN 36 2HE2 GLN 36 -0.979 2.849 -4.736
254 H ILE 37 H ILE 37 3.867 7.038 -3.275
255 HA ILE 37 HA ILE 37 2.955 9.693 -3.773
256 HB ILE 37 HB ILE 37 4.601 8.624 -1.478
257 HG12 ILE 37 1HG1 ILE 37 1.668 9.280 -1.415
258 HG13 ILE 37 2HG1 ILE 37 2.224 7.702 -1.962
259 HG21 ILE 37 1HG2 ILE 37 2.912 11.007 -1.115
260 HG22 ILE 37 2HG2 ILE 37 4.513 10.638 -0.474
261 HG23 ILE 37 3HG2 ILE 37 4.340 11.230 -2.126
262 HD11 ILE 37 1HD1 ILE 37 1.590 7.680 0.389
263 HD12 ILE 37 2HD1 ILE 37 3.306 7.329 0.181
264 HD13 ILE 37 3HD1 ILE 37 2.792 8.925 0.728
265 H GLU 38 H GLU 38 6.129 8.155 -3.599
266 HA GLU 38 HA GLU 38 7.688 10.490 -3.710
267 HB2 GLU 38 1HB GLU 38 8.773 8.479 -3.083
268 HB3 GLU 38 2HB GLU 38 8.224 7.641 -4.528
269 HG2 GLU 38 1HG GLU 38 9.671 9.068 -5.895
270 HG3 GLU 38 2HG GLU 38 10.237 9.877 -4.434
271 H ASP 39 H ASP 39 5.858 8.844 -6.115
272 HA ASP 39 HA ASP 39 7.249 10.159 -8.315
273 HB2 ASP 39 1HB ASP 39 5.045 8.109 -8.181
274 HB3 ASP 39 2HB ASP 39 5.473 8.914 -9.688
275 H GLN 40 H GLN 40 4.378 10.465 -6.401
276 HA GLN 40 HA GLN 40 3.079 12.276 -8.245
277 HB2 GLN 40 1HB GLN 40 2.405 11.039 -5.627
278 HB3 GLN 40 2HB GLN 40 1.620 12.562 -6.024
279 HG2 GLN 40 1HG GLN 40 1.615 10.348 -8.018
280 HG3 GLN 40 2HG GLN 40 0.508 10.290 -6.647
281 HE21 GLN 40 1HE2 GLN 40 0.656 11.078 -9.761
282 HE22 GLN 40 2HE2 GLN 40 -0.518 12.343 -9.831
283 H GLN 41 H GLN 41 4.278 12.557 -4.895
284 HA GLN 41 HA GLN 41 4.252 15.436 -5.048
285 HB2 GLN 41 1HB GLN 41 5.329 13.609 -2.894
286 HB3 GLN 41 2HB GLN 41 5.112 15.348 -2.749
287 HG2 GLN 41 1HG GLN 41 2.631 14.771 -3.372
288 HG3 GLN 41 2HG GLN 41 3.082 13.177 -2.767
289 HE21 GLN 41 1HE2 GLN 41 4.403 13.375 -0.628
290 HE22 GLN 41 2HE2 GLN 41 3.682 14.389 0.570
291 H GLY 42 H GLY 42 6.564 12.872 -5.448
292 HA2 GLY 42 1HA GLY 42 8.619 13.079 -6.559
293 HA3 GLY 42 2HA GLY 42 8.538 14.821 -6.338
294 H LEU 43 H LEU 43 7.849 13.130 -3.496
295 HA LEU 43 HA LEU 43 10.424 13.910 -2.383
296 HB2 LEU 43 1HB LEU 43 7.981 14.202 -1.385
297 HB3 LEU 43 2HB LEU 43 8.327 12.600 -0.737
298 HG LEU 43 HG LEU 43 10.314 14.776 -0.294
299 HD11 LEU 43 1HD1 LEU 43 7.834 14.449 1.384
300 HD12 LEU 43 2HD1 LEU 43 8.091 15.755 0.228
301 HD13 LEU 43 3HD1 LEU 43 9.149 15.599 1.630
302 HD21 LEU 43 1HD2 LEU 43 9.579 13.045 1.912
303 HD22 LEU 43 2HD2 LEU 43 11.156 13.328 1.174
304 HD23 LEU 43 3HD2 LEU 43 10.060 12.131 0.482
305 HA PRO 44 HA PRO 44 12.101 9.835 -2.516
306 HB2 PRO 44 1HB PRO 44 14.026 10.135 -0.625
307 HB3 PRO 44 2HB PRO 44 14.150 10.839 -2.241
308 HG2 PRO 44 1HG PRO 44 13.319 12.130 0.329
309 HG3 PRO 44 2HG PRO 44 14.382 12.756 -0.945
310 HD2 PRO 44 1HD PRO 44 11.789 13.503 -0.714
311 HD3 PRO 44 2HD PRO 44 12.615 13.392 -2.282
312 H LYS 45 H LYS 45 12.210 7.910 -1.303
313 HA LYS 45 HA LYS 45 10.276 7.736 0.814
314 HB2 LYS 45 1HB LYS 45 12.130 5.594 -0.242
315 HB3 LYS 45 2HB LYS 45 10.689 5.343 0.735
316 HG2 LYS 45 1HG LYS 45 9.257 5.921 -1.022
317 HG3 LYS 45 2HG LYS 45 10.557 6.673 -1.948
318 HD2 LYS 45 1HD LYS 45 10.655 3.756 -1.276
319 HD3 LYS 45 2HD LYS 45 9.700 4.329 -2.645
320 HE2 LYS 45 1HE LYS 45 11.740 3.842 -3.625
321 HE3 LYS 45 2HE LYS 45 11.868 5.574 -3.321
322 HZ1 LYS 45 1HZ LYS 45 13.385 5.267 -1.668
323 HZ2 LYS 45 2HZ LYS 45 13.775 3.940 -2.641
324 HZ3 LYS 45 3HZ LYS 45 12.823 3.725 -1.259
325 H LYS 46 H LYS 46 13.600 8.336 0.667
326 HA LYS 46 HA LYS 46 14.243 7.179 3.242
327 HB2 LYS 46 1HB LYS 46 16.461 7.847 2.842
328 HB3 LYS 46 2HB LYS 46 15.844 7.399 1.257
329 HG2 LYS 46 1HG LYS 46 15.518 9.722 0.684
330 HG3 LYS 46 2HG LYS 46 16.017 10.218 2.303
331 HD2 LYS 46 1HD LYS 46 17.870 8.533 0.690
332 HD3 LYS 46 2HD LYS 46 17.709 10.242 0.280
333 HE2 LYS 46 1HE LYS 46 19.520 10.067 1.804
334 HE3 LYS 46 2HE LYS 46 18.166 10.757 2.697
335 HZ1 LYS 46 1HZ LYS 46 19.616 8.702 3.566
336 HZ2 LYS 46 2HZ LYS 46 18.378 7.865 2.775
337 HZ3 LYS 46 3HZ LYS 46 18.004 8.958 4.011
338 H GLN 47 H GLN 47 12.357 9.633 2.551
339 HA GLN 47 HA GLN 47 13.256 11.209 4.865
340 HB2 GLN 47 1HB GLN 47 12.473 12.165 2.141
341 HB3 GLN 47 2HB GLN 47 12.124 13.174 3.538
342 HG2 GLN 47 1HG GLN 47 14.871 12.091 3.040
343 HG3 GLN 47 2HG GLN 47 14.306 13.573 2.271
344 HE21 GLN 47 1HE2 GLN 47 14.323 15.423 3.397
345 HE22 GLN 47 2HE2 GLN 47 14.773 15.561 5.060
346 H GLN 48 H GLN 48 10.583 10.186 2.809
347 HA GLN 48 HA GLN 48 8.559 11.268 4.527
348 HB2 GLN 48 1HB GLN 48 7.041 10.546 2.962
349 HB3 GLN 48 2HB GLN 48 8.485 10.654 1.964
350 HG2 GLN 48 1HG GLN 48 8.851 8.255 2.229
351 HG3 GLN 48 2HG GLN 48 7.404 8.147 3.230
352 HE21 GLN 48 1HE2 GLN 48 8.569 8.969 0.012
353 HE22 GLN 48 2HE2 GLN 48 7.104 8.581 -0.817
354 H GLN 49 H GLN 49 7.265 10.214 5.996
355 HA GLN 49 HA GLN 49 7.782 7.389 6.538
356 HB2 GLN 49 1HB GLN 49 9.332 8.593 7.992
357 HB3 GLN 49 2HB GLN 49 8.011 9.569 8.620
358 HG2 GLN 49 1HG GLN 49 7.009 7.644 9.651
359 HG3 GLN 49 2HG GLN 49 8.206 6.581 8.912
360 HE21 GLN 49 1HE2 GLN 49 7.839 6.494 11.588
361 HE22 GLN 49 2HE2 GLN 49 9.199 7.179 12.405
362 H LEU 50 H LEU 50 5.865 6.437 6.517
363 HA LEU 50 HA LEU 50 3.463 7.952 7.137
364 HB2 LEU 50 1HB LEU 50 3.905 5.161 6.098
365 HB3 LEU 50 2HB LEU 50 2.312 5.833 6.441
366 HG LEU 50 HG LEU 50 4.243 6.965 4.419
367 HD11 LEU 50 1HD1 LEU 50 3.002 5.898 2.721
368 HD12 LEU 50 2HD1 LEU 50 1.752 5.381 3.853
369 HD13 LEU 50 3HD1 LEU 50 3.356 4.652 3.918
370 HD21 LEU 50 1HD2 LEU 50 2.181 8.136 3.632
371 HD22 LEU 50 2HD2 LEU 50 2.752 8.651 5.219
372 HD23 LEU 50 3HD2 LEU 50 1.368 7.566 5.090
373 H GLU 51 H GLU 51 2.244 7.731 8.925
374 HA GLU 51 HA GLU 51 2.966 5.601 10.827
375 HB2 GLU 51 1HB GLU 51 2.414 8.513 11.401
376 HB3 GLU 51 2HB GLU 51 2.420 7.271 12.646
377 HG2 GLU 51 1HG GLU 51 4.697 6.932 12.488
378 HG3 GLU 51 2HG GLU 51 4.787 7.601 10.859
379 H PHE 52 H PHE 52 1.295 4.753 12.086
380 HA PHE 52 HA PHE 52 -1.423 5.680 11.520
381 HB2 PHE 52 1HB PHE 52 -0.892 3.847 9.920
382 HB3 PHE 52 2HB PHE 52 -0.591 2.781 11.289
383 HD1 PHE 52 2HD PHE 52 -3.214 4.887 9.720
384 HD2 PHE 52 1HD PHE 52 -2.332 1.584 12.255
385 HE1 PHE 52 2HE PHE 52 -5.602 4.299 9.779
386 HE2 PHE 52 1HE PHE 52 -4.719 0.990 12.318
387 HZ PHE 52 HZ PHE 52 -6.358 2.349 11.080
388 H GLN 53 H GLN 53 -2.365 6.042 13.407
389 HA GLN 53 HA GLN 53 -2.981 5.883 15.590
390 HB2 GLN 53 1HB GLN 53 -2.353 3.008 14.965
391 HB3 GLN 53 2HB GLN 53 -2.894 3.501 16.564
392 HG2 GLN 53 1HG GLN 53 -4.839 4.628 15.243
393 HG3 GLN 53 2HG GLN 53 -4.378 3.485 13.983
394 HE21 GLN 53 1HE2 GLN 53 -5.536 1.711 14.003
395 HE22 GLN 53 2HE2 GLN 53 -6.199 0.934 15.396
396 H GLY 54 H GLY 54 -0.303 6.684 15.006
397 HA2 GLY 54 1HA GLY 54 1.549 7.267 16.248
398 HA3 GLY 54 2HA GLY 54 0.820 6.448 17.621
399 H GLN 55 H GLN 55 1.808 5.219 14.435
400 HA GLN 55 HA GLN 55 3.875 3.603 15.732
401 HB2 GLN 55 1HB GLN 55 1.869 2.412 13.814
402 HB3 GLN 55 2HB GLN 55 3.139 1.564 14.687
403 HG2 GLN 55 1HG GLN 55 2.001 2.150 16.809
404 HG3 GLN 55 2HG GLN 55 0.688 2.852 15.864
405 HE21 GLN 55 1HE2 GLN 55 -0.404 1.399 14.340
406 HE22 GLN 55 2HE2 GLN 55 -0.600 -0.260 14.780
407 H VAL 56 H VAL 56 5.354 2.586 14.152
408 HA VAL 56 HA VAL 56 5.711 4.355 11.832
409 HB VAL 56 HB VAL 56 7.736 2.563 13.180
410 HG11 VAL 56 1HG1 VAL 56 8.961 2.838 11.349
411 HG12 VAL 56 2HG1 VAL 56 7.722 3.868 10.630
412 HG13 VAL 56 3HG1 VAL 56 8.973 4.574 11.654
413 HG21 VAL 56 1HG2 VAL 56 8.735 4.761 13.891
414 HG22 VAL 56 2HG2 VAL 56 7.232 5.526 13.375
415 HG23 VAL 56 3HG2 VAL 56 7.213 4.336 14.676
416 H LEU 57 H LEU 57 4.868 3.509 10.038
417 HA LEU 57 HA LEU 57 4.565 0.698 9.628
418 HB2 LEU 57 1HB LEU 57 4.359 2.833 7.523
419 HB3 LEU 57 2HB LEU 57 3.574 1.256 7.552
420 HG LEU 57 HG LEU 57 2.927 3.602 9.336
421 HD11 LEU 57 1HD1 LEU 57 2.166 3.930 7.058
422 HD12 LEU 57 2HD1 LEU 57 0.796 3.607 8.120
423 HD13 LEU 57 3HD1 LEU 57 1.407 2.337 7.060
424 HD21 LEU 57 1HD2 LEU 57 2.589 0.901 9.870
425 HD22 LEU 57 2HD2 LEU 57 1.018 1.427 9.267
426 HD23 LEU 57 3HD2 LEU 57 1.751 2.243 10.649
427 H GLN 58 H GLN 58 6.017 -0.683 8.867
428 HA GLN 58 HA GLN 58 8.564 0.256 7.905
429 HB2 GLN 58 1HB GLN 58 7.398 -2.463 8.443
430 HB3 GLN 58 2HB GLN 58 8.950 -2.281 7.636
431 HG2 GLN 58 1HG GLN 58 8.189 -1.627 10.443
432 HG3 GLN 58 2HG GLN 58 9.555 -2.563 9.839
433 HE21 GLN 58 1HE2 GLN 58 9.029 0.015 11.522
434 HE22 GLN 58 2HE2 GLN 58 10.241 1.096 10.932
435 H ASP 59 H ASP 59 9.401 -1.389 6.001
436 HA ASP 59 HA ASP 59 7.663 -0.722 3.732
437 HB2 ASP 59 1HB ASP 59 9.884 -1.368 2.470
438 HB3 ASP 59 2HB ASP 59 9.716 0.210 3.236
439 H TRP 60 H TRP 60 9.586 -3.377 5.081
440 HA TRP 60 HA TRP 60 8.671 -5.263 3.116
441 HB2 TRP 60 1HB TRP 60 10.114 -6.780 4.101
442 HB3 TRP 60 2HB TRP 60 10.878 -5.254 4.540
443 HD1 TRP 60 HD TRP 60 8.885 -8.150 6.060
444 HE1 TRP 60 1HE TRP 60 9.150 -8.073 8.619
445 HE3 TRP 60 3HE TRP 60 11.348 -3.690 6.488
446 HZ2 TRP 60 2HZ TRP 60 10.256 -6.350 10.562
447 HZ3 TRP 60 3HZ TRP 60 11.973 -2.899 8.732
448 HH2 TRP 60 HH TRP 60 11.437 -4.202 10.726
449 H LEU 61 H LEU 61 7.109 -3.820 5.589
450 HA LEU 61 HA LEU 61 5.620 -6.195 6.432
451 HB2 LEU 61 1HB LEU 61 5.710 -3.365 7.443
452 HB3 LEU 61 2HB LEU 61 4.514 -4.534 7.998
453 HG LEU 61 HG LEU 61 7.482 -4.527 8.459
454 HD11 LEU 61 1HD1 LEU 61 6.980 -4.155 10.630
455 HD12 LEU 61 2HD1 LEU 61 5.499 -5.110 10.567
456 HD13 LEU 61 3HD1 LEU 61 5.514 -3.464 9.933
457 HD21 LEU 61 1HD2 LEU 61 6.817 -6.761 9.690
458 HD22 LEU 61 2HD2 LEU 61 7.300 -6.757 7.993
459 HD23 LEU 61 3HD2 LEU 61 5.590 -6.822 8.424
460 H GLY 62 H GLY 62 3.790 -6.719 5.446
461 HA2 GLY 62 1HA GLY 62 2.632 -5.259 3.368
462 HA3 GLY 62 2HA GLY 62 1.843 -6.562 4.243
463 H LEU 63 H LEU 63 0.020 -4.991 3.597
464 HA LEU 63 HA LEU 63 -0.247 -2.678 5.316
465 HB2 LEU 63 1HB LEU 63 -1.836 -3.897 3.111
466 HB3 LEU 63 2HB LEU 63 -2.640 -2.794 4.226
467 HG LEU 63 HG LEU 63 -0.670 -1.192 3.612
468 HD11 LEU 63 1HD1 LEU 63 0.022 -1.506 1.245
469 HD12 LEU 63 2HD1 LEU 63 -0.689 -3.119 1.296
470 HD13 LEU 63 3HD1 LEU 63 0.670 -2.721 2.348
471 HD21 LEU 63 1HD2 LEU 63 -2.010 -0.244 1.844
472 HD22 LEU 63 2HD2 LEU 63 -3.068 -0.850 3.118
473 HD23 LEU 63 3HD2 LEU 63 -2.865 -1.771 1.627
474 H GLY 64 H GLY 64 -1.626 -5.917 5.038
475 HA2 GLY 64 1HA GLY 64 -3.638 -5.652 6.984
476 HA3 GLY 64 2HA GLY 64 -2.890 -7.164 6.492
477 H ILE 65 H ILE 65 -0.204 -6.187 7.283
478 HA ILE 65 HA ILE 65 -0.028 -7.295 9.811
479 HB ILE 65 HB ILE 65 1.807 -5.205 8.633
480 HG12 ILE 65 1HG1 ILE 65 1.459 -7.214 7.201
481 HG13 ILE 65 2HG1 ILE 65 3.113 -7.056 7.781
482 HG21 ILE 65 1HG2 ILE 65 2.962 -7.218 10.391
483 HG22 ILE 65 2HG2 ILE 65 3.175 -5.468 10.378
484 HG23 ILE 65 3HG2 ILE 65 1.788 -6.181 11.201
485 HD11 ILE 65 1HD1 ILE 65 1.557 -9.310 7.912
486 HD12 ILE 65 2HD1 ILE 65 3.028 -9.008 8.837
487 HD13 ILE 65 3HD1 ILE 65 1.453 -8.655 9.546
488 H TYR 66 H TYR 66 -0.470 -3.913 8.890
489 HA TYR 66 HA TYR 66 -0.601 -3.134 11.706
490 HB2 TYR 66 1HB TYR 66 -0.395 -1.595 9.130
491 HB3 TYR 66 2HB TYR 66 -0.860 -0.797 10.628
492 HD1 TYR 66 2HD TYR 66 0.765 -1.339 12.675
493 HD2 TYR 66 1HD TYR 66 1.841 -1.600 8.567
494 HE1 TYR 66 2HE TYR 66 3.135 -1.096 13.287
495 HE2 TYR 66 1HE TYR 66 4.214 -1.359 9.167
496 HH TYR 66 HH TYR 66 5.691 -1.481 10.923
497 H GLY 67 H GLY 67 -2.685 -4.730 10.250
498 HA2 GLY 67 1HA GLY 67 -4.975 -4.812 10.039
499 HA3 GLY 67 2HA GLY 67 -4.962 -3.802 11.477
500 H ILE 68 H ILE 68 -3.559 -2.697 8.488
501 HA ILE 68 HA ILE 68 -5.163 -0.359 8.457
502 HB ILE 68 HB ILE 68 -3.342 -1.517 6.347
503 HG12 ILE 68 1HG1 ILE 68 -2.916 0.852 8.173
504 HG13 ILE 68 2HG1 ILE 68 -2.350 -0.772 8.548
505 HG21 ILE 68 1HG2 ILE 68 -3.755 1.302 6.090
506 HG22 ILE 68 2HG2 ILE 68 -4.033 0.024 4.909
507 HG23 ILE 68 3HG2 ILE 68 -5.309 0.469 6.042
508 HD11 ILE 68 1HD1 ILE 68 -0.786 1.001 7.410
509 HD12 ILE 68 2HD1 ILE 68 -0.703 -0.707 6.976
510 HD13 ILE 68 3HD1 ILE 68 -1.578 0.424 5.944
511 H GLN 69 H GLN 69 -7.081 0.021 7.555
512 HA GLN 69 HA GLN 69 -8.147 -1.977 5.670
513 HB2 GLN 69 1HB GLN 69 -10.323 -1.650 6.557
514 HB3 GLN 69 2HB GLN 69 -9.254 -1.847 7.939
515 HG2 GLN 69 1HG GLN 69 -9.215 0.574 8.256
516 HG3 GLN 69 2HG GLN 69 -10.291 0.769 6.873
517 HE21 GLN 69 1HE2 GLN 69 -10.018 -0.304 10.168
518 HE22 GLN 69 2HE2 GLN 69 -11.712 -0.386 10.495
519 H ASP 70 H ASP 70 -10.128 -0.930 4.447
520 HA ASP 70 HA ASP 70 -9.032 1.120 2.807
521 HB2 ASP 70 1HB ASP 70 -11.172 1.019 1.606
522 HB3 ASP 70 2HB ASP 70 -10.532 -0.595 1.902
523 H SER 71 H SER 71 -10.095 3.182 2.329
524 HA SER 71 HA SER 71 -10.765 5.258 2.978
525 HB2 SER 71 1HB SER 71 -12.721 3.456 4.359
526 HB3 SER 71 2HB SER 71 -12.755 5.187 4.695
527 HG SER 71 HG SER 71 -14.116 4.430 2.912
528 H ASP 72 H ASP 72 -8.528 4.157 4.332
529 HA ASP 72 HA ASP 72 -8.831 5.078 7.095
530 HB2 ASP 72 1HB ASP 72 -6.837 3.911 7.603
531 HB3 ASP 72 2HB ASP 72 -7.726 2.854 6.509
532 H THR 73 H THR 73 -6.945 6.333 7.995
533 HA THR 73 HA THR 73 -6.055 8.341 6.027
534 HB THR 73 HB THR 73 -6.634 8.804 8.960
535 HG1 THR 73 1HG THR 73 -8.553 9.572 8.328
536 HG21 THR 73 1HG2 THR 73 -6.607 11.242 7.733
537 HG22 THR 73 2HG2 THR 73 -5.329 10.391 6.866
538 HG23 THR 73 3HG2 THR 73 -5.252 10.547 8.621
539 H LEU 74 H LEU 74 -3.930 8.706 5.863
540 HA LEU 74 HA LEU 74 -2.171 7.655 7.980
541 HB2 LEU 74 1HB LEU 74 -1.548 7.694 5.033
542 HB3 LEU 74 2HB LEU 74 -0.573 6.984 6.318
543 HG LEU 74 HG LEU 74 -3.310 5.987 5.541
544 HD11 LEU 74 1HD1 LEU 74 -0.575 5.173 4.606
545 HD12 LEU 74 2HD1 LEU 74 -1.987 5.596 3.639
546 HD13 LEU 74 3HD1 LEU 74 -1.960 4.083 4.543
547 HD21 LEU 74 1HD2 LEU 74 -1.616 5.489 7.760
548 HD22 LEU 74 2HD2 LEU 74 -1.626 4.043 6.749
549 HD23 LEU 74 3HD2 LEU 74 -3.145 4.712 7.347
550 H ILE 75 H ILE 75 -0.731 9.045 8.790
551 HA ILE 75 HA ILE 75 -0.647 11.740 7.712
552 HB ILE 75 HB ILE 75 0.825 10.717 10.135
553 HG12 ILE 75 1HG1 ILE 75 -1.609 10.216 10.288
554 HG13 ILE 75 2HG1 ILE 75 -1.070 11.386 11.487
555 HG21 ILE 75 1HG2 ILE 75 1.650 12.828 9.531
556 HG22 ILE 75 2HG2 ILE 75 0.046 13.433 9.123
557 HG23 ILE 75 3HG2 ILE 75 0.479 13.152 10.809
558 HD11 ILE 75 1HD1 ILE 75 -2.811 11.773 9.109
559 HD12 ILE 75 2HD1 ILE 75 -3.015 12.343 10.766
560 HD13 ILE 75 3HD1 ILE 75 -1.846 13.124 9.701
561 H LEU 76 H LEU 76 1.160 12.774 6.931
562 HA LEU 76 HA LEU 76 3.497 11.060 6.400
563 HB2 LEU 76 1HB LEU 76 2.226 11.554 4.376
564 HB3 LEU 76 2HB LEU 76 2.367 13.280 4.702
565 HG LEU 76 HG LEU 76 4.908 12.888 4.532
566 HD11 LEU 76 1HD1 LEU 76 3.880 10.251 3.931
567 HD12 LEU 76 2HD1 LEU 76 5.533 10.773 4.255
568 HD13 LEU 76 3HD1 LEU 76 4.878 10.881 2.621
569 HD21 LEU 76 1HD2 LEU 76 4.101 14.192 2.841
570 HD22 LEU 76 2HD2 LEU 76 2.893 13.004 2.349
571 HD23 LEU 76 3HD2 LEU 76 4.587 12.773 1.912
572 H SER 77 H SER 77 5.392 11.744 7.156
573 HA SER 77 HA SER 77 5.837 14.594 7.614
574 HB2 SER 77 1HB SER 77 6.198 12.489 9.761
575 HB3 SER 77 2HB SER 77 6.707 14.172 9.893
576 HG SER 77 HG SER 77 4.738 14.676 10.394
577 H LYS 78 H LYS 78 7.848 15.213 7.105
578 HA LYS 78 HA LYS 78 9.665 13.284 6.004
579 HB2 LYS 78 1HB LYS 78 11.022 15.173 5.382
580 HB3 LYS 78 2HB LYS 78 9.339 15.561 5.051
581 HG2 LYS 78 1HG LYS 78 9.348 16.705 7.340
582 HG3 LYS 78 2HG LYS 78 11.107 16.598 7.235
583 HD2 LYS 78 1HD LYS 78 9.325 17.900 5.176
584 HD3 LYS 78 2HD LYS 78 10.222 18.762 6.428
585 HE2 LYS 78 1HE LYS 78 11.681 16.903 4.609
586 HE3 LYS 78 2HE LYS 78 11.204 18.490 4.008
587 HZ1 LYS 78 1HZ LYS 78 12.305 19.036 6.426
588 HZ2 LYS 78 2HZ LYS 78 13.085 19.196 4.934
589 HZ3 LYS 78 3HZ LYS 78 13.290 17.787 5.848
590 H LYS 79 H LYS 79 11.676 12.680 6.756
591 HA LYS 79 HA LYS 79 12.002 12.548 9.567
592 HB2 LYS 79 1HB LYS 79 14.139 12.029 7.500
593 HB3 LYS 79 2HB LYS 79 14.031 11.359 9.122
594 HG2 LYS 79 1HG LYS 79 11.735 10.430 8.181
595 HG3 LYS 79 2HG LYS 79 12.594 10.591 6.647
596 HD2 LYS 79 1HD LYS 79 14.354 9.157 7.407
597 HD3 LYS 79 2HD LYS 79 13.703 9.141 9.048
598 HE2 LYS 79 1HE LYS 79 11.730 7.958 8.280
599 HE3 LYS 79 2HE LYS 79 12.298 8.044 6.613
600 HZ1 LYS 79 1HZ LYS 79 13.888 6.462 6.975
601 HZ2 LYS 79 2HZ LYS 79 12.692 5.917 8.040
602 HZ3 LYS 79 3HZ LYS 79 14.018 6.786 8.631
603 H LYS 80 H LYS 80 13.244 13.705 10.953
604 HA LYS 80 HA LYS 80 14.264 16.250 9.989
605 HB2 LYS 80 1HB LYS 80 12.869 15.724 12.179
606 HB3 LYS 80 2HB LYS 80 14.466 15.422 12.850
607 HG2 LYS 80 1HG LYS 80 14.042 17.944 11.344
608 HG3 LYS 80 2HG LYS 80 13.337 17.802 12.956
609 HD2 LYS 80 1HD LYS 80 16.178 17.000 12.586
610 HD3 LYS 80 2HD LYS 80 15.791 18.722 12.587
611 HE2 LYS 80 1HE LYS 80 15.024 16.768 14.753
612 HE3 LYS 80 2HE LYS 80 16.400 17.868 14.824
613 HZ1 LYS 80 1HZ LYS 80 13.871 18.409 15.678
614 HZ2 LYS 80 2HZ LYS 80 13.956 19.214 14.192
615 HZ3 LYS 80 3HZ LYS 80 15.090 19.550 15.402
616 H GLY 81 H GLY 81 16.164 15.782 8.915
617 HA2 GLY 81 1HA GLY 81 18.433 15.473 8.730
618 HA3 GLY 81 2HA GLY 81 18.506 15.576 10.483
619 H SER 82 H SER 82 20.189 13.893 9.110
620 HA SER 82 HA SER 82 19.260 11.289 10.076
621 HB2 SER 82 1HB SER 82 20.171 10.181 8.044
622 HB3 SER 82 2HB SER 82 18.803 11.234 7.687
623 HG SER 82 HG SER 82 21.426 12.233 7.523
624 H GLY 83 H GLY 83 20.977 9.783 10.521
625 HA2 GLY 83 1HA GLY 83 23.635 11.048 10.740
626 HA3 GLY 83 2HA GLY 83 22.922 10.189 12.098
627 HA PRO 84 HA PRO 84 23.991 6.907 8.682
628 HB2 PRO 84 1HB PRO 84 25.707 7.750 6.755
629 HB3 PRO 84 2HB PRO 84 23.951 7.860 6.592
630 HG2 PRO 84 1HG PRO 84 25.916 9.978 7.376
631 HG3 PRO 84 2HG PRO 84 24.527 10.091 6.280
632 HD2 PRO 84 1HD PRO 84 24.441 10.978 8.837
633 HD3 PRO 84 2HD PRO 84 23.020 10.310 8.009
634 H SER 85 H SER 85 26.463 9.347 9.403
635 HA SER 85 HA SER 85 28.683 7.639 9.449
636 HB2 SER 85 1HB SER 85 28.595 10.222 9.522
637 HB3 SER 85 2HB SER 85 28.426 10.026 11.267
638 HG SER 85 HG SER 85 30.472 8.617 10.002
639 H SER 86 H SER 86 28.162 5.725 10.511
640 HA SER 86 HA SER 86 27.279 5.780 13.263
641 HB2 SER 86 1HB SER 86 27.212 3.378 13.114
642 HB3 SER 86 2HB SER 86 26.548 4.026 11.615
643 HG SER 86 HG SER 86 27.968 2.718 10.759
644 H GLY 87 H GLY 87 28.452 4.960 15.043
645 HA2 GLY 87 1HA GLY 87 30.685 3.840 15.596
646 HA3 GLY 87 2HA GLY 87 31.371 5.184 14.695
Start of MODEL 4
1 H1 GLY 1 H GLY 1 -4.792 5.438 -16.046
2 HA2 GLY 1 1HA GLY 1 -6.302 3.572 -16.643
3 HA3 GLY 1 2HA GLY 1 -5.307 4.036 -18.015
4 H SER 2 H SER 2 -4.567 2.160 -15.084
5 HA SER 2 HA SER 2 -3.875 -0.111 -16.827
6 HB2 SER 2 1HB SER 2 -2.365 0.728 -14.341
7 HB3 SER 2 2HB SER 2 -1.958 -0.609 -15.417
8 HG SER 2 HG SER 2 -1.025 1.757 -15.614
9 H SER 3 H SER 3 -4.287 -2.169 -16.028
10 HA SER 3 HA SER 3 -6.548 -2.630 -14.591
11 HB2 SER 3 1HB SER 3 -5.103 -4.306 -15.882
12 HB3 SER 3 2HB SER 3 -4.186 -4.496 -14.388
13 HG SER 3 HG SER 3 -6.272 -5.827 -14.985
14 H GLY 4 H GLY 4 -7.073 -1.898 -12.638
15 HA2 GLY 4 1HA GLY 4 -5.511 -2.677 -10.345
16 HA3 GLY 4 2HA GLY 4 -5.494 -0.945 -10.642
17 H SER 5 H SER 5 -8.154 -3.233 -11.120
18 HA SER 5 HA SER 5 -10.040 -1.525 -9.884
19 HB2 SER 5 1HB SER 5 -10.096 -4.377 -10.825
20 HB3 SER 5 2HB SER 5 -11.456 -3.714 -9.919
21 HG SER 5 HG SER 5 -12.070 -2.821 -11.705
22 H SER 6 H SER 6 -8.849 -4.720 -8.829
23 HA SER 6 HA SER 6 -9.971 -4.540 -6.243
24 HB2 SER 6 1HB SER 6 -9.456 -6.714 -7.086
25 HB3 SER 6 2HB SER 6 -7.774 -6.272 -7.384
26 HG SER 6 HG SER 6 -7.342 -6.795 -5.404
27 H GLY 7 H GLY 7 -9.216 -3.732 -4.364
28 HA2 GLY 7 1HA GLY 7 -6.830 -3.398 -3.282
29 HA3 GLY 7 2HA GLY 7 -6.774 -2.133 -4.500
30 H ILE 8 H ILE 8 -6.598 -1.747 -1.681
31 HA ILE 8 HA ILE 8 -9.176 -0.596 -0.932
32 HB ILE 8 HB ILE 8 -8.228 -0.251 1.268
33 HG12 ILE 8 1HG1 ILE 8 -5.662 -1.569 0.483
34 HG13 ILE 8 2HG1 ILE 8 -5.864 0.149 0.157
35 HG21 ILE 8 1HG2 ILE 8 -8.007 -2.913 -0.029
36 HG22 ILE 8 2HG2 ILE 8 -7.389 -2.737 1.613
37 HG23 ILE 8 3HG2 ILE 8 -9.077 -2.367 1.262
38 HD11 ILE 8 1HD1 ILE 8 -6.494 0.362 2.616
39 HD12 ILE 8 2HD1 ILE 8 -5.833 -1.264 2.796
40 HD13 ILE 8 3HD1 ILE 8 -4.802 0.049 2.228
41 H GLN 9 H GLN 9 -9.193 1.594 0.041
42 HA GLN 9 HA GLN 9 -7.432 3.392 -1.483
43 HB2 GLN 9 1HB GLN 9 -9.752 3.679 -2.077
44 HB3 GLN 9 2HB GLN 9 -10.213 3.821 -0.386
45 HG2 GLN 9 1HG GLN 9 -8.885 5.898 -0.239
46 HG3 GLN 9 2HG GLN 9 -8.548 5.768 -1.964
47 HE21 GLN 9 1HE2 GLN 9 -10.093 6.334 -3.423
48 HE22 GLN 9 2HE2 GLN 9 -11.605 7.050 -2.989
49 H VAL 10 H VAL 10 -6.190 4.858 -0.458
50 HA VAL 10 HA VAL 10 -6.565 5.217 2.438
51 HB VAL 10 HB VAL 10 -4.094 5.241 2.713
52 HG11 VAL 10 1HG1 VAL 10 -4.968 2.608 1.561
53 HG12 VAL 10 2HG1 VAL 10 -3.874 2.911 2.913
54 HG13 VAL 10 3HG1 VAL 10 -5.602 3.221 3.088
55 HG21 VAL 10 1HG2 VAL 10 -4.227 4.594 -0.192
56 HG22 VAL 10 2HG2 VAL 10 -3.115 5.652 0.677
57 HG23 VAL 10 3HG2 VAL 10 -2.926 3.901 0.776
58 H PHE 11 H PHE 11 -6.412 7.267 3.143
59 HA PHE 11 HA PHE 11 -5.876 9.336 1.152
60 HB2 PHE 11 1HB PHE 11 -6.994 9.644 3.944
61 HB3 PHE 11 2HB PHE 11 -6.979 10.864 2.675
62 HD1 PHE 11 1HD PHE 11 -8.216 10.211 0.473
63 HD2 PHE 11 2HD PHE 11 -8.874 8.351 4.245
64 HE1 PHE 11 1HE PHE 11 -10.422 9.438 -0.297
65 HE2 PHE 11 2HE PHE 11 -11.080 7.575 3.481
66 HZ PHE 11 HZ PHE 11 -11.857 8.117 1.207
67 H VAL 12 H VAL 12 -3.866 10.069 1.023
68 HA VAL 12 HA VAL 12 -2.125 9.981 3.365
69 HB VAL 12 HB VAL 12 -1.557 10.541 0.456
70 HG11 VAL 12 1HG1 VAL 12 0.888 10.310 1.417
71 HG12 VAL 12 2HG1 VAL 12 0.059 11.867 1.387
72 HG13 VAL 12 3HG1 VAL 12 0.123 10.929 2.880
73 HG21 VAL 12 1HG2 VAL 12 -0.575 8.305 2.220
74 HG22 VAL 12 2HG2 VAL 12 -1.996 8.182 1.182
75 HG23 VAL 12 3HG2 VAL 12 -0.405 8.451 0.470
76 H LYS 13 H LYS 13 -2.359 11.684 4.676
77 HA LYS 13 HA LYS 13 -2.967 14.315 3.628
78 HB2 LYS 13 1HB LYS 13 -3.949 13.371 5.761
79 HB3 LYS 13 2HB LYS 13 -2.359 13.563 6.488
80 HG2 LYS 13 1HG LYS 13 -2.451 15.907 6.329
81 HG3 LYS 13 2HG LYS 13 -3.826 15.855 5.223
82 HD2 LYS 13 1HD LYS 13 -5.279 15.082 6.967
83 HD3 LYS 13 2HD LYS 13 -3.920 14.884 8.076
84 HE2 LYS 13 1HE LYS 13 -4.771 16.902 8.774
85 HE3 LYS 13 2HE LYS 13 -3.555 17.431 7.612
86 HZ1 LYS 13 1HZ LYS 13 -5.948 18.393 7.523
87 HZ2 LYS 13 2HZ LYS 13 -6.307 16.962 6.697
88 HZ3 LYS 13 3HZ LYS 13 -5.139 18.021 6.084
89 H ASN 14 H ASN 14 -1.315 15.345 2.681
90 HA ASN 14 HA ASN 14 1.408 14.997 3.443
91 HB2 ASN 14 1HB ASN 14 1.863 16.808 1.834
92 HB3 ASN 14 2HB ASN 14 0.799 15.584 1.149
93 HD21 ASN 14 1HD2 ASN 14 0.306 17.315 -0.372
94 HD22 ASN 14 2HD2 ASN 14 -0.915 18.465 0.042
95 HA PRO 15 HA PRO 15 1.836 17.934 6.682
96 HB2 PRO 15 1HB PRO 15 4.417 18.693 6.321
97 HB3 PRO 15 2HB PRO 15 3.962 17.112 6.967
98 HG2 PRO 15 1HG PRO 15 4.766 17.860 4.182
99 HG3 PRO 15 2HG PRO 15 5.247 16.450 5.145
100 HD2 PRO 15 1HD PRO 15 3.340 16.322 3.227
101 HD3 PRO 15 2HD PRO 15 3.295 15.314 4.687
102 H ASP 16 H ASP 16 1.725 18.801 3.474
103 HA ASP 16 HA ASP 16 2.345 21.617 3.893
104 HB2 ASP 16 1HB ASP 16 1.561 20.040 1.439
105 HB3 ASP 16 2HB ASP 16 1.778 21.788 1.435
106 H GLY 17 H GLY 17 -0.392 19.489 3.573
107 HA2 GLY 17 1HA GLY 17 -2.417 20.415 4.723
108 HA3 GLY 17 2HA GLY 17 -2.181 21.837 3.718
109 H GLY 18 H GLY 18 -3.341 18.571 3.848
110 HA2 GLY 18 1HA GLY 18 -5.368 18.536 2.200
111 HA3 GLY 18 2HA GLY 18 -4.080 18.644 1.010
112 H SER 19 H SER 19 -5.807 16.537 0.926
113 HA SER 19 HA SER 19 -4.009 14.315 1.533
114 HB2 SER 19 1HB SER 19 -5.920 14.709 3.315
115 HB3 SER 19 2HB SER 19 -6.918 13.907 2.103
116 HG SER 19 HG SER 19 -4.766 12.905 3.594
117 H TYR 20 H TYR 20 -4.096 12.649 0.076
118 HA TYR 20 HA TYR 20 -5.999 12.964 -2.153
119 HB2 TYR 20 1HB TYR 20 -3.235 11.802 -2.445
120 HB3 TYR 20 2HB TYR 20 -4.322 12.361 -3.712
121 HD1 TYR 20 2HD TYR 20 -5.115 14.992 -2.966
122 HD2 TYR 20 1HD TYR 20 -1.341 13.114 -2.385
123 HE1 TYR 20 2HE TYR 20 -4.029 17.198 -2.927
124 HE2 TYR 20 1HE TYR 20 -0.245 15.315 -2.343
125 HH TYR 20 HH TYR 20 -1.658 18.061 -1.777
126 H ALA 21 H ALA 21 -6.846 11.100 -3.083
127 HA ALA 21 HA ALA 21 -6.878 8.788 -1.326
128 HB1 ALA 21 1HB ALA 21 -9.025 9.035 -1.954
129 HB2 ALA 21 2HB ALA 21 -8.601 9.856 -3.457
130 HB3 ALA 21 3HB ALA 21 -8.516 8.098 -3.359
131 H TYR 22 H TYR 22 -5.256 7.386 -1.555
132 HA TYR 22 HA TYR 22 -4.142 6.872 -4.207
133 HB2 TYR 22 1HB TYR 22 -3.229 6.234 -1.411
134 HB3 TYR 22 2HB TYR 22 -2.492 5.466 -2.813
135 HD1 TYR 22 2HD TYR 22 -3.222 8.798 -1.328
136 HD2 TYR 22 1HD TYR 22 -0.781 6.544 -3.986
137 HE1 TYR 22 2HE TYR 22 -1.741 10.741 -1.606
138 HE2 TYR 22 1HE TYR 22 0.707 8.481 -4.271
139 HH TYR 22 HH TYR 22 1.318 10.522 -3.100
140 H ALA 23 H ALA 23 -3.682 4.622 -4.833
141 HA ALA 23 HA ALA 23 -5.723 2.750 -3.822
142 HB1 ALA 23 1HB ALA 23 -5.843 1.858 -6.166
143 HB2 ALA 23 2HB ALA 23 -6.498 3.481 -5.947
144 HB3 ALA 23 3HB ALA 23 -4.906 3.263 -6.674
145 H ILE 24 H ILE 24 -4.731 1.141 -2.806
146 HA ILE 24 HA ILE 24 -2.572 -0.276 -4.138
147 HB ILE 24 HB ILE 24 -1.375 1.377 -2.782
148 HG12 ILE 24 1HG1 ILE 24 -1.081 -1.259 -1.367
149 HG13 ILE 24 2HG1 ILE 24 -0.655 -1.101 -3.067
150 HG21 ILE 24 1HG2 ILE 24 -2.772 0.119 -0.423
151 HG22 ILE 24 2HG2 ILE 24 -1.535 1.374 -0.356
152 HG23 ILE 24 3HG2 ILE 24 -3.105 1.723 -1.078
153 HD11 ILE 24 1HD1 ILE 24 0.535 1.028 -1.577
154 HD12 ILE 24 2HD1 ILE 24 0.929 -0.524 -0.835
155 HD13 ILE 24 3HD1 ILE 24 1.305 -0.237 -2.534
156 H ASN 25 H ASN 25 -2.564 -2.426 -3.704
157 HA ASN 25 HA ASN 25 -4.827 -3.535 -2.372
158 HB2 ASN 25 1HB ASN 25 -2.425 -4.648 -3.771
159 HB3 ASN 25 2HB ASN 25 -3.407 -5.717 -2.775
160 HD21 ASN 25 1HD2 ASN 25 -3.850 -6.851 -4.746
161 HD22 ASN 25 2HD2 ASN 25 -5.076 -6.272 -5.817
162 HA PRO 26 HA PRO 26 -3.275 -3.915 1.728
163 HB2 PRO 26 1HB PRO 26 -4.796 -5.994 2.583
164 HB3 PRO 26 2HB PRO 26 -5.441 -4.366 2.347
165 HG2 PRO 26 1HG PRO 26 -5.600 -6.747 0.540
166 HG3 PRO 26 2HG PRO 26 -6.860 -5.570 0.954
167 HD2 PRO 26 1HD PRO 26 -5.471 -5.460 -1.368
168 HD3 PRO 26 2HD PRO 26 -6.069 -4.006 -0.542
169 H ASN 27 H ASN 27 -3.127 -6.524 -0.546
170 HA ASN 27 HA ASN 27 -1.593 -8.277 1.149
171 HB2 ASN 27 1HB ASN 27 -2.139 -8.370 -1.827
172 HB3 ASN 27 2HB ASN 27 -1.346 -9.645 -0.906
173 HD21 ASN 27 1HD2 ASN 27 -3.828 -9.679 -2.453
174 HD22 ASN 27 2HD2 ASN 27 -5.060 -10.196 -1.357
175 H SER 28 H SER 28 -0.956 -5.750 -1.139
176 HA SER 28 HA SER 28 1.704 -6.394 -1.802
177 HB2 SER 28 1HB SER 28 0.097 -4.619 -2.832
178 HB3 SER 28 2HB SER 28 0.749 -3.553 -1.588
179 HG SER 28 HG SER 28 2.569 -5.015 -3.108
180 H PHE 29 H PHE 29 3.490 -4.659 -1.204
181 HA PHE 29 HA PHE 29 3.733 -4.795 1.707
182 HB2 PHE 29 1HB PHE 29 5.863 -4.056 -0.306
183 HB3 PHE 29 2HB PHE 29 6.100 -4.494 1.382
184 HD1 PHE 29 2HD PHE 29 5.135 -6.879 2.020
185 HD2 PHE 29 1HD PHE 29 6.247 -5.654 -1.901
186 HE1 PHE 29 2HE PHE 29 5.418 -9.234 1.369
187 HE2 PHE 29 1HE PHE 29 6.531 -8.008 -2.559
188 HZ PHE 29 HZ PHE 29 6.118 -9.802 -0.923
189 H ILE 30 H ILE 30 4.165 -3.019 2.992
190 HA ILE 30 HA ILE 30 2.898 -0.685 2.678
191 HB ILE 30 HB ILE 30 5.589 -1.085 3.977
192 HG12 ILE 30 1HG1 ILE 30 3.635 -2.331 4.898
193 HG13 ILE 30 2HG1 ILE 30 4.325 -1.180 6.036
194 HG21 ILE 30 1HG2 ILE 30 5.772 1.131 4.086
195 HG22 ILE 30 2HG2 ILE 30 4.146 1.367 3.449
196 HG23 ILE 30 3HG2 ILE 30 4.386 1.105 5.176
197 HD11 ILE 30 1HD1 ILE 30 1.729 -1.067 4.575
198 HD12 ILE 30 2HD1 ILE 30 2.063 -0.849 6.293
199 HD13 ILE 30 3HD1 ILE 30 2.495 0.416 5.142
200 H LEU 31 H LEU 31 6.303 -1.130 1.713
201 HA LEU 31 HA LEU 31 6.943 1.285 0.695
202 HB2 LEU 31 1HB LEU 31 8.548 -0.440 0.602
203 HB3 LEU 31 2HB LEU 31 7.515 -1.450 -0.406
204 HG LEU 31 HG LEU 31 7.825 0.523 -2.123
205 HD11 LEU 31 1HD1 LEU 31 9.958 0.951 -0.103
206 HD12 LEU 31 2HD1 LEU 31 9.081 2.119 -1.090
207 HD13 LEU 31 3HD1 LEU 31 10.370 1.152 -1.806
208 HD21 LEU 31 1HD2 LEU 31 10.075 -0.682 -2.752
209 HD22 LEU 31 2HD2 LEU 31 8.529 -1.521 -2.877
210 HD23 LEU 31 3HD2 LEU 31 9.574 -1.800 -1.483
211 H GLY 32 H GLY 32 5.087 -1.204 -1.043
212 HA2 GLY 32 1HA GLY 32 4.740 -0.141 -3.498
213 HA3 GLY 32 2HA GLY 32 3.425 -0.919 -2.630
214 H LEU 33 H LEU 33 3.067 0.963 -0.578
215 HA LEU 33 HA LEU 33 1.461 2.881 -1.945
216 HB2 LEU 33 1HB LEU 33 0.670 2.067 0.134
217 HB3 LEU 33 2HB LEU 33 2.179 2.477 0.946
218 HG LEU 33 HG LEU 33 1.647 4.865 0.698
219 HD11 LEU 33 1HD1 LEU 33 -1.094 4.826 0.152
220 HD12 LEU 33 2HD1 LEU 33 -0.346 3.831 -1.097
221 HD13 LEU 33 3HD1 LEU 33 0.193 5.492 -0.854
222 HD21 LEU 33 1HD2 LEU 33 0.332 4.923 2.553
223 HD22 LEU 33 2HD2 LEU 33 0.761 3.213 2.578
224 HD23 LEU 33 3HD2 LEU 33 -0.798 3.722 1.929
225 H LYS 34 H LYS 34 4.254 3.255 0.244
226 HA LYS 34 HA LYS 34 4.625 5.971 0.028
227 HB2 LYS 34 1HB LYS 34 6.762 3.839 0.210
228 HB3 LYS 34 2HB LYS 34 7.005 5.546 0.557
229 HG2 LYS 34 1HG LYS 34 5.908 5.442 2.550
230 HG3 LYS 34 2HG LYS 34 4.858 4.122 2.031
231 HD2 LYS 34 1HD LYS 34 6.221 2.979 3.463
232 HD3 LYS 34 2HD LYS 34 7.156 2.805 1.976
233 HE2 LYS 34 1HE LYS 34 8.227 5.071 2.791
234 HE3 LYS 34 2HE LYS 34 7.670 4.509 4.366
235 HZ1 LYS 34 1HZ LYS 34 9.434 2.986 2.524
236 HZ2 LYS 34 2HZ LYS 34 8.922 2.475 4.053
237 HZ3 LYS 34 3HZ LYS 34 9.945 3.815 3.908
238 H GLN 35 H GLN 35 6.184 3.478 -1.993
239 HA GLN 35 HA GLN 35 7.665 4.980 -3.688
240 HB2 GLN 35 1HB GLN 35 7.205 2.438 -3.697
241 HB3 GLN 35 2HB GLN 35 5.890 2.823 -4.800
242 HG2 GLN 35 1HG GLN 35 8.745 3.625 -5.284
243 HG3 GLN 35 2HG GLN 35 8.037 2.124 -5.878
244 HE21 GLN 35 1HE2 GLN 35 8.911 5.033 -6.862
245 HE22 GLN 35 2HE2 GLN 35 7.732 5.340 -8.086
246 H GLN 36 H GLN 36 4.179 4.373 -4.028
247 HA GLN 36 HA GLN 36 3.766 5.791 -6.390
248 HB2 GLN 36 1HB GLN 36 2.038 4.996 -4.094
249 HB3 GLN 36 2HB GLN 36 1.402 6.161 -5.248
250 HG2 GLN 36 1HG GLN 36 1.866 4.550 -7.065
251 HG3 GLN 36 2HG GLN 36 2.371 3.377 -5.850
252 HE21 GLN 36 1HE2 GLN 36 0.825 2.481 -4.470
253 HE22 GLN 36 2HE2 GLN 36 -0.862 2.534 -4.836
254 H ILE 37 H ILE 37 3.977 6.900 -3.065
255 HA ILE 37 HA ILE 37 3.081 9.557 -3.590
256 HB ILE 37 HB ILE 37 4.720 8.501 -1.283
257 HG12 ILE 37 1HG1 ILE 37 1.802 9.188 -1.178
258 HG13 ILE 37 2HG1 ILE 37 2.310 7.618 -1.791
259 HG21 ILE 37 1HG2 ILE 37 3.962 11.172 -2.027
260 HG22 ILE 37 2HG2 ILE 37 3.221 10.725 -0.491
261 HG23 ILE 37 3HG2 ILE 37 4.971 10.626 -0.687
262 HD11 ILE 37 1HD1 ILE 37 2.215 8.628 0.940
263 HD12 ILE 37 2HD1 ILE 37 2.179 6.972 0.335
264 HD13 ILE 37 3HD1 ILE 37 3.721 7.805 0.534
265 H GLU 38 H GLU 38 6.196 7.947 -3.596
266 HA GLU 38 HA GLU 38 7.754 10.336 -3.728
267 HB2 GLU 38 1HB GLU 38 8.820 8.368 -2.898
268 HB3 GLU 38 2HB GLU 38 8.377 7.447 -4.328
269 HG2 GLU 38 1HG GLU 38 9.813 9.227 -5.575
270 HG3 GLU 38 2HG GLU 38 10.515 9.492 -3.980
271 H ASP 39 H ASP 39 6.157 8.299 -6.052
272 HA ASP 39 HA ASP 39 7.516 9.537 -8.305
273 HB2 ASP 39 1HB ASP 39 6.650 7.046 -8.046
274 HB3 ASP 39 2HB ASP 39 5.152 7.746 -8.653
275 H GLN 40 H GLN 40 4.539 9.800 -6.545
276 HA GLN 40 HA GLN 40 3.256 11.406 -8.593
277 HB2 GLN 40 1HB GLN 40 2.444 10.327 -5.923
278 HB3 GLN 40 2HB GLN 40 1.544 11.669 -6.616
279 HG2 GLN 40 1HG GLN 40 2.004 9.022 -7.973
280 HG3 GLN 40 2HG GLN 40 0.544 9.470 -7.092
281 HE21 GLN 40 1HE2 GLN 40 1.916 9.286 -10.076
282 HE22 GLN 40 2HE2 GLN 40 0.910 10.404 -10.925
283 H GLN 41 H GLN 41 4.677 11.843 -5.384
284 HA GLN 41 HA GLN 41 4.269 14.730 -5.565
285 HB2 GLN 41 1HB GLN 41 5.385 13.051 -3.312
286 HB3 GLN 41 2HB GLN 41 5.065 14.779 -3.238
287 HG2 GLN 41 1HG GLN 41 2.645 14.100 -3.870
288 HG3 GLN 41 2HG GLN 41 3.139 12.502 -3.312
289 HE21 GLN 41 1HE2 GLN 41 1.303 13.081 -1.812
290 HE22 GLN 41 2HE2 GLN 41 1.729 13.867 -0.334
291 H GLY 42 H GLY 42 6.850 12.329 -5.434
292 HA2 GLY 42 1HA GLY 42 8.871 12.711 -6.700
293 HA3 GLY 42 2HA GLY 42 8.712 14.425 -6.345
294 H LEU 43 H LEU 43 7.947 13.486 -3.498
295 HA LEU 43 HA LEU 43 10.539 13.847 -2.386
296 HB2 LEU 43 1HB LEU 43 8.110 14.343 -1.459
297 HB3 LEU 43 2HB LEU 43 8.311 12.738 -0.757
298 HG LEU 43 HG LEU 43 10.441 14.778 -0.314
299 HD11 LEU 43 1HD1 LEU 43 8.868 16.201 0.457
300 HD12 LEU 43 2HD1 LEU 43 8.939 15.156 1.875
301 HD13 LEU 43 3HD1 LEU 43 7.665 14.930 0.676
302 HD21 LEU 43 1HD2 LEU 43 10.582 12.363 0.403
303 HD22 LEU 43 2HD2 LEU 43 9.279 12.712 1.540
304 HD23 LEU 43 3HD2 LEU 43 10.821 13.558 1.678
305 HA PRO 44 HA PRO 44 11.960 9.673 -2.331
306 HB2 PRO 44 1HB PRO 44 13.881 9.938 -0.431
307 HB3 PRO 44 2HB PRO 44 14.064 10.559 -2.076
308 HG2 PRO 44 1HG PRO 44 13.290 12.014 0.423
309 HG3 PRO 44 2HG PRO 44 14.403 12.515 -0.864
310 HD2 PRO 44 1HD PRO 44 11.860 13.430 -0.698
311 HD3 PRO 44 2HD PRO 44 12.692 13.198 -2.249
312 H LYS 45 H LYS 45 12.110 7.821 -0.929
313 HA LYS 45 HA LYS 45 10.041 7.776 1.058
314 HB2 LYS 45 1HB LYS 45 12.024 5.629 0.279
315 HB3 LYS 45 2HB LYS 45 10.582 5.391 1.258
316 HG2 LYS 45 1HG LYS 45 9.162 5.914 -0.603
317 HG3 LYS 45 2HG LYS 45 10.554 6.360 -1.592
318 HD2 LYS 45 1HD LYS 45 10.313 3.617 -0.403
319 HD3 LYS 45 2HD LYS 45 9.505 4.026 -1.918
320 HE2 LYS 45 1HE LYS 45 12.402 4.659 -1.583
321 HE3 LYS 45 2HE LYS 45 11.917 2.999 -1.921
322 HZ1 LYS 45 1HZ LYS 45 11.006 5.275 -3.579
323 HZ2 LYS 45 2HZ LYS 45 10.970 3.626 -3.956
324 HZ3 LYS 45 3HZ LYS 45 12.447 4.448 -3.900
325 H LYS 46 H LYS 46 13.569 7.583 1.070
326 HA LYS 46 HA LYS 46 13.985 6.946 3.744
327 HB2 LYS 46 1HB LYS 46 16.185 8.106 3.468
328 HB3 LYS 46 2HB LYS 46 15.828 6.930 2.210
329 HG2 LYS 46 1HG LYS 46 15.398 8.593 0.619
330 HG3 LYS 46 2HG LYS 46 15.252 9.851 1.849
331 HD2 LYS 46 1HD LYS 46 17.796 8.357 1.216
332 HD3 LYS 46 2HD LYS 46 17.383 9.949 0.576
333 HE2 LYS 46 1HE LYS 46 17.092 10.613 3.054
334 HE3 LYS 46 2HE LYS 46 18.012 9.149 3.396
335 HZ1 LYS 46 1HZ LYS 46 19.740 10.553 3.192
336 HZ2 LYS 46 2HZ LYS 46 18.891 11.662 2.238
337 HZ3 LYS 46 3HZ LYS 46 19.544 10.269 1.536
338 H GLN 47 H GLN 47 12.599 9.735 2.423
339 HA GLN 47 HA GLN 47 13.191 11.326 4.819
340 HB2 GLN 47 1HB GLN 47 12.123 12.094 2.104
341 HB3 GLN 47 2HB GLN 47 12.160 13.204 3.468
342 HG2 GLN 47 1HG GLN 47 14.612 11.820 2.423
343 HG3 GLN 47 2HG GLN 47 14.061 13.386 1.830
344 HE21 GLN 47 1HE2 GLN 47 13.667 15.030 3.584
345 HE22 GLN 47 2HE2 GLN 47 14.832 15.103 4.858
346 H GLN 48 H GLN 48 10.486 10.275 2.772
347 HA GLN 48 HA GLN 48 8.446 11.344 4.405
348 HB2 GLN 48 1HB GLN 48 6.969 10.361 2.950
349 HB3 GLN 48 2HB GLN 48 8.413 10.381 1.947
350 HG2 GLN 48 1HG GLN 48 8.863 8.041 2.685
351 HG3 GLN 48 2HG GLN 48 7.291 8.053 3.482
352 HE21 GLN 48 1HE2 GLN 48 8.637 8.978 0.327
353 HE22 GLN 48 2HE2 GLN 48 7.402 8.220 -0.612
354 H GLN 49 H GLN 49 7.205 10.447 6.014
355 HA GLN 49 HA GLN 49 7.844 7.744 6.926
356 HB2 GLN 49 1HB GLN 49 9.305 9.352 8.162
357 HB3 GLN 49 2HB GLN 49 7.855 10.126 8.786
358 HG2 GLN 49 1HG GLN 49 7.212 8.042 9.884
359 HG3 GLN 49 2HG GLN 49 8.669 7.268 9.262
360 HE21 GLN 49 1HE2 GLN 49 8.184 7.276 11.932
361 HE22 GLN 49 2HE2 GLN 49 9.299 8.321 12.737
362 H LEU 50 H LEU 50 5.929 6.770 6.845
363 HA LEU 50 HA LEU 50 3.508 8.256 7.521
364 HB2 LEU 50 1HB LEU 50 3.812 5.461 6.436
365 HB3 LEU 50 2HB LEU 50 2.304 6.358 6.600
366 HG LEU 50 HG LEU 50 4.522 7.376 4.857
367 HD11 LEU 50 1HD1 LEU 50 4.292 5.332 3.835
368 HD12 LEU 50 2HD1 LEU 50 3.042 6.266 3.013
369 HD13 LEU 50 3HD1 LEU 50 2.603 5.160 4.313
370 HD21 LEU 50 1HD2 LEU 50 2.571 8.810 5.510
371 HD22 LEU 50 2HD2 LEU 50 1.534 7.681 4.639
372 HD23 LEU 50 3HD2 LEU 50 2.781 8.582 3.774
373 H GLU 51 H GLU 51 2.089 7.652 9.146
374 HA GLU 51 HA GLU 51 2.839 5.438 10.895
375 HB2 GLU 51 1HB GLU 51 2.761 8.331 11.692
376 HB3 GLU 51 2HB GLU 51 2.392 7.076 12.868
377 HG2 GLU 51 1HG GLU 51 4.598 6.046 12.366
378 HG3 GLU 51 2HG GLU 51 4.960 7.436 11.344
379 H PHE 52 H PHE 52 1.117 4.364 11.644
380 HA PHE 52 HA PHE 52 -1.520 5.660 11.411
381 HB2 PHE 52 1HB PHE 52 -1.118 3.873 9.711
382 HB3 PHE 52 2HB PHE 52 -0.926 2.720 11.027
383 HD1 PHE 52 2HD PHE 52 -3.378 5.404 10.171
384 HD2 PHE 52 1HD PHE 52 -2.735 1.351 11.299
385 HE1 PHE 52 2HE PHE 52 -5.809 5.027 10.188
386 HE2 PHE 52 1HE PHE 52 -5.165 0.966 11.317
387 HZ PHE 52 HZ PHE 52 -6.706 2.806 10.762
388 H GLN 53 H GLN 53 -2.078 6.172 13.438
389 HA GLN 53 HA GLN 53 -2.730 5.921 15.604
390 HB2 GLN 53 1HB GLN 53 -2.395 2.955 15.132
391 HB3 GLN 53 2HB GLN 53 -3.313 3.715 16.425
392 HG2 GLN 53 1HG GLN 53 -3.940 3.840 13.484
393 HG3 GLN 53 2HG GLN 53 -4.787 2.882 14.698
394 HE21 GLN 53 1HE2 GLN 53 -6.225 4.558 13.170
395 HE22 GLN 53 2HE2 GLN 53 -6.759 5.920 14.089
396 H GLY 54 H GLY 54 0.017 6.349 14.963
397 HA2 GLY 54 1HA GLY 54 1.956 6.585 16.194
398 HA3 GLY 54 2HA GLY 54 1.172 5.723 17.510
399 H GLN 55 H GLN 55 1.499 4.445 14.260
400 HA GLN 55 HA GLN 55 3.527 2.555 15.249
401 HB2 GLN 55 1HB GLN 55 2.398 0.715 14.449
402 HB3 GLN 55 2HB GLN 55 1.052 1.723 14.962
403 HG2 GLN 55 1HG GLN 55 0.936 2.554 12.579
404 HG3 GLN 55 2HG GLN 55 2.057 1.256 12.173
405 HE21 GLN 55 1HE2 GLN 55 -0.831 1.548 14.219
406 HE22 GLN 55 2HE2 GLN 55 -1.654 0.186 13.546
407 H VAL 56 H VAL 56 5.322 2.620 14.085
408 HA VAL 56 HA VAL 56 5.387 3.997 11.550
409 HB VAL 56 HB VAL 56 7.652 2.535 12.908
410 HG11 VAL 56 1HG1 VAL 56 7.510 3.639 10.395
411 HG12 VAL 56 2HG1 VAL 56 8.235 4.931 11.354
412 HG13 VAL 56 3HG1 VAL 56 8.989 3.337 11.307
413 HG21 VAL 56 1HG2 VAL 56 6.369 5.127 13.506
414 HG22 VAL 56 2HG2 VAL 56 7.264 4.032 14.561
415 HG23 VAL 56 3HG2 VAL 56 8.133 5.115 13.474
416 H LEU 57 H LEU 57 5.089 3.065 9.645
417 HA LEU 57 HA LEU 57 5.002 0.187 9.414
418 HB2 LEU 57 1HB LEU 57 4.719 2.173 7.178
419 HB3 LEU 57 2HB LEU 57 4.095 0.527 7.260
420 HG LEU 57 HG LEU 57 3.111 2.716 9.073
421 HD11 LEU 57 1HD1 LEU 57 2.504 3.640 7.060
422 HD12 LEU 57 2HD1 LEU 57 1.118 2.602 7.390
423 HD13 LEU 57 3HD1 LEU 57 2.363 2.075 6.258
424 HD21 LEU 57 1HD2 LEU 57 2.266 -0.065 8.383
425 HD22 LEU 57 2HD2 LEU 57 1.066 1.114 8.910
426 HD23 LEU 57 3HD2 LEU 57 2.420 0.702 9.963
427 H GLN 58 H GLN 58 6.212 -1.033 7.873
428 HA GLN 58 HA GLN 58 8.755 0.214 7.071
429 HB2 GLN 58 1HB GLN 58 8.372 -2.579 8.163
430 HB3 GLN 58 2HB GLN 58 9.887 -1.923 7.557
431 HG2 GLN 58 1HG GLN 58 8.499 -0.451 9.728
432 HG3 GLN 58 2HG GLN 58 9.309 -1.965 10.129
433 HE21 GLN 58 1HE2 GLN 58 10.544 -0.379 11.469
434 HE22 GLN 58 2HE2 GLN 58 11.934 0.354 10.750
435 H ASP 59 H ASP 59 9.739 -0.620 5.179
436 HA ASP 59 HA ASP 59 8.019 -1.152 3.060
437 HB2 ASP 59 1HB ASP 59 10.030 -0.367 2.293
438 HB3 ASP 59 2HB ASP 59 10.961 -1.291 3.468
439 H TRP 60 H TRP 60 10.248 -3.438 4.653
440 HA TRP 60 HA TRP 60 9.472 -5.730 3.306
441 HB2 TRP 60 1HB TRP 60 10.727 -6.893 4.840
442 HB3 TRP 60 2HB TRP 60 11.340 -5.267 5.129
443 HD1 TRP 60 HD TRP 60 8.878 -7.818 6.659
444 HE1 TRP 60 1HE TRP 60 8.655 -7.308 9.172
445 HE3 TRP 60 3HE TRP 60 11.663 -3.536 6.868
446 HZ2 TRP 60 2HZ TRP 60 9.542 -5.349 11.001
447 HZ3 TRP 60 3HZ TRP 60 11.926 -2.405 9.038
448 HH2 TRP 60 HH TRP 60 10.886 -3.295 11.060
449 H LEU 61 H LEU 61 7.815 -3.962 5.768
450 HA LEU 61 HA LEU 61 6.040 -6.114 6.495
451 HB2 LEU 61 1HB LEU 61 5.995 -3.162 7.092
452 HB3 LEU 61 2HB LEU 61 4.819 -4.314 7.722
453 HG LEU 61 HG LEU 61 7.778 -4.483 8.272
454 HD11 LEU 61 1HD1 LEU 61 6.227 -2.447 9.144
455 HD12 LEU 61 2HD1 LEU 61 7.594 -3.109 10.041
456 HD13 LEU 61 3HD1 LEU 61 5.954 -3.638 10.417
457 HD21 LEU 61 1HD2 LEU 61 7.273 -6.156 9.783
458 HD22 LEU 61 2HD2 LEU 61 6.153 -6.500 8.465
459 HD23 LEU 61 3HD2 LEU 61 5.582 -5.673 9.915
460 H GLY 62 H GLY 62 3.710 -6.020 6.192
461 HA2 GLY 62 1HA GLY 62 3.013 -4.753 3.616
462 HA3 GLY 62 2HA GLY 62 2.355 -6.286 4.167
463 H LEU 63 H LEU 63 0.705 -4.239 3.323
464 HA LEU 63 HA LEU 63 -0.231 -2.477 5.252
465 HB2 LEU 63 1HB LEU 63 -1.601 -3.886 2.982
466 HB3 LEU 63 2HB LEU 63 -2.456 -2.745 4.017
467 HG LEU 63 HG LEU 63 -0.435 -1.173 3.317
468 HD11 LEU 63 1HD1 LEU 63 0.850 -1.953 1.691
469 HD12 LEU 63 2HD1 LEU 63 -0.563 -2.091 0.645
470 HD13 LEU 63 3HD1 LEU 63 -0.076 -3.453 1.654
471 HD21 LEU 63 1HD2 LEU 63 -2.913 -0.887 2.955
472 HD22 LEU 63 2HD2 LEU 63 -2.698 -1.696 1.402
473 HD23 LEU 63 3HD2 LEU 63 -1.873 -0.170 1.724
474 H GLY 64 H GLY 64 -1.331 -5.795 4.563
475 HA2 GLY 64 1HA GLY 64 -3.274 -5.877 6.616
476 HA3 GLY 64 2HA GLY 64 -2.560 -7.272 5.820
477 H ILE 65 H ILE 65 0.152 -6.700 6.564
478 HA ILE 65 HA ILE 65 0.456 -8.147 8.857
479 HB ILE 65 HB ILE 65 2.261 -5.898 7.957
480 HG12 ILE 65 1HG1 ILE 65 2.188 -7.334 6.127
481 HG13 ILE 65 2HG1 ILE 65 3.547 -7.977 7.043
482 HG21 ILE 65 1HG2 ILE 65 3.995 -6.934 9.228
483 HG22 ILE 65 2HG2 ILE 65 2.609 -6.710 10.295
484 HG23 ILE 65 3HG2 ILE 65 2.959 -8.305 9.627
485 HD11 ILE 65 1HD1 ILE 65 0.825 -9.109 6.644
486 HD12 ILE 65 2HD1 ILE 65 2.403 -9.886 6.510
487 HD13 ILE 65 3HD1 ILE 65 1.733 -9.519 8.099
488 H TYR 66 H TYR 66 -0.307 -4.756 8.575
489 HA TYR 66 HA TYR 66 -0.039 -4.386 11.468
490 HB2 TYR 66 1HB TYR 66 -0.245 -2.523 9.133
491 HB3 TYR 66 2HB TYR 66 -0.708 -1.954 10.733
492 HD1 TYR 66 2HD TYR 66 1.087 -2.516 12.626
493 HD2 TYR 66 1HD TYR 66 1.939 -2.199 8.470
494 HE1 TYR 66 2HE TYR 66 3.446 -2.059 13.150
495 HE2 TYR 66 1HE TYR 66 4.301 -1.742 8.982
496 HH TYR 66 HH TYR 66 5.462 -1.626 12.340
497 H GLY 67 H GLY 67 -2.423 -4.246 8.863
498 HA2 GLY 67 1HA GLY 67 -4.664 -5.065 9.330
499 HA3 GLY 67 2HA GLY 67 -4.532 -4.341 10.926
500 H ILE 68 H ILE 68 -3.575 -2.812 7.902
501 HA ILE 68 HA ILE 68 -5.168 -0.503 8.510
502 HB ILE 68 HB ILE 68 -3.630 -1.126 5.986
503 HG12 ILE 68 1HG1 ILE 68 -2.650 0.737 8.107
504 HG13 ILE 68 2HG1 ILE 68 -2.452 -0.995 8.351
505 HG21 ILE 68 1HG2 ILE 68 -3.747 1.211 5.508
506 HG22 ILE 68 2HG2 ILE 68 -5.385 0.643 5.828
507 HG23 ILE 68 3HG2 ILE 68 -4.507 1.546 7.063
508 HD11 ILE 68 1HD1 ILE 68 -0.502 -0.624 7.304
509 HD12 ILE 68 2HD1 ILE 68 -1.496 -0.767 5.854
510 HD13 ILE 68 3HD1 ILE 68 -1.089 0.826 6.490
511 H GLN 69 H GLN 69 -7.107 0.070 7.718
512 HA GLN 69 HA GLN 69 -8.434 -1.822 5.911
513 HB2 GLN 69 1HB GLN 69 -9.394 0.062 8.021
514 HB3 GLN 69 2HB GLN 69 -10.483 -0.359 6.706
515 HG2 GLN 69 1HG GLN 69 -10.073 -2.766 7.264
516 HG3 GLN 69 2HG GLN 69 -9.212 -2.213 8.699
517 HE21 GLN 69 1HE2 GLN 69 -12.059 -3.373 7.676
518 HE22 GLN 69 2HE2 GLN 69 -13.117 -2.687 8.856
519 H ASP 70 H ASP 70 -10.328 -0.538 4.682
520 HA ASP 70 HA ASP 70 -8.922 1.225 2.873
521 HB2 ASP 70 1HB ASP 70 -11.033 1.139 1.556
522 HB3 ASP 70 2HB ASP 70 -10.373 -0.455 1.912
523 H SER 71 H SER 71 -9.834 3.285 2.169
524 HA SER 71 HA SER 71 -10.497 5.420 2.590
525 HB2 SER 71 1HB SER 71 -12.718 4.102 2.777
526 HB3 SER 71 2HB SER 71 -12.546 4.345 4.515
527 HG SER 71 HG SER 71 -13.272 6.117 2.564
528 H ASP 72 H ASP 72 -8.504 4.104 4.328
529 HA ASP 72 HA ASP 72 -8.910 5.356 6.923
530 HB2 ASP 72 1HB ASP 72 -6.954 3.409 5.783
531 HB3 ASP 72 2HB ASP 72 -6.465 4.362 7.181
532 H THR 73 H THR 73 -7.258 6.749 7.862
533 HA THR 73 HA THR 73 -6.102 8.535 5.829
534 HB THR 73 HB THR 73 -6.860 9.117 8.698
535 HG1 THR 73 1HG THR 73 -8.320 10.605 7.483
536 HG21 THR 73 1HG2 THR 73 -5.594 10.948 8.614
537 HG22 THR 73 2HG2 THR 73 -6.364 11.448 7.109
538 HG23 THR 73 3HG2 THR 73 -4.948 10.398 7.068
539 H LEU 74 H LEU 74 -3.965 9.019 5.832
540 HA LEU 74 HA LEU 74 -2.314 7.886 7.990
541 HB2 LEU 74 1HB LEU 74 -1.666 7.892 5.046
542 HB3 LEU 74 2HB LEU 74 -0.616 7.302 6.333
543 HG LEU 74 HG LEU 74 -3.301 6.103 5.661
544 HD11 LEU 74 1HD1 LEU 74 -2.293 5.277 3.852
545 HD12 LEU 74 2HD1 LEU 74 -1.371 4.274 4.972
546 HD13 LEU 74 3HD1 LEU 74 -0.697 5.798 4.395
547 HD21 LEU 74 1HD2 LEU 74 -2.564 4.262 7.042
548 HD22 LEU 74 2HD2 LEU 74 -2.496 5.761 7.968
549 HD23 LEU 74 3HD2 LEU 74 -1.014 5.054 7.324
550 H ILE 75 H ILE 75 -0.816 9.210 8.831
551 HA ILE 75 HA ILE 75 -0.699 11.937 7.842
552 HB ILE 75 HB ILE 75 0.719 10.778 10.239
553 HG12 ILE 75 1HG1 ILE 75 -1.646 10.393 10.531
554 HG13 ILE 75 2HG1 ILE 75 -1.175 11.752 11.547
555 HG21 ILE 75 1HG2 ILE 75 0.413 13.272 10.931
556 HG22 ILE 75 2HG2 ILE 75 1.723 12.813 9.844
557 HG23 ILE 75 3HG2 ILE 75 0.250 13.534 9.195
558 HD11 ILE 75 1HD1 ILE 75 -2.733 11.785 8.989
559 HD12 ILE 75 2HD1 ILE 75 -3.206 12.377 10.582
560 HD13 ILE 75 3HD1 ILE 75 -1.981 13.237 9.649
561 H LEU 76 H LEU 76 0.979 12.857 6.815
562 HA LEU 76 HA LEU 76 3.341 11.173 6.315
563 HB2 LEU 76 1HB LEU 76 2.124 11.681 4.303
564 HB3 LEU 76 2HB LEU 76 2.126 13.401 4.690
565 HG LEU 76 HG LEU 76 4.658 13.292 4.481
566 HD11 LEU 76 1HD1 LEU 76 4.923 11.240 2.651
567 HD12 LEU 76 2HD1 LEU 76 3.967 10.526 3.949
568 HD13 LEU 76 3HD1 LEU 76 5.533 11.254 4.306
569 HD21 LEU 76 1HD2 LEU 76 2.867 12.821 2.104
570 HD22 LEU 76 2HD2 LEU 76 4.546 13.350 1.987
571 HD23 LEU 76 3HD2 LEU 76 3.354 14.369 2.794
572 H SER 77 H SER 77 5.259 11.814 7.052
573 HA SER 77 HA SER 77 5.773 14.642 7.540
574 HB2 SER 77 1HB SER 77 6.695 14.092 9.825
575 HB3 SER 77 2HB SER 77 4.940 13.981 9.689
576 HG SER 77 HG SER 77 5.189 12.027 10.400
577 H LYS 78 H LYS 78 7.800 15.198 7.026
578 HA LYS 78 HA LYS 78 9.571 13.198 5.968
579 HB2 LYS 78 1HB LYS 78 10.978 15.046 5.311
580 HB3 LYS 78 2HB LYS 78 9.305 15.446 4.943
581 HG2 LYS 78 1HG LYS 78 9.169 16.870 6.879
582 HG3 LYS 78 2HG LYS 78 10.791 16.390 7.386
583 HD2 LYS 78 1HD LYS 78 10.225 17.720 4.744
584 HD3 LYS 78 2HD LYS 78 10.605 18.624 6.211
585 HE2 LYS 78 1HE LYS 78 12.365 16.471 5.050
586 HE3 LYS 78 2HE LYS 78 12.560 18.190 4.713
587 HZ1 LYS 78 1HZ LYS 78 12.407 17.555 7.519
588 HZ2 LYS 78 2HZ LYS 78 13.503 18.543 6.692
589 HZ3 LYS 78 3HZ LYS 78 13.744 16.869 6.741
590 H LYS 79 H LYS 79 11.652 12.686 6.693
591 HA LYS 79 HA LYS 79 11.948 12.523 9.508
592 HB2 LYS 79 1HB LYS 79 14.107 12.083 7.444
593 HB3 LYS 79 2HB LYS 79 14.027 11.408 9.066
594 HG2 LYS 79 1HG LYS 79 11.753 10.415 8.119
595 HG3 LYS 79 2HG LYS 79 12.624 10.586 6.593
596 HD2 LYS 79 1HD LYS 79 14.289 9.096 7.234
597 HD3 LYS 79 2HD LYS 79 13.933 9.285 8.953
598 HE2 LYS 79 1HE LYS 79 11.799 8.114 8.621
599 HE3 LYS 79 2HE LYS 79 12.190 7.902 6.915
600 HZ1 LYS 79 1HZ LYS 79 12.676 5.946 8.352
601 HZ2 LYS 79 2HZ LYS 79 13.877 6.858 9.118
602 HZ3 LYS 79 3HZ LYS 79 14.007 6.505 7.469
603 H LYS 80 H LYS 80 12.575 14.084 10.831
604 HA LYS 80 HA LYS 80 13.779 16.498 9.885
605 HB2 LYS 80 1HB LYS 80 12.233 16.550 11.760
606 HB3 LYS 80 2HB LYS 80 13.280 15.487 12.690
607 HG2 LYS 80 1HG LYS 80 14.963 17.178 12.854
608 HG3 LYS 80 2HG LYS 80 14.081 18.228 11.743
609 HD2 LYS 80 1HD LYS 80 12.206 18.273 13.390
610 HD3 LYS 80 2HD LYS 80 13.238 17.384 14.513
611 HE2 LYS 80 1HE LYS 80 14.927 19.283 14.141
612 HE3 LYS 80 2HE LYS 80 13.570 20.173 13.453
613 HZ1 LYS 80 1HZ LYS 80 13.497 18.962 16.157
614 HZ2 LYS 80 2HZ LYS 80 12.417 20.082 15.495
615 HZ3 LYS 80 3HZ LYS 80 13.996 20.554 15.876
616 H GLY 81 H GLY 81 15.832 17.350 10.472
617 HA2 GLY 81 1HA GLY 81 17.968 17.006 11.625
618 HA3 GLY 81 2HA GLY 81 17.806 15.295 11.256
619 H SER 82 H SER 82 20.077 16.840 10.630
620 HA SER 82 HA SER 82 21.568 16.977 8.904
621 HB2 SER 82 1HB SER 82 20.089 14.972 8.043
622 HB3 SER 82 2HB SER 82 19.512 16.168 6.883
623 HG SER 82 HG SER 82 21.625 14.756 6.609
624 H GLY 83 H GLY 83 20.284 19.234 9.744
625 HA2 GLY 83 1HA GLY 83 19.759 20.686 7.223
626 HA3 GLY 83 2HA GLY 83 18.997 21.094 8.753
627 HA PRO 84 HA PRO 84 23.284 23.184 8.029
628 HB2 PRO 84 1HB PRO 84 22.586 25.388 6.604
629 HB3 PRO 84 2HB PRO 84 23.106 23.878 5.846
630 HG2 PRO 84 1HG PRO 84 20.336 24.930 6.268
631 HG3 PRO 84 2HG PRO 84 21.028 24.144 4.837
632 HD2 PRO 84 1HD PRO 84 19.457 22.826 6.605
633 HD3 PRO 84 2HD PRO 84 20.773 22.030 5.719
634 H SER 85 H SER 85 23.869 25.390 8.829
635 HA SER 85 HA SER 85 22.203 26.051 11.094
636 HB2 SER 85 1HB SER 85 24.892 27.061 10.157
637 HB3 SER 85 2HB SER 85 24.076 27.687 11.589
638 HG SER 85 HG SER 85 25.477 26.042 12.197
639 H SER 86 H SER 86 20.368 27.023 10.267
640 HA SER 86 HA SER 86 20.793 29.638 8.974
641 HB2 SER 86 1HB SER 86 19.697 27.882 7.526
642 HB3 SER 86 2HB SER 86 18.341 27.898 8.653
643 HG SER 86 HG SER 86 19.259 30.305 7.530
644 H GLY 87 H GLY 87 19.921 31.384 9.927
645 HA2 GLY 87 1HA GLY 87 18.374 32.588 11.221
646 HA3 GLY 87 2HA GLY 87 17.746 31.070 11.845
Start of MODEL 5
1 H1 GLY 1 H GLY 1 -4.665 8.513 -15.099
2 HA2 GLY 1 1HA GLY 1 -4.026 6.522 -13.710
3 HA3 GLY 1 2HA GLY 1 -3.178 7.673 -12.688
4 H SER 2 H SER 2 -4.228 7.915 -10.838
5 HA SER 2 HA SER 2 -5.939 7.937 -9.312
6 HB2 SER 2 1HB SER 2 -6.754 9.888 -11.449
7 HB3 SER 2 2HB SER 2 -7.772 9.633 -10.032
8 HG SER 2 HG SER 2 -5.623 11.156 -10.233
9 H SER 3 H SER 3 -6.137 5.623 -10.652
10 HA SER 3 HA SER 3 -8.976 5.116 -10.586
11 HB2 SER 3 1HB SER 3 -9.090 4.111 -12.829
12 HB3 SER 3 2HB SER 3 -8.681 5.824 -12.922
13 HG SER 3 HG SER 3 -6.611 3.939 -12.814
14 H GLY 4 H GLY 4 -9.480 2.946 -10.252
15 HA2 GLY 4 1HA GLY 4 -7.796 0.759 -10.605
16 HA3 GLY 4 2HA GLY 4 -7.468 1.393 -8.999
17 H SER 5 H SER 5 -8.853 -1.096 -10.185
18 HA SER 5 HA SER 5 -11.235 -0.936 -8.457
19 HB2 SER 5 1HB SER 5 -12.076 -2.816 -10.094
20 HB3 SER 5 2HB SER 5 -12.227 -1.118 -10.546
21 HG SER 5 HG SER 5 -10.223 -2.950 -11.368
22 H SER 6 H SER 6 -8.513 -1.804 -7.822
23 HA SER 6 HA SER 6 -9.200 -4.392 -6.698
24 HB2 SER 6 1HB SER 6 -8.003 -4.651 -9.005
25 HB3 SER 6 2HB SER 6 -6.556 -4.196 -8.106
26 HG SER 6 HG SER 6 -6.508 -6.250 -7.643
27 H GLY 7 H GLY 7 -8.868 -4.030 -4.604
28 HA2 GLY 7 1HA GLY 7 -7.041 -4.002 -2.930
29 HA3 GLY 7 2HA GLY 7 -6.377 -2.642 -3.824
30 H ILE 8 H ILE 8 -6.447 -1.660 -1.636
31 HA ILE 8 HA ILE 8 -9.133 -0.662 -0.963
32 HB ILE 8 HB ILE 8 -8.267 -0.142 1.256
33 HG12 ILE 8 1HG1 ILE 8 -5.701 -1.522 0.476
34 HG13 ILE 8 2HG1 ILE 8 -5.889 0.226 0.391
35 HG21 ILE 8 1HG2 ILE 8 -8.148 -2.886 0.153
36 HG22 ILE 8 2HG2 ILE 8 -7.509 -2.645 1.778
37 HG23 ILE 8 3HG2 ILE 8 -9.180 -2.213 1.414
38 HD11 ILE 8 1HD1 ILE 8 -6.730 -0.269 2.918
39 HD12 ILE 8 2HD1 ILE 8 -5.506 -1.521 2.705
40 HD13 ILE 8 3HD1 ILE 8 -5.082 0.175 2.472
41 H GLN 9 H GLN 9 -9.150 1.585 -0.031
42 HA GLN 9 HA GLN 9 -7.273 3.306 -1.514
43 HB2 GLN 9 1HB GLN 9 -9.625 3.332 -2.365
44 HB3 GLN 9 2HB GLN 9 -10.136 3.955 -0.802
45 HG2 GLN 9 1HG GLN 9 -8.987 5.985 -1.122
46 HG3 GLN 9 2HG GLN 9 -8.091 5.347 -2.500
47 HE21 GLN 9 1HE2 GLN 9 -8.817 5.866 -4.432
48 HE22 GLN 9 2HE2 GLN 9 -10.414 6.406 -4.808
49 H VAL 10 H VAL 10 -5.925 4.328 -0.203
50 HA VAL 10 HA VAL 10 -6.826 5.002 2.517
51 HB VAL 10 HB VAL 10 -4.497 5.081 3.173
52 HG11 VAL 10 1HG1 VAL 10 -5.873 2.780 2.375
53 HG12 VAL 10 2HG1 VAL 10 -4.214 2.562 1.815
54 HG13 VAL 10 3HG1 VAL 10 -4.535 2.886 3.519
55 HG21 VAL 10 1HG2 VAL 10 -3.799 5.860 0.804
56 HG22 VAL 10 2HG2 VAL 10 -2.681 4.873 1.745
57 HG23 VAL 10 3HG2 VAL 10 -3.644 4.136 0.464
58 H PHE 11 H PHE 11 -6.199 7.043 3.416
59 HA PHE 11 HA PHE 11 -5.904 9.132 1.363
60 HB2 PHE 11 1HB PHE 11 -7.136 9.313 4.121
61 HB3 PHE 11 2HB PHE 11 -6.994 10.647 2.981
62 HD1 PHE 11 1HD PHE 11 -7.899 9.831 0.501
63 HD2 PHE 11 2HD PHE 11 -9.255 8.484 4.305
64 HE1 PHE 11 1HE PHE 11 -10.063 9.212 -0.493
65 HE2 PHE 11 2HE PHE 11 -11.420 7.862 3.317
66 HZ PHE 11 HZ PHE 11 -11.827 8.225 0.915
67 H VAL 12 H VAL 12 -3.807 9.657 1.241
68 HA VAL 12 HA VAL 12 -2.131 9.702 3.607
69 HB VAL 12 HB VAL 12 -1.483 10.377 0.734
70 HG11 VAL 12 1HG1 VAL 12 0.771 10.554 1.325
71 HG12 VAL 12 2HG1 VAL 12 -0.074 11.444 2.594
72 HG13 VAL 12 3HG1 VAL 12 0.512 9.808 2.901
73 HG21 VAL 12 1HG2 VAL 12 -0.834 8.221 0.413
74 HG22 VAL 12 2HG2 VAL 12 -0.392 7.984 2.104
75 HG23 VAL 12 3HG2 VAL 12 -2.087 7.940 1.622
76 H LYS 13 H LYS 13 -2.435 11.401 4.914
77 HA LYS 13 HA LYS 13 -3.090 14.016 3.883
78 HB2 LYS 13 1HB LYS 13 -4.064 13.203 5.993
79 HB3 LYS 13 2HB LYS 13 -2.457 13.124 6.703
80 HG2 LYS 13 1HG LYS 13 -2.222 15.525 6.519
81 HG3 LYS 13 2HG LYS 13 -3.788 15.638 5.714
82 HD2 LYS 13 1HD LYS 13 -4.958 15.064 7.661
83 HD3 LYS 13 2HD LYS 13 -3.513 14.417 8.443
84 HE2 LYS 13 1HE LYS 13 -2.746 16.484 9.042
85 HE3 LYS 13 2HE LYS 13 -3.511 17.285 7.671
86 HZ1 LYS 13 1HZ LYS 13 -5.625 17.135 8.746
87 HZ2 LYS 13 2HZ LYS 13 -4.533 17.830 9.834
88 HZ3 LYS 13 3HZ LYS 13 -4.988 16.210 10.010
89 H ASN 14 H ASN 14 -1.623 15.387 3.141
90 HA ASN 14 HA ASN 14 1.183 15.020 3.732
91 HB2 ASN 14 1HB ASN 14 1.404 17.053 2.195
92 HB3 ASN 14 2HB ASN 14 0.749 15.584 1.479
93 HD21 ASN 14 1HD2 ASN 14 -0.046 17.118 -0.130
94 HD22 ASN 14 2HD2 ASN 14 -1.555 17.910 0.155
95 HA PRO 15 HA PRO 15 1.621 17.997 6.928
96 HB2 PRO 15 1HB PRO 15 4.088 18.994 6.391
97 HB3 PRO 15 2HB PRO 15 3.829 17.373 7.046
98 HG2 PRO 15 1HG PRO 15 4.354 18.214 4.221
99 HG3 PRO 15 2HG PRO 15 5.031 16.848 5.126
100 HD2 PRO 15 1HD PRO 15 3.008 16.559 3.349
101 HD3 PRO 15 2HD PRO 15 3.163 15.539 4.794
102 H ASP 16 H ASP 16 1.752 18.958 3.617
103 HA ASP 16 HA ASP 16 1.886 21.790 4.153
104 HB2 ASP 16 1HB ASP 16 2.838 20.916 2.084
105 HB3 ASP 16 2HB ASP 16 1.267 20.275 1.608
106 H GLY 17 H GLY 17 -0.604 19.559 2.912
107 HA2 GLY 17 1HA GLY 17 -2.791 20.101 4.235
108 HA3 GLY 17 2HA GLY 17 -2.631 21.628 3.380
109 H GLY 18 H GLY 18 -3.590 18.330 3.180
110 HA2 GLY 18 1HA GLY 18 -5.426 18.277 1.338
111 HA3 GLY 18 2HA GLY 18 -4.045 18.548 0.286
112 H SER 19 H SER 19 -5.958 16.240 1.820
113 HA SER 19 HA SER 19 -3.937 14.143 1.728
114 HB2 SER 19 1HB SER 19 -5.455 12.788 2.914
115 HB3 SER 19 2HB SER 19 -5.725 14.403 3.570
116 HG SER 19 HG SER 19 -7.521 14.583 2.160
117 H TYR 20 H TYR 20 -3.740 12.689 0.141
118 HA TYR 20 HA TYR 20 -5.681 12.809 -2.064
119 HB2 TYR 20 1HB TYR 20 -2.979 11.521 -2.281
120 HB3 TYR 20 2HB TYR 20 -3.968 12.241 -3.546
121 HD1 TYR 20 2HD TYR 20 -4.193 14.753 -3.627
122 HD2 TYR 20 1HD TYR 20 -1.353 12.792 -1.137
123 HE1 TYR 20 2HE TYR 20 -2.924 16.851 -3.430
124 HE2 TYR 20 1HE TYR 20 -0.078 14.885 -0.933
125 HH TYR 20 HH TYR 20 -1.146 17.854 -2.570
126 H ALA 21 H ALA 21 -6.339 10.859 -3.100
127 HA ALA 21 HA ALA 21 -6.461 8.596 -1.243
128 HB1 ALA 21 1HB ALA 21 -8.432 7.919 -2.313
129 HB2 ALA 21 2HB ALA 21 -8.545 9.678 -2.244
130 HB3 ALA 21 3HB ALA 21 -8.087 8.883 -3.750
131 H TYR 22 H TYR 22 -4.882 7.159 -1.536
132 HA TYR 22 HA TYR 22 -3.926 6.606 -4.250
133 HB2 TYR 22 1HB TYR 22 -2.780 6.082 -1.516
134 HB3 TYR 22 2HB TYR 22 -2.136 5.292 -2.951
135 HD1 TYR 22 2HD TYR 22 -2.697 8.582 -1.352
136 HD2 TYR 22 1HD TYR 22 -0.689 6.442 -4.433
137 HE1 TYR 22 2HE TYR 22 -1.293 10.552 -1.798
138 HE2 TYR 22 1HE TYR 22 0.721 8.406 -4.887
139 HH TYR 22 HH TYR 22 0.265 11.444 -3.108
140 H ALA 23 H ALA 23 -4.058 4.618 -5.190
141 HA ALA 23 HA ALA 23 -5.742 2.645 -3.803
142 HB1 ALA 23 1HB ALA 23 -6.675 3.521 -5.884
143 HB2 ALA 23 2HB ALA 23 -5.242 2.979 -6.759
144 HB3 ALA 23 3HB ALA 23 -6.321 1.798 -6.016
145 H ILE 24 H ILE 24 -4.677 0.986 -2.962
146 HA ILE 24 HA ILE 24 -2.653 -0.377 -4.546
147 HB ILE 24 HB ILE 24 -1.273 1.147 -3.293
148 HG12 ILE 24 1HG1 ILE 24 -0.999 -1.367 -1.698
149 HG13 ILE 24 2HG1 ILE 24 -0.804 -1.447 -3.445
150 HG21 ILE 24 1HG2 ILE 24 -1.763 1.875 -1.251
151 HG22 ILE 24 2HG2 ILE 24 -3.247 0.929 -1.341
152 HG23 ILE 24 3HG2 ILE 24 -1.801 0.232 -0.610
153 HD11 ILE 24 1HD1 ILE 24 1.265 -1.103 -1.939
154 HD12 ILE 24 2HD1 ILE 24 1.105 -0.157 -3.420
155 HD13 ILE 24 3HD1 ILE 24 0.717 0.571 -1.861
156 H ASN 25 H ASN 25 -2.516 -2.547 -4.130
157 HA ASN 25 HA ASN 25 -4.699 -3.780 -2.827
158 HB2 ASN 25 1HB ASN 25 -2.158 -4.768 -4.072
159 HB3 ASN 25 2HB ASN 25 -3.154 -5.876 -3.134
160 HD21 ASN 25 1HD2 ASN 25 -5.584 -5.635 -3.731
161 HD22 ASN 25 2HD2 ASN 25 -5.917 -5.669 -5.426
162 HA PRO 26 HA PRO 26 -3.327 -4.021 1.345
163 HB2 PRO 26 1HB PRO 26 -4.711 -6.215 2.148
164 HB3 PRO 26 2HB PRO 26 -5.476 -4.647 1.863
165 HG2 PRO 26 1HG PRO 26 -5.348 -7.045 0.075
166 HG3 PRO 26 2HG PRO 26 -6.720 -5.975 0.415
167 HD2 PRO 26 1HD PRO 26 -5.231 -5.765 -1.837
168 HD3 PRO 26 2HD PRO 26 -5.987 -4.361 -1.058
169 H ASN 27 H ASN 27 -2.926 -6.698 -0.847
170 HA ASN 27 HA ASN 27 -1.350 -8.313 0.909
171 HB2 ASN 27 1HB ASN 27 -1.858 -8.353 -2.061
172 HB3 ASN 27 2HB ASN 27 -0.723 -9.465 -1.301
173 HD21 ASN 27 1HD2 ASN 27 -1.774 -11.345 -1.524
174 HD22 ASN 27 2HD2 ASN 27 -3.333 -11.685 -0.860
175 H SER 28 H SER 28 -0.670 -5.900 -1.564
176 HA SER 28 HA SER 28 2.069 -6.277 -1.857
177 HB2 SER 28 1HB SER 28 2.155 -4.004 -2.691
178 HB3 SER 28 2HB SER 28 0.659 -4.754 -3.248
179 HG SER 28 HG SER 28 -0.186 -3.722 -1.169
180 H PHE 29 H PHE 29 3.785 -4.729 -1.084
181 HA PHE 29 HA PHE 29 3.709 -4.664 1.809
182 HB2 PHE 29 1HB PHE 29 5.945 -3.806 -0.037
183 HB3 PHE 29 2HB PHE 29 6.070 -4.155 1.684
184 HD1 PHE 29 2HD PHE 29 5.148 -6.598 2.311
185 HD2 PHE 29 1HD PHE 29 6.689 -5.417 -1.477
186 HE1 PHE 29 2HE PHE 29 5.672 -8.946 1.796
187 HE2 PHE 29 1HE PHE 29 7.214 -7.763 -1.998
188 HZ PHE 29 HZ PHE 29 6.707 -9.531 -0.361
189 H ILE 30 H ILE 30 4.335 -2.769 3.040
190 HA ILE 30 HA ILE 30 2.792 -0.529 2.517
191 HB ILE 30 HB ILE 30 5.266 -0.766 4.229
192 HG12 ILE 30 1HG1 ILE 30 3.370 -2.204 4.880
193 HG13 ILE 30 2HG1 ILE 30 3.675 -0.948 6.074
194 HG21 ILE 30 1HG2 ILE 30 5.218 1.480 4.208
195 HG22 ILE 30 2HG2 ILE 30 3.570 1.540 3.587
196 HG23 ILE 30 3HG2 ILE 30 3.854 1.280 5.308
197 HD11 ILE 30 1HD1 ILE 30 1.844 0.348 4.743
198 HD12 ILE 30 2HD1 ILE 30 1.390 -1.267 4.198
199 HD13 ILE 30 3HD1 ILE 30 1.395 -0.886 5.920
200 H LEU 31 H LEU 31 6.288 -0.955 2.004
201 HA LEU 31 HA LEU 31 7.008 1.517 1.108
202 HB2 LEU 31 1HB LEU 31 8.391 -0.636 1.339
203 HB3 LEU 31 2HB LEU 31 7.921 -0.952 -0.330
204 HG LEU 31 HG LEU 31 9.197 1.662 0.312
205 HD11 LEU 31 1HD1 LEU 31 11.092 -0.440 -0.406
206 HD12 LEU 31 2HD1 LEU 31 10.405 -0.622 1.208
207 HD13 LEU 31 3HD1 LEU 31 11.236 0.870 0.768
208 HD21 LEU 31 1HD2 LEU 31 10.287 0.648 -1.977
209 HD22 LEU 31 2HD2 LEU 31 8.885 1.716 -1.904
210 HD23 LEU 31 3HD2 LEU 31 8.659 -0.030 -2.012
211 H GLY 32 H GLY 32 5.402 -1.029 -0.759
212 HA2 GLY 32 1HA GLY 32 5.477 0.023 -3.295
213 HA3 GLY 32 2HA GLY 32 4.114 -0.887 -2.660
214 H LEU 33 H LEU 33 3.248 0.905 -0.686
215 HA LEU 33 HA LEU 33 1.672 2.665 -2.251
216 HB2 LEU 33 1HB LEU 33 0.724 1.834 -0.256
217 HB3 LEU 33 2HB LEU 33 2.104 2.360 0.706
218 HG LEU 33 HG LEU 33 1.430 4.662 0.506
219 HD11 LEU 33 1HD1 LEU 33 -0.262 3.592 -1.636
220 HD12 LEU 33 2HD1 LEU 33 0.450 5.193 -1.440
221 HD13 LEU 33 3HD1 LEU 33 -1.045 4.784 -0.598
222 HD21 LEU 33 1HD2 LEU 33 -1.145 3.283 1.110
223 HD22 LEU 33 2HD2 LEU 33 -0.346 4.602 1.965
224 HD23 LEU 33 3HD2 LEU 33 0.269 2.955 2.111
225 H LYS 34 H LYS 34 4.498 3.135 -0.184
226 HA LYS 34 HA LYS 34 4.547 5.946 -0.257
227 HB2 LYS 34 1HB LYS 34 6.557 3.813 0.323
228 HB3 LYS 34 2HB LYS 34 7.121 5.463 0.098
229 HG2 LYS 34 1HG LYS 34 6.817 5.427 2.359
230 HG3 LYS 34 2HG LYS 34 5.236 6.013 1.836
231 HD2 LYS 34 1HD LYS 34 4.207 3.968 2.236
232 HD3 LYS 34 2HD LYS 34 5.730 3.078 2.173
233 HE2 LYS 34 1HE LYS 34 5.273 5.119 4.310
234 HE3 LYS 34 2HE LYS 34 4.569 3.510 4.464
235 HZ1 LYS 34 1HZ LYS 34 7.234 3.196 3.713
236 HZ2 LYS 34 2HZ LYS 34 6.516 2.790 5.190
237 HZ3 LYS 34 3HZ LYS 34 7.209 4.319 4.979
238 H GLN 35 H GLN 35 6.023 3.511 -2.360
239 HA GLN 35 HA GLN 35 7.623 5.093 -3.942
240 HB2 GLN 35 1HB GLN 35 7.520 2.650 -4.128
241 HB3 GLN 35 2HB GLN 35 5.912 2.764 -4.830
242 HG2 GLN 35 1HG GLN 35 7.122 2.545 -6.730
243 HG3 GLN 35 2HG GLN 35 7.171 4.300 -6.570
244 HE21 GLN 35 1HE2 GLN 35 9.087 5.256 -6.545
245 HE22 GLN 35 2HE2 GLN 35 10.607 4.459 -6.347
246 H GLN 36 H GLN 36 4.135 4.591 -4.168
247 HA GLN 36 HA GLN 36 3.698 5.930 -6.590
248 HB2 GLN 36 1HB GLN 36 2.001 5.263 -4.223
249 HB3 GLN 36 2HB GLN 36 1.370 6.375 -5.431
250 HG2 GLN 36 1HG GLN 36 1.945 4.585 -7.144
251 HG3 GLN 36 2HG GLN 36 2.152 3.501 -5.770
252 HE21 GLN 36 1HE2 GLN 36 0.358 2.932 -4.532
253 HE22 GLN 36 2HE2 GLN 36 -1.257 3.147 -5.108
254 H ILE 37 H ILE 37 3.827 7.119 -3.264
255 HA ILE 37 HA ILE 37 3.060 9.782 -3.875
256 HB ILE 37 HB ILE 37 4.533 8.611 -1.520
257 HG12 ILE 37 1HG1 ILE 37 1.775 9.820 -1.590
258 HG13 ILE 37 2HG1 ILE 37 2.050 8.128 -1.990
259 HG21 ILE 37 1HG2 ILE 37 3.617 11.006 -0.633
260 HG22 ILE 37 2HG2 ILE 37 5.270 10.701 -1.164
261 HG23 ILE 37 3HG2 ILE 37 4.103 11.412 -2.279
262 HD11 ILE 37 1HD1 ILE 37 2.693 7.597 0.173
263 HD12 ILE 37 2HD1 ILE 37 3.029 9.278 0.590
264 HD13 ILE 37 3HD1 ILE 37 1.363 8.731 0.401
265 H GLU 38 H GLU 38 6.122 8.084 -3.840
266 HA GLU 38 HA GLU 38 7.774 10.399 -3.963
267 HB2 GLU 38 1HB GLU 38 8.676 8.281 -3.192
268 HB3 GLU 38 2HB GLU 38 8.317 7.529 -4.740
269 HG2 GLU 38 1HG GLU 38 9.885 9.236 -5.767
270 HG3 GLU 38 2HG GLU 38 10.392 9.603 -4.120
271 H ASP 39 H ASP 39 5.938 8.631 -6.281
272 HA ASP 39 HA ASP 39 7.373 9.806 -8.537
273 HB2 ASP 39 1HB ASP 39 5.271 7.684 -8.258
274 HB3 ASP 39 2HB ASP 39 5.524 8.469 -9.814
275 H GLN 40 H GLN 40 4.591 10.337 -6.610
276 HA GLN 40 HA GLN 40 3.273 11.985 -8.616
277 HB2 GLN 40 1HB GLN 40 2.535 11.181 -5.805
278 HB3 GLN 40 2HB GLN 40 1.598 12.342 -6.737
279 HG2 GLN 40 1HG GLN 40 2.185 9.704 -7.966
280 HG3 GLN 40 2HG GLN 40 0.984 9.782 -6.678
281 HE21 GLN 40 1HE2 GLN 40 -0.265 8.987 -8.639
282 HE22 GLN 40 2HE2 GLN 40 -1.050 10.200 -9.586
283 H GLN 41 H GLN 41 4.640 12.381 -5.353
284 HA GLN 41 HA GLN 41 4.563 15.277 -5.648
285 HB2 GLN 41 1HB GLN 41 5.622 13.694 -3.308
286 HB3 GLN 41 2HB GLN 41 5.143 15.386 -3.329
287 HG2 GLN 41 1HG GLN 41 3.105 13.349 -4.038
288 HG3 GLN 41 2HG GLN 41 3.581 13.503 -2.348
289 HE21 GLN 41 1HE2 GLN 41 2.951 15.265 -1.192
290 HE22 GLN 41 2HE2 GLN 41 1.872 16.471 -1.797
291 H GLY 42 H GLY 42 6.920 12.660 -5.325
292 HA2 GLY 42 1HA GLY 42 8.971 12.862 -6.644
293 HA3 GLY 42 2HA GLY 42 8.996 14.566 -6.212
294 H LEU 43 H LEU 43 8.107 13.671 -3.416
295 HA LEU 43 HA LEU 43 10.681 13.691 -2.248
296 HB2 LEU 43 1HB LEU 43 8.290 14.342 -1.329
297 HB3 LEU 43 2HB LEU 43 8.330 12.686 -0.727
298 HG LEU 43 HG LEU 43 10.633 14.475 -0.118
299 HD11 LEU 43 1HD1 LEU 43 8.774 15.907 0.403
300 HD12 LEU 43 2HD1 LEU 43 9.444 15.270 1.904
301 HD13 LEU 43 3HD1 LEU 43 7.950 14.598 1.251
302 HD21 LEU 43 1HD2 LEU 43 10.712 13.149 1.899
303 HD22 LEU 43 2HD2 LEU 43 10.629 12.084 0.496
304 HD23 LEU 43 3HD2 LEU 43 9.191 12.361 1.479
305 HA PRO 44 HA PRO 44 11.740 9.412 -2.437
306 HB2 PRO 44 1HB PRO 44 13.678 9.414 -0.536
307 HB3 PRO 44 2HB PRO 44 13.913 10.101 -2.147
308 HG2 PRO 44 1HG PRO 44 13.268 11.486 0.427
309 HG3 PRO 44 2HG PRO 44 14.418 11.955 -0.838
310 HD2 PRO 44 1HD PRO 44 11.963 13.075 -0.613
311 HD3 PRO 44 2HD PRO 44 12.771 12.853 -2.178
312 H LYS 45 H LYS 45 11.953 7.511 -0.984
313 HA LYS 45 HA LYS 45 9.810 7.519 0.957
314 HB2 LYS 45 1HB LYS 45 11.624 5.208 0.276
315 HB3 LYS 45 2HB LYS 45 10.005 5.145 0.960
316 HG2 LYS 45 1HG LYS 45 8.995 5.675 -1.072
317 HG3 LYS 45 2HG LYS 45 10.495 6.303 -1.758
318 HD2 LYS 45 1HD LYS 45 10.259 3.425 -0.956
319 HD3 LYS 45 2HD LYS 45 9.649 3.981 -2.517
320 HE2 LYS 45 1HE LYS 45 12.411 4.743 -1.705
321 HE3 LYS 45 2HE LYS 45 12.116 3.090 -2.243
322 HZ1 LYS 45 1HZ LYS 45 11.243 5.427 -3.831
323 HZ2 LYS 45 2HZ LYS 45 11.431 3.825 -4.338
324 HZ3 LYS 45 3HZ LYS 45 12.793 4.768 -3.994
325 H LYS 46 H LYS 46 13.286 7.510 0.939
326 HA LYS 46 HA LYS 46 13.652 6.626 3.621
327 HB2 LYS 46 1HB LYS 46 15.947 7.328 3.356
328 HB3 LYS 46 2HB LYS 46 15.420 6.528 1.881
329 HG2 LYS 46 1HG LYS 46 14.948 8.854 0.972
330 HG3 LYS 46 2HG LYS 46 15.864 9.456 2.356
331 HD2 LYS 46 1HD LYS 46 17.717 7.870 1.601
332 HD3 LYS 46 2HD LYS 46 16.815 7.725 0.090
333 HE2 LYS 46 1HE LYS 46 16.870 10.274 0.012
334 HE3 LYS 46 2HE LYS 46 18.087 10.173 1.284
335 HZ1 LYS 46 1HZ LYS 46 19.234 8.554 -0.342
336 HZ2 LYS 46 2HZ LYS 46 19.350 10.218 -0.624
337 HZ3 LYS 46 3HZ LYS 46 18.260 9.283 -1.517
338 H GLN 47 H GLN 47 12.208 9.341 2.488
339 HA GLN 47 HA GLN 47 13.051 10.941 4.815
340 HB2 GLN 47 1HB GLN 47 12.158 11.777 2.065
341 HB3 GLN 47 2HB GLN 47 12.113 12.889 3.427
342 HG2 GLN 47 1HG GLN 47 14.638 11.436 2.800
343 HG3 GLN 47 2HG GLN 47 14.168 12.832 1.832
344 HE21 GLN 47 1HE2 GLN 47 15.801 11.823 4.537
345 HE22 GLN 47 2HE2 GLN 47 15.917 13.333 5.368
346 H GLN 48 H GLN 48 10.302 10.037 2.772
347 HA GLN 48 HA GLN 48 8.363 11.253 4.490
348 HB2 GLN 48 1HB GLN 48 6.797 10.615 2.939
349 HB3 GLN 48 2HB GLN 48 8.241 10.601 1.936
350 HG2 GLN 48 1HG GLN 48 8.436 8.187 2.248
351 HG3 GLN 48 2HG GLN 48 6.987 8.202 3.251
352 HE21 GLN 48 1HE2 GLN 48 8.138 9.120 0.032
353 HE22 GLN 48 2HE2 GLN 48 6.673 8.728 -0.795
354 H GLN 49 H GLN 49 7.398 10.439 6.238
355 HA GLN 49 HA GLN 49 7.638 7.550 6.751
356 HB2 GLN 49 1HB GLN 49 9.215 8.922 8.137
357 HB3 GLN 49 2HB GLN 49 7.816 9.709 8.856
358 HG2 GLN 49 1HG GLN 49 7.113 7.733 9.912
359 HG3 GLN 49 2HG GLN 49 8.189 6.735 8.936
360 HE21 GLN 49 1HE2 GLN 49 7.759 8.084 11.900
361 HE22 GLN 49 2HE2 GLN 49 9.393 8.080 12.461
362 H LEU 50 H LEU 50 5.718 6.617 6.890
363 HA LEU 50 HA LEU 50 3.387 8.259 7.587
364 HB2 LEU 50 1HB LEU 50 3.565 5.563 6.251
365 HB3 LEU 50 2HB LEU 50 2.066 6.416 6.611
366 HG LEU 50 HG LEU 50 4.178 7.589 4.822
367 HD11 LEU 50 1HD1 LEU 50 1.791 6.286 3.650
368 HD12 LEU 50 2HD1 LEU 50 3.103 5.239 4.192
369 HD13 LEU 50 3HD1 LEU 50 3.414 6.491 2.990
370 HD21 LEU 50 1HD2 LEU 50 1.813 8.508 3.949
371 HD22 LEU 50 2HD2 LEU 50 2.766 9.314 5.195
372 HD23 LEU 50 3HD2 LEU 50 1.425 8.262 5.651
373 H GLU 51 H GLU 51 2.319 7.963 9.438
374 HA GLU 51 HA GLU 51 2.946 5.560 11.026
375 HB2 GLU 51 1HB GLU 51 2.518 8.413 11.887
376 HB3 GLU 51 2HB GLU 51 2.362 7.073 13.014
377 HG2 GLU 51 1HG GLU 51 4.657 6.436 12.640
378 HG3 GLU 51 2HG GLU 51 4.831 7.682 11.405
379 H PHE 52 H PHE 52 1.232 4.966 12.604
380 HA PHE 52 HA PHE 52 -1.460 5.832 11.937
381 HB2 PHE 52 1HB PHE 52 -0.820 3.926 10.372
382 HB3 PHE 52 2HB PHE 52 -0.789 2.894 11.798
383 HD1 PHE 52 2HD PHE 52 -3.120 5.590 10.701
384 HD2 PHE 52 1HD PHE 52 -2.609 1.496 11.746
385 HE1 PHE 52 2HE PHE 52 -5.546 5.238 10.493
386 HE2 PHE 52 1HE PHE 52 -5.034 1.136 11.538
387 HZ PHE 52 HZ PHE 52 -6.506 3.009 10.912
388 H GLN 53 H GLN 53 -2.603 6.017 13.744
389 HA GLN 53 HA GLN 53 -3.192 5.903 15.941
390 HB2 GLN 53 1HB GLN 53 -2.442 3.038 15.384
391 HB3 GLN 53 2HB GLN 53 -3.115 3.552 16.925
392 HG2 GLN 53 1HG GLN 53 -5.044 4.517 15.567
393 HG3 GLN 53 2HG GLN 53 -4.410 3.567 14.224
394 HE21 GLN 53 1HE2 GLN 53 -5.315 1.665 13.983
395 HE22 GLN 53 2HE2 GLN 53 -6.021 0.701 15.230
396 H GLY 54 H GLY 54 -0.378 6.541 15.243
397 HA2 GLY 54 1HA GLY 54 1.413 7.230 16.541
398 HA3 GLY 54 2HA GLY 54 0.659 6.461 17.930
399 H GLN 55 H GLN 55 1.598 5.043 14.818
400 HA GLN 55 HA GLN 55 3.714 3.531 16.158
401 HB2 GLN 55 1HB GLN 55 2.882 1.446 15.685
402 HB3 GLN 55 2HB GLN 55 1.379 2.314 15.972
403 HG2 GLN 55 1HG GLN 55 1.394 2.723 13.427
404 HG3 GLN 55 2HG GLN 55 2.569 1.409 13.384
405 HE21 GLN 55 1HE2 GLN 55 0.355 0.991 12.018
406 HE22 GLN 55 2HE2 GLN 55 -0.704 -0.109 12.827
407 H VAL 56 H VAL 56 5.439 3.030 14.873
408 HA VAL 56 HA VAL 56 5.580 4.396 12.327
409 HB VAL 56 HB VAL 56 7.701 2.740 13.700
410 HG11 VAL 56 1HG1 VAL 56 7.571 4.114 11.157
411 HG12 VAL 56 2HG1 VAL 56 8.884 4.726 12.164
412 HG13 VAL 56 3HG1 VAL 56 8.794 3.007 11.779
413 HG21 VAL 56 1HG2 VAL 56 8.609 4.985 14.370
414 HG22 VAL 56 2HG2 VAL 56 7.069 5.681 13.868
415 HG23 VAL 56 3HG2 VAL 56 7.119 4.508 15.184
416 H LEU 57 H LEU 57 4.889 3.443 10.534
417 HA LEU 57 HA LEU 57 4.670 0.575 10.335
418 HB2 LEU 57 1HB LEU 57 4.202 2.626 8.182
419 HB3 LEU 57 2HB LEU 57 3.608 0.967 8.227
420 HG LEU 57 HG LEU 57 2.759 3.093 10.187
421 HD11 LEU 57 1HD1 LEU 57 2.058 3.836 8.025
422 HD12 LEU 57 2HD1 LEU 57 0.658 3.155 8.853
423 HD13 LEU 57 3HD1 LEU 57 1.481 2.224 7.601
424 HD21 LEU 57 1HD2 LEU 57 2.155 0.240 9.763
425 HD22 LEU 57 2HD2 LEU 57 0.765 1.282 10.070
426 HD23 LEU 57 3HD2 LEU 57 2.089 1.212 11.234
427 H GLN 58 H GLN 58 5.918 -0.796 9.168
428 HA GLN 58 HA GLN 58 8.483 0.220 8.260
429 HB2 GLN 58 1HB GLN 58 7.523 -2.642 8.286
430 HB3 GLN 58 2HB GLN 58 9.184 -2.076 8.173
431 HG2 GLN 58 1HG GLN 58 7.359 -1.826 10.552
432 HG3 GLN 58 2HG GLN 58 8.743 -2.907 10.388
433 HE21 GLN 58 1HE2 GLN 58 7.719 -0.047 11.648
434 HE22 GLN 58 2HE2 GLN 58 9.242 0.744 11.843
435 H ASP 59 H ASP 59 9.373 -0.284 6.186
436 HA ASP 59 HA ASP 59 7.452 0.017 4.068
437 HB2 ASP 59 1HB ASP 59 10.337 -0.525 3.515
438 HB3 ASP 59 2HB ASP 59 9.233 0.593 2.719
439 H TRP 60 H TRP 60 9.624 -2.516 5.209
440 HA TRP 60 HA TRP 60 9.110 -4.298 3.042
441 HB2 TRP 60 1HB TRP 60 10.559 -5.748 4.086
442 HB3 TRP 60 2HB TRP 60 11.065 -4.231 4.824
443 HD1 TRP 60 HD TRP 60 9.043 -7.405 5.627
444 HE1 TRP 60 1HE TRP 60 8.933 -7.668 8.185
445 HE3 TRP 60 3HE TRP 60 11.233 -2.992 6.992
446 HZ2 TRP 60 2HZ TRP 60 9.676 -6.199 10.478
447 HZ3 TRP 60 3HZ TRP 60 11.495 -2.497 9.388
448 HH2 TRP 60 HH TRP 60 10.731 -4.068 11.093
449 H LEU 61 H LEU 61 7.613 -3.679 6.134
450 HA LEU 61 HA LEU 61 6.112 -6.059 6.345
451 HB2 LEU 61 1HB LEU 61 5.763 -3.299 7.472
452 HB3 LEU 61 2HB LEU 61 4.603 -4.586 7.794
453 HG LEU 61 HG LEU 61 7.527 -4.625 8.539
454 HD11 LEU 61 1HD1 LEU 61 5.912 -3.054 9.778
455 HD12 LEU 61 2HD1 LEU 61 6.908 -4.154 10.729
456 HD13 LEU 61 3HD1 LEU 61 5.211 -4.533 10.435
457 HD21 LEU 61 1HD2 LEU 61 6.170 -6.548 9.990
458 HD22 LEU 61 2HD2 LEU 61 7.246 -6.834 8.622
459 HD23 LEU 61 3HD2 LEU 61 5.506 -6.699 8.363
460 H GLY 62 H GLY 62 3.729 -6.205 6.173
461 HA2 GLY 62 1HA GLY 62 2.874 -5.034 3.628
462 HA3 GLY 62 2HA GLY 62 2.138 -6.413 4.432
463 H LEU 63 H LEU 63 0.451 -4.592 3.472
464 HA LEU 63 HA LEU 63 -0.168 -2.480 5.275
465 HB2 LEU 63 1HB LEU 63 -1.566 -3.781 2.978
466 HB3 LEU 63 2HB LEU 63 -2.447 -2.664 4.019
467 HG LEU 63 HG LEU 63 -0.463 -1.050 3.477
468 HD11 LEU 63 1HD1 LEU 63 -0.389 -2.895 1.094
469 HD12 LEU 63 2HD1 LEU 63 0.877 -2.752 2.313
470 HD13 LEU 63 3HD1 LEU 63 0.490 -1.377 1.278
471 HD21 LEU 63 1HD2 LEU 63 -1.727 -0.132 1.662
472 HD22 LEU 63 2HD2 LEU 63 -2.858 -0.793 2.843
473 HD23 LEU 63 3HD2 LEU 63 -2.512 -1.682 1.359
474 H GLY 64 H GLY 64 -1.662 -5.662 4.680
475 HA2 GLY 64 1HA GLY 64 -3.587 -5.441 6.744
476 HA3 GLY 64 2HA GLY 64 -3.072 -6.934 5.972
477 H ILE 65 H ILE 65 -0.245 -6.429 6.742
478 HA ILE 65 HA ILE 65 -0.017 -8.001 8.960
479 HB ILE 65 HB ILE 65 1.797 -5.796 8.005
480 HG12 ILE 65 1HG1 ILE 65 1.682 -7.642 6.483
481 HG13 ILE 65 2HG1 ILE 65 3.205 -7.781 7.354
482 HG21 ILE 65 1HG2 ILE 65 3.349 -7.458 9.560
483 HG22 ILE 65 2HG2 ILE 65 2.788 -5.847 10.003
484 HG23 ILE 65 3HG2 ILE 65 1.876 -7.268 10.511
485 HD11 ILE 65 1HD1 ILE 65 2.562 -9.920 7.564
486 HD12 ILE 65 2HD1 ILE 65 1.625 -9.290 8.919
487 HD13 ILE 65 3HD1 ILE 65 0.852 -9.540 7.354
488 H TYR 66 H TYR 66 -0.456 -4.503 8.863
489 HA TYR 66 HA TYR 66 -0.318 -4.301 11.758
490 HB2 TYR 66 1HB TYR 66 -0.595 -2.330 9.513
491 HB3 TYR 66 2HB TYR 66 -0.980 -1.847 11.162
492 HD1 TYR 66 2HD TYR 66 0.845 -2.210 12.943
493 HD2 TYR 66 1HD TYR 66 1.612 -2.276 8.758
494 HE1 TYR 66 2HE TYR 66 3.228 -1.784 13.378
495 HE2 TYR 66 1HE TYR 66 3.997 -1.852 9.182
496 HH TYR 66 HH TYR 66 5.178 -0.886 12.230
497 H GLY 67 H GLY 67 -2.724 -4.022 9.178
498 HA2 GLY 67 1HA GLY 67 -4.950 -4.936 9.690
499 HA3 GLY 67 2HA GLY 67 -4.818 -4.159 11.260
500 H ILE 68 H ILE 68 -3.856 -2.678 8.224
501 HA ILE 68 HA ILE 68 -5.482 -0.383 8.753
502 HB ILE 68 HB ILE 68 -3.824 -1.134 6.346
503 HG12 ILE 68 1HG1 ILE 68 -3.265 1.090 8.284
504 HG13 ILE 68 2HG1 ILE 68 -2.802 -0.562 8.677
505 HG21 ILE 68 1HG2 ILE 68 -5.567 0.318 5.583
506 HG22 ILE 68 2HG2 ILE 68 -5.322 1.409 6.946
507 HG23 ILE 68 3HG2 ILE 68 -4.081 1.260 5.702
508 HD11 ILE 68 1HD1 ILE 68 -0.889 -0.017 7.662
509 HD12 ILE 68 2HD1 ILE 68 -1.791 -0.311 6.175
510 HD13 ILE 68 3HD1 ILE 68 -1.617 1.332 6.791
511 H GLN 69 H GLN 69 -7.319 0.312 7.720
512 HA GLN 69 HA GLN 69 -8.642 -1.663 5.979
513 HB2 GLN 69 1HB GLN 69 -10.765 -0.960 6.875
514 HB3 GLN 69 2HB GLN 69 -9.699 -1.373 8.212
515 HG2 GLN 69 1HG GLN 69 -10.196 1.432 7.244
516 HG3 GLN 69 2HG GLN 69 -11.057 0.668 8.579
517 HE21 GLN 69 1HE2 GLN 69 -9.583 -0.271 10.290
518 HE22 GLN 69 2HE2 GLN 69 -8.232 0.697 10.760
519 H ASP 70 H ASP 70 -10.606 -0.417 4.830
520 HA ASP 70 HA ASP 70 -9.315 1.491 3.095
521 HB2 ASP 70 1HB ASP 70 -11.275 1.313 1.715
522 HB3 ASP 70 2HB ASP 70 -10.854 -0.306 2.268
523 H SER 71 H SER 71 -10.030 3.612 2.672
524 HA SER 71 HA SER 71 -10.906 5.669 3.135
525 HB2 SER 71 1HB SER 71 -12.681 4.480 5.252
526 HB3 SER 71 2HB SER 71 -12.977 5.876 4.216
527 HG SER 71 HG SER 71 -12.922 4.247 2.445
528 H ASP 72 H ASP 72 -8.664 4.432 4.574
529 HA ASP 72 HA ASP 72 -8.821 5.558 7.250
530 HB2 ASP 72 1HB ASP 72 -6.866 4.384 7.739
531 HB3 ASP 72 2HB ASP 72 -7.665 3.333 6.574
532 H THR 73 H THR 73 -6.640 6.700 7.925
533 HA THR 73 HA THR 73 -5.885 8.653 5.864
534 HB THR 73 HB THR 73 -6.630 9.374 8.706
535 HG1 THR 73 1HG THR 73 -8.564 9.512 7.867
536 HG21 THR 73 1HG2 THR 73 -4.771 10.689 7.549
537 HG22 THR 73 2HG2 THR 73 -6.139 11.615 8.168
538 HG23 THR 73 3HG2 THR 73 -6.020 11.262 6.445
539 H LEU 74 H LEU 74 -3.769 8.387 5.591
540 HA LEU 74 HA LEU 74 -2.096 7.707 7.900
541 HB2 LEU 74 1HB LEU 74 -1.443 7.661 4.958
542 HB3 LEU 74 2HB LEU 74 -0.390 7.111 6.259
543 HG LEU 74 HG LEU 74 -3.075 5.855 5.789
544 HD11 LEU 74 1HD1 LEU 74 -1.563 5.880 3.713
545 HD12 LEU 74 2HD1 LEU 74 -2.207 4.331 4.259
546 HD13 LEU 74 3HD1 LEU 74 -0.538 4.769 4.622
547 HD21 LEU 74 1HD2 LEU 74 -0.595 4.549 6.838
548 HD22 LEU 74 2HD2 LEU 74 -2.285 4.119 7.106
549 HD23 LEU 74 3HD2 LEU 74 -1.601 5.542 7.893
550 H ILE 75 H ILE 75 -0.814 9.172 8.808
551 HA ILE 75 HA ILE 75 -0.694 11.845 7.748
552 HB ILE 75 HB ILE 75 0.677 10.663 10.166
553 HG12 ILE 75 1HG1 ILE 75 -1.800 10.598 10.262
554 HG13 ILE 75 2HG1 ILE 75 -1.110 11.690 11.457
555 HG21 ILE 75 1HG2 ILE 75 0.373 13.501 9.211
556 HG22 ILE 75 2HG2 ILE 75 0.827 13.075 10.860
557 HG23 ILE 75 3HG2 ILE 75 1.866 12.612 9.513
558 HD11 ILE 75 1HD1 ILE 75 -2.985 12.783 10.549
559 HD12 ILE 75 2HD1 ILE 75 -1.572 13.557 9.830
560 HD13 ILE 75 3HD1 ILE 75 -2.509 12.390 8.897
561 H LEU 76 H LEU 76 0.951 12.816 6.709
562 HA LEU 76 HA LEU 76 3.333 11.184 6.145
563 HB2 LEU 76 1HB LEU 76 2.115 11.708 4.155
564 HB3 LEU 76 2HB LEU 76 2.028 13.412 4.596
565 HG LEU 76 HG LEU 76 4.641 13.273 4.436
566 HD11 LEU 76 1HD1 LEU 76 3.705 10.787 3.107
567 HD12 LEU 76 2HD1 LEU 76 5.183 11.099 4.016
568 HD13 LEU 76 3HD1 LEU 76 5.025 11.688 2.361
569 HD21 LEU 76 1HD2 LEU 76 2.524 13.874 2.571
570 HD22 LEU 76 2HD2 LEU 76 3.975 13.326 1.731
571 HD23 LEU 76 3HD2 LEU 76 4.060 14.700 2.834
572 H SER 77 H SER 77 5.205 11.795 6.990
573 HA SER 77 HA SER 77 5.754 14.622 7.449
574 HB2 SER 77 1HB SER 77 6.015 12.557 9.649
575 HB3 SER 77 2HB SER 77 6.468 14.258 9.761
576 HG SER 77 HG SER 77 4.257 13.444 10.522
577 H LYS 78 H LYS 78 7.787 15.128 6.936
578 HA LYS 78 HA LYS 78 9.546 13.133 5.912
579 HB2 LYS 78 1HB LYS 78 10.142 16.035 6.515
580 HB3 LYS 78 2HB LYS 78 11.071 14.974 5.464
581 HG2 LYS 78 1HG LYS 78 9.081 14.778 3.994
582 HG3 LYS 78 2HG LYS 78 8.268 15.972 5.008
583 HD2 LYS 78 1HD LYS 78 9.286 16.957 2.979
584 HD3 LYS 78 2HD LYS 78 9.942 17.628 4.474
585 HE2 LYS 78 1HE LYS 78 11.936 16.357 4.269
586 HE3 LYS 78 2HE LYS 78 11.255 15.372 2.976
587 HZ1 LYS 78 1HZ LYS 78 12.216 18.154 2.871
588 HZ2 LYS 78 2HZ LYS 78 11.072 17.613 1.748
589 HZ3 LYS 78 3HZ LYS 78 12.583 16.858 1.846
590 H LYS 79 H LYS 79 11.606 12.535 6.671
591 HA LYS 79 HA LYS 79 11.775 12.197 9.491
592 HB2 LYS 79 1HB LYS 79 13.939 11.732 7.433
593 HB3 LYS 79 2HB LYS 79 13.858 11.043 9.049
594 HG2 LYS 79 1HG LYS 79 11.546 10.125 8.130
595 HG3 LYS 79 2HG LYS 79 12.387 10.299 6.588
596 HD2 LYS 79 1HD LYS 79 14.244 8.942 7.480
597 HD3 LYS 79 2HD LYS 79 13.344 8.729 8.983
598 HE2 LYS 79 1HE LYS 79 11.470 7.819 7.449
599 HE3 LYS 79 2HE LYS 79 12.753 7.646 6.252
600 HZ1 LYS 79 1HZ LYS 79 13.981 6.374 8.044
601 HZ2 LYS 79 2HZ LYS 79 12.648 5.601 7.348
602 HZ3 LYS 79 3HZ LYS 79 12.511 6.308 8.878
603 H LYS 80 H LYS 80 13.155 13.122 10.977
604 HA LYS 80 HA LYS 80 13.872 15.829 10.546
605 HB2 LYS 80 1HB LYS 80 13.273 15.158 12.757
606 HB3 LYS 80 2HB LYS 80 14.489 13.888 12.771
607 HG2 LYS 80 1HG LYS 80 16.228 15.372 13.100
608 HG3 LYS 80 2HG LYS 80 15.313 16.743 12.469
609 HD2 LYS 80 1HD LYS 80 13.819 16.560 14.467
610 HD3 LYS 80 2HD LYS 80 14.922 15.342 15.111
611 HE2 LYS 80 1HE LYS 80 16.578 16.865 15.529
612 HE3 LYS 80 2HE LYS 80 16.060 17.946 14.236
613 HZ1 LYS 80 1HZ LYS 80 14.052 17.755 16.221
614 HZ2 LYS 80 2HZ LYS 80 14.885 19.123 15.679
615 HZ3 LYS 80 3HZ LYS 80 15.523 18.188 16.936
616 H GLY 81 H GLY 81 15.738 16.748 9.920
617 HA2 GLY 81 1HA GLY 81 17.960 16.976 9.344
618 HA3 GLY 81 2HA GLY 81 18.277 15.456 10.167
619 H SER 82 H SER 82 18.884 16.769 7.400
620 HA SER 82 HA SER 82 17.980 14.547 5.709
621 HB2 SER 82 1HB SER 82 18.682 15.985 3.810
622 HB3 SER 82 2HB SER 82 17.473 16.763 4.832
623 HG SER 82 HG SER 82 20.170 17.372 4.473
624 H GLY 83 H GLY 83 20.926 16.525 6.132
625 HA2 GLY 83 1HA GLY 83 23.016 15.416 6.724
626 HA3 GLY 83 2HA GLY 83 22.495 14.054 5.744
627 HA PRO 84 HA PRO 84 25.416 16.507 3.163
628 HB2 PRO 84 1HB PRO 84 26.620 14.331 2.074
629 HB3 PRO 84 2HB PRO 84 27.108 15.023 3.625
630 HG2 PRO 84 1HG PRO 84 25.361 12.656 3.073
631 HG3 PRO 84 2HG PRO 84 26.644 12.841 4.282
632 HD2 PRO 84 1HD PRO 84 24.017 13.067 4.899
633 HD3 PRO 84 2HD PRO 84 25.278 13.993 5.739
634 H SER 85 H SER 85 25.338 16.888 0.955
635 HA SER 85 HA SER 85 22.948 16.097 -0.377
636 HB2 SER 85 1HB SER 85 25.379 17.599 -1.375
637 HB3 SER 85 2HB SER 85 23.890 17.390 -2.297
638 HG SER 85 HG SER 85 23.653 19.308 -1.280
639 H SER 86 H SER 86 26.371 15.612 -1.263
640 HA SER 86 HA SER 86 25.635 13.001 -2.386
641 HB2 SER 86 1HB SER 86 26.944 15.289 -3.790
642 HB3 SER 86 2HB SER 86 27.466 13.653 -4.191
643 HG SER 86 HG SER 86 24.964 14.870 -4.556
644 H GLY 87 H GLY 87 27.747 11.781 -3.011
645 HA2 GLY 87 1HA GLY 87 30.124 11.540 -2.473
646 HA3 GLY 87 2HA GLY 87 29.773 12.288 -0.922
Start of MODEL 6
1 H1 GLY 1 H GLY 1 1.194 2.667 -15.309
2 HA2 GLY 1 1HA GLY 1 2.266 0.126 -14.938
3 HA3 GLY 1 2HA GLY 1 1.877 0.746 -13.341
4 H SER 2 H SER 2 -0.002 0.015 -12.633
5 HA SER 2 HA SER 2 -1.982 -1.048 -14.407
6 HB2 SER 2 1HB SER 2 -1.668 -0.794 -11.451
7 HB3 SER 2 2HB SER 2 -3.291 -1.055 -12.089
8 HG SER 2 HG SER 2 -2.039 -2.804 -13.358
9 H SER 3 H SER 3 -4.280 -0.387 -14.306
10 HA SER 3 HA SER 3 -4.583 2.519 -13.938
11 HB2 SER 3 1HB SER 3 -5.722 2.760 -15.982
12 HB3 SER 3 2HB SER 3 -4.378 1.687 -16.375
13 HG SER 3 HG SER 3 -6.084 -0.013 -15.787
14 H GLY 4 H GLY 4 -6.174 3.039 -12.594
15 HA2 GLY 4 1HA GLY 4 -8.454 2.970 -11.899
16 HA3 GLY 4 2HA GLY 4 -8.536 1.299 -12.438
17 H SER 5 H SER 5 -8.891 2.938 -9.786
18 HA SER 5 HA SER 5 -7.208 2.348 -7.798
19 HB2 SER 5 1HB SER 5 -9.177 1.984 -6.304
20 HB3 SER 5 2HB SER 5 -9.345 3.397 -7.346
21 HG SER 5 HG SER 5 -10.675 0.932 -7.449
22 H SER 6 H SER 6 -5.935 0.577 -7.815
23 HA SER 6 HA SER 6 -7.200 -2.063 -8.013
24 HB2 SER 6 1HB SER 6 -4.884 -2.904 -8.348
25 HB3 SER 6 2HB SER 6 -5.353 -1.707 -9.556
26 HG SER 6 HG SER 6 -4.191 -0.152 -8.359
27 H GLY 7 H GLY 7 -8.039 -2.208 -5.917
28 HA2 GLY 7 1HA GLY 7 -7.370 -3.537 -3.937
29 HA3 GLY 7 2HA GLY 7 -5.986 -2.462 -3.804
30 H ILE 8 H ILE 8 -6.385 -1.629 -1.805
31 HA ILE 8 HA ILE 8 -9.006 -0.483 -1.235
32 HB ILE 8 HB ILE 8 -8.249 -0.199 1.032
33 HG12 ILE 8 1HG1 ILE 8 -5.556 -1.310 0.261
34 HG13 ILE 8 2HG1 ILE 8 -5.872 0.421 0.282
35 HG21 ILE 8 1HG2 ILE 8 -7.169 -2.741 1.139
36 HG22 ILE 8 2HG2 ILE 8 -8.882 -2.329 1.191
37 HG23 ILE 8 3HG2 ILE 8 -8.122 -2.749 -0.344
38 HD11 ILE 8 1HD1 ILE 8 -5.104 0.244 2.383
39 HD12 ILE 8 2HD1 ILE 8 -6.763 -0.249 2.726
40 HD13 ILE 8 3HD1 ILE 8 -5.509 -1.468 2.503
41 H GLN 9 H GLN 9 -9.274 1.692 -0.542
42 HA GLN 9 HA GLN 9 -7.308 3.513 -1.740
43 HB2 GLN 9 1HB GLN 9 -9.690 3.565 -2.541
44 HB3 GLN 9 2HB GLN 9 -10.155 4.127 -0.941
45 HG2 GLN 9 1HG GLN 9 -8.529 6.040 -1.305
46 HG3 GLN 9 2HG GLN 9 -8.480 5.534 -2.993
47 HE21 GLN 9 1HE2 GLN 9 -9.538 7.112 -4.009
48 HE22 GLN 9 2HE2 GLN 9 -11.150 7.620 -3.651
49 H VAL 10 H VAL 10 -5.985 4.552 -0.418
50 HA VAL 10 HA VAL 10 -6.857 5.040 2.355
51 HB VAL 10 HB VAL 10 -4.512 5.067 3.002
52 HG11 VAL 10 1HG1 VAL 10 -5.101 2.923 3.347
53 HG12 VAL 10 2HG1 VAL 10 -5.762 2.734 1.722
54 HG13 VAL 10 3HG1 VAL 10 -4.023 2.606 1.988
55 HG21 VAL 10 1HG2 VAL 10 -3.495 4.006 0.464
56 HG22 VAL 10 2HG2 VAL 10 -3.980 5.701 0.411
57 HG23 VAL 10 3HG2 VAL 10 -2.774 5.165 1.581
58 H PHE 11 H PHE 11 -6.373 7.038 3.322
59 HA PHE 11 HA PHE 11 -6.012 9.218 1.390
60 HB2 PHE 11 1HB PHE 11 -7.349 9.054 4.079
61 HB3 PHE 11 2HB PHE 11 -6.889 10.608 3.391
62 HD1 PHE 11 1HD PHE 11 -7.767 11.136 1.030
63 HD2 PHE 11 2HD PHE 11 -9.379 8.091 3.529
64 HE1 PHE 11 1HE PHE 11 -9.854 11.177 -0.272
65 HE2 PHE 11 2HE PHE 11 -11.468 8.127 2.230
66 HZ PHE 11 HZ PHE 11 -11.708 9.671 0.326
67 H VAL 12 H VAL 12 -3.978 9.895 1.244
68 HA VAL 12 HA VAL 12 -2.201 9.742 3.547
69 HB VAL 12 HB VAL 12 -1.650 10.558 0.691
70 HG11 VAL 12 1HG1 VAL 12 0.383 11.235 1.292
71 HG12 VAL 12 2HG1 VAL 12 -0.172 11.175 2.966
72 HG13 VAL 12 3HG1 VAL 12 0.650 9.784 2.258
73 HG21 VAL 12 1HG2 VAL 12 -0.487 8.121 1.907
74 HG22 VAL 12 2HG2 VAL 12 -2.204 8.077 1.506
75 HG23 VAL 12 3HG2 VAL 12 -1.014 8.421 0.251
76 H LYS 13 H LYS 13 -2.514 11.369 4.952
77 HA LYS 13 HA LYS 13 -3.155 14.040 4.069
78 HB2 LYS 13 1HB LYS 13 -3.910 12.814 6.246
79 HB3 LYS 13 2HB LYS 13 -2.357 13.345 6.876
80 HG2 LYS 13 1HG LYS 13 -3.075 15.687 6.107
81 HG3 LYS 13 2HG LYS 13 -4.697 14.998 6.008
82 HD2 LYS 13 1HD LYS 13 -4.729 15.769 8.162
83 HD3 LYS 13 2HD LYS 13 -4.100 14.142 8.435
84 HE2 LYS 13 1HE LYS 13 -2.341 16.553 8.036
85 HE3 LYS 13 2HE LYS 13 -2.882 16.004 9.622
86 HZ1 LYS 13 1HZ LYS 13 -0.940 14.877 9.497
87 HZ2 LYS 13 2HZ LYS 13 -0.936 14.811 7.807
88 HZ3 LYS 13 3HZ LYS 13 -1.905 13.744 8.693
89 H ASN 14 H ASN 14 -1.618 15.286 3.230
90 HA ASN 14 HA ASN 14 1.158 14.905 3.721
91 HB2 ASN 14 1HB ASN 14 1.311 17.173 2.505
92 HB3 ASN 14 2HB ASN 14 0.655 15.805 1.611
93 HD21 ASN 14 1HD2 ASN 14 -0.326 17.369 0.228
94 HD22 ASN 14 2HD2 ASN 14 -1.801 18.139 0.695
95 HA PRO 15 HA PRO 15 1.890 17.387 7.265
96 HB2 PRO 15 1HB PRO 15 4.319 18.455 6.691
97 HB3 PRO 15 2HB PRO 15 4.094 16.754 7.115
98 HG2 PRO 15 1HG PRO 15 4.406 18.007 4.415
99 HG3 PRO 15 2HG PRO 15 5.137 16.522 5.050
100 HD2 PRO 15 1HD PRO 15 2.979 16.500 3.415
101 HD3 PRO 15 2HD PRO 15 3.234 15.276 4.675
102 H ASP 16 H ASP 16 2.518 19.014 4.171
103 HA ASP 16 HA ASP 16 2.454 21.650 5.141
104 HB2 ASP 16 1HB ASP 16 2.141 22.320 2.821
105 HB3 ASP 16 2HB ASP 16 3.327 21.021 2.914
106 H GLY 17 H GLY 17 -0.110 19.601 3.780
107 HA2 GLY 17 1HA GLY 17 -2.220 20.152 5.268
108 HA3 GLY 17 2HA GLY 17 -2.095 21.661 4.376
109 H GLY 18 H GLY 18 -3.773 18.911 4.464
110 HA2 GLY 18 1HA GLY 18 -5.376 18.950 2.448
111 HA3 GLY 18 2HA GLY 18 -3.915 18.591 1.540
112 H SER 19 H SER 19 -4.929 16.650 0.814
113 HA SER 19 HA SER 19 -4.223 14.372 2.310
114 HB2 SER 19 1HB SER 19 -6.579 13.469 2.610
115 HB3 SER 19 2HB SER 19 -6.115 14.770 3.707
116 HG SER 19 HG SER 19 -8.071 14.707 1.807
117 H TYR 20 H TYR 20 -3.548 13.129 0.702
118 HA TYR 20 HA TYR 20 -4.918 13.214 -1.876
119 HB2 TYR 20 1HB TYR 20 -2.221 12.306 -0.953
120 HB3 TYR 20 2HB TYR 20 -2.880 11.648 -2.447
121 HD1 TYR 20 1HD TYR 20 -3.481 15.089 -1.256
122 HD2 TYR 20 2HD TYR 20 -1.291 12.617 -3.938
123 HE1 TYR 20 1HE TYR 20 -2.718 17.090 -2.468
124 HE2 TYR 20 2HE TYR 20 -0.521 14.610 -5.156
125 HH TYR 20 HH TYR 20 -1.771 17.297 -5.262
126 H ALA 21 H ALA 21 -5.300 11.177 -3.038
127 HA ALA 21 HA ALA 21 -6.008 8.981 -1.202
128 HB1 ALA 21 1HB ALA 21 -7.531 9.764 -3.682
129 HB2 ALA 21 2HB ALA 21 -7.978 8.536 -2.498
130 HB3 ALA 21 3HB ALA 21 -7.978 10.240 -2.044
131 H TYR 22 H TYR 22 -4.677 7.332 -1.559
132 HA TYR 22 HA TYR 22 -3.834 6.771 -4.324
133 HB2 TYR 22 1HB TYR 22 -2.504 6.142 -1.686
134 HB3 TYR 22 2HB TYR 22 -1.966 5.475 -3.223
135 HD1 TYR 22 2HD TYR 22 -2.459 8.649 -1.369
136 HD2 TYR 22 1HD TYR 22 -0.574 6.721 -4.661
137 HE1 TYR 22 2HE TYR 22 -1.088 10.655 -1.752
138 HE2 TYR 22 1HE TYR 22 0.803 8.722 -5.052
139 HH TYR 22 HH TYR 22 0.750 11.113 -4.582
140 H ALA 23 H ALA 23 -3.654 4.536 -4.965
141 HA ALA 23 HA ALA 23 -5.493 2.767 -3.488
142 HB1 ALA 23 1HB ALA 23 -6.643 3.348 -5.451
143 HB2 ALA 23 2HB ALA 23 -5.194 3.192 -6.446
144 HB3 ALA 23 3HB ALA 23 -5.962 1.753 -5.775
145 H ILE 24 H ILE 24 -4.565 0.995 -2.721
146 HA ILE 24 HA ILE 24 -2.543 -0.401 -4.271
147 HB ILE 24 HB ILE 24 -1.015 0.904 -3.086
148 HG12 ILE 24 1HG1 ILE 24 -1.354 -1.413 -1.186
149 HG13 ILE 24 2HG1 ILE 24 -0.767 -1.632 -2.831
150 HG21 ILE 24 1HG2 ILE 24 -2.981 0.718 -0.847
151 HG22 ILE 24 2HG2 ILE 24 -1.292 1.087 -0.503
152 HG23 ILE 24 3HG2 ILE 24 -2.226 2.142 -1.563
153 HD11 ILE 24 1HD1 ILE 24 0.616 -0.681 -0.471
154 HD12 ILE 24 2HD1 ILE 24 1.260 -1.304 -1.990
155 HD13 ILE 24 3HD1 ILE 24 0.816 0.397 -1.852
156 H ASN 25 H ASN 25 -2.478 -2.575 -3.871
157 HA ASN 25 HA ASN 25 -4.708 -3.773 -2.644
158 HB2 ASN 25 1HB ASN 25 -2.071 -4.880 -3.603
159 HB3 ASN 25 2HB ASN 25 -3.320 -5.907 -2.907
160 HD21 ASN 25 1HD2 ASN 25 -2.069 -4.928 -5.717
161 HD22 ASN 25 2HD2 ASN 25 -3.454 -5.057 -6.741
162 HA PRO 26 HA PRO 26 -3.551 -3.944 1.599
163 HB2 PRO 26 1HB PRO 26 -5.065 -6.060 2.376
164 HB3 PRO 26 2HB PRO 26 -5.748 -4.468 2.021
165 HG2 PRO 26 1HG PRO 26 -5.634 -6.909 0.291
166 HG3 PRO 26 2HG PRO 26 -6.975 -5.775 0.540
167 HD2 PRO 26 1HD PRO 26 -5.370 -5.678 -1.639
168 HD3 PRO 26 2HD PRO 26 -6.103 -4.226 -0.927
169 H ASN 27 H ASN 27 -2.987 -6.533 -0.597
170 HA ASN 27 HA ASN 27 -1.528 -8.140 1.335
171 HB2 ASN 27 1HB ASN 27 -2.861 -9.300 -0.345
172 HB3 ASN 27 2HB ASN 27 -1.965 -8.505 -1.637
173 HD21 ASN 27 1HD2 ASN 27 0.030 -9.249 -2.206
174 HD22 ASN 27 2HD2 ASN 27 0.719 -10.703 -1.575
175 H SER 28 H SER 28 -0.916 -5.797 -1.153
176 HA SER 28 HA SER 28 1.806 -6.369 -1.630
177 HB2 SER 28 1HB SER 28 0.125 -3.893 -1.983
178 HB3 SER 28 2HB SER 28 1.849 -3.897 -2.355
179 HG SER 28 HG SER 28 1.292 -4.729 -4.191
180 H PHE 29 H PHE 29 3.655 -5.062 -0.976
181 HA PHE 29 HA PHE 29 3.713 -4.710 1.865
182 HB2 PHE 29 1HB PHE 29 5.835 -4.017 -0.178
183 HB3 PHE 29 2HB PHE 29 6.074 -4.192 1.558
184 HD1 PHE 29 2HD PHE 29 4.925 -6.591 2.372
185 HD2 PHE 29 1HD PHE 29 6.748 -5.731 -1.377
186 HE1 PHE 29 2HE PHE 29 5.411 -8.983 2.064
187 HE2 PHE 29 1HE PHE 29 7.237 -8.122 -1.691
188 HZ PHE 29 HZ PHE 29 6.569 -9.751 0.031
189 H ILE 30 H ILE 30 4.189 -2.798 3.014
190 HA ILE 30 HA ILE 30 2.719 -0.563 2.410
191 HB ILE 30 HB ILE 30 5.270 -0.642 4.025
192 HG12 ILE 30 1HG1 ILE 30 3.472 -2.220 4.749
193 HG13 ILE 30 2HG1 ILE 30 3.851 -0.987 5.947
194 HG21 ILE 30 1HG2 ILE 30 4.577 1.633 3.335
195 HG22 ILE 30 2HG2 ILE 30 3.024 1.365 4.125
196 HG23 ILE 30 3HG2 ILE 30 4.507 1.385 5.080
197 HD11 ILE 30 1HD1 ILE 30 1.705 -0.219 4.135
198 HD12 ILE 30 2HD1 ILE 30 1.351 -1.660 5.090
199 HD13 ILE 30 3HD1 ILE 30 1.789 -0.153 5.895
200 H LEU 31 H LEU 31 6.107 -1.197 1.615
201 HA LEU 31 HA LEU 31 6.923 1.245 0.676
202 HB2 LEU 31 1HB LEU 31 8.317 -0.794 0.822
203 HB3 LEU 31 2HB LEU 31 7.510 -1.413 -0.618
204 HG LEU 31 HG LEU 31 8.401 0.669 -1.801
205 HD11 LEU 31 1HD1 LEU 31 10.428 0.691 0.405
206 HD12 LEU 31 2HD1 LEU 31 9.001 1.725 0.462
207 HD13 LEU 31 3HD1 LEU 31 10.152 1.884 -0.865
208 HD21 LEU 31 1HD2 LEU 31 9.888 -1.738 -0.934
209 HD22 LEU 31 2HD2 LEU 31 10.823 -0.450 -1.694
210 HD23 LEU 31 3HD2 LEU 31 9.469 -1.184 -2.554
211 H GLY 32 H GLY 32 5.199 -1.264 -1.174
212 HA2 GLY 32 1HA GLY 32 5.073 -0.151 -3.654
213 HA3 GLY 32 2HA GLY 32 3.733 -1.036 -2.941
214 H LEU 33 H LEU 33 3.204 0.839 -0.834
215 HA LEU 33 HA LEU 33 1.520 2.641 -2.272
216 HB2 LEU 33 1HB LEU 33 0.681 1.812 -0.232
217 HB3 LEU 33 2HB LEU 33 2.148 2.253 0.639
218 HG LEU 33 HG LEU 33 1.564 4.599 0.501
219 HD11 LEU 33 1HD1 LEU 33 -0.906 4.983 -0.335
220 HD12 LEU 33 2HD1 LEU 33 -0.538 3.577 -1.334
221 HD13 LEU 33 3HD1 LEU 33 0.460 5.026 -1.450
222 HD21 LEU 33 1HD2 LEU 33 -0.841 3.025 1.406
223 HD22 LEU 33 2HD2 LEU 33 -0.316 4.607 1.981
224 HD23 LEU 33 3HD2 LEU 33 0.652 3.175 2.333
225 H LYS 34 H LYS 34 4.326 3.104 -0.130
226 HA LYS 34 HA LYS 34 4.505 5.870 -0.284
227 HB2 LYS 34 1HB LYS 34 6.445 3.674 0.260
228 HB3 LYS 34 2HB LYS 34 7.090 5.282 -0.041
229 HG2 LYS 34 1HG LYS 34 6.876 5.351 2.224
230 HG3 LYS 34 2HG LYS 34 5.296 5.980 1.750
231 HD2 LYS 34 1HD LYS 34 4.213 3.984 2.261
232 HD3 LYS 34 2HD LYS 34 5.704 3.043 2.182
233 HE2 LYS 34 1HE LYS 34 5.225 5.157 4.267
234 HE3 LYS 34 2HE LYS 34 4.744 3.476 4.493
235 HZ1 LYS 34 1HZ LYS 34 7.509 4.418 3.956
236 HZ2 LYS 34 2HZ LYS 34 7.043 2.810 4.192
237 HZ3 LYS 34 3HZ LYS 34 6.914 3.922 5.460
238 H GLN 35 H GLN 35 6.302 3.492 -2.248
239 HA GLN 35 HA GLN 35 7.731 5.024 -3.917
240 HB2 GLN 35 1HB GLN 35 7.605 2.585 -4.112
241 HB3 GLN 35 2HB GLN 35 5.988 2.714 -4.791
242 HG2 GLN 35 1HG GLN 35 7.644 2.311 -6.520
243 HG3 GLN 35 2HG GLN 35 6.873 3.883 -6.728
244 HE21 GLN 35 1HE2 GLN 35 8.252 5.350 -7.390
245 HE22 GLN 35 2HE2 GLN 35 9.903 5.499 -6.902
246 H GLN 36 H GLN 36 4.259 4.386 -4.333
247 HA GLN 36 HA GLN 36 3.849 5.823 -6.672
248 HB2 GLN 36 1HB GLN 36 2.128 5.017 -4.381
249 HB3 GLN 36 2HB GLN 36 1.493 6.223 -5.493
250 HG2 GLN 36 1HG GLN 36 2.088 4.580 -7.347
251 HG3 GLN 36 2HG GLN 36 2.278 3.388 -6.063
252 HE21 GLN 36 1HE2 GLN 36 0.432 2.960 -4.705
253 HE22 GLN 36 2HE2 GLN 36 -1.161 3.136 -5.350
254 H ILE 37 H ILE 37 3.811 6.942 -3.313
255 HA ILE 37 HA ILE 37 3.014 9.591 -3.848
256 HB ILE 37 HB ILE 37 4.660 8.519 -1.554
257 HG12 ILE 37 1HG1 ILE 37 1.746 9.263 -1.492
258 HG13 ILE 37 2HG1 ILE 37 2.258 7.659 -2.004
259 HG21 ILE 37 1HG2 ILE 37 3.087 10.891 -1.021
260 HG22 ILE 37 2HG2 ILE 37 4.790 10.569 -0.697
261 HG23 ILE 37 3HG2 ILE 37 4.291 11.167 -2.280
262 HD11 ILE 37 1HD1 ILE 37 3.382 8.619 0.541
263 HD12 ILE 37 2HD1 ILE 37 1.649 8.288 0.523
264 HD13 ILE 37 3HD1 ILE 37 2.794 7.021 0.083
265 H GLU 38 H GLU 38 6.190 8.057 -3.678
266 HA GLU 38 HA GLU 38 7.690 10.456 -3.914
267 HB2 GLU 38 1HB GLU 38 8.797 8.551 -3.014
268 HB3 GLU 38 2HB GLU 38 8.368 7.560 -4.401
269 HG2 GLU 38 1HG GLU 38 9.787 9.191 -5.769
270 HG3 GLU 38 2HG GLU 38 10.420 9.732 -4.215
271 H ASP 39 H ASP 39 6.200 8.294 -6.205
272 HA ASP 39 HA ASP 39 7.572 9.451 -8.477
273 HB2 ASP 39 1HB ASP 39 5.578 7.264 -8.075
274 HB3 ASP 39 2HB ASP 39 5.709 7.996 -9.672
275 H GLN 40 H GLN 40 4.759 10.074 -6.644
276 HA GLN 40 HA GLN 40 3.487 11.588 -8.794
277 HB2 GLN 40 1HB GLN 40 2.605 10.782 -6.031
278 HB3 GLN 40 2HB GLN 40 1.713 11.963 -6.981
279 HG2 GLN 40 1HG GLN 40 2.342 9.208 -7.995
280 HG3 GLN 40 2HG GLN 40 0.888 9.580 -7.069
281 HE21 GLN 40 1HE2 GLN 40 2.623 10.184 -10.043
282 HE22 GLN 40 2HE2 GLN 40 1.266 10.758 -10.946
283 H GLN 41 H GLN 41 4.259 12.189 -5.361
284 HA GLN 41 HA GLN 41 4.194 15.029 -5.726
285 HB2 GLN 41 1HB GLN 41 5.223 13.405 -3.393
286 HB3 GLN 41 2HB GLN 41 4.903 15.134 -3.380
287 HG2 GLN 41 1HG GLN 41 2.502 14.395 -4.094
288 HG3 GLN 41 2HG GLN 41 2.992 12.852 -3.397
289 HE21 GLN 41 1HE2 GLN 41 1.193 13.346 -1.930
290 HE22 GLN 41 2HE2 GLN 41 1.511 14.314 -0.535
291 H GLY 42 H GLY 42 6.687 12.562 -5.596
292 HA2 GLY 42 1HA GLY 42 8.774 12.824 -6.707
293 HA3 GLY 42 2HA GLY 42 8.619 14.565 -6.527
294 H LEU 43 H LEU 43 7.744 13.197 -3.649
295 HA LEU 43 HA LEU 43 10.253 13.964 -2.427
296 HB2 LEU 43 1HB LEU 43 7.763 14.308 -1.604
297 HB3 LEU 43 2HB LEU 43 8.040 12.730 -0.870
298 HG LEU 43 HG LEU 43 10.004 14.921 -0.375
299 HD11 LEU 43 1HD1 LEU 43 7.192 14.969 0.393
300 HD12 LEU 43 2HD1 LEU 43 8.406 16.247 0.442
301 HD13 LEU 43 3HD1 LEU 43 8.298 15.083 1.763
302 HD21 LEU 43 1HD2 LEU 43 10.264 12.506 0.366
303 HD22 LEU 43 2HD2 LEU 43 8.938 12.816 1.487
304 HD23 LEU 43 3HD2 LEU 43 10.435 13.740 1.615
305 HA PRO 44 HA PRO 44 11.951 9.899 -2.241
306 HB2 PRO 44 1HB PRO 44 13.761 10.318 -0.262
307 HB3 PRO 44 2HB PRO 44 13.976 10.931 -1.906
308 HG2 PRO 44 1HG PRO 44 12.992 12.359 0.535
309 HG3 PRO 44 2HG PRO 44 14.125 12.919 -0.709
310 HD2 PRO 44 1HD PRO 44 11.521 13.660 -0.671
311 HD3 PRO 44 2HD PRO 44 12.437 13.467 -2.179
312 H LYS 45 H LYS 45 11.917 8.037 -0.965
313 HA LYS 45 HA LYS 45 9.868 7.932 1.011
314 HB2 LYS 45 1HB LYS 45 11.915 5.819 0.315
315 HB3 LYS 45 2HB LYS 45 10.397 5.564 1.166
316 HG2 LYS 45 1HG LYS 45 9.122 5.922 -0.759
317 HG3 LYS 45 2HG LYS 45 10.465 6.686 -1.613
318 HD2 LYS 45 1HD LYS 45 10.785 3.868 -0.708
319 HD3 LYS 45 2HD LYS 45 9.750 4.186 -2.103
320 HE2 LYS 45 1HE LYS 45 12.037 3.697 -2.797
321 HE3 LYS 45 2HE LYS 45 11.590 5.353 -3.207
322 HZ1 LYS 45 1HZ LYS 45 13.854 5.040 -2.201
323 HZ2 LYS 45 2HZ LYS 45 13.084 4.663 -0.743
324 HZ3 LYS 45 3HZ LYS 45 12.875 6.191 -1.438
325 H LYS 46 H LYS 46 13.369 8.048 1.095
326 HA LYS 46 HA LYS 46 13.737 7.316 3.789
327 HB2 LYS 46 1HB LYS 46 15.907 8.634 3.537
328 HB3 LYS 46 2HB LYS 46 15.658 7.295 2.424
329 HG2 LYS 46 1HG LYS 46 15.389 8.665 0.613
330 HG3 LYS 46 2HG LYS 46 14.807 10.018 1.585
331 HD2 LYS 46 1HD LYS 46 17.074 10.351 2.462
332 HD3 LYS 46 2HD LYS 46 17.649 9.008 1.472
333 HE2 LYS 46 1HE LYS 46 16.655 10.352 -0.501
334 HE3 LYS 46 2HE LYS 46 16.686 11.714 0.617
335 HZ1 LYS 46 1HZ LYS 46 18.845 10.461 -0.789
336 HZ2 LYS 46 2HZ LYS 46 19.160 10.617 0.865
337 HZ3 LYS 46 3HZ LYS 46 18.776 11.984 -0.055
338 H GLN 47 H GLN 47 12.185 9.974 2.503
339 HA GLN 47 HA GLN 47 12.759 11.640 4.858
340 HB2 GLN 47 1HB GLN 47 11.745 12.304 2.104
341 HB3 GLN 47 2HB GLN 47 11.564 13.426 3.445
342 HG2 GLN 47 1HG GLN 47 13.989 13.450 3.751
343 HG3 GLN 47 2HG GLN 47 14.166 12.334 2.398
344 HE21 GLN 47 1HE2 GLN 47 15.575 14.142 1.677
345 HE22 GLN 47 2HE2 GLN 47 14.844 15.408 0.757
346 H GLN 48 H GLN 48 10.063 10.588 2.785
347 HA GLN 48 HA GLN 48 8.051 11.496 4.583
348 HB2 GLN 48 1HB GLN 48 6.527 10.732 3.039
349 HB3 GLN 48 2HB GLN 48 7.943 10.935 2.016
350 HG2 GLN 48 1HG GLN 48 8.430 8.500 2.388
351 HG3 GLN 48 2HG GLN 48 6.847 8.381 3.155
352 HE21 GLN 48 1HE2 GLN 48 8.518 9.140 0.164
353 HE22 GLN 48 2HE2 GLN 48 7.188 8.800 -0.885
354 H GLN 49 H GLN 49 6.802 10.360 6.039
355 HA GLN 49 HA GLN 49 7.401 7.546 6.514
356 HB2 GLN 49 1HB GLN 49 8.955 9.003 7.909
357 HB3 GLN 49 2HB GLN 49 7.523 9.524 8.786
358 HG2 GLN 49 1HG GLN 49 7.075 7.123 9.312
359 HG3 GLN 49 2HG GLN 49 8.646 6.742 8.609
360 HE21 GLN 49 1HE2 GLN 49 7.102 7.249 11.425
361 HE22 GLN 49 2HE2 GLN 49 8.420 7.788 12.404
362 H LEU 50 H LEU 50 5.490 6.580 6.539
363 HA LEU 50 HA LEU 50 3.103 8.050 7.293
364 HB2 LEU 50 1HB LEU 50 3.468 5.236 6.274
365 HB3 LEU 50 2HB LEU 50 1.913 6.016 6.559
366 HG LEU 50 HG LEU 50 3.961 6.913 4.532
367 HD11 LEU 50 1HD1 LEU 50 2.604 4.674 4.253
368 HD12 LEU 50 2HD1 LEU 50 2.824 5.787 2.903
369 HD13 LEU 50 3HD1 LEU 50 1.308 5.784 3.805
370 HD21 LEU 50 1HD2 LEU 50 1.100 7.790 4.883
371 HD22 LEU 50 2HD2 LEU 50 2.296 8.441 3.762
372 HD23 LEU 50 3HD2 LEU 50 2.489 8.686 5.498
373 H GLU 51 H GLU 51 2.081 7.890 9.187
374 HA GLU 51 HA GLU 51 2.910 5.742 11.026
375 HB2 GLU 51 1HB GLU 51 2.159 8.603 11.636
376 HB3 GLU 51 2HB GLU 51 2.347 7.361 12.865
377 HG2 GLU 51 1HG GLU 51 4.381 8.468 12.885
378 HG3 GLU 51 2HG GLU 51 4.698 7.036 11.907
379 H PHE 52 H PHE 52 1.276 5.146 12.656
380 HA PHE 52 HA PHE 52 -1.486 5.759 11.998
381 HB2 PHE 52 1HB PHE 52 -0.644 3.746 10.599
382 HB3 PHE 52 2HB PHE 52 -0.697 2.860 12.120
383 HD1 PHE 52 2HD PHE 52 -2.922 5.279 10.344
384 HD2 PHE 52 1HD PHE 52 -2.551 1.547 12.356
385 HE1 PHE 52 2HE PHE 52 -5.325 4.866 10.014
386 HE2 PHE 52 1HE PHE 52 -4.953 1.127 12.028
387 HZ PHE 52 HZ PHE 52 -6.344 2.788 10.857
388 H GLN 53 H GLN 53 -2.708 5.842 13.780
389 HA GLN 53 HA GLN 53 -3.180 5.926 16.015
390 HB2 GLN 53 1HB GLN 53 -2.482 3.088 15.417
391 HB3 GLN 53 2HB GLN 53 -2.750 3.545 17.094
392 HG2 GLN 53 1HG GLN 53 -4.974 4.289 16.597
393 HG3 GLN 53 2HG GLN 53 -4.716 4.033 14.872
394 HE21 GLN 53 1HE2 GLN 53 -5.924 2.389 14.262
395 HE22 GLN 53 2HE2 GLN 53 -6.062 0.872 15.077
396 H GLY 54 H GLY 54 -0.433 6.671 15.231
397 HA2 GLY 54 1HA GLY 54 1.333 7.529 16.468
398 HA3 GLY 54 2HA GLY 54 0.679 6.737 17.894
399 H GLN 55 H GLN 55 1.646 5.352 14.772
400 HA GLN 55 HA GLN 55 3.881 3.996 16.085
401 HB2 GLN 55 1HB GLN 55 3.209 1.845 15.559
402 HB3 GLN 55 2HB GLN 55 1.681 2.597 15.999
403 HG2 GLN 55 1HG GLN 55 1.452 3.080 13.478
404 HG3 GLN 55 2HG GLN 55 2.703 1.853 13.292
405 HE21 GLN 55 1HE2 GLN 55 0.571 1.166 12.062
406 HE22 GLN 55 2HE2 GLN 55 -0.400 0.034 12.932
407 H VAL 56 H VAL 56 5.521 3.283 14.668
408 HA VAL 56 HA VAL 56 5.621 4.794 12.185
409 HB VAL 56 HB VAL 56 7.800 3.043 13.312
410 HG11 VAL 56 1HG1 VAL 56 7.531 4.801 11.030
411 HG12 VAL 56 2HG1 VAL 56 8.875 5.281 12.068
412 HG13 VAL 56 3HG1 VAL 56 8.803 3.643 11.417
413 HG21 VAL 56 1HG2 VAL 56 6.684 5.222 14.615
414 HG22 VAL 56 2HG2 VAL 56 8.268 4.511 14.925
415 HG23 VAL 56 3HG2 VAL 56 8.115 5.877 13.821
416 H LEU 57 H LEU 57 5.389 3.953 10.211
417 HA LEU 57 HA LEU 57 4.959 1.070 9.981
418 HB2 LEU 57 1HB LEU 57 4.482 3.182 7.891
419 HB3 LEU 57 2HB LEU 57 3.872 1.528 7.906
420 HG LEU 57 HG LEU 57 3.061 3.638 9.902
421 HD11 LEU 57 1HD1 LEU 57 0.946 3.723 8.612
422 HD12 LEU 57 2HD1 LEU 57 1.716 2.757 7.353
423 HD13 LEU 57 3HD1 LEU 57 2.334 4.365 7.732
424 HD21 LEU 57 1HD2 LEU 57 2.412 0.787 9.456
425 HD22 LEU 57 2HD2 LEU 57 1.068 1.853 9.865
426 HD23 LEU 57 3HD2 LEU 57 2.454 1.724 10.950
427 H GLN 58 H GLN 58 6.033 -0.212 8.470
428 HA GLN 58 HA GLN 58 8.644 0.837 7.657
429 HB2 GLN 58 1HB GLN 58 7.611 -1.992 7.899
430 HB3 GLN 58 2HB GLN 58 9.214 -1.576 7.306
431 HG2 GLN 58 1HG GLN 58 8.098 -1.178 10.064
432 HG3 GLN 58 2HG GLN 58 9.461 -2.181 9.570
433 HE21 GLN 58 1HE2 GLN 58 8.425 0.917 10.544
434 HE22 GLN 58 2HE2 GLN 58 9.958 1.709 10.469
435 H ASP 59 H ASP 59 9.400 -0.662 5.605
436 HA ASP 59 HA ASP 59 7.436 -0.021 3.507
437 HB2 ASP 59 1HB ASP 59 10.342 -0.461 2.928
438 HB3 ASP 59 2HB ASP 59 9.170 0.529 2.063
439 H TRP 60 H TRP 60 9.445 -2.505 4.874
440 HA TRP 60 HA TRP 60 9.003 -4.353 2.693
441 HB2 TRP 60 1HB TRP 60 10.494 -5.774 3.761
442 HB3 TRP 60 2HB TRP 60 11.061 -4.196 4.301
443 HD1 TRP 60 HD TRP 60 8.931 -7.157 5.589
444 HE1 TRP 60 1HE TRP 60 9.102 -7.205 8.156
445 HE3 TRP 60 3HE TRP 60 11.656 -2.890 6.300
446 HZ2 TRP 60 2HZ TRP 60 10.241 -5.640 10.211
447 HZ3 TRP 60 3HZ TRP 60 12.244 -2.236 8.597
448 HH2 TRP 60 HH TRP 60 11.550 -3.584 10.511
449 H LEU 61 H LEU 61 7.616 -3.628 5.805
450 HA LEU 61 HA LEU 61 6.221 -6.027 6.248
451 HB2 LEU 61 1HB LEU 61 5.555 -3.208 7.079
452 HB3 LEU 61 2HB LEU 61 4.750 -4.649 7.695
453 HG LEU 61 HG LEU 61 7.691 -4.079 8.040
454 HD11 LEU 61 1HD1 LEU 61 5.716 -3.885 10.260
455 HD12 LEU 61 2HD1 LEU 61 5.911 -2.517 9.164
456 HD13 LEU 61 3HD1 LEU 61 7.294 -3.117 10.080
457 HD21 LEU 61 1HD2 LEU 61 5.853 -6.086 9.343
458 HD22 LEU 61 2HD2 LEU 61 7.557 -5.840 9.728
459 HD23 LEU 61 3HD2 LEU 61 7.090 -6.442 8.137
460 H GLY 62 H GLY 62 3.679 -5.920 6.379
461 HA2 GLY 62 1HA GLY 62 2.742 -5.046 3.715
462 HA3 GLY 62 2HA GLY 62 2.186 -6.511 4.511
463 H LEU 63 H LEU 63 0.496 -4.466 3.520
464 HA LEU 63 HA LEU 63 -0.353 -2.644 5.475
465 HB2 LEU 63 1HB LEU 63 -1.590 -3.860 3.052
466 HB3 LEU 63 2HB LEU 63 -2.609 -2.945 4.161
467 HG LEU 63 HG LEU 63 -0.902 -1.050 3.847
468 HD11 LEU 63 1HD1 LEU 63 -0.234 -2.760 1.456
469 HD12 LEU 63 2HD1 LEU 63 0.848 -2.354 2.788
470 HD13 LEU 63 3HD1 LEU 63 0.278 -1.090 1.698
471 HD21 LEU 63 1HD2 LEU 63 -1.978 -0.465 1.603
472 HD22 LEU 63 2HD2 LEU 63 -3.051 -0.732 2.977
473 HD23 LEU 63 3HD2 LEU 63 -2.844 -1.993 1.761
474 H GLY 64 H GLY 64 -1.203 -6.008 4.884
475 HA2 GLY 64 1HA GLY 64 -3.356 -6.058 6.774
476 HA3 GLY 64 2HA GLY 64 -2.594 -7.454 6.025
477 H ILE 65 H ILE 65 0.083 -6.468 6.980
478 HA ILE 65 HA ILE 65 0.292 -8.023 9.284
479 HB ILE 65 HB ILE 65 2.101 -5.775 8.389
480 HG12 ILE 65 1HG1 ILE 65 1.857 -7.514 6.692
481 HG13 ILE 65 2HG1 ILE 65 3.461 -7.589 7.413
482 HG21 ILE 65 1HG2 ILE 65 3.346 -7.929 9.865
483 HG22 ILE 65 2HG2 ILE 65 3.433 -6.188 10.123
484 HG23 ILE 65 3HG2 ILE 65 2.104 -7.116 10.817
485 HD11 ILE 65 1HD1 ILE 65 3.085 -9.758 7.673
486 HD12 ILE 65 2HD1 ILE 65 1.971 -9.311 8.965
487 HD13 ILE 65 3HD1 ILE 65 1.365 -9.581 7.331
488 H TYR 66 H TYR 66 -0.151 -4.535 8.915
489 HA TYR 66 HA TYR 66 -0.102 -4.104 11.777
490 HB2 TYR 66 1HB TYR 66 -0.336 -2.359 9.363
491 HB3 TYR 66 2HB TYR 66 -0.892 -1.735 10.911
492 HD1 TYR 66 2HD TYR 66 0.889 -2.260 12.898
493 HD2 TYR 66 1HD TYR 66 1.814 -1.803 8.770
494 HE1 TYR 66 2HE TYR 66 3.199 -1.655 13.488
495 HE2 TYR 66 1HE TYR 66 4.127 -1.198 9.349
496 HH TYR 66 HH TYR 66 5.695 -1.731 11.459
497 H GLY 67 H GLY 67 -2.488 -4.044 9.155
498 HA2 GLY 67 1HA GLY 67 -4.699 -4.962 9.635
499 HA3 GLY 67 2HA GLY 67 -4.596 -4.203 11.217
500 H ILE 68 H ILE 68 -3.627 -2.643 8.227
501 HA ILE 68 HA ILE 68 -5.273 -0.381 8.766
502 HB ILE 68 HB ILE 68 -3.758 -1.095 6.253
503 HG12 ILE 68 1HG1 ILE 68 -2.932 0.917 8.330
504 HG13 ILE 68 2HG1 ILE 68 -2.511 -0.784 8.501
505 HG21 ILE 68 1HG2 ILE 68 -3.871 1.504 6.054
506 HG22 ILE 68 2HG2 ILE 68 -5.232 0.517 5.524
507 HG23 ILE 68 3HG2 ILE 68 -5.288 1.327 7.089
508 HD11 ILE 68 1HD1 ILE 68 -0.953 1.023 7.287
509 HD12 ILE 68 2HD1 ILE 68 -0.955 -0.693 6.881
510 HD13 ILE 68 3HD1 ILE 68 -1.880 0.446 5.903
511 H GLN 69 H GLN 69 -7.120 0.329 7.742
512 HA GLN 69 HA GLN 69 -8.471 -1.644 6.018
513 HB2 GLN 69 1HB GLN 69 -9.753 0.247 7.998
514 HB3 GLN 69 2HB GLN 69 -10.599 -0.907 6.976
515 HG2 GLN 69 1HG GLN 69 -9.240 -2.706 8.133
516 HG3 GLN 69 2HG GLN 69 -8.781 -1.463 9.295
517 HE21 GLN 69 1HE2 GLN 69 -11.549 -3.098 7.853
518 HE22 GLN 69 2HE2 GLN 69 -12.595 -2.920 9.216
519 H ASP 70 H ASP 70 -10.163 -0.682 4.599
520 HA ASP 70 HA ASP 70 -9.068 1.349 2.992
521 HB2 ASP 70 1HB ASP 70 -10.484 0.039 1.757
522 HB3 ASP 70 2HB ASP 70 -11.636 -0.148 3.076
523 H SER 71 H SER 71 -10.094 3.421 2.442
524 HA SER 71 HA SER 71 -10.673 5.537 3.051
525 HB2 SER 71 1HB SER 71 -12.819 5.806 4.016
526 HB3 SER 71 2HB SER 71 -12.902 4.277 3.140
527 HG SER 71 HG SER 71 -12.944 4.771 5.874
528 H ASP 72 H ASP 72 -8.512 4.485 4.470
529 HA ASP 72 HA ASP 72 -8.913 5.374 7.233
530 HB2 ASP 72 1HB ASP 72 -6.904 3.636 5.866
531 HB3 ASP 72 2HB ASP 72 -6.424 4.484 7.334
532 H THR 73 H THR 73 -6.987 6.578 8.191
533 HA THR 73 HA THR 73 -6.124 8.657 6.287
534 HB THR 73 HB THR 73 -6.746 8.913 9.234
535 HG1 THR 73 1HG THR 73 -7.903 10.212 6.976
536 HG21 THR 73 1HG2 THR 73 -5.061 10.527 7.488
537 HG22 THR 73 2HG2 THR 73 -5.233 10.566 9.243
538 HG23 THR 73 3HG2 THR 73 -6.367 11.454 8.225
539 H LEU 74 H LEU 74 -4.016 8.722 5.908
540 HA LEU 74 HA LEU 74 -2.187 7.611 7.932
541 HB2 LEU 74 1HB LEU 74 -1.694 7.913 4.975
542 HB3 LEU 74 2HB LEU 74 -0.658 7.098 6.144
543 HG LEU 74 HG LEU 74 -3.444 6.149 5.522
544 HD11 LEU 74 1HD1 LEU 74 -2.189 4.414 4.124
545 HD12 LEU 74 2HD1 LEU 74 -0.863 5.576 4.106
546 HD13 LEU 74 3HD1 LEU 74 -2.428 6.015 3.423
547 HD21 LEU 74 1HD2 LEU 74 -2.253 3.972 6.265
548 HD22 LEU 74 2HD2 LEU 74 -2.753 5.140 7.488
549 HD23 LEU 74 3HD2 LEU 74 -1.065 5.064 6.978
550 H ILE 75 H ILE 75 -0.833 8.969 8.895
551 HA ILE 75 HA ILE 75 -0.721 11.730 8.070
552 HB ILE 75 HB ILE 75 0.882 10.440 10.273
553 HG12 ILE 75 1HG1 ILE 75 -1.408 9.875 10.716
554 HG13 ILE 75 2HG1 ILE 75 -0.982 11.217 11.771
555 HG21 ILE 75 1HG2 ILE 75 -0.142 13.258 10.135
556 HG22 ILE 75 2HG2 ILE 75 1.140 12.598 11.149
557 HG23 ILE 75 3HG2 ILE 75 1.397 12.788 9.414
558 HD11 ILE 75 1HD1 ILE 75 -2.159 12.762 10.368
559 HD12 ILE 75 2HD1 ILE 75 -2.464 11.503 9.170
560 HD13 ILE 75 3HD1 ILE 75 -3.225 11.412 10.758
561 H LEU 76 H LEU 76 0.734 12.584 6.748
562 HA LEU 76 HA LEU 76 3.198 11.072 6.204
563 HB2 LEU 76 1HB LEU 76 1.834 11.353 4.249
564 HB3 LEU 76 2HB LEU 76 1.697 13.085 4.541
565 HG LEU 76 HG LEU 76 4.333 12.963 4.274
566 HD11 LEU 76 1HD1 LEU 76 4.741 11.345 2.330
567 HD12 LEU 76 2HD1 LEU 76 3.295 10.511 2.897
568 HD13 LEU 76 3HD1 LEU 76 4.689 10.680 3.963
569 HD21 LEU 76 1HD2 LEU 76 3.329 14.416 2.836
570 HD22 LEU 76 2HD2 LEU 76 2.130 13.237 2.302
571 HD23 LEU 76 3HD2 LEU 76 3.783 13.154 1.690
572 H SER 77 H SER 77 5.054 11.874 6.915
573 HA SER 77 HA SER 77 5.409 14.765 7.125
574 HB2 SER 77 1HB SER 77 5.683 12.831 9.426
575 HB3 SER 77 2HB SER 77 6.469 14.410 9.420
576 HG SER 77 HG SER 77 4.453 15.380 9.297
577 H LYS 78 H LYS 78 7.548 15.448 6.993
578 HA LYS 78 HA LYS 78 9.357 13.500 5.820
579 HB2 LYS 78 1HB LYS 78 10.674 15.381 5.116
580 HB3 LYS 78 2HB LYS 78 8.985 15.742 4.784
581 HG2 LYS 78 1HG LYS 78 9.122 16.875 7.163
582 HG3 LYS 78 2HG LYS 78 10.837 16.961 6.757
583 HD2 LYS 78 1HD LYS 78 8.806 17.851 4.756
584 HD3 LYS 78 2HD LYS 78 9.221 18.914 6.102
585 HE2 LYS 78 1HE LYS 78 11.606 18.717 5.460
586 HE3 LYS 78 2HE LYS 78 11.120 17.758 4.062
587 HZ1 LYS 78 1HZ LYS 78 10.855 20.623 4.533
588 HZ2 LYS 78 2HZ LYS 78 9.590 19.873 3.698
589 HZ3 LYS 78 3HZ LYS 78 11.169 19.786 3.096
590 H LYS 79 H LYS 79 11.265 12.829 6.678
591 HA LYS 79 HA LYS 79 11.602 12.867 9.468
592 HB2 LYS 79 1HB LYS 79 13.780 12.295 7.460
593 HB3 LYS 79 2HB LYS 79 13.637 11.672 9.099
594 HG2 LYS 79 1HG LYS 79 11.368 10.702 8.129
595 HG3 LYS 79 2HG LYS 79 12.267 10.819 6.614
596 HD2 LYS 79 1HD LYS 79 14.121 9.548 7.710
597 HD3 LYS 79 2HD LYS 79 13.060 9.306 9.100
598 HE2 LYS 79 1HE LYS 79 11.561 7.990 7.859
599 HE3 LYS 79 2HE LYS 79 12.239 8.519 6.320
600 HZ1 LYS 79 1HZ LYS 79 12.889 6.240 6.977
601 HZ2 LYS 79 2HZ LYS 79 13.715 6.882 8.306
602 HZ3 LYS 79 3HZ LYS 79 14.210 7.269 6.736
603 H LYS 80 H LYS 80 12.477 14.320 10.786
604 HA LYS 80 HA LYS 80 13.521 16.779 9.785
605 HB2 LYS 80 1HB LYS 80 13.047 15.601 12.488
606 HB3 LYS 80 2HB LYS 80 14.111 16.996 12.357
607 HG2 LYS 80 1HG LYS 80 11.449 17.113 11.037
608 HG3 LYS 80 2HG LYS 80 11.536 17.272 12.793
609 HD2 LYS 80 1HD LYS 80 13.371 18.896 11.088
610 HD3 LYS 80 2HD LYS 80 11.683 19.388 11.250
611 HE2 LYS 80 1HE LYS 80 12.771 20.550 12.954
612 HE3 LYS 80 2HE LYS 80 12.066 19.159 13.776
613 HZ1 LYS 80 1HZ LYS 80 14.556 19.845 14.143
614 HZ2 LYS 80 2HZ LYS 80 14.796 18.913 12.752
615 HZ3 LYS 80 3HZ LYS 80 14.092 18.218 14.124
616 H GLY 81 H GLY 81 15.309 15.962 8.514
617 HA2 GLY 81 1HA GLY 81 17.677 16.205 8.479
618 HA3 GLY 81 2HA GLY 81 17.725 15.695 10.160
619 H SER 82 H SER 82 16.481 14.335 7.104
620 HA SER 82 HA SER 82 16.787 11.664 7.760
621 HB2 SER 82 1HB SER 82 16.596 11.184 5.421
622 HB3 SER 82 2HB SER 82 15.613 12.615 5.731
623 HG SER 82 HG SER 82 17.268 12.512 3.874
624 H GLY 83 H GLY 83 18.546 10.608 8.383
625 HA2 GLY 83 1HA GLY 83 21.182 11.559 7.582
626 HA3 GLY 83 2HA GLY 83 20.839 10.327 8.788
627 HA PRO 84 HA PRO 84 21.772 8.612 4.367
628 HB2 PRO 84 1HB PRO 84 24.487 8.602 4.317
629 HB3 PRO 84 2HB PRO 84 23.519 9.938 3.683
630 HG2 PRO 84 1HG PRO 84 24.912 9.693 6.321
631 HG3 PRO 84 2HG PRO 84 24.832 11.083 5.224
632 HD2 PRO 84 1HD PRO 84 23.278 10.879 7.432
633 HD3 PRO 84 2HD PRO 84 22.734 11.699 5.954
634 H SER 85 H SER 85 22.091 6.445 4.145
635 HA SER 85 HA SER 85 23.347 5.018 6.396
636 HB2 SER 85 1HB SER 85 21.646 3.339 6.352
637 HB3 SER 85 2HB SER 85 20.815 4.895 6.381
638 HG SER 85 HG SER 85 19.862 3.641 4.810
639 H SER 86 H SER 86 24.250 2.940 5.875
640 HA SER 86 HA SER 86 25.906 2.888 3.689
641 HB2 SER 86 1HB SER 86 26.381 1.381 5.454
642 HB3 SER 86 2HB SER 86 24.785 0.637 5.355
643 HG SER 86 HG SER 86 25.447 -0.586 3.760
644 H GLY 87 H GLY 87 25.147 3.232 1.673
645 HA2 GLY 87 1HA GLY 87 22.913 1.560 0.730
646 HA3 GLY 87 2HA GLY 87 23.417 3.079 0.005
Start of MODEL 7
1 H1 GLY 1 H GLY 1 -7.419 4.961 -13.914
2 HA2 GLY 1 1HA GLY 1 -9.451 4.139 -12.856
3 HA3 GLY 1 2HA GLY 1 -10.367 5.093 -14.014
4 H SER 2 H SER 2 -9.490 2.037 -13.246
5 HA SER 2 HA SER 2 -9.734 1.137 -16.042
6 HB2 SER 2 1HB SER 2 -7.483 0.684 -15.094
7 HB3 SER 2 2HB SER 2 -8.236 -0.268 -13.815
8 HG SER 2 HG SER 2 -8.855 -0.898 -16.466
9 H SER 3 H SER 3 -10.864 -0.859 -16.377
10 HA SER 3 HA SER 3 -13.252 -1.058 -14.899
11 HB2 SER 3 1HB SER 3 -13.793 -2.929 -16.316
12 HB3 SER 3 2HB SER 3 -12.948 -1.735 -17.302
13 HG SER 3 HG SER 3 -12.295 -4.091 -17.378
14 H GLY 4 H GLY 4 -13.681 -2.045 -13.042
15 HA2 GLY 4 1HA GLY 4 -13.658 -3.775 -11.469
16 HA3 GLY 4 2HA GLY 4 -12.302 -4.500 -12.320
17 H SER 5 H SER 5 -13.009 -1.490 -10.538
18 HA SER 5 HA SER 5 -10.354 -1.025 -9.744
19 HB2 SER 5 1HB SER 5 -13.010 -0.082 -8.675
20 HB3 SER 5 2HB SER 5 -11.489 0.403 -7.925
21 HG SER 5 HG SER 5 -10.962 1.540 -9.681
22 H SER 6 H SER 6 -9.123 -2.121 -8.382
23 HA SER 6 HA SER 6 -10.418 -3.596 -6.183
24 HB2 SER 6 1HB SER 6 -8.027 -4.385 -7.858
25 HB3 SER 6 2HB SER 6 -8.483 -5.204 -6.364
26 HG SER 6 HG SER 6 -10.662 -5.277 -7.581
27 H GLY 7 H GLY 7 -8.528 -4.254 -4.540
28 HA2 GLY 7 1HA GLY 7 -6.856 -3.561 -3.093
29 HA3 GLY 7 2HA GLY 7 -6.530 -2.211 -4.170
30 H ILE 8 H ILE 8 -6.397 -1.674 -1.567
31 HA ILE 8 HA ILE 8 -8.983 -0.594 -0.728
32 HB ILE 8 HB ILE 8 -7.908 -0.138 1.424
33 HG12 ILE 8 1HG1 ILE 8 -5.451 -1.544 0.392
34 HG13 ILE 8 2HG1 ILE 8 -5.611 0.208 0.321
35 HG21 ILE 8 1HG2 ILE 8 -8.478 -2.650 0.319
36 HG22 ILE 8 2HG2 ILE 8 -6.999 -2.855 1.257
37 HG23 ILE 8 3HG2 ILE 8 -8.448 -2.206 2.026
38 HD11 ILE 8 1HD1 ILE 8 -4.961 -1.517 2.559
39 HD12 ILE 8 2HD1 ILE 8 -4.698 0.214 2.344
40 HD13 ILE 8 3HD1 ILE 8 -6.254 -0.376 2.929
41 H GLN 9 H GLN 9 -9.267 1.593 -0.180
42 HA GLN 9 HA GLN 9 -7.398 3.401 -1.548
43 HB2 GLN 9 1HB GLN 9 -9.878 3.270 -2.201
44 HB3 GLN 9 2HB GLN 9 -10.195 4.101 -0.684
45 HG2 GLN 9 1HG GLN 9 -8.694 5.928 -1.437
46 HG3 GLN 9 2HG GLN 9 -8.557 5.113 -2.994
47 HE21 GLN 9 1HE2 GLN 9 -10.698 4.605 -4.040
48 HE22 GLN 9 2HE2 GLN 9 -11.910 5.833 -3.966
49 H VAL 10 H VAL 10 -6.032 4.443 -0.272
50 HA VAL 10 HA VAL 10 -6.896 5.132 2.461
51 HB VAL 10 HB VAL 10 -4.457 5.286 2.990
52 HG11 VAL 10 1HG1 VAL 10 -5.562 3.330 3.704
53 HG12 VAL 10 2HG1 VAL 10 -5.632 2.678 2.065
54 HG13 VAL 10 3HG1 VAL 10 -4.087 2.779 2.910
55 HG21 VAL 10 1HG2 VAL 10 -4.142 5.224 0.250
56 HG22 VAL 10 2HG2 VAL 10 -2.859 5.046 1.447
57 HG23 VAL 10 3HG2 VAL 10 -3.628 3.615 0.759
58 H PHE 11 H PHE 11 -6.229 7.169 3.327
59 HA PHE 11 HA PHE 11 -5.881 9.219 1.246
60 HB2 PHE 11 1HB PHE 11 -7.269 9.245 3.912
61 HB3 PHE 11 2HB PHE 11 -6.757 10.747 3.151
62 HD1 PHE 11 2HD PHE 11 -9.017 7.873 2.914
63 HD2 PHE 11 1HD PHE 11 -7.866 11.595 1.201
64 HE1 PHE 11 2HE PHE 11 -11.076 7.886 1.568
65 HE2 PHE 11 1HE PHE 11 -9.924 11.615 -0.148
66 HZ PHE 11 HZ PHE 11 -11.532 9.758 0.034
67 H VAL 12 H VAL 12 -3.778 9.695 1.083
68 HA VAL 12 HA VAL 12 -2.067 9.724 3.429
69 HB VAL 12 HB VAL 12 -1.399 10.357 0.550
70 HG11 VAL 12 1HG1 VAL 12 0.134 11.362 2.208
71 HG12 VAL 12 2HG1 VAL 12 0.438 9.752 2.865
72 HG13 VAL 12 3HG1 VAL 12 0.913 10.135 1.209
73 HG21 VAL 12 1HG2 VAL 12 -0.380 7.888 1.757
74 HG22 VAL 12 2HG2 VAL 12 -2.130 7.927 1.543
75 HG23 VAL 12 3HG2 VAL 12 -1.067 8.171 0.157
76 H LYS 13 H LYS 13 -2.174 11.463 4.694
77 HA LYS 13 HA LYS 13 -2.701 14.089 3.548
78 HB2 LYS 13 1HB LYS 13 -3.962 13.911 5.461
79 HB3 LYS 13 2HB LYS 13 -2.774 12.907 6.281
80 HG2 LYS 13 1HG LYS 13 -1.342 14.898 6.569
81 HG3 LYS 13 2HG LYS 13 -2.613 15.881 5.837
82 HD2 LYS 13 1HD LYS 13 -3.270 14.133 8.167
83 HD3 LYS 13 2HD LYS 13 -2.433 15.663 8.442
84 HE2 LYS 13 1HE LYS 13 -4.599 16.370 8.597
85 HE3 LYS 13 2HE LYS 13 -4.337 16.587 6.867
86 HZ1 LYS 13 1HZ LYS 13 -6.160 15.346 6.648
87 HZ2 LYS 13 2HZ LYS 13 -6.099 14.777 8.240
88 HZ3 LYS 13 3HZ LYS 13 -5.178 14.023 7.037
89 H ASN 14 H ASN 14 -1.077 15.328 2.905
90 HA ASN 14 HA ASN 14 1.638 14.774 3.555
91 HB2 ASN 14 1HB ASN 14 0.817 17.419 2.431
92 HB3 ASN 14 2HB ASN 14 2.189 16.399 2.007
93 HD21 ASN 14 1HD2 ASN 14 0.323 17.643 0.228
94 HD22 ASN 14 2HD2 ASN 14 -0.462 16.378 -0.648
95 HA PRO 15 HA PRO 15 2.261 17.142 7.198
96 HB2 PRO 15 1HB PRO 15 4.813 17.995 6.840
97 HB3 PRO 15 2HB PRO 15 4.406 16.318 7.222
98 HG2 PRO 15 1HG PRO 15 5.050 17.555 4.573
99 HG3 PRO 15 2HG PRO 15 5.594 16.007 5.247
100 HD2 PRO 15 1HD PRO 15 3.585 16.184 3.440
101 HD3 PRO 15 2HD PRO 15 3.628 14.935 4.701
102 H ASP 16 H ASP 16 1.939 18.552 4.214
103 HA ASP 16 HA ASP 16 2.579 21.262 5.075
104 HB2 ASP 16 1HB ASP 16 3.250 20.882 2.851
105 HB3 ASP 16 2HB ASP 16 1.754 20.044 2.450
106 H GLY 17 H GLY 17 -0.250 19.524 3.765
107 HA2 GLY 17 1HA GLY 17 -2.187 20.148 5.492
108 HA3 GLY 17 2HA GLY 17 -2.004 21.674 4.641
109 H GLY 18 H GLY 18 -1.737 18.404 3.309
110 HA2 GLY 18 1HA GLY 18 -4.276 18.805 1.887
111 HA3 GLY 18 2HA GLY 18 -2.821 18.510 0.946
112 H SER 19 H SER 19 -4.737 16.782 0.483
113 HA SER 19 HA SER 19 -3.660 14.304 1.469
114 HB2 SER 19 1HB SER 19 -5.862 13.459 2.308
115 HB3 SER 19 2HB SER 19 -5.178 14.747 3.299
116 HG SER 19 HG SER 19 -6.617 16.184 2.395
117 H TYR 20 H TYR 20 -4.057 12.611 0.101
118 HA TYR 20 HA TYR 20 -5.927 13.070 -2.120
119 HB2 TYR 20 1HB TYR 20 -3.175 11.878 -2.480
120 HB3 TYR 20 2HB TYR 20 -4.329 12.303 -3.739
121 HD1 TYR 20 2HD TYR 20 -5.180 14.986 -2.947
122 HD2 TYR 20 1HD TYR 20 -1.312 13.219 -2.833
123 HE1 TYR 20 2HE TYR 20 -4.162 17.217 -3.132
124 HE2 TYR 20 1HE TYR 20 -0.283 15.445 -3.016
125 HH TYR 20 HH TYR 20 -1.515 18.104 -2.313
126 H ALA 21 H ALA 21 -6.358 11.025 -3.358
127 HA ALA 21 HA ALA 21 -6.619 8.803 -1.456
128 HB1 ALA 21 1HB ALA 21 -8.110 9.194 -4.046
129 HB2 ALA 21 2HB ALA 21 -8.471 8.038 -2.762
130 HB3 ALA 21 3HB ALA 21 -8.682 9.766 -2.478
131 H TYR 22 H TYR 22 -5.068 7.326 -1.639
132 HA TYR 22 HA TYR 22 -3.910 6.774 -4.275
133 HB2 TYR 22 1HB TYR 22 -2.975 6.299 -1.459
134 HB3 TYR 22 2HB TYR 22 -2.261 5.412 -2.802
135 HD1 TYR 22 2HD TYR 22 -2.886 8.839 -1.515
136 HD2 TYR 22 1HD TYR 22 -0.592 6.391 -4.132
137 HE1 TYR 22 2HE TYR 22 -1.381 10.733 -1.958
138 HE2 TYR 22 1HE TYR 22 0.920 8.278 -4.581
139 HH TYR 22 HH TYR 22 0.723 10.858 -4.487
140 H ALA 23 H ALA 23 -3.706 4.648 -5.061
141 HA ALA 23 HA ALA 23 -5.623 2.745 -3.882
142 HB1 ALA 23 1HB ALA 23 -5.687 3.831 -6.399
143 HB2 ALA 23 2HB ALA 23 -4.908 2.272 -6.669
144 HB3 ALA 23 3HB ALA 23 -6.494 2.344 -5.900
145 H ILE 24 H ILE 24 -4.747 0.993 -3.014
146 HA ILE 24 HA ILE 24 -2.564 -0.383 -4.308
147 HB ILE 24 HB ILE 24 -1.329 1.246 -2.971
148 HG12 ILE 24 1HG1 ILE 24 -1.124 -1.427 -1.590
149 HG13 ILE 24 2HG1 ILE 24 -0.588 -1.187 -3.249
150 HG21 ILE 24 1HG2 ILE 24 -2.669 0.033 -0.559
151 HG22 ILE 24 2HG2 ILE 24 -1.499 1.352 -0.578
152 HG23 ILE 24 3HG2 ILE 24 -3.104 1.588 -1.268
153 HD11 ILE 24 1HD1 ILE 24 1.342 -0.384 -2.540
154 HD12 ILE 24 2HD1 ILE 24 0.521 0.853 -1.587
155 HD13 ILE 24 3HD1 ILE 24 0.844 -0.732 -0.885
156 H ASN 25 H ASN 25 -2.477 -2.535 -3.789
157 HA ASN 25 HA ASN 25 -4.769 -3.637 -2.482
158 HB2 ASN 25 1HB ASN 25 -2.273 -4.945 -3.583
159 HB3 ASN 25 2HB ASN 25 -3.670 -5.828 -2.975
160 HD21 ASN 25 1HD2 ASN 25 -5.637 -5.700 -4.114
161 HD22 ASN 25 2HD2 ASN 25 -5.675 -5.250 -5.782
162 HA PRO 26 HA PRO 26 -3.217 -3.939 1.627
163 HB2 PRO 26 1HB PRO 26 -4.794 -5.956 2.528
164 HB3 PRO 26 2HB PRO 26 -5.394 -4.316 2.259
165 HG2 PRO 26 1HG PRO 26 -5.623 -6.729 0.502
166 HG3 PRO 26 2HG PRO 26 -6.850 -5.509 0.893
167 HD2 PRO 26 1HD PRO 26 -5.462 -5.488 -1.432
168 HD3 PRO 26 2HD PRO 26 -6.017 -4.000 -0.638
169 H ASN 27 H ASN 27 -3.116 -6.574 -0.608
170 HA ASN 27 HA ASN 27 -1.649 -8.351 1.123
171 HB2 ASN 27 1HB ASN 27 -1.720 -9.898 -0.624
172 HB3 ASN 27 2HB ASN 27 -3.201 -8.976 -0.864
173 HD21 ASN 27 1HD2 ASN 27 -0.109 -9.795 -2.117
174 HD22 ASN 27 2HD2 ASN 27 -0.263 -8.978 -3.632
175 H SER 28 H SER 28 -0.922 -5.836 -1.135
176 HA SER 28 HA SER 28 1.767 -6.596 -1.689
177 HB2 SER 28 1HB SER 28 1.936 -4.597 -2.881
178 HB3 SER 28 2HB SER 28 0.208 -4.938 -2.966
179 HG SER 28 HG SER 28 1.428 -2.804 -1.938
180 H PHE 29 H PHE 29 3.634 -5.144 -1.095
181 HA PHE 29 HA PHE 29 3.770 -4.971 1.772
182 HB2 PHE 29 1HB PHE 29 5.825 -4.180 -0.304
183 HB3 PHE 29 2HB PHE 29 6.118 -4.385 1.420
184 HD1 PHE 29 2HD PHE 29 4.972 -6.827 2.188
185 HD2 PHE 29 1HD PHE 29 6.789 -5.847 -1.534
186 HE1 PHE 29 2HE PHE 29 5.487 -9.204 1.817
187 HE2 PHE 29 1HE PHE 29 7.306 -8.223 -1.911
188 HZ PHE 29 HZ PHE 29 6.656 -9.905 -0.234
189 H ILE 30 H ILE 30 4.455 -3.071 2.943
190 HA ILE 30 HA ILE 30 2.886 -0.822 2.457
191 HB ILE 30 HB ILE 30 5.338 -1.177 4.169
192 HG12 ILE 30 1HG1 ILE 30 2.993 -2.262 4.609
193 HG13 ILE 30 2HG1 ILE 30 3.874 -1.513 5.936
194 HG21 ILE 30 1HG2 ILE 30 3.913 1.277 3.438
195 HG22 ILE 30 2HG2 ILE 30 4.113 1.035 5.173
196 HG23 ILE 30 3HG2 ILE 30 5.526 1.058 4.118
197 HD11 ILE 30 1HD1 ILE 30 1.917 0.101 4.374
198 HD12 ILE 30 2HD1 ILE 30 1.348 -1.027 5.605
199 HD13 ILE 30 3HD1 ILE 30 2.446 0.281 6.047
200 H LEU 31 H LEU 31 6.367 -1.291 1.891
201 HA LEU 31 HA LEU 31 7.220 1.110 1.049
202 HB2 LEU 31 1HB LEU 31 8.541 -0.983 1.014
203 HB3 LEU 31 2HB LEU 31 7.717 -1.444 -0.474
204 HG LEU 31 HG LEU 31 8.702 0.552 -1.576
205 HD11 LEU 31 1HD1 LEU 31 10.363 0.778 0.928
206 HD12 LEU 31 2HD1 LEU 31 9.033 1.857 0.511
207 HD13 LEU 31 3HD1 LEU 31 10.464 1.785 -0.517
208 HD21 LEU 31 1HD2 LEU 31 10.413 -1.603 -0.397
209 HD22 LEU 31 2HD2 LEU 31 11.118 -0.360 -1.431
210 HD23 LEU 31 3HD2 LEU 31 9.844 -1.409 -2.055
211 H GLY 32 H GLY 32 5.502 -1.187 -1.074
212 HA2 GLY 32 1HA GLY 32 5.393 0.137 -3.426
213 HA3 GLY 32 2HA GLY 32 4.012 -0.742 -2.787
214 H LEU 33 H LEU 33 3.351 0.867 -0.617
215 HA LEU 33 HA LEU 33 1.740 2.809 -1.808
216 HB2 LEU 33 1HB LEU 33 1.292 1.816 0.383
217 HB3 LEU 33 2HB LEU 33 2.695 2.651 1.048
218 HG LEU 33 HG LEU 33 1.631 4.749 0.929
219 HD11 LEU 33 1HD1 LEU 33 -0.739 4.849 -0.085
220 HD12 LEU 33 2HD1 LEU 33 -0.266 3.378 -0.935
221 HD13 LEU 33 3HD1 LEU 33 0.652 4.865 -1.170
222 HD21 LEU 33 1HD2 LEU 33 -0.478 4.398 2.161
223 HD22 LEU 33 2HD2 LEU 33 0.847 3.415 2.783
224 HD23 LEU 33 3HD2 LEU 33 -0.396 2.680 1.769
225 H LYS 34 H LYS 34 4.666 3.293 0.174
226 HA LYS 34 HA LYS 34 4.907 6.017 0.003
227 HB2 LYS 34 1HB LYS 34 6.926 3.812 0.164
228 HB3 LYS 34 2HB LYS 34 7.476 5.471 -0.031
229 HG2 LYS 34 1HG LYS 34 7.510 5.236 2.250
230 HG3 LYS 34 2HG LYS 34 5.911 5.938 1.996
231 HD2 LYS 34 1HD LYS 34 4.826 3.915 2.378
232 HD3 LYS 34 2HD LYS 34 6.280 2.965 2.061
233 HE2 LYS 34 1HE LYS 34 6.117 4.855 4.386
234 HE3 LYS 34 2HE LYS 34 5.490 3.211 4.495
235 HZ1 LYS 34 1HZ LYS 34 8.234 3.669 3.535
236 HZ2 LYS 34 2HZ LYS 34 7.581 2.306 4.293
237 HZ3 LYS 34 3HZ LYS 34 7.913 3.698 5.196
238 H GLN 35 H GLN 35 6.515 3.718 -2.206
239 HA GLN 35 HA GLN 35 7.684 5.342 -3.995
240 HB2 GLN 35 1HB GLN 35 7.753 2.957 -4.289
241 HB3 GLN 35 2HB GLN 35 6.023 2.893 -4.595
242 HG2 GLN 35 1HG GLN 35 6.824 2.742 -6.721
243 HG3 GLN 35 2HG GLN 35 6.629 4.488 -6.581
244 HE21 GLN 35 1HE2 GLN 35 8.246 5.531 -7.469
245 HE22 GLN 35 2HE2 GLN 35 9.908 5.062 -7.440
246 H GLN 36 H GLN 36 4.230 4.490 -4.084
247 HA GLN 36 HA GLN 36 3.526 5.979 -6.330
248 HB2 GLN 36 1HB GLN 36 2.023 5.022 -3.924
249 HB3 GLN 36 2HB GLN 36 1.232 6.099 -5.067
250 HG2 GLN 36 1HG GLN 36 1.818 4.472 -6.873
251 HG3 GLN 36 2HG GLN 36 2.370 3.371 -5.611
252 HE21 GLN 36 1HE2 GLN 36 0.856 2.470 -4.192
253 HE22 GLN 36 2HE2 GLN 36 -0.828 2.427 -4.571
254 H ILE 37 H ILE 37 3.745 6.939 -2.937
255 HA ILE 37 HA ILE 37 2.705 9.559 -3.326
256 HB ILE 37 HB ILE 37 4.467 8.527 -1.099
257 HG12 ILE 37 1HG1 ILE 37 1.508 8.946 -0.889
258 HG13 ILE 37 2HG1 ILE 37 2.122 7.467 -1.620
259 HG21 ILE 37 1HG2 ILE 37 3.589 11.151 -1.714
260 HG22 ILE 37 2HG2 ILE 37 2.715 10.608 -0.283
261 HG23 ILE 37 3HG2 ILE 37 4.479 10.595 -0.297
262 HD11 ILE 37 1HD1 ILE 37 1.649 7.844 1.035
263 HD12 ILE 37 2HD1 ILE 37 2.705 6.608 0.352
264 HD13 ILE 37 3HD1 ILE 37 3.385 8.131 0.923
265 H GLU 38 H GLU 38 5.863 8.123 -3.622
266 HA GLU 38 HA GLU 38 7.299 10.608 -3.609
267 HB2 GLU 38 1HB GLU 38 8.550 8.723 -2.933
268 HB3 GLU 38 2HB GLU 38 8.030 7.777 -4.320
269 HG2 GLU 38 1HG GLU 38 9.628 10.254 -4.753
270 HG3 GLU 38 2HG GLU 38 10.432 8.778 -4.223
271 H ASP 39 H ASP 39 6.129 8.371 -6.088
272 HA ASP 39 HA ASP 39 7.215 9.893 -8.262
273 HB2 ASP 39 1HB ASP 39 6.510 7.341 -8.104
274 HB3 ASP 39 2HB ASP 39 4.966 7.973 -8.669
275 H GLN 40 H GLN 40 4.569 10.307 -6.245
276 HA GLN 40 HA GLN 40 3.039 11.779 -8.272
277 HB2 GLN 40 1HB GLN 40 2.348 10.462 -5.696
278 HB3 GLN 40 2HB GLN 40 1.425 11.889 -6.147
279 HG2 GLN 40 1HG GLN 40 1.784 9.729 -8.158
280 HG3 GLN 40 2HG GLN 40 0.646 9.482 -6.835
281 HE21 GLN 40 1HE2 GLN 40 0.889 10.485 -9.922
282 HE22 GLN 40 2HE2 GLN 40 -0.478 11.538 -10.008
283 H GLN 41 H GLN 41 4.131 12.149 -4.897
284 HA GLN 41 HA GLN 41 3.733 15.008 -5.004
285 HB2 GLN 41 1HB GLN 41 4.814 13.159 -2.880
286 HB3 GLN 41 2HB GLN 41 4.744 14.905 -2.680
287 HG2 GLN 41 1HG GLN 41 2.338 14.870 -2.909
288 HG3 GLN 41 2HG GLN 41 2.371 13.134 -3.215
289 HE21 GLN 41 1HE2 GLN 41 4.197 15.002 -0.845
290 HE22 GLN 41 2HE2 GLN 41 3.538 14.221 0.547
291 H GLY 42 H GLY 42 6.225 12.837 -5.780
292 HA2 GLY 42 1HA GLY 42 8.260 13.350 -6.787
293 HA3 GLY 42 2HA GLY 42 8.016 15.038 -6.360
294 H LEU 43 H LEU 43 7.420 13.711 -3.543
295 HA LEU 43 HA LEU 43 9.990 14.323 -2.470
296 HB2 LEU 43 1HB LEU 43 7.557 14.423 -1.434
297 HB3 LEU 43 2HB LEU 43 7.980 12.799 -0.894
298 HG LEU 43 HG LEU 43 9.876 15.023 -0.317
299 HD11 LEU 43 1HD1 LEU 43 7.709 15.960 0.292
300 HD12 LEU 43 2HD1 LEU 43 8.665 15.584 1.725
301 HD13 LEU 43 3HD1 LEU 43 7.345 14.519 1.242
302 HD21 LEU 43 1HD2 LEU 43 10.811 13.445 0.929
303 HD22 LEU 43 2HD2 LEU 43 9.591 12.302 0.367
304 HD23 LEU 43 3HD2 LEU 43 9.313 13.236 1.838
305 HA PRO 44 HA PRO 44 11.906 10.368 -2.868
306 HB2 PRO 44 1HB PRO 44 13.880 10.712 -1.036
307 HB3 PRO 44 2HB PRO 44 13.898 11.487 -2.625
308 HG2 PRO 44 1HG PRO 44 13.090 12.619 0.026
309 HG3 PRO 44 2HG PRO 44 14.063 13.361 -1.258
310 HD2 PRO 44 1HD PRO 44 11.440 13.934 -0.902
311 HD3 PRO 44 2HD PRO 44 12.210 13.938 -2.502
312 H LYS 45 H LYS 45 11.900 8.389 -1.870
313 HA LYS 45 HA LYS 45 10.172 8.044 0.367
314 HB2 LYS 45 1HB LYS 45 12.020 6.029 -0.923
315 HB3 LYS 45 2HB LYS 45 10.664 5.667 0.136
316 HG2 LYS 45 1HG LYS 45 9.102 6.118 -1.478
317 HG3 LYS 45 2HG LYS 45 10.166 7.221 -2.354
318 HD2 LYS 45 1HD LYS 45 10.008 5.301 -3.708
319 HD3 LYS 45 2HD LYS 45 11.575 5.174 -2.905
320 HE2 LYS 45 1HE LYS 45 10.666 3.618 -1.296
321 HE3 LYS 45 2HE LYS 45 9.049 3.815 -1.970
322 HZ1 LYS 45 1HZ LYS 45 11.230 2.178 -2.885
323 HZ2 LYS 45 2HZ LYS 45 10.516 3.088 -4.120
324 HZ3 LYS 45 3HZ LYS 45 9.571 2.038 -3.189
325 H LYS 46 H LYS 46 13.384 8.914 0.165
326 HA LYS 46 HA LYS 46 14.228 7.570 2.602
327 HB2 LYS 46 1HB LYS 46 16.326 9.044 2.162
328 HB3 LYS 46 2HB LYS 46 16.001 7.674 1.107
329 HG2 LYS 46 1HG LYS 46 15.119 9.112 -0.593
330 HG3 LYS 46 2HG LYS 46 15.212 10.511 0.480
331 HD2 LYS 46 1HD LYS 46 17.140 10.819 -0.702
332 HD3 LYS 46 2HD LYS 46 17.760 9.790 0.590
333 HE2 LYS 46 1HE LYS 46 17.158 7.843 -1.006
334 HE3 LYS 46 2HE LYS 46 17.131 9.088 -2.253
335 HZ1 LYS 46 1HZ LYS 46 19.444 8.665 -0.450
336 HZ2 LYS 46 2HZ LYS 46 19.390 9.591 -1.864
337 HZ3 LYS 46 3HZ LYS 46 19.300 7.905 -1.954
338 H GLN 47 H GLN 47 12.235 10.013 2.115
339 HA GLN 47 HA GLN 47 13.128 11.434 4.527
340 HB2 GLN 47 1HB GLN 47 12.342 12.582 1.880
341 HB3 GLN 47 2HB GLN 47 11.968 13.479 3.346
342 HG2 GLN 47 1HG GLN 47 14.355 13.401 3.962
343 HG3 GLN 47 2HG GLN 47 14.695 12.593 2.432
344 HE21 GLN 47 1HE2 GLN 47 15.996 14.201 1.639
345 HE22 GLN 47 2HE2 GLN 47 15.401 15.755 1.173
346 H GLN 48 H GLN 48 10.468 10.531 2.400
347 HA GLN 48 HA GLN 48 8.409 11.494 4.122
348 HB2 GLN 48 1HB GLN 48 6.931 10.734 2.540
349 HB3 GLN 48 2HB GLN 48 8.383 10.869 1.557
350 HG2 GLN 48 1HG GLN 48 8.789 8.504 1.749
351 HG3 GLN 48 2HG GLN 48 7.432 8.330 2.860
352 HE21 GLN 48 1HE2 GLN 48 8.241 9.369 -0.420
353 HE22 GLN 48 2HE2 GLN 48 6.759 8.853 -1.140
354 H GLN 49 H GLN 49 7.226 10.451 5.657
355 HA GLN 49 HA GLN 49 7.733 7.617 6.157
356 HB2 GLN 49 1HB GLN 49 9.316 8.457 7.646
357 HB3 GLN 49 2HB GLN 49 8.342 9.867 8.041
358 HG2 GLN 49 1HG GLN 49 6.740 8.326 9.190
359 HG3 GLN 49 2HG GLN 49 7.916 7.035 8.950
360 HE21 GLN 49 1HE2 GLN 49 8.299 6.703 11.107
361 HE22 GLN 49 2HE2 GLN 49 9.124 7.845 12.106
362 H LEU 50 H LEU 50 5.828 6.652 6.291
363 HA LEU 50 HA LEU 50 3.465 8.201 7.009
364 HB2 LEU 50 1HB LEU 50 3.779 5.401 5.940
365 HB3 LEU 50 2HB LEU 50 2.232 6.171 6.287
366 HG LEU 50 HG LEU 50 4.209 7.211 4.262
367 HD11 LEU 50 1HD1 LEU 50 2.795 6.230 2.561
368 HD12 LEU 50 2HD1 LEU 50 1.738 5.548 3.797
369 HD13 LEU 50 3HD1 LEU 50 3.399 4.974 3.642
370 HD21 LEU 50 1HD2 LEU 50 2.902 9.008 4.333
371 HD22 LEU 50 2HD2 LEU 50 1.750 8.209 5.403
372 HD23 LEU 50 3HD2 LEU 50 1.615 8.011 3.655
373 H GLU 51 H GLU 51 1.968 7.509 8.604
374 HA GLU 51 HA GLU 51 2.906 5.500 10.511
375 HB2 GLU 51 1HB GLU 51 2.365 8.393 11.137
376 HB3 GLU 51 2HB GLU 51 2.238 7.146 12.371
377 HG2 GLU 51 1HG GLU 51 4.602 6.502 11.809
378 HG3 GLU 51 2HG GLU 51 4.678 7.959 10.820
379 H PHE 52 H PHE 52 1.290 4.461 11.634
380 HA PHE 52 HA PHE 52 -1.471 5.291 11.037
381 HB2 PHE 52 1HB PHE 52 -0.902 3.378 9.626
382 HB3 PHE 52 2HB PHE 52 -0.381 2.468 11.040
383 HD1 PHE 52 2HD PHE 52 -3.382 4.290 9.779
384 HD2 PHE 52 1HD PHE 52 -1.854 0.972 11.963
385 HE1 PHE 52 2HE PHE 52 -5.668 3.425 10.058
386 HE2 PHE 52 1HE PHE 52 -4.138 0.101 12.245
387 HZ PHE 52 HZ PHE 52 -6.049 1.329 11.293
388 H GLN 53 H GLN 53 -2.085 6.089 12.969
389 HA GLN 53 HA GLN 53 -2.872 6.042 15.110
390 HB2 GLN 53 1HB GLN 53 -1.994 3.188 15.414
391 HB3 GLN 53 2HB GLN 53 -3.355 4.011 16.165
392 HG2 GLN 53 1HG GLN 53 -4.300 4.193 13.789
393 HG3 GLN 53 2HG GLN 53 -3.100 2.972 13.370
394 HE21 GLN 53 1HE2 GLN 53 -6.218 3.386 14.180
395 HE22 GLN 53 2HE2 GLN 53 -6.559 1.848 14.888
396 H GLY 54 H GLY 54 -0.415 7.097 14.697
397 HA2 GLY 54 1HA GLY 54 1.463 7.762 15.838
398 HA3 GLY 54 2HA GLY 54 0.751 7.011 17.258
399 H GLN 55 H GLN 55 1.546 5.317 14.283
400 HA GLN 55 HA GLN 55 3.815 4.038 15.644
401 HB2 GLN 55 1HB GLN 55 3.062 1.900 15.285
402 HB3 GLN 55 2HB GLN 55 1.529 2.723 15.541
403 HG2 GLN 55 1HG GLN 55 1.407 2.977 13.024
404 HG3 GLN 55 2HG GLN 55 2.751 1.839 12.948
405 HE21 GLN 55 1HE2 GLN 55 0.915 0.797 11.656
406 HE22 GLN 55 2HE2 GLN 55 -0.082 -0.311 12.530
407 H VAL 56 H VAL 56 5.299 2.930 14.162
408 HA VAL 56 HA VAL 56 5.482 4.389 11.623
409 HB VAL 56 HB VAL 56 7.635 2.772 12.989
410 HG11 VAL 56 1HG1 VAL 56 8.361 2.939 10.824
411 HG12 VAL 56 2HG1 VAL 56 7.508 4.457 10.538
412 HG13 VAL 56 3HG1 VAL 56 8.999 4.445 11.481
413 HG21 VAL 56 1HG2 VAL 56 7.141 5.747 13.059
414 HG22 VAL 56 2HG2 VAL 56 6.971 4.629 14.413
415 HG23 VAL 56 3HG2 VAL 56 8.561 4.929 13.711
416 H LEU 57 H LEU 57 5.682 3.361 9.669
417 HA LEU 57 HA LEU 57 5.070 0.486 9.681
418 HB2 LEU 57 1HB LEU 57 4.822 2.129 7.219
419 HB3 LEU 57 2HB LEU 57 3.859 0.756 7.761
420 HG LEU 57 HG LEU 57 3.676 3.549 8.887
421 HD11 LEU 57 1HD1 LEU 57 1.442 3.515 7.736
422 HD12 LEU 57 2HD1 LEU 57 1.999 2.089 6.860
423 HD13 LEU 57 3HD1 LEU 57 2.842 3.626 6.668
424 HD21 LEU 57 1HD2 LEU 57 2.996 1.220 10.113
425 HD22 LEU 57 2HD2 LEU 57 1.495 1.629 9.282
426 HD23 LEU 57 3HD2 LEU 57 2.220 2.776 10.409
427 H GLN 58 H GLN 58 6.317 -0.960 8.582
428 HA GLN 58 HA GLN 58 8.961 -0.045 7.804
429 HB2 GLN 58 1HB GLN 58 7.817 -2.839 7.967
430 HB3 GLN 58 2HB GLN 58 9.504 -2.444 7.663
431 HG2 GLN 58 1HG GLN 58 9.051 -3.117 9.992
432 HG3 GLN 58 2HG GLN 58 9.743 -1.502 9.850
433 HE21 GLN 58 1HE2 GLN 58 8.910 -0.212 11.314
434 HE22 GLN 58 2HE2 GLN 58 7.252 -0.145 11.794
435 H ASP 59 H ASP 59 9.818 -1.641 5.877
436 HA ASP 59 HA ASP 59 8.127 -0.914 3.589
437 HB2 ASP 59 1HB ASP 59 10.031 -0.635 2.325
438 HB3 ASP 59 2HB ASP 59 10.656 -0.222 3.919
439 H TRP 60 H TRP 60 9.657 -3.598 5.203
440 HA TRP 60 HA TRP 60 9.041 -5.461 3.071
441 HB2 TRP 60 1HB TRP 60 10.303 -7.019 4.231
442 HB3 TRP 60 2HB TRP 60 11.055 -5.513 4.750
443 HD1 TRP 60 HD TRP 60 8.790 -8.325 6.036
444 HE1 TRP 60 1HE TRP 60 8.756 -8.237 8.608
445 HE3 TRP 60 3HE TRP 60 11.359 -3.960 6.733
446 HZ2 TRP 60 2HZ TRP 60 9.693 -6.541 10.661
447 HZ3 TRP 60 3HZ TRP 60 11.747 -3.174 9.032
448 HH2 TRP 60 HH TRP 60 10.930 -4.440 10.954
449 H LEU 61 H LEU 61 7.521 -4.214 5.869
450 HA LEU 61 HA LEU 61 5.772 -6.475 6.281
451 HB2 LEU 61 1HB LEU 61 5.762 -3.686 7.421
452 HB3 LEU 61 2HB LEU 61 4.636 -4.957 7.893
453 HG LEU 61 HG LEU 61 7.610 -4.870 8.370
454 HD11 LEU 61 1HD1 LEU 61 7.113 -4.174 10.421
455 HD12 LEU 61 2HD1 LEU 61 5.871 -5.411 10.616
456 HD13 LEU 61 3HD1 LEU 61 5.475 -3.878 9.838
457 HD21 LEU 61 1HD2 LEU 61 5.662 -7.107 8.921
458 HD22 LEU 61 2HD2 LEU 61 7.340 -7.046 9.463
459 HD23 LEU 61 3HD2 LEU 61 6.972 -7.133 7.740
460 H GLY 62 H GLY 62 3.579 -6.582 5.806
461 HA2 GLY 62 1HA GLY 62 2.771 -4.991 3.512
462 HA3 GLY 62 2HA GLY 62 1.928 -6.389 4.163
463 H LEU 63 H LEU 63 0.276 -4.515 3.494
464 HA LEU 63 HA LEU 63 -0.140 -2.544 5.549
465 HB2 LEU 63 1HB LEU 63 -1.729 -3.399 3.146
466 HB3 LEU 63 2HB LEU 63 -2.312 -2.185 4.282
467 HG LEU 63 HG LEU 63 -0.039 -1.008 3.732
468 HD11 LEU 63 1HD1 LEU 63 1.171 -1.781 2.039
469 HD12 LEU 63 2HD1 LEU 63 -0.249 -1.919 1.002
470 HD13 LEU 63 3HD1 LEU 63 0.181 -3.240 2.089
471 HD21 LEU 63 1HD2 LEU 63 -1.164 0.360 2.212
472 HD22 LEU 63 2HD2 LEU 63 -2.456 -0.340 3.187
473 HD23 LEU 63 3HD2 LEU 63 -2.124 -0.975 1.575
474 H GLY 64 H GLY 64 -1.100 -5.799 4.984
475 HA2 GLY 64 1HA GLY 64 -3.434 -5.686 6.691
476 HA3 GLY 64 2HA GLY 64 -2.745 -7.125 5.955
477 H ILE 65 H ILE 65 -0.055 -6.483 7.025
478 HA ILE 65 HA ILE 65 -0.016 -8.067 9.267
479 HB ILE 65 HB ILE 65 1.866 -5.798 8.610
480 HG12 ILE 65 1HG1 ILE 65 1.597 -7.627 6.899
481 HG13 ILE 65 2HG1 ILE 65 3.229 -7.446 7.532
482 HG21 ILE 65 1HG2 ILE 65 2.030 -6.445 10.960
483 HG22 ILE 65 2HG2 ILE 65 2.250 -8.128 10.485
484 HG23 ILE 65 3HG2 ILE 65 3.469 -6.926 10.063
485 HD11 ILE 65 1HD1 ILE 65 3.200 -9.462 8.550
486 HD12 ILE 65 2HD1 ILE 65 1.472 -9.391 8.894
487 HD13 ILE 65 3HD1 ILE 65 2.033 -9.801 7.273
488 H TYR 66 H TYR 66 -0.232 -4.525 9.144
489 HA TYR 66 HA TYR 66 -0.423 -4.293 12.007
490 HB2 TYR 66 1HB TYR 66 -0.566 -2.368 9.711
491 HB3 TYR 66 2HB TYR 66 -1.079 -1.861 11.316
492 HD1 TYR 66 2HD TYR 66 0.618 -2.181 13.236
493 HD2 TYR 66 1HD TYR 66 1.686 -2.269 9.118
494 HE1 TYR 66 2HE TYR 66 2.955 -1.707 13.838
495 HE2 TYR 66 1HE TYR 66 4.026 -1.797 9.709
496 HH TYR 66 HH TYR 66 5.484 -2.223 11.934
497 H GLY 67 H GLY 67 -2.623 -4.497 9.308
498 HA2 GLY 67 1HA GLY 67 -4.863 -5.264 9.600
499 HA3 GLY 67 2HA GLY 67 -4.856 -4.571 11.216
500 H ILE 68 H ILE 68 -3.651 -2.794 8.471
501 HA ILE 68 HA ILE 68 -5.238 -0.546 8.965
502 HB ILE 68 HB ILE 68 -3.865 -1.355 6.400
503 HG12 ILE 68 1HG1 ILE 68 -2.890 0.712 8.345
504 HG13 ILE 68 2HG1 ILE 68 -2.559 -0.993 8.633
505 HG21 ILE 68 1HG2 ILE 68 -4.825 1.376 7.237
506 HG22 ILE 68 2HG2 ILE 68 -4.042 0.945 5.717
507 HG23 ILE 68 3HG2 ILE 68 -5.653 0.331 6.084
508 HD11 ILE 68 1HD1 ILE 68 -1.490 0.827 6.560
509 HD12 ILE 68 2HD1 ILE 68 -0.685 -0.437 7.491
510 HD13 ILE 68 3HD1 ILE 68 -1.719 -0.867 6.129
511 H GLN 69 H GLN 69 -7.038 0.318 7.908
512 HA GLN 69 HA GLN 69 -8.671 -1.665 6.467
513 HB2 GLN 69 1HB GLN 69 -10.641 -0.460 7.308
514 HB3 GLN 69 2HB GLN 69 -9.633 -1.054 8.621
515 HG2 GLN 69 1HG GLN 69 -8.603 1.266 8.675
516 HG3 GLN 69 2HG GLN 69 -9.939 1.762 7.637
517 HE21 GLN 69 1HE2 GLN 69 -8.908 1.378 10.781
518 HE22 GLN 69 2HE2 GLN 69 -10.436 1.489 11.580
519 H ASP 70 H ASP 70 -10.327 -0.646 4.987
520 HA ASP 70 HA ASP 70 -8.973 0.978 3.081
521 HB2 ASP 70 1HB ASP 70 -10.928 0.754 1.730
522 HB3 ASP 70 2HB ASP 70 -10.710 -0.783 2.563
523 H SER 71 H SER 71 -9.986 2.979 2.155
524 HA SER 71 HA SER 71 -10.295 5.223 2.499
525 HB2 SER 71 1HB SER 71 -12.637 4.177 4.109
526 HB3 SER 71 2HB SER 71 -12.502 5.778 3.383
527 HG SER 71 HG SER 71 -12.257 4.560 1.332
528 H ASP 72 H ASP 72 -8.413 4.179 4.281
529 HA ASP 72 HA ASP 72 -9.031 5.315 6.895
530 HB2 ASP 72 1HB ASP 72 -7.889 3.117 6.740
531 HB3 ASP 72 2HB ASP 72 -6.525 3.906 5.954
532 H THR 73 H THR 73 -7.159 6.577 7.934
533 HA THR 73 HA THR 73 -6.201 8.579 5.993
534 HB THR 73 HB THR 73 -6.986 8.977 8.886
535 HG1 THR 73 1HG THR 73 -8.775 9.855 8.082
536 HG21 THR 73 1HG2 THR 73 -5.111 10.418 7.341
537 HG22 THR 73 2HG2 THR 73 -5.776 10.847 8.917
538 HG23 THR 73 3HG2 THR 73 -6.563 11.413 7.445
539 H LEU 74 H LEU 74 -4.083 8.457 5.687
540 HA LEU 74 HA LEU 74 -2.377 7.532 7.895
541 HB2 LEU 74 1HB LEU 74 -1.681 7.711 4.971
542 HB3 LEU 74 2HB LEU 74 -0.746 6.927 6.243
543 HG LEU 74 HG LEU 74 -3.473 6.000 5.352
544 HD11 LEU 74 1HD1 LEU 74 -1.407 4.199 4.616
545 HD12 LEU 74 2HD1 LEU 74 -1.001 5.793 3.980
546 HD13 LEU 74 3HD1 LEU 74 -2.550 5.052 3.577
547 HD21 LEU 74 1HD2 LEU 74 -3.171 5.098 7.445
548 HD22 LEU 74 2HD2 LEU 74 -1.416 5.022 7.281
549 HD23 LEU 74 3HD2 LEU 74 -2.433 3.857 6.432
550 H ILE 75 H ILE 75 -0.801 8.799 8.712
551 HA ILE 75 HA ILE 75 -0.722 11.571 7.810
552 HB ILE 75 HB ILE 75 0.717 10.410 10.190
553 HG12 ILE 75 1HG1 ILE 75 -1.845 10.037 10.101
554 HG13 ILE 75 2HG1 ILE 75 -1.155 10.759 11.551
555 HG21 ILE 75 1HG2 ILE 75 -0.131 13.199 9.428
556 HG22 ILE 75 2HG2 ILE 75 0.512 12.756 11.009
557 HG23 ILE 75 3HG2 ILE 75 1.514 12.579 9.569
558 HD11 ILE 75 1HD1 ILE 75 -2.410 12.316 9.305
559 HD12 ILE 75 2HD1 ILE 75 -3.234 11.847 10.792
560 HD13 ILE 75 3HD1 ILE 75 -1.855 12.944 10.857
561 H LEU 76 H LEU 76 1.096 12.611 7.077
562 HA LEU 76 HA LEU 76 3.430 10.902 6.514
563 HB2 LEU 76 1HB LEU 76 2.315 11.376 4.459
564 HB3 LEU 76 2HB LEU 76 2.186 13.088 4.860
565 HG LEU 76 HG LEU 76 4.678 13.231 4.700
566 HD11 LEU 76 1HD1 LEU 76 4.696 10.560 4.891
567 HD12 LEU 76 2HD1 LEU 76 5.995 11.485 4.139
568 HD13 LEU 76 3HD1 LEU 76 4.757 10.728 3.137
569 HD21 LEU 76 1HD2 LEU 76 3.105 12.361 2.282
570 HD22 LEU 76 2HD2 LEU 76 4.711 13.087 2.208
571 HD23 LEU 76 3HD2 LEU 76 3.356 14.006 2.865
572 H SER 77 H SER 77 5.377 11.611 7.153
573 HA SER 77 HA SER 77 5.740 14.433 7.825
574 HB2 SER 77 1HB SER 77 6.301 12.164 9.750
575 HB3 SER 77 2HB SER 77 6.774 13.844 10.002
576 HG SER 77 HG SER 77 4.714 13.083 10.975
577 H LYS 78 H LYS 78 7.647 15.174 7.153
578 HA LYS 78 HA LYS 78 9.462 13.475 5.772
579 HB2 LYS 78 1HB LYS 78 8.920 16.033 5.477
580 HB3 LYS 78 2HB LYS 78 10.220 16.235 6.644
581 HG2 LYS 78 1HG LYS 78 11.607 14.766 5.072
582 HG3 LYS 78 2HG LYS 78 10.343 15.085 3.881
583 HD2 LYS 78 1HD LYS 78 11.641 17.339 5.367
584 HD3 LYS 78 2HD LYS 78 12.426 16.625 3.957
585 HE2 LYS 78 1HE LYS 78 10.701 17.276 2.523
586 HE3 LYS 78 2HE LYS 78 9.568 17.527 3.850
587 HZ1 LYS 78 1HZ LYS 78 10.150 19.646 3.887
588 HZ2 LYS 78 2HZ LYS 78 11.256 19.400 2.632
589 HZ3 LYS 78 3HZ LYS 78 11.751 19.227 4.240
590 H LYS 79 H LYS 79 11.635 13.003 6.266
591 HA LYS 79 HA LYS 79 12.114 12.320 8.973
592 HB2 LYS 79 1HB LYS 79 13.916 12.352 6.552
593 HB3 LYS 79 2HB LYS 79 14.427 11.755 8.125
594 HG2 LYS 79 1HG LYS 79 11.966 10.652 6.846
595 HG3 LYS 79 2HG LYS 79 13.560 10.099 6.327
596 HD2 LYS 79 1HD LYS 79 14.073 9.575 8.714
597 HD3 LYS 79 2HD LYS 79 12.397 9.964 9.107
598 HE2 LYS 79 1HE LYS 79 11.613 8.195 7.650
599 HE3 LYS 79 2HE LYS 79 13.265 7.846 7.142
600 HZ1 LYS 79 1HZ LYS 79 13.270 7.712 9.898
601 HZ2 LYS 79 2HZ LYS 79 13.371 6.419 8.814
602 HZ3 LYS 79 3HZ LYS 79 11.865 6.902 9.415
603 H LYS 80 H LYS 80 12.995 13.455 10.573
604 HA LYS 80 HA LYS 80 13.947 16.145 10.039
605 HB2 LYS 80 1HB LYS 80 12.374 15.544 11.935
606 HB3 LYS 80 2HB LYS 80 13.744 14.765 12.716
607 HG2 LYS 80 1HG LYS 80 14.902 16.825 12.932
608 HG3 LYS 80 2HG LYS 80 13.744 17.656 11.891
609 HD2 LYS 80 1HD LYS 80 12.824 16.331 14.412
610 HD3 LYS 80 2HD LYS 80 13.574 17.928 14.471
611 HE2 LYS 80 1HE LYS 80 11.269 17.289 12.647
612 HE3 LYS 80 2HE LYS 80 11.036 17.848 14.303
613 HZ1 LYS 80 1HZ LYS 80 12.746 19.365 12.440
614 HZ2 LYS 80 2HZ LYS 80 11.937 19.908 13.822
615 HZ3 LYS 80 3HZ LYS 80 11.066 19.564 12.413
616 H GLY 81 H GLY 81 16.012 16.852 10.228
617 HA2 GLY 81 1HA GLY 81 18.233 16.707 11.131
618 HA3 GLY 81 2HA GLY 81 18.029 14.965 11.245
619 H SER 82 H SER 82 20.209 16.407 10.019
620 HA SER 82 HA SER 82 19.861 15.571 7.214
621 HB2 SER 82 1HB SER 82 21.620 17.216 6.645
622 HB3 SER 82 2HB SER 82 20.221 17.982 7.397
623 HG SER 82 HG SER 82 22.358 18.626 8.203
624 H GLY 83 H GLY 83 22.006 14.979 6.156
625 HA2 GLY 83 1HA GLY 83 24.328 14.232 7.278
626 HA3 GLY 83 2HA GLY 83 23.252 12.951 7.816
627 HA PRO 84 HA PRO 84 25.044 11.586 3.798
628 HB2 PRO 84 1HB PRO 84 25.358 9.002 4.569
629 HB3 PRO 84 2HB PRO 84 26.561 10.255 4.897
630 HG2 PRO 84 1HG PRO 84 24.459 9.127 6.706
631 HG3 PRO 84 2HG PRO 84 26.154 9.507 7.061
632 HD2 PRO 84 1HD PRO 84 24.115 11.144 7.766
633 HD3 PRO 84 2HD PRO 84 25.724 11.756 7.331
634 H SER 85 H SER 85 24.333 9.620 2.465
635 HA SER 85 HA SER 85 21.503 8.986 2.957
636 HB2 SER 85 1HB SER 85 22.736 10.269 0.569
637 HB3 SER 85 2HB SER 85 21.461 9.084 0.285
638 HG SER 85 HG SER 85 20.110 10.589 0.806
639 H SER 86 H SER 86 20.764 7.015 2.061
640 HA SER 86 HA SER 86 22.846 5.210 1.044
641 HB2 SER 86 1HB SER 86 22.136 3.429 2.523
642 HB3 SER 86 2HB SER 86 22.534 4.844 3.497
643 HG SER 86 HG SER 86 20.298 5.297 3.613
644 H GLY 87 H GLY 87 22.211 4.498 -0.875
645 HA2 GLY 87 1HA GLY 87 19.744 3.162 -1.277
646 HA3 GLY 87 2HA GLY 87 19.665 4.779 -1.963
Start of MODEL 8
1 H1 GLY 1 H GLY 1 6.836 -8.879 -7.685
2 HA2 GLY 1 1HA GLY 1 5.537 -7.510 -5.546
3 HA3 GLY 1 2HA GLY 1 6.114 -6.380 -6.761
4 H SER 2 H SER 2 3.627 -6.092 -6.641
5 HA SER 2 HA SER 2 2.553 -7.372 -9.004
6 HB2 SER 2 1HB SER 2 1.484 -7.888 -6.254
7 HB3 SER 2 2HB SER 2 0.362 -7.811 -7.612
8 HG SER 2 HG SER 2 1.996 -9.811 -6.892
9 H SER 3 H SER 3 0.635 -6.325 -9.808
10 HA SER 3 HA SER 3 0.637 -3.497 -9.210
11 HB2 SER 3 1HB SER 3 0.430 -4.693 -11.544
12 HB3 SER 3 2HB SER 3 -1.284 -4.756 -11.134
13 HG SER 3 HG SER 3 0.115 -2.698 -12.075
14 H GLY 4 H GLY 4 -1.218 -2.273 -8.639
15 HA2 GLY 4 1HA GLY 4 -2.850 -3.544 -6.662
16 HA3 GLY 4 2HA GLY 4 -2.953 -1.866 -7.176
17 H SER 5 H SER 5 -4.205 -5.061 -7.555
18 HA SER 5 HA SER 5 -6.023 -4.192 -9.682
19 HB2 SER 5 1HB SER 5 -4.861 -6.333 -10.018
20 HB3 SER 5 2HB SER 5 -5.559 -6.951 -8.521
21 HG SER 5 HG SER 5 -7.072 -6.061 -10.751
22 H SER 6 H SER 6 -7.428 -2.883 -8.510
23 HA SER 6 HA SER 6 -9.340 -2.431 -7.358
24 HB2 SER 6 1HB SER 6 -10.116 -4.580 -8.425
25 HB3 SER 6 2HB SER 6 -9.617 -5.416 -6.954
26 HG SER 6 HG SER 6 -11.276 -3.198 -6.665
27 H GLY 7 H GLY 7 -6.759 -2.583 -6.049
28 HA2 GLY 7 1HA GLY 7 -6.859 -3.844 -3.547
29 HA3 GLY 7 2HA GLY 7 -5.877 -2.440 -3.936
30 H ILE 8 H ILE 8 -6.208 -1.473 -1.932
31 HA ILE 8 HA ILE 8 -8.969 -0.687 -1.302
32 HB ILE 8 HB ILE 8 -8.169 -0.156 0.942
33 HG12 ILE 8 1HG1 ILE 8 -5.498 -1.343 0.231
34 HG13 ILE 8 2HG1 ILE 8 -5.799 0.381 0.039
35 HG21 ILE 8 1HG2 ILE 8 -8.784 -2.270 1.274
36 HG22 ILE 8 2HG2 ILE 8 -8.087 -2.790 -0.260
37 HG23 ILE 8 3HG2 ILE 8 -7.073 -2.689 1.180
38 HD11 ILE 8 1HD1 ILE 8 -4.796 0.172 2.132
39 HD12 ILE 8 2HD1 ILE 8 -6.516 0.349 2.483
40 HD13 ILE 8 3HD1 ILE 8 -5.760 -1.243 2.554
41 H GLN 9 H GLN 9 -9.058 1.525 -0.141
42 HA GLN 9 HA GLN 9 -7.429 3.446 -1.671
43 HB2 GLN 9 1HB GLN 9 -9.761 3.438 -2.422
44 HB3 GLN 9 2HB GLN 9 -10.302 3.731 -0.774
45 HG2 GLN 9 1HG GLN 9 -9.677 5.922 -0.805
46 HG3 GLN 9 2HG GLN 9 -8.395 5.655 -1.985
47 HE21 GLN 9 1HE2 GLN 9 -8.902 5.598 -4.174
48 HE22 GLN 9 2HE2 GLN 9 -10.401 6.202 -4.786
49 H VAL 10 H VAL 10 -6.001 4.367 -0.360
50 HA VAL 10 HA VAL 10 -6.789 4.940 2.417
51 HB VAL 10 HB VAL 10 -4.378 5.105 2.906
52 HG11 VAL 10 1HG1 VAL 10 -4.392 2.933 3.391
53 HG12 VAL 10 2HG1 VAL 10 -5.877 2.808 2.446
54 HG13 VAL 10 3HG1 VAL 10 -4.318 2.486 1.687
55 HG21 VAL 10 1HG2 VAL 10 -3.969 5.609 0.333
56 HG22 VAL 10 2HG2 VAL 10 -2.718 4.904 1.356
57 HG23 VAL 10 3HG2 VAL 10 -3.678 3.870 0.299
58 H PHE 11 H PHE 11 -6.359 6.968 3.325
59 HA PHE 11 HA PHE 11 -6.110 9.124 1.349
60 HB2 PHE 11 1HB PHE 11 -7.375 8.976 4.075
61 HB3 PHE 11 2HB PHE 11 -6.997 10.525 3.328
62 HD1 PHE 11 2HD PHE 11 -9.105 7.540 3.167
63 HD2 PHE 11 1HD PHE 11 -8.233 11.323 1.422
64 HE1 PHE 11 2HE PHE 11 -11.228 7.454 1.927
65 HE2 PHE 11 1HE PHE 11 -10.356 11.243 0.180
66 HZ PHE 11 HZ PHE 11 -11.856 9.307 0.431
67 H VAL 12 H VAL 12 -4.079 9.807 1.142
68 HA VAL 12 HA VAL 12 -2.274 9.788 3.428
69 HB VAL 12 HB VAL 12 -1.712 10.585 0.569
70 HG11 VAL 12 1HG1 VAL 12 0.573 10.561 1.116
71 HG12 VAL 12 2HG1 VAL 12 -0.201 11.445 2.432
72 HG13 VAL 12 3HG1 VAL 12 0.281 9.764 2.661
73 HG21 VAL 12 1HG2 VAL 12 -1.443 7.956 2.003
74 HG22 VAL 12 2HG2 VAL 12 -2.319 8.303 0.512
75 HG23 VAL 12 3HG2 VAL 12 -0.556 8.328 0.525
76 H LYS 13 H LYS 13 -2.596 11.468 4.766
77 HA LYS 13 HA LYS 13 -3.312 14.083 3.783
78 HB2 LYS 13 1HB LYS 13 -4.264 13.365 5.879
79 HB3 LYS 13 2HB LYS 13 -2.668 13.055 6.550
80 HG2 LYS 13 1HG LYS 13 -2.172 15.469 6.393
81 HG3 LYS 13 2HG LYS 13 -3.821 15.741 5.824
82 HD2 LYS 13 1HD LYS 13 -4.702 14.840 7.910
83 HD3 LYS 13 2HD LYS 13 -3.063 14.511 8.476
84 HE2 LYS 13 1HE LYS 13 -4.089 17.253 7.756
85 HE3 LYS 13 2HE LYS 13 -4.080 16.601 9.394
86 HZ1 LYS 13 1HZ LYS 13 -2.008 17.892 8.056
87 HZ2 LYS 13 2HZ LYS 13 -1.527 16.285 8.264
88 HZ3 LYS 13 3HZ LYS 13 -1.978 17.212 9.605
89 H ASN 14 H ASN 14 -1.927 15.584 3.134
90 HA ASN 14 HA ASN 14 0.915 15.218 3.567
91 HB2 ASN 14 1HB ASN 14 -0.395 17.517 2.119
92 HB3 ASN 14 2HB ASN 14 1.241 16.895 1.917
93 HD21 ASN 14 1HD2 ASN 14 -1.612 17.082 0.446
94 HD22 ASN 14 2HD2 ASN 14 -1.588 15.630 -0.489
95 HA PRO 15 HA PRO 15 1.404 18.040 6.895
96 HB2 PRO 15 1HB PRO 15 3.875 19.030 6.367
97 HB3 PRO 15 2HB PRO 15 3.606 17.387 6.960
98 HG2 PRO 15 1HG PRO 15 4.104 18.334 4.164
99 HG3 PRO 15 2HG PRO 15 4.778 16.926 5.005
100 HD2 PRO 15 1HD PRO 15 2.729 16.729 3.245
101 HD3 PRO 15 2HD PRO 15 2.891 15.652 4.647
102 H ASP 16 H ASP 16 1.534 19.136 3.621
103 HA ASP 16 HA ASP 16 1.852 21.910 4.107
104 HB2 ASP 16 1HB ASP 16 0.469 20.590 1.763
105 HB3 ASP 16 2HB ASP 16 1.139 22.218 1.810
106 H GLY 17 H GLY 17 -1.027 19.893 3.546
107 HA2 GLY 17 1HA GLY 17 -2.798 20.746 5.292
108 HA3 GLY 17 2HA GLY 17 -2.740 22.160 4.251
109 H GLY 18 H GLY 18 -3.037 18.616 3.924
110 HA2 GLY 18 1HA GLY 18 -5.583 18.684 2.747
111 HA3 GLY 18 2HA GLY 18 -4.387 18.685 1.458
112 H SER 19 H SER 19 -5.668 16.622 1.056
113 HA SER 19 HA SER 19 -4.058 14.412 1.955
114 HB2 SER 19 1HB SER 19 -5.981 13.087 2.818
115 HB3 SER 19 2HB SER 19 -5.622 14.498 3.812
116 HG SER 19 HG SER 19 -7.486 14.784 1.753
117 H TYR 20 H TYR 20 -3.962 12.852 0.439
118 HA TYR 20 HA TYR 20 -5.829 13.073 -1.829
119 HB2 TYR 20 1HB TYR 20 -3.006 11.985 -1.834
120 HB3 TYR 20 2HB TYR 20 -4.051 12.173 -3.238
121 HD1 TYR 20 2HD TYR 20 -5.175 14.912 -2.400
122 HD2 TYR 20 1HD TYR 20 -1.217 13.364 -2.606
123 HE1 TYR 20 2HE TYR 20 -4.309 17.188 -2.742
124 HE2 TYR 20 1HE TYR 20 -0.340 15.636 -2.948
125 HH TYR 20 HH TYR 20 -2.172 18.197 -3.851
126 H ALA 21 H ALA 21 -6.368 11.083 -2.950
127 HA ALA 21 HA ALA 21 -6.565 8.826 -1.077
128 HB1 ALA 21 1HB ALA 21 -8.724 9.014 -1.624
129 HB2 ALA 21 2HB ALA 21 -8.373 9.991 -3.051
130 HB3 ALA 21 3HB ALA 21 -8.266 8.233 -3.139
131 H TYR 22 H TYR 22 -4.971 7.404 -1.381
132 HA TYR 22 HA TYR 22 -4.035 6.855 -4.104
133 HB2 TYR 22 1HB TYR 22 -2.856 6.413 -1.377
134 HB3 TYR 22 2HB TYR 22 -2.249 5.522 -2.767
135 HD1 TYR 22 2HD TYR 22 -2.791 8.948 -1.448
136 HD2 TYR 22 1HD TYR 22 -0.726 6.513 -4.260
137 HE1 TYR 22 2HE TYR 22 -1.353 10.855 -2.034
138 HE2 TYR 22 1HE TYR 22 0.719 8.413 -4.853
139 HH TYR 22 HH TYR 22 0.035 11.538 -4.132
140 H ALA 23 H ALA 23 -3.818 4.707 -4.867
141 HA ALA 23 HA ALA 23 -5.547 2.757 -3.487
142 HB1 ALA 23 1HB ALA 23 -6.161 3.887 -5.851
143 HB2 ALA 23 2HB ALA 23 -5.238 2.489 -6.406
144 HB3 ALA 23 3HB ALA 23 -6.658 2.259 -5.386
145 H ILE 24 H ILE 24 -4.560 0.949 -2.890
146 HA ILE 24 HA ILE 24 -2.495 -0.242 -4.531
147 HB ILE 24 HB ILE 24 -0.989 1.075 -3.335
148 HG12 ILE 24 1HG1 ILE 24 -1.235 -1.407 -1.624
149 HG13 ILE 24 2HG1 ILE 24 -0.503 -1.381 -3.225
150 HG21 ILE 24 1HG2 ILE 24 -3.048 1.016 -1.296
151 HG22 ILE 24 2HG2 ILE 24 -1.434 0.810 -0.618
152 HG23 ILE 24 3HG2 ILE 24 -1.801 2.223 -1.607
153 HD11 ILE 24 1HD1 ILE 24 0.705 0.656 -1.664
154 HD12 ILE 24 2HD1 ILE 24 0.698 -0.841 -0.730
155 HD13 ILE 24 3HD1 ILE 24 1.430 -0.805 -2.334
156 H ASN 25 H ASN 25 -2.058 -2.421 -4.001
157 HA ASN 25 HA ASN 25 -4.266 -3.833 -2.929
158 HB2 ASN 25 1HB ASN 25 -2.516 -4.589 -4.691
159 HB3 ASN 25 2HB ASN 25 -1.546 -5.058 -3.298
160 HD21 ASN 25 1HD2 ASN 25 -2.114 -6.828 -2.112
161 HD22 ASN 25 2HD2 ASN 25 -3.372 -7.918 -2.575
162 HA PRO 26 HA PRO 26 -3.271 -3.854 1.366
163 HB2 PRO 26 1HB PRO 26 -4.753 -6.004 2.110
164 HB3 PRO 26 2HB PRO 26 -5.467 -4.437 1.710
165 HG2 PRO 26 1HG PRO 26 -5.218 -6.893 0.016
166 HG3 PRO 26 2HG PRO 26 -6.599 -5.796 0.200
167 HD2 PRO 26 1HD PRO 26 -4.915 -5.676 -1.917
168 HD3 PRO 26 2HD PRO 26 -5.716 -4.238 -1.252
169 H ASN 27 H ASN 27 -3.128 -6.944 -0.388
170 HA ASN 27 HA ASN 27 -1.489 -8.266 1.506
171 HB2 ASN 27 1HB ASN 27 -2.929 -9.176 -0.520
172 HB3 ASN 27 2HB ASN 27 -1.403 -9.018 -1.384
173 HD21 ASN 27 1HD2 ASN 27 -3.277 -11.040 0.430
174 HD22 ASN 27 2HD2 ASN 27 -2.070 -12.173 0.924
175 H SER 28 H SER 28 -0.834 -6.005 -1.011
176 HA SER 28 HA SER 28 1.890 -6.663 -1.464
177 HB2 SER 28 1HB SER 28 0.449 -5.276 -2.993
178 HB3 SER 28 2HB SER 28 0.588 -3.957 -1.831
179 HG SER 28 HG SER 28 2.941 -4.265 -2.109
180 H PHE 29 H PHE 29 3.763 -5.507 -0.780
181 HA PHE 29 HA PHE 29 3.838 -4.995 1.993
182 HB2 PHE 29 1HB PHE 29 5.835 -4.418 -0.200
183 HB3 PHE 29 2HB PHE 29 6.172 -4.170 1.510
184 HD1 PHE 29 2HD PHE 29 5.323 -6.388 2.932
185 HD2 PHE 29 1HD PHE 29 6.804 -6.298 -1.057
186 HE1 PHE 29 2HE PHE 29 6.009 -8.741 3.138
187 HE2 PHE 29 1HE PHE 29 7.492 -8.652 -0.858
188 HZ PHE 29 HZ PHE 29 7.095 -9.877 1.242
189 H ILE 30 H ILE 30 4.610 -2.976 3.003
190 HA ILE 30 HA ILE 30 2.905 -0.824 2.444
191 HB ILE 30 HB ILE 30 5.456 -0.872 4.058
192 HG12 ILE 30 1HG1 ILE 30 3.554 -2.368 4.776
193 HG13 ILE 30 2HG1 ILE 30 4.051 -1.174 5.970
194 HG21 ILE 30 1HG2 ILE 30 3.528 1.289 3.461
195 HG22 ILE 30 2HG2 ILE 30 4.071 1.147 5.132
196 HG23 ILE 30 3HG2 ILE 30 5.248 1.374 3.838
197 HD11 ILE 30 1HD1 ILE 30 1.895 -0.315 4.177
198 HD12 ILE 30 2HD1 ILE 30 1.497 -1.649 5.260
199 HD13 ILE 30 3HD1 ILE 30 2.076 -0.120 5.920
200 H LEU 31 H LEU 31 6.378 -1.228 1.794
201 HA LEU 31 HA LEU 31 7.149 1.140 0.803
202 HB2 LEU 31 1HB LEU 31 8.527 -0.901 0.811
203 HB3 LEU 31 2HB LEU 31 7.633 -1.490 -0.589
204 HG LEU 31 HG LEU 31 8.480 0.623 -1.775
205 HD11 LEU 31 1HD1 LEU 31 10.245 1.816 -0.907
206 HD12 LEU 31 2HD1 LEU 31 10.709 0.530 0.206
207 HD13 LEU 31 3HD1 LEU 31 9.284 1.513 0.541
208 HD21 LEU 31 1HD2 LEU 31 10.610 -0.471 -2.333
209 HD22 LEU 31 2HD2 LEU 31 9.261 -1.607 -2.321
210 HD23 LEU 31 3HD2 LEU 31 10.392 -1.566 -0.968
211 H GLY 32 H GLY 32 5.305 -1.259 -1.076
212 HA2 GLY 32 1HA GLY 32 5.104 -0.076 -3.508
213 HA3 GLY 32 2HA GLY 32 3.757 -0.917 -2.756
214 H LEU 33 H LEU 33 3.215 0.822 -0.645
215 HA LEU 33 HA LEU 33 1.606 2.747 -1.937
216 HB2 LEU 33 1HB LEU 33 0.892 1.896 0.156
217 HB3 LEU 33 2HB LEU 33 2.405 2.353 0.935
218 HG LEU 33 HG LEU 33 1.801 4.703 0.779
219 HD11 LEU 33 1HD1 LEU 33 -0.531 3.622 -0.754
220 HD12 LEU 33 2HD1 LEU 33 0.553 4.952 -1.160
221 HD13 LEU 33 3HD1 LEU 33 -0.650 5.154 0.113
222 HD21 LEU 33 1HD2 LEU 33 0.281 2.710 2.241
223 HD22 LEU 33 2HD2 LEU 33 -0.627 4.203 2.001
224 HD23 LEU 33 3HD2 LEU 33 0.952 4.247 2.787
225 H LYS 34 H LYS 34 4.646 3.016 -0.131
226 HA LYS 34 HA LYS 34 4.893 5.800 -0.191
227 HB2 LYS 34 1HB LYS 34 6.768 3.515 0.148
228 HB3 LYS 34 2HB LYS 34 7.469 5.086 -0.218
229 HG2 LYS 34 1HG LYS 34 7.485 5.106 2.072
230 HG3 LYS 34 2HG LYS 34 5.948 5.906 1.734
231 HD2 LYS 34 1HD LYS 34 4.706 4.119 2.447
232 HD3 LYS 34 2HD LYS 34 5.956 2.946 2.030
233 HE2 LYS 34 1HE LYS 34 5.524 3.329 4.504
234 HE3 LYS 34 2HE LYS 34 7.201 3.426 3.966
235 HZ1 LYS 34 1HZ LYS 34 6.031 5.973 3.775
236 HZ2 LYS 34 2HZ LYS 34 7.314 5.474 4.758
237 HZ3 LYS 34 3HZ LYS 34 5.723 5.360 5.322
238 H GLN 35 H GLN 35 6.435 3.416 -2.355
239 HA GLN 35 HA GLN 35 7.739 4.971 -4.115
240 HB2 GLN 35 1HB GLN 35 7.135 2.393 -4.137
241 HB3 GLN 35 2HB GLN 35 5.940 2.916 -5.316
242 HG2 GLN 35 1HG GLN 35 8.912 3.357 -5.498
243 HG3 GLN 35 2HG GLN 35 7.982 2.157 -6.393
244 HE21 GLN 35 1HE2 GLN 35 9.643 4.389 -7.331
245 HE22 GLN 35 2HE2 GLN 35 8.615 5.347 -8.336
246 H GLN 36 H GLN 36 4.247 4.309 -4.284
247 HA GLN 36 HA GLN 36 3.656 5.797 -6.549
248 HB2 GLN 36 1HB GLN 36 2.063 5.072 -4.111
249 HB3 GLN 36 2HB GLN 36 1.366 6.099 -5.357
250 HG2 GLN 36 1HG GLN 36 2.085 4.221 -6.976
251 HG3 GLN 36 2HG GLN 36 2.195 3.234 -5.520
252 HE21 GLN 36 1HE2 GLN 36 0.393 2.376 -4.704
253 HE22 GLN 36 2HE2 GLN 36 -1.207 2.711 -5.260
254 H ILE 37 H ILE 37 3.952 6.836 -3.188
255 HA ILE 37 HA ILE 37 3.104 9.515 -3.666
256 HB ILE 37 HB ILE 37 4.753 8.431 -1.380
257 HG12 ILE 37 1HG1 ILE 37 1.817 9.033 -1.261
258 HG13 ILE 37 2HG1 ILE 37 2.369 7.487 -1.895
259 HG21 ILE 37 1HG2 ILE 37 3.092 10.665 -0.715
260 HG22 ILE 37 2HG2 ILE 37 4.842 10.498 -0.579
261 HG23 ILE 37 3HG2 ILE 37 4.127 11.079 -2.082
262 HD11 ILE 37 1HD1 ILE 37 3.776 7.664 0.424
263 HD12 ILE 37 2HD1 ILE 37 2.264 8.465 0.852
264 HD13 ILE 37 3HD1 ILE 37 2.243 6.817 0.226
265 H GLU 38 H GLU 38 6.178 7.848 -3.756
266 HA GLU 38 HA GLU 38 7.798 10.195 -3.807
267 HB2 GLU 38 1HB GLU 38 8.912 8.253 -3.104
268 HB3 GLU 38 2HB GLU 38 8.281 7.299 -4.439
269 HG2 GLU 38 1HG GLU 38 9.670 8.704 -5.978
270 HG3 GLU 38 2HG GLU 38 10.414 9.413 -4.545
271 H ASP 39 H ASP 39 6.164 8.267 -6.214
272 HA ASP 39 HA ASP 39 7.498 9.610 -8.417
273 HB2 ASP 39 1HB ASP 39 5.551 7.357 -8.166
274 HB3 ASP 39 2HB ASP 39 5.658 8.214 -9.700
275 H GLN 40 H GLN 40 4.581 9.862 -6.580
276 HA GLN 40 HA GLN 40 3.246 11.527 -8.542
277 HB2 GLN 40 1HB GLN 40 2.531 10.410 -5.863
278 HB3 GLN 40 2HB GLN 40 1.632 11.790 -6.478
279 HG2 GLN 40 1HG GLN 40 1.463 10.260 -8.627
280 HG3 GLN 40 2HG GLN 40 1.696 8.985 -7.432
281 HE21 GLN 40 1HE2 GLN 40 -0.317 8.126 -7.491
282 HE22 GLN 40 2HE2 GLN 40 -1.742 8.970 -6.999
283 H GLN 41 H GLN 41 4.389 11.944 -5.189
284 HA GLN 41 HA GLN 41 4.156 14.814 -5.383
285 HB2 GLN 41 1HB GLN 41 5.352 13.103 -3.196
286 HB3 GLN 41 2HB GLN 41 5.001 14.822 -3.080
287 HG2 GLN 41 1HG GLN 41 2.840 12.856 -3.719
288 HG3 GLN 41 2HG GLN 41 3.350 13.141 -2.056
289 HE21 GLN 41 1HE2 GLN 41 2.992 15.167 -1.123
290 HE22 GLN 41 2HE2 GLN 41 1.850 16.283 -1.781
291 H GLY 42 H GLY 42 6.700 12.401 -5.523
292 HA2 GLY 42 1HA GLY 42 8.721 12.745 -6.714
293 HA3 GLY 42 2HA GLY 42 8.528 14.478 -6.491
294 H LEU 43 H LEU 43 7.839 13.119 -3.585
295 HA LEU 43 HA LEU 43 10.428 13.864 -2.519
296 HB2 LEU 43 1HB LEU 43 7.980 14.252 -1.564
297 HB3 LEU 43 2HB LEU 43 8.304 12.695 -0.804
298 HG LEU 43 HG LEU 43 10.309 14.880 -0.498
299 HD11 LEU 43 1HD1 LEU 43 8.938 16.261 0.558
300 HD12 LEU 43 2HD1 LEU 43 8.529 14.981 1.700
301 HD13 LEU 43 3HD1 LEU 43 7.578 15.187 0.229
302 HD21 LEU 43 1HD2 LEU 43 10.351 12.383 0.346
303 HD22 LEU 43 2HD2 LEU 43 9.375 13.051 1.655
304 HD23 LEU 43 3HD2 LEU 43 10.985 13.697 1.337
305 HA PRO 44 HA PRO 44 12.057 9.771 -2.354
306 HB2 PRO 44 1HB PRO 44 13.965 10.176 -0.467
307 HB3 PRO 44 2HB PRO 44 14.114 10.768 -2.126
308 HG2 PRO 44 1HG PRO 44 13.273 12.240 0.342
309 HG3 PRO 44 2HG PRO 44 14.356 12.765 -0.960
310 HD2 PRO 44 1HD PRO 44 11.771 13.556 -0.808
311 HD3 PRO 44 2HD PRO 44 12.611 13.330 -2.356
312 H LYS 45 H LYS 45 12.018 7.921 -1.073
313 HA LYS 45 HA LYS 45 10.079 7.890 1.014
314 HB2 LYS 45 1HB LYS 45 12.008 5.669 0.348
315 HB3 LYS 45 2HB LYS 45 10.417 5.531 1.083
316 HG2 LYS 45 1HG LYS 45 9.351 6.153 -0.977
317 HG3 LYS 45 2HG LYS 45 10.913 6.484 -1.729
318 HD2 LYS 45 1HD LYS 45 10.439 3.779 -0.579
319 HD3 LYS 45 2HD LYS 45 9.656 4.190 -2.106
320 HE2 LYS 45 1HE LYS 45 12.591 4.643 -1.676
321 HE3 LYS 45 2HE LYS 45 11.969 3.074 -2.185
322 HZ1 LYS 45 1HZ LYS 45 10.914 4.206 -4.086
323 HZ2 LYS 45 2HZ LYS 45 12.601 4.333 -4.103
324 HZ3 LYS 45 3HZ LYS 45 11.659 5.653 -3.622
325 H LYS 46 H LYS 46 13.562 8.008 0.902
326 HA LYS 46 HA LYS 46 14.068 7.231 3.575
327 HB2 LYS 46 1HB LYS 46 16.276 8.304 3.235
328 HB3 LYS 46 2HB LYS 46 15.844 7.207 1.930
329 HG2 LYS 46 1HG LYS 46 15.585 8.897 0.407
330 HG3 LYS 46 2HG LYS 46 15.203 10.099 1.641
331 HD2 LYS 46 1HD LYS 46 17.924 8.871 1.587
332 HD3 LYS 46 2HD LYS 46 17.522 10.133 0.420
333 HE2 LYS 46 1HE LYS 46 17.279 11.745 2.046
334 HE3 LYS 46 2HE LYS 46 16.907 10.569 3.306
335 HZ1 LYS 46 1HZ LYS 46 19.541 10.234 2.241
336 HZ2 LYS 46 2HZ LYS 46 19.043 10.403 3.849
337 HZ3 LYS 46 3HZ LYS 46 19.316 11.776 2.899
338 H GLN 47 H GLN 47 12.412 9.848 2.442
339 HA GLN 47 HA GLN 47 13.156 11.501 4.764
340 HB2 GLN 47 1HB GLN 47 12.185 12.248 2.019
341 HB3 GLN 47 2HB GLN 47 12.011 13.355 3.374
342 HG2 GLN 47 1HG GLN 47 14.502 13.099 3.728
343 HG3 GLN 47 2HG GLN 47 14.542 12.296 2.159
344 HE21 GLN 47 1HE2 GLN 47 15.996 14.078 1.633
345 HE22 GLN 47 2HE2 GLN 47 15.318 15.576 1.100
346 H GLN 48 H GLN 48 10.426 10.486 2.731
347 HA GLN 48 HA GLN 48 8.441 11.516 4.499
348 HB2 GLN 48 1HB GLN 48 6.900 10.764 2.974
349 HB3 GLN 48 2HB GLN 48 8.324 10.856 1.947
350 HG2 GLN 48 1HG GLN 48 8.706 8.437 2.361
351 HG3 GLN 48 2HG GLN 48 7.174 8.393 3.233
352 HE21 GLN 48 1HE2 GLN 48 8.688 8.851 0.119
353 HE22 GLN 48 2HE2 GLN 48 7.273 8.562 -0.830
354 H GLN 49 H GLN 49 7.215 10.488 6.034
355 HA GLN 49 HA GLN 49 7.714 7.665 6.582
356 HB2 GLN 49 1HB GLN 49 9.357 8.984 7.919
357 HB3 GLN 49 2HB GLN 49 8.010 9.787 8.713
358 HG2 GLN 49 1HG GLN 49 7.351 7.848 9.825
359 HG3 GLN 49 2HG GLN 49 8.278 6.807 8.746
360 HE21 GLN 49 1HE2 GLN 49 9.896 5.907 9.782
361 HE22 GLN 49 2HE2 GLN 49 10.911 6.670 10.954
362 H LEU 50 H LEU 50 5.754 6.797 6.589
363 HA LEU 50 HA LEU 50 3.469 8.368 7.503
364 HB2 LEU 50 1HB LEU 50 3.509 5.633 6.241
365 HB3 LEU 50 2HB LEU 50 2.097 6.655 6.499
366 HG LEU 50 HG LEU 50 4.323 7.645 4.772
367 HD11 LEU 50 1HD1 LEU 50 3.439 6.555 2.842
368 HD12 LEU 50 2HD1 LEU 50 2.125 5.843 3.777
369 HD13 LEU 50 3HD1 LEU 50 3.786 5.317 4.050
370 HD21 LEU 50 1HD2 LEU 50 1.368 8.088 5.027
371 HD22 LEU 50 2HD2 LEU 50 2.249 8.569 3.577
372 HD23 LEU 50 3HD2 LEU 50 2.680 9.261 5.142
373 H GLU 51 H GLU 51 2.080 7.708 9.142
374 HA GLU 51 HA GLU 51 2.911 5.400 10.752
375 HB2 GLU 51 1HB GLU 51 2.489 8.216 11.747
376 HB3 GLU 51 2HB GLU 51 2.462 6.817 12.811
377 HG2 GLU 51 1HG GLU 51 4.706 6.461 12.638
378 HG3 GLU 51 2HG GLU 51 4.809 7.176 11.030
379 H PHE 52 H PHE 52 1.240 4.788 12.376
380 HA PHE 52 HA PHE 52 -1.461 5.694 11.800
381 HB2 PHE 52 1HB PHE 52 -0.969 3.846 10.174
382 HB3 PHE 52 2HB PHE 52 -0.745 2.768 11.548
383 HD1 PHE 52 2HD PHE 52 -3.268 5.227 10.310
384 HD2 PHE 52 1HD PHE 52 -2.522 1.447 12.119
385 HE1 PHE 52 2HE PHE 52 -5.684 4.767 10.337
386 HE2 PHE 52 1HE PHE 52 -4.938 0.981 12.148
387 HZ PHE 52 HZ PHE 52 -6.523 2.642 11.258
388 H GLN 53 H GLN 53 -2.445 5.971 13.681
389 HA GLN 53 HA GLN 53 -2.978 5.827 15.888
390 HB2 GLN 53 1HB GLN 53 -2.269 2.915 15.491
391 HB3 GLN 53 2HB GLN 53 -3.211 3.572 16.822
392 HG2 GLN 53 1HG GLN 53 -3.971 3.391 13.926
393 HG3 GLN 53 2HG GLN 53 -4.751 2.631 15.312
394 HE21 GLN 53 1HE2 GLN 53 -5.964 4.288 13.309
395 HE22 GLN 53 2HE2 GLN 53 -6.620 5.665 14.121
396 H GLY 54 H GLY 54 -0.226 6.462 15.168
397 HA2 GLY 54 1HA GLY 54 1.629 7.040 16.429
398 HA3 GLY 54 2HA GLY 54 0.929 6.176 17.790
399 H GLN 55 H GLN 55 1.806 5.058 14.532
400 HA GLN 55 HA GLN 55 3.887 3.366 15.707
401 HB2 GLN 55 1HB GLN 55 1.741 2.324 13.849
402 HB3 GLN 55 2HB GLN 55 3.094 1.401 14.489
403 HG2 GLN 55 1HG GLN 55 2.134 2.012 16.798
404 HG3 GLN 55 2HG GLN 55 0.665 2.410 15.909
405 HE21 GLN 55 1HE2 GLN 55 0.018 0.641 14.303
406 HE22 GLN 55 2HE2 GLN 55 0.066 -0.976 14.909
407 H VAL 56 H VAL 56 5.458 2.608 14.193
408 HA VAL 56 HA VAL 56 5.656 4.342 11.831
409 HB VAL 56 HB VAL 56 7.841 2.741 13.168
410 HG11 VAL 56 1HG1 VAL 56 9.089 3.239 11.403
411 HG12 VAL 56 2HG1 VAL 56 7.698 4.012 10.640
412 HG13 VAL 56 3HG1 VAL 56 8.786 4.957 11.658
413 HG21 VAL 56 1HG2 VAL 56 7.227 5.688 13.370
414 HG22 VAL 56 2HG2 VAL 56 6.975 4.495 14.644
415 HG23 VAL 56 3HG2 VAL 56 8.609 4.863 14.093
416 H LEU 57 H LEU 57 5.095 3.452 9.964
417 HA LEU 57 HA LEU 57 5.028 0.582 9.634
418 HB2 LEU 57 1HB LEU 57 4.517 2.575 7.458
419 HB3 LEU 57 2HB LEU 57 3.841 0.960 7.661
420 HG LEU 57 HG LEU 57 3.165 3.307 9.429
421 HD11 LEU 57 1HD1 LEU 57 1.976 2.337 6.872
422 HD12 LEU 57 2HD1 LEU 57 2.235 3.986 7.441
423 HD13 LEU 57 3HD1 LEU 57 0.928 3.015 8.118
424 HD21 LEU 57 1HD2 LEU 57 1.426 0.930 9.105
425 HD22 LEU 57 2HD2 LEU 57 1.703 1.950 10.517
426 HD23 LEU 57 3HD2 LEU 57 2.898 0.736 10.057
427 H GLN 58 H GLN 58 6.524 -0.637 8.672
428 HA GLN 58 HA GLN 58 8.937 0.628 7.686
429 HB2 GLN 58 1HB GLN 58 8.309 -2.321 7.839
430 HB3 GLN 58 2HB GLN 58 9.895 -1.579 7.682
431 HG2 GLN 58 1HG GLN 58 8.075 -1.342 10.067
432 HG3 GLN 58 2HG GLN 58 9.488 -2.389 9.944
433 HE21 GLN 58 1HE2 GLN 58 8.986 -0.306 11.864
434 HE22 GLN 58 2HE2 GLN 58 10.257 0.851 11.691
435 H ASP 59 H ASP 59 9.906 -0.903 5.750
436 HA ASP 59 HA ASP 59 8.025 -0.457 3.544
437 HB2 ASP 59 1HB ASP 59 11.025 -0.849 3.492
438 HB3 ASP 59 2HB ASP 59 10.014 -0.507 2.091
439 H TRP 60 H TRP 60 9.726 -2.927 5.252
440 HA TRP 60 HA TRP 60 9.372 -4.921 3.182
441 HB2 TRP 60 1HB TRP 60 10.648 -6.343 4.505
442 HB3 TRP 60 2HB TRP 60 11.285 -4.762 4.949
443 HD1 TRP 60 HD TRP 60 8.771 -7.383 6.299
444 HE1 TRP 60 1HE TRP 60 8.750 -7.213 8.867
445 HE3 TRP 60 3HE TRP 60 11.902 -3.383 6.873
446 HZ2 TRP 60 2HZ TRP 60 9.908 -5.597 10.871
447 HZ3 TRP 60 3HZ TRP 60 12.394 -2.587 9.148
448 HH2 TRP 60 HH TRP 60 11.416 -3.672 11.105
449 H LEU 61 H LEU 61 7.688 -3.774 5.977
450 HA LEU 61 HA LEU 61 6.088 -6.094 6.413
451 HB2 LEU 61 1HB LEU 61 5.639 -3.220 7.203
452 HB3 LEU 61 2HB LEU 61 4.694 -4.589 7.785
453 HG LEU 61 HG LEU 61 7.634 -4.146 8.300
454 HD11 LEU 61 1HD1 LEU 61 6.859 -3.787 10.642
455 HD12 LEU 61 2HD1 LEU 61 5.205 -3.736 10.033
456 HD13 LEU 61 3HD1 LEU 61 6.373 -2.521 9.514
457 HD21 LEU 61 1HD2 LEU 61 6.946 -6.519 8.195
458 HD22 LEU 61 2HD2 LEU 61 5.747 -6.200 9.448
459 HD23 LEU 61 3HD2 LEU 61 7.465 -6.023 9.806
460 H GLY 62 H GLY 62 3.553 -5.649 6.404
461 HA2 GLY 62 1HA GLY 62 2.872 -4.594 3.729
462 HA3 GLY 62 2HA GLY 62 2.217 -6.111 4.327
463 H LEU 63 H LEU 63 0.523 -4.149 3.459
464 HA LEU 63 HA LEU 63 -0.373 -2.393 5.483
465 HB2 LEU 63 1HB LEU 63 -1.600 -3.489 2.980
466 HB3 LEU 63 2HB LEU 63 -2.541 -2.487 4.083
467 HG LEU 63 HG LEU 63 -0.505 -0.834 3.768
468 HD11 LEU 63 1HD1 LEU 63 0.946 -2.051 2.417
469 HD12 LEU 63 2HD1 LEU 63 0.121 -0.985 1.280
470 HD13 LEU 63 3HD1 LEU 63 -0.359 -2.677 1.410
471 HD21 LEU 63 1HD2 LEU 63 -2.737 -1.261 1.786
472 HD22 LEU 63 2HD2 LEU 63 -1.749 0.197 1.884
473 HD23 LEU 63 3HD2 LEU 63 -2.780 -0.264 3.240
474 H GLY 64 H GLY 64 -1.217 -5.704 4.626
475 HA2 GLY 64 1HA GLY 64 -3.444 -5.864 6.422
476 HA3 GLY 64 2HA GLY 64 -2.662 -7.211 5.608
477 H ILE 65 H ILE 65 -0.053 -6.080 6.826
478 HA ILE 65 HA ILE 65 0.083 -7.876 8.992
479 HB ILE 65 HB ILE 65 1.900 -5.555 8.334
480 HG12 ILE 65 1HG1 ILE 65 2.069 -6.967 6.496
481 HG13 ILE 65 2HG1 ILE 65 3.338 -7.590 7.545
482 HG21 ILE 65 1HG2 ILE 65 2.456 -7.951 10.076
483 HG22 ILE 65 2HG2 ILE 65 3.542 -6.602 9.747
484 HG23 ILE 65 3HG2 ILE 65 2.069 -6.340 10.680
485 HD11 ILE 65 1HD1 ILE 65 2.080 -9.403 6.571
486 HD12 ILE 65 2HD1 ILE 65 1.807 -9.347 8.313
487 HD13 ILE 65 3HD1 ILE 65 0.577 -8.736 7.208
488 H TYR 66 H TYR 66 -0.300 -4.355 8.864
489 HA TYR 66 HA TYR 66 -0.410 -4.124 11.737
490 HB2 TYR 66 1HB TYR 66 -0.631 -2.215 9.441
491 HB3 TYR 66 2HB TYR 66 -1.180 -1.715 11.037
492 HD1 TYR 66 2HD TYR 66 0.461 -1.717 12.943
493 HD2 TYR 66 1HD TYR 66 1.670 -2.269 8.901
494 HE1 TYR 66 2HE TYR 66 2.771 -1.147 13.563
495 HE2 TYR 66 1HE TYR 66 3.985 -1.702 9.510
496 HH TYR 66 HH TYR 66 5.420 -1.594 11.389
497 H GLY 67 H GLY 67 -2.690 -4.049 9.039
498 HA2 GLY 67 1HA GLY 67 -4.901 -4.979 9.361
499 HA3 GLY 67 2HA GLY 67 -4.870 -4.351 11.002
500 H ILE 68 H ILE 68 -3.811 -2.513 8.214
501 HA ILE 68 HA ILE 68 -5.527 -0.340 8.866
502 HB ILE 68 HB ILE 68 -3.938 -0.808 6.341
503 HG12 ILE 68 1HG1 ILE 68 -3.142 1.014 8.590
504 HG13 ILE 68 2HG1 ILE 68 -2.766 -0.704 8.670
505 HG21 ILE 68 1HG2 ILE 68 -4.329 1.944 7.067
506 HG22 ILE 68 2HG2 ILE 68 -4.733 1.115 5.565
507 HG23 ILE 68 3HG2 ILE 68 -5.882 1.125 6.903
508 HD11 ILE 68 1HD1 ILE 68 -1.959 0.171 6.127
509 HD12 ILE 68 2HD1 ILE 68 -1.400 1.378 7.286
510 HD13 ILE 68 3HD1 ILE 68 -0.946 -0.314 7.486
511 H GLN 69 H GLN 69 -7.499 0.178 8.135
512 HA GLN 69 HA GLN 69 -8.735 -1.626 6.175
513 HB2 GLN 69 1HB GLN 69 -10.881 -0.881 7.084
514 HB3 GLN 69 2HB GLN 69 -9.844 -1.516 8.354
515 HG2 GLN 69 1HG GLN 69 -9.187 0.907 8.793
516 HG3 GLN 69 2HG GLN 69 -10.570 1.334 7.787
517 HE21 GLN 69 1HE2 GLN 69 -12.274 1.840 8.941
518 HE22 GLN 69 2HE2 GLN 69 -12.752 1.117 10.435
519 H ASP 70 H ASP 70 -10.332 -0.656 4.686
520 HA ASP 70 HA ASP 70 -9.202 1.345 3.110
521 HB2 ASP 70 1HB ASP 70 -11.026 1.094 1.716
522 HB3 ASP 70 2HB ASP 70 -11.093 -0.419 2.616
523 H SER 71 H SER 71 -10.064 3.478 2.590
524 HA SER 71 HA SER 71 -10.613 5.610 3.162
525 HB2 SER 71 1HB SER 71 -12.620 4.022 4.735
526 HB3 SER 71 2HB SER 71 -12.544 5.776 4.905
527 HG SER 71 HG SER 71 -13.401 5.994 2.993
528 H ASP 72 H ASP 72 -8.470 4.238 4.572
529 HA ASP 72 HA ASP 72 -8.577 5.211 7.299
530 HB2 ASP 72 1HB ASP 72 -6.228 4.295 7.397
531 HB3 ASP 72 2HB ASP 72 -7.473 3.113 7.002
532 H THR 73 H THR 73 -7.059 6.706 8.186
533 HA THR 73 HA THR 73 -6.178 8.714 6.224
534 HB THR 73 HB THR 73 -6.712 9.085 9.178
535 HG1 THR 73 1HG THR 73 -8.553 10.275 8.338
536 HG21 THR 73 1HG2 THR 73 -5.029 10.589 7.813
537 HG22 THR 73 2HG2 THR 73 -6.174 11.307 8.946
538 HG23 THR 73 3HG2 THR 73 -6.518 11.322 7.217
539 H LEU 74 H LEU 74 -4.081 8.592 5.777
540 HA LEU 74 HA LEU 74 -2.220 7.762 7.894
541 HB2 LEU 74 1HB LEU 74 -1.699 7.933 4.933
542 HB3 LEU 74 2HB LEU 74 -0.669 7.189 6.155
543 HG LEU 74 HG LEU 74 -3.418 6.168 5.463
544 HD11 LEU 74 1HD1 LEU 74 -0.741 5.284 4.396
545 HD12 LEU 74 2HD1 LEU 74 -2.037 6.048 3.476
546 HD13 LEU 74 3HD1 LEU 74 -2.270 4.438 4.155
547 HD21 LEU 74 1HD2 LEU 74 -3.042 5.052 7.369
548 HD22 LEU 74 2HD2 LEU 74 -1.322 5.441 7.373
549 HD23 LEU 74 3HD2 LEU 74 -1.920 4.092 6.406
550 H ILE 75 H ILE 75 -0.730 9.128 8.673
551 HA ILE 75 HA ILE 75 -0.746 11.869 7.687
552 HB ILE 75 HB ILE 75 0.708 10.760 10.088
553 HG12 ILE 75 1HG1 ILE 75 -1.771 10.427 10.183
554 HG13 ILE 75 2HG1 ILE 75 -1.149 11.494 11.437
555 HG21 ILE 75 1HG2 ILE 75 0.418 13.425 8.883
556 HG22 ILE 75 2HG2 ILE 75 0.187 13.357 10.629
557 HG23 ILE 75 3HG2 ILE 75 1.692 12.776 9.916
558 HD11 ILE 75 1HD1 ILE 75 -2.911 12.742 10.796
559 HD12 ILE 75 2HD1 ILE 75 -1.763 13.317 9.586
560 HD13 ILE 75 3HD1 ILE 75 -2.936 12.070 9.166
561 H LEU 76 H LEU 76 0.968 12.901 6.780
562 HA LEU 76 HA LEU 76 3.342 11.253 6.211
563 HB2 LEU 76 1HB LEU 76 2.314 11.675 4.159
564 HB3 LEU 76 2HB LEU 76 1.900 13.329 4.604
565 HG LEU 76 HG LEU 76 4.446 13.746 4.557
566 HD11 LEU 76 1HD1 LEU 76 5.687 11.938 4.185
567 HD12 LEU 76 2HD1 LEU 76 5.115 12.006 2.519
568 HD13 LEU 76 3HD1 LEU 76 4.289 10.982 3.693
569 HD21 LEU 76 1HD2 LEU 76 2.786 14.619 2.937
570 HD22 LEU 76 2HD2 LEU 76 3.015 13.165 1.966
571 HD23 LEU 76 3HD2 LEU 76 4.358 14.282 2.211
572 H SER 77 H SER 77 5.225 11.912 7.007
573 HA SER 77 HA SER 77 5.701 14.749 7.488
574 HB2 SER 77 1HB SER 77 5.881 12.633 9.642
575 HB3 SER 77 2HB SER 77 6.573 14.249 9.789
576 HG SER 77 HG SER 77 3.834 13.734 9.257
577 H LYS 78 H LYS 78 7.719 15.321 6.973
578 HA LYS 78 HA LYS 78 9.525 13.362 5.928
579 HB2 LYS 78 1HB LYS 78 10.898 15.197 5.281
580 HB3 LYS 78 2HB LYS 78 9.231 15.701 5.034
581 HG2 LYS 78 1HG LYS 78 9.300 17.245 6.708
582 HG3 LYS 78 2HG LYS 78 10.514 16.356 7.630
583 HD2 LYS 78 1HD LYS 78 11.652 18.240 6.825
584 HD3 LYS 78 2HD LYS 78 12.123 16.940 5.728
585 HE2 LYS 78 1HE LYS 78 10.434 17.696 4.121
586 HE3 LYS 78 2HE LYS 78 9.975 18.998 5.218
587 HZ1 LYS 78 1HZ LYS 78 12.410 19.681 5.059
588 HZ2 LYS 78 2HZ LYS 78 11.425 19.990 3.719
589 HZ3 LYS 78 3HZ LYS 78 12.488 18.674 3.701
590 H LYS 79 H LYS 79 11.608 12.850 6.669
591 HA LYS 79 HA LYS 79 11.849 12.547 9.471
592 HB2 LYS 79 1HB LYS 79 14.040 12.279 7.409
593 HB3 LYS 79 2HB LYS 79 14.005 11.557 9.012
594 HG2 LYS 79 1HG LYS 79 11.773 10.483 8.066
595 HG3 LYS 79 2HG LYS 79 12.604 10.748 6.531
596 HD2 LYS 79 1HD LYS 79 14.503 9.462 7.291
597 HD3 LYS 79 2HD LYS 79 13.785 9.289 8.894
598 HE2 LYS 79 1HE LYS 79 12.053 7.902 8.066
599 HE3 LYS 79 2HE LYS 79 12.446 8.290 6.392
600 HZ1 LYS 79 1HZ LYS 79 14.122 6.716 8.272
601 HZ2 LYS 79 2HZ LYS 79 14.580 7.148 6.703
602 HZ3 LYS 79 3HZ LYS 79 13.265 6.112 6.944
603 H LYS 80 H LYS 80 12.575 13.918 10.952
604 HA LYS 80 HA LYS 80 13.178 16.534 10.634
605 HB2 LYS 80 1HB LYS 80 14.384 14.647 12.664
606 HB3 LYS 80 2HB LYS 80 14.450 16.400 12.777
607 HG2 LYS 80 1HG LYS 80 11.788 15.124 12.465
608 HG3 LYS 80 2HG LYS 80 12.604 14.990 14.025
609 HD2 LYS 80 1HD LYS 80 11.171 16.932 14.037
610 HD3 LYS 80 2HD LYS 80 12.857 17.453 14.056
611 HE2 LYS 80 1HE LYS 80 12.790 18.156 11.835
612 HE3 LYS 80 2HE LYS 80 11.358 17.193 11.475
613 HZ1 LYS 80 1HZ LYS 80 11.490 19.871 12.283
614 HZ2 LYS 80 2HZ LYS 80 10.699 19.003 13.499
615 HZ3 LYS 80 3HZ LYS 80 10.117 18.955 11.912
616 H GLY 81 H GLY 81 15.223 17.743 10.834
617 HA2 GLY 81 1HA GLY 81 17.759 17.218 10.643
618 HA3 GLY 81 2HA GLY 81 17.264 16.521 9.108
619 H SER 82 H SER 82 19.118 18.672 9.486
620 HA SER 82 HA SER 82 17.627 20.925 8.314
621 HB2 SER 82 1HB SER 82 20.294 20.910 9.748
622 HB3 SER 82 2HB SER 82 19.553 22.332 9.012
623 HG SER 82 HG SER 82 18.517 22.552 10.814
624 H GLY 83 H GLY 83 20.584 18.992 8.031
625 HA2 GLY 83 1HA GLY 83 20.854 19.979 5.258
626 HA3 GLY 83 2HA GLY 83 22.212 19.483 6.257
627 HA PRO 84 HA PRO 84 19.756 15.521 4.856
628 HB2 PRO 84 1HB PRO 84 18.272 15.865 2.609
629 HB3 PRO 84 2HB PRO 84 17.614 16.075 4.236
630 HG2 PRO 84 1HG PRO 84 18.571 18.146 2.298
631 HG3 PRO 84 2HG PRO 84 17.129 18.161 3.331
632 HD2 PRO 84 1HD PRO 84 19.392 19.506 3.967
633 HD3 PRO 84 2HD PRO 84 18.319 18.806 5.196
634 H SER 85 H SER 85 21.197 17.898 2.779
635 HA SER 85 HA SER 85 22.679 15.765 1.414
636 HB2 SER 85 1HB SER 85 20.703 16.864 0.058
637 HB3 SER 85 2HB SER 85 21.861 18.175 -0.164
638 HG SER 85 HG SER 85 22.006 16.635 -1.840
639 H SER 86 H SER 86 24.804 16.095 1.444
640 HA SER 86 HA SER 86 26.761 17.080 2.168
641 HB2 SER 86 1HB SER 86 27.386 18.999 0.688
642 HB3 SER 86 2HB SER 86 26.758 17.606 -0.192
643 HG SER 86 HG SER 86 25.695 20.138 0.117
644 H GLY 87 H GLY 87 24.756 17.651 4.007
645 HA2 GLY 87 1HA GLY 87 24.366 19.033 5.798
646 HA3 GLY 87 2HA GLY 87 25.855 19.861 5.368
Start of MODEL 9
1 H1 GLY 1 H GLY 1 -12.807 -5.850 -23.172
2 HA2 GLY 1 1HA GLY 1 -10.216 -4.714 -22.341
3 HA3 GLY 1 2HA GLY 1 -11.687 -3.760 -22.218
4 H SER 2 H SER 2 -9.602 -5.310 -20.374
5 HA SER 2 HA SER 2 -11.112 -7.070 -18.789
6 HB2 SER 2 1HB SER 2 -8.773 -5.367 -17.899
7 HB3 SER 2 2HB SER 2 -9.340 -6.856 -17.144
8 HG SER 2 HG SER 2 -8.929 -7.717 -19.424
9 H SER 3 H SER 3 -12.265 -6.801 -16.905
10 HA SER 3 HA SER 3 -12.803 -4.036 -16.056
11 HB2 SER 3 1HB SER 3 -15.140 -4.385 -15.995
12 HB3 SER 3 2HB SER 3 -14.628 -5.075 -17.535
13 HG SER 3 HG SER 3 -16.033 -6.477 -16.403
14 H GLY 4 H GLY 4 -13.226 -3.732 -13.871
15 HA2 GLY 4 1HA GLY 4 -13.914 -5.042 -11.781
16 HA3 GLY 4 2HA GLY 4 -12.523 -6.040 -12.177
17 H SER 5 H SER 5 -12.580 -4.941 -9.731
18 HA SER 5 HA SER 5 -10.324 -3.113 -9.842
19 HB2 SER 5 1HB SER 5 -12.959 -2.409 -8.547
20 HB3 SER 5 2HB SER 5 -11.445 -1.621 -8.104
21 HG SER 5 HG SER 5 -12.789 -0.606 -9.811
22 H SER 6 H SER 6 -8.848 -3.764 -8.431
23 HA SER 6 HA SER 6 -9.737 -5.172 -6.002
24 HB2 SER 6 1HB SER 6 -7.447 -5.895 -7.839
25 HB3 SER 6 2HB SER 6 -7.649 -6.572 -6.223
26 HG SER 6 HG SER 6 -9.482 -6.776 -8.383
27 H GLY 7 H GLY 7 -8.823 -4.535 -4.129
28 HA2 GLY 7 1HA GLY 7 -6.644 -3.770 -3.110
29 HA3 GLY 7 2HA GLY 7 -6.694 -2.497 -4.321
30 H ILE 8 H ILE 8 -6.444 -1.379 -2.081
31 HA ILE 8 HA ILE 8 -9.149 -0.633 -1.184
32 HB ILE 8 HB ILE 8 -8.334 -0.280 1.061
33 HG12 ILE 8 1HG1 ILE 8 -5.660 -1.331 0.118
34 HG13 ILE 8 2HG1 ILE 8 -6.013 0.374 0.375
35 HG21 ILE 8 1HG2 ILE 8 -8.979 -2.402 1.279
36 HG22 ILE 8 2HG2 ILE 8 -8.249 -2.863 -0.258
37 HG23 ILE 8 3HG2 ILE 8 -7.268 -2.822 1.207
38 HD11 ILE 8 1HD1 ILE 8 -5.257 -1.649 2.269
39 HD12 ILE 8 2HD1 ILE 8 -5.342 0.102 2.464
40 HD13 ILE 8 3HD1 ILE 8 -6.777 -0.886 2.735
41 H GLN 9 H GLN 9 -9.297 1.558 -0.277
42 HA GLN 9 HA GLN 9 -7.485 3.386 -1.697
43 HB2 GLN 9 1HB GLN 9 -9.951 3.432 -2.233
44 HB3 GLN 9 2HB GLN 9 -10.224 4.019 -0.598
45 HG2 GLN 9 1HG GLN 9 -9.073 6.034 -1.023
46 HG3 GLN 9 2HG GLN 9 -8.414 5.420 -2.538
47 HE21 GLN 9 1HE2 GLN 9 -9.756 5.274 -4.348
48 HE22 GLN 9 2HE2 GLN 9 -11.243 6.148 -4.452
49 H VAL 10 H VAL 10 -6.076 4.502 -0.535
50 HA VAL 10 HA VAL 10 -6.650 4.952 2.322
51 HB VAL 10 HB VAL 10 -4.224 5.003 2.704
52 HG11 VAL 10 1HG1 VAL 10 -5.505 2.579 1.517
53 HG12 VAL 10 2HG1 VAL 10 -3.818 2.522 2.032
54 HG13 VAL 10 3HG1 VAL 10 -5.084 2.916 3.195
55 HG21 VAL 10 1HG2 VAL 10 -4.155 4.575 -0.253
56 HG22 VAL 10 2HG2 VAL 10 -3.214 5.688 0.740
57 HG23 VAL 10 3HG2 VAL 10 -2.845 3.964 0.758
58 H PHE 11 H PHE 11 -6.139 6.953 3.223
59 HA PHE 11 HA PHE 11 -5.857 9.120 1.260
60 HB2 PHE 11 1HB PHE 11 -7.057 9.018 4.023
61 HB3 PHE 11 2HB PHE 11 -6.688 10.543 3.224
62 HD1 PHE 11 1HD PHE 11 -7.760 10.983 0.957
63 HD2 PHE 11 2HD PHE 11 -9.053 7.905 3.597
64 HE1 PHE 11 1HE PHE 11 -9.924 10.896 -0.210
65 HE2 PHE 11 2HE PHE 11 -11.219 7.813 2.434
66 HZ PHE 11 HZ PHE 11 -11.657 9.309 0.527
67 H VAL 12 H VAL 12 -3.804 9.729 1.030
68 HA VAL 12 HA VAL 12 -1.954 9.600 3.268
69 HB VAL 12 HB VAL 12 -1.504 10.428 0.397
70 HG11 VAL 12 1HG1 VAL 12 0.451 11.248 1.053
71 HG12 VAL 12 2HG1 VAL 12 0.112 10.801 2.726
72 HG13 VAL 12 3HG1 VAL 12 0.899 9.649 1.646
73 HG21 VAL 12 1HG2 VAL 12 -1.875 8.168 0.241
74 HG22 VAL 12 2HG2 VAL 12 -0.141 8.190 0.560
75 HG23 VAL 12 3HG2 VAL 12 -1.273 7.845 1.867
76 H LYS 13 H LYS 13 -2.022 11.229 4.674
77 HA LYS 13 HA LYS 13 -2.692 13.920 3.785
78 HB2 LYS 13 1HB LYS 13 -3.698 12.948 5.853
79 HB3 LYS 13 2HB LYS 13 -2.095 12.928 6.577
80 HG2 LYS 13 1HG LYS 13 -2.034 15.430 6.142
81 HG3 LYS 13 2HG LYS 13 -3.764 15.301 5.812
82 HD2 LYS 13 1HD LYS 13 -3.979 14.192 8.076
83 HD3 LYS 13 2HD LYS 13 -2.313 14.689 8.379
84 HE2 LYS 13 1HE LYS 13 -2.888 16.994 8.190
85 HE3 LYS 13 2HE LYS 13 -4.499 16.604 7.590
86 HZ1 LYS 13 1HZ LYS 13 -3.773 15.541 10.205
87 HZ2 LYS 13 2HZ LYS 13 -5.256 16.139 9.654
88 HZ3 LYS 13 3HZ LYS 13 -4.029 17.211 10.110
89 H ASN 14 H ASN 14 -1.093 15.111 2.981
90 HA ASN 14 HA ASN 14 1.657 14.641 3.566
91 HB2 ASN 14 1HB ASN 14 0.755 17.224 2.371
92 HB3 ASN 14 2HB ASN 14 2.120 16.201 1.932
93 HD21 ASN 14 1HD2 ASN 14 -0.179 17.415 0.413
94 HD22 ASN 14 2HD2 ASN 14 -0.847 16.093 -0.477
95 HA PRO 15 HA PRO 15 2.318 17.166 7.095
96 HB2 PRO 15 1HB PRO 15 4.831 18.081 6.627
97 HB3 PRO 15 2HB PRO 15 4.487 16.408 7.083
98 HG2 PRO 15 1HG PRO 15 5.014 17.561 4.372
99 HG3 PRO 15 2HG PRO 15 5.624 16.058 5.086
100 HD2 PRO 15 1HD PRO 15 3.559 16.106 3.336
101 HD3 PRO 15 2HD PRO 15 3.677 14.908 4.641
102 H ASP 16 H ASP 16 1.821 18.448 4.090
103 HA ASP 16 HA ASP 16 2.357 21.215 4.885
104 HB2 ASP 16 1HB ASP 16 1.870 19.838 2.277
105 HB3 ASP 16 2HB ASP 16 1.475 21.549 2.414
106 H GLY 17 H GLY 17 -0.302 19.200 3.641
107 HA2 GLY 17 1HA GLY 17 -2.363 19.713 5.161
108 HA3 GLY 17 2HA GLY 17 -2.207 21.295 4.411
109 H GLY 18 H GLY 18 -2.159 17.895 3.315
110 HA2 GLY 18 1HA GLY 18 -4.470 18.354 1.642
111 HA3 GLY 18 2HA GLY 18 -2.971 18.159 0.747
112 H SER 19 H SER 19 -5.570 16.522 1.311
113 HA SER 19 HA SER 19 -4.172 13.980 1.835
114 HB2 SER 19 1HB SER 19 -6.308 13.110 2.717
115 HB3 SER 19 2HB SER 19 -5.750 14.510 3.633
116 HG SER 19 HG SER 19 -7.252 15.776 2.567
117 H TYR 20 H TYR 20 -4.000 12.762 0.086
118 HA TYR 20 HA TYR 20 -6.024 13.033 -2.034
119 HB2 TYR 20 1HB TYR 20 -3.286 11.824 -2.380
120 HB3 TYR 20 2HB TYR 20 -4.378 12.425 -3.623
121 HD1 TYR 20 2HD TYR 20 -5.123 15.051 -2.393
122 HD2 TYR 20 1HD TYR 20 -1.356 13.106 -2.753
123 HE1 TYR 20 2HE TYR 20 -3.996 17.236 -2.330
124 HE2 TYR 20 1HE TYR 20 -0.218 15.286 -2.690
125 HH TYR 20 HH TYR 20 -1.573 18.036 -1.625
126 H ALA 21 H ALA 21 -6.567 11.075 -3.239
127 HA ALA 21 HA ALA 21 -6.695 8.754 -1.444
128 HB1 ALA 21 1HB ALA 21 -8.340 8.672 -3.860
129 HB2 ALA 21 2HB ALA 21 -8.777 8.380 -2.176
130 HB3 ALA 21 3HB ALA 21 -8.698 10.030 -2.792
131 H TYR 22 H TYR 22 -5.194 7.263 -1.813
132 HA TYR 22 HA TYR 22 -4.200 6.871 -4.544
133 HB2 TYR 22 1HB TYR 22 -3.093 6.164 -1.834
134 HB3 TYR 22 2HB TYR 22 -2.442 5.460 -3.310
135 HD1 TYR 22 2HD TYR 22 -3.069 8.696 -1.600
136 HD2 TYR 22 1HD TYR 22 -0.878 6.635 -4.609
137 HE1 TYR 22 2HE TYR 22 -1.638 10.673 -1.904
138 HE2 TYR 22 1HE TYR 22 0.560 8.606 -4.920
139 HH TYR 22 HH TYR 22 1.235 10.668 -3.281
140 H ALA 23 H ALA 23 -3.760 4.632 -5.237
141 HA ALA 23 HA ALA 23 -5.732 2.734 -4.143
142 HB1 ALA 23 1HB ALA 23 -5.800 1.870 -6.579
143 HB2 ALA 23 2HB ALA 23 -6.705 3.326 -6.162
144 HB3 ALA 23 3HB ALA 23 -5.152 3.459 -6.987
145 H ILE 24 H ILE 24 -4.751 1.037 -3.279
146 HA ILE 24 HA ILE 24 -2.683 -0.367 -4.720
147 HB ILE 24 HB ILE 24 -1.149 1.039 -3.672
148 HG12 ILE 24 1HG1 ILE 24 -1.437 -1.149 -1.612
149 HG13 ILE 24 2HG1 ILE 24 -0.822 -1.446 -3.234
150 HG21 ILE 24 1HG2 ILE 24 -2.019 2.415 -2.137
151 HG22 ILE 24 2HG2 ILE 24 -3.208 1.224 -1.611
152 HG23 ILE 24 3HG2 ILE 24 -1.566 1.172 -0.970
153 HD11 ILE 24 1HD1 ILE 24 0.667 -0.762 -1.035
154 HD12 ILE 24 2HD1 ILE 24 1.190 -0.657 -2.717
155 HD13 ILE 24 3HD1 ILE 24 0.521 0.762 -1.911
156 H ASN 25 H ASN 25 -2.476 -2.501 -4.094
157 HA ASN 25 HA ASN 25 -4.679 -3.620 -2.683
158 HB2 ASN 25 1HB ASN 25 -2.137 -4.812 -3.793
159 HB3 ASN 25 2HB ASN 25 -3.363 -5.779 -2.978
160 HD21 ASN 25 1HD2 ASN 25 -2.341 -4.508 -5.895
161 HD22 ASN 25 2HD2 ASN 25 -3.767 -4.807 -6.824
162 HA PRO 26 HA PRO 26 -3.137 -3.584 1.440
163 HB2 PRO 26 1HB PRO 26 -4.604 -5.626 2.463
164 HB3 PRO 26 2HB PRO 26 -5.293 -4.042 2.089
165 HG2 PRO 26 1HG PRO 26 -5.377 -6.570 0.488
166 HG3 PRO 26 2HG PRO 26 -6.671 -5.398 0.798
167 HD2 PRO 26 1HD PRO 26 -5.274 -5.445 -1.521
168 HD3 PRO 26 2HD PRO 26 -5.915 -3.944 -0.823
169 H ASN 27 H ASN 27 -2.927 -6.389 -0.591
170 HA ASN 27 HA ASN 27 -1.423 -8.011 1.215
171 HB2 ASN 27 1HB ASN 27 -1.838 -8.145 -1.775
172 HB3 ASN 27 2HB ASN 27 -0.912 -9.341 -0.872
173 HD21 ASN 27 1HD2 ASN 27 -2.061 -10.413 0.922
174 HD22 ASN 27 2HD2 ASN 27 -3.738 -10.769 0.712
175 H SER 28 H SER 28 -0.636 -5.684 -1.295
176 HA SER 28 HA SER 28 2.075 -6.224 -1.620
177 HB2 SER 28 1HB SER 28 0.482 -3.675 -1.852
178 HB3 SER 28 2HB SER 28 2.213 -3.720 -2.187
179 HG SER 28 HG SER 28 1.501 -5.618 -3.602
180 H PHE 29 H PHE 29 3.879 -4.747 -0.893
181 HA PHE 29 HA PHE 29 3.864 -4.665 1.997
182 HB2 PHE 29 1HB PHE 29 6.094 -3.853 0.125
183 HB3 PHE 29 2HB PHE 29 6.231 -4.263 1.832
184 HD1 PHE 29 2HD PHE 29 5.290 -6.686 2.418
185 HD2 PHE 29 1HD PHE 29 6.697 -5.445 -1.403
186 HE1 PHE 29 2HE PHE 29 5.721 -9.033 1.818
187 HE2 PHE 29 1HE PHE 29 7.130 -7.791 -2.009
188 HZ PHE 29 HZ PHE 29 6.643 -9.588 -0.397
189 H ILE 30 H ILE 30 4.510 -2.802 3.231
190 HA ILE 30 HA ILE 30 3.051 -0.512 2.734
191 HB ILE 30 HB ILE 30 5.479 -0.963 4.449
192 HG12 ILE 30 1HG1 ILE 30 3.292 -1.994 5.073
193 HG13 ILE 30 2HG1 ILE 30 3.895 -0.853 6.270
194 HG21 ILE 30 1HG2 ILE 30 5.826 1.258 4.304
195 HG22 ILE 30 2HG2 ILE 30 4.200 1.579 3.703
196 HG23 ILE 30 3HG2 ILE 30 4.470 1.341 5.429
197 HD11 ILE 30 1HD1 ILE 30 2.360 0.777 4.775
198 HD12 ILE 30 2HD1 ILE 30 1.488 -0.746 4.598
199 HD13 ILE 30 3HD1 ILE 30 1.793 -0.086 6.204
200 H LEU 31 H LEU 31 6.503 -1.078 2.104
201 HA LEU 31 HA LEU 31 7.293 1.384 1.215
202 HB2 LEU 31 1HB LEU 31 8.529 -0.926 1.359
203 HB3 LEU 31 2HB LEU 31 8.117 -1.017 -0.352
204 HG LEU 31 HG LEU 31 9.309 1.183 -0.643
205 HD11 LEU 31 1HD1 LEU 31 9.621 0.809 2.244
206 HD12 LEU 31 2HD1 LEU 31 9.700 2.277 1.271
207 HD13 LEU 31 3HD1 LEU 31 11.110 1.226 1.395
208 HD21 LEU 31 1HD2 LEU 31 11.547 0.158 -0.583
209 HD22 LEU 31 2HD2 LEU 31 10.339 -0.907 -1.303
210 HD23 LEU 31 3HD2 LEU 31 10.890 -1.187 0.350
211 H GLY 32 H GLY 32 5.500 -1.073 -0.590
212 HA2 GLY 32 1HA GLY 32 5.564 0.000 -3.133
213 HA3 GLY 32 2HA GLY 32 4.199 -0.891 -2.475
214 H LEU 33 H LEU 33 3.337 0.834 -0.495
215 HA LEU 33 HA LEU 33 1.764 2.643 -1.960
216 HB2 LEU 33 1HB LEU 33 0.905 1.852 0.085
217 HB3 LEU 33 2HB LEU 33 2.348 2.342 0.970
218 HG LEU 33 HG LEU 33 1.723 4.666 0.787
219 HD11 LEU 33 1HD1 LEU 33 -0.641 5.110 -0.160
220 HD12 LEU 33 2HD1 LEU 33 -0.397 3.597 -1.032
221 HD13 LEU 33 3HD1 LEU 33 0.714 4.944 -1.277
222 HD21 LEU 33 1HD2 LEU 33 -0.855 3.412 1.572
223 HD22 LEU 33 2HD2 LEU 33 0.104 4.641 2.397
224 HD23 LEU 33 3HD2 LEU 33 0.602 2.949 2.452
225 H LYS 34 H LYS 34 4.642 3.135 0.049
226 HA LYS 34 HA LYS 34 4.767 5.906 -0.010
227 HB2 LYS 34 1HB LYS 34 6.950 3.827 0.070
228 HB3 LYS 34 2HB LYS 34 7.280 5.549 0.206
229 HG2 LYS 34 1HG LYS 34 6.228 5.718 2.267
230 HG3 LYS 34 2HG LYS 34 5.318 4.223 2.034
231 HD2 LYS 34 1HD LYS 34 7.096 2.891 2.608
232 HD3 LYS 34 2HD LYS 34 8.293 4.084 2.096
233 HE2 LYS 34 1HE LYS 34 7.451 5.490 4.065
234 HE3 LYS 34 2HE LYS 34 6.676 4.009 4.626
235 HZ1 LYS 34 1HZ LYS 34 9.432 4.774 4.735
236 HZ2 LYS 34 2HZ LYS 34 9.223 3.240 4.054
237 HZ3 LYS 34 3HZ LYS 34 8.613 3.570 5.597
238 H GLN 35 H GLN 35 6.255 3.593 -2.273
239 HA GLN 35 HA GLN 35 7.588 5.220 -3.975
240 HB2 GLN 35 1HB GLN 35 7.621 2.904 -4.431
241 HB3 GLN 35 2HB GLN 35 5.870 2.821 -4.564
242 HG2 GLN 35 1HG GLN 35 6.750 2.633 -6.751
243 HG3 GLN 35 2HG GLN 35 6.042 4.242 -6.612
244 HE21 GLN 35 1HE2 GLN 35 7.420 6.043 -6.458
245 HE22 GLN 35 2HE2 GLN 35 9.062 5.967 -6.990
246 H GLN 36 H GLN 36 4.092 4.590 -4.085
247 HA GLN 36 HA GLN 36 3.482 6.140 -6.317
248 HB2 GLN 36 1HB GLN 36 1.874 5.419 -3.874
249 HB3 GLN 36 2HB GLN 36 1.192 6.354 -5.198
250 HG2 GLN 36 1HG GLN 36 1.293 4.579 -6.678
251 HG3 GLN 36 2HG GLN 36 2.513 3.729 -5.731
252 HE21 GLN 36 1HE2 GLN 36 -0.536 3.507 -6.685
253 HE22 GLN 36 2HE2 GLN 36 -1.243 2.681 -5.343
254 H ILE 37 H ILE 37 3.948 7.059 -2.959
255 HA ILE 37 HA ILE 37 3.000 9.731 -3.252
256 HB ILE 37 HB ILE 37 4.793 8.499 -1.159
257 HG12 ILE 37 1HG1 ILE 37 1.911 9.338 -0.883
258 HG13 ILE 37 2HG1 ILE 37 2.363 7.725 -1.426
259 HG21 ILE 37 1HG2 ILE 37 5.107 10.952 -1.397
260 HG22 ILE 37 2HG2 ILE 37 3.390 11.163 -1.057
261 HG23 ILE 37 3HG2 ILE 37 4.452 10.470 0.168
262 HD11 ILE 37 1HD1 ILE 37 3.568 7.364 0.664
263 HD12 ILE 37 2HD1 ILE 37 3.103 8.976 1.207
264 HD13 ILE 37 3HD1 ILE 37 1.869 7.744 0.945
265 H GLU 38 H GLU 38 6.105 8.159 -3.644
266 HA GLU 38 HA GLU 38 7.641 10.563 -3.755
267 HB2 GLU 38 1HB GLU 38 8.727 8.489 -3.167
268 HB3 GLU 38 2HB GLU 38 8.237 7.752 -4.686
269 HG2 GLU 38 1HG GLU 38 9.627 9.451 -5.870
270 HG3 GLU 38 2HG GLU 38 10.221 9.977 -4.296
271 H ASP 39 H ASP 39 5.908 8.619 -6.084
272 HA ASP 39 HA ASP 39 7.036 10.007 -8.359
273 HB2 ASP 39 1HB ASP 39 5.096 7.773 -7.964
274 HB3 ASP 39 2HB ASP 39 5.040 8.665 -9.482
275 H GLN 40 H GLN 40 4.556 10.561 -6.137
276 HA GLN 40 HA GLN 40 3.037 12.236 -8.003
277 HB2 GLN 40 1HB GLN 40 2.430 11.102 -5.286
278 HB3 GLN 40 2HB GLN 40 1.484 12.429 -5.947
279 HG2 GLN 40 1HG GLN 40 1.875 9.791 -7.337
280 HG3 GLN 40 2HG GLN 40 0.504 10.168 -6.295
281 HE21 GLN 40 1HE2 GLN 40 1.771 10.332 -9.412
282 HE22 GLN 40 2HE2 GLN 40 0.553 11.327 -10.126
283 H GLN 41 H GLN 41 4.181 12.466 -4.628
284 HA GLN 41 HA GLN 41 4.100 15.328 -4.672
285 HB2 GLN 41 1HB GLN 41 5.236 13.366 -2.678
286 HB3 GLN 41 2HB GLN 41 5.223 15.107 -2.432
287 HG2 GLN 41 1HG GLN 41 2.735 15.034 -2.686
288 HG3 GLN 41 2HG GLN 41 2.854 13.275 -2.677
289 HE21 GLN 41 1HE2 GLN 41 4.423 15.840 -0.795
290 HE22 GLN 41 2HE2 GLN 41 3.978 15.214 0.752
291 H GLY 42 H GLY 42 6.595 12.871 -5.023
292 HA2 GLY 42 1HA GLY 42 8.509 13.330 -6.417
293 HA3 GLY 42 2HA GLY 42 8.442 15.002 -5.879
294 H LEU 43 H LEU 43 7.939 13.952 -3.069
295 HA LEU 43 HA LEU 43 10.600 14.104 -2.163
296 HB2 LEU 43 1HB LEU 43 8.270 14.482 -0.974
297 HB3 LEU 43 2HB LEU 43 8.513 12.806 -0.487
298 HG LEU 43 HG LEU 43 10.714 14.749 0.006
299 HD11 LEU 43 1HD1 LEU 43 9.684 15.376 2.156
300 HD12 LEU 43 2HD1 LEU 43 8.192 14.586 1.649
301 HD13 LEU 43 3HD1 LEU 43 8.788 15.991 0.766
302 HD21 LEU 43 1HD2 LEU 43 11.028 13.343 1.979
303 HD22 LEU 43 2HD2 LEU 43 11.012 12.379 0.502
304 HD23 LEU 43 3HD2 LEU 43 9.592 12.412 1.549
305 HA PRO 44 HA PRO 44 11.983 9.953 -2.747
306 HB2 PRO 44 1HB PRO 44 14.124 10.033 -1.079
307 HB3 PRO 44 2HB PRO 44 14.109 10.820 -2.662
308 HG2 PRO 44 1HG PRO 44 13.658 12.008 0.049
309 HG3 PRO 44 2HG PRO 44 14.608 12.643 -1.307
310 HD2 PRO 44 1HD PRO 44 12.111 13.524 -0.739
311 HD3 PRO 44 2HD PRO 44 12.746 13.455 -2.396
312 H LYS 45 H LYS 45 11.850 7.972 -1.747
313 HA LYS 45 HA LYS 45 10.202 7.744 0.532
314 HB2 LYS 45 1HB LYS 45 11.969 5.651 -0.749
315 HB3 LYS 45 2HB LYS 45 10.659 5.335 0.382
316 HG2 LYS 45 1HG LYS 45 9.032 5.749 -1.167
317 HG3 LYS 45 2HG LYS 45 10.049 6.845 -2.105
318 HD2 LYS 45 1HD LYS 45 9.954 4.990 -3.479
319 HD3 LYS 45 2HD LYS 45 11.448 4.702 -2.584
320 HE2 LYS 45 1HE LYS 45 10.204 3.258 -1.024
321 HE3 LYS 45 2HE LYS 45 8.741 3.518 -1.972
322 HZ1 LYS 45 1HZ LYS 45 10.194 1.428 -2.378
323 HZ2 LYS 45 2HZ LYS 45 11.151 2.479 -3.295
324 HZ3 LYS 45 3HZ LYS 45 9.524 2.249 -3.697
325 H LYS 46 H LYS 46 13.609 8.052 0.150
326 HA LYS 46 HA LYS 46 14.337 6.902 2.673
327 HB2 LYS 46 1HB LYS 46 16.555 7.864 2.221
328 HB3 LYS 46 2HB LYS 46 15.940 6.967 0.839
329 HG2 LYS 46 1HG LYS 46 15.610 8.869 -0.421
330 HG3 LYS 46 2HG LYS 46 15.519 9.917 0.997
331 HD2 LYS 46 1HD LYS 46 18.020 9.090 1.305
332 HD3 LYS 46 2HD LYS 46 17.895 8.854 -0.440
333 HE2 LYS 46 1HE LYS 46 17.147 11.430 0.925
334 HE3 LYS 46 2HE LYS 46 18.773 11.100 0.329
335 HZ1 LYS 46 1HZ LYS 46 16.307 11.091 -1.327
336 HZ2 LYS 46 2HZ LYS 46 17.880 10.826 -1.888
337 HZ3 LYS 46 3HZ LYS 46 17.445 12.342 -1.276
338 H GLN 47 H GLN 47 12.504 9.462 2.129
339 HA GLN 47 HA GLN 47 13.512 10.883 4.495
340 HB2 GLN 47 1HB GLN 47 12.757 12.016 1.829
341 HB3 GLN 47 2HB GLN 47 12.497 12.974 3.281
342 HG2 GLN 47 1HG GLN 47 14.870 12.781 3.832
343 HG3 GLN 47 2HG GLN 47 15.128 11.828 2.372
344 HE21 GLN 47 1HE2 GLN 47 16.564 14.104 2.805
345 HE22 GLN 47 2HE2 GLN 47 16.077 15.329 1.688
346 H GLN 48 H GLN 48 10.776 10.110 2.413
347 HA GLN 48 HA GLN 48 8.795 11.264 4.095
348 HB2 GLN 48 1HB GLN 48 7.256 10.485 2.575
349 HB3 GLN 48 2HB GLN 48 8.702 10.513 1.575
350 HG2 GLN 48 1HG GLN 48 9.020 8.093 2.121
351 HG3 GLN 48 2HG GLN 48 7.435 8.128 2.893
352 HE21 GLN 48 1HE2 GLN 48 8.896 9.235 -0.151
353 HE22 GLN 48 2HE2 GLN 48 7.637 8.635 -1.170
354 H GLN 49 H GLN 49 7.445 10.321 5.600
355 HA GLN 49 HA GLN 49 7.889 7.525 6.314
356 HB2 GLN 49 1HB GLN 49 9.467 8.755 7.708
357 HB3 GLN 49 2HB GLN 49 8.181 9.819 8.260
358 HG2 GLN 49 1HG GLN 49 7.062 7.883 9.294
359 HG3 GLN 49 2HG GLN 49 8.416 6.869 8.801
360 HE21 GLN 49 1HE2 GLN 49 7.734 6.997 11.418
361 HE22 GLN 49 2HE2 GLN 49 8.933 7.865 12.308
362 H LEU 50 H LEU 50 6.018 6.537 6.678
363 HA LEU 50 HA LEU 50 3.649 8.195 7.208
364 HB2 LEU 50 1HB LEU 50 3.802 5.380 6.141
365 HB3 LEU 50 2HB LEU 50 2.340 6.349 6.318
366 HG LEU 50 HG LEU 50 4.585 7.242 4.538
367 HD11 LEU 50 1HD1 LEU 50 3.569 6.125 2.676
368 HD12 LEU 50 2HD1 LEU 50 2.279 5.493 3.699
369 HD13 LEU 50 3HD1 LEU 50 3.935 4.927 3.918
370 HD21 LEU 50 1HD2 LEU 50 1.615 7.764 4.610
371 HD22 LEU 50 2HD2 LEU 50 2.721 8.376 3.380
372 HD23 LEU 50 3HD2 LEU 50 2.898 8.889 5.058
373 H GLU 51 H GLU 51 2.406 7.875 8.978
374 HA GLU 51 HA GLU 51 3.124 5.646 10.763
375 HB2 GLU 51 1HB GLU 51 2.554 8.514 11.520
376 HB3 GLU 51 2HB GLU 51 2.654 7.195 12.677
377 HG2 GLU 51 1HG GLU 51 4.946 6.874 12.277
378 HG3 GLU 51 2HG GLU 51 4.908 7.855 10.813
379 H PHE 52 H PHE 52 1.429 4.993 12.250
380 HA PHE 52 HA PHE 52 -1.275 5.859 11.583
381 HB2 PHE 52 1HB PHE 52 -0.584 3.882 10.108
382 HB3 PHE 52 2HB PHE 52 -0.610 2.919 11.582
383 HD1 PHE 52 2HD PHE 52 -2.721 5.135 9.479
384 HD2 PHE 52 1HD PHE 52 -2.597 1.989 12.343
385 HE1 PHE 52 2HE PHE 52 -5.143 4.799 9.209
386 HE2 PHE 52 1HE PHE 52 -5.019 1.647 12.077
387 HZ PHE 52 HZ PHE 52 -6.295 3.054 10.510
388 H GLN 53 H GLN 53 -2.020 6.449 13.512
389 HA GLN 53 HA GLN 53 -2.662 6.372 15.692
390 HB2 GLN 53 1HB GLN 53 -2.393 3.498 14.977
391 HB3 GLN 53 2HB GLN 53 -2.511 3.897 16.686
392 HG2 GLN 53 1HG GLN 53 -4.705 3.492 16.050
393 HG3 GLN 53 2HG GLN 53 -4.579 5.250 16.038
394 HE21 GLN 53 1HE2 GLN 53 -3.765 6.082 13.810
395 HE22 GLN 53 2HE2 GLN 53 -4.607 5.439 12.446
396 H GLY 54 H GLY 54 -0.085 7.192 15.235
397 HA2 GLY 54 1HA GLY 54 1.839 7.648 16.406
398 HA3 GLY 54 2HA GLY 54 1.096 6.848 17.784
399 H GLN 55 H GLN 55 1.991 5.580 14.587
400 HA GLN 55 HA GLN 55 4.021 3.895 15.860
401 HB2 GLN 55 1HB GLN 55 1.883 2.832 14.006
402 HB3 GLN 55 2HB GLN 55 3.207 1.905 14.698
403 HG2 GLN 55 1HG GLN 55 2.156 2.768 16.961
404 HG3 GLN 55 2HG GLN 55 0.710 2.886 15.960
405 HE21 GLN 55 1HE2 GLN 55 0.437 0.852 14.515
406 HE22 GLN 55 2HE2 GLN 55 0.586 -0.655 15.346
407 H VAL 56 H VAL 56 5.501 2.897 14.308
408 HA VAL 56 HA VAL 56 5.817 4.592 11.922
409 HB VAL 56 HB VAL 56 7.923 2.991 13.383
410 HG11 VAL 56 1HG1 VAL 56 9.002 5.025 11.726
411 HG12 VAL 56 2HG1 VAL 56 9.202 3.276 11.592
412 HG13 VAL 56 3HG1 VAL 56 7.870 4.079 10.760
413 HG21 VAL 56 1HG2 VAL 56 7.585 4.716 14.844
414 HG22 VAL 56 2HG2 VAL 56 8.734 5.478 13.746
415 HG23 VAL 56 3HG2 VAL 56 7.010 5.814 13.590
416 H LEU 57 H LEU 57 4.990 3.585 10.199
417 HA LEU 57 HA LEU 57 4.800 0.769 9.929
418 HB2 LEU 57 1HB LEU 57 4.705 2.726 7.654
419 HB3 LEU 57 2HB LEU 57 3.887 1.171 7.796
420 HG LEU 57 HG LEU 57 3.215 3.688 9.319
421 HD11 LEU 57 1HD1 LEU 57 2.124 2.374 6.885
422 HD12 LEU 57 2HD1 LEU 57 2.313 4.087 7.260
423 HD13 LEU 57 3HD1 LEU 57 1.002 3.164 7.994
424 HD21 LEU 57 1HD2 LEU 57 2.702 0.954 9.935
425 HD22 LEU 57 2HD2 LEU 57 1.183 1.728 9.485
426 HD23 LEU 57 3HD2 LEU 57 2.164 2.401 10.788
427 H GLN 58 H GLN 58 6.153 -0.685 9.061
428 HA GLN 58 HA GLN 58 8.813 0.191 8.325
429 HB2 GLN 58 1HB GLN 58 7.647 -2.591 8.521
430 HB3 GLN 58 2HB GLN 58 9.347 -2.213 8.274
431 HG2 GLN 58 1HG GLN 58 7.709 -1.507 10.699
432 HG3 GLN 58 2HG GLN 58 8.900 -2.802 10.585
433 HE21 GLN 58 1HE2 GLN 58 9.303 -1.128 12.558
434 HE22 GLN 58 2HE2 GLN 58 10.588 -0.022 12.227
435 H ASP 59 H ASP 59 9.725 -1.480 6.480
436 HA ASP 59 HA ASP 59 8.175 -0.752 4.101
437 HB2 ASP 59 1HB ASP 59 10.277 -1.193 2.862
438 HB3 ASP 59 2HB ASP 59 10.473 0.035 4.110
439 H TRP 60 H TRP 60 9.681 -3.504 5.707
440 HA TRP 60 HA TRP 60 8.923 -5.367 3.651
441 HB2 TRP 60 1HB TRP 60 10.019 -6.996 4.912
442 HB3 TRP 60 2HB TRP 60 10.904 -5.529 5.320
443 HD1 TRP 60 HD TRP 60 8.490 -8.085 6.820
444 HE1 TRP 60 1HE TRP 60 8.476 -7.805 9.378
445 HE3 TRP 60 3HE TRP 60 11.281 -3.818 7.183
446 HZ2 TRP 60 2HZ TRP 60 9.511 -6.011 11.297
447 HZ3 TRP 60 3HZ TRP 60 11.723 -2.884 9.416
448 HH2 TRP 60 HH TRP 60 10.855 -3.959 11.429
449 H LEU 61 H LEU 61 7.411 -3.980 6.387
450 HA LEU 61 HA LEU 61 5.562 -6.116 6.889
451 HB2 LEU 61 1HB LEU 61 5.545 -3.221 7.726
452 HB3 LEU 61 2HB LEU 61 4.395 -4.432 8.289
453 HG LEU 61 HG LEU 61 7.368 -4.596 8.761
454 HD11 LEU 61 1HD1 LEU 61 7.094 -3.634 10.859
455 HD12 LEU 61 2HD1 LEU 61 5.341 -3.820 10.825
456 HD13 LEU 61 3HD1 LEU 61 6.119 -2.607 9.809
457 HD21 LEU 61 1HD2 LEU 61 6.955 -6.441 10.051
458 HD22 LEU 61 2HD2 LEU 61 5.711 -6.638 8.816
459 HD23 LEU 61 3HD2 LEU 61 5.290 -5.968 10.393
460 H GLY 62 H GLY 62 3.429 -6.289 6.267
461 HA2 GLY 62 1HA GLY 62 2.740 -4.866 3.826
462 HA3 GLY 62 2HA GLY 62 1.878 -6.232 4.518
463 H LEU 63 H LEU 63 0.177 -4.539 3.688
464 HA LEU 63 HA LEU 63 -0.360 -2.391 5.537
465 HB2 LEU 63 1HB LEU 63 -1.634 -3.448 3.059
466 HB3 LEU 63 2HB LEU 63 -2.581 -2.418 4.130
467 HG LEU 63 HG LEU 63 -0.633 -0.748 3.898
468 HD11 LEU 63 1HD1 LEU 63 -0.079 -1.744 1.223
469 HD12 LEU 63 2HD1 LEU 63 0.507 -2.818 2.492
470 HD13 LEU 63 3HD1 LEU 63 1.022 -1.132 2.457
471 HD21 LEU 63 1HD2 LEU 63 -1.656 0.254 1.992
472 HD22 LEU 63 2HD2 LEU 63 -2.926 -0.552 2.914
473 HD23 LEU 63 3HD2 LEU 63 -2.292 -1.297 1.445
474 H GLY 64 H GLY 64 -1.367 -5.689 5.069
475 HA2 GLY 64 1HA GLY 64 -3.660 -5.459 6.823
476 HA3 GLY 64 2HA GLY 64 -3.051 -6.934 6.086
477 H ILE 65 H ILE 65 -0.301 -6.188 7.145
478 HA ILE 65 HA ILE 65 -0.297 -7.813 9.406
479 HB ILE 65 HB ILE 65 1.705 -5.667 8.689
480 HG12 ILE 65 1HG1 ILE 65 1.670 -7.107 6.845
481 HG13 ILE 65 2HG1 ILE 65 2.957 -7.773 7.844
482 HG21 ILE 65 1HG2 ILE 65 1.592 -6.844 11.065
483 HG22 ILE 65 2HG2 ILE 65 2.452 -8.111 10.193
484 HG23 ILE 65 3HG2 ILE 65 3.124 -6.483 10.271
485 HD11 ILE 65 1HD1 ILE 65 1.095 -9.295 8.791
486 HD12 ILE 65 2HD1 ILE 65 0.221 -8.841 7.328
487 HD13 ILE 65 3HD1 ILE 65 1.784 -9.648 7.207
488 H TYR 66 H TYR 66 -0.329 -4.272 9.167
489 HA TYR 66 HA TYR 66 -0.387 -3.921 12.020
490 HB2 TYR 66 1HB TYR 66 -0.627 -2.063 9.668
491 HB3 TYR 66 2HB TYR 66 -0.947 -1.497 11.303
492 HD1 TYR 66 2HD TYR 66 0.855 -1.323 12.935
493 HD2 TYR 66 1HD TYR 66 1.619 -2.635 8.960
494 HE1 TYR 66 2HE TYR 66 3.262 -0.956 13.283
495 HE2 TYR 66 1HE TYR 66 4.029 -2.273 9.297
496 HH TYR 66 HH TYR 66 5.440 -1.921 12.243
497 H GLY 67 H GLY 67 -2.730 -3.886 9.387
498 HA2 GLY 67 1HA GLY 67 -4.976 -4.705 9.941
499 HA3 GLY 67 2HA GLY 67 -4.870 -3.764 11.421
500 H ILE 68 H ILE 68 -3.667 -2.426 8.459
501 HA ILE 68 HA ILE 68 -5.391 -0.175 8.646
502 HB ILE 68 HB ILE 68 -3.631 -1.035 6.347
503 HG12 ILE 68 1HG1 ILE 68 -3.017 1.085 8.395
504 HG13 ILE 68 2HG1 ILE 68 -2.586 -0.600 8.663
505 HG21 ILE 68 1HG2 ILE 68 -4.269 0.781 5.227
506 HG22 ILE 68 2HG2 ILE 68 -5.601 0.908 6.375
507 HG23 ILE 68 3HG2 ILE 68 -4.109 1.806 6.653
508 HD11 ILE 68 1HD1 ILE 68 -1.258 1.406 7.094
509 HD12 ILE 68 2HD1 ILE 68 -0.697 -0.192 7.589
510 HD13 ILE 68 3HD1 ILE 68 -1.643 -0.008 6.112
511 H GLN 69 H GLN 69 -7.315 0.212 7.743
512 HA GLN 69 HA GLN 69 -8.368 -1.786 5.854
513 HB2 GLN 69 1HB GLN 69 -10.562 -1.341 6.688
514 HB3 GLN 69 2HB GLN 69 -9.515 -1.591 8.079
515 HG2 GLN 69 1HG GLN 69 -9.346 0.847 8.360
516 HG3 GLN 69 2HG GLN 69 -10.461 1.058 7.011
517 HE21 GLN 69 1HE2 GLN 69 -11.054 2.139 9.428
518 HE22 GLN 69 2HE2 GLN 69 -12.373 1.291 10.153
519 H ASP 70 H ASP 70 -10.227 -0.810 4.485
520 HA ASP 70 HA ASP 70 -9.089 1.210 2.848
521 HB2 ASP 70 1HB ASP 70 -11.275 1.094 1.628
522 HB3 ASP 70 2HB ASP 70 -10.482 -0.466 1.832
523 H SER 71 H SER 71 -9.929 3.298 2.369
524 HA SER 71 HA SER 71 -10.701 5.372 2.896
525 HB2 SER 71 1HB SER 71 -12.889 4.040 2.982
526 HB3 SER 71 2HB SER 71 -12.703 4.064 4.735
527 HG SER 71 HG SER 71 -13.931 5.824 4.175
528 H ASP 72 H ASP 72 -8.531 4.351 4.364
529 HA ASP 72 HA ASP 72 -8.984 5.342 7.089
530 HB2 ASP 72 1HB ASP 72 -7.045 3.448 5.858
531 HB3 ASP 72 2HB ASP 72 -6.495 4.389 7.242
532 H THR 73 H THR 73 -7.043 6.528 8.043
533 HA THR 73 HA THR 73 -6.058 8.485 6.070
534 HB THR 73 HB THR 73 -6.696 8.951 8.990
535 HG1 THR 73 1HG THR 73 -8.000 9.661 6.567
536 HG21 THR 73 1HG2 THR 73 -6.210 11.223 7.176
537 HG22 THR 73 2HG2 THR 73 -4.791 10.255 7.576
538 HG23 THR 73 3HG2 THR 73 -5.744 10.997 8.861
539 H LEU 74 H LEU 74 -3.938 8.432 5.760
540 HA LEU 74 HA LEU 74 -2.225 7.348 7.892
541 HB2 LEU 74 1HB LEU 74 -1.674 7.589 4.938
542 HB3 LEU 74 2HB LEU 74 -0.598 6.872 6.135
543 HG LEU 74 HG LEU 74 -3.298 5.799 5.316
544 HD11 LEU 74 1HD1 LEU 74 -0.639 4.501 4.847
545 HD12 LEU 74 2HD1 LEU 74 -1.315 5.649 3.692
546 HD13 LEU 74 3HD1 LEU 74 -2.191 4.168 4.079
547 HD21 LEU 74 1HD2 LEU 74 -3.252 4.612 7.189
548 HD22 LEU 74 2HD2 LEU 74 -1.726 5.362 7.656
549 HD23 LEU 74 3HD2 LEU 74 -1.725 3.892 6.681
550 H ILE 75 H ILE 75 -0.736 8.604 8.825
551 HA ILE 75 HA ILE 75 -0.577 11.388 8.037
552 HB ILE 75 HB ILE 75 0.713 9.922 10.340
553 HG12 ILE 75 1HG1 ILE 75 -1.751 10.070 10.458
554 HG13 ILE 75 2HG1 ILE 75 -0.972 11.028 11.713
555 HG21 ILE 75 1HG2 ILE 75 2.021 11.697 10.589
556 HG22 ILE 75 2HG2 ILE 75 1.248 12.506 9.228
557 HG23 ILE 75 3HG2 ILE 75 0.580 12.679 10.851
558 HD11 ILE 75 1HD1 ILE 75 -2.578 12.479 11.000
559 HD12 ILE 75 2HD1 ILE 75 -1.240 12.953 9.953
560 HD13 ILE 75 3HD1 ILE 75 -2.516 11.906 9.334
561 H LEU 76 H LEU 76 0.919 12.172 6.721
562 HA LEU 76 HA LEU 76 3.403 10.636 6.340
563 HB2 LEU 76 1HB LEU 76 2.151 10.729 4.313
564 HB3 LEU 76 2HB LEU 76 1.893 12.464 4.485
565 HG LEU 76 HG LEU 76 4.551 12.475 4.336
566 HD11 LEU 76 1HD1 LEU 76 4.810 10.078 4.189
567 HD12 LEU 76 2HD1 LEU 76 5.286 10.823 2.664
568 HD13 LEU 76 3HD1 LEU 76 3.724 10.016 2.801
569 HD21 LEU 76 1HD2 LEU 76 3.808 13.771 2.684
570 HD22 LEU 76 2HD2 LEU 76 2.359 12.791 2.460
571 HD23 LEU 76 3HD2 LEU 76 3.866 12.334 1.664
572 H SER 77 H SER 77 5.278 11.544 6.888
573 HA SER 77 HA SER 77 5.530 14.447 6.989
574 HB2 SER 77 1HB SER 77 4.821 13.330 9.287
575 HB3 SER 77 2HB SER 77 6.542 12.955 9.372
576 HG SER 77 HG SER 77 6.916 14.966 9.825
577 H LYS 78 H LYS 78 7.696 15.190 6.972
578 HA LYS 78 HA LYS 78 9.496 13.411 5.606
579 HB2 LYS 78 1HB LYS 78 9.110 16.023 5.356
580 HB3 LYS 78 2HB LYS 78 10.367 16.093 6.584
581 HG2 LYS 78 1HG LYS 78 10.845 14.390 4.201
582 HG3 LYS 78 2HG LYS 78 10.929 16.143 4.008
583 HD2 LYS 78 1HD LYS 78 12.477 16.104 6.049
584 HD3 LYS 78 2HD LYS 78 12.591 14.365 5.769
585 HE2 LYS 78 1HE LYS 78 14.412 15.189 4.597
586 HE3 LYS 78 2HE LYS 78 13.183 15.037 3.343
587 HZ1 LYS 78 1HZ LYS 78 14.590 17.321 4.093
588 HZ2 LYS 78 2HZ LYS 78 12.975 17.578 4.524
589 HZ3 LYS 78 3HZ LYS 78 13.372 17.189 2.926
590 H LYS 79 H LYS 79 11.522 12.714 6.295
591 HA LYS 79 HA LYS 79 11.749 11.947 8.979
592 HB2 LYS 79 1HB LYS 79 13.702 12.029 6.695
593 HB3 LYS 79 2HB LYS 79 14.203 11.509 8.298
594 HG2 LYS 79 1HG LYS 79 11.795 10.237 7.123
595 HG3 LYS 79 2HG LYS 79 13.373 9.801 6.462
596 HD2 LYS 79 1HD LYS 79 14.148 9.165 8.677
597 HD3 LYS 79 2HD LYS 79 12.607 9.665 9.379
598 HE2 LYS 79 1HE LYS 79 11.462 7.876 8.462
599 HE3 LYS 79 2HE LYS 79 12.654 7.635 7.186
600 HZ1 LYS 79 1HZ LYS 79 14.056 7.205 9.477
601 HZ2 LYS 79 2HZ LYS 79 13.432 6.005 8.461
602 HZ3 LYS 79 3HZ LYS 79 12.552 6.508 9.816
603 H LYS 80 H LYS 80 12.620 12.873 10.735
604 HA LYS 80 HA LYS 80 13.981 15.463 10.375
605 HB2 LYS 80 1HB LYS 80 11.714 15.479 11.510
606 HB3 LYS 80 2HB LYS 80 12.459 14.586 12.829
607 HG2 LYS 80 1HG LYS 80 14.135 16.505 12.952
608 HG3 LYS 80 2HG LYS 80 13.003 17.393 11.930
609 HD2 LYS 80 1HD LYS 80 11.939 16.045 14.358
610 HD3 LYS 80 2HD LYS 80 12.892 17.515 14.575
611 HE2 LYS 80 1HE LYS 80 10.553 17.324 12.688
612 HE3 LYS 80 2HE LYS 80 10.397 17.837 14.367
613 HZ1 LYS 80 1HZ LYS 80 10.956 19.451 12.248
614 HZ2 LYS 80 2HZ LYS 80 12.468 19.240 12.976
615 HZ3 LYS 80 3HZ LYS 80 11.173 19.848 13.879
616 H GLY 81 H GLY 81 16.076 14.660 10.311
617 HA2 GLY 81 1HA GLY 81 17.748 14.626 12.308
618 HA3 GLY 81 2HA GLY 81 16.984 13.072 12.608
619 H SER 82 H SER 82 19.582 12.921 12.294
620 HA SER 82 HA SER 82 20.038 12.168 9.484
621 HB2 SER 82 1HB SER 82 21.581 13.890 10.321
622 HB3 SER 82 2HB SER 82 22.067 12.821 11.637
623 HG SER 82 HG SER 82 23.430 12.885 9.661
624 H GLY 83 H GLY 83 20.355 10.090 8.986
625 HA2 GLY 83 1HA GLY 83 21.092 8.225 11.145
626 HA3 GLY 83 2HA GLY 83 19.702 7.882 10.126
627 HA PRO 84 HA PRO 84 23.932 6.559 8.239
628 HB2 PRO 84 1HB PRO 84 24.204 4.057 9.256
629 HB3 PRO 84 2HB PRO 84 24.906 5.486 10.022
630 HG2 PRO 84 1HG PRO 84 22.380 4.026 10.692
631 HG3 PRO 84 2HG PRO 84 23.620 4.673 11.781
632 HD2 PRO 84 1HD PRO 84 21.283 5.957 11.308
633 HD3 PRO 84 2HD PRO 84 22.796 6.822 11.647
634 H SER 85 H SER 85 20.733 5.623 8.441
635 HA SER 85 HA SER 85 20.301 3.299 7.187
636 HB2 SER 85 1HB SER 85 19.008 5.966 6.611
637 HB3 SER 85 2HB SER 85 18.422 4.458 5.909
638 HG SER 85 HG SER 85 17.400 5.127 7.926
639 H SER 86 H SER 86 21.200 2.313 5.517
640 HA SER 86 HA SER 86 22.045 3.938 3.207
641 HB2 SER 86 1HB SER 86 23.316 1.440 4.346
642 HB3 SER 86 2HB SER 86 23.777 2.170 2.808
643 HG SER 86 HG SER 86 24.074 3.199 5.419
644 H GLY 87 H GLY 87 20.143 3.673 2.044
645 HA2 GLY 87 1HA GLY 87 19.017 2.609 0.310
646 HA3 GLY 87 2HA GLY 87 19.923 1.143 0.658
Start of MODEL 10
1 H1 GLY 1 H GLY 1 -0.935 6.413 -13.413
2 HA2 GLY 1 1HA GLY 1 -1.655 3.858 -13.840
3 HA3 GLY 1 2HA GLY 1 -1.003 3.775 -12.210
4 H SER 2 H SER 2 -3.745 3.336 -13.199
5 HA SER 2 HA SER 2 -5.084 5.229 -11.397
6 HB2 SER 2 1HB SER 2 -6.983 5.410 -12.946
7 HB3 SER 2 2HB SER 2 -5.498 5.988 -13.703
8 HG SER 2 HG SER 2 -6.516 3.361 -14.027
9 H SER 3 H SER 3 -6.338 4.261 -9.941
10 HA SER 3 HA SER 3 -7.483 1.634 -10.535
11 HB2 SER 3 1HB SER 3 -5.616 2.277 -8.266
12 HB3 SER 3 2HB SER 3 -6.807 0.985 -8.116
13 HG SER 3 HG SER 3 -5.228 1.021 -10.413
14 H GLY 4 H GLY 4 -9.570 1.606 -10.032
15 HA2 GLY 4 1HA GLY 4 -10.604 3.691 -8.243
16 HA3 GLY 4 2HA GLY 4 -11.548 2.774 -9.407
17 H SER 5 H SER 5 -11.228 0.235 -8.874
18 HA SER 5 HA SER 5 -12.134 -0.019 -6.090
19 HB2 SER 5 1HB SER 5 -13.763 -0.728 -7.776
20 HB3 SER 5 2HB SER 5 -12.588 -1.851 -8.459
21 HG SER 5 HG SER 5 -13.819 -3.050 -7.099
22 H SER 6 H SER 6 -10.162 -1.697 -8.528
23 HA SER 6 HA SER 6 -9.141 -3.787 -7.161
24 HB2 SER 6 1HB SER 6 -7.948 -1.934 -9.170
25 HB3 SER 6 2HB SER 6 -6.870 -3.070 -8.358
26 HG SER 6 HG SER 6 -8.152 -3.664 -10.417
27 H GLY 7 H GLY 7 -8.598 -3.822 -5.070
28 HA2 GLY 7 1HA GLY 7 -7.005 -3.554 -3.360
29 HA3 GLY 7 2HA GLY 7 -6.359 -2.159 -4.211
30 H ILE 8 H ILE 8 -6.548 -1.723 -1.666
31 HA ILE 8 HA ILE 8 -9.164 -0.593 -1.025
32 HB ILE 8 HB ILE 8 -8.315 -0.268 1.222
33 HG12 ILE 8 1HG1 ILE 8 -5.720 -1.586 0.534
34 HG13 ILE 8 2HG1 ILE 8 -5.903 0.137 0.225
35 HG21 ILE 8 1HG2 ILE 8 -9.108 -2.370 1.305
36 HG22 ILE 8 2HG2 ILE 8 -8.204 -2.876 -0.121
37 HG23 ILE 8 3HG2 ILE 8 -7.407 -2.811 1.450
38 HD11 ILE 8 1HD1 ILE 8 -6.278 -1.216 2.885
39 HD12 ILE 8 2HD1 ILE 8 -4.867 -0.285 2.383
40 HD13 ILE 8 3HD1 ILE 8 -6.429 0.512 2.568
41 H GLN 9 H GLN 9 -9.468 1.579 -0.450
42 HA GLN 9 HA GLN 9 -7.498 3.398 -1.640
43 HB2 GLN 9 1HB GLN 9 -9.660 3.654 -2.616
44 HB3 GLN 9 2HB GLN 9 -10.437 3.703 -1.039
45 HG2 GLN 9 1HG GLN 9 -9.580 5.857 -0.578
46 HG3 GLN 9 2HG GLN 9 -8.480 5.787 -1.954
47 HE21 GLN 9 1HE2 GLN 9 -9.373 5.889 -4.075
48 HE22 GLN 9 2HE2 GLN 9 -10.893 6.664 -4.347
49 H VAL 10 H VAL 10 -6.233 4.557 -0.360
50 HA VAL 10 HA VAL 10 -7.138 5.103 2.394
51 HB VAL 10 HB VAL 10 -4.804 5.078 3.108
52 HG11 VAL 10 1HG1 VAL 10 -5.560 2.992 3.544
53 HG12 VAL 10 2HG1 VAL 10 -6.096 2.721 1.884
54 HG13 VAL 10 3HG1 VAL 10 -4.390 2.551 2.301
55 HG21 VAL 10 1HG2 VAL 10 -3.822 3.849 0.615
56 HG22 VAL 10 2HG2 VAL 10 -4.154 5.579 0.540
57 HG23 VAL 10 3HG2 VAL 10 -3.017 4.950 1.733
58 H PHE 11 H PHE 11 -6.608 7.116 3.302
59 HA PHE 11 HA PHE 11 -6.097 9.205 1.304
60 HB2 PHE 11 1HB PHE 11 -7.340 9.385 4.056
61 HB3 PHE 11 2HB PHE 11 -7.097 10.748 2.969
62 HD1 PHE 11 1HD PHE 11 -8.379 10.897 0.868
63 HD2 PHE 11 2HD PHE 11 -9.144 7.872 3.763
64 HE1 PHE 11 1HE PHE 11 -10.563 10.455 -0.176
65 HE2 PHE 11 2HE PHE 11 -11.328 7.424 2.723
66 HZ PHE 11 HZ PHE 11 -12.040 8.716 0.751
67 H VAL 12 H VAL 12 -3.995 9.684 1.192
68 HA VAL 12 HA VAL 12 -2.354 9.658 3.605
69 HB VAL 12 HB VAL 12 -1.528 10.158 0.742
70 HG11 VAL 12 1HG1 VAL 12 -0.150 10.448 3.241
71 HG12 VAL 12 2HG1 VAL 12 0.604 9.175 2.279
72 HG13 VAL 12 3HG1 VAL 12 0.416 10.795 1.607
73 HG21 VAL 12 1HG2 VAL 12 -1.869 7.679 2.342
74 HG22 VAL 12 2HG2 VAL 12 -2.133 7.960 0.621
75 HG23 VAL 12 3HG2 VAL 12 -0.493 7.773 1.243
76 H LYS 13 H LYS 13 -2.248 11.446 4.781
77 HA LYS 13 HA LYS 13 -2.753 14.042 3.559
78 HB2 LYS 13 1HB LYS 13 -3.928 13.853 5.564
79 HB3 LYS 13 2HB LYS 13 -2.605 13.027 6.376
80 HG2 LYS 13 1HG LYS 13 -1.323 15.167 6.299
81 HG3 LYS 13 2HG LYS 13 -2.782 15.949 5.685
82 HD2 LYS 13 1HD LYS 13 -2.937 14.335 8.191
83 HD3 LYS 13 2HD LYS 13 -2.237 15.954 8.252
84 HE2 LYS 13 1HE LYS 13 -4.337 16.743 7.063
85 HE3 LYS 13 2HE LYS 13 -5.013 15.153 7.413
86 HZ1 LYS 13 1HZ LYS 13 -4.167 17.234 9.343
87 HZ2 LYS 13 2HZ LYS 13 -4.457 15.633 9.805
88 HZ3 LYS 13 3HZ LYS 13 -5.707 16.562 9.144
89 H ASN 14 H ASN 14 -1.133 15.212 2.792
90 HA ASN 14 HA ASN 14 1.597 14.591 3.323
91 HB2 ASN 14 1HB ASN 14 1.854 16.921 2.091
92 HB3 ASN 14 2HB ASN 14 1.373 15.474 1.209
93 HD21 ASN 14 1HD2 ASN 14 -0.751 15.252 0.521
94 HD22 ASN 14 2HD2 ASN 14 -1.843 16.590 0.463
95 HA PRO 15 HA PRO 15 2.546 17.145 6.762
96 HB2 PRO 15 1HB PRO 15 5.016 18.073 6.122
97 HB3 PRO 15 2HB PRO 15 4.711 16.397 6.593
98 HG2 PRO 15 1HG PRO 15 5.041 17.565 3.857
99 HG3 PRO 15 2HG PRO 15 5.706 16.061 4.518
100 HD2 PRO 15 1HD PRO 15 3.522 16.109 2.918
101 HD3 PRO 15 2HD PRO 15 3.736 14.905 4.206
102 H ASP 16 H ASP 16 2.576 18.537 3.580
103 HA ASP 16 HA ASP 16 2.857 21.258 4.491
104 HB2 ASP 16 1HB ASP 16 3.502 20.227 2.175
105 HB3 ASP 16 2HB ASP 16 1.810 20.517 1.780
106 H GLY 17 H GLY 17 0.231 19.140 3.448
107 HA2 GLY 17 1HA GLY 17 -1.827 19.813 4.900
108 HA3 GLY 17 2HA GLY 17 -1.705 21.288 3.952
109 H GLY 18 H GLY 18 -3.518 18.687 4.191
110 HA2 GLY 18 1HA GLY 18 -5.201 18.512 2.366
111 HA3 GLY 18 2HA GLY 18 -3.835 18.394 1.266
112 H SER 19 H SER 19 -5.545 16.452 0.958
113 HA SER 19 HA SER 19 -4.115 14.123 1.917
114 HB2 SER 19 1HB SER 19 -6.275 13.024 2.664
115 HB3 SER 19 2HB SER 19 -5.674 14.303 3.720
116 HG SER 19 HG SER 19 -7.406 15.093 1.705
117 H TYR 20 H TYR 20 -3.825 12.873 0.206
118 HA TYR 20 HA TYR 20 -5.742 13.034 -2.012
119 HB2 TYR 20 1HB TYR 20 -2.967 11.843 -2.061
120 HB3 TYR 20 2HB TYR 20 -3.984 12.235 -3.442
121 HD1 TYR 20 2HD TYR 20 -4.926 14.932 -2.770
122 HD2 TYR 20 1HD TYR 20 -1.079 13.184 -2.276
123 HE1 TYR 20 2HE TYR 20 -3.902 17.164 -2.894
124 HE2 TYR 20 1HE TYR 20 -0.044 15.412 -2.398
125 HH TYR 20 HH TYR 20 -1.953 18.326 -2.387
126 H ALA 21 H ALA 21 -6.241 11.044 -3.184
127 HA ALA 21 HA ALA 21 -6.509 8.781 -1.328
128 HB1 ALA 21 1HB ALA 21 -8.351 10.063 -3.039
129 HB2 ALA 21 2HB ALA 21 -8.086 8.441 -3.681
130 HB3 ALA 21 3HB ALA 21 -8.614 8.653 -2.012
131 H TYR 22 H TYR 22 -4.989 7.284 -1.594
132 HA TYR 22 HA TYR 22 -3.936 6.773 -4.284
133 HB2 TYR 22 1HB TYR 22 -2.875 6.212 -1.523
134 HB3 TYR 22 2HB TYR 22 -2.200 5.423 -2.945
135 HD1 TYR 22 2HD TYR 22 -2.733 8.693 -1.309
136 HD2 TYR 22 1HD TYR 22 -0.729 6.580 -4.410
137 HE1 TYR 22 2HE TYR 22 -1.292 10.648 -1.701
138 HE2 TYR 22 1HE TYR 22 0.718 8.528 -4.811
139 HH TYR 22 HH TYR 22 1.275 10.574 -4.156
140 H ALA 23 H ALA 23 -3.522 4.527 -4.903
141 HA ALA 23 HA ALA 23 -5.526 2.686 -3.766
142 HB1 ALA 23 1HB ALA 23 -4.693 3.070 -6.633
143 HB2 ALA 23 2HB ALA 23 -5.625 1.682 -6.070
144 HB3 ALA 23 3HB ALA 23 -6.291 3.308 -5.925
145 H ILE 24 H ILE 24 -4.565 1.100 -2.689
146 HA ILE 24 HA ILE 24 -2.315 -0.297 -3.918
147 HB ILE 24 HB ILE 24 -1.238 1.311 -2.439
148 HG12 ILE 24 1HG1 ILE 24 -1.073 -1.287 -0.953
149 HG13 ILE 24 2HG1 ILE 24 -0.565 -1.217 -2.637
150 HG21 ILE 24 1HG2 ILE 24 -3.374 1.296 -0.907
151 HG22 ILE 24 2HG2 ILE 24 -2.463 0.069 -0.027
152 HG23 ILE 24 3HG2 ILE 24 -1.786 1.682 -0.245
153 HD11 ILE 24 1HD1 ILE 24 0.864 0.797 -1.842
154 HD12 ILE 24 2HD1 ILE 24 0.630 0.091 -0.243
155 HD13 ILE 24 3HD1 ILE 24 1.404 -0.850 -1.518
156 H ASN 25 H ASN 25 -2.799 -2.382 -3.948
157 HA ASN 25 HA ASN 25 -4.980 -3.564 -2.725
158 HB2 ASN 25 1HB ASN 25 -2.402 -4.755 -3.745
159 HB3 ASN 25 2HB ASN 25 -3.730 -5.747 -3.150
160 HD21 ASN 25 1HD2 ASN 25 -3.904 -6.684 -5.217
161 HD22 ASN 25 2HD2 ASN 25 -4.676 -5.847 -6.516
162 HA PRO 26 HA PRO 26 -3.859 -4.121 1.493
163 HB2 PRO 26 1HB PRO 26 -5.462 -6.226 2.101
164 HB3 PRO 26 2HB PRO 26 -6.077 -4.586 1.867
165 HG2 PRO 26 1HG PRO 26 -6.053 -6.889 -0.044
166 HG3 PRO 26 2HG PRO 26 -7.347 -5.724 0.287
167 HD2 PRO 26 1HD PRO 26 -5.727 -5.526 -1.873
168 HD3 PRO 26 2HD PRO 26 -6.404 -4.104 -1.055
169 H ASN 27 H ASN 27 -3.316 -6.496 -0.912
170 HA ASN 27 HA ASN 27 -1.834 -8.220 0.939
171 HB2 ASN 27 1HB ASN 27 -3.405 -9.359 -0.547
172 HB3 ASN 27 2HB ASN 27 -2.615 -8.652 -1.953
173 HD21 ASN 27 1HD2 ASN 27 -1.713 -10.472 0.960
174 HD22 ASN 27 2HD2 ASN 27 -0.650 -11.567 0.151
175 H SER 28 H SER 28 -1.018 -5.511 -0.161
176 HA SER 28 HA SER 28 1.482 -6.325 -1.485
177 HB2 SER 28 1HB SER 28 0.090 -3.636 -1.466
178 HB3 SER 28 2HB SER 28 1.629 -3.971 -2.258
179 HG SER 28 HG SER 28 0.452 -5.600 -3.479
180 H PHE 29 H PHE 29 3.217 -4.448 -1.033
181 HA PHE 29 HA PHE 29 3.578 -4.488 1.868
182 HB2 PHE 29 1HB PHE 29 5.566 -3.772 -0.297
183 HB3 PHE 29 2HB PHE 29 5.923 -4.009 1.411
184 HD1 PHE 29 1HD PHE 29 4.824 -5.715 -1.674
185 HD2 PHE 29 2HD PHE 29 6.308 -6.158 2.291
186 HE1 PHE 29 1HE PHE 29 5.230 -8.104 -2.097
187 HE2 PHE 29 2HE PHE 29 6.718 -8.548 1.874
188 HZ PHE 29 HZ PHE 29 6.180 -9.524 -0.322
189 H ILE 30 H ILE 30 4.132 -2.633 3.053
190 HA ILE 30 HA ILE 30 2.712 -0.315 2.472
191 HB ILE 30 HB ILE 30 5.024 -0.795 4.339
192 HG12 ILE 30 1HG1 ILE 30 2.773 -1.839 4.777
193 HG13 ILE 30 2HG1 ILE 30 3.353 -0.778 6.056
194 HG21 ILE 30 1HG2 ILE 30 3.852 1.737 3.485
195 HG22 ILE 30 2HG2 ILE 30 3.837 1.505 5.232
196 HG23 ILE 30 3HG2 ILE 30 5.358 1.417 4.344
197 HD11 ILE 30 1HD1 ILE 30 1.929 0.981 4.624
198 HD12 ILE 30 2HD1 ILE 30 1.038 -0.498 4.262
199 HD13 ILE 30 3HD1 ILE 30 1.254 0.014 5.935
200 H LEU 31 H LEU 31 6.253 -0.755 2.345
201 HA LEU 31 HA LEU 31 7.083 1.639 1.411
202 HB2 LEU 31 1HB LEU 31 8.324 -0.654 1.749
203 HB3 LEU 31 2HB LEU 31 8.119 -0.776 0.003
204 HG LEU 31 HG LEU 31 9.294 1.461 -0.158
205 HD11 LEU 31 1HD1 LEU 31 10.349 2.411 1.638
206 HD12 LEU 31 2HD1 LEU 31 10.424 0.897 2.538
207 HD13 LEU 31 3HD1 LEU 31 8.900 1.775 2.416
208 HD21 LEU 31 1HD2 LEU 31 11.353 -0.192 1.015
209 HD22 LEU 31 2HD2 LEU 31 11.101 0.268 -0.668
210 HD23 LEU 31 3HD2 LEU 31 10.267 -1.137 -0.004
211 H GLY 32 H GLY 32 5.628 -0.930 -0.554
212 HA2 GLY 32 1HA GLY 32 5.927 0.052 -3.089
213 HA3 GLY 32 2HA GLY 32 4.483 -0.792 -2.549
214 H LEU 33 H LEU 33 3.533 1.098 -0.699
215 HA LEU 33 HA LEU 33 2.107 2.827 -2.410
216 HB2 LEU 33 1HB LEU 33 1.007 2.241 -0.446
217 HB3 LEU 33 2HB LEU 33 2.409 2.601 0.559
218 HG LEU 33 HG LEU 33 2.035 4.986 0.262
219 HD11 LEU 33 1HD1 LEU 33 -0.549 5.105 -0.817
220 HD12 LEU 33 2HD1 LEU 33 0.393 4.091 -1.910
221 HD13 LEU 33 3HD1 LEU 33 0.945 5.721 -1.522
222 HD21 LEU 33 1HD2 LEU 33 -0.659 3.939 0.981
223 HD22 LEU 33 2HD2 LEU 33 0.330 5.159 1.785
224 HD23 LEU 33 3HD2 LEU 33 0.733 3.448 1.947
225 H LYS 34 H LYS 34 4.606 3.547 0.029
226 HA LYS 34 HA LYS 34 4.850 6.247 -0.265
227 HB2 LYS 34 1HB LYS 34 6.873 4.105 0.283
228 HB3 LYS 34 2HB LYS 34 7.395 5.776 0.117
229 HG2 LYS 34 1HG LYS 34 7.082 5.680 2.368
230 HG3 LYS 34 2HG LYS 34 5.473 6.200 1.864
231 HD2 LYS 34 1HD LYS 34 4.576 4.043 2.134
232 HD3 LYS 34 2HD LYS 34 6.174 3.296 2.192
233 HE2 LYS 34 1HE LYS 34 5.202 5.248 4.266
234 HE3 LYS 34 2HE LYS 34 4.950 3.508 4.399
235 HZ1 LYS 34 1HZ LYS 34 7.632 3.881 3.812
236 HZ2 LYS 34 2HZ LYS 34 6.962 3.369 5.278
237 HZ3 LYS 34 3HZ LYS 34 7.258 5.013 5.013
238 H GLN 35 H GLN 35 6.270 3.756 -2.339
239 HA GLN 35 HA GLN 35 7.855 5.337 -3.965
240 HB2 GLN 35 1HB GLN 35 7.657 2.812 -3.970
241 HB3 GLN 35 2HB GLN 35 6.216 3.008 -4.958
242 HG2 GLN 35 1HG GLN 35 8.983 3.945 -5.684
243 HG3 GLN 35 2HG GLN 35 8.183 2.501 -6.305
244 HE21 GLN 35 1HE2 GLN 35 9.146 5.210 -7.417
245 HE22 GLN 35 2HE2 GLN 35 7.824 5.716 -8.408
246 H GLN 36 H GLN 36 4.383 4.783 -4.087
247 HA GLN 36 HA GLN 36 3.909 6.011 -6.583
248 HB2 GLN 36 1HB GLN 36 2.132 5.559 -4.188
249 HB3 GLN 36 2HB GLN 36 1.550 6.261 -5.692
250 HG2 GLN 36 1HG GLN 36 2.427 4.176 -6.835
251 HG3 GLN 36 2HG GLN 36 2.604 3.494 -5.219
252 HE21 GLN 36 1HE2 GLN 36 0.923 2.467 -4.398
253 HE22 GLN 36 2HE2 GLN 36 -0.706 2.579 -4.961
254 H ILE 37 H ILE 37 4.041 7.264 -3.291
255 HA ILE 37 HA ILE 37 3.140 9.884 -3.959
256 HB ILE 37 HB ILE 37 4.551 8.749 -1.559
257 HG12 ILE 37 1HG1 ILE 37 1.851 10.082 -1.761
258 HG13 ILE 37 2HG1 ILE 37 2.077 8.358 -2.036
259 HG21 ILE 37 1HG2 ILE 37 3.914 11.104 -0.593
260 HG22 ILE 37 2HG2 ILE 37 5.440 10.860 -1.440
261 HG23 ILE 37 3HG2 ILE 37 4.076 11.601 -2.277
262 HD11 ILE 37 1HD1 ILE 37 2.942 9.709 0.498
263 HD12 ILE 37 2HD1 ILE 37 1.321 9.054 0.268
264 HD13 ILE 37 3HD1 ILE 37 2.722 7.986 0.192
265 H GLU 38 H GLU 38 6.190 8.261 -4.103
266 HA GLU 38 HA GLU 38 7.829 10.602 -4.106
267 HB2 GLU 38 1HB GLU 38 8.909 8.599 -3.475
268 HB3 GLU 38 2HB GLU 38 8.297 7.731 -4.876
269 HG2 GLU 38 1HG GLU 38 10.673 8.214 -5.084
270 HG3 GLU 38 2HG GLU 38 9.736 9.022 -6.338
271 H ASP 39 H ASP 39 6.176 8.716 -6.545
272 HA ASP 39 HA ASP 39 7.442 10.181 -8.717
273 HB2 ASP 39 1HB ASP 39 5.667 7.798 -8.506
274 HB3 ASP 39 2HB ASP 39 5.611 8.728 -10.001
275 H GLN 40 H GLN 40 4.564 10.266 -6.823
276 HA GLN 40 HA GLN 40 3.074 11.859 -8.724
277 HB2 GLN 40 1HB GLN 40 2.536 10.885 -5.930
278 HB3 GLN 40 2HB GLN 40 1.487 12.066 -6.703
279 HG2 GLN 40 1HG GLN 40 2.112 9.569 -8.180
280 HG3 GLN 40 2HG GLN 40 0.998 9.481 -6.817
281 HE21 GLN 40 1HE2 GLN 40 -0.473 8.811 -8.572
282 HE22 GLN 40 2HE2 GLN 40 -1.323 10.042 -9.436
283 H GLN 41 H GLN 41 4.241 12.404 -5.395
284 HA GLN 41 HA GLN 41 3.969 15.264 -5.711
285 HB2 GLN 41 1HB GLN 41 5.130 13.674 -3.416
286 HB3 GLN 41 2HB GLN 41 4.723 15.385 -3.388
287 HG2 GLN 41 1HG GLN 41 2.407 14.931 -3.536
288 HG3 GLN 41 2HG GLN 41 2.695 13.235 -3.918
289 HE21 GLN 41 1HE2 GLN 41 1.225 12.840 -2.141
290 HE22 GLN 41 2HE2 GLN 41 1.832 12.836 -0.524
291 H GLY 42 H GLY 42 6.647 12.983 -5.143
292 HA2 GLY 42 1HA GLY 42 8.636 13.366 -6.591
293 HA3 GLY 42 2HA GLY 42 8.478 15.065 -6.170
294 H LEU 43 H LEU 43 7.659 13.635 -3.412
295 HA LEU 43 HA LEU 43 10.263 14.064 -2.245
296 HB2 LEU 43 1HB LEU 43 7.883 14.603 -1.292
297 HB3 LEU 43 2HB LEU 43 7.952 12.933 -0.732
298 HG LEU 43 HG LEU 43 10.202 14.774 -0.064
299 HD11 LEU 43 1HD1 LEU 43 8.888 15.291 2.062
300 HD12 LEU 43 2HD1 LEU 43 7.456 14.826 1.144
301 HD13 LEU 43 3HD1 LEU 43 8.452 16.176 0.600
302 HD21 LEU 43 1HD2 LEU 43 10.495 12.496 0.549
303 HD22 LEU 43 2HD2 LEU 43 8.875 12.406 1.239
304 HD23 LEU 43 3HD2 LEU 43 10.115 13.383 2.025
305 HA PRO 44 HA PRO 44 11.587 9.856 -2.447
306 HB2 PRO 44 1HB PRO 44 13.596 10.015 -0.627
307 HB3 PRO 44 2HB PRO 44 13.721 10.687 -2.257
308 HG2 PRO 44 1HG PRO 44 13.092 12.073 0.321
309 HG3 PRO 44 2HG PRO 44 14.158 12.593 -0.998
310 HD2 PRO 44 1HD PRO 44 11.646 13.557 -0.689
311 HD3 PRO 44 2HD PRO 44 12.404 13.359 -2.282
312 H LYS 45 H LYS 45 11.578 7.942 -1.211
313 HA LYS 45 HA LYS 45 9.642 7.856 0.860
314 HB2 LYS 45 1HB LYS 45 11.618 5.673 0.212
315 HB3 LYS 45 2HB LYS 45 10.011 5.504 0.904
316 HG2 LYS 45 1HG LYS 45 9.112 6.420 -1.268
317 HG3 LYS 45 2HG LYS 45 10.742 6.227 -1.918
318 HD2 LYS 45 1HD LYS 45 9.391 3.930 -0.560
319 HD3 LYS 45 2HD LYS 45 8.990 4.326 -2.233
320 HE2 LYS 45 1HE LYS 45 10.699 2.756 -2.434
321 HE3 LYS 45 2HE LYS 45 11.529 4.298 -2.629
322 HZ1 LYS 45 1HZ LYS 45 12.468 2.486 -1.038
323 HZ2 LYS 45 2HZ LYS 45 11.338 3.116 0.051
324 HZ3 LYS 45 3HZ LYS 45 12.537 4.118 -0.598
325 H LYS 46 H LYS 46 13.173 7.564 0.834
326 HA LYS 46 HA LYS 46 13.626 6.904 3.477
327 HB2 LYS 46 1HB LYS 46 15.838 7.774 3.206
328 HB3 LYS 46 2HB LYS 46 15.350 7.083 1.664
329 HG2 LYS 46 1HG LYS 46 16.256 9.034 0.937
330 HG3 LYS 46 2HG LYS 46 14.592 9.566 1.188
331 HD2 LYS 46 1HD LYS 46 15.120 10.649 3.196
332 HD3 LYS 46 2HD LYS 46 16.647 9.780 3.366
333 HE2 LYS 46 1HE LYS 46 16.185 11.601 1.035
334 HE3 LYS 46 2HE LYS 46 16.667 12.258 2.598
335 HZ1 LYS 46 1HZ LYS 46 18.185 10.051 1.364
336 HZ2 LYS 46 2HZ LYS 46 18.696 11.177 2.518
337 HZ3 LYS 46 3HZ LYS 46 18.479 11.655 0.910
338 H GLN 47 H GLN 47 12.261 9.755 2.231
339 HA GLN 47 HA GLN 47 12.874 11.279 4.660
340 HB2 GLN 47 1HB GLN 47 11.854 12.042 1.941
341 HB3 GLN 47 2HB GLN 47 11.649 13.125 3.312
342 HG2 GLN 47 1HG GLN 47 14.177 12.860 3.644
343 HG3 GLN 47 2HG GLN 47 14.181 12.208 2.006
344 HE21 GLN 47 1HE2 GLN 47 15.666 14.291 2.182
345 HE22 GLN 47 2HE2 GLN 47 14.913 15.728 1.589
346 H GLN 48 H GLN 48 10.082 10.416 2.623
347 HA GLN 48 HA GLN 48 8.146 11.322 4.487
348 HB2 GLN 48 1HB GLN 48 6.579 10.649 2.960
349 HB3 GLN 48 2HB GLN 48 7.985 10.746 1.908
350 HG2 GLN 48 1HG GLN 48 8.331 8.298 2.298
351 HG3 GLN 48 2HG GLN 48 6.775 8.280 3.126
352 HE21 GLN 48 1HE2 GLN 48 8.286 9.211 0.065
353 HE22 GLN 48 2HE2 GLN 48 6.931 8.808 -0.928
354 H GLN 49 H GLN 49 6.977 10.243 6.024
355 HA GLN 49 HA GLN 49 7.540 7.404 6.464
356 HB2 GLN 49 1HB GLN 49 8.979 9.106 7.881
357 HB3 GLN 49 2HB GLN 49 7.510 9.210 8.843
358 HG2 GLN 49 1HG GLN 49 7.601 6.940 9.427
359 HG3 GLN 49 2HG GLN 49 8.787 6.581 8.173
360 HE21 GLN 49 1HE2 GLN 49 10.349 5.750 9.471
361 HE22 GLN 49 2HE2 GLN 49 11.202 6.668 10.659
362 H LEU 50 H LEU 50 5.608 6.475 6.369
363 HA LEU 50 HA LEU 50 3.225 7.913 7.193
364 HB2 LEU 50 1HB LEU 50 3.631 5.189 5.972
365 HB3 LEU 50 2HB LEU 50 2.054 5.859 6.385
366 HG LEU 50 HG LEU 50 3.967 7.030 4.365
367 HD11 LEU 50 1HD1 LEU 50 2.055 6.298 2.806
368 HD12 LEU 50 2HD1 LEU 50 1.608 5.202 4.113
369 HD13 LEU 50 3HD1 LEU 50 3.200 5.078 3.365
370 HD21 LEU 50 1HD2 LEU 50 1.805 8.265 3.735
371 HD22 LEU 50 2HD2 LEU 50 2.691 8.813 5.159
372 HD23 LEU 50 3HD2 LEU 50 1.245 7.819 5.347
373 H GLU 51 H GLU 51 2.124 7.604 9.034
374 HA GLU 51 HA GLU 51 2.942 5.363 10.765
375 HB2 GLU 51 1HB GLU 51 2.210 8.181 11.578
376 HB3 GLU 51 2HB GLU 51 2.468 6.855 12.702
377 HG2 GLU 51 1HG GLU 51 4.469 8.065 12.696
378 HG3 GLU 51 2HG GLU 51 4.784 6.640 11.707
379 H PHE 52 H PHE 52 1.301 4.652 12.307
380 HA PHE 52 HA PHE 52 -1.450 5.384 11.699
381 HB2 PHE 52 1HB PHE 52 -0.936 3.564 10.115
382 HB3 PHE 52 2HB PHE 52 -0.463 2.533 11.461
383 HD1 PHE 52 2HD PHE 52 -3.332 4.395 10.029
384 HD2 PHE 52 1HD PHE 52 -2.046 1.249 12.591
385 HE1 PHE 52 2HE PHE 52 -5.660 3.632 10.255
386 HE2 PHE 52 1HE PHE 52 -4.372 0.480 12.820
387 HZ PHE 52 HZ PHE 52 -6.182 1.673 11.652
388 H GLN 53 H GLN 53 -2.229 5.859 13.641
389 HA GLN 53 HA GLN 53 -2.821 5.699 15.831
390 HB2 GLN 53 1HB GLN 53 -2.037 2.799 15.492
391 HB3 GLN 53 2HB GLN 53 -2.951 3.458 16.842
392 HG2 GLN 53 1HG GLN 53 -3.862 3.546 13.977
393 HG3 GLN 53 2HG GLN 53 -4.333 2.305 15.137
394 HE21 GLN 53 1HE2 GLN 53 -5.736 4.570 13.638
395 HE22 GLN 53 2HE2 GLN 53 -6.673 5.346 14.864
396 H GLY 54 H GLY 54 -0.221 6.591 15.220
397 HA2 GLY 54 1HA GLY 54 1.667 7.197 16.389
398 HA3 GLY 54 2HA GLY 54 0.997 6.364 17.784
399 H GLN 55 H GLN 55 1.901 5.136 14.574
400 HA GLN 55 HA GLN 55 4.053 3.580 15.805
401 HB2 GLN 55 1HB GLN 55 1.959 2.353 14.005
402 HB3 GLN 55 2HB GLN 55 3.326 1.524 14.737
403 HG2 GLN 55 1HG GLN 55 2.254 2.336 16.971
404 HG3 GLN 55 2HG GLN 55 0.798 2.479 15.988
405 HE21 GLN 55 1HE2 GLN 55 0.599 0.439 14.463
406 HE22 GLN 55 2HE2 GLN 55 0.699 -1.069 15.301
407 H VAL 56 H VAL 56 5.491 2.577 14.174
408 HA VAL 56 HA VAL 56 5.748 4.356 11.851
409 HB VAL 56 HB VAL 56 7.802 2.573 13.167
410 HG11 VAL 56 1HG1 VAL 56 7.729 3.510 10.530
411 HG12 VAL 56 2HG1 VAL 56 8.870 4.555 11.379
412 HG13 VAL 56 3HG1 VAL 56 9.104 2.807 11.381
413 HG21 VAL 56 1HG2 VAL 56 8.786 5.057 13.389
414 HG22 VAL 56 2HG2 VAL 56 7.061 5.422 13.445
415 HG23 VAL 56 3HG2 VAL 56 7.766 4.311 14.620
416 H LEU 57 H LEU 57 4.555 3.439 10.252
417 HA LEU 57 HA LEU 57 4.203 0.719 9.766
418 HB2 LEU 57 1HB LEU 57 4.259 2.850 7.643
419 HB3 LEU 57 2HB LEU 57 3.364 1.332 7.623
420 HG LEU 57 HG LEU 57 2.804 3.655 9.467
421 HD11 LEU 57 1HD1 LEU 57 1.355 4.482 7.975
422 HD12 LEU 57 2HD1 LEU 57 0.810 2.883 7.470
423 HD13 LEU 57 3HD1 LEU 57 2.288 3.564 6.793
424 HD21 LEU 57 1HD2 LEU 57 1.599 2.211 10.641
425 HD22 LEU 57 2HD2 LEU 57 2.030 0.904 9.536
426 HD23 LEU 57 3HD2 LEU 57 0.613 1.904 9.211
427 H GLN 58 H GLN 58 5.955 -0.583 9.695
428 HA GLN 58 HA GLN 58 8.464 -0.013 8.675
429 HB2 GLN 58 1HB GLN 58 6.949 -2.549 9.132
430 HB3 GLN 58 2HB GLN 58 8.484 -2.616 8.275
431 HG2 GLN 58 1HG GLN 58 7.942 -1.786 11.097
432 HG3 GLN 58 2HG GLN 58 9.042 -3.024 10.494
433 HE21 GLN 58 1HE2 GLN 58 9.059 -0.223 12.001
434 HE22 GLN 58 2HE2 GLN 58 10.504 0.490 11.378
435 H ASP 59 H ASP 59 9.294 -1.668 6.786
436 HA ASP 59 HA ASP 59 7.793 -0.810 4.408
437 HB2 ASP 59 1HB ASP 59 9.929 -1.154 3.186
438 HB3 ASP 59 2HB ASP 59 10.059 0.047 4.468
439 H TRP 60 H TRP 60 9.230 -3.578 6.010
440 HA TRP 60 HA TRP 60 8.465 -5.364 3.843
441 HB2 TRP 60 1HB TRP 60 9.767 -7.001 4.878
442 HB3 TRP 60 2HB TRP 60 10.629 -5.515 5.267
443 HD1 TRP 60 HD TRP 60 8.530 -8.271 6.878
444 HE1 TRP 60 1HE TRP 60 8.792 -8.121 9.434
445 HE3 TRP 60 3HE TRP 60 11.123 -3.875 7.172
446 HZ2 TRP 60 2HZ TRP 60 9.945 -6.371 11.325
447 HZ3 TRP 60 3HZ TRP 60 11.767 -3.032 9.392
448 HH2 TRP 60 HH TRP 60 11.189 -4.255 11.424
449 H LEU 61 H LEU 61 6.739 -3.890 6.074
450 HA LEU 61 HA LEU 61 5.182 -6.246 6.884
451 HB2 LEU 61 1HB LEU 61 5.599 -3.539 8.025
452 HB3 LEU 61 2HB LEU 61 4.025 -4.292 8.272
453 HG LEU 61 HG LEU 61 5.072 -6.165 9.412
454 HD11 LEU 61 1HD1 LEU 61 7.197 -6.068 8.089
455 HD12 LEU 61 2HD1 LEU 61 7.410 -6.305 9.823
456 HD13 LEU 61 3HD1 LEU 61 7.694 -4.718 9.109
457 HD21 LEU 61 1HD2 LEU 61 4.516 -4.637 11.011
458 HD22 LEU 61 2HD2 LEU 61 5.541 -3.376 10.325
459 HD23 LEU 61 3HD2 LEU 61 6.262 -4.690 11.256
460 H GLY 62 H GLY 62 3.409 -6.701 5.769
461 HA2 GLY 62 1HA GLY 62 2.379 -4.979 3.758
462 HA3 GLY 62 2HA GLY 62 1.648 -6.480 4.307
463 H LEU 63 H LEU 63 0.042 -4.392 3.615
464 HA LEU 63 HA LEU 63 -0.650 -2.614 5.664
465 HB2 LEU 63 1HB LEU 63 -2.270 -3.804 3.425
466 HB3 LEU 63 2HB LEU 63 -2.892 -2.560 4.508
467 HG LEU 63 HG LEU 63 -0.708 -1.290 3.683
468 HD11 LEU 63 1HD1 LEU 63 -1.078 -3.504 1.785
469 HD12 LEU 63 2HD1 LEU 63 0.355 -2.544 2.150
470 HD13 LEU 63 3HD1 LEU 63 -0.877 -1.909 1.060
471 HD21 LEU 63 1HD2 LEU 63 -2.094 0.000 2.347
472 HD22 LEU 63 2HD2 LEU 63 -3.233 -0.775 3.449
473 HD23 LEU 63 3HD2 LEU 63 -3.037 -1.389 1.806
474 H GLY 64 H GLY 64 -1.519 -5.960 5.102
475 HA2 GLY 64 1HA GLY 64 -3.665 -6.058 6.974
476 HA3 GLY 64 2HA GLY 64 -2.807 -7.438 6.308
477 H ILE 65 H ILE 65 -0.310 -7.253 7.178
478 HA ILE 65 HA ILE 65 -0.152 -8.328 9.612
479 HB ILE 65 HB ILE 65 1.753 -6.350 8.382
480 HG12 ILE 65 1HG1 ILE 65 3.120 -8.525 8.236
481 HG13 ILE 65 2HG1 ILE 65 1.615 -9.350 8.628
482 HG21 ILE 65 1HG2 ILE 65 2.109 -7.930 10.924
483 HG22 ILE 65 2HG2 ILE 65 3.413 -7.118 10.060
484 HG23 ILE 65 3HG2 ILE 65 2.095 -6.175 10.755
485 HD11 ILE 65 1HD1 ILE 65 2.371 -8.987 6.145
486 HD12 ILE 65 2HD1 ILE 65 0.673 -8.875 6.607
487 HD13 ILE 65 3HD1 ILE 65 1.624 -7.408 6.382
488 H TYR 66 H TYR 66 -0.584 -4.898 8.988
489 HA TYR 66 HA TYR 66 -0.436 -4.241 11.813
490 HB2 TYR 66 1HB TYR 66 -0.608 -2.701 9.271
491 HB3 TYR 66 2HB TYR 66 -1.232 -1.936 10.728
492 HD1 TYR 66 2HD TYR 66 0.559 -2.612 12.823
493 HD2 TYR 66 1HD TYR 66 1.466 -1.855 8.736
494 HE1 TYR 66 2HE TYR 66 2.842 -1.951 13.458
495 HE2 TYR 66 1HE TYR 66 3.752 -1.194 9.359
496 HH TYR 66 HH TYR 66 5.342 -1.593 11.214
497 H GLY 67 H GLY 67 -2.862 -4.283 9.223
498 HA2 GLY 67 1HA GLY 67 -5.089 -5.110 9.774
499 HA3 GLY 67 2HA GLY 67 -4.939 -4.290 11.321
500 H ILE 68 H ILE 68 -3.909 -2.803 8.337
501 HA ILE 68 HA ILE 68 -5.504 -0.505 8.782
502 HB ILE 68 HB ILE 68 -4.088 -1.351 6.251
503 HG12 ILE 68 1HG1 ILE 68 -3.114 0.606 8.328
504 HG13 ILE 68 2HG1 ILE 68 -2.710 -1.106 8.393
505 HG21 ILE 68 1HG2 ILE 68 -5.903 0.431 6.107
506 HG22 ILE 68 2HG2 ILE 68 -4.821 1.446 7.059
507 HG23 ILE 68 3HG2 ILE 68 -4.311 0.854 5.478
508 HD11 ILE 68 1HD1 ILE 68 -1.859 0.964 6.424
509 HD12 ILE 68 2HD1 ILE 68 -0.887 -0.199 7.325
510 HD13 ILE 68 3HD1 ILE 68 -1.877 -0.739 5.970
511 H GLN 69 H GLN 69 -7.344 0.228 7.758
512 HA GLN 69 HA GLN 69 -8.780 -1.751 6.113
513 HB2 GLN 69 1HB GLN 69 -9.902 0.132 8.193
514 HB3 GLN 69 2HB GLN 69 -10.882 -0.837 7.100
515 HG2 GLN 69 1HG GLN 69 -9.978 -2.874 8.059
516 HG3 GLN 69 2HG GLN 69 -8.937 -1.928 9.121
517 HE21 GLN 69 1HE2 GLN 69 -10.072 -3.266 10.745
518 HE22 GLN 69 2HE2 GLN 69 -11.567 -2.676 11.379
519 H ASP 70 H ASP 70 -10.474 -0.784 4.711
520 HA ASP 70 HA ASP 70 -9.370 1.289 3.126
521 HB2 ASP 70 1HB ASP 70 -11.344 1.068 1.755
522 HB3 ASP 70 2HB ASP 70 -10.827 -0.540 2.255
523 H SER 71 H SER 71 -10.157 3.387 2.727
524 HA SER 71 HA SER 71 -11.045 5.423 3.239
525 HB2 SER 71 1HB SER 71 -13.161 3.887 3.514
526 HB3 SER 71 2HB SER 71 -12.929 4.215 5.231
527 HG SER 71 HG SER 71 -14.263 5.795 4.435
528 H ASP 72 H ASP 72 -8.794 4.435 4.633
529 HA ASP 72 HA ASP 72 -9.165 5.495 7.349
530 HB2 ASP 72 1HB ASP 72 -8.120 3.165 6.853
531 HB3 ASP 72 2HB ASP 72 -6.684 4.084 6.412
532 H THR 73 H THR 73 -7.152 6.648 8.212
533 HA THR 73 HA THR 73 -6.193 8.529 6.154
534 HB THR 73 HB THR 73 -6.760 9.045 9.079
535 HG1 THR 73 1HG THR 73 -8.077 9.579 6.672
536 HG21 THR 73 1HG2 THR 73 -5.600 10.881 6.979
537 HG22 THR 73 2HG2 THR 73 -4.769 10.266 8.408
538 HG23 THR 73 3HG2 THR 73 -6.126 11.378 8.586
539 H LEU 74 H LEU 74 -4.048 8.937 6.006
540 HA LEU 74 HA LEU 74 -2.284 7.679 8.002
541 HB2 LEU 74 1HB LEU 74 -1.881 7.805 5.017
542 HB3 LEU 74 2HB LEU 74 -0.707 7.186 6.177
543 HG LEU 74 HG LEU 74 -3.439 5.969 5.875
544 HD11 LEU 74 1HD1 LEU 74 -1.622 6.068 3.822
545 HD12 LEU 74 2HD1 LEU 74 -2.875 4.845 4.032
546 HD13 LEU 74 3HD1 LEU 74 -1.238 4.538 4.612
547 HD21 LEU 74 1HD2 LEU 74 -2.265 5.379 7.895
548 HD22 LEU 74 2HD2 LEU 74 -0.810 4.985 6.979
549 HD23 LEU 74 3HD2 LEU 74 -2.261 3.997 6.799
550 H ILE 75 H ILE 75 -0.624 8.883 8.748
551 HA ILE 75 HA ILE 75 -0.510 11.665 7.880
552 HB ILE 75 HB ILE 75 0.993 10.406 10.172
553 HG12 ILE 75 1HG1 ILE 75 -1.250 9.982 10.734
554 HG13 ILE 75 2HG1 ILE 75 -0.894 11.506 11.539
555 HG21 ILE 75 1HG2 ILE 75 0.247 13.258 9.537
556 HG22 ILE 75 2HG2 ILE 75 1.036 12.722 11.020
557 HG23 ILE 75 3HG2 ILE 75 1.862 12.551 9.471
558 HD11 ILE 75 1HD1 ILE 75 -2.498 11.053 9.047
559 HD12 ILE 75 2HD1 ILE 75 -3.018 11.759 10.578
560 HD13 ILE 75 3HD1 ILE 75 -1.914 12.646 9.528
561 H LEU 76 H LEU 76 1.110 12.520 6.735
562 HA LEU 76 HA LEU 76 3.479 10.839 6.238
563 HB2 LEU 76 1HB LEU 76 2.033 11.190 4.273
564 HB3 LEU 76 2HB LEU 76 2.256 12.930 4.443
565 HG LEU 76 HG LEU 76 4.813 12.235 4.219
566 HD11 LEU 76 1HD1 LEU 76 4.893 9.993 3.916
567 HD12 LEU 76 2HD1 LEU 76 4.625 10.460 2.238
568 HD13 LEU 76 3HD1 LEU 76 3.271 9.914 3.227
569 HD21 LEU 76 1HD2 LEU 76 2.764 13.211 2.468
570 HD22 LEU 76 2HD2 LEU 76 3.913 12.229 1.558
571 HD23 LEU 76 3HD2 LEU 76 4.483 13.605 2.505
572 H SER 77 H SER 77 5.400 11.618 6.817
573 HA SER 77 HA SER 77 5.819 14.497 7.013
574 HB2 SER 77 1HB SER 77 6.010 12.582 9.331
575 HB3 SER 77 2HB SER 77 6.936 14.083 9.301
576 HG SER 77 HG SER 77 4.680 14.007 10.275
577 H LYS 78 H LYS 78 8.025 15.115 7.017
578 HA LYS 78 HA LYS 78 9.721 13.262 5.605
579 HB2 LYS 78 1HB LYS 78 10.579 15.963 6.607
580 HB3 LYS 78 2HB LYS 78 11.140 15.090 5.188
581 HG2 LYS 78 1HG LYS 78 9.077 15.505 4.042
582 HG3 LYS 78 2HG LYS 78 8.363 16.212 5.493
583 HD2 LYS 78 1HD LYS 78 8.997 18.047 4.167
584 HD3 LYS 78 2HD LYS 78 10.259 17.915 5.394
585 HE2 LYS 78 1HE LYS 78 10.503 16.646 2.679
586 HE3 LYS 78 2HE LYS 78 11.016 18.302 2.997
587 HZ1 LYS 78 1HZ LYS 78 12.239 15.799 3.801
588 HZ2 LYS 78 2HZ LYS 78 12.230 17.009 4.982
589 HZ3 LYS 78 3HZ LYS 78 12.952 17.300 3.480
590 H LYS 79 H LYS 79 11.790 12.566 6.262
591 HA LYS 79 HA LYS 79 11.967 11.903 9.040
592 HB2 LYS 79 1HB LYS 79 13.914 11.483 6.766
593 HB3 LYS 79 2HB LYS 79 14.110 10.817 8.381
594 HG2 LYS 79 1HG LYS 79 11.682 9.872 7.862
595 HG3 LYS 79 2HG LYS 79 12.271 10.017 6.205
596 HD2 LYS 79 1HD LYS 79 14.327 8.751 6.969
597 HD3 LYS 79 2HD LYS 79 13.450 8.412 8.463
598 HE2 LYS 79 1HE LYS 79 11.765 7.207 7.294
599 HE3 LYS 79 2HE LYS 79 12.370 7.754 5.731
600 HZ1 LYS 79 1HZ LYS 79 13.456 5.703 7.528
601 HZ2 LYS 79 2HZ LYS 79 14.520 6.548 6.521
602 HZ3 LYS 79 3HZ LYS 79 13.247 5.659 5.849
603 H LYS 80 H LYS 80 13.485 12.569 10.552
604 HA LYS 80 HA LYS 80 14.584 15.226 10.072
605 HB2 LYS 80 1HB LYS 80 13.250 14.725 12.127
606 HB3 LYS 80 2HB LYS 80 14.526 13.628 12.637
607 HG2 LYS 80 1HG LYS 80 16.100 15.456 12.765
608 HG3 LYS 80 2HG LYS 80 14.887 16.577 12.143
609 HD2 LYS 80 1HD LYS 80 13.718 16.619 14.113
610 HD3 LYS 80 2HD LYS 80 14.225 14.991 14.573
611 HE2 LYS 80 1HE LYS 80 16.152 17.294 14.470
612 HE3 LYS 80 2HE LYS 80 15.185 16.951 15.904
613 HZ1 LYS 80 1HZ LYS 80 17.277 15.888 16.159
614 HZ2 LYS 80 2HZ LYS 80 17.191 15.177 14.627
615 HZ3 LYS 80 3HZ LYS 80 16.142 14.671 15.854
616 H GLY 81 H GLY 81 16.176 14.182 8.553
617 HA2 GLY 81 1HA GLY 81 18.504 14.051 8.295
618 HA3 GLY 81 2HA GLY 81 18.655 13.739 10.018
619 H SER 82 H SER 82 17.968 12.321 6.889
620 HA SER 82 HA SER 82 17.636 9.655 7.845
621 HB2 SER 82 1HB SER 82 16.694 10.301 5.700
622 HB3 SER 82 2HB SER 82 18.296 10.707 5.083
623 HG SER 82 HG SER 82 17.926 8.132 6.077
624 H GLY 83 H GLY 83 20.252 11.022 5.833
625 HA2 GLY 83 1HA GLY 83 22.511 10.670 7.077
626 HA3 GLY 83 2HA GLY 83 22.054 8.979 6.931
627 HA PRO 84 HA PRO 84 24.096 10.841 2.984
628 HB2 PRO 84 1HB PRO 84 26.727 10.412 3.499
629 HB3 PRO 84 2HB PRO 84 25.908 11.930 3.884
630 HG2 PRO 84 1HG PRO 84 26.568 9.625 5.677
631 HG3 PRO 84 2HG PRO 84 26.724 11.364 5.987
632 HD2 PRO 84 1HD PRO 84 24.655 9.896 6.933
633 HD3 PRO 84 2HD PRO 84 24.486 11.605 6.482
634 H SER 85 H SER 85 23.914 9.340 1.455
635 HA SER 85 HA SER 85 25.092 6.683 1.936
636 HB2 SER 85 1HB SER 85 22.483 6.918 1.974
637 HB3 SER 85 2HB SER 85 22.651 7.007 0.221
638 HG SER 85 HG SER 85 22.473 4.843 1.530
639 H SER 86 H SER 86 26.118 5.704 0.221
640 HA SER 86 HA SER 86 26.610 7.444 -2.098
641 HB2 SER 86 1HB SER 86 28.750 6.475 -2.304
642 HB3 SER 86 2HB SER 86 28.528 6.668 -0.566
643 HG SER 86 HG SER 86 28.132 4.507 -0.376
644 H GLY 87 H GLY 87 26.657 6.559 -4.204
645 HA2 GLY 87 1HA GLY 87 26.353 4.798 -5.773
646 HA3 GLY 87 2HA GLY 87 25.577 3.849 -4.514
Start of MODEL 11
1 H1 GLY 1 H GLY 1 -5.830 -1.483 -23.157
2 HA2 GLY 1 1HA GLY 1 -5.136 0.289 -20.904
3 HA3 GLY 1 2HA GLY 1 -6.817 0.011 -21.336
4 H SER 2 H SER 2 -6.654 -0.616 -18.938
5 HA SER 2 HA SER 2 -6.466 -3.527 -18.842
6 HB2 SER 2 1HB SER 2 -4.947 -1.653 -17.030
7 HB3 SER 2 2HB SER 2 -5.317 -3.314 -16.565
8 HG SER 2 HG SER 2 -3.250 -2.614 -17.864
9 H SER 3 H SER 3 -8.165 -4.381 -17.835
10 HA SER 3 HA SER 3 -9.736 -2.645 -16.044
11 HB2 SER 3 1HB SER 3 -11.056 -2.943 -17.996
12 HB3 SER 3 2HB SER 3 -10.658 -4.658 -18.096
13 HG SER 3 HG SER 3 -12.213 -5.079 -16.746
14 H GLY 4 H GLY 4 -10.107 -3.380 -14.047
15 HA2 GLY 4 1HA GLY 4 -10.816 -5.367 -12.716
16 HA3 GLY 4 2HA GLY 4 -9.502 -6.223 -13.507
17 H SER 5 H SER 5 -9.866 -3.116 -11.790
18 HA SER 5 HA SER 5 -7.335 -3.668 -10.417
19 HB2 SER 5 1HB SER 5 -8.924 -1.117 -10.760
20 HB3 SER 5 2HB SER 5 -7.473 -1.239 -9.765
21 HG SER 5 HG SER 5 -7.460 -2.047 -12.467
22 H SER 6 H SER 6 -7.349 -4.374 -8.397
23 HA SER 6 HA SER 6 -9.688 -3.772 -6.708
24 HB2 SER 6 1HB SER 6 -8.060 -6.325 -6.686
25 HB3 SER 6 2HB SER 6 -9.454 -5.970 -5.666
26 HG SER 6 HG SER 6 -10.534 -5.640 -7.839
27 H GLY 7 H GLY 7 -9.231 -3.863 -4.360
28 HA2 GLY 7 1HA GLY 7 -7.139 -4.031 -2.841
29 HA3 GLY 7 2HA GLY 7 -6.584 -2.694 -3.838
30 H ILE 8 H ILE 8 -6.493 -1.806 -1.536
31 HA ILE 8 HA ILE 8 -9.106 -0.691 -0.768
32 HB ILE 8 HB ILE 8 -8.167 -0.271 1.436
33 HG12 ILE 8 1HG1 ILE 8 -5.686 -1.788 0.711
34 HG13 ILE 8 2HG1 ILE 8 -5.774 -0.061 0.383
35 HG21 ILE 8 1HG2 ILE 8 -7.345 -3.080 1.018
36 HG22 ILE 8 2HG2 ILE 8 -8.474 -2.387 2.181
37 HG23 ILE 8 3HG2 ILE 8 -8.977 -2.644 0.511
38 HD11 ILE 8 1HD1 ILE 8 -4.789 -0.106 2.453
39 HD12 ILE 8 2HD1 ILE 8 -6.490 0.092 2.877
40 HD13 ILE 8 3HD1 ILE 8 -5.732 -1.496 2.991
41 H GLN 9 H GLN 9 -8.915 1.529 0.293
42 HA GLN 9 HA GLN 9 -7.067 3.194 -1.287
43 HB2 GLN 9 1HB GLN 9 -9.690 3.257 -1.637
44 HB3 GLN 9 2HB GLN 9 -9.626 4.306 -0.228
45 HG2 GLN 9 1HG GLN 9 -9.452 5.871 -1.854
46 HG3 GLN 9 2HG GLN 9 -7.742 5.496 -1.643
47 HE21 GLN 9 1HE2 GLN 9 -8.153 6.595 -3.912
48 HE22 GLN 9 2HE2 GLN 9 -8.230 5.475 -5.225
49 H VAL 10 H VAL 10 -5.901 4.743 -0.259
50 HA VAL 10 HA VAL 10 -6.382 5.126 2.621
51 HB VAL 10 HB VAL 10 -3.862 5.321 2.859
52 HG11 VAL 10 1HG1 VAL 10 -5.490 2.900 2.557
53 HG12 VAL 10 2HG1 VAL 10 -3.748 2.632 2.474
54 HG13 VAL 10 3HG1 VAL 10 -4.455 3.415 3.888
55 HG21 VAL 10 1HG2 VAL 10 -3.971 4.986 0.073
56 HG22 VAL 10 2HG2 VAL 10 -2.535 5.078 1.092
57 HG23 VAL 10 3HG2 VAL 10 -3.252 3.511 0.719
58 H PHE 11 H PHE 11 -6.481 7.188 3.241
59 HA PHE 11 HA PHE 11 -5.930 9.262 1.277
60 HB2 PHE 11 1HB PHE 11 -7.289 9.300 3.973
61 HB3 PHE 11 2HB PHE 11 -6.988 10.756 3.030
62 HD1 PHE 11 1HD PHE 11 -8.211 11.192 0.987
63 HD2 PHE 11 2HD PHE 11 -8.952 7.691 3.292
64 HE1 PHE 11 1HE PHE 11 -10.308 10.828 -0.247
65 HE2 PHE 11 2HE PHE 11 -11.049 7.320 2.060
66 HZ PHE 11 HZ PHE 11 -11.729 8.889 0.288
67 H VAL 12 H VAL 12 -3.882 9.924 1.170
68 HA VAL 12 HA VAL 12 -2.221 9.995 3.559
69 HB VAL 12 HB VAL 12 -1.529 10.658 0.693
70 HG11 VAL 12 1HG1 VAL 12 0.525 9.984 2.728
71 HG12 VAL 12 2HG1 VAL 12 0.631 11.037 1.316
72 HG13 VAL 12 3HG1 VAL 12 -0.183 11.598 2.777
73 HG21 VAL 12 1HG2 VAL 12 -0.357 8.286 1.950
74 HG22 VAL 12 2HG2 VAL 12 -2.103 8.195 1.714
75 HG23 VAL 12 3HG2 VAL 12 -1.041 8.496 0.338
76 H LYS 13 H LYS 13 -2.572 11.713 4.829
77 HA LYS 13 HA LYS 13 -3.225 14.303 3.712
78 HB2 LYS 13 1HB LYS 13 -4.393 13.753 5.705
79 HB3 LYS 13 2HB LYS 13 -2.915 13.269 6.526
80 HG2 LYS 13 1HG LYS 13 -2.188 15.702 6.279
81 HG3 LYS 13 2HG LYS 13 -3.873 16.034 5.873
82 HD2 LYS 13 1HD LYS 13 -4.412 14.758 8.052
83 HD3 LYS 13 2HD LYS 13 -2.713 15.027 8.449
84 HE2 LYS 13 1HE LYS 13 -3.150 17.483 7.961
85 HE3 LYS 13 2HE LYS 13 -4.865 17.073 7.968
86 HZ1 LYS 13 1HZ LYS 13 -3.744 17.887 10.129
87 HZ2 LYS 13 2HZ LYS 13 -3.164 16.303 10.244
88 HZ3 LYS 13 3HZ LYS 13 -4.831 16.592 10.204
89 H ASN 14 H ASN 14 -1.709 15.641 3.007
90 HA ASN 14 HA ASN 14 1.055 15.302 3.698
91 HB2 ASN 14 1HB ASN 14 1.345 17.372 2.268
92 HB3 ASN 14 2HB ASN 14 0.599 15.994 1.463
93 HD21 ASN 14 1HD2 ASN 14 -0.011 17.839 0.016
94 HD22 ASN 14 2HD2 ASN 14 -1.508 18.635 0.349
95 HA PRO 15 HA PRO 15 1.410 18.075 7.083
96 HB2 PRO 15 1HB PRO 15 3.904 19.070 6.684
97 HB3 PRO 15 2HB PRO 15 3.607 17.417 7.235
98 HG2 PRO 15 1HG PRO 15 4.232 18.413 4.481
99 HG3 PRO 15 2HG PRO 15 4.865 16.989 5.327
100 HD2 PRO 15 1HD PRO 15 2.898 16.828 3.473
101 HD3 PRO 15 2HD PRO 15 2.994 15.725 4.861
102 H ASP 16 H ASP 16 1.368 19.175 3.876
103 HA ASP 16 HA ASP 16 1.519 21.996 4.627
104 HB2 ASP 16 1HB ASP 16 1.583 20.510 2.026
105 HB3 ASP 16 2HB ASP 16 1.135 22.213 2.042
106 H GLY 17 H GLY 17 -0.708 19.753 2.984
107 HA2 GLY 17 1HA GLY 17 -3.048 20.248 4.127
108 HA3 GLY 17 2HA GLY 17 -2.857 21.718 3.183
109 H GLY 18 H GLY 18 -4.651 19.189 3.108
110 HA2 GLY 18 1HA GLY 18 -5.942 18.557 1.224
111 HA3 GLY 18 2HA GLY 18 -4.595 18.999 0.185
112 H SER 19 H SER 19 -6.235 16.465 1.685
113 HA SER 19 HA SER 19 -3.980 14.618 1.512
114 HB2 SER 19 1HB SER 19 -5.582 12.977 2.507
115 HB3 SER 19 2HB SER 19 -5.343 14.413 3.502
116 HG SER 19 HG SER 19 -7.518 13.935 1.738
117 H TYR 20 H TYR 20 -3.992 12.767 0.209
118 HA TYR 20 HA TYR 20 -5.926 12.840 -2.015
119 HB2 TYR 20 1HB TYR 20 -3.168 11.708 -2.335
120 HB3 TYR 20 2HB TYR 20 -4.250 12.361 -3.559
121 HD1 TYR 20 2HD TYR 20 -4.696 14.898 -3.492
122 HD2 TYR 20 1HD TYR 20 -1.468 13.032 -1.443
123 HE1 TYR 20 2HE TYR 20 -3.528 17.060 -3.376
124 HE2 TYR 20 1HE TYR 20 -0.292 15.189 -1.319
125 HH TYR 20 HH TYR 20 -0.963 17.757 -3.160
126 H ALA 21 H ALA 21 -6.579 10.847 -2.908
127 HA ALA 21 HA ALA 21 -6.398 8.619 -1.012
128 HB1 ALA 21 1HB ALA 21 -8.270 8.864 -3.356
129 HB2 ALA 21 2HB ALA 21 -8.393 7.767 -1.980
130 HB3 ALA 21 3HB ALA 21 -8.632 9.499 -1.751
131 H TYR 22 H TYR 22 -4.805 7.232 -1.422
132 HA TYR 22 HA TYR 22 -4.014 6.719 -4.194
133 HB2 TYR 22 1HB TYR 22 -2.692 6.268 -1.535
134 HB3 TYR 22 2HB TYR 22 -2.135 5.409 -2.967
135 HD1 TYR 22 2HD TYR 22 -2.678 8.800 -1.563
136 HD2 TYR 22 1HD TYR 22 -0.718 6.458 -4.526
137 HE1 TYR 22 2HE TYR 22 -1.313 10.748 -2.191
138 HE2 TYR 22 1HE TYR 22 0.653 8.399 -5.162
139 HH TYR 22 HH TYR 22 0.963 11.122 -3.289
140 H ALA 23 H ALA 23 -3.751 4.569 -4.975
141 HA ALA 23 HA ALA 23 -5.499 2.621 -3.620
142 HB1 ALA 23 1HB ALA 23 -6.140 1.756 -5.730
143 HB2 ALA 23 2HB ALA 23 -6.262 3.512 -5.850
144 HB3 ALA 23 3HB ALA 23 -4.886 2.672 -6.565
145 H ILE 24 H ILE 24 -4.502 0.910 -2.802
146 HA ILE 24 HA ILE 24 -2.320 -0.354 -4.236
147 HB ILE 24 HB ILE 24 -1.055 1.202 -2.916
148 HG12 ILE 24 1HG1 ILE 24 -0.959 -1.441 -1.457
149 HG13 ILE 24 2HG1 ILE 24 -0.310 -1.212 -3.077
150 HG21 ILE 24 1HG2 ILE 24 -3.146 0.903 -1.065
151 HG22 ILE 24 2HG2 ILE 24 -1.680 0.354 -0.254
152 HG23 ILE 24 3HG2 ILE 24 -1.748 1.971 -0.953
153 HD11 ILE 24 1HD1 ILE 24 1.099 0.649 -2.067
154 HD12 ILE 24 2HD1 ILE 24 0.634 -0.015 -0.501
155 HD13 ILE 24 3HD1 ILE 24 1.524 -1.011 -1.651
156 H ASN 25 H ASN 25 -2.629 -2.474 -4.172
157 HA ASN 25 HA ASN 25 -4.676 -3.762 -2.864
158 HB2 ASN 25 1HB ASN 25 -2.940 -4.556 -4.711
159 HB3 ASN 25 2HB ASN 25 -2.152 -5.288 -3.317
160 HD21 ASN 25 1HD2 ASN 25 -2.619 -7.359 -3.273
161 HD22 ASN 25 2HD2 ASN 25 -4.178 -8.058 -3.528
162 HA PRO 26 HA PRO 26 -3.472 -4.011 1.367
163 HB2 PRO 26 1HB PRO 26 -5.040 -6.096 2.118
164 HB3 PRO 26 2HB PRO 26 -5.679 -4.478 1.806
165 HG2 PRO 26 1HG PRO 26 -5.660 -6.884 0.024
166 HG3 PRO 26 2HG PRO 26 -6.962 -5.716 0.314
167 HD2 PRO 26 1HD PRO 26 -5.382 -5.621 -1.883
168 HD3 PRO 26 2HD PRO 26 -6.062 -4.163 -1.132
169 H ASN 27 H ASN 27 -3.115 -6.655 -0.846
170 HA ASN 27 HA ASN 27 -1.622 -8.289 1.029
171 HB2 ASN 27 1HB ASN 27 -2.330 -8.626 -1.887
172 HB3 ASN 27 2HB ASN 27 -1.304 -9.762 -1.015
173 HD21 ASN 27 1HD2 ASN 27 -2.676 -11.480 -1.147
174 HD22 ASN 27 2HD2 ASN 27 -4.197 -11.548 -0.330
175 H SER 28 H SER 28 -0.954 -5.632 -0.829
176 HA SER 28 HA SER 28 1.683 -6.387 -1.720
177 HB2 SER 28 1HB SER 28 0.027 -4.611 -2.734
178 HB3 SER 28 2HB SER 28 0.777 -3.536 -1.555
179 HG SER 28 HG SER 28 2.482 -5.093 -3.105
180 H PHE 29 H PHE 29 3.350 -4.403 -1.167
181 HA PHE 29 HA PHE 29 3.765 -4.687 1.706
182 HB2 PHE 29 1HB PHE 29 5.563 -3.728 -0.525
183 HB3 PHE 29 2HB PHE 29 6.031 -3.714 1.172
184 HD1 PHE 29 2HD PHE 29 6.067 -5.917 2.421
185 HD2 PHE 29 1HD PHE 29 5.796 -5.654 -1.818
186 HE1 PHE 29 2HE PHE 29 6.827 -8.249 2.231
187 HE2 PHE 29 1HE PHE 29 6.555 -7.986 -2.015
188 HZ PHE 29 HZ PHE 29 7.073 -9.287 0.011
189 H ILE 30 H ILE 30 4.296 -2.896 3.052
190 HA ILE 30 HA ILE 30 2.616 -0.661 2.713
191 HB ILE 30 HB ILE 30 4.864 -1.243 4.622
192 HG12 ILE 30 1HG1 ILE 30 2.610 -2.370 4.816
193 HG13 ILE 30 2HG1 ILE 30 3.123 -1.472 6.240
194 HG21 ILE 30 1HG2 ILE 30 3.509 1.333 4.092
195 HG22 ILE 30 2HG2 ILE 30 3.736 0.881 5.780
196 HG23 ILE 30 3HG2 ILE 30 5.129 1.008 4.706
197 HD11 ILE 30 1HD1 ILE 30 0.958 -0.862 4.293
198 HD12 ILE 30 2HD1 ILE 30 0.932 -0.837 6.057
199 HD13 ILE 30 3HD1 ILE 30 1.737 0.456 5.168
200 H LEU 31 H LEU 31 6.159 -0.954 2.498
201 HA LEU 31 HA LEU 31 6.698 1.706 1.836
202 HB2 LEU 31 1HB LEU 31 8.460 0.233 2.513
203 HB3 LEU 31 2HB LEU 31 8.159 -0.834 1.142
204 HG LEU 31 HG LEU 31 8.959 1.981 0.594
205 HD11 LEU 31 1HD1 LEU 31 10.463 0.418 2.334
206 HD12 LEU 31 2HD1 LEU 31 11.003 1.845 1.451
207 HD13 LEU 31 3HD1 LEU 31 11.252 0.239 0.766
208 HD21 LEU 31 1HD2 LEU 31 8.386 -0.110 -0.997
209 HD22 LEU 31 2HD2 LEU 31 10.123 -0.341 -0.803
210 HD23 LEU 31 3HD2 LEU 31 9.502 1.180 -1.445
211 H GLY 32 H GLY 32 5.405 -0.880 -0.061
212 HA2 GLY 32 1HA GLY 32 6.089 0.004 -2.641
213 HA3 GLY 32 2HA GLY 32 4.699 -0.994 -2.241
214 H LEU 33 H LEU 33 3.767 1.203 -0.375
215 HA LEU 33 HA LEU 33 2.168 2.578 -2.333
216 HB2 LEU 33 1HB LEU 33 1.015 1.951 -0.392
217 HB3 LEU 33 2HB LEU 33 2.281 2.574 0.664
218 HG LEU 33 HG LEU 33 1.623 4.885 -0.095
219 HD11 LEU 33 1HD1 LEU 33 0.336 4.929 -1.924
220 HD12 LEU 33 2HD1 LEU 33 -0.991 4.603 -0.810
221 HD13 LEU 33 3HD1 LEU 33 -0.230 3.276 -1.687
222 HD21 LEU 33 1HD2 LEU 33 0.466 4.977 1.799
223 HD22 LEU 33 2HD2 LEU 33 0.547 3.216 1.861
224 HD23 LEU 33 3HD2 LEU 33 -0.842 4.010 1.117
225 H LYS 34 H LYS 34 4.563 3.535 0.113
226 HA LYS 34 HA LYS 34 4.577 6.249 -0.169
227 HB2 LYS 34 1HB LYS 34 6.715 4.251 0.410
228 HB3 LYS 34 2HB LYS 34 7.196 5.916 0.115
229 HG2 LYS 34 1HG LYS 34 6.944 5.986 2.371
230 HG3 LYS 34 2HG LYS 34 5.301 6.410 1.884
231 HD2 LYS 34 1HD LYS 34 4.443 4.388 2.523
232 HD3 LYS 34 2HD LYS 34 5.957 3.530 2.227
233 HE2 LYS 34 1HE LYS 34 6.834 4.098 4.277
234 HE3 LYS 34 2HE LYS 34 5.842 5.548 4.419
235 HZ1 LYS 34 1HZ LYS 34 3.990 3.608 4.417
236 HZ2 LYS 34 2HZ LYS 34 4.651 4.291 5.816
237 HZ3 LYS 34 3HZ LYS 34 5.263 2.832 5.217
238 H GLN 35 H GLN 35 6.254 3.906 -2.240
239 HA GLN 35 HA GLN 35 7.685 5.556 -3.883
240 HB2 GLN 35 1HB GLN 35 7.628 3.064 -3.998
241 HB3 GLN 35 2HB GLN 35 6.079 3.174 -4.822
242 HG2 GLN 35 1HG GLN 35 7.555 2.908 -6.567
243 HG3 GLN 35 2HG GLN 35 7.348 4.658 -6.511
244 HE21 GLN 35 1HE2 GLN 35 9.205 5.569 -7.009
245 HE22 GLN 35 2HE2 GLN 35 10.755 5.125 -6.390
246 H GLN 36 H GLN 36 4.279 4.616 -4.332
247 HA GLN 36 HA GLN 36 3.734 6.001 -6.651
248 HB2 GLN 36 1HB GLN 36 2.060 5.253 -4.282
249 HB3 GLN 36 2HB GLN 36 1.368 6.247 -5.557
250 HG2 GLN 36 1HG GLN 36 2.176 4.424 -7.159
251 HG3 GLN 36 2HG GLN 36 2.375 3.433 -5.715
252 HE21 GLN 36 1HE2 GLN 36 0.690 2.292 -5.085
253 HE22 GLN 36 2HE2 GLN 36 -0.952 2.566 -5.546
254 H ILE 37 H ILE 37 3.938 7.207 -3.359
255 HA ILE 37 HA ILE 37 2.918 9.810 -3.977
256 HB ILE 37 HB ILE 37 4.509 8.855 -1.594
257 HG12 ILE 37 1HG1 ILE 37 1.590 9.531 -1.572
258 HG13 ILE 37 2HG1 ILE 37 2.108 7.957 -2.168
259 HG21 ILE 37 1HG2 ILE 37 4.705 10.985 -1.006
260 HG22 ILE 37 2HG2 ILE 37 3.808 11.497 -2.434
261 HG23 ILE 37 3HG2 ILE 37 2.947 11.102 -0.946
262 HD11 ILE 37 1HD1 ILE 37 1.515 8.501 0.406
263 HD12 ILE 37 2HD1 ILE 37 2.590 7.203 -0.116
264 HD13 ILE 37 3HD1 ILE 37 3.261 8.747 0.410
265 H GLU 38 H GLU 38 6.060 8.297 -3.969
266 HA GLU 38 HA GLU 38 7.606 10.680 -3.994
267 HB2 GLU 38 1HB GLU 38 8.688 8.651 -3.356
268 HB3 GLU 38 2HB GLU 38 8.206 7.849 -4.844
269 HG2 GLU 38 1HG GLU 38 9.923 10.273 -5.008
270 HG3 GLU 38 2HG GLU 38 10.643 8.741 -4.516
271 H ASP 39 H ASP 39 6.403 8.537 -6.551
272 HA ASP 39 HA ASP 39 7.559 10.080 -8.667
273 HB2 ASP 39 1HB ASP 39 5.467 7.899 -8.648
274 HB3 ASP 39 2HB ASP 39 6.072 8.650 -10.122
275 H GLN 40 H GLN 40 4.624 10.207 -6.854
276 HA GLN 40 HA GLN 40 3.201 11.802 -8.797
277 HB2 GLN 40 1HB GLN 40 2.615 10.799 -6.036
278 HB3 GLN 40 2HB GLN 40 1.637 12.091 -6.718
279 HG2 GLN 40 1HG GLN 40 2.077 9.453 -8.089
280 HG3 GLN 40 2HG GLN 40 0.729 9.773 -6.998
281 HE21 GLN 40 1HE2 GLN 40 -0.518 11.810 -7.563
282 HE22 GLN 40 2HE2 GLN 40 -0.874 12.049 -9.237
283 H GLN 41 H GLN 41 4.283 12.401 -5.448
284 HA GLN 41 HA GLN 41 4.063 15.252 -5.814
285 HB2 GLN 41 1HB GLN 41 5.243 13.720 -3.492
286 HB3 GLN 41 2HB GLN 41 4.770 15.413 -3.496
287 HG2 GLN 41 1HG GLN 41 2.711 13.387 -4.172
288 HG3 GLN 41 2HG GLN 41 3.222 13.533 -2.491
289 HE21 GLN 41 1HE2 GLN 41 2.345 15.078 -1.287
290 HE22 GLN 41 2HE2 GLN 41 1.366 16.374 -1.877
291 H GLY 42 H GLY 42 6.699 12.916 -5.352
292 HA2 GLY 42 1HA GLY 42 8.678 13.331 -6.803
293 HA3 GLY 42 2HA GLY 42 8.566 15.008 -6.289
294 H LEU 43 H LEU 43 7.850 14.078 -3.519
295 HA LEU 43 HA LEU 43 10.432 14.188 -2.411
296 HB2 LEU 43 1HB LEU 43 8.049 14.680 -1.412
297 HB3 LEU 43 2HB LEU 43 8.163 13.002 -0.885
298 HG LEU 43 HG LEU 43 10.409 14.845 -0.231
299 HD11 LEU 43 1HD1 LEU 43 7.638 15.115 0.745
300 HD12 LEU 43 2HD1 LEU 43 8.936 16.305 0.658
301 HD13 LEU 43 3HD1 LEU 43 8.905 15.130 1.972
302 HD21 LEU 43 1HD2 LEU 43 9.088 12.462 1.043
303 HD22 LEU 43 2HD2 LEU 43 10.286 13.450 1.878
304 HD23 LEU 43 3HD2 LEU 43 10.725 12.592 0.400
305 HA PRO 44 HA PRO 44 11.745 9.987 -2.774
306 HB2 PRO 44 1HB PRO 44 13.781 10.082 -0.980
307 HB3 PRO 44 2HB PRO 44 13.882 10.809 -2.588
308 HG2 PRO 44 1HG PRO 44 13.295 12.108 0.044
309 HG3 PRO 44 2HG PRO 44 14.342 12.670 -1.273
310 HD2 PRO 44 1HD PRO 44 11.838 13.628 -0.893
311 HD3 PRO 44 2HD PRO 44 12.571 13.482 -2.504
312 H LYS 45 H LYS 45 11.377 8.069 -1.760
313 HA LYS 45 HA LYS 45 9.611 7.936 0.400
314 HB2 LYS 45 1HB LYS 45 11.494 5.749 -0.493
315 HB3 LYS 45 2HB LYS 45 9.973 5.549 0.367
316 HG2 LYS 45 1HG LYS 45 8.711 5.879 -1.497
317 HG3 LYS 45 2HG LYS 45 9.906 6.933 -2.256
318 HD2 LYS 45 1HD LYS 45 9.828 4.880 -3.489
319 HD3 LYS 45 2HD LYS 45 11.351 4.927 -2.598
320 HE2 LYS 45 1HE LYS 45 8.920 3.570 -1.479
321 HE3 LYS 45 2HE LYS 45 10.005 2.738 -2.593
322 HZ1 LYS 45 1HZ LYS 45 10.477 3.606 0.163
323 HZ2 LYS 45 2HZ LYS 45 11.791 3.607 -0.903
324 HZ3 LYS 45 3HZ LYS 45 10.939 2.174 -0.612
325 H LYS 46 H LYS 46 13.122 7.409 0.290
326 HA LYS 46 HA LYS 46 13.609 6.625 2.872
327 HB2 LYS 46 1HB LYS 46 15.837 7.662 2.631
328 HB3 LYS 46 2HB LYS 46 15.370 6.745 1.205
329 HG2 LYS 46 1HG LYS 46 14.894 8.728 -0.016
330 HG3 LYS 46 2HG LYS 46 15.049 9.726 1.431
331 HD2 LYS 46 1HD LYS 46 17.319 8.076 0.346
332 HD3 LYS 46 2HD LYS 46 17.019 9.737 -0.169
333 HE2 LYS 46 1HE LYS 46 17.154 9.163 2.747
334 HE3 LYS 46 2HE LYS 46 18.659 9.171 1.828
335 HZ1 LYS 46 1HZ LYS 46 16.708 11.394 2.074
336 HZ2 LYS 46 2HZ LYS 46 18.028 11.410 1.017
337 HZ3 LYS 46 3HZ LYS 46 18.284 11.347 2.688
338 H GLN 47 H GLN 47 12.393 9.636 1.805
339 HA GLN 47 HA GLN 47 13.055 10.948 4.340
340 HB2 GLN 47 1HB GLN 47 12.136 11.936 1.663
341 HB3 GLN 47 2HB GLN 47 11.899 12.931 3.094
342 HG2 GLN 47 1HG GLN 47 14.547 11.864 2.140
343 HG3 GLN 47 2HG GLN 47 13.946 13.499 1.870
344 HE21 GLN 47 1HE2 GLN 47 15.665 11.470 3.926
345 HE22 GLN 47 2HE2 GLN 47 15.807 12.537 5.277
346 H GLN 48 H GLN 48 10.249 10.289 2.255
347 HA GLN 48 HA GLN 48 8.315 11.230 4.085
348 HB2 GLN 48 1HB GLN 48 6.747 10.546 2.555
349 HB3 GLN 48 2HB GLN 48 8.166 10.627 1.519
350 HG2 GLN 48 1HG GLN 48 8.480 8.155 2.033
351 HG3 GLN 48 2HG GLN 48 6.841 8.203 2.680
352 HE21 GLN 48 1HE2 GLN 48 8.553 9.411 -0.190
353 HE22 GLN 48 2HE2 GLN 48 7.369 8.878 -1.329
354 H GLN 49 H GLN 49 7.118 10.213 5.636
355 HA GLN 49 HA GLN 49 7.483 7.358 6.088
356 HB2 GLN 49 1HB GLN 49 9.283 8.534 7.365
357 HB3 GLN 49 2HB GLN 49 8.032 9.376 8.270
358 HG2 GLN 49 1HG GLN 49 7.171 7.046 8.881
359 HG3 GLN 49 2HG GLN 49 8.733 6.466 8.305
360 HE21 GLN 49 1HE2 GLN 49 9.348 5.750 10.334
361 HE22 GLN 49 2HE2 GLN 49 9.781 6.835 11.607
362 H LEU 50 H LEU 50 5.466 6.633 6.162
363 HA LEU 50 HA LEU 50 3.329 8.316 7.192
364 HB2 LEU 50 1HB LEU 50 3.255 5.573 5.946
365 HB3 LEU 50 2HB LEU 50 1.844 6.532 6.385
366 HG LEU 50 HG LEU 50 3.860 7.542 4.404
367 HD11 LEU 50 1HD1 LEU 50 3.092 6.270 2.734
368 HD12 LEU 50 2HD1 LEU 50 1.426 6.357 3.304
369 HD13 LEU 50 3HD1 LEU 50 2.540 5.187 4.011
370 HD21 LEU 50 1HD2 LEU 50 1.013 8.140 4.109
371 HD22 LEU 50 2HD2 LEU 50 2.412 9.215 4.065
372 HD23 LEU 50 3HD2 LEU 50 1.719 8.730 5.614
373 H GLU 51 H GLU 51 2.341 8.061 9.105
374 HA GLU 51 HA GLU 51 3.164 5.768 10.762
375 HB2 GLU 51 1HB GLU 51 2.737 8.648 11.380
376 HB3 GLU 51 2HB GLU 51 2.312 7.477 12.620
377 HG2 GLU 51 1HG GLU 51 4.474 6.836 12.961
378 HG3 GLU 51 2HG GLU 51 4.972 7.247 11.321
379 H PHE 52 H PHE 52 1.610 4.800 12.131
380 HA PHE 52 HA PHE 52 -1.177 5.557 11.816
381 HB2 PHE 52 1HB PHE 52 -0.484 3.928 9.938
382 HB3 PHE 52 2HB PHE 52 -0.411 2.711 11.208
383 HD1 PHE 52 2HD PHE 52 -2.788 5.477 10.409
384 HD2 PHE 52 1HD PHE 52 -2.224 1.318 11.116
385 HE1 PHE 52 2HE PHE 52 -5.212 5.115 10.195
386 HE2 PHE 52 1HE PHE 52 -4.647 0.949 10.902
387 HZ PHE 52 HZ PHE 52 -6.145 2.850 10.442
388 H GLN 53 H GLN 53 -2.255 5.271 13.662
389 HA GLN 53 HA GLN 53 -2.651 4.781 15.852
390 HB2 GLN 53 1HB GLN 53 -1.651 2.139 14.803
391 HB3 GLN 53 2HB GLN 53 -2.240 2.331 16.449
392 HG2 GLN 53 1HG GLN 53 -4.404 3.075 15.581
393 HG3 GLN 53 2HG GLN 53 -3.811 2.856 13.936
394 HE21 GLN 53 1HE2 GLN 53 -5.611 1.410 13.681
395 HE22 GLN 53 2HE2 GLN 53 -5.488 -0.222 14.232
396 H GLY 54 H GLY 54 0.047 5.798 15.068
397 HA2 GLY 54 1HA GLY 54 1.914 6.442 16.257
398 HA3 GLY 54 2HA GLY 54 1.253 5.598 17.650
399 H GLN 55 H GLN 55 1.804 4.034 14.569
400 HA GLN 55 HA GLN 55 4.184 2.708 15.665
401 HB2 GLN 55 1HB GLN 55 3.378 0.584 15.371
402 HB3 GLN 55 2HB GLN 55 1.879 1.412 15.773
403 HG2 GLN 55 1HG GLN 55 1.543 1.694 13.273
404 HG3 GLN 55 2HG GLN 55 2.853 0.530 13.078
405 HE21 GLN 55 1HE2 GLN 55 2.485 -1.387 14.770
406 HE22 GLN 55 2HE2 GLN 55 0.929 -2.124 14.632
407 H VAL 56 H VAL 56 5.835 2.770 14.298
408 HA VAL 56 HA VAL 56 5.614 3.889 11.709
409 HB VAL 56 HB VAL 56 7.915 2.339 12.908
410 HG11 VAL 56 1HG1 VAL 56 9.035 4.074 11.170
411 HG12 VAL 56 2HG1 VAL 56 8.628 2.404 10.769
412 HG13 VAL 56 3HG1 VAL 56 7.527 3.712 10.332
413 HG21 VAL 56 1HG2 VAL 56 7.001 4.496 14.042
414 HG22 VAL 56 2HG2 VAL 56 8.737 4.312 13.787
415 HG23 VAL 56 3HG2 VAL 56 7.786 5.318 12.694
416 H LEU 57 H LEU 57 4.658 2.885 10.065
417 HA LEU 57 HA LEU 57 4.318 0.095 9.853
418 HB2 LEU 57 1HB LEU 57 4.256 1.989 7.525
419 HB3 LEU 57 2HB LEU 57 3.336 0.503 7.755
420 HG LEU 57 HG LEU 57 2.922 3.073 9.282
421 HD11 LEU 57 1HD1 LEU 57 2.023 3.619 7.262
422 HD12 LEU 57 2HD1 LEU 57 0.650 2.764 7.964
423 HD13 LEU 57 3HD1 LEU 57 1.710 1.940 6.820
424 HD21 LEU 57 1HD2 LEU 57 0.876 0.958 9.268
425 HD22 LEU 57 2HD2 LEU 57 1.408 2.019 10.573
426 HD23 LEU 57 3HD2 LEU 57 2.350 0.584 10.163
427 H GLN 58 H GLN 58 5.803 -1.382 9.414
428 HA GLN 58 HA GLN 58 8.399 -0.783 8.495
429 HB2 GLN 58 1HB GLN 58 6.846 -3.262 9.027
430 HB3 GLN 58 2HB GLN 58 8.284 -3.410 8.025
431 HG2 GLN 58 1HG GLN 58 8.098 -2.444 10.861
432 HG3 GLN 58 2HG GLN 58 8.943 -3.863 10.244
433 HE21 GLN 58 1HE2 GLN 58 9.933 -1.610 11.825
434 HE22 GLN 58 2HE2 GLN 58 11.231 -0.926 10.914
435 H ASP 59 H ASP 59 9.237 -2.321 6.570
436 HA ASP 59 HA ASP 59 7.692 -1.464 4.223
437 HB2 ASP 59 1HB ASP 59 10.510 -2.459 4.045
438 HB3 ASP 59 2HB ASP 59 9.676 -1.281 3.035
439 H TRP 60 H TRP 60 9.170 -4.242 5.767
440 HA TRP 60 HA TRP 60 8.431 -6.003 3.574
441 HB2 TRP 60 1HB TRP 60 9.790 -7.599 4.542
442 HB3 TRP 60 2HB TRP 60 10.564 -6.124 5.114
443 HD1 TRP 60 HD TRP 60 8.277 -8.960 6.356
444 HE1 TRP 60 1HE TRP 60 8.453 -9.076 8.921
445 HE3 TRP 60 3HE TRP 60 11.156 -4.813 7.159
446 HZ2 TRP 60 2HZ TRP 60 9.653 -7.603 11.009
447 HZ3 TRP 60 3HZ TRP 60 11.774 -4.236 9.470
448 HH2 TRP 60 HH TRP 60 11.037 -5.603 11.354
449 H LEU 61 H LEU 61 6.641 -4.565 5.755
450 HA LEU 61 HA LEU 61 5.080 -6.948 6.489
451 HB2 LEU 61 1HB LEU 61 5.527 -4.311 7.769
452 HB3 LEU 61 2HB LEU 61 3.938 -5.047 7.964
453 HG LEU 61 HG LEU 61 5.004 -7.033 8.959
454 HD11 LEU 61 1HD1 LEU 61 7.322 -7.083 9.499
455 HD12 LEU 61 2HD1 LEU 61 7.554 -5.433 8.921
456 HD13 LEU 61 3HD1 LEU 61 7.188 -6.724 7.777
457 HD21 LEU 61 1HD2 LEU 61 4.249 -5.617 10.605
458 HD22 LEU 61 2HD2 LEU 61 5.341 -4.313 10.138
459 HD23 LEU 61 3HD2 LEU 61 5.964 -5.717 11.005
460 H GLY 62 H GLY 62 3.227 -7.305 5.464
461 HA2 GLY 62 1HA GLY 62 2.255 -5.501 3.480
462 HA3 GLY 62 2HA GLY 62 1.488 -6.998 3.986
463 H LEU 63 H LEU 63 -0.019 -4.780 3.362
464 HA LEU 63 HA LEU 63 -0.670 -3.054 5.440
465 HB2 LEU 63 1HB LEU 63 -2.345 -4.208 3.225
466 HB3 LEU 63 2HB LEU 63 -2.950 -2.985 4.340
467 HG LEU 63 HG LEU 63 -0.781 -1.697 3.498
468 HD11 LEU 63 1HD1 LEU 63 0.171 -3.225 2.027
469 HD12 LEU 63 2HD1 LEU 63 -0.717 -2.133 0.965
470 HD13 LEU 63 3HD1 LEU 63 -1.391 -3.713 1.367
471 HD21 LEU 63 1HD2 LEU 63 -3.375 -1.280 3.275
472 HD22 LEU 63 2HD2 LEU 63 -3.065 -1.703 1.591
473 HD23 LEU 63 3HD2 LEU 63 -2.211 -0.348 2.332
474 H GLY 64 H GLY 64 -1.947 -6.283 4.708
475 HA2 GLY 64 1HA GLY 64 -3.903 -6.357 6.728
476 HA3 GLY 64 2HA GLY 64 -3.155 -7.761 5.981
477 H ILE 65 H ILE 65 -0.498 -7.336 6.764
478 HA ILE 65 HA ILE 65 -0.310 -8.641 9.152
479 HB ILE 65 HB ILE 65 1.594 -6.704 7.863
480 HG12 ILE 65 1HG1 ILE 65 2.893 -8.964 7.744
481 HG13 ILE 65 2HG1 ILE 65 1.322 -9.688 8.073
482 HG21 ILE 65 1HG2 ILE 65 1.717 -7.894 10.559
483 HG22 ILE 65 2HG2 ILE 65 3.189 -7.997 9.594
484 HG23 ILE 65 3HG2 ILE 65 2.463 -6.426 9.930
485 HD11 ILE 65 1HD1 ILE 65 0.634 -9.373 5.984
486 HD12 ILE 65 2HD1 ILE 65 1.232 -7.714 5.943
487 HD13 ILE 65 3HD1 ILE 65 2.326 -9.055 5.604
488 H TYR 66 H TYR 66 -0.628 -5.176 8.639
489 HA TYR 66 HA TYR 66 -0.377 -4.624 11.482
490 HB2 TYR 66 1HB TYR 66 -0.621 -2.940 9.015
491 HB3 TYR 66 2HB TYR 66 -0.972 -2.235 10.589
492 HD1 TYR 66 2HD TYR 66 1.016 -3.374 12.344
493 HD2 TYR 66 1HD TYR 66 1.419 -2.122 8.297
494 HE1 TYR 66 2HE TYR 66 3.417 -2.986 12.709
495 HE2 TYR 66 1HE TYR 66 3.821 -1.732 8.651
496 HH TYR 66 HH TYR 66 5.232 -1.589 11.694
497 H GLY 67 H GLY 67 -2.847 -4.553 8.950
498 HA2 GLY 67 1HA GLY 67 -5.112 -5.171 9.428
499 HA3 GLY 67 2HA GLY 67 -4.889 -4.580 11.068
500 H ILE 68 H ILE 68 -3.940 -2.874 8.138
501 HA ILE 68 HA ILE 68 -5.253 -0.494 8.961
502 HB ILE 68 HB ILE 68 -4.057 -1.243 6.292
503 HG12 ILE 68 1HG1 ILE 68 -2.991 0.499 8.524
504 HG13 ILE 68 2HG1 ILE 68 -2.482 -1.156 8.208
505 HG21 ILE 68 1HG2 ILE 68 -4.770 1.520 7.247
506 HG22 ILE 68 2HG2 ILE 68 -4.213 1.037 5.646
507 HG23 ILE 68 3HG2 ILE 68 -5.814 0.554 6.205
508 HD11 ILE 68 1HD1 ILE 68 -1.470 1.238 7.110
509 HD12 ILE 68 2HD1 ILE 68 -0.968 -0.421 6.782
510 HD13 ILE 68 3HD1 ILE 68 -2.228 0.329 5.803
511 H GLN 69 H GLN 69 -7.088 0.503 8.167
512 HA GLN 69 HA GLN 69 -8.961 -1.284 6.781
513 HB2 GLN 69 1HB GLN 69 -9.399 1.110 8.564
514 HB3 GLN 69 2HB GLN 69 -10.691 0.367 7.631
515 HG2 GLN 69 1HG GLN 69 -10.537 -1.653 8.843
516 HG3 GLN 69 2HG GLN 69 -9.012 -1.172 9.585
517 HE21 GLN 69 1HE2 GLN 69 -10.498 -1.920 11.436
518 HE22 GLN 69 2HE2 GLN 69 -11.367 -0.664 12.243
519 H ASP 70 H ASP 70 -10.268 -0.493 5.079
520 HA ASP 70 HA ASP 70 -8.906 1.183 3.247
521 HB2 ASP 70 1HB ASP 70 -10.249 -0.421 2.219
522 HB3 ASP 70 2HB ASP 70 -11.606 -0.120 3.300
523 H SER 71 H SER 71 -9.573 3.205 2.376
524 HA SER 71 HA SER 71 -10.211 5.384 2.523
525 HB2 SER 71 1HB SER 71 -12.504 4.222 4.125
526 HB3 SER 71 2HB SER 71 -12.444 5.860 3.475
527 HG SER 71 HG SER 71 -13.591 4.422 2.106
528 H ASP 72 H ASP 72 -8.408 4.258 4.510
529 HA ASP 72 HA ASP 72 -9.054 5.644 6.982
530 HB2 ASP 72 1HB ASP 72 -7.057 4.617 7.880
531 HB3 ASP 72 2HB ASP 72 -7.980 3.397 7.007
532 H THR 73 H THR 73 -7.136 6.887 7.998
533 HA THR 73 HA THR 73 -6.079 8.740 5.962
534 HB THR 73 HB THR 73 -6.813 9.343 8.834
535 HG1 THR 73 1HG THR 73 -8.409 10.682 7.753
536 HG21 THR 73 1HG2 THR 73 -5.936 11.433 8.609
537 HG22 THR 73 2HG2 THR 73 -6.220 11.484 6.869
538 HG23 THR 73 3HG2 THR 73 -4.849 10.581 7.513
539 H LEU 74 H LEU 74 -3.939 8.980 5.835
540 HA LEU 74 HA LEU 74 -2.292 7.972 8.061
541 HB2 LEU 74 1HB LEU 74 -1.587 7.918 5.133
542 HB3 LEU 74 2HB LEU 74 -0.638 7.250 6.459
543 HG LEU 74 HG LEU 74 -3.388 6.233 5.789
544 HD11 LEU 74 1HD1 LEU 74 -0.896 4.876 4.857
545 HD12 LEU 74 2HD1 LEU 74 -1.629 6.146 3.878
546 HD13 LEU 74 3HD1 LEU 74 -2.554 4.699 4.282
547 HD21 LEU 74 1HD2 LEU 74 -2.772 4.345 7.070
548 HD22 LEU 74 2HD2 LEU 74 -2.290 5.754 8.015
549 HD23 LEU 74 3HD2 LEU 74 -1.079 4.837 7.119
550 H ILE 75 H ILE 75 -0.801 9.314 8.874
551 HA ILE 75 HA ILE 75 -0.668 12.014 7.849
552 HB ILE 75 HB ILE 75 0.658 10.723 10.234
553 HG12 ILE 75 1HG1 ILE 75 -1.792 10.971 10.391
554 HG13 ILE 75 2HG1 ILE 75 -0.957 12.019 11.533
555 HG21 ILE 75 1HG2 ILE 75 1.362 12.922 10.913
556 HG22 ILE 75 2HG2 ILE 75 1.987 12.590 9.299
557 HG23 ILE 75 3HG2 ILE 75 0.589 13.646 9.504
558 HD11 ILE 75 1HD1 ILE 75 -2.892 12.721 9.624
559 HD12 ILE 75 2HD1 ILE 75 -1.991 13.784 10.705
560 HD13 ILE 75 3HD1 ILE 75 -1.370 13.435 9.093
561 H LEU 76 H LEU 76 1.011 12.967 6.822
562 HA LEU 76 HA LEU 76 3.277 11.234 6.104
563 HB2 LEU 76 1HB LEU 76 2.181 11.844 4.136
564 HB3 LEU 76 2HB LEU 76 1.906 13.493 4.693
565 HG LEU 76 HG LEU 76 4.427 13.806 4.512
566 HD11 LEU 76 1HD1 LEU 76 5.537 11.880 4.215
567 HD12 LEU 76 2HD1 LEU 76 5.112 12.101 2.518
568 HD13 LEU 76 3HD1 LEU 76 4.132 11.053 3.543
569 HD21 LEU 76 1HD2 LEU 76 2.367 14.129 2.694
570 HD22 LEU 76 2HD2 LEU 76 3.629 13.318 1.766
571 HD23 LEU 76 3HD2 LEU 76 3.978 14.838 2.590
572 H SER 77 H SER 77 5.201 11.697 6.924
573 HA SER 77 HA SER 77 5.927 14.467 7.479
574 HB2 SER 77 1HB SER 77 6.096 12.286 9.573
575 HB3 SER 77 2HB SER 77 6.721 13.926 9.747
576 HG SER 77 HG SER 77 4.021 13.109 9.488
577 H LYS 78 H LYS 78 7.921 14.864 6.792
578 HA LYS 78 HA LYS 78 9.545 12.806 5.692
579 HB2 LYS 78 1HB LYS 78 11.094 14.556 5.127
580 HB3 LYS 78 2HB LYS 78 9.463 15.152 4.845
581 HG2 LYS 78 1HG LYS 78 9.544 16.341 6.994
582 HG3 LYS 78 2HG LYS 78 11.201 15.777 7.224
583 HD2 LYS 78 1HD LYS 78 10.305 17.401 4.849
584 HD3 LYS 78 2HD LYS 78 10.984 18.109 6.316
585 HE2 LYS 78 1HE LYS 78 12.983 16.601 5.960
586 HE3 LYS 78 2HE LYS 78 12.316 16.241 4.367
587 HZ1 LYS 78 1HZ LYS 78 14.018 18.210 4.789
588 HZ2 LYS 78 2HZ LYS 78 12.582 19.055 5.077
589 HZ3 LYS 78 3HZ LYS 78 12.827 18.286 3.591
590 H LYS 79 H LYS 79 11.650 12.162 6.333
591 HA LYS 79 HA LYS 79 11.920 11.684 9.114
592 HB2 LYS 79 1HB LYS 79 14.064 11.389 7.008
593 HB3 LYS 79 2HB LYS 79 13.975 10.562 8.558
594 HG2 LYS 79 1HG LYS 79 11.666 9.731 7.545
595 HG3 LYS 79 2HG LYS 79 12.524 10.029 6.032
596 HD2 LYS 79 1HD LYS 79 14.203 8.472 6.550
597 HD3 LYS 79 2HD LYS 79 13.755 8.429 8.257
598 HE2 LYS 79 1HE LYS 79 11.800 7.187 7.814
599 HE3 LYS 79 2HE LYS 79 11.888 7.516 6.085
600 HZ1 LYS 79 1HZ LYS 79 12.889 5.552 5.934
601 HZ2 LYS 79 2HZ LYS 79 13.131 5.435 7.604
602 HZ3 LYS 79 3HZ LYS 79 14.246 6.271 6.644
603 H LYS 80 H LYS 80 12.546 13.106 10.587
604 HA LYS 80 HA LYS 80 13.550 15.628 10.165
605 HB2 LYS 80 1HB LYS 80 12.653 14.749 12.322
606 HB3 LYS 80 2HB LYS 80 14.168 13.887 12.559
607 HG2 LYS 80 1HG LYS 80 15.364 16.043 12.536
608 HG3 LYS 80 2HG LYS 80 13.813 16.873 12.391
609 HD2 LYS 80 1HD LYS 80 13.254 15.404 14.528
610 HD3 LYS 80 2HD LYS 80 15.008 15.455 14.715
611 HE2 LYS 80 1HE LYS 80 14.357 17.319 15.904
612 HE3 LYS 80 2HE LYS 80 14.700 18.011 14.319
613 HZ1 LYS 80 1HZ LYS 80 12.368 18.255 15.728
614 HZ2 LYS 80 2HZ LYS 80 11.998 17.120 14.530
615 HZ3 LYS 80 3HZ LYS 80 12.597 18.642 14.097
616 H GLY 81 H GLY 81 15.447 12.730 11.027
617 HA2 GLY 81 1HA GLY 81 17.536 13.048 9.295
618 HA3 GLY 81 2HA GLY 81 17.948 14.092 10.648
619 H SER 82 H SER 82 16.898 10.763 9.954
620 HA SER 82 HA SER 82 17.453 9.514 12.302
621 HB2 SER 82 1HB SER 82 16.552 8.271 10.443
622 HB3 SER 82 2HB SER 82 18.020 8.524 9.499
623 HG SER 82 HG SER 82 17.564 6.813 11.669
624 H GLY 83 H GLY 83 19.831 10.021 9.689
625 HA2 GLY 83 1HA GLY 83 21.988 10.977 10.779
626 HA3 GLY 83 2HA GLY 83 21.975 9.427 11.608
627 HA PRO 84 HA PRO 84 23.925 9.294 7.222
628 HB2 PRO 84 1HB PRO 84 26.538 9.697 7.841
629 HB3 PRO 84 2HB PRO 84 25.443 11.011 7.395
630 HG2 PRO 84 1HG PRO 84 26.332 10.125 10.113
631 HG3 PRO 84 2HG PRO 84 26.163 11.769 9.472
632 HD2 PRO 84 1HD PRO 84 24.302 10.633 11.077
633 HD3 PRO 84 2HD PRO 84 23.883 11.801 9.807
634 H SER 85 H SER 85 24.488 7.313 6.541
635 HA SER 85 HA SER 85 25.071 5.274 8.512
636 HB2 SER 85 1HB SER 85 23.456 4.804 6.724
637 HB3 SER 85 2HB SER 85 24.709 5.067 5.512
638 HG SER 85 HG SER 85 25.245 3.207 7.511
639 H SER 86 H SER 86 27.014 4.470 8.965
640 HA SER 86 HA SER 86 29.325 5.494 7.537
641 HB2 SER 86 1HB SER 86 29.109 5.295 10.096
642 HB3 SER 86 2HB SER 86 29.404 3.573 9.858
643 HG SER 86 HG SER 86 31.124 5.532 8.772
644 H GLY 87 H GLY 87 30.783 4.293 6.376
645 HA2 GLY 87 1HA GLY 87 29.971 2.202 4.820
646 HA3 GLY 87 2HA GLY 87 31.656 2.494 5.229
Start of MODEL 12
1 H1 GLY 1 H GLY 1 -13.409 12.424 -10.725
2 HA2 GLY 1 1HA GLY 1 -12.468 11.333 -8.713
3 HA3 GLY 1 2HA GLY 1 -13.943 10.530 -9.231
4 H SER 2 H SER 2 -10.581 10.225 -8.718
5 HA SER 2 HA SER 2 -10.091 7.930 -10.314
6 HB2 SER 2 1HB SER 2 -8.348 9.490 -9.320
7 HB3 SER 2 2HB SER 2 -8.619 8.671 -7.782
8 HG SER 2 HG SER 2 -7.091 7.901 -9.825
9 H SER 3 H SER 3 -11.738 6.443 -9.961
10 HA SER 3 HA SER 3 -11.886 5.278 -7.263
11 HB2 SER 3 1HB SER 3 -14.048 4.295 -8.038
12 HB3 SER 3 2HB SER 3 -14.040 6.058 -8.048
13 HG SER 3 HG SER 3 -14.847 4.801 -9.991
14 H GLY 4 H GLY 4 -10.833 3.436 -6.966
15 HA2 GLY 4 1HA GLY 4 -9.939 1.883 -9.254
16 HA3 GLY 4 2HA GLY 4 -9.478 1.632 -7.576
17 H SER 5 H SER 5 -9.937 -0.601 -8.840
18 HA SER 5 HA SER 5 -12.689 -1.378 -8.123
19 HB2 SER 5 1HB SER 5 -10.895 -2.315 -10.353
20 HB3 SER 5 2HB SER 5 -12.241 -3.302 -9.785
21 HG SER 5 HG SER 5 -12.754 -0.623 -10.365
22 H SER 6 H SER 6 -9.449 -2.812 -8.546
23 HA SER 6 HA SER 6 -10.044 -4.654 -6.341
24 HB2 SER 6 1HB SER 6 -9.263 -5.589 -8.533
25 HB3 SER 6 2HB SER 6 -7.728 -4.756 -8.288
26 HG SER 6 HG SER 6 -8.484 -7.117 -7.341
27 H GLY 7 H GLY 7 -9.264 -4.223 -4.393
28 HA2 GLY 7 1HA GLY 7 -7.145 -3.911 -3.127
29 HA3 GLY 7 2HA GLY 7 -6.827 -2.561 -4.206
30 H ILE 8 H ILE 8 -6.580 -1.585 -1.956
31 HA ILE 8 HA ILE 8 -9.201 -0.585 -1.046
32 HB ILE 8 HB ILE 8 -8.277 -0.268 1.165
33 HG12 ILE 8 1HG1 ILE 8 -5.733 -1.613 0.275
34 HG13 ILE 8 2HG1 ILE 8 -5.912 0.138 0.229
35 HG21 ILE 8 1HG2 ILE 8 -7.373 -2.891 1.257
36 HG22 ILE 8 2HG2 ILE 8 -9.035 -2.339 1.460
37 HG23 ILE 8 3HG2 ILE 8 -8.464 -2.847 -0.129
38 HD11 ILE 8 1HD1 ILE 8 -6.439 -1.397 2.740
39 HD12 ILE 8 2HD1 ILE 8 -4.803 -0.930 2.274
40 HD13 ILE 8 3HD1 ILE 8 -6.032 0.307 2.539
41 H GLN 9 H GLN 9 -9.281 1.616 -0.311
42 HA GLN 9 HA GLN 9 -7.277 3.310 -1.643
43 HB2 GLN 9 1HB GLN 9 -9.634 3.452 -2.472
44 HB3 GLN 9 2HB GLN 9 -10.108 4.045 -0.886
45 HG2 GLN 9 1HG GLN 9 -8.586 5.960 -1.181
46 HG3 GLN 9 2HG GLN 9 -8.212 5.380 -2.803
47 HE21 GLN 9 1HE2 GLN 9 -10.297 4.897 -4.105
48 HE22 GLN 9 2HE2 GLN 9 -11.485 6.150 -4.069
49 H VAL 10 H VAL 10 -6.004 4.534 -0.424
50 HA VAL 10 HA VAL 10 -6.792 5.014 2.376
51 HB VAL 10 HB VAL 10 -4.376 5.208 2.881
52 HG11 VAL 10 1HG1 VAL 10 -4.474 2.551 1.643
53 HG12 VAL 10 2HG1 VAL 10 -4.255 3.011 3.333
54 HG13 VAL 10 3HG1 VAL 10 -5.875 2.953 2.636
55 HG21 VAL 10 1HG2 VAL 10 -4.101 5.424 0.132
56 HG22 VAL 10 2HG2 VAL 10 -2.797 5.267 1.308
57 HG23 VAL 10 3HG2 VAL 10 -3.441 3.833 0.508
58 H PHE 11 H PHE 11 -6.108 7.027 3.334
59 HA PHE 11 HA PHE 11 -5.858 9.188 1.347
60 HB2 PHE 11 1HB PHE 11 -7.297 9.112 3.998
61 HB3 PHE 11 2HB PHE 11 -6.935 10.618 3.160
62 HD1 PHE 11 1HD PHE 11 -7.778 10.810 0.724
63 HD2 PHE 11 2HD PHE 11 -9.256 7.979 3.539
64 HE1 PHE 11 1HE PHE 11 -9.833 10.565 -0.606
65 HE2 PHE 11 2HE PHE 11 -11.313 7.729 2.212
66 HZ PHE 11 HZ PHE 11 -11.603 9.022 0.136
67 H VAL 12 H VAL 12 -3.772 9.762 1.307
68 HA VAL 12 HA VAL 12 -2.167 9.747 3.722
69 HB VAL 12 HB VAL 12 -1.520 10.394 0.850
70 HG11 VAL 12 1HG1 VAL 12 0.061 10.851 3.329
71 HG12 VAL 12 2HG1 VAL 12 0.902 10.300 1.879
72 HG13 VAL 12 3HG1 VAL 12 -0.018 11.805 1.848
73 HG21 VAL 12 1HG2 VAL 12 -0.736 8.293 0.683
74 HG22 VAL 12 2HG2 VAL 12 -0.056 8.307 2.310
75 HG23 VAL 12 3HG2 VAL 12 -1.774 7.985 2.076
76 H LYS 13 H LYS 13 -2.487 11.393 5.083
77 HA LYS 13 HA LYS 13 -3.217 14.023 4.158
78 HB2 LYS 13 1HB LYS 13 -4.161 13.175 6.236
79 HB3 LYS 13 2HB LYS 13 -2.551 12.989 6.920
80 HG2 LYS 13 1HG LYS 13 -2.231 15.413 6.817
81 HG3 LYS 13 2HG LYS 13 -3.855 15.593 6.150
82 HD2 LYS 13 1HD LYS 13 -4.533 14.240 8.301
83 HD3 LYS 13 2HD LYS 13 -3.000 14.865 8.912
84 HE2 LYS 13 1HE LYS 13 -3.701 17.094 8.701
85 HE3 LYS 13 2HE LYS 13 -5.045 16.661 7.645
86 HZ1 LYS 13 1HZ LYS 13 -4.805 16.235 10.564
87 HZ2 LYS 13 2HZ LYS 13 -5.954 15.417 9.630
88 HZ3 LYS 13 3HZ LYS 13 -5.990 17.105 9.726
89 H ASN 14 H ASN 14 -1.818 15.497 3.483
90 HA ASN 14 HA ASN 14 1.012 15.175 3.956
91 HB2 ASN 14 1HB ASN 14 1.185 17.246 2.534
92 HB3 ASN 14 2HB ASN 14 0.372 15.889 1.759
93 HD21 ASN 14 1HD2 ASN 14 -0.226 17.932 0.466
94 HD22 ASN 14 2HD2 ASN 14 -1.729 18.665 0.899
95 HA PRO 15 HA PRO 15 1.489 17.909 7.357
96 HB2 PRO 15 1HB PRO 15 3.915 19.002 6.821
97 HB3 PRO 15 2HB PRO 15 3.712 17.330 7.358
98 HG2 PRO 15 1HG PRO 15 4.125 18.395 4.590
99 HG3 PRO 15 2HG PRO 15 4.861 16.981 5.366
100 HD2 PRO 15 1HD PRO 15 2.787 16.778 3.638
101 HD3 PRO 15 2HD PRO 15 3.011 15.656 4.995
102 H ASP 16 H ASP 16 2.245 19.333 4.191
103 HA ASP 16 HA ASP 16 2.120 22.022 4.908
104 HB2 ASP 16 1HB ASP 16 2.851 20.971 2.681
105 HB3 ASP 16 2HB ASP 16 1.142 20.985 2.254
106 H GLY 17 H GLY 17 -0.458 19.811 3.903
107 HA2 GLY 17 1HA GLY 17 -2.556 20.381 5.289
108 HA3 GLY 17 2HA GLY 17 -2.430 21.925 4.458
109 H GLY 18 H GLY 18 -3.648 18.765 4.332
110 HA2 GLY 18 1HA GLY 18 -5.450 19.014 2.369
111 HA3 GLY 18 2HA GLY 18 -3.984 18.724 1.446
112 H SER 19 H SER 19 -5.249 16.832 0.710
113 HA SER 19 HA SER 19 -4.373 14.483 2.039
114 HB2 SER 19 1HB SER 19 -6.808 13.603 2.317
115 HB3 SER 19 2HB SER 19 -6.134 14.650 3.566
116 HG SER 19 HG SER 19 -8.249 15.283 2.909
117 H TYR 20 H TYR 20 -3.976 13.071 0.478
118 HA TYR 20 HA TYR 20 -5.458 13.321 -2.049
119 HB2 TYR 20 1HB TYR 20 -2.816 11.925 -1.602
120 HB3 TYR 20 2HB TYR 20 -3.560 12.329 -3.145
121 HD1 TYR 20 2HD TYR 20 -4.384 15.114 -2.722
122 HD2 TYR 20 1HD TYR 20 -0.817 13.114 -1.546
123 HE1 TYR 20 2HE TYR 20 -3.180 17.259 -2.744
124 HE2 TYR 20 1HE TYR 20 0.396 15.253 -1.564
125 HH TYR 20 HH TYR 20 0.044 17.570 -1.495
126 H ALA 21 H ALA 21 -5.452 11.127 -3.296
127 HA ALA 21 HA ALA 21 -6.219 8.972 -1.439
128 HB1 ALA 21 1HB ALA 21 -8.099 8.402 -2.813
129 HB2 ALA 21 2HB ALA 21 -8.201 10.117 -2.412
130 HB3 ALA 21 3HB ALA 21 -7.651 9.617 -4.011
131 H TYR 22 H TYR 22 -5.018 7.223 -1.732
132 HA TYR 22 HA TYR 22 -3.849 6.745 -4.393
133 HB2 TYR 22 1HB TYR 22 -2.838 6.086 -1.630
134 HB3 TYR 22 2HB TYR 22 -2.170 5.339 -3.077
135 HD1 TYR 22 2HD TYR 22 -2.802 8.655 -1.509
136 HD2 TYR 22 1HD TYR 22 -0.478 6.410 -4.277
137 HE1 TYR 22 2HE TYR 22 -1.304 10.583 -1.806
138 HE2 TYR 22 1HE TYR 22 1.028 8.331 -4.580
139 HH TYR 22 HH TYR 22 1.435 10.451 -4.063
140 H ALA 23 H ALA 23 -3.710 4.573 -5.145
141 HA ALA 23 HA ALA 23 -5.661 2.753 -3.889
142 HB1 ALA 23 1HB ALA 23 -6.412 3.771 -6.051
143 HB2 ALA 23 2HB ALA 23 -5.087 2.916 -6.841
144 HB3 ALA 23 3HB ALA 23 -6.368 2.008 -6.038
145 H ILE 24 H ILE 24 -4.865 0.865 -3.250
146 HA ILE 24 HA ILE 24 -2.810 -0.498 -4.742
147 HB ILE 24 HB ILE 24 -1.377 0.930 -3.436
148 HG12 ILE 24 1HG1 ILE 24 -1.351 -1.713 -1.993
149 HG13 ILE 24 2HG1 ILE 24 -0.914 -1.593 -3.694
150 HG21 ILE 24 1HG2 ILE 24 -3.378 0.516 -1.415
151 HG22 ILE 24 2HG2 ILE 24 -1.775 0.154 -0.778
152 HG23 ILE 24 3HG2 ILE 24 -2.103 1.731 -1.495
153 HD11 ILE 24 1HD1 ILE 24 1.125 -0.922 -3.170
154 HD12 ILE 24 2HD1 ILE 24 0.494 0.383 -2.165
155 HD13 ILE 24 3HD1 ILE 24 0.736 -1.222 -1.477
156 H ASN 25 H ASN 25 -2.464 -2.676 -4.021
157 HA ASN 25 HA ASN 25 -4.835 -3.798 -2.793
158 HB2 ASN 25 1HB ASN 25 -2.518 -4.866 -4.338
159 HB3 ASN 25 2HB ASN 25 -3.382 -5.974 -3.275
160 HD21 ASN 25 1HD2 ASN 25 -4.083 -3.461 -5.682
161 HD22 ASN 25 2HD2 ASN 25 -5.357 -4.328 -6.464
162 HA PRO 26 HA PRO 26 -3.163 -4.273 1.251
163 HB2 PRO 26 1HB PRO 26 -4.697 -6.339 2.115
164 HB3 PRO 26 2HB PRO 26 -5.317 -4.694 1.929
165 HG2 PRO 26 1HG PRO 26 -5.579 -7.037 0.085
166 HG3 PRO 26 2HG PRO 26 -6.802 -5.845 0.560
167 HD2 PRO 26 1HD PRO 26 -5.484 -5.718 -1.802
168 HD3 PRO 26 2HD PRO 26 -6.027 -4.268 -0.932
169 H ASN 27 H ASN 27 -2.783 -6.536 -1.211
170 HA ASN 27 HA ASN 27 -1.391 -8.500 0.423
171 HB2 ASN 27 1HB ASN 27 -1.490 -9.924 -1.390
172 HB3 ASN 27 2HB ASN 27 -2.905 -8.920 -1.696
173 HD21 ASN 27 1HD2 ASN 27 0.340 -9.677 -2.662
174 HD22 ASN 27 2HD2 ASN 27 0.303 -8.839 -4.172
175 H SER 28 H SER 28 -0.706 -5.854 -1.731
176 HA SER 28 HA SER 28 2.038 -6.506 -2.181
177 HB2 SER 28 1HB SER 28 0.691 -5.042 -3.691
178 HB3 SER 28 2HB SER 28 0.687 -3.808 -2.431
179 HG SER 28 HG SER 28 3.053 -3.966 -2.554
180 H PHE 29 H PHE 29 3.881 -5.517 -1.296
181 HA PHE 29 HA PHE 29 3.878 -5.176 1.476
182 HB2 PHE 29 1HB PHE 29 5.920 -4.257 -0.558
183 HB3 PHE 29 2HB PHE 29 6.195 -4.333 1.179
184 HD1 PHE 29 2HD PHE 29 5.490 -6.744 2.195
185 HD2 PHE 29 1HD PHE 29 6.791 -5.974 -1.784
186 HE1 PHE 29 2HE PHE 29 6.206 -9.088 1.979
187 HE2 PHE 29 1HE PHE 29 7.508 -8.317 -2.007
188 HZ PHE 29 HZ PHE 29 7.217 -9.877 -0.123
189 H ILE 30 H ILE 30 4.473 -3.263 2.717
190 HA ILE 30 HA ILE 30 2.744 -1.120 2.324
191 HB ILE 30 HB ILE 30 5.227 -1.395 3.997
192 HG12 ILE 30 1HG1 ILE 30 3.044 -2.600 4.533
193 HG13 ILE 30 2HG1 ILE 30 3.725 -1.607 5.818
194 HG21 ILE 30 1HG2 ILE 30 5.337 0.871 3.789
195 HG22 ILE 30 2HG2 ILE 30 3.619 1.034 3.431
196 HG23 ILE 30 3HG2 ILE 30 4.152 0.766 5.090
197 HD11 ILE 30 1HD1 ILE 30 2.033 -0.100 5.734
198 HD12 ILE 30 2HD1 ILE 30 1.745 -0.349 4.012
199 HD13 ILE 30 3HD1 ILE 30 1.164 -1.532 5.183
200 H LEU 31 H LEU 31 6.064 -1.577 1.284
201 HA LEU 31 HA LEU 31 6.746 1.023 0.593
202 HB2 LEU 31 1HB LEU 31 8.324 -0.831 0.570
203 HB3 LEU 31 2HB LEU 31 7.482 -1.547 -0.803
204 HG LEU 31 HG LEU 31 8.099 0.800 -1.899
205 HD11 LEU 31 1HD1 LEU 31 9.185 1.493 0.289
206 HD12 LEU 31 2HD1 LEU 31 10.146 1.697 -1.174
207 HD13 LEU 31 3HD1 LEU 31 10.458 0.335 -0.098
208 HD21 LEU 31 1HD2 LEU 31 10.473 -0.645 -2.178
209 HD22 LEU 31 2HD2 LEU 31 9.050 -0.713 -3.218
210 HD23 LEU 31 3HD2 LEU 31 9.221 -1.851 -1.881
211 H GLY 32 H GLY 32 4.763 -1.321 -1.116
212 HA2 GLY 32 1HA GLY 32 4.638 -0.201 -3.640
213 HA3 GLY 32 2HA GLY 32 3.308 -1.057 -2.874
214 H LEU 33 H LEU 33 3.348 1.041 -0.684
215 HA LEU 33 HA LEU 33 1.546 2.874 -2.042
216 HB2 LEU 33 1HB LEU 33 0.723 1.972 -0.006
217 HB3 LEU 33 2HB LEU 33 2.206 2.386 0.852
218 HG LEU 33 HG LEU 33 1.645 4.744 0.740
219 HD11 LEU 33 1HD1 LEU 33 -0.721 3.784 -0.849
220 HD12 LEU 33 2HD1 LEU 33 0.519 4.941 -1.331
221 HD13 LEU 33 3HD1 LEU 33 -0.651 5.372 -0.085
222 HD21 LEU 33 1HD2 LEU 33 0.136 2.750 2.127
223 HD22 LEU 33 2HD2 LEU 33 -0.906 4.124 1.756
224 HD23 LEU 33 3HD2 LEU 33 0.592 4.370 2.655
225 H LYS 34 H LYS 34 4.577 2.950 -0.235
226 HA LYS 34 HA LYS 34 4.876 5.753 -0.164
227 HB2 LYS 34 1HB LYS 34 6.698 3.415 0.182
228 HB3 LYS 34 2HB LYS 34 7.417 5.004 -0.042
229 HG2 LYS 34 1HG LYS 34 7.283 4.803 2.258
230 HG3 LYS 34 2HG LYS 34 5.844 5.743 1.859
231 HD2 LYS 34 1HD LYS 34 5.598 2.782 1.929
232 HD3 LYS 34 2HD LYS 34 5.746 3.635 3.467
233 HE2 LYS 34 1HE LYS 34 3.892 5.174 2.379
234 HE3 LYS 34 2HE LYS 34 3.568 3.717 1.441
235 HZ1 LYS 34 1HZ LYS 34 3.861 3.281 4.282
236 HZ2 LYS 34 2HZ LYS 34 2.701 2.680 3.208
237 HZ3 LYS 34 3HZ LYS 34 2.527 4.232 3.859
238 H GLN 35 H GLN 35 6.270 3.322 -2.365
239 HA GLN 35 HA GLN 35 7.752 4.911 -4.016
240 HB2 GLN 35 1HB GLN 35 7.418 2.393 -4.134
241 HB3 GLN 35 2HB GLN 35 5.967 2.722 -5.072
242 HG2 GLN 35 1HG GLN 35 7.630 2.277 -6.650
243 HG3 GLN 35 2HG GLN 35 7.457 4.031 -6.648
244 HE21 GLN 35 1HE2 GLN 35 9.320 5.029 -6.804
245 HE22 GLN 35 2HE2 GLN 35 10.819 4.516 -6.115
246 H GLN 36 H GLN 36 4.256 4.359 -4.184
247 HA GLN 36 HA GLN 36 3.779 5.839 -6.524
248 HB2 GLN 36 1HB GLN 36 2.062 5.039 -4.194
249 HB3 GLN 36 2HB GLN 36 1.424 6.076 -5.463
250 HG2 GLN 36 1HG GLN 36 2.167 4.281 -7.095
251 HG3 GLN 36 2HG GLN 36 2.395 3.248 -5.685
252 HE21 GLN 36 1HE2 GLN 36 0.604 2.570 -4.512
253 HE22 GLN 36 2HE2 GLN 36 -1.002 2.673 -5.142
254 H ILE 37 H ILE 37 4.092 6.792 -3.166
255 HA ILE 37 HA ILE 37 3.132 9.460 -3.548
256 HB ILE 37 HB ILE 37 4.822 8.337 -1.310
257 HG12 ILE 37 1HG1 ILE 37 1.874 8.898 -1.176
258 HG13 ILE 37 2HG1 ILE 37 2.461 7.366 -1.815
259 HG21 ILE 37 1HG2 ILE 37 4.787 10.860 -1.667
260 HG22 ILE 37 2HG2 ILE 37 3.087 10.785 -1.205
261 HG23 ILE 37 3HG2 ILE 37 4.333 10.269 -0.069
262 HD11 ILE 37 1HD1 ILE 37 3.573 8.201 0.781
263 HD12 ILE 37 2HD1 ILE 37 1.865 7.763 0.757
264 HD13 ILE 37 3HD1 ILE 37 3.079 6.607 0.210
265 H GLU 38 H GLU 38 6.248 7.878 -3.713
266 HA GLU 38 HA GLU 38 7.746 10.335 -3.796
267 HB2 GLU 38 1HB GLU 38 8.858 8.422 -2.890
268 HB3 GLU 38 2HB GLU 38 8.489 7.457 -4.312
269 HG2 GLU 38 1HG GLU 38 9.884 9.324 -5.530
270 HG3 GLU 38 2HG GLU 38 10.565 9.543 -3.919
271 H ASP 39 H ASP 39 6.309 8.142 -6.095
272 HA ASP 39 HA ASP 39 7.659 9.355 -8.357
273 HB2 ASP 39 1HB ASP 39 5.565 7.193 -8.125
274 HB3 ASP 39 2HB ASP 39 6.140 7.805 -9.674
275 H GLN 40 H GLN 40 4.868 9.916 -6.511
276 HA GLN 40 HA GLN 40 3.558 11.391 -8.681
277 HB2 GLN 40 1HB GLN 40 2.588 10.456 -5.984
278 HB3 GLN 40 2HB GLN 40 1.671 11.576 -6.984
279 HG2 GLN 40 1HG GLN 40 2.580 8.975 -8.126
280 HG3 GLN 40 2HG GLN 40 1.170 9.030 -7.070
281 HE21 GLN 40 1HE2 GLN 40 -0.582 8.920 -8.272
282 HE22 GLN 40 2HE2 GLN 40 -0.878 9.807 -9.725
283 H GLN 41 H GLN 41 4.700 11.793 -5.347
284 HA GLN 41 HA GLN 41 4.309 14.674 -5.514
285 HB2 GLN 41 1HB GLN 41 5.378 12.987 -3.244
286 HB3 GLN 41 2HB GLN 41 4.976 14.697 -3.157
287 HG2 GLN 41 1HG GLN 41 2.626 14.104 -3.718
288 HG3 GLN 41 2HG GLN 41 3.080 12.405 -3.599
289 HE21 GLN 41 1HE2 GLN 41 1.162 12.924 -2.003
290 HE22 GLN 41 2HE2 GLN 41 1.660 13.172 -0.367
291 H GLY 42 H GLY 42 6.817 12.327 -5.836
292 HA2 GLY 42 1HA GLY 42 8.907 12.755 -6.826
293 HA3 GLY 42 2HA GLY 42 8.708 14.461 -6.458
294 H LEU 43 H LEU 43 7.915 13.607 -3.638
295 HA LEU 43 HA LEU 43 10.453 13.977 -2.458
296 HB2 LEU 43 1HB LEU 43 7.960 14.336 -1.593
297 HB3 LEU 43 2HB LEU 43 8.263 12.756 -0.873
298 HG LEU 43 HG LEU 43 10.258 14.919 -0.420
299 HD11 LEU 43 1HD1 LEU 43 9.036 15.958 1.288
300 HD12 LEU 43 2HD1 LEU 43 7.785 14.715 1.269
301 HD13 LEU 43 3HD1 LEU 43 7.915 15.855 -0.070
302 HD21 LEU 43 1HD2 LEU 43 10.201 12.391 0.371
303 HD22 LEU 43 2HD2 LEU 43 9.216 13.077 1.663
304 HD23 LEU 43 3HD2 LEU 43 10.855 13.672 1.391
305 HA PRO 44 HA PRO 44 12.034 9.863 -2.404
306 HB2 PRO 44 1HB PRO 44 13.858 10.160 -0.415
307 HB3 PRO 44 2HB PRO 44 14.088 10.825 -2.036
308 HG2 PRO 44 1HG PRO 44 13.148 12.192 0.455
309 HG3 PRO 44 2HG PRO 44 14.295 12.764 -0.770
310 HD2 PRO 44 1HD PRO 44 11.713 13.576 -0.700
311 HD3 PRO 44 2HD PRO 44 12.621 13.411 -2.217
312 H LYS 45 H LYS 45 12.350 8.027 -0.921
313 HA LYS 45 HA LYS 45 10.128 7.790 0.885
314 HB2 LYS 45 1HB LYS 45 12.362 5.847 0.269
315 HB3 LYS 45 2HB LYS 45 10.902 5.469 1.174
316 HG2 LYS 45 1HG LYS 45 9.554 5.963 -0.812
317 HG3 LYS 45 2HG LYS 45 11.031 6.306 -1.717
318 HD2 LYS 45 1HD LYS 45 10.531 3.670 -0.352
319 HD3 LYS 45 2HD LYS 45 10.038 3.992 -2.016
320 HE2 LYS 45 1HE LYS 45 12.846 4.589 -1.243
321 HE3 LYS 45 2HE LYS 45 12.380 2.899 -1.432
322 HZ1 LYS 45 1HZ LYS 45 12.397 5.046 -3.456
323 HZ2 LYS 45 2HZ LYS 45 11.424 3.677 -3.662
324 HZ3 LYS 45 3HZ LYS 45 13.103 3.510 -3.531
325 H LYS 46 H LYS 46 13.663 7.511 1.250
326 HA LYS 46 HA LYS 46 13.899 7.073 3.922
327 HB2 LYS 46 1HB LYS 46 16.064 8.077 3.834
328 HB3 LYS 46 2HB LYS 46 15.772 7.336 2.266
329 HG2 LYS 46 1HG LYS 46 14.996 9.658 1.522
330 HG3 LYS 46 2HG LYS 46 15.774 10.242 2.995
331 HD2 LYS 46 1HD LYS 46 17.883 9.195 2.265
332 HD3 LYS 46 2HD LYS 46 17.094 8.683 0.772
333 HE2 LYS 46 1HE LYS 46 18.168 10.636 0.138
334 HE3 LYS 46 2HE LYS 46 16.532 11.191 0.490
335 HZ1 LYS 46 1HZ LYS 46 17.209 12.113 2.512
336 HZ2 LYS 46 2HZ LYS 46 18.436 12.544 1.430
337 HZ3 LYS 46 3HZ LYS 46 18.679 11.276 2.522
338 H GLN 47 H GLN 47 12.649 9.897 2.405
339 HA GLN 47 HA GLN 47 12.858 11.480 4.850
340 HB2 GLN 47 1HB GLN 47 11.951 12.137 2.051
341 HB3 GLN 47 2HB GLN 47 11.767 13.258 3.394
342 HG2 GLN 47 1HG GLN 47 14.440 12.088 2.749
343 HG3 GLN 47 2HG GLN 47 13.815 13.466 1.844
344 HE21 GLN 47 1HE2 GLN 47 16.059 13.948 3.079
345 HE22 GLN 47 2HE2 GLN 47 15.837 14.875 4.520
346 H GLN 48 H GLN 48 10.276 10.675 2.520
347 HA GLN 48 HA GLN 48 8.120 11.461 4.067
348 HB2 GLN 48 1HB GLN 48 6.790 10.448 2.497
349 HB3 GLN 48 2HB GLN 48 8.298 10.540 1.598
350 HG2 GLN 48 1HG GLN 48 8.791 8.211 2.306
351 HG3 GLN 48 2HG GLN 48 7.189 8.143 3.037
352 HE21 GLN 48 1HE2 GLN 48 8.822 8.822 -0.027
353 HE22 GLN 48 2HE2 GLN 48 7.582 8.166 -1.035
354 H GLN 49 H GLN 49 7.509 10.826 6.017
355 HA GLN 49 HA GLN 49 7.790 7.982 6.723
356 HB2 GLN 49 1HB GLN 49 9.490 9.400 7.868
357 HB3 GLN 49 2HB GLN 49 8.180 10.307 8.614
358 HG2 GLN 49 1HG GLN 49 7.407 8.257 9.716
359 HG3 GLN 49 2HG GLN 49 8.756 7.378 8.998
360 HE21 GLN 49 1HE2 GLN 49 8.523 7.293 11.652
361 HE22 GLN 49 2HE2 GLN 49 9.730 8.264 12.417
362 H LEU 50 H LEU 50 5.832 7.134 6.912
363 HA LEU 50 HA LEU 50 3.604 8.828 7.776
364 HB2 LEU 50 1HB LEU 50 3.510 6.028 6.670
365 HB3 LEU 50 2HB LEU 50 2.153 7.130 6.892
366 HG LEU 50 HG LEU 50 4.398 7.827 5.034
367 HD11 LEU 50 1HD1 LEU 50 3.054 6.835 3.207
368 HD12 LEU 50 2HD1 LEU 50 2.017 6.085 4.419
369 HD13 LEU 50 3HD1 LEU 50 3.719 5.636 4.315
370 HD21 LEU 50 1HD2 LEU 50 2.939 9.632 5.456
371 HD22 LEU 50 2HD2 LEU 50 1.509 8.607 5.333
372 HD23 LEU 50 3HD2 LEU 50 2.454 8.980 3.891
373 H GLU 51 H GLU 51 1.988 7.863 9.250
374 HA GLU 51 HA GLU 51 2.934 5.765 11.016
375 HB2 GLU 51 1HB GLU 51 2.549 8.613 11.930
376 HB3 GLU 51 2HB GLU 51 2.524 7.248 13.038
377 HG2 GLU 51 1HG GLU 51 4.827 6.683 11.992
378 HG3 GLU 51 2HG GLU 51 4.802 8.366 11.468
379 H PHE 52 H PHE 52 1.301 4.895 12.354
380 HA PHE 52 HA PHE 52 -1.412 5.923 11.953
381 HB2 PHE 52 1HB PHE 52 -0.856 4.077 10.284
382 HB3 PHE 52 2HB PHE 52 -0.789 2.986 11.664
383 HD1 PHE 52 2HD PHE 52 -3.120 5.769 10.823
384 HD2 PHE 52 1HD PHE 52 -2.627 1.607 11.566
385 HE1 PHE 52 2HE PHE 52 -5.557 5.460 10.691
386 HE2 PHE 52 1HE PHE 52 -5.064 1.291 11.434
387 HZ PHE 52 HZ PHE 52 -6.532 3.220 10.998
388 H GLN 53 H GLN 53 -2.194 6.281 13.915
389 HA GLN 53 HA GLN 53 -2.681 6.073 16.127
390 HB2 GLN 53 1HB GLN 53 -2.260 3.138 15.537
391 HB3 GLN 53 2HB GLN 53 -3.027 3.780 16.984
392 HG2 GLN 53 1HG GLN 53 -4.029 4.012 14.157
393 HG3 GLN 53 2HG GLN 53 -4.707 3.020 15.447
394 HE21 GLN 53 1HE2 GLN 53 -5.192 5.737 13.763
395 HE22 GLN 53 2HE2 GLN 53 -6.059 6.677 14.924
396 H GLY 54 H GLY 54 -0.090 6.829 15.638
397 HA2 GLY 54 1HA GLY 54 1.889 7.105 16.773
398 HA3 GLY 54 2HA GLY 54 1.173 6.190 18.092
399 H GLN 55 H GLN 55 1.869 5.215 14.749
400 HA GLN 55 HA GLN 55 3.905 3.360 15.743
401 HB2 GLN 55 1HB GLN 55 1.680 2.514 13.882
402 HB3 GLN 55 2HB GLN 55 2.968 1.496 14.514
403 HG2 GLN 55 1HG GLN 55 2.031 2.076 16.825
404 HG3 GLN 55 2HG GLN 55 0.607 2.643 15.954
405 HE21 GLN 55 1HE2 GLN 55 -0.224 1.021 14.300
406 HE22 GLN 55 2HE2 GLN 55 -0.310 -0.623 14.825
407 H VAL 56 H VAL 56 5.236 2.439 13.999
408 HA VAL 56 HA VAL 56 5.432 4.306 11.726
409 HB VAL 56 HB VAL 56 7.656 2.723 13.022
410 HG11 VAL 56 1HG1 VAL 56 9.050 3.385 11.382
411 HG12 VAL 56 2HG1 VAL 56 7.563 3.535 10.444
412 HG13 VAL 56 3HG1 VAL 56 8.270 4.957 11.211
413 HG21 VAL 56 1HG2 VAL 56 7.550 5.697 13.025
414 HG22 VAL 56 2HG2 VAL 56 6.546 4.819 14.179
415 HG23 VAL 56 3HG2 VAL 56 8.294 4.592 14.181
416 H LEU 57 H LEU 57 4.735 3.405 9.908
417 HA LEU 57 HA LEU 57 4.657 0.551 9.553
418 HB2 LEU 57 1HB LEU 57 4.145 2.592 7.414
419 HB3 LEU 57 2HB LEU 57 3.479 0.967 7.565
420 HG LEU 57 HG LEU 57 2.787 3.297 9.353
421 HD11 LEU 57 1HD1 LEU 57 0.622 2.277 7.777
422 HD12 LEU 57 2HD1 LEU 57 1.953 2.766 6.728
423 HD13 LEU 57 3HD1 LEU 57 1.262 3.919 7.870
424 HD21 LEU 57 1HD2 LEU 57 2.628 0.691 10.003
425 HD22 LEU 57 2HD2 LEU 57 1.081 0.897 9.181
426 HD23 LEU 57 3HD2 LEU 57 1.485 1.910 10.567
427 H GLN 58 H GLN 58 6.100 -0.701 8.551
428 HA GLN 58 HA GLN 58 8.564 0.463 7.614
429 HB2 GLN 58 1HB GLN 58 7.579 -2.367 7.909
430 HB3 GLN 58 2HB GLN 58 9.121 -1.994 7.150
431 HG2 GLN 58 1HG GLN 58 8.321 -1.273 9.961
432 HG3 GLN 58 2HG GLN 58 9.389 -2.596 9.494
433 HE21 GLN 58 1HE2 GLN 58 9.673 0.009 11.062
434 HE22 GLN 58 2HE2 GLN 58 11.108 0.718 10.412
435 H ASP 59 H ASP 59 9.444 -0.951 5.559
436 HA ASP 59 HA ASP 59 7.542 -0.314 3.406
437 HB2 ASP 59 1HB ASP 59 10.526 -0.647 3.103
438 HB3 ASP 59 2HB ASP 59 9.399 0.100 1.974
439 H TRP 60 H TRP 60 9.452 -2.819 4.840
440 HA TRP 60 HA TRP 60 9.146 -4.629 2.600
441 HB2 TRP 60 1HB TRP 60 10.568 -6.078 3.735
442 HB3 TRP 60 2HB TRP 60 11.119 -4.504 4.303
443 HD1 TRP 60 HD TRP 60 8.884 -7.435 5.486
444 HE1 TRP 60 1HE TRP 60 8.946 -7.494 8.059
445 HE3 TRP 60 3HE TRP 60 11.668 -3.230 6.328
446 HZ2 TRP 60 2HZ TRP 60 10.031 -5.961 10.166
447 HZ3 TRP 60 3HZ TRP 60 12.173 -2.596 8.651
448 HH2 TRP 60 HH TRP 60 11.370 -3.934 10.529
449 H LEU 61 H LEU 61 7.631 -3.998 5.685
450 HA LEU 61 HA LEU 61 6.187 -6.403 5.939
451 HB2 LEU 61 1HB LEU 61 5.428 -3.656 6.921
452 HB3 LEU 61 2HB LEU 61 4.776 -5.187 7.502
453 HG LEU 61 HG LEU 61 7.663 -4.362 7.781
454 HD11 LEU 61 1HD1 LEU 61 5.908 -4.482 10.144
455 HD12 LEU 61 2HD1 LEU 61 5.646 -3.121 9.054
456 HD13 LEU 61 3HD1 LEU 61 7.237 -3.386 9.766
457 HD21 LEU 61 1HD2 LEU 61 7.102 -6.810 7.773
458 HD22 LEU 61 2HD2 LEU 61 6.130 -6.521 9.217
459 HD23 LEU 61 3HD2 LEU 61 7.869 -6.221 9.248
460 H GLY 62 H GLY 62 3.594 -6.067 6.099
461 HA2 GLY 62 1HA GLY 62 2.769 -5.060 3.445
462 HA3 GLY 62 2HA GLY 62 2.150 -6.556 4.128
463 H LEU 63 H LEU 63 0.413 -4.622 3.270
464 HA LEU 63 HA LEU 63 -0.392 -2.791 5.261
465 HB2 LEU 63 1HB LEU 63 -1.775 -4.019 2.899
466 HB3 LEU 63 2HB LEU 63 -2.621 -2.925 3.992
467 HG LEU 63 HG LEU 63 -0.915 -1.185 3.458
468 HD11 LEU 63 1HD1 LEU 63 0.909 -2.595 2.750
469 HD12 LEU 63 2HD1 LEU 63 0.446 -1.523 1.428
470 HD13 LEU 63 3HD1 LEU 63 -0.049 -3.215 1.405
471 HD21 LEU 63 1HD2 LEU 63 -3.106 -2.093 1.934
472 HD22 LEU 63 2HD2 LEU 63 -1.847 -1.620 0.793
473 HD23 LEU 63 3HD2 LEU 63 -2.423 -0.468 1.999
474 H GLY 64 H GLY 64 -1.185 -6.157 4.649
475 HA2 GLY 64 1HA GLY 64 -3.384 -6.303 6.449
476 HA3 GLY 64 2HA GLY 64 -2.474 -7.666 5.813
477 H ILE 65 H ILE 65 0.070 -7.004 6.794
478 HA ILE 65 HA ILE 65 0.240 -8.257 9.176
479 HB ILE 65 HB ILE 65 1.938 -5.878 8.414
480 HG12 ILE 65 1HG1 ILE 65 2.234 -7.293 6.610
481 HG13 ILE 65 2HG1 ILE 65 3.474 -7.896 7.705
482 HG21 ILE 65 1HG2 ILE 65 1.931 -7.547 10.724
483 HG22 ILE 65 2HG2 ILE 65 3.400 -7.857 9.800
484 HG23 ILE 65 3HG2 ILE 65 3.017 -6.217 10.322
485 HD11 ILE 65 1HD1 ILE 65 1.842 -9.628 8.458
486 HD12 ILE 65 2HD1 ILE 65 0.771 -9.088 7.165
487 HD13 ILE 65 3HD1 ILE 65 2.352 -9.765 6.776
488 H TYR 66 H TYR 66 -0.313 -4.780 8.748
489 HA TYR 66 HA TYR 66 -0.512 -4.324 11.588
490 HB2 TYR 66 1HB TYR 66 -0.853 -2.599 9.150
491 HB3 TYR 66 2HB TYR 66 -1.326 -2.014 10.742
492 HD1 TYR 66 2HD TYR 66 0.467 -2.041 12.583
493 HD2 TYR 66 1HD TYR 66 1.367 -2.433 8.444
494 HE1 TYR 66 2HE TYR 66 2.790 -1.370 13.031
495 HE2 TYR 66 1HE TYR 66 3.693 -1.764 8.880
496 HH TYR 66 HH TYR 66 5.247 -1.468 10.521
497 H GLY 67 H GLY 67 -2.739 -4.460 8.832
498 HA2 GLY 67 1HA GLY 67 -4.917 -5.464 9.116
499 HA3 GLY 67 2HA GLY 67 -4.936 -4.843 10.760
500 H ILE 68 H ILE 68 -3.813 -2.813 8.187
501 HA ILE 68 HA ILE 68 -5.563 -0.723 8.761
502 HB ILE 68 HB ILE 68 -4.146 -1.270 6.150
503 HG12 ILE 68 1HG1 ILE 68 -3.271 0.549 8.394
504 HG13 ILE 68 2HG1 ILE 68 -2.746 -1.127 8.274
505 HG21 ILE 68 1HG2 ILE 68 -5.292 1.294 7.250
506 HG22 ILE 68 2HG2 ILE 68 -4.364 1.134 5.759
507 HG23 ILE 68 3HG2 ILE 68 -5.942 0.360 5.902
508 HD11 ILE 68 1HD1 ILE 68 -2.114 -0.285 5.814
509 HD12 ILE 68 2HD1 ILE 68 -1.946 1.229 6.703
510 HD13 ILE 68 3HD1 ILE 68 -1.016 -0.188 7.190
511 H GLN 69 H GLN 69 -7.418 0.064 7.760
512 HA GLN 69 HA GLN 69 -8.865 -1.900 6.107
513 HB2 GLN 69 1HB GLN 69 -9.793 -0.081 8.303
514 HB3 GLN 69 2HB GLN 69 -10.921 -0.614 7.064
515 HG2 GLN 69 1HG GLN 69 -9.267 -2.548 8.651
516 HG3 GLN 69 2HG GLN 69 -10.827 -1.954 9.218
517 HE21 GLN 69 1HE2 GLN 69 -11.500 -4.171 9.153
518 HE22 GLN 69 2HE2 GLN 69 -12.000 -4.878 7.658
519 H ASP 70 H ASP 70 -10.485 -0.969 4.628
520 HA ASP 70 HA ASP 70 -9.353 0.969 2.945
521 HB2 ASP 70 1HB ASP 70 -11.404 0.849 1.675
522 HB3 ASP 70 2HB ASP 70 -10.992 -0.770 2.233
523 H SER 71 H SER 71 -9.788 3.124 2.596
524 HA SER 71 HA SER 71 -10.436 5.261 3.048
525 HB2 SER 71 1HB SER 71 -12.744 4.074 3.159
526 HB3 SER 71 2HB SER 71 -12.574 4.248 4.906
527 HG SER 71 HG SER 71 -13.335 6.175 4.575
528 H ASP 72 H ASP 72 -8.330 4.279 4.458
529 HA ASP 72 HA ASP 72 -8.737 5.039 7.254
530 HB2 ASP 72 1HB ASP 72 -6.741 3.918 7.759
531 HB3 ASP 72 2HB ASP 72 -7.468 2.923 6.500
532 H THR 73 H THR 73 -6.697 6.210 8.196
533 HA THR 73 HA THR 73 -5.999 8.436 6.395
534 HB THR 73 HB THR 73 -6.579 8.655 9.356
535 HG1 THR 73 1HG THR 73 -8.075 9.403 7.051
536 HG21 THR 73 1HG2 THR 73 -4.926 10.273 8.724
537 HG22 THR 73 2HG2 THR 73 -6.472 11.109 8.871
538 HG23 THR 73 3HG2 THR 73 -5.833 10.710 7.277
539 H LEU 74 H LEU 74 -3.895 8.907 6.240
540 HA LEU 74 HA LEU 74 -2.069 7.876 8.304
541 HB2 LEU 74 1HB LEU 74 -1.531 7.851 5.339
542 HB3 LEU 74 2HB LEU 74 -0.475 7.236 6.609
543 HG LEU 74 HG LEU 74 -3.200 6.080 6.064
544 HD11 LEU 74 1HD1 LEU 74 -0.569 5.516 4.756
545 HD12 LEU 74 2HD1 LEU 74 -2.167 5.684 4.029
546 HD13 LEU 74 3HD1 LEU 74 -1.768 4.238 4.957
547 HD21 LEU 74 1HD2 LEU 74 -0.863 5.392 7.770
548 HD22 LEU 74 2HD2 LEU 74 -1.814 4.078 7.078
549 HD23 LEU 74 3HD2 LEU 74 -2.589 5.277 8.114
550 H ILE 75 H ILE 75 -0.797 9.391 9.133
551 HA ILE 75 HA ILE 75 -0.762 12.039 7.985
552 HB ILE 75 HB ILE 75 0.840 11.122 10.364
553 HG12 ILE 75 1HG1 ILE 75 -1.471 10.425 10.727
554 HG13 ILE 75 2HG1 ILE 75 -1.082 11.794 11.762
555 HG21 ILE 75 1HG2 ILE 75 1.451 13.297 9.614
556 HG22 ILE 75 2HG2 ILE 75 -0.236 13.782 9.454
557 HG23 ILE 75 3HG2 ILE 75 0.453 13.501 11.053
558 HD11 ILE 75 1HD1 ILE 75 -2.784 11.744 9.297
559 HD12 ILE 75 2HD1 ILE 75 -3.225 12.225 10.936
560 HD13 ILE 75 3HD1 ILE 75 -2.153 13.245 9.976
561 H LEU 76 H LEU 76 0.917 13.064 7.010
562 HA LEU 76 HA LEU 76 3.337 11.459 6.511
563 HB2 LEU 76 1HB LEU 76 2.147 11.688 4.471
564 HB3 LEU 76 2HB LEU 76 1.874 13.407 4.748
565 HG LEU 76 HG LEU 76 4.518 13.477 4.636
566 HD11 LEU 76 1HD1 LEU 76 4.219 10.833 4.208
567 HD12 LEU 76 2HD1 LEU 76 5.571 11.784 3.594
568 HD13 LEU 76 3HD1 LEU 76 4.197 11.428 2.548
569 HD21 LEU 76 1HD2 LEU 76 3.488 13.208 1.932
570 HD22 LEU 76 2HD2 LEU 76 4.126 14.626 2.766
571 HD23 LEU 76 3HD2 LEU 76 2.434 14.170 2.969
572 H SER 77 H SER 77 5.208 12.276 7.185
573 HA SER 77 HA SER 77 5.529 15.166 7.449
574 HB2 SER 77 1HB SER 77 5.921 13.207 9.721
575 HB3 SER 77 2HB SER 77 6.524 14.864 9.738
576 HG SER 77 HG SER 77 3.867 13.937 9.780
577 H LYS 78 H LYS 78 7.469 15.815 6.772
578 HA LYS 78 HA LYS 78 9.362 13.896 5.809
579 HB2 LYS 78 1HB LYS 78 10.681 15.880 5.145
580 HB3 LYS 78 2HB LYS 78 9.015 15.962 4.588
581 HG2 LYS 78 1HG LYS 78 8.468 17.657 6.048
582 HG3 LYS 78 2HG LYS 78 9.775 17.260 7.165
583 HD2 LYS 78 1HD LYS 78 10.386 19.283 6.076
584 HD3 LYS 78 2HD LYS 78 11.384 18.004 5.379
585 HE2 LYS 78 1HE LYS 78 10.286 18.061 3.363
586 HE3 LYS 78 2HE LYS 78 8.794 18.677 4.072
587 HZ1 LYS 78 1HZ LYS 78 11.110 20.432 4.210
588 HZ2 LYS 78 2HZ LYS 78 9.487 20.802 3.908
589 HZ3 LYS 78 3HZ LYS 78 10.458 20.182 2.669
590 H LYS 79 H LYS 79 11.590 13.751 6.427
591 HA LYS 79 HA LYS 79 11.940 13.737 9.273
592 HB2 LYS 79 1HB LYS 79 14.006 13.213 7.131
593 HB3 LYS 79 2HB LYS 79 14.095 12.734 8.821
594 HG2 LYS 79 1HG LYS 79 11.784 11.764 7.237
595 HG3 LYS 79 2HG LYS 79 13.367 11.054 6.911
596 HD2 LYS 79 1HD LYS 79 13.531 10.735 9.450
597 HD3 LYS 79 2HD LYS 79 11.794 11.050 9.471
598 HE2 LYS 79 1HE LYS 79 11.898 8.737 9.330
599 HE3 LYS 79 2HE LYS 79 11.678 9.221 7.649
600 HZ1 LYS 79 1HZ LYS 79 13.409 7.809 7.394
601 HZ2 LYS 79 2HZ LYS 79 14.010 8.053 8.956
602 HZ3 LYS 79 3HZ LYS 79 14.306 9.199 7.748
603 H LYS 80 H LYS 80 13.687 14.784 10.410
604 HA LYS 80 HA LYS 80 13.874 17.549 9.819
605 HB2 LYS 80 1HB LYS 80 15.076 15.733 11.870
606 HB3 LYS 80 2HB LYS 80 15.726 17.356 11.680
607 HG2 LYS 80 1HG LYS 80 14.105 17.404 13.423
608 HG3 LYS 80 2HG LYS 80 13.428 18.247 12.027
609 HD2 LYS 80 1HD LYS 80 11.937 16.533 11.555
610 HD3 LYS 80 2HD LYS 80 12.884 15.332 12.436
611 HE2 LYS 80 1HE LYS 80 12.320 16.707 14.525
612 HE3 LYS 80 2HE LYS 80 11.094 17.484 13.525
613 HZ1 LYS 80 1HZ LYS 80 10.982 14.988 14.824
614 HZ2 LYS 80 2HZ LYS 80 10.833 14.743 13.157
615 HZ3 LYS 80 3HZ LYS 80 9.767 15.784 13.956
616 H GLY 81 H GLY 81 15.553 18.775 9.029
617 HA2 GLY 81 1HA GLY 81 17.720 17.244 7.731
618 HA3 GLY 81 2HA GLY 81 17.045 18.737 7.095
619 H SER 82 H SER 82 18.575 20.242 7.177
620 HA SER 82 HA SER 82 20.298 21.541 7.911
621 HB2 SER 82 1HB SER 82 18.416 22.161 9.494
622 HB3 SER 82 2HB SER 82 19.152 21.069 10.668
623 HG SER 82 HG SER 82 20.013 23.549 9.754
624 H GLY 83 H GLY 83 21.174 19.036 7.457
625 HA2 GLY 83 1HA GLY 83 23.436 18.860 9.205
626 HA3 GLY 83 2HA GLY 83 22.309 17.535 9.455
627 HA PRO 84 HA PRO 84 25.302 16.340 6.107
628 HB2 PRO 84 1HB PRO 84 25.887 13.908 7.162
629 HB3 PRO 84 2HB PRO 84 26.749 15.383 7.614
630 HG2 PRO 84 1HG PRO 84 24.531 13.971 9.045
631 HG3 PRO 84 2HG PRO 84 26.013 14.686 9.707
632 HD2 PRO 84 1HD PRO 84 23.614 15.938 9.820
633 HD3 PRO 84 2HD PRO 84 25.147 16.822 9.673
634 H SER 85 H SER 85 24.034 15.877 4.404
635 HA SER 85 HA SER 85 21.828 14.032 4.604
636 HB2 SER 85 1HB SER 85 21.391 14.594 2.282
637 HB3 SER 85 2HB SER 85 21.733 16.073 3.179
638 HG SER 85 HG SER 85 24.004 15.639 2.396
639 H SER 86 H SER 86 21.814 11.936 4.091
640 HA SER 86 HA SER 86 23.748 10.803 2.271
641 HB2 SER 86 1HB SER 86 24.575 9.127 3.924
642 HB3 SER 86 2HB SER 86 25.073 10.776 4.301
643 HG SER 86 HG SER 86 23.116 10.778 5.696
644 H GLY 87 H GLY 87 23.274 8.590 1.711
645 HA2 GLY 87 1HA GLY 87 21.565 6.769 2.520
646 HA3 GLY 87 2HA GLY 87 20.421 8.010 2.033
Start of MODEL 13
1 H1 GLY 1 H GLY 1 -10.714 8.137 -17.013
2 HA2 GLY 1 1HA GLY 1 -10.668 8.465 -14.476
3 HA3 GLY 1 2HA GLY 1 -12.342 7.939 -14.563
4 H SER 2 H SER 2 -9.500 6.885 -13.611
5 HA SER 2 HA SER 2 -9.595 4.243 -14.847
6 HB2 SER 2 1HB SER 2 -7.435 5.588 -14.389
7 HB3 SER 2 2HB SER 2 -7.651 5.093 -12.710
8 HG SER 2 HG SER 2 -7.875 2.882 -13.782
9 H SER 3 H SER 3 -10.939 2.805 -14.001
10 HA SER 3 HA SER 3 -11.658 2.963 -11.176
11 HB2 SER 3 1HB SER 3 -13.439 1.392 -11.725
12 HB3 SER 3 2HB SER 3 -13.451 2.726 -12.877
13 HG SER 3 HG SER 3 -12.402 1.386 -14.365
14 H GLY 4 H GLY 4 -11.442 1.227 -9.736
15 HA2 GLY 4 1HA GLY 4 -9.342 -0.690 -10.515
16 HA3 GLY 4 2HA GLY 4 -9.648 -0.141 -8.873
17 H SER 5 H SER 5 -9.480 -2.867 -9.909
18 HA SER 5 HA SER 5 -12.226 -3.837 -9.698
19 HB2 SER 5 1HB SER 5 -9.615 -5.106 -10.489
20 HB3 SER 5 2HB SER 5 -11.016 -6.098 -10.087
21 HG SER 5 HG SER 5 -11.870 -5.601 -11.939
22 H SER 6 H SER 6 -9.109 -4.127 -8.044
23 HA SER 6 HA SER 6 -10.535 -4.857 -5.597
24 HB2 SER 6 1HB SER 6 -9.659 -6.933 -6.840
25 HB3 SER 6 2HB SER 6 -8.050 -6.366 -6.394
26 HG SER 6 HG SER 6 -9.476 -7.861 -4.937
27 H GLY 7 H GLY 7 -9.232 -4.577 -3.651
28 HA2 GLY 7 1HA GLY 7 -7.017 -3.811 -2.799
29 HA3 GLY 7 2HA GLY 7 -7.076 -2.597 -4.067
30 H ILE 8 H ILE 8 -6.639 -1.644 -1.642
31 HA ILE 8 HA ILE 8 -9.249 -0.587 -0.768
32 HB ILE 8 HB ILE 8 -8.372 -0.304 1.459
33 HG12 ILE 8 1HG1 ILE 8 -5.828 -1.710 0.718
34 HG13 ILE 8 2HG1 ILE 8 -5.963 0.030 0.489
35 HG21 ILE 8 1HG2 ILE 8 -9.231 -2.572 0.589
36 HG22 ILE 8 2HG2 ILE 8 -7.548 -3.083 0.706
37 HG23 ILE 8 3HG2 ILE 8 -8.403 -2.526 2.145
38 HD11 ILE 8 1HD1 ILE 8 -4.959 -0.272 2.586
39 HD12 ILE 8 2HD1 ILE 8 -6.637 0.151 2.925
40 HD13 ILE 8 3HD1 ILE 8 -6.108 -1.527 3.047
41 H GLN 9 H GLN 9 -9.366 1.615 -0.203
42 HA GLN 9 HA GLN 9 -7.286 3.254 -1.468
43 HB2 GLN 9 1HB GLN 9 -9.804 3.348 -2.112
44 HB3 GLN 9 2HB GLN 9 -9.979 4.282 -0.632
45 HG2 GLN 9 1HG GLN 9 -8.831 6.074 -1.457
46 HG3 GLN 9 2HG GLN 9 -7.881 5.092 -2.571
47 HE21 GLN 9 1HE2 GLN 9 -11.235 6.073 -1.971
48 HE22 GLN 9 2HE2 GLN 9 -11.656 6.269 -3.635
49 H VAL 10 H VAL 10 -5.987 4.480 -0.273
50 HA VAL 10 HA VAL 10 -6.812 5.137 2.479
51 HB VAL 10 HB VAL 10 -4.422 4.971 3.145
52 HG11 VAL 10 1HG1 VAL 10 -6.009 3.143 3.568
53 HG12 VAL 10 2HG1 VAL 10 -5.572 2.420 2.019
54 HG13 VAL 10 3HG1 VAL 10 -4.370 2.550 3.303
55 HG21 VAL 10 1HG2 VAL 10 -2.835 3.833 1.720
56 HG22 VAL 10 2HG2 VAL 10 -4.057 3.636 0.464
57 HG23 VAL 10 3HG2 VAL 10 -3.473 5.247 0.880
58 H PHE 11 H PHE 11 -6.480 7.194 3.147
59 HA PHE 11 HA PHE 11 -5.669 9.119 1.130
60 HB2 PHE 11 1HB PHE 11 -6.801 9.492 3.910
61 HB3 PHE 11 2HB PHE 11 -6.455 10.803 2.787
62 HD1 PHE 11 1HD PHE 11 -7.695 10.856 0.586
63 HD2 PHE 11 2HD PHE 11 -8.824 8.331 3.821
64 HE1 PHE 11 1HE PHE 11 -9.937 10.607 -0.396
65 HE2 PHE 11 2HE PHE 11 -11.068 8.077 2.844
66 HZ PHE 11 HZ PHE 11 -11.627 9.215 0.733
67 H VAL 12 H VAL 12 -3.754 10.100 1.053
68 HA VAL 12 HA VAL 12 -1.919 9.733 3.326
69 HB VAL 12 HB VAL 12 -1.308 10.194 0.404
70 HG11 VAL 12 1HG1 VAL 12 0.689 10.952 1.003
71 HG12 VAL 12 2HG1 VAL 12 0.256 10.799 2.707
72 HG13 VAL 12 3HG1 VAL 12 0.997 9.442 1.859
73 HG21 VAL 12 1HG2 VAL 12 -2.079 7.897 1.260
74 HG22 VAL 12 2HG2 VAL 12 -0.599 7.972 0.304
75 HG23 VAL 12 3HG2 VAL 12 -0.509 7.824 2.059
76 H LYS 13 H LYS 13 -1.999 11.498 4.574
77 HA LYS 13 HA LYS 13 -2.342 14.135 3.412
78 HB2 LYS 13 1HB LYS 13 -3.555 13.998 5.375
79 HB3 LYS 13 2HB LYS 13 -2.343 13.007 6.178
80 HG2 LYS 13 1HG LYS 13 -0.878 14.987 6.335
81 HG3 LYS 13 2HG LYS 13 -2.166 15.961 5.622
82 HD2 LYS 13 1HD LYS 13 -2.819 14.308 8.006
83 HD3 LYS 13 2HD LYS 13 -1.849 15.763 8.246
84 HE2 LYS 13 1HE LYS 13 -3.555 17.129 7.246
85 HE3 LYS 13 2HE LYS 13 -4.489 15.705 6.792
86 HZ1 LYS 13 1HZ LYS 13 -4.846 17.143 9.047
87 HZ2 LYS 13 2HZ LYS 13 -3.898 15.858 9.605
88 HZ3 LYS 13 3HZ LYS 13 -5.366 15.548 8.824
89 H ASN 14 H ASN 14 -0.774 15.588 3.067
90 HA ASN 14 HA ASN 14 1.972 14.793 3.627
91 HB2 ASN 14 1HB ASN 14 2.378 17.001 2.266
92 HB3 ASN 14 2HB ASN 14 1.857 15.536 1.438
93 HD21 ASN 14 1HD2 ASN 14 0.864 16.552 -0.247
94 HD22 ASN 14 2HD2 ASN 14 -0.575 17.493 -0.076
95 HA PRO 15 HA PRO 15 2.682 17.544 6.971
96 HB2 PRO 15 1HB PRO 15 5.211 18.397 6.475
97 HB3 PRO 15 2HB PRO 15 4.840 16.758 7.024
98 HG2 PRO 15 1HG PRO 15 5.407 17.745 4.256
99 HG3 PRO 15 2HG PRO 15 5.991 16.277 5.062
100 HD2 PRO 15 1HD PRO 15 3.942 16.251 3.291
101 HD3 PRO 15 2HD PRO 15 4.032 15.129 4.665
102 H ASP 16 H ASP 16 2.472 18.670 3.804
103 HA ASP 16 HA ASP 16 2.917 21.468 4.511
104 HB2 ASP 16 1HB ASP 16 2.087 20.357 1.828
105 HB3 ASP 16 2HB ASP 16 2.778 21.941 2.167
106 H GLY 17 H GLY 17 0.330 19.319 3.399
107 HA2 GLY 17 1HA GLY 17 -1.816 19.940 4.675
108 HA3 GLY 17 2HA GLY 17 -1.608 21.487 3.867
109 H GLY 18 H GLY 18 -2.534 18.157 3.511
110 HA2 GLY 18 1HA GLY 18 -4.437 18.349 1.650
111 HA3 GLY 18 2HA GLY 18 -2.995 18.433 0.650
112 H SER 19 H SER 19 -5.301 16.392 1.534
113 HA SER 19 HA SER 19 -3.501 14.067 1.708
114 HB2 SER 19 1HB SER 19 -5.248 12.867 2.827
115 HB3 SER 19 2HB SER 19 -5.118 14.439 3.615
116 HG SER 19 HG SER 19 -7.180 14.544 3.216
117 H TYR 20 H TYR 20 -3.494 12.625 0.101
118 HA TYR 20 HA TYR 20 -5.564 12.882 -1.981
119 HB2 TYR 20 1HB TYR 20 -2.873 11.676 -2.518
120 HB3 TYR 20 2HB TYR 20 -3.981 12.466 -3.635
121 HD1 TYR 20 2HD TYR 20 -4.425 15.038 -3.041
122 HD2 TYR 20 1HD TYR 20 -0.967 12.825 -1.921
123 HE1 TYR 20 2HE TYR 20 -3.162 17.137 -2.815
124 HE2 TYR 20 1HE TYR 20 0.305 14.918 -1.691
125 HH TYR 20 HH TYR 20 -1.175 18.058 -2.433
126 H ALA 21 H ALA 21 -6.447 11.024 -2.878
127 HA ALA 21 HA ALA 21 -6.391 8.700 -1.152
128 HB1 ALA 21 1HB ALA 21 -8.540 9.439 -1.917
129 HB2 ALA 21 2HB ALA 21 -8.025 9.343 -3.601
130 HB3 ALA 21 3HB ALA 21 -8.196 7.870 -2.647
131 H TYR 22 H TYR 22 -5.152 6.977 -1.466
132 HA TYR 22 HA TYR 22 -3.950 6.581 -4.125
133 HB2 TYR 22 1HB TYR 22 -2.943 5.992 -1.352
134 HB3 TYR 22 2HB TYR 22 -2.261 5.182 -2.759
135 HD1 TYR 22 2HD TYR 22 -2.904 8.552 -1.322
136 HD2 TYR 22 1HD TYR 22 -0.594 6.221 -4.030
137 HE1 TYR 22 2HE TYR 22 -1.418 10.475 -1.701
138 HE2 TYR 22 1HE TYR 22 0.899 8.137 -4.415
139 HH TYR 22 HH TYR 22 0.320 11.264 -2.832
140 H ALA 23 H ALA 23 -3.821 4.488 -4.987
141 HA ALA 23 HA ALA 23 -5.674 2.549 -3.762
142 HB1 ALA 23 1HB ALA 23 -5.102 3.003 -6.688
143 HB2 ALA 23 2HB ALA 23 -6.158 1.750 -6.033
144 HB3 ALA 23 3HB ALA 23 -6.575 3.451 -5.826
145 H ILE 24 H ILE 24 -4.689 0.810 -2.992
146 HA ILE 24 HA ILE 24 -2.686 -0.570 -4.544
147 HB ILE 24 HB ILE 24 -1.300 1.064 -3.347
148 HG12 ILE 24 1HG1 ILE 24 -0.930 -1.675 -2.127
149 HG13 ILE 24 2HG1 ILE 24 -0.542 -1.310 -3.804
150 HG21 ILE 24 1HG2 ILE 24 -1.249 1.305 -1.034
151 HG22 ILE 24 2HG2 ILE 24 -2.969 1.151 -1.389
152 HG23 ILE 24 3HG2 ILE 24 -2.071 -0.230 -0.758
153 HD11 ILE 24 1HD1 ILE 24 1.413 -0.443 -3.233
154 HD12 ILE 24 2HD1 ILE 24 0.672 0.595 -2.014
155 HD13 ILE 24 3HD1 ILE 24 1.125 -1.060 -1.606
156 H ASN 25 H ASN 25 -2.994 -2.685 -4.321
157 HA ASN 25 HA ASN 25 -4.978 -3.796 -2.721
158 HB2 ASN 25 1HB ASN 25 -2.706 -4.882 -4.312
159 HB3 ASN 25 2HB ASN 25 -3.486 -5.967 -3.164
160 HD21 ASN 25 1HD2 ASN 25 -3.689 -4.425 -6.191
161 HD22 ASN 25 2HD2 ASN 25 -5.239 -5.030 -6.657
162 HA PRO 26 HA PRO 26 -3.227 -4.212 1.288
163 HB2 PRO 26 1HB PRO 26 -4.535 -6.425 2.160
164 HB3 PRO 26 2HB PRO 26 -5.320 -4.851 1.987
165 HG2 PRO 26 1HG PRO 26 -5.364 -7.203 0.136
166 HG3 PRO 26 2HG PRO 26 -6.697 -6.142 0.629
167 HD2 PRO 26 1HD PRO 26 -5.424 -5.875 -1.746
168 HD3 PRO 26 2HD PRO 26 -6.101 -4.491 -0.865
169 H ASN 27 H ASN 27 -2.835 -6.616 -1.121
170 HA ASN 27 HA ASN 27 -1.225 -8.410 0.445
171 HB2 ASN 27 1HB ASN 27 -2.009 -8.204 -2.433
172 HB3 ASN 27 2HB ASN 27 -0.629 -9.209 -2.001
173 HD21 ASN 27 1HD2 ASN 27 -3.115 -10.063 -3.125
174 HD22 ASN 27 2HD2 ASN 27 -3.840 -11.147 -1.992
175 H SER 28 H SER 28 -0.670 -5.694 -1.695
176 HA SER 28 HA SER 28 2.082 -6.042 -2.128
177 HB2 SER 28 1HB SER 28 0.541 -4.433 -3.337
178 HB3 SER 28 2HB SER 28 0.669 -3.378 -1.930
179 HG SER 28 HG SER 28 2.772 -4.247 -3.624
180 H PHE 29 H PHE 29 3.839 -4.723 -1.236
181 HA PHE 29 HA PHE 29 3.693 -4.695 1.661
182 HB2 PHE 29 1HB PHE 29 6.057 -4.051 -0.110
183 HB3 PHE 29 2HB PHE 29 6.095 -4.428 1.609
184 HD1 PHE 29 2HD PHE 29 5.357 -6.750 2.333
185 HD2 PHE 29 1HD PHE 29 6.236 -5.735 -1.706
186 HE1 PHE 29 2HE PHE 29 5.660 -9.134 1.803
187 HE2 PHE 29 1HE PHE 29 6.539 -8.117 -2.243
188 HZ PHE 29 HZ PHE 29 6.252 -9.820 -0.487
189 H ILE 30 H ILE 30 3.946 -2.918 2.969
190 HA ILE 30 HA ILE 30 2.822 -0.538 2.382
191 HB ILE 30 HB ILE 30 5.091 -1.125 4.266
192 HG12 ILE 30 1HG1 ILE 30 2.782 -2.033 4.683
193 HG13 ILE 30 2HG1 ILE 30 3.400 -0.995 5.964
194 HG21 ILE 30 1HG2 ILE 30 4.046 1.241 5.153
195 HG22 ILE 30 2HG2 ILE 30 5.560 1.062 4.268
196 HG23 ILE 30 3HG2 ILE 30 4.079 1.476 3.405
197 HD11 ILE 30 1HD1 ILE 30 2.110 0.865 4.654
198 HD12 ILE 30 2HD1 ILE 30 1.204 -0.511 4.022
199 HD13 ILE 30 3HD1 ILE 30 1.265 -0.218 5.760
200 H LEU 31 H LEU 31 6.302 -1.224 2.073
201 HA LEU 31 HA LEU 31 7.287 1.170 1.264
202 HB2 LEU 31 1HB LEU 31 8.350 -1.234 1.409
203 HB3 LEU 31 2HB LEU 31 8.068 -1.223 -0.331
204 HG LEU 31 HG LEU 31 9.483 0.754 -0.556
205 HD11 LEU 31 1HD1 LEU 31 9.720 0.509 2.432
206 HD12 LEU 31 2HD1 LEU 31 9.160 1.892 1.492
207 HD13 LEU 31 3HD1 LEU 31 10.860 1.423 1.444
208 HD21 LEU 31 1HD2 LEU 31 11.111 -1.122 1.089
209 HD22 LEU 31 2HD2 LEU 31 11.473 -0.381 -0.470
210 HD23 LEU 31 3HD2 LEU 31 10.334 -1.724 -0.376
211 H GLY 32 H GLY 32 5.662 -1.199 -0.834
212 HA2 GLY 32 1HA GLY 32 5.907 0.073 -3.271
213 HA3 GLY 32 2HA GLY 32 4.527 -0.913 -2.811
214 H LEU 33 H LEU 33 3.445 0.637 -0.778
215 HA LEU 33 HA LEU 33 1.894 2.468 -2.224
216 HB2 LEU 33 1HB LEU 33 0.924 1.589 -0.291
217 HB3 LEU 33 2HB LEU 33 2.327 1.982 0.700
218 HG LEU 33 HG LEU 33 1.725 4.391 0.479
219 HD11 LEU 33 1HD1 LEU 33 -0.649 4.845 -0.211
220 HD12 LEU 33 2HD1 LEU 33 -0.678 3.224 -0.904
221 HD13 LEU 33 3HD1 LEU 33 0.454 4.427 -1.522
222 HD21 LEU 33 1HD2 LEU 33 -0.036 4.323 2.111
223 HD22 LEU 33 2HD2 LEU 33 1.082 2.996 2.427
224 HD23 LEU 33 3HD2 LEU 33 -0.466 2.678 1.642
225 H LYS 34 H LYS 34 4.604 2.994 0.008
226 HA LYS 34 HA LYS 34 4.612 5.773 0.020
227 HB2 LYS 34 1HB LYS 34 6.653 3.662 0.494
228 HB3 LYS 34 2HB LYS 34 7.233 5.305 0.254
229 HG2 LYS 34 1HG LYS 34 7.005 5.214 2.536
230 HG3 LYS 34 2HG LYS 34 5.457 5.912 2.053
231 HD2 LYS 34 1HD LYS 34 4.330 3.855 2.343
232 HD3 LYS 34 2HD LYS 34 5.845 2.954 2.446
233 HE2 LYS 34 1HE LYS 34 4.999 5.043 4.446
234 HE3 LYS 34 2HE LYS 34 4.667 3.321 4.633
235 HZ1 LYS 34 1HZ LYS 34 6.765 2.909 5.229
236 HZ2 LYS 34 2HZ LYS 34 6.881 4.571 5.522
237 HZ3 LYS 34 3HZ LYS 34 7.424 3.931 4.053
238 H GLN 35 H GLN 35 6.643 3.650 -2.008
239 HA GLN 35 HA GLN 35 7.891 5.478 -3.579
240 HB2 GLN 35 1HB GLN 35 7.997 2.912 -3.663
241 HB3 GLN 35 2HB GLN 35 6.659 3.017 -4.799
242 HG2 GLN 35 1HG GLN 35 9.434 4.124 -5.120
243 HG3 GLN 35 2HG GLN 35 8.665 2.840 -6.053
244 HE21 GLN 35 1HE2 GLN 35 9.685 5.841 -6.343
245 HE22 GLN 35 2HE2 GLN 35 8.521 6.490 -7.443
246 H GLN 36 H GLN 36 4.593 4.259 -4.029
247 HA GLN 36 HA GLN 36 4.000 5.534 -6.432
248 HB2 GLN 36 1HB GLN 36 2.376 4.531 -4.140
249 HB3 GLN 36 2HB GLN 36 1.585 5.538 -5.345
250 HG2 GLN 36 1HG GLN 36 2.533 3.926 -7.072
251 HG3 GLN 36 2HG GLN 36 2.884 2.863 -5.711
252 HE21 GLN 36 1HE2 GLN 36 1.014 2.398 -4.268
253 HE22 GLN 36 2HE2 GLN 36 -0.528 2.164 -5.011
254 H ILE 37 H ILE 37 3.892 6.736 -3.125
255 HA ILE 37 HA ILE 37 2.575 9.175 -3.690
256 HB ILE 37 HB ILE 37 4.416 8.403 -1.427
257 HG12 ILE 37 1HG1 ILE 37 1.434 8.852 -1.367
258 HG13 ILE 37 2HG1 ILE 37 2.138 7.279 -1.726
259 HG21 ILE 37 1HG2 ILE 37 3.135 10.459 -0.379
260 HG22 ILE 37 2HG2 ILE 37 4.626 10.673 -1.295
261 HG23 ILE 37 3HG2 ILE 37 3.068 10.974 -2.064
262 HD11 ILE 37 1HD1 ILE 37 2.670 8.833 0.792
263 HD12 ILE 37 2HD1 ILE 37 1.448 7.571 0.633
264 HD13 ILE 37 3HD1 ILE 37 3.156 7.176 0.434
265 H GLU 38 H GLU 38 5.966 8.216 -3.670
266 HA GLU 38 HA GLU 38 7.176 10.711 -3.814
267 HB2 GLU 38 1HB GLU 38 8.409 8.601 -3.524
268 HB3 GLU 38 2HB GLU 38 8.040 8.159 -5.185
269 HG2 GLU 38 1HG GLU 38 9.433 10.734 -4.676
270 HG3 GLU 38 2HG GLU 38 10.343 9.232 -4.531
271 H ASP 39 H ASP 39 5.974 8.658 -6.450
272 HA ASP 39 HA ASP 39 6.711 10.441 -8.530
273 HB2 ASP 39 1HB ASP 39 4.888 8.066 -8.339
274 HB3 ASP 39 2HB ASP 39 4.891 9.058 -9.794
275 H GLN 40 H GLN 40 4.393 10.716 -6.160
276 HA GLN 40 HA GLN 40 2.596 12.324 -7.834
277 HB2 GLN 40 1HB GLN 40 2.245 11.206 -5.049
278 HB3 GLN 40 2HB GLN 40 1.077 12.249 -5.848
279 HG2 GLN 40 1HG GLN 40 1.973 9.700 -7.127
280 HG3 GLN 40 2HG GLN 40 0.718 9.702 -5.889
281 HE21 GLN 40 1HE2 GLN 40 1.091 9.528 -9.049
282 HE22 GLN 40 2HE2 GLN 40 -0.323 10.352 -9.602
283 H GLN 41 H GLN 41 3.765 12.520 -4.469
284 HA GLN 41 HA GLN 41 3.596 15.384 -4.490
285 HB2 GLN 41 1HB GLN 41 4.850 13.555 -2.437
286 HB3 GLN 41 2HB GLN 41 4.445 15.250 -2.205
287 HG2 GLN 41 1HG GLN 41 2.056 14.652 -2.621
288 HG3 GLN 41 2HG GLN 41 2.544 12.958 -2.611
289 HE21 GLN 41 1HE2 GLN 41 1.186 12.591 -0.825
290 HE22 GLN 41 2HE2 GLN 41 1.642 13.084 0.766
291 H GLY 42 H GLY 42 6.061 13.021 -5.090
292 HA2 GLY 42 1HA GLY 42 8.029 13.561 -6.314
293 HA3 GLY 42 2HA GLY 42 7.932 15.201 -5.691
294 H LEU 43 H LEU 43 7.373 13.959 -2.956
295 HA LEU 43 HA LEU 43 10.034 14.083 -2.002
296 HB2 LEU 43 1HB LEU 43 7.690 14.456 -0.836
297 HB3 LEU 43 2HB LEU 43 7.904 12.762 -0.399
298 HG LEU 43 HG LEU 43 10.092 14.706 0.192
299 HD11 LEU 43 1HD1 LEU 43 7.404 14.678 1.408
300 HD12 LEU 43 2HD1 LEU 43 8.593 15.976 1.302
301 HD13 LEU 43 3HD1 LEU 43 8.770 14.716 2.524
302 HD21 LEU 43 1HD2 LEU 43 9.344 12.722 2.176
303 HD22 LEU 43 2HD2 LEU 43 10.904 13.025 1.410
304 HD23 LEU 43 3HD2 LEU 43 9.710 12.004 0.608
305 HA PRO 44 HA PRO 44 11.384 9.937 -2.659
306 HB2 PRO 44 1HB PRO 44 13.422 9.897 -0.867
307 HB3 PRO 44 2HB PRO 44 13.514 10.759 -2.407
308 HG2 PRO 44 1HG PRO 44 12.922 11.823 0.327
309 HG3 PRO 44 2HG PRO 44 13.961 12.505 -0.938
310 HD2 PRO 44 1HD PRO 44 11.449 13.404 -0.474
311 HD3 PRO 44 2HD PRO 44 12.180 13.404 -2.092
312 H LYS 45 H LYS 45 10.449 8.136 -1.950
313 HA LYS 45 HA LYS 45 8.965 7.842 0.348
314 HB2 LYS 45 1HB LYS 45 9.363 5.338 0.006
315 HB3 LYS 45 2HB LYS 45 8.648 6.227 -1.333
316 HG2 LYS 45 1HG LYS 45 10.821 6.336 -2.432
317 HG3 LYS 45 2HG LYS 45 11.551 5.462 -1.083
318 HD2 LYS 45 1HD LYS 45 9.210 4.252 -2.473
319 HD3 LYS 45 2HD LYS 45 10.783 4.208 -3.272
320 HE2 LYS 45 1HE LYS 45 10.385 3.291 -0.436
321 HE3 LYS 45 2HE LYS 45 10.169 2.214 -1.815
322 HZ1 LYS 45 1HZ LYS 45 12.627 3.431 -0.775
323 HZ2 LYS 45 2HZ LYS 45 12.527 3.104 -2.431
324 HZ3 LYS 45 3HZ LYS 45 12.352 1.849 -1.310
325 H LYS 46 H LYS 46 12.375 7.027 -0.158
326 HA LYS 46 HA LYS 46 12.981 5.748 2.189
327 HB2 LYS 46 1HB LYS 46 15.192 6.161 1.714
328 HB3 LYS 46 2HB LYS 46 14.470 6.489 0.144
329 HG2 LYS 46 1HG LYS 46 14.492 8.877 0.616
330 HG3 LYS 46 2HG LYS 46 15.181 8.562 2.211
331 HD2 LYS 46 1HD LYS 46 17.212 7.784 1.285
332 HD3 LYS 46 2HD LYS 46 16.516 7.665 -0.332
333 HE2 LYS 46 1HE LYS 46 16.132 10.231 -0.040
334 HE3 LYS 46 2HE LYS 46 17.385 10.084 1.190
335 HZ1 LYS 46 1HZ LYS 46 17.602 9.953 -1.685
336 HZ2 LYS 46 2HZ LYS 46 18.465 8.746 -0.873
337 HZ3 LYS 46 3HZ LYS 46 18.764 10.375 -0.530
338 H GLN 47 H GLN 47 11.990 9.002 1.778
339 HA GLN 47 HA GLN 47 12.864 9.699 4.494
340 HB2 GLN 47 1HB GLN 47 12.122 11.337 2.092
341 HB3 GLN 47 2HB GLN 47 12.056 12.041 3.702
342 HG2 GLN 47 1HG GLN 47 14.343 11.904 4.001
343 HG3 GLN 47 2HG GLN 47 14.530 10.654 2.772
344 HE21 GLN 47 1HE2 GLN 47 12.582 13.485 2.255
345 HE22 GLN 47 2HE2 GLN 47 13.626 14.243 1.107
346 H GLN 48 H GLN 48 10.032 10.188 2.377
347 HA GLN 48 HA GLN 48 8.183 11.045 4.168
348 HB2 GLN 48 1HB GLN 48 6.573 10.471 2.640
349 HB3 GLN 48 2HB GLN 48 8.002 10.372 1.621
350 HG2 GLN 48 1HG GLN 48 8.074 7.916 2.137
351 HG3 GLN 48 2HG GLN 48 6.496 8.109 2.899
352 HE21 GLN 48 1HE2 GLN 48 7.922 9.429 -0.067
353 HE22 GLN 48 2HE2 GLN 48 6.680 8.858 -1.124
354 H GLN 49 H GLN 49 7.389 10.321 6.022
355 HA GLN 49 HA GLN 49 7.460 7.421 6.540
356 HB2 GLN 49 1HB GLN 49 9.088 8.725 7.899
357 HB3 GLN 49 2HB GLN 49 7.745 9.634 8.579
358 HG2 GLN 49 1HG GLN 49 6.825 7.379 9.332
359 HG3 GLN 49 2HG GLN 49 8.426 6.742 8.961
360 HE21 GLN 49 1HE2 GLN 49 9.910 6.834 10.495
361 HE22 GLN 49 2HE2 GLN 49 9.824 7.797 11.927
362 H LEU 50 H LEU 50 5.453 6.663 6.405
363 HA LEU 50 HA LEU 50 3.196 8.342 7.168
364 HB2 LEU 50 1HB LEU 50 3.352 5.628 5.872
365 HB3 LEU 50 2HB LEU 50 1.843 6.444 6.272
366 HG LEU 50 HG LEU 50 3.899 7.583 4.387
367 HD11 LEU 50 1HD1 LEU 50 3.284 5.866 3.065
368 HD12 LEU 50 2HD1 LEU 50 1.859 6.867 2.790
369 HD13 LEU 50 3HD1 LEU 50 1.802 5.556 3.968
370 HD21 LEU 50 1HD2 LEU 50 2.301 9.149 5.478
371 HD22 LEU 50 2HD2 LEU 50 0.979 8.236 4.749
372 HD23 LEU 50 3HD2 LEU 50 2.144 9.074 3.722
373 H GLU 51 H GLU 51 1.849 7.954 8.866
374 HA GLU 51 HA GLU 51 2.504 5.666 10.602
375 HB2 GLU 51 1HB GLU 51 2.045 8.545 11.348
376 HB3 GLU 51 2HB GLU 51 1.824 7.247 12.513
377 HG2 GLU 51 1HG GLU 51 4.194 6.540 11.955
378 HG3 GLU 51 2HG GLU 51 4.346 8.088 11.124
379 H PHE 52 H PHE 52 0.745 5.037 12.070
380 HA PHE 52 HA PHE 52 -1.928 5.849 11.205
381 HB2 PHE 52 1HB PHE 52 -1.262 3.832 9.885
382 HB3 PHE 52 2HB PHE 52 -1.099 2.948 11.398
383 HD1 PHE 52 2HD PHE 52 -3.630 5.149 9.755
384 HD2 PHE 52 1HD PHE 52 -2.848 1.582 11.941
385 HE1 PHE 52 2HE PHE 52 -6.022 4.580 9.676
386 HE2 PHE 52 1HE PHE 52 -5.239 1.006 11.864
387 HZ PHE 52 HZ PHE 52 -6.830 2.507 10.732
388 H GLN 53 H GLN 53 -2.834 6.557 13.019
389 HA GLN 53 HA GLN 53 -3.539 6.696 15.176
390 HB2 GLN 53 1HB GLN 53 -3.123 3.702 15.144
391 HB3 GLN 53 2HB GLN 53 -4.076 4.598 16.320
392 HG2 GLN 53 1HG GLN 53 -4.653 4.210 13.398
393 HG3 GLN 53 2HG GLN 53 -5.578 3.614 14.774
394 HE21 GLN 53 1HE2 GLN 53 -6.058 5.515 12.411
395 HE22 GLN 53 2HE2 GLN 53 -6.836 6.871 13.145
396 H GLY 54 H GLY 54 -0.733 7.052 14.642
397 HA2 GLY 54 1HA GLY 54 1.062 7.599 16.006
398 HA3 GLY 54 2HA GLY 54 0.230 6.837 17.353
399 H GLN 55 H GLN 55 1.092 5.418 14.226
400 HA GLN 55 HA GLN 55 3.041 3.698 15.591
401 HB2 GLN 55 1HB GLN 55 0.922 2.724 13.667
402 HB3 GLN 55 2HB GLN 55 2.192 1.739 14.382
403 HG2 GLN 55 1HG GLN 55 1.203 2.442 16.636
404 HG3 GLN 55 2HG GLN 55 -0.199 2.962 15.703
405 HE21 GLN 55 1HE2 GLN 55 -1.244 1.346 14.354
406 HE22 GLN 55 2HE2 GLN 55 -1.248 -0.303 14.871
407 H VAL 56 H VAL 56 4.716 2.895 14.285
408 HA VAL 56 HA VAL 56 5.157 4.469 11.857
409 HB VAL 56 HB VAL 56 7.093 2.786 13.456
410 HG11 VAL 56 1HG1 VAL 56 7.269 3.645 10.798
411 HG12 VAL 56 2HG1 VAL 56 8.294 4.743 11.724
412 HG13 VAL 56 3HG1 VAL 56 8.565 3.002 11.806
413 HG21 VAL 56 1HG2 VAL 56 6.172 5.546 13.686
414 HG22 VAL 56 2HG2 VAL 56 7.039 4.540 14.847
415 HG23 VAL 56 3HG2 VAL 56 7.927 5.397 13.587
416 H LEU 57 H LEU 57 4.523 3.546 10.024
417 HA LEU 57 HA LEU 57 4.239 0.706 9.745
418 HB2 LEU 57 1HB LEU 57 4.152 2.739 7.533
419 HB3 LEU 57 2HB LEU 57 3.386 1.153 7.581
420 HG LEU 57 HG LEU 57 2.594 3.516 9.283
421 HD11 LEU 57 1HD1 LEU 57 0.523 3.390 7.821
422 HD12 LEU 57 2HD1 LEU 57 1.487 2.407 6.720
423 HD13 LEU 57 3HD1 LEU 57 1.976 4.062 7.082
424 HD21 LEU 57 1HD2 LEU 57 2.097 0.750 9.574
425 HD22 LEU 57 2HD2 LEU 57 0.598 1.497 9.022
426 HD23 LEU 57 3HD2 LEU 57 1.393 2.089 10.482
427 H GLN 58 H GLN 58 5.748 -0.692 9.143
428 HA GLN 58 HA GLN 58 8.316 0.277 8.208
429 HB2 GLN 58 1HB GLN 58 7.391 -2.532 8.833
430 HB3 GLN 58 2HB GLN 58 9.046 -2.057 8.477
431 HG2 GLN 58 1HG GLN 58 7.408 -1.176 10.842
432 HG3 GLN 58 2HG GLN 58 8.730 -2.341 10.856
433 HE21 GLN 58 1HE2 GLN 58 8.303 0.305 12.190
434 HE22 GLN 58 2HE2 GLN 58 9.718 1.219 11.809
435 H ASP 59 H ASP 59 9.328 -1.510 6.565
436 HA ASP 59 HA ASP 59 7.680 -1.233 4.167
437 HB2 ASP 59 1HB ASP 59 9.662 -1.438 2.904
438 HB3 ASP 59 2HB ASP 59 10.118 -0.464 4.299
439 H TRP 60 H TRP 60 9.379 -3.688 6.055
440 HA TRP 60 HA TRP 60 8.551 -5.829 4.311
441 HB2 TRP 60 1HB TRP 60 9.889 -7.216 5.595
442 HB3 TRP 60 2HB TRP 60 10.681 -5.661 5.831
443 HD1 TRP 60 HD TRP 60 8.671 -8.310 7.685
444 HE1 TRP 60 1HE TRP 60 8.761 -7.810 10.209
445 HE3 TRP 60 3HE TRP 60 10.907 -3.715 7.523
446 HZ2 TRP 60 2HZ TRP 60 9.660 -5.741 11.905
447 HZ3 TRP 60 3HZ TRP 60 11.347 -2.542 9.641
448 HH2 TRP 60 HH TRP 60 10.735 -3.535 11.785
449 H LEU 61 H LEU 61 6.736 -4.001 6.136
450 HA LEU 61 HA LEU 61 5.154 -6.212 7.270
451 HB2 LEU 61 1HB LEU 61 5.213 -3.296 8.031
452 HB3 LEU 61 2HB LEU 61 4.126 -4.497 8.724
453 HG LEU 61 HG LEU 61 7.133 -4.593 8.947
454 HD11 LEU 61 1HD1 LEU 61 5.327 -3.946 11.227
455 HD12 LEU 61 2HD1 LEU 61 5.786 -2.668 10.102
456 HD13 LEU 61 3HD1 LEU 61 7.030 -3.552 10.987
457 HD21 LEU 61 1HD2 LEU 61 6.820 -6.359 10.472
458 HD22 LEU 61 2HD2 LEU 61 5.787 -6.740 9.094
459 HD23 LEU 61 3HD2 LEU 61 5.082 -6.076 10.569
460 H GLY 62 H GLY 62 3.898 -6.739 5.516
461 HA2 GLY 62 1HA GLY 62 2.768 -5.145 3.608
462 HA3 GLY 62 2HA GLY 62 1.992 -6.594 4.230
463 H LEU 63 H LEU 63 0.459 -4.523 3.324
464 HA LEU 63 HA LEU 63 -0.291 -2.607 5.223
465 HB2 LEU 63 1HB LEU 63 -1.569 -3.824 2.831
466 HB3 LEU 63 2HB LEU 63 -2.581 -2.886 3.926
467 HG LEU 63 HG LEU 63 -0.981 -0.973 3.604
468 HD11 LEU 63 1HD1 LEU 63 0.965 -2.137 2.841
469 HD12 LEU 63 2HD1 LEU 63 0.410 -1.078 1.545
470 HD13 LEU 63 3HD1 LEU 63 0.086 -2.809 1.468
471 HD21 LEU 63 1HD2 LEU 63 -2.440 -2.049 1.194
472 HD22 LEU 63 2HD2 LEU 63 -1.867 -0.391 1.375
473 HD23 LEU 63 3HD2 LEU 63 -3.109 -1.019 2.459
474 H GLY 64 H GLY 64 -1.561 -5.865 4.601
475 HA2 GLY 64 1HA GLY 64 -3.638 -5.796 6.497
476 HA3 GLY 64 2HA GLY 64 -2.871 -7.251 5.877
477 H ILE 65 H ILE 65 -0.247 -6.756 6.801
478 HA ILE 65 HA ILE 65 -0.088 -8.008 9.167
479 HB ILE 65 HB ILE 65 1.659 -5.706 8.292
480 HG12 ILE 65 1HG1 ILE 65 1.738 -7.483 6.694
481 HG13 ILE 65 2HG1 ILE 65 3.201 -7.604 7.665
482 HG21 ILE 65 1HG2 ILE 65 1.573 -6.954 10.805
483 HG22 ILE 65 2HG2 ILE 65 2.985 -7.609 9.976
484 HG23 ILE 65 3HG2 ILE 65 2.813 -5.866 10.182
485 HD11 ILE 65 1HD1 ILE 65 0.892 -9.431 7.472
486 HD12 ILE 65 2HD1 ILE 65 2.608 -9.779 7.681
487 HD13 ILE 65 3HD1 ILE 65 1.641 -9.253 9.058
488 H TYR 66 H TYR 66 -0.611 -4.527 8.780
489 HA TYR 66 HA TYR 66 -0.799 -4.137 11.647
490 HB2 TYR 66 1HB TYR 66 -0.933 -2.320 9.259
491 HB3 TYR 66 2HB TYR 66 -1.453 -1.754 10.842
492 HD1 TYR 66 2HD TYR 66 0.266 -2.086 12.784
493 HD2 TYR 66 1HD TYR 66 1.297 -2.115 8.656
494 HE1 TYR 66 2HE TYR 66 2.598 -1.564 13.368
495 HE2 TYR 66 1HE TYR 66 3.632 -1.595 9.229
496 HH TYR 66 HH TYR 66 4.955 -0.733 10.957
497 H GLY 67 H GLY 67 -2.929 -4.252 8.842
498 HA2 GLY 67 1HA GLY 67 -5.169 -5.088 9.061
499 HA3 GLY 67 2HA GLY 67 -5.211 -4.433 10.692
500 H ILE 68 H ILE 68 -3.948 -2.597 8.009
501 HA ILE 68 HA ILE 68 -5.570 -0.369 8.514
502 HB ILE 68 HB ILE 68 -4.153 -1.065 5.939
503 HG12 ILE 68 1HG1 ILE 68 -3.138 0.760 8.108
504 HG13 ILE 68 2HG1 ILE 68 -2.806 -0.968 8.138
505 HG21 ILE 68 1HG2 ILE 68 -5.960 0.966 6.421
506 HG22 ILE 68 2HG2 ILE 68 -4.392 1.744 6.631
507 HG23 ILE 68 3HG2 ILE 68 -4.769 0.915 5.121
508 HD11 ILE 68 1HD1 ILE 68 -1.555 1.127 6.602
509 HD12 ILE 68 2HD1 ILE 68 -1.022 -0.527 6.904
510 HD13 ILE 68 3HD1 ILE 68 -2.124 -0.186 5.571
511 H GLN 69 H GLN 69 -7.494 0.315 7.736
512 HA GLN 69 HA GLN 69 -8.942 -1.538 5.968
513 HB2 GLN 69 1HB GLN 69 -9.970 0.421 8.024
514 HB3 GLN 69 2HB GLN 69 -11.002 -0.485 6.926
515 HG2 GLN 69 1HG GLN 69 -9.150 -1.681 8.975
516 HG3 GLN 69 2HG GLN 69 -10.896 -1.503 9.142
517 HE21 GLN 69 1HE2 GLN 69 -12.157 -3.088 8.431
518 HE22 GLN 69 2HE2 GLN 69 -11.639 -4.424 7.467
519 H ASP 70 H ASP 70 -10.519 -0.562 4.486
520 HA ASP 70 HA ASP 70 -9.338 1.410 2.866
521 HB2 ASP 70 1HB ASP 70 -11.242 1.218 1.473
522 HB3 ASP 70 2HB ASP 70 -11.025 -0.379 2.185
523 H SER 71 H SER 71 -10.037 3.542 2.380
524 HA SER 71 HA SER 71 -10.729 5.656 2.862
525 HB2 SER 71 1HB SER 71 -12.715 4.322 4.717
526 HB3 SER 71 2HB SER 71 -12.797 5.976 4.112
527 HG SER 71 HG SER 71 -13.498 3.623 2.893
528 H ASP 72 H ASP 72 -8.644 4.294 4.406
529 HA ASP 72 HA ASP 72 -8.886 5.413 7.080
530 HB2 ASP 72 1HB ASP 72 -6.963 3.566 5.722
531 HB3 ASP 72 2HB ASP 72 -6.451 4.418 7.176
532 H THR 73 H THR 73 -7.073 6.696 7.973
533 HA THR 73 HA THR 73 -6.075 8.599 5.956
534 HB THR 73 HB THR 73 -6.617 9.099 8.889
535 HG1 THR 73 1HG THR 73 -8.232 10.567 7.789
536 HG21 THR 73 1HG2 THR 73 -6.127 11.239 6.862
537 HG22 THR 73 2HG2 THR 73 -4.754 10.399 7.583
538 HG23 THR 73 3HG2 THR 73 -5.892 11.273 8.608
539 H LEU 74 H LEU 74 -3.941 9.149 5.919
540 HA LEU 74 HA LEU 74 -2.187 7.893 7.922
541 HB2 LEU 74 1HB LEU 74 -1.636 8.098 4.966
542 HB3 LEU 74 2HB LEU 74 -0.572 7.391 6.179
543 HG LEU 74 HG LEU 74 -3.282 6.303 5.420
544 HD11 LEU 74 1HD1 LEU 74 -0.749 4.893 4.788
545 HD12 LEU 74 2HD1 LEU 74 -1.219 6.247 3.761
546 HD13 LEU 74 3HD1 LEU 74 -2.302 4.868 3.952
547 HD21 LEU 74 1HD2 LEU 74 -1.518 4.432 6.658
548 HD22 LEU 74 2HD2 LEU 74 -3.102 4.989 7.197
549 HD23 LEU 74 3HD2 LEU 74 -1.647 5.864 7.678
550 H ILE 75 H ILE 75 -0.660 9.178 8.772
551 HA ILE 75 HA ILE 75 -0.538 11.940 7.826
552 HB ILE 75 HB ILE 75 0.733 10.815 10.318
553 HG12 ILE 75 1HG1 ILE 75 -1.569 10.344 10.602
554 HG13 ILE 75 2HG1 ILE 75 -1.302 11.862 11.452
555 HG21 ILE 75 1HG2 ILE 75 0.721 13.125 11.070
556 HG22 ILE 75 2HG2 ILE 75 1.577 12.983 9.535
557 HG23 ILE 75 3HG2 ILE 75 -0.065 13.626 9.572
558 HD11 ILE 75 1HD1 ILE 75 -2.006 12.799 9.037
559 HD12 ILE 75 2HD1 ILE 75 -2.910 11.284 9.061
560 HD13 ILE 75 3HD1 ILE 75 -3.151 12.476 10.339
561 H LEU 76 H LEU 76 1.222 12.840 6.922
562 HA LEU 76 HA LEU 76 3.591 11.125 6.590
563 HB2 LEU 76 1HB LEU 76 2.291 11.833 4.553
564 HB3 LEU 76 2HB LEU 76 2.803 13.484 4.895
565 HG LEU 76 HG LEU 76 5.191 12.602 4.721
566 HD11 LEU 76 1HD1 LEU 76 4.556 10.513 2.889
567 HD12 LEU 76 2HD1 LEU 76 3.800 10.162 4.443
568 HD13 LEU 76 3HD1 LEU 76 5.538 10.446 4.353
569 HD21 LEU 76 1HD2 LEU 76 3.517 12.487 2.218
570 HD22 LEU 76 2HD2 LEU 76 5.228 12.896 2.345
571 HD23 LEU 76 3HD2 LEU 76 4.009 13.981 3.015
572 H SER 77 H SER 77 5.593 11.862 7.120
573 HA SER 77 HA SER 77 5.867 14.638 8.023
574 HB2 SER 77 1HB SER 77 7.032 13.941 10.055
575 HB3 SER 77 2HB SER 77 5.409 13.253 10.021
576 HG SER 77 HG SER 77 7.494 11.748 8.933
577 H LYS 78 H LYS 78 7.555 15.549 7.076
578 HA LYS 78 HA LYS 78 9.421 14.049 5.537
579 HB2 LYS 78 1HB LYS 78 8.550 16.575 5.384
580 HB3 LYS 78 2HB LYS 78 10.033 16.861 6.285
581 HG2 LYS 78 1HG LYS 78 10.191 15.165 3.855
582 HG3 LYS 78 2HG LYS 78 9.966 16.903 3.646
583 HD2 LYS 78 1HD LYS 78 12.240 16.856 3.707
584 HD3 LYS 78 2HD LYS 78 11.932 16.969 5.442
585 HE2 LYS 78 1HE LYS 78 12.481 14.770 5.818
586 HE3 LYS 78 2HE LYS 78 12.062 14.273 4.180
587 HZ1 LYS 78 1HZ LYS 78 14.144 14.573 3.516
588 HZ2 LYS 78 2HZ LYS 78 14.579 14.755 5.140
589 HZ3 LYS 78 3HZ LYS 78 14.234 16.118 4.200
590 H LYS 79 H LYS 79 10.967 12.854 6.430
591 HA LYS 79 HA LYS 79 11.923 12.884 8.984
592 HB2 LYS 79 1HB LYS 79 13.522 12.254 6.495
593 HB3 LYS 79 2HB LYS 79 13.940 11.757 8.130
594 HG2 LYS 79 1HG LYS 79 11.270 10.991 7.084
595 HG3 LYS 79 2HG LYS 79 12.688 10.147 6.457
596 HD2 LYS 79 1HD LYS 79 13.347 9.788 8.893
597 HD3 LYS 79 2HD LYS 79 11.709 10.305 9.297
598 HE2 LYS 79 1HE LYS 79 11.416 8.034 9.170
599 HE3 LYS 79 2HE LYS 79 11.039 8.502 7.513
600 HZ1 LYS 79 1HZ LYS 79 12.728 6.574 8.071
601 HZ2 LYS 79 2HZ LYS 79 13.821 7.863 8.131
602 HZ3 LYS 79 3HZ LYS 79 12.933 7.573 6.721
603 H LYS 80 H LYS 80 12.451 14.741 9.995
604 HA LYS 80 HA LYS 80 13.687 16.976 8.920
605 HB2 LYS 80 1HB LYS 80 12.573 16.683 11.211
606 HB3 LYS 80 2HB LYS 80 14.129 16.073 11.760
607 HG2 LYS 80 1HG LYS 80 14.074 18.688 10.355
608 HG3 LYS 80 2HG LYS 80 13.459 18.611 12.008
609 HD2 LYS 80 1HD LYS 80 15.566 17.676 12.774
610 HD3 LYS 80 2HD LYS 80 16.182 17.658 11.120
611 HE2 LYS 80 1HE LYS 80 16.204 20.029 11.014
612 HE3 LYS 80 2HE LYS 80 15.278 20.172 12.507
613 HZ1 LYS 80 1HZ LYS 80 17.815 20.534 12.556
614 HZ2 LYS 80 2HZ LYS 80 17.907 18.846 12.524
615 HZ3 LYS 80 3HZ LYS 80 17.097 19.624 13.788
616 H GLY 81 H GLY 81 15.530 16.898 7.785
617 HA2 GLY 81 1HA GLY 81 17.969 17.055 8.156
618 HA3 GLY 81 2HA GLY 81 17.837 15.545 9.044
619 H SER 82 H SER 82 19.669 15.289 7.314
620 HA SER 82 HA SER 82 18.443 13.985 4.972
621 HB2 SER 82 1HB SER 82 20.369 14.635 3.628
622 HB3 SER 82 2HB SER 82 19.633 16.071 4.339
623 HG SER 82 HG SER 82 21.848 16.188 4.621
624 H GLY 83 H GLY 83 19.512 12.111 4.173
625 HA2 GLY 83 1HA GLY 83 21.599 10.967 5.886
626 HA3 GLY 83 2HA GLY 83 20.095 10.075 5.710
627 HA PRO 84 HA PRO 84 23.203 9.506 2.064
628 HB2 PRO 84 1HB PRO 84 24.778 7.500 2.995
629 HB3 PRO 84 2HB PRO 84 25.189 9.209 3.181
630 HG2 PRO 84 1HG PRO 84 23.948 7.333 5.156
631 HG3 PRO 84 2HG PRO 84 25.224 8.539 5.407
632 HD2 PRO 84 1HD PRO 84 22.642 8.985 6.090
633 HD3 PRO 84 2HD PRO 84 23.723 10.282 5.542
634 H SER 85 H SER 85 22.930 7.865 0.562
635 HA SER 85 HA SER 85 21.759 5.337 1.324
636 HB2 SER 85 1HB SER 85 19.686 5.556 0.195
637 HB3 SER 85 2HB SER 85 19.844 7.026 1.156
638 HG SER 85 HG SER 85 20.699 8.011 -0.800
639 H SER 86 H SER 86 21.344 3.962 -0.652
640 HA SER 86 HA SER 86 22.707 4.713 -3.077
641 HB2 SER 86 1HB SER 86 23.898 2.681 -1.190
642 HB3 SER 86 2HB SER 86 24.273 2.700 -2.913
643 HG SER 86 HG SER 86 25.742 4.084 -2.310
644 H GLY 87 H GLY 87 22.750 2.810 -4.641
645 HA2 GLY 87 1HA GLY 87 20.404 1.079 -4.155
646 HA3 GLY 87 2HA GLY 87 20.671 1.879 -5.696
Start of MODEL 14
1 H1 GLY 1 H GLY 1 -3.507 -12.982 -16.712
2 HA2 GLY 1 1HA GLY 1 -5.251 -13.273 -19.080
3 HA3 GLY 1 2HA GLY 1 -5.836 -13.243 -17.423
4 H SER 2 H SER 2 -7.032 -11.463 -17.226
5 HA SER 2 HA SER 2 -6.316 -9.023 -18.609
6 HB2 SER 2 1HB SER 2 -8.418 -8.148 -17.775
7 HB3 SER 2 2HB SER 2 -8.686 -9.775 -18.401
8 HG SER 2 HG SER 2 -9.693 -9.511 -16.385
9 H SER 3 H SER 3 -6.655 -6.936 -17.208
10 HA SER 3 HA SER 3 -5.170 -7.242 -14.684
11 HB2 SER 3 1HB SER 3 -3.892 -6.316 -16.792
12 HB3 SER 3 2HB SER 3 -4.747 -4.823 -16.401
13 HG SER 3 HG SER 3 -2.549 -5.749 -15.292
14 H GLY 4 H GLY 4 -6.412 -6.590 -13.063
15 HA2 GLY 4 1HA GLY 4 -7.581 -3.993 -13.004
16 HA3 GLY 4 2HA GLY 4 -8.809 -5.226 -13.248
17 H SER 5 H SER 5 -5.860 -5.437 -11.303
18 HA SER 5 HA SER 5 -7.353 -6.452 -9.069
19 HB2 SER 5 1HB SER 5 -4.431 -5.816 -9.486
20 HB3 SER 5 2HB SER 5 -5.064 -6.390 -7.943
21 HG SER 5 HG SER 5 -5.755 -7.833 -10.222
22 H SER 6 H SER 6 -8.711 -4.836 -8.346
23 HA SER 6 HA SER 6 -7.676 -2.218 -7.695
24 HB2 SER 6 1HB SER 6 -9.928 -1.644 -7.119
25 HB3 SER 6 2HB SER 6 -10.012 -2.647 -8.567
26 HG SER 6 HG SER 6 -11.460 -3.599 -7.301
27 H GLY 7 H GLY 7 -6.792 -1.653 -5.822
28 HA2 GLY 7 1HA GLY 7 -6.955 -3.528 -3.575
29 HA3 GLY 7 2HA GLY 7 -5.775 -2.239 -3.761
30 H ILE 8 H ILE 8 -6.265 -1.671 -1.557
31 HA ILE 8 HA ILE 8 -8.911 -0.602 -1.009
32 HB ILE 8 HB ILE 8 -8.045 -0.151 1.250
33 HG12 ILE 8 1HG1 ILE 8 -5.499 -1.542 0.447
34 HG13 ILE 8 2HG1 ILE 8 -5.653 0.208 0.346
35 HG21 ILE 8 1HG2 ILE 8 -7.210 -2.751 1.480
36 HG22 ILE 8 2HG2 ILE 8 -8.888 -2.209 1.473
37 HG23 ILE 8 3HG2 ILE 8 -8.138 -2.775 -0.020
38 HD11 ILE 8 1HD1 ILE 8 -6.550 -0.482 2.899
39 HD12 ILE 8 2HD1 ILE 8 -5.098 -1.442 2.617
40 HD13 ILE 8 3HD1 ILE 8 -5.038 0.314 2.463
41 H GLN 9 H GLN 9 -9.288 1.563 -0.337
42 HA GLN 9 HA GLN 9 -7.455 3.472 -1.600
43 HB2 GLN 9 1HB GLN 9 -9.973 3.311 -2.164
44 HB3 GLN 9 2HB GLN 9 -10.222 4.121 -0.623
45 HG2 GLN 9 1HG GLN 9 -8.622 5.901 -1.484
46 HG3 GLN 9 2HG GLN 9 -8.824 5.151 -3.066
47 HE21 GLN 9 1HE2 GLN 9 -11.229 4.735 -3.592
48 HE22 GLN 9 2HE2 GLN 9 -12.285 6.073 -3.311
49 H VAL 10 H VAL 10 -6.132 4.596 -0.350
50 HA VAL 10 HA VAL 10 -6.926 5.107 2.444
51 HB VAL 10 HB VAL 10 -4.551 5.163 3.029
52 HG11 VAL 10 1HG1 VAL 10 -4.422 2.928 3.319
53 HG12 VAL 10 2HG1 VAL 10 -6.061 2.965 2.666
54 HG13 VAL 10 3HG1 VAL 10 -4.699 2.582 1.612
55 HG21 VAL 10 1HG2 VAL 10 -4.189 5.431 0.254
56 HG22 VAL 10 2HG2 VAL 10 -2.948 5.387 1.506
57 HG23 VAL 10 3HG2 VAL 10 -3.449 3.896 0.708
58 H PHE 11 H PHE 11 -6.431 7.128 3.346
59 HA PHE 11 HA PHE 11 -6.081 9.254 1.353
60 HB2 PHE 11 1HB PHE 11 -7.335 9.214 4.094
61 HB3 PHE 11 2HB PHE 11 -6.955 10.718 3.263
62 HD1 PHE 11 1HD PHE 11 -8.063 11.230 1.090
63 HD2 PHE 11 2HD PHE 11 -9.245 7.954 3.537
64 HE1 PHE 11 1HE PHE 11 -10.206 11.109 -0.113
65 HE2 PHE 11 2HE PHE 11 -11.389 7.827 2.337
66 HZ PHE 11 HZ PHE 11 -11.872 9.405 0.509
67 H VAL 12 H VAL 12 -4.052 9.930 1.163
68 HA VAL 12 HA VAL 12 -2.249 9.835 3.452
69 HB VAL 12 HB VAL 12 -1.750 10.478 0.545
70 HG11 VAL 12 1HG1 VAL 12 -0.214 11.770 1.875
71 HG12 VAL 12 2HG1 VAL 12 0.185 10.358 2.855
72 HG13 VAL 12 3HG1 VAL 12 0.652 10.413 1.155
73 HG21 VAL 12 1HG2 VAL 12 -1.622 8.270 0.323
74 HG22 VAL 12 2HG2 VAL 12 -0.231 8.284 1.408
75 HG23 VAL 12 3HG2 VAL 12 -1.852 8.036 2.056
76 H LYS 13 H LYS 13 -2.393 11.520 4.792
77 HA LYS 13 HA LYS 13 -3.030 14.170 3.788
78 HB2 LYS 13 1HB LYS 13 -4.039 13.270 5.890
79 HB3 LYS 13 2HB LYS 13 -2.441 13.301 6.623
80 HG2 LYS 13 1HG LYS 13 -2.386 15.769 6.138
81 HG3 LYS 13 2HG LYS 13 -4.091 15.637 5.702
82 HD2 LYS 13 1HD LYS 13 -4.237 14.445 8.056
83 HD3 LYS 13 2HD LYS 13 -2.779 15.392 8.364
84 HE2 LYS 13 1HE LYS 13 -4.685 16.653 9.097
85 HE3 LYS 13 2HE LYS 13 -4.018 17.425 7.660
86 HZ1 LYS 13 1HZ LYS 13 -5.953 15.544 6.877
87 HZ2 LYS 13 2HZ LYS 13 -5.970 17.222 6.668
88 HZ3 LYS 13 3HZ LYS 13 -6.625 16.538 8.070
89 H ASN 14 H ASN 14 -1.573 15.680 3.323
90 HA ASN 14 HA ASN 14 1.232 15.139 3.717
91 HB2 ASN 14 1HB ASN 14 0.159 17.737 2.664
92 HB3 ASN 14 2HB ASN 14 1.644 16.895 2.232
93 HD21 ASN 14 1HD2 ASN 14 -1.256 17.745 1.095
94 HD22 ASN 14 2HD2 ASN 14 -1.533 16.475 -0.043
95 HA PRO 15 HA PRO 15 1.908 17.447 7.390
96 HB2 PRO 15 1HB PRO 15 4.422 18.377 6.957
97 HB3 PRO 15 2HB PRO 15 4.074 16.683 7.323
98 HG2 PRO 15 1HG PRO 15 4.589 17.983 4.676
99 HG3 PRO 15 2HG PRO 15 5.198 16.440 5.302
100 HD2 PRO 15 1HD PRO 15 3.122 16.592 3.570
101 HD3 PRO 15 2HD PRO 15 3.244 15.323 4.806
102 H ASP 16 H ASP 16 2.150 18.994 4.291
103 HA ASP 16 HA ASP 16 2.295 21.664 5.424
104 HB2 ASP 16 1HB ASP 16 2.331 20.533 2.650
105 HB3 ASP 16 2HB ASP 16 1.952 22.237 2.886
106 H GLY 17 H GLY 17 -0.021 19.699 3.578
107 HA2 GLY 17 1HA GLY 17 -2.328 20.301 4.808
108 HA3 GLY 17 2HA GLY 17 -2.071 21.739 3.831
109 H GLY 18 H GLY 18 -3.821 19.065 3.882
110 HA2 GLY 18 1HA GLY 18 -5.161 18.829 1.767
111 HA3 GLY 18 2HA GLY 18 -3.610 18.616 0.969
112 H SER 19 H SER 19 -5.345 16.686 0.512
113 HA SER 19 HA SER 19 -4.099 14.385 1.674
114 HB2 SER 19 1HB SER 19 -6.166 13.396 2.616
115 HB3 SER 19 2HB SER 19 -5.686 14.864 3.467
116 HG SER 19 HG SER 19 -7.274 15.991 2.341
117 H TYR 20 H TYR 20 -3.931 12.962 0.083
118 HA TYR 20 HA TYR 20 -5.931 13.029 -2.078
119 HB2 TYR 20 1HB TYR 20 -3.190 11.832 -2.367
120 HB3 TYR 20 2HB TYR 20 -4.267 12.442 -3.619
121 HD1 TYR 20 2HD TYR 20 -4.888 15.070 -3.171
122 HD2 TYR 20 1HD TYR 20 -1.307 13.096 -1.998
123 HE1 TYR 20 2HE TYR 20 -3.717 17.232 -3.132
124 HE2 TYR 20 1HE TYR 20 -0.125 15.253 -1.954
125 HH TYR 20 HH TYR 20 -1.432 18.092 -3.293
126 H ALA 21 H ALA 21 -6.447 10.985 -3.111
127 HA ALA 21 HA ALA 21 -6.454 8.783 -1.166
128 HB1 ALA 21 1HB ALA 21 -8.505 9.925 -2.673
129 HB2 ALA 21 2HB ALA 21 -8.188 8.363 -3.429
130 HB3 ALA 21 3HB ALA 21 -8.582 8.447 -1.712
131 H TYR 22 H TYR 22 -4.940 7.300 -1.500
132 HA TYR 22 HA TYR 22 -3.956 6.815 -4.211
133 HB2 TYR 22 1HB TYR 22 -2.904 6.195 -1.467
134 HB3 TYR 22 2HB TYR 22 -2.278 5.344 -2.875
135 HD1 TYR 22 2HD TYR 22 -2.893 8.805 -1.621
136 HD2 TYR 22 1HD TYR 22 -0.502 6.260 -4.051
137 HE1 TYR 22 2HE TYR 22 -1.358 10.676 -2.061
138 HE2 TYR 22 1HE TYR 22 1.040 8.123 -4.497
139 HH TYR 22 HH TYR 22 0.354 11.388 -3.358
140 H ALA 23 H ALA 23 -3.677 4.637 -4.990
141 HA ALA 23 HA ALA 23 -5.654 2.759 -3.867
142 HB1 ALA 23 1HB ALA 23 -5.131 2.182 -6.612
143 HB2 ALA 23 2HB ALA 23 -6.649 2.651 -5.846
144 HB3 ALA 23 3HB ALA 23 -5.547 3.889 -6.451
145 H ILE 24 H ILE 24 -4.790 0.971 -3.067
146 HA ILE 24 HA ILE 24 -2.665 -0.410 -4.451
147 HB ILE 24 HB ILE 24 -1.186 0.925 -3.234
148 HG12 ILE 24 1HG1 ILE 24 -1.583 -1.359 -1.308
149 HG13 ILE 24 2HG1 ILE 24 -0.948 -1.610 -2.930
150 HG21 ILE 24 1HG2 ILE 24 -3.065 1.851 -1.782
151 HG22 ILE 24 2HG2 ILE 24 -2.712 0.521 -0.680
152 HG23 ILE 24 3HG2 ILE 24 -1.470 1.718 -1.042
153 HD11 ILE 24 1HD1 ILE 24 0.360 0.456 -1.267
154 HD12 ILE 24 2HD1 ILE 24 0.616 -1.234 -0.829
155 HD13 ILE 24 3HD1 ILE 24 1.049 -0.666 -2.441
156 H ASN 25 H ASN 25 -2.482 -2.574 -3.864
157 HA ASN 25 HA ASN 25 -4.807 -3.690 -2.607
158 HB2 ASN 25 1HB ASN 25 -2.401 -4.776 -4.005
159 HB3 ASN 25 2HB ASN 25 -3.330 -5.860 -2.974
160 HD21 ASN 25 1HD2 ASN 25 -3.299 -3.998 -5.888
161 HD22 ASN 25 2HD2 ASN 25 -4.748 -4.649 -6.567
162 HA PRO 26 HA PRO 26 -3.297 -4.027 1.513
163 HB2 PRO 26 1HB PRO 26 -4.840 -6.088 2.373
164 HB3 PRO 26 2HB PRO 26 -5.472 -4.457 2.115
165 HG2 PRO 26 1HG PRO 26 -5.629 -6.855 0.329
166 HG3 PRO 26 2HG PRO 26 -6.886 -5.666 0.720
167 HD2 PRO 26 1HD PRO 26 -5.473 -5.587 -1.589
168 HD3 PRO 26 2HD PRO 26 -6.069 -4.122 -0.784
169 H ASN 27 H ASN 27 -3.076 -6.600 -0.770
170 HA ASN 27 HA ASN 27 -1.534 -8.322 0.986
171 HB2 ASN 27 1HB ASN 27 -3.068 -9.348 -0.620
172 HB3 ASN 27 2HB ASN 27 -2.208 -8.583 -1.953
173 HD21 ASN 27 1HD2 ASN 27 -1.951 -10.732 -2.779
174 HD22 ASN 27 2HD2 ASN 27 -0.682 -11.740 -2.179
175 H SER 28 H SER 28 -0.934 -5.649 -0.932
176 HA SER 28 HA SER 28 1.739 -6.440 -1.748
177 HB2 SER 28 1HB SER 28 -0.007 -4.055 -2.226
178 HB3 SER 28 2HB SER 28 1.733 -3.905 -2.463
179 HG SER 28 HG SER 28 -0.147 -5.310 -3.930
180 H PHE 29 H PHE 29 3.644 -5.341 -1.089
181 HA PHE 29 HA PHE 29 3.846 -4.910 1.677
182 HB2 PHE 29 1HB PHE 29 5.761 -4.014 -0.488
183 HB3 PHE 29 2HB PHE 29 6.138 -4.189 1.223
184 HD1 PHE 29 2HD PHE 29 5.149 -6.693 2.040
185 HD2 PHE 29 1HD PHE 29 6.792 -5.625 -1.739
186 HE1 PHE 29 2HE PHE 29 5.788 -9.038 1.658
187 HE2 PHE 29 1HE PHE 29 7.433 -7.969 -2.127
188 HZ PHE 29 HZ PHE 29 6.932 -9.679 -0.426
189 H ILE 30 H ILE 30 4.466 -2.964 2.810
190 HA ILE 30 HA ILE 30 2.747 -0.815 2.378
191 HB ILE 30 HB ILE 30 5.260 -1.063 4.011
192 HG12 ILE 30 1HG1 ILE 30 2.952 -2.162 4.551
193 HG13 ILE 30 2HG1 ILE 30 3.843 -1.347 5.831
194 HG21 ILE 30 1HG2 ILE 30 4.093 1.159 5.015
195 HG22 ILE 30 2HG2 ILE 30 5.426 1.175 3.861
196 HG23 ILE 30 3HG2 ILE 30 3.767 1.365 3.295
197 HD11 ILE 30 1HD1 ILE 30 2.034 0.415 4.383
198 HD12 ILE 30 2HD1 ILE 30 1.224 -0.926 5.193
199 HD13 ILE 30 3HD1 ILE 30 2.246 0.175 6.117
200 H LEU 31 H LEU 31 6.156 -1.214 1.505
201 HA LEU 31 HA LEU 31 6.853 1.278 0.663
202 HB2 LEU 31 1HB LEU 31 8.349 -0.647 0.597
203 HB3 LEU 31 2HB LEU 31 7.437 -1.319 -0.754
204 HG LEU 31 HG LEU 31 8.112 0.924 -1.931
205 HD11 LEU 31 1HD1 LEU 31 9.996 2.012 -1.178
206 HD12 LEU 31 2HD1 LEU 31 10.521 0.650 -0.189
207 HD13 LEU 31 3HD1 LEU 31 9.167 1.650 0.336
208 HD21 LEU 31 1HD2 LEU 31 8.944 -0.859 -3.041
209 HD22 LEU 31 2HD2 LEU 31 9.544 -1.633 -1.574
210 HD23 LEU 31 3HD2 LEU 31 10.458 -0.320 -2.316
211 H GLY 32 H GLY 32 5.010 -1.116 -1.209
212 HA2 GLY 32 1HA GLY 32 4.763 0.068 -3.638
213 HA3 GLY 32 2HA GLY 32 3.430 -0.770 -2.858
214 H LEU 33 H LEU 33 3.222 1.130 -0.667
215 HA LEU 33 HA LEU 33 1.544 3.057 -1.989
216 HB2 LEU 33 1HB LEU 33 0.806 2.053 0.079
217 HB3 LEU 33 2HB LEU 33 2.240 2.647 0.915
218 HG LEU 33 HG LEU 33 1.445 4.836 0.979
219 HD11 LEU 33 1HD1 LEU 33 -0.249 4.000 -1.329
220 HD12 LEU 33 2HD1 LEU 33 0.804 5.404 -1.154
221 HD13 LEU 33 3HD1 LEU 33 -0.753 5.361 -0.326
222 HD21 LEU 33 1HD2 LEU 33 -0.038 4.303 2.538
223 HD22 LEU 33 2HD2 LEU 33 -0.294 2.724 1.795
224 HD23 LEU 33 3HD2 LEU 33 -1.262 4.108 1.283
225 H LYS 34 H LYS 34 4.448 3.212 0.057
226 HA LYS 34 HA LYS 34 4.777 5.984 0.037
227 HB2 LYS 34 1HB LYS 34 6.608 3.660 0.454
228 HB3 LYS 34 2HB LYS 34 7.309 5.263 0.271
229 HG2 LYS 34 1HG LYS 34 7.082 5.196 2.531
230 HG3 LYS 34 2HG LYS 34 5.513 5.882 2.100
231 HD2 LYS 34 1HD LYS 34 4.397 3.870 2.468
232 HD3 LYS 34 2HD LYS 34 5.876 2.916 2.337
233 HE2 LYS 34 1HE LYS 34 5.520 4.917 4.539
234 HE3 LYS 34 2HE LYS 34 4.836 3.298 4.671
235 HZ1 LYS 34 1HZ LYS 34 6.950 2.329 4.586
236 HZ2 LYS 34 2HZ LYS 34 7.130 3.646 5.632
237 HZ3 LYS 34 3HZ LYS 34 7.691 3.748 4.039
238 H GLN 35 H GLN 35 6.586 3.623 -1.939
239 HA GLN 35 HA GLN 35 7.955 5.271 -3.591
240 HB2 GLN 35 1HB GLN 35 7.651 2.647 -3.565
241 HB3 GLN 35 2HB GLN 35 6.529 2.983 -4.876
242 HG2 GLN 35 1HG GLN 35 9.447 3.714 -4.783
243 HG3 GLN 35 2HG GLN 35 8.708 2.442 -5.755
244 HE21 GLN 35 1HE2 GLN 35 10.170 5.114 -6.246
245 HE22 GLN 35 2HE2 GLN 35 9.209 5.864 -7.469
246 H GLN 36 H GLN 36 4.550 4.367 -3.943
247 HA GLN 36 HA GLN 36 4.039 5.601 -6.389
248 HB2 GLN 36 1HB GLN 36 2.384 4.801 -4.049
249 HB3 GLN 36 2HB GLN 36 1.658 5.890 -5.224
250 HG2 GLN 36 1HG GLN 36 2.339 4.209 -6.991
251 HG3 GLN 36 2HG GLN 36 2.687 3.106 -5.660
252 HE21 GLN 36 1HE2 GLN 36 0.943 2.525 -4.248
253 HE22 GLN 36 2HE2 GLN 36 -0.682 2.526 -4.835
254 H ILE 37 H ILE 37 4.057 6.922 -3.119
255 HA ILE 37 HA ILE 37 3.020 9.472 -3.818
256 HB ILE 37 HB ILE 37 4.680 8.621 -1.444
257 HG12 ILE 37 1HG1 ILE 37 1.764 9.314 -1.392
258 HG13 ILE 37 2HG1 ILE 37 2.269 7.713 -1.923
259 HG21 ILE 37 1HG2 ILE 37 4.867 10.754 -0.868
260 HG22 ILE 37 2HG2 ILE 37 4.052 11.232 -2.357
261 HG23 ILE 37 3HG2 ILE 37 3.111 10.921 -0.898
262 HD11 ILE 37 1HD1 ILE 37 3.149 8.875 0.696
263 HD12 ILE 37 2HD1 ILE 37 1.642 7.977 0.514
264 HD13 ILE 37 3HD1 ILE 37 3.183 7.193 0.170
265 H GLU 38 H GLU 38 6.276 8.143 -3.580
266 HA GLU 38 HA GLU 38 7.649 10.603 -3.893
267 HB2 GLU 38 1HB GLU 38 8.814 8.716 -2.965
268 HB3 GLU 38 2HB GLU 38 8.495 7.749 -4.398
269 HG2 GLU 38 1HG GLU 38 9.865 9.426 -5.688
270 HG3 GLU 38 2HG GLU 38 10.345 10.098 -4.131
271 H ASP 39 H ASP 39 6.196 8.364 -6.119
272 HA ASP 39 HA ASP 39 7.507 9.512 -8.434
273 HB2 ASP 39 1HB ASP 39 5.637 7.250 -7.937
274 HB3 ASP 39 2HB ASP 39 5.620 7.977 -9.541
275 H GLN 40 H GLN 40 4.630 9.994 -6.612
276 HA GLN 40 HA GLN 40 3.298 11.444 -8.756
277 HB2 GLN 40 1HB GLN 40 2.470 10.858 -5.910
278 HB3 GLN 40 2HB GLN 40 1.486 11.749 -7.064
279 HG2 GLN 40 1HG GLN 40 2.465 9.021 -7.761
280 HG3 GLN 40 2HG GLN 40 1.088 9.209 -6.676
281 HE21 GLN 40 1HE2 GLN 40 -0.319 11.221 -7.664
282 HE22 GLN 40 2HE2 GLN 40 -0.844 10.900 -9.278
283 H GLN 41 H GLN 41 4.291 12.138 -5.399
284 HA GLN 41 HA GLN 41 4.093 14.982 -5.860
285 HB2 GLN 41 1HB GLN 41 5.123 13.466 -3.456
286 HB3 GLN 41 2HB GLN 41 4.788 15.191 -3.516
287 HG2 GLN 41 1HG GLN 41 2.399 14.330 -4.254
288 HG3 GLN 41 2HG GLN 41 2.919 12.896 -3.371
289 HE21 GLN 41 1HE2 GLN 41 3.281 13.032 -1.156
290 HE22 GLN 41 2HE2 GLN 41 2.684 14.347 -0.207
291 H GLY 42 H GLY 42 6.658 12.593 -5.382
292 HA2 GLY 42 1HA GLY 42 8.713 12.894 -6.662
293 HA3 GLY 42 2HA GLY 42 8.576 14.618 -6.352
294 H LEU 43 H LEU 43 7.673 13.591 -3.516
295 HA LEU 43 HA LEU 43 10.208 14.031 -2.293
296 HB2 LEU 43 1HB LEU 43 7.762 14.479 -1.447
297 HB3 LEU 43 2HB LEU 43 7.912 12.844 -0.806
298 HG LEU 43 HG LEU 43 10.046 14.818 -0.160
299 HD11 LEU 43 1HD1 LEU 43 7.269 14.825 0.990
300 HD12 LEU 43 2HD1 LEU 43 8.175 16.176 0.309
301 HD13 LEU 43 3HD1 LEU 43 8.665 15.475 1.851
302 HD21 LEU 43 1HD2 LEU 43 8.996 12.269 0.844
303 HD22 LEU 43 2HD2 LEU 43 9.412 13.441 2.094
304 HD23 LEU 43 3HD2 LEU 43 10.627 12.937 0.919
305 HA PRO 44 HA PRO 44 11.721 9.880 -2.304
306 HB2 PRO 44 1HB PRO 44 13.671 10.199 -0.442
307 HB3 PRO 44 2HB PRO 44 13.810 10.814 -2.094
308 HG2 PRO 44 1HG PRO 44 13.052 12.268 0.411
309 HG3 PRO 44 2HG PRO 44 14.129 12.784 -0.900
310 HD2 PRO 44 1HD PRO 44 11.570 13.646 -0.692
311 HD3 PRO 44 2HD PRO 44 12.378 13.421 -2.257
312 H LYS 45 H LYS 45 11.992 8.053 -0.861
313 HA LYS 45 HA LYS 45 9.943 7.969 1.153
314 HB2 LYS 45 1HB LYS 45 11.966 5.821 0.524
315 HB3 LYS 45 2HB LYS 45 10.393 5.623 1.285
316 HG2 LYS 45 1HG LYS 45 9.270 6.153 -0.768
317 HG3 LYS 45 2HG LYS 45 10.801 6.552 -1.549
318 HD2 LYS 45 1HD LYS 45 10.461 3.842 -0.355
319 HD3 LYS 45 2HD LYS 45 9.672 4.199 -1.893
320 HE2 LYS 45 1HE LYS 45 11.755 3.299 -2.483
321 HE3 LYS 45 2HE LYS 45 11.949 5.041 -2.672
322 HZ1 LYS 45 1HZ LYS 45 13.765 3.729 -1.458
323 HZ2 LYS 45 2HZ LYS 45 12.696 3.711 -0.147
324 HZ3 LYS 45 3HZ LYS 45 13.241 5.185 -0.774
325 H LYS 46 H LYS 46 13.465 7.960 1.091
326 HA LYS 46 HA LYS 46 13.989 7.307 3.741
327 HB2 LYS 46 1HB LYS 46 16.111 8.560 3.440
328 HB3 LYS 46 2HB LYS 46 15.770 7.455 2.115
329 HG2 LYS 46 1HG LYS 46 15.230 9.193 0.650
330 HG3 LYS 46 2HG LYS 46 15.034 10.357 1.963
331 HD2 LYS 46 1HD LYS 46 17.376 10.441 2.351
332 HD3 LYS 46 2HD LYS 46 17.665 9.044 1.311
333 HE2 LYS 46 1HE LYS 46 18.250 10.733 -0.116
334 HE3 LYS 46 2HE LYS 46 16.536 10.587 -0.501
335 HZ1 LYS 46 1HZ LYS 46 17.420 12.904 -0.107
336 HZ2 LYS 46 2HZ LYS 46 17.534 12.494 1.530
337 HZ3 LYS 46 3HZ LYS 46 16.029 12.480 0.757
338 H GLN 47 H GLN 47 12.392 10.022 2.506
339 HA GLN 47 HA GLN 47 12.933 11.599 4.923
340 HB2 GLN 47 1HB GLN 47 12.073 12.285 2.153
341 HB3 GLN 47 2HB GLN 47 11.529 13.319 3.467
342 HG2 GLN 47 1HG GLN 47 14.063 13.298 4.122
343 HG3 GLN 47 2HG GLN 47 14.278 12.857 2.429
344 HE21 GLN 47 1HE2 GLN 47 13.003 14.282 0.885
345 HE22 GLN 47 2HE2 GLN 47 13.052 15.980 1.198
346 H GLN 48 H GLN 48 10.179 10.782 2.805
347 HA GLN 48 HA GLN 48 8.170 11.561 4.587
348 HB2 GLN 48 1HB GLN 48 6.683 10.676 3.078
349 HB3 GLN 48 2HB GLN 48 8.102 10.833 2.053
350 HG2 GLN 48 1HG GLN 48 8.628 8.435 2.612
351 HG3 GLN 48 2HG GLN 48 7.029 8.346 3.349
352 HE21 GLN 48 1HE2 GLN 48 8.337 9.760 0.365
353 HE22 GLN 48 2HE2 GLN 48 7.200 9.003 -0.693
354 H GLN 49 H GLN 49 6.914 10.443 6.069
355 HA GLN 49 HA GLN 49 7.622 7.694 6.721
356 HB2 GLN 49 1HB GLN 49 9.160 9.035 8.075
357 HB3 GLN 49 2HB GLN 49 7.806 9.944 8.732
358 HG2 GLN 49 1HG GLN 49 6.944 7.921 9.780
359 HG3 GLN 49 2HG GLN 49 8.287 6.997 9.108
360 HE21 GLN 49 1HE2 GLN 49 9.273 6.393 10.956
361 HE22 GLN 49 2HE2 GLN 49 9.964 7.493 12.095
362 H LEU 50 H LEU 50 5.700 6.734 6.622
363 HA LEU 50 HA LEU 50 3.292 8.147 7.421
364 HB2 LEU 50 1HB LEU 50 3.747 5.418 6.231
365 HB3 LEU 50 2HB LEU 50 2.158 6.056 6.647
366 HG LEU 50 HG LEU 50 4.002 7.371 4.661
367 HD11 LEU 50 1HD1 LEU 50 3.159 4.957 4.156
368 HD12 LEU 50 2HD1 LEU 50 3.038 6.212 2.924
369 HD13 LEU 50 3HD1 LEU 50 1.617 5.764 3.867
370 HD21 LEU 50 1HD2 LEU 50 1.485 8.065 5.875
371 HD22 LEU 50 2HD2 LEU 50 1.315 7.912 4.126
372 HD23 LEU 50 3HD2 LEU 50 2.514 9.014 4.803
373 H GLU 51 H GLU 51 2.152 7.802 9.242
374 HA GLU 51 HA GLU 51 2.945 5.559 10.972
375 HB2 GLU 51 1HB GLU 51 2.840 8.468 11.600
376 HB3 GLU 51 2HB GLU 51 2.316 7.345 12.847
377 HG2 GLU 51 1HG GLU 51 4.484 6.188 12.676
378 HG3 GLU 51 2HG GLU 51 5.004 7.388 11.494
379 H PHE 52 H PHE 52 1.322 4.659 12.242
380 HA PHE 52 HA PHE 52 -1.390 5.717 11.917
381 HB2 PHE 52 1HB PHE 52 -0.799 3.859 10.217
382 HB3 PHE 52 2HB PHE 52 -0.873 2.772 11.599
383 HD1 PHE 52 2HD PHE 52 -2.978 5.691 10.638
384 HD2 PHE 52 1HD PHE 52 -2.786 1.509 11.405
385 HE1 PHE 52 2HE PHE 52 -5.420 5.535 10.380
386 HE2 PHE 52 1HE PHE 52 -5.227 1.346 11.147
387 HZ PHE 52 HZ PHE 52 -6.548 3.361 10.636
388 H GLN 53 H GLN 53 -2.723 5.397 13.648
389 HA GLN 53 HA GLN 53 -3.133 5.237 15.900
390 HB2 GLN 53 1HB GLN 53 -2.169 2.423 15.359
391 HB3 GLN 53 2HB GLN 53 -3.195 2.927 16.696
392 HG2 GLN 53 1HG GLN 53 -4.872 3.679 14.979
393 HG3 GLN 53 2HG GLN 53 -3.876 2.869 13.771
394 HE21 GLN 53 1HE2 GLN 53 -3.478 0.567 14.094
395 HE22 GLN 53 2HE2 GLN 53 -4.711 -0.397 14.825
396 H GLY 54 H GLY 54 -0.390 6.066 15.180
397 HA2 GLY 54 1HA GLY 54 1.430 6.716 16.450
398 HA3 GLY 54 2HA GLY 54 0.749 5.835 17.809
399 H GLN 55 H GLN 55 1.607 4.625 14.591
400 HA GLN 55 HA GLN 55 3.823 3.116 15.764
401 HB2 GLN 55 1HB GLN 55 3.045 1.036 15.183
402 HB3 GLN 55 2HB GLN 55 1.527 1.832 15.578
403 HG2 GLN 55 1HG GLN 55 1.367 2.386 13.097
404 HG3 GLN 55 2HG GLN 55 2.659 1.208 12.875
405 HE21 GLN 55 1HE2 GLN 55 0.348 0.753 11.615
406 HE22 GLN 55 2HE2 GLN 55 -0.522 -0.541 12.360
407 H VAL 56 H VAL 56 5.496 2.668 14.366
408 HA VAL 56 HA VAL 56 5.548 4.244 11.940
409 HB VAL 56 HB VAL 56 7.718 2.464 13.053
410 HG11 VAL 56 1HG1 VAL 56 7.496 4.253 10.745
411 HG12 VAL 56 2HG1 VAL 56 8.928 4.524 11.740
412 HG13 VAL 56 3HG1 VAL 56 8.619 2.929 11.052
413 HG21 VAL 56 1HG2 VAL 56 7.388 3.970 14.783
414 HG22 VAL 56 2HG2 VAL 56 8.620 4.775 13.812
415 HG23 VAL 56 3HG2 VAL 56 6.934 5.280 13.694
416 H LEU 57 H LEU 57 5.500 3.507 9.888
417 HA LEU 57 HA LEU 57 4.943 0.658 9.511
418 HB2 LEU 57 1HB LEU 57 4.686 2.805 7.430
419 HB3 LEU 57 2HB LEU 57 3.905 1.226 7.477
420 HG LEU 57 HG LEU 57 3.281 3.535 9.318
421 HD11 LEU 57 1HD1 LEU 57 1.840 2.461 6.901
422 HD12 LEU 57 2HD1 LEU 57 2.543 4.065 7.101
423 HD13 LEU 57 3HD1 LEU 57 1.140 3.592 8.059
424 HD21 LEU 57 1HD2 LEU 57 2.403 1.944 10.607
425 HD22 LEU 57 2HD2 LEU 57 2.628 0.707 9.370
426 HD23 LEU 57 3HD2 LEU 57 1.191 1.730 9.344
427 H GLN 58 H GLN 58 6.167 -0.658 8.242
428 HA GLN 58 HA GLN 58 8.806 0.341 7.517
429 HB2 GLN 58 1HB GLN 58 7.700 -2.472 7.525
430 HB3 GLN 58 2HB GLN 58 9.371 -2.039 7.191
431 HG2 GLN 58 1HG GLN 58 7.927 -1.536 9.784
432 HG3 GLN 58 2HG GLN 58 9.050 -2.860 9.475
433 HE21 GLN 58 1HE2 GLN 58 9.824 -1.564 11.507
434 HE22 GLN 58 2HE2 GLN 58 11.066 -0.408 11.184
435 H ASP 59 H ASP 59 9.640 -1.096 5.465
436 HA ASP 59 HA ASP 59 7.817 -0.342 3.281
437 HB2 ASP 59 1HB ASP 59 10.780 -0.798 2.985
438 HB3 ASP 59 2HB ASP 59 9.695 0.078 1.909
439 H TRP 60 H TRP 60 9.342 -2.959 4.837
440 HA TRP 60 HA TRP 60 9.080 -4.723 2.523
441 HB2 TRP 60 1HB TRP 60 10.466 -6.223 3.620
442 HB3 TRP 60 2HB TRP 60 11.062 -4.683 4.234
443 HD1 TRP 60 HD TRP 60 8.733 -7.576 5.327
444 HE1 TRP 60 1HE TRP 60 8.785 -7.711 7.897
445 HE3 TRP 60 3HE TRP 60 11.644 -3.487 6.296
446 HZ2 TRP 60 2HZ TRP 60 9.910 -6.274 10.050
447 HZ3 TRP 60 3HZ TRP 60 12.161 -2.936 8.638
448 HH2 TRP 60 HH TRP 60 11.311 -4.301 10.474
449 H LEU 61 H LEU 61 7.642 -4.090 5.652
450 HA LEU 61 HA LEU 61 6.080 -6.434 5.844
451 HB2 LEU 61 1HB LEU 61 5.486 -3.705 6.976
452 HB3 LEU 61 2HB LEU 61 4.795 -5.234 7.514
453 HG LEU 61 HG LEU 61 7.731 -4.580 7.704
454 HD11 LEU 61 1HD1 LEU 61 7.391 -4.003 9.996
455 HD12 LEU 61 2HD1 LEU 61 5.674 -4.394 9.896
456 HD13 LEU 61 3HD1 LEU 61 6.314 -3.005 9.018
457 HD21 LEU 61 1HD2 LEU 61 6.982 -6.981 7.699
458 HD22 LEU 61 2HD2 LEU 61 6.107 -6.634 9.191
459 HD23 LEU 61 3HD2 LEU 61 7.863 -6.466 9.138
460 H GLY 62 H GLY 62 3.522 -5.998 6.078
461 HA2 GLY 62 1HA GLY 62 2.670 -4.744 3.540
462 HA3 GLY 62 2HA GLY 62 2.038 -6.292 4.080
463 H LEU 63 H LEU 63 0.301 -4.286 3.466
464 HA LEU 63 HA LEU 63 -0.430 -2.615 5.608
465 HB2 LEU 63 1HB LEU 63 -1.884 -3.683 3.218
466 HB3 LEU 63 2HB LEU 63 -2.727 -2.718 4.428
467 HG LEU 63 HG LEU 63 -0.974 -0.925 3.994
468 HD11 LEU 63 1HD1 LEU 63 0.110 -1.021 1.792
469 HD12 LEU 63 2HD1 LEU 63 -0.477 -2.670 1.586
470 HD13 LEU 63 3HD1 LEU 63 0.674 -2.298 2.869
471 HD21 LEU 63 1HD2 LEU 63 -3.133 -0.498 3.208
472 HD22 LEU 63 2HD2 LEU 63 -3.044 -1.775 1.995
473 HD23 LEU 63 3HD2 LEU 63 -2.109 -0.294 1.787
474 H GLY 64 H GLY 64 -1.353 -5.911 4.756
475 HA2 GLY 64 1HA GLY 64 -3.444 -6.212 6.622
476 HA3 GLY 64 2HA GLY 64 -2.506 -7.521 5.917
477 H ILE 65 H ILE 65 -0.036 -7.237 6.859
478 HA ILE 65 HA ILE 65 0.120 -8.423 9.242
479 HB ILE 65 HB ILE 65 1.955 -6.228 8.281
480 HG12 ILE 65 1HG1 ILE 65 3.370 -8.428 7.904
481 HG13 ILE 65 2HG1 ILE 65 1.782 -9.187 7.882
482 HG21 ILE 65 1HG2 ILE 65 2.250 -6.469 10.659
483 HG22 ILE 65 2HG2 ILE 65 2.347 -8.223 10.505
484 HG23 ILE 65 3HG2 ILE 65 3.620 -7.207 9.829
485 HD11 ILE 65 1HD1 ILE 65 1.437 -8.529 5.801
486 HD12 ILE 65 2HD1 ILE 65 1.805 -6.853 6.210
487 HD13 ILE 65 3HD1 ILE 65 3.105 -7.957 5.765
488 H TYR 66 H TYR 66 -0.030 -4.888 8.864
489 HA TYR 66 HA TYR 66 -0.176 -4.443 11.698
490 HB2 TYR 66 1HB TYR 66 -0.407 -2.675 9.277
491 HB3 TYR 66 2HB TYR 66 -0.785 -2.062 10.883
492 HD1 TYR 66 2HD TYR 66 1.087 -2.543 12.699
493 HD2 TYR 66 1HD TYR 66 1.754 -2.443 8.498
494 HE1 TYR 66 2HE TYR 66 3.473 -2.099 13.095
495 HE2 TYR 66 1HE TYR 66 4.143 -1.999 8.882
496 HH TYR 66 HH TYR 66 5.672 -1.376 10.445
497 H GLY 67 H GLY 67 -2.461 -4.383 8.990
498 HA2 GLY 67 1HA GLY 67 -4.709 -5.238 9.406
499 HA3 GLY 67 2HA GLY 67 -4.646 -4.448 10.975
500 H ILE 68 H ILE 68 -3.443 -2.869 8.114
501 HA ILE 68 HA ILE 68 -5.125 -0.617 8.509
502 HB ILE 68 HB ILE 68 -3.413 -1.350 6.131
503 HG12 ILE 68 1HG1 ILE 68 -2.802 0.689 8.261
504 HG13 ILE 68 2HG1 ILE 68 -2.346 -1.000 8.450
505 HG21 ILE 68 1HG2 ILE 68 -4.797 0.237 5.225
506 HG22 ILE 68 2HG2 ILE 68 -5.062 1.045 6.769
507 HG23 ILE 68 3HG2 ILE 68 -3.537 1.263 5.911
508 HD11 ILE 68 1HD1 ILE 68 -1.435 -0.294 5.921
509 HD12 ILE 68 2HD1 ILE 68 -1.066 1.090 6.950
510 HD13 ILE 68 3HD1 ILE 68 -0.473 -0.513 7.383
511 H GLN 69 H GLN 69 -6.860 0.133 7.309
512 HA GLN 69 HA GLN 69 -8.031 -1.739 5.367
513 HB2 GLN 69 1HB GLN 69 -10.197 -1.533 6.313
514 HB3 GLN 69 2HB GLN 69 -9.110 -1.886 7.650
515 HG2 GLN 69 1HG GLN 69 -9.253 0.261 8.504
516 HG3 GLN 69 2HG GLN 69 -9.814 0.938 6.976
517 HE21 GLN 69 1HE2 GLN 69 -10.937 1.108 9.687
518 HE22 GLN 69 2HE2 GLN 69 -12.558 0.524 9.558
519 H ASP 70 H ASP 70 -9.772 -0.689 4.043
520 HA ASP 70 HA ASP 70 -8.773 1.605 2.773
521 HB2 ASP 70 1HB ASP 70 -10.967 1.627 1.577
522 HB3 ASP 70 2HB ASP 70 -10.166 0.058 1.557
523 H SER 71 H SER 71 -10.197 3.597 2.389
524 HA SER 71 HA SER 71 -10.958 5.569 3.235
525 HB2 SER 71 1HB SER 71 -12.976 5.483 4.472
526 HB3 SER 71 2HB SER 71 -12.982 4.017 3.491
527 HG SER 71 HG SER 71 -12.635 2.818 5.244
528 H ASP 72 H ASP 72 -8.592 4.289 4.469
529 HA ASP 72 HA ASP 72 -8.738 5.245 7.229
530 HB2 ASP 72 1HB ASP 72 -6.881 3.456 5.717
531 HB3 ASP 72 2HB ASP 72 -6.274 4.294 7.142
532 H THR 73 H THR 73 -6.919 6.545 8.065
533 HA THR 73 HA THR 73 -6.013 8.492 6.045
534 HB THR 73 HB THR 73 -6.547 8.965 8.985
535 HG1 THR 73 1HG THR 73 -8.443 9.736 8.359
536 HG21 THR 73 1HG2 THR 73 -6.233 11.366 8.347
537 HG22 THR 73 2HG2 THR 73 -5.628 10.815 6.784
538 HG23 THR 73 3HG2 THR 73 -4.762 10.396 8.263
539 H LEU 74 H LEU 74 -3.889 8.933 5.878
540 HA LEU 74 HA LEU 74 -2.084 7.784 7.903
541 HB2 LEU 74 1HB LEU 74 -1.595 7.927 4.932
542 HB3 LEU 74 2HB LEU 74 -0.499 7.257 6.139
543 HG LEU 74 HG LEU 74 -3.221 6.072 5.855
544 HD11 LEU 74 1HD1 LEU 74 -0.960 5.173 4.106
545 HD12 LEU 74 2HD1 LEU 74 -2.123 6.380 3.558
546 HD13 LEU 74 3HD1 LEU 74 -2.673 4.766 4.006
547 HD21 LEU 74 1HD2 LEU 74 -0.791 5.493 7.224
548 HD22 LEU 74 2HD2 LEU 74 -1.126 4.188 6.086
549 HD23 LEU 74 3HD2 LEU 74 -2.332 4.638 7.293
550 H ILE 75 H ILE 75 -0.652 9.149 8.759
551 HA ILE 75 HA ILE 75 -0.607 11.893 7.844
552 HB ILE 75 HB ILE 75 0.956 10.664 10.114
553 HG12 ILE 75 1HG1 ILE 75 -1.599 10.425 10.199
554 HG13 ILE 75 2HG1 ILE 75 -0.814 11.179 11.583
555 HG21 ILE 75 1HG2 ILE 75 0.671 13.142 10.900
556 HG22 ILE 75 2HG2 ILE 75 1.941 12.709 9.758
557 HG23 ILE 75 3HG2 ILE 75 0.449 13.449 9.178
558 HD11 ILE 75 1HD1 ILE 75 -2.324 12.542 9.373
559 HD12 ILE 75 2HD1 ILE 75 -2.772 12.422 11.075
560 HD13 ILE 75 3HD1 ILE 75 -1.381 13.395 10.595
561 H LEU 76 H LEU 76 1.059 12.943 6.879
562 HA LEU 76 HA LEU 76 3.401 11.313 6.146
563 HB2 LEU 76 1HB LEU 76 2.035 11.872 4.228
564 HB3 LEU 76 2HB LEU 76 2.082 13.580 4.659
565 HG LEU 76 HG LEU 76 4.642 13.341 4.336
566 HD11 LEU 76 1HD1 LEU 76 5.010 11.067 4.102
567 HD12 LEU 76 2HD1 LEU 76 5.017 11.634 2.432
568 HD13 LEU 76 3HD1 LEU 76 3.587 10.837 3.086
569 HD21 LEU 76 1HD2 LEU 76 4.430 13.951 2.028
570 HD22 LEU 76 2HD2 LEU 76 3.063 14.631 2.911
571 HD23 LEU 76 3HD2 LEU 76 2.844 13.186 1.922
572 H SER 77 H SER 77 5.293 11.944 6.931
573 HA SER 77 HA SER 77 5.819 14.775 7.390
574 HB2 SER 77 1HB SER 77 5.757 12.673 9.534
575 HB3 SER 77 2HB SER 77 6.854 14.047 9.673
576 HG SER 77 HG SER 77 4.434 14.056 10.446
577 H LYS 78 H LYS 78 7.891 15.335 7.001
578 HA LYS 78 HA LYS 78 9.641 13.313 5.909
579 HB2 LYS 78 1HB LYS 78 11.040 15.143 5.212
580 HB3 LYS 78 2HB LYS 78 9.367 15.558 4.864
581 HG2 LYS 78 1HG LYS 78 9.469 16.737 7.185
582 HG3 LYS 78 2HG LYS 78 11.212 16.687 6.915
583 HD2 LYS 78 1HD LYS 78 9.252 17.805 4.918
584 HD3 LYS 78 2HD LYS 78 10.059 18.787 6.144
585 HE2 LYS 78 1HE LYS 78 12.196 18.339 5.220
586 HE3 LYS 78 2HE LYS 78 11.557 17.066 4.181
587 HZ1 LYS 78 1HZ LYS 78 11.962 19.067 2.918
588 HZ2 LYS 78 2HZ LYS 78 10.970 19.969 3.948
589 HZ3 LYS 78 3HZ LYS 78 10.300 18.759 2.974
590 H LYS 79 H LYS 79 11.620 12.675 6.702
591 HA LYS 79 HA LYS 79 11.939 12.663 9.515
592 HB2 LYS 79 1HB LYS 79 14.100 12.011 7.517
593 HB3 LYS 79 2HB LYS 79 13.898 11.369 9.142
594 HG2 LYS 79 1HG LYS 79 11.606 10.521 8.113
595 HG3 LYS 79 2HG LYS 79 12.540 10.619 6.619
596 HD2 LYS 79 1HD LYS 79 14.270 9.197 7.613
597 HD3 LYS 79 2HD LYS 79 13.328 9.095 9.103
598 HE2 LYS 79 1HE LYS 79 11.547 7.955 7.955
599 HE3 LYS 79 2HE LYS 79 12.346 8.185 6.401
600 HZ1 LYS 79 1HZ LYS 79 13.795 6.518 6.795
601 HZ2 LYS 79 2HZ LYS 79 12.559 5.960 7.805
602 HZ3 LYS 79 3HZ LYS 79 13.871 6.803 8.461
603 H LYS 80 H LYS 80 13.039 13.967 10.847
604 HA LYS 80 HA LYS 80 14.545 16.187 9.640
605 HB2 LYS 80 1HB LYS 80 12.656 16.940 10.949
606 HB3 LYS 80 2HB LYS 80 13.164 15.961 12.319
607 HG2 LYS 80 1HG LYS 80 13.817 18.120 12.883
608 HG3 LYS 80 2HG LYS 80 15.301 17.365 12.296
609 HD2 LYS 80 1HD LYS 80 14.807 18.381 10.050
610 HD3 LYS 80 2HD LYS 80 13.502 19.283 10.822
611 HE2 LYS 80 1HE LYS 80 15.254 20.791 10.892
612 HE3 LYS 80 2HE LYS 80 15.345 20.037 12.483
613 HZ1 LYS 80 1HZ LYS 80 17.104 19.649 10.151
614 HZ2 LYS 80 2HZ LYS 80 16.984 18.447 11.334
615 HZ3 LYS 80 3HZ LYS 80 17.521 19.995 11.754
616 H GLY 81 H GLY 81 16.670 15.861 9.655
617 HA2 GLY 81 1HA GLY 81 18.586 15.940 11.265
618 HA3 GLY 81 2HA GLY 81 17.849 14.533 12.018
619 H SER 82 H SER 82 20.146 15.572 9.836
620 HA SER 82 HA SER 82 20.667 12.845 8.991
621 HB2 SER 82 1HB SER 82 19.131 14.021 7.269
622 HB3 SER 82 2HB SER 82 20.566 14.956 6.848
623 HG SER 82 HG SER 82 20.565 13.193 5.526
624 H GLY 83 H GLY 83 22.782 12.666 7.853
625 HA2 GLY 83 1HA GLY 83 24.598 14.916 8.284
626 HA3 GLY 83 2HA GLY 83 24.931 13.440 9.178
627 HA PRO 84 HA PRO 84 27.330 13.093 5.289
628 HB2 PRO 84 1HB PRO 84 29.404 11.775 6.441
629 HB3 PRO 84 2HB PRO 84 29.262 13.536 6.451
630 HG2 PRO 84 1HG PRO 84 28.576 11.569 8.600
631 HG3 PRO 84 2HG PRO 84 29.407 13.129 8.736
632 HD2 PRO 84 1HD PRO 84 26.787 12.818 9.342
633 HD3 PRO 84 2HD PRO 84 27.439 14.327 8.671
634 H SER 85 H SER 85 26.504 11.556 4.015
635 HA SER 85 HA SER 85 25.477 9.097 4.856
636 HB2 SER 85 1HB SER 85 26.248 10.258 2.213
637 HB3 SER 85 2HB SER 85 25.912 8.529 2.304
638 HG SER 85 HG SER 85 23.964 9.404 1.928
639 H SER 86 H SER 86 26.334 6.978 3.722
640 HA SER 86 HA SER 86 29.237 6.778 4.147
641 HB2 SER 86 1HB SER 86 27.056 5.118 5.377
642 HB3 SER 86 2HB SER 86 28.656 4.426 5.110
643 HG SER 86 HG SER 86 29.527 5.889 6.494
644 H GLY 87 H GLY 87 26.400 4.934 3.006
645 HA2 GLY 87 1HA GLY 87 26.218 4.277 0.691
646 HA3 GLY 87 2HA GLY 87 27.973 4.197 0.625
Start of MODEL 15
1 H1 GLY 1 H GLY 1 -4.738 0.740 -18.400
2 HA2 GLY 1 1HA GLY 1 -2.341 0.083 -16.803
3 HA3 GLY 1 2HA GLY 1 -3.517 1.309 -16.355
4 H SER 2 H SER 2 -4.038 0.445 -14.374
5 HA SER 2 HA SER 2 -5.233 -2.245 -14.388
6 HB2 SER 2 1HB SER 2 -4.115 -0.636 -12.079
7 HB3 SER 2 2HB SER 2 -4.860 -2.228 -11.935
8 HG SER 2 HG SER 2 -2.338 -1.605 -12.599
9 H SER 3 H SER 3 -7.303 -1.727 -15.038
10 HA SER 3 HA SER 3 -8.782 0.296 -13.544
11 HB2 SER 3 1HB SER 3 -9.234 -1.201 -16.093
12 HB3 SER 3 2HB SER 3 -10.630 -0.548 -15.237
13 HG SER 3 HG SER 3 -9.052 0.746 -16.854
14 H GLY 4 H GLY 4 -11.184 -0.392 -13.124
15 HA2 GLY 4 1HA GLY 4 -12.705 -1.900 -12.194
16 HA3 GLY 4 2HA GLY 4 -11.470 -3.149 -12.261
17 H SER 5 H SER 5 -13.341 -1.641 -10.163
18 HA SER 5 HA SER 5 -11.810 -0.548 -8.156
19 HB2 SER 5 1HB SER 5 -13.595 -1.150 -6.619
20 HB3 SER 5 2HB SER 5 -14.297 -0.658 -8.161
21 HG SER 5 HG SER 5 -15.252 -2.520 -8.127
22 H SER 6 H SER 6 -9.998 -1.343 -7.323
23 HA SER 6 HA SER 6 -10.037 -3.996 -6.128
24 HB2 SER 6 1HB SER 6 -7.933 -3.181 -8.148
25 HB3 SER 6 2HB SER 6 -7.907 -4.655 -7.180
26 HG SER 6 HG SER 6 -8.792 -5.202 -9.124
27 H GLY 7 H GLY 7 -8.352 -4.329 -4.573
28 HA2 GLY 7 1HA GLY 7 -6.860 -3.685 -2.943
29 HA3 GLY 7 2HA GLY 7 -6.442 -2.310 -3.955
30 H ILE 8 H ILE 8 -6.360 -1.623 -1.495
31 HA ILE 8 HA ILE 8 -8.995 -0.581 -0.713
32 HB ILE 8 HB ILE 8 -7.989 -0.167 1.502
33 HG12 ILE 8 1HG1 ILE 8 -5.619 -1.814 0.695
34 HG13 ILE 8 2HG1 ILE 8 -5.612 -0.079 0.397
35 HG21 ILE 8 1HG2 ILE 8 -9.169 -2.185 1.341
36 HG22 ILE 8 2HG2 ILE 8 -7.913 -2.942 0.363
37 HG23 ILE 8 3HG2 ILE 8 -7.628 -2.629 2.075
38 HD11 ILE 8 1HD1 ILE 8 -5.023 0.295 2.490
39 HD12 ILE 8 2HD1 ILE 8 -6.456 -0.552 3.074
40 HD13 ILE 8 3HD1 ILE 8 -4.967 -1.446 2.767
41 H GLN 9 H GLN 9 -9.250 1.603 -0.146
42 HA GLN 9 HA GLN 9 -7.328 3.381 -1.456
43 HB2 GLN 9 1HB GLN 9 -9.890 3.354 -1.908
44 HB3 GLN 9 2HB GLN 9 -9.999 4.249 -0.398
45 HG2 GLN 9 1HG GLN 9 -8.577 5.992 -1.297
46 HG3 GLN 9 2HG GLN 9 -8.382 5.084 -2.795
47 HE21 GLN 9 1HE2 GLN 9 -10.619 4.404 -3.730
48 HE22 GLN 9 2HE2 GLN 9 -11.772 5.685 -3.845
49 H VAL 10 H VAL 10 -5.939 4.518 -0.289
50 HA VAL 10 HA VAL 10 -6.591 5.069 2.534
51 HB VAL 10 HB VAL 10 -4.180 5.042 3.010
52 HG11 VAL 10 1HG1 VAL 10 -3.832 2.569 2.650
53 HG12 VAL 10 2HG1 VAL 10 -5.328 3.020 3.469
54 HG13 VAL 10 3HG1 VAL 10 -5.357 2.568 1.765
55 HG21 VAL 10 1HG2 VAL 10 -3.280 5.661 0.873
56 HG22 VAL 10 2HG2 VAL 10 -2.641 4.076 1.307
57 HG23 VAL 10 3HG2 VAL 10 -3.941 4.209 0.122
58 H PHE 11 H PHE 11 -6.681 7.139 3.107
59 HA PHE 11 HA PHE 11 -5.910 9.170 1.169
60 HB2 PHE 11 1HB PHE 11 -7.467 9.292 3.754
61 HB3 PHE 11 2HB PHE 11 -7.046 10.722 2.818
62 HD1 PHE 11 1HD PHE 11 -8.022 11.078 0.594
63 HD2 PHE 11 2HD PHE 11 -9.205 7.819 3.062
64 HE1 PHE 11 1HE PHE 11 -10.032 10.765 -0.790
65 HE2 PHE 11 2HE PHE 11 -11.217 7.500 1.682
66 HZ PHE 11 HZ PHE 11 -11.632 8.973 -0.247
67 H VAL 12 H VAL 12 -3.825 9.726 1.216
68 HA VAL 12 HA VAL 12 -2.332 9.740 3.702
69 HB VAL 12 HB VAL 12 -1.454 10.472 0.905
70 HG11 VAL 12 1HG1 VAL 12 0.473 11.163 1.765
71 HG12 VAL 12 2HG1 VAL 12 -0.222 10.995 3.378
72 HG13 VAL 12 3HG1 VAL 12 0.662 9.651 2.653
73 HG21 VAL 12 1HG2 VAL 12 -1.672 7.921 2.363
74 HG22 VAL 12 2HG2 VAL 12 -1.695 8.244 0.629
75 HG23 VAL 12 3HG2 VAL 12 -0.159 8.180 1.494
76 H LYS 13 H LYS 13 -2.699 11.426 5.004
77 HA LYS 13 HA LYS 13 -3.288 14.053 3.959
78 HB2 LYS 13 1HB LYS 13 -4.448 13.328 5.954
79 HB3 LYS 13 2HB LYS 13 -2.924 13.032 6.780
80 HG2 LYS 13 1HG LYS 13 -2.427 15.383 6.818
81 HG3 LYS 13 2HG LYS 13 -3.853 15.737 5.841
82 HD2 LYS 13 1HD LYS 13 -5.321 15.131 7.595
83 HD3 LYS 13 2HD LYS 13 -4.020 14.380 8.522
84 HE2 LYS 13 1HE LYS 13 -2.976 16.593 8.800
85 HE3 LYS 13 2HE LYS 13 -4.319 17.322 7.922
86 HZ1 LYS 13 1HZ LYS 13 -5.792 16.861 9.638
87 HZ2 LYS 13 2HZ LYS 13 -4.393 17.338 10.459
88 HZ3 LYS 13 3HZ LYS 13 -4.786 15.697 10.343
89 H ASN 14 H ASN 14 -1.846 15.580 3.516
90 HA ASN 14 HA ASN 14 0.936 15.158 3.833
91 HB2 ASN 14 1HB ASN 14 -0.720 17.527 2.988
92 HB3 ASN 14 2HB ASN 14 1.031 17.642 3.146
93 HD21 ASN 14 1HD2 ASN 14 0.939 18.152 0.864
94 HD22 ASN 14 2HD2 ASN 14 0.884 16.864 -0.287
95 HA PRO 15 HA PRO 15 1.812 16.799 7.808
96 HB2 PRO 15 1HB PRO 15 4.211 17.997 7.387
97 HB3 PRO 15 2HB PRO 15 4.009 16.241 7.431
98 HG2 PRO 15 1HG PRO 15 4.203 18.068 5.067
99 HG3 PRO 15 2HG PRO 15 4.964 16.487 5.325
100 HD2 PRO 15 1HD PRO 15 2.738 16.803 3.816
101 HD3 PRO 15 2HD PRO 15 3.050 15.333 4.761
102 H ASP 16 H ASP 16 2.391 19.100 5.157
103 HA ASP 16 HA ASP 16 2.017 21.381 6.881
104 HB2 ASP 16 1HB ASP 16 2.667 20.954 4.003
105 HB3 ASP 16 2HB ASP 16 1.972 22.504 4.469
106 H GLY 17 H GLY 17 0.183 19.760 4.316
107 HA2 GLY 17 1HA GLY 17 -2.327 20.091 5.322
108 HA3 GLY 17 2HA GLY 17 -2.017 21.607 4.490
109 H GLY 18 H GLY 18 -3.428 18.680 4.144
110 HA2 GLY 18 1HA GLY 18 -4.394 18.752 1.699
111 HA3 GLY 18 2HA GLY 18 -2.730 18.330 1.324
112 H SER 19 H SER 19 -4.646 16.637 0.499
113 HA SER 19 HA SER 19 -3.949 14.219 1.858
114 HB2 SER 19 1HB SER 19 -6.488 13.643 2.155
115 HB3 SER 19 2HB SER 19 -5.655 14.579 3.396
116 HG SER 19 HG SER 19 -7.229 15.648 1.287
117 H TYR 20 H TYR 20 -3.693 12.765 0.308
118 HA TYR 20 HA TYR 20 -5.333 13.005 -2.129
119 HB2 TYR 20 1HB TYR 20 -2.626 11.687 -1.995
120 HB3 TYR 20 2HB TYR 20 -3.509 12.219 -3.422
121 HD1 TYR 20 2HD TYR 20 -4.121 14.869 -3.279
122 HD2 TYR 20 1HD TYR 20 -0.805 12.964 -1.415
123 HE1 TYR 20 2HE TYR 20 -2.926 17.018 -3.222
124 HE2 TYR 20 1HE TYR 20 0.399 15.108 -1.352
125 HH TYR 20 HH TYR 20 -0.670 17.819 -1.402
126 H ALA 21 H ALA 21 -6.097 11.110 -3.112
127 HA ALA 21 HA ALA 21 -6.372 8.857 -1.259
128 HB1 ALA 21 1HB ALA 21 -7.917 8.959 -3.789
129 HB2 ALA 21 2HB ALA 21 -8.405 8.421 -2.182
130 HB3 ALA 21 3HB ALA 21 -8.306 10.144 -2.542
131 H TYR 22 H TYR 22 -4.891 7.316 -1.508
132 HA TYR 22 HA TYR 22 -3.822 6.751 -4.172
133 HB2 TYR 22 1HB TYR 22 -2.918 6.036 -1.389
134 HB3 TYR 22 2HB TYR 22 -2.235 5.257 -2.812
135 HD1 TYR 22 2HD TYR 22 -2.670 8.521 -1.119
136 HD2 TYR 22 1HD TYR 22 -0.590 6.340 -4.122
137 HE1 TYR 22 2HE TYR 22 -1.093 10.391 -1.377
138 HE2 TYR 22 1HE TYR 22 0.993 8.203 -4.388
139 HH TYR 22 HH TYR 22 0.809 10.858 -3.907
140 H ALA 23 H ALA 23 -3.505 4.471 -4.792
141 HA ALA 23 HA ALA 23 -5.580 2.692 -3.702
142 HB1 ALA 23 1HB ALA 23 -6.218 3.816 -5.891
143 HB2 ALA 23 2HB ALA 23 -4.962 2.829 -6.638
144 HB3 ALA 23 3HB ALA 23 -6.330 2.057 -5.837
145 H ILE 24 H ILE 24 -4.699 0.883 -2.969
146 HA ILE 24 HA ILE 24 -2.679 -0.508 -4.509
147 HB ILE 24 HB ILE 24 -1.218 0.880 -3.221
148 HG12 ILE 24 1HG1 ILE 24 -1.309 -1.743 -1.734
149 HG13 ILE 24 2HG1 ILE 24 -0.768 -1.627 -3.405
150 HG21 ILE 24 1HG2 ILE 24 -1.307 0.954 -0.760
151 HG22 ILE 24 2HG2 ILE 24 -2.761 1.612 -1.508
152 HG23 ILE 24 3HG2 ILE 24 -2.787 -0.004 -0.803
153 HD11 ILE 24 1HD1 ILE 24 0.650 0.333 -1.998
154 HD12 ILE 24 2HD1 ILE 24 0.674 -1.115 -0.992
155 HD13 ILE 24 3HD1 ILE 24 1.260 -1.186 -2.654
156 H ASN 25 H ASN 25 -2.520 -2.698 -4.010
157 HA ASN 25 HA ASN 25 -4.835 -3.860 -2.838
158 HB2 ASN 25 1HB ASN 25 -3.278 -4.778 -4.713
159 HB3 ASN 25 2HB ASN 25 -2.315 -5.403 -3.377
160 HD21 ASN 25 1HD2 ASN 25 -5.609 -5.351 -4.659
161 HD22 ASN 25 2HD2 ASN 25 -6.028 -6.940 -4.127
162 HA PRO 26 HA PRO 26 -3.570 -4.039 1.384
163 HB2 PRO 26 1HB PRO 26 -5.298 -5.957 2.225
164 HB3 PRO 26 2HB PRO 26 -5.800 -4.299 1.875
165 HG2 PRO 26 1HG PRO 26 -6.026 -6.747 0.166
166 HG3 PRO 26 2HG PRO 26 -7.216 -5.461 0.443
167 HD2 PRO 26 1HD PRO 26 -5.676 -5.568 -1.782
168 HD3 PRO 26 2HD PRO 26 -6.212 -4.035 -1.064
169 H ASN 27 H ASN 27 -3.121 -6.503 -0.876
170 HA ASN 27 HA ASN 27 -1.965 -8.387 1.023
171 HB2 ASN 27 1HB ASN 27 -3.386 -9.015 -1.048
172 HB3 ASN 27 2HB ASN 27 -1.919 -8.696 -1.968
173 HD21 ASN 27 1HD2 ASN 27 -3.159 -10.560 0.763
174 HD22 ASN 27 2HD2 ASN 27 -2.115 -11.918 0.538
175 H SER 28 H SER 28 -1.001 -5.999 -1.316
176 HA SER 28 HA SER 28 1.694 -6.822 -1.621
177 HB2 SER 28 1HB SER 28 0.254 -5.126 -3.016
178 HB3 SER 28 2HB SER 28 0.879 -3.947 -1.863
179 HG SER 28 HG SER 28 2.537 -5.726 -3.315
180 H PHE 29 H PHE 29 3.537 -5.312 -0.959
181 HA PHE 29 HA PHE 29 3.557 -5.179 1.904
182 HB2 PHE 29 1HB PHE 29 5.620 -4.334 -0.141
183 HB3 PHE 29 2HB PHE 29 5.891 -4.370 1.598
184 HD1 PHE 29 2HD PHE 29 4.680 -6.859 2.429
185 HD2 PHE 29 1HD PHE 29 6.928 -5.980 -1.077
186 HE1 PHE 29 2HE PHE 29 5.356 -9.220 2.275
187 HE2 PHE 29 1HE PHE 29 7.607 -8.339 -1.237
188 HZ PHE 29 HZ PHE 29 6.822 -9.963 0.440
189 H ILE 30 H ILE 30 4.806 -3.084 2.782
190 HA ILE 30 HA ILE 30 2.924 -0.931 2.428
191 HB ILE 30 HB ILE 30 5.391 -1.134 4.157
192 HG12 ILE 30 1HG1 ILE 30 3.510 -2.664 4.728
193 HG13 ILE 30 2HG1 ILE 30 3.843 -1.478 5.986
194 HG21 ILE 30 1HG2 ILE 30 5.254 1.076 4.372
195 HG22 ILE 30 2HG2 ILE 30 3.753 1.135 3.450
196 HG23 ILE 30 3HG2 ILE 30 3.709 0.827 5.186
197 HD11 ILE 30 1HD1 ILE 30 1.541 -1.482 5.870
198 HD12 ILE 30 2HD1 ILE 30 1.973 -0.107 4.852
199 HD13 ILE 30 3HD1 ILE 30 1.526 -1.645 4.114
200 H LEU 31 H LEU 31 6.417 -1.366 1.922
201 HA LEU 31 HA LEU 31 7.217 1.086 1.106
202 HB2 LEU 31 1HB LEU 31 8.613 -0.971 1.191
203 HB3 LEU 31 2HB LEU 31 7.910 -1.461 -0.349
204 HG LEU 31 HG LEU 31 8.864 0.700 -1.296
205 HD11 LEU 31 1HD1 LEU 31 10.627 1.782 -0.131
206 HD12 LEU 31 2HD1 LEU 31 10.596 0.584 1.163
207 HD13 LEU 31 3HD1 LEU 31 9.251 1.708 0.970
208 HD21 LEU 31 1HD2 LEU 31 11.311 -0.536 -0.790
209 HD22 LEU 31 2HD2 LEU 31 10.228 -0.832 -2.151
210 HD23 LEU 31 3HD2 LEU 31 10.116 -1.829 -0.699
211 H GLY 32 H GLY 32 5.446 -1.266 -0.869
212 HA2 GLY 32 1HA GLY 32 5.484 -0.016 -3.324
213 HA3 GLY 32 2HA GLY 32 4.126 -0.958 -2.726
214 H LEU 33 H LEU 33 3.305 0.654 -0.606
215 HA LEU 33 HA LEU 33 1.682 2.524 -1.935
216 HB2 LEU 33 1HB LEU 33 0.919 1.584 0.106
217 HB3 LEU 33 2HB LEU 33 2.354 2.131 0.970
218 HG LEU 33 HG LEU 33 1.588 4.456 0.738
219 HD11 LEU 33 1HD1 LEU 33 0.278 4.676 -1.116
220 HD12 LEU 33 2HD1 LEU 33 -0.975 4.543 0.117
221 HD13 LEU 33 3HD1 LEU 33 -0.544 3.138 -0.857
222 HD21 LEU 33 1HD2 LEU 33 -0.716 3.900 2.042
223 HD22 LEU 33 2HD2 LEU 33 0.883 3.834 2.782
224 HD23 LEU 33 3HD2 LEU 33 0.124 2.357 2.186
225 H LYS 34 H LYS 34 4.656 2.901 -0.061
226 HA LYS 34 HA LYS 34 4.723 5.709 -0.024
227 HB2 LYS 34 1HB LYS 34 6.818 3.575 0.226
228 HB3 LYS 34 2HB LYS 34 7.283 5.270 0.167
229 HG2 LYS 34 1HG LYS 34 7.114 5.024 2.412
230 HG3 LYS 34 2HG LYS 34 5.439 5.456 2.060
231 HD2 LYS 34 1HD LYS 34 5.102 3.598 3.350
232 HD3 LYS 34 2HD LYS 34 5.198 2.843 1.757
233 HE2 LYS 34 1HE LYS 34 6.626 1.515 2.984
234 HE3 LYS 34 2HE LYS 34 7.744 2.690 2.294
235 HZ1 LYS 34 1HZ LYS 34 7.104 2.193 5.030
236 HZ2 LYS 34 2HZ LYS 34 6.907 3.826 4.637
237 HZ3 LYS 34 3HZ LYS 34 8.395 3.066 4.370
238 H GLN 35 H GLN 35 6.396 3.430 -2.198
239 HA GLN 35 HA GLN 35 7.717 5.105 -3.862
240 HB2 GLN 35 1HB GLN 35 7.778 2.698 -4.153
241 HB3 GLN 35 2HB GLN 35 6.093 2.684 -4.657
242 HG2 GLN 35 1HG GLN 35 7.918 2.521 -6.451
243 HG3 GLN 35 2HG GLN 35 6.564 3.617 -6.720
244 HE21 GLN 35 1HE2 GLN 35 9.731 3.691 -5.112
245 HE22 GLN 35 2HE2 GLN 35 10.215 5.216 -5.763
246 H GLN 36 H GLN 36 4.255 4.372 -4.003
247 HA GLN 36 HA GLN 36 3.652 5.801 -6.331
248 HB2 GLN 36 1HB GLN 36 2.028 5.037 -3.919
249 HB3 GLN 36 2HB GLN 36 1.326 5.981 -5.226
250 HG2 GLN 36 1HG GLN 36 2.338 4.023 -6.689
251 HG3 GLN 36 2HG GLN 36 2.168 3.141 -5.172
252 HE21 GLN 36 1HE2 GLN 36 0.193 2.496 -4.521
253 HE22 GLN 36 2HE2 GLN 36 -1.267 2.789 -5.397
254 H ILE 37 H ILE 37 3.972 6.841 -2.989
255 HA ILE 37 HA ILE 37 2.911 9.447 -3.353
256 HB ILE 37 HB ILE 37 4.690 8.242 -1.249
257 HG12 ILE 37 1HG1 ILE 37 1.874 9.346 -1.136
258 HG13 ILE 37 2HG1 ILE 37 2.276 7.641 -1.310
259 HG21 ILE 37 1HG2 ILE 37 4.047 11.093 -1.740
260 HG22 ILE 37 2HG2 ILE 37 3.990 10.522 -0.073
261 HG23 ILE 37 3HG2 ILE 37 5.475 10.362 -1.010
262 HD11 ILE 37 1HD1 ILE 37 2.354 7.457 0.887
263 HD12 ILE 37 2HD1 ILE 37 3.679 8.620 0.937
264 HD13 ILE 37 3HD1 ILE 37 2.011 9.178 1.057
265 H GLU 38 H GLU 38 6.133 8.069 -3.654
266 HA GLU 38 HA GLU 38 7.498 10.553 -3.902
267 HB2 GLU 38 1HB GLU 38 8.688 8.539 -3.237
268 HB3 GLU 38 2HB GLU 38 8.291 7.768 -4.765
269 HG2 GLU 38 1HG GLU 38 9.841 10.322 -4.704
270 HG3 GLU 38 2HG GLU 38 10.637 8.772 -4.439
271 H ASP 39 H ASP 39 5.941 8.369 -6.155
272 HA ASP 39 HA ASP 39 6.976 9.651 -8.503
273 HB2 ASP 39 1HB ASP 39 5.030 7.476 -7.925
274 HB3 ASP 39 2HB ASP 39 4.883 8.300 -9.475
275 H GLN 40 H GLN 40 4.634 10.483 -6.258
276 HA GLN 40 HA GLN 40 3.137 12.098 -8.205
277 HB2 GLN 40 1HB GLN 40 2.425 11.259 -5.391
278 HB3 GLN 40 2HB GLN 40 1.449 12.335 -6.383
279 HG2 GLN 40 1HG GLN 40 2.176 9.675 -7.485
280 HG3 GLN 40 2HG GLN 40 0.946 9.759 -6.225
281 HE21 GLN 40 1HE2 GLN 40 -0.887 9.394 -7.296
282 HE22 GLN 40 2HE2 GLN 40 -1.446 10.306 -8.653
283 H GLN 41 H GLN 41 4.316 12.346 -4.845
284 HA GLN 41 HA GLN 41 4.306 15.219 -4.954
285 HB2 GLN 41 1HB GLN 41 5.446 13.359 -2.862
286 HB3 GLN 41 2HB GLN 41 5.217 15.093 -2.679
287 HG2 GLN 41 1HG GLN 41 2.742 14.602 -3.169
288 HG3 GLN 41 2HG GLN 41 3.159 12.928 -2.810
289 HE21 GLN 41 1HE2 GLN 41 3.801 16.144 -1.443
290 HE22 GLN 41 2HE2 GLN 41 3.464 15.702 0.192
291 H GLY 42 H GLY 42 6.588 12.689 -5.551
292 HA2 GLY 42 1HA GLY 42 8.600 12.973 -6.734
293 HA3 GLY 42 2HA GLY 42 8.560 14.687 -6.347
294 H LEU 43 H LEU 43 7.971 13.831 -3.463
295 HA LEU 43 HA LEU 43 10.654 13.988 -2.551
296 HB2 LEU 43 1HB LEU 43 8.317 14.630 -1.452
297 HB3 LEU 43 2HB LEU 43 8.513 13.033 -0.732
298 HG LEU 43 HG LEU 43 10.770 14.963 -0.521
299 HD11 LEU 43 1HD1 LEU 43 8.134 15.207 0.868
300 HD12 LEU 43 2HD1 LEU 43 9.154 16.466 0.173
301 HD13 LEU 43 3HD1 LEU 43 9.624 15.685 1.682
302 HD21 LEU 43 1HD2 LEU 43 10.484 12.457 0.331
303 HD22 LEU 43 2HD2 LEU 43 9.762 13.290 1.708
304 HD23 LEU 43 3HD2 LEU 43 11.417 13.660 1.222
305 HA PRO 44 HA PRO 44 11.779 9.725 -2.566
306 HB2 PRO 44 1HB PRO 44 13.827 9.847 -0.787
307 HB3 PRO 44 2HB PRO 44 13.952 10.460 -2.440
308 HG2 PRO 44 1HG PRO 44 13.437 11.957 0.101
309 HG3 PRO 44 2HG PRO 44 14.502 12.382 -1.252
310 HD2 PRO 44 1HD PRO 44 12.044 13.474 -0.932
311 HD3 PRO 44 2HD PRO 44 12.762 13.190 -2.531
312 H LYS 45 H LYS 45 11.716 7.855 -1.261
313 HA LYS 45 HA LYS 45 9.807 7.918 0.835
314 HB2 LYS 45 1HB LYS 45 11.697 5.650 0.210
315 HB3 LYS 45 2HB LYS 45 10.121 5.550 0.984
316 HG2 LYS 45 1HG LYS 45 8.979 5.839 -0.998
317 HG3 LYS 45 2HG LYS 45 10.345 6.629 -1.790
318 HD2 LYS 45 1HD LYS 45 10.556 3.772 -0.925
319 HD3 LYS 45 2HD LYS 45 9.724 4.184 -2.427
320 HE2 LYS 45 1HE LYS 45 11.685 5.198 -3.323
321 HE3 LYS 45 2HE LYS 45 12.516 5.103 -1.771
322 HZ1 LYS 45 1HZ LYS 45 12.723 3.294 -3.770
323 HZ2 LYS 45 2HZ LYS 45 11.603 2.556 -2.741
324 HZ3 LYS 45 3HZ LYS 45 13.123 3.006 -2.152
325 H LYS 46 H LYS 46 13.313 7.317 0.811
326 HA LYS 46 HA LYS 46 13.786 6.785 3.446
327 HB2 LYS 46 1HB LYS 46 16.015 7.504 3.118
328 HB3 LYS 46 2HB LYS 46 15.467 6.934 1.547
329 HG2 LYS 46 1HG LYS 46 14.907 9.381 1.059
330 HG3 LYS 46 2HG LYS 46 15.900 9.751 2.471
331 HD2 LYS 46 1HD LYS 46 17.842 9.023 1.461
332 HD3 LYS 46 2HD LYS 46 16.986 7.952 0.350
333 HE2 LYS 46 1HE LYS 46 17.604 9.638 -1.077
334 HE3 LYS 46 2HE LYS 46 16.012 10.204 -0.575
335 HZ1 LYS 46 1HZ LYS 46 17.699 11.958 -0.506
336 HZ2 LYS 46 2HZ LYS 46 18.581 11.073 0.635
337 HZ3 LYS 46 3HZ LYS 46 17.042 11.659 1.024
338 H GLN 47 H GLN 47 12.619 9.719 2.106
339 HA GLN 47 HA GLN 47 13.230 11.218 4.547
340 HB2 GLN 47 1HB GLN 47 12.367 12.001 1.783
341 HB3 GLN 47 2HB GLN 47 12.125 13.108 3.128
342 HG2 GLN 47 1HG GLN 47 14.784 11.917 2.382
343 HG3 GLN 47 2HG GLN 47 14.211 13.491 1.834
344 HE21 GLN 47 1HE2 GLN 47 16.553 12.966 3.375
345 HE22 GLN 47 2HE2 GLN 47 16.368 13.782 4.887
346 H GLN 48 H GLN 48 10.519 10.102 2.583
347 HA GLN 48 HA GLN 48 8.508 11.315 4.199
348 HB2 GLN 48 1HB GLN 48 6.991 10.402 2.741
349 HB3 GLN 48 2HB GLN 48 8.431 10.375 1.732
350 HG2 GLN 48 1HG GLN 48 8.784 8.003 2.548
351 HG3 GLN 48 2HG GLN 48 7.148 8.095 3.198
352 HE21 GLN 48 1HE2 GLN 48 8.602 9.267 0.185
353 HE22 GLN 48 2HE2 GLN 48 7.508 8.443 -0.867
354 H GLN 49 H GLN 49 7.212 10.425 5.780
355 HA GLN 49 HA GLN 49 7.802 7.707 6.684
356 HB2 GLN 49 1HB GLN 49 9.280 9.073 8.019
357 HB3 GLN 49 2HB GLN 49 7.967 10.172 8.422
358 HG2 GLN 49 1HG GLN 49 6.836 8.259 9.569
359 HG3 GLN 49 2HG GLN 49 8.308 7.322 9.315
360 HE21 GLN 49 1HE2 GLN 49 7.042 8.111 11.804
361 HE22 GLN 49 2HE2 GLN 49 8.217 9.028 12.678
362 H LEU 50 H LEU 50 5.941 6.666 6.852
363 HA LEU 50 HA LEU 50 3.512 8.201 7.478
364 HB2 LEU 50 1HB LEU 50 3.720 5.475 6.213
365 HB3 LEU 50 2HB LEU 50 2.260 6.445 6.401
366 HG LEU 50 HG LEU 50 4.517 7.555 4.802
367 HD11 LEU 50 1HD1 LEU 50 4.444 5.425 3.817
368 HD12 LEU 50 2HD1 LEU 50 3.431 6.441 2.793
369 HD13 LEU 50 3HD1 LEU 50 2.688 5.332 3.945
370 HD21 LEU 50 1HD2 LEU 50 1.514 7.681 4.542
371 HD22 LEU 50 2HD2 LEU 50 2.680 8.566 3.559
372 HD23 LEU 50 3HD2 LEU 50 2.538 8.911 5.283
373 H GLU 51 H GLU 51 2.338 7.749 9.251
374 HA GLU 51 HA GLU 51 3.135 5.408 10.853
375 HB2 GLU 51 1HB GLU 51 2.687 8.249 11.630
376 HB3 GLU 51 2HB GLU 51 2.204 7.000 12.770
377 HG2 GLU 51 1HG GLU 51 4.388 6.219 13.024
378 HG3 GLU 51 2HG GLU 51 4.945 7.035 11.564
379 H PHE 52 H PHE 52 1.489 4.430 12.142
380 HA PHE 52 HA PHE 52 -1.269 5.174 11.514
381 HB2 PHE 52 1HB PHE 52 -0.506 3.424 9.878
382 HB3 PHE 52 2HB PHE 52 -0.272 2.334 11.240
383 HD1 PHE 52 2HD PHE 52 -2.789 4.238 9.332
384 HD2 PHE 52 1HD PHE 52 -2.090 1.200 12.230
385 HE1 PHE 52 2HE PHE 52 -5.151 3.566 9.191
386 HE2 PHE 52 1HE PHE 52 -4.452 0.522 12.093
387 HZ PHE 52 HZ PHE 52 -5.986 1.706 10.574
388 H GLN 53 H GLN 53 -2.545 5.088 13.249
389 HA GLN 53 HA GLN 53 -3.153 4.878 15.439
390 HB2 GLN 53 1HB GLN 53 -2.310 2.144 14.588
391 HB3 GLN 53 2HB GLN 53 -2.689 2.413 16.284
392 HG2 GLN 53 1HG GLN 53 -4.908 3.187 15.693
393 HG3 GLN 53 2HG GLN 53 -4.535 3.000 13.980
394 HE21 GLN 53 1HE2 GLN 53 -3.885 0.918 16.770
395 HE22 GLN 53 2HE2 GLN 53 -4.720 -0.463 16.154
396 H GLY 54 H GLY 54 -0.424 5.825 14.904
397 HA2 GLY 54 1HA GLY 54 1.270 6.581 16.288
398 HA3 GLY 54 2HA GLY 54 0.554 5.662 17.604
399 H GLN 55 H GLN 55 1.556 4.371 14.480
400 HA GLN 55 HA GLN 55 3.877 3.104 15.729
401 HB2 GLN 55 1HB GLN 55 3.242 0.935 15.315
402 HB3 GLN 55 2HB GLN 55 1.680 1.651 15.688
403 HG2 GLN 55 1HG GLN 55 1.645 2.054 13.078
404 HG3 GLN 55 2HG GLN 55 2.762 0.690 13.100
405 HE21 GLN 55 1HE2 GLN 55 0.434 0.376 11.815
406 HE22 GLN 55 2HE2 GLN 55 -0.626 -0.660 12.702
407 H VAL 56 H VAL 56 5.571 2.718 14.355
408 HA VAL 56 HA VAL 56 5.493 4.098 11.822
409 HB VAL 56 HB VAL 56 7.795 2.481 12.904
410 HG11 VAL 56 1HG1 VAL 56 8.684 4.784 11.611
411 HG12 VAL 56 2HG1 VAL 56 8.735 3.131 10.995
412 HG13 VAL 56 3HG1 VAL 56 7.367 4.176 10.608
413 HG21 VAL 56 1HG2 VAL 56 7.036 4.038 14.636
414 HG22 VAL 56 2HG2 VAL 56 8.603 4.515 13.981
415 HG23 VAL 56 3HG2 VAL 56 7.142 5.370 13.484
416 H LEU 57 H LEU 57 5.205 3.222 9.876
417 HA LEU 57 HA LEU 57 4.765 0.370 9.659
418 HB2 LEU 57 1HB LEU 57 4.702 2.321 7.384
419 HB3 LEU 57 2HB LEU 57 3.827 0.802 7.557
420 HG LEU 57 HG LEU 57 3.266 3.387 9.006
421 HD11 LEU 57 1HD1 LEU 57 1.806 1.858 6.863
422 HD12 LEU 57 2HD1 LEU 57 2.470 3.489 6.766
423 HD13 LEU 57 3HD1 LEU 57 1.083 3.163 7.804
424 HD21 LEU 57 1HD2 LEU 57 2.228 0.607 9.389
425 HD22 LEU 57 2HD2 LEU 57 1.202 2.000 9.728
426 HD23 LEU 57 3HD2 LEU 57 2.723 1.793 10.597
427 H GLN 58 H GLN 58 6.019 -1.086 8.601
428 HA GLN 58 HA GLN 58 8.643 -0.127 7.690
429 HB2 GLN 58 1HB GLN 58 7.935 -2.975 8.369
430 HB3 GLN 58 2HB GLN 58 9.536 -2.258 8.233
431 HG2 GLN 58 1HG GLN 58 7.517 -1.551 10.350
432 HG3 GLN 58 2HG GLN 58 8.840 -2.698 10.559
433 HE21 GLN 58 1HE2 GLN 58 7.970 0.240 11.397
434 HE22 GLN 58 2HE2 GLN 58 9.491 1.058 11.409
435 H ASP 59 H ASP 59 9.603 -1.113 5.816
436 HA ASP 59 HA ASP 59 7.838 -1.270 3.619
437 HB2 ASP 59 1HB ASP 59 9.907 -0.574 2.922
438 HB3 ASP 59 2HB ASP 59 10.760 -1.636 4.039
439 H TRP 60 H TRP 60 10.018 -3.812 4.854
440 HA TRP 60 HA TRP 60 9.092 -5.945 3.433
441 HB2 TRP 60 1HB TRP 60 10.212 -7.293 4.924
442 HB3 TRP 60 2HB TRP 60 10.923 -5.733 5.331
443 HD1 TRP 60 HD TRP 60 8.256 -8.202 6.634
444 HE1 TRP 60 1HE TRP 60 7.991 -7.833 9.168
445 HE3 TRP 60 3HE TRP 60 11.302 -4.133 7.184
446 HZ2 TRP 60 2HZ TRP 60 8.946 -6.052 11.138
447 HZ3 TRP 60 3HZ TRP 60 11.572 -3.156 9.426
448 HH2 TRP 60 HH TRP 60 10.417 -4.097 11.361
449 H LEU 61 H LEU 61 7.503 -4.315 6.059
450 HA LEU 61 HA LEU 61 5.578 -6.375 6.568
451 HB2 LEU 61 1HB LEU 61 5.657 -3.456 7.304
452 HB3 LEU 61 2HB LEU 61 4.399 -4.570 7.835
453 HG LEU 61 HG LEU 61 7.323 -4.916 8.483
454 HD11 LEU 61 1HD1 LEU 61 5.222 -3.883 10.362
455 HD12 LEU 61 2HD1 LEU 61 6.225 -2.804 9.393
456 HD13 LEU 61 3HD1 LEU 61 6.975 -3.892 10.561
457 HD21 LEU 61 1HD2 LEU 61 6.685 -6.642 9.878
458 HD22 LEU 61 2HD2 LEU 61 5.594 -6.859 8.509
459 HD23 LEU 61 3HD2 LEU 61 5.016 -6.082 9.984
460 H GLY 62 H GLY 62 3.221 -6.017 6.287
461 HA2 GLY 62 1HA GLY 62 2.693 -4.679 3.705
462 HA3 GLY 62 2HA GLY 62 1.910 -6.171 4.204
463 H LEU 63 H LEU 63 0.478 -3.931 3.370
464 HA LEU 63 HA LEU 63 -0.385 -2.198 5.367
465 HB2 LEU 63 1HB LEU 63 -1.718 -3.310 2.922
466 HB3 LEU 63 2HB LEU 63 -2.567 -2.206 4.002
467 HG LEU 63 HG LEU 63 -0.477 -0.677 3.587
468 HD11 LEU 63 1HD1 LEU 63 -0.263 -1.403 0.875
469 HD12 LEU 63 2HD1 LEU 63 0.021 -2.864 1.820
470 HD13 LEU 63 3HD1 LEU 63 0.996 -1.424 2.111
471 HD21 LEU 63 1HD2 LEU 63 -1.659 0.143 1.461
472 HD22 LEU 63 2HD2 LEU 63 -2.576 0.129 2.968
473 HD23 LEU 63 3HD2 LEU 63 -2.819 -1.148 1.774
474 H GLY 64 H GLY 64 -1.432 -5.476 4.590
475 HA2 GLY 64 1HA GLY 64 -3.612 -5.472 6.453
476 HA3 GLY 64 2HA GLY 64 -2.947 -6.874 5.629
477 H ILE 65 H ILE 65 -0.264 -6.589 6.539
478 HA ILE 65 HA ILE 65 -0.223 -8.127 8.796
479 HB ILE 65 HB ILE 65 1.837 -6.059 8.023
480 HG12 ILE 65 1HG1 ILE 65 1.260 -7.779 6.286
481 HG13 ILE 65 2HG1 ILE 65 2.938 -7.821 6.818
482 HG21 ILE 65 1HG2 ILE 65 2.399 -8.540 9.596
483 HG22 ILE 65 2HG2 ILE 65 3.349 -7.062 9.467
484 HG23 ILE 65 3HG2 ILE 65 1.855 -7.070 10.403
485 HD11 ILE 65 1HD1 ILE 65 1.017 -9.592 8.210
486 HD12 ILE 65 2HD1 ILE 65 1.481 -10.009 6.560
487 HD13 ILE 65 3HD1 ILE 65 2.715 -9.846 7.809
488 H TYR 66 H TYR 66 -0.228 -4.593 8.628
489 HA TYR 66 HA TYR 66 -0.090 -4.294 11.489
490 HB2 TYR 66 1HB TYR 66 -0.344 -2.429 9.162
491 HB3 TYR 66 2HB TYR 66 -0.733 -1.845 10.776
492 HD1 TYR 66 2HD TYR 66 1.063 -2.098 12.588
493 HD2 TYR 66 1HD TYR 66 1.876 -2.507 8.431
494 HE1 TYR 66 2HE TYR 66 3.451 -1.696 13.021
495 HE2 TYR 66 1HE TYR 66 4.266 -2.107 8.853
496 HH TYR 66 HH TYR 66 5.563 -1.968 12.082
497 H GLY 67 H GLY 67 -2.580 -3.813 8.994
498 HA2 GLY 67 1HA GLY 67 -4.811 -4.749 9.704
499 HA3 GLY 67 2HA GLY 67 -4.595 -3.780 11.154
500 H ILE 68 H ILE 68 -3.403 -2.334 8.313
501 HA ILE 68 HA ILE 68 -5.074 -0.102 8.487
502 HB ILE 68 HB ILE 68 -3.571 -1.061 6.049
503 HG12 ILE 68 1HG1 ILE 68 -2.599 1.008 7.998
504 HG13 ILE 68 2HG1 ILE 68 -2.317 -0.703 8.300
505 HG21 ILE 68 1HG2 ILE 68 -3.516 1.485 5.650
506 HG22 ILE 68 2HG2 ILE 68 -5.000 0.606 5.287
507 HG23 ILE 68 3HG2 ILE 68 -4.870 1.537 6.779
508 HD11 ILE 68 1HD1 ILE 68 -1.018 1.112 6.430
509 HD12 ILE 68 2HD1 ILE 68 -0.444 -0.397 7.139
510 HD13 ILE 68 3HD1 ILE 68 -1.485 -0.431 5.716
511 H GLN 69 H GLN 69 -6.939 0.504 7.490
512 HA GLN 69 HA GLN 69 -8.275 -1.538 5.838
513 HB2 GLN 69 1HB GLN 69 -10.408 -0.719 6.729
514 HB3 GLN 69 2HB GLN 69 -9.354 -1.293 8.015
515 HG2 GLN 69 1HG GLN 69 -8.664 1.220 8.170
516 HG3 GLN 69 2HG GLN 69 -10.207 1.483 7.359
517 HE21 GLN 69 1HE2 GLN 69 -12.113 1.018 8.435
518 HE22 GLN 69 2HE2 GLN 69 -12.173 0.751 10.141
519 H ASP 70 H ASP 70 -10.128 -0.503 4.519
520 HA ASP 70 HA ASP 70 -8.945 1.397 2.757
521 HB2 ASP 70 1HB ASP 70 -11.085 1.275 1.538
522 HB3 ASP 70 2HB ASP 70 -10.458 -0.326 1.920
523 H SER 71 H SER 71 -10.035 3.423 2.087
524 HA SER 71 HA SER 71 -10.550 5.579 2.637
525 HB2 SER 71 1HB SER 71 -12.708 4.377 4.370
526 HB3 SER 71 2HB SER 71 -12.748 5.897 3.477
527 HG SER 71 HG SER 71 -13.191 3.309 2.603
528 H ASP 72 H ASP 72 -8.475 4.618 4.180
529 HA ASP 72 HA ASP 72 -9.045 5.560 6.902
530 HB2 ASP 72 1HB ASP 72 -7.873 3.301 6.364
531 HB3 ASP 72 2HB ASP 72 -6.455 4.298 6.052
532 H THR 73 H THR 73 -7.259 6.828 7.951
533 HA THR 73 HA THR 73 -6.236 8.828 6.045
534 HB THR 73 HB THR 73 -6.876 9.184 8.980
535 HG1 THR 73 1HG THR 73 -8.303 9.605 6.619
536 HG21 THR 73 1HG2 THR 73 -6.160 11.300 6.956
537 HG22 THR 73 2HG2 THR 73 -4.988 10.578 8.058
538 HG23 THR 73 3HG2 THR 73 -6.354 11.491 8.698
539 H LEU 74 H LEU 74 -4.129 8.656 5.686
540 HA LEU 74 HA LEU 74 -2.399 7.602 7.812
541 HB2 LEU 74 1HB LEU 74 -1.922 7.875 4.848
542 HB3 LEU 74 2HB LEU 74 -0.752 7.243 6.005
543 HG LEU 74 HG LEU 74 -3.439 5.956 5.622
544 HD11 LEU 74 1HD1 LEU 74 -2.373 4.402 4.060
545 HD12 LEU 74 2HD1 LEU 74 -0.904 5.378 4.094
546 HD13 LEU 74 3HD1 LEU 74 -2.393 6.049 3.429
547 HD21 LEU 74 1HD2 LEU 74 -1.258 4.204 6.203
548 HD22 LEU 74 2HD2 LEU 74 -2.699 4.542 7.162
549 HD23 LEU 74 3HD2 LEU 74 -1.256 5.539 7.356
550 H ILE 75 H ILE 75 -0.768 8.782 8.662
551 HA ILE 75 HA ILE 75 -0.687 11.611 7.979
552 HB ILE 75 HB ILE 75 0.690 10.117 10.214
553 HG12 ILE 75 1HG1 ILE 75 -1.727 10.090 10.481
554 HG13 ILE 75 2HG1 ILE 75 -1.018 11.201 11.647
555 HG21 ILE 75 1HG2 ILE 75 1.923 11.947 10.460
556 HG22 ILE 75 2HG2 ILE 75 1.038 12.775 9.180
557 HG23 ILE 75 3HG2 ILE 75 0.445 12.831 10.840
558 HD11 ILE 75 1HD1 ILE 75 -3.025 12.141 10.698
559 HD12 ILE 75 2HD1 ILE 75 -1.622 13.079 10.188
560 HD13 ILE 75 3HD1 ILE 75 -2.379 11.946 9.070
561 H LEU 76 H LEU 76 0.913 12.572 6.892
562 HA LEU 76 HA LEU 76 3.356 11.013 6.361
563 HB2 LEU 76 1HB LEU 76 2.232 11.100 4.314
564 HB3 LEU 76 2HB LEU 76 1.717 12.766 4.567
565 HG LEU 76 HG LEU 76 4.344 13.182 4.450
566 HD11 LEU 76 1HD1 LEU 76 4.600 10.635 4.124
567 HD12 LEU 76 2HD1 LEU 76 5.525 11.723 3.090
568 HD13 LEU 76 3HD1 LEU 76 4.064 10.952 2.474
569 HD21 LEU 76 1HD2 LEU 76 3.847 14.249 2.540
570 HD22 LEU 76 2HD2 LEU 76 2.196 13.722 2.870
571 HD23 LEU 76 3HD2 LEU 76 3.217 12.791 1.772
572 H SER 77 H SER 77 5.230 11.931 6.904
573 HA SER 77 HA SER 77 5.439 14.833 7.097
574 HB2 SER 77 1HB SER 77 5.946 12.955 9.412
575 HB3 SER 77 2HB SER 77 6.519 14.622 9.366
576 HG SER 77 HG SER 77 4.527 14.487 10.441
577 H LYS 78 H LYS 78 7.461 15.607 6.683
578 HA LYS 78 HA LYS 78 9.308 13.860 5.406
579 HB2 LYS 78 1HB LYS 78 9.301 16.777 6.104
580 HB3 LYS 78 2HB LYS 78 10.771 16.017 5.508
581 HG2 LYS 78 1HG LYS 78 9.840 16.840 3.575
582 HG3 LYS 78 2HG LYS 78 9.246 15.178 3.581
583 HD2 LYS 78 1HD LYS 78 7.250 16.306 4.925
584 HD3 LYS 78 2HD LYS 78 7.787 17.728 4.028
585 HE2 LYS 78 1HE LYS 78 7.375 16.702 1.952
586 HE3 LYS 78 2HE LYS 78 7.260 15.098 2.675
587 HZ1 LYS 78 1HZ LYS 78 5.134 16.467 2.007
588 HZ2 LYS 78 2HZ LYS 78 5.344 17.126 3.550
589 HZ3 LYS 78 3HZ LYS 78 5.141 15.457 3.364
590 H LYS 79 H LYS 79 11.278 13.102 6.071
591 HA LYS 79 HA LYS 79 11.652 12.599 8.814
592 HB2 LYS 79 1HB LYS 79 13.379 12.256 6.382
593 HB3 LYS 79 2HB LYS 79 14.026 11.936 7.985
594 HG2 LYS 79 1HG LYS 79 11.449 10.660 7.257
595 HG3 LYS 79 2HG LYS 79 12.924 10.043 6.507
596 HD2 LYS 79 1HD LYS 79 13.911 9.733 8.735
597 HD3 LYS 79 2HD LYS 79 12.419 10.324 9.471
598 HE2 LYS 79 1HE LYS 79 11.251 8.421 8.954
599 HE3 LYS 79 2HE LYS 79 12.251 8.059 7.548
600 HZ1 LYS 79 1HZ LYS 79 12.448 6.961 10.082
601 HZ2 LYS 79 2HZ LYS 79 13.812 7.944 9.899
602 HZ3 LYS 79 3HZ LYS 79 13.495 6.721 8.775
603 H LYS 80 H LYS 80 12.851 13.569 10.365
604 HA LYS 80 HA LYS 80 13.303 16.189 10.561
605 HB2 LYS 80 1HB LYS 80 13.763 14.529 12.352
606 HB3 LYS 80 2HB LYS 80 15.281 14.131 11.559
607 HG2 LYS 80 1HG LYS 80 15.801 16.648 11.802
608 HG3 LYS 80 2HG LYS 80 14.504 16.632 12.999
609 HD2 LYS 80 1HD LYS 80 16.697 14.602 13.139
610 HD3 LYS 80 2HD LYS 80 16.966 16.236 13.751
611 HE2 LYS 80 1HE LYS 80 14.966 15.983 15.184
612 HE3 LYS 80 2HE LYS 80 14.804 14.320 14.620
613 HZ1 LYS 80 1HZ LYS 80 15.985 13.998 16.522
614 HZ2 LYS 80 2HZ LYS 80 16.788 15.483 16.432
615 HZ3 LYS 80 3HZ LYS 80 17.274 14.198 15.445
616 H GLY 81 H GLY 81 15.858 13.969 9.413
617 HA2 GLY 81 1HA GLY 81 16.695 15.319 7.201
618 HA3 GLY 81 2HA GLY 81 17.499 16.158 8.520
619 H SER 82 H SER 82 17.005 12.911 7.165
620 HA SER 82 HA SER 82 18.859 11.452 8.515
621 HB2 SER 82 1HB SER 82 17.377 10.621 6.668
622 HB3 SER 82 2HB SER 82 18.513 11.316 5.512
623 HG SER 82 HG SER 82 19.500 9.596 7.485
624 H GLY 83 H GLY 83 21.026 11.313 8.672
625 HA2 GLY 83 1HA GLY 83 22.612 13.454 7.599
626 HA3 GLY 83 2HA GLY 83 23.185 12.137 8.612
627 HA PRO 84 HA PRO 84 24.074 11.574 3.906
628 HB2 PRO 84 1HB PRO 84 26.421 12.912 3.633
629 HB3 PRO 84 2HB PRO 84 24.849 13.658 3.326
630 HG2 PRO 84 1HG PRO 84 26.586 13.833 5.758
631 HG3 PRO 84 2HG PRO 84 25.684 15.117 4.933
632 HD2 PRO 84 1HD PRO 84 24.783 13.922 7.190
633 HD3 PRO 84 2HD PRO 84 23.690 14.529 5.929
634 H SER 85 H SER 85 25.491 11.130 6.920
635 HA SER 85 HA SER 85 27.936 10.052 6.673
636 HB2 SER 85 1HB SER 85 27.285 8.366 8.413
637 HB3 SER 85 2HB SER 85 26.796 10.016 8.800
638 HG SER 85 HG SER 85 25.170 7.931 7.774
639 H SER 86 H SER 86 28.889 8.586 5.436
640 HA SER 86 HA SER 86 27.604 7.126 3.452
641 HB2 SER 86 1HB SER 86 29.691 6.134 2.991
642 HB3 SER 86 2HB SER 86 30.105 7.696 3.699
643 HG SER 86 HG SER 86 30.763 6.725 5.510
644 H GLY 87 H GLY 87 28.174 4.571 3.367
645 HA2 GLY 87 1HA GLY 87 27.503 2.490 4.064
646 HA3 GLY 87 2HA GLY 87 27.893 3.032 5.690
Start of MODEL 16
1 H1 GLY 1 H GLY 1 -2.824 -5.362 -12.105
2 HA2 GLY 1 1HA GLY 1 -3.732 -7.407 -13.283
3 HA3 GLY 1 2HA GLY 1 -5.093 -7.251 -12.182
4 H SER 2 H SER 2 -5.658 -7.313 -14.799
5 HA SER 2 HA SER 2 -5.815 -4.608 -15.840
6 HB2 SER 2 1HB SER 2 -6.944 -5.719 -17.783
7 HB3 SER 2 2HB SER 2 -5.333 -6.350 -17.440
8 HG SER 2 HG SER 2 -7.844 -7.524 -16.895
9 H SER 3 H SER 3 -8.074 -7.170 -14.852
10 HA SER 3 HA SER 3 -9.973 -5.164 -13.974
11 HB2 SER 3 1HB SER 3 -11.814 -5.928 -15.326
12 HB3 SER 3 2HB SER 3 -10.475 -5.545 -16.408
13 HG SER 3 HG SER 3 -11.350 -8.100 -15.554
14 H GLY 4 H GLY 4 -10.415 -5.820 -11.979
15 HA2 GLY 4 1HA GLY 4 -11.734 -7.365 -10.639
16 HA3 GLY 4 2HA GLY 4 -11.024 -8.679 -11.566
17 H SER 5 H SER 5 -10.014 -5.969 -9.482
18 HA SER 5 HA SER 5 -8.226 -7.826 -8.081
19 HB2 SER 5 1HB SER 5 -6.504 -5.976 -7.992
20 HB3 SER 5 2HB SER 5 -6.742 -6.695 -9.584
21 HG SER 5 HG SER 5 -7.262 -4.792 -10.271
22 H SER 6 H SER 6 -8.565 -7.763 -5.968
23 HA SER 6 HA SER 6 -10.254 -5.741 -4.814
24 HB2 SER 6 1HB SER 6 -8.903 -8.208 -3.735
25 HB3 SER 6 2HB SER 6 -9.736 -7.077 -2.669
26 HG SER 6 HG SER 6 -11.014 -8.889 -3.514
27 H GLY 7 H GLY 7 -9.445 -3.799 -4.357
28 HA2 GLY 7 1HA GLY 7 -6.865 -3.692 -2.928
29 HA3 GLY 7 2HA GLY 7 -7.218 -2.577 -4.240
30 H ILE 8 H ILE 8 -6.525 -1.602 -1.783
31 HA ILE 8 HA ILE 8 -9.083 -0.566 -0.748
32 HB ILE 8 HB ILE 8 -8.068 -0.264 1.418
33 HG12 ILE 8 1HG1 ILE 8 -5.571 -1.656 0.500
34 HG13 ILE 8 2HG1 ILE 8 -5.731 0.087 0.316
35 HG21 ILE 8 1HG2 ILE 8 -7.141 -2.924 1.360
36 HG22 ILE 8 2HG2 ILE 8 -8.734 -2.338 1.837
37 HG23 ILE 8 3HG2 ILE 8 -8.430 -2.804 0.163
38 HD11 ILE 8 1HD1 ILE 8 -5.456 -1.546 2.776
39 HD12 ILE 8 2HD1 ILE 8 -4.696 -0.016 2.337
40 HD13 ILE 8 3HD1 ILE 8 -6.380 -0.047 2.861
41 H GLN 9 H GLN 9 -9.115 1.640 -0.063
42 HA GLN 9 HA GLN 9 -7.128 3.290 -1.472
43 HB2 GLN 9 1HB GLN 9 -9.586 3.402 -2.143
44 HB3 GLN 9 2HB GLN 9 -9.869 4.183 -0.593
45 HG2 GLN 9 1HG GLN 9 -8.310 5.966 -1.215
46 HG3 GLN 9 2HG GLN 9 -8.058 5.188 -2.777
47 HE21 GLN 9 1HE2 GLN 9 -9.873 5.025 -4.214
48 HE22 GLN 9 2HE2 GLN 9 -11.138 6.199 -4.141
49 H VAL 10 H VAL 10 -5.813 4.540 -0.321
50 HA VAL 10 HA VAL 10 -6.491 5.045 2.504
51 HB VAL 10 HB VAL 10 -4.119 5.124 3.002
52 HG11 VAL 10 1HG1 VAL 10 -3.990 2.903 3.241
53 HG12 VAL 10 2HG1 VAL 10 -5.556 2.862 2.427
54 HG13 VAL 10 3HG1 VAL 10 -4.073 2.621 1.502
55 HG21 VAL 10 1HG2 VAL 10 -2.831 4.066 0.788
56 HG22 VAL 10 2HG2 VAL 10 -3.896 5.301 0.118
57 HG23 VAL 10 3HG2 VAL 10 -2.728 5.728 1.368
58 H PHE 11 H PHE 11 -6.189 7.086 3.346
59 HA PHE 11 HA PHE 11 -5.895 9.216 1.354
60 HB2 PHE 11 1HB PHE 11 -7.170 9.098 4.076
61 HB3 PHE 11 2HB PHE 11 -6.793 10.639 3.313
62 HD1 PHE 11 1HD PHE 11 -7.808 11.138 1.052
63 HD2 PHE 11 2HD PHE 11 -9.107 7.922 3.519
64 HE1 PHE 11 1HE PHE 11 -9.925 11.037 -0.199
65 HE2 PHE 11 2HE PHE 11 -11.225 7.816 2.272
66 HZ PHE 11 HZ PHE 11 -11.636 9.374 0.410
67 H VAL 12 H VAL 12 -3.864 9.901 1.145
68 HA VAL 12 HA VAL 12 -2.058 9.904 3.426
69 HB VAL 12 HB VAL 12 -1.530 10.695 0.558
70 HG11 VAL 12 1HG1 VAL 12 0.337 11.576 1.403
71 HG12 VAL 12 2HG1 VAL 12 0.051 10.859 2.991
72 HG13 VAL 12 3HG1 VAL 12 0.846 9.919 1.728
73 HG21 VAL 12 1HG2 VAL 12 -1.253 8.097 2.030
74 HG22 VAL 12 2HG2 VAL 12 -2.023 8.413 0.476
75 HG23 VAL 12 3HG2 VAL 12 -0.266 8.460 0.614
76 H LYS 13 H LYS 13 -2.168 11.586 4.761
77 HA LYS 13 HA LYS 13 -2.955 14.208 3.780
78 HB2 LYS 13 1HB LYS 13 -3.919 13.362 5.879
79 HB3 LYS 13 2HB LYS 13 -2.310 13.270 6.582
80 HG2 LYS 13 1HG LYS 13 -2.142 15.533 6.848
81 HG3 LYS 13 2HG LYS 13 -3.237 15.882 5.508
82 HD2 LYS 13 1HD LYS 13 -5.143 15.358 6.803
83 HD3 LYS 13 2HD LYS 13 -4.169 14.601 8.066
84 HE2 LYS 13 1HE LYS 13 -3.342 16.680 8.811
85 HE3 LYS 13 2HE LYS 13 -3.908 17.512 7.363
86 HZ1 LYS 13 1HZ LYS 13 -6.011 16.215 8.828
87 HZ2 LYS 13 2HZ LYS 13 -5.922 17.798 8.239
88 HZ3 LYS 13 3HZ LYS 13 -5.220 17.410 9.728
89 H ASN 14 H ASN 14 -1.344 15.242 2.750
90 HA ASN 14 HA ASN 14 1.402 14.986 3.422
91 HB2 ASN 14 1HB ASN 14 1.795 16.697 1.768
92 HB3 ASN 14 2HB ASN 14 0.545 15.616 1.160
93 HD21 ASN 14 1HD2 ASN 14 0.793 18.030 0.023
94 HD22 ASN 14 2HD2 ASN 14 -0.522 19.057 0.472
95 HA PRO 15 HA PRO 15 1.890 17.903 6.669
96 HB2 PRO 15 1HB PRO 15 4.413 18.780 6.185
97 HB3 PRO 15 2HB PRO 15 4.062 17.171 6.827
98 HG2 PRO 15 1HG PRO 15 4.682 17.994 4.017
99 HG3 PRO 15 2HG PRO 15 5.275 16.594 4.929
100 HD2 PRO 15 1HD PRO 15 3.275 16.409 3.112
101 HD3 PRO 15 2HD PRO 15 3.352 15.379 4.556
102 H ASP 16 H ASP 16 1.972 18.845 3.384
103 HA ASP 16 HA ASP 16 2.266 21.679 3.941
104 HB2 ASP 16 1HB ASP 16 3.279 20.936 1.908
105 HB3 ASP 16 2HB ASP 16 1.805 20.119 1.397
106 H GLY 17 H GLY 17 -0.264 19.406 2.984
107 HA2 GLY 17 1HA GLY 17 -2.443 20.140 4.148
108 HA3 GLY 17 2HA GLY 17 -2.240 21.581 3.162
109 H GLY 18 H GLY 18 -4.020 18.928 3.338
110 HA2 GLY 18 1HA GLY 18 -5.585 18.479 1.550
111 HA3 GLY 18 2HA GLY 18 -4.279 18.753 0.406
112 H SER 19 H SER 19 -6.146 16.426 1.752
113 HA SER 19 HA SER 19 -4.061 14.371 1.780
114 HB2 SER 19 1HB SER 19 -5.930 12.900 2.627
115 HB3 SER 19 2HB SER 19 -5.529 14.261 3.674
116 HG SER 19 HG SER 19 -7.319 15.367 2.815
117 H TYR 20 H TYR 20 -3.762 13.014 0.139
118 HA TYR 20 HA TYR 20 -5.632 13.119 -2.109
119 HB2 TYR 20 1HB TYR 20 -2.976 11.710 -2.134
120 HB3 TYR 20 2HB TYR 20 -3.875 12.387 -3.487
121 HD1 TYR 20 2HD TYR 20 -3.895 14.828 -3.862
122 HD2 TYR 20 1HD TYR 20 -1.505 13.065 -0.815
123 HE1 TYR 20 2HE TYR 20 -2.579 16.900 -3.704
124 HE2 TYR 20 1HE TYR 20 -0.183 15.133 -0.648
125 HH TYR 20 HH TYR 20 -1.154 18.057 -2.100
126 H ALA 21 H ALA 21 -6.043 11.069 -3.293
127 HA ALA 21 HA ALA 21 -6.438 8.857 -1.386
128 HB1 ALA 21 1HB ALA 21 -8.031 9.173 -3.902
129 HB2 ALA 21 2HB ALA 21 -8.446 8.314 -2.418
130 HB3 ALA 21 3HB ALA 21 -8.451 10.077 -2.447
131 H TYR 22 H TYR 22 -4.990 7.299 -1.689
132 HA TYR 22 HA TYR 22 -4.017 6.757 -4.404
133 HB2 TYR 22 1HB TYR 22 -2.910 6.126 -1.673
134 HB3 TYR 22 2HB TYR 22 -2.284 5.364 -3.131
135 HD1 TYR 22 2HD TYR 22 -2.739 8.612 -1.419
136 HD2 TYR 22 1HD TYR 22 -0.792 6.516 -4.568
137 HE1 TYR 22 2HE TYR 22 -1.266 10.547 -1.788
138 HE2 TYR 22 1HE TYR 22 0.687 8.444 -4.946
139 HH TYR 22 HH TYR 22 1.319 10.451 -4.217
140 H ALA 23 H ALA 23 -3.568 4.427 -4.902
141 HA ALA 23 HA ALA 23 -5.578 2.644 -3.701
142 HB1 ALA 23 1HB ALA 23 -6.548 3.375 -5.756
143 HB2 ALA 23 2HB ALA 23 -5.053 3.059 -6.638
144 HB3 ALA 23 3HB ALA 23 -5.991 1.716 -5.983
145 H ILE 24 H ILE 24 -4.615 0.922 -2.866
146 HA ILE 24 HA ILE 24 -2.531 -0.451 -4.355
147 HB ILE 24 HB ILE 24 -1.183 1.040 -3.034
148 HG12 ILE 24 1HG1 ILE 24 -1.147 -1.597 -1.571
149 HG13 ILE 24 2HG1 ILE 24 -0.593 -1.440 -3.235
150 HG21 ILE 24 1HG2 ILE 24 -1.348 1.256 -0.657
151 HG22 ILE 24 2HG2 ILE 24 -2.948 1.530 -1.345
152 HG23 ILE 24 3HG2 ILE 24 -2.572 -0.012 -0.576
153 HD11 ILE 24 1HD1 ILE 24 1.167 0.008 -2.599
154 HD12 ILE 24 2HD1 ILE 24 0.520 0.184 -0.968
155 HD13 ILE 24 3HD1 ILE 24 1.193 -1.360 -1.488
156 H ASN 25 H ASN 25 -2.590 -2.615 -4.074
157 HA ASN 25 HA ASN 25 -4.799 -3.812 -2.822
158 HB2 ASN 25 1HB ASN 25 -2.187 -5.015 -3.759
159 HB3 ASN 25 2HB ASN 25 -3.582 -5.960 -3.245
160 HD21 ASN 25 1HD2 ASN 25 -2.038 -5.259 -5.871
161 HD22 ASN 25 2HD2 ASN 25 -3.324 -5.047 -7.006
162 HA PRO 26 HA PRO 26 -3.550 -4.124 1.388
163 HB2 PRO 26 1HB PRO 26 -5.100 -6.221 2.141
164 HB3 PRO 26 2HB PRO 26 -5.749 -4.603 1.847
165 HG2 PRO 26 1HG PRO 26 -5.740 -6.996 0.049
166 HG3 PRO 26 2HG PRO 26 -7.044 -5.836 0.361
167 HD2 PRO 26 1HD PRO 26 -5.488 -5.718 -1.852
168 HD3 PRO 26 2HD PRO 26 -6.166 -4.268 -1.083
169 H ASN 27 H ASN 27 -2.930 -6.510 -0.944
170 HA ASN 27 HA ASN 27 -1.554 -8.290 0.912
171 HB2 ASN 27 1HB ASN 27 -2.165 -8.444 -2.037
172 HB3 ASN 27 2HB ASN 27 -1.084 -9.587 -1.245
173 HD21 ASN 27 1HD2 ASN 27 -1.915 -11.201 -0.034
174 HD22 ASN 27 2HD2 ASN 27 -3.607 -11.482 0.175
175 H SER 28 H SER 28 -0.895 -5.742 -1.318
176 HA SER 28 HA SER 28 1.844 -6.354 -1.804
177 HB2 SER 28 1HB SER 28 0.112 -3.938 -2.210
178 HB3 SER 28 2HB SER 28 1.860 -3.804 -2.397
179 HG SER 28 HG SER 28 0.183 -5.638 -3.771
180 H PHE 29 H PHE 29 3.690 -5.212 -1.006
181 HA PHE 29 HA PHE 29 3.680 -4.906 1.814
182 HB2 PHE 29 1HB PHE 29 5.855 -3.930 -0.033
183 HB3 PHE 29 2HB PHE 29 6.011 -4.486 1.631
184 HD1 PHE 29 2HD PHE 29 5.922 -6.867 2.159
185 HD2 PHE 29 1HD PHE 29 5.743 -5.473 -1.859
186 HE1 PHE 29 2HE PHE 29 6.434 -9.134 1.353
187 HE2 PHE 29 1HE PHE 29 6.254 -7.739 -2.671
188 HZ PHE 29 HZ PHE 29 6.601 -9.573 -1.064
189 H ILE 30 H ILE 30 4.408 -2.976 2.982
190 HA ILE 30 HA ILE 30 2.789 -0.755 2.479
191 HB ILE 30 HB ILE 30 5.250 -1.016 4.203
192 HG12 ILE 30 1HG1 ILE 30 3.141 -2.348 4.722
193 HG13 ILE 30 2HG1 ILE 30 3.748 -1.318 6.013
194 HG21 ILE 30 1HG2 ILE 30 3.281 1.262 4.039
195 HG22 ILE 30 2HG2 ILE 30 4.510 1.072 5.289
196 HG23 ILE 30 3HG2 ILE 30 4.991 1.313 3.609
197 HD11 ILE 30 1HD1 ILE 30 1.943 0.024 5.968
198 HD12 ILE 30 2HD1 ILE 30 1.749 -0.110 4.220
199 HD13 ILE 30 3HD1 ILE 30 1.183 -1.407 5.272
200 H LEU 31 H LEU 31 6.146 -1.401 1.638
201 HA LEU 31 HA LEU 31 6.973 1.125 0.864
202 HB2 LEU 31 1HB LEU 31 8.344 -0.983 0.992
203 HB3 LEU 31 2HB LEU 31 7.677 -1.421 -0.579
204 HG LEU 31 HG LEU 31 8.680 0.714 -1.472
205 HD11 LEU 31 1HD1 LEU 31 9.043 1.343 1.158
206 HD12 LEU 31 2HD1 LEU 31 9.870 2.113 -0.196
207 HD13 LEU 31 3HD1 LEU 31 10.652 0.800 0.683
208 HD21 LEU 31 1HD2 LEU 31 9.661 -1.604 -1.678
209 HD22 LEU 31 2HD2 LEU 31 10.714 -1.185 -0.326
210 HD23 LEU 31 3HD2 LEU 31 10.802 -0.268 -1.831
211 H GLY 32 H GLY 32 5.013 -1.224 -0.879
212 HA2 GLY 32 1HA GLY 32 5.055 -0.137 -3.430
213 HA3 GLY 32 2HA GLY 32 3.686 -0.994 -2.739
214 H LEU 33 H LEU 33 3.589 1.127 -0.569
215 HA LEU 33 HA LEU 33 1.808 2.900 -2.010
216 HB2 LEU 33 1HB LEU 33 1.004 2.074 0.068
217 HB3 LEU 33 2HB LEU 33 2.477 2.562 0.903
218 HG LEU 33 HG LEU 33 1.857 4.918 0.597
219 HD11 LEU 33 1HD1 LEU 33 -0.867 4.094 -0.290
220 HD12 LEU 33 2HD1 LEU 33 0.418 4.266 -1.485
221 HD13 LEU 33 3HD1 LEU 33 -0.038 5.640 -0.478
222 HD21 LEU 33 1HD2 LEU 33 0.850 3.140 2.408
223 HD22 LEU 33 2HD2 LEU 33 -0.615 3.901 1.786
224 HD23 LEU 33 3HD2 LEU 33 0.663 4.892 2.491
225 H LYS 34 H LYS 34 4.644 3.267 0.113
226 HA LYS 34 HA LYS 34 4.979 5.984 0.033
227 HB2 LYS 34 1HB LYS 34 6.854 3.684 0.265
228 HB3 LYS 34 2HB LYS 34 7.551 5.272 -0.027
229 HG2 LYS 34 1HG LYS 34 7.570 5.199 2.258
230 HG3 LYS 34 2HG LYS 34 6.018 5.987 1.965
231 HD2 LYS 34 1HD LYS 34 4.820 3.987 2.373
232 HD3 LYS 34 2HD LYS 34 6.288 3.008 2.305
233 HE2 LYS 34 1HE LYS 34 5.838 5.142 4.379
234 HE3 LYS 34 2HE LYS 34 5.343 3.465 4.611
235 HZ1 LYS 34 1HZ LYS 34 7.965 3.375 3.755
236 HZ2 LYS 34 2HZ LYS 34 7.391 3.066 5.315
237 HZ3 LYS 34 3HZ LYS 34 7.913 4.620 4.900
238 H GLN 35 H GLN 35 6.299 3.641 -2.303
239 HA GLN 35 HA GLN 35 7.638 5.339 -3.990
240 HB2 GLN 35 1HB GLN 35 7.603 2.880 -4.215
241 HB3 GLN 35 2HB GLN 35 5.954 2.968 -4.818
242 HG2 GLN 35 1HG GLN 35 7.106 2.816 -6.777
243 HG3 GLN 35 2HG GLN 35 7.014 4.567 -6.596
244 HE21 GLN 35 1HE2 GLN 35 8.855 5.728 -6.184
245 HE22 GLN 35 2HE2 GLN 35 10.440 5.045 -6.260
246 H GLN 36 H GLN 36 4.175 4.586 -3.994
247 HA GLN 36 HA GLN 36 3.486 6.044 -6.288
248 HB2 GLN 36 1HB GLN 36 1.979 5.103 -3.878
249 HB3 GLN 36 2HB GLN 36 1.196 6.190 -5.017
250 HG2 GLN 36 1HG GLN 36 1.922 4.498 -6.809
251 HG3 GLN 36 2HG GLN 36 2.179 3.400 -5.454
252 HE21 GLN 36 1HE2 GLN 36 0.430 2.613 -4.325
253 HE22 GLN 36 2HE2 GLN 36 -1.197 2.783 -4.881
254 H ILE 37 H ILE 37 4.081 7.035 -3.000
255 HA ILE 37 HA ILE 37 2.938 9.657 -3.324
256 HB ILE 37 HB ILE 37 4.752 8.579 -1.162
257 HG12 ILE 37 1HG1 ILE 37 1.816 9.139 -0.879
258 HG13 ILE 37 2HG1 ILE 37 2.363 7.610 -1.559
259 HG21 ILE 37 1HG2 ILE 37 3.058 11.069 -1.112
260 HG22 ILE 37 2HG2 ILE 37 4.183 10.512 0.126
261 HG23 ILE 37 3HG2 ILE 37 4.791 11.057 -1.437
262 HD11 ILE 37 1HD1 ILE 37 3.577 8.460 0.999
263 HD12 ILE 37 2HD1 ILE 37 1.891 7.941 1.027
264 HD13 ILE 37 3HD1 ILE 37 3.140 6.851 0.424
265 H GLU 38 H GLU 38 6.111 8.195 -3.594
266 HA GLU 38 HA GLU 38 7.519 10.692 -3.749
267 HB2 GLU 38 1HB GLU 38 8.791 8.871 -2.948
268 HB3 GLU 38 2HB GLU 38 8.283 7.828 -4.268
269 HG2 GLU 38 1HG GLU 38 9.957 10.280 -4.702
270 HG3 GLU 38 2HG GLU 38 10.653 8.699 -4.350
271 H ASP 39 H ASP 39 6.424 8.256 -6.077
272 HA ASP 39 HA ASP 39 7.498 9.582 -8.355
273 HB2 ASP 39 1HB ASP 39 5.550 7.343 -7.933
274 HB3 ASP 39 2HB ASP 39 5.726 8.055 -9.535
275 H GLN 40 H GLN 40 4.720 10.083 -6.432
276 HA GLN 40 HA GLN 40 3.363 11.596 -8.539
277 HB2 GLN 40 1HB GLN 40 2.502 10.568 -5.849
278 HB3 GLN 40 2HB GLN 40 1.572 11.800 -6.691
279 HG2 GLN 40 1HG GLN 40 2.251 9.098 -7.828
280 HG3 GLN 40 2HG GLN 40 0.730 9.503 -7.034
281 HE21 GLN 40 1HE2 GLN 40 -0.203 11.661 -7.975
282 HE22 GLN 40 2HE2 GLN 40 -0.299 11.703 -9.699
283 H GLN 41 H GLN 41 4.353 12.014 -5.140
284 HA GLN 41 HA GLN 41 4.038 14.878 -5.314
285 HB2 GLN 41 1HB GLN 41 5.239 13.216 -3.094
286 HB3 GLN 41 2HB GLN 41 4.749 14.901 -2.985
287 HG2 GLN 41 1HG GLN 41 2.776 12.779 -3.724
288 HG3 GLN 41 2HG GLN 41 3.196 13.084 -2.039
289 HE21 GLN 41 1HE2 GLN 41 2.351 14.812 -1.017
290 HE22 GLN 41 2HE2 GLN 41 1.267 15.942 -1.745
291 H GLY 42 H GLY 42 6.615 12.548 -5.558
292 HA2 GLY 42 1HA GLY 42 8.648 13.027 -6.687
293 HA3 GLY 42 2HA GLY 42 8.440 14.725 -6.284
294 H LEU 43 H LEU 43 7.713 13.615 -3.463
295 HA LEU 43 HA LEU 43 10.259 14.098 -2.317
296 HB2 LEU 43 1HB LEU 43 7.801 14.312 -1.369
297 HB3 LEU 43 2HB LEU 43 8.137 12.682 -0.787
298 HG LEU 43 HG LEU 43 10.103 14.834 -0.178
299 HD11 LEU 43 1HD1 LEU 43 8.216 14.664 1.945
300 HD12 LEU 43 2HD1 LEU 43 7.363 15.095 0.464
301 HD13 LEU 43 3HD1 LEU 43 8.717 16.079 1.018
302 HD21 LEU 43 1HD2 LEU 43 10.383 13.529 1.853
303 HD22 LEU 43 2HD2 LEU 43 10.539 12.499 0.430
304 HD23 LEU 43 3HD2 LEU 43 9.052 12.474 1.379
305 HA PRO 44 HA PRO 44 12.043 10.069 -2.573
306 HB2 PRO 44 1HB PRO 44 13.980 10.393 -0.700
307 HB3 PRO 44 2HB PRO 44 14.066 11.124 -2.307
308 HG2 PRO 44 1HG PRO 44 13.232 12.354 0.292
309 HG3 PRO 44 2HG PRO 44 14.263 13.027 -0.985
310 HD2 PRO 44 1HD PRO 44 11.654 13.701 -0.713
311 HD3 PRO 44 2HD PRO 44 12.464 13.635 -2.291
312 H LYS 45 H LYS 45 12.140 8.123 -1.431
313 HA LYS 45 HA LYS 45 10.230 7.820 0.657
314 HB2 LYS 45 1HB LYS 45 12.293 5.772 -0.140
315 HB3 LYS 45 2HB LYS 45 10.697 5.494 0.545
316 HG2 LYS 45 1HG LYS 45 9.827 6.610 -1.613
317 HG3 LYS 45 2HG LYS 45 11.443 6.276 -2.242
318 HD2 LYS 45 1HD LYS 45 10.894 3.874 -1.216
319 HD3 LYS 45 2HD LYS 45 9.245 4.412 -1.544
320 HE2 LYS 45 1HE LYS 45 9.674 4.657 -3.846
321 HE3 LYS 45 2HE LYS 45 11.420 4.576 -3.611
322 HZ1 LYS 45 1HZ LYS 45 11.338 2.397 -3.896
323 HZ2 LYS 45 2HZ LYS 45 9.674 2.485 -4.186
324 HZ3 LYS 45 3HZ LYS 45 10.247 2.223 -2.615
325 H LYS 46 H LYS 46 13.568 8.547 0.606
326 HA LYS 46 HA LYS 46 14.151 7.523 3.238
327 HB2 LYS 46 1HB LYS 46 16.319 8.668 2.946
328 HB3 LYS 46 2HB LYS 46 15.931 7.617 1.591
329 HG2 LYS 46 1HG LYS 46 15.678 9.349 0.135
330 HG3 LYS 46 2HG LYS 46 15.163 10.476 1.392
331 HD2 LYS 46 1HD LYS 46 17.648 10.106 2.230
332 HD3 LYS 46 2HD LYS 46 17.904 9.703 0.531
333 HE2 LYS 46 1HE LYS 46 16.504 12.219 1.391
334 HE3 LYS 46 2HE LYS 46 18.256 12.132 1.223
335 HZ1 LYS 46 1HZ LYS 46 16.713 12.867 -0.758
336 HZ2 LYS 46 2HZ LYS 46 16.626 11.198 -1.017
337 HZ3 LYS 46 3HZ LYS 46 18.127 11.977 -1.025
338 H GLN 47 H GLN 47 12.225 9.930 2.329
339 HA GLN 47 HA GLN 47 12.917 11.582 4.666
340 HB2 GLN 47 1HB GLN 47 12.068 12.428 1.913
341 HB3 GLN 47 2HB GLN 47 11.761 13.461 3.302
342 HG2 GLN 47 1HG GLN 47 14.083 13.672 3.761
343 HG3 GLN 47 2HG GLN 47 14.488 12.424 2.584
344 HE21 GLN 47 1HE2 GLN 47 15.886 14.503 2.158
345 HE22 GLN 47 2HE2 GLN 47 15.282 15.512 0.892
346 H GLN 48 H GLN 48 10.352 10.413 2.534
347 HA GLN 48 HA GLN 48 8.219 11.390 4.155
348 HB2 GLN 48 1HB GLN 48 6.802 10.484 2.589
349 HB3 GLN 48 2HB GLN 48 8.267 10.649 1.629
350 HG2 GLN 48 1HG GLN 48 8.793 8.298 2.020
351 HG3 GLN 48 2HG GLN 48 7.328 8.132 2.987
352 HE21 GLN 48 1HE2 GLN 48 8.543 8.840 -0.235
353 HE22 GLN 48 2HE2 GLN 48 7.129 8.325 -1.083
354 H GLN 49 H GLN 49 7.248 10.497 5.869
355 HA GLN 49 HA GLN 49 7.739 7.668 6.467
356 HB2 GLN 49 1HB GLN 49 9.352 8.952 7.782
357 HB3 GLN 49 2HB GLN 49 8.053 9.940 8.436
358 HG2 GLN 49 1HG GLN 49 7.098 7.686 9.277
359 HG3 GLN 49 2HG GLN 49 8.737 7.093 9.016
360 HE21 GLN 49 1HE2 GLN 49 6.802 8.053 11.348
361 HE22 GLN 49 2HE2 GLN 49 7.913 8.835 12.415
362 H LEU 50 H LEU 50 5.792 6.763 6.460
363 HA LEU 50 HA LEU 50 3.461 8.296 7.304
364 HB2 LEU 50 1HB LEU 50 3.734 5.574 6.043
365 HB3 LEU 50 2HB LEU 50 2.196 6.314 6.483
366 HG LEU 50 HG LEU 50 4.122 7.496 4.487
367 HD11 LEU 50 1HD1 LEU 50 1.686 6.501 3.352
368 HD12 LEU 50 2HD1 LEU 50 2.540 5.203 4.185
369 HD13 LEU 50 3HD1 LEU 50 3.355 6.127 2.923
370 HD21 LEU 50 1HD2 LEU 50 2.194 8.850 3.843
371 HD22 LEU 50 2HD2 LEU 50 2.615 9.103 5.537
372 HD23 LEU 50 3HD2 LEU 50 1.232 8.093 5.112
373 H GLU 51 H GLU 51 2.079 7.678 8.964
374 HA GLU 51 HA GLU 51 2.964 5.482 10.695
375 HB2 GLU 51 1HB GLU 51 2.555 8.353 11.486
376 HB3 GLU 51 2HB GLU 51 2.369 7.055 12.658
377 HG2 GLU 51 1HG GLU 51 4.611 6.485 12.581
378 HG3 GLU 51 2HG GLU 51 4.857 7.263 11.018
379 H PHE 52 H PHE 52 1.301 4.893 12.329
380 HA PHE 52 HA PHE 52 -1.424 5.682 11.665
381 HB2 PHE 52 1HB PHE 52 -0.782 3.698 10.221
382 HB3 PHE 52 2HB PHE 52 -0.659 2.762 11.707
383 HD1 PHE 52 2HD PHE 52 -3.136 5.295 10.545
384 HD2 PHE 52 1HD PHE 52 -2.420 1.289 11.795
385 HE1 PHE 52 2HE PHE 52 -5.551 4.837 10.450
386 HE2 PHE 52 1HE PHE 52 -4.834 0.825 11.701
387 HZ PHE 52 HZ PHE 52 -6.404 2.600 11.029
388 H GLN 53 H GLN 53 -2.797 5.601 13.376
389 HA GLN 53 HA GLN 53 -3.217 5.800 15.638
390 HB2 GLN 53 1HB GLN 53 -2.654 2.887 15.134
391 HB3 GLN 53 2HB GLN 53 -3.218 3.461 16.698
392 HG2 GLN 53 1HG GLN 53 -5.295 4.039 15.891
393 HG3 GLN 53 2HG GLN 53 -4.724 4.188 14.230
394 HE21 GLN 53 1HE2 GLN 53 -4.393 1.576 16.597
395 HE22 GLN 53 2HE2 GLN 53 -5.154 0.366 15.629
396 H GLY 54 H GLY 54 -0.456 6.409 14.982
397 HA2 GLY 54 1HA GLY 54 1.364 7.039 16.269
398 HA3 GLY 54 2HA GLY 54 0.629 6.225 17.642
399 H GLN 55 H GLN 55 1.479 4.885 14.475
400 HA GLN 55 HA GLN 55 3.631 3.339 15.714
401 HB2 GLN 55 1HB GLN 55 2.777 1.266 15.221
402 HB3 GLN 55 2HB GLN 55 1.287 2.132 15.573
403 HG2 GLN 55 1HG GLN 55 0.949 2.500 13.172
404 HG3 GLN 55 2HG GLN 55 2.422 1.590 12.838
405 HE21 GLN 55 1HE2 GLN 55 -0.038 0.891 11.777
406 HE22 GLN 55 2HE2 GLN 55 -0.535 -0.618 12.455
407 H VAL 56 H VAL 56 5.381 3.203 14.456
408 HA VAL 56 HA VAL 56 5.432 4.524 11.927
409 HB VAL 56 HB VAL 56 7.541 2.848 13.295
410 HG11 VAL 56 1HG1 VAL 56 7.418 3.872 10.626
411 HG12 VAL 56 2HG1 VAL 56 8.697 4.699 11.517
412 HG13 VAL 56 3HG1 VAL 56 8.698 2.939 11.402
413 HG21 VAL 56 1HG2 VAL 56 6.586 5.178 14.187
414 HG22 VAL 56 2HG2 VAL 56 8.283 4.722 14.340
415 HG23 VAL 56 3HG2 VAL 56 7.770 5.788 13.031
416 H LEU 57 H LEU 57 4.974 3.703 10.001
417 HA LEU 57 HA LEU 57 4.547 0.854 9.702
418 HB2 LEU 57 1HB LEU 57 4.283 3.023 7.629
419 HB3 LEU 57 2HB LEU 57 3.624 1.391 7.549
420 HG LEU 57 HG LEU 57 2.753 3.491 9.532
421 HD11 LEU 57 1HD1 LEU 57 2.168 4.172 7.277
422 HD12 LEU 57 2HD1 LEU 57 0.729 3.664 8.161
423 HD13 LEU 57 3HD1 LEU 57 1.455 2.590 6.965
424 HD21 LEU 57 1HD2 LEU 57 0.757 1.633 9.270
425 HD22 LEU 57 2HD2 LEU 57 1.935 1.695 10.581
426 HD23 LEU 57 3HD2 LEU 57 2.214 0.643 9.192
427 H GLN 58 H GLN 58 5.941 -0.541 8.842
428 HA GLN 58 HA GLN 58 8.533 0.361 7.991
429 HB2 GLN 58 1HB GLN 58 7.317 -2.405 8.060
430 HB3 GLN 58 2HB GLN 58 9.002 -2.060 7.695
431 HG2 GLN 58 1HG GLN 58 7.544 -1.780 10.291
432 HG3 GLN 58 2HG GLN 58 9.018 -2.679 9.932
433 HE21 GLN 58 1HE2 GLN 58 10.591 -0.903 8.702
434 HE22 GLN 58 2HE2 GLN 58 10.943 0.436 9.736
435 H ASP 59 H ASP 59 9.368 -1.151 5.990
436 HA ASP 59 HA ASP 59 7.656 -0.337 3.741
437 HB2 ASP 59 1HB ASP 59 9.645 -0.223 2.390
438 HB3 ASP 59 2HB ASP 59 9.947 0.664 3.881
439 H TRP 60 H TRP 60 9.532 -3.000 5.072
440 HA TRP 60 HA TRP 60 8.922 -4.776 2.890
441 HB2 TRP 60 1HB TRP 60 10.258 -6.353 3.976
442 HB3 TRP 60 2HB TRP 60 10.981 -4.824 4.469
443 HD1 TRP 60 HD TRP 60 8.905 -7.734 5.844
444 HE1 TRP 60 1HE TRP 60 8.994 -7.661 8.416
445 HE3 TRP 60 3HE TRP 60 11.307 -3.261 6.447
446 HZ2 TRP 60 2HZ TRP 60 9.955 -5.935 10.432
447 HZ3 TRP 60 3HZ TRP 60 11.773 -2.471 8.730
448 HH2 TRP 60 HH TRP 60 11.110 -3.782 10.680
449 H LEU 61 H LEU 61 7.523 -3.959 5.961
450 HA LEU 61 HA LEU 61 5.925 -6.286 6.278
451 HB2 LEU 61 1HB LEU 61 5.603 -3.499 7.378
452 HB3 LEU 61 2HB LEU 61 4.640 -4.888 7.878
453 HG LEU 61 HG LEU 61 7.605 -4.507 8.290
454 HD11 LEU 61 1HD1 LEU 61 5.802 -3.286 9.721
455 HD12 LEU 61 2HD1 LEU 61 7.155 -4.097 10.510
456 HD13 LEU 61 3HD1 LEU 61 5.575 -4.877 10.447
457 HD21 LEU 61 1HD2 LEU 61 7.501 -6.615 9.536
458 HD22 LEU 61 2HD2 LEU 61 7.105 -6.843 7.833
459 HD23 LEU 61 3HD2 LEU 61 5.821 -6.820 9.042
460 H GLY 62 H GLY 62 3.667 -6.525 5.959
461 HA2 GLY 62 1HA GLY 62 2.702 -5.024 3.632
462 HA3 GLY 62 2HA GLY 62 2.077 -6.566 4.197
463 H LEU 63 H LEU 63 0.231 -4.778 3.573
464 HA LEU 63 HA LEU 63 -0.497 -3.034 5.709
465 HB2 LEU 63 1HB LEU 63 -1.936 -4.063 3.284
466 HB3 LEU 63 2HB LEU 63 -2.735 -3.035 4.472
467 HG LEU 63 HG LEU 63 -0.923 -1.327 4.023
468 HD11 LEU 63 1HD1 LEU 63 0.285 -1.511 1.923
469 HD12 LEU 63 2HD1 LEU 63 -0.416 -3.103 1.640
470 HD13 LEU 63 3HD1 LEU 63 0.689 -2.855 2.992
471 HD21 LEU 63 1HD2 LEU 63 -2.857 -2.147 1.864
472 HD22 LEU 63 2HD2 LEU 63 -1.965 -0.625 1.853
473 HD23 LEU 63 3HD2 LEU 63 -3.109 -0.967 3.151
474 H GLY 64 H GLY 64 -1.940 -6.077 4.516
475 HA2 GLY 64 1HA GLY 64 -3.876 -6.443 6.433
476 HA3 GLY 64 2HA GLY 64 -3.017 -7.762 5.651
477 H ILE 65 H ILE 65 -0.466 -6.583 6.866
478 HA ILE 65 HA ILE 65 -0.428 -8.268 9.159
479 HB ILE 65 HB ILE 65 1.545 -6.302 8.027
480 HG12 ILE 65 1HG1 ILE 65 2.858 -8.570 7.988
481 HG13 ILE 65 2HG1 ILE 65 1.258 -9.284 8.152
482 HG21 ILE 65 1HG2 ILE 65 1.891 -6.126 10.372
483 HG22 ILE 65 2HG2 ILE 65 1.750 -7.870 10.588
484 HG23 ILE 65 3HG2 ILE 65 3.145 -7.196 9.746
485 HD11 ILE 65 1HD1 ILE 65 0.657 -8.745 6.047
486 HD12 ILE 65 2HD1 ILE 65 1.586 -7.246 6.045
487 HD13 ILE 65 3HD1 ILE 65 2.402 -8.790 5.800
488 H TYR 66 H TYR 66 -0.195 -4.732 8.778
489 HA TYR 66 HA TYR 66 -0.270 -4.213 11.573
490 HB2 TYR 66 1HB TYR 66 -0.414 -2.574 9.089
491 HB3 TYR 66 2HB TYR 66 -0.984 -1.845 10.586
492 HD1 TYR 66 2HD TYR 66 0.737 -2.370 12.646
493 HD2 TYR 66 1HD TYR 66 1.760 -2.088 8.525
494 HE1 TYR 66 2HE TYR 66 3.053 -1.822 13.264
495 HE2 TYR 66 1HE TYR 66 4.079 -1.541 9.132
496 HH TYR 66 HH TYR 66 5.085 -0.395 11.709
497 H GLY 67 H GLY 67 -2.707 -4.132 9.000
498 HA2 GLY 67 1HA GLY 67 -4.953 -4.911 9.571
499 HA3 GLY 67 2HA GLY 67 -4.774 -4.082 11.110
500 H ILE 68 H ILE 68 -3.579 -2.481 8.309
501 HA ILE 68 HA ILE 68 -5.143 -0.198 8.681
502 HB ILE 68 HB ILE 68 -3.733 -1.127 6.177
503 HG12 ILE 68 1HG1 ILE 68 -2.811 0.949 8.159
504 HG13 ILE 68 2HG1 ILE 68 -2.402 -0.754 8.336
505 HG21 ILE 68 1HG2 ILE 68 -5.458 0.547 5.696
506 HG22 ILE 68 2HG2 ILE 68 -4.741 1.622 6.895
507 HG23 ILE 68 3HG2 ILE 68 -3.836 1.190 5.445
508 HD11 ILE 68 1HD1 ILE 68 -1.065 1.196 6.835
509 HD12 ILE 68 2HD1 ILE 68 -0.727 -0.533 6.915
510 HD13 ILE 68 3HD1 ILE 68 -1.810 0.097 5.674
511 H GLN 69 H GLN 69 -7.179 0.272 8.185
512 HA GLN 69 HA GLN 69 -8.661 -1.571 6.456
513 HB2 GLN 69 1HB GLN 69 -10.677 -0.598 7.454
514 HB3 GLN 69 2HB GLN 69 -9.582 -1.204 8.690
515 HG2 GLN 69 1HG GLN 69 -8.729 1.261 8.733
516 HG3 GLN 69 2HG GLN 69 -10.297 1.603 8.002
517 HE21 GLN 69 1HE2 GLN 69 -8.613 0.996 10.865
518 HE22 GLN 69 2HE2 GLN 69 -9.967 0.892 11.932
519 H ASP 70 H ASP 70 -10.017 -0.811 4.790
520 HA ASP 70 HA ASP 70 -8.958 1.128 3.121
521 HB2 ASP 70 1HB ASP 70 -10.382 -0.302 2.006
522 HB3 ASP 70 2HB ASP 70 -11.595 -0.261 3.283
523 H SER 71 H SER 71 -9.605 3.237 2.558
524 HA SER 71 HA SER 71 -10.265 5.381 2.943
525 HB2 SER 71 1HB SER 71 -12.527 4.092 3.191
526 HB3 SER 71 2HB SER 71 -12.331 4.443 4.908
527 HG SER 71 HG SER 71 -12.352 6.619 4.452
528 H ASP 72 H ASP 72 -8.186 4.242 4.513
529 HA ASP 72 HA ASP 72 -8.554 5.295 7.202
530 HB2 ASP 72 1HB ASP 72 -6.202 4.418 7.529
531 HB3 ASP 72 2HB ASP 72 -7.414 3.203 7.130
532 H THR 73 H THR 73 -6.898 6.724 8.139
533 HA THR 73 HA THR 73 -6.047 8.738 6.169
534 HB THR 73 HB THR 73 -6.598 9.059 9.125
535 HG1 THR 73 1HG THR 73 -7.973 10.206 6.914
536 HG21 THR 73 1HG2 THR 73 -5.380 10.922 9.040
537 HG22 THR 73 2HG2 THR 73 -6.468 11.549 7.800
538 HG23 THR 73 3HG2 THR 73 -5.026 10.646 7.335
539 H LEU 74 H LEU 74 -3.973 8.436 5.648
540 HA LEU 74 HA LEU 74 -2.076 7.583 7.707
541 HB2 LEU 74 1HB LEU 74 -1.618 7.913 4.748
542 HB3 LEU 74 2HB LEU 74 -0.555 7.113 5.905
543 HG LEU 74 HG LEU 74 -3.318 6.116 5.236
544 HD11 LEU 74 1HD1 LEU 74 -1.824 6.181 3.240
545 HD12 LEU 74 2HD1 LEU 74 -2.332 4.562 3.716
546 HD13 LEU 74 3HD1 LEU 74 -0.708 5.126 4.106
547 HD21 LEU 74 1HD2 LEU 74 -1.260 5.368 7.123
548 HD22 LEU 74 2HD2 LEU 74 -1.649 4.040 6.030
549 HD23 LEU 74 3HD2 LEU 74 -2.924 4.799 6.985
550 H ILE 75 H ILE 75 -0.745 8.973 8.657
551 HA ILE 75 HA ILE 75 -0.701 11.736 7.799
552 HB ILE 75 HB ILE 75 0.852 10.515 10.077
553 HG12 ILE 75 1HG1 ILE 75 -1.632 10.049 10.174
554 HG13 ILE 75 2HG1 ILE 75 -0.987 10.962 11.533
555 HG21 ILE 75 1HG2 ILE 75 -0.055 13.159 10.567
556 HG22 ILE 75 2HG2 ILE 75 1.600 12.578 10.395
557 HG23 ILE 75 3HG2 ILE 75 0.707 13.126 8.977
558 HD11 ILE 75 1HD1 ILE 75 -2.248 12.744 11.078
559 HD12 ILE 75 2HD1 ILE 75 -1.969 12.622 9.341
560 HD13 ILE 75 3HD1 ILE 75 -3.201 11.622 10.108
561 H LEU 76 H LEU 76 1.039 12.862 7.018
562 HA LEU 76 HA LEU 76 3.428 11.276 6.340
563 HB2 LEU 76 1HB LEU 76 2.220 11.675 4.327
564 HB3 LEU 76 2HB LEU 76 1.990 13.374 4.732
565 HG LEU 76 HG LEU 76 4.495 13.636 4.514
566 HD11 LEU 76 1HD1 LEU 76 4.356 11.038 3.016
567 HD12 LEU 76 2HD1 LEU 76 4.878 11.132 4.697
568 HD13 LEU 76 3HD1 LEU 76 5.779 11.986 3.445
569 HD21 LEU 76 1HD2 LEU 76 2.446 13.516 2.546
570 HD22 LEU 76 2HD2 LEU 76 3.941 12.910 1.832
571 HD23 LEU 76 3HD2 LEU 76 3.901 14.514 2.567
572 H SER 77 H SER 77 5.298 12.036 7.079
573 HA SER 77 HA SER 77 5.584 14.898 7.621
574 HB2 SER 77 1HB SER 77 6.035 12.689 9.630
575 HB3 SER 77 2HB SER 77 6.720 14.303 9.814
576 HG SER 77 HG SER 77 3.961 13.939 9.365
577 H LYS 78 H LYS 78 7.432 15.645 6.828
578 HA LYS 78 HA LYS 78 9.332 13.917 5.607
579 HB2 LYS 78 1HB LYS 78 8.663 16.421 5.100
580 HB3 LYS 78 2HB LYS 78 9.975 16.772 6.217
581 HG2 LYS 78 1HG LYS 78 11.301 15.102 4.689
582 HG3 LYS 78 2HG LYS 78 10.063 15.543 3.510
583 HD2 LYS 78 1HD LYS 78 10.656 17.982 4.228
584 HD3 LYS 78 2HD LYS 78 12.156 17.246 4.796
585 HE2 LYS 78 1HE LYS 78 12.153 16.160 2.406
586 HE3 LYS 78 2HE LYS 78 11.098 17.519 2.019
587 HZ1 LYS 78 1HZ LYS 78 13.805 17.753 3.218
588 HZ2 LYS 78 2HZ LYS 78 12.801 19.035 2.763
589 HZ3 LYS 78 3HZ LYS 78 13.441 18.004 1.585
590 H LYS 79 H LYS 79 11.465 13.486 6.174
591 HA LYS 79 HA LYS 79 11.970 13.233 8.964
592 HB2 LYS 79 1HB LYS 79 13.740 12.788 6.556
593 HB3 LYS 79 2HB LYS 79 14.217 12.408 8.206
594 HG2 LYS 79 1HG LYS 79 11.673 11.261 7.195
595 HG3 LYS 79 2HG LYS 79 13.191 10.590 6.593
596 HD2 LYS 79 1HD LYS 79 13.913 10.299 8.967
597 HD3 LYS 79 2HD LYS 79 12.294 10.792 9.466
598 HE2 LYS 79 1HE LYS 79 11.330 8.853 8.735
599 HE3 LYS 79 2HE LYS 79 12.532 8.605 7.469
600 HZ1 LYS 79 1HZ LYS 79 13.029 6.972 9.006
601 HZ2 LYS 79 2HZ LYS 79 12.713 7.962 10.340
602 HZ3 LYS 79 3HZ LYS 79 14.119 8.195 9.429
603 H LYS 80 H LYS 80 13.527 14.249 10.238
604 HA LYS 80 HA LYS 80 14.329 16.904 9.270
605 HB2 LYS 80 1HB LYS 80 13.886 15.799 12.039
606 HB3 LYS 80 2HB LYS 80 14.700 17.333 11.762
607 HG2 LYS 80 1HG LYS 80 11.965 16.765 10.667
608 HG3 LYS 80 2HG LYS 80 12.217 17.404 12.293
609 HD2 LYS 80 1HD LYS 80 13.044 19.418 11.514
610 HD3 LYS 80 2HD LYS 80 13.522 18.737 9.957
611 HE2 LYS 80 1HE LYS 80 10.662 19.087 10.841
612 HE3 LYS 80 2HE LYS 80 11.543 20.265 9.869
613 HZ1 LYS 80 1HZ LYS 80 10.945 19.117 8.091
614 HZ2 LYS 80 2HZ LYS 80 10.236 17.906 9.034
615 HZ3 LYS 80 3HZ LYS 80 11.876 17.811 8.630
616 H GLY 81 H GLY 81 16.269 16.581 8.276
617 HA2 GLY 81 1HA GLY 81 18.550 16.171 9.961
618 HA3 GLY 81 2HA GLY 81 18.273 14.808 8.886
619 H SER 82 H SER 82 19.419 14.875 7.085
620 HA SER 82 HA SER 82 19.488 17.081 5.337
621 HB2 SER 82 1HB SER 82 21.035 17.847 7.242
622 HB3 SER 82 2HB SER 82 22.160 16.621 6.657
623 HG SER 82 HG SER 82 21.335 19.007 5.461
624 H GLY 83 H GLY 83 19.482 16.033 3.467
625 HA2 GLY 83 1HA GLY 83 21.499 13.937 3.029
626 HA3 GLY 83 2HA GLY 83 19.812 13.594 2.673
627 HA PRO 84 HA PRO 84 22.142 16.018 -0.792
628 HB2 PRO 84 1HB PRO 84 23.362 14.015 -2.159
629 HB3 PRO 84 2HB PRO 84 24.162 14.926 -0.873
630 HG2 PRO 84 1HG PRO 84 22.859 12.233 -0.758
631 HG3 PRO 84 2HG PRO 84 24.391 12.766 -0.043
632 HD2 PRO 84 1HD PRO 84 22.108 12.553 1.396
633 HD3 PRO 84 2HD PRO 84 23.349 13.771 1.751
634 H SER 85 H SER 85 21.472 16.022 -2.994
635 HA SER 85 HA SER 85 19.144 14.297 -3.491
636 HB2 SER 85 1HB SER 85 19.863 17.016 -4.606
637 HB3 SER 85 2HB SER 85 18.476 16.065 -5.137
638 HG SER 85 HG SER 85 18.186 17.720 -3.389
639 H SER 86 H SER 86 19.883 12.544 -4.556
640 HA SER 86 HA SER 86 21.959 12.688 -6.526
641 HB2 SER 86 1HB SER 86 21.330 10.691 -4.998
642 HB3 SER 86 2HB SER 86 20.088 10.353 -6.203
643 HG SER 86 HG SER 86 21.593 9.836 -7.643
644 H GLY 87 H GLY 87 21.667 13.471 -8.500
645 HA2 GLY 87 1HA GLY 87 19.070 13.795 -9.657
646 HA3 GLY 87 2HA GLY 87 20.606 14.155 -10.430
Start of MODEL 17
1 H1 GLY 1 H GLY 1 -15.377 7.791 -11.793
2 HA2 GLY 1 1HA GLY 1 -14.226 6.548 -9.377
3 HA3 GLY 1 2HA GLY 1 -15.686 7.521 -9.280
4 H SER 2 H SER 2 -14.389 4.752 -11.112
5 HA SER 2 HA SER 2 -16.865 3.301 -10.561
6 HB2 SER 2 1HB SER 2 -15.735 3.608 -13.354
7 HB3 SER 2 2HB SER 2 -17.130 2.629 -12.901
8 HG SER 2 HG SER 2 -16.885 5.451 -12.747
9 H SER 3 H SER 3 -16.686 1.002 -10.885
10 HA SER 3 HA SER 3 -14.420 -0.151 -9.838
11 HB2 SER 3 1HB SER 3 -16.737 -1.189 -10.166
12 HB3 SER 3 2HB SER 3 -16.199 -1.606 -11.793
13 HG SER 3 HG SER 3 -14.467 -2.763 -10.822
14 H GLY 4 H GLY 4 -12.455 -0.647 -10.573
15 HA2 GLY 4 1HA GLY 4 -11.968 -1.338 -13.320
16 HA3 GLY 4 2HA GLY 4 -11.359 0.258 -12.905
17 H SER 5 H SER 5 -10.378 -0.056 -10.403
18 HA SER 5 HA SER 5 -8.335 -2.156 -10.728
19 HB2 SER 5 1HB SER 5 -7.450 0.140 -11.096
20 HB3 SER 5 2HB SER 5 -7.949 0.566 -9.459
21 HG SER 5 HG SER 5 -5.708 -0.100 -9.695
22 H SER 6 H SER 6 -8.571 -3.684 -9.249
23 HA SER 6 HA SER 6 -10.151 -3.434 -6.932
24 HB2 SER 6 1HB SER 6 -9.341 -5.558 -8.254
25 HB3 SER 6 2HB SER 6 -7.993 -5.506 -7.118
26 HG SER 6 HG SER 6 -9.289 -6.073 -5.537
27 H GLY 7 H GLY 7 -9.119 -4.187 -4.722
28 HA2 GLY 7 1HA GLY 7 -7.176 -3.964 -3.277
29 HA3 GLY 7 2HA GLY 7 -6.688 -2.582 -4.247
30 H ILE 8 H ILE 8 -6.580 -1.883 -1.827
31 HA ILE 8 HA ILE 8 -9.185 -0.763 -1.036
32 HB ILE 8 HB ILE 8 -8.294 -0.529 1.212
33 HG12 ILE 8 1HG1 ILE 8 -5.805 -1.973 0.316
34 HG13 ILE 8 2HG1 ILE 8 -5.894 -0.216 0.351
35 HG21 ILE 8 1HG2 ILE 8 -7.642 -3.122 1.449
36 HG22 ILE 8 2HG2 ILE 8 -9.294 -2.554 1.214
37 HG23 ILE 8 3HG2 ILE 8 -8.359 -3.139 -0.162
38 HD11 ILE 8 1HD1 ILE 8 -6.599 -1.779 2.788
39 HD12 ILE 8 2HD1 ILE 8 -4.908 -1.508 2.367
40 HD13 ILE 8 3HD1 ILE 8 -5.978 -0.135 2.646
41 H GLN 9 H GLN 9 -9.355 1.414 -0.474
42 HA GLN 9 HA GLN 9 -7.325 3.121 -1.695
43 HB2 GLN 9 1HB GLN 9 -9.886 3.263 -2.117
44 HB3 GLN 9 2HB GLN 9 -9.931 4.099 -0.571
45 HG2 GLN 9 1HG GLN 9 -9.741 5.876 -1.973
46 HG3 GLN 9 2HG GLN 9 -8.035 5.547 -1.672
47 HE21 GLN 9 1HE2 GLN 9 -10.573 4.323 -3.836
48 HE22 GLN 9 2HE2 GLN 9 -9.620 4.401 -5.275
49 H VAL 10 H VAL 10 -6.146 4.622 -0.606
50 HA VAL 10 HA VAL 10 -6.605 4.883 2.289
51 HB VAL 10 HB VAL 10 -4.173 4.891 2.668
52 HG11 VAL 10 1HG1 VAL 10 -5.496 2.823 2.930
53 HG12 VAL 10 2HG1 VAL 10 -5.100 2.386 1.267
54 HG13 VAL 10 3HG1 VAL 10 -3.821 2.508 2.476
55 HG21 VAL 10 1HG2 VAL 10 -3.218 5.571 0.648
56 HG22 VAL 10 2HG2 VAL 10 -2.781 3.867 0.767
57 HG23 VAL 10 3HG2 VAL 10 -4.105 4.366 -0.285
58 H PHE 11 H PHE 11 -6.249 6.887 3.161
59 HA PHE 11 HA PHE 11 -5.822 9.048 1.227
60 HB2 PHE 11 1HB PHE 11 -7.088 8.991 3.967
61 HB3 PHE 11 2HB PHE 11 -6.737 10.489 3.111
62 HD1 PHE 11 1HD PHE 11 -7.753 10.750 0.762
63 HD2 PHE 11 2HD PHE 11 -9.094 7.892 3.616
64 HE1 PHE 11 1HE PHE 11 -9.900 10.576 -0.427
65 HE2 PHE 11 2HE PHE 11 -11.243 7.712 2.432
66 HZ PHE 11 HZ PHE 11 -11.648 9.055 0.407
67 H VAL 12 H VAL 12 -3.847 9.865 1.112
68 HA VAL 12 HA VAL 12 -2.075 9.687 3.439
69 HB VAL 12 HB VAL 12 -1.450 10.348 0.558
70 HG11 VAL 12 1HG1 VAL 12 0.931 10.017 1.344
71 HG12 VAL 12 2HG1 VAL 12 0.138 11.501 1.876
72 HG13 VAL 12 3HG1 VAL 12 0.309 10.143 2.989
73 HG21 VAL 12 1HG2 VAL 12 -0.082 8.083 1.149
74 HG22 VAL 12 2HG2 VAL 12 -1.542 7.855 2.113
75 HG23 VAL 12 3HG2 VAL 12 -1.666 8.114 0.373
76 H LYS 13 H LYS 13 -2.308 11.389 4.754
77 HA LYS 13 HA LYS 13 -2.872 14.031 3.705
78 HB2 LYS 13 1HB LYS 13 -4.003 13.334 5.738
79 HB3 LYS 13 2HB LYS 13 -2.461 13.035 6.529
80 HG2 LYS 13 1HG LYS 13 -1.946 15.461 6.280
81 HG3 LYS 13 2HG LYS 13 -3.591 15.692 5.684
82 HD2 LYS 13 1HD LYS 13 -4.360 14.585 7.843
83 HD3 LYS 13 2HD LYS 13 -2.702 14.791 8.414
84 HE2 LYS 13 1HE LYS 13 -4.106 17.147 7.262
85 HE3 LYS 13 2HE LYS 13 -4.568 16.606 8.875
86 HZ1 LYS 13 1HZ LYS 13 -2.131 17.889 7.983
87 HZ2 LYS 13 2HZ LYS 13 -1.904 16.608 9.063
88 HZ3 LYS 13 3HZ LYS 13 -2.879 17.919 9.500
89 H ASN 14 H ASN 14 -1.338 15.390 3.085
90 HA ASN 14 HA ASN 14 1.429 14.894 3.765
91 HB2 ASN 14 1HB ASN 14 1.941 16.665 2.184
92 HB3 ASN 14 2HB ASN 14 0.757 15.572 1.474
93 HD21 ASN 14 1HD2 ASN 14 0.661 17.643 0.125
94 HD22 ASN 14 2HD2 ASN 14 -0.550 18.784 0.590
95 HA PRO 15 HA PRO 15 1.783 17.727 7.105
96 HB2 PRO 15 1HB PRO 15 4.375 18.486 6.828
97 HB3 PRO 15 2HB PRO 15 3.899 16.889 7.416
98 HG2 PRO 15 1HG PRO 15 4.772 17.716 4.674
99 HG3 PRO 15 2HG PRO 15 5.225 16.277 5.606
100 HD2 PRO 15 1HD PRO 15 3.364 16.213 3.640
101 HD3 PRO 15 2HD PRO 15 3.281 15.162 5.069
102 H ASP 16 H ASP 16 1.839 18.690 3.901
103 HA ASP 16 HA ASP 16 2.480 21.475 4.380
104 HB2 ASP 16 1HB ASP 16 1.650 19.908 1.946
105 HB3 ASP 16 2HB ASP 16 1.730 21.668 1.926
106 H GLY 17 H GLY 17 -0.383 19.524 3.640
107 HA2 GLY 17 1HA GLY 17 -2.336 20.478 5.041
108 HA3 GLY 17 2HA GLY 17 -2.065 21.903 4.048
109 H GLY 18 H GLY 18 -2.728 18.416 3.790
110 HA2 GLY 18 1HA GLY 18 -4.980 18.683 2.173
111 HA3 GLY 18 2HA GLY 18 -3.600 18.511 1.098
112 H SER 19 H SER 19 -5.165 16.589 0.636
113 HA SER 19 HA SER 19 -3.858 14.242 1.587
114 HB2 SER 19 1HB SER 19 -5.909 13.183 2.573
115 HB3 SER 19 2HB SER 19 -5.261 14.515 3.529
116 HG SER 19 HG SER 19 -6.913 15.793 2.893
117 H TYR 20 H TYR 20 -3.883 12.810 -0.016
118 HA TYR 20 HA TYR 20 -6.006 13.035 -2.046
119 HB2 TYR 20 1HB TYR 20 -3.360 11.771 -2.644
120 HB3 TYR 20 2HB TYR 20 -4.474 12.595 -3.730
121 HD1 TYR 20 2HD TYR 20 -4.879 15.189 -2.805
122 HD2 TYR 20 1HD TYR 20 -1.344 12.852 -2.427
123 HE1 TYR 20 2HE TYR 20 -3.546 17.247 -2.619
124 HE2 TYR 20 1HE TYR 20 -0.001 14.904 -2.238
125 HH TYR 20 HH TYR 20 -0.917 17.793 -3.163
126 H ALA 21 H ALA 21 -6.586 11.037 -3.162
127 HA ALA 21 HA ALA 21 -6.602 8.779 -1.293
128 HB1 ALA 21 1HB ALA 21 -8.268 8.886 -3.771
129 HB2 ALA 21 2HB ALA 21 -8.597 8.092 -2.231
130 HB3 ALA 21 3HB ALA 21 -8.716 9.847 -2.361
131 H TYR 22 H TYR 22 -5.275 7.132 -1.629
132 HA TYR 22 HA TYR 22 -4.198 6.713 -4.334
133 HB2 TYR 22 1HB TYR 22 -3.105 6.086 -1.598
134 HB3 TYR 22 2HB TYR 22 -2.446 5.341 -3.050
135 HD1 TYR 22 2HD TYR 22 -3.230 8.698 -1.621
136 HD2 TYR 22 1HD TYR 22 -0.728 6.405 -4.187
137 HE1 TYR 22 2HE TYR 22 -1.798 10.666 -1.974
138 HE2 TYR 22 1HE TYR 22 0.712 8.366 -4.546
139 HH TYR 22 HH TYR 22 0.036 11.225 -4.244
140 H ALA 23 H ALA 23 -3.901 4.529 -5.080
141 HA ALA 23 HA ALA 23 -5.818 2.635 -3.882
142 HB1 ALA 23 1HB ALA 23 -5.192 3.136 -6.785
143 HB2 ALA 23 2HB ALA 23 -6.102 1.738 -6.209
144 HB3 ALA 23 3HB ALA 23 -6.731 3.366 -5.954
145 H ILE 24 H ILE 24 -4.749 1.041 -2.919
146 HA ILE 24 HA ILE 24 -2.646 -0.345 -4.390
147 HB ILE 24 HB ILE 24 -1.405 1.243 -3.020
148 HG12 ILE 24 1HG1 ILE 24 -1.180 -1.472 -1.723
149 HG13 ILE 24 2HG1 ILE 24 -0.637 -1.164 -3.369
150 HG21 ILE 24 1HG2 ILE 24 -3.281 1.377 -1.285
151 HG22 ILE 24 2HG2 ILE 24 -2.536 -0.045 -0.558
152 HG23 ILE 24 3HG2 ILE 24 -1.619 1.455 -0.700
153 HD11 ILE 24 1HD1 ILE 24 0.425 -0.002 -0.816
154 HD12 ILE 24 2HD1 ILE 24 1.266 -0.996 -2.005
155 HD13 ILE 24 3HD1 ILE 24 0.815 0.661 -2.403
156 H ASN 25 H ASN 25 -2.961 -2.466 -4.291
157 HA ASN 25 HA ASN 25 -5.070 -3.697 -3.017
158 HB2 ASN 25 1HB ASN 25 -2.432 -4.787 -3.985
159 HB3 ASN 25 2HB ASN 25 -3.673 -5.833 -3.301
160 HD21 ASN 25 1HD2 ASN 25 -2.590 -4.164 -6.048
161 HD22 ASN 25 2HD2 ASN 25 -3.919 -4.531 -7.089
162 HA PRO 26 HA PRO 26 -4.019 -4.132 1.225
163 HB2 PRO 26 1HB PRO 26 -5.269 -6.468 1.818
164 HB3 PRO 26 2HB PRO 26 -6.141 -4.957 1.534
165 HG2 PRO 26 1HG PRO 26 -5.663 -7.248 -0.333
166 HG3 PRO 26 2HG PRO 26 -7.146 -6.312 -0.066
167 HD2 PRO 26 1HD PRO 26 -5.505 -5.873 -2.175
168 HD3 PRO 26 2HD PRO 26 -6.439 -4.574 -1.406
169 H ASN 27 H ASN 27 -3.227 -6.674 -1.027
170 HA ASN 27 HA ASN 27 -1.592 -8.148 0.830
171 HB2 ASN 27 1HB ASN 27 -2.063 -8.340 -2.141
172 HB3 ASN 27 2HB ASN 27 -0.861 -9.335 -1.324
173 HD21 ASN 27 1HD2 ASN 27 -2.950 -10.468 -2.677
174 HD22 ASN 27 2HD2 ASN 27 -4.032 -11.215 -1.556
175 H SER 28 H SER 28 -1.083 -5.808 -1.757
176 HA SER 28 HA SER 28 1.615 -5.924 -2.154
177 HB2 SER 28 1HB SER 28 -0.346 -3.671 -2.158
178 HB3 SER 28 2HB SER 28 1.371 -3.287 -2.282
179 HG SER 28 HG SER 28 -0.262 -4.742 -4.049
180 H PHE 29 H PHE 29 3.436 -4.873 -1.256
181 HA PHE 29 HA PHE 29 3.370 -4.755 1.626
182 HB2 PHE 29 1HB PHE 29 5.736 -4.113 -0.128
183 HB3 PHE 29 2HB PHE 29 5.740 -4.695 1.534
184 HD1 PHE 29 2HD PHE 29 4.496 -7.035 1.835
185 HD2 PHE 29 1HD PHE 29 6.245 -5.615 -1.777
186 HE1 PHE 29 2HE PHE 29 4.692 -9.350 1.024
187 HE2 PHE 29 1HE PHE 29 6.443 -7.928 -2.594
188 HZ PHE 29 HZ PHE 29 5.667 -9.799 -1.193
189 H ILE 30 H ILE 30 3.713 -2.981 2.915
190 HA ILE 30 HA ILE 30 2.658 -0.567 2.347
191 HB ILE 30 HB ILE 30 5.049 -1.082 4.117
192 HG12 ILE 30 1HG1 ILE 30 3.024 -2.327 4.732
193 HG13 ILE 30 2HG1 ILE 30 3.385 -1.082 5.923
194 HG21 ILE 30 1HG2 ILE 30 3.883 1.396 3.310
195 HG22 ILE 30 2HG2 ILE 30 3.565 1.137 5.025
196 HG23 ILE 30 3HG2 ILE 30 5.222 1.109 4.421
197 HD11 ILE 30 1HD1 ILE 30 1.719 0.313 4.413
198 HD12 ILE 30 2HD1 ILE 30 1.123 -1.304 4.032
199 HD13 ILE 30 3HD1 ILE 30 1.158 -0.748 5.706
200 H LEU 31 H LEU 31 6.128 -1.317 2.016
201 HA LEU 31 HA LEU 31 7.161 1.016 1.144
202 HB2 LEU 31 1HB LEU 31 8.222 -1.333 1.311
203 HB3 LEU 31 2HB LEU 31 7.769 -1.488 -0.385
204 HG LEU 31 HG LEU 31 9.161 0.474 -0.914
205 HD11 LEU 31 1HD1 LEU 31 9.899 1.855 0.653
206 HD12 LEU 31 2HD1 LEU 31 10.738 0.537 1.471
207 HD13 LEU 31 3HD1 LEU 31 9.055 0.889 1.865
208 HD21 LEU 31 1HD2 LEU 31 11.179 -0.677 -0.927
209 HD22 LEU 31 2HD2 LEU 31 9.982 -1.969 -0.822
210 HD23 LEU 31 3HD2 LEU 31 10.858 -1.457 0.622
211 H GLY 32 H GLY 32 5.418 -1.304 -0.917
212 HA2 GLY 32 1HA GLY 32 5.633 -0.073 -3.363
213 HA3 GLY 32 2HA GLY 32 4.209 -0.962 -2.844
214 H LEU 33 H LEU 33 3.440 0.773 -0.726
215 HA LEU 33 HA LEU 33 1.878 2.630 -2.150
216 HB2 LEU 33 1HB LEU 33 1.032 1.858 -0.098
217 HB3 LEU 33 2HB LEU 33 2.511 2.279 0.762
218 HG LEU 33 HG LEU 33 1.933 4.695 0.360
219 HD11 LEU 33 1HD1 LEU 33 -0.837 3.709 -0.226
220 HD12 LEU 33 2HD1 LEU 33 0.310 4.061 -1.519
221 HD13 LEU 33 3HD1 LEU 33 -0.175 5.335 -0.401
222 HD21 LEU 33 1HD2 LEU 33 0.064 4.661 2.081
223 HD22 LEU 33 2HD2 LEU 33 1.570 3.858 2.529
224 HD23 LEU 33 3HD2 LEU 33 0.178 2.902 2.016
225 H LYS 34 H LYS 34 4.544 3.235 0.144
226 HA LYS 34 HA LYS 34 4.813 5.920 -0.013
227 HB2 LYS 34 1HB LYS 34 6.776 3.706 0.269
228 HB3 LYS 34 2HB LYS 34 7.421 5.310 -0.056
229 HG2 LYS 34 1HG LYS 34 7.418 5.376 2.209
230 HG3 LYS 34 2HG LYS 34 5.779 5.963 1.917
231 HD2 LYS 34 1HD LYS 34 5.526 4.323 3.571
232 HD3 LYS 34 2HD LYS 34 5.070 3.508 2.073
233 HE2 LYS 34 1HE LYS 34 6.457 1.958 3.094
234 HE3 LYS 34 2HE LYS 34 7.553 2.788 1.991
235 HZ1 LYS 34 1HZ LYS 34 8.621 3.840 3.696
236 HZ2 LYS 34 2HZ LYS 34 8.204 2.396 4.471
237 HZ3 LYS 34 3HZ LYS 34 7.286 3.792 4.734
238 H GLN 35 H GLN 35 6.421 3.667 -2.266
239 HA GLN 35 HA GLN 35 7.685 5.337 -3.959
240 HB2 GLN 35 1HB GLN 35 7.734 2.972 -4.348
241 HB3 GLN 35 2HB GLN 35 6.006 2.932 -4.667
242 HG2 GLN 35 1HG GLN 35 6.995 2.778 -6.768
243 HG3 GLN 35 2HG GLN 35 6.499 4.465 -6.637
244 HE21 GLN 35 1HE2 GLN 35 7.942 5.849 -7.339
245 HE22 GLN 35 2HE2 GLN 35 9.657 5.642 -7.320
246 H GLN 36 H GLN 36 4.245 4.463 -4.309
247 HA GLN 36 HA GLN 36 3.588 6.015 -6.472
248 HB2 GLN 36 1HB GLN 36 2.033 5.196 -4.042
249 HB3 GLN 36 2HB GLN 36 1.297 6.238 -5.253
250 HG2 GLN 36 1HG GLN 36 1.924 4.477 -6.955
251 HG3 GLN 36 2HG GLN 36 2.302 3.430 -5.588
252 HE21 GLN 36 1HE2 GLN 36 0.655 2.608 -4.341
253 HE22 GLN 36 2HE2 GLN 36 -1.008 2.709 -4.798
254 H ILE 37 H ILE 37 3.848 7.013 -3.093
255 HA ILE 37 HA ILE 37 2.916 9.667 -3.513
256 HB ILE 37 HB ILE 37 4.627 8.557 -1.286
257 HG12 ILE 37 1HG1 ILE 37 1.718 9.235 -1.055
258 HG13 ILE 37 2HG1 ILE 37 2.191 7.701 -1.777
259 HG21 ILE 37 1HG2 ILE 37 3.132 10.753 -0.393
260 HG22 ILE 37 2HG2 ILE 37 4.879 10.656 -0.611
261 HG23 ILE 37 3HG2 ILE 37 3.859 11.248 -1.922
262 HD11 ILE 37 1HD1 ILE 37 1.935 7.078 0.397
263 HD12 ILE 37 2HD1 ILE 37 3.646 7.508 0.402
264 HD13 ILE 37 3HD1 ILE 37 2.449 8.644 1.024
265 H GLU 38 H GLU 38 6.010 8.104 -3.818
266 HA GLU 38 HA GLU 38 7.598 10.467 -3.780
267 HB2 GLU 38 1HB GLU 38 8.709 8.423 -3.310
268 HB3 GLU 38 2HB GLU 38 8.093 7.665 -4.772
269 HG2 GLU 38 1HG GLU 38 9.897 10.044 -4.924
270 HG3 GLU 38 2HG GLU 38 10.548 8.422 -4.698
271 H ASP 39 H ASP 39 6.427 8.390 -6.425
272 HA ASP 39 HA ASP 39 7.398 10.126 -8.473
273 HB2 ASP 39 1HB ASP 39 5.749 7.652 -8.361
274 HB3 ASP 39 2HB ASP 39 5.611 8.650 -9.805
275 H GLN 40 H GLN 40 4.532 9.992 -6.564
276 HA GLN 40 HA GLN 40 2.912 11.542 -8.371
277 HB2 GLN 40 1HB GLN 40 2.576 10.516 -5.574
278 HB3 GLN 40 2HB GLN 40 1.471 11.730 -6.204
279 HG2 GLN 40 1HG GLN 40 1.993 9.215 -7.731
280 HG3 GLN 40 2HG GLN 40 0.849 9.236 -6.390
281 HE21 GLN 40 1HE2 GLN 40 -1.091 9.155 -7.292
282 HE22 GLN 40 2HE2 GLN 40 -1.665 10.205 -8.539
283 H GLN 41 H GLN 41 4.079 12.206 -5.063
284 HA GLN 41 HA GLN 41 3.742 15.042 -5.451
285 HB2 GLN 41 1HB GLN 41 4.978 13.532 -3.141
286 HB3 GLN 41 2HB GLN 41 4.545 15.237 -3.142
287 HG2 GLN 41 1HG GLN 41 2.179 14.564 -3.530
288 HG3 GLN 41 2HG GLN 41 2.678 12.886 -3.319
289 HE21 GLN 41 1HE2 GLN 41 2.094 15.922 -1.767
290 HE22 GLN 41 2HE2 GLN 41 2.191 15.348 -0.141
291 H GLY 42 H GLY 42 6.471 12.808 -5.040
292 HA2 GLY 42 1HA GLY 42 8.414 13.272 -6.506
293 HA3 GLY 42 2HA GLY 42 8.235 14.958 -6.042
294 H LEU 43 H LEU 43 7.541 13.738 -3.250
295 HA LEU 43 HA LEU 43 10.137 14.133 -2.152
296 HB2 LEU 43 1HB LEU 43 7.724 14.454 -1.140
297 HB3 LEU 43 2HB LEU 43 7.974 12.793 -0.604
298 HG LEU 43 HG LEU 43 10.083 14.800 0.016
299 HD11 LEU 43 1HD1 LEU 43 7.578 14.557 1.667
300 HD12 LEU 43 2HD1 LEU 43 7.878 15.875 0.535
301 HD13 LEU 43 3HD1 LEU 43 8.943 15.644 1.921
302 HD21 LEU 43 1HD2 LEU 43 8.922 12.370 1.362
303 HD22 LEU 43 2HD2 LEU 43 10.103 13.433 2.128
304 HD23 LEU 43 3HD2 LEU 43 10.527 12.557 0.656
305 HA PRO 44 HA PRO 44 11.725 10.030 -2.525
306 HB2 PRO 44 1HB PRO 44 13.749 10.251 -0.730
307 HB3 PRO 44 2HB PRO 44 13.803 10.991 -2.335
308 HG2 PRO 44 1HG PRO 44 13.130 12.236 0.303
309 HG3 PRO 44 2HG PRO 44 14.138 12.872 -1.010
310 HD2 PRO 44 1HD PRO 44 11.576 13.660 -0.628
311 HD3 PRO 44 2HD PRO 44 12.318 13.571 -2.239
312 H LYS 45 H LYS 45 11.534 8.082 -1.503
313 HA LYS 45 HA LYS 45 9.754 7.806 0.633
314 HB2 LYS 45 1HB LYS 45 11.831 5.773 -0.188
315 HB3 LYS 45 2HB LYS 45 10.289 5.464 0.600
316 HG2 LYS 45 1HG LYS 45 9.124 6.263 -1.414
317 HG3 LYS 45 2HG LYS 45 10.686 6.494 -2.202
318 HD2 LYS 45 1HD LYS 45 9.837 3.844 -1.062
319 HD3 LYS 45 2HD LYS 45 9.444 4.330 -2.713
320 HE2 LYS 45 1HE LYS 45 11.968 4.799 -2.938
321 HE3 LYS 45 2HE LYS 45 12.131 3.815 -1.485
322 HZ1 LYS 45 1HZ LYS 45 10.663 2.833 -3.854
323 HZ2 LYS 45 2HZ LYS 45 11.320 1.941 -2.577
324 HZ3 LYS 45 3HZ LYS 45 12.341 2.655 -3.721
325 H LYS 46 H LYS 46 13.289 7.335 0.606
326 HA LYS 46 HA LYS 46 13.774 6.699 3.201
327 HB2 LYS 46 1HB LYS 46 15.928 8.004 2.963
328 HB3 LYS 46 2HB LYS 46 15.611 6.822 1.700
329 HG2 LYS 46 1HG LYS 46 14.694 9.595 1.218
330 HG3 LYS 46 2HG LYS 46 16.433 9.292 1.181
331 HD2 LYS 46 1HD LYS 46 15.647 7.247 -0.327
332 HD3 LYS 46 2HD LYS 46 14.291 8.333 -0.639
333 HE2 LYS 46 1HE LYS 46 15.934 8.721 -2.324
334 HE3 LYS 46 2HE LYS 46 15.952 10.104 -1.231
335 HZ1 LYS 46 1HZ LYS 46 18.138 8.786 -1.996
336 HZ2 LYS 46 2HZ LYS 46 17.787 7.963 -0.561
337 HZ3 LYS 46 3HZ LYS 46 18.022 9.638 -0.538
338 H GLN 47 H GLN 47 12.520 9.679 2.023
339 HA GLN 47 HA GLN 47 13.020 11.032 4.570
340 HB2 GLN 47 1HB GLN 47 11.978 12.025 1.916
341 HB3 GLN 47 2HB GLN 47 12.031 13.021 3.365
342 HG2 GLN 47 1HG GLN 47 14.412 11.739 2.044
343 HG3 GLN 47 2HG GLN 47 13.932 13.427 1.880
344 HE21 GLN 47 1HE2 GLN 47 15.949 11.381 3.458
345 HE22 GLN 47 2HE2 GLN 47 16.292 12.330 4.860
346 H GLN 48 H GLN 48 10.300 10.368 2.364
347 HA GLN 48 HA GLN 48 8.266 11.250 4.069
348 HB2 GLN 48 1HB GLN 48 6.803 10.435 2.508
349 HB3 GLN 48 2HB GLN 48 8.268 10.479 1.536
350 HG2 GLN 48 1HG GLN 48 8.606 8.055 2.241
351 HG3 GLN 48 2HG GLN 48 6.935 8.111 2.799
352 HE21 GLN 48 1HE2 GLN 48 8.712 9.252 -0.058
353 HE22 GLN 48 2HE2 GLN 48 7.622 8.576 -1.215
354 H GLN 49 H GLN 49 7.554 10.481 5.936
355 HA GLN 49 HA GLN 49 7.872 7.607 6.491
356 HB2 GLN 49 1HB GLN 49 9.524 8.859 7.778
357 HB3 GLN 49 2HB GLN 49 8.260 9.898 8.424
358 HG2 GLN 49 1HG GLN 49 7.360 8.175 9.734
359 HG3 GLN 49 2HG GLN 49 8.251 6.932 8.858
360 HE21 GLN 49 1HE2 GLN 49 8.493 9.529 11.182
361 HE22 GLN 49 2HE2 GLN 49 9.996 9.031 11.873
362 H LEU 50 H LEU 50 5.978 6.647 6.752
363 HA LEU 50 HA LEU 50 3.642 8.254 7.472
364 HB2 LEU 50 1HB LEU 50 3.806 5.405 6.500
365 HB3 LEU 50 2HB LEU 50 2.330 6.340 6.732
366 HG LEU 50 HG LEU 50 4.475 7.053 4.737
367 HD11 LEU 50 1HD1 LEU 50 2.367 6.248 3.254
368 HD12 LEU 50 2HD1 LEU 50 2.260 5.124 4.608
369 HD13 LEU 50 3HD1 LEU 50 3.743 5.221 3.659
370 HD21 LEU 50 1HD2 LEU 50 2.828 8.797 5.672
371 HD22 LEU 50 2HD2 LEU 50 1.610 7.934 4.732
372 HD23 LEU 50 3HD2 LEU 50 3.001 8.658 3.922
373 H GLU 51 H GLU 51 2.538 8.019 9.335
374 HA GLU 51 HA GLU 51 3.427 5.899 11.180
375 HB2 GLU 51 1HB GLU 51 3.006 8.816 11.613
376 HB3 GLU 51 2HB GLU 51 2.579 7.724 12.923
377 HG2 GLU 51 1HG GLU 51 4.806 6.889 13.054
378 HG3 GLU 51 2HG GLU 51 5.271 7.745 11.585
379 H PHE 52 H PHE 52 1.881 4.850 12.389
380 HA PHE 52 HA PHE 52 -0.906 5.672 12.136
381 HB2 PHE 52 1HB PHE 52 -0.288 4.061 10.248
382 HB3 PHE 52 2HB PHE 52 -0.119 2.832 11.497
383 HD1 PHE 52 2HD PHE 52 -2.552 5.343 10.218
384 HD2 PHE 52 1HD PHE 52 -1.953 1.573 12.100
385 HE1 PHE 52 2HE PHE 52 -4.971 4.910 10.111
386 HE2 PHE 52 1HE PHE 52 -4.372 1.133 11.995
387 HZ PHE 52 HZ PHE 52 -5.884 2.803 11.001
388 H GLN 53 H GLN 53 -2.086 5.243 13.919
389 HA GLN 53 HA GLN 53 -2.453 4.799 16.130
390 HB2 GLN 53 1HB GLN 53 -1.461 2.177 15.038
391 HB3 GLN 53 2HB GLN 53 -1.979 2.335 16.711
392 HG2 GLN 53 1HG GLN 53 -4.150 3.292 15.738
393 HG3 GLN 53 2HG GLN 53 -3.600 2.604 14.211
394 HE21 GLN 53 1HE2 GLN 53 -5.437 1.239 14.247
395 HE22 GLN 53 2HE2 GLN 53 -5.470 -0.176 15.236
396 H GLY 54 H GLY 54 0.204 5.890 15.410
397 HA2 GLY 54 1HA GLY 54 2.067 6.529 16.603
398 HA3 GLY 54 2HA GLY 54 1.408 5.664 17.983
399 H GLN 55 H GLN 55 2.034 4.170 14.874
400 HA GLN 55 HA GLN 55 4.410 2.852 15.983
401 HB2 GLN 55 1HB GLN 55 3.642 0.718 15.640
402 HB3 GLN 55 2HB GLN 55 2.134 1.517 16.067
403 HG2 GLN 55 1HG GLN 55 1.799 1.850 13.563
404 HG3 GLN 55 2HG GLN 55 3.102 0.680 13.358
405 HE21 GLN 55 1HE2 GLN 55 -0.156 1.033 13.519
406 HE22 GLN 55 2HE2 GLN 55 -0.603 -0.578 13.956
407 H VAL 56 H VAL 56 6.066 3.078 14.647
408 HA VAL 56 HA VAL 56 5.831 4.166 12.054
409 HB VAL 56 HB VAL 56 8.191 2.700 13.242
410 HG11 VAL 56 1HG1 VAL 56 9.379 3.239 11.427
411 HG12 VAL 56 2HG1 VAL 56 7.821 3.507 10.642
412 HG13 VAL 56 3HG1 VAL 56 8.696 4.863 11.355
413 HG21 VAL 56 1HG2 VAL 56 7.003 5.253 13.868
414 HG22 VAL 56 2HG2 VAL 56 8.326 4.404 14.667
415 HG23 VAL 56 3HG2 VAL 56 8.656 5.448 13.285
416 H LEU 57 H LEU 57 4.964 3.131 10.381
417 HA LEU 57 HA LEU 57 4.727 0.332 10.161
418 HB2 LEU 57 1HB LEU 57 4.656 2.241 7.843
419 HB3 LEU 57 2HB LEU 57 3.802 0.709 8.024
420 HG LEU 57 HG LEU 57 3.215 3.196 9.629
421 HD11 LEU 57 1HD1 LEU 57 2.363 3.897 7.664
422 HD12 LEU 57 2HD1 LEU 57 1.036 2.822 8.102
423 HD13 LEU 57 3HD1 LEU 57 2.286 2.270 6.988
424 HD21 LEU 57 1HD2 LEU 57 2.514 1.346 10.885
425 HD22 LEU 57 2HD2 LEU 57 1.962 0.472 9.457
426 HD23 LEU 57 3HD2 LEU 57 1.066 1.879 10.032
427 H GLN 58 H GLN 58 5.707 -1.097 8.630
428 HA GLN 58 HA GLN 58 8.479 -0.341 7.995
429 HB2 GLN 58 1HB GLN 58 7.218 -2.986 8.679
430 HB3 GLN 58 2HB GLN 58 8.785 -2.893 7.886
431 HG2 GLN 58 1HG GLN 58 8.080 -1.695 10.556
432 HG3 GLN 58 2HG GLN 58 9.021 -3.161 10.288
433 HE21 GLN 58 1HE2 GLN 58 10.143 -1.268 11.784
434 HE22 GLN 58 2HE2 GLN 58 11.401 -0.453 10.925
435 H ASP 59 H ASP 59 9.245 -2.127 6.191
436 HA ASP 59 HA ASP 59 7.535 -1.520 3.886
437 HB2 ASP 59 1HB ASP 59 9.582 -2.109 2.550
438 HB3 ASP 59 2HB ASP 59 9.777 -0.716 3.611
439 H TRP 60 H TRP 60 8.969 -4.155 5.675
440 HA TRP 60 HA TRP 60 8.026 -6.122 3.742
441 HB2 TRP 60 1HB TRP 60 9.316 -7.715 4.899
442 HB3 TRP 60 2HB TRP 60 10.281 -6.243 4.963
443 HD1 TRP 60 HD TRP 60 8.376 -8.671 7.178
444 HE1 TRP 60 1HE TRP 60 8.876 -8.127 9.644
445 HE3 TRP 60 3HE TRP 60 10.881 -4.260 6.544
446 HZ2 TRP 60 2HZ TRP 60 10.161 -6.096 11.124
447 HZ3 TRP 60 3HZ TRP 60 11.713 -3.079 8.536
448 HH2 TRP 60 HH TRP 60 11.359 -3.979 10.777
449 H LEU 61 H LEU 61 6.549 -4.383 5.998
450 HA LEU 61 HA LEU 61 4.990 -6.587 7.142
451 HB2 LEU 61 1HB LEU 61 5.491 -3.758 7.907
452 HB3 LEU 61 2HB LEU 61 3.958 -4.488 8.381
453 HG LEU 61 HG LEU 61 5.064 -6.125 9.717
454 HD11 LEU 61 1HD1 LEU 61 7.703 -5.013 8.786
455 HD12 LEU 61 2HD1 LEU 61 6.963 -6.476 8.138
456 HD13 LEU 61 3HD1 LEU 61 7.431 -6.403 9.837
457 HD21 LEU 61 1HD2 LEU 61 4.972 -4.441 11.194
458 HD22 LEU 61 2HD2 LEU 61 5.665 -3.277 10.064
459 HD23 LEU 61 3HD2 LEU 61 6.719 -4.364 10.969
460 H GLY 62 H GLY 62 3.723 -7.133 5.357
461 HA2 GLY 62 1HA GLY 62 2.412 -5.631 3.540
462 HA3 GLY 62 2HA GLY 62 1.680 -7.052 4.269
463 H LEU 63 H LEU 63 0.350 -4.664 3.337
464 HA LEU 63 HA LEU 63 -0.338 -2.812 5.246
465 HB2 LEU 63 1HB LEU 63 -1.746 -4.023 2.933
466 HB3 LEU 63 2HB LEU 63 -2.709 -3.080 4.068
467 HG LEU 63 HG LEU 63 -0.840 -1.276 3.655
468 HD11 LEU 63 1HD1 LEU 63 0.678 -2.418 2.299
469 HD12 LEU 63 2HD1 LEU 63 -0.231 -1.410 1.174
470 HD13 LEU 63 3HD1 LEU 63 -0.597 -3.129 1.310
471 HD21 LEU 63 1HD2 LEU 63 -3.062 -1.930 1.724
472 HD22 LEU 63 2HD2 LEU 63 -2.205 -0.390 1.783
473 HD23 LEU 63 3HD2 LEU 63 -3.168 -0.917 3.164
474 H GLY 64 H GLY 64 -1.937 -5.948 4.669
475 HA2 GLY 64 1HA GLY 64 -3.815 -5.777 6.733
476 HA3 GLY 64 2HA GLY 64 -3.199 -7.275 6.052
477 H ILE 65 H ILE 65 -0.494 -7.003 6.784
478 HA ILE 65 HA ILE 65 -0.257 -8.274 9.130
479 HB ILE 65 HB ILE 65 1.611 -6.072 8.244
480 HG12 ILE 65 1HG1 ILE 65 1.282 -7.719 6.483
481 HG13 ILE 65 2HG1 ILE 65 2.883 -7.916 7.186
482 HG21 ILE 65 1HG2 ILE 65 1.899 -8.310 10.225
483 HG22 ILE 65 2HG2 ILE 65 3.294 -7.539 9.473
484 HG23 ILE 65 3HG2 ILE 65 2.187 -6.586 10.460
485 HD11 ILE 65 1HD1 ILE 65 1.915 -9.756 8.594
486 HD12 ILE 65 2HD1 ILE 65 0.460 -9.637 7.604
487 HD13 ILE 65 3HD1 ILE 65 1.998 -10.078 6.862
488 H TYR 66 H TYR 66 -0.497 -4.753 8.796
489 HA TYR 66 HA TYR 66 -0.431 -4.356 11.657
490 HB2 TYR 66 1HB TYR 66 -0.627 -2.569 9.265
491 HB3 TYR 66 2HB TYR 66 -1.087 -1.943 10.844
492 HD1 TYR 66 2HD TYR 66 0.841 -3.070 12.663
493 HD2 TYR 66 1HD TYR 66 1.421 -1.665 8.689
494 HE1 TYR 66 2HE TYR 66 3.203 -2.614 13.175
495 HE2 TYR 66 1HE TYR 66 3.785 -1.206 9.190
496 HH TYR 66 HH TYR 66 5.022 -0.850 12.056
497 H GLY 67 H GLY 67 -2.830 -4.125 9.054
498 HA2 GLY 67 1HA GLY 67 -5.082 -4.944 9.540
499 HA3 GLY 67 2HA GLY 67 -4.928 -4.213 11.131
500 H ILE 68 H ILE 68 -3.916 -2.677 8.140
501 HA ILE 68 HA ILE 68 -5.403 -0.323 8.724
502 HB ILE 68 HB ILE 68 -3.959 -1.164 6.210
503 HG12 ILE 68 1HG1 ILE 68 -3.170 0.876 8.294
504 HG13 ILE 68 2HG1 ILE 68 -2.622 -0.797 8.322
505 HG21 ILE 68 1HG2 ILE 68 -5.068 0.484 5.200
506 HG22 ILE 68 2HG2 ILE 68 -5.742 1.066 6.721
507 HG23 ILE 68 3HG2 ILE 68 -4.139 1.592 6.209
508 HD11 ILE 68 1HD1 ILE 68 -1.782 -0.310 5.932
509 HD12 ILE 68 2HD1 ILE 68 -1.936 1.383 6.404
510 HD13 ILE 68 3HD1 ILE 68 -0.871 0.307 7.310
511 H GLN 69 H GLN 69 -7.333 0.379 7.983
512 HA GLN 69 HA GLN 69 -8.880 -1.499 6.334
513 HB2 GLN 69 1HB GLN 69 -10.870 -0.548 7.308
514 HB3 GLN 69 2HB GLN 69 -9.761 -0.986 8.600
515 HG2 GLN 69 1HG GLN 69 -9.006 1.462 8.512
516 HG3 GLN 69 2HG GLN 69 -10.482 1.736 7.588
517 HE21 GLN 69 1HE2 GLN 69 -9.166 1.732 10.610
518 HE22 GLN 69 2HE2 GLN 69 -10.610 1.601 11.549
519 H ASP 70 H ASP 70 -10.339 -0.630 4.736
520 HA ASP 70 HA ASP 70 -9.136 1.217 3.012
521 HB2 ASP 70 1HB ASP 70 -10.591 -0.184 1.899
522 HB3 ASP 70 2HB ASP 70 -11.816 -0.088 3.160
523 H SER 71 H SER 71 -9.806 3.324 2.366
524 HA SER 71 HA SER 71 -10.350 5.499 2.749
525 HB2 SER 71 1HB SER 71 -12.567 4.210 4.356
526 HB3 SER 71 2HB SER 71 -12.487 5.931 3.979
527 HG SER 71 HG SER 71 -12.212 4.916 1.687
528 H ASP 72 H ASP 72 -8.347 4.363 4.372
529 HA ASP 72 HA ASP 72 -8.793 5.436 7.050
530 HB2 ASP 72 1HB ASP 72 -6.605 4.417 7.580
531 HB3 ASP 72 2HB ASP 72 -7.733 3.247 6.901
532 H THR 73 H THR 73 -7.060 6.773 8.033
533 HA THR 73 HA THR 73 -6.055 8.727 6.071
534 HB THR 73 HB THR 73 -6.728 9.151 8.989
535 HG1 THR 73 1HG THR 73 -8.014 9.959 6.577
536 HG21 THR 73 1HG2 THR 73 -4.897 10.547 7.472
537 HG22 THR 73 2HG2 THR 73 -5.723 11.153 8.907
538 HG23 THR 73 3HG2 THR 73 -6.369 11.503 7.304
539 H LEU 74 H LEU 74 -3.927 8.961 5.863
540 HA LEU 74 HA LEU 74 -2.192 7.884 7.988
541 HB2 LEU 74 1HB LEU 74 -1.687 8.022 5.019
542 HB3 LEU 74 2HB LEU 74 -0.527 7.460 6.221
543 HG LEU 74 HG LEU 74 -3.188 6.129 5.753
544 HD11 LEU 74 1HD1 LEU 74 -1.002 4.592 4.777
545 HD12 LEU 74 2HD1 LEU 74 -0.963 6.180 4.011
546 HD13 LEU 74 3HD1 LEU 74 -2.415 5.186 3.905
547 HD21 LEU 74 1HD2 LEU 74 -0.687 5.410 7.257
548 HD22 LEU 74 2HD2 LEU 74 -1.895 4.209 6.797
549 HD23 LEU 74 3HD2 LEU 74 -2.337 5.540 7.867
550 H ILE 75 H ILE 75 -0.746 9.218 8.883
551 HA ILE 75 HA ILE 75 -0.651 11.972 7.951
552 HB ILE 75 HB ILE 75 0.655 10.761 10.389
553 HG12 ILE 75 1HG1 ILE 75 -1.740 10.478 10.561
554 HG13 ILE 75 2HG1 ILE 75 -1.251 11.794 11.622
555 HG21 ILE 75 1HG2 ILE 75 1.085 13.210 9.177
556 HG22 ILE 75 2HG2 ILE 75 -0.040 13.573 10.485
557 HG23 ILE 75 3HG2 ILE 75 1.493 12.776 10.836
558 HD11 ILE 75 1HD1 ILE 75 -1.926 13.373 9.791
559 HD12 ILE 75 2HD1 ILE 75 -2.634 11.984 8.966
560 HD13 ILE 75 3HD1 ILE 75 -3.238 12.472 10.549
561 H LEU 76 H LEU 76 1.061 12.934 7.015
562 HA LEU 76 HA LEU 76 3.468 11.290 6.598
563 HB2 LEU 76 1HB LEU 76 2.319 11.718 4.532
564 HB3 LEU 76 2HB LEU 76 2.244 13.444 4.884
565 HG LEU 76 HG LEU 76 4.769 13.451 4.755
566 HD11 LEU 76 1HD1 LEU 76 5.920 11.588 4.382
567 HD12 LEU 76 2HD1 LEU 76 4.881 11.137 3.031
568 HD13 LEU 76 3HD1 LEU 76 4.428 10.695 4.677
569 HD21 LEU 76 1HD2 LEU 76 3.091 14.126 2.938
570 HD22 LEU 76 2HD2 LEU 76 3.509 12.593 2.171
571 HD23 LEU 76 3HD2 LEU 76 4.756 13.810 2.448
572 H SER 77 H SER 77 5.393 12.042 7.249
573 HA SER 77 HA SER 77 5.715 14.886 7.837
574 HB2 SER 77 1HB SER 77 6.017 12.656 9.844
575 HB3 SER 77 2HB SER 77 6.857 14.195 10.037
576 HG SER 77 HG SER 77 4.122 14.273 9.499
577 H LYS 78 H LYS 78 7.623 15.616 7.160
578 HA LYS 78 HA LYS 78 9.486 13.873 5.900
579 HB2 LYS 78 1HB LYS 78 9.968 16.756 6.647
580 HB3 LYS 78 2HB LYS 78 10.717 15.842 5.344
581 HG2 LYS 78 1HG LYS 78 8.699 15.820 4.089
582 HG3 LYS 78 2HG LYS 78 7.777 16.465 5.449
583 HD2 LYS 78 1HD LYS 78 8.178 18.240 3.878
584 HD3 LYS 78 2HD LYS 78 9.150 18.535 5.322
585 HE2 LYS 78 1HE LYS 78 11.041 17.356 4.077
586 HE3 LYS 78 2HE LYS 78 10.045 17.535 2.633
587 HZ1 LYS 78 1HZ LYS 78 11.735 19.333 3.057
588 HZ2 LYS 78 2HZ LYS 78 10.770 19.833 4.353
589 HZ3 LYS 78 3HZ LYS 78 10.153 19.862 2.778
590 H LYS 79 H LYS 79 11.709 13.566 6.438
591 HA LYS 79 HA LYS 79 12.122 13.083 9.232
592 HB2 LYS 79 1HB LYS 79 14.007 12.825 6.882
593 HB3 LYS 79 2HB LYS 79 14.345 12.253 8.510
594 HG2 LYS 79 1HG LYS 79 11.864 11.298 7.196
595 HG3 LYS 79 2HG LYS 79 13.407 10.657 6.627
596 HD2 LYS 79 1HD LYS 79 13.948 10.099 9.011
597 HD3 LYS 79 2HD LYS 79 12.292 10.547 9.426
598 HE2 LYS 79 1HE LYS 79 11.993 8.311 9.115
599 HE3 LYS 79 2HE LYS 79 11.743 8.857 7.458
600 HZ1 LYS 79 1HZ LYS 79 13.442 6.930 8.124
601 HZ2 LYS 79 2HZ LYS 79 14.487 8.258 8.198
602 HZ3 LYS 79 3HZ LYS 79 13.652 7.919 6.767
603 H LYS 80 H LYS 80 12.708 14.597 10.628
604 HA LYS 80 HA LYS 80 13.426 17.172 10.187
605 HB2 LYS 80 1HB LYS 80 14.336 15.326 12.393
606 HB3 LYS 80 2HB LYS 80 14.655 17.055 12.403
607 HG2 LYS 80 1HG LYS 80 12.460 17.599 12.773
608 HG3 LYS 80 2HG LYS 80 11.855 16.113 12.040
609 HD2 LYS 80 1HD LYS 80 13.463 15.985 14.558
610 HD3 LYS 80 2HD LYS 80 11.754 16.423 14.627
611 HE2 LYS 80 1HE LYS 80 12.704 13.974 13.172
612 HE3 LYS 80 2HE LYS 80 12.373 13.952 14.904
613 HZ1 LYS 80 1HZ LYS 80 10.115 14.820 14.344
614 HZ2 LYS 80 2HZ LYS 80 10.419 13.247 13.802
615 HZ3 LYS 80 3HZ LYS 80 10.465 14.540 12.712
616 H GLY 81 H GLY 81 15.289 18.357 9.860
617 HA2 GLY 81 1HA GLY 81 17.445 18.802 9.195
618 HA3 GLY 81 2HA GLY 81 17.899 17.241 9.862
619 H SER 82 H SER 82 18.990 18.332 7.506
620 HA SER 82 HA SER 82 17.717 17.188 5.211
621 HB2 SER 82 1HB SER 82 19.836 17.814 4.046
622 HB3 SER 82 2HB SER 82 19.104 19.154 4.928
623 HG SER 82 HG SER 82 21.263 17.535 5.813
624 H GLY 83 H GLY 83 18.007 15.239 4.291
625 HA2 GLY 83 1HA GLY 83 19.281 13.171 5.776
626 HA3 GLY 83 2HA GLY 83 18.571 13.011 4.177
627 HA PRO 84 HA PRO 84 23.382 13.259 4.205
628 HB2 PRO 84 1HB PRO 84 24.040 10.642 4.506
629 HB3 PRO 84 2HB PRO 84 23.899 11.760 5.868
630 HG2 PRO 84 1HG PRO 84 21.925 9.752 4.852
631 HG3 PRO 84 2HG PRO 84 22.380 10.126 6.524
632 HD2 PRO 84 1HD PRO 84 20.117 11.078 5.383
633 HD3 PRO 84 2HD PRO 84 21.022 11.986 6.611
634 H SER 85 H SER 85 24.405 13.034 2.283
635 HA SER 85 HA SER 85 23.177 11.242 0.290
636 HB2 SER 85 1HB SER 85 22.722 13.663 -0.138
637 HB3 SER 85 2HB SER 85 24.461 13.925 -0.274
638 HG SER 85 HG SER 85 23.274 11.927 -1.835
639 H SER 86 H SER 86 24.509 9.982 -0.907
640 HA SER 86 HA SER 86 27.163 9.559 0.025
641 HB2 SER 86 1HB SER 86 25.694 7.760 -0.894
642 HB3 SER 86 2HB SER 86 25.881 8.476 -2.495
643 HG SER 86 HG SER 86 27.420 6.914 -2.348
644 H GLY 87 H GLY 87 29.015 9.368 -1.614
645 HA2 GLY 87 1HA GLY 87 28.948 11.570 -3.562
646 HA3 GLY 87 2HA GLY 87 30.208 11.545 -2.338
Start of MODEL 18
1 H1 GLY 1 H GLY 1 -13.943 4.860 -17.968
2 HA2 GLY 1 1HA GLY 1 -14.320 2.605 -17.759
3 HA3 GLY 1 2HA GLY 1 -12.740 2.414 -18.506
4 H SER 2 H SER 2 -11.406 1.195 -17.368
5 HA SER 2 HA SER 2 -10.583 -0.028 -15.611
6 HB2 SER 2 1HB SER 2 -9.706 1.389 -13.774
7 HB3 SER 2 2HB SER 2 -9.344 2.058 -15.365
8 HG SER 2 HG SER 2 -10.135 3.644 -13.907
9 H SER 3 H SER 3 -13.339 -0.278 -15.737
10 HA SER 3 HA SER 3 -14.766 0.311 -13.422
11 HB2 SER 3 1HB SER 3 -15.762 -0.570 -15.527
12 HB3 SER 3 2HB SER 3 -15.082 -2.154 -15.152
13 HG SER 3 HG SER 3 -16.958 -0.713 -13.580
14 H GLY 4 H GLY 4 -15.195 -0.820 -11.524
15 HA2 GLY 4 1HA GLY 4 -14.925 -2.517 -9.931
16 HA3 GLY 4 2HA GLY 4 -13.731 -3.275 -10.974
17 H SER 5 H SER 5 -14.142 -1.703 -8.115
18 HA SER 5 HA SER 5 -11.937 0.025 -7.958
19 HB2 SER 5 1HB SER 5 -13.575 -1.464 -5.936
20 HB3 SER 5 2HB SER 5 -12.113 -0.624 -5.421
21 HG SER 5 HG SER 5 -14.346 0.495 -5.551
22 H SER 6 H SER 6 -9.846 -0.255 -7.174
23 HA SER 6 HA SER 6 -8.887 -3.043 -7.175
24 HB2 SER 6 1HB SER 6 -8.143 -1.540 -9.094
25 HB3 SER 6 2HB SER 6 -7.222 -0.629 -7.897
26 HG SER 6 HG SER 6 -5.982 -2.276 -8.929
27 H GLY 7 H GLY 7 -7.792 -3.753 -5.444
28 HA2 GLY 7 1HA GLY 7 -7.012 -3.779 -3.279
29 HA3 GLY 7 2HA GLY 7 -6.079 -2.380 -3.790
30 H ILE 8 H ILE 8 -6.272 -1.589 -1.622
31 HA ILE 8 HA ILE 8 -8.954 -0.635 -0.895
32 HB ILE 8 HB ILE 8 -8.116 -0.315 1.354
33 HG12 ILE 8 1HG1 ILE 8 -5.484 -1.544 0.616
34 HG13 ILE 8 2HG1 ILE 8 -5.724 0.186 0.399
35 HG21 ILE 8 1HG2 ILE 8 -8.027 -2.887 -0.015
36 HG22 ILE 8 2HG2 ILE 8 -7.099 -2.860 1.483
37 HG23 ILE 8 3HG2 ILE 8 -8.810 -2.434 1.499
38 HD11 ILE 8 1HD1 ILE 8 -6.469 0.190 2.846
39 HD12 ILE 8 2HD1 ILE 8 -5.720 -1.405 2.930
40 HD13 ILE 8 3HD1 ILE 8 -4.751 0.003 2.496
41 H GLN 9 H GLN 9 -9.305 1.527 -0.323
42 HA GLN 9 HA GLN 9 -7.458 3.393 -1.595
43 HB2 GLN 9 1HB GLN 9 -10.016 3.333 -1.966
44 HB3 GLN 9 2HB GLN 9 -10.117 4.124 -0.399
45 HG2 GLN 9 1HG GLN 9 -9.018 6.041 -1.166
46 HG3 GLN 9 2HG GLN 9 -8.419 5.223 -2.609
47 HE21 GLN 9 1HE2 GLN 9 -9.279 6.511 -4.142
48 HE22 GLN 9 2HE2 GLN 9 -10.974 6.740 -4.384
49 H VAL 10 H VAL 10 -6.026 4.494 -0.448
50 HA VAL 10 HA VAL 10 -6.564 4.949 2.416
51 HB VAL 10 HB VAL 10 -4.102 5.024 2.730
52 HG11 VAL 10 1HG1 VAL 10 -5.593 2.612 1.880
53 HG12 VAL 10 2HG1 VAL 10 -3.844 2.455 2.059
54 HG13 VAL 10 3HG1 VAL 10 -4.827 2.988 3.423
55 HG21 VAL 10 1HG2 VAL 10 -4.125 5.009 -0.118
56 HG22 VAL 10 2HG2 VAL 10 -2.751 5.182 0.974
57 HG23 VAL 10 3HG2 VAL 10 -3.261 3.578 0.446
58 H PHE 11 H PHE 11 -6.131 6.957 3.285
59 HA PHE 11 HA PHE 11 -5.759 9.105 1.316
60 HB2 PHE 11 1HB PHE 11 -7.055 9.054 4.040
61 HB3 PHE 11 2HB PHE 11 -6.684 10.556 3.199
62 HD1 PHE 11 1HD PHE 11 -7.861 11.154 1.144
63 HD2 PHE 11 2HD PHE 11 -8.858 7.648 3.341
64 HE1 PHE 11 1HE PHE 11 -9.990 10.997 -0.079
65 HE2 PHE 11 2HE PHE 11 -10.988 7.485 2.121
66 HZ PHE 11 HZ PHE 11 -11.556 9.160 0.408
67 H VAL 12 H VAL 12 -3.706 9.734 1.172
68 HA VAL 12 HA VAL 12 -1.952 9.617 3.490
69 HB VAL 12 HB VAL 12 -1.354 10.435 0.643
70 HG11 VAL 12 1HG1 VAL 12 0.520 11.282 1.502
71 HG12 VAL 12 2HG1 VAL 12 0.186 10.601 3.095
72 HG13 VAL 12 3HG1 VAL 12 0.992 9.623 1.868
73 HG21 VAL 12 1HG2 VAL 12 -0.394 8.258 0.362
74 HG22 VAL 12 2HG2 VAL 12 -0.673 7.860 2.057
75 HG23 VAL 12 3HG2 VAL 12 -2.040 8.058 0.962
76 H LYS 13 H LYS 13 -1.961 11.269 4.859
77 HA LYS 13 HA LYS 13 -2.672 13.939 3.943
78 HB2 LYS 13 1HB LYS 13 -3.663 13.038 6.023
79 HB3 LYS 13 2HB LYS 13 -2.055 12.941 6.730
80 HG2 LYS 13 1HG LYS 13 -1.835 15.272 6.828
81 HG3 LYS 13 2HG LYS 13 -3.188 15.530 5.724
82 HD2 LYS 13 1HD LYS 13 -4.621 14.395 7.523
83 HD3 LYS 13 2HD LYS 13 -3.246 14.659 8.599
84 HE2 LYS 13 1HE LYS 13 -3.354 17.047 8.193
85 HE3 LYS 13 2HE LYS 13 -4.662 16.815 7.035
86 HZ1 LYS 13 1HZ LYS 13 -4.747 16.884 9.915
87 HZ2 LYS 13 2HZ LYS 13 -5.618 15.601 9.240
88 HZ3 LYS 13 3HZ LYS 13 -5.971 17.192 8.788
89 H ASN 14 H ASN 14 -0.953 14.773 2.845
90 HA ASN 14 HA ASN 14 1.749 14.455 3.524
91 HB2 ASN 14 1HB ASN 14 1.959 16.672 2.154
92 HB3 ASN 14 2HB ASN 14 1.428 15.200 1.347
93 HD21 ASN 14 1HD2 ASN 14 -0.503 15.165 0.380
94 HD22 ASN 14 2HD2 ASN 14 -1.653 16.454 0.425
95 HA PRO 15 HA PRO 15 2.453 17.192 6.883
96 HB2 PRO 15 1HB PRO 15 4.956 18.085 6.328
97 HB3 PRO 15 2HB PRO 15 4.624 16.441 6.887
98 HG2 PRO 15 1HG PRO 15 5.111 17.433 4.105
99 HG3 PRO 15 2HG PRO 15 5.737 15.976 4.899
100 HD2 PRO 15 1HD PRO 15 3.649 15.915 3.176
101 HD3 PRO 15 2HD PRO 15 3.788 14.796 4.548
102 H ASP 16 H ASP 16 2.673 18.378 3.625
103 HA ASP 16 HA ASP 16 3.050 21.126 4.228
104 HB2 ASP 16 1HB ASP 16 3.276 19.795 1.962
105 HB3 ASP 16 2HB ASP 16 1.586 20.253 1.770
106 H GLY 17 H GLY 17 0.125 19.369 3.168
107 HA2 GLY 17 1HA GLY 17 -1.702 20.161 4.973
108 HA3 GLY 17 2HA GLY 17 -1.548 21.597 3.972
109 H GLY 18 H GLY 18 -3.069 18.602 4.338
110 HA2 GLY 18 1HA GLY 18 -5.125 18.617 2.800
111 HA3 GLY 18 2HA GLY 18 -3.923 18.573 1.518
112 H SER 19 H SER 19 -5.142 16.598 0.938
113 HA SER 19 HA SER 19 -3.718 14.285 1.732
114 HB2 SER 19 1HB SER 19 -5.545 13.032 2.797
115 HB3 SER 19 2HB SER 19 -5.137 14.469 3.734
116 HG SER 19 HG SER 19 -7.298 14.554 3.597
117 H TYR 20 H TYR 20 -3.893 12.723 0.212
118 HA TYR 20 HA TYR 20 -6.011 13.052 -1.812
119 HB2 TYR 20 1HB TYR 20 -3.349 11.852 -2.485
120 HB3 TYR 20 2HB TYR 20 -4.508 12.650 -3.542
121 HD1 TYR 20 2HD TYR 20 -4.955 15.223 -2.742
122 HD2 TYR 20 1HD TYR 20 -1.384 12.991 -2.134
123 HE1 TYR 20 2HE TYR 20 -3.683 17.320 -2.559
124 HE2 TYR 20 1HE TYR 20 -0.102 15.082 -1.948
125 HH TYR 20 HH TYR 20 -1.121 17.961 -2.979
126 H ALA 21 H ALA 21 -6.557 11.072 -3.003
127 HA ALA 21 HA ALA 21 -6.533 8.762 -1.197
128 HB1 ALA 21 1HB ALA 21 -8.718 9.631 -1.950
129 HB2 ALA 21 2HB ALA 21 -8.270 9.250 -3.613
130 HB3 ALA 21 3HB ALA 21 -8.446 7.955 -2.429
131 H TYR 22 H TYR 22 -5.120 7.201 -1.586
132 HA TYR 22 HA TYR 22 -4.096 6.857 -4.318
133 HB2 TYR 22 1HB TYR 22 -2.957 6.191 -1.612
134 HB3 TYR 22 2HB TYR 22 -2.310 5.471 -3.082
135 HD1 TYR 22 2HD TYR 22 -3.095 8.794 -1.579
136 HD2 TYR 22 1HD TYR 22 -0.635 6.576 -4.250
137 HE1 TYR 22 2HE TYR 22 -1.688 10.782 -1.926
138 HE2 TYR 22 1HE TYR 22 0.779 8.557 -4.602
139 HH TYR 22 HH TYR 22 0.846 11.138 -2.653
140 H ALA 23 H ALA 23 -3.735 4.684 -5.105
141 HA ALA 23 HA ALA 23 -5.646 2.743 -3.973
142 HB1 ALA 23 1HB ALA 23 -6.031 1.913 -6.226
143 HB2 ALA 23 2HB ALA 23 -6.390 3.638 -6.130
144 HB3 ALA 23 3HB ALA 23 -4.887 3.090 -6.871
145 H ILE 24 H ILE 24 -4.673 1.047 -3.099
146 HA ILE 24 HA ILE 24 -2.569 -0.340 -4.502
147 HB ILE 24 HB ILE 24 -1.180 1.246 -3.360
148 HG12 ILE 24 1HG1 ILE 24 -1.051 -1.210 -1.625
149 HG13 ILE 24 2HG1 ILE 24 -0.636 -1.278 -3.334
150 HG21 ILE 24 1HG2 ILE 24 -3.073 1.635 -1.595
151 HG22 ILE 24 2HG2 ILE 24 -2.181 0.425 -0.674
152 HG23 ILE 24 3HG2 ILE 24 -1.385 1.918 -1.171
153 HD11 ILE 24 1HD1 ILE 24 1.006 -0.554 -1.180
154 HD12 ILE 24 2HD1 ILE 24 1.390 -0.518 -2.901
155 HD13 ILE 24 3HD1 ILE 24 0.726 0.914 -2.116
156 H ASN 25 H ASN 25 -2.577 -2.477 -4.053
157 HA ASN 25 HA ASN 25 -4.717 -3.582 -2.583
158 HB2 ASN 25 1HB ASN 25 -2.211 -4.804 -3.744
159 HB3 ASN 25 2HB ASN 25 -3.453 -5.760 -2.940
160 HD21 ASN 25 1HD2 ASN 25 -2.747 -3.704 -5.676
161 HD22 ASN 25 2HD2 ASN 25 -4.061 -4.239 -6.662
162 HA PRO 26 HA PRO 26 -3.153 -3.735 1.523
163 HB2 PRO 26 1HB PRO 26 -4.518 -5.887 2.458
164 HB3 PRO 26 2HB PRO 26 -5.281 -4.321 2.160
165 HG2 PRO 26 1HG PRO 26 -5.260 -6.775 0.445
166 HG3 PRO 26 2HG PRO 26 -6.605 -5.680 0.814
167 HD2 PRO 26 1HD PRO 26 -5.222 -5.556 -1.511
168 HD3 PRO 26 2HD PRO 26 -5.927 -4.120 -0.741
169 H ASN 27 H ASN 27 -2.882 -6.484 -0.600
170 HA ASN 27 HA ASN 27 -1.252 -8.073 1.124
171 HB2 ASN 27 1HB ASN 27 -1.582 -8.193 -1.882
172 HB3 ASN 27 2HB ASN 27 -0.836 -9.436 -0.882
173 HD21 ASN 27 1HD2 ASN 27 -3.232 -9.428 -2.647
174 HD22 ASN 27 2HD2 ASN 27 -4.515 -10.026 -1.656
175 H SER 28 H SER 28 -0.651 -5.624 -1.307
176 HA SER 28 HA SER 28 2.103 -6.072 -1.673
177 HB2 SER 28 1HB SER 28 0.473 -4.563 -3.017
178 HB3 SER 28 2HB SER 28 0.871 -3.331 -1.819
179 HG SER 28 HG SER 28 2.457 -2.995 -3.189
180 H PHE 29 H PHE 29 3.912 -4.978 -0.815
181 HA PHE 29 HA PHE 29 3.817 -4.586 1.993
182 HB2 PHE 29 1HB PHE 29 6.041 -3.809 0.098
183 HB3 PHE 29 2HB PHE 29 6.179 -4.087 1.831
184 HD1 PHE 29 2HD PHE 29 4.777 -6.550 2.283
185 HD2 PHE 29 1HD PHE 29 7.244 -5.428 -0.998
186 HE1 PHE 29 2HE PHE 29 5.287 -8.919 1.862
187 HE2 PHE 29 1HE PHE 29 7.759 -7.796 -1.425
188 HZ PHE 29 HZ PHE 29 6.781 -9.545 0.006
189 H ILE 30 H ILE 30 4.309 -2.676 3.183
190 HA ILE 30 HA ILE 30 2.834 -0.433 2.506
191 HB ILE 30 HB ILE 30 5.117 -0.789 4.430
192 HG12 ILE 30 1HG1 ILE 30 2.673 -1.719 4.689
193 HG13 ILE 30 2HG1 ILE 30 3.490 -0.983 6.064
194 HG21 ILE 30 1HG2 ILE 30 5.249 1.507 3.739
195 HG22 ILE 30 2HG2 ILE 30 3.508 1.709 3.931
196 HG23 ILE 30 3HG2 ILE 30 4.526 1.442 5.346
197 HD11 ILE 30 1HD1 ILE 30 1.512 0.393 4.262
198 HD12 ILE 30 2HD1 ILE 30 1.179 -0.241 5.874
199 HD13 ILE 30 3HD1 ILE 30 2.306 1.099 5.668
200 H LEU 31 H LEU 31 6.187 -1.194 1.815
201 HA LEU 31 HA LEU 31 7.154 1.297 1.082
202 HB2 LEU 31 1HB LEU 31 8.451 -0.834 1.259
203 HB3 LEU 31 2HB LEU 31 7.788 -1.301 -0.305
204 HG LEU 31 HG LEU 31 8.861 0.994 -1.055
205 HD11 LEU 31 1HD1 LEU 31 10.569 1.820 0.188
206 HD12 LEU 31 2HD1 LEU 31 10.952 0.257 0.909
207 HD13 LEU 31 3HD1 LEU 31 9.574 1.185 1.499
208 HD21 LEU 31 1HD2 LEU 31 10.821 -0.229 -1.771
209 HD22 LEU 31 2HD2 LEU 31 9.392 -1.251 -1.923
210 HD23 LEU 31 3HD2 LEU 31 10.507 -1.488 -0.576
211 H GLY 32 H GLY 32 5.407 -1.080 -0.899
212 HA2 GLY 32 1HA GLY 32 5.519 0.104 -3.371
213 HA3 GLY 32 2HA GLY 32 4.119 -0.780 -2.782
214 H LEU 33 H LEU 33 3.415 0.992 -0.676
215 HA LEU 33 HA LEU 33 1.818 2.833 -2.098
216 HB2 LEU 33 1HB LEU 33 1.056 1.990 -0.002
217 HB3 LEU 33 2HB LEU 33 2.495 2.586 0.824
218 HG LEU 33 HG LEU 33 1.732 4.896 0.438
219 HD11 LEU 33 1HD1 LEU 33 -0.874 3.732 -0.497
220 HD12 LEU 33 2HD1 LEU 33 0.382 4.258 -1.616
221 HD13 LEU 33 3HD1 LEU 33 -0.354 5.417 -0.509
222 HD21 LEU 33 1HD2 LEU 33 1.182 3.780 2.527
223 HD22 LEU 33 2HD2 LEU 33 -0.280 3.109 1.802
224 HD23 LEU 33 3HD2 LEU 33 -0.129 4.852 2.033
225 H LYS 34 H LYS 34 4.786 3.218 -0.208
226 HA LYS 34 HA LYS 34 4.935 6.026 -0.365
227 HB2 LYS 34 1HB LYS 34 7.198 4.034 -0.123
228 HB3 LYS 34 2HB LYS 34 7.292 5.750 0.249
229 HG2 LYS 34 1HG LYS 34 5.930 5.529 2.143
230 HG3 LYS 34 2HG LYS 34 5.365 3.930 1.652
231 HD2 LYS 34 1HD LYS 34 7.347 2.899 2.271
232 HD3 LYS 34 2HD LYS 34 8.274 4.398 2.172
233 HE2 LYS 34 1HE LYS 34 6.910 5.215 4.139
234 HE3 LYS 34 2HE LYS 34 6.317 3.563 4.301
235 HZ1 LYS 34 1HZ LYS 34 8.147 3.797 5.756
236 HZ2 LYS 34 2HZ LYS 34 9.114 4.509 4.566
237 HZ3 LYS 34 3HZ LYS 34 8.700 2.873 4.452
238 H GLN 35 H GLN 35 6.374 3.483 -2.386
239 HA GLN 35 HA GLN 35 7.902 4.987 -4.095
240 HB2 GLN 35 1HB GLN 35 7.357 2.403 -4.000
241 HB3 GLN 35 2HB GLN 35 6.211 2.822 -5.267
242 HG2 GLN 35 1HG GLN 35 9.178 3.325 -5.330
243 HG3 GLN 35 2HG GLN 35 8.319 2.052 -6.195
244 HE21 GLN 35 1HE2 GLN 35 9.853 4.744 -6.767
245 HE22 GLN 35 2HE2 GLN 35 8.906 5.429 -8.039
246 H GLN 36 H GLN 36 4.411 4.453 -4.220
247 HA GLN 36 HA GLN 36 3.998 5.807 -6.679
248 HB2 GLN 36 1HB GLN 36 2.226 4.917 -4.435
249 HB3 GLN 36 2HB GLN 36 1.584 5.982 -5.678
250 HG2 GLN 36 1HG GLN 36 2.536 4.231 -7.327
251 HG3 GLN 36 2HG GLN 36 2.554 3.169 -5.919
252 HE21 GLN 36 1HE2 GLN 36 0.528 2.835 -4.801
253 HE22 GLN 36 2HE2 GLN 36 -0.952 2.895 -5.689
254 H ILE 37 H ILE 37 3.936 6.816 -3.301
255 HA ILE 37 HA ILE 37 2.920 9.420 -3.759
256 HB ILE 37 HB ILE 37 4.592 8.362 -1.478
257 HG12 ILE 37 1HG1 ILE 37 1.644 8.978 -1.462
258 HG13 ILE 37 2HG1 ILE 37 2.250 7.405 -1.968
259 HG21 ILE 37 1HG2 ILE 37 4.867 10.516 -0.947
260 HG22 ILE 37 2HG2 ILE 37 3.654 11.049 -2.109
261 HG23 ILE 37 3HG2 ILE 37 3.158 10.491 -0.511
262 HD11 ILE 37 1HD1 ILE 37 3.432 7.302 0.266
263 HD12 ILE 37 2HD1 ILE 37 2.454 8.695 0.729
264 HD13 ILE 37 3HD1 ILE 37 1.673 7.176 0.290
265 H GLU 38 H GLU 38 6.118 8.028 -3.901
266 HA GLU 38 HA GLU 38 7.500 10.543 -3.929
267 HB2 GLU 38 1HB GLU 38 8.785 8.743 -3.134
268 HB3 GLU 38 2HB GLU 38 8.306 7.697 -4.463
269 HG2 GLU 38 1HG GLU 38 9.577 9.268 -5.982
270 HG3 GLU 38 2HG GLU 38 10.234 9.996 -4.518
271 H ASP 39 H ASP 39 5.879 8.605 -6.248
272 HA ASP 39 HA ASP 39 7.230 9.878 -8.502
273 HB2 ASP 39 1HB ASP 39 5.306 7.591 -8.228
274 HB3 ASP 39 2HB ASP 39 5.526 8.378 -9.789
275 H GLN 40 H GLN 40 4.523 10.344 -6.533
276 HA GLN 40 HA GLN 40 3.099 11.873 -8.592
277 HB2 GLN 40 1HB GLN 40 2.258 10.869 -5.874
278 HB3 GLN 40 2HB GLN 40 1.282 11.977 -6.829
279 HG2 GLN 40 1HG GLN 40 2.189 9.309 -7.864
280 HG3 GLN 40 2HG GLN 40 0.684 9.532 -6.974
281 HE21 GLN 40 1HE2 GLN 40 -0.425 11.712 -7.898
282 HE22 GLN 40 2HE2 GLN 40 -0.698 11.640 -9.602
283 H GLN 41 H GLN 41 4.531 12.175 -5.377
284 HA GLN 41 HA GLN 41 4.099 15.069 -5.443
285 HB2 GLN 41 1HB GLN 41 5.192 13.362 -3.202
286 HB3 GLN 41 2HB GLN 41 4.733 15.056 -3.097
287 HG2 GLN 41 1HG GLN 41 2.678 13.112 -3.989
288 HG3 GLN 41 2HG GLN 41 3.138 13.118 -2.287
289 HE21 GLN 41 1HE2 GLN 41 2.700 14.932 -1.031
290 HE22 GLN 41 2HE2 GLN 41 1.575 16.144 -1.530
291 H GLY 42 H GLY 42 6.602 12.653 -5.630
292 HA2 GLY 42 1HA GLY 42 8.665 13.110 -6.742
293 HA3 GLY 42 2HA GLY 42 8.528 14.788 -6.237
294 H LEU 43 H LEU 43 7.732 13.742 -3.484
295 HA LEU 43 HA LEU 43 10.278 13.947 -2.297
296 HB2 LEU 43 1HB LEU 43 7.810 14.275 -1.377
297 HB3 LEU 43 2HB LEU 43 8.064 12.620 -0.827
298 HG LEU 43 HG LEU 43 10.126 14.661 -0.159
299 HD11 LEU 43 1HD1 LEU 43 7.404 15.062 0.455
300 HD12 LEU 43 2HD1 LEU 43 8.802 15.942 1.070
301 HD13 LEU 43 3HD1 LEU 43 8.197 14.532 1.938
302 HD21 LEU 43 1HD2 LEU 43 10.301 12.208 0.368
303 HD22 LEU 43 2HD2 LEU 43 8.947 12.426 1.477
304 HD23 LEU 43 3HD2 LEU 43 10.460 13.292 1.750
305 HA PRO 44 HA PRO 44 11.794 9.821 -2.651
306 HB2 PRO 44 1HB PRO 44 13.669 9.921 -0.690
307 HB3 PRO 44 2HB PRO 44 13.872 10.719 -2.254
308 HG2 PRO 44 1HG PRO 44 13.013 11.881 0.367
309 HG3 PRO 44 2HG PRO 44 14.140 12.540 -0.833
310 HD2 PRO 44 1HD PRO 44 11.573 13.379 -0.630
311 HD3 PRO 44 2HD PRO 44 12.443 13.332 -2.177
312 H LYS 45 H LYS 45 12.254 7.900 -1.226
313 HA LYS 45 HA LYS 45 10.068 7.605 0.674
314 HB2 LYS 45 1HB LYS 45 12.006 5.540 -0.385
315 HB3 LYS 45 2HB LYS 45 10.566 5.212 0.570
316 HG2 LYS 45 1HG LYS 45 9.265 6.332 -1.311
317 HG3 LYS 45 2HG LYS 45 10.748 6.195 -2.257
318 HD2 LYS 45 1HD LYS 45 9.474 3.843 -0.877
319 HD3 LYS 45 2HD LYS 45 9.060 4.321 -2.526
320 HE2 LYS 45 1HE LYS 45 11.842 3.655 -1.569
321 HE3 LYS 45 2HE LYS 45 10.776 2.534 -2.415
322 HZ1 LYS 45 1HZ LYS 45 12.253 4.830 -3.443
323 HZ2 LYS 45 2HZ LYS 45 10.725 4.547 -4.111
324 HZ3 LYS 45 3HZ LYS 45 11.912 3.344 -4.178
325 H LYS 46 H LYS 46 13.373 8.286 0.719
326 HA LYS 46 HA LYS 46 13.878 7.083 3.313
327 HB2 LYS 46 1HB LYS 46 16.089 8.461 2.969
328 HB3 LYS 46 2HB LYS 46 15.812 6.976 2.069
329 HG2 LYS 46 1HG LYS 46 14.880 9.489 0.821
330 HG3 LYS 46 2HG LYS 46 16.624 9.236 0.922
331 HD2 LYS 46 1HD LYS 46 15.932 6.836 0.009
332 HD3 LYS 46 2HD LYS 46 14.568 7.757 -0.629
333 HE2 LYS 46 1HE LYS 46 17.480 7.992 -1.257
334 HE3 LYS 46 2HE LYS 46 16.104 7.886 -2.354
335 HZ1 LYS 46 1HZ LYS 46 17.375 10.190 -1.312
336 HZ2 LYS 46 2HZ LYS 46 15.739 10.195 -0.883
337 HZ3 LYS 46 3HZ LYS 46 16.186 10.080 -2.510
338 H GLN 47 H GLN 47 12.115 9.610 2.467
339 HA GLN 47 HA GLN 47 12.935 11.192 4.811
340 HB2 GLN 47 1HB GLN 47 12.048 12.134 2.095
341 HB3 GLN 47 2HB GLN 47 11.912 13.164 3.513
342 HG2 GLN 47 1HG GLN 47 14.457 11.958 2.453
343 HG3 GLN 47 2HG GLN 47 13.939 13.630 2.248
344 HE21 GLN 47 1HE2 GLN 47 14.485 15.066 3.749
345 HE22 GLN 47 2HE2 GLN 47 15.193 14.693 5.280
346 H GLN 48 H GLN 48 10.264 10.256 2.683
347 HA GLN 48 HA GLN 48 8.218 11.320 4.345
348 HB2 GLN 48 1HB GLN 48 6.717 10.449 2.818
349 HB3 GLN 48 2HB GLN 48 8.160 10.625 1.828
350 HG2 GLN 48 1HG GLN 48 8.648 8.287 2.017
351 HG3 GLN 48 2HG GLN 48 7.337 8.065 3.175
352 HE21 GLN 48 1HE2 GLN 48 8.204 8.380 -0.138
353 HE22 GLN 48 2HE2 GLN 48 6.640 8.070 -0.804
354 H GLN 49 H GLN 49 7.082 10.426 5.981
355 HA GLN 49 HA GLN 49 7.535 7.601 6.627
356 HB2 GLN 49 1HB GLN 49 9.081 9.023 7.977
357 HB3 GLN 49 2HB GLN 49 7.677 9.825 8.668
358 HG2 GLN 49 1HG GLN 49 6.917 7.643 9.549
359 HG3 GLN 49 2HG GLN 49 8.407 6.920 8.945
360 HE21 GLN 49 1HE2 GLN 49 9.606 6.470 10.654
361 HE22 GLN 49 2HE2 GLN 49 9.970 7.555 11.948
362 H LEU 50 H LEU 50 5.602 6.676 6.612
363 HA LEU 50 HA LEU 50 3.225 8.233 7.251
364 HB2 LEU 50 1HB LEU 50 3.517 5.401 6.260
365 HB3 LEU 50 2HB LEU 50 1.993 6.263 6.459
366 HG LEU 50 HG LEU 50 4.131 7.276 4.611
367 HD11 LEU 50 1HD1 LEU 50 2.313 6.076 2.974
368 HD12 LEU 50 2HD1 LEU 50 2.433 4.915 4.295
369 HD13 LEU 50 3HD1 LEU 50 3.882 5.401 3.415
370 HD21 LEU 50 1HD2 LEU 50 1.176 7.704 4.944
371 HD22 LEU 50 2HD2 LEU 50 2.032 8.156 3.470
372 HD23 LEU 50 3HD2 LEU 50 2.476 8.894 5.009
373 H GLU 51 H GLU 51 1.753 7.693 8.869
374 HA GLU 51 HA GLU 51 2.574 5.638 10.793
375 HB2 GLU 51 1HB GLU 51 2.071 8.547 11.379
376 HB3 GLU 51 2HB GLU 51 1.892 7.315 12.620
377 HG2 GLU 51 1HG GLU 51 4.254 6.624 12.132
378 HG3 GLU 51 2HG GLU 51 4.385 8.060 11.118
379 H PHE 52 H PHE 52 0.804 5.322 12.488
380 HA PHE 52 HA PHE 52 -1.875 5.987 11.622
381 HB2 PHE 52 1HB PHE 52 -1.188 3.937 10.301
382 HB3 PHE 52 2HB PHE 52 -1.115 3.073 11.833
383 HD1 PHE 52 2HD PHE 52 -3.497 5.372 10.103
384 HD2 PHE 52 1HD PHE 52 -2.932 1.771 12.300
385 HE1 PHE 52 2HE PHE 52 -5.908 4.904 9.949
386 HE2 PHE 52 1HE PHE 52 -5.342 1.296 12.149
387 HZ PHE 52 HZ PHE 52 -6.833 2.865 10.973
388 H GLN 53 H GLN 53 -2.673 6.720 13.480
389 HA GLN 53 HA GLN 53 -3.314 6.845 15.658
390 HB2 GLN 53 1HB GLN 53 -2.833 3.870 15.785
391 HB3 GLN 53 2HB GLN 53 -3.932 4.823 16.773
392 HG2 GLN 53 1HG GLN 53 -4.197 4.151 13.857
393 HG3 GLN 53 2HG GLN 53 -5.230 3.631 15.187
394 HE21 GLN 53 1HE2 GLN 53 -6.264 4.823 12.934
395 HE22 GLN 53 2HE2 GLN 53 -6.889 6.380 13.344
396 H GLY 54 H GLY 54 -0.580 7.315 15.065
397 HA2 GLY 54 1HA GLY 54 1.314 7.806 16.284
398 HA3 GLY 54 2HA GLY 54 0.504 7.161 17.705
399 H GLN 55 H GLN 55 1.300 5.564 14.638
400 HA GLN 55 HA GLN 55 3.250 3.890 16.040
401 HB2 GLN 55 1HB GLN 55 2.234 1.882 15.573
402 HB3 GLN 55 2HB GLN 55 0.820 2.894 15.841
403 HG2 GLN 55 1HG GLN 55 0.767 3.259 13.343
404 HG3 GLN 55 2HG GLN 55 1.966 1.972 13.225
405 HE21 GLN 55 1HE2 GLN 55 -0.910 2.369 15.256
406 HE22 GLN 55 2HE2 GLN 55 -1.678 0.905 14.756
407 H VAL 56 H VAL 56 5.066 3.739 14.910
408 HA VAL 56 HA VAL 56 5.305 4.846 12.303
409 HB VAL 56 HB VAL 56 7.287 3.131 13.806
410 HG11 VAL 56 1HG1 VAL 56 7.444 4.756 11.305
411 HG12 VAL 56 2HG1 VAL 56 8.870 4.583 12.329
412 HG13 VAL 56 3HG1 VAL 56 8.096 3.153 11.645
413 HG21 VAL 56 1HG2 VAL 56 6.779 6.094 13.805
414 HG22 VAL 56 2HG2 VAL 56 6.835 4.993 15.181
415 HG23 VAL 56 3HG2 VAL 56 8.317 5.397 14.314
416 H LEU 57 H LEU 57 5.180 3.916 10.357
417 HA LEU 57 HA LEU 57 4.573 1.063 10.233
418 HB2 LEU 57 1HB LEU 57 4.411 3.189 8.101
419 HB3 LEU 57 2HB LEU 57 3.860 1.522 7.939
420 HG LEU 57 HG LEU 57 2.699 3.568 9.829
421 HD11 LEU 57 1HD1 LEU 57 2.369 3.788 7.258
422 HD12 LEU 57 2HD1 LEU 57 0.981 3.923 8.337
423 HD13 LEU 57 3HD1 LEU 57 1.279 2.418 7.468
424 HD21 LEU 57 1HD2 LEU 57 1.041 1.297 9.260
425 HD22 LEU 57 2HD2 LEU 57 1.613 1.902 10.815
426 HD23 LEU 57 3HD2 LEU 57 2.599 0.765 9.893
427 H GLN 58 H GLN 58 5.669 -0.380 8.880
428 HA GLN 58 HA GLN 58 8.434 0.397 8.317
429 HB2 GLN 58 1HB GLN 58 7.059 -2.241 8.727
430 HB3 GLN 58 2HB GLN 58 8.638 -2.163 7.957
431 HG2 GLN 58 1HG GLN 58 7.965 -1.142 10.707
432 HG3 GLN 58 2HG GLN 58 8.823 -2.636 10.335
433 HE21 GLN 58 1HE2 GLN 58 9.901 -0.703 11.978
434 HE22 GLN 58 2HE2 GLN 58 11.265 0.014 11.197
435 H ASP 59 H ASP 59 9.302 -1.132 6.386
436 HA ASP 59 HA ASP 59 7.689 -0.337 4.069
437 HB2 ASP 59 1HB ASP 59 9.693 -0.382 2.781
438 HB3 ASP 59 2HB ASP 59 10.092 0.426 4.294
439 H TRP 60 H TRP 60 9.445 -3.100 5.418
440 HA TRP 60 HA TRP 60 8.641 -4.885 3.326
441 HB2 TRP 60 1HB TRP 60 9.869 -6.526 4.442
442 HB3 TRP 60 2HB TRP 60 10.707 -5.042 4.889
443 HD1 TRP 60 HD TRP 60 8.443 -7.760 6.356
444 HE1 TRP 60 1HE TRP 60 8.559 -7.627 8.924
445 HE3 TRP 60 3HE TRP 60 11.158 -3.453 6.823
446 HZ2 TRP 60 2HZ TRP 60 9.656 -5.922 10.887
447 HZ3 TRP 60 3HZ TRP 60 11.698 -2.639 9.082
448 HH2 TRP 60 HH TRP 60 10.961 -3.849 11.070
449 H LEU 61 H LEU 61 7.249 -3.773 6.267
450 HA LEU 61 HA LEU 61 5.514 -6.002 6.713
451 HB2 LEU 61 1HB LEU 61 5.459 -3.163 7.716
452 HB3 LEU 61 2HB LEU 61 4.320 -4.407 8.230
453 HG LEU 61 HG LEU 61 7.289 -4.315 8.743
454 HD11 LEU 61 1HD1 LEU 61 6.634 -3.221 10.562
455 HD12 LEU 61 2HD1 LEU 61 5.875 -4.720 11.095
456 HD13 LEU 61 3HD1 LEU 61 4.931 -3.519 10.214
457 HD21 LEU 61 1HD2 LEU 61 6.715 -6.598 8.252
458 HD22 LEU 61 2HD2 LEU 61 5.299 -6.511 9.300
459 HD23 LEU 61 3HD2 LEU 61 6.918 -6.424 9.995
460 H GLY 62 H GLY 62 3.533 -6.406 5.917
461 HA2 GLY 62 1HA GLY 62 2.598 -4.838 3.694
462 HA3 GLY 62 2HA GLY 62 1.846 -6.290 4.337
463 H LEU 63 H LEU 63 0.419 -4.016 3.486
464 HA LEU 63 HA LEU 63 -0.285 -2.269 5.572
465 HB2 LEU 63 1HB LEU 63 -1.562 -3.121 3.016
466 HB3 LEU 63 2HB LEU 63 -2.503 -2.180 4.172
467 HG LEU 63 HG LEU 63 -0.463 -0.546 4.055
468 HD11 LEU 63 1HD1 LEU 63 1.036 -1.835 2.745
469 HD12 LEU 63 2HD1 LEU 63 0.459 -0.523 1.719
470 HD13 LEU 63 3HD1 LEU 63 -0.196 -2.148 1.522
471 HD21 LEU 63 1HD2 LEU 63 -2.442 0.377 3.375
472 HD22 LEU 63 2HD2 LEU 63 -2.762 -0.896 2.197
473 HD23 LEU 63 3HD2 LEU 63 -1.571 0.356 1.842
474 H GLY 64 H GLY 64 -1.082 -5.559 4.991
475 HA2 GLY 64 1HA GLY 64 -3.487 -5.530 6.607
476 HA3 GLY 64 2HA GLY 64 -2.726 -6.942 5.888
477 H ILE 65 H ILE 65 -0.144 -6.646 6.956
478 HA ILE 65 HA ILE 65 -0.210 -8.065 9.264
479 HB ILE 65 HB ILE 65 1.808 -6.031 8.351
480 HG12 ILE 65 1HG1 ILE 65 1.738 -8.009 6.997
481 HG13 ILE 65 2HG1 ILE 65 3.165 -8.126 8.020
482 HG21 ILE 65 1HG2 ILE 65 3.156 -7.543 10.173
483 HG22 ILE 65 2HG2 ILE 65 2.523 -5.926 10.472
484 HG23 ILE 65 3HG2 ILE 65 1.590 -7.341 10.960
485 HD11 ILE 65 1HD1 ILE 65 2.366 -10.223 8.283
486 HD12 ILE 65 2HD1 ILE 65 1.458 -9.435 9.574
487 HD13 ILE 65 3HD1 ILE 65 0.691 -9.741 8.015
488 H TYR 66 H TYR 66 -0.527 -4.579 8.948
489 HA TYR 66 HA TYR 66 -0.521 -4.156 11.809
490 HB2 TYR 66 1HB TYR 66 -0.782 -2.398 9.399
491 HB3 TYR 66 2HB TYR 66 -1.291 -1.788 10.970
492 HD1 TYR 66 2HD TYR 66 0.424 -1.850 12.874
493 HD2 TYR 66 1HD TYR 66 1.472 -2.341 8.779
494 HE1 TYR 66 2HE TYR 66 2.753 -1.264 13.405
495 HE2 TYR 66 1HE TYR 66 3.804 -1.757 9.300
496 HH TYR 66 HH TYR 66 4.783 -0.208 11.864
497 H GLY 67 H GLY 67 -2.891 -4.005 9.165
498 HA2 GLY 67 1HA GLY 67 -5.103 -4.971 9.631
499 HA3 GLY 67 2HA GLY 67 -5.014 -4.206 11.211
500 H ILE 68 H ILE 68 -3.886 -2.492 8.419
501 HA ILE 68 HA ILE 68 -5.579 -0.291 8.877
502 HB ILE 68 HB ILE 68 -4.059 -0.998 6.364
503 HG12 ILE 68 1HG1 ILE 68 -3.201 1.003 8.432
504 HG13 ILE 68 2HG1 ILE 68 -2.838 -0.706 8.649
505 HG21 ILE 68 1HG2 ILE 68 -4.720 1.797 7.120
506 HG22 ILE 68 2HG2 ILE 68 -4.500 1.077 5.526
507 HG23 ILE 68 3HG2 ILE 68 -5.995 0.801 6.420
508 HD11 ILE 68 1HD1 ILE 68 -1.490 1.242 7.058
509 HD12 ILE 68 2HD1 ILE 68 -1.036 -0.427 7.406
510 HD13 ILE 68 3HD1 ILE 68 -2.074 -0.065 6.027
511 H GLN 69 H GLN 69 -7.504 0.317 8.038
512 HA GLN 69 HA GLN 69 -8.835 -1.604 6.247
513 HB2 GLN 69 1HB GLN 69 -10.962 -0.738 7.189
514 HB3 GLN 69 2HB GLN 69 -9.931 -1.498 8.394
515 HG2 GLN 69 1HG GLN 69 -9.107 0.882 8.890
516 HG3 GLN 69 2HG GLN 69 -10.537 1.404 8.002
517 HE21 GLN 69 1HE2 GLN 69 -10.736 2.339 10.304
518 HE22 GLN 69 2HE2 GLN 69 -11.681 1.401 11.403
519 H ASP 70 H ASP 70 -10.284 -0.765 4.644
520 HA ASP 70 HA ASP 70 -9.238 1.289 3.096
521 HB2 ASP 70 1HB ASP 70 -11.473 1.244 1.921
522 HB3 ASP 70 2HB ASP 70 -10.672 -0.318 2.066
523 H SER 71 H SER 71 -9.926 3.414 2.657
524 HA SER 71 HA SER 71 -10.686 5.506 3.140
525 HB2 SER 71 1HB SER 71 -12.903 4.227 3.325
526 HB3 SER 71 2HB SER 71 -12.657 4.286 5.070
527 HG SER 71 HG SER 71 -13.916 6.052 4.026
528 H ASP 72 H ASP 72 -8.520 4.367 4.593
529 HA ASP 72 HA ASP 72 -8.846 5.377 7.318
530 HB2 ASP 72 1HB ASP 72 -6.584 4.381 7.685
531 HB3 ASP 72 2HB ASP 72 -7.794 3.213 7.161
532 H THR 73 H THR 73 -6.977 6.647 8.221
533 HA THR 73 HA THR 73 -6.049 8.611 6.227
534 HB THR 73 HB THR 73 -6.658 9.122 9.145
535 HG1 THR 73 1HG THR 73 -8.376 10.430 8.119
536 HG21 THR 73 1HG2 THR 73 -5.086 10.560 7.259
537 HG22 THR 73 2HG2 THR 73 -5.511 11.016 8.909
538 HG23 THR 73 3HG2 THR 73 -6.556 11.483 7.567
539 H LEU 74 H LEU 74 -3.942 8.417 5.873
540 HA LEU 74 HA LEU 74 -2.203 7.545 8.077
541 HB2 LEU 74 1HB LEU 74 -1.559 7.605 5.136
542 HB3 LEU 74 2HB LEU 74 -0.624 6.839 6.419
543 HG LEU 74 HG LEU 74 -3.382 5.957 5.575
544 HD11 LEU 74 1HD1 LEU 74 -1.736 5.683 3.762
545 HD12 LEU 74 2HD1 LEU 74 -2.305 4.142 4.402
546 HD13 LEU 74 3HD1 LEU 74 -0.714 4.751 4.856
547 HD21 LEU 74 1HD2 LEU 74 -2.880 3.968 6.865
548 HD22 LEU 74 2HD2 LEU 74 -2.741 5.401 7.884
549 HD23 LEU 74 3HD2 LEU 74 -1.288 4.607 7.275
550 H ILE 75 H ILE 75 -0.928 8.996 9.004
551 HA ILE 75 HA ILE 75 -0.718 11.662 7.937
552 HB ILE 75 HB ILE 75 0.664 10.496 10.355
553 HG12 ILE 75 1HG1 ILE 75 -1.783 10.277 10.514
554 HG13 ILE 75 2HG1 ILE 75 -1.167 11.461 11.662
555 HG21 ILE 75 1HG2 ILE 75 1.184 12.663 11.001
556 HG22 ILE 75 2HG2 ILE 75 1.461 12.694 9.260
557 HG23 ILE 75 3HG2 ILE 75 -0.020 13.378 9.929
558 HD11 ILE 75 1HD1 ILE 75 -1.856 12.754 9.202
559 HD12 ILE 75 2HD1 ILE 75 -3.213 11.793 9.790
560 HD13 ILE 75 3HD1 ILE 75 -2.488 13.022 10.826
561 H LEU 76 H LEU 76 0.822 12.390 6.635
562 HA LEU 76 HA LEU 76 3.284 10.805 6.350
563 HB2 LEU 76 1HB LEU 76 2.065 10.927 4.301
564 HB3 LEU 76 2HB LEU 76 1.878 12.672 4.454
565 HG LEU 76 HG LEU 76 4.540 12.560 4.359
566 HD11 LEU 76 1HD1 LEU 76 5.137 10.405 4.042
567 HD12 LEU 76 2HD1 LEU 76 4.803 10.801 2.357
568 HD13 LEU 76 3HD1 LEU 76 3.589 9.964 3.323
569 HD21 LEU 76 1HD2 LEU 76 2.408 12.870 2.365
570 HD22 LEU 76 2HD2 LEU 76 4.004 12.525 1.698
571 HD23 LEU 76 3HD2 LEU 76 3.770 13.923 2.748
572 H SER 77 H SER 77 5.163 11.653 6.963
573 HA SER 77 HA SER 77 5.517 14.547 7.026
574 HB2 SER 77 1HB SER 77 4.695 13.490 9.317
575 HB3 SER 77 2HB SER 77 6.399 13.064 9.465
576 HG SER 77 HG SER 77 5.198 15.469 9.776
577 H LYS 78 H LYS 78 7.705 15.212 7.055
578 HA LYS 78 HA LYS 78 9.495 13.285 5.855
579 HB2 LYS 78 1HB LYS 78 9.144 15.862 5.329
580 HB3 LYS 78 2HB LYS 78 10.380 16.044 6.567
581 HG2 LYS 78 1HG LYS 78 11.674 14.284 5.161
582 HG3 LYS 78 2HG LYS 78 10.572 14.776 3.873
583 HD2 LYS 78 1HD LYS 78 12.023 16.860 5.448
584 HD3 LYS 78 2HD LYS 78 12.875 15.981 4.175
585 HE2 LYS 78 1HE LYS 78 11.444 16.786 2.507
586 HE3 LYS 78 2HE LYS 78 10.214 17.273 3.672
587 HZ1 LYS 78 1HZ LYS 78 11.221 19.225 4.042
588 HZ2 LYS 78 2HZ LYS 78 11.975 18.947 2.554
589 HZ3 LYS 78 3HZ LYS 78 12.780 18.570 3.992
590 H LYS 79 H LYS 79 11.522 12.679 6.650
591 HA LYS 79 HA LYS 79 11.658 12.365 9.483
592 HB2 LYS 79 1HB LYS 79 13.850 11.821 7.479
593 HB3 LYS 79 2HB LYS 79 13.672 11.118 9.082
594 HG2 LYS 79 1HG LYS 79 11.368 10.302 8.055
595 HG3 LYS 79 2HG LYS 79 12.280 10.459 6.552
596 HD2 LYS 79 1HD LYS 79 14.086 9.074 7.654
597 HD3 LYS 79 2HD LYS 79 12.926 8.748 8.944
598 HE2 LYS 79 1HE LYS 79 11.359 7.887 7.186
599 HE3 LYS 79 2HE LYS 79 12.678 8.037 6.026
600 HZ1 LYS 79 1HZ LYS 79 12.925 5.879 6.666
601 HZ2 LYS 79 2HZ LYS 79 12.352 6.142 8.235
602 HZ3 LYS 79 3HZ LYS 79 13.922 6.615 7.818
603 H LYS 80 H LYS 80 13.347 13.095 10.879
604 HA LYS 80 HA LYS 80 14.399 15.725 10.089
605 HB2 LYS 80 1HB LYS 80 12.842 15.336 12.153
606 HB3 LYS 80 2HB LYS 80 14.311 14.751 12.923
607 HG2 LYS 80 1HG LYS 80 14.327 17.403 11.562
608 HG3 LYS 80 2HG LYS 80 13.598 17.244 13.161
609 HD2 LYS 80 1HD LYS 80 15.698 16.298 14.011
610 HD3 LYS 80 2HD LYS 80 16.423 16.486 12.413
611 HE2 LYS 80 1HE LYS 80 15.325 18.740 14.090
612 HE3 LYS 80 2HE LYS 80 17.029 18.302 13.983
613 HZ1 LYS 80 1HZ LYS 80 15.570 19.968 12.283
614 HZ2 LYS 80 2HZ LYS 80 16.019 18.606 11.386
615 HZ3 LYS 80 3HZ LYS 80 17.200 19.531 12.168
616 H GLY 81 H GLY 81 16.378 15.379 9.230
617 HA2 GLY 81 1HA GLY 81 18.487 14.555 11.002
618 HA3 GLY 81 2HA GLY 81 18.192 13.397 9.714
619 H SER 82 H SER 82 18.789 16.863 10.243
620 HA SER 82 HA SER 82 19.443 17.596 7.663
621 HB2 SER 82 1HB SER 82 19.227 19.111 9.682
622 HB3 SER 82 2HB SER 82 20.868 18.637 10.118
623 HG SER 82 HG SER 82 21.650 19.766 8.484
624 H GLY 83 H GLY 83 21.138 17.311 6.333
625 HA2 GLY 83 1HA GLY 83 23.776 16.729 7.191
626 HA3 GLY 83 2HA GLY 83 22.965 15.248 6.705
627 HA PRO 84 HA PRO 84 24.542 17.958 3.041
628 HB2 PRO 84 1HB PRO 84 27.108 17.104 2.799
629 HB3 PRO 84 2HB PRO 84 26.653 18.521 3.753
630 HG2 PRO 84 1HG PRO 84 27.232 15.729 4.665
631 HG3 PRO 84 2HG PRO 84 27.743 17.268 5.381
632 HD2 PRO 84 1HD PRO 84 25.669 15.826 6.356
633 HD3 PRO 84 2HD PRO 84 25.716 17.600 6.427
634 H SER 85 H SER 85 25.241 14.645 4.027
635 HA SER 85 HA SER 85 25.067 13.756 1.239
636 HB2 SER 85 1HB SER 85 26.205 11.815 1.860
637 HB3 SER 85 2HB SER 85 26.930 13.029 2.914
638 HG SER 85 HG SER 85 25.629 12.308 4.590
639 H SER 86 H SER 86 23.697 11.989 0.659
640 HA SER 86 HA SER 86 21.551 11.321 2.525
641 HB2 SER 86 1HB SER 86 19.788 11.940 1.036
642 HB3 SER 86 2HB SER 86 20.864 13.333 1.140
643 HG SER 86 HG SER 86 21.872 12.350 -0.825
644 H GLY 87 H GLY 87 20.267 9.478 1.834
645 HA2 GLY 87 1HA GLY 87 21.887 7.424 0.720
646 HA3 GLY 87 2HA GLY 87 20.190 7.282 1.154
Start of MODEL 19
1 H1 GLY 1 H GLY 1 -3.234 7.600 -16.913
2 HA2 GLY 1 1HA GLY 1 -6.152 8.050 -16.853
3 HA3 GLY 1 2HA GLY 1 -5.401 7.045 -18.083
4 H SER 2 H SER 2 -7.059 6.958 -15.253
5 HA SER 2 HA SER 2 -5.908 4.347 -14.514
6 HB2 SER 2 1HB SER 2 -7.328 6.319 -12.707
7 HB3 SER 2 2HB SER 2 -6.677 4.754 -12.218
8 HG SER 2 HG SER 2 -4.957 6.553 -13.483
9 H SER 3 H SER 3 -7.254 3.155 -15.863
10 HA SER 3 HA SER 3 -10.097 3.488 -15.856
11 HB2 SER 3 1HB SER 3 -9.163 2.616 -17.859
12 HB3 SER 3 2HB SER 3 -8.262 1.375 -16.987
13 HG SER 3 HG SER 3 -10.498 0.983 -18.111
14 H GLY 4 H GLY 4 -11.296 2.984 -14.145
15 HA2 GLY 4 1HA GLY 4 -12.293 1.653 -12.545
16 HA3 GLY 4 2HA GLY 4 -11.276 0.324 -13.082
17 H SER 5 H SER 5 -11.125 -0.192 -10.794
18 HA SER 5 HA SER 5 -8.858 1.188 -9.579
19 HB2 SER 5 1HB SER 5 -11.560 0.851 -8.282
20 HB3 SER 5 2HB SER 5 -10.090 1.058 -7.330
21 HG SER 5 HG SER 5 -9.904 3.085 -8.018
22 H SER 6 H SER 6 -7.980 -0.049 -7.702
23 HA SER 6 HA SER 6 -8.713 -2.828 -7.479
24 HB2 SER 6 1HB SER 6 -6.515 -3.703 -8.186
25 HB3 SER 6 2HB SER 6 -7.352 -2.899 -9.514
26 HG SER 6 HG SER 6 -4.960 -2.326 -8.420
27 H GLY 7 H GLY 7 -8.272 -3.548 -5.485
28 HA2 GLY 7 1HA GLY 7 -7.009 -3.809 -3.519
29 HA3 GLY 7 2HA GLY 7 -6.042 -2.416 -3.982
30 H ILE 8 H ILE 8 -6.230 -1.476 -1.935
31 HA ILE 8 HA ILE 8 -8.933 -0.565 -1.204
32 HB ILE 8 HB ILE 8 -8.068 -0.201 1.058
33 HG12 ILE 8 1HG1 ILE 8 -5.556 -1.675 0.400
34 HG13 ILE 8 2HG1 ILE 8 -5.636 0.044 0.033
35 HG21 ILE 8 1HG2 ILE 8 -8.234 -2.780 -0.265
36 HG22 ILE 8 2HG2 ILE 8 -7.241 -2.829 1.191
37 HG23 ILE 8 3HG2 ILE 8 -8.906 -2.255 1.278
38 HD11 ILE 8 1HD1 ILE 8 -5.767 -1.320 2.688
39 HD12 ILE 8 2HD1 ILE 8 -4.691 -0.032 2.146
40 HD13 ILE 8 3HD1 ILE 8 -6.389 0.316 2.470
41 H GLN 9 H GLN 9 -9.244 1.602 -0.557
42 HA GLN 9 HA GLN 9 -7.287 3.449 -1.730
43 HB2 GLN 9 1HB GLN 9 -9.824 3.334 -2.382
44 HB3 GLN 9 2HB GLN 9 -10.047 4.271 -0.911
45 HG2 GLN 9 1HG GLN 9 -9.014 6.121 -1.761
46 HG3 GLN 9 2HG GLN 9 -8.015 5.187 -2.874
47 HE21 GLN 9 1HE2 GLN 9 -10.901 6.943 -2.450
48 HE22 GLN 9 2HE2 GLN 9 -11.547 6.720 -4.036
49 H VAL 10 H VAL 10 -5.966 4.428 -0.360
50 HA VAL 10 HA VAL 10 -6.882 4.913 2.395
51 HB VAL 10 HB VAL 10 -4.492 5.102 2.990
52 HG11 VAL 10 1HG1 VAL 10 -5.909 2.887 2.813
53 HG12 VAL 10 2HG1 VAL 10 -4.714 2.493 1.576
54 HG13 VAL 10 3HG1 VAL 10 -4.195 2.845 3.224
55 HG21 VAL 10 1HG2 VAL 10 -2.770 4.939 1.507
56 HG22 VAL 10 2HG2 VAL 10 -3.675 3.911 0.396
57 HG23 VAL 10 3HG2 VAL 10 -3.984 5.647 0.441
58 H PHE 11 H PHE 11 -6.069 6.894 3.438
59 HA PHE 11 HA PHE 11 -5.953 9.120 1.512
60 HB2 PHE 11 1HB PHE 11 -7.108 9.007 4.302
61 HB3 PHE 11 2HB PHE 11 -6.892 10.502 3.398
62 HD1 PHE 11 1HD PHE 11 -8.123 10.792 1.227
63 HD2 PHE 11 2HD PHE 11 -8.973 7.634 3.951
64 HE1 PHE 11 1HE PHE 11 -10.312 10.461 0.154
65 HE2 PHE 11 2HE PHE 11 -11.163 7.297 2.882
66 HZ PHE 11 HZ PHE 11 -11.835 8.711 0.981
67 H VAL 12 H VAL 12 -3.898 9.746 1.314
68 HA VAL 12 HA VAL 12 -2.075 9.619 3.570
69 HB VAL 12 HB VAL 12 -1.611 10.530 0.727
70 HG11 VAL 12 1HG1 VAL 12 -0.002 10.779 3.109
71 HG12 VAL 12 2HG1 VAL 12 0.808 9.788 1.895
72 HG13 VAL 12 3HG1 VAL 12 0.279 11.422 1.491
73 HG21 VAL 12 1HG2 VAL 12 -1.198 7.919 2.146
74 HG22 VAL 12 2HG2 VAL 12 -2.032 8.232 0.624
75 HG23 VAL 12 3HG2 VAL 12 -0.274 8.342 0.704
76 H LYS 13 H LYS 13 -2.121 11.217 5.005
77 HA LYS 13 HA LYS 13 -2.930 13.895 4.224
78 HB2 LYS 13 1HB LYS 13 -3.654 12.697 6.370
79 HB3 LYS 13 2HB LYS 13 -2.032 13.026 6.966
80 HG2 LYS 13 1HG LYS 13 -2.400 15.277 7.142
81 HG3 LYS 13 2HG LYS 13 -3.638 15.284 5.883
82 HD2 LYS 13 1HD LYS 13 -5.252 14.336 7.347
83 HD3 LYS 13 2HD LYS 13 -4.027 13.969 8.564
84 HE2 LYS 13 1HE LYS 13 -3.890 16.144 9.277
85 HE3 LYS 13 2HE LYS 13 -4.387 16.800 7.718
86 HZ1 LYS 13 1HZ LYS 13 -6.093 17.085 9.416
87 HZ2 LYS 13 2HZ LYS 13 -6.175 15.411 9.641
88 HZ3 LYS 13 3HZ LYS 13 -6.641 16.090 8.163
89 H ASN 14 H ASN 14 -1.344 14.930 3.137
90 HA ASN 14 HA ASN 14 1.421 14.654 3.675
91 HB2 ASN 14 1HB ASN 14 1.640 16.695 2.222
92 HB3 ASN 14 2HB ASN 14 0.737 15.372 1.490
93 HD21 ASN 14 1HD2 ASN 14 -0.410 16.640 0.092
94 HD22 ASN 14 2HD2 ASN 14 -1.627 17.754 0.606
95 HA PRO 15 HA PRO 15 2.085 17.380 7.053
96 HB2 PRO 15 1HB PRO 15 4.582 18.285 6.491
97 HB3 PRO 15 2HB PRO 15 4.261 16.641 7.057
98 HG2 PRO 15 1HG PRO 15 4.737 17.627 4.270
99 HG3 PRO 15 2HG PRO 15 5.372 16.176 5.068
100 HD2 PRO 15 1HD PRO 15 3.281 16.096 3.349
101 HD3 PRO 15 2HD PRO 15 3.430 14.984 4.725
102 H ASP 16 H ASP 16 1.711 18.480 3.909
103 HA ASP 16 HA ASP 16 2.298 21.263 4.404
104 HB2 ASP 16 1HB ASP 16 2.659 20.718 2.173
105 HB3 ASP 16 2HB ASP 16 1.228 19.695 2.085
106 H GLY 17 H GLY 17 -0.685 19.483 3.562
107 HA2 GLY 17 1HA GLY 17 -2.401 20.223 5.471
108 HA3 GLY 17 2HA GLY 17 -2.294 21.704 4.531
109 H GLY 18 H GLY 18 -2.742 18.205 3.977
110 HA2 GLY 18 1HA GLY 18 -5.263 18.575 2.712
111 HA3 GLY 18 2HA GLY 18 -3.996 18.361 1.512
112 H SER 19 H SER 19 -5.314 16.449 0.962
113 HA SER 19 HA SER 19 -4.161 14.100 2.115
114 HB2 SER 19 1HB SER 19 -6.220 13.055 2.905
115 HB3 SER 19 2HB SER 19 -5.947 14.567 3.770
116 HG SER 19 HG SER 19 -7.438 15.549 2.309
117 H TYR 20 H TYR 20 -3.818 12.801 0.450
118 HA TYR 20 HA TYR 20 -5.567 13.020 -1.900
119 HB2 TYR 20 1HB TYR 20 -2.830 11.748 -1.730
120 HB3 TYR 20 2HB TYR 20 -3.742 12.108 -3.192
121 HD1 TYR 20 2HD TYR 20 -4.632 14.814 -2.881
122 HD2 TYR 20 1HD TYR 20 -0.943 13.076 -1.665
123 HE1 TYR 20 2HE TYR 20 -3.555 17.021 -3.014
124 HE2 TYR 20 1HE TYR 20 0.143 15.279 -1.793
125 HH TYR 20 HH TYR 20 -0.822 17.821 -1.599
126 H ALA 21 H ALA 21 -5.806 10.938 -3.166
127 HA ALA 21 HA ALA 21 -6.276 8.700 -1.304
128 HB1 ALA 21 1HB ALA 21 -8.283 9.956 -2.366
129 HB2 ALA 21 2HB ALA 21 -7.860 9.045 -3.816
130 HB3 ALA 21 3HB ALA 21 -8.284 8.192 -2.332
131 H TYR 22 H TYR 22 -4.783 7.188 -1.643
132 HA TYR 22 HA TYR 22 -3.819 6.715 -4.374
133 HB2 TYR 22 1HB TYR 22 -2.689 6.054 -1.661
134 HB3 TYR 22 2HB TYR 22 -2.061 5.319 -3.132
135 HD1 TYR 22 2HD TYR 22 -2.623 8.581 -1.453
136 HD2 TYR 22 1HD TYR 22 -0.516 6.465 -4.483
137 HE1 TYR 22 2HE TYR 22 -1.177 10.539 -1.806
138 HE2 TYR 22 1HE TYR 22 0.938 8.416 -4.844
139 HH TYR 22 HH TYR 22 0.617 11.054 -4.418
140 H ALA 23 H ALA 23 -3.845 4.676 -5.304
141 HA ALA 23 HA ALA 23 -5.650 2.744 -4.005
142 HB1 ALA 23 1HB ALA 23 -6.396 3.808 -6.167
143 HB2 ALA 23 2HB ALA 23 -5.090 2.922 -6.956
144 HB3 ALA 23 3HB ALA 23 -6.386 2.044 -6.143
145 H ILE 24 H ILE 24 -4.603 1.072 -3.163
146 HA ILE 24 HA ILE 24 -2.661 -0.368 -4.767
147 HB ILE 24 HB ILE 24 -1.067 0.978 -3.724
148 HG12 ILE 24 1HG1 ILE 24 -1.258 -1.229 -1.687
149 HG13 ILE 24 2HG1 ILE 24 -0.850 -1.571 -3.364
150 HG21 ILE 24 1HG2 ILE 24 -1.108 1.525 -1.308
151 HG22 ILE 24 2HG2 ILE 24 -2.493 2.163 -2.192
152 HG23 ILE 24 3HG2 ILE 24 -2.675 0.725 -1.188
153 HD11 ILE 24 1HD1 ILE 24 1.066 -1.290 -1.725
154 HD12 ILE 24 2HD1 ILE 24 1.156 -0.376 -3.232
155 HD13 ILE 24 3HD1 ILE 24 0.676 0.430 -1.738
156 H ASN 25 H ASN 25 -2.432 -2.524 -4.182
157 HA ASN 25 HA ASN 25 -4.626 -3.662 -2.773
158 HB2 ASN 25 1HB ASN 25 -3.126 -4.616 -4.728
159 HB3 ASN 25 2HB ASN 25 -2.174 -5.256 -3.392
160 HD21 ASN 25 1HD2 ASN 25 -5.236 -5.345 -5.035
161 HD22 ASN 25 2HD2 ASN 25 -5.806 -6.810 -4.317
162 HA PRO 26 HA PRO 26 -3.023 -3.684 1.331
163 HB2 PRO 26 1HB PRO 26 -4.562 -5.669 2.361
164 HB3 PRO 26 2HB PRO 26 -5.187 -4.054 2.008
165 HG2 PRO 26 1HG PRO 26 -5.404 -6.563 0.390
166 HG3 PRO 26 2HG PRO 26 -6.642 -5.339 0.728
167 HD2 PRO 26 1HD PRO 26 -5.280 -5.428 -1.612
168 HD3 PRO 26 2HD PRO 26 -5.846 -3.906 -0.893
169 H ASN 27 H ASN 27 -2.996 -6.505 -0.703
170 HA ASN 27 HA ASN 27 -1.543 -8.208 1.056
171 HB2 ASN 27 1HB ASN 27 -1.835 -8.294 -1.955
172 HB3 ASN 27 2HB ASN 27 -1.157 -9.585 -0.968
173 HD21 ASN 27 1HD2 ASN 27 -3.497 -9.558 -2.726
174 HD22 ASN 27 2HD2 ASN 27 -4.830 -10.045 -1.741
175 H SER 28 H SER 28 -0.652 -5.860 -1.397
176 HA SER 28 HA SER 28 2.062 -6.540 -1.654
177 HB2 SER 28 1HB SER 28 0.425 -4.110 -2.223
178 HB3 SER 28 2HB SER 28 2.180 -3.942 -2.210
179 HG SER 28 HG SER 28 0.881 -5.976 -3.681
180 H PHE 29 H PHE 29 3.827 -4.880 -1.008
181 HA PHE 29 HA PHE 29 3.767 -4.719 1.888
182 HB2 PHE 29 1HB PHE 29 6.018 -3.974 0.013
183 HB3 PHE 29 2HB PHE 29 6.136 -4.272 1.744
184 HD1 PHE 29 2HD PHE 29 5.058 -6.686 2.395
185 HD2 PHE 29 1HD PHE 29 6.835 -5.632 -1.326
186 HE1 PHE 29 2HE PHE 29 5.534 -9.059 1.954
187 HE2 PHE 29 1HE PHE 29 7.313 -8.003 -1.774
188 HZ PHE 29 HZ PHE 29 6.664 -9.720 -0.132
189 H ILE 30 H ILE 30 4.472 -2.778 3.024
190 HA ILE 30 HA ILE 30 2.962 -0.529 2.388
191 HB ILE 30 HB ILE 30 5.415 -0.703 4.141
192 HG12 ILE 30 1HG1 ILE 30 3.552 -2.183 4.808
193 HG13 ILE 30 2HG1 ILE 30 3.822 -0.897 5.979
194 HG21 ILE 30 1HG2 ILE 30 3.578 1.334 4.933
195 HG22 ILE 30 2HG2 ILE 30 5.276 1.484 4.480
196 HG23 ILE 30 3HG2 ILE 30 4.022 1.578 3.243
197 HD11 ILE 30 1HD1 ILE 30 1.470 -1.522 4.416
198 HD12 ILE 30 2HD1 ILE 30 1.641 -0.521 5.858
199 HD13 ILE 30 3HD1 ILE 30 1.946 0.169 4.264
200 H LEU 31 H LEU 31 6.311 -1.308 1.636
201 HA LEU 31 HA LEU 31 7.277 1.133 0.808
202 HB2 LEU 31 1HB LEU 31 8.543 -1.012 0.935
203 HB3 LEU 31 2HB LEU 31 7.782 -1.493 -0.581
204 HG LEU 31 HG LEU 31 8.851 0.575 -1.601
205 HD11 LEU 31 1HD1 LEU 31 10.799 0.448 0.653
206 HD12 LEU 31 2HD1 LEU 31 9.349 1.439 0.813
207 HD13 LEU 31 3HD1 LEU 31 10.488 1.748 -0.497
208 HD21 LEU 31 1HD2 LEU 31 10.576 -0.703 -2.314
209 HD22 LEU 31 2HD2 LEU 31 9.678 -1.969 -1.475
210 HD23 LEU 31 3HD2 LEU 31 11.043 -1.181 -0.682
211 H GLY 32 H GLY 32 5.440 -1.230 -1.117
212 HA2 GLY 32 1HA GLY 32 5.450 -0.019 -3.577
213 HA3 GLY 32 2HA GLY 32 4.076 -0.914 -2.943
214 H LEU 33 H LEU 33 3.253 0.715 -0.882
215 HA LEU 33 HA LEU 33 1.681 2.608 -2.209
216 HB2 LEU 33 1HB LEU 33 0.932 1.746 -0.133
217 HB3 LEU 33 2HB LEU 33 2.402 2.264 0.690
218 HG LEU 33 HG LEU 33 1.688 4.624 0.352
219 HD11 LEU 33 1HD1 LEU 33 -0.512 5.152 -0.377
220 HD12 LEU 33 2HD1 LEU 33 -0.961 3.449 -0.461
221 HD13 LEU 33 3HD1 LEU 33 0.209 4.109 -1.604
222 HD21 LEU 33 1HD2 LEU 33 1.011 2.907 2.309
223 HD22 LEU 33 2HD2 LEU 33 -0.593 3.398 1.764
224 HD23 LEU 33 3HD2 LEU 33 0.564 4.613 2.309
225 H LYS 34 H LYS 34 4.538 3.095 -0.141
226 HA LYS 34 HA LYS 34 4.709 5.848 -0.260
227 HB2 LYS 34 1HB LYS 34 6.740 3.672 0.041
228 HB3 LYS 34 2HB LYS 34 7.289 5.332 -0.151
229 HG2 LYS 34 1HG LYS 34 7.180 5.241 2.112
230 HG3 LYS 34 2HG LYS 34 5.525 5.752 1.776
231 HD2 LYS 34 1HD LYS 34 5.190 4.006 3.249
232 HD3 LYS 34 2HD LYS 34 5.045 3.192 1.690
233 HE2 LYS 34 1HE LYS 34 6.446 1.781 2.887
234 HE3 LYS 34 2HE LYS 34 7.575 2.751 1.943
235 HZ1 LYS 34 1HZ LYS 34 8.542 2.982 3.951
236 HZ2 LYS 34 2HZ LYS 34 7.113 2.712 4.815
237 HZ3 LYS 34 3HZ LYS 34 7.413 4.229 4.129
238 H GLN 35 H GLN 35 6.347 3.527 -2.418
239 HA GLN 35 HA GLN 35 7.654 5.157 -4.127
240 HB2 GLN 35 1HB GLN 35 7.672 2.748 -4.394
241 HB3 GLN 35 2HB GLN 35 5.978 2.754 -4.867
242 HG2 GLN 35 1HG GLN 35 7.118 2.532 -6.874
243 HG3 GLN 35 2HG GLN 35 6.718 4.248 -6.806
244 HE21 GLN 35 1HE2 GLN 35 8.386 5.729 -6.189
245 HE22 GLN 35 2HE2 GLN 35 10.043 5.341 -6.486
246 H GLN 36 H GLN 36 4.183 4.433 -4.267
247 HA GLN 36 HA GLN 36 3.586 5.885 -6.580
248 HB2 GLN 36 1HB GLN 36 1.983 5.036 -4.194
249 HB3 GLN 36 2HB GLN 36 1.262 6.084 -5.408
250 HG2 GLN 36 1HG GLN 36 2.002 4.326 -7.105
251 HG3 GLN 36 2HG GLN 36 2.253 3.275 -5.712
252 HE21 GLN 36 1HE2 GLN 36 0.425 2.827 -4.349
253 HE22 GLN 36 2HE2 GLN 36 -1.168 2.842 -5.016
254 H ILE 37 H ILE 37 3.668 6.890 -3.186
255 HA ILE 37 HA ILE 37 2.709 9.511 -3.594
256 HB ILE 37 HB ILE 37 4.494 8.435 -1.409
257 HG12 ILE 37 1HG1 ILE 37 1.568 9.082 -1.180
258 HG13 ILE 37 2HG1 ILE 37 2.094 7.521 -1.801
259 HG21 ILE 37 1HG2 ILE 37 3.023 10.619 -0.468
260 HG22 ILE 37 2HG2 ILE 37 4.761 10.539 -0.753
261 HG23 ILE 37 3HG2 ILE 37 3.686 11.124 -2.022
262 HD11 ILE 37 1HD1 ILE 37 2.291 6.792 0.272
263 HD12 ILE 37 2HD1 ILE 37 3.535 8.006 0.574
264 HD13 ILE 37 3HD1 ILE 37 1.841 8.381 0.892
265 H GLU 38 H GLU 38 5.900 8.083 -3.827
266 HA GLU 38 HA GLU 38 7.291 10.584 -3.978
267 HB2 GLU 38 1HB GLU 38 8.569 8.759 -3.191
268 HB3 GLU 38 2HB GLU 38 8.070 7.730 -4.526
269 HG2 GLU 38 1HG GLU 38 9.659 10.207 -5.037
270 HG3 GLU 38 2HG GLU 38 10.450 8.723 -4.511
271 H ASP 39 H ASP 39 6.475 8.069 -6.365
272 HA ASP 39 HA ASP 39 7.450 9.474 -8.605
273 HB2 ASP 39 1HB ASP 39 5.662 7.129 -8.178
274 HB3 ASP 39 2HB ASP 39 5.643 7.895 -9.764
275 H GLN 40 H GLN 40 4.735 10.013 -6.670
276 HA GLN 40 HA GLN 40 3.289 11.410 -8.803
277 HB2 GLN 40 1HB GLN 40 2.512 10.440 -6.069
278 HB3 GLN 40 2HB GLN 40 1.549 11.657 -6.897
279 HG2 GLN 40 1HG GLN 40 2.231 9.023 -8.160
280 HG3 GLN 40 2HG GLN 40 0.818 9.241 -7.129
281 HE21 GLN 40 1HE2 GLN 40 2.033 9.461 -10.244
282 HE22 GLN 40 2HE2 GLN 40 0.725 10.324 -10.972
283 H GLN 41 H GLN 41 4.050 12.012 -5.367
284 HA GLN 41 HA GLN 41 3.854 14.858 -5.745
285 HB2 GLN 41 1HB GLN 41 4.745 13.226 -3.362
286 HB3 GLN 41 2HB GLN 41 4.507 14.968 -3.351
287 HG2 GLN 41 1HG GLN 41 2.138 14.619 -3.929
288 HG3 GLN 41 2HG GLN 41 2.398 12.878 -3.841
289 HE21 GLN 41 1HE2 GLN 41 2.625 15.853 -1.957
290 HE22 GLN 41 2HE2 GLN 41 2.285 15.123 -0.429
291 H GLY 42 H GLY 42 6.390 12.471 -5.635
292 HA2 GLY 42 1HA GLY 42 8.482 12.941 -6.735
293 HA3 GLY 42 2HA GLY 42 8.331 14.612 -6.210
294 H LEU 43 H LEU 43 7.548 13.904 -3.493
295 HA LEU 43 HA LEU 43 10.016 13.945 -2.237
296 HB2 LEU 43 1HB LEU 43 7.546 14.340 -1.384
297 HB3 LEU 43 2HB LEU 43 7.719 12.673 -0.837
298 HG LEU 43 HG LEU 43 9.832 14.630 -0.085
299 HD11 LEU 43 1HD1 LEU 43 8.618 15.565 1.685
300 HD12 LEU 43 2HD1 LEU 43 7.292 14.418 1.499
301 HD13 LEU 43 3HD1 LEU 43 7.540 15.680 0.293
302 HD21 LEU 43 1HD2 LEU 43 10.456 12.887 1.135
303 HD22 LEU 43 2HD2 LEU 43 9.048 11.974 0.593
304 HD23 LEU 43 3HD2 LEU 43 8.942 12.988 2.033
305 HA PRO 44 HA PRO 44 11.469 9.788 -2.538
306 HB2 PRO 44 1HB PRO 44 13.350 9.903 -0.584
307 HB3 PRO 44 2HB PRO 44 13.561 10.663 -2.166
308 HG2 PRO 44 1HG PRO 44 12.727 11.896 0.431
309 HG3 PRO 44 2HG PRO 44 13.861 12.510 -0.787
310 HD2 PRO 44 1HD PRO 44 11.308 13.393 -0.595
311 HD3 PRO 44 2HD PRO 44 12.172 13.298 -2.143
312 H LYS 45 H LYS 45 11.633 7.829 -1.277
313 HA LYS 45 HA LYS 45 9.507 7.582 0.629
314 HB2 LYS 45 1HB LYS 45 11.555 5.458 0.039
315 HB3 LYS 45 2HB LYS 45 9.877 5.255 0.527
316 HG2 LYS 45 1HG LYS 45 9.194 6.212 -1.669
317 HG3 LYS 45 2HG LYS 45 10.894 6.196 -2.144
318 HD2 LYS 45 1HD LYS 45 10.674 3.665 -1.334
319 HD3 LYS 45 2HD LYS 45 8.992 3.947 -1.788
320 HE2 LYS 45 1HE LYS 45 9.821 4.775 -4.000
321 HE3 LYS 45 2HE LYS 45 11.435 4.250 -3.526
322 HZ1 LYS 45 1HZ LYS 45 9.878 2.693 -4.896
323 HZ2 LYS 45 2HZ LYS 45 9.227 2.325 -3.379
324 HZ3 LYS 45 3HZ LYS 45 10.869 2.056 -3.681
325 H LYS 46 H LYS 46 13.034 7.117 0.788
326 HA LYS 46 HA LYS 46 13.410 6.392 3.369
327 HB2 LYS 46 1HB LYS 46 15.553 7.601 3.316
328 HB3 LYS 46 2HB LYS 46 15.260 6.726 1.819
329 HG2 LYS 46 1HG LYS 46 14.381 8.922 0.889
330 HG3 LYS 46 2HG LYS 46 15.099 9.680 2.312
331 HD2 LYS 46 1HD LYS 46 16.851 9.866 0.857
332 HD3 LYS 46 2HD LYS 46 17.210 8.279 1.543
333 HE2 LYS 46 1HE LYS 46 15.710 8.783 -1.026
334 HE3 LYS 46 2HE LYS 46 17.401 8.300 -0.907
335 HZ1 LYS 46 1HZ LYS 46 15.025 6.725 -0.086
336 HZ2 LYS 46 2HZ LYS 46 16.615 6.279 0.280
337 HZ3 LYS 46 3HZ LYS 46 16.111 6.368 -1.333
338 H GLN 47 H GLN 47 12.537 9.598 2.217
339 HA GLN 47 HA GLN 47 12.736 10.776 4.848
340 HB2 GLN 47 1HB GLN 47 11.775 11.815 2.186
341 HB3 GLN 47 2HB GLN 47 11.678 12.765 3.663
342 HG2 GLN 47 1HG GLN 47 14.290 11.579 2.861
343 HG3 GLN 47 2HG GLN 47 13.702 13.025 2.042
344 HE21 GLN 47 1HE2 GLN 47 15.590 11.975 4.485
345 HE22 GLN 47 2HE2 GLN 47 15.554 13.363 5.512
346 H GLN 48 H GLN 48 10.039 10.443 2.532
347 HA GLN 48 HA GLN 48 7.967 11.109 4.204
348 HB2 GLN 48 1HB GLN 48 6.559 10.294 2.590
349 HB3 GLN 48 2HB GLN 48 8.048 10.392 1.660
350 HG2 GLN 48 1HG GLN 48 8.435 7.971 2.265
351 HG3 GLN 48 2HG GLN 48 6.779 7.956 2.868
352 HE21 GLN 48 1HE2 GLN 48 8.533 9.081 -0.008
353 HE22 GLN 48 2HE2 GLN 48 7.398 8.459 -1.152
354 H GLN 49 H GLN 49 7.338 10.321 6.092
355 HA GLN 49 HA GLN 49 7.611 7.428 6.571
356 HB2 GLN 49 1HB GLN 49 9.273 8.542 7.907
357 HB3 GLN 49 2HB GLN 49 8.093 9.707 8.493
358 HG2 GLN 49 1HG GLN 49 6.896 7.865 9.623
359 HG3 GLN 49 2HG GLN 49 8.171 6.762 9.108
360 HE21 GLN 49 1HE2 GLN 49 9.239 6.244 10.889
361 HE22 GLN 49 2HE2 GLN 49 9.886 7.362 12.036
362 H LEU 50 H LEU 50 5.658 6.547 6.635
363 HA LEU 50 HA LEU 50 3.361 8.135 7.466
364 HB2 LEU 50 1HB LEU 50 3.360 5.285 6.505
365 HB3 LEU 50 2HB LEU 50 2.007 6.414 6.547
366 HG LEU 50 HG LEU 50 4.398 6.924 4.807
367 HD11 LEU 50 1HD1 LEU 50 3.386 4.623 4.411
368 HD12 LEU 50 2HD1 LEU 50 3.467 5.713 3.027
369 HD13 LEU 50 3HD1 LEU 50 1.938 5.476 3.873
370 HD21 LEU 50 1HD2 LEU 50 2.650 8.684 5.316
371 HD22 LEU 50 2HD2 LEU 50 1.513 7.682 4.413
372 HD23 LEU 50 3HD2 LEU 50 2.939 8.342 3.610
373 H GLU 51 H GLU 51 2.256 7.856 9.320
374 HA GLU 51 HA GLU 51 3.084 5.642 11.080
375 HB2 GLU 51 1HB GLU 51 3.713 8.165 11.623
376 HB3 GLU 51 2HB GLU 51 2.070 8.192 12.246
377 HG2 GLU 51 1HG GLU 51 2.890 5.978 13.448
378 HG3 GLU 51 2HG GLU 51 4.459 6.757 13.247
379 H PHE 52 H PHE 52 1.487 4.802 12.504
380 HA PHE 52 HA PHE 52 -1.284 5.552 11.898
381 HB2 PHE 52 1HB PHE 52 -0.434 3.495 10.583
382 HB3 PHE 52 2HB PHE 52 -0.492 2.659 12.131
383 HD1 PHE 52 1HD PHE 52 -2.837 3.275 13.434
384 HD2 PHE 52 2HD PHE 52 -2.221 3.075 9.227
385 HE1 PHE 52 1HE PHE 52 -5.235 2.834 13.108
386 HE2 PHE 52 2HE PHE 52 -4.619 2.635 8.894
387 HZ PHE 52 HZ PHE 52 -6.129 2.515 10.836
388 H GLN 53 H GLN 53 -2.028 6.250 13.794
389 HA GLN 53 HA GLN 53 -2.409 6.432 16.039
390 HB2 GLN 53 1HB GLN 53 -3.652 4.296 15.246
391 HB3 GLN 53 2HB GLN 53 -2.404 3.431 16.133
392 HG2 GLN 53 1HG GLN 53 -4.544 3.851 17.374
393 HG3 GLN 53 2HG GLN 53 -3.069 4.372 18.187
394 HE21 GLN 53 1HE2 GLN 53 -5.483 5.649 15.917
395 HE22 GLN 53 2HE2 GLN 53 -5.607 7.204 16.659
396 H GLY 54 H GLY 54 0.347 6.460 15.337
397 HA2 GLY 54 1HA GLY 54 2.265 6.669 16.643
398 HA3 GLY 54 2HA GLY 54 1.459 5.776 17.925
399 H GLN 55 H GLN 55 1.900 4.773 14.564
400 HA GLN 55 HA GLN 55 3.783 2.709 15.471
401 HB2 GLN 55 1HB GLN 55 1.404 2.253 13.662
402 HB3 GLN 55 2HB GLN 55 2.644 1.060 14.024
403 HG2 GLN 55 1HG GLN 55 2.005 1.313 16.450
404 HG3 GLN 55 2HG GLN 55 0.612 2.239 15.892
405 HE21 GLN 55 1HE2 GLN 55 -0.835 1.155 14.367
406 HE22 GLN 55 2HE2 GLN 55 -1.077 -0.548 14.522
407 H VAL 56 H VAL 56 5.468 2.334 14.137
408 HA VAL 56 HA VAL 56 5.736 4.067 11.816
409 HB VAL 56 HB VAL 56 7.758 2.188 13.046
410 HG11 VAL 56 1HG1 VAL 56 7.795 3.323 10.548
411 HG12 VAL 56 2HG1 VAL 56 8.720 4.475 11.513
412 HG13 VAL 56 3HG1 VAL 56 9.209 2.781 11.452
413 HG21 VAL 56 1HG2 VAL 56 8.603 4.739 13.561
414 HG22 VAL 56 2HG2 VAL 56 6.857 4.874 13.772
415 HG23 VAL 56 3HG2 VAL 56 7.770 3.691 14.709
416 H LEU 57 H LEU 57 4.847 3.317 9.996
417 HA LEU 57 HA LEU 57 4.618 0.519 9.418
418 HB2 LEU 57 1HB LEU 57 4.229 2.774 7.471
419 HB3 LEU 57 2HB LEU 57 3.504 1.168 7.437
420 HG LEU 57 HG LEU 57 2.871 3.312 9.464
421 HD11 LEU 57 1HD1 LEU 57 0.597 3.022 8.133
422 HD12 LEU 57 2HD1 LEU 57 1.708 2.613 6.827
423 HD13 LEU 57 3HD1 LEU 57 1.834 4.176 7.635
424 HD21 LEU 57 1HD2 LEU 57 0.871 1.323 9.255
425 HD22 LEU 57 2HD2 LEU 57 1.904 1.698 10.635
426 HD23 LEU 57 3HD2 LEU 57 2.420 0.501 9.446
427 H GLN 58 H GLN 58 6.564 -0.468 9.165
428 HA GLN 58 HA GLN 58 8.769 0.660 7.793
429 HB2 GLN 58 1HB GLN 58 8.261 -2.280 8.247
430 HB3 GLN 58 2HB GLN 58 9.813 -1.484 8.023
431 HG2 GLN 58 1HG GLN 58 8.057 -0.752 10.327
432 HG3 GLN 58 2HG GLN 58 9.073 -2.191 10.393
433 HE21 GLN 58 1HE2 GLN 58 9.255 1.257 9.591
434 HE22 GLN 58 2HE2 GLN 58 10.818 1.512 10.282
435 H ASP 59 H ASP 59 9.765 -0.285 5.832
436 HA ASP 59 HA ASP 59 7.908 -0.260 3.675
437 HB2 ASP 59 1HB ASP 59 10.699 -1.241 3.283
438 HB3 ASP 59 2HB ASP 59 9.743 -0.147 2.287
439 H TRP 60 H TRP 60 10.144 -2.785 4.839
440 HA TRP 60 HA TRP 60 9.311 -4.837 3.177
441 HB2 TRP 60 1HB TRP 60 10.577 -6.234 4.491
442 HB3 TRP 60 2HB TRP 60 11.218 -4.678 5.010
443 HD1 TRP 60 HD TRP 60 8.819 -7.450 6.195
444 HE1 TRP 60 1HE TRP 60 8.623 -7.306 8.757
445 HE3 TRP 60 3HE TRP 60 11.499 -3.167 6.974
446 HZ2 TRP 60 2HZ TRP 60 9.489 -5.601 10.834
447 HZ3 TRP 60 3HZ TRP 60 11.768 -2.346 9.278
448 HH2 TRP 60 HH TRP 60 10.783 -3.539 11.167
449 H LEU 61 H LEU 61 7.851 -3.608 6.111
450 HA LEU 61 HA LEU 61 6.090 -5.737 6.630
451 HB2 LEU 61 1HB LEU 61 6.030 -2.810 7.281
452 HB3 LEU 61 2HB LEU 61 4.708 -3.880 7.743
453 HG LEU 61 HG LEU 61 7.579 -4.118 8.642
454 HD11 LEU 61 1HD1 LEU 61 5.257 -3.567 10.431
455 HD12 LEU 61 2HD1 LEU 61 5.997 -2.244 9.531
456 HD13 LEU 61 3HD1 LEU 61 6.966 -3.194 10.656
457 HD21 LEU 61 1HD2 LEU 61 5.419 -6.016 8.595
458 HD22 LEU 61 2HD2 LEU 61 5.881 -5.646 10.256
459 HD23 LEU 61 3HD2 LEU 61 7.091 -6.232 9.114
460 H GLY 62 H GLY 62 3.665 -5.548 6.458
461 HA2 GLY 62 1HA GLY 62 2.972 -4.540 3.769
462 HA3 GLY 62 2HA GLY 62 2.264 -5.975 4.495
463 H LEU 63 H LEU 63 0.562 -4.162 3.501
464 HA LEU 63 HA LEU 63 -0.237 -2.156 5.348
465 HB2 LEU 63 1HB LEU 63 -1.401 -3.395 2.905
466 HB3 LEU 63 2HB LEU 63 -2.459 -2.456 3.956
467 HG LEU 63 HG LEU 63 -0.504 -0.670 3.667
468 HD11 LEU 63 1HD1 LEU 63 -0.087 -2.647 1.529
469 HD12 LEU 63 2HD1 LEU 63 1.031 -1.482 2.238
470 HD13 LEU 63 3HD1 LEU 63 -0.125 -0.962 1.012
471 HD21 LEU 63 1HD2 LEU 63 -2.640 0.024 3.138
472 HD22 LEU 63 2HD2 LEU 63 -2.891 -1.276 1.973
473 HD23 LEU 63 3HD2 LEU 63 -1.842 0.083 1.566
474 H GLY 64 H GLY 64 -1.349 -5.458 4.692
475 HA2 GLY 64 1HA GLY 64 -3.525 -5.436 6.492
476 HA3 GLY 64 2HA GLY 64 -2.708 -6.870 5.889
477 H ILE 65 H ILE 65 -0.151 -5.569 7.048
478 HA ILE 65 HA ILE 65 -0.011 -7.097 9.381
479 HB ILE 65 HB ILE 65 1.641 -4.691 8.602
480 HG12 ILE 65 1HG1 ILE 65 1.944 -6.336 6.937
481 HG13 ILE 65 2HG1 ILE 65 3.302 -6.561 8.034
482 HG21 ILE 65 1HG2 ILE 65 1.786 -5.134 10.998
483 HG22 ILE 65 2HG2 ILE 65 2.195 -6.817 10.668
484 HG23 ILE 65 3HG2 ILE 65 3.300 -5.530 10.186
485 HD11 ILE 65 1HD1 ILE 65 0.842 -8.247 7.742
486 HD12 ILE 65 2HD1 ILE 65 2.532 -8.712 7.540
487 HD13 ILE 65 3HD1 ILE 65 1.900 -8.358 9.148
488 H TYR 66 H TYR 66 -0.580 -3.614 8.972
489 HA TYR 66 HA TYR 66 -1.149 -3.367 11.829
490 HB2 TYR 66 1HB TYR 66 -0.874 -1.287 9.652
491 HB3 TYR 66 2HB TYR 66 -1.254 -0.919 11.331
492 HD1 TYR 66 2HD TYR 66 0.439 -1.350 13.100
493 HD2 TYR 66 1HD TYR 66 1.355 -1.774 8.967
494 HE1 TYR 66 2HE TYR 66 2.840 -1.275 13.630
495 HE2 TYR 66 1HE TYR 66 3.759 -1.701 9.485
496 HH TYR 66 HH TYR 66 5.107 -2.334 12.044
497 H GLY 67 H GLY 67 -2.972 -4.864 10.216
498 HA2 GLY 67 1HA GLY 67 -5.201 -4.983 9.620
499 HA3 GLY 67 2HA GLY 67 -5.414 -4.094 11.121
500 H ILE 68 H ILE 68 -3.797 -2.860 8.251
501 HA ILE 68 HA ILE 68 -5.505 -0.547 8.239
502 HB ILE 68 HB ILE 68 -3.284 -1.383 6.374
503 HG12 ILE 68 1HG1 ILE 68 -3.344 0.801 8.463
504 HG13 ILE 68 2HG1 ILE 68 -2.690 -0.808 8.751
505 HG21 ILE 68 1HG2 ILE 68 -5.018 0.080 5.316
506 HG22 ILE 68 2HG2 ILE 68 -4.627 1.307 6.519
507 HG23 ILE 68 3HG2 ILE 68 -3.399 0.776 5.370
508 HD11 ILE 68 1HD1 ILE 68 -1.051 -0.437 6.962
509 HD12 ILE 68 2HD1 ILE 68 -1.685 1.196 6.746
510 HD13 ILE 68 3HD1 ILE 68 -0.913 0.743 8.266
511 H GLN 69 H GLN 69 -7.216 -0.144 6.976
512 HA GLN 69 HA GLN 69 -7.702 -1.859 4.647
513 HB2 GLN 69 1HB GLN 69 -9.673 -1.278 6.860
514 HB3 GLN 69 2HB GLN 69 -10.127 -1.955 5.301
515 HG2 GLN 69 1HG GLN 69 -8.616 -3.865 5.742
516 HG3 GLN 69 2HG GLN 69 -8.309 -3.203 7.347
517 HE21 GLN 69 1HE2 GLN 69 -9.954 -3.229 8.887
518 HE22 GLN 69 2HE2 GLN 69 -11.341 -4.247 8.725
519 H ASP 70 H ASP 70 -9.497 -0.971 3.262
520 HA ASP 70 HA ASP 70 -8.933 1.528 2.315
521 HB2 ASP 70 1HB ASP 70 -11.158 1.494 1.233
522 HB3 ASP 70 2HB ASP 70 -10.315 -0.045 1.076
523 H SER 71 H SER 71 -10.171 3.539 2.355
524 HA SER 71 HA SER 71 -11.063 5.330 3.437
525 HB2 SER 71 1HB SER 71 -12.530 3.379 5.213
526 HB3 SER 71 2HB SER 71 -13.016 5.012 4.758
527 HG SER 71 HG SER 71 -14.080 3.248 3.604
528 H ASP 72 H ASP 72 -8.558 4.396 4.294
529 HA ASP 72 HA ASP 72 -8.640 4.904 7.194
530 HB2 ASP 72 1HB ASP 72 -6.864 3.243 5.471
531 HB3 ASP 72 2HB ASP 72 -6.151 4.007 6.889
532 H THR 73 H THR 73 -6.721 6.098 8.053
533 HA THR 73 HA THR 73 -5.896 8.214 6.172
534 HB THR 73 HB THR 73 -6.429 8.517 9.134
535 HG1 THR 73 1HG THR 73 -8.101 9.994 8.135
536 HG21 THR 73 1HG2 THR 73 -6.316 10.995 7.759
537 HG22 THR 73 2HG2 THR 73 -4.872 10.078 7.327
538 HG23 THR 73 3HG2 THR 73 -5.242 10.397 9.022
539 H LEU 74 H LEU 74 -3.776 8.725 6.073
540 HA LEU 74 HA LEU 74 -1.970 7.441 8.014
541 HB2 LEU 74 1HB LEU 74 -1.454 7.837 5.071
542 HB3 LEU 74 2HB LEU 74 -0.363 7.082 6.231
543 HG LEU 74 HG LEU 74 -3.063 5.974 5.469
544 HD11 LEU 74 1HD1 LEU 74 -0.442 5.791 4.171
545 HD12 LEU 74 2HD1 LEU 74 -2.054 5.472 3.532
546 HD13 LEU 74 3HD1 LEU 74 -1.222 4.239 4.480
547 HD21 LEU 74 1HD2 LEU 74 -0.811 5.034 7.208
548 HD22 LEU 74 2HD2 LEU 74 -1.910 3.884 6.444
549 HD23 LEU 74 3HD2 LEU 74 -2.539 5.099 7.558
550 H ILE 75 H ILE 75 -0.590 8.763 9.007
551 HA ILE 75 HA ILE 75 -0.564 11.568 8.294
552 HB ILE 75 HB ILE 75 0.911 10.169 10.527
553 HG12 ILE 75 1HG1 ILE 75 -1.460 9.832 10.825
554 HG13 ILE 75 2HG1 ILE 75 -0.932 11.072 11.957
555 HG21 ILE 75 1HG2 ILE 75 1.809 12.377 9.862
556 HG22 ILE 75 2HG2 ILE 75 0.227 13.085 10.186
557 HG23 ILE 75 3HG2 ILE 75 1.155 12.361 11.500
558 HD11 ILE 75 1HD1 ILE 75 -2.585 12.329 11.199
559 HD12 ILE 75 2HD1 ILE 75 -1.702 12.463 9.677
560 HD13 ILE 75 3HD1 ILE 75 -2.918 11.202 9.884
561 H LEU 76 H LEU 76 0.928 12.525 7.085
562 HA LEU 76 HA LEU 76 3.424 11.071 6.531
563 HB2 LEU 76 1HB LEU 76 1.975 11.522 4.596
564 HB3 LEU 76 2HB LEU 76 2.085 13.248 4.932
565 HG LEU 76 HG LEU 76 4.592 13.002 4.573
566 HD11 LEU 76 1HD1 LEU 76 3.710 10.267 4.115
567 HD12 LEU 76 2HD1 LEU 76 5.326 10.902 4.421
568 HD13 LEU 76 3HD1 LEU 76 4.669 10.916 2.785
569 HD21 LEU 76 1HD2 LEU 76 2.503 12.751 2.448
570 HD22 LEU 76 2HD2 LEU 76 4.211 12.806 2.013
571 HD23 LEU 76 3HD2 LEU 76 3.482 14.147 2.897
572 H SER 77 H SER 77 5.254 11.852 7.329
573 HA SER 77 HA SER 77 5.533 14.733 7.759
574 HB2 SER 77 1HB SER 77 5.716 12.607 9.867
575 HB3 SER 77 2HB SER 77 6.719 14.052 9.996
576 HG SER 77 HG SER 77 3.925 13.802 10.098
577 H LYS 78 H LYS 78 7.474 15.482 7.171
578 HA LYS 78 HA LYS 78 9.370 13.715 5.973
579 HB2 LYS 78 1HB LYS 78 8.767 16.238 5.460
580 HB3 LYS 78 2HB LYS 78 10.052 16.552 6.619
581 HG2 LYS 78 1HG LYS 78 11.512 15.045 5.209
582 HG3 LYS 78 2HG LYS 78 10.238 15.114 3.989
583 HD2 LYS 78 1HD LYS 78 10.451 17.691 4.311
584 HD3 LYS 78 2HD LYS 78 12.030 17.291 4.990
585 HE2 LYS 78 1HE LYS 78 12.619 16.117 2.929
586 HE3 LYS 78 2HE LYS 78 11.035 16.497 2.253
587 HZ1 LYS 78 1HZ LYS 78 12.232 18.874 3.142
588 HZ2 LYS 78 2HZ LYS 78 11.824 18.430 1.562
589 HZ3 LYS 78 3HZ LYS 78 13.352 18.049 2.179
590 H LYS 79 H LYS 79 11.379 13.098 6.668
591 HA LYS 79 HA LYS 79 11.807 12.786 9.420
592 HB2 LYS 79 1HB LYS 79 13.814 12.625 7.164
593 HB3 LYS 79 2HB LYS 79 14.059 12.002 8.790
594 HG2 LYS 79 1HG LYS 79 11.684 11.056 7.282
595 HG3 LYS 79 2HG LYS 79 13.273 10.455 6.802
596 HD2 LYS 79 1HD LYS 79 13.670 9.782 9.161
597 HD3 LYS 79 2HD LYS 79 12.016 10.269 9.539
598 HE2 LYS 79 1HE LYS 79 11.714 8.029 9.165
599 HE3 LYS 79 2HE LYS 79 11.429 8.664 7.545
600 HZ1 LYS 79 1HZ LYS 79 14.185 8.147 7.935
601 HZ2 LYS 79 2HZ LYS 79 13.135 7.503 6.777
602 HZ3 LYS 79 3HZ LYS 79 13.284 6.759 8.289
603 H LYS 80 H LYS 80 13.081 13.840 10.895
604 HA LYS 80 HA LYS 80 13.497 16.619 10.512
605 HB2 LYS 80 1HB LYS 80 14.572 16.531 12.749
606 HB3 LYS 80 2HB LYS 80 12.989 15.764 12.713
607 HG2 LYS 80 1HG LYS 80 14.419 13.600 12.267
608 HG3 LYS 80 2HG LYS 80 15.680 14.553 13.053
609 HD2 LYS 80 1HD LYS 80 14.168 14.919 14.968
610 HD3 LYS 80 2HD LYS 80 12.959 13.898 14.185
611 HE2 LYS 80 1HE LYS 80 15.737 12.910 14.753
612 HE3 LYS 80 2HE LYS 80 14.462 12.832 15.967
613 HZ1 LYS 80 1HZ LYS 80 14.899 11.163 13.696
614 HZ2 LYS 80 2HZ LYS 80 13.330 11.796 13.702
615 HZ3 LYS 80 3HZ LYS 80 13.892 10.916 15.033
616 H GLY 81 H GLY 81 15.732 13.862 10.756
617 HA2 GLY 81 1HA GLY 81 17.683 15.392 9.200
618 HA3 GLY 81 2HA GLY 81 18.186 14.809 10.779
619 H SER 82 H SER 82 19.331 14.127 8.228
620 HA SER 82 HA SER 82 18.442 11.491 7.519
621 HB2 SER 82 1HB SER 82 19.518 13.054 5.897
622 HB3 SER 82 2HB SER 82 21.033 12.872 6.780
623 HG SER 82 HG SER 82 20.536 10.483 6.375
624 H GLY 83 H GLY 83 21.373 12.784 9.089
625 HA2 GLY 83 1HA GLY 83 21.513 10.463 10.807
626 HA3 GLY 83 2HA GLY 83 22.800 10.547 9.614
627 HA PRO 84 HA PRO 84 23.447 13.389 13.454
628 HB2 PRO 84 1HB PRO 84 24.660 11.686 15.185
629 HB3 PRO 84 2HB PRO 84 22.915 11.964 15.176
630 HG2 PRO 84 1HG PRO 84 24.480 9.714 13.972
631 HG3 PRO 84 2HG PRO 84 22.959 9.658 14.882
632 HD2 PRO 84 1HD PRO 84 23.047 9.514 12.179
633 HD3 PRO 84 2HD PRO 84 21.697 10.267 13.052
634 H SER 85 H SER 85 25.016 14.426 12.263
635 HA SER 85 HA SER 85 27.045 14.751 11.198
636 HB2 SER 85 1HB SER 85 28.896 14.742 12.868
637 HB3 SER 85 2HB SER 85 27.440 15.543 13.459
638 HG SER 85 HG SER 85 27.917 12.811 13.977
639 H SER 86 H SER 86 26.152 12.312 10.369
640 HA SER 86 HA SER 86 28.190 10.308 10.811
641 HB2 SER 86 1HB SER 86 25.734 9.789 10.464
642 HB3 SER 86 2HB SER 86 25.960 10.234 8.772
643 HG SER 86 HG SER 86 27.106 8.087 10.203
644 H GLY 87 H GLY 87 27.040 12.248 8.055
645 HA2 GLY 87 1HA GLY 87 29.742 12.090 6.920
646 HA3 GLY 87 2HA GLY 87 28.388 11.580 5.924
Start of MODEL 20
1 H1 GLY 1 H GLY 1 -4.996 -12.163 -14.379
2 HA2 GLY 1 1HA GLY 1 -6.694 -11.531 -16.073
3 HA3 GLY 1 2HA GLY 1 -7.204 -10.281 -14.948
4 H SER 2 H SER 2 -6.861 -8.665 -16.510
5 HA SER 2 HA SER 2 -4.040 -8.173 -17.194
6 HB2 SER 2 1HB SER 2 -6.518 -7.088 -18.555
7 HB3 SER 2 2HB SER 2 -4.851 -6.837 -19.072
8 HG SER 2 HG SER 2 -6.183 -8.612 -20.078
9 H SER 3 H SER 3 -7.023 -6.303 -16.607
10 HA SER 3 HA SER 3 -5.530 -4.008 -15.735
11 HB2 SER 3 1HB SER 3 -7.826 -4.041 -16.922
12 HB3 SER 3 2HB SER 3 -8.489 -4.387 -15.325
13 HG SER 3 HG SER 3 -7.355 -2.057 -16.318
14 H GLY 4 H GLY 4 -7.782 -6.267 -14.139
15 HA2 GLY 4 1HA GLY 4 -7.931 -6.945 -11.951
16 HA3 GLY 4 2HA GLY 4 -6.263 -6.423 -11.765
17 H SER 5 H SER 5 -9.621 -5.378 -11.637
18 HA SER 5 HA SER 5 -8.859 -2.865 -10.372
19 HB2 SER 5 1HB SER 5 -11.559 -3.971 -11.178
20 HB3 SER 5 2HB SER 5 -11.312 -2.390 -10.436
21 HG SER 5 HG SER 5 -10.354 -1.672 -12.237
22 H SER 6 H SER 6 -8.059 -3.523 -8.381
23 HA SER 6 HA SER 6 -10.058 -4.034 -6.375
24 HB2 SER 6 1HB SER 6 -8.865 -6.056 -5.468
25 HB3 SER 6 2HB SER 6 -9.684 -6.325 -7.006
26 HG SER 6 HG SER 6 -7.003 -5.526 -7.042
27 H GLY 7 H GLY 7 -8.921 -4.279 -4.151
28 HA2 GLY 7 1HA GLY 7 -6.761 -3.791 -3.007
29 HA3 GLY 7 2HA GLY 7 -6.601 -2.447 -4.127
30 H ILE 8 H ILE 8 -6.312 -1.408 -1.908
31 HA ILE 8 HA ILE 8 -8.950 -0.561 -0.900
32 HB ILE 8 HB ILE 8 -7.909 -0.119 1.269
33 HG12 ILE 8 1HG1 ILE 8 -5.448 -1.608 0.462
34 HG13 ILE 8 2HG1 ILE 8 -5.568 0.099 0.049
35 HG21 ILE 8 1HG2 ILE 8 -8.386 -2.662 0.114
36 HG22 ILE 8 2HG2 ILE 8 -7.011 -2.813 1.206
37 HG23 ILE 8 3HG2 ILE 8 -8.543 -2.176 1.802
38 HD11 ILE 8 1HD1 ILE 8 -4.412 -0.048 2.104
39 HD12 ILE 8 2HD1 ILE 8 -6.032 0.542 2.473
40 HD13 ILE 8 3HD1 ILE 8 -5.616 -1.143 2.782
41 H GLN 9 H GLN 9 -9.177 1.635 -0.270
42 HA GLN 9 HA GLN 9 -7.294 3.424 -1.649
43 HB2 GLN 9 1HB GLN 9 -9.862 3.275 -2.190
44 HB3 GLN 9 2HB GLN 9 -10.016 4.296 -0.766
45 HG2 GLN 9 1HG GLN 9 -8.962 6.078 -1.758
46 HG3 GLN 9 2HG GLN 9 -8.092 5.062 -2.906
47 HE21 GLN 9 1HE2 GLN 9 -8.698 5.703 -4.853
48 HE22 GLN 9 2HE2 GLN 9 -10.328 5.908 -5.387
49 H VAL 10 H VAL 10 -5.950 4.521 -0.398
50 HA VAL 10 HA VAL 10 -6.800 5.184 2.347
51 HB VAL 10 HB VAL 10 -4.414 5.239 2.953
52 HG11 VAL 10 1HG1 VAL 10 -5.968 2.935 2.300
53 HG12 VAL 10 2HG1 VAL 10 -4.264 2.587 1.999
54 HG13 VAL 10 3HG1 VAL 10 -4.784 3.145 3.589
55 HG21 VAL 10 1HG2 VAL 10 -4.086 4.568 0.058
56 HG22 VAL 10 2HG2 VAL 10 -3.216 5.748 1.039
57 HG23 VAL 10 3HG2 VAL 10 -2.887 4.026 1.233
58 H PHE 11 H PHE 11 -6.280 7.228 3.180
59 HA PHE 11 HA PHE 11 -5.815 9.262 1.113
60 HB2 PHE 11 1HB PHE 11 -7.121 9.445 3.833
61 HB3 PHE 11 2HB PHE 11 -6.798 10.839 2.807
62 HD1 PHE 11 2HD PHE 11 -8.651 7.638 2.969
63 HD2 PHE 11 1HD PHE 11 -8.275 11.441 1.096
64 HE1 PHE 11 2HE PHE 11 -10.797 7.280 1.820
65 HE2 PHE 11 1HE PHE 11 -10.420 11.090 -0.056
66 HZ PHE 11 HZ PHE 11 -11.683 9.007 0.304
67 H VAL 12 H VAL 12 -3.782 9.936 0.998
68 HA VAL 12 HA VAL 12 -2.051 9.834 3.333
69 HB VAL 12 HB VAL 12 -1.470 10.583 0.465
70 HG11 VAL 12 1HG1 VAL 12 0.851 9.918 2.014
71 HG12 VAL 12 2HG1 VAL 12 0.507 11.381 1.088
72 HG13 VAL 12 3HG1 VAL 12 -0.016 11.256 2.768
73 HG21 VAL 12 1HG2 VAL 12 -1.983 8.125 1.360
74 HG22 VAL 12 2HG2 VAL 12 -0.780 8.446 0.111
75 HG23 VAL 12 3HG2 VAL 12 -0.274 8.215 1.785
76 H LYS 13 H LYS 13 -2.244 11.482 4.711
77 HA LYS 13 HA LYS 13 -2.931 14.141 3.800
78 HB2 LYS 13 1HB LYS 13 -3.751 13.048 5.958
79 HB3 LYS 13 2HB LYS 13 -2.140 13.346 6.599
80 HG2 LYS 13 1HG LYS 13 -2.429 15.737 6.254
81 HG3 LYS 13 2HG LYS 13 -4.031 15.453 5.571
82 HD2 LYS 13 1HD LYS 13 -4.887 14.706 7.644
83 HD3 LYS 13 2HD LYS 13 -3.273 14.562 8.343
84 HE2 LYS 13 1HE LYS 13 -3.016 16.894 8.494
85 HE3 LYS 13 2HE LYS 13 -4.368 17.196 7.403
86 HZ1 LYS 13 1HZ LYS 13 -5.796 16.136 9.173
87 HZ2 LYS 13 2HZ LYS 13 -5.158 17.657 9.546
88 HZ3 LYS 13 3HZ LYS 13 -4.465 16.264 10.211
89 H ASN 14 H ASN 14 -1.543 15.721 3.345
90 HA ASN 14 HA ASN 14 1.302 15.253 3.788
91 HB2 ASN 14 1HB ASN 14 1.539 17.312 2.322
92 HB3 ASN 14 2HB ASN 14 0.800 15.908 1.557
93 HD21 ASN 14 1HD2 ASN 14 -0.135 17.298 0.014
94 HD22 ASN 14 2HD2 ASN 14 -1.535 18.237 0.392
95 HA PRO 15 HA PRO 15 1.660 18.037 7.170
96 HB2 PRO 15 1HB PRO 15 4.228 18.854 6.840
97 HB3 PRO 15 2HB PRO 15 3.800 17.240 7.420
98 HG2 PRO 15 1HG PRO 15 4.589 18.118 4.669
99 HG3 PRO 15 2HG PRO 15 5.094 16.678 5.571
100 HD2 PRO 15 1HD PRO 15 3.188 16.598 3.650
101 HD3 PRO 15 2HD PRO 15 3.161 15.528 5.067
102 H ASP 16 H ASP 16 1.439 19.034 4.033
103 HA ASP 16 HA ASP 16 1.944 21.861 4.638
104 HB2 ASP 16 1HB ASP 16 2.948 20.817 2.576
105 HB3 ASP 16 2HB ASP 16 1.312 20.633 1.950
106 H GLY 17 H GLY 17 -0.572 19.617 3.621
107 HA2 GLY 17 1HA GLY 17 -2.782 20.337 4.690
108 HA3 GLY 17 2HA GLY 17 -2.536 21.812 3.767
109 H GLY 18 H GLY 18 -3.858 18.707 3.753
110 HA2 GLY 18 1HA GLY 18 -5.537 18.486 1.890
111 HA3 GLY 18 2HA GLY 18 -4.181 18.801 0.818
112 H SER 19 H SER 19 -6.088 16.440 1.409
113 HA SER 19 HA SER 19 -3.980 14.392 1.644
114 HB2 SER 19 1HB SER 19 -5.945 14.588 3.397
115 HB3 SER 19 2HB SER 19 -6.857 13.739 2.148
116 HG SER 19 HG SER 19 -4.445 12.881 3.377
117 H TYR 20 H TYR 20 -3.889 12.769 0.145
118 HA TYR 20 HA TYR 20 -5.692 13.053 -2.168
119 HB2 TYR 20 1HB TYR 20 -3.005 11.731 -2.341
120 HB3 TYR 20 2HB TYR 20 -3.939 12.519 -3.608
121 HD1 TYR 20 2HD TYR 20 -4.289 15.101 -3.303
122 HD2 TYR 20 1HD TYR 20 -1.218 12.860 -1.393
123 HE1 TYR 20 2HE TYR 20 -2.989 17.165 -2.985
124 HE2 TYR 20 1HE TYR 20 0.090 14.917 -1.068
125 HH TYR 20 HH TYR 20 -0.037 17.433 -2.563
126 H ALA 21 H ALA 21 -6.460 11.185 -3.198
127 HA ALA 21 HA ALA 21 -6.635 8.864 -1.433
128 HB1 ALA 21 1HB ALA 21 -8.679 9.955 -2.422
129 HB2 ALA 21 2HB ALA 21 -8.164 9.318 -3.984
130 HB3 ALA 21 3HB ALA 21 -8.550 8.213 -2.665
131 H TYR 22 H TYR 22 -5.085 7.393 -1.698
132 HA TYR 22 HA TYR 22 -4.025 6.888 -4.384
133 HB2 TYR 22 1HB TYR 22 -3.001 6.379 -1.612
134 HB3 TYR 22 2HB TYR 22 -2.368 5.447 -2.964
135 HD1 TYR 22 2HD TYR 22 -2.797 8.898 -1.675
136 HD2 TYR 22 1HD TYR 22 -0.745 6.363 -4.407
137 HE1 TYR 22 2HE TYR 22 -1.244 10.732 -2.201
138 HE2 TYR 22 1HE TYR 22 0.814 8.189 -4.940
139 HH TYR 22 HH TYR 22 0.289 11.271 -4.401
140 H ALA 23 H ALA 23 -3.580 4.621 -4.981
141 HA ALA 23 HA ALA 23 -5.575 2.763 -3.863
142 HB1 ALA 23 1HB ALA 23 -6.636 2.955 -5.823
143 HB2 ALA 23 2HB ALA 23 -5.243 3.696 -6.614
144 HB3 ALA 23 3HB ALA 23 -5.338 1.942 -6.456
145 H ILE 24 H ILE 24 -4.750 0.902 -3.176
146 HA ILE 24 HA ILE 24 -2.579 -0.406 -4.527
147 HB ILE 24 HB ILE 24 -1.107 0.941 -3.322
148 HG12 ILE 24 1HG1 ILE 24 -1.483 -1.319 -1.363
149 HG13 ILE 24 2HG1 ILE 24 -0.853 -1.590 -2.984
150 HG21 ILE 24 1HG2 ILE 24 -1.506 1.144 -0.733
151 HG22 ILE 24 2HG2 ILE 24 -2.330 2.216 -1.864
152 HG23 ILE 24 3HG2 ILE 24 -3.180 0.827 -1.188
153 HD11 ILE 24 1HD1 ILE 24 0.897 -1.385 -1.259
154 HD12 ILE 24 2HD1 ILE 24 1.034 -0.177 -2.538
155 HD13 ILE 24 3HD1 ILE 24 0.372 0.273 -0.966
156 H ASN 25 H ASN 25 -2.343 -2.566 -3.930
157 HA ASN 25 HA ASN 25 -4.645 -3.721 -2.659
158 HB2 ASN 25 1HB ASN 25 -2.140 -4.923 -3.847
159 HB3 ASN 25 2HB ASN 25 -3.426 -5.891 -3.132
160 HD21 ASN 25 1HD2 ASN 25 -4.013 -6.916 -4.994
161 HD22 ASN 25 2HD2 ASN 25 -4.763 -6.111 -6.326
162 HA PRO 26 HA PRO 26 -3.085 -4.043 1.444
163 HB2 PRO 26 1HB PRO 26 -4.585 -6.131 2.315
164 HB3 PRO 26 2HB PRO 26 -5.246 -4.511 2.068
165 HG2 PRO 26 1HG PRO 26 -5.384 -6.906 0.278
166 HG3 PRO 26 2HG PRO 26 -6.655 -5.739 0.685
167 HD2 PRO 26 1HD PRO 26 -5.269 -5.632 -1.639
168 HD3 PRO 26 2HD PRO 26 -5.880 -4.178 -0.824
169 H ASN 27 H ASN 27 -2.955 -6.703 -0.788
170 HA ASN 27 HA ASN 27 -1.434 -8.453 0.893
171 HB2 ASN 27 1HB ASN 27 -2.609 -9.595 -0.768
172 HB3 ASN 27 2HB ASN 27 -2.179 -8.427 -2.014
173 HD21 ASN 27 1HD2 ASN 27 -0.991 -9.387 -3.487
174 HD22 ASN 27 2HD2 ASN 27 0.318 -10.475 -3.190
175 H SER 28 H SER 28 -0.710 -5.896 -1.355
176 HA SER 28 HA SER 28 2.041 -6.546 -1.727
177 HB2 SER 28 1HB SER 28 0.282 -4.228 -2.371
178 HB3 SER 28 2HB SER 28 2.023 -3.952 -2.347
179 HG SER 28 HG SER 28 0.784 -6.045 -3.804
180 H PHE 29 H PHE 29 3.868 -5.465 -0.871
181 HA PHE 29 HA PHE 29 3.896 -5.135 1.885
182 HB2 PHE 29 1HB PHE 29 5.822 -3.956 -0.130
183 HB3 PHE 29 2HB PHE 29 6.136 -4.163 1.590
184 HD1 PHE 29 2HD PHE 29 5.388 -6.764 2.293
185 HD2 PHE 29 1HD PHE 29 7.010 -5.430 -1.409
186 HE1 PHE 29 2HE PHE 29 6.256 -9.026 1.862
187 HE2 PHE 29 1HE PHE 29 7.881 -7.689 -1.846
188 HZ PHE 29 HZ PHE 29 7.505 -9.490 -0.209
189 H ILE 30 H ILE 30 4.797 -3.028 2.931
190 HA ILE 30 HA ILE 30 2.762 -1.034 2.612
191 HB ILE 30 HB ILE 30 5.221 -1.047 4.365
192 HG12 ILE 30 1HG1 ILE 30 3.550 -2.833 4.832
193 HG13 ILE 30 2HG1 ILE 30 3.718 -1.683 6.154
194 HG21 ILE 30 1HG2 ILE 30 3.845 0.697 5.637
195 HG22 ILE 30 2HG2 ILE 30 4.647 1.208 4.153
196 HG23 ILE 30 3HG2 ILE 30 2.918 0.861 4.146
197 HD11 ILE 30 1HD1 ILE 30 1.430 -2.187 4.352
198 HD12 ILE 30 2HD1 ILE 30 1.463 -1.811 6.076
199 HD13 ILE 30 3HD1 ILE 30 1.694 -0.528 4.888
200 H LEU 31 H LEU 31 6.213 -1.261 1.903
201 HA LEU 31 HA LEU 31 6.818 1.348 1.288
202 HB2 LEU 31 1HB LEU 31 8.392 -0.579 1.292
203 HB3 LEU 31 2HB LEU 31 7.736 -1.062 -0.271
204 HG LEU 31 HG LEU 31 9.180 1.530 0.283
205 HD11 LEU 31 1HD1 LEU 31 10.465 -0.725 0.344
206 HD12 LEU 31 2HD1 LEU 31 11.102 0.616 -0.608
207 HD13 LEU 31 3HD1 LEU 31 10.236 -0.697 -1.405
208 HD21 LEU 31 1HD2 LEU 31 9.254 1.174 -2.388
209 HD22 LEU 31 2HD2 LEU 31 8.024 2.128 -1.557
210 HD23 LEU 31 3HD2 LEU 31 7.685 0.459 -2.019
211 H GLY 32 H GLY 32 5.377 -1.093 -0.860
212 HA2 GLY 32 1HA GLY 32 5.265 0.197 -3.245
213 HA3 GLY 32 2HA GLY 32 3.945 -0.798 -2.648
214 H LEU 33 H LEU 33 3.499 1.061 -0.368
215 HA LEU 33 HA LEU 33 1.589 2.740 -1.653
216 HB2 LEU 33 1HB LEU 33 1.055 1.892 0.498
217 HB3 LEU 33 2HB LEU 33 2.552 2.518 1.187
218 HG LEU 33 HG LEU 33 1.729 4.778 1.047
219 HD11 LEU 33 1HD1 LEU 33 -0.869 4.821 0.406
220 HD12 LEU 33 2HD1 LEU 33 -0.330 3.524 -0.659
221 HD13 LEU 33 3HD1 LEU 33 0.418 5.118 -0.762
222 HD21 LEU 33 1HD2 LEU 33 0.054 4.686 2.710
223 HD22 LEU 33 2HD2 LEU 33 1.065 3.262 2.959
224 HD23 LEU 33 3HD2 LEU 33 -0.504 3.103 2.168
225 H LYS 34 H LYS 34 4.681 3.326 -0.023
226 HA LYS 34 HA LYS 34 4.639 6.137 -0.248
227 HB2 LYS 34 1HB LYS 34 6.823 4.114 0.155
228 HB3 LYS 34 2HB LYS 34 7.207 5.817 -0.055
229 HG2 LYS 34 1HG LYS 34 7.080 5.767 2.203
230 HG3 LYS 34 2HG LYS 34 5.376 6.066 1.853
231 HD2 LYS 34 1HD LYS 34 5.154 4.307 3.288
232 HD3 LYS 34 2HD LYS 34 5.313 3.417 1.772
233 HE2 LYS 34 1HE LYS 34 7.606 2.954 2.190
234 HE3 LYS 34 2HE LYS 34 7.655 4.085 3.541
235 HZ1 LYS 34 1HZ LYS 34 7.500 2.011 4.539
236 HZ2 LYS 34 2HZ LYS 34 6.382 1.425 3.414
237 HZ3 LYS 34 3HZ LYS 34 5.902 2.564 4.569
238 H GLN 35 H GLN 35 6.147 3.638 -2.278
239 HA GLN 35 HA GLN 35 7.490 5.105 -4.118
240 HB2 GLN 35 1HB GLN 35 7.438 2.700 -4.249
241 HB3 GLN 35 2HB GLN 35 5.718 2.711 -4.614
242 HG2 GLN 35 1HG GLN 35 6.623 2.363 -6.687
243 HG3 GLN 35 2HG GLN 35 6.441 4.116 -6.678
244 HE21 GLN 35 1HE2 GLN 35 8.302 5.410 -6.323
245 HE22 GLN 35 2HE2 GLN 35 9.879 4.804 -6.682
246 H GLN 36 H GLN 36 4.002 4.735 -3.888
247 HA GLN 36 HA GLN 36 3.432 6.061 -6.353
248 HB2 GLN 36 1HB GLN 36 1.772 5.283 -3.969
249 HB3 GLN 36 2HB GLN 36 1.094 6.234 -5.283
250 HG2 GLN 36 1HG GLN 36 1.872 4.390 -6.833
251 HG3 GLN 36 2HG GLN 36 2.169 3.435 -5.381
252 HE21 GLN 36 1HE2 GLN 36 0.419 2.782 -4.111
253 HE22 GLN 36 2HE2 GLN 36 -1.196 2.772 -4.724
254 H ILE 37 H ILE 37 3.799 7.058 -3.014
255 HA ILE 37 HA ILE 37 2.766 9.699 -3.411
256 HB ILE 37 HB ILE 37 4.522 8.661 -1.183
257 HG12 ILE 37 1HG1 ILE 37 1.561 9.097 -0.982
258 HG13 ILE 37 2HG1 ILE 37 2.179 7.598 -1.666
259 HG21 ILE 37 1HG2 ILE 37 4.265 11.206 -1.645
260 HG22 ILE 37 2HG2 ILE 37 2.655 10.983 -0.962
261 HG23 ILE 37 3HG2 ILE 37 4.081 10.596 0.000
262 HD11 ILE 37 1HD1 ILE 37 2.509 6.784 0.358
263 HD12 ILE 37 2HD1 ILE 37 3.550 8.146 0.772
264 HD13 ILE 37 3HD1 ILE 37 1.810 8.253 1.039
265 H GLU 38 H GLU 38 5.929 8.192 -3.547
266 HA GLU 38 HA GLU 38 7.400 10.642 -3.642
267 HB2 GLU 38 1HB GLU 38 8.608 8.763 -2.882
268 HB3 GLU 38 2HB GLU 38 8.085 7.773 -4.237
269 HG2 GLU 38 1HG GLU 38 9.730 10.200 -4.758
270 HG3 GLU 38 2HG GLU 38 10.505 8.740 -4.146
271 H ASP 39 H ASP 39 6.360 8.279 -6.079
272 HA ASP 39 HA ASP 39 7.489 9.638 -8.290
273 HB2 ASP 39 1HB ASP 39 6.523 7.184 -8.024
274 HB3 ASP 39 2HB ASP 39 5.053 7.944 -8.629
275 H GLN 40 H GLN 40 4.625 10.133 -6.449
276 HA GLN 40 HA GLN 40 3.377 11.764 -8.518
277 HB2 GLN 40 1HB GLN 40 2.509 10.677 -5.873
278 HB3 GLN 40 2HB GLN 40 1.682 12.085 -6.526
279 HG2 GLN 40 1HG GLN 40 2.008 9.485 -8.003
280 HG3 GLN 40 2HG GLN 40 0.594 9.913 -7.042
281 HE21 GLN 40 1HE2 GLN 40 -0.729 11.637 -7.738
282 HE22 GLN 40 2HE2 GLN 40 -0.740 12.142 -9.390
283 H GLN 41 H GLN 41 4.210 12.204 -5.075
284 HA GLN 41 HA GLN 41 4.113 15.060 -5.299
285 HB2 GLN 41 1HB GLN 41 5.147 13.294 -3.074
286 HB3 GLN 41 2HB GLN 41 4.921 15.034 -2.960
287 HG2 GLN 41 1HG GLN 41 2.466 14.402 -3.701
288 HG3 GLN 41 2HG GLN 41 2.912 12.854 -2.986
289 HE21 GLN 41 1HE2 GLN 41 3.800 12.951 -0.771
290 HE22 GLN 41 2HE2 GLN 41 3.135 14.112 0.320
291 H GLY 42 H GLY 42 6.612 12.606 -5.377
292 HA2 GLY 42 1HA GLY 42 8.653 13.001 -6.571
293 HA3 GLY 42 2HA GLY 42 8.535 14.700 -6.135
294 H LEU 43 H LEU 43 7.760 13.707 -3.331
295 HA LEU 43 HA LEU 43 10.314 13.986 -2.175
296 HB2 LEU 43 1HB LEU 43 7.870 14.319 -1.229
297 HB3 LEU 43 2HB LEU 43 8.112 12.664 -0.672
298 HG LEU 43 HG LEU 43 10.191 14.695 -0.022
299 HD11 LEU 43 1HD1 LEU 43 9.000 15.825 1.522
300 HD12 LEU 43 2HD1 LEU 43 7.979 14.442 1.909
301 HD13 LEU 43 3HD1 LEU 43 7.647 15.407 0.471
302 HD21 LEU 43 1HD2 LEU 43 9.009 12.358 1.476
303 HD22 LEU 43 2HD2 LEU 43 10.377 13.343 1.999
304 HD23 LEU 43 3HD2 LEU 43 10.512 12.340 0.553
305 HA PRO 44 HA PRO 44 11.884 9.873 -2.483
306 HB2 PRO 44 1HB PRO 44 13.835 10.071 -0.605
307 HB3 PRO 44 2HB PRO 44 13.961 10.817 -2.203
308 HG2 PRO 44 1HG PRO 44 13.189 12.056 0.410
309 HG3 PRO 44 2HG PRO 44 14.255 12.690 -0.857
310 HD2 PRO 44 1HD PRO 44 11.685 13.496 -0.577
311 HD3 PRO 44 2HD PRO 44 12.492 13.408 -2.156
312 H LYS 45 H LYS 45 11.999 7.916 -1.301
313 HA LYS 45 HA LYS 45 10.025 7.668 0.748
314 HB2 LYS 45 1HB LYS 45 12.037 5.611 -0.179
315 HB3 LYS 45 2HB LYS 45 10.553 5.299 0.712
316 HG2 LYS 45 1HG LYS 45 9.213 5.660 -1.123
317 HG3 LYS 45 2HG LYS 45 10.415 6.667 -1.935
318 HD2 LYS 45 1HD LYS 45 10.046 4.356 -2.907
319 HD3 LYS 45 2HD LYS 45 11.718 4.791 -2.543
320 HE2 LYS 45 1HE LYS 45 10.103 3.386 -0.468
321 HE3 LYS 45 2HE LYS 45 10.733 2.460 -1.829
322 HZ1 LYS 45 1HZ LYS 45 12.162 3.737 0.371
323 HZ2 LYS 45 2HZ LYS 45 12.919 3.749 -1.141
324 HZ3 LYS 45 3HZ LYS 45 12.483 2.280 -0.426
325 H LYS 46 H LYS 46 13.440 8.137 0.706
326 HA LYS 46 HA LYS 46 13.955 7.128 3.337
327 HB2 LYS 46 1HB LYS 46 16.149 8.248 3.077
328 HB3 LYS 46 2HB LYS 46 15.753 7.205 1.717
329 HG2 LYS 46 1HG LYS 46 15.458 8.967 0.273
330 HG3 LYS 46 2HG LYS 46 15.094 10.108 1.570
331 HD2 LYS 46 1HD LYS 46 17.213 10.786 1.050
332 HD3 LYS 46 2HD LYS 46 17.588 9.560 2.263
333 HE2 LYS 46 1HE LYS 46 19.032 8.987 0.560
334 HE3 LYS 46 2HE LYS 46 17.649 7.951 0.214
335 HZ1 LYS 46 1HZ LYS 46 17.162 9.076 -1.658
336 HZ2 LYS 46 2HZ LYS 46 18.797 9.506 -1.602
337 HZ3 LYS 46 3HZ LYS 46 17.620 10.578 -1.029
338 H GLN 47 H GLN 47 12.089 9.595 2.464
339 HA GLN 47 HA GLN 47 12.782 11.166 4.854
340 HB2 GLN 47 1HB GLN 47 12.112 12.110 2.091
341 HB3 GLN 47 2HB GLN 47 11.709 13.113 3.478
342 HG2 GLN 47 1HG GLN 47 14.154 12.853 4.155
343 HG3 GLN 47 2HG GLN 47 14.412 12.246 2.520
344 HE21 GLN 47 1HE2 GLN 47 12.722 14.938 4.107
345 HE22 GLN 47 2HE2 GLN 47 13.270 16.152 3.008
346 H GLN 48 H GLN 48 10.262 10.094 2.633
347 HA GLN 48 HA GLN 48 8.114 11.120 4.230
348 HB2 GLN 48 1HB GLN 48 6.708 10.369 2.575
349 HB3 GLN 48 2HB GLN 48 8.205 10.524 1.666
350 HG2 GLN 48 1HG GLN 48 8.609 8.091 2.093
351 HG3 GLN 48 2HG GLN 48 6.981 8.009 2.763
352 HE21 GLN 48 1HE2 GLN 48 8.585 9.339 -0.114
353 HE22 GLN 48 2HE2 GLN 48 7.415 8.756 -1.244
354 H GLN 49 H GLN 49 7.452 10.273 6.080
355 HA GLN 49 HA GLN 49 7.623 7.356 6.435
356 HB2 GLN 49 1HB GLN 49 9.356 8.511 7.765
357 HB3 GLN 49 2HB GLN 49 8.102 9.451 8.562
358 HG2 GLN 49 1HG GLN 49 7.127 7.280 9.361
359 HG3 GLN 49 2HG GLN 49 8.580 6.491 8.750
360 HE21 GLN 49 1HE2 GLN 49 7.462 9.019 10.943
361 HE22 GLN 49 2HE2 GLN 49 8.758 8.861 12.074
362 H LEU 50 H LEU 50 5.614 6.598 6.424
363 HA LEU 50 HA LEU 50 3.415 8.239 7.395
364 HB2 LEU 50 1HB LEU 50 3.464 5.535 6.065
365 HB3 LEU 50 2HB LEU 50 1.998 6.392 6.536
366 HG LEU 50 HG LEU 50 3.909 7.744 4.692
367 HD11 LEU 50 1HD1 LEU 50 2.264 5.345 4.053
368 HD12 LEU 50 2HD1 LEU 50 3.854 5.815 3.455
369 HD13 LEU 50 3HD1 LEU 50 2.411 6.631 2.855
370 HD21 LEU 50 1HD2 LEU 50 1.233 7.989 3.896
371 HD22 LEU 50 2HD2 LEU 50 2.231 9.198 4.705
372 HD23 LEU 50 3HD2 LEU 50 1.229 8.102 5.656
373 H GLU 51 H GLU 51 2.320 7.907 9.246
374 HA GLU 51 HA GLU 51 3.057 5.555 10.860
375 HB2 GLU 51 1HB GLU 51 2.536 8.391 11.755
376 HB3 GLU 51 2HB GLU 51 2.627 7.027 12.860
377 HG2 GLU 51 1HG GLU 51 4.906 6.669 12.394
378 HG3 GLU 51 2HG GLU 51 4.861 7.726 10.984
379 H PHE 52 H PHE 52 1.445 4.435 11.853
380 HA PHE 52 HA PHE 52 -1.303 5.424 11.464
381 HB2 PHE 52 1HB PHE 52 -0.776 3.583 9.899
382 HB3 PHE 52 2HB PHE 52 -0.370 2.553 11.268
383 HD1 PHE 52 2HD PHE 52 -3.167 4.575 9.877
384 HD2 PHE 52 1HD PHE 52 -1.997 1.215 12.214
385 HE1 PHE 52 2HE PHE 52 -5.519 3.872 10.037
386 HE2 PHE 52 1HE PHE 52 -4.348 0.506 12.377
387 HZ PHE 52 HZ PHE 52 -6.112 1.835 11.289
388 H GLN 53 H GLN 53 -2.486 5.564 13.254
389 HA GLN 53 HA GLN 53 -3.072 5.478 15.453
390 HB2 GLN 53 1HB GLN 53 -2.221 2.656 14.877
391 HB3 GLN 53 2HB GLN 53 -2.757 3.119 16.487
392 HG2 GLN 53 1HG GLN 53 -4.329 3.215 13.929
393 HG3 GLN 53 2HG GLN 53 -4.619 2.201 15.342
394 HE21 GLN 53 1HE2 GLN 53 -6.195 4.328 13.864
395 HE22 GLN 53 2HE2 GLN 53 -6.748 5.382 15.116
396 H GLY 54 H GLY 54 -0.297 6.258 14.746
397 HA2 GLY 54 1HA GLY 54 1.434 7.094 16.044
398 HA3 GLY 54 2HA GLY 54 0.736 6.286 17.440
399 H GLN 55 H GLN 55 1.621 4.763 14.386
400 HA GLN 55 HA GLN 55 3.885 3.455 15.721
401 HB2 GLN 55 1HB GLN 55 3.204 1.308 15.189
402 HB3 GLN 55 2HB GLN 55 1.676 2.075 15.603
403 HG2 GLN 55 1HG GLN 55 1.613 2.574 13.021
404 HG3 GLN 55 2HG GLN 55 2.705 1.191 12.961
405 HE21 GLN 55 1HE2 GLN 55 1.148 -0.011 11.840
406 HE22 GLN 55 2HE2 GLN 55 -0.226 -0.684 12.641
407 H VAL 56 H VAL 56 5.660 3.163 14.476
408 HA VAL 56 HA VAL 56 5.698 4.456 11.895
409 HB VAL 56 HB VAL 56 7.929 3.039 13.359
410 HG11 VAL 56 1HG1 VAL 56 9.185 4.802 11.806
411 HG12 VAL 56 2HG1 VAL 56 8.802 3.167 11.265
412 HG13 VAL 56 3HG1 VAL 56 7.768 4.517 10.797
413 HG21 VAL 56 1HG2 VAL 56 8.450 5.730 13.453
414 HG22 VAL 56 2HG2 VAL 56 6.704 5.668 13.693
415 HG23 VAL 56 3HG2 VAL 56 7.774 4.771 14.770
416 H LEU 57 H LEU 57 4.933 3.354 10.205
417 HA LEU 57 HA LEU 57 4.994 0.501 10.042
418 HB2 LEU 57 1HB LEU 57 4.451 2.442 7.807
419 HB3 LEU 57 2HB LEU 57 3.940 0.758 7.916
420 HG LEU 57 HG LEU 57 2.956 2.896 9.795
421 HD11 LEU 57 1HD1 LEU 57 2.384 3.454 7.455
422 HD12 LEU 57 2HD1 LEU 57 0.973 3.070 8.441
423 HD13 LEU 57 3HD1 LEU 57 1.602 1.880 7.301
424 HD21 LEU 57 1HD2 LEU 57 1.034 1.115 9.812
425 HD22 LEU 57 2HD2 LEU 57 2.475 0.892 10.805
426 HD23 LEU 57 3HD2 LEU 57 2.317 0.032 9.273
427 H GLN 58 H GLN 58 6.160 -0.796 8.593
428 HA GLN 58 HA GLN 58 8.775 0.294 7.896
429 HB2 GLN 58 1HB GLN 58 7.839 -2.574 7.742
430 HB3 GLN 58 2HB GLN 58 9.499 -1.995 7.670
431 HG2 GLN 58 1HG GLN 58 7.737 -1.594 10.068
432 HG3 GLN 58 2HG GLN 58 8.759 -3.013 9.851
433 HE21 GLN 58 1HE2 GLN 58 9.219 -1.608 12.033
434 HE22 GLN 58 2HE2 GLN 58 10.662 -0.668 11.901
435 H ASP 59 H ASP 59 9.661 -1.075 5.829
436 HA ASP 59 HA ASP 59 7.864 -0.278 3.649
437 HB2 ASP 59 1HB ASP 59 10.159 -0.698 2.355
438 HB3 ASP 59 2HB ASP 59 9.810 0.825 3.170
439 H TRP 60 H TRP 60 9.593 -2.984 5.005
440 HA TRP 60 HA TRP 60 9.038 -4.710 2.748
441 HB2 TRP 60 1HB TRP 60 10.335 -6.333 3.832
442 HB3 TRP 60 2HB TRP 60 11.095 -4.816 4.304
443 HD1 TRP 60 HD TRP 60 8.964 -7.664 5.727
444 HE1 TRP 60 1HE TRP 60 9.089 -7.576 8.297
445 HE3 TRP 60 3HE TRP 60 11.494 -3.255 6.266
446 HZ2 TRP 60 2HZ TRP 60 10.123 -5.864 10.288
447 HZ3 TRP 60 3HZ TRP 60 12.011 -2.462 8.537
448 HH2 TRP 60 HH TRP 60 11.339 -3.740 10.505
449 H LEU 61 H LEU 61 7.761 -4.095 5.957
450 HA LEU 61 HA LEU 61 6.136 -6.344 6.255
451 HB2 LEU 61 1HB LEU 61 5.711 -3.520 7.216
452 HB3 LEU 61 2HB LEU 61 4.773 -4.910 7.758
453 HG LEU 61 HG LEU 61 7.736 -4.516 8.182
454 HD11 LEU 61 1HD1 LEU 61 5.489 -4.399 10.184
455 HD12 LEU 61 2HD1 LEU 61 6.272 -2.985 9.481
456 HD13 LEU 61 3HD1 LEU 61 7.202 -4.102 10.479
457 HD21 LEU 61 1HD2 LEU 61 7.191 -6.860 7.994
458 HD22 LEU 61 2HD2 LEU 61 5.844 -6.672 9.116
459 HD23 LEU 61 3HD2 LEU 61 7.501 -6.464 9.684
460 H GLY 62 H GLY 62 3.673 -6.243 6.263
461 HA2 GLY 62 1HA GLY 62 2.814 -5.144 3.667
462 HA3 GLY 62 2HA GLY 62 2.106 -6.547 4.452
463 H LEU 63 H LEU 63 0.357 -4.767 3.587
464 HA LEU 63 HA LEU 63 -0.237 -2.710 5.485
465 HB2 LEU 63 1HB LEU 63 -1.548 -3.838 3.065
466 HB3 LEU 63 2HB LEU 63 -2.533 -2.899 4.185
467 HG LEU 63 HG LEU 63 -0.546 -1.160 3.871
468 HD11 LEU 63 1HD1 LEU 63 0.298 -3.080 2.138
469 HD12 LEU 63 2HD1 LEU 63 0.729 -1.373 2.043
470 HD13 LEU 63 3HD1 LEU 63 -0.599 -2.003 1.068
471 HD21 LEU 63 1HD2 LEU 63 -2.531 -0.230 3.345
472 HD22 LEU 63 2HD2 LEU 63 -3.084 -1.649 2.455
473 HD23 LEU 63 3HD2 LEU 63 -1.984 -0.501 1.690
474 H GLY 64 H GLY 64 -1.346 -6.005 4.917
475 HA2 GLY 64 1HA GLY 64 -3.448 -5.870 6.873
476 HA3 GLY 64 2HA GLY 64 -2.862 -7.318 6.068
477 H ILE 65 H ILE 65 -0.064 -6.633 6.933
478 HA ILE 65 HA ILE 65 0.084 -8.256 9.188
479 HB ILE 65 HB ILE 65 2.053 -6.156 8.274
480 HG12 ILE 65 1HG1 ILE 65 1.546 -7.889 6.588
481 HG13 ILE 65 2HG1 ILE 65 3.200 -8.012 7.179
482 HG21 ILE 65 1HG2 ILE 65 3.263 -8.358 9.625
483 HG22 ILE 65 2HG2 ILE 65 3.307 -6.645 10.036
484 HG23 ILE 65 3HG2 ILE 65 2.010 -7.667 10.656
485 HD11 ILE 65 1HD1 ILE 65 2.676 -10.192 7.312
486 HD12 ILE 65 2HD1 ILE 65 1.985 -9.710 8.862
487 HD13 ILE 65 3HD1 ILE 65 0.946 -9.881 7.447
488 H TYR 66 H TYR 66 0.157 -4.711 8.965
489 HA TYR 66 HA TYR 66 0.309 -4.363 11.807
490 HB2 TYR 66 1HB TYR 66 0.000 -2.542 9.452
491 HB3 TYR 66 2HB TYR 66 -0.353 -1.928 11.064
492 HD1 TYR 66 2HD TYR 66 1.516 -2.353 12.858
493 HD2 TYR 66 1HD TYR 66 2.170 -2.425 8.654
494 HE1 TYR 66 2HE TYR 66 3.912 -1.943 13.229
495 HE2 TYR 66 1HE TYR 66 4.569 -2.016 9.014
496 HH TYR 66 HH TYR 66 5.841 -0.911 11.843
497 H GLY 67 H GLY 67 -2.241 -3.966 9.361
498 HA2 GLY 67 1HA GLY 67 -4.461 -4.848 10.085
499 HA3 GLY 67 2HA GLY 67 -4.205 -3.945 11.570
500 H ILE 68 H ILE 68 -3.260 -2.638 8.485
501 HA ILE 68 HA ILE 68 -4.824 -0.298 8.871
502 HB ILE 68 HB ILE 68 -3.377 -1.262 6.402
503 HG12 ILE 68 1HG1 ILE 68 -2.473 0.930 8.245
504 HG13 ILE 68 2HG1 ILE 68 -2.116 -0.752 8.623
505 HG21 ILE 68 1HG2 ILE 68 -3.448 1.225 5.844
506 HG22 ILE 68 2HG2 ILE 68 -4.940 0.309 5.639
507 HG23 ILE 68 3HG2 ILE 68 -4.725 1.339 7.054
508 HD11 ILE 68 1HD1 ILE 68 -1.116 0.938 6.382
509 HD12 ILE 68 2HD1 ILE 68 -0.223 -0.087 7.507
510 HD13 ILE 68 3HD1 ILE 68 -1.169 -0.816 6.210
511 H GLN 69 H GLN 69 -6.498 0.515 7.481
512 HA GLN 69 HA GLN 69 -8.025 -1.569 6.075
513 HB2 GLN 69 1HB GLN 69 -10.103 -0.669 6.967
514 HB3 GLN 69 2HB GLN 69 -9.040 -1.157 8.280
515 HG2 GLN 69 1HG GLN 69 -8.545 1.051 8.857
516 HG3 GLN 69 2HG GLN 69 -9.147 1.679 7.324
517 HE21 GLN 69 1HE2 GLN 69 -10.365 3.146 8.678
518 HE22 GLN 69 2HE2 GLN 69 -11.872 2.630 9.347
519 H ASP 70 H ASP 70 -9.919 -0.404 4.826
520 HA ASP 70 HA ASP 70 -8.627 1.402 2.995
521 HB2 ASP 70 1HB ASP 70 -10.650 1.201 1.664
522 HB3 ASP 70 2HB ASP 70 -10.148 -0.394 2.219
523 H SER 71 H SER 71 -10.130 3.272 2.150
524 HA SER 71 HA SER 71 -10.630 5.462 2.632
525 HB2 SER 71 1HB SER 71 -12.806 5.702 3.476
526 HB3 SER 71 2HB SER 71 -12.798 4.056 2.843
527 HG SER 71 HG SER 71 -13.692 4.316 5.004
528 H ASP 72 H ASP 72 -8.603 4.191 4.398
529 HA ASP 72 HA ASP 72 -9.036 5.471 6.971
530 HB2 ASP 72 1HB ASP 72 -7.855 3.170 6.463
531 HB3 ASP 72 2HB ASP 72 -6.443 4.192 6.207
532 H THR 73 H THR 73 -7.208 6.779 7.900
533 HA THR 73 HA THR 73 -6.171 8.620 5.845
534 HB THR 73 HB THR 73 -6.887 9.236 8.718
535 HG1 THR 73 1HG THR 73 -8.540 8.968 6.860
536 HG21 THR 73 1HG2 THR 73 -5.203 10.751 8.307
537 HG22 THR 73 2HG2 THR 73 -6.596 11.640 7.690
538 HG23 THR 73 3HG2 THR 73 -5.522 10.797 6.574
539 H LEU 74 H LEU 74 -4.038 8.696 5.626
540 HA LEU 74 HA LEU 74 -2.366 7.708 7.839
541 HB2 LEU 74 1HB LEU 74 -1.718 7.839 4.897
542 HB3 LEU 74 2HB LEU 74 -0.684 7.175 6.161
543 HG LEU 74 HG LEU 74 -3.391 6.033 5.507
544 HD11 LEU 74 1HD1 LEU 74 -2.537 4.685 3.889
545 HD12 LEU 74 2HD1 LEU 74 -0.909 4.714 4.565
546 HD13 LEU 74 3HD1 LEU 74 -1.505 6.094 3.643
547 HD21 LEU 74 1HD2 LEU 74 -2.812 4.265 6.861
548 HD22 LEU 74 2HD2 LEU 74 -2.056 5.612 7.712
549 HD23 LEU 74 3HD2 LEU 74 -1.081 4.557 6.688
550 H ILE 75 H ILE 75 -0.715 8.934 8.612
551 HA ILE 75 HA ILE 75 -0.681 11.729 7.789
552 HB ILE 75 HB ILE 75 0.760 10.402 10.088
553 HG12 ILE 75 1HG1 ILE 75 -1.627 10.205 10.413
554 HG13 ILE 75 2HG1 ILE 75 -1.020 11.469 11.476
555 HG21 ILE 75 1HG2 ILE 75 1.868 12.428 9.501
556 HG22 ILE 75 2HG2 ILE 75 0.338 13.290 9.350
557 HG23 ILE 75 3HG2 ILE 75 0.896 12.756 10.935
558 HD11 ILE 75 1HD1 ILE 75 -3.003 11.607 9.390
559 HD12 ILE 75 2HD1 ILE 75 -2.625 12.761 10.670
560 HD13 ILE 75 3HD1 ILE 75 -1.728 12.802 9.152
561 H LEU 76 H LEU 76 1.128 12.820 7.064
562 HA LEU 76 HA LEU 76 3.392 11.121 6.243
563 HB2 LEU 76 1HB LEU 76 2.084 11.876 4.340
564 HB3 LEU 76 2HB LEU 76 2.240 13.548 4.875
565 HG LEU 76 HG LEU 76 4.794 13.115 4.590
566 HD11 LEU 76 1HD1 LEU 76 3.637 10.672 3.573
567 HD12 LEU 76 2HD1 LEU 76 5.324 11.075 3.890
568 HD13 LEU 76 3HD1 LEU 76 4.594 11.497 2.342
569 HD21 LEU 76 1HD2 LEU 76 3.130 13.294 2.091
570 HD22 LEU 76 2HD2 LEU 76 4.696 14.036 2.421
571 HD23 LEU 76 3HD2 LEU 76 3.252 14.618 3.251
572 H SER 77 H SER 77 5.399 11.733 6.807
573 HA SER 77 HA SER 77 5.881 14.463 7.721
574 HB2 SER 77 1HB SER 77 7.171 13.383 9.716
575 HB3 SER 77 2HB SER 77 5.422 13.577 9.830
576 HG SER 77 HG SER 77 5.371 11.342 8.948
577 H LYS 78 H LYS 78 7.910 15.184 7.309
578 HA LYS 78 HA LYS 78 9.599 13.485 5.681
579 HB2 LYS 78 1HB LYS 78 10.144 16.332 6.517
580 HB3 LYS 78 2HB LYS 78 10.816 15.467 5.141
581 HG2 LYS 78 1HG LYS 78 8.870 15.648 3.908
582 HG3 LYS 78 2HG LYS 78 7.868 15.908 5.337
583 HD2 LYS 78 1HD LYS 78 8.072 17.982 4.122
584 HD3 LYS 78 2HD LYS 78 8.954 18.113 5.645
585 HE2 LYS 78 1HE LYS 78 11.007 18.102 4.613
586 HE3 LYS 78 2HE LYS 78 10.416 17.213 3.210
587 HZ1 LYS 78 1HZ LYS 78 9.877 20.066 3.834
588 HZ2 LYS 78 2HZ LYS 78 9.222 19.223 2.522
589 HZ3 LYS 78 3HZ LYS 78 10.892 19.481 2.612
590 H LYS 79 H LYS 79 11.764 12.984 6.116
591 HA LYS 79 HA LYS 79 12.352 12.634 8.922
592 HB2 LYS 79 1HB LYS 79 13.821 11.827 6.410
593 HB3 LYS 79 2HB LYS 79 14.410 11.478 8.030
594 HG2 LYS 79 1HG LYS 79 11.885 10.464 6.747
595 HG3 LYS 79 2HG LYS 79 13.315 9.533 7.197
596 HD2 LYS 79 1HD LYS 79 11.959 9.068 8.982
597 HD3 LYS 79 2HD LYS 79 12.776 10.510 9.588
598 HE2 LYS 79 1HE LYS 79 10.721 11.677 8.339
599 HE3 LYS 79 2HE LYS 79 9.969 10.129 8.721
600 HZ1 LYS 79 1HZ LYS 79 10.677 10.492 11.058
601 HZ2 LYS 79 2HZ LYS 79 9.545 11.620 10.505
602 HZ3 LYS 79 3HZ LYS 79 11.176 12.051 10.631
603 H LYS 80 H LYS 80 13.512 13.974 10.127
604 HA LYS 80 HA LYS 80 14.433 16.439 9.403
605 HB2 LYS 80 1HB LYS 80 14.237 15.649 11.733
606 HB3 LYS 80 2HB LYS 80 15.662 14.643 11.505
607 HG2 LYS 80 1HG LYS 80 15.817 17.588 11.029
608 HG3 LYS 80 2HG LYS 80 15.886 16.943 12.671
609 HD2 LYS 80 1HD LYS 80 17.705 15.364 11.697
610 HD3 LYS 80 2HD LYS 80 17.799 16.558 10.400
611 HE2 LYS 80 1HE LYS 80 18.165 18.309 12.135
612 HE3 LYS 80 2HE LYS 80 18.234 17.029 13.346
613 HZ1 LYS 80 1HZ LYS 80 20.408 17.914 12.306
614 HZ2 LYS 80 2HZ LYS 80 20.004 16.921 10.997
615 HZ3 LYS 80 3HZ LYS 80 20.224 16.247 12.533
616 H GLY 81 H GLY 81 15.991 17.165 8.116
617 HA2 GLY 81 1HA GLY 81 17.772 17.106 6.648
618 HA3 GLY 81 2HA GLY 81 18.631 16.509 8.060
619 H SER 82 H SER 82 19.870 14.875 7.414
620 HA SER 82 HA SER 82 20.586 13.085 6.143
621 HB2 SER 82 1HB SER 82 19.286 12.219 8.181
622 HB3 SER 82 2HB SER 82 17.981 11.864 7.049
623 HG SER 82 HG SER 82 20.571 10.962 6.468
624 H GLY 83 H GLY 83 19.401 14.895 4.430
625 HA2 GLY 83 1HA GLY 83 17.370 13.668 2.826
626 HA3 GLY 83 2HA GLY 83 18.294 15.106 2.417
627 HA PRO 84 HA PRO 84 20.424 12.782 -0.633
628 HB2 PRO 84 1HB PRO 84 22.737 14.196 -0.783
629 HB3 PRO 84 2HB PRO 84 21.202 14.793 -1.427
630 HG2 PRO 84 1HG PRO 84 22.550 15.444 1.166
631 HG3 PRO 84 2HG PRO 84 21.736 16.530 0.024
632 HD2 PRO 84 1HD PRO 84 20.551 15.648 2.294
633 HD3 PRO 84 2HD PRO 84 19.638 15.987 0.810
634 H SER 85 H SER 85 22.404 11.538 -1.023
635 HA SER 85 HA SER 85 24.071 10.966 1.289
636 HB2 SER 85 1HB SER 85 23.545 8.668 1.465
637 HB3 SER 85 2HB SER 85 21.981 9.477 1.363
638 HG SER 85 HG SER 85 22.936 7.584 -0.215
639 H SER 86 H SER 86 26.010 9.897 0.777
640 HA SER 86 HA SER 86 26.531 9.341 -2.048
641 HB2 SER 86 1HB SER 86 28.563 10.681 -2.064
642 HB3 SER 86 2HB SER 86 27.190 11.702 -1.639
643 HG SER 86 HG SER 86 28.932 12.094 -0.246
644 H GLY 87 H GLY 87 28.058 7.770 -2.413
645 HA2 GLY 87 1HA GLY 87 29.756 6.831 -0.264
646 HA3 GLY 87 2HA GLY 87 28.465 5.723 -0.707
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