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 |
|
|
584339 |
2mwb   |
25311 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H ALA 431 HN ALA 431 -11.571 8.006 -2.151
2 HA ALA 431 HA ALA 431 -12.376 6.676 -4.532
3 HB1 ALA 431 HB1 ALA 431 -10.600 8.351 -4.522
4 HB2 ALA 431 HB2 ALA 431 -10.014 6.813 -5.155
5 HB3 ALA 431 HB3 ALA 431 -9.604 7.302 -3.510
6 H VAL 432 HN VAL 432 -11.176 4.703 -5.356
7 HA VAL 432 HA VAL 432 -11.509 2.622 -3.377
8 HB VAL 432 HB VAL 432 -12.342 2.214 -5.632
9 HG11 VAL 432 HG11 VAL 432 -10.827 1.859 -7.519
10 HG12 VAL 432 HG12 VAL 432 -9.467 2.378 -6.523
11 HG13 VAL 432 HG13 VAL 432 -10.754 3.516 -6.923
12 HG21 VAL 432 HG21 VAL 432 -10.029 0.419 -4.915
13 HG22 VAL 432 HG22 VAL 432 -11.345 0.009 -6.016
14 HG23 VAL 432 HG23 VAL 432 -11.680 0.298 -4.309
15 H SER 433 HN SER 433 -9.960 1.823 -2.134
16 HA SER 433 HA SER 433 -7.220 2.643 -2.639
17 HB2 SER 433 HB2 SER 433 -8.350 1.115 -0.286
18 HB3 SER 433 HB1 SER 433 -6.757 1.867 -0.386
19 HG SER 433 HG SER 433 -8.613 3.695 -0.975
20 H GLU 434 HN GLU 434 -6.471 1.402 -4.285
21 HA GLU 434 HA GLU 434 -6.692 -1.479 -4.192
22 HB2 GLU 434 HB2 GLU 434 -6.727 -0.162 -6.326
23 HB3 GLU 434 HB1 GLU 434 -5.041 0.247 -6.049
24 HG2 GLU 434 HG2 GLU 434 -4.377 -2.034 -6.273
25 HG3 GLU 434 HG1 GLU 434 -6.057 -2.568 -6.318
26 H TRP 435 HN TRP 435 -4.753 0.877 -2.851
27 HA TRP 435 HA TRP 435 -2.538 -0.978 -2.353
28 HB2 TRP 435 HB2 TRP 435 -2.729 1.924 -1.519
29 HB3 TRP 435 HB1 TRP 435 -1.285 0.918 -1.574
30 HD1 TRP 435 HD1 TRP 435 -3.402 3.208 -3.689
31 HE1 TRP 435 HE1 TRP 435 -2.354 3.457 -6.026
32 HE3 TRP 435 HE3 TRP 435 0.127 -0.486 -3.386
33 HZ2 TRP 435 HZ2 TRP 435 -0.299 2.254 -7.520
34 HZ3 TRP 435 HZ3 TRP 435 1.578 -0.883 -5.340
35 HH2 TRP 435 HH2 TRP 435 1.371 0.467 -7.355
36 H THR 436 HN THR 436 -2.836 -2.227 -0.603
37 HA THR 436 HA THR 436 -4.681 -1.321 1.464
38 HB THR 436 HB THR 436 -3.335 -4.017 1.316
39 HG1 THR 436 HG1 THR 436 -4.388 -4.065 -0.566
40 HG21 THR 436 HG21 THR 436 -5.971 -3.113 2.491
41 HG22 THR 436 HG22 THR 436 -4.504 -3.450 3.409
42 HG23 THR 436 HG23 THR 436 -5.317 -4.751 2.541
43 H GLU 437 HN GLU 437 -4.124 -0.876 3.522
44 HA GLU 437 HA GLU 437 -1.295 -0.413 4.021
45 HB2 GLU 437 HB2 GLU 437 -2.930 1.374 4.441
46 HB3 GLU 437 HB1 GLU 437 -3.769 0.346 5.590
47 HG2 GLU 437 HG2 GLU 437 -2.533 1.737 6.947
48 HG3 GLU 437 HG1 GLU 437 -1.527 0.295 6.852
49 H TYR 438 HN TYR 438 -0.214 -2.126 4.800
50 HA TYR 438 HA TYR 438 -1.366 -3.483 7.149
51 HB2 TYR 438 HB2 TYR 438 0.412 -4.600 4.978
52 HB3 TYR 438 HB1 TYR 438 0.207 -5.395 6.534
53 HD1 TYR 438 HD2 TYR 438 -2.269 -5.891 7.221
54 HD2 TYR 438 HD1 TYR 438 -1.003 -5.142 3.231
55 HE1 TYR 438 HE2 TYR 438 -4.276 -7.033 6.380
56 HE2 TYR 438 HE1 TYR 438 -3.004 -6.288 2.377
57 HH TYR 438 HH TYR 438 -4.634 -7.950 3.120
58 H LYS 439 HN LYS 439 -0.375 -2.875 8.942
59 HA LYS 439 HA LYS 439 2.439 -2.045 8.745
60 HB2 LYS 439 HB2 LYS 439 1.022 -0.161 9.265
61 HB3 LYS 439 HB1 LYS 439 0.255 -1.047 10.575
62 HG2 LYS 439 HG2 LYS 439 2.286 -1.022 11.855
63 HG3 LYS 439 HG1 LYS 439 3.169 -0.295 10.509
64 HD2 LYS 439 HD2 LYS 439 1.935 1.735 10.701
65 HD3 LYS 439 HD1 LYS 439 0.803 1.011 11.846
66 HE2 LYS 439 HE2 LYS 439 3.753 1.366 12.363
67 HE3 LYS 439 HE1 LYS 439 2.511 2.503 12.888
68 HZ1 LYS 439 HZ1 LYS 439 1.508 0.784 14.222
69 HZ2 LYS 439 HZ2 LYS 439 3.147 0.929 14.640
70 HZ3 LYS 439 HZ3 LYS 439 2.626 -0.364 13.673
71 H THR 440 HN THR 440 3.780 -3.432 9.618
72 HA THR 440 HA THR 440 2.894 -5.226 11.731
73 HB THR 440 HB THR 440 4.199 -6.294 10.024
74 HG1 THR 440 HG1 THR 440 4.675 -6.992 12.163
75 HG21 THR 440 HG21 THR 440 5.364 -4.352 9.124
76 HG22 THR 440 HG22 THR 440 6.511 -5.636 9.505
77 HG23 THR 440 HG23 THR 440 6.349 -4.249 10.583
78 H ALA 441 HN ALA 441 3.940 -5.396 13.737
79 HA ALA 441 HA ALA 441 4.352 -2.964 15.053
80 HB1 ALA 441 HB1 ALA 441 4.951 -4.299 16.991
81 HB2 ALA 441 HB2 ALA 441 5.158 -5.720 15.968
82 HB3 ALA 441 HB3 ALA 441 3.560 -4.998 16.162
83 H ASP 442 HN ASP 442 6.512 -4.810 13.199
84 HA ASP 442 HA ASP 442 8.968 -4.038 14.377
85 HB2 ASP 442 HB2 ASP 442 8.826 -5.899 12.808
86 HB3 ASP 442 HB1 ASP 442 8.290 -4.816 11.531
87 H GLY 443 HN GLY 443 6.605 -2.277 12.743
88 HA2 GLY 443 HA2 GLY 443 6.605 0.051 12.492
89 HA3 GLY 443 HA1 GLY 443 8.358 0.048 12.635
90 H LYS 444 HN LYS 444 6.531 -2.034 10.504
91 HA LYS 444 HA LYS 444 7.574 -0.490 8.213
92 HB2 LYS 444 HB2 LYS 444 7.379 -3.493 8.490
93 HB3 LYS 444 HB1 LYS 444 7.685 -2.672 6.967
94 HG2 LYS 444 HG2 LYS 444 9.698 -1.619 8.176
95 HG3 LYS 444 HG1 LYS 444 9.454 -2.892 9.375
96 HD2 LYS 444 HD2 LYS 444 9.880 -3.330 6.419
97 HD3 LYS 444 HD1 LYS 444 11.112 -3.520 7.665
98 HE2 LYS 444 HE2 LYS 444 8.532 -5.047 7.782
99 HE3 LYS 444 HE1 LYS 444 9.889 -5.620 6.815
100 HZ1 LYS 444 HZ1 LYS 444 9.675 -6.464 9.193
101 HZ2 LYS 444 HZ2 LYS 444 10.235 -4.931 9.670
102 HZ3 LYS 444 HZ3 LYS 444 11.200 -5.922 8.687
103 H THR 445 HN THR 445 6.022 0.328 7.007
104 HA THR 445 HA THR 445 3.385 -0.925 6.990
105 HB THR 445 HB THR 445 2.777 1.138 5.614
106 HG1 THR 445 HG1 THR 445 4.930 1.704 5.036
107 HG21 THR 445 HG21 THR 445 2.687 2.600 7.591
108 HG22 THR 445 HG22 THR 445 3.827 1.544 8.425
109 HG23 THR 445 HG23 THR 445 2.224 0.947 7.993
110 H TYR 446 HN TYR 446 3.316 -2.579 5.599
111 HA TYR 446 HA TYR 446 4.518 -2.189 2.958
112 HB2 TYR 446 HB2 TYR 446 4.273 -4.693 2.721
113 HB3 TYR 446 HB1 TYR 446 5.455 -4.143 3.895
114 HD1 TYR 446 HD1 TYR 446 4.716 -4.128 6.371
115 HD2 TYR 446 HD2 TYR 446 2.651 -6.257 3.324
116 HE1 TYR 446 HE1 TYR 446 3.717 -5.592 8.076
117 HE2 TYR 446 HE2 TYR 446 1.640 -7.718 5.017
118 HH TYR 446 HH TYR 446 2.369 -8.478 7.442
119 H TYR 447 HN TYR 447 3.259 -1.685 1.404
120 HA TYR 447 HA TYR 447 0.382 -1.938 1.718
121 HB2 TYR 447 HB2 TYR 447 2.085 -0.495 -0.320
122 HB3 TYR 447 HB1 TYR 447 0.326 -0.531 -0.363
123 HD1 TYR 447 HD2 TYR 447 3.232 0.579 1.673
124 HD2 TYR 447 HD1 TYR 447 -0.948 0.948 0.949
125 HE1 TYR 447 HE2 TYR 447 3.152 2.530 3.163
126 HE2 TYR 447 HE1 TYR 447 -1.039 2.895 2.445
127 HH TYR 447 HH TYR 447 0.304 3.763 4.389
128 H TYR 448 HN TYR 448 -0.574 -3.686 1.030
129 HA TYR 448 HA TYR 448 0.655 -5.309 -1.045
130 HB2 TYR 448 HB2 TYR 448 -0.183 -6.459 0.943
131 HB3 TYR 448 HB1 TYR 448 -1.791 -5.797 0.667
132 HD1 TYR 448 HD1 TYR 448 0.796 -7.881 -1.045
133 HD2 TYR 448 HD2 TYR 448 -3.346 -7.082 -0.473
134 HE1 TYR 448 HE1 TYR 448 0.232 -9.833 -2.430
135 HE2 TYR 448 HE2 TYR 448 -3.921 -9.030 -1.857
136 HH TYR 448 HH TYR 448 -2.965 -10.419 -3.560
137 H ASN 449 HN ASN 449 0.147 -5.095 -3.082
138 HA ASN 449 HA ASN 449 -2.519 -4.070 -3.788
139 HB2 ASN 449 HB2 ASN 449 -1.573 -2.735 -5.550
140 HB3 ASN 449 HB1 ASN 449 -0.726 -2.336 -4.062
141 HD21 ASN 449 HD21 ASN 449 1.431 -2.973 -3.817
142 HD22 ASN 449 HD22 ASN 449 2.391 -3.491 -5.159
143 H ASN 450 HN ASN 450 -3.421 -4.893 -5.667
144 HA ASN 450 HA ASN 450 -2.425 -7.508 -6.420
145 HB2 ASN 450 HB2 ASN 450 -4.562 -7.679 -7.686
146 HB3 ASN 450 HB1 ASN 450 -4.802 -7.300 -5.984
147 HD21 ASN 450 HD21 ASN 450 -5.029 -6.121 -9.248
148 HD22 ASN 450 HD22 ASN 450 -5.918 -4.683 -8.871
149 H ARG 451 HN ARG 451 -1.545 -4.556 -7.408
150 HA ARG 451 HA ARG 451 -1.711 -4.878 -10.253
151 HB2 ARG 451 HB2 ARG 451 0.005 -2.998 -8.637
152 HB3 ARG 451 HB1 ARG 451 -0.204 -2.937 -10.381
153 HG2 ARG 451 HG2 ARG 451 -2.636 -2.566 -10.003
154 HG3 ARG 451 HG1 ARG 451 -2.293 -2.440 -8.276
155 HD2 ARG 451 HD2 ARG 451 -0.684 -0.604 -8.817
156 HD3 ARG 451 HD1 ARG 451 -1.259 -0.670 -10.483
157 HE ARG 451 HE ARG 451 -3.506 -0.391 -8.886
158 HH11 ARG 451 HH11 ARG 451 -0.683 1.473 -9.791
159 HH12 ARG 451 HH12 ARG 451 -1.377 2.996 -9.309
160 HH21 ARG 451 HH21 ARG 451 -4.433 1.571 -8.306
161 HH22 ARG 451 HH22 ARG 451 -3.513 3.050 -8.426
162 H THR 452 HN THR 452 0.826 -5.227 -7.819
163 HA THR 452 HA THR 452 2.334 -6.831 -9.773
164 HB THR 452 HB THR 452 4.251 -6.488 -8.123
165 HG1 THR 452 HG1 THR 452 3.992 -4.642 -6.756
166 HG21 THR 452 HG21 THR 452 3.115 -4.068 -9.531
167 HG22 THR 452 HG22 THR 452 4.119 -5.315 -10.269
168 HG23 THR 452 HG23 THR 452 4.790 -4.271 -9.016
169 H LEU 453 HN LEU 453 0.175 -7.279 -7.373
170 HA LEU 453 HA LEU 453 -0.324 -8.865 -5.826
171 HB2 LEU 453 HB2 LEU 453 1.538 -10.419 -7.619
172 HB3 LEU 453 HB1 LEU 453 0.781 -11.153 -6.221
173 HG LEU 453 HG LEU 453 -1.452 -10.519 -7.248
174 HD11 LEU 453 HD11 LEU 453 -0.653 -8.839 -8.819
175 HD12 LEU 453 HD12 LEU 453 -1.494 -10.144 -9.655
176 HD13 LEU 453 HD13 LEU 453 0.268 -10.072 -9.681
177 HD21 LEU 453 HD21 LEU 453 -1.444 -12.438 -8.755
178 HD22 LEU 453 HD22 LEU 453 -0.574 -12.790 -7.262
179 HD23 LEU 453 HD23 LEU 453 0.320 -12.445 -8.742
180 H GLU 454 HN GLU 454 1.754 -6.985 -5.254
181 HA GLU 454 HA GLU 454 3.553 -8.564 -3.538
182 HB2 GLU 454 HB2 GLU 454 4.781 -7.936 -5.550
183 HB3 GLU 454 HB1 GLU 454 4.314 -6.254 -5.340
184 HG2 GLU 454 HG2 GLU 454 5.595 -6.165 -3.256
185 HG3 GLU 454 HG1 GLU 454 6.074 -7.847 -3.486
186 H SER 455 HN SER 455 4.056 -7.679 -1.577
187 HA SER 455 HA SER 455 2.690 -5.236 -0.797
188 HB2 SER 455 HB2 SER 455 3.698 -5.849 1.474
189 HB3 SER 455 HB1 SER 455 2.494 -6.966 0.828
190 HG SER 455 HG SER 455 5.320 -7.247 0.713
191 H THR 456 HN THR 456 3.692 -3.390 -1.255
192 HA THR 456 HA THR 456 6.613 -3.376 -1.423
193 HB THR 456 HB THR 456 5.432 -2.509 -3.378
194 HG1 THR 456 HG1 THR 456 7.262 -1.405 -3.304
195 HG21 THR 456 HG21 THR 456 4.122 -0.448 -3.267
196 HG22 THR 456 HG22 THR 456 4.314 -0.410 -1.515
197 HG23 THR 456 HG23 THR 456 3.395 -1.710 -2.273
198 H PHE 457 HN PHE 457 7.892 -1.973 -0.255
199 HA PHE 457 HA PHE 457 6.645 -0.944 2.185
200 HB2 PHE 457 HB2 PHE 457 9.549 -1.325 1.424
201 HB3 PHE 457 HB1 PHE 457 9.003 -0.678 2.968
202 HD1 PHE 457 HD1 PHE 457 7.689 -2.121 4.505
203 HD2 PHE 457 HD2 PHE 457 9.564 -3.648 1.005
204 HE1 PHE 457 HE1 PHE 457 7.489 -4.402 5.402
205 HE2 PHE 457 HE2 PHE 457 9.366 -5.935 1.894
206 HZ PHE 457 HZ PHE 457 8.325 -6.313 4.094
207 H GLU 458 HN GLU 458 7.101 0.207 -0.780
208 HA GLU 458 HA GLU 458 7.948 2.883 0.062
209 HB2 GLU 458 HB2 GLU 458 8.877 1.720 -2.032
210 HB3 GLU 458 HB1 GLU 458 7.301 2.011 -2.754
211 HG2 GLU 458 HG2 GLU 458 8.758 3.754 -3.452
212 HG3 GLU 458 HG1 GLU 458 7.617 4.438 -2.294
213 H LYS 459 HN LYS 459 6.426 4.317 0.588
214 HA LYS 459 HA LYS 459 3.674 3.807 0.399
215 HB2 LYS 459 HB2 LYS 459 5.075 6.458 0.759
216 HB3 LYS 459 HB1 LYS 459 3.372 6.156 1.068
217 HG2 LYS 459 HG2 LYS 459 4.054 4.481 2.787
218 HG3 LYS 459 HG1 LYS 459 5.724 5.001 2.549
219 HD2 LYS 459 HD2 LYS 459 4.828 6.157 4.452
220 HD3 LYS 459 HD1 LYS 459 5.016 7.317 3.135
221 HE2 LYS 459 HE2 LYS 459 2.613 7.004 2.597
222 HE3 LYS 459 HE1 LYS 459 2.466 5.973 4.019
223 HZ1 LYS 459 HZ1 LYS 459 3.266 8.836 4.020
224 HZ2 LYS 459 HZ2 LYS 459 3.149 7.852 5.395
225 HZ3 LYS 459 HZ3 LYS 459 1.759 8.223 4.496
226 HA PRO 460 HA PRO 460 3.055 4.415 -3.959
227 HB2 PRO 460 HB2 PRO 460 0.280 4.920 -2.997
228 HB3 PRO 460 HB1 PRO 460 0.848 3.836 -4.272
229 HG2 PRO 460 HG2 PRO 460 0.109 2.876 -1.904
230 HG3 PRO 460 HG1 PRO 460 1.505 2.198 -2.763
231 HD2 PRO 460 HD2 PRO 460 1.424 4.015 -0.406
232 HD3 PRO 460 HD1 PRO 460 2.566 2.713 -0.797
233 H GLN 461 HN GLN 461 3.453 6.192 -5.062
234 HA GLN 461 HA GLN 461 3.200 8.790 -3.951
235 HB2 GLN 461 HB2 GLN 461 3.948 9.552 -6.208
236 HB3 GLN 461 HB1 GLN 461 4.995 8.345 -5.473
237 HG2 GLN 461 HG2 GLN 461 4.019 6.614 -6.852
238 HG3 GLN 461 HG1 GLN 461 2.893 7.777 -7.548
239 HE21 GLN 461 HE21 GLN 461 6.215 6.746 -7.379
240 HE22 GLN 461 HE22 GLN 461 6.747 7.565 -8.819
241 H GLU 462 HN GLU 462 0.954 6.825 -5.547
242 HA GLU 462 HA GLU 462 -0.619 9.124 -6.446
243 HB2 GLU 462 HB2 GLU 462 -2.120 7.421 -7.469
244 HB3 GLU 462 HB1 GLU 462 -0.475 7.377 -8.090
245 HG2 GLU 462 HG2 GLU 462 0.023 5.403 -6.923
246 HG3 GLU 462 HG1 GLU 462 -1.403 5.554 -5.896
247 H LEU 463 HN LEU 463 -0.207 7.408 -3.688
248 HA LEU 463 HA LEU 463 -3.014 7.189 -2.983
249 HB2 LEU 463 HB2 LEU 463 -1.401 5.439 -2.298
250 HB3 LEU 463 HB1 LEU 463 -0.553 6.625 -1.324
251 HG LEU 463 HG LEU 463 -2.599 6.909 0.057
252 HD11 LEU 463 HD11 LEU 463 -3.627 4.599 -1.581
253 HD12 LEU 463 HD12 LEU 463 -4.257 6.246 -1.595
254 HD13 LEU 463 HD13 LEU 463 -4.394 5.262 -0.137
255 HD21 LEU 463 HD21 LEU 463 -2.406 4.774 1.230
256 HD22 LEU 463 HD22 LEU 463 -0.824 5.399 0.766
257 HD23 LEU 463 HD23 LEU 463 -1.560 4.088 -0.156
258 H LYS 464 HN LYS 464 -3.875 9.167 -2.744
259 HA LYS 464 HA LYS 464 -3.101 10.691 -0.424
260 HB2 LYS 464 HB2 LYS 464 -1.620 11.600 -2.204
261 HB3 LYS 464 HB1 LYS 464 -3.043 11.988 -3.160
262 HG2 LYS 464 HG2 LYS 464 -3.767 13.376 -1.111
263 HG3 LYS 464 HG1 LYS 464 -2.074 13.251 -0.630
264 HD2 LYS 464 HD2 LYS 464 -2.502 15.307 -1.887
265 HD3 LYS 464 HD1 LYS 464 -1.388 14.244 -2.748
266 HE2 LYS 464 HE2 LYS 464 -3.087 15.247 -4.234
267 HE3 LYS 464 HE1 LYS 464 -3.162 13.486 -4.200
268 HZ1 LYS 464 HZ1 LYS 464 -4.923 15.267 -2.606
269 HZ2 LYS 464 HZ2 LYS 464 -5.045 13.578 -2.748
270 HZ3 LYS 464 HZ3 LYS 464 -5.356 14.571 -4.088
Start of MODEL 2
1 H ALA 431 HN ALA 431 -13.386 0.507 -1.675
2 HA ALA 431 HA ALA 431 -12.982 3.344 -1.222
3 HB1 ALA 431 HB1 ALA 431 -11.161 1.005 -0.650
4 HB2 ALA 431 HB2 ALA 431 -12.284 1.744 0.493
5 HB3 ALA 431 HB3 ALA 431 -10.911 2.668 -0.118
6 H VAL 432 HN VAL 432 -10.948 4.376 -1.931
7 HA VAL 432 HA VAL 432 -10.401 3.686 -4.719
8 HB VAL 432 HB VAL 432 -11.043 6.027 -4.052
9 HG11 VAL 432 HG11 VAL 432 -9.311 7.473 -3.085
10 HG12 VAL 432 HG12 VAL 432 -8.294 6.055 -2.825
11 HG13 VAL 432 HG13 VAL 432 -9.830 6.206 -1.972
12 HG21 VAL 432 HG21 VAL 432 -8.376 5.694 -5.416
13 HG22 VAL 432 HG22 VAL 432 -9.393 7.132 -5.496
14 HG23 VAL 432 HG23 VAL 432 -9.963 5.610 -6.179
15 H SER 433 HN SER 433 -9.200 2.900 -1.802
16 HA SER 433 HA SER 433 -6.394 3.213 -2.293
17 HB2 SER 433 HB2 SER 433 -7.750 1.477 -0.221
18 HB3 SER 433 HB1 SER 433 -6.082 2.052 -0.198
19 HG SER 433 HG SER 433 -7.089 4.234 -0.211
20 H GLU 434 HN GLU 434 -5.795 2.130 -4.129
21 HA GLU 434 HA GLU 434 -6.370 -0.679 -4.477
22 HB2 GLU 434 HB2 GLU 434 -6.001 0.900 -6.392
23 HB3 GLU 434 HB1 GLU 434 -4.322 1.042 -5.895
24 HG2 GLU 434 HG2 GLU 434 -4.152 -1.457 -6.191
25 HG3 GLU 434 HG1 GLU 434 -5.734 -1.380 -6.965
26 H TRP 435 HN TRP 435 -4.198 1.227 -2.766
27 HA TRP 435 HA TRP 435 -2.272 -0.968 -2.449
28 HB2 TRP 435 HB2 TRP 435 -1.840 1.916 -1.649
29 HB3 TRP 435 HB1 TRP 435 -0.625 0.662 -1.884
30 HD1 TRP 435 HD1 TRP 435 -2.898 3.032 -3.877
31 HE1 TRP 435 HE1 TRP 435 -2.000 3.231 -6.266
32 HE3 TRP 435 HE3 TRP 435 0.807 -0.484 -3.653
33 HZ2 TRP 435 HZ2 TRP 435 0.010 2.084 -7.845
34 HZ3 TRP 435 HZ3 TRP 435 2.171 -0.867 -5.667
35 HH2 TRP 435 HH2 TRP 435 1.785 0.398 -7.716
36 H THR 436 HN THR 436 -2.851 -2.143 -0.714
37 HA THR 436 HA THR 436 -4.281 -0.852 1.474
38 HB THR 436 HB THR 436 -4.524 -3.232 2.325
39 HG1 THR 436 HG1 THR 436 -3.357 -3.758 -0.229
40 HG21 THR 436 HG21 THR 436 -6.317 -2.097 1.122
41 HG22 THR 436 HG22 THR 436 -6.255 -3.803 0.681
42 HG23 THR 436 HG23 THR 436 -5.608 -2.585 -0.418
43 H GLU 437 HN GLU 437 -3.176 -0.032 3.117
44 HA GLU 437 HA GLU 437 -0.454 -0.949 3.566
45 HB2 GLU 437 HB2 GLU 437 -0.343 1.001 5.161
46 HB3 GLU 437 HB1 GLU 437 -0.594 1.403 3.471
47 HG2 GLU 437 HG2 GLU 437 -2.851 1.956 3.830
48 HG3 GLU 437 HG1 GLU 437 -2.862 1.201 5.424
49 H TYR 438 HN TYR 438 -0.325 -2.713 4.746
50 HA TYR 438 HA TYR 438 -1.848 -2.883 7.237
51 HB2 TYR 438 HB2 TYR 438 -0.039 -4.882 5.863
52 HB3 TYR 438 HB1 TYR 438 -0.849 -5.168 7.399
53 HD1 TYR 438 HD2 TYR 438 -3.358 -5.240 7.455
54 HD2 TYR 438 HD1 TYR 438 -1.168 -5.202 3.807
55 HE1 TYR 438 HE2 TYR 438 -5.333 -6.094 6.268
56 HE2 TYR 438 HE1 TYR 438 -3.139 -6.057 2.609
57 HH TYR 438 HH TYR 438 -5.217 -7.412 3.213
58 H LYS 439 HN LYS 439 -0.970 -2.101 9.026
59 HA LYS 439 HA LYS 439 1.897 -1.558 9.027
60 HB2 LYS 439 HB2 LYS 439 1.385 -0.154 11.054
61 HB3 LYS 439 HB1 LYS 439 0.653 0.395 9.556
62 HG2 LYS 439 HG2 LYS 439 -0.900 -1.317 11.451
63 HG3 LYS 439 HG1 LYS 439 -0.723 0.412 11.745
64 HD2 LYS 439 HD2 LYS 439 -1.897 -0.874 9.276
65 HD3 LYS 439 HD1 LYS 439 -2.793 -0.042 10.547
66 HE2 LYS 439 HE2 LYS 439 -1.481 2.019 10.010
67 HE3 LYS 439 HE1 LYS 439 -0.797 1.158 8.632
68 HZ1 LYS 439 HZ1 LYS 439 -2.618 2.451 7.862
69 HZ2 LYS 439 HZ2 LYS 439 -3.647 1.861 9.081
70 HZ3 LYS 439 HZ3 LYS 439 -3.122 0.830 7.843
71 H THR 440 HN THR 440 3.208 -2.890 9.978
72 HA THR 440 HA THR 440 2.153 -4.698 12.034
73 HB THR 440 HB THR 440 3.099 -5.925 10.200
74 HG1 THR 440 HG1 THR 440 4.790 -7.039 11.312
75 HG21 THR 440 HG21 THR 440 4.498 -4.130 9.261
76 HG22 THR 440 HG22 THR 440 5.391 -5.643 9.426
77 HG23 THR 440 HG23 THR 440 5.640 -4.339 10.590
78 H ALA 441 HN ALA 441 3.297 -5.038 13.963
79 HA ALA 441 HA ALA 441 4.549 -2.764 15.097
80 HB1 ALA 441 HB1 ALA 441 4.503 -5.602 16.122
81 HB2 ALA 441 HB2 ALA 441 3.267 -4.380 16.422
82 HB3 ALA 441 HB3 ALA 441 4.896 -4.159 17.058
83 H ASP 442 HN ASP 442 5.711 -5.037 12.994
84 HA ASP 442 HA ASP 442 8.420 -5.261 13.836
85 HB2 ASP 442 HB2 ASP 442 7.236 -6.795 12.225
86 HB3 ASP 442 HB1 ASP 442 7.296 -5.502 11.035
87 H GLY 443 HN GLY 443 6.622 -2.668 12.751
88 HA2 GLY 443 HA2 GLY 443 7.439 -0.464 12.707
89 HA3 GLY 443 HA1 GLY 443 9.059 -1.095 12.444
90 H LYS 444 HN LYS 444 6.216 -2.023 10.625
91 HA LYS 444 HA LYS 444 7.309 -0.672 8.260
92 HB2 LYS 444 HB2 LYS 444 6.714 -3.622 8.487
93 HB3 LYS 444 HB1 LYS 444 7.028 -2.790 6.971
94 HG2 LYS 444 HG2 LYS 444 9.264 -2.422 7.493
95 HG3 LYS 444 HG1 LYS 444 9.005 -2.705 9.216
96 HD2 LYS 444 HD2 LYS 444 8.635 -5.047 8.826
97 HD3 LYS 444 HD1 LYS 444 8.710 -4.807 7.081
98 HE2 LYS 444 HE2 LYS 444 11.017 -4.280 7.165
99 HE3 LYS 444 HE1 LYS 444 10.993 -4.161 8.926
100 HZ1 LYS 444 HZ1 LYS 444 11.968 -6.250 8.088
101 HZ2 LYS 444 HZ2 LYS 444 10.469 -6.660 7.407
102 HZ3 LYS 444 HZ3 LYS 444 10.620 -6.504 9.091
103 H THR 445 HN THR 445 5.793 0.168 6.992
104 HA THR 445 HA THR 445 3.044 -0.854 7.207
105 HB THR 445 HB THR 445 2.524 1.336 5.909
106 HG1 THR 445 HG1 THR 445 4.979 2.115 7.143
107 HG21 THR 445 HG21 THR 445 2.360 2.613 8.004
108 HG22 THR 445 HG22 THR 445 3.387 1.419 8.801
109 HG23 THR 445 HG23 THR 445 1.798 0.952 8.194
110 H TYR 446 HN TYR 446 3.160 -2.573 5.764
111 HA TYR 446 HA TYR 446 4.303 -2.026 3.143
112 HB2 TYR 446 HB2 TYR 446 4.073 -4.457 2.731
113 HB3 TYR 446 HB1 TYR 446 5.071 -4.074 4.123
114 HD1 TYR 446 HD1 TYR 446 4.256 -4.567 6.401
115 HD2 TYR 446 HD2 TYR 446 2.028 -5.694 2.955
116 HE1 TYR 446 HE1 TYR 446 2.965 -6.158 7.763
117 HE2 TYR 446 HE2 TYR 446 0.724 -7.276 4.308
118 HH TYR 446 HH TYR 446 0.886 -7.336 7.748
119 H TYR 447 HN TYR 447 3.179 -1.500 1.491
120 HA TYR 447 HA TYR 447 0.266 -1.607 1.595
121 HB2 TYR 447 HB2 TYR 447 2.167 -0.253 -0.335
122 HB3 TYR 447 HB1 TYR 447 0.415 -0.176 -0.454
123 HD1 TYR 447 HD2 TYR 447 3.097 0.474 2.086
124 HD2 TYR 447 HD1 TYR 447 -0.614 1.695 0.401
125 HE1 TYR 447 HE2 TYR 447 3.081 2.440 3.564
126 HE2 TYR 447 HE1 TYR 447 -0.638 3.665 1.872
127 HH TYR 447 HH TYR 447 0.317 4.346 4.037
128 H TYR 448 HN TYR 448 -0.644 -3.410 0.851
129 HA TYR 448 HA TYR 448 0.677 -4.962 -1.230
130 HB2 TYR 448 HB2 TYR 448 -0.232 -6.225 0.630
131 HB3 TYR 448 HB1 TYR 448 -1.818 -5.492 0.403
132 HD1 TYR 448 HD1 TYR 448 0.681 -7.670 -1.309
133 HD2 TYR 448 HD2 TYR 448 -3.401 -6.521 -0.959
134 HE1 TYR 448 HE1 TYR 448 0.041 -9.497 -2.826
135 HE2 TYR 448 HE2 TYR 448 -4.050 -8.348 -2.468
136 HH TYR 448 HH TYR 448 -1.983 -10.872 -3.296
137 H ASN 449 HN ASN 449 0.178 -4.834 -3.296
138 HA ASN 449 HA ASN 449 -2.358 -3.526 -4.043
139 HB2 ASN 449 HB2 ASN 449 -1.269 -2.456 -5.884
140 HB3 ASN 449 HB1 ASN 449 -0.305 -2.139 -4.450
141 HD21 ASN 449 HD21 ASN 449 0.446 -2.060 -7.242
142 HD22 ASN 449 HD22 ASN 449 1.773 -3.160 -7.433
143 H ASN 450 HN ASN 450 -3.463 -4.324 -5.819
144 HA ASN 450 HA ASN 450 -2.832 -7.035 -6.610
145 HB2 ASN 450 HB2 ASN 450 -4.934 -6.953 -7.862
146 HB3 ASN 450 HB1 ASN 450 -5.176 -6.376 -6.217
147 HD21 ASN 450 HD21 ASN 450 -5.132 -5.534 -9.575
148 HD22 ASN 450 HD22 ASN 450 -5.802 -3.950 -9.402
149 H ARG 451 HN ARG 451 -1.946 -3.987 -7.602
150 HA ARG 451 HA ARG 451 -1.863 -4.330 -10.418
151 HB2 ARG 451 HB2 ARG 451 -1.794 -2.129 -9.226
152 HB3 ARG 451 HB1 ARG 451 -0.151 -2.504 -8.731
153 HG2 ARG 451 HG2 ARG 451 0.585 -2.507 -11.030
154 HG3 ARG 451 HG1 ARG 451 -1.073 -2.260 -11.589
155 HD2 ARG 451 HD2 ARG 451 0.622 -0.355 -9.976
156 HD3 ARG 451 HD1 ARG 451 0.068 -0.147 -11.636
157 HE ARG 451 HE ARG 451 -2.060 -0.458 -9.695
158 HH11 ARG 451 HH11 ARG 451 0.064 1.848 -11.288
159 HH12 ARG 451 HH12 ARG 451 -1.008 3.195 -11.034
160 HH21 ARG 451 HH21 ARG 451 -3.477 1.275 -9.403
161 HH22 ARG 451 HH22 ARG 451 -3.053 2.857 -10.003
162 H THR 452 HN THR 452 0.504 -4.792 -7.838
163 HA THR 452 HA THR 452 2.183 -6.262 -9.764
164 HB THR 452 HB THR 452 3.232 -5.248 -7.145
165 HG1 THR 452 HG1 THR 452 3.535 -3.565 -9.344
166 HG21 THR 452 HG21 THR 452 4.463 -5.558 -9.887
167 HG22 THR 452 HG22 THR 452 4.643 -6.689 -8.546
168 HG23 THR 452 HG23 THR 452 5.309 -5.061 -8.421
169 H LEU 453 HN LEU 453 -0.020 -6.868 -7.369
170 HA LEU 453 HA LEU 453 -0.422 -8.476 -5.813
171 HB2 LEU 453 HB2 LEU 453 1.534 -10.015 -7.532
172 HB3 LEU 453 HB1 LEU 453 0.503 -10.728 -6.304
173 HG LEU 453 HG LEU 453 -0.453 -9.341 -8.805
174 HD11 LEU 453 HD11 LEU 453 -1.160 -11.567 -9.507
175 HD12 LEU 453 HD12 LEU 453 -0.447 -12.259 -8.050
176 HD13 LEU 453 HD13 LEU 453 0.585 -11.500 -9.263
177 HD21 LEU 453 HD21 LEU 453 -1.990 -10.783 -6.651
178 HD22 LEU 453 HD22 LEU 453 -2.664 -10.154 -8.154
179 HD23 LEU 453 HD23 LEU 453 -2.005 -9.045 -6.952
180 H GLU 454 HN GLU 454 1.532 -6.559 -5.153
181 HA GLU 454 HA GLU 454 3.490 -8.120 -3.593
182 HB2 GLU 454 HB2 GLU 454 3.988 -5.872 -5.505
183 HB3 GLU 454 HB1 GLU 454 5.046 -6.079 -4.117
184 HG2 GLU 454 HG2 GLU 454 4.499 -8.137 -6.241
185 HG3 GLU 454 HG1 GLU 454 5.951 -7.145 -6.103
186 H SER 455 HN SER 455 4.166 -7.243 -1.660
187 HA SER 455 HA SER 455 2.667 -4.915 -0.695
188 HB2 SER 455 HB2 SER 455 4.422 -6.827 0.867
189 HB3 SER 455 HB1 SER 455 3.326 -5.617 1.532
190 HG SER 455 HG SER 455 2.017 -7.241 -0.171
191 H THR 456 HN THR 456 3.669 -3.050 -1.122
192 HA THR 456 HA THR 456 6.581 -2.965 -1.272
193 HB THR 456 HB THR 456 5.509 -1.862 -3.098
194 HG1 THR 456 HG1 THR 456 6.024 0.526 -2.048
195 HG21 THR 456 HG21 THR 456 3.934 -0.009 -2.822
196 HG22 THR 456 HG22 THR 456 3.986 -0.221 -1.071
197 HG23 THR 456 HG23 THR 456 3.310 -1.490 -2.094
198 H PHE 457 HN PHE 457 7.875 -1.904 0.136
199 HA PHE 457 HA PHE 457 6.657 -1.018 2.628
200 HB2 PHE 457 HB2 PHE 457 9.536 -1.460 1.816
201 HB3 PHE 457 HB1 PHE 457 9.050 -0.875 3.404
202 HD1 PHE 457 HD2 PHE 457 8.919 -3.746 1.098
203 HD2 PHE 457 HD1 PHE 457 8.197 -2.354 5.053
204 HE1 PHE 457 HE2 PHE 457 8.634 -6.069 1.858
205 HE2 PHE 457 HE1 PHE 457 7.915 -4.675 5.823
206 HZ PHE 457 HZ PHE 457 8.134 -6.535 4.223
207 H GLU 458 HN GLU 458 7.391 0.340 -0.261
208 HA GLU 458 HA GLU 458 7.995 2.966 0.912
209 HB2 GLU 458 HB2 GLU 458 9.567 2.147 -0.841
210 HB3 GLU 458 HB1 GLU 458 8.227 2.086 -1.977
211 HG2 GLU 458 HG2 GLU 458 9.640 4.095 -2.220
212 HG3 GLU 458 HG1 GLU 458 7.949 4.458 -1.878
213 H LYS 459 HN LYS 459 6.648 4.705 0.486
214 HA LYS 459 HA LYS 459 3.905 3.948 0.182
215 HB2 LYS 459 HB2 LYS 459 5.149 6.665 0.574
216 HB3 LYS 459 HB1 LYS 459 3.425 6.318 0.659
217 HG2 LYS 459 HG2 LYS 459 3.987 4.654 2.482
218 HG3 LYS 459 HG1 LYS 459 5.600 5.369 2.500
219 HD2 LYS 459 HD2 LYS 459 4.630 7.551 3.007
220 HD3 LYS 459 HD1 LYS 459 3.012 6.845 2.972
221 HE2 LYS 459 HE2 LYS 459 5.237 6.205 4.906
222 HE3 LYS 459 HE1 LYS 459 3.732 7.053 5.259
223 HZ1 LYS 459 HZ1 LYS 459 3.376 4.889 5.995
224 HZ2 LYS 459 HZ2 LYS 459 4.126 4.190 4.649
225 HZ3 LYS 459 HZ3 LYS 459 2.605 4.917 4.482
226 HA PRO 460 HA PRO 460 3.862 4.310 -4.279
227 HB2 PRO 460 HB2 PRO 460 0.944 4.224 -3.752
228 HB3 PRO 460 HB1 PRO 460 1.926 3.232 -4.834
229 HG2 PRO 460 HG2 PRO 460 1.006 2.252 -2.540
230 HG3 PRO 460 HG1 PRO 460 2.623 1.834 -3.133
231 HD2 PRO 460 HD2 PRO 460 1.824 3.718 -0.967
232 HD3 PRO 460 HD1 PRO 460 3.216 2.619 -1.070
233 H GLN 461 HN GLN 461 3.383 5.803 -5.799
234 HA GLN 461 HA GLN 461 2.680 8.460 -4.938
235 HB2 GLN 461 HB2 GLN 461 2.940 8.978 -7.407
236 HB3 GLN 461 HB1 GLN 461 4.365 8.319 -6.610
237 HG2 GLN 461 HG2 GLN 461 4.116 6.232 -7.624
238 HG3 GLN 461 HG1 GLN 461 2.441 6.548 -8.068
239 HE21 GLN 461 HE21 GLN 461 1.983 7.655 -9.903
240 HE22 GLN 461 HE22 GLN 461 3.178 8.069 -11.086
241 H GLU 462 HN GLU 462 0.946 5.765 -6.071
242 HA GLU 462 HA GLU 462 -1.088 7.230 -7.499
243 HB2 GLU 462 HB2 GLU 462 -1.201 4.359 -6.577
244 HB3 GLU 462 HB1 GLU 462 -2.138 5.103 -7.863
245 HG2 GLU 462 HG2 GLU 462 0.843 4.792 -7.918
246 HG3 GLU 462 HG1 GLU 462 -0.281 3.633 -8.619
247 H LEU 463 HN LEU 463 -0.429 6.855 -4.301
248 HA LEU 463 HA LEU 463 -3.270 7.046 -3.567
249 HB2 LEU 463 HB2 LEU 463 -2.173 4.953 -2.786
250 HB3 LEU 463 HB1 LEU 463 -1.035 5.926 -1.875
251 HG LEU 463 HG LEU 463 -2.931 6.832 -0.542
252 HD11 LEU 463 HD11 LEU 463 -4.527 4.771 -2.059
253 HD12 LEU 463 HD12 LEU 463 -4.727 6.522 -2.142
254 HD13 LEU 463 HD13 LEU 463 -5.087 5.662 -0.644
255 HD21 LEU 463 HD21 LEU 463 -3.296 4.788 0.762
256 HD22 LEU 463 HD22 LEU 463 -1.606 4.978 0.295
257 HD23 LEU 463 HD23 LEU 463 -2.635 3.831 -0.564
258 H LYS 464 HN LYS 464 -3.546 9.191 -3.404
259 HA LYS 464 HA LYS 464 -2.144 10.572 -1.278
260 HB2 LYS 464 HB2 LYS 464 -0.742 10.955 -3.316
261 HB3 LYS 464 HB1 LYS 464 -2.136 11.700 -4.088
262 HG2 LYS 464 HG2 LYS 464 -0.662 13.408 -3.239
263 HG3 LYS 464 HG1 LYS 464 -2.169 13.414 -2.320
264 HD2 LYS 464 HD2 LYS 464 -0.316 13.656 -0.797
265 HD3 LYS 464 HD1 LYS 464 -1.048 12.068 -0.565
266 HE2 LYS 464 HE2 LYS 464 1.330 11.800 -0.543
267 HE3 LYS 464 HE1 LYS 464 0.716 11.110 -2.044
268 HZ1 LYS 464 HZ1 LYS 464 2.671 12.405 -2.491
269 HZ2 LYS 464 HZ2 LYS 464 2.016 13.760 -1.713
270 HZ3 LYS 464 HZ3 LYS 464 1.334 13.205 -3.162
Start of MODEL 3
1 H ALA 431 HN ALA 431 -12.756 4.350 -0.667
2 HA ALA 431 HA ALA 431 -13.993 1.760 -0.019
3 HB1 ALA 431 HB1 ALA 431 -15.311 2.095 -2.105
4 HB2 ALA 431 HB2 ALA 431 -14.581 3.695 -2.257
5 HB3 ALA 431 HB3 ALA 431 -15.593 3.316 -0.866
6 H VAL 432 HN VAL 432 -12.662 3.134 -3.057
7 HA VAL 432 HA VAL 432 -11.535 0.481 -3.571
8 HB VAL 432 HB VAL 432 -13.033 1.146 -5.313
9 HG11 VAL 432 HG11 VAL 432 -12.732 3.177 -6.648
10 HG12 VAL 432 HG12 VAL 432 -11.422 3.677 -5.578
11 HG13 VAL 432 HG13 VAL 432 -13.067 3.543 -4.955
12 HG21 VAL 432 HG21 VAL 432 -11.578 1.102 -7.277
13 HG22 VAL 432 HG22 VAL 432 -11.033 -0.034 -6.042
14 HG23 VAL 432 HG23 VAL 432 -10.192 1.502 -6.262
15 H SER 433 HN SER 433 -9.555 0.393 -2.740
16 HA SER 433 HA SER 433 -7.668 2.519 -3.501
17 HB2 SER 433 HB2 SER 433 -8.252 2.276 -1.005
18 HB3 SER 433 HB1 SER 433 -7.355 0.760 -1.067
19 HG SER 433 HG SER 433 -5.582 1.873 -0.958
20 H GLU 434 HN GLU 434 -6.135 1.840 -4.864
21 HA GLU 434 HA GLU 434 -5.800 -0.942 -5.471
22 HB2 GLU 434 HB2 GLU 434 -4.177 1.449 -6.368
23 HB3 GLU 434 HB1 GLU 434 -4.087 -0.165 -7.059
24 HG2 GLU 434 HG2 GLU 434 -6.530 1.593 -7.071
25 HG3 GLU 434 HG1 GLU 434 -5.411 1.397 -8.418
26 H TRP 435 HN TRP 435 -4.521 1.156 -3.180
27 HA TRP 435 HA TRP 435 -2.354 -0.732 -2.545
28 HB2 TRP 435 HB2 TRP 435 -2.201 2.233 -1.980
29 HB3 TRP 435 HB1 TRP 435 -0.906 1.049 -1.889
30 HD1 TRP 435 HD1 TRP 435 -2.964 3.023 -4.475
31 HE1 TRP 435 HE1 TRP 435 -1.610 3.157 -6.657
32 HE3 TRP 435 HE3 TRP 435 0.947 -0.013 -3.191
33 HZ2 TRP 435 HZ2 TRP 435 0.797 2.110 -7.691
34 HZ3 TRP 435 HZ3 TRP 435 2.721 -0.403 -4.854
35 HH2 TRP 435 HH2 TRP 435 2.650 0.647 -7.045
36 H THR 436 HN THR 436 -2.842 -1.674 -0.626
37 HA THR 436 HA THR 436 -4.208 0.017 1.358
38 HB THR 436 HB THR 436 -5.527 -1.975 0.741
39 HG1 THR 436 HG1 THR 436 -5.370 -1.057 2.979
40 HG21 THR 436 HG21 THR 436 -3.218 -3.549 1.871
41 HG22 THR 436 HG22 THR 436 -3.743 -3.532 0.188
42 HG23 THR 436 HG23 THR 436 -4.793 -4.211 1.430
43 H GLU 437 HN GLU 437 -3.052 0.679 3.015
44 HA GLU 437 HA GLU 437 -0.436 -0.546 3.450
45 HB2 GLU 437 HB2 GLU 437 0.001 1.455 4.878
46 HB3 GLU 437 HB1 GLU 437 -0.350 1.828 3.199
47 HG2 GLU 437 HG2 GLU 437 -2.531 1.912 5.236
48 HG3 GLU 437 HG1 GLU 437 -1.395 3.251 5.089
49 H TYR 438 HN TYR 438 -0.191 -2.020 4.930
50 HA TYR 438 HA TYR 438 -1.710 -1.756 7.440
51 HB2 TYR 438 HB2 TYR 438 -0.858 -4.227 5.940
52 HB3 TYR 438 HB1 TYR 438 -1.242 -4.279 7.658
53 HD1 TYR 438 HD1 TYR 438 -2.628 -3.700 4.285
54 HD2 TYR 438 HD2 TYR 438 -3.500 -4.140 8.427
55 HE1 TYR 438 HE1 TYR 438 -5.021 -3.915 3.747
56 HE2 TYR 438 HE2 TYR 438 -5.890 -4.367 7.905
57 HH TYR 438 HH TYR 438 -7.450 -3.686 6.096
58 H LYS 439 HN LYS 439 -0.543 -1.544 9.247
59 HA LYS 439 HA LYS 439 2.365 -1.523 8.916
60 HB2 LYS 439 HB2 LYS 439 1.329 0.590 9.599
61 HB3 LYS 439 HB1 LYS 439 0.626 -0.200 11.002
62 HG2 LYS 439 HG2 LYS 439 2.783 -0.545 11.973
63 HG3 LYS 439 HG1 LYS 439 3.586 0.022 10.507
64 HD2 LYS 439 HD2 LYS 439 2.602 2.244 10.833
65 HD3 LYS 439 HD1 LYS 439 1.806 1.672 12.302
66 HE2 LYS 439 HE2 LYS 439 4.788 1.609 11.899
67 HE3 LYS 439 HE1 LYS 439 3.942 2.962 12.646
68 HZ1 LYS 439 HZ1 LYS 439 4.909 1.216 14.182
69 HZ2 LYS 439 HZ2 LYS 439 3.651 0.198 13.669
70 HZ3 LYS 439 HZ3 LYS 439 3.297 1.661 14.450
71 H THR 440 HN THR 440 3.534 -3.087 9.781
72 HA THR 440 HA THR 440 2.357 -4.806 11.815
73 HB THR 440 HB THR 440 3.599 -5.857 9.944
74 HG1 THR 440 HG1 THR 440 3.911 -7.332 11.407
75 HG21 THR 440 HG21 THR 440 5.302 -4.148 9.575
76 HG22 THR 440 HG22 THR 440 6.046 -5.720 9.860
77 HG23 THR 440 HG23 THR 440 6.020 -4.511 11.144
78 H ALA 441 HN ALA 441 3.345 -5.166 13.847
79 HA ALA 441 HA ALA 441 4.029 -2.812 15.201
80 HB1 ALA 441 HB1 ALA 441 2.940 -4.732 16.267
81 HB2 ALA 441 HB2 ALA 441 4.387 -4.231 17.144
82 HB3 ALA 441 HB3 ALA 441 4.433 -5.659 16.109
83 H ASP 442 HN ASP 442 5.977 -5.022 13.473
84 HA ASP 442 HA ASP 442 8.477 -4.583 14.694
85 HB2 ASP 442 HB2 ASP 442 8.099 -6.418 13.133
86 HB3 ASP 442 HB1 ASP 442 7.781 -5.278 11.831
87 H GLY 443 HN GLY 443 6.472 -2.504 12.936
88 HA2 GLY 443 HA2 GLY 443 6.845 -0.202 12.691
89 HA3 GLY 443 HA1 GLY 443 8.568 -0.479 12.914
90 H LYS 444 HN LYS 444 6.434 -2.168 10.707
91 HA LYS 444 HA LYS 444 7.682 -0.749 8.458
92 HB2 LYS 444 HB2 LYS 444 7.480 -3.732 8.804
93 HB3 LYS 444 HB1 LYS 444 7.607 -2.997 7.212
94 HG2 LYS 444 HG2 LYS 444 9.696 -1.821 8.177
95 HG3 LYS 444 HG1 LYS 444 9.620 -3.073 9.419
96 HD2 LYS 444 HD2 LYS 444 9.620 -3.682 6.470
97 HD3 LYS 444 HD1 LYS 444 11.098 -3.568 7.425
98 HE2 LYS 444 HE2 LYS 444 8.841 -5.400 8.189
99 HE3 LYS 444 HE1 LYS 444 10.101 -5.891 7.056
100 HZ1 LYS 444 HZ1 LYS 444 10.488 -5.049 9.885
101 HZ2 LYS 444 HZ2 LYS 444 11.748 -5.382 8.796
102 HZ3 LYS 444 HZ3 LYS 444 10.674 -6.614 9.254
103 H THR 445 HN THR 445 6.233 0.077 7.142
104 HA THR 445 HA THR 445 3.481 -0.883 7.235
105 HB THR 445 HB THR 445 4.514 1.498 5.692
106 HG1 THR 445 HG1 THR 445 4.631 1.261 8.276
107 HG21 THR 445 HG21 THR 445 2.198 2.264 5.880
108 HG22 THR 445 HG22 THR 445 1.782 0.805 6.780
109 HG23 THR 445 HG23 THR 445 2.277 0.688 5.092
110 H TYR 446 HN TYR 446 3.143 -2.578 5.927
111 HA TYR 446 HA TYR 446 4.473 -2.597 3.328
112 HB2 TYR 446 HB2 TYR 446 3.688 -4.958 3.164
113 HB3 TYR 446 HB1 TYR 446 4.761 -4.658 4.522
114 HD1 TYR 446 HD1 TYR 446 3.866 -4.672 6.826
115 HD2 TYR 446 HD2 TYR 446 1.431 -5.669 3.485
116 HE1 TYR 446 HE1 TYR 446 2.229 -5.719 8.330
117 HE2 TYR 446 HE2 TYR 446 -0.212 -6.711 4.983
118 HH TYR 446 HH TYR 446 -0.206 -6.246 8.312
119 H TYR 447 HN TYR 447 3.482 -1.903 1.635
120 HA TYR 447 HA TYR 447 0.594 -1.501 1.671
121 HB2 TYR 447 HB2 TYR 447 2.746 -0.604 -0.258
122 HB3 TYR 447 HB1 TYR 447 1.033 -0.286 -0.488
123 HD1 TYR 447 HD2 TYR 447 3.821 0.306 1.932
124 HD2 TYR 447 HD1 TYR 447 0.082 1.645 0.390
125 HE1 TYR 447 HE2 TYR 447 4.030 2.378 3.234
126 HE2 TYR 447 HE1 TYR 447 0.289 3.722 1.690
127 HH TYR 447 HH TYR 447 1.428 4.569 3.643
128 H TYR 448 HN TYR 448 -0.610 -3.142 0.985
129 HA TYR 448 HA TYR 448 0.458 -4.996 -0.992
130 HB2 TYR 448 HB2 TYR 448 -0.724 -6.005 0.870
131 HB3 TYR 448 HB1 TYR 448 -2.136 -4.996 0.569
132 HD1 TYR 448 HD1 TYR 448 0.021 -7.444 -1.274
133 HD2 TYR 448 HD2 TYR 448 -3.905 -5.970 -0.545
134 HE1 TYR 448 HE1 TYR 448 -0.901 -9.173 -2.757
135 HE2 TYR 448 HE2 TYR 448 -4.835 -7.694 -2.029
136 HH TYR 448 HH TYR 448 -4.142 -9.124 -3.854
137 H ASN 449 HN ASN 449 0.188 -4.645 -3.060
138 HA ASN 449 HA ASN 449 -2.093 -2.993 -3.912
139 HB2 ASN 449 HB2 ASN 449 -0.660 -2.067 -5.688
140 HB3 ASN 449 HB1 ASN 449 -0.060 -1.683 -4.080
141 HD21 ASN 449 HD21 ASN 449 1.864 -2.564 -3.384
142 HD22 ASN 449 HD22 ASN 449 2.953 -3.387 -4.444
143 H ASN 450 HN ASN 450 -3.152 -3.551 -5.704
144 HA ASN 450 HA ASN 450 -2.725 -6.202 -6.767
145 HB2 ASN 450 HB2 ASN 450 -4.776 -5.661 -8.123
146 HB3 ASN 450 HB1 ASN 450 -5.006 -5.570 -6.379
147 HD21 ASN 450 HD21 ASN 450 -4.791 -3.776 -9.339
148 HD22 ASN 450 HD22 ASN 450 -5.399 -2.276 -8.707
149 H ARG 451 HN ARG 451 -1.213 -3.384 -7.360
150 HA ARG 451 HA ARG 451 -1.120 -3.232 -10.160
151 HB2 ARG 451 HB2 ARG 451 -0.119 -1.456 -8.848
152 HB3 ARG 451 HB1 ARG 451 1.034 -2.580 -8.138
153 HG2 ARG 451 HG2 ARG 451 2.060 -2.924 -10.330
154 HG3 ARG 451 HG1 ARG 451 0.898 -1.813 -11.053
155 HD2 ARG 451 HD2 ARG 451 2.758 -1.001 -8.831
156 HD3 ARG 451 HD1 ARG 451 3.209 -0.893 -10.530
157 HE ARG 451 HE ARG 451 0.771 0.421 -10.244
158 HH11 ARG 451 HH11 ARG 451 4.095 0.782 -9.161
159 HH12 ARG 451 HH12 ARG 451 3.985 2.510 -8.997
160 HH21 ARG 451 HH21 ARG 451 0.631 2.704 -10.013
161 HH22 ARG 451 HH22 ARG 451 2.029 3.598 -9.475
162 H THR 452 HN THR 452 1.137 -4.844 -7.927
163 HA THR 452 HA THR 452 1.657 -6.810 -10.056
164 HB THR 452 HB THR 452 3.723 -7.338 -8.592
165 HG1 THR 452 HG1 THR 452 4.399 -5.694 -7.255
166 HG21 THR 452 HG21 THR 452 5.021 -5.594 -9.735
167 HG22 THR 452 HG22 THR 452 3.525 -4.749 -10.136
168 HG23 THR 452 HG23 THR 452 3.844 -6.344 -10.814
169 H LEU 453 HN LEU 453 -0.200 -6.511 -7.403
170 HA LEU 453 HA LEU 453 -1.186 -7.906 -5.906
171 HB2 LEU 453 HB2 LEU 453 -0.025 -9.952 -7.791
172 HB3 LEU 453 HB1 LEU 453 -0.893 -10.431 -6.346
173 HG LEU 453 HG LEU 453 -2.424 -10.563 -8.150
174 HD11 LEU 453 HD11 LEU 453 -4.142 -8.931 -7.544
175 HD12 LEU 453 HD12 LEU 453 -2.938 -8.007 -6.645
176 HD13 LEU 453 HD13 LEU 453 -3.368 -9.636 -6.124
177 HD21 LEU 453 HD21 LEU 453 -1.656 -7.741 -8.876
178 HD22 LEU 453 HD22 LEU 453 -2.927 -8.692 -9.644
179 HD23 LEU 453 HD23 LEU 453 -1.243 -9.198 -9.779
180 H GLU 454 HN GLU 454 1.393 -6.818 -5.465
181 HA GLU 454 HA GLU 454 2.640 -8.841 -3.726
182 HB2 GLU 454 HB2 GLU 454 3.899 -8.484 -5.863
183 HB3 GLU 454 HB1 GLU 454 4.093 -6.796 -5.418
184 HG2 GLU 454 HG2 GLU 454 6.102 -8.038 -4.935
185 HG3 GLU 454 HG1 GLU 454 5.359 -7.467 -3.440
186 H SER 455 HN SER 455 3.370 -8.062 -1.745
187 HA SER 455 HA SER 455 2.471 -5.384 -1.048
188 HB2 SER 455 HB2 SER 455 1.986 -7.397 0.400
189 HB3 SER 455 HB1 SER 455 3.709 -7.465 0.764
190 HG SER 455 HG SER 455 2.589 -6.298 2.351
191 H THR 456 HN THR 456 3.802 -3.700 -1.065
192 HA THR 456 HA THR 456 6.696 -4.212 -0.853
193 HB THR 456 HB THR 456 6.130 -3.574 -3.147
194 HG1 THR 456 HG1 THR 456 7.523 -1.665 -3.232
195 HG21 THR 456 HG21 THR 456 4.086 -2.295 -2.720
196 HG22 THR 456 HG22 THR 456 5.233 -1.351 -3.669
197 HG23 THR 456 HG23 THR 456 5.035 -1.024 -1.947
198 H PHE 457 HN PHE 457 7.935 -2.671 0.290
199 HA PHE 457 HA PHE 457 6.377 -1.355 2.373
200 HB2 PHE 457 HB2 PHE 457 9.353 -1.845 2.127
201 HB3 PHE 457 HB1 PHE 457 8.560 -1.126 3.524
202 HD1 PHE 457 HD1 PHE 457 7.044 -2.489 4.920
203 HD2 PHE 457 HD2 PHE 457 9.347 -4.185 1.770
204 HE1 PHE 457 HE1 PHE 457 6.689 -4.731 5.873
205 HE2 PHE 457 HE2 PHE 457 8.993 -6.429 2.712
206 HZ PHE 457 HZ PHE 457 7.662 -6.705 4.767
207 H GLU 458 HN GLU 458 7.308 -0.424 -0.552
208 HA GLU 458 HA GLU 458 8.433 2.164 0.127
209 HB2 GLU 458 HB2 GLU 458 8.549 2.539 -2.265
210 HB3 GLU 458 HB1 GLU 458 9.193 0.947 -1.892
211 HG2 GLU 458 HG2 GLU 458 6.920 0.030 -2.502
212 HG3 GLU 458 HG1 GLU 458 6.553 1.632 -3.141
213 H LYS 459 HN LYS 459 7.375 4.145 -0.182
214 HA LYS 459 HA LYS 459 4.506 3.923 0.224
215 HB2 LYS 459 HB2 LYS 459 6.380 6.266 0.556
216 HB3 LYS 459 HB1 LYS 459 4.658 6.301 0.920
217 HG2 LYS 459 HG2 LYS 459 4.973 4.554 2.599
218 HG3 LYS 459 HG1 LYS 459 6.697 4.512 2.233
219 HD2 LYS 459 HD2 LYS 459 6.889 6.857 2.943
220 HD3 LYS 459 HD1 LYS 459 5.168 6.869 3.334
221 HE2 LYS 459 HE2 LYS 459 5.526 5.109 4.990
222 HE3 LYS 459 HE1 LYS 459 7.240 5.067 4.585
223 HZ1 LYS 459 HZ1 LYS 459 6.921 6.353 6.563
224 HZ2 LYS 459 HZ2 LYS 459 5.761 7.334 5.815
225 HZ3 LYS 459 HZ3 LYS 459 7.383 7.405 5.318
226 HA PRO 460 HA PRO 460 3.810 4.895 -4.124
227 HB2 PRO 460 HB2 PRO 460 1.013 4.961 -3.162
228 HB3 PRO 460 HB1 PRO 460 1.732 4.011 -4.464
229 HG2 PRO 460 HG2 PRO 460 1.020 2.880 -2.154
230 HG3 PRO 460 HG1 PRO 460 2.470 2.359 -3.032
231 HD2 PRO 460 HD2 PRO 460 2.239 4.086 -0.607
232 HD3 PRO 460 HD1 PRO 460 3.437 2.834 -1.005
233 H GLN 461 HN GLN 461 3.311 6.713 -5.248
234 HA GLN 461 HA GLN 461 2.689 9.104 -3.641
235 HB2 GLN 461 HB2 GLN 461 4.128 8.932 -6.295
236 HB3 GLN 461 HB1 GLN 461 3.909 10.379 -5.320
237 HG2 GLN 461 HG2 GLN 461 5.439 7.939 -4.451
238 HG3 GLN 461 HG1 GLN 461 6.164 9.396 -5.130
239 HE21 GLN 461 HE21 GLN 461 6.422 8.081 -2.486
240 HE22 GLN 461 HE22 GLN 461 6.062 9.316 -1.331
241 H GLU 462 HN GLU 462 1.421 6.995 -5.895
242 HA GLU 462 HA GLU 462 -0.314 8.986 -7.137
243 HB2 GLU 462 HB2 GLU 462 -1.233 6.958 -8.369
244 HB3 GLU 462 HB1 GLU 462 0.429 7.406 -8.719
245 HG2 GLU 462 HG2 GLU 462 -0.171 5.317 -6.668
246 HG3 GLU 462 HG1 GLU 462 -0.194 4.921 -8.385
247 H LEU 463 HN LEU 463 -0.281 7.396 -4.302
248 HA LEU 463 HA LEU 463 -3.200 6.977 -4.238
249 HB2 LEU 463 HB2 LEU 463 -1.322 5.216 -3.536
250 HB3 LEU 463 HB1 LEU 463 -1.384 6.108 -2.032
251 HG LEU 463 HG LEU 463 -3.264 4.154 -3.154
252 HD11 LEU 463 HD11 LEU 463 -1.979 3.691 -1.184
253 HD12 LEU 463 HD12 LEU 463 -3.693 3.754 -0.774
254 HD13 LEU 463 HD13 LEU 463 -2.640 5.112 -0.375
255 HD21 LEU 463 HD21 LEU 463 -4.691 6.097 -3.392
256 HD22 LEU 463 HD22 LEU 463 -4.356 6.575 -1.727
257 HD23 LEU 463 HD23 LEU 463 -5.242 5.085 -2.058
258 H LYS 464 HN LYS 464 -1.261 9.406 -3.881
259 HA LYS 464 HA LYS 464 -2.713 10.523 -1.604
260 HB2 LYS 464 HB2 LYS 464 -0.566 11.736 -0.967
261 HB3 LYS 464 HB1 LYS 464 -0.643 10.022 -0.583
262 HG2 LYS 464 HG2 LYS 464 0.871 9.451 -2.245
263 HG3 LYS 464 HG1 LYS 464 0.608 10.950 -3.136
264 HD2 LYS 464 HD2 LYS 464 1.973 10.721 -0.452
265 HD3 LYS 464 HD1 LYS 464 2.789 10.926 -2.004
266 HE2 LYS 464 HE2 LYS 464 0.935 12.862 -0.629
267 HE3 LYS 464 HE1 LYS 464 2.654 13.070 -0.953
268 HZ1 LYS 464 HZ1 LYS 464 0.481 12.940 -2.977
269 HZ2 LYS 464 HZ2 LYS 464 2.136 13.040 -3.343
270 HZ3 LYS 464 HZ3 LYS 464 1.367 14.317 -2.535
Start of MODEL 4
1 H ALA 431 HN ALA 431 -11.744 -3.003 -4.117
2 HA ALA 431 HA ALA 431 -9.178 -2.295 -5.293
3 HB1 ALA 431 HB1 ALA 431 -10.729 -3.753 -6.529
4 HB2 ALA 431 HB2 ALA 431 -10.372 -2.267 -7.410
5 HB3 ALA 431 HB3 ALA 431 -11.911 -2.443 -6.569
6 H VAL 432 HN VAL 432 -11.407 -0.746 -3.523
7 HA VAL 432 HA VAL 432 -11.774 1.707 -4.904
8 HB VAL 432 HB VAL 432 -11.877 1.213 -1.919
9 HG11 VAL 432 HG11 VAL 432 -13.352 3.144 -1.856
10 HG12 VAL 432 HG12 VAL 432 -13.159 3.363 -3.596
11 HG13 VAL 432 HG13 VAL 432 -11.777 3.576 -2.522
12 HG21 VAL 432 HG21 VAL 432 -14.076 1.017 -3.972
13 HG22 VAL 432 HG22 VAL 432 -14.278 0.880 -2.224
14 HG23 VAL 432 HG23 VAL 432 -13.341 -0.329 -3.100
15 H SER 433 HN SER 433 -9.423 0.522 -2.580
16 HA SER 433 HA SER 433 -7.831 2.960 -2.993
17 HB2 SER 433 HB2 SER 433 -7.591 0.943 -0.746
18 HB3 SER 433 HB1 SER 433 -6.748 2.486 -0.877
19 HG SER 433 HG SER 433 -9.106 3.283 -1.029
20 H GLU 434 HN GLU 434 -6.107 2.726 -4.285
21 HA GLU 434 HA GLU 434 -5.392 0.168 -5.301
22 HB2 GLU 434 HB2 GLU 434 -3.750 2.688 -5.550
23 HB3 GLU 434 HB1 GLU 434 -3.768 1.303 -6.633
24 HG2 GLU 434 HG2 GLU 434 -5.194 2.453 -7.877
25 HG3 GLU 434 HG1 GLU 434 -6.389 2.142 -6.618
26 H TRP 435 HN TRP 435 -4.394 1.984 -2.579
27 HA TRP 435 HA TRP 435 -2.231 0.055 -2.087
28 HB2 TRP 435 HB2 TRP 435 -2.075 2.962 -1.261
29 HB3 TRP 435 HB1 TRP 435 -0.796 1.756 -1.199
30 HD1 TRP 435 HD1 TRP 435 -2.370 4.312 -3.464
31 HE1 TRP 435 HE1 TRP 435 -1.102 4.389 -5.698
32 HE3 TRP 435 HE3 TRP 435 0.565 0.164 -2.875
33 HZ2 TRP 435 HZ2 TRP 435 0.887 2.899 -7.028
34 HZ3 TRP 435 HZ3 TRP 435 2.124 -0.439 -4.686
35 HH2 TRP 435 HH2 TRP 435 2.282 0.900 -6.716
36 H THR 436 HN THR 436 -2.882 -1.130 -0.387
37 HA THR 436 HA THR 436 -4.385 0.201 1.753
38 HB THR 436 HB THR 436 -4.834 -2.119 2.581
39 HG1 THR 436 HG1 THR 436 -3.760 -2.946 0.071
40 HG21 THR 436 HG21 THR 436 -6.472 -0.971 1.184
41 HG22 THR 436 HG22 THR 436 -6.453 -2.698 0.827
42 HG23 THR 436 HG23 THR 436 -5.666 -1.561 -0.269
43 H GLU 437 HN GLU 437 -3.472 0.558 3.710
44 HA GLU 437 HA GLU 437 -0.647 -0.089 3.977
45 HB2 GLU 437 HB2 GLU 437 -2.437 1.593 5.735
46 HB3 GLU 437 HB1 GLU 437 -0.705 1.399 5.939
47 HG2 GLU 437 HG2 GLU 437 -0.426 2.391 3.656
48 HG3 GLU 437 HG1 GLU 437 -2.148 2.772 3.697
49 H TYR 438 HN TYR 438 -0.160 -1.996 4.836
50 HA TYR 438 HA TYR 438 -1.559 -2.748 7.311
51 HB2 TYR 438 HB2 TYR 438 0.098 -4.416 5.405
52 HB3 TYR 438 HB1 TYR 438 -0.459 -4.992 6.973
53 HD1 TYR 438 HD2 TYR 438 -2.811 -5.496 7.351
54 HD2 TYR 438 HD1 TYR 438 -1.451 -4.134 3.553
55 HE1 TYR 438 HE2 TYR 438 -4.934 -6.215 6.339
56 HE2 TYR 438 HE1 TYR 438 -3.571 -4.848 2.535
57 HH TYR 438 HH TYR 438 -6.307 -5.656 4.340
58 H LYS 439 HN LYS 439 -0.530 -2.053 9.061
59 HA LYS 439 HA LYS 439 2.371 -1.662 8.860
60 HB2 LYS 439 HB2 LYS 439 2.086 0.073 10.636
61 HB3 LYS 439 HB1 LYS 439 1.316 0.454 9.104
62 HG2 LYS 439 HG2 LYS 439 -0.854 -0.228 10.048
63 HG3 LYS 439 HG1 LYS 439 -0.058 -0.534 11.597
64 HD2 LYS 439 HD2 LYS 439 0.704 1.837 11.601
65 HD3 LYS 439 HD1 LYS 439 -0.256 2.103 10.147
66 HE2 LYS 439 HE2 LYS 439 -1.342 1.177 12.802
67 HE3 LYS 439 HE1 LYS 439 -1.395 2.835 12.210
68 HZ1 LYS 439 HZ1 LYS 439 -2.733 2.049 10.327
69 HZ2 LYS 439 HZ2 LYS 439 -3.486 1.751 11.816
70 HZ3 LYS 439 HZ3 LYS 439 -2.732 0.486 10.978
71 H THR 440 HN THR 440 3.541 -3.012 9.927
72 HA THR 440 HA THR 440 2.434 -4.393 12.266
73 HB THR 440 HB THR 440 3.251 -5.900 10.563
74 HG1 THR 440 HG1 THR 440 4.937 -6.961 11.824
75 HG21 THR 440 HG21 THR 440 4.822 -4.331 9.471
76 HG22 THR 440 HG22 THR 440 5.546 -5.910 9.781
77 HG23 THR 440 HG23 THR 440 5.933 -4.541 10.824
78 H ALA 441 HN ALA 441 3.663 -4.568 14.192
79 HA ALA 441 HA ALA 441 4.844 -2.147 15.022
80 HB1 ALA 441 HB1 ALA 441 4.897 -4.835 16.381
81 HB2 ALA 441 HB2 ALA 441 3.622 -3.627 16.534
82 HB3 ALA 441 HB3 ALA 441 5.244 -3.279 17.137
83 H ASP 442 HN ASP 442 6.178 -4.639 13.242
84 HA ASP 442 HA ASP 442 8.859 -4.573 14.227
85 HB2 ASP 442 HB2 ASP 442 7.993 -6.476 12.932
86 HB3 ASP 442 HB1 ASP 442 7.764 -5.437 11.534
87 H GLY 443 HN GLY 443 7.033 -2.255 12.773
88 HA2 GLY 443 HA2 GLY 443 7.753 -0.101 12.210
89 HA3 GLY 443 HA1 GLY 443 9.394 -0.716 12.045
90 H LYS 444 HN LYS 444 6.779 -2.386 10.541
91 HA LYS 444 HA LYS 444 7.771 -1.474 7.919
92 HB2 LYS 444 HB2 LYS 444 6.631 -4.178 8.631
93 HB3 LYS 444 HB1 LYS 444 7.210 -3.685 7.048
94 HG2 LYS 444 HG2 LYS 444 8.893 -3.951 9.529
95 HG3 LYS 444 HG1 LYS 444 8.809 -5.109 8.202
96 HD2 LYS 444 HD2 LYS 444 9.519 -3.154 6.704
97 HD3 LYS 444 HD1 LYS 444 9.966 -2.340 8.207
98 HE2 LYS 444 HE2 LYS 444 11.000 -4.998 7.231
99 HE3 LYS 444 HE1 LYS 444 11.887 -3.473 7.241
100 HZ1 LYS 444 HZ1 LYS 444 11.834 -3.455 9.630
101 HZ2 LYS 444 HZ2 LYS 444 12.457 -4.941 9.117
102 HZ3 LYS 444 HZ3 LYS 444 10.860 -4.843 9.679
103 H THR 445 HN THR 445 6.334 -0.305 6.874
104 HA THR 445 HA THR 445 3.489 -1.005 7.127
105 HB THR 445 HB THR 445 3.162 1.160 5.798
106 HG1 THR 445 HG1 THR 445 5.794 1.082 5.714
107 HG21 THR 445 HG21 THR 445 3.339 2.570 7.787
108 HG22 THR 445 HG22 THR 445 4.364 1.361 8.558
109 HG23 THR 445 HG23 THR 445 2.680 0.984 8.191
110 H TYR 446 HN TYR 446 3.301 -2.749 5.775
111 HA TYR 446 HA TYR 446 4.422 -2.466 3.091
112 HB2 TYR 446 HB2 TYR 446 3.958 -4.897 2.832
113 HB3 TYR 446 HB1 TYR 446 5.082 -4.522 4.126
114 HD1 TYR 446 HD1 TYR 446 4.243 -4.619 6.516
115 HD2 TYR 446 HD2 TYR 446 2.003 -6.134 3.233
116 HE1 TYR 446 HE1 TYR 446 2.922 -5.999 8.064
117 HE2 TYR 446 HE2 TYR 446 0.671 -7.514 4.770
118 HH TYR 446 HH TYR 446 0.665 -7.070 8.122
119 H TYR 447 HN TYR 447 3.255 -1.881 1.502
120 HA TYR 447 HA TYR 447 0.380 -1.590 1.828
121 HB2 TYR 447 HB2 TYR 447 2.293 -0.612 -0.308
122 HB3 TYR 447 HB1 TYR 447 0.569 -0.263 -0.282
123 HD1 TYR 447 HD2 TYR 447 3.549 0.037 1.976
124 HD2 TYR 447 HD1 TYR 447 -0.088 1.762 0.597
125 HE1 TYR 447 HE2 TYR 447 3.972 2.019 3.364
126 HE2 TYR 447 HE1 TYR 447 0.329 3.747 1.982
127 HH TYR 447 HH TYR 447 1.565 4.357 3.991
128 H TYR 448 HN TYR 448 -0.931 -3.146 1.124
129 HA TYR 448 HA TYR 448 -0.030 -4.937 -0.989
130 HB2 TYR 448 HB2 TYR 448 -1.176 -5.941 0.939
131 HB3 TYR 448 HB1 TYR 448 -2.596 -4.954 0.618
132 HD1 TYR 448 HD1 TYR 448 -0.453 -7.606 -0.862
133 HD2 TYR 448 HD2 TYR 448 -4.267 -5.721 -0.841
134 HE1 TYR 448 HE1 TYR 448 -1.321 -9.355 -2.358
135 HE2 TYR 448 HE2 TYR 448 -5.141 -7.464 -2.335
136 HH TYR 448 HH TYR 448 -3.567 -10.361 -2.900
137 H ASN 449 HN ASN 449 -0.307 -4.345 -2.993
138 HA ASN 449 HA ASN 449 -2.570 -2.573 -3.634
139 HB2 ASN 449 HB2 ASN 449 -1.214 -1.658 -5.442
140 HB3 ASN 449 HB1 ASN 449 -0.366 -1.501 -3.906
141 HD21 ASN 449 HD21 ASN 449 1.505 -2.657 -3.565
142 HD22 ASN 449 HD22 ASN 449 2.327 -3.494 -4.833
143 H ASN 450 HN ASN 450 -3.822 -3.012 -5.381
144 HA ASN 450 HA ASN 450 -3.663 -5.679 -6.504
145 HB2 ASN 450 HB2 ASN 450 -5.797 -5.109 -7.610
146 HB3 ASN 450 HB1 ASN 450 -5.867 -4.792 -5.880
147 HD21 ASN 450 HD21 ASN 450 -6.110 -2.704 -5.157
148 HD22 ASN 450 HD22 ASN 450 -6.441 -1.376 -6.212
149 H ARG 451 HN ARG 451 -2.059 -2.976 -7.090
150 HA ARG 451 HA ARG 451 -2.244 -2.603 -9.886
151 HB2 ARG 451 HB2 ARG 451 -1.362 -0.870 -8.483
152 HB3 ARG 451 HB1 ARG 451 -0.124 -1.937 -7.848
153 HG2 ARG 451 HG2 ARG 451 1.131 -1.837 -9.827
154 HG3 ARG 451 HG1 ARG 451 -0.218 -1.153 -10.744
155 HD2 ARG 451 HD2 ARG 451 0.018 0.934 -9.799
156 HD3 ARG 451 HD1 ARG 451 0.806 0.311 -8.355
157 HE ARG 451 HE ARG 451 2.742 -0.134 -9.988
158 HH11 ARG 451 HH11 ARG 451 0.488 2.520 -10.333
159 HH12 ARG 451 HH12 ARG 451 1.674 3.620 -10.958
160 HH21 ARG 451 HH21 ARG 451 4.320 1.316 -10.772
161 HH22 ARG 451 HH22 ARG 451 3.860 2.942 -11.188
162 H THR 452 HN THR 452 0.415 -4.093 -7.994
163 HA THR 452 HA THR 452 0.799 -5.952 -10.244
164 HB THR 452 HB THR 452 3.070 -6.363 -9.122
165 HG1 THR 452 HG1 THR 452 3.687 -5.028 -7.563
166 HG21 THR 452 HG21 THR 452 2.499 -3.651 -10.322
167 HG22 THR 452 HG22 THR 452 2.788 -5.135 -11.229
168 HG23 THR 452 HG23 THR 452 4.074 -4.438 -10.243
169 H LEU 453 HN LEU 453 -0.714 -5.868 -7.361
170 HA LEU 453 HA LEU 453 -1.474 -7.375 -5.865
171 HB2 LEU 453 HB2 LEU 453 -0.573 -9.270 -8.018
172 HB3 LEU 453 HB1 LEU 453 -1.249 -9.853 -6.513
173 HG LEU 453 HG LEU 453 -3.005 -9.866 -8.098
174 HD11 LEU 453 HD11 LEU 453 -3.661 -9.056 -5.912
175 HD12 LEU 453 HD12 LEU 453 -4.614 -8.278 -7.175
176 HD13 LEU 453 HD13 LEU 453 -3.297 -7.401 -6.396
177 HD21 LEU 453 HD21 LEU 453 -2.273 -7.020 -8.759
178 HD22 LEU 453 HD22 LEU 453 -3.677 -7.884 -9.384
179 HD23 LEU 453 HD23 LEU 453 -2.051 -8.433 -9.793
180 H GLU 454 HN GLU 454 0.619 -6.319 -4.904
181 HA GLU 454 HA GLU 454 2.038 -8.485 -3.585
182 HB2 GLU 454 HB2 GLU 454 4.247 -7.652 -4.049
183 HB3 GLU 454 HB1 GLU 454 3.428 -7.955 -5.573
184 HG2 GLU 454 HG2 GLU 454 3.001 -5.588 -5.847
185 HG3 GLU 454 HG1 GLU 454 3.732 -5.255 -4.278
186 H SER 455 HN SER 455 2.910 -7.904 -1.581
187 HA SER 455 HA SER 455 2.064 -5.298 -0.555
188 HB2 SER 455 HB2 SER 455 3.266 -7.633 0.956
189 HB3 SER 455 HB1 SER 455 2.474 -6.220 1.650
190 HG SER 455 HG SER 455 0.621 -7.022 0.227
191 H THR 456 HN THR 456 3.518 -3.737 -1.005
192 HA THR 456 HA THR 456 6.373 -4.429 -0.827
193 HB THR 456 HB THR 456 5.777 -3.714 -3.055
194 HG1 THR 456 HG1 THR 456 7.254 -1.954 -3.228
195 HG21 THR 456 HG21 THR 456 4.889 -1.463 -3.511
196 HG22 THR 456 HG22 THR 456 4.740 -1.178 -1.777
197 HG23 THR 456 HG23 THR 456 3.762 -2.423 -2.553
198 H PHE 457 HN PHE 457 7.823 -2.927 0.141
199 HA PHE 457 HA PHE 457 6.604 -1.651 2.450
200 HB2 PHE 457 HB2 PHE 457 9.503 -2.161 1.750
201 HB3 PHE 457 HB1 PHE 457 8.949 -1.446 3.259
202 HD1 PHE 457 HD2 PHE 457 9.005 -4.523 1.241
203 HD2 PHE 457 HD1 PHE 457 8.051 -2.787 5.006
204 HE1 PHE 457 HE2 PHE 457 8.778 -6.772 2.215
205 HE2 PHE 457 HE1 PHE 457 7.827 -5.033 5.993
206 HZ PHE 457 HZ PHE 457 8.188 -7.030 4.593
207 H GLU 458 HN GLU 458 7.212 -0.645 -0.571
208 HA GLU 458 HA GLU 458 8.448 1.906 0.025
209 HB2 GLU 458 HB2 GLU 458 8.231 2.334 -2.372
210 HB3 GLU 458 HB1 GLU 458 8.947 0.754 -2.093
211 HG2 GLU 458 HG2 GLU 458 6.638 -0.211 -2.401
212 HG3 GLU 458 HG1 GLU 458 6.142 1.383 -2.961
213 H LYS 459 HN LYS 459 7.425 3.853 0.209
214 HA LYS 459 HA LYS 459 4.499 3.830 0.213
215 HB2 LYS 459 HB2 LYS 459 6.459 5.930 1.153
216 HB3 LYS 459 HB1 LYS 459 4.708 6.073 1.258
217 HG2 LYS 459 HG2 LYS 459 4.628 4.137 2.734
218 HG3 LYS 459 HG1 LYS 459 6.383 3.976 2.624
219 HD2 LYS 459 HD2 LYS 459 6.650 6.191 3.635
220 HD3 LYS 459 HD1 LYS 459 4.894 6.356 3.733
221 HE2 LYS 459 HE2 LYS 459 6.484 4.174 5.074
222 HE3 LYS 459 HE1 LYS 459 5.956 5.655 5.869
223 HZ1 LYS 459 HZ1 LYS 459 3.798 4.976 5.910
224 HZ2 LYS 459 HZ2 LYS 459 4.550 3.454 5.973
225 HZ3 LYS 459 HZ3 LYS 459 3.934 4.037 4.507
226 HA PRO 460 HA PRO 460 5.098 5.718 -3.873
227 HB2 PRO 460 HB2 PRO 460 2.422 4.848 -4.504
228 HB3 PRO 460 HB1 PRO 460 3.951 4.254 -5.151
229 HG2 PRO 460 HG2 PRO 460 2.299 2.784 -3.538
230 HG3 PRO 460 HG1 PRO 460 4.047 2.523 -3.669
231 HD2 PRO 460 HD2 PRO 460 2.497 3.970 -1.555
232 HD3 PRO 460 HD1 PRO 460 3.898 2.886 -1.394
233 H GLN 461 HN GLN 461 4.563 7.709 -4.526
234 HA GLN 461 HA GLN 461 2.802 9.342 -2.983
235 HB2 GLN 461 HB2 GLN 461 4.926 10.021 -4.268
236 HB3 GLN 461 HB1 GLN 461 3.908 10.035 -5.701
237 HG2 GLN 461 HG2 GLN 461 4.062 12.263 -4.911
238 HG3 GLN 461 HG1 GLN 461 2.435 11.688 -4.547
239 HE21 GLN 461 HE21 GLN 461 5.509 12.636 -3.241
240 HE22 GLN 461 HE22 GLN 461 5.004 12.719 -1.582
241 H GLU 462 HN GLU 462 2.022 7.005 -5.079
242 HA GLU 462 HA GLU 462 0.021 8.275 -6.696
243 HB2 GLU 462 HB2 GLU 462 -0.053 5.349 -6.055
244 HB3 GLU 462 HB1 GLU 462 -0.427 6.166 -7.564
245 HG2 GLU 462 HG2 GLU 462 2.338 5.833 -6.432
246 HG3 GLU 462 HG1 GLU 462 1.615 4.796 -7.658
247 H LEU 463 HN LEU 463 0.241 7.415 -3.468
248 HA LEU 463 HA LEU 463 -2.558 6.789 -3.073
249 HB2 LEU 463 HB2 LEU 463 -0.765 5.711 -1.738
250 HB3 LEU 463 HB1 LEU 463 -0.370 7.275 -1.050
251 HG LEU 463 HG LEU 463 -2.609 7.387 -0.024
252 HD11 LEU 463 HD11 LEU 463 -2.940 4.598 -1.125
253 HD12 LEU 463 HD12 LEU 463 -3.818 6.032 -1.655
254 HD13 LEU 463 HD13 LEU 463 -4.046 5.413 -0.019
255 HD21 LEU 463 HD21 LEU 463 -2.246 5.672 1.671
256 HD22 LEU 463 HD22 LEU 463 -0.730 6.458 1.234
257 HD23 LEU 463 HD23 LEU 463 -1.101 4.853 0.609
258 H LYS 464 HN LYS 464 -4.032 8.100 -2.024
259 HA LYS 464 HA LYS 464 -3.592 10.916 -2.487
260 HB2 LYS 464 HB2 LYS 464 -6.050 9.370 -1.635
261 HB3 LYS 464 HB1 LYS 464 -6.023 11.108 -1.883
262 HG2 LYS 464 HG2 LYS 464 -6.951 10.102 -3.831
263 HG3 LYS 464 HG1 LYS 464 -5.342 10.689 -4.251
264 HD2 LYS 464 HD2 LYS 464 -4.468 8.395 -3.933
265 HD3 LYS 464 HD1 LYS 464 -6.113 7.842 -3.617
266 HE2 LYS 464 HE2 LYS 464 -6.803 8.388 -5.834
267 HE3 LYS 464 HE1 LYS 464 -5.281 9.219 -6.163
268 HZ1 LYS 464 HZ1 LYS 464 -5.342 6.999 -7.152
269 HZ2 LYS 464 HZ2 LYS 464 -5.562 6.300 -5.628
270 HZ3 LYS 464 HZ3 LYS 464 -4.120 7.117 -5.988
Start of MODEL 5
1 H ALA 431 HN ALA 431 -14.401 3.698 0.303
2 HA ALA 431 HA ALA 431 -14.083 4.627 -2.424
3 HB1 ALA 431 HB1 ALA 431 -12.225 4.862 -0.056
4 HB2 ALA 431 HB2 ALA 431 -13.428 6.058 -0.547
5 HB3 ALA 431 HB3 ALA 431 -12.056 5.702 -1.598
6 H VAL 432 HN VAL 432 -12.437 3.997 -3.842
7 HA VAL 432 HA VAL 432 -11.430 1.302 -3.342
8 HB VAL 432 HB VAL 432 -12.633 1.491 -5.410
9 HG11 VAL 432 HG11 VAL 432 -10.730 3.706 -6.162
10 HG12 VAL 432 HG12 VAL 432 -12.442 3.886 -5.784
11 HG13 VAL 432 HG13 VAL 432 -11.948 2.992 -7.221
12 HG21 VAL 432 HG21 VAL 432 -10.700 0.021 -5.440
13 HG22 VAL 432 HG22 VAL 432 -9.668 1.359 -5.941
14 HG23 VAL 432 HG23 VAL 432 -10.929 0.767 -7.022
15 H SER 433 HN SER 433 -9.520 1.224 -2.414
16 HA SER 433 HA SER 433 -7.388 2.966 -3.454
17 HB2 SER 433 HB2 SER 433 -6.288 2.656 -1.217
18 HB3 SER 433 HB1 SER 433 -7.819 3.527 -1.135
19 HG SER 433 HG SER 433 -7.743 0.731 -0.800
20 H GLU 434 HN GLU 434 -6.085 1.823 -4.760
21 HA GLU 434 HA GLU 434 -5.984 -1.029 -4.685
22 HB2 GLU 434 HB2 GLU 434 -3.954 0.708 -6.076
23 HB3 GLU 434 HB1 GLU 434 -4.489 -0.907 -6.515
24 HG2 GLU 434 HG2 GLU 434 -5.653 0.239 -8.063
25 HG3 GLU 434 HG1 GLU 434 -6.815 0.382 -6.744
26 H TRP 435 HN TRP 435 -4.338 1.421 -3.007
27 HA TRP 435 HA TRP 435 -2.171 -0.411 -2.250
28 HB2 TRP 435 HB2 TRP 435 -2.295 2.542 -1.619
29 HB3 TRP 435 HB1 TRP 435 -0.889 1.484 -1.573
30 HD1 TRP 435 HD1 TRP 435 -2.834 3.743 -3.866
31 HE1 TRP 435 HE1 TRP 435 -1.716 3.818 -6.173
32 HE3 TRP 435 HE3 TRP 435 0.517 -0.080 -3.272
33 HZ2 TRP 435 HZ2 TRP 435 0.317 2.450 -7.562
34 HZ3 TRP 435 HZ3 TRP 435 2.011 -0.626 -5.151
35 HH2 TRP 435 HH2 TRP 435 1.914 0.614 -7.248
36 H THR 436 HN THR 436 -2.980 -1.634 -0.616
37 HA THR 436 HA THR 436 -4.381 -0.264 1.574
38 HB THR 436 HB THR 436 -4.120 -3.241 1.096
39 HG1 THR 436 HG1 THR 436 -5.481 -1.579 -0.333
40 HG21 THR 436 HG21 THR 436 -5.946 -1.649 2.904
41 HG22 THR 436 HG22 THR 436 -4.588 -2.646 3.423
42 HG23 THR 436 HG23 THR 436 -5.997 -3.396 2.674
43 H GLU 437 HN GLU 437 -3.360 0.112 3.447
44 HA GLU 437 HA GLU 437 -0.615 -0.826 3.686
45 HB2 GLU 437 HB2 GLU 437 -0.437 0.805 5.520
46 HB3 GLU 437 HB1 GLU 437 -1.008 1.542 4.030
47 HG2 GLU 437 HG2 GLU 437 -3.249 1.632 4.857
48 HG3 GLU 437 HG1 GLU 437 -2.812 0.691 6.280
49 H TYR 438 HN TYR 438 -0.013 -2.442 4.938
50 HA TYR 438 HA TYR 438 -1.667 -3.046 7.297
51 HB2 TYR 438 HB2 TYR 438 -0.042 -4.926 5.573
52 HB3 TYR 438 HB1 TYR 438 -0.689 -5.370 7.151
53 HD1 TYR 438 HD2 TYR 438 -3.208 -5.209 7.488
54 HD2 TYR 438 HD1 TYR 438 -1.382 -5.107 3.647
55 HE1 TYR 438 HE2 TYR 438 -5.359 -5.796 6.459
56 HE2 TYR 438 HE1 TYR 438 -3.533 -5.690 2.605
57 HH TYR 438 HH TYR 438 -6.476 -5.522 4.257
58 H LYS 439 HN LYS 439 -0.742 -2.450 9.096
59 HA LYS 439 HA LYS 439 2.127 -1.907 9.075
60 HB2 LYS 439 HB2 LYS 439 1.620 -0.588 11.152
61 HB3 LYS 439 HB1 LYS 439 0.853 0.001 9.688
62 HG2 LYS 439 HG2 LYS 439 -1.242 -1.116 10.370
63 HG3 LYS 439 HG1 LYS 439 -0.458 -1.602 11.875
64 HD2 LYS 439 HD2 LYS 439 -1.770 0.387 12.261
65 HD3 LYS 439 HD1 LYS 439 -0.056 0.784 12.392
66 HE2 LYS 439 HE2 LYS 439 -1.100 2.531 11.154
67 HE3 LYS 439 HE1 LYS 439 -0.146 1.577 10.019
68 HZ1 LYS 439 HZ1 LYS 439 -2.196 1.982 8.976
69 HZ2 LYS 439 HZ2 LYS 439 -3.087 1.597 10.361
70 HZ3 LYS 439 HZ3 LYS 439 -2.291 0.370 9.504
71 H THR 440 HN THR 440 3.466 -3.254 9.971
72 HA THR 440 HA THR 440 2.503 -5.170 11.960
73 HB THR 440 HB THR 440 3.714 -6.226 10.179
74 HG1 THR 440 HG1 THR 440 5.073 -7.379 11.418
75 HG21 THR 440 HG21 THR 440 4.956 -4.275 9.369
76 HG22 THR 440 HG22 THR 440 6.017 -5.663 9.604
77 HG23 THR 440 HG23 THR 440 6.002 -4.354 10.786
78 H ALA 441 HN ALA 441 3.604 -5.460 13.948
79 HA ALA 441 HA ALA 441 4.211 -3.075 15.303
80 HB1 ALA 441 HB1 ALA 441 4.746 -4.484 17.200
81 HB2 ALA 441 HB2 ALA 441 4.826 -5.898 16.150
82 HB3 ALA 441 HB3 ALA 441 3.291 -5.064 16.393
83 H ASP 442 HN ASP 442 6.142 -4.845 13.232
84 HA ASP 442 HA ASP 442 8.717 -4.436 14.303
85 HB2 ASP 442 HB2 ASP 442 8.430 -5.940 12.453
86 HB3 ASP 442 HB1 ASP 442 7.705 -4.680 11.464
87 H GLY 443 HN GLY 443 6.391 -2.244 13.190
88 HA2 GLY 443 HA2 GLY 443 6.546 0.094 13.094
89 HA3 GLY 443 HA1 GLY 443 8.303 -0.042 13.168
90 H LYS 444 HN LYS 444 6.284 -1.870 11.028
91 HA LYS 444 HA LYS 444 7.488 -0.474 8.734
92 HB2 LYS 444 HB2 LYS 444 8.571 -2.667 9.239
93 HB3 LYS 444 HB1 LYS 444 7.012 -3.448 9.013
94 HG2 LYS 444 HG2 LYS 444 8.128 -3.768 7.001
95 HG3 LYS 444 HG1 LYS 444 7.023 -2.431 6.686
96 HD2 LYS 444 HD2 LYS 444 8.993 -1.679 5.734
97 HD3 LYS 444 HD1 LYS 444 9.044 -0.937 7.333
98 HE2 LYS 444 HE2 LYS 444 10.359 -3.572 6.716
99 HE3 LYS 444 HE1 LYS 444 11.185 -2.029 6.504
100 HZ1 LYS 444 HZ1 LYS 444 10.759 -1.581 8.886
101 HZ2 LYS 444 HZ2 LYS 444 11.753 -2.924 8.622
102 HZ3 LYS 444 HZ3 LYS 444 10.131 -3.150 9.054
103 H THR 445 HN THR 445 6.087 0.101 7.182
104 HA THR 445 HA THR 445 3.357 -0.979 7.319
105 HB THR 445 HB THR 445 2.873 1.229 5.984
106 HG1 THR 445 HG1 THR 445 4.429 2.845 7.123
107 HG21 THR 445 HG21 THR 445 2.438 2.405 8.090
108 HG22 THR 445 HG22 THR 445 3.453 1.246 8.951
109 HG23 THR 445 HG23 THR 445 1.954 0.712 8.190
110 H TYR 446 HN TYR 446 3.432 -2.625 5.849
111 HA TYR 446 HA TYR 446 4.562 -2.022 3.223
112 HB2 TYR 446 HB2 TYR 446 4.361 -4.439 2.758
113 HB3 TYR 446 HB1 TYR 446 5.347 -4.107 4.171
114 HD1 TYR 446 HD1 TYR 446 4.560 -4.730 6.408
115 HD2 TYR 446 HD2 TYR 446 2.264 -5.610 2.936
116 HE1 TYR 446 HE1 TYR 446 3.231 -6.346 7.702
117 HE2 TYR 446 HE2 TYR 446 0.927 -7.220 4.220
118 HH TYR 446 HH TYR 446 1.085 -8.569 6.207
119 H TYR 447 HN TYR 447 3.383 -1.692 1.500
120 HA TYR 447 HA TYR 447 0.480 -1.688 1.839
121 HB2 TYR 447 HB2 TYR 447 2.325 -0.276 -0.084
122 HB3 TYR 447 HB1 TYR 447 0.581 -0.320 -0.325
123 HD1 TYR 447 HD2 TYR 447 3.198 0.718 2.110
124 HD2 TYR 447 HD1 TYR 447 -0.809 1.207 0.768
125 HE1 TYR 447 HE2 TYR 447 2.932 2.641 3.621
126 HE2 TYR 447 HE1 TYR 447 -1.085 3.128 2.275
127 HH TYR 447 HH TYR 447 -0.098 4.011 4.339
128 H TYR 448 HN TYR 448 -0.627 -3.301 1.096
129 HA TYR 448 HA TYR 448 0.473 -5.066 -0.934
130 HB2 TYR 448 HB2 TYR 448 -0.530 -6.116 1.022
131 HB3 TYR 448 HB1 TYR 448 -2.035 -5.245 0.746
132 HD1 TYR 448 HD1 TYR 448 0.259 -7.412 -1.270
133 HD2 TYR 448 HD2 TYR 448 -3.739 -6.532 -0.110
134 HE1 TYR 448 HE1 TYR 448 -0.550 -9.259 -2.675
135 HE2 TYR 448 HE2 TYR 448 -4.557 -8.378 -1.513
136 HH TYR 448 HH TYR 448 -2.405 -10.682 -2.949
137 H ASN 449 HN ASN 449 -0.027 -4.889 -2.993
138 HA ASN 449 HA ASN 449 -2.507 -3.508 -3.731
139 HB2 ASN 449 HB2 ASN 449 -1.362 -2.212 -5.428
140 HB3 ASN 449 HB1 ASN 449 -0.605 -1.912 -3.868
141 HD21 ASN 449 HD21 ASN 449 1.455 -2.707 -3.470
142 HD22 ASN 449 HD22 ASN 449 2.489 -3.247 -4.745
143 H ASN 450 HN ASN 450 -3.481 -4.211 -5.570
144 HA ASN 450 HA ASN 450 -2.677 -6.825 -6.516
145 HB2 ASN 450 HB2 ASN 450 -4.805 -6.852 -7.693
146 HB3 ASN 450 HB1 ASN 450 -5.057 -6.320 -6.034
147 HD21 ASN 450 HD21 ASN 450 -6.619 -5.899 -8.511
148 HD22 ASN 450 HD22 ASN 450 -6.804 -4.177 -8.651
149 H ARG 451 HN ARG 451 -1.815 -3.753 -7.338
150 HA ARG 451 HA ARG 451 -1.878 -3.864 -10.167
151 HB2 ARG 451 HB2 ARG 451 -0.131 -2.280 -8.284
152 HB3 ARG 451 HB1 ARG 451 -0.072 -2.104 -10.031
153 HG2 ARG 451 HG2 ARG 451 -2.497 -1.492 -9.970
154 HG3 ARG 451 HG1 ARG 451 -2.383 -1.481 -8.206
155 HD2 ARG 451 HD2 ARG 451 -0.659 0.221 -8.304
156 HD3 ARG 451 HD1 ARG 451 -0.686 0.180 -10.064
157 HE ARG 451 HE ARG 451 -3.166 0.887 -8.696
158 HH11 ARG 451 HH11 ARG 451 -0.369 1.883 -10.533
159 HH12 ARG 451 HH12 ARG 451 -1.008 3.455 -10.902
160 HH21 ARG 451 HH21 ARG 451 -4.018 2.968 -9.167
161 HH22 ARG 451 HH22 ARG 451 -3.064 4.073 -10.126
162 H THR 452 HN THR 452 0.756 -4.455 -7.845
163 HA THR 452 HA THR 452 2.135 -5.972 -9.950
164 HB THR 452 HB THR 452 3.385 -4.099 -8.854
165 HG1 THR 452 HG1 THR 452 4.403 -6.746 -8.533
166 HG21 THR 452 HG21 THR 452 2.530 -4.331 -6.582
167 HG22 THR 452 HG22 THR 452 4.289 -4.460 -6.601
168 HG23 THR 452 HG23 THR 452 3.300 -5.912 -6.440
169 H LEU 453 HN LEU 453 0.045 -6.518 -7.510
170 HA LEU 453 HA LEU 453 -0.638 -8.353 -6.361
171 HB2 LEU 453 HB2 LEU 453 1.227 -9.672 -8.323
172 HB3 LEU 453 HB1 LEU 453 0.363 -10.595 -7.111
173 HG LEU 453 HG LEU 453 -1.778 -9.641 -8.099
174 HD11 LEU 453 HD11 LEU 453 -0.806 -7.785 -9.337
175 HD12 LEU 453 HD12 LEU 453 -1.675 -8.880 -10.415
176 HD13 LEU 453 HD13 LEU 453 0.087 -8.918 -10.352
177 HD21 LEU 453 HD21 LEU 453 -1.814 -11.281 -9.907
178 HD22 LEU 453 HD22 LEU 453 -1.054 -11.938 -8.457
179 HD23 LEU 453 HD23 LEU 453 -0.058 -11.421 -9.818
180 H GLU 454 HN GLU 454 1.511 -6.770 -5.299
181 HA GLU 454 HA GLU 454 2.814 -8.730 -3.586
182 HB2 GLU 454 HB2 GLU 454 4.346 -8.552 -5.481
183 HB3 GLU 454 HB1 GLU 454 4.365 -6.801 -5.328
184 HG2 GLU 454 HG2 GLU 454 5.511 -6.930 -3.237
185 HG3 GLU 454 HG1 GLU 454 5.331 -8.682 -3.189
186 H SER 455 HN SER 455 3.576 -7.869 -1.640
187 HA SER 455 HA SER 455 2.512 -5.249 -0.965
188 HB2 SER 455 HB2 SER 455 3.868 -7.305 0.797
189 HB3 SER 455 HB1 SER 455 3.024 -5.860 1.351
190 HG SER 455 HG SER 455 1.923 -8.124 0.032
191 H THR 456 HN THR 456 3.721 -3.530 -1.288
192 HA THR 456 HA THR 456 6.635 -3.830 -1.337
193 HB THR 456 HB THR 456 5.705 -2.826 -3.341
194 HG1 THR 456 HG1 THR 456 6.801 -0.680 -3.130
195 HG21 THR 456 HG21 THR 456 3.636 -1.922 -2.409
196 HG22 THR 456 HG22 THR 456 4.522 -0.678 -3.291
197 HG23 THR 456 HG23 THR 456 4.556 -0.704 -1.527
198 H PHE 457 HN PHE 457 7.988 -2.488 -0.138
199 HA PHE 457 HA PHE 457 6.758 -1.376 2.272
200 HB2 PHE 457 HB2 PHE 457 9.664 -1.872 1.577
201 HB3 PHE 457 HB1 PHE 457 9.080 -1.280 3.128
202 HD1 PHE 457 HD1 PHE 457 7.834 -2.751 4.631
203 HD2 PHE 457 HD2 PHE 457 9.486 -4.181 0.975
204 HE1 PHE 457 HE1 PHE 457 7.587 -5.068 5.426
205 HE2 PHE 457 HE2 PHE 457 9.234 -6.499 1.761
206 HZ PHE 457 HZ PHE 457 8.283 -6.946 3.989
207 H GLU 458 HN GLU 458 7.407 -0.320 -0.703
208 HA GLU 458 HA GLU 458 8.374 2.322 0.142
209 HB2 GLU 458 HB2 GLU 458 9.753 1.207 -1.551
210 HB3 GLU 458 HB1 GLU 458 8.351 1.049 -2.600
211 HG2 GLU 458 HG2 GLU 458 8.220 3.418 -2.889
212 HG3 GLU 458 HG1 GLU 458 9.471 3.682 -1.673
213 H LYS 459 HN LYS 459 6.939 3.895 0.236
214 HA LYS 459 HA LYS 459 4.250 3.503 -0.697
215 HB2 LYS 459 HB2 LYS 459 5.566 5.918 0.557
216 HB3 LYS 459 HB1 LYS 459 3.840 5.729 0.282
217 HG2 LYS 459 HG2 LYS 459 3.796 3.832 1.814
218 HG3 LYS 459 HG1 LYS 459 5.532 4.009 2.083
219 HD2 LYS 459 HD2 LYS 459 4.263 5.037 3.890
220 HD3 LYS 459 HD1 LYS 459 5.162 6.254 2.981
221 HE2 LYS 459 HE2 LYS 459 3.100 6.770 1.712
222 HE3 LYS 459 HE1 LYS 459 2.224 5.617 2.720
223 HZ1 LYS 459 HZ1 LYS 459 2.784 6.951 4.657
224 HZ2 LYS 459 HZ2 LYS 459 1.927 7.869 3.517
225 HZ3 LYS 459 HZ3 LYS 459 3.607 8.064 3.677
226 HA PRO 460 HA PRO 460 5.119 5.581 -4.585
227 HB2 PRO 460 HB2 PRO 460 2.941 4.722 -5.880
228 HB3 PRO 460 HB1 PRO 460 4.289 3.633 -5.531
229 HG2 PRO 460 HG2 PRO 460 1.653 3.886 -4.158
230 HG3 PRO 460 HG1 PRO 460 2.595 2.431 -4.523
231 HD2 PRO 460 HD2 PRO 460 2.525 3.729 -2.067
232 HD3 PRO 460 HD1 PRO 460 3.780 2.591 -2.592
233 H GLN 461 HN GLN 461 4.316 7.411 -5.592
234 HA GLN 461 HA GLN 461 2.658 9.099 -3.977
235 HB2 GLN 461 HB2 GLN 461 4.615 9.924 -5.247
236 HB3 GLN 461 HB1 GLN 461 3.785 9.553 -6.749
237 HG2 GLN 461 HG2 GLN 461 2.213 11.265 -6.430
238 HG3 GLN 461 HG1 GLN 461 2.642 11.455 -4.731
239 HE21 GLN 461 HE21 GLN 461 3.638 12.066 -8.024
240 HE22 GLN 461 HE22 GLN 461 4.816 13.276 -7.644
241 H GLU 462 HN GLU 462 1.812 6.648 -5.914
242 HA GLU 462 HA GLU 462 -0.425 7.780 -7.301
243 HB2 GLU 462 HB2 GLU 462 0.695 5.698 -8.042
244 HB3 GLU 462 HB1 GLU 462 0.147 4.899 -6.580
245 HG2 GLU 462 HG2 GLU 462 -1.291 4.241 -8.341
246 HG3 GLU 462 HG1 GLU 462 -2.193 5.337 -7.299
247 H LEU 463 HN LEU 463 0.199 7.053 -4.072
248 HA LEU 463 HA LEU 463 -2.605 6.521 -3.441
249 HB2 LEU 463 HB2 LEU 463 -0.875 5.145 -2.357
250 HB3 LEU 463 HB1 LEU 463 -0.184 6.590 -1.641
251 HG LEU 463 HG LEU 463 -2.293 6.949 -0.391
252 HD11 LEU 463 HD11 LEU 463 -3.053 4.266 -1.536
253 HD12 LEU 463 HD12 LEU 463 -3.821 5.810 -1.908
254 HD13 LEU 463 HD13 LEU 463 -3.933 5.139 -0.280
255 HD21 LEU 463 HD21 LEU 463 -1.961 5.148 1.209
256 HD22 LEU 463 HD22 LEU 463 -0.413 5.770 0.633
257 HD23 LEU 463 HD23 LEU 463 -1.037 4.241 0.010
258 H LYS 464 HN LYS 464 -3.898 8.162 -3.064
259 HA LYS 464 HA LYS 464 -2.764 10.754 -2.332
260 HB2 LYS 464 HB2 LYS 464 -5.576 10.068 -3.225
261 HB3 LYS 464 HB1 LYS 464 -4.950 11.685 -2.954
262 HG2 LYS 464 HG2 LYS 464 -4.858 11.495 -5.245
263 HG3 LYS 464 HG1 LYS 464 -3.217 11.055 -4.774
264 HD2 LYS 464 HD2 LYS 464 -3.850 8.673 -4.901
265 HD3 LYS 464 HD1 LYS 464 -5.461 9.149 -5.440
266 HE2 LYS 464 HE2 LYS 464 -4.474 10.225 -7.410
267 HE3 LYS 464 HE1 LYS 464 -2.869 9.734 -6.870
268 HZ1 LYS 464 HZ1 LYS 464 -3.689 7.398 -6.979
269 HZ2 LYS 464 HZ2 LYS 464 -3.585 8.170 -8.480
270 HZ3 LYS 464 HZ3 LYS 464 -5.097 7.971 -7.734
Start of MODEL 6
1 H ALA 431 HN ALA 431 -7.446 7.076 -3.337
2 HA ALA 431 HA ALA 431 -7.226 4.361 -4.277
3 HB1 ALA 431 HB1 ALA 431 -5.256 5.818 -4.155
4 HB2 ALA 431 HB2 ALA 431 -5.054 4.357 -3.188
5 HB3 ALA 431 HB3 ALA 431 -5.428 5.889 -2.400
6 H VAL 432 HN VAL 432 -8.798 3.169 -3.329
7 HA VAL 432 HA VAL 432 -8.622 2.881 -0.399
8 HB VAL 432 HB VAL 432 -11.012 2.127 -0.447
9 HG11 VAL 432 HG11 VAL 432 -10.396 4.374 0.275
10 HG12 VAL 432 HG12 VAL 432 -11.940 4.388 -0.577
11 HG13 VAL 432 HG13 VAL 432 -10.478 4.941 -1.394
12 HG21 VAL 432 HG21 VAL 432 -12.394 2.759 -2.369
13 HG22 VAL 432 HG22 VAL 432 -11.181 1.557 -2.812
14 HG23 VAL 432 HG23 VAL 432 -10.945 3.249 -3.248
15 H SER 433 HN SER 433 -9.086 1.170 -3.467
16 HA SER 433 HA SER 433 -8.830 -1.370 -2.017
17 HB2 SER 433 HB2 SER 433 -9.794 -2.325 -4.183
18 HB3 SER 433 HB1 SER 433 -10.875 -1.335 -3.200
19 HG SER 433 HG SER 433 -9.345 -0.266 -5.335
20 H GLU 434 HN GLU 434 -7.123 0.681 -4.159
21 HA GLU 434 HA GLU 434 -5.660 -1.476 -5.410
22 HB2 GLU 434 HB2 GLU 434 -4.315 0.473 -6.402
23 HB3 GLU 434 HB1 GLU 434 -5.984 0.273 -6.910
24 HG2 GLU 434 HG2 GLU 434 -5.316 2.117 -4.660
25 HG3 GLU 434 HG1 GLU 434 -5.078 2.627 -6.330
26 H TRP 435 HN TRP 435 -5.318 0.524 -2.636
27 HA TRP 435 HA TRP 435 -2.714 -0.745 -2.159
28 HB2 TRP 435 HB2 TRP 435 -3.299 2.107 -1.348
29 HB3 TRP 435 HB1 TRP 435 -1.777 1.244 -1.187
30 HD1 TRP 435 HD1 TRP 435 -3.589 3.540 -3.408
31 HE1 TRP 435 HE1 TRP 435 -2.327 3.881 -5.622
32 HE3 TRP 435 HE3 TRP 435 -0.185 -0.225 -2.957
33 HZ2 TRP 435 HZ2 TRP 435 -0.160 2.703 -6.991
34 HZ3 TRP 435 HZ3 TRP 435 1.452 -0.562 -4.772
35 HH2 TRP 435 HH2 TRP 435 1.465 0.883 -6.736
36 H THR 436 HN THR 436 -3.095 -2.075 -0.499
37 HA THR 436 HA THR 436 -4.749 -1.093 1.715
38 HB THR 436 HB THR 436 -4.478 -3.452 2.611
39 HG1 THR 436 HG1 THR 436 -3.533 -3.943 -0.038
40 HG21 THR 436 HG21 THR 436 -6.168 -4.401 1.152
41 HG22 THR 436 HG22 THR 436 -5.790 -3.212 -0.093
42 HG23 THR 436 HG23 THR 436 -6.510 -2.692 1.431
43 H GLU 437 HN GLU 437 -3.638 0.055 3.157
44 HA GLU 437 HA GLU 437 -0.794 -0.452 3.467
45 HB2 GLU 437 HB2 GLU 437 -0.819 1.610 4.869
46 HB3 GLU 437 HB1 GLU 437 -1.366 1.854 3.218
47 HG2 GLU 437 HG2 GLU 437 -3.672 1.897 3.961
48 HG3 GLU 437 HG1 GLU 437 -3.164 1.557 5.615
49 H TYR 438 HN TYR 438 -0.323 -2.085 4.753
50 HA TYR 438 HA TYR 438 -1.753 -2.304 7.305
51 HB2 TYR 438 HB2 TYR 438 -0.078 -4.305 5.783
52 HB3 TYR 438 HB1 TYR 438 -0.659 -4.576 7.423
53 HD1 TYR 438 HD2 TYR 438 -3.066 -4.843 7.856
54 HD2 TYR 438 HD1 TYR 438 -1.562 -4.489 3.893
55 HE1 TYR 438 HE2 TYR 438 -5.192 -5.708 6.978
56 HE2 TYR 438 HE1 TYR 438 -3.690 -5.348 3.001
57 HH TYR 438 HH TYR 438 -5.595 -6.756 3.804
58 H LYS 439 HN LYS 439 -0.822 -1.296 8.903
59 HA LYS 439 HA LYS 439 2.069 -0.876 8.891
60 HB2 LYS 439 HB2 LYS 439 0.573 1.072 9.212
61 HB3 LYS 439 HB1 LYS 439 -0.074 0.321 10.662
62 HG2 LYS 439 HG2 LYS 439 2.220 0.397 11.635
63 HG3 LYS 439 HG1 LYS 439 2.725 1.329 10.222
64 HD2 LYS 439 HD2 LYS 439 0.834 2.927 10.787
65 HD3 LYS 439 HD1 LYS 439 0.720 2.085 12.332
66 HE2 LYS 439 HE2 LYS 439 2.087 4.033 12.622
67 HE3 LYS 439 HE1 LYS 439 3.116 2.604 12.726
68 HZ1 LYS 439 HZ1 LYS 439 2.776 4.108 10.198
69 HZ2 LYS 439 HZ2 LYS 439 3.999 3.004 10.608
70 HZ3 LYS 439 HZ3 LYS 439 3.955 4.535 11.340
71 H THR 440 HN THR 440 3.104 -2.573 9.755
72 HA THR 440 HA THR 440 1.954 -3.861 12.114
73 HB THR 440 HB THR 440 2.623 -5.387 10.345
74 HG1 THR 440 HG1 THR 440 3.001 -6.503 12.113
75 HG21 THR 440 HG21 THR 440 4.373 -3.984 9.325
76 HG22 THR 440 HG22 THR 440 4.924 -5.631 9.626
77 HG23 THR 440 HG23 THR 440 5.422 -4.322 10.700
78 H ALA 441 HN ALA 441 3.078 -4.073 14.038
79 HA ALA 441 HA ALA 441 4.598 -1.789 14.778
80 HB1 ALA 441 HB1 ALA 441 4.063 -4.329 16.308
81 HB2 ALA 441 HB2 ALA 441 3.054 -2.882 16.313
82 HB3 ALA 441 HB3 ALA 441 4.683 -2.825 16.987
83 H ASP 442 HN ASP 442 5.524 -4.489 13.150
84 HA ASP 442 HA ASP 442 8.108 -4.928 14.285
85 HB2 ASP 442 HB2 ASP 442 6.778 -6.527 12.799
86 HB3 ASP 442 HB1 ASP 442 7.286 -5.529 11.441
87 H GLY 443 HN GLY 443 6.788 -2.347 12.696
88 HA2 GLY 443 HA2 GLY 443 7.927 -0.308 12.479
89 HA3 GLY 443 HA1 GLY 443 9.446 -1.189 12.409
90 H LYS 444 HN LYS 444 6.610 -1.925 10.482
91 HA LYS 444 HA LYS 444 7.734 -0.562 8.174
92 HB2 LYS 444 HB2 LYS 444 7.674 -2.617 6.764
93 HB3 LYS 444 HB1 LYS 444 8.922 -2.634 8.000
94 HG2 LYS 444 HG2 LYS 444 6.490 -3.828 8.980
95 HG3 LYS 444 HG1 LYS 444 7.022 -4.600 7.485
96 HD2 LYS 444 HD2 LYS 444 8.893 -4.079 9.780
97 HD3 LYS 444 HD1 LYS 444 7.925 -5.551 9.669
98 HE2 LYS 444 HE2 LYS 444 9.800 -4.604 7.510
99 HE3 LYS 444 HE1 LYS 444 10.256 -5.747 8.772
100 HZ1 LYS 444 HZ1 LYS 444 8.000 -6.191 6.891
101 HZ2 LYS 444 HZ2 LYS 444 8.663 -7.306 7.977
102 HZ3 LYS 444 HZ3 LYS 444 9.567 -6.784 6.639
103 H THR 445 HN THR 445 6.209 0.180 6.846
104 HA THR 445 HA THR 445 3.471 -0.827 7.117
105 HB THR 445 HB THR 445 3.040 1.155 5.479
106 HG1 THR 445 HG1 THR 445 5.378 1.443 5.154
107 HG21 THR 445 HG21 THR 445 2.985 2.764 7.387
108 HG22 THR 445 HG22 THR 445 3.831 1.563 8.361
109 HG23 THR 445 HG23 THR 445 2.223 1.212 7.731
110 H TYR 446 HN TYR 446 3.114 -2.557 5.813
111 HA TYR 446 HA TYR 446 4.348 -2.483 3.158
112 HB2 TYR 446 HB2 TYR 446 3.832 -4.900 3.011
113 HB3 TYR 446 HB1 TYR 446 4.915 -4.495 4.331
114 HD1 TYR 446 HD1 TYR 446 3.988 -4.486 6.692
115 HD2 TYR 446 HD2 TYR 446 1.818 -6.040 3.376
116 HE1 TYR 446 HE1 TYR 446 2.569 -5.776 8.231
117 HE2 TYR 446 HE2 TYR 446 0.391 -7.328 4.905
118 HH TYR 446 HH TYR 446 0.529 -8.270 7.194
119 H TYR 447 HN TYR 447 3.222 -1.905 1.530
120 HA TYR 447 HA TYR 447 0.310 -1.749 1.744
121 HB2 TYR 447 HB2 TYR 447 2.175 -0.570 -0.338
122 HB3 TYR 447 HB1 TYR 447 0.455 -0.239 -0.183
123 HD1 TYR 447 HD2 TYR 447 3.677 0.094 1.673
124 HD2 TYR 447 HD1 TYR 447 -0.269 1.574 1.097
125 HE1 TYR 447 HE2 TYR 447 4.183 1.993 3.145
126 HE2 TYR 447 HE1 TYR 447 0.228 3.479 2.570
127 HH TYR 447 HH TYR 447 1.726 4.116 4.316
128 H TYR 448 HN TYR 448 -0.749 -3.490 1.002
129 HA TYR 448 HA TYR 448 0.455 -5.096 -1.109
130 HB2 TYR 448 HB2 TYR 448 -0.489 -6.329 0.760
131 HB3 TYR 448 HB1 TYR 448 -2.050 -5.545 0.524
132 HD1 TYR 448 HD1 TYR 448 0.421 -7.583 -1.416
133 HD2 TYR 448 HD2 TYR 448 -3.670 -6.717 -0.634
134 HE1 TYR 448 HE1 TYR 448 -0.246 -9.378 -2.958
135 HE2 TYR 448 HE2 TYR 448 -4.350 -8.513 -2.169
136 HH TYR 448 HH TYR 448 -3.489 -9.772 -4.026
137 H ASN 449 HN ASN 449 0.043 -4.755 -3.146
138 HA ASN 449 HA ASN 449 -2.536 -3.538 -3.874
139 HB2 ASN 449 HB2 ASN 449 -1.409 -2.395 -5.732
140 HB3 ASN 449 HB1 ASN 449 -0.751 -1.890 -4.181
141 HD21 ASN 449 HD21 ASN 449 1.355 -2.474 -3.646
142 HD22 ASN 449 HD22 ASN 449 2.465 -3.098 -4.815
143 H ASN 450 HN ASN 450 -3.568 -4.312 -5.622
144 HA ASN 450 HA ASN 450 -2.719 -6.872 -6.664
145 HB2 ASN 450 HB2 ASN 450 -4.876 -6.882 -7.829
146 HB3 ASN 450 HB1 ASN 450 -5.096 -6.493 -6.128
147 HD21 ASN 450 HD21 ASN 450 -6.766 -5.927 -8.494
148 HD22 ASN 450 HD22 ASN 450 -7.012 -4.215 -8.482
149 H ARG 451 HN ARG 451 -1.744 -3.865 -7.328
150 HA ARG 451 HA ARG 451 -2.021 -3.727 -10.144
151 HB2 ARG 451 HB2 ARG 451 -1.511 -1.749 -8.694
152 HB3 ARG 451 HB1 ARG 451 0.121 -2.384 -8.499
153 HG2 ARG 451 HG2 ARG 451 0.564 -2.160 -10.837
154 HG3 ARG 451 HG1 ARG 451 -1.117 -1.743 -11.167
155 HD2 ARG 451 HD2 ARG 451 0.028 0.294 -11.218
156 HD3 ARG 451 HD1 ARG 451 -0.748 0.257 -9.638
157 HE ARG 451 HE ARG 451 1.905 -0.780 -9.513
158 HH11 ARG 451 HH11 ARG 451 0.073 2.200 -9.711
159 HH12 ARG 451 HH12 ARG 451 1.316 3.176 -8.979
160 HH21 ARG 451 HH21 ARG 451 3.563 0.493 -8.576
161 HH22 ARG 451 HH22 ARG 451 3.306 2.194 -8.319
162 H THR 452 HN THR 452 0.740 -4.581 -8.074
163 HA THR 452 HA THR 452 1.802 -6.144 -10.327
164 HB THR 452 HB THR 452 3.309 -4.393 -9.454
165 HG1 THR 452 HG1 THR 452 4.843 -6.434 -8.618
166 HG21 THR 452 HG21 THR 452 3.232 -6.000 -6.903
167 HG22 THR 452 HG22 THR 452 2.605 -4.368 -7.131
168 HG23 THR 452 HG23 THR 452 4.339 -4.670 -7.241
169 H LEU 453 HN LEU 453 -0.075 -6.590 -7.694
170 HA LEU 453 HA LEU 453 -0.726 -8.368 -6.442
171 HB2 LEU 453 HB2 LEU 453 1.001 -9.818 -8.439
172 HB3 LEU 453 HB1 LEU 453 0.192 -10.662 -7.136
173 HG LEU 453 HG LEU 453 -1.988 -9.747 -8.047
174 HD11 LEU 453 HD11 LEU 453 -2.008 -9.065 -10.394
175 HD12 LEU 453 HD12 LEU 453 -0.245 -9.090 -10.416
176 HD13 LEU 453 HD13 LEU 453 -1.096 -7.931 -9.395
177 HD21 LEU 453 HD21 LEU 453 -2.115 -11.441 -9.804
178 HD22 LEU 453 HD22 LEU 453 -1.286 -12.050 -8.372
179 HD23 LEU 453 HD23 LEU 453 -0.357 -11.581 -9.796
180 H GLU 454 HN GLU 454 1.476 -6.749 -5.632
181 HA GLU 454 HA GLU 454 2.975 -8.638 -3.957
182 HB2 GLU 454 HB2 GLU 454 4.260 -6.420 -5.560
183 HB3 GLU 454 HB1 GLU 454 5.080 -7.449 -4.395
184 HG2 GLU 454 HG2 GLU 454 4.621 -9.394 -5.803
185 HG3 GLU 454 HG1 GLU 454 3.827 -8.345 -6.978
186 H SER 455 HN SER 455 3.694 -7.781 -2.007
187 HA SER 455 HA SER 455 2.494 -5.238 -1.254
188 HB2 SER 455 HB2 SER 455 2.153 -7.271 0.175
189 HB3 SER 455 HB1 SER 455 3.884 -7.268 0.509
190 HG SER 455 HG SER 455 1.885 -5.568 1.425
191 H THR 456 HN THR 456 3.657 -3.460 -1.339
192 HA THR 456 HA THR 456 6.585 -3.692 -1.194
193 HB THR 456 HB THR 456 5.974 -2.885 -3.366
194 HG1 THR 456 HG1 THR 456 7.091 -0.943 -3.362
195 HG21 THR 456 HG21 THR 456 4.318 -0.768 -1.982
196 HG22 THR 456 HG22 THR 456 3.699 -2.134 -2.906
197 HG23 THR 456 HG23 THR 456 4.619 -0.866 -3.715
198 H PHE 457 HN PHE 457 7.719 -2.249 0.095
199 HA PHE 457 HA PHE 457 6.156 -1.162 2.294
200 HB2 PHE 457 HB2 PHE 457 9.145 -1.462 1.937
201 HB3 PHE 457 HB1 PHE 457 8.364 -0.851 3.392
202 HD1 PHE 457 HD1 PHE 457 7.135 -2.341 4.861
203 HD2 PHE 457 HD2 PHE 457 9.084 -3.801 1.371
204 HE1 PHE 457 HE1 PHE 457 6.923 -4.642 5.712
205 HE2 PHE 457 HE2 PHE 457 8.875 -6.103 2.211
206 HZ PHE 457 HZ PHE 457 7.794 -6.525 4.384
207 H GLU 458 HN GLU 458 7.163 -0.074 -0.609
208 HA GLU 458 HA GLU 458 8.025 2.573 0.171
209 HB2 GLU 458 HB2 GLU 458 7.308 1.449 -2.545
210 HB3 GLU 458 HB1 GLU 458 8.066 3.009 -2.252
211 HG2 GLU 458 HG2 GLU 458 10.010 1.887 -1.288
212 HG3 GLU 458 HG1 GLU 458 9.252 0.324 -1.588
213 H LYS 459 HN LYS 459 6.812 4.394 0.176
214 HA LYS 459 HA LYS 459 3.964 3.975 0.408
215 HB2 LYS 459 HB2 LYS 459 5.624 6.467 0.809
216 HB3 LYS 459 HB1 LYS 459 3.923 6.294 1.228
217 HG2 LYS 459 HG2 LYS 459 4.473 4.565 2.841
218 HG3 LYS 459 HG1 LYS 459 6.176 4.669 2.395
219 HD2 LYS 459 HD2 LYS 459 6.244 6.980 3.182
220 HD3 LYS 459 HD1 LYS 459 4.534 6.890 3.612
221 HE2 LYS 459 HE2 LYS 459 6.723 5.167 4.770
222 HE3 LYS 459 HE1 LYS 459 6.011 6.574 5.558
223 HZ1 LYS 459 HZ1 LYS 459 4.475 4.163 4.750
224 HZ2 LYS 459 HZ2 LYS 459 3.908 5.473 5.661
225 HZ3 LYS 459 HZ3 LYS 459 5.075 4.433 6.312
226 HA PRO 460 HA PRO 460 3.372 4.849 -3.948
227 HB2 PRO 460 HB2 PRO 460 0.550 4.966 -3.034
228 HB3 PRO 460 HB1 PRO 460 1.273 4.023 -4.342
229 HG2 PRO 460 HG2 PRO 460 0.560 2.857 -2.060
230 HG3 PRO 460 HG1 PRO 460 2.040 2.375 -2.910
231 HD2 PRO 460 HD2 PRO 460 1.719 4.064 -0.470
232 HD3 PRO 460 HD1 PRO 460 2.967 2.864 -0.864
233 H GLN 461 HN GLN 461 3.369 6.697 -5.007
234 HA GLN 461 HA GLN 461 2.803 9.188 -3.696
235 HB2 GLN 461 HB2 GLN 461 4.644 8.821 -5.365
236 HB3 GLN 461 HB1 GLN 461 3.417 8.665 -6.611
237 HG2 GLN 461 HG2 GLN 461 2.654 10.994 -5.896
238 HG3 GLN 461 HG1 GLN 461 4.194 11.090 -5.040
239 HE21 GLN 461 HE21 GLN 461 6.133 11.010 -6.252
240 HE22 GLN 461 HE22 GLN 461 6.146 11.426 -7.938
241 H GLU 462 HN GLU 462 1.085 6.952 -5.636
242 HA GLU 462 HA GLU 462 -0.920 8.907 -6.466
243 HB2 GLU 462 HB2 GLU 462 -1.891 7.004 -7.741
244 HB3 GLU 462 HB1 GLU 462 -0.228 7.362 -8.179
245 HG2 GLU 462 HG2 GLU 462 -0.782 5.257 -6.142
246 HG3 GLU 462 HG1 GLU 462 -1.034 4.901 -7.849
247 H LEU 463 HN LEU 463 -0.403 7.492 -3.674
248 HA LEU 463 HA LEU 463 -3.024 6.309 -3.271
249 HB2 LEU 463 HB2 LEU 463 -0.796 5.465 -2.271
250 HB3 LEU 463 HB1 LEU 463 -0.980 6.772 -1.119
251 HG LEU 463 HG LEU 463 -3.094 4.661 -1.516
252 HD11 LEU 463 HD11 LEU 463 -1.166 3.461 -0.873
253 HD12 LEU 463 HD12 LEU 463 -2.150 3.662 0.579
254 HD13 LEU 463 HD13 LEU 463 -0.726 4.673 0.331
255 HD21 LEU 463 HD21 LEU 463 -2.538 6.645 0.683
256 HD22 LEU 463 HD22 LEU 463 -3.730 5.349 0.780
257 HD23 LEU 463 HD23 LEU 463 -3.915 6.626 -0.421
258 H LYS 464 HN LYS 464 -4.632 7.661 -3.071
259 HA LYS 464 HA LYS 464 -4.588 9.644 -0.959
260 HB2 LYS 464 HB2 LYS 464 -3.843 10.789 -3.098
261 HB3 LYS 464 HB1 LYS 464 -5.421 10.412 -3.769
262 HG2 LYS 464 HG2 LYS 464 -5.192 11.946 -1.213
263 HG3 LYS 464 HG1 LYS 464 -4.980 12.753 -2.765
264 HD2 LYS 464 HD2 LYS 464 -7.202 12.009 -3.462
265 HD3 LYS 464 HD1 LYS 464 -7.410 11.169 -1.924
266 HE2 LYS 464 HE2 LYS 464 -6.953 14.135 -2.204
267 HE3 LYS 464 HE1 LYS 464 -8.538 13.384 -2.027
268 HZ1 LYS 464 HZ1 LYS 464 -7.967 12.608 0.126
269 HZ2 LYS 464 HZ2 LYS 464 -7.542 14.248 0.071
270 HZ3 LYS 464 HZ3 LYS 464 -6.343 13.057 -0.054
Start of MODEL 7
1 H ALA 431 HN ALA 431 -13.075 6.409 -5.613
2 HA ALA 431 HA ALA 431 -13.025 5.904 -2.734
3 HB1 ALA 431 HB1 ALA 431 -15.187 4.829 -3.071
4 HB2 ALA 431 HB2 ALA 431 -15.039 5.061 -4.813
5 HB3 ALA 431 HB3 ALA 431 -15.178 6.457 -3.747
6 H VAL 432 HN VAL 432 -11.549 4.696 -5.389
7 HA VAL 432 HA VAL 432 -11.532 1.944 -4.325
8 HB VAL 432 HB VAL 432 -11.104 2.781 -7.204
9 HG11 VAL 432 HG11 VAL 432 -11.125 0.374 -7.675
10 HG12 VAL 432 HG12 VAL 432 -11.232 0.041 -5.946
11 HG13 VAL 432 HG13 VAL 432 -9.795 0.821 -6.607
12 HG21 VAL 432 HG21 VAL 432 -13.440 1.371 -5.916
13 HG22 VAL 432 HG22 VAL 432 -13.230 1.635 -7.647
14 HG23 VAL 432 HG23 VAL 432 -13.439 3.011 -6.563
15 H SER 433 HN SER 433 -9.679 1.563 -3.315
16 HA SER 433 HA SER 433 -7.230 2.839 -4.352
17 HB2 SER 433 HB2 SER 433 -7.835 3.609 -2.095
18 HB3 SER 433 HB1 SER 433 -7.853 1.940 -1.526
19 HG SER 433 HG SER 433 -5.836 2.402 -1.064
20 H GLU 434 HN GLU 434 -5.675 1.559 -5.088
21 HA GLU 434 HA GLU 434 -5.930 -1.321 -4.872
22 HB2 GLU 434 HB2 GLU 434 -3.876 0.409 -6.266
23 HB3 GLU 434 HB1 GLU 434 -3.927 -1.345 -6.349
24 HG2 GLU 434 HG2 GLU 434 -5.995 -1.305 -7.521
25 HG3 GLU 434 HG1 GLU 434 -6.172 0.429 -7.259
26 H TRP 435 HN TRP 435 -4.517 1.131 -3.086
27 HA TRP 435 HA TRP 435 -2.227 -0.505 -2.263
28 HB2 TRP 435 HB2 TRP 435 -2.696 2.400 -1.570
29 HB3 TRP 435 HB1 TRP 435 -1.182 1.503 -1.506
30 HD1 TRP 435 HD1 TRP 435 -3.131 3.752 -3.718
31 HE1 TRP 435 HE1 TRP 435 -2.071 3.874 -6.060
32 HE3 TRP 435 HE3 TRP 435 0.159 -0.127 -3.322
33 HZ2 TRP 435 HZ2 TRP 435 -0.125 2.495 -7.540
34 HZ3 TRP 435 HZ3 TRP 435 1.549 -0.694 -5.279
35 HH2 TRP 435 HH2 TRP 435 1.428 0.611 -7.329
36 H THR 436 HN THR 436 -2.740 -1.802 -0.619
37 HA THR 436 HA THR 436 -4.398 -0.717 1.557
38 HB THR 436 HB THR 436 -3.731 -3.627 1.066
39 HG1 THR 436 HG1 THR 436 -5.206 -2.128 -0.467
40 HG21 THR 436 HG21 THR 436 -5.689 -4.023 2.491
41 HG22 THR 436 HG22 THR 436 -5.894 -2.283 2.690
42 HG23 THR 436 HG23 THR 436 -4.461 -3.079 3.339
43 H GLU 437 HN GLU 437 -3.295 -0.043 3.281
44 HA GLU 437 HA GLU 437 -0.513 -0.829 3.585
45 HB2 GLU 437 HB2 GLU 437 -0.584 0.965 5.401
46 HB3 GLU 437 HB1 GLU 437 -0.793 1.490 3.736
47 HG2 GLU 437 HG2 GLU 437 -3.113 1.798 4.023
48 HG3 GLU 437 HG1 GLU 437 -3.108 0.946 5.566
49 H TYR 438 HN TYR 438 0.218 -2.214 5.023
50 HA TYR 438 HA TYR 438 -1.328 -2.658 7.496
51 HB2 TYR 438 HB2 TYR 438 0.308 -4.704 5.975
52 HB3 TYR 438 HB1 TYR 438 -0.481 -4.976 7.520
53 HD1 TYR 438 HD2 TYR 438 -2.904 -5.239 7.651
54 HD2 TYR 438 HD1 TYR 438 -0.954 -4.666 3.913
55 HE1 TYR 438 HE2 TYR 438 -4.924 -6.015 6.482
56 HE2 TYR 438 HE1 TYR 438 -2.968 -5.438 2.737
57 HH TYR 438 HH TYR 438 -4.932 -6.844 3.198
58 H LYS 439 HN LYS 439 -0.184 -2.180 9.295
59 HA LYS 439 HA LYS 439 2.721 -1.898 8.993
60 HB2 LYS 439 HB2 LYS 439 2.513 -0.647 11.230
61 HB3 LYS 439 HB1 LYS 439 1.932 0.144 9.777
62 HG2 LYS 439 HG2 LYS 439 0.240 0.619 11.219
63 HG3 LYS 439 HG1 LYS 439 -0.369 -0.867 10.501
64 HD2 LYS 439 HD2 LYS 439 -0.720 -0.956 12.870
65 HD3 LYS 439 HD1 LYS 439 0.540 -2.115 12.451
66 HE2 LYS 439 HE2 LYS 439 1.314 0.646 13.281
67 HE3 LYS 439 HE1 LYS 439 0.806 -0.507 14.514
68 HZ1 LYS 439 HZ1 LYS 439 2.533 -2.022 13.751
69 HZ2 LYS 439 HZ2 LYS 439 3.196 -0.540 14.237
70 HZ3 LYS 439 HZ3 LYS 439 3.040 -0.894 12.590
71 H THR 440 HN THR 440 4.027 -3.336 9.813
72 HA THR 440 HA THR 440 2.989 -5.345 11.643
73 HB THR 440 HB THR 440 4.314 -6.153 9.751
74 HG1 THR 440 HG1 THR 440 5.153 -7.655 10.993
75 HG21 THR 440 HG21 THR 440 5.783 -4.238 9.421
76 HG22 THR 440 HG22 THR 440 6.727 -5.714 9.622
77 HG23 THR 440 HG23 THR 440 6.583 -4.569 10.957
78 H ALA 441 HN ALA 441 4.006 -5.840 13.638
79 HA ALA 441 HA ALA 441 4.462 -3.593 15.247
80 HB1 ALA 441 HB1 ALA 441 3.574 -5.721 16.075
81 HB2 ALA 441 HB2 ALA 441 4.954 -5.166 17.023
82 HB3 ALA 441 HB3 ALA 441 5.158 -6.461 15.844
83 H ASP 442 HN ASP 442 6.615 -5.197 13.183
84 HA ASP 442 HA ASP 442 9.068 -4.723 14.530
85 HB2 ASP 442 HB2 ASP 442 8.824 -6.270 12.603
86 HB3 ASP 442 HB1 ASP 442 8.530 -4.891 11.553
87 H GLY 443 HN GLY 443 6.795 -2.637 13.197
88 HA2 GLY 443 HA2 GLY 443 6.860 -0.296 13.309
89 HA3 GLY 443 HA1 GLY 443 8.611 -0.371 13.469
90 H LYS 444 HN LYS 444 6.773 -2.063 11.027
91 HA LYS 444 HA LYS 444 7.954 -0.312 8.982
92 HB2 LYS 444 HB2 LYS 444 9.316 -2.403 9.438
93 HB3 LYS 444 HB1 LYS 444 7.952 -3.330 8.830
94 HG2 LYS 444 HG2 LYS 444 8.193 -2.400 6.653
95 HG3 LYS 444 HG1 LYS 444 9.378 -1.222 7.227
96 HD2 LYS 444 HD2 LYS 444 10.912 -3.059 7.790
97 HD3 LYS 444 HD1 LYS 444 9.735 -4.220 7.173
98 HE2 LYS 444 HE2 LYS 444 9.899 -3.248 4.958
99 HE3 LYS 444 HE1 LYS 444 11.017 -2.020 5.555
100 HZ1 LYS 444 HZ1 LYS 444 12.193 -3.816 4.446
101 HZ2 LYS 444 HZ2 LYS 444 11.518 -4.950 5.511
102 HZ3 LYS 444 HZ3 LYS 444 12.593 -3.777 6.095
103 H THR 445 HN THR 445 6.554 0.250 7.440
104 HA THR 445 HA THR 445 3.908 -1.011 7.473
105 HB THR 445 HB THR 445 3.296 1.090 6.120
106 HG1 THR 445 HG1 THR 445 5.646 1.583 5.835
107 HG21 THR 445 HG21 THR 445 3.125 2.466 8.171
108 HG22 THR 445 HG22 THR 445 4.173 1.315 9.000
109 HG23 THR 445 HG23 THR 445 2.590 0.803 8.415
110 H TYR 446 HN TYR 446 3.276 -2.266 5.831
111 HA TYR 446 HA TYR 446 4.631 -1.890 3.250
112 HB2 TYR 446 HB2 TYR 446 4.342 -4.312 2.817
113 HB3 TYR 446 HB1 TYR 446 5.401 -3.984 4.180
114 HD1 TYR 446 HD1 TYR 446 4.664 -4.510 6.471
115 HD2 TYR 446 HD2 TYR 446 2.251 -5.456 3.096
116 HE1 TYR 446 HE1 TYR 446 3.338 -6.049 7.856
117 HE2 TYR 446 HE2 TYR 446 0.916 -6.993 4.472
118 HH TYR 446 HH TYR 446 0.999 -8.216 6.474
119 H TYR 447 HN TYR 447 3.417 -1.574 1.548
120 HA TYR 447 HA TYR 447 0.508 -1.700 1.852
121 HB2 TYR 447 HB2 TYR 447 2.323 -0.264 -0.085
122 HB3 TYR 447 HB1 TYR 447 0.595 -0.425 -0.376
123 HD1 TYR 447 HD2 TYR 447 2.912 0.683 2.356
124 HD2 TYR 447 HD1 TYR 447 -0.761 1.295 0.295
125 HE1 TYR 447 HE2 TYR 447 2.481 2.688 3.722
126 HE2 TYR 447 HE1 TYR 447 -1.193 3.298 1.649
127 HH TYR 447 HH TYR 447 -0.501 4.154 3.946
128 H TYR 448 HN TYR 448 -0.367 -3.558 1.223
129 HA TYR 448 HA TYR 448 0.849 -5.088 -0.938
130 HB2 TYR 448 HB2 TYR 448 0.090 -6.363 0.992
131 HB3 TYR 448 HB1 TYR 448 -1.527 -5.680 0.844
132 HD1 TYR 448 HD1 TYR 448 0.925 -7.481 -1.336
133 HD2 TYR 448 HD2 TYR 448 -3.119 -7.066 -0.083
134 HE1 TYR 448 HE1 TYR 448 0.282 -9.331 -2.820
135 HE2 TYR 448 HE2 TYR 448 -3.774 -8.916 -1.565
136 HH TYR 448 HH TYR 448 -2.981 -10.059 -3.550
137 H ASN 449 HN ASN 449 0.280 -4.745 -2.963
138 HA ASN 449 HA ASN 449 -2.384 -3.598 -3.460
139 HB2 ASN 449 HB2 ASN 449 -1.409 -2.541 -5.485
140 HB3 ASN 449 HB1 ASN 449 -0.745 -1.937 -3.981
141 HD21 ASN 449 HD21 ASN 449 -0.085 -3.364 -6.978
142 HD22 ASN 449 HD22 ASN 449 1.616 -3.575 -6.777
143 H ASN 450 HN ASN 450 -3.678 -4.538 -4.818
144 HA ASN 450 HA ASN 450 -3.046 -7.121 -5.869
145 HB2 ASN 450 HB2 ASN 450 -5.344 -7.137 -6.659
146 HB3 ASN 450 HB1 ASN 450 -5.298 -6.504 -5.016
147 HD21 ASN 450 HD21 ASN 450 -5.995 -5.838 -8.319
148 HD22 ASN 450 HD22 ASN 450 -6.624 -4.240 -8.086
149 H ARG 451 HN ARG 451 -2.319 -4.074 -6.954
150 HA ARG 451 HA ARG 451 -2.855 -4.195 -9.686
151 HB2 ARG 451 HB2 ARG 451 -2.084 -2.141 -8.562
152 HB3 ARG 451 HB1 ARG 451 -0.489 -2.862 -8.380
153 HG2 ARG 451 HG2 ARG 451 -0.195 -2.937 -10.771
154 HG3 ARG 451 HG1 ARG 451 -1.840 -2.356 -11.026
155 HD2 ARG 451 HD2 ARG 451 0.330 -0.816 -9.608
156 HD3 ARG 451 HD1 ARG 451 -0.109 -0.601 -11.301
157 HE ARG 451 HE ARG 451 -2.448 -0.296 -9.842
158 HH11 ARG 451 HH11 ARG 451 0.677 1.298 -10.080
159 HH12 ARG 451 HH12 ARG 451 0.061 2.849 -9.585
160 HH21 ARG 451 HH21 ARG 451 -3.260 1.757 -9.246
161 HH22 ARG 451 HH22 ARG 451 -2.161 3.113 -9.121
162 H THR 452 HN THR 452 0.124 -5.074 -7.971
163 HA THR 452 HA THR 452 0.732 -6.892 -10.195
164 HB THR 452 HB THR 452 2.361 -5.092 -10.040
165 HG1 THR 452 HG1 THR 452 3.224 -7.704 -9.332
166 HG21 THR 452 HG21 THR 452 2.879 -6.108 -7.249
167 HG22 THR 452 HG22 THR 452 2.198 -4.541 -7.688
168 HG23 THR 452 HG23 THR 452 3.869 -4.924 -8.102
169 H LEU 453 HN LEU 453 -0.477 -7.015 -7.153
170 HA LEU 453 HA LEU 453 -0.665 -8.582 -5.534
171 HB2 LEU 453 HB2 LEU 453 0.496 -10.247 -7.746
172 HB3 LEU 453 HB1 LEU 453 0.227 -10.937 -6.158
173 HG LEU 453 HG LEU 453 -2.194 -10.269 -6.380
174 HD11 LEU 453 HD11 LEU 453 -1.967 -8.569 -8.095
175 HD12 LEU 453 HD12 LEU 453 -3.044 -9.857 -8.637
176 HD13 LEU 453 HD13 LEU 453 -1.388 -9.777 -9.241
177 HD21 LEU 453 HD21 LEU 453 -2.754 -12.155 -7.813
178 HD22 LEU 453 HD22 LEU 453 -1.414 -12.556 -6.738
179 HD23 LEU 453 HD23 LEU 453 -1.105 -12.186 -8.434
180 H GLU 454 HN GLU 454 1.424 -6.826 -5.338
181 HA GLU 454 HA GLU 454 3.541 -8.447 -4.090
182 HB2 GLU 454 HB2 GLU 454 3.806 -6.792 -6.356
183 HB3 GLU 454 HB1 GLU 454 4.516 -5.892 -5.024
184 HG2 GLU 454 HG2 GLU 454 5.248 -8.719 -5.727
185 HG3 GLU 454 HG1 GLU 454 6.112 -7.295 -6.305
186 H SER 455 HN SER 455 4.484 -7.529 -2.233
187 HA SER 455 HA SER 455 2.891 -5.373 -1.030
188 HB2 SER 455 HB2 SER 455 4.758 -7.343 0.318
189 HB3 SER 455 HB1 SER 455 3.723 -6.166 1.128
190 HG SER 455 HG SER 455 2.467 -7.883 -0.650
191 H THR 456 HN THR 456 3.780 -3.440 -1.380
192 HA THR 456 HA THR 456 6.693 -3.227 -1.503
193 HB THR 456 HB THR 456 5.609 -2.200 -3.380
194 HG1 THR 456 HG1 THR 456 6.078 0.204 -2.234
195 HG21 THR 456 HG21 THR 456 4.004 -0.356 -3.151
196 HG22 THR 456 HG22 THR 456 4.019 -0.562 -1.400
197 HG23 THR 456 HG23 THR 456 3.385 -1.843 -2.433
198 H PHE 457 HN PHE 457 7.813 -2.545 0.168
199 HA PHE 457 HA PHE 457 6.477 -1.444 2.490
200 HB2 PHE 457 HB2 PHE 457 9.395 -2.034 1.947
201 HB3 PHE 457 HB1 PHE 457 8.757 -1.482 3.490
202 HD1 PHE 457 HD2 PHE 457 8.825 -4.279 1.100
203 HD2 PHE 457 HD1 PHE 457 7.664 -2.964 4.974
204 HE1 PHE 457 HE2 PHE 457 8.417 -6.614 1.766
205 HE2 PHE 457 HE1 PHE 457 7.261 -5.290 5.648
206 HZ PHE 457 HZ PHE 457 7.635 -7.123 4.045
207 H GLU 458 HN GLU 458 7.563 -0.250 -0.343
208 HA GLU 458 HA GLU 458 8.365 2.350 0.731
209 HB2 GLU 458 HB2 GLU 458 8.355 1.372 -2.134
210 HB3 GLU 458 HB1 GLU 458 9.078 2.862 -1.540
211 HG2 GLU 458 HG2 GLU 458 10.691 1.607 -0.248
212 HG3 GLU 458 HG1 GLU 458 9.939 0.091 -0.740
213 H LYS 459 HN LYS 459 6.948 3.940 0.837
214 HA LYS 459 HA LYS 459 4.211 3.452 0.219
215 HB2 LYS 459 HB2 LYS 459 5.683 5.861 1.272
216 HB3 LYS 459 HB1 LYS 459 3.943 5.855 1.008
217 HG2 LYS 459 HG2 LYS 459 3.625 4.141 2.618
218 HG3 LYS 459 HG1 LYS 459 5.359 3.861 2.758
219 HD2 LYS 459 HD2 LYS 459 4.470 5.139 4.661
220 HD3 LYS 459 HD1 LYS 459 5.656 6.065 3.740
221 HE2 LYS 459 HE2 LYS 459 3.804 7.482 4.315
222 HE3 LYS 459 HE1 LYS 459 3.809 7.213 2.575
223 HZ1 LYS 459 HZ1 LYS 459 1.586 7.041 3.356
224 HZ2 LYS 459 HZ2 LYS 459 2.016 5.959 4.588
225 HZ3 LYS 459 HZ3 LYS 459 2.092 5.472 2.969
226 HA PRO 460 HA PRO 460 4.351 5.142 -3.942
227 HB2 PRO 460 HB2 PRO 460 1.750 4.571 -4.508
228 HB3 PRO 460 HB1 PRO 460 3.049 3.380 -4.616
229 HG2 PRO 460 HG2 PRO 460 1.011 3.776 -2.478
230 HG3 PRO 460 HG1 PRO 460 1.688 2.272 -3.119
231 HD2 PRO 460 HD2 PRO 460 2.463 3.410 -0.752
232 HD3 PRO 460 HD1 PRO 460 3.501 2.356 -1.731
233 H GLN 461 HN GLN 461 3.829 7.129 -4.696
234 HA GLN 461 HA GLN 461 2.543 8.911 -2.800
235 HB2 GLN 461 HB2 GLN 461 3.531 10.710 -3.998
236 HB3 GLN 461 HB1 GLN 461 4.746 9.449 -3.889
237 HG2 GLN 461 HG2 GLN 461 3.037 10.010 -6.307
238 HG3 GLN 461 HG1 GLN 461 4.699 10.547 -6.085
239 HE21 GLN 461 HE21 GLN 461 6.368 9.036 -6.187
240 HE22 GLN 461 HE22 GLN 461 6.139 7.474 -6.890
241 H GLU 462 HN GLU 462 1.507 7.127 -5.416
242 HA GLU 462 HA GLU 462 -0.215 9.120 -6.580
243 HB2 GLU 462 HB2 GLU 462 -1.116 7.218 -7.921
244 HB3 GLU 462 HB1 GLU 462 0.618 7.461 -8.080
245 HG2 GLU 462 HG2 GLU 462 1.083 5.573 -6.725
246 HG3 GLU 462 HG1 GLU 462 -0.608 5.431 -6.237
247 H LEU 463 HN LEU 463 -0.405 7.322 -3.801
248 HA LEU 463 HA LEU 463 -3.207 6.725 -3.831
249 HB2 LEU 463 HB2 LEU 463 -1.256 5.740 -2.363
250 HB3 LEU 463 HB1 LEU 463 -1.637 7.080 -1.304
251 HG LEU 463 HG LEU 463 -3.553 4.893 -2.129
252 HD11 LEU 463 HD11 LEU 463 -1.817 4.109 -0.622
253 HD12 LEU 463 HD12 LEU 463 -3.380 4.173 0.192
254 HD13 LEU 463 HD13 LEU 463 -2.176 5.427 0.493
255 HD21 LEU 463 HD21 LEU 463 -4.706 7.019 -1.725
256 HD22 LEU 463 HD22 LEU 463 -3.931 7.133 -0.144
257 HD23 LEU 463 HD23 LEU 463 -5.066 5.825 -0.480
258 H LYS 464 HN LYS 464 -4.708 8.259 -3.814
259 HA LYS 464 HA LYS 464 -4.255 10.669 -2.204
260 HB2 LYS 464 HB2 LYS 464 -5.712 11.764 -4.125
261 HB3 LYS 464 HB1 LYS 464 -3.964 11.640 -4.255
262 HG2 LYS 464 HG2 LYS 464 -4.225 9.599 -5.598
263 HG3 LYS 464 HG1 LYS 464 -5.978 9.776 -5.501
264 HD2 LYS 464 HD2 LYS 464 -5.980 11.695 -6.828
265 HD3 LYS 464 HD1 LYS 464 -4.264 11.999 -6.552
266 HE2 LYS 464 HE2 LYS 464 -5.371 9.663 -8.106
267 HE3 LYS 464 HE1 LYS 464 -4.768 11.154 -8.832
268 HZ1 LYS 464 HZ1 LYS 464 -3.173 9.295 -7.144
269 HZ2 LYS 464 HZ2 LYS 464 -2.599 10.714 -7.867
270 HZ3 LYS 464 HZ3 LYS 464 -3.084 9.407 -8.836
Start of MODEL 8
1 H ALA 431 HN ALA 431 -13.195 0.065 -0.104
2 HA ALA 431 HA ALA 431 -11.308 2.224 0.124
3 HB1 ALA 431 HB1 ALA 431 -10.815 -0.731 -0.241
4 HB2 ALA 431 HB2 ALA 431 -10.956 0.106 1.305
5 HB3 ALA 431 HB3 ALA 431 -9.615 0.477 0.220
6 H VAL 432 HN VAL 432 -11.473 3.413 -1.752
7 HA VAL 432 HA VAL 432 -11.222 2.225 -4.351
8 HB VAL 432 HB VAL 432 -10.909 5.139 -3.595
9 HG11 VAL 432 HG11 VAL 432 -11.590 5.565 -5.915
10 HG12 VAL 432 HG12 VAL 432 -11.618 3.828 -6.218
11 HG13 VAL 432 HG13 VAL 432 -10.096 4.631 -5.832
12 HG21 VAL 432 HG21 VAL 432 -13.406 3.646 -4.389
13 HG22 VAL 432 HG22 VAL 432 -13.280 5.387 -4.128
14 HG23 VAL 432 HG23 VAL 432 -13.041 4.274 -2.782
15 H SER 433 HN SER 433 -9.061 3.402 -1.936
16 HA SER 433 HA SER 433 -6.802 3.941 -3.520
17 HB2 SER 433 HB2 SER 433 -6.859 2.897 -0.678
18 HB3 SER 433 HB1 SER 433 -5.546 3.785 -1.453
19 HG SER 433 HG SER 433 -7.046 5.558 -1.683
20 H GLU 434 HN GLU 434 -5.780 2.565 -4.805
21 HA GLU 434 HA GLU 434 -6.140 -0.256 -4.678
22 HB2 GLU 434 HB2 GLU 434 -5.776 1.007 -6.784
23 HB3 GLU 434 HB1 GLU 434 -4.131 1.348 -6.273
24 HG2 GLU 434 HG2 GLU 434 -3.623 -1.039 -6.307
25 HG3 GLU 434 HG1 GLU 434 -5.274 -1.384 -6.817
26 H TRP 435 HN TRP 435 -4.129 1.845 -3.029
27 HA TRP 435 HA TRP 435 -2.188 -0.276 -2.423
28 HB2 TRP 435 HB2 TRP 435 -1.882 2.650 -1.732
29 HB3 TRP 435 HB1 TRP 435 -0.633 1.412 -1.779
30 HD1 TRP 435 HD1 TRP 435 -2.553 3.814 -4.023
31 HE1 TRP 435 HE1 TRP 435 -1.461 3.859 -6.341
32 HE3 TRP 435 HE3 TRP 435 0.759 -0.040 -3.440
33 HZ2 TRP 435 HZ2 TRP 435 0.542 2.472 -7.733
34 HZ3 TRP 435 HZ3 TRP 435 2.231 -0.609 -5.328
35 HH2 TRP 435 HH2 TRP 435 2.128 0.621 -7.428
36 H THR 436 HN THR 436 -3.060 -1.399 -0.723
37 HA THR 436 HA THR 436 -4.257 0.165 1.452
38 HB THR 436 HB THR 436 -5.637 -1.676 0.586
39 HG1 THR 436 HG1 THR 436 -6.269 -2.335 2.544
40 HG21 THR 436 HG21 THR 436 -5.019 -4.008 0.938
41 HG22 THR 436 HG22 THR 436 -3.449 -3.503 1.566
42 HG23 THR 436 HG23 THR 436 -3.862 -3.204 -0.122
43 H GLU 437 HN GLU 437 -3.104 0.586 3.226
44 HA GLU 437 HA GLU 437 -0.548 -0.786 3.513
45 HB2 GLU 437 HB2 GLU 437 -0.014 1.046 5.137
46 HB3 GLU 437 HB1 GLU 437 -0.296 1.569 3.486
47 HG2 GLU 437 HG2 GLU 437 -2.465 2.400 4.052
48 HG3 GLU 437 HG1 GLU 437 -2.358 1.708 5.670
49 H TYR 438 HN TYR 438 -0.404 -2.429 4.797
50 HA TYR 438 HA TYR 438 -1.886 -2.379 7.340
51 HB2 TYR 438 HB2 TYR 438 -0.908 -4.694 5.665
52 HB3 TYR 438 HB1 TYR 438 -1.380 -4.888 7.351
53 HD1 TYR 438 HD1 TYR 438 -2.670 -3.657 4.072
54 HD2 TYR 438 HD2 TYR 438 -3.606 -5.260 7.900
55 HE1 TYR 438 HE1 TYR 438 -5.028 -3.861 3.401
56 HE2 TYR 438 HE2 TYR 438 -5.963 -5.479 7.239
57 HH TYR 438 HH TYR 438 -7.007 -5.222 4.037
58 H LYS 439 HN LYS 439 -0.673 -1.876 9.024
59 HA LYS 439 HA LYS 439 2.225 -1.992 8.644
60 HB2 LYS 439 HB2 LYS 439 2.350 -0.225 10.363
61 HB3 LYS 439 HB1 LYS 439 1.392 0.246 8.970
62 HG2 LYS 439 HG2 LYS 439 -0.638 -0.464 10.359
63 HG3 LYS 439 HG1 LYS 439 0.465 -0.435 11.737
64 HD2 LYS 439 HD2 LYS 439 -0.156 1.867 9.881
65 HD3 LYS 439 HD1 LYS 439 -0.698 1.691 11.550
66 HE2 LYS 439 HE2 LYS 439 2.198 1.833 10.727
67 HE3 LYS 439 HE1 LYS 439 1.250 3.238 11.211
68 HZ1 LYS 439 HZ1 LYS 439 1.697 0.849 12.920
69 HZ2 LYS 439 HZ2 LYS 439 0.946 2.304 13.375
70 HZ3 LYS 439 HZ3 LYS 439 2.604 2.278 13.013
71 H THR 440 HN THR 440 3.446 -3.279 9.757
72 HA THR 440 HA THR 440 2.273 -4.791 11.962
73 HB THR 440 HB THR 440 3.341 -6.183 10.330
74 HG1 THR 440 HG1 THR 440 3.957 -7.230 12.072
75 HG21 THR 440 HG21 THR 440 4.793 -4.521 9.285
76 HG22 THR 440 HG22 THR 440 5.708 -5.962 9.729
77 HG23 THR 440 HG23 THR 440 5.822 -4.506 10.717
78 H ALA 441 HN ALA 441 3.280 -4.993 13.972
79 HA ALA 441 HA ALA 441 4.300 -2.593 15.063
80 HB1 ALA 441 HB1 ALA 441 4.318 -5.371 16.243
81 HB2 ALA 441 HB2 ALA 441 3.001 -4.205 16.366
82 HB3 ALA 441 HB3 ALA 441 4.555 -3.866 17.130
83 H ASP 442 HN ASP 442 5.818 -4.995 13.295
84 HA ASP 442 HA ASP 442 8.432 -4.958 14.363
85 HB2 ASP 442 HB2 ASP 442 7.646 -6.614 12.707
86 HB3 ASP 442 HB1 ASP 442 7.521 -5.343 11.498
87 H GLY 443 HN GLY 443 6.585 -2.572 12.843
88 HA2 GLY 443 HA2 GLY 443 7.202 -0.327 12.564
89 HA3 GLY 443 HA1 GLY 443 8.893 -0.801 12.657
90 H LYS 444 HN LYS 444 6.479 -2.301 10.609
91 HA LYS 444 HA LYS 444 7.693 -1.018 8.256
92 HB2 LYS 444 HB2 LYS 444 7.210 -3.971 8.637
93 HB3 LYS 444 HB1 LYS 444 7.444 -3.242 7.056
94 HG2 LYS 444 HG2 LYS 444 9.646 -2.334 8.082
95 HG3 LYS 444 HG1 LYS 444 9.400 -3.608 9.281
96 HD2 LYS 444 HD2 LYS 444 9.453 -4.052 6.296
97 HD3 LYS 444 HD1 LYS 444 10.830 -4.301 7.367
98 HE2 LYS 444 HE2 LYS 444 8.214 -5.684 7.846
99 HE3 LYS 444 HE1 LYS 444 9.394 -6.333 6.709
100 HZ1 LYS 444 HZ1 LYS 444 10.997 -6.508 8.452
101 HZ2 LYS 444 HZ2 LYS 444 9.573 -7.272 8.970
102 HZ3 LYS 444 HZ3 LYS 444 9.975 -5.732 9.564
103 H THR 445 HN THR 445 6.241 -0.195 6.916
104 HA THR 445 HA THR 445 3.447 -1.037 7.204
105 HB THR 445 HB THR 445 4.358 1.386 5.673
106 HG1 THR 445 HG1 THR 445 4.093 2.569 7.618
107 HG21 THR 445 HG21 THR 445 2.115 2.195 6.240
108 HG22 THR 445 HG22 THR 445 1.803 0.709 7.137
109 HG23 THR 445 HG23 THR 445 2.038 0.653 5.390
110 H TYR 446 HN TYR 446 3.218 -2.776 5.866
111 HA TYR 446 HA TYR 446 4.310 -2.531 3.174
112 HB2 TYR 446 HB2 TYR 446 3.698 -4.944 2.929
113 HB3 TYR 446 HB1 TYR 446 4.895 -4.613 4.167
114 HD1 TYR 446 HD1 TYR 446 4.356 -4.925 6.531
115 HD2 TYR 446 HD2 TYR 446 1.508 -5.794 3.490
116 HE1 TYR 446 HE1 TYR 446 3.035 -6.222 8.148
117 HE2 TYR 446 HE2 TYR 446 0.173 -7.086 5.101
118 HH TYR 446 HH TYR 446 0.526 -8.310 7.210
119 H TYR 447 HN TYR 447 3.160 -1.928 1.582
120 HA TYR 447 HA TYR 447 0.265 -1.762 1.771
121 HB2 TYR 447 HB2 TYR 447 2.278 -0.790 -0.264
122 HB3 TYR 447 HB1 TYR 447 0.541 -0.632 -0.486
123 HD1 TYR 447 HD2 TYR 447 3.208 0.230 2.014
124 HD2 TYR 447 HD1 TYR 447 -0.477 1.316 0.173
125 HE1 TYR 447 HE2 TYR 447 3.235 2.365 3.226
126 HE2 TYR 447 HE1 TYR 447 -0.457 3.453 1.384
127 HH TYR 447 HH TYR 447 0.523 4.350 3.489
128 H TYR 448 HN TYR 448 -0.960 -3.372 1.046
129 HA TYR 448 HA TYR 448 0.150 -5.295 -0.836
130 HB2 TYR 448 HB2 TYR 448 -1.079 -6.283 0.977
131 HB3 TYR 448 HB1 TYR 448 -2.454 -5.222 0.699
132 HD1 TYR 448 HD1 TYR 448 -0.434 -7.428 -1.566
133 HD2 TYR 448 HD2 TYR 448 -4.265 -6.449 0.008
134 HE1 TYR 448 HE1 TYR 448 -1.462 -9.126 -3.023
135 HE2 TYR 448 HE2 TYR 448 -5.299 -8.142 -1.437
136 HH TYR 448 HH TYR 448 -4.939 -9.424 -3.323
137 H ASN 449 HN ASN 449 0.143 -4.669 -2.862
138 HA ASN 449 HA ASN 449 -2.242 -3.260 -3.859
139 HB2 ASN 449 HB2 ASN 449 -0.549 -2.434 -5.657
140 HB3 ASN 449 HB1 ASN 449 -0.577 -1.669 -4.072
141 HD21 ASN 449 HD21 ASN 449 1.227 -3.624 -6.265
142 HD22 ASN 449 HD22 ASN 449 2.698 -3.673 -5.354
143 H ASN 450 HN ASN 450 -3.387 -4.224 -5.315
144 HA ASN 450 HA ASN 450 -2.626 -6.777 -6.367
145 HB2 ASN 450 HB2 ASN 450 -4.830 -6.806 -7.383
146 HB3 ASN 450 HB1 ASN 450 -4.967 -6.201 -5.735
147 HD21 ASN 450 HD21 ASN 450 -5.327 -5.482 -9.086
148 HD22 ASN 450 HD22 ASN 450 -6.015 -3.906 -8.890
149 H ARG 451 HN ARG 451 -1.908 -3.670 -7.278
150 HA ARG 451 HA ARG 451 -2.085 -3.719 -10.068
151 HB2 ARG 451 HB2 ARG 451 -1.566 -1.682 -8.785
152 HB3 ARG 451 HB1 ARG 451 -0.010 -2.362 -8.332
153 HG2 ARG 451 HG2 ARG 451 0.700 -2.347 -10.654
154 HG3 ARG 451 HG1 ARG 451 -0.875 -1.721 -11.144
155 HD2 ARG 451 HD2 ARG 451 1.097 -0.328 -9.335
156 HD3 ARG 451 HD1 ARG 451 0.812 0.052 -11.033
157 HE ARG 451 HE ARG 451 -1.532 0.183 -9.325
158 HH11 ARG 451 HH11 ARG 451 1.175 1.984 -10.683
159 HH12 ARG 451 HH12 ARG 451 0.377 3.524 -10.519
160 HH21 ARG 451 HH21 ARG 451 -2.559 2.176 -9.130
161 HH22 ARG 451 HH22 ARG 451 -1.769 3.636 -9.666
162 H THR 452 HN THR 452 0.647 -4.550 -7.964
163 HA THR 452 HA THR 452 1.693 -6.242 -10.121
164 HB THR 452 HB THR 452 3.719 -6.031 -8.277
165 HG1 THR 452 HG1 THR 452 3.510 -4.198 -7.222
166 HG21 THR 452 HG21 THR 452 3.165 -4.240 -10.649
167 HG22 THR 452 HG22 THR 452 3.943 -5.822 -10.707
168 HG23 THR 452 HG23 THR 452 4.738 -4.478 -9.887
169 H LEU 453 HN LEU 453 -0.091 -6.532 -7.370
170 HA LEU 453 HA LEU 453 -0.721 -8.271 -6.068
171 HB2 LEU 453 HB2 LEU 453 0.948 -9.830 -8.034
172 HB3 LEU 453 HB1 LEU 453 -0.022 -10.575 -6.779
173 HG LEU 453 HG LEU 453 -1.112 -8.851 -9.008
174 HD11 LEU 453 HD11 LEU 453 -1.194 -11.838 -8.619
175 HD12 LEU 453 HD12 LEU 453 -0.257 -10.977 -9.839
176 HD13 LEU 453 HD13 LEU 453 -2.020 -10.939 -9.891
177 HD21 LEU 453 HD21 LEU 453 -2.501 -10.497 -6.896
178 HD22 LEU 453 HD22 LEU 453 -3.290 -9.665 -8.235
179 HD23 LEU 453 HD23 LEU 453 -2.463 -8.736 -6.985
180 H GLU 454 HN GLU 454 1.653 -6.721 -5.417
181 HA GLU 454 HA GLU 454 2.949 -8.646 -3.654
182 HB2 GLU 454 HB2 GLU 454 5.193 -7.527 -4.196
183 HB3 GLU 454 HB1 GLU 454 4.559 -8.709 -5.326
184 HG2 GLU 454 HG2 GLU 454 5.288 -7.073 -6.738
185 HG3 GLU 454 HG1 GLU 454 3.596 -6.624 -6.543
186 H SER 455 HN SER 455 3.924 -7.771 -1.807
187 HA SER 455 HA SER 455 2.679 -5.273 -0.983
188 HB2 SER 455 HB2 SER 455 4.306 -7.210 0.676
189 HB3 SER 455 HB1 SER 455 3.246 -5.930 1.268
190 HG SER 455 HG SER 455 1.725 -7.337 -0.269
191 H THR 456 HN THR 456 3.759 -3.445 -1.301
192 HA THR 456 HA THR 456 6.689 -3.450 -1.207
193 HB THR 456 HB THR 456 5.827 -2.350 -3.159
194 HG1 THR 456 HG1 THR 456 7.602 -1.272 -2.152
195 HG21 THR 456 HG21 THR 456 4.306 -0.432 -3.042
196 HG22 THR 456 HG22 THR 456 4.191 -0.629 -1.293
197 HG23 THR 456 HG23 THR 456 3.562 -1.881 -2.366
198 H PHE 457 HN PHE 457 7.847 -2.145 0.235
199 HA PHE 457 HA PHE 457 6.305 -1.247 2.558
200 HB2 PHE 457 HB2 PHE 457 9.277 -1.693 2.200
201 HB3 PHE 457 HB1 PHE 457 8.522 -1.131 3.689
202 HD1 PHE 457 HD1 PHE 457 6.976 -2.629 4.922
203 HD2 PHE 457 HD2 PHE 457 9.281 -3.987 1.613
204 HE1 PHE 457 HE1 PHE 457 6.604 -4.960 5.622
205 HE2 PHE 457 HE2 PHE 457 8.913 -6.318 2.306
206 HZ PHE 457 HZ PHE 457 7.574 -6.806 4.312
207 H GLU 458 HN GLU 458 7.149 0.033 -0.232
208 HA GLU 458 HA GLU 458 8.144 2.584 0.820
209 HB2 GLU 458 HB2 GLU 458 7.957 1.617 -2.044
210 HB3 GLU 458 HB1 GLU 458 8.653 3.142 -1.522
211 HG2 GLU 458 HG2 GLU 458 10.478 1.752 -1.939
212 HG3 GLU 458 HG1 GLU 458 10.310 1.763 -0.186
213 H LYS 459 HN LYS 459 6.741 4.187 1.102
214 HA LYS 459 HA LYS 459 4.028 4.071 0.387
215 HB2 LYS 459 HB2 LYS 459 5.810 6.354 1.207
216 HB3 LYS 459 HB1 LYS 459 4.102 6.585 0.863
217 HG2 LYS 459 HG2 LYS 459 3.519 5.023 2.630
218 HG3 LYS 459 HG1 LYS 459 5.229 4.741 2.959
219 HD2 LYS 459 HD2 LYS 459 5.541 6.966 3.714
220 HD3 LYS 459 HD1 LYS 459 3.963 7.467 3.105
221 HE2 LYS 459 HE2 LYS 459 4.398 5.458 5.308
222 HE3 LYS 459 HE1 LYS 459 4.022 7.161 5.563
223 HZ1 LYS 459 HZ1 LYS 459 2.298 5.182 4.165
224 HZ2 LYS 459 HZ2 LYS 459 1.942 6.827 4.344
225 HZ3 LYS 459 HZ3 LYS 459 2.029 5.826 5.712
226 HA PRO 460 HA PRO 460 4.629 5.256 -3.889
227 HB2 PRO 460 HB2 PRO 460 2.298 4.291 -4.792
228 HB3 PRO 460 HB1 PRO 460 3.628 3.223 -4.332
229 HG2 PRO 460 HG2 PRO 460 1.120 3.867 -2.871
230 HG3 PRO 460 HG1 PRO 460 2.031 2.350 -2.925
231 HD2 PRO 460 HD2 PRO 460 2.115 4.270 -0.881
232 HD3 PRO 460 HD1 PRO 460 3.257 2.932 -1.112
233 H GLN 461 HN GLN 461 4.033 7.010 -5.068
234 HA GLN 461 HA GLN 461 2.319 8.941 -3.766
235 HB2 GLN 461 HB2 GLN 461 4.567 9.420 -4.893
236 HB3 GLN 461 HB1 GLN 461 3.713 9.263 -6.421
237 HG2 GLN 461 HG2 GLN 461 3.912 11.585 -5.818
238 HG3 GLN 461 HG1 GLN 461 2.219 11.095 -5.760
239 HE21 GLN 461 HE21 GLN 461 4.560 10.273 -3.299
240 HE22 GLN 461 HE22 GLN 461 3.888 11.262 -2.053
241 H GLU 462 HN GLU 462 1.646 6.399 -5.671
242 HA GLU 462 HA GLU 462 -0.185 7.572 -7.552
243 HB2 GLU 462 HB2 GLU 462 -0.263 4.709 -6.623
244 HB3 GLU 462 HB1 GLU 462 -0.748 5.364 -8.179
245 HG2 GLU 462 HG2 GLU 462 2.076 5.243 -7.177
246 HG3 GLU 462 HG1 GLU 462 1.335 4.047 -8.236
247 H LEU 463 HN LEU 463 -0.260 7.001 -4.253
248 HA LEU 463 HA LEU 463 -3.092 6.390 -4.108
249 HB2 LEU 463 HB2 LEU 463 -1.127 5.523 -2.583
250 HB3 LEU 463 HB1 LEU 463 -1.398 7.027 -1.725
251 HG LEU 463 HG LEU 463 -3.475 4.875 -2.160
252 HD11 LEU 463 HD11 LEU 463 -1.730 4.146 -0.645
253 HD12 LEU 463 HD12 LEU 463 -3.223 4.462 0.240
254 HD13 LEU 463 HD13 LEU 463 -1.899 5.626 0.295
255 HD21 LEU 463 HD21 LEU 463 -3.575 7.395 -0.507
256 HD22 LEU 463 HD22 LEU 463 -4.811 6.137 -0.550
257 HD23 LEU 463 HD23 LEU 463 -4.471 7.087 -1.995
258 H LYS 464 HN LYS 464 -4.285 8.092 -4.670
259 HA LYS 464 HA LYS 464 -4.062 10.515 -3.054
260 HB2 LYS 464 HB2 LYS 464 -2.797 10.828 -5.222
261 HB3 LYS 464 HB1 LYS 464 -4.320 10.601 -6.069
262 HG2 LYS 464 HG2 LYS 464 -5.217 12.562 -4.800
263 HG3 LYS 464 HG1 LYS 464 -3.584 12.827 -4.185
264 HD2 LYS 464 HD2 LYS 464 -4.394 12.800 -7.093
265 HD3 LYS 464 HD1 LYS 464 -4.056 14.240 -6.133
266 HE2 LYS 464 HE2 LYS 464 -1.756 13.564 -5.852
267 HE3 LYS 464 HE1 LYS 464 -2.070 12.031 -6.664
268 HZ1 LYS 464 HZ1 LYS 464 -1.001 13.653 -8.130
269 HZ2 LYS 464 HZ2 LYS 464 -2.305 14.713 -7.923
270 HZ3 LYS 464 HZ3 LYS 464 -2.541 13.222 -8.696
Start of MODEL 9
1 H ALA 431 HN ALA 431 -14.208 0.337 0.592
2 HA ALA 431 HA ALA 431 -14.067 2.880 -0.785
3 HB1 ALA 431 HB1 ALA 431 -13.380 2.729 1.557
4 HB2 ALA 431 HB2 ALA 431 -12.040 3.241 0.531
5 HB3 ALA 431 HB3 ALA 431 -12.116 1.581 1.115
6 H VAL 432 HN VAL 432 -13.155 3.130 -2.717
7 HA VAL 432 HA VAL 432 -11.810 0.915 -3.944
8 HB VAL 432 HB VAL 432 -13.355 2.178 -5.291
9 HG11 VAL 432 HG11 VAL 432 -13.192 4.351 -4.241
10 HG12 VAL 432 HG12 VAL 432 -12.920 4.493 -5.978
11 HG13 VAL 432 HG13 VAL 432 -11.555 4.556 -4.863
12 HG21 VAL 432 HG21 VAL 432 -11.506 1.135 -6.461
13 HG22 VAL 432 HG22 VAL 432 -10.517 2.577 -6.231
14 HG23 VAL 432 HG23 VAL 432 -11.953 2.646 -7.254
15 H SER 433 HN SER 433 -10.034 0.849 -2.434
16 HA SER 433 HA SER 433 -7.881 2.667 -3.285
17 HB2 SER 433 HB2 SER 433 -8.501 2.881 -0.858
18 HB3 SER 433 HB1 SER 433 -8.036 1.193 -0.642
19 HG SER 433 HG SER 433 -6.044 1.831 -0.505
20 H GLU 434 HN GLU 434 -6.556 1.663 -4.633
21 HA GLU 434 HA GLU 434 -6.366 -1.219 -4.663
22 HB2 GLU 434 HB2 GLU 434 -5.004 0.898 -6.333
23 HB3 GLU 434 HB1 GLU 434 -4.817 -0.833 -6.584
24 HG2 GLU 434 HG2 GLU 434 -7.263 -0.989 -6.943
25 HG3 GLU 434 HG1 GLU 434 -7.350 0.767 -6.829
26 H TRP 435 HN TRP 435 -5.019 1.100 -2.826
27 HA TRP 435 HA TRP 435 -2.596 -0.503 -2.347
28 HB2 TRP 435 HB2 TRP 435 -3.001 2.419 -1.654
29 HB3 TRP 435 HB1 TRP 435 -1.524 1.487 -1.456
30 HD1 TRP 435 HD1 TRP 435 -3.378 3.601 -3.934
31 HE1 TRP 435 HE1 TRP 435 -2.025 3.766 -6.114
32 HE3 TRP 435 HE3 TRP 435 0.110 -0.020 -3.009
33 HZ2 TRP 435 HZ2 TRP 435 0.217 2.513 -7.288
34 HZ3 TRP 435 HZ3 TRP 435 1.808 -0.476 -4.731
35 HH2 TRP 435 HH2 TRP 435 1.862 0.770 -6.814
36 H THR 436 HN THR 436 -3.137 -1.825 -0.667
37 HA THR 436 HA THR 436 -4.717 -0.710 1.520
38 HB THR 436 HB THR 436 -4.637 -3.088 2.405
39 HG1 THR 436 HG1 THR 436 -3.924 -4.678 1.038
40 HG21 THR 436 HG21 THR 436 -6.584 -2.195 1.229
41 HG22 THR 436 HG22 THR 436 -6.333 -3.895 0.838
42 HG23 THR 436 HG23 THR 436 -5.865 -2.647 -0.318
43 H GLU 437 HN GLU 437 -3.763 0.118 3.240
44 HA GLU 437 HA GLU 437 -0.887 -0.245 3.537
45 HB2 GLU 437 HB2 GLU 437 -1.714 2.039 3.589
46 HB3 GLU 437 HB1 GLU 437 -2.814 1.644 4.905
47 HG2 GLU 437 HG2 GLU 437 -0.891 1.180 6.354
48 HG3 GLU 437 HG1 GLU 437 0.196 1.610 5.037
49 H TYR 438 HN TYR 438 -0.338 -2.017 4.629
50 HA TYR 438 HA TYR 438 -1.709 -2.528 7.181
51 HB2 TYR 438 HB2 TYR 438 0.223 -4.377 5.776
52 HB3 TYR 438 HB1 TYR 438 -0.852 -4.762 7.112
53 HD1 TYR 438 HD1 TYR 438 -3.459 -4.116 6.449
54 HD2 TYR 438 HD2 TYR 438 -0.367 -5.304 3.782
55 HE1 TYR 438 HE1 TYR 438 -5.151 -4.913 4.846
56 HE2 TYR 438 HE2 TYR 438 -2.044 -6.097 2.176
57 HH TYR 438 HH TYR 438 -4.373 -6.885 2.193
58 H LYS 439 HN LYS 439 -0.724 -1.550 8.819
59 HA LYS 439 HA LYS 439 2.195 -1.232 8.694
60 HB2 LYS 439 HB2 LYS 439 1.885 0.551 10.391
61 HB3 LYS 439 HB1 LYS 439 1.051 0.881 8.882
62 HG2 LYS 439 HG2 LYS 439 -1.053 0.091 9.928
63 HG3 LYS 439 HG1 LYS 439 -0.182 -0.086 11.452
64 HD2 LYS 439 HD2 LYS 439 -1.357 2.028 11.429
65 HD3 LYS 439 HD1 LYS 439 0.383 2.319 11.372
66 HE2 LYS 439 HE2 LYS 439 0.257 2.663 8.961
67 HE3 LYS 439 HE1 LYS 439 -1.476 2.337 8.995
68 HZ1 LYS 439 HZ1 LYS 439 -1.095 4.692 8.950
69 HZ2 LYS 439 HZ2 LYS 439 -0.078 4.609 10.303
70 HZ3 LYS 439 HZ3 LYS 439 -1.733 4.275 10.466
71 H THR 440 HN THR 440 3.414 -2.410 9.968
72 HA THR 440 HA THR 440 2.174 -3.698 12.302
73 HB THR 440 HB THR 440 3.047 -5.350 10.772
74 HG1 THR 440 HG1 THR 440 3.959 -6.462 12.348
75 HG21 THR 440 HG21 THR 440 4.657 -3.928 9.579
76 HG22 THR 440 HG22 THR 440 5.393 -5.438 10.117
77 HG23 THR 440 HG23 THR 440 5.708 -3.941 10.997
78 H ALA 441 HN ALA 441 3.299 -3.730 14.281
79 HA ALA 441 HA ALA 441 4.578 -1.288 14.941
80 HB1 ALA 441 HB1 ALA 441 4.819 -2.239 17.172
81 HB2 ALA 441 HB2 ALA 441 4.402 -3.834 16.548
82 HB3 ALA 441 HB3 ALA 441 3.204 -2.540 16.530
83 H ASP 442 HN ASP 442 5.782 -3.993 13.432
84 HA ASP 442 HA ASP 442 8.442 -4.045 14.451
85 HB2 ASP 442 HB2 ASP 442 7.464 -5.922 13.194
86 HB3 ASP 442 HB1 ASP 442 7.356 -4.912 11.759
87 H GLY 443 HN GLY 443 6.763 -1.746 12.700
88 HA2 GLY 443 HA2 GLY 443 7.612 0.349 12.065
89 HA3 GLY 443 HA1 GLY 443 9.235 -0.329 12.078
90 H LYS 444 HN LYS 444 6.462 -1.715 10.468
91 HA LYS 444 HA LYS 444 7.673 -1.086 7.864
92 HB2 LYS 444 HB2 LYS 444 7.037 -3.735 9.052
93 HB3 LYS 444 HB1 LYS 444 6.682 -3.519 7.345
94 HG2 LYS 444 HG2 LYS 444 8.966 -3.053 6.854
95 HG3 LYS 444 HG1 LYS 444 9.375 -2.984 8.570
96 HD2 LYS 444 HD2 LYS 444 9.068 -5.298 8.846
97 HD3 LYS 444 HD1 LYS 444 8.204 -5.450 7.315
98 HE2 LYS 444 HE2 LYS 444 10.186 -5.115 6.066
99 HE3 LYS 444 HE1 LYS 444 11.091 -4.624 7.500
100 HZ1 LYS 444 HZ1 LYS 444 10.262 -7.070 8.202
101 HZ2 LYS 444 HZ2 LYS 444 11.757 -6.749 7.475
102 HZ3 LYS 444 HZ3 LYS 444 10.454 -7.281 6.527
103 H THR 445 HN THR 445 6.255 -0.163 6.539
104 HA THR 445 HA THR 445 3.410 -0.843 6.871
105 HB THR 445 HB THR 445 2.941 1.172 5.481
106 HG1 THR 445 HG1 THR 445 5.281 1.115 4.670
107 HG21 THR 445 HG21 THR 445 4.615 1.830 7.889
108 HG22 THR 445 HG22 THR 445 2.969 1.214 7.984
109 HG23 THR 445 HG23 THR 445 3.286 2.776 7.225
110 H TYR 446 HN TYR 446 3.118 -2.632 5.651
111 HA TYR 446 HA TYR 446 4.273 -2.632 2.964
112 HB2 TYR 446 HB2 TYR 446 3.610 -5.090 2.968
113 HB3 TYR 446 HB1 TYR 446 4.928 -4.614 4.026
114 HD1 TYR 446 HD1 TYR 446 4.396 -4.289 6.510
115 HD2 TYR 446 HD2 TYR 446 1.763 -6.252 3.807
116 HE1 TYR 446 HE1 TYR 446 3.289 -5.397 8.404
117 HE2 TYR 446 HE2 TYR 446 0.641 -7.359 5.692
118 HH TYR 446 HH TYR 446 1.062 -6.413 8.903
119 H TYR 447 HN TYR 447 3.105 -1.995 1.422
120 HA TYR 447 HA TYR 447 0.192 -1.918 1.651
121 HB2 TYR 447 HB2 TYR 447 2.065 -0.629 -0.357
122 HB3 TYR 447 HB1 TYR 447 0.326 -0.388 -0.290
123 HD1 TYR 447 HD2 TYR 447 3.309 -0.080 1.961
124 HD2 TYR 447 HD1 TYR 447 -0.434 1.530 0.737
125 HE1 TYR 447 HE2 TYR 447 3.644 1.828 3.483
126 HE2 TYR 447 HE1 TYR 447 -0.104 3.447 2.241
127 HH TYR 447 HH TYR 447 1.157 3.988 4.292
128 H TYR 448 HN TYR 448 -0.935 -3.513 0.730
129 HA TYR 448 HA TYR 448 0.325 -5.126 -1.342
130 HB2 TYR 448 HB2 TYR 448 -0.834 -6.359 0.402
131 HB3 TYR 448 HB1 TYR 448 -2.316 -5.459 0.096
132 HD1 TYR 448 HD1 TYR 448 0.124 -7.661 -1.695
133 HD2 TYR 448 HD2 TYR 448 -3.921 -6.405 -1.270
134 HE1 TYR 448 HE1 TYR 448 -0.569 -9.348 -3.351
135 HE2 TYR 448 HE2 TYR 448 -4.624 -8.089 -2.921
136 HH TYR 448 HH TYR 448 -3.709 -9.397 -4.724
137 H ASN 449 HN ASN 449 0.041 -4.751 -3.400
138 HA ASN 449 HA ASN 449 -2.340 -3.227 -4.226
139 HB2 ASN 449 HB2 ASN 449 -0.965 -2.080 -5.898
140 HB3 ASN 449 HB1 ASN 449 -0.372 -1.770 -4.271
141 HD21 ASN 449 HD21 ASN 449 1.609 -2.607 -3.645
142 HD22 ASN 449 HD22 ASN 449 2.736 -3.263 -4.778
143 H ASN 450 HN ASN 450 -3.361 -3.886 -6.031
144 HA ASN 450 HA ASN 450 -2.627 -6.433 -7.152
145 HB2 ASN 450 HB2 ASN 450 -4.689 -6.396 -8.313
146 HB3 ASN 450 HB1 ASN 450 -5.018 -5.664 -6.752
147 HD21 ASN 450 HD21 ASN 450 -3.840 -3.078 -7.468
148 HD22 ASN 450 HD22 ASN 450 -4.956 -2.331 -8.559
149 H ARG 451 HN ARG 451 -1.355 -3.501 -7.636
150 HA ARG 451 HA ARG 451 -1.324 -3.336 -10.475
151 HB2 ARG 451 HB2 ARG 451 -0.913 -1.364 -9.022
152 HB3 ARG 451 HB1 ARG 451 0.621 -2.079 -8.539
153 HG2 ARG 451 HG2 ARG 451 1.465 -1.937 -10.779
154 HG3 ARG 451 HG1 ARG 451 -0.107 -1.414 -11.385
155 HD2 ARG 451 HD2 ARG 451 1.229 0.526 -11.239
156 HD3 ARG 451 HD1 ARG 451 0.111 0.592 -9.880
157 HE ARG 451 HE ARG 451 2.446 -0.612 -8.964
158 HH11 ARG 451 HH11 ARG 451 1.449 2.474 -10.272
159 HH12 ARG 451 HH12 ARG 451 2.626 3.390 -9.376
160 HH21 ARG 451 HH21 ARG 451 4.030 0.566 -7.818
161 HH22 ARG 451 HH22 ARG 451 4.112 2.297 -7.991
162 H THR 452 HN THR 452 1.105 -4.309 -8.084
163 HA THR 452 HA THR 452 2.428 -5.895 -10.182
164 HB THR 452 HB THR 452 3.569 -5.267 -7.454
165 HG1 THR 452 HG1 THR 452 4.206 -3.761 -9.760
166 HG21 THR 452 HG21 THR 452 4.693 -7.022 -8.750
167 HG22 THR 452 HG22 THR 452 5.714 -5.593 -8.600
168 HG23 THR 452 HG23 THR 452 4.863 -5.913 -10.110
169 H LEU 453 HN LEU 453 0.114 -6.270 -7.921
170 HA LEU 453 HA LEU 453 -0.743 -7.933 -6.634
171 HB2 LEU 453 HB2 LEU 453 0.973 -9.543 -8.513
172 HB3 LEU 453 HB1 LEU 453 0.042 -10.309 -7.242
173 HG LEU 453 HG LEU 453 -1.247 -10.506 -9.203
174 HD11 LEU 453 HD11 LEU 453 -3.253 -9.204 -8.719
175 HD12 LEU 453 HD12 LEU 453 -2.320 -8.167 -7.639
176 HD13 LEU 453 HD13 LEU 453 -2.539 -9.876 -7.252
177 HD21 LEU 453 HD21 LEU 453 -0.834 -7.555 -9.663
178 HD22 LEU 453 HD22 LEU 453 -1.844 -8.619 -10.642
179 HD23 LEU 453 HD23 LEU 453 -0.100 -8.867 -10.585
180 H GLU 454 HN GLU 454 1.573 -6.498 -5.787
181 HA GLU 454 HA GLU 454 3.041 -8.504 -4.216
182 HB2 GLU 454 HB2 GLU 454 4.442 -7.725 -6.028
183 HB3 GLU 454 HB1 GLU 454 4.080 -6.050 -5.642
184 HG2 GLU 454 HG2 GLU 454 5.291 -6.221 -3.568
185 HG3 GLU 454 HG1 GLU 454 5.564 -7.942 -3.836
186 H SER 455 HN SER 455 3.522 -7.981 -2.126
187 HA SER 455 HA SER 455 2.303 -5.580 -1.017
188 HB2 SER 455 HB2 SER 455 2.032 -7.836 0.082
189 HB3 SER 455 HB1 SER 455 3.759 -7.813 0.427
190 HG SER 455 HG SER 455 2.376 -7.058 2.159
191 H THR 456 HN THR 456 3.517 -3.796 -1.206
192 HA THR 456 HA THR 456 6.435 -4.090 -1.138
193 HB THR 456 HB THR 456 5.681 -3.047 -3.169
194 HG1 THR 456 HG1 THR 456 7.550 -2.097 -2.581
195 HG21 THR 456 HG21 THR 456 3.505 -2.203 -2.427
196 HG22 THR 456 HG22 THR 456 4.441 -0.926 -3.204
197 HG23 THR 456 HG23 THR 456 4.304 -0.976 -1.445
198 H PHE 457 HN PHE 457 7.656 -3.155 0.381
199 HA PHE 457 HA PHE 457 6.303 -2.075 2.695
200 HB2 PHE 457 HB2 PHE 457 9.213 -2.695 2.157
201 HB3 PHE 457 HB1 PHE 457 8.599 -2.100 3.696
202 HD1 PHE 457 HD2 PHE 457 8.717 -4.960 1.407
203 HD2 PHE 457 HD1 PHE 457 7.339 -3.514 5.162
204 HE1 PHE 457 HE2 PHE 457 8.231 -7.266 2.113
205 HE2 PHE 457 HE1 PHE 457 6.858 -5.814 5.878
206 HZ PHE 457 HZ PHE 457 7.298 -7.695 4.350
207 H GLU 458 HN GLU 458 7.169 -0.713 -0.092
208 HA GLU 458 HA GLU 458 8.187 1.761 1.109
209 HB2 GLU 458 HB2 GLU 458 9.380 0.741 -0.869
210 HB3 GLU 458 HB1 GLU 458 7.947 1.087 -1.828
211 HG2 GLU 458 HG2 GLU 458 9.737 2.778 -2.066
212 HG3 GLU 458 HG1 GLU 458 8.208 3.442 -1.490
213 H LYS 459 HN LYS 459 7.110 3.708 0.809
214 HA LYS 459 HA LYS 459 4.247 3.424 0.564
215 HB2 LYS 459 HB2 LYS 459 5.938 5.873 1.092
216 HB3 LYS 459 HB1 LYS 459 4.185 5.801 1.209
217 HG2 LYS 459 HG2 LYS 459 4.437 4.071 2.976
218 HG3 LYS 459 HG1 LYS 459 6.180 4.340 2.921
219 HD2 LYS 459 HD2 LYS 459 5.876 6.655 3.561
220 HD3 LYS 459 HD1 LYS 459 4.123 6.462 3.518
221 HE2 LYS 459 HE2 LYS 459 6.064 5.149 5.410
222 HE3 LYS 459 HE1 LYS 459 4.837 6.354 5.801
223 HZ1 LYS 459 HZ1 LYS 459 4.540 3.493 5.302
224 HZ2 LYS 459 HZ2 LYS 459 3.300 4.495 4.733
225 HZ3 LYS 459 HZ3 LYS 459 3.699 4.500 6.379
226 HA PRO 460 HA PRO 460 4.408 4.303 -3.811
227 HB2 PRO 460 HB2 PRO 460 1.668 4.367 -4.115
228 HB3 PRO 460 HB1 PRO 460 2.654 2.904 -4.175
229 HG2 PRO 460 HG2 PRO 460 0.985 3.975 -1.962
230 HG3 PRO 460 HG1 PRO 460 1.299 2.297 -2.425
231 HD2 PRO 460 HD2 PRO 460 2.490 3.514 -0.301
232 HD3 PRO 460 HD1 PRO 460 3.246 2.200 -1.223
233 H GLN 461 HN GLN 461 4.564 6.182 -4.803
234 HA GLN 461 HA GLN 461 3.844 8.605 -3.431
235 HB2 GLN 461 HB2 GLN 461 5.974 8.319 -4.685
236 HB3 GLN 461 HB1 GLN 461 5.050 8.220 -6.175
237 HG2 GLN 461 HG2 GLN 461 4.182 10.511 -5.686
238 HG3 GLN 461 HG1 GLN 461 5.325 10.586 -4.346
239 HE21 GLN 461 HE21 GLN 461 6.010 8.962 -7.349
240 HE22 GLN 461 HE22 GLN 461 7.204 10.083 -7.912
241 H GLU 462 HN GLU 462 2.409 6.562 -5.730
242 HA GLU 462 HA GLU 462 0.704 8.610 -6.878
243 HB2 GLU 462 HB2 GLU 462 -0.420 6.561 -7.951
244 HB3 GLU 462 HB1 GLU 462 1.215 6.962 -8.452
245 HG2 GLU 462 HG2 GLU 462 0.756 4.962 -6.280
246 HG3 GLU 462 HG1 GLU 462 0.575 4.503 -7.972
247 H LEU 463 HN LEU 463 0.780 7.282 -3.972
248 HA LEU 463 HA LEU 463 -2.116 6.971 -3.674
249 HB2 LEU 463 HB2 LEU 463 -0.712 5.248 -2.657
250 HB3 LEU 463 HB1 LEU 463 0.152 6.468 -1.741
251 HG LEU 463 HG LEU 463 -1.950 7.002 -0.530
252 HD11 LEU 463 HD11 LEU 463 -3.032 4.593 -1.989
253 HD12 LEU 463 HD12 LEU 463 -3.542 6.264 -2.230
254 HD13 LEU 463 HD13 LEU 463 -3.838 5.466 -0.685
255 HD21 LEU 463 HD21 LEU 463 -1.964 4.984 0.850
256 HD22 LEU 463 HD22 LEU 463 -0.319 5.465 0.430
257 HD23 LEU 463 HD23 LEU 463 -1.086 4.114 -0.408
258 H LYS 464 HN LYS 464 -3.335 8.499 -2.721
259 HA LYS 464 HA LYS 464 -1.943 10.830 -1.585
260 HB2 LYS 464 HB2 LYS 464 -4.074 12.076 -2.167
261 HB3 LYS 464 HB1 LYS 464 -3.088 11.559 -3.528
262 HG2 LYS 464 HG2 LYS 464 -4.596 9.902 -4.153
263 HG3 LYS 464 HG1 LYS 464 -5.369 9.874 -2.567
264 HD2 LYS 464 HD2 LYS 464 -5.476 12.384 -4.171
265 HD3 LYS 464 HD1 LYS 464 -6.523 11.042 -4.631
266 HE2 LYS 464 HE2 LYS 464 -7.658 12.601 -3.116
267 HE3 LYS 464 HE1 LYS 464 -7.490 11.001 -2.400
268 HZ1 LYS 464 HZ1 LYS 464 -5.593 11.811 -1.128
269 HZ2 LYS 464 HZ2 LYS 464 -6.984 12.723 -0.798
270 HZ3 LYS 464 HZ3 LYS 464 -5.775 13.357 -1.809
Start of MODEL 10
1 H ALA 431 HN ALA 431 -11.373 5.350 -10.620
2 HA ALA 431 HA ALA 431 -9.504 3.395 -11.597
3 HB1 ALA 431 HB1 ALA 431 -9.311 6.406 -11.591
4 HB2 ALA 431 HB2 ALA 431 -10.023 5.429 -12.874
5 HB3 ALA 431 HB3 ALA 431 -8.301 5.294 -12.516
6 H VAL 432 HN VAL 432 -9.844 5.374 -8.786
7 HA VAL 432 HA VAL 432 -7.079 5.261 -8.021
8 HB VAL 432 HB VAL 432 -7.837 6.145 -5.842
9 HG11 VAL 432 HG11 VAL 432 -8.620 8.313 -6.660
10 HG12 VAL 432 HG12 VAL 432 -8.981 7.590 -8.229
11 HG13 VAL 432 HG13 VAL 432 -7.314 7.677 -7.659
12 HG21 VAL 432 HG21 VAL 432 -10.598 5.971 -7.047
13 HG22 VAL 432 HG22 VAL 432 -10.191 6.796 -5.543
14 HG23 VAL 432 HG23 VAL 432 -9.996 5.048 -5.671
15 H SER 433 HN SER 433 -6.107 3.902 -6.569
16 HA SER 433 HA SER 433 -7.648 1.485 -5.915
17 HB2 SER 433 HB2 SER 433 -4.646 1.841 -5.982
18 HB3 SER 433 HB1 SER 433 -5.536 0.322 -5.872
19 HG SER 433 HG SER 433 -6.086 1.999 -8.035
20 H GLU 434 HN GLU 434 -7.941 0.887 -3.847
21 HA GLU 434 HA GLU 434 -6.751 2.527 -1.761
22 HB2 GLU 434 HB2 GLU 434 -8.299 1.187 -0.259
23 HB3 GLU 434 HB1 GLU 434 -9.068 2.255 -1.425
24 HG2 GLU 434 HG2 GLU 434 -9.285 0.212 -2.919
25 HG3 GLU 434 HG1 GLU 434 -8.854 -0.735 -1.495
26 H TRP 435 HN TRP 435 -4.854 1.954 -1.070
27 HA TRP 435 HA TRP 435 -3.907 -0.772 -1.429
28 HB2 TRP 435 HB2 TRP 435 -2.394 1.660 -0.433
29 HB3 TRP 435 HB1 TRP 435 -1.697 0.142 -0.985
30 HD1 TRP 435 HD1 TRP 435 -3.851 3.016 -2.475
31 HE1 TRP 435 HE1 TRP 435 -3.160 3.352 -4.927
32 HE3 TRP 435 HE3 TRP 435 -0.389 -0.727 -2.859
33 HZ2 TRP 435 HZ2 TRP 435 -1.366 2.206 -6.766
34 HZ3 TRP 435 HZ3 TRP 435 0.771 -1.031 -5.009
35 HH2 TRP 435 HH2 TRP 435 0.295 0.407 -6.916
36 H THR 436 HN THR 436 -3.592 -2.189 0.230
37 HA THR 436 HA THR 436 -4.699 -1.358 2.791
38 HB THR 436 HB THR 436 -3.840 -4.140 1.988
39 HG1 THR 436 HG1 THR 436 -6.000 -2.604 1.172
40 HG21 THR 436 HG21 THR 436 -4.264 -3.805 4.376
41 HG22 THR 436 HG22 THR 436 -5.515 -4.818 3.653
42 HG23 THR 436 HG23 THR 436 -5.849 -3.123 4.005
43 H GLU 437 HN GLU 437 -3.425 -0.688 4.361
44 HA GLU 437 HA GLU 437 -0.563 -1.224 4.225
45 HB2 GLU 437 HB2 GLU 437 -1.387 1.085 4.628
46 HB3 GLU 437 HB1 GLU 437 -2.116 0.538 6.132
47 HG2 GLU 437 HG2 GLU 437 0.532 -0.288 6.293
48 HG3 GLU 437 HG1 GLU 437 0.603 1.319 5.576
49 H TYR 438 HN TYR 438 0.277 -2.886 5.272
50 HA TYR 438 HA TYR 438 -0.943 -3.665 7.834
51 HB2 TYR 438 HB2 TYR 438 0.837 -5.268 5.988
52 HB3 TYR 438 HB1 TYR 438 0.287 -5.812 7.569
53 HD1 TYR 438 HD2 TYR 438 -2.264 -5.965 7.924
54 HD2 TYR 438 HD1 TYR 438 -0.443 -5.703 4.090
55 HE1 TYR 438 HE2 TYR 438 -4.299 -6.890 6.901
56 HE2 TYR 438 HE1 TYR 438 -2.473 -6.628 3.057
57 HH TYR 438 HH TYR 438 -5.423 -6.906 4.718
58 H LYS 439 HN LYS 439 0.037 -2.717 9.451
59 HA LYS 439 HA LYS 439 2.837 -1.954 9.238
60 HB2 LYS 439 HB2 LYS 439 1.225 -0.289 10.019
61 HB3 LYS 439 HB1 LYS 439 0.743 -1.349 11.337
62 HG2 LYS 439 HG2 LYS 439 3.009 -1.171 12.272
63 HG3 LYS 439 HG1 LYS 439 3.439 -0.065 10.967
64 HD2 LYS 439 HD2 LYS 439 1.183 0.428 12.906
65 HD3 LYS 439 HD1 LYS 439 2.821 1.032 13.142
66 HE2 LYS 439 HE2 LYS 439 1.670 2.829 12.187
67 HE3 LYS 439 HE1 LYS 439 2.564 2.125 10.845
68 HZ1 LYS 439 HZ1 LYS 439 0.572 1.075 10.050
69 HZ2 LYS 439 HZ2 LYS 439 0.244 2.714 10.303
70 HZ3 LYS 439 HZ3 LYS 439 -0.302 1.565 11.420
71 H THR 440 HN THR 440 4.273 -3.442 9.790
72 HA THR 440 HA THR 440 3.634 -5.371 11.882
73 HB THR 440 HB THR 440 4.597 -6.298 9.847
74 HG1 THR 440 HG1 THR 440 5.179 -7.406 11.702
75 HG21 THR 440 HG21 THR 440 5.880 -4.354 9.094
76 HG22 THR 440 HG22 THR 440 6.890 -5.799 9.159
77 HG23 THR 440 HG23 THR 440 7.012 -4.580 10.428
78 H ALA 441 HN ALA 441 4.877 -5.638 13.739
79 HA ALA 441 HA ALA 441 5.818 -3.271 14.950
80 HB1 ALA 441 HB1 ALA 441 4.824 -5.109 16.210
81 HB2 ALA 441 HB2 ALA 441 6.420 -4.689 16.833
82 HB3 ALA 441 HB3 ALA 441 6.215 -6.125 15.830
83 H ASP 442 HN ASP 442 7.335 -5.136 12.688
84 HA ASP 442 HA ASP 442 10.041 -4.935 13.577
85 HB2 ASP 442 HB2 ASP 442 9.339 -6.553 11.859
86 HB3 ASP 442 HB1 ASP 442 8.902 -5.231 10.784
87 H GLY 443 HN GLY 443 7.764 -2.695 12.557
88 HA2 GLY 443 HA2 GLY 443 8.071 -0.371 12.570
89 HA3 GLY 443 HA1 GLY 443 9.803 -0.617 12.393
90 H LYS 444 HN LYS 444 7.341 -2.136 10.413
91 HA LYS 444 HA LYS 444 8.037 -0.351 8.191
92 HB2 LYS 444 HB2 LYS 444 8.212 -3.368 8.077
93 HB3 LYS 444 HB1 LYS 444 8.218 -2.329 6.660
94 HG2 LYS 444 HG2 LYS 444 10.227 -1.180 7.912
95 HG3 LYS 444 HG1 LYS 444 10.329 -2.751 8.711
96 HD2 LYS 444 HD2 LYS 444 10.306 -2.339 5.722
97 HD3 LYS 444 HD1 LYS 444 11.763 -2.560 6.690
98 HE2 LYS 444 HE2 LYS 444 9.523 -4.565 6.681
99 HE3 LYS 444 HE1 LYS 444 10.823 -4.607 5.492
100 HZ1 LYS 444 HZ1 LYS 444 12.415 -4.777 7.318
101 HZ2 LYS 444 HZ2 LYS 444 11.313 -6.068 7.325
102 HZ3 LYS 444 HZ3 LYS 444 11.143 -4.802 8.443
103 H THR 445 HN THR 445 6.306 0.326 7.162
104 HA THR 445 HA THR 445 3.782 -1.139 7.430
105 HB THR 445 HB THR 445 2.868 0.960 6.274
106 HG1 THR 445 HG1 THR 445 5.034 1.646 5.602
107 HG21 THR 445 HG21 THR 445 2.953 2.296 8.364
108 HG22 THR 445 HG22 THR 445 4.137 1.153 9.005
109 HG23 THR 445 HG23 THR 445 2.504 0.611 8.625
110 H TYR 446 HN TYR 446 3.612 -2.700 5.867
111 HA TYR 446 HA TYR 446 4.456 -1.933 3.170
112 HB2 TYR 446 HB2 TYR 446 4.408 -4.326 2.600
113 HB3 TYR 446 HB1 TYR 446 5.521 -3.969 3.908
114 HD1 TYR 446 HD1 TYR 446 5.082 -4.796 6.171
115 HD2 TYR 446 HD2 TYR 446 2.436 -5.684 2.958
116 HE1 TYR 446 HE1 TYR 446 4.073 -6.604 7.499
117 HE2 TYR 446 HE2 TYR 446 1.423 -7.485 4.278
118 HH TYR 446 HH TYR 446 1.927 -7.839 7.601
119 H TYR 447 HN TYR 447 3.057 -1.443 1.719
120 HA TYR 447 HA TYR 447 0.220 -1.852 2.226
121 HB2 TYR 447 HB2 TYR 447 1.710 -0.280 0.112
122 HB3 TYR 447 HB1 TYR 447 -0.042 -0.414 0.170
123 HD1 TYR 447 HD2 TYR 447 2.826 0.602 2.366
124 HD2 TYR 447 HD1 TYR 447 -1.231 1.237 1.250
125 HE1 TYR 447 HE2 TYR 447 2.723 2.545 3.873
126 HE2 TYR 447 HE1 TYR 447 -1.346 3.181 2.747
127 HH TYR 447 HH TYR 447 -0.160 3.988 4.806
128 H TYR 448 HN TYR 448 -0.602 -3.744 1.591
129 HA TYR 448 HA TYR 448 0.619 -5.150 -0.649
130 HB2 TYR 448 HB2 TYR 448 0.078 -6.412 1.425
131 HB3 TYR 448 HB1 TYR 448 -1.628 -6.063 1.156
132 HD1 TYR 448 HD1 TYR 448 1.299 -7.568 -0.614
133 HD2 TYR 448 HD2 TYR 448 -2.910 -7.630 0.017
134 HE1 TYR 448 HE1 TYR 448 1.121 -9.560 -2.041
135 HE2 TYR 448 HE2 TYR 448 -3.097 -9.626 -1.414
136 HH TYR 448 HH TYR 448 -1.898 -10.774 -3.146
137 H ASN 449 HN ASN 449 -0.152 -5.154 -2.602
138 HA ASN 449 HA ASN 449 -2.962 -4.394 -3.032
139 HB2 ASN 449 HB2 ASN 449 -2.338 -3.058 -4.945
140 HB3 ASN 449 HB1 ASN 449 -1.416 -2.499 -3.555
141 HD21 ASN 449 HD21 ASN 449 0.818 -2.868 -3.492
142 HD22 ASN 449 HD22 ASN 449 1.707 -3.306 -4.912
143 H ASN 450 HN ASN 450 -4.032 -5.557 -4.570
144 HA ASN 450 HA ASN 450 -2.654 -7.871 -5.657
145 HB2 ASN 450 HB2 ASN 450 -4.842 -8.658 -6.342
146 HB3 ASN 450 HB1 ASN 450 -4.917 -8.117 -4.671
147 HD21 ASN 450 HD21 ASN 450 -6.099 -6.282 -4.158
148 HD22 ASN 450 HD22 ASN 450 -7.253 -5.603 -5.258
149 H ARG 451 HN ARG 451 -2.748 -4.796 -6.560
150 HA ARG 451 HA ARG 451 -3.347 -4.928 -9.325
151 HB2 ARG 451 HB2 ARG 451 -1.826 -3.004 -7.606
152 HB3 ARG 451 HB1 ARG 451 -1.752 -2.859 -9.357
153 HG2 ARG 451 HG2 ARG 451 -4.127 -2.540 -9.488
154 HG3 ARG 451 HG1 ARG 451 -4.303 -2.859 -7.762
155 HD2 ARG 451 HD2 ARG 451 -4.360 -0.439 -8.410
156 HD3 ARG 451 HD1 ARG 451 -3.164 -0.861 -7.187
157 HE ARG 451 HE ARG 451 -1.778 -0.996 -9.529
158 HH11 ARG 451 HH11 ARG 451 -3.833 1.470 -8.125
159 HH12 ARG 451 HH12 ARG 451 -2.831 2.793 -8.657
160 HH21 ARG 451 HH21 ARG 451 -0.476 0.724 -10.258
161 HH22 ARG 451 HH22 ARG 451 -0.932 2.368 -9.905
162 H THR 452 HN THR 452 -0.223 -4.784 -7.632
163 HA THR 452 HA THR 452 0.981 -6.235 -9.884
164 HB THR 452 HB THR 452 2.515 -4.985 -7.612
165 HG1 THR 452 HG1 THR 452 1.478 -3.731 -9.964
166 HG21 THR 452 HG21 THR 452 4.273 -4.801 -9.301
167 HG22 THR 452 HG22 THR 452 3.189 -5.474 -10.518
168 HG23 THR 452 HG23 THR 452 3.720 -6.470 -9.164
169 H LEU 453 HN LEU 453 -0.469 -6.884 -7.030
170 HA LEU 453 HA LEU 453 -0.612 -8.673 -5.661
171 HB2 LEU 453 HB2 LEU 453 1.061 -9.917 -7.837
172 HB3 LEU 453 HB1 LEU 453 0.471 -10.822 -6.457
173 HG LEU 453 HG LEU 453 -1.872 -9.977 -7.226
174 HD11 LEU 453 HD11 LEU 453 -0.295 -9.721 -9.779
175 HD12 LEU 453 HD12 LEU 453 -1.096 -8.411 -8.912
176 HD13 LEU 453 HD13 LEU 453 -2.053 -9.698 -9.647
177 HD21 LEU 453 HD21 LEU 453 -1.193 -12.300 -7.212
178 HD22 LEU 453 HD22 LEU 453 -0.337 -12.078 -8.739
179 HD23 LEU 453 HD23 LEU 453 -2.094 -11.931 -8.682
180 H GLU 454 HN GLU 454 1.408 -6.724 -5.153
181 HA GLU 454 HA GLU 454 3.357 -8.370 -3.704
182 HB2 GLU 454 HB2 GLU 454 5.153 -6.784 -4.319
183 HB3 GLU 454 HB1 GLU 454 4.507 -7.653 -5.703
184 HG2 GLU 454 HG2 GLU 454 3.251 -5.732 -6.398
185 HG3 GLU 454 HG1 GLU 454 3.692 -4.865 -4.927
186 H SER 455 HN SER 455 4.140 -7.496 -1.804
187 HA SER 455 HA SER 455 2.666 -5.207 -0.762
188 HB2 SER 455 HB2 SER 455 3.914 -5.911 1.393
189 HB3 SER 455 HB1 SER 455 2.623 -6.957 0.800
190 HG SER 455 HG SER 455 4.250 -8.262 -0.174
191 H THR 456 HN THR 456 3.521 -3.289 -1.161
192 HA THR 456 HA THR 456 6.436 -3.079 -1.370
193 HB THR 456 HB THR 456 5.061 -2.299 -3.308
194 HG1 THR 456 HG1 THR 456 6.963 -1.324 -3.375
195 HG21 THR 456 HG21 THR 456 3.892 -0.145 -3.142
196 HG22 THR 456 HG22 THR 456 4.184 -0.123 -1.402
197 HG23 THR 456 HG23 THR 456 3.151 -1.367 -2.109
198 H PHE 457 HN PHE 457 7.599 -1.707 -0.084
199 HA PHE 457 HA PHE 457 6.248 -0.841 2.345
200 HB2 PHE 457 HB2 PHE 457 9.192 -0.911 1.648
201 HB3 PHE 457 HB1 PHE 457 8.530 -0.493 3.225
202 HD1 PHE 457 HD1 PHE 457 7.413 -2.212 4.588
203 HD2 PHE 457 HD2 PHE 457 9.392 -3.166 0.945
204 HE1 PHE 457 HE1 PHE 457 7.449 -4.586 5.233
205 HE2 PHE 457 HE2 PHE 457 9.433 -5.542 1.584
206 HZ PHE 457 HZ PHE 457 8.461 -6.254 3.731
207 H GLU 458 HN GLU 458 6.783 0.487 -0.571
208 HA GLU 458 HA GLU 458 7.435 3.147 0.456
209 HB2 GLU 458 HB2 GLU 458 8.605 2.237 -1.580
210 HB3 GLU 458 HB1 GLU 458 7.064 2.311 -2.424
211 HG2 GLU 458 HG2 GLU 458 8.581 4.243 -2.836
212 HG3 GLU 458 HG1 GLU 458 6.980 4.679 -2.233
213 H LYS 459 HN LYS 459 6.018 4.804 0.419
214 HA LYS 459 HA LYS 459 3.262 4.009 0.537
215 HB2 LYS 459 HB2 LYS 459 4.562 6.700 0.986
216 HB3 LYS 459 HB1 LYS 459 2.889 6.296 1.367
217 HG2 LYS 459 HG2 LYS 459 3.642 4.621 2.965
218 HG3 LYS 459 HG1 LYS 459 5.320 4.981 2.565
219 HD2 LYS 459 HD2 LYS 459 5.016 7.270 3.383
220 HD3 LYS 459 HD1 LYS 459 3.341 6.893 3.795
221 HE2 LYS 459 HE2 LYS 459 4.677 6.735 5.781
222 HE3 LYS 459 HE1 LYS 459 4.162 5.118 5.312
223 HZ1 LYS 459 HZ1 LYS 459 6.448 5.025 5.921
224 HZ2 LYS 459 HZ2 LYS 459 6.845 6.329 4.923
225 HZ3 LYS 459 HZ3 LYS 459 6.381 4.856 4.236
226 HA PRO 460 HA PRO 460 2.272 4.900 -3.731
227 HB2 PRO 460 HB2 PRO 460 -0.428 5.078 -2.474
228 HB3 PRO 460 HB1 PRO 460 0.090 4.178 -3.905
229 HG2 PRO 460 HG2 PRO 460 -0.334 2.901 -1.629
230 HG3 PRO 460 HG1 PRO 460 1.060 2.480 -2.642
231 HD2 PRO 460 HD2 PRO 460 0.963 4.082 -0.121
232 HD3 PRO 460 HD1 PRO 460 2.175 2.903 -0.669
233 H GLN 461 HN GLN 461 1.673 6.657 -4.947
234 HA GLN 461 HA GLN 461 1.569 9.194 -3.510
235 HB2 GLN 461 HB2 GLN 461 3.217 8.881 -5.324
236 HB3 GLN 461 HB1 GLN 461 1.906 8.605 -6.458
237 HG2 GLN 461 HG2 GLN 461 2.787 10.849 -6.676
238 HG3 GLN 461 HG1 GLN 461 1.116 10.882 -6.118
239 HE21 GLN 461 HE21 GLN 461 0.649 11.632 -4.086
240 HE22 GLN 461 HE22 GLN 461 1.813 12.459 -3.098
241 H GLU 462 HN GLU 462 -0.497 7.021 -5.133
242 HA GLU 462 HA GLU 462 -2.490 9.056 -5.726
243 HB2 GLU 462 HB2 GLU 462 -3.844 7.134 -6.568
244 HB3 GLU 462 HB1 GLU 462 -2.295 7.333 -7.376
245 HG2 GLU 462 HG2 GLU 462 -1.357 5.498 -6.166
246 HG3 GLU 462 HG1 GLU 462 -2.790 5.381 -5.144
247 H LEU 463 HN LEU 463 -1.725 6.873 -3.189
248 HA LEU 463 HA LEU 463 -4.391 7.319 -2.024
249 HB2 LEU 463 HB2 LEU 463 -3.819 4.942 -2.732
250 HB3 LEU 463 HB1 LEU 463 -2.623 4.947 -1.455
251 HG LEU 463 HG LEU 463 -4.895 3.845 -0.991
252 HD11 LEU 463 HD11 LEU 463 -3.251 4.264 0.743
253 HD12 LEU 463 HD12 LEU 463 -4.882 4.568 1.343
254 HD13 LEU 463 HD13 LEU 463 -3.834 5.921 0.917
255 HD21 LEU 463 HD21 LEU 463 -5.684 6.738 -0.699
256 HD22 LEU 463 HD22 LEU 463 -6.640 5.354 -0.170
257 HD23 LEU 463 HD23 LEU 463 -6.312 5.595 -1.887
258 H LYS 464 HN LYS 464 -4.130 8.893 -0.588
259 HA LYS 464 HA LYS 464 -2.286 8.427 1.615
260 HB2 LYS 464 HB2 LYS 464 -2.355 10.976 -0.011
261 HB3 LYS 464 HB1 LYS 464 -1.659 10.879 1.600
262 HG2 LYS 464 HG2 LYS 464 -0.016 9.285 0.838
263 HG3 LYS 464 HG1 LYS 464 -0.752 9.255 -0.766
264 HD2 LYS 464 HD2 LYS 464 -0.191 11.594 -1.095
265 HD3 LYS 464 HD1 LYS 464 0.468 11.684 0.542
266 HE2 LYS 464 HE2 LYS 464 1.497 9.832 -1.600
267 HE3 LYS 464 HE1 LYS 464 2.182 11.419 -1.257
268 HZ1 LYS 464 HZ1 LYS 464 2.837 10.723 0.889
269 HZ2 LYS 464 HZ2 LYS 464 3.328 9.498 -0.174
270 HZ3 LYS 464 HZ3 LYS 464 1.949 9.284 0.789
Start of MODEL 11
1 H ALA 431 HN ALA 431 -12.387 1.933 -8.452
2 HA ALA 431 HA ALA 431 -13.280 4.259 -6.914
3 HB1 ALA 431 HB1 ALA 431 -15.262 2.951 -6.405
4 HB2 ALA 431 HB2 ALA 431 -14.568 1.552 -7.224
5 HB3 ALA 431 HB3 ALA 431 -14.980 2.998 -8.145
6 H VAL 432 HN VAL 432 -12.000 0.998 -6.532
7 HA VAL 432 HA VAL 432 -12.005 1.280 -3.628
8 HB VAL 432 HB VAL 432 -11.102 -1.001 -3.574
9 HG11 VAL 432 HG11 VAL 432 -13.505 -0.697 -5.369
10 HG12 VAL 432 HG12 VAL 432 -13.509 -0.701 -3.605
11 HG13 VAL 432 HG13 VAL 432 -13.061 -2.159 -4.490
12 HG21 VAL 432 HG21 VAL 432 -9.779 -0.931 -5.631
13 HG22 VAL 432 HG22 VAL 432 -11.261 -0.894 -6.587
14 HG23 VAL 432 HG23 VAL 432 -10.872 -2.315 -5.617
15 H SER 433 HN SER 433 -10.018 0.942 -2.395
16 HA SER 433 HA SER 433 -7.873 2.512 -3.477
17 HB2 SER 433 HB2 SER 433 -8.534 2.667 -1.091
18 HB3 SER 433 HB1 SER 433 -8.012 0.999 -0.852
19 HG SER 433 HG SER 433 -6.125 1.837 -0.476
20 H GLU 434 HN GLU 434 -6.170 1.778 -4.570
21 HA GLU 434 HA GLU 434 -5.744 -1.012 -4.986
22 HB2 GLU 434 HB2 GLU 434 -4.084 1.400 -5.717
23 HB3 GLU 434 HB1 GLU 434 -3.632 -0.241 -6.139
24 HG2 GLU 434 HG2 GLU 434 -5.771 -0.442 -7.386
25 HG3 GLU 434 HG1 GLU 434 -6.057 1.271 -7.067
26 H TRP 435 HN TRP 435 -4.716 1.211 -2.603
27 HA TRP 435 HA TRP 435 -2.454 -0.531 -1.872
28 HB2 TRP 435 HB2 TRP 435 -2.730 2.362 -1.062
29 HB3 TRP 435 HB1 TRP 435 -1.287 1.355 -1.022
30 HD1 TRP 435 HD1 TRP 435 -3.110 3.776 -3.158
31 HE1 TRP 435 HE1 TRP 435 -1.959 4.019 -5.442
32 HE3 TRP 435 HE3 TRP 435 0.096 -0.165 -2.840
33 HZ2 TRP 435 HZ2 TRP 435 0.033 2.696 -6.917
34 HZ3 TRP 435 HZ3 TRP 435 1.570 -0.641 -4.769
35 HH2 TRP 435 HH2 TRP 435 1.554 0.780 -6.745
36 H THR 436 HN THR 436 -2.714 -1.626 -0.063
37 HA THR 436 HA THR 436 -4.583 -0.616 1.967
38 HB THR 436 HB THR 436 -4.417 -2.973 2.894
39 HG1 THR 436 HG1 THR 436 -3.316 -3.548 0.322
40 HG21 THR 436 HG21 THR 436 -6.338 -2.217 1.569
41 HG22 THR 436 HG22 THR 436 -5.968 -3.913 1.257
42 HG23 THR 436 HG23 THR 436 -5.497 -2.678 0.090
43 H GLU 437 HN GLU 437 -3.846 -0.115 3.999
44 HA GLU 437 HA GLU 437 -0.941 -0.010 4.230
45 HB2 GLU 437 HB2 GLU 437 -1.306 1.531 6.109
46 HB3 GLU 437 HB1 GLU 437 -2.102 2.078 4.643
47 HG2 GLU 437 HG2 GLU 437 -4.243 1.362 5.487
48 HG3 GLU 437 HG1 GLU 437 -3.480 0.663 6.914
49 H TYR 438 HN TYR 438 -0.185 -1.932 4.882
50 HA TYR 438 HA TYR 438 -1.246 -2.963 7.414
51 HB2 TYR 438 HB2 TYR 438 0.363 -4.330 5.259
52 HB3 TYR 438 HB1 TYR 438 0.092 -5.036 6.848
53 HD1 TYR 438 HD2 TYR 438 -2.209 -5.647 7.549
54 HD2 TYR 438 HD1 TYR 438 -1.351 -4.351 3.590
55 HE1 TYR 438 HE2 TYR 438 -4.355 -6.577 6.786
56 HE2 TYR 438 HE1 TYR 438 -3.495 -5.274 2.822
57 HH TYR 438 HH TYR 438 -5.120 -6.965 3.486
58 H LYS 439 HN LYS 439 -0.247 -1.762 8.887
59 HA LYS 439 HA LYS 439 2.652 -1.516 8.749
60 HB2 LYS 439 HB2 LYS 439 2.388 0.170 10.582
61 HB3 LYS 439 HB1 LYS 439 1.643 0.615 9.060
62 HG2 LYS 439 HG2 LYS 439 0.112 -0.548 11.378
63 HG3 LYS 439 HG1 LYS 439 0.335 1.181 11.122
64 HD2 LYS 439 HD2 LYS 439 -0.706 0.845 8.839
65 HD3 LYS 439 HD1 LYS 439 -1.138 -0.780 9.371
66 HE2 LYS 439 HE2 LYS 439 -3.055 0.449 9.836
67 HE3 LYS 439 HE1 LYS 439 -2.220 0.418 11.390
68 HZ1 LYS 439 HZ1 LYS 439 -2.914 2.625 11.048
69 HZ2 LYS 439 HZ2 LYS 439 -2.365 2.645 9.441
70 HZ3 LYS 439 HZ3 LYS 439 -1.248 2.627 10.721
71 H THR 440 HN THR 440 3.699 -3.096 9.650
72 HA THR 440 HA THR 440 2.449 -4.562 11.841
73 HB THR 440 HB THR 440 3.208 -5.893 9.934
74 HG1 THR 440 HG1 THR 440 3.515 -7.313 11.447
75 HG21 THR 440 HG21 THR 440 5.085 -4.420 9.249
76 HG22 THR 440 HG22 THR 440 5.533 -6.122 9.341
77 HG23 THR 440 HG23 THR 440 6.009 -5.014 10.630
78 H ALA 441 HN ALA 441 3.504 -4.998 13.766
79 HA ALA 441 HA ALA 441 4.923 -2.782 14.827
80 HB1 ALA 441 HB1 ALA 441 3.334 -4.124 16.135
81 HB2 ALA 441 HB2 ALA 441 4.910 -4.005 16.917
82 HB3 ALA 441 HB3 ALA 441 4.455 -5.487 16.075
83 H ASP 442 HN ASP 442 6.047 -5.192 12.916
84 HA ASP 442 HA ASP 442 8.615 -5.661 14.048
85 HB2 ASP 442 HB2 ASP 442 7.617 -7.068 12.261
86 HB3 ASP 442 HB1 ASP 442 7.759 -5.719 11.141
87 H GLY 443 HN GLY 443 7.122 -2.954 12.775
88 HA2 GLY 443 HA2 GLY 443 8.012 -0.789 12.897
89 HA3 GLY 443 HA1 GLY 443 9.630 -1.478 12.890
90 H LYS 444 HN LYS 444 7.154 -2.387 10.594
91 HA LYS 444 HA LYS 444 8.243 -0.615 8.564
92 HB2 LYS 444 HB2 LYS 444 8.753 -2.441 6.977
93 HB3 LYS 444 HB1 LYS 444 9.800 -2.450 8.385
94 HG2 LYS 444 HG2 LYS 444 8.728 -4.348 9.292
95 HG3 LYS 444 HG1 LYS 444 7.383 -4.223 8.153
96 HD2 LYS 444 HD2 LYS 444 8.994 -4.649 6.302
97 HD3 LYS 444 HD1 LYS 444 10.249 -4.914 7.513
98 HE2 LYS 444 HE2 LYS 444 7.725 -6.465 7.749
99 HE3 LYS 444 HE1 LYS 444 8.852 -6.911 6.471
100 HZ1 LYS 444 HZ1 LYS 444 9.676 -6.639 9.308
101 HZ2 LYS 444 HZ2 LYS 444 10.525 -7.373 8.035
102 HZ3 LYS 444 HZ3 LYS 444 9.119 -8.100 8.645
103 H THR 445 HN THR 445 6.792 -0.094 7.013
104 HA THR 445 HA THR 445 4.143 -1.328 7.259
105 HB THR 445 HB THR 445 4.744 1.171 5.696
106 HG1 THR 445 HG1 THR 445 5.560 1.562 7.772
107 HG21 THR 445 HG21 THR 445 2.423 1.713 6.261
108 HG22 THR 445 HG22 THR 445 2.292 0.218 7.187
109 HG23 THR 445 HG23 THR 445 2.524 0.158 5.439
110 H TYR 446 HN TYR 446 3.487 -2.734 5.745
111 HA TYR 446 HA TYR 446 4.682 -2.441 3.079
112 HB2 TYR 446 HB2 TYR 446 4.205 -4.842 2.692
113 HB3 TYR 446 HB1 TYR 446 5.361 -4.560 3.981
114 HD1 TYR 446 HD1 TYR 446 4.579 -4.821 6.379
115 HD2 TYR 446 HD2 TYR 446 2.244 -6.085 3.057
116 HE1 TYR 446 HE1 TYR 446 3.284 -6.302 7.852
117 HE2 TYR 446 HE2 TYR 446 0.942 -7.564 4.523
118 HH TYR 446 HH TYR 446 1.307 -8.747 6.723
119 H TYR 447 HN TYR 447 3.444 -1.668 1.643
120 HA TYR 447 HA TYR 447 0.557 -1.615 2.005
121 HB2 TYR 447 HB2 TYR 447 2.318 -0.337 -0.105
122 HB3 TYR 447 HB1 TYR 447 0.588 -0.076 0.072
123 HD1 TYR 447 HD2 TYR 447 3.829 0.368 1.879
124 HD2 TYR 447 HD1 TYR 447 -0.206 1.641 1.425
125 HE1 TYR 447 HE2 TYR 447 4.266 2.268 3.375
126 HE2 TYR 447 HE1 TYR 447 0.221 3.541 2.923
127 HH TYR 447 HH TYR 447 1.760 4.191 4.684
128 H TYR 448 HN TYR 448 -0.567 -3.287 1.237
129 HA TYR 448 HA TYR 448 0.546 -4.892 -0.923
130 HB2 TYR 448 HB2 TYR 448 -0.348 -6.083 1.005
131 HB3 TYR 448 HB1 TYR 448 -1.910 -5.300 0.797
132 HD1 TYR 448 HD1 TYR 448 0.494 -7.425 -1.113
133 HD2 TYR 448 HD2 TYR 448 -3.570 -6.448 -0.332
134 HE1 TYR 448 HE1 TYR 448 -0.222 -9.262 -2.580
135 HE2 TYR 448 HE2 TYR 448 -4.297 -8.282 -1.798
136 HH TYR 448 HH TYR 448 -3.502 -9.661 -3.572
137 H ASN 449 HN ASN 449 0.075 -4.474 -2.953
138 HA ASN 449 HA ASN 449 -2.462 -3.094 -3.526
139 HB2 ASN 449 HB2 ASN 449 -1.436 -2.214 -5.550
140 HB3 ASN 449 HB1 ASN 449 -0.510 -1.745 -4.138
141 HD21 ASN 449 HD21 ASN 449 0.416 -1.759 -6.813
142 HD22 ASN 449 HD22 ASN 449 1.705 -2.910 -6.930
143 H ASN 450 HN ASN 450 -3.883 -3.975 -4.865
144 HA ASN 450 HA ASN 450 -3.411 -6.571 -5.981
145 HB2 ASN 450 HB2 ASN 450 -5.655 -6.515 -6.765
146 HB3 ASN 450 HB1 ASN 450 -5.664 -5.741 -5.188
147 HD21 ASN 450 HD21 ASN 450 -4.580 -3.199 -6.201
148 HD22 ASN 450 HD22 ASN 450 -5.864 -2.457 -7.081
149 H ARG 451 HN ARG 451 -2.264 -3.672 -6.853
150 HA ARG 451 HA ARG 451 -2.679 -3.662 -9.656
151 HB2 ARG 451 HB2 ARG 451 -2.071 -1.624 -8.419
152 HB3 ARG 451 HB1 ARG 451 -0.495 -2.322 -8.073
153 HG2 ARG 451 HG2 ARG 451 0.000 -2.382 -10.473
154 HG3 ARG 451 HG1 ARG 451 -1.573 -1.657 -10.806
155 HD2 ARG 451 HD2 ARG 451 0.587 -0.386 -9.129
156 HD3 ARG 451 HD1 ARG 451 0.300 -0.031 -10.829
157 HE ARG 451 HE ARG 451 -2.107 0.366 -9.458
158 HH11 ARG 451 HH11 ARG 451 1.125 1.737 -9.590
159 HH12 ARG 451 HH12 ARG 451 0.611 3.337 -9.130
160 HH21 ARG 451 HH21 ARG 451 -2.803 2.473 -8.910
161 HH22 ARG 451 HH22 ARG 451 -1.632 3.754 -8.781
162 H THR 452 HN THR 452 0.128 -4.548 -7.658
163 HA THR 452 HA THR 452 1.002 -6.272 -9.872
164 HB THR 452 HB THR 452 3.269 -6.154 -8.605
165 HG1 THR 452 HG1 THR 452 3.530 -4.398 -7.298
166 HG21 THR 452 HG21 THR 452 2.876 -5.210 -10.830
167 HG22 THR 452 HG22 THR 452 3.891 -4.141 -9.862
168 HG23 THR 452 HG23 THR 452 2.186 -3.761 -10.098
169 H LEU 453 HN LEU 453 -0.599 -6.529 -7.036
170 HA LEU 453 HA LEU 453 -0.996 -8.158 -5.512
171 HB2 LEU 453 HB2 LEU 453 0.495 -9.773 -7.569
172 HB3 LEU 453 HB1 LEU 453 -0.038 -10.491 -6.064
173 HG LEU 453 HG LEU 453 -2.386 -9.821 -6.675
174 HD11 LEU 453 HD11 LEU 453 -1.869 -8.076 -8.292
175 HD12 LEU 453 HD12 LEU 453 -2.857 -9.342 -9.023
176 HD13 LEU 453 HD13 LEU 453 -1.127 -9.272 -9.358
177 HD21 LEU 453 HD21 LEU 453 -2.666 -11.661 -8.274
178 HD22 LEU 453 HD22 LEU 453 -1.592 -12.095 -6.944
179 HD23 LEU 453 HD23 LEU 453 -0.920 -11.694 -8.525
180 H GLU 454 HN GLU 454 1.119 -6.377 -5.173
181 HA GLU 454 HA GLU 454 3.272 -7.993 -3.970
182 HB2 GLU 454 HB2 GLU 454 3.984 -6.707 -5.941
183 HB3 GLU 454 HB1 GLU 454 3.395 -5.228 -5.197
184 HG2 GLU 454 HG2 GLU 454 5.761 -5.300 -4.953
185 HG3 GLU 454 HG1 GLU 454 5.037 -5.562 -3.367
186 H SER 455 HN SER 455 3.961 -7.482 -1.927
187 HA SER 455 HA SER 455 2.586 -5.275 -0.566
188 HB2 SER 455 HB2 SER 455 3.702 -6.455 1.501
189 HB3 SER 455 HB1 SER 455 2.243 -7.142 0.788
190 HG SER 455 HG SER 455 4.908 -7.943 0.173
191 H THR 456 HN THR 456 3.784 -3.526 -1.175
192 HA THR 456 HA THR 456 6.699 -3.754 -1.125
193 HB THR 456 HB THR 456 5.695 -2.825 -3.164
194 HG1 THR 456 HG1 THR 456 7.675 -1.993 -2.931
195 HG21 THR 456 HG21 THR 456 4.649 -0.600 -3.146
196 HG22 THR 456 HG22 THR 456 4.730 -0.579 -1.384
197 HG23 THR 456 HG23 THR 456 3.715 -1.764 -2.207
198 H PHE 457 HN PHE 457 8.010 -2.473 0.127
199 HA PHE 457 HA PHE 457 6.714 -1.367 2.488
200 HB2 PHE 457 HB2 PHE 457 9.650 -1.829 1.912
201 HB3 PHE 457 HB1 PHE 457 8.963 -1.368 3.467
202 HD1 PHE 457 HD1 PHE 457 7.418 -2.974 4.633
203 HD2 PHE 457 HD2 PHE 457 9.737 -4.076 1.238
204 HE1 PHE 457 HE1 PHE 457 7.108 -5.348 5.196
205 HE2 PHE 457 HE2 PHE 457 9.432 -6.452 1.799
206 HZ PHE 457 HZ PHE 457 8.114 -7.091 3.777
207 H GLU 458 HN GLU 458 7.241 -0.173 -0.391
208 HA GLU 458 HA GLU 458 8.349 2.391 0.491
209 HB2 GLU 458 HB2 GLU 458 7.970 1.160 -2.232
210 HB3 GLU 458 HB1 GLU 458 8.337 2.868 -2.021
211 HG2 GLU 458 HG2 GLU 458 10.029 0.525 -1.189
212 HG3 GLU 458 HG1 GLU 458 10.368 1.694 -2.466
213 H LYS 459 HN LYS 459 7.168 4.200 0.536
214 HA LYS 459 HA LYS 459 4.331 4.004 0.495
215 HB2 LYS 459 HB2 LYS 459 6.207 6.347 0.794
216 HB3 LYS 459 HB1 LYS 459 4.458 6.496 0.878
217 HG2 LYS 459 HG2 LYS 459 4.371 5.064 2.803
218 HG3 LYS 459 HG1 LYS 459 6.099 4.732 2.678
219 HD2 LYS 459 HD2 LYS 459 6.640 7.001 3.206
220 HD3 LYS 459 HD1 LYS 459 4.944 7.482 3.107
221 HE2 LYS 459 HE2 LYS 459 6.051 5.512 5.101
222 HE3 LYS 459 HE1 LYS 459 5.785 7.224 5.431
223 HZ1 LYS 459 HZ1 LYS 459 3.693 5.250 4.674
224 HZ2 LYS 459 HZ2 LYS 459 3.428 6.901 4.952
225 HZ3 LYS 459 HZ3 LYS 459 3.940 5.900 6.224
226 HA PRO 460 HA PRO 460 3.858 4.792 -3.929
227 HB2 PRO 460 HB2 PRO 460 1.020 4.981 -3.141
228 HB3 PRO 460 HB1 PRO 460 1.783 3.931 -4.338
229 HG2 PRO 460 HG2 PRO 460 0.893 2.963 -2.011
230 HG3 PRO 460 HG1 PRO 460 2.373 2.343 -2.767
231 HD2 PRO 460 HD2 PRO 460 2.066 4.243 -0.473
232 HD3 PRO 460 HD1 PRO 460 3.225 2.914 -0.700
233 H GLN 461 HN GLN 461 3.739 6.668 -5.036
234 HA GLN 461 HA GLN 461 3.355 9.096 -3.513
235 HB2 GLN 461 HB2 GLN 461 4.124 8.683 -6.405
236 HB3 GLN 461 HB1 GLN 461 4.090 10.239 -5.585
237 HG2 GLN 461 HG2 GLN 461 5.824 9.480 -4.053
238 HG3 GLN 461 HG1 GLN 461 5.842 7.903 -4.844
239 HE21 GLN 461 HE21 GLN 461 7.994 8.085 -5.415
240 HE22 GLN 461 HE22 GLN 461 8.535 9.142 -6.677
241 H GLU 462 HN GLU 462 1.519 7.147 -5.666
242 HA GLU 462 HA GLU 462 -0.274 9.272 -6.462
243 HB2 GLU 462 HB2 GLU 462 -1.639 7.403 -7.439
244 HB3 GLU 462 HB1 GLU 462 -0.003 7.530 -8.064
245 HG2 GLU 462 HG2 GLU 462 -0.498 5.682 -5.797
246 HG3 GLU 462 HG1 GLU 462 -1.070 5.218 -7.399
247 H LEU 463 HN LEU 463 0.160 7.700 -3.625
248 HA LEU 463 HA LEU 463 -2.592 7.237 -2.934
249 HB2 LEU 463 HB2 LEU 463 -0.756 5.947 -1.902
250 HB3 LEU 463 HB1 LEU 463 -0.156 7.415 -1.154
251 HG LEU 463 HG LEU 463 -2.210 7.587 0.179
252 HD11 LEU 463 HD11 LEU 463 -2.946 4.968 -1.126
253 HD12 LEU 463 HD12 LEU 463 -3.755 6.517 -1.369
254 HD13 LEU 463 HD13 LEU 463 -3.806 5.734 0.210
255 HD21 LEU 463 HD21 LEU 463 -1.786 5.694 1.648
256 HD22 LEU 463 HD22 LEU 463 -0.270 6.380 1.058
257 HD23 LEU 463 HD23 LEU 463 -0.892 4.882 0.361
258 H LYS 464 HN LYS 464 -3.869 8.947 -2.911
259 HA LYS 464 HA LYS 464 -2.921 11.490 -1.865
260 HB2 LYS 464 HB2 LYS 464 -5.098 12.364 -2.715
261 HB3 LYS 464 HB1 LYS 464 -4.092 11.636 -3.959
262 HG2 LYS 464 HG2 LYS 464 -5.442 9.650 -3.968
263 HG3 LYS 464 HG1 LYS 464 -6.381 10.234 -2.594
264 HD2 LYS 464 HD2 LYS 464 -7.619 10.551 -4.660
265 HD3 LYS 464 HD1 LYS 464 -7.186 12.112 -3.964
266 HE2 LYS 464 HE2 LYS 464 -5.321 12.299 -5.524
267 HE3 LYS 464 HE1 LYS 464 -5.720 10.721 -6.201
268 HZ1 LYS 464 HZ1 LYS 464 -6.582 12.513 -7.568
269 HZ2 LYS 464 HZ2 LYS 464 -7.472 13.123 -6.260
270 HZ3 LYS 464 HZ3 LYS 464 -7.855 11.601 -6.912
Start of MODEL 12
1 H ALA 431 HN ALA 431 -13.439 5.855 -2.563
2 HA ALA 431 HA ALA 431 -10.846 7.105 -3.188
3 HB1 ALA 431 HB1 ALA 431 -10.024 6.326 -1.030
4 HB2 ALA 431 HB2 ALA 431 -11.601 5.621 -0.673
5 HB3 ALA 431 HB3 ALA 431 -11.431 7.369 -0.825
6 H VAL 432 HN VAL 432 -9.270 5.825 -3.997
7 HA VAL 432 HA VAL 432 -10.050 3.063 -4.618
8 HB VAL 432 HB VAL 432 -7.735 4.672 -5.719
9 HG11 VAL 432 HG11 VAL 432 -8.967 2.085 -6.666
10 HG12 VAL 432 HG12 VAL 432 -7.410 2.251 -5.854
11 HG13 VAL 432 HG13 VAL 432 -7.651 2.955 -7.453
12 HG21 VAL 432 HG21 VAL 432 -10.446 4.137 -6.931
13 HG22 VAL 432 HG22 VAL 432 -9.104 4.959 -7.729
14 HG23 VAL 432 HG23 VAL 432 -9.872 5.690 -6.320
15 H SER 433 HN SER 433 -9.339 1.519 -3.332
16 HA SER 433 HA SER 433 -7.141 2.047 -1.491
17 HB2 SER 433 HB2 SER 433 -8.922 -0.392 -1.689
18 HB3 SER 433 HB1 SER 433 -7.943 0.104 -0.307
19 HG SER 433 HG SER 433 -9.386 2.152 -0.659
20 H GLU 434 HN GLU 434 -6.370 1.773 -4.200
21 HA GLU 434 HA GLU 434 -5.609 -0.855 -4.887
22 HB2 GLU 434 HB2 GLU 434 -4.136 0.226 -6.562
23 HB3 GLU 434 HB1 GLU 434 -5.791 0.822 -6.597
24 HG2 GLU 434 HG2 GLU 434 -5.123 2.814 -5.385
25 HG3 GLU 434 HG1 GLU 434 -3.469 2.211 -5.272
26 H TRP 435 HN TRP 435 -4.172 1.490 -2.794
27 HA TRP 435 HA TRP 435 -1.964 -0.405 -2.316
28 HB2 TRP 435 HB2 TRP 435 -1.886 2.539 -1.619
29 HB3 TRP 435 HB1 TRP 435 -0.553 1.393 -1.583
30 HD1 TRP 435 HD1 TRP 435 -2.292 3.830 -3.819
31 HE1 TRP 435 HE1 TRP 435 -1.215 3.842 -6.131
32 HE3 TRP 435 HE3 TRP 435 0.716 -0.266 -3.334
33 HZ2 TRP 435 HZ2 TRP 435 0.643 2.354 -7.565
34 HZ3 TRP 435 HZ3 TRP 435 2.100 -0.921 -5.273
35 HH2 TRP 435 HH2 TRP 435 2.080 0.373 -7.335
36 H THR 436 HN THR 436 -2.635 -1.594 -0.611
37 HA THR 436 HA THR 436 -4.149 -0.255 1.510
38 HB THR 436 HB THR 436 -3.601 -3.214 1.333
39 HG1 THR 436 HG1 THR 436 -4.957 -1.747 -0.433
40 HG21 THR 436 HG21 THR 436 -5.823 -1.584 2.570
41 HG22 THR 436 HG22 THR 436 -4.518 -2.386 3.441
42 HG23 THR 436 HG23 THR 436 -5.722 -3.344 2.579
43 H GLU 437 HN GLU 437 -3.285 0.171 3.467
44 HA GLU 437 HA GLU 437 -0.436 -0.325 3.750
45 HB2 GLU 437 HB2 GLU 437 -1.298 1.949 4.080
46 HB3 GLU 437 HB1 GLU 437 -2.325 1.374 5.385
47 HG2 GLU 437 HG2 GLU 437 -0.243 0.683 6.599
48 HG3 GLU 437 HG1 GLU 437 0.677 1.513 5.344
49 H TYR 438 HN TYR 438 0.033 -2.259 4.594
50 HA TYR 438 HA TYR 438 -1.342 -3.030 7.076
51 HB2 TYR 438 HB2 TYR 438 0.217 -4.718 5.104
52 HB3 TYR 438 HB1 TYR 438 -0.408 -5.310 6.639
53 HD1 TYR 438 HD2 TYR 438 -2.987 -4.911 7.005
54 HD2 TYR 438 HD1 TYR 438 -1.083 -5.011 3.199
55 HE1 TYR 438 HE2 TYR 438 -5.142 -5.437 5.951
56 HE2 TYR 438 HE1 TYR 438 -3.240 -5.533 2.132
57 HH TYR 438 HH TYR 438 -5.414 -6.552 2.765
58 H LYS 439 HN LYS 439 -0.245 -2.796 8.885
59 HA LYS 439 HA LYS 439 2.664 -2.427 8.693
60 HB2 LYS 439 HB2 LYS 439 2.250 -0.868 10.743
61 HB3 LYS 439 HB1 LYS 439 1.963 -0.267 9.119
62 HG2 LYS 439 HG2 LYS 439 -0.445 -0.772 9.404
63 HG3 LYS 439 HG1 LYS 439 -0.110 -1.245 11.071
64 HD2 LYS 439 HD2 LYS 439 0.607 0.966 11.628
65 HD3 LYS 439 HD1 LYS 439 0.555 1.468 9.938
66 HE2 LYS 439 HE2 LYS 439 -1.825 0.622 11.584
67 HE3 LYS 439 HE1 LYS 439 -1.377 2.286 11.223
68 HZ1 LYS 439 HZ1 LYS 439 -2.100 0.234 9.208
69 HZ2 LYS 439 HZ2 LYS 439 -1.706 1.845 8.874
70 HZ3 LYS 439 HZ3 LYS 439 -3.118 1.474 9.745
71 H THR 440 HN THR 440 3.763 -3.854 9.747
72 HA THR 440 HA THR 440 2.509 -5.476 11.810
73 HB THR 440 HB THR 440 3.770 -6.683 10.128
74 HG1 THR 440 HG1 THR 440 4.908 -7.942 11.513
75 HG21 THR 440 HG21 THR 440 5.319 -4.835 9.539
76 HG22 THR 440 HG22 THR 440 6.137 -6.381 9.765
77 HG23 THR 440 HG23 THR 440 6.208 -5.149 11.028
78 H ALA 441 HN ALA 441 3.428 -5.758 13.887
79 HA ALA 441 HA ALA 441 4.126 -3.315 15.113
80 HB1 ALA 441 HB1 ALA 441 4.246 -6.098 16.250
81 HB2 ALA 441 HB2 ALA 441 2.831 -5.046 16.237
82 HB3 ALA 441 HB3 ALA 441 4.256 -4.593 17.171
83 H ASP 442 HN ASP 442 6.096 -5.318 13.356
84 HA ASP 442 HA ASP 442 8.503 -5.019 14.903
85 HB2 ASP 442 HB2 ASP 442 8.184 -6.839 13.216
86 HB3 ASP 442 HB1 ASP 442 8.226 -5.617 11.948
87 H GLY 443 HN GLY 443 6.602 -2.922 13.166
88 HA2 GLY 443 HA2 GLY 443 6.987 -0.620 12.923
89 HA3 GLY 443 HA1 GLY 443 8.712 -0.910 13.126
90 H LYS 444 HN LYS 444 6.528 -2.578 10.939
91 HA LYS 444 HA LYS 444 8.013 -1.412 8.672
92 HB2 LYS 444 HB2 LYS 444 6.909 -4.215 8.683
93 HB3 LYS 444 HB1 LYS 444 8.060 -3.504 7.561
94 HG2 LYS 444 HG2 LYS 444 9.747 -3.447 9.324
95 HG3 LYS 444 HG1 LYS 444 8.588 -4.147 10.454
96 HD2 LYS 444 HD2 LYS 444 9.880 -5.965 9.721
97 HD3 LYS 444 HD1 LYS 444 8.383 -6.070 8.792
98 HE2 LYS 444 HE2 LYS 444 10.120 -6.444 7.245
99 HE3 LYS 444 HE1 LYS 444 9.579 -4.791 6.968
100 HZ1 LYS 444 HZ1 LYS 444 11.452 -4.031 8.365
101 HZ2 LYS 444 HZ2 LYS 444 11.960 -4.852 6.970
102 HZ3 LYS 444 HZ3 LYS 444 11.999 -5.634 8.475
103 H THR 445 HN THR 445 6.683 -0.229 7.474
104 HA THR 445 HA THR 445 3.849 -0.935 7.321
105 HB THR 445 HB THR 445 3.874 1.317 5.955
106 HG1 THR 445 HG1 THR 445 5.791 2.207 5.915
107 HG21 THR 445 HG21 THR 445 3.565 2.572 8.047
108 HG22 THR 445 HG22 THR 445 4.241 1.215 8.951
109 HG23 THR 445 HG23 THR 445 2.722 1.023 8.078
110 H TYR 446 HN TYR 446 3.510 -2.458 5.787
111 HA TYR 446 HA TYR 446 4.809 -2.029 3.187
112 HB2 TYR 446 HB2 TYR 446 4.390 -4.500 2.796
113 HB3 TYR 446 HB1 TYR 446 5.618 -4.099 3.985
114 HD1 TYR 446 HD1 TYR 446 5.106 -4.385 6.419
115 HD2 TYR 446 HD2 TYR 446 2.468 -5.768 3.381
116 HE1 TYR 446 HE1 TYR 446 4.007 -5.856 8.050
117 HE2 TYR 446 HE2 TYR 446 1.358 -7.237 5.009
118 HH TYR 446 HH TYR 446 1.882 -8.330 7.167
119 H TYR 447 HN TYR 447 3.591 -1.408 1.625
120 HA TYR 447 HA TYR 447 0.696 -1.505 1.887
121 HB2 TYR 447 HB2 TYR 447 2.509 -0.124 -0.108
122 HB3 TYR 447 HB1 TYR 447 0.751 -0.022 -0.130
123 HD1 TYR 447 HD2 TYR 447 3.720 0.714 2.000
124 HD2 TYR 447 HD1 TYR 447 -0.353 1.607 1.138
125 HE1 TYR 447 HE2 TYR 447 3.813 2.615 3.555
126 HE2 TYR 447 HE1 TYR 447 -0.265 3.515 2.685
127 HH TYR 447 HH TYR 447 1.123 4.149 4.743
128 H TYR 448 HN TYR 448 -0.366 -3.147 1.098
129 HA TYR 448 HA TYR 448 0.816 -4.819 -0.977
130 HB2 TYR 448 HB2 TYR 448 -0.147 -5.937 0.972
131 HB3 TYR 448 HB1 TYR 448 -1.694 -5.150 0.682
132 HD1 TYR 448 HD1 TYR 448 0.737 -7.494 -0.900
133 HD2 TYR 448 HD2 TYR 448 -3.308 -6.210 -0.622
134 HE1 TYR 448 HE1 TYR 448 0.046 -9.388 -2.308
135 HE2 TYR 448 HE2 TYR 448 -4.015 -8.100 -2.028
136 HH TYR 448 HH TYR 448 -1.963 -10.725 -2.744
137 H ASN 449 HN ASN 449 0.287 -4.613 -3.056
138 HA ASN 449 HA ASN 449 -2.224 -3.200 -3.669
139 HB2 ASN 449 HB2 ASN 449 -1.226 -2.303 -5.656
140 HB3 ASN 449 HB1 ASN 449 -0.178 -1.943 -4.303
141 HD21 ASN 449 HD21 ASN 449 0.561 -1.908 -7.026
142 HD22 ASN 449 HD22 ASN 449 1.796 -3.094 -7.247
143 H ASN 450 HN ASN 450 -3.638 -4.100 -5.001
144 HA ASN 450 HA ASN 450 -3.241 -6.769 -5.977
145 HB2 ASN 450 HB2 ASN 450 -5.474 -6.492 -6.994
146 HB3 ASN 450 HB1 ASN 450 -5.476 -6.028 -5.295
147 HD21 ASN 450 HD21 ASN 450 -5.864 -3.920 -4.730
148 HD22 ASN 450 HD22 ASN 450 -6.376 -2.719 -5.871
149 H ARG 451 HN ARG 451 -2.172 -3.825 -6.985
150 HA ARG 451 HA ARG 451 -2.542 -3.954 -9.768
151 HB2 ARG 451 HB2 ARG 451 -0.535 -2.481 -8.090
152 HB3 ARG 451 HB1 ARG 451 -0.601 -2.335 -9.842
153 HG2 ARG 451 HG2 ARG 451 -2.915 -1.536 -9.676
154 HG3 ARG 451 HG1 ARG 451 -2.818 -1.650 -7.918
155 HD2 ARG 451 HD2 ARG 451 -2.475 0.639 -8.666
156 HD3 ARG 451 HD1 ARG 451 -1.018 0.000 -7.908
157 HE ARG 451 HE ARG 451 -0.502 -0.489 -10.477
158 HH11 ARG 451 HH11 ARG 451 -1.860 2.389 -8.968
159 HH12 ARG 451 HH12 ARG 451 -1.104 3.471 -10.104
160 HH21 ARG 451 HH21 ARG 451 0.509 0.956 -11.937
161 HH22 ARG 451 HH22 ARG 451 0.233 2.662 -11.778
162 H THR 452 HN THR 452 0.380 -4.700 -7.836
163 HA THR 452 HA THR 452 1.079 -6.619 -9.958
164 HB THR 452 HB THR 452 2.741 -4.827 -9.648
165 HG1 THR 452 HG1 THR 452 4.302 -6.850 -8.733
166 HG21 THR 452 HG21 THR 452 3.128 -6.005 -6.897
167 HG22 THR 452 HG22 THR 452 2.448 -4.418 -7.258
168 HG23 THR 452 HG23 THR 452 4.135 -4.764 -7.642
169 H LEU 453 HN LEU 453 -0.341 -6.599 -7.008
170 HA LEU 453 HA LEU 453 -0.859 -8.183 -5.486
171 HB2 LEU 453 HB2 LEU 453 0.550 -9.945 -7.483
172 HB3 LEU 453 HB1 LEU 453 -0.131 -10.576 -5.998
173 HG LEU 453 HG LEU 453 -2.364 -9.609 -6.780
174 HD11 LEU 453 HD11 LEU 453 -1.538 -8.107 -8.501
175 HD12 LEU 453 HD12 LEU 453 -2.622 -9.314 -9.196
176 HD13 LEU 453 HD13 LEU 453 -0.879 -9.476 -9.399
177 HD21 LEU 453 HD21 LEU 453 -2.840 -11.542 -8.170
178 HD22 LEU 453 HD22 LEU 453 -1.824 -11.996 -6.802
179 HD23 LEU 453 HD23 LEU 453 -1.115 -11.817 -8.406
180 H GLU 454 HN GLU 454 1.356 -6.553 -5.021
181 HA GLU 454 HA GLU 454 3.101 -8.338 -3.473
182 HB2 GLU 454 HB2 GLU 454 4.114 -6.255 -5.417
183 HB3 GLU 454 HB1 GLU 454 5.116 -7.118 -4.257
184 HG2 GLU 454 HG2 GLU 454 4.570 -9.232 -5.344
185 HG3 GLU 454 HG1 GLU 454 3.548 -8.379 -6.498
186 H SER 455 HN SER 455 4.134 -7.369 -1.696
187 HA SER 455 HA SER 455 2.920 -4.827 -0.873
188 HB2 SER 455 HB2 SER 455 4.323 -6.911 0.818
189 HB3 SER 455 HB1 SER 455 3.449 -5.498 1.412
190 HG SER 455 HG SER 455 1.772 -6.725 -0.150
191 H THR 456 HN THR 456 4.132 -3.054 -0.989
192 HA THR 456 HA THR 456 7.061 -3.354 -0.820
193 HB THR 456 HB THR 456 6.335 -2.580 -3.035
194 HG1 THR 456 HG1 THR 456 7.808 -0.936 -3.142
195 HG21 THR 456 HG21 THR 456 4.255 -1.453 -2.375
196 HG22 THR 456 HG22 THR 456 5.292 -0.396 -3.334
197 HG23 THR 456 HG23 THR 456 5.196 -0.188 -1.584
198 H PHE 457 HN PHE 457 8.224 -1.796 0.412
199 HA PHE 457 HA PHE 457 6.634 -0.863 2.663
200 HB2 PHE 457 HB2 PHE 457 9.627 -1.044 2.279
201 HB3 PHE 457 HB1 PHE 457 8.843 -0.513 3.763
202 HD1 PHE 457 HD2 PHE 457 9.497 -3.376 1.564
203 HD2 PHE 457 HD1 PHE 457 7.804 -2.090 5.250
204 HE1 PHE 457 HE2 PHE 457 9.362 -5.714 2.312
205 HE2 PHE 457 HE1 PHE 457 7.672 -4.430 6.008
206 HZ PHE 457 HZ PHE 457 8.450 -6.244 4.537
207 H GLU 458 HN GLU 458 7.497 0.462 -0.183
208 HA GLU 458 HA GLU 458 8.014 3.135 0.918
209 HB2 GLU 458 HB2 GLU 458 8.644 3.775 -1.349
210 HB3 GLU 458 HB1 GLU 458 9.544 2.351 -0.850
211 HG2 GLU 458 HG2 GLU 458 7.984 0.944 -2.122
212 HG3 GLU 458 HG1 GLU 458 7.135 2.394 -2.656
213 H LYS 459 HN LYS 459 6.725 4.921 0.268
214 HA LYS 459 HA LYS 459 3.943 4.159 -0.136
215 HB2 LYS 459 HB2 LYS 459 5.158 6.843 0.522
216 HB3 LYS 459 HB1 LYS 459 3.436 6.484 0.479
217 HG2 LYS 459 HG2 LYS 459 3.742 4.863 2.297
218 HG3 LYS 459 HG1 LYS 459 5.457 5.278 2.359
219 HD2 LYS 459 HD2 LYS 459 4.871 7.593 2.903
220 HD3 LYS 459 HD1 LYS 459 3.158 7.172 2.844
221 HE2 LYS 459 HE2 LYS 459 3.488 5.587 4.680
222 HE3 LYS 459 HE1 LYS 459 5.198 6.015 4.740
223 HZ1 LYS 459 HZ1 LYS 459 4.017 7.212 6.425
224 HZ2 LYS 459 HZ2 LYS 459 2.910 7.821 5.299
225 HZ3 LYS 459 HZ3 LYS 459 4.530 8.310 5.241
226 HA PRO 460 HA PRO 460 4.353 5.535 -4.445
227 HB2 PRO 460 HB2 PRO 460 1.875 4.116 -4.917
228 HB3 PRO 460 HB1 PRO 460 3.490 3.737 -5.518
229 HG2 PRO 460 HG2 PRO 460 2.154 2.194 -3.710
230 HG3 PRO 460 HG1 PRO 460 3.921 2.284 -3.809
231 HD2 PRO 460 HD2 PRO 460 2.059 3.669 -1.913
232 HD3 PRO 460 HD1 PRO 460 3.626 2.892 -1.596
233 H GLN 461 HN GLN 461 3.379 7.231 -5.459
234 HA GLN 461 HA GLN 461 1.508 8.764 -3.894
235 HB2 GLN 461 HB2 GLN 461 2.819 9.313 -6.556
236 HB3 GLN 461 HB1 GLN 461 1.798 10.458 -5.700
237 HG2 GLN 461 HG2 GLN 461 3.410 10.353 -3.798
238 HG3 GLN 461 HG1 GLN 461 4.460 9.373 -4.821
239 HE21 GLN 461 HE21 GLN 461 6.098 10.909 -4.810
240 HE22 GLN 461 HE22 GLN 461 5.981 12.388 -5.704
241 H GLU 462 HN GLU 462 0.861 6.249 -5.766
242 HA GLU 462 HA GLU 462 -1.168 7.398 -7.485
243 HB2 GLU 462 HB2 GLU 462 -0.533 4.496 -6.934
244 HB3 GLU 462 HB1 GLU 462 -1.566 5.104 -8.221
245 HG2 GLU 462 HG2 GLU 462 1.370 5.634 -7.916
246 HG3 GLU 462 HG1 GLU 462 0.633 4.493 -9.045
247 H LEU 463 HN LEU 463 -0.988 6.526 -4.298
248 HA LEU 463 HA LEU 463 -3.513 5.265 -3.940
249 HB2 LEU 463 HB2 LEU 463 -1.446 5.203 -2.441
250 HB3 LEU 463 HB1 LEU 463 -1.951 6.779 -1.854
251 HG LEU 463 HG LEU 463 -3.662 4.294 -1.661
252 HD11 LEU 463 HD11 LEU 463 -1.609 3.997 -0.391
253 HD12 LEU 463 HD12 LEU 463 -2.994 4.201 0.680
254 HD13 LEU 463 HD13 LEU 463 -1.877 5.540 0.420
255 HD21 LEU 463 HD21 LEU 463 -3.861 6.975 -0.286
256 HD22 LEU 463 HD22 LEU 463 -4.898 5.580 0.014
257 HD23 LEU 463 HD23 LEU 463 -4.926 6.376 -1.559
258 H LYS 464 HN LYS 464 -5.394 6.219 -4.235
259 HA LYS 464 HA LYS 464 -5.683 9.044 -3.517
260 HB2 LYS 464 HB2 LYS 464 -7.177 9.298 -5.519
261 HB3 LYS 464 HB1 LYS 464 -5.486 9.018 -5.906
262 HG2 LYS 464 HG2 LYS 464 -6.018 6.631 -6.312
263 HG3 LYS 464 HG1 LYS 464 -7.723 7.000 -6.041
264 HD2 LYS 464 HD2 LYS 464 -7.488 7.062 -8.366
265 HD3 LYS 464 HD1 LYS 464 -7.426 8.760 -7.886
266 HE2 LYS 464 HE2 LYS 464 -5.700 8.342 -9.507
267 HE3 LYS 464 HE1 LYS 464 -4.950 8.638 -7.941
268 HZ1 LYS 464 HZ1 LYS 464 -4.504 6.346 -7.667
269 HZ2 LYS 464 HZ2 LYS 464 -4.023 6.721 -9.250
270 HZ3 LYS 464 HZ3 LYS 464 -5.487 5.911 -8.978
Start of MODEL 13
1 H ALA 431 HN ALA 431 -15.611 -0.150 -1.203
2 HA ALA 431 HA ALA 431 -14.274 2.254 -2.025
3 HB1 ALA 431 HB1 ALA 431 -13.068 2.063 0.090
4 HB2 ALA 431 HB2 ALA 431 -13.735 0.449 0.333
5 HB3 ALA 431 HB3 ALA 431 -14.803 1.854 0.331
6 H VAL 432 HN VAL 432 -13.012 1.946 -3.776
7 HA VAL 432 HA VAL 432 -11.270 -0.388 -3.920
8 HB VAL 432 HB VAL 432 -11.713 1.820 -5.940
9 HG11 VAL 432 HG11 VAL 432 -10.326 -0.845 -6.214
10 HG12 VAL 432 HG12 VAL 432 -9.552 0.738 -6.227
11 HG13 VAL 432 HG13 VAL 432 -10.648 0.284 -7.531
12 HG21 VAL 432 HG21 VAL 432 -12.861 -0.968 -5.821
13 HG22 VAL 432 HG22 VAL 432 -13.083 0.184 -7.137
14 HG23 VAL 432 HG23 VAL 432 -13.745 0.533 -5.541
15 H SER 433 HN SER 433 -9.323 -0.286 -3.072
16 HA SER 433 HA SER 433 -7.856 2.261 -3.179
17 HB2 SER 433 HB2 SER 433 -7.562 0.070 -1.107
18 HB3 SER 433 HB1 SER 433 -6.736 1.629 -1.112
19 HG SER 433 HG SER 433 -9.263 2.211 -1.278
20 H GLU 434 HN GLU 434 -6.177 2.194 -4.511
21 HA GLU 434 HA GLU 434 -5.329 -0.254 -5.724
22 HB2 GLU 434 HB2 GLU 434 -4.242 2.559 -5.880
23 HB3 GLU 434 HB1 GLU 434 -3.618 1.218 -6.831
24 HG2 GLU 434 HG2 GLU 434 -6.486 2.105 -6.912
25 HG3 GLU 434 HG1 GLU 434 -5.244 2.724 -8.000
26 H TRP 435 HN TRP 435 -4.233 1.712 -3.094
27 HA TRP 435 HA TRP 435 -2.091 -0.237 -2.588
28 HB2 TRP 435 HB2 TRP 435 -1.867 2.686 -1.852
29 HB3 TRP 435 HB1 TRP 435 -0.597 1.469 -1.840
30 HD1 TRP 435 HD1 TRP 435 -2.246 4.017 -4.047
31 HE1 TRP 435 HE1 TRP 435 -1.117 4.056 -6.360
32 HE3 TRP 435 HE3 TRP 435 0.633 -0.162 -3.589
33 HZ2 TRP 435 HZ2 TRP 435 0.733 2.504 -7.794
34 HZ3 TRP 435 HZ3 TRP 435 2.021 -0.851 -5.513
35 HH2 TRP 435 HH2 TRP 435 2.089 0.472 -7.555
36 H THR 436 HN THR 436 -2.809 -1.371 -0.877
37 HA THR 436 HA THR 436 -4.477 -0.044 1.113
38 HB THR 436 HB THR 436 -4.735 -2.323 2.101
39 HG1 THR 436 HG1 THR 436 -3.325 -3.184 -0.227
40 HG21 THR 436 HG21 THR 436 -6.361 -1.484 0.483
41 HG22 THR 436 HG22 THR 436 -6.134 -3.223 0.302
42 HG23 THR 436 HG23 THR 436 -5.380 -2.112 -0.841
43 H GLU 437 HN GLU 437 -3.837 0.461 3.130
44 HA GLU 437 HA GLU 437 -0.975 0.259 3.634
45 HB2 GLU 437 HB2 GLU 437 -2.122 2.470 3.696
46 HB3 GLU 437 HB1 GLU 437 -3.075 1.907 5.058
47 HG2 GLU 437 HG2 GLU 437 -0.095 1.878 5.218
48 HG3 GLU 437 HG1 GLU 437 -0.977 3.386 5.441
49 H TYR 438 HN TYR 438 -0.416 -1.543 4.646
50 HA TYR 438 HA TYR 438 -1.821 -2.182 7.148
51 HB2 TYR 438 HB2 TYR 438 -0.676 -4.108 5.116
52 HB3 TYR 438 HB1 TYR 438 -1.137 -4.580 6.748
53 HD1 TYR 438 HD2 TYR 438 -3.586 -4.032 7.441
54 HD2 TYR 438 HD1 TYR 438 -2.254 -4.227 3.404
55 HE1 TYR 438 HE2 TYR 438 -5.904 -4.378 6.701
56 HE2 TYR 438 HE1 TYR 438 -4.571 -4.571 2.654
57 HH TYR 438 HH TYR 438 -7.255 -4.062 4.682
58 H LYS 439 HN LYS 439 -0.558 -1.916 8.850
59 HA LYS 439 HA LYS 439 2.348 -2.013 8.434
60 HB2 LYS 439 HB2 LYS 439 2.478 -0.271 10.244
61 HB3 LYS 439 HB1 LYS 439 1.744 0.271 8.743
62 HG2 LYS 439 HG2 LYS 439 -0.491 -0.183 9.797
63 HG3 LYS 439 HG1 LYS 439 0.366 -0.424 11.320
64 HD2 LYS 439 HD2 LYS 439 1.163 1.821 11.311
65 HD3 LYS 439 HD1 LYS 439 0.595 2.078 9.659
66 HE2 LYS 439 HE2 LYS 439 -1.132 1.574 12.080
67 HE3 LYS 439 HE1 LYS 439 -0.905 3.124 11.272
68 HZ1 LYS 439 HZ1 LYS 439 -2.965 2.114 10.573
69 HZ2 LYS 439 HZ2 LYS 439 -2.162 0.699 10.097
70 HZ3 LYS 439 HZ3 LYS 439 -1.889 2.146 9.259
71 H THR 440 HN THR 440 3.499 -3.294 9.674
72 HA THR 440 HA THR 440 2.195 -4.554 11.976
73 HB THR 440 HB THR 440 3.149 -6.127 10.373
74 HG1 THR 440 HG1 THR 440 4.840 -7.033 11.957
75 HG21 THR 440 HG21 THR 440 4.891 -4.722 9.402
76 HG22 THR 440 HG22 THR 440 5.576 -6.236 9.991
77 HG23 THR 440 HG23 THR 440 5.784 -4.753 10.922
78 H ALA 441 HN ALA 441 3.246 -4.646 13.991
79 HA ALA 441 HA ALA 441 4.398 -2.167 14.753
80 HB1 ALA 441 HB1 ALA 441 4.154 -4.706 16.357
81 HB2 ALA 441 HB2 ALA 441 2.908 -3.466 16.200
82 HB3 ALA 441 HB3 ALA 441 4.436 -3.085 16.996
83 H ASP 442 HN ASP 442 5.922 -4.441 13.100
84 HA ASP 442 HA ASP 442 8.408 -4.548 14.564
85 HB2 ASP 442 HB2 ASP 442 7.675 -6.387 13.049
86 HB3 ASP 442 HB1 ASP 442 7.825 -5.288 11.684
87 H GLY 443 HN GLY 443 6.818 -2.189 12.911
88 HA2 GLY 443 HA2 GLY 443 7.624 -0.013 12.568
89 HA3 GLY 443 HA1 GLY 443 9.269 -0.636 12.611
90 H LYS 444 HN LYS 444 6.767 -2.077 10.662
91 HA LYS 444 HA LYS 444 8.011 -0.955 8.243
92 HB2 LYS 444 HB2 LYS 444 7.480 -3.896 8.721
93 HB3 LYS 444 HB1 LYS 444 8.034 -3.196 7.206
94 HG2 LYS 444 HG2 LYS 444 10.102 -2.485 8.265
95 HG3 LYS 444 HG1 LYS 444 9.544 -3.123 9.812
96 HD2 LYS 444 HD2 LYS 444 11.042 -4.721 8.849
97 HD3 LYS 444 HD1 LYS 444 9.411 -5.379 8.747
98 HE2 LYS 444 HE2 LYS 444 9.281 -4.635 6.404
99 HE3 LYS 444 HE1 LYS 444 10.935 -4.032 6.519
100 HZ1 LYS 444 HZ1 LYS 444 10.085 -6.863 6.833
101 HZ2 LYS 444 HZ2 LYS 444 11.676 -6.296 6.982
102 HZ3 LYS 444 HZ3 LYS 444 10.880 -6.204 5.487
103 H THR 445 HN THR 445 6.530 -0.181 6.904
104 HA THR 445 HA THR 445 3.766 -1.118 7.149
105 HB THR 445 HB THR 445 4.649 1.323 5.621
106 HG1 THR 445 HG1 THR 445 4.296 0.948 8.402
107 HG21 THR 445 HG21 THR 445 2.358 2.060 6.088
108 HG22 THR 445 HG22 THR 445 2.055 0.569 6.979
109 HG23 THR 445 HG23 THR 445 2.364 0.512 5.244
110 H TYR 446 HN TYR 446 3.061 -2.514 5.652
111 HA TYR 446 HA TYR 446 4.416 -2.473 3.048
112 HB2 TYR 446 HB2 TYR 446 3.626 -4.847 2.797
113 HB3 TYR 446 HB1 TYR 446 4.831 -4.592 4.049
114 HD1 TYR 446 HD1 TYR 446 4.091 -4.577 6.461
115 HD2 TYR 446 HD2 TYR 446 1.523 -5.785 3.290
116 HE1 TYR 446 HE1 TYR 446 2.650 -5.740 8.079
117 HE2 TYR 446 HE2 TYR 446 0.070 -6.940 4.900
118 HH TYR 446 HH TYR 446 0.278 -6.481 8.237
119 H TYR 447 HN TYR 447 3.335 -1.607 1.515
120 HA TYR 447 HA TYR 447 0.441 -1.370 1.668
121 HB2 TYR 447 HB2 TYR 447 2.474 -0.199 -0.246
122 HB3 TYR 447 HB1 TYR 447 0.741 0.097 -0.337
123 HD1 TYR 447 HD2 TYR 447 3.757 0.636 1.774
124 HD2 TYR 447 HD1 TYR 447 -0.300 1.700 1.038
125 HE1 TYR 447 HE2 TYR 447 3.980 2.533 3.316
126 HE2 TYR 447 HE1 TYR 447 -0.086 3.597 2.583
127 HH TYR 447 HH TYR 447 1.341 4.249 4.516
128 H TYR 448 HN TYR 448 -0.720 -2.974 0.895
129 HA TYR 448 HA TYR 448 0.371 -4.719 -1.162
130 HB2 TYR 448 HB2 TYR 448 -0.628 -5.896 0.648
131 HB3 TYR 448 HB1 TYR 448 -2.064 -4.881 0.609
132 HD1 TYR 448 HD1 TYR 448 -0.193 -7.333 -1.512
133 HD2 TYR 448 HD2 TYR 448 -3.955 -5.642 -0.467
134 HE1 TYR 448 HE1 TYR 448 -1.330 -8.984 -2.942
135 HE2 TYR 448 HE2 TYR 448 -5.098 -7.281 -1.896
136 HH TYR 448 HH TYR 448 -4.661 -8.722 -3.766
137 H ASN 449 HN ASN 449 -0.010 -4.396 -3.219
138 HA ASN 449 HA ASN 449 -2.403 -2.862 -3.977
139 HB2 ASN 449 HB2 ASN 449 -1.247 -2.208 -6.001
140 HB3 ASN 449 HB1 ASN 449 -0.265 -1.801 -4.611
141 HD21 ASN 449 HD21 ASN 449 0.667 -2.039 -7.259
142 HD22 ASN 449 HD22 ASN 449 1.807 -3.346 -7.309
143 H ASN 450 HN ASN 450 -3.764 -3.608 -5.490
144 HA ASN 450 HA ASN 450 -3.589 -6.388 -6.257
145 HB2 ASN 450 HB2 ASN 450 -5.758 -5.912 -7.435
146 HB3 ASN 450 HB1 ASN 450 -5.790 -5.548 -5.713
147 HD21 ASN 450 HD21 ASN 450 -7.552 -4.143 -6.039
148 HD22 ASN 450 HD22 ASN 450 -7.335 -2.570 -6.725
149 H ARG 451 HN ARG 451 -2.188 -3.636 -7.322
150 HA ARG 451 HA ARG 451 -2.574 -3.807 -10.120
151 HB2 ARG 451 HB2 ARG 451 -1.882 -1.752 -8.850
152 HB3 ARG 451 HB1 ARG 451 -0.279 -2.463 -8.727
153 HG2 ARG 451 HG2 ARG 451 0.067 -2.346 -11.054
154 HG3 ARG 451 HG1 ARG 451 -1.642 -2.032 -11.367
155 HD2 ARG 451 HD2 ARG 451 0.252 -0.176 -9.925
156 HD3 ARG 451 HD1 ARG 451 -0.276 -0.008 -11.600
157 HE ARG 451 HE ARG 451 -2.600 -0.092 -10.178
158 HH11 ARG 451 HH11 ARG 451 0.268 1.902 -10.065
159 HH12 ARG 451 HH12 ARG 451 -0.561 3.289 -9.413
160 HH21 ARG 451 HH21 ARG 451 -3.708 1.730 -9.364
161 HH22 ARG 451 HH22 ARG 451 -2.813 3.188 -9.032
162 H THR 452 HN THR 452 0.408 -4.392 -8.244
163 HA THR 452 HA THR 452 1.143 -6.388 -10.261
164 HB THR 452 HB THR 452 3.419 -6.261 -9.101
165 HG1 THR 452 HG1 THR 452 3.702 -4.800 -7.578
166 HG21 THR 452 HG21 THR 452 2.349 -3.812 -10.509
167 HG22 THR 452 HG22 THR 452 2.985 -5.261 -11.287
168 HG23 THR 452 HG23 THR 452 4.052 -4.233 -10.329
169 H LEU 453 HN LEU 453 -0.404 -6.270 -7.415
170 HA LEU 453 HA LEU 453 -0.987 -7.748 -5.815
171 HB2 LEU 453 HB2 LEU 453 0.261 -9.724 -7.726
172 HB3 LEU 453 HB1 LEU 453 -0.658 -10.173 -6.302
173 HG LEU 453 HG LEU 453 -1.748 -8.625 -8.657
174 HD11 LEU 453 HD11 LEU 453 -1.262 -10.931 -9.242
175 HD12 LEU 453 HD12 LEU 453 -3.004 -10.679 -9.123
176 HD13 LEU 453 HD13 LEU 453 -2.139 -11.495 -7.820
177 HD21 LEU 453 HD21 LEU 453 -2.843 -8.050 -6.549
178 HD22 LEU 453 HD22 LEU 453 -3.126 -9.760 -6.224
179 HD23 LEU 453 HD23 LEU 453 -3.918 -8.979 -7.592
180 H GLU 454 HN GLU 454 0.932 -6.390 -4.875
181 HA GLU 454 HA GLU 454 2.625 -8.302 -3.486
182 HB2 GLU 454 HB2 GLU 454 4.722 -7.315 -4.037
183 HB3 GLU 454 HB1 GLU 454 3.895 -7.648 -5.550
184 HG2 GLU 454 HG2 GLU 454 3.260 -5.301 -5.727
185 HG3 GLU 454 HG1 GLU 454 4.076 -4.965 -4.200
186 H SER 455 HN SER 455 3.427 -7.562 -1.531
187 HA SER 455 HA SER 455 2.329 -5.020 -0.610
188 HB2 SER 455 HB2 SER 455 3.116 -5.895 1.653
189 HB3 SER 455 HB1 SER 455 1.811 -6.796 0.882
190 HG SER 455 HG SER 455 4.572 -7.467 0.801
191 H THR 456 HN THR 456 3.644 -3.409 -1.240
192 HA THR 456 HA THR 456 6.536 -3.780 -1.028
193 HB THR 456 HB THR 456 5.779 -2.867 -3.143
194 HG1 THR 456 HG1 THR 456 7.336 -1.384 -3.219
195 HG21 THR 456 HG21 THR 456 4.692 -0.681 -3.308
196 HG22 THR 456 HG22 THR 456 4.615 -0.577 -1.548
197 HG23 THR 456 HG23 THR 456 3.692 -1.816 -2.401
198 H PHE 457 HN PHE 457 7.777 -2.754 0.434
199 HA PHE 457 HA PHE 457 6.400 -1.453 2.624
200 HB2 PHE 457 HB2 PHE 457 9.288 -2.260 2.251
201 HB3 PHE 457 HB1 PHE 457 8.668 -1.486 3.706
202 HD1 PHE 457 HD2 PHE 457 8.695 -4.552 1.707
203 HD2 PHE 457 HD1 PHE 457 7.277 -2.690 5.261
204 HE1 PHE 457 HE2 PHE 457 8.073 -6.754 2.607
205 HE2 PHE 457 HE1 PHE 457 6.651 -4.890 6.167
206 HZ PHE 457 HZ PHE 457 7.050 -6.926 4.840
207 H GLU 458 HN GLU 458 7.552 -0.397 -0.230
208 HA GLU 458 HA GLU 458 8.621 2.125 0.792
209 HB2 GLU 458 HB2 GLU 458 8.486 0.985 -2.006
210 HB3 GLU 458 HB1 GLU 458 9.138 2.571 -1.615
211 HG2 GLU 458 HG2 GLU 458 10.198 -0.062 -0.605
212 HG3 GLU 458 HG1 GLU 458 10.900 0.907 -1.900
213 H LYS 459 HN LYS 459 7.414 3.881 0.913
214 HA LYS 459 HA LYS 459 4.644 3.830 0.535
215 HB2 LYS 459 HB2 LYS 459 6.521 6.172 0.839
216 HB3 LYS 459 HB1 LYS 459 4.770 6.285 0.936
217 HG2 LYS 459 HG2 LYS 459 4.736 4.878 2.883
218 HG3 LYS 459 HG1 LYS 459 6.470 4.590 2.748
219 HD2 LYS 459 HD2 LYS 459 6.167 6.223 4.448
220 HD3 LYS 459 HD1 LYS 459 6.804 7.064 3.036
221 HE2 LYS 459 HE2 LYS 459 3.862 6.923 3.629
222 HE3 LYS 459 HE1 LYS 459 4.894 8.175 4.313
223 HZ1 LYS 459 HZ1 LYS 459 4.321 7.681 1.441
224 HZ2 LYS 459 HZ2 LYS 459 5.525 8.746 1.979
225 HZ3 LYS 459 HZ3 LYS 459 3.897 9.040 2.362
226 HA PRO 460 HA PRO 460 4.488 4.524 -3.912
227 HB2 PRO 460 HB2 PRO 460 1.608 4.818 -3.328
228 HB3 PRO 460 HB1 PRO 460 2.421 3.720 -4.446
229 HG2 PRO 460 HG2 PRO 460 1.339 2.838 -2.161
230 HG3 PRO 460 HG1 PRO 460 2.837 2.146 -2.810
231 HD2 PRO 460 HD2 PRO 460 2.462 4.094 -0.571
232 HD3 PRO 460 HD1 PRO 460 3.594 2.730 -0.710
233 H GLN 461 HN GLN 461 4.872 6.429 -4.806
234 HA GLN 461 HA GLN 461 4.344 8.852 -3.376
235 HB2 GLN 461 HB2 GLN 461 6.384 8.407 -4.758
236 HB3 GLN 461 HB1 GLN 461 5.381 8.527 -6.197
237 HG2 GLN 461 HG2 GLN 461 6.589 10.585 -5.803
238 HG3 GLN 461 HG1 GLN 461 4.852 10.838 -5.651
239 HE21 GLN 461 HE21 GLN 461 6.797 9.291 -3.179
240 HE22 GLN 461 HE22 GLN 461 6.664 10.569 -2.013
241 H GLU 462 HN GLU 462 2.435 7.027 -5.429
242 HA GLU 462 HA GLU 462 0.933 9.365 -6.380
243 HB2 GLU 462 HB2 GLU 462 -0.216 7.763 -7.876
244 HB3 GLU 462 HB1 GLU 462 1.524 7.810 -8.130
245 HG2 GLU 462 HG2 GLU 462 1.830 5.738 -7.022
246 HG3 GLU 462 HG1 GLU 462 0.170 5.740 -6.425
247 H LEU 463 HN LEU 463 0.950 7.540 -3.728
248 HA LEU 463 HA LEU 463 -1.748 6.611 -3.630
249 HB2 LEU 463 HB2 LEU 463 -0.086 5.433 -2.377
250 HB3 LEU 463 HB1 LEU 463 0.367 6.885 -1.504
251 HG LEU 463 HG LEU 463 -1.821 6.897 -0.379
252 HD11 LEU 463 HD11 LEU 463 -3.117 5.793 -2.155
253 HD12 LEU 463 HD12 LEU 463 -3.338 5.020 -0.585
254 HD13 LEU 463 HD13 LEU 463 -2.291 4.275 -1.790
255 HD21 LEU 463 HD21 LEU 463 -1.444 4.958 1.042
256 HD22 LEU 463 HD22 LEU 463 0.081 5.755 0.645
257 HD23 LEU 463 HD23 LEU 463 -0.377 4.261 -0.179
258 H LYS 464 HN LYS 464 -3.303 8.030 -3.717
259 HA LYS 464 HA LYS 464 -3.881 9.595 -1.415
260 HB2 LYS 464 HB2 LYS 464 -2.380 11.111 -2.883
261 HB3 LYS 464 HB1 LYS 464 -3.742 11.170 -3.991
262 HG2 LYS 464 HG2 LYS 464 -3.904 11.990 -1.097
263 HG3 LYS 464 HG1 LYS 464 -3.574 13.106 -2.421
264 HD2 LYS 464 HD2 LYS 464 -5.718 12.766 -3.365
265 HD3 LYS 464 HD1 LYS 464 -6.022 11.355 -2.353
266 HE2 LYS 464 HE2 LYS 464 -7.298 13.157 -1.465
267 HE3 LYS 464 HE1 LYS 464 -5.952 12.869 -0.367
268 HZ1 LYS 464 HZ1 LYS 464 -6.207 15.200 -0.674
269 HZ2 LYS 464 HZ2 LYS 464 -6.195 15.057 -2.362
270 HZ3 LYS 464 HZ3 LYS 464 -4.788 14.739 -1.473
Start of MODEL 14
1 H ALA 431 HN ALA 431 -9.037 6.563 -4.612
2 HA ALA 431 HA ALA 431 -8.605 6.098 -7.426
3 HB1 ALA 431 HB1 ALA 431 -6.532 5.022 -6.696
4 HB2 ALA 431 HB2 ALA 431 -7.067 5.123 -5.018
5 HB3 ALA 431 HB3 ALA 431 -6.735 6.596 -5.928
6 H VAL 432 HN VAL 432 -8.351 3.984 -8.370
7 HA VAL 432 HA VAL 432 -10.435 2.201 -7.445
8 HB VAL 432 HB VAL 432 -9.973 0.892 -9.489
9 HG11 VAL 432 HG11 VAL 432 -10.720 2.595 -11.090
10 HG12 VAL 432 HG12 VAL 432 -10.309 3.855 -9.925
11 HG13 VAL 432 HG13 VAL 432 -11.587 2.696 -9.556
12 HG21 VAL 432 HG21 VAL 432 -7.881 2.998 -10.034
13 HG22 VAL 432 HG22 VAL 432 -8.412 1.756 -11.167
14 HG23 VAL 432 HG23 VAL 432 -7.577 1.296 -9.684
15 H SER 433 HN SER 433 -6.947 2.261 -7.540
16 HA SER 433 HA SER 433 -6.816 -0.456 -6.479
17 HB2 SER 433 HB2 SER 433 -4.577 1.464 -7.180
18 HB3 SER 433 HB1 SER 433 -4.383 -0.226 -6.715
19 HG SER 433 HG SER 433 -6.113 -0.173 -8.702
20 H GLU 434 HN GLU 434 -7.122 -0.647 -4.361
21 HA GLU 434 HA GLU 434 -6.535 1.600 -2.620
22 HB2 GLU 434 HB2 GLU 434 -7.644 0.194 -0.872
23 HB3 GLU 434 HB1 GLU 434 -8.663 0.603 -2.242
24 HG2 GLU 434 HG2 GLU 434 -8.303 -1.614 -3.184
25 HG3 GLU 434 HG1 GLU 434 -7.267 -2.030 -1.821
26 H TRP 435 HN TRP 435 -4.651 1.798 -1.700
27 HA TRP 435 HA TRP 435 -2.887 -0.497 -1.416
28 HB2 TRP 435 HB2 TRP 435 -2.331 2.388 -0.679
29 HB3 TRP 435 HB1 TRP 435 -1.151 1.110 -0.955
30 HD1 TRP 435 HD1 TRP 435 -3.639 3.338 -2.888
31 HE1 TRP 435 HE1 TRP 435 -2.881 3.470 -5.342
32 HE3 TRP 435 HE3 TRP 435 0.276 0.056 -2.713
33 HZ2 TRP 435 HZ2 TRP 435 -0.888 2.338 -6.985
34 HZ3 TRP 435 HZ3 TRP 435 1.557 -0.360 -4.777
35 HH2 TRP 435 HH2 TRP 435 0.989 0.766 -6.863
36 H THR 436 HN THR 436 -3.051 -1.686 0.383
37 HA THR 436 HA THR 436 -4.450 -0.544 2.667
38 HB THR 436 HB THR 436 -3.514 -3.399 2.380
39 HG1 THR 436 HG1 THR 436 -5.109 -2.237 0.713
40 HG21 THR 436 HG21 THR 436 -5.789 -2.128 3.913
41 HG22 THR 436 HG22 THR 436 -4.275 -2.709 4.607
42 HG23 THR 436 HG23 THR 436 -5.403 -3.850 3.877
43 H GLU 437 HN GLU 437 -3.468 0.145 4.438
44 HA GLU 437 HA GLU 437 -0.579 -0.128 4.634
45 HB2 GLU 437 HB2 GLU 437 -2.471 1.510 6.332
46 HB3 GLU 437 HB1 GLU 437 -0.718 1.631 6.304
47 HG2 GLU 437 HG2 GLU 437 -0.836 2.353 3.956
48 HG3 GLU 437 HG1 GLU 437 -2.596 2.303 4.054
49 H TYR 438 HN TYR 438 0.221 -1.789 5.737
50 HA TYR 438 HA TYR 438 -1.103 -2.522 8.266
51 HB2 TYR 438 HB2 TYR 438 0.281 -4.273 6.247
52 HB3 TYR 438 HB1 TYR 438 0.049 -4.784 7.913
53 HD1 TYR 438 HD2 TYR 438 -2.473 -4.512 8.760
54 HD2 TYR 438 HD1 TYR 438 -1.287 -4.935 4.697
55 HE1 TYR 438 HE2 TYR 438 -4.714 -5.351 8.199
56 HE2 TYR 438 HE1 TYR 438 -3.526 -5.777 4.128
57 HH TYR 438 HH TYR 438 -6.180 -5.536 6.256
58 H LYS 439 HN LYS 439 0.048 -2.040 9.991
59 HA LYS 439 HA LYS 439 2.951 -1.754 9.753
60 HB2 LYS 439 HB2 LYS 439 1.838 0.085 10.880
61 HB3 LYS 439 HB1 LYS 439 1.034 -1.024 11.981
62 HG2 LYS 439 HG2 LYS 439 2.902 0.147 13.045
63 HG3 LYS 439 HG1 LYS 439 3.156 -1.599 13.006
64 HD2 LYS 439 HD2 LYS 439 4.594 -1.318 11.021
65 HD3 LYS 439 HD1 LYS 439 4.376 0.429 11.131
66 HE2 LYS 439 HE2 LYS 439 5.542 -1.263 13.337
67 HE3 LYS 439 HE1 LYS 439 6.510 -0.445 12.113
68 HZ1 LYS 439 HZ1 LYS 439 4.703 0.862 14.085
69 HZ2 LYS 439 HZ2 LYS 439 5.560 1.668 12.864
70 HZ3 LYS 439 HZ3 LYS 439 6.402 0.874 14.103
71 H THR 440 HN THR 440 4.004 -3.603 9.961
72 HA THR 440 HA THR 440 3.006 -5.645 11.785
73 HB THR 440 HB THR 440 3.673 -6.534 9.664
74 HG1 THR 440 HG1 THR 440 4.960 -8.120 10.399
75 HG21 THR 440 HG21 THR 440 6.347 -5.199 10.077
76 HG22 THR 440 HG22 THR 440 5.119 -4.728 8.905
77 HG23 THR 440 HG23 THR 440 5.933 -6.284 8.750
78 H ALA 441 HN ALA 441 4.235 -6.484 13.488
79 HA ALA 441 HA ALA 441 5.690 -4.573 14.992
80 HB1 ALA 441 HB1 ALA 441 6.037 -6.388 16.591
81 HB2 ALA 441 HB2 ALA 441 5.465 -7.552 15.398
82 HB3 ALA 441 HB3 ALA 441 4.362 -6.332 16.037
83 H ASP 442 HN ASP 442 6.647 -6.248 12.360
84 HA ASP 442 HA ASP 442 9.371 -6.787 12.986
85 HB2 ASP 442 HB2 ASP 442 8.090 -7.736 11.032
86 HB3 ASP 442 HB1 ASP 442 8.163 -6.146 10.284
87 H GLY 443 HN GLY 443 7.585 -3.975 12.731
88 HA2 GLY 443 HA2 GLY 443 8.407 -1.876 13.371
89 HA3 GLY 443 HA1 GLY 443 10.030 -2.399 12.940
90 H LYS 444 HN LYS 444 7.316 -2.837 10.799
91 HA LYS 444 HA LYS 444 8.186 -0.603 9.125
92 HB2 LYS 444 HB2 LYS 444 8.419 -3.504 8.340
93 HB3 LYS 444 HB1 LYS 444 8.326 -2.218 7.143
94 HG2 LYS 444 HG2 LYS 444 10.461 -1.652 7.433
95 HG3 LYS 444 HG1 LYS 444 10.322 -1.701 9.191
96 HD2 LYS 444 HD2 LYS 444 11.938 -3.338 8.444
97 HD3 LYS 444 HD1 LYS 444 10.525 -4.154 9.116
98 HE2 LYS 444 HE2 LYS 444 9.673 -4.473 6.810
99 HE3 LYS 444 HE1 LYS 444 11.161 -3.757 6.192
100 HZ1 LYS 444 HZ1 LYS 444 12.406 -5.544 7.270
101 HZ2 LYS 444 HZ2 LYS 444 11.283 -6.160 6.156
102 HZ3 LYS 444 HZ3 LYS 444 10.957 -6.233 7.821
103 H THR 445 HN THR 445 6.604 0.246 7.909
104 HA THR 445 HA THR 445 3.971 -1.008 7.964
105 HB THR 445 HB THR 445 3.373 1.177 6.693
106 HG1 THR 445 HG1 THR 445 5.495 1.827 6.217
107 HG21 THR 445 HG21 THR 445 3.172 2.417 8.771
108 HG22 THR 445 HG22 THR 445 4.326 1.335 9.554
109 HG23 THR 445 HG23 THR 445 2.757 0.722 9.026
110 H TYR 446 HN TYR 446 3.495 -2.407 6.363
111 HA TYR 446 HA TYR 446 4.708 -1.897 3.735
112 HB2 TYR 446 HB2 TYR 446 4.527 -4.217 3.214
113 HB3 TYR 446 HB1 TYR 446 5.257 -4.095 4.805
114 HD1 TYR 446 HD2 TYR 446 2.252 -5.072 2.933
115 HD2 TYR 446 HD1 TYR 446 4.126 -4.980 6.756
116 HE1 TYR 446 HE2 TYR 446 0.585 -6.662 3.781
117 HE2 TYR 446 HE1 TYR 446 2.459 -6.576 7.609
118 HH TYR 446 HH TYR 446 0.256 -7.381 7.131
119 H TYR 447 HN TYR 447 3.505 -1.574 2.008
120 HA TYR 447 HA TYR 447 0.618 -1.299 2.415
121 HB2 TYR 447 HB2 TYR 447 2.508 -0.152 0.353
122 HB3 TYR 447 HB1 TYR 447 0.762 0.045 0.278
123 HD1 TYR 447 HD2 TYR 447 3.470 0.480 2.844
124 HD2 TYR 447 HD1 TYR 447 -0.024 2.072 1.011
125 HE1 TYR 447 HE2 TYR 447 3.623 2.463 4.290
126 HE2 TYR 447 HE1 TYR 447 0.127 4.062 2.445
127 HH TYR 447 HH TYR 447 1.089 4.654 4.659
128 H TYR 448 HN TYR 448 -0.579 -2.942 1.748
129 HA TYR 448 HA TYR 448 0.417 -4.722 -0.328
130 HB2 TYR 448 HB2 TYR 448 -0.554 -5.789 1.622
131 HB3 TYR 448 HB1 TYR 448 -2.044 -4.870 1.427
132 HD1 TYR 448 HD1 TYR 448 0.109 -7.277 -0.460
133 HD2 TYR 448 HD2 TYR 448 -3.829 -5.868 0.329
134 HE1 TYR 448 HE1 TYR 448 -0.808 -9.059 -1.885
135 HE2 TYR 448 HE2 TYR 448 -4.757 -7.648 -1.093
136 HH TYR 448 HH TYR 448 -2.947 -10.307 -2.132
137 H ASN 449 HN ASN 449 -0.083 -4.465 -2.378
138 HA ASN 449 HA ASN 449 -2.562 -3.013 -3.044
139 HB2 ASN 449 HB2 ASN 449 -1.400 -2.239 -5.103
140 HB3 ASN 449 HB1 ASN 449 -0.693 -1.624 -3.619
141 HD21 ASN 449 HD21 ASN 449 -0.229 -3.628 -6.379
142 HD22 ASN 449 HD22 ASN 449 1.454 -3.949 -6.145
143 H ASN 450 HN ASN 450 -3.909 -3.873 -4.468
144 HA ASN 450 HA ASN 450 -3.458 -6.565 -5.401
145 HB2 ASN 450 HB2 ASN 450 -5.730 -6.455 -6.247
146 HB3 ASN 450 HB1 ASN 450 -5.691 -5.793 -4.617
147 HD21 ASN 450 HD21 ASN 450 -7.591 -5.394 -6.794
148 HD22 ASN 450 HD22 ASN 450 -7.653 -3.681 -7.077
149 H ARG 451 HN ARG 451 -2.506 -3.620 -6.458
150 HA ARG 451 HA ARG 451 -3.000 -3.582 -9.203
151 HB2 ARG 451 HB2 ARG 451 -2.049 -1.724 -7.795
152 HB3 ARG 451 HB1 ARG 451 -0.511 -2.568 -7.827
153 HG2 ARG 451 HG2 ARG 451 -0.427 -2.341 -10.257
154 HG3 ARG 451 HG1 ARG 451 -1.976 -1.493 -10.226
155 HD2 ARG 451 HD2 ARG 451 -0.932 0.196 -8.713
156 HD3 ARG 451 HD1 ARG 451 0.615 -0.606 -8.969
157 HE ARG 451 HE ARG 451 -0.355 -0.024 -11.487
158 HH11 ARG 451 HH11 ARG 451 0.542 1.782 -8.624
159 HH12 ARG 451 HH12 ARG 451 0.961 3.222 -9.493
160 HH21 ARG 451 HH21 ARG 451 0.200 1.837 -12.644
161 HH22 ARG 451 HH22 ARG 451 0.750 3.261 -11.801
162 H THR 452 HN THR 452 0.006 -4.615 -7.578
163 HA THR 452 HA THR 452 0.455 -6.487 -9.795
164 HB THR 452 HB THR 452 2.867 -6.434 -8.954
165 HG1 THR 452 HG1 THR 452 3.414 -4.970 -7.482
166 HG21 THR 452 HG21 THR 452 2.163 -5.318 -11.011
167 HG22 THR 452 HG22 THR 452 3.367 -4.352 -10.157
168 HG23 THR 452 HG23 THR 452 1.661 -3.905 -10.084
169 H LEU 453 HN LEU 453 -0.756 -6.511 -6.774
170 HA LEU 453 HA LEU 453 -0.958 -7.956 -5.053
171 HB2 LEU 453 HB2 LEU 453 0.128 -9.924 -7.070
172 HB3 LEU 453 HB1 LEU 453 -0.547 -10.364 -5.511
173 HG LEU 453 HG LEU 453 -2.052 -9.015 -7.755
174 HD11 LEU 453 HD11 LEU 453 -3.250 -11.136 -7.928
175 HD12 LEU 453 HD12 LEU 453 -2.204 -11.831 -6.690
176 HD13 LEU 453 HD13 LEU 453 -1.527 -11.345 -8.242
177 HD21 LEU 453 HD21 LEU 453 -4.026 -9.387 -6.359
178 HD22 LEU 453 HD22 LEU 453 -2.864 -8.325 -5.566
179 HD23 LEU 453 HD23 LEU 453 -2.995 -10.012 -5.072
180 H GLU 454 HN GLU 454 0.990 -6.415 -4.568
181 HA GLU 454 HA GLU 454 3.165 -8.073 -3.516
182 HB2 GLU 454 HB2 GLU 454 3.544 -5.489 -5.046
183 HB3 GLU 454 HB1 GLU 454 4.812 -6.357 -4.195
184 HG2 GLU 454 HG2 GLU 454 4.480 -8.270 -5.700
185 HG3 GLU 454 HG1 GLU 454 3.262 -7.344 -6.575
186 H SER 455 HN SER 455 4.077 -7.287 -1.604
187 HA SER 455 HA SER 455 2.705 -4.999 -0.386
188 HB2 SER 455 HB2 SER 455 4.627 -6.969 0.882
189 HB3 SER 455 HB1 SER 455 3.647 -5.766 1.723
190 HG SER 455 HG SER 455 2.240 -7.475 0.075
191 H THR 456 HN THR 456 3.632 -3.116 -0.907
192 HA THR 456 HA THR 456 6.539 -3.020 -1.298
193 HB THR 456 HB THR 456 5.156 -2.172 -3.153
194 HG1 THR 456 HG1 THR 456 6.921 -1.009 -3.326
195 HG21 THR 456 HG21 THR 456 3.882 -0.098 -2.914
196 HG22 THR 456 HG22 THR 456 4.235 -0.071 -1.187
197 HG23 THR 456 HG23 THR 456 3.237 -1.358 -1.864
198 H PHE 457 HN PHE 457 7.814 -1.384 -0.305
199 HA PHE 457 HA PHE 457 6.694 -0.517 2.267
200 HB2 PHE 457 HB2 PHE 457 9.561 -0.782 1.333
201 HB3 PHE 457 HB1 PHE 457 9.083 -0.182 2.918
202 HD1 PHE 457 HD1 PHE 457 7.782 -1.720 4.441
203 HD2 PHE 457 HD2 PHE 457 9.761 -3.075 0.929
204 HE1 PHE 457 HE1 PHE 457 7.736 -4.017 5.311
205 HE2 PHE 457 HE2 PHE 457 9.719 -5.381 1.793
206 HZ PHE 457 HZ PHE 457 8.703 -5.854 3.988
207 H GLU 458 HN GLU 458 6.874 0.720 -0.674
208 HA GLU 458 HA GLU 458 7.809 3.382 0.127
209 HB2 GLU 458 HB2 GLU 458 8.163 1.926 -2.204
210 HB3 GLU 458 HB1 GLU 458 6.891 3.062 -2.631
211 HG2 GLU 458 HG2 GLU 458 9.570 3.801 -1.475
212 HG3 GLU 458 HG1 GLU 458 9.124 3.905 -3.175
213 H LYS 459 HN LYS 459 6.442 5.146 0.145
214 HA LYS 459 HA LYS 459 3.631 4.557 0.430
215 HB2 LYS 459 HB2 LYS 459 5.223 7.094 0.731
216 HB3 LYS 459 HB1 LYS 459 3.478 7.024 0.939
217 HG2 LYS 459 HG2 LYS 459 3.738 5.435 2.757
218 HG3 LYS 459 HG1 LYS 459 5.487 5.452 2.533
219 HD2 LYS 459 HD2 LYS 459 5.585 7.787 3.133
220 HD3 LYS 459 HD1 LYS 459 3.826 7.866 3.237
221 HE2 LYS 459 HE2 LYS 459 3.828 6.342 5.110
222 HE3 LYS 459 HE1 LYS 459 5.569 6.106 4.958
223 HZ1 LYS 459 HZ1 LYS 459 4.254 8.694 5.598
224 HZ2 LYS 459 HZ2 LYS 459 5.923 8.401 5.528
225 HZ3 LYS 459 HZ3 LYS 459 4.987 7.667 6.735
226 HA PRO 460 HA PRO 460 3.082 5.307 -3.986
227 HB2 PRO 460 HB2 PRO 460 0.259 4.760 -3.332
228 HB3 PRO 460 HB1 PRO 460 1.325 3.952 -4.486
229 HG2 PRO 460 HG2 PRO 460 0.591 2.770 -2.205
230 HG3 PRO 460 HG1 PRO 460 2.214 2.551 -2.887
231 HD2 PRO 460 HD2 PRO 460 1.326 4.299 -0.628
232 HD3 PRO 460 HD1 PRO 460 2.778 3.286 -0.779
233 H GLN 461 HN GLN 461 2.582 7.096 -5.069
234 HA GLN 461 HA GLN 461 1.197 9.250 -3.673
235 HB2 GLN 461 HB2 GLN 461 3.385 9.653 -4.812
236 HB3 GLN 461 HB1 GLN 461 2.613 9.289 -6.348
237 HG2 GLN 461 HG2 GLN 461 1.171 11.206 -6.130
238 HG3 GLN 461 HG1 GLN 461 1.791 11.529 -4.511
239 HE21 GLN 461 HE21 GLN 461 1.797 13.221 -6.913
240 HE22 GLN 461 HE22 GLN 461 3.455 13.629 -7.192
241 H GLU 462 HN GLU 462 0.553 6.776 -5.848
242 HA GLU 462 HA GLU 462 -1.690 8.096 -7.130
243 HB2 GLU 462 HB2 GLU 462 -2.162 5.726 -7.967
244 HB3 GLU 462 HB1 GLU 462 -0.696 6.509 -8.541
245 HG2 GLU 462 HG2 GLU 462 -0.555 4.748 -6.145
246 HG3 GLU 462 HG1 GLU 462 -0.695 4.017 -7.742
247 H LEU 463 HN LEU 463 -1.223 7.117 -4.106
248 HA LEU 463 HA LEU 463 -3.773 5.803 -3.662
249 HB2 LEU 463 HB2 LEU 463 -1.472 5.574 -2.343
250 HB3 LEU 463 HB1 LEU 463 -2.112 6.936 -1.450
251 HG LEU 463 HG LEU 463 -3.386 4.209 -1.701
252 HD11 LEU 463 HD11 LEU 463 -1.489 4.160 -0.246
253 HD12 LEU 463 HD12 LEU 463 -2.953 4.117 0.735
254 HD13 LEU 463 HD13 LEU 463 -2.032 5.614 0.592
255 HD21 LEU 463 HD21 LEU 463 -5.003 5.037 -0.033
256 HD22 LEU 463 HD22 LEU 463 -5.125 5.877 -1.580
257 HD23 LEU 463 HD23 LEU 463 -4.324 6.651 -0.218
258 H LYS 464 HN LYS 464 -5.579 7.005 -3.653
259 HA LYS 464 HA LYS 464 -5.550 9.580 -2.298
260 HB2 LYS 464 HB2 LYS 464 -5.119 9.963 -4.753
261 HB3 LYS 464 HB1 LYS 464 -6.714 9.295 -5.070
262 HG2 LYS 464 HG2 LYS 464 -6.882 11.674 -5.079
263 HG3 LYS 464 HG1 LYS 464 -7.678 11.073 -3.622
264 HD2 LYS 464 HD2 LYS 464 -4.949 11.518 -2.995
265 HD3 LYS 464 HD1 LYS 464 -5.537 12.943 -3.851
266 HE2 LYS 464 HE2 LYS 464 -5.932 13.330 -1.548
267 HE3 LYS 464 HE1 LYS 464 -7.493 12.950 -2.267
268 HZ1 LYS 464 HZ1 LYS 464 -7.349 10.714 -1.400
269 HZ2 LYS 464 HZ2 LYS 464 -7.130 11.828 -0.135
270 HZ3 LYS 464 HZ3 LYS 464 -5.796 11.013 -0.786
Start of MODEL 15
1 H ALA 431 HN ALA 431 -8.476 8.981 -1.106
2 HA ALA 431 HA ALA 431 -6.458 7.081 -1.660
3 HB1 ALA 431 HB1 ALA 431 -8.614 6.983 0.447
4 HB2 ALA 431 HB2 ALA 431 -7.046 7.769 0.616
5 HB3 ALA 431 HB3 ALA 431 -7.139 6.019 0.421
6 H VAL 432 HN VAL 432 -6.665 5.616 -3.213
7 HA VAL 432 HA VAL 432 -9.206 4.309 -3.721
8 HB VAL 432 HB VAL 432 -7.978 3.118 -5.531
9 HG11 VAL 432 HG11 VAL 432 -9.143 5.184 -6.028
10 HG12 VAL 432 HG12 VAL 432 -7.649 5.098 -6.961
11 HG13 VAL 432 HG13 VAL 432 -7.735 6.124 -5.530
12 HG21 VAL 432 HG21 VAL 432 -5.754 3.093 -4.539
13 HG22 VAL 432 HG22 VAL 432 -5.664 4.849 -4.660
14 HG23 VAL 432 HG23 VAL 432 -5.714 3.866 -6.124
15 H SER 433 HN SER 433 -9.263 1.910 -3.883
16 HA SER 433 HA SER 433 -7.995 0.811 -1.491
17 HB2 SER 433 HB2 SER 433 -10.251 -0.278 -3.192
18 HB3 SER 433 HB1 SER 433 -9.709 -0.937 -1.645
19 HG SER 433 HG SER 433 -10.128 1.449 -0.988
20 H GLU 434 HN GLU 434 -6.996 1.113 -4.459
21 HA GLU 434 HA GLU 434 -6.325 -1.545 -5.250
22 HB2 GLU 434 HB2 GLU 434 -5.024 1.067 -6.044
23 HB3 GLU 434 HB1 GLU 434 -4.835 -0.474 -6.870
24 HG2 GLU 434 HG2 GLU 434 -7.249 -0.451 -7.382
25 HG3 GLU 434 HG1 GLU 434 -7.361 1.147 -6.640
26 H TRP 435 HN TRP 435 -5.140 0.566 -2.898
27 HA TRP 435 HA TRP 435 -2.667 -1.003 -2.622
28 HB2 TRP 435 HB2 TRP 435 -2.966 1.908 -1.843
29 HB3 TRP 435 HB1 TRP 435 -1.485 0.957 -1.885
30 HD1 TRP 435 HD1 TRP 435 -3.701 3.095 -4.062
31 HE1 TRP 435 HE1 TRP 435 -2.685 3.285 -6.411
32 HE3 TRP 435 HE3 TRP 435 -0.042 -0.445 -3.659
33 HZ2 TRP 435 HZ2 TRP 435 -0.625 2.097 -7.900
34 HZ3 TRP 435 HZ3 TRP 435 1.391 -0.870 -5.614
35 HH2 TRP 435 HH2 TRP 435 1.113 0.379 -7.683
36 H THR 436 HN THR 436 -2.849 -2.243 -0.854
37 HA THR 436 HA THR 436 -4.840 -1.540 1.145
38 HB THR 436 HB THR 436 -3.195 -4.049 1.230
39 HG1 THR 436 HG1 THR 436 -3.889 -4.183 -0.839
40 HG21 THR 436 HG21 THR 436 -6.071 -3.414 1.917
41 HG22 THR 436 HG22 THR 436 -4.745 -3.589 3.067
42 HG23 THR 436 HG23 THR 436 -5.284 -4.979 2.125
43 H GLU 437 HN GLU 437 -4.441 -1.059 3.223
44 HA GLU 437 HA GLU 437 -1.726 -0.306 3.939
45 HB2 GLU 437 HB2 GLU 437 -3.524 1.300 4.288
46 HB3 GLU 437 HB1 GLU 437 -4.407 0.145 5.270
47 HG2 GLU 437 HG2 GLU 437 -3.511 1.421 6.903
48 HG3 GLU 437 HG1 GLU 437 -2.215 0.241 6.733
49 H TYR 438 HN TYR 438 -0.536 -2.003 4.707
50 HA TYR 438 HA TYR 438 -1.673 -3.408 7.034
51 HB2 TYR 438 HB2 TYR 438 -0.002 -4.539 4.795
52 HB3 TYR 438 HB1 TYR 438 -0.073 -5.312 6.374
53 HD1 TYR 438 HD2 TYR 438 -2.641 -5.545 7.248
54 HD2 TYR 438 HD1 TYR 438 -1.375 -5.432 3.192
55 HE1 TYR 438 HE2 TYR 438 -4.686 -6.736 6.587
56 HE2 TYR 438 HE1 TYR 438 -3.418 -6.624 2.516
57 HH TYR 438 HH TYR 438 -5.095 -8.143 3.531
58 H LYS 439 HN LYS 439 -0.669 -2.784 8.797
59 HA LYS 439 HA LYS 439 2.187 -2.074 8.630
60 HB2 LYS 439 HB2 LYS 439 0.790 -0.233 9.383
61 HB3 LYS 439 HB1 LYS 439 0.062 -1.249 10.618
62 HG2 LYS 439 HG2 LYS 439 2.247 -1.432 11.731
63 HG3 LYS 439 HG1 LYS 439 2.935 -0.356 10.510
64 HD2 LYS 439 HD2 LYS 439 1.487 1.439 11.204
65 HD3 LYS 439 HD1 LYS 439 0.632 0.368 12.317
66 HE2 LYS 439 HE2 LYS 439 3.566 1.016 12.516
67 HE3 LYS 439 HE1 LYS 439 2.307 1.875 13.399
68 HZ1 LYS 439 HZ1 LYS 439 3.486 -0.015 14.590
69 HZ2 LYS 439 HZ2 LYS 439 2.593 -1.062 13.595
70 HZ3 LYS 439 HZ3 LYS 439 1.792 -0.004 14.646
71 H THR 440 HN THR 440 3.615 -3.384 9.582
72 HA THR 440 HA THR 440 2.628 -5.405 11.453
73 HB THR 440 HB THR 440 4.001 -6.371 9.746
74 HG1 THR 440 HG1 THR 440 4.585 -7.488 11.468
75 HG21 THR 440 HG21 THR 440 5.211 -4.355 9.049
76 HG22 THR 440 HG22 THR 440 6.306 -5.711 9.330
77 HG23 THR 440 HG23 THR 440 6.165 -4.426 10.530
78 H ALA 441 HN ALA 441 3.418 -5.647 13.511
79 HA ALA 441 HA ALA 441 3.915 -3.250 14.913
80 HB1 ALA 441 HB1 ALA 441 4.117 -4.666 16.890
81 HB2 ALA 441 HB2 ALA 441 4.206 -6.096 15.862
82 HB3 ALA 441 HB3 ALA 441 2.730 -5.133 15.906
83 H ASP 442 HN ASP 442 6.018 -5.135 13.152
84 HA ASP 442 HA ASP 442 8.412 -4.866 14.632
85 HB2 ASP 442 HB2 ASP 442 8.215 -6.426 12.764
86 HB3 ASP 442 HB1 ASP 442 7.959 -5.092 11.646
87 H GLY 443 HN GLY 443 6.434 -2.580 13.166
88 HA2 GLY 443 HA2 GLY 443 6.717 -0.268 13.438
89 HA3 GLY 443 HA1 GLY 443 8.439 -0.526 13.674
90 H LYS 444 HN LYS 444 6.526 -1.828 11.036
91 HA LYS 444 HA LYS 444 7.424 0.272 9.247
92 HB2 LYS 444 HB2 LYS 444 8.419 -1.286 7.602
93 HB3 LYS 444 HB1 LYS 444 9.336 -1.179 9.092
94 HG2 LYS 444 HG2 LYS 444 8.704 -3.329 9.768
95 HG3 LYS 444 HG1 LYS 444 7.373 -3.394 8.610
96 HD2 LYS 444 HD2 LYS 444 8.951 -3.441 6.762
97 HD3 LYS 444 HD1 LYS 444 10.302 -3.298 7.885
98 HE2 LYS 444 HE2 LYS 444 8.353 -5.558 8.116
99 HE3 LYS 444 HE1 LYS 444 9.667 -5.627 6.945
100 HZ1 LYS 444 HZ1 LYS 444 11.250 -5.366 8.734
101 HZ2 LYS 444 HZ2 LYS 444 10.243 -6.691 9.051
102 HZ3 LYS 444 HZ3 LYS 444 10.005 -5.229 9.876
103 H THR 445 HN THR 445 6.107 0.577 7.517
104 HA THR 445 HA THR 445 3.671 -1.050 7.509
105 HB THR 445 HB THR 445 4.076 1.547 6.024
106 HG1 THR 445 HG1 THR 445 2.709 2.055 8.191
107 HG21 THR 445 HG21 THR 445 1.650 1.689 6.210
108 HG22 THR 445 HG22 THR 445 1.616 0.180 7.122
109 HG23 THR 445 HG23 THR 445 2.125 0.177 5.433
110 H TYR 446 HN TYR 446 3.056 -2.241 5.788
111 HA TYR 446 HA TYR 446 4.565 -1.905 3.302
112 HB2 TYR 446 HB2 TYR 446 4.502 -4.345 2.938
113 HB3 TYR 446 HB1 TYR 446 5.430 -3.904 4.361
114 HD1 TYR 446 HD1 TYR 446 4.257 -4.160 6.650
115 HD2 TYR 446 HD2 TYR 446 2.818 -5.945 3.068
116 HE1 TYR 446 HE1 TYR 446 2.987 -5.795 7.976
117 HE2 TYR 446 HE2 TYR 446 1.545 -7.579 4.386
118 HH TYR 446 HH TYR 446 0.985 -7.259 7.690
119 H TYR 447 HN TYR 447 3.334 -1.393 1.694
120 HA TYR 447 HA TYR 447 0.453 -1.784 1.892
121 HB2 TYR 447 HB2 TYR 447 2.191 -0.115 0.075
122 HB3 TYR 447 HB1 TYR 447 0.460 -0.306 -0.182
123 HD1 TYR 447 HD2 TYR 447 3.002 0.980 2.206
124 HD2 TYR 447 HD1 TYR 447 -1.101 0.941 1.076
125 HE1 TYR 447 HE2 TYR 447 2.560 2.826 3.769
126 HE2 TYR 447 HE1 TYR 447 -1.551 2.788 2.629
127 HH TYR 447 HH TYR 447 -0.590 3.740 4.669
128 H TYR 448 HN TYR 448 -0.317 -3.601 1.135
129 HA TYR 448 HA TYR 448 1.089 -5.032 -0.982
130 HB2 TYR 448 HB2 TYR 448 0.476 -6.310 0.997
131 HB3 TYR 448 HB1 TYR 448 -1.208 -5.833 0.821
132 HD1 TYR 448 HD1 TYR 448 1.421 -7.395 -1.351
133 HD2 TYR 448 HD2 TYR 448 -2.591 -7.497 0.060
134 HE1 TYR 448 HE1 TYR 448 1.006 -9.418 -2.686
135 HE2 TYR 448 HE2 TYR 448 -3.018 -9.517 -1.274
136 HH TYR 448 HH TYR 448 -2.163 -10.694 -3.159
137 H ASN 449 HN ASN 449 0.436 -4.954 -3.030
138 HA ASN 449 HA ASN 449 -2.351 -4.151 -3.554
139 HB2 ASN 449 HB2 ASN 449 -1.608 -3.063 -5.613
140 HB3 ASN 449 HB1 ASN 449 -0.823 -2.358 -4.212
141 HD21 ASN 449 HD21 ASN 449 1.381 -2.599 -3.953
142 HD22 ASN 449 HD22 ASN 449 2.405 -3.208 -5.203
143 H ASN 450 HN ASN 450 -3.497 -5.280 -4.983
144 HA ASN 450 HA ASN 450 -2.439 -7.814 -5.889
145 HB2 ASN 450 HB2 ASN 450 -4.709 -8.311 -6.577
146 HB3 ASN 450 HB1 ASN 450 -4.746 -7.616 -4.962
147 HD21 ASN 450 HD21 ASN 450 -6.818 -7.776 -7.007
148 HD22 ASN 450 HD22 ASN 450 -7.339 -6.150 -7.292
149 H ARG 451 HN ARG 451 -2.182 -4.777 -7.018
150 HA ARG 451 HA ARG 451 -2.764 -4.935 -9.750
151 HB2 ARG 451 HB2 ARG 451 -0.792 -3.328 -8.170
152 HB3 ARG 451 HB1 ARG 451 -0.772 -3.270 -9.925
153 HG2 ARG 451 HG2 ARG 451 -3.156 -2.566 -9.867
154 HG3 ARG 451 HG1 ARG 451 -3.033 -2.473 -8.106
155 HD2 ARG 451 HD2 ARG 451 -1.322 -0.798 -8.259
156 HD3 ARG 451 HD1 ARG 451 -1.231 -0.984 -10.007
157 HE ARG 451 HE ARG 451 -3.840 -0.200 -9.116
158 HH11 ARG 451 HH11 ARG 451 -0.641 0.935 -9.983
159 HH12 ARG 451 HH12 ARG 451 -1.152 2.570 -10.291
160 HH21 ARG 451 HH21 ARG 451 -4.544 1.930 -9.570
161 HH22 ARG 451 HH22 ARG 451 -3.389 3.122 -10.081
162 H THR 452 HN THR 452 0.422 -5.232 -8.218
163 HA THR 452 HA THR 452 1.171 -7.111 -10.346
164 HB THR 452 HB THR 452 2.527 -5.084 -10.296
165 HG1 THR 452 HG1 THR 452 4.448 -6.787 -9.309
166 HG21 THR 452 HG21 THR 452 3.260 -5.917 -7.492
167 HG22 THR 452 HG22 THR 452 2.315 -4.501 -7.948
168 HG23 THR 452 HG23 THR 452 4.017 -4.611 -8.401
169 H LEU 453 HN LEU 453 0.084 -7.184 -7.267
170 HA LEU 453 HA LEU 453 -0.001 -8.760 -5.642
171 HB2 LEU 453 HB2 LEU 453 1.644 -10.392 -7.582
172 HB3 LEU 453 HB1 LEU 453 0.966 -11.012 -6.088
173 HG LEU 453 HG LEU 453 -0.607 -9.972 -8.440
174 HD11 LEU 453 HD11 LEU 453 -0.244 -12.766 -7.370
175 HD12 LEU 453 HD12 LEU 453 0.443 -12.128 -8.864
176 HD13 LEU 453 HD13 LEU 453 -1.304 -12.294 -8.697
177 HD21 LEU 453 HD21 LEU 453 -2.567 -10.776 -7.211
178 HD22 LEU 453 HD22 LEU 453 -1.730 -9.496 -6.334
179 HD23 LEU 453 HD23 LEU 453 -1.536 -11.177 -5.836
180 H GLU 454 HN GLU 454 1.898 -6.724 -5.533
181 HA GLU 454 HA GLU 454 4.111 -8.054 -4.113
182 HB2 GLU 454 HB2 GLU 454 4.288 -5.723 -6.027
183 HB3 GLU 454 HB1 GLU 454 5.568 -6.131 -4.893
184 HG2 GLU 454 HG2 GLU 454 5.798 -8.326 -5.933
185 HG3 GLU 454 HG1 GLU 454 4.505 -7.927 -7.063
186 H SER 455 HN SER 455 4.940 -6.941 -2.329
187 HA SER 455 HA SER 455 3.126 -4.895 -1.266
188 HB2 SER 455 HB2 SER 455 3.356 -6.996 0.047
189 HB3 SER 455 HB1 SER 455 5.080 -6.673 0.216
190 HG SER 455 HG SER 455 3.589 -4.535 0.951
191 H THR 456 HN THR 456 3.849 -2.882 -1.337
192 HA THR 456 HA THR 456 6.745 -2.434 -1.491
193 HB THR 456 HB THR 456 5.657 -1.498 -3.398
194 HG1 THR 456 HG1 THR 456 5.815 0.935 -2.561
195 HG21 THR 456 HG21 THR 456 3.365 -1.418 -2.557
196 HG22 THR 456 HG22 THR 456 3.835 0.139 -3.244
197 HG23 THR 456 HG23 THR 456 3.789 -0.077 -1.492
198 H PHE 457 HN PHE 457 7.789 -1.332 0.057
199 HA PHE 457 HA PHE 457 6.322 -0.546 2.432
200 HB2 PHE 457 HB2 PHE 457 9.290 -0.476 1.827
201 HB3 PHE 457 HB1 PHE 457 8.566 -0.138 3.395
202 HD1 PHE 457 HD1 PHE 457 7.515 -1.950 4.687
203 HD2 PHE 457 HD2 PHE 457 9.580 -2.698 1.046
204 HE1 PHE 457 HE1 PHE 457 7.643 -4.341 5.257
205 HE2 PHE 457 HE2 PHE 457 9.708 -5.089 1.603
206 HZ PHE 457 HZ PHE 457 8.739 -5.913 3.711
207 H GLU 458 HN GLU 458 6.896 0.857 -0.418
208 HA GLU 458 HA GLU 458 7.272 3.563 0.682
209 HB2 GLU 458 HB2 GLU 458 8.955 2.752 -0.985
210 HB3 GLU 458 HB1 GLU 458 7.658 2.600 -2.161
211 HG2 GLU 458 HG2 GLU 458 7.242 5.003 -2.012
212 HG3 GLU 458 HG1 GLU 458 8.554 5.150 -0.841
213 H LYS 459 HN LYS 459 5.780 5.147 0.191
214 HA LYS 459 HA LYS 459 3.135 4.205 -0.395
215 HB2 LYS 459 HB2 LYS 459 4.139 7.030 -0.002
216 HB3 LYS 459 HB1 LYS 459 2.457 6.521 0.017
217 HG2 LYS 459 HG2 LYS 459 2.755 5.307 2.031
218 HG3 LYS 459 HG1 LYS 459 4.509 5.484 1.951
219 HD2 LYS 459 HD2 LYS 459 4.241 7.926 2.207
220 HD3 LYS 459 HD1 LYS 459 2.498 7.696 2.370
221 HE2 LYS 459 HE2 LYS 459 2.820 6.380 4.369
222 HE3 LYS 459 HE1 LYS 459 4.571 6.468 4.181
223 HZ1 LYS 459 HZ1 LYS 459 2.771 8.788 4.650
224 HZ2 LYS 459 HZ2 LYS 459 4.458 8.858 4.492
225 HZ3 LYS 459 HZ3 LYS 459 3.765 8.062 5.818
226 HA PRO 460 HA PRO 460 3.535 4.947 -4.782
227 HB2 PRO 460 HB2 PRO 460 1.066 4.041 -5.445
228 HB3 PRO 460 HB1 PRO 460 2.418 2.966 -5.073
229 HG2 PRO 460 HG2 PRO 460 0.104 3.764 -3.378
230 HG3 PRO 460 HG1 PRO 460 0.927 2.200 -3.496
231 HD2 PRO 460 HD2 PRO 460 1.331 4.015 -1.473
232 HD3 PRO 460 HD1 PRO 460 2.507 2.782 -1.964
233 H GLN 461 HN GLN 461 2.809 6.466 -6.233
234 HA GLN 461 HA GLN 461 1.711 8.815 -5.069
235 HB2 GLN 461 HB2 GLN 461 1.908 9.743 -7.387
236 HB3 GLN 461 HB1 GLN 461 3.394 9.076 -6.727
237 HG2 GLN 461 HG2 GLN 461 2.934 6.984 -8.001
238 HG3 GLN 461 HG1 GLN 461 1.572 7.808 -8.756
239 HE21 GLN 461 HE21 GLN 461 2.501 7.592 -10.803
240 HE22 GLN 461 HE22 GLN 461 3.858 8.543 -11.306
241 H GLU 462 HN GLU 462 0.193 6.119 -6.474
242 HA GLU 462 HA GLU 462 -2.133 7.536 -7.409
243 HB2 GLU 462 HB2 GLU 462 -1.626 4.610 -6.892
244 HB3 GLU 462 HB1 GLU 462 -3.174 5.229 -7.442
245 HG2 GLU 462 HG2 GLU 462 -2.315 4.698 -9.439
246 HG3 GLU 462 HG1 GLU 462 -1.629 6.314 -9.307
247 H LEU 463 HN LEU 463 -0.974 6.752 -4.365
248 HA LEU 463 HA LEU 463 -3.675 6.554 -3.236
249 HB2 LEU 463 HB2 LEU 463 -2.081 4.733 -2.694
250 HB3 LEU 463 HB1 LEU 463 -1.030 5.915 -1.935
251 HG LEU 463 HG LEU 463 -2.794 6.405 -0.277
252 HD11 LEU 463 HD11 LEU 463 -4.265 4.132 -1.603
253 HD12 LEU 463 HD12 LEU 463 -4.736 5.831 -1.644
254 HD13 LEU 463 HD13 LEU 463 -4.745 4.949 -0.114
255 HD21 LEU 463 HD21 LEU 463 -2.610 4.303 0.959
256 HD22 LEU 463 HD22 LEU 463 -1.071 4.764 0.231
257 HD23 LEU 463 HD23 LEU 463 -2.050 3.492 -0.505
258 H LYS 464 HN LYS 464 -4.477 8.407 -2.571
259 HA LYS 464 HA LYS 464 -2.689 10.321 -1.234
260 HB2 LYS 464 HB2 LYS 464 -5.182 10.840 -2.863
261 HB3 LYS 464 HB1 LYS 464 -4.368 12.062 -1.898
262 HG2 LYS 464 HG2 LYS 464 -3.240 10.601 -4.279
263 HG3 LYS 464 HG1 LYS 464 -3.730 12.295 -4.202
264 HD2 LYS 464 HD2 LYS 464 -1.462 11.002 -2.689
265 HD3 LYS 464 HD1 LYS 464 -1.317 12.120 -4.044
266 HE2 LYS 464 HE2 LYS 464 -2.554 12.770 -1.368
267 HE3 LYS 464 HE1 LYS 464 -0.918 13.199 -1.862
268 HZ1 LYS 464 HZ1 LYS 464 -1.865 14.529 -3.659
269 HZ2 LYS 464 HZ2 LYS 464 -2.403 15.056 -2.143
270 HZ3 LYS 464 HZ3 LYS 464 -3.436 14.146 -3.135
Start of MODEL 16
1 H ALA 431 HN ALA 431 -14.320 1.734 -1.744
2 HA ALA 431 HA ALA 431 -13.286 4.391 -2.050
3 HB1 ALA 431 HB1 ALA 431 -11.978 1.920 -0.909
4 HB2 ALA 431 HB2 ALA 431 -12.906 3.111 0.003
5 HB3 ALA 431 HB3 ALA 431 -11.381 3.571 -0.753
6 H VAL 432 HN VAL 432 -11.414 5.011 -3.198
7 HA VAL 432 HA VAL 432 -11.074 3.447 -5.634
8 HB VAL 432 HB VAL 432 -9.919 5.420 -6.533
9 HG11 VAL 432 HG11 VAL 432 -11.842 6.947 -6.535
10 HG12 VAL 432 HG12 VAL 432 -12.548 6.051 -5.190
11 HG13 VAL 432 HG13 VAL 432 -12.333 5.269 -6.757
12 HG21 VAL 432 HG21 VAL 432 -9.822 7.502 -5.232
13 HG22 VAL 432 HG22 VAL 432 -8.855 6.223 -4.497
14 HG23 VAL 432 HG23 VAL 432 -10.428 6.640 -3.818
15 H SER 433 HN SER 433 -9.646 3.324 -2.752
16 HA SER 433 HA SER 433 -6.876 3.381 -3.626
17 HB2 SER 433 HB2 SER 433 -8.048 2.772 -0.904
18 HB3 SER 433 HB1 SER 433 -6.341 3.024 -1.263
19 HG SER 433 HG SER 433 -8.449 4.914 -1.530
20 H GLU 434 HN GLU 434 -5.980 1.658 -4.522
21 HA GLU 434 HA GLU 434 -6.965 -1.025 -3.904
22 HB2 GLU 434 HB2 GLU 434 -6.417 -0.350 -6.263
23 HB3 GLU 434 HB1 GLU 434 -4.732 -0.216 -5.783
24 HG2 GLU 434 HG2 GLU 434 -5.070 -2.680 -4.982
25 HG3 GLU 434 HG1 GLU 434 -6.424 -2.648 -6.109
26 H TRP 435 HN TRP 435 -4.694 1.138 -2.776
27 HA TRP 435 HA TRP 435 -2.634 -0.819 -2.171
28 HB2 TRP 435 HB2 TRP 435 -2.647 2.096 -1.382
29 HB3 TRP 435 HB1 TRP 435 -1.259 1.027 -1.555
30 HD1 TRP 435 HD1 TRP 435 -3.483 3.365 -3.516
31 HE1 TRP 435 HE1 TRP 435 -2.598 3.586 -5.913
32 HE3 TRP 435 HE3 TRP 435 -0.007 -0.390 -3.454
33 HZ2 TRP 435 HZ2 TRP 435 -0.688 2.348 -7.559
34 HZ3 TRP 435 HZ3 TRP 435 1.301 -0.801 -5.499
35 HH2 TRP 435 HH2 TRP 435 0.969 0.542 -7.505
36 H THR 436 HN THR 436 -3.039 -2.068 -0.457
37 HA THR 436 HA THR 436 -4.390 -0.888 1.866
38 HB THR 436 HB THR 436 -4.682 -3.238 2.633
39 HG1 THR 436 HG1 THR 436 -3.569 -3.878 0.075
40 HG21 THR 436 HG21 THR 436 -6.460 -2.149 1.376
41 HG22 THR 436 HG22 THR 436 -6.376 -3.864 0.964
42 HG23 THR 436 HG23 THR 436 -5.718 -2.657 -0.143
43 H GLU 437 HN GLU 437 -3.075 -0.140 3.427
44 HA GLU 437 HA GLU 437 -0.389 -1.240 3.623
45 HB2 GLU 437 HB2 GLU 437 0.043 0.576 5.231
46 HB3 GLU 437 HB1 GLU 437 -0.527 1.164 3.681
47 HG2 GLU 437 HG2 GLU 437 -2.691 1.631 4.577
48 HG3 GLU 437 HG1 GLU 437 -2.285 0.837 6.100
49 H TYR 438 HN TYR 438 0.084 -2.818 4.913
50 HA TYR 438 HA TYR 438 -1.520 -3.198 7.342
51 HB2 TYR 438 HB2 TYR 438 0.285 -5.112 5.853
52 HB3 TYR 438 HB1 TYR 438 -0.483 -5.475 7.397
53 HD1 TYR 438 HD2 TYR 438 -2.934 -5.717 7.535
54 HD2 TYR 438 HD1 TYR 438 -0.964 -5.162 3.805
55 HE1 TYR 438 HE2 TYR 438 -4.953 -6.481 6.360
56 HE2 TYR 438 HE1 TYR 438 -2.981 -5.921 2.621
57 HH TYR 438 HH TYR 438 -4.954 -7.260 3.033
58 H LYS 439 HN LYS 439 -0.681 -2.620 9.181
59 HA LYS 439 HA LYS 439 2.087 -1.691 9.222
60 HB2 LYS 439 HB2 LYS 439 -0.366 -0.754 10.265
61 HB3 LYS 439 HB1 LYS 439 0.628 -1.181 11.649
62 HG2 LYS 439 HG2 LYS 439 1.374 0.725 9.444
63 HG3 LYS 439 HG1 LYS 439 0.855 1.162 11.071
64 HD2 LYS 439 HD2 LYS 439 2.833 -0.183 11.909
65 HD3 LYS 439 HD1 LYS 439 3.392 -0.218 10.235
66 HE2 LYS 439 HE2 LYS 439 2.931 2.208 11.962
67 HE3 LYS 439 HE1 LYS 439 4.474 1.606 11.358
68 HZ1 LYS 439 HZ1 LYS 439 2.263 2.761 9.742
69 HZ2 LYS 439 HZ2 LYS 439 3.655 2.051 9.085
70 HZ3 LYS 439 HZ3 LYS 439 3.787 3.451 10.030
71 H THR 440 HN THR 440 3.567 -3.124 9.934
72 HA THR 440 HA THR 440 2.782 -5.066 11.966
73 HB THR 440 HB THR 440 4.124 -5.935 10.100
74 HG1 THR 440 HG1 THR 440 5.915 -6.787 11.486
75 HG21 THR 440 HG21 THR 440 5.422 -3.942 9.560
76 HG22 THR 440 HG22 THR 440 6.485 -5.318 9.856
77 HG23 THR 440 HG23 THR 440 6.285 -4.075 11.092
78 H ALA 441 HN ALA 441 3.717 -5.172 13.999
79 HA ALA 441 HA ALA 441 4.126 -2.694 15.259
80 HB1 ALA 441 HB1 ALA 441 4.785 -5.450 16.288
81 HB2 ALA 441 HB2 ALA 441 3.208 -4.667 16.385
82 HB3 ALA 441 HB3 ALA 441 4.583 -3.994 17.262
83 H ASP 442 HN ASP 442 6.276 -4.668 13.555
84 HA ASP 442 HA ASP 442 8.723 -4.038 14.821
85 HB2 ASP 442 HB2 ASP 442 8.419 -5.878 13.185
86 HB3 ASP 442 HB1 ASP 442 8.200 -4.685 11.910
87 H GLY 443 HN GLY 443 6.551 -2.139 13.074
88 HA2 GLY 443 HA2 GLY 443 6.714 0.176 12.757
89 HA3 GLY 443 HA1 GLY 443 8.456 0.066 12.980
90 H LYS 444 HN LYS 444 6.496 -1.891 10.834
91 HA LYS 444 HA LYS 444 7.572 -0.421 8.520
92 HB2 LYS 444 HB2 LYS 444 7.557 -3.428 8.860
93 HB3 LYS 444 HB1 LYS 444 7.834 -2.618 7.324
94 HG2 LYS 444 HG2 LYS 444 9.759 -1.418 8.556
95 HG3 LYS 444 HG1 LYS 444 9.584 -2.708 9.749
96 HD2 LYS 444 HD2 LYS 444 10.015 -3.154 6.797
97 HD3 LYS 444 HD1 LYS 444 11.299 -3.177 8.007
98 HE2 LYS 444 HE2 LYS 444 8.900 -4.939 8.310
99 HE3 LYS 444 HE1 LYS 444 10.213 -5.407 7.232
100 HZ1 LYS 444 HZ1 LYS 444 10.437 -6.334 9.478
101 HZ2 LYS 444 HZ2 LYS 444 10.546 -4.764 10.122
102 HZ3 LYS 444 HZ3 LYS 444 11.739 -5.336 9.065
103 H THR 445 HN THR 445 6.179 -0.225 6.799
104 HA THR 445 HA THR 445 3.502 -1.410 7.171
105 HB THR 445 HB THR 445 3.703 1.117 5.647
106 HG1 THR 445 HG1 THR 445 5.052 1.692 7.331
107 HG21 THR 445 HG21 THR 445 1.626 1.599 6.853
108 HG22 THR 445 HG22 THR 445 1.846 0.146 7.834
109 HG23 THR 445 HG23 THR 445 1.561 0.006 6.097
110 H TYR 446 HN TYR 446 3.188 -2.892 5.612
111 HA TYR 446 HA TYR 446 4.384 -2.346 2.988
112 HB2 TYR 446 HB2 TYR 446 4.198 -4.730 2.503
113 HB3 TYR 446 HB1 TYR 446 5.127 -4.461 3.966
114 HD1 TYR 446 HD1 TYR 446 4.138 -5.043 6.176
115 HD2 TYR 446 HD2 TYR 446 2.168 -5.971 2.520
116 HE1 TYR 446 HE1 TYR 446 2.726 -6.677 7.355
117 HE2 TYR 446 HE2 TYR 446 0.748 -7.600 3.688
118 HH TYR 446 HH TYR 446 0.786 -8.957 5.717
119 H TYR 447 HN TYR 447 3.167 -1.814 1.379
120 HA TYR 447 HA TYR 447 0.273 -1.937 1.629
121 HB2 TYR 447 HB2 TYR 447 2.117 -0.623 -0.371
122 HB3 TYR 447 HB1 TYR 447 0.368 -0.649 -0.559
123 HD1 TYR 447 HD2 TYR 447 3.074 0.476 1.745
124 HD2 TYR 447 HD1 TYR 447 -0.959 0.965 0.478
125 HE1 TYR 447 HE2 TYR 447 2.886 2.496 3.136
126 HE2 TYR 447 HE1 TYR 447 -1.155 2.978 1.869
127 HH TYR 447 HH TYR 447 -0.073 3.920 3.905
128 H TYR 448 HN TYR 448 -0.691 -3.729 1.019
129 HA TYR 448 HA TYR 448 0.503 -5.436 -1.015
130 HB2 TYR 448 HB2 TYR 448 -0.343 -6.510 1.010
131 HB3 TYR 448 HB1 TYR 448 -1.937 -5.815 0.738
132 HD1 TYR 448 HD1 TYR 448 0.557 -7.909 -1.107
133 HD2 TYR 448 HD2 TYR 448 -3.529 -7.205 -0.165
134 HE1 TYR 448 HE1 TYR 448 -0.078 -9.903 -2.398
135 HE2 TYR 448 HE2 TYR 448 -4.179 -9.196 -1.454
136 HH TYR 448 HH TYR 448 -3.357 -10.627 -3.187
137 H ASN 449 HN ASN 449 0.008 -5.157 -3.069
138 HA ASN 449 HA ASN 449 -2.709 -4.294 -3.766
139 HB2 ASN 449 HB2 ASN 449 -1.873 -2.705 -5.380
140 HB3 ASN 449 HB1 ASN 449 -1.161 -2.337 -3.812
141 HD21 ASN 449 HD21 ASN 449 -0.592 -3.177 -7.054
142 HD22 ASN 449 HD22 ASN 449 1.143 -3.245 -6.981
143 H ASN 450 HN ASN 450 -3.514 -5.115 -5.671
144 HA ASN 450 HA ASN 450 -2.147 -7.533 -6.553
145 HB2 ASN 450 HB2 ASN 450 -4.294 -8.134 -7.590
146 HB3 ASN 450 HB1 ASN 450 -4.482 -7.754 -5.882
147 HD21 ASN 450 HD21 ASN 450 -5.651 -5.983 -5.270
148 HD22 ASN 450 HD22 ASN 450 -6.602 -5.050 -6.378
149 H ARG 451 HN ARG 451 -2.382 -4.361 -7.539
150 HA ARG 451 HA ARG 451 -2.386 -4.529 -10.321
151 HB2 ARG 451 HB2 ARG 451 -2.469 -2.380 -9.296
152 HB3 ARG 451 HB1 ARG 451 -0.970 -2.661 -8.424
153 HG2 ARG 451 HG2 ARG 451 0.252 -2.620 -10.564
154 HG3 ARG 451 HG1 ARG 451 -1.265 -2.267 -11.396
155 HD2 ARG 451 HD2 ARG 451 -1.497 -0.191 -10.234
156 HD3 ARG 451 HD1 ARG 451 -0.135 -0.567 -9.181
157 HE ARG 451 HE ARG 451 0.682 -0.563 -11.899
158 HH11 ARG 451 HH11 ARG 451 -0.196 1.561 -9.273
159 HH12 ARG 451 HH12 ARG 451 0.734 2.913 -9.853
160 HH21 ARG 451 HH21 ARG 451 1.926 1.213 -12.691
161 HH22 ARG 451 HH22 ARG 451 1.939 2.712 -11.803
162 H THR 452 HN THR 452 0.419 -4.539 -8.133
163 HA THR 452 HA THR 452 1.980 -5.817 -10.262
164 HB THR 452 HB THR 452 3.943 -5.144 -8.712
165 HG1 THR 452 HG1 THR 452 3.517 -3.720 -7.160
166 HG21 THR 452 HG21 THR 452 4.030 -2.908 -9.723
167 HG22 THR 452 HG22 THR 452 2.328 -3.044 -10.165
168 HG23 THR 452 HG23 THR 452 3.518 -4.124 -10.893
169 H LEU 453 HN LEU 453 0.245 -6.673 -7.618
170 HA LEU 453 HA LEU 453 0.054 -8.571 -6.398
171 HB2 LEU 453 HB2 LEU 453 2.086 -9.517 -8.409
172 HB3 LEU 453 HB1 LEU 453 1.479 -10.560 -7.140
173 HG LEU 453 HG LEU 453 -0.851 -10.094 -8.074
174 HD11 LEU 453 HD11 LEU 453 -0.964 -9.455 -10.425
175 HD12 LEU 453 HD12 LEU 453 0.772 -9.146 -10.429
176 HD13 LEU 453 HD13 LEU 453 -0.298 -8.153 -9.440
177 HD21 LEU 453 HD21 LEU 453 -0.603 -11.799 -9.803
178 HD22 LEU 453 HD22 LEU 453 0.306 -12.216 -8.349
179 HD23 LEU 453 HD23 LEU 453 1.147 -11.585 -9.765
180 H GLU 454 HN GLU 454 1.918 -6.479 -5.595
181 HA GLU 454 HA GLU 454 3.849 -8.101 -4.071
182 HB2 GLU 454 HB2 GLU 454 5.601 -6.532 -4.422
183 HB3 GLU 454 HB1 GLU 454 4.922 -6.884 -6.005
184 HG2 GLU 454 HG2 GLU 454 3.709 -4.803 -5.995
185 HG3 GLU 454 HG1 GLU 454 4.246 -4.464 -4.351
186 H SER 455 HN SER 455 4.327 -7.407 -2.001
187 HA SER 455 HA SER 455 2.662 -5.241 -0.954
188 HB2 SER 455 HB2 SER 455 4.468 -7.162 0.537
189 HB3 SER 455 HB1 SER 455 3.311 -6.040 1.256
190 HG SER 455 HG SER 455 2.163 -7.628 -0.628
191 H THR 456 HN THR 456 3.569 -3.334 -1.433
192 HA THR 456 HA THR 456 6.469 -3.084 -1.450
193 HB THR 456 HB THR 456 5.444 -2.132 -3.372
194 HG1 THR 456 HG1 THR 456 5.761 0.323 -2.235
195 HG21 THR 456 HG21 THR 456 3.170 -1.858 -2.509
196 HG22 THR 456 HG22 THR 456 3.739 -0.381 -3.286
197 HG23 THR 456 HG23 THR 456 3.702 -0.493 -1.526
198 H PHE 457 HN PHE 457 7.605 -2.239 0.142
199 HA PHE 457 HA PHE 457 6.290 -1.153 2.464
200 HB2 PHE 457 HB2 PHE 457 9.208 -1.576 1.803
201 HB3 PHE 457 HB1 PHE 457 8.638 -0.933 3.337
202 HD1 PHE 457 HD2 PHE 457 8.851 -3.911 1.214
203 HD2 PHE 457 HD1 PHE 457 7.571 -2.347 4.960
204 HE1 PHE 457 HE2 PHE 457 8.602 -6.200 2.081
205 HE2 PHE 457 HE1 PHE 457 7.323 -4.635 5.833
206 HZ PHE 457 HZ PHE 457 7.840 -6.566 4.395
207 H GLU 458 HN GLU 458 7.279 0.095 -0.441
208 HA GLU 458 HA GLU 458 7.839 2.775 0.609
209 HB2 GLU 458 HB2 GLU 458 7.967 1.696 -2.221
210 HB3 GLU 458 HB1 GLU 458 8.418 3.324 -1.731
211 HG2 GLU 458 HG2 GLU 458 9.753 0.812 -0.752
212 HG3 GLU 458 HG1 GLU 458 10.341 1.814 -2.077
213 H LYS 459 HN LYS 459 6.354 4.379 0.467
214 HA LYS 459 HA LYS 459 3.655 3.679 -0.069
215 HB2 LYS 459 HB2 LYS 459 4.918 6.354 0.514
216 HB3 LYS 459 HB1 LYS 459 3.184 6.084 0.393
217 HG2 LYS 459 HG2 LYS 459 3.451 4.372 2.225
218 HG3 LYS 459 HG1 LYS 459 5.089 4.988 2.438
219 HD2 LYS 459 HD2 LYS 459 3.552 6.033 4.016
220 HD3 LYS 459 HD1 LYS 459 4.186 7.223 2.878
221 HE2 LYS 459 HE2 LYS 459 2.154 7.205 1.620
222 HE3 LYS 459 HE1 LYS 459 1.535 5.834 2.536
223 HZ1 LYS 459 HZ1 LYS 459 0.519 7.867 3.285
224 HZ2 LYS 459 HZ2 LYS 459 2.036 8.564 3.601
225 HZ3 LYS 459 HZ3 LYS 459 1.502 7.236 4.516
226 HA PRO 460 HA PRO 460 3.755 4.611 -4.485
227 HB2 PRO 460 HB2 PRO 460 0.868 4.070 -4.214
228 HB3 PRO 460 HB1 PRO 460 2.059 3.303 -5.268
229 HG2 PRO 460 HG2 PRO 460 1.038 2.018 -3.157
230 HG3 PRO 460 HG1 PRO 460 2.731 1.805 -3.644
231 HD2 PRO 460 HD2 PRO 460 1.588 3.452 -1.422
232 HD3 PRO 460 HD1 PRO 460 3.042 2.428 -1.446
233 H GLN 461 HN GLN 461 3.295 6.435 -5.578
234 HA GLN 461 HA GLN 461 2.375 8.695 -4.103
235 HB2 GLN 461 HB2 GLN 461 3.039 8.425 -7.041
236 HB3 GLN 461 HB1 GLN 461 2.808 9.944 -6.184
237 HG2 GLN 461 HG2 GLN 461 4.926 7.937 -5.452
238 HG3 GLN 461 HG1 GLN 461 5.190 9.268 -6.577
239 HE21 GLN 461 HE21 GLN 461 6.781 10.137 -5.224
240 HE22 GLN 461 HE22 GLN 461 6.381 10.968 -3.762
241 H GLU 462 HN GLU 462 0.797 6.344 -5.963
242 HA GLU 462 HA GLU 462 -1.375 7.843 -6.966
243 HB2 GLU 462 HB2 GLU 462 -1.092 4.927 -6.251
244 HB3 GLU 462 HB1 GLU 462 -2.571 5.594 -6.921
245 HG2 GLU 462 HG2 GLU 462 -1.554 4.768 -8.779
246 HG3 GLU 462 HG1 GLU 462 -1.022 6.446 -8.818
247 H LEU 463 HN LEU 463 -0.528 7.044 -3.794
248 HA LEU 463 HA LEU 463 -3.303 7.419 -2.880
249 HB2 LEU 463 HB2 LEU 463 -2.141 5.275 -2.275
250 HB3 LEU 463 HB1 LEU 463 -0.992 6.222 -1.349
251 HG LEU 463 HG LEU 463 -2.833 7.015 0.095
252 HD11 LEU 463 HD11 LEU 463 -4.511 5.063 -1.473
253 HD12 LEU 463 HD12 LEU 463 -4.661 6.820 -1.505
254 HD13 LEU 463 HD13 LEU 463 -5.013 5.932 -0.023
255 HD21 LEU 463 HD21 LEU 463 -3.194 4.895 1.268
256 HD22 LEU 463 HD22 LEU 463 -1.516 5.094 0.766
257 HD23 LEU 463 HD23 LEU 463 -2.585 4.021 -0.138
258 H LYS 464 HN LYS 464 -0.722 9.185 -3.488
259 HA LYS 464 HA LYS 464 -0.228 10.516 -1.013
260 HB2 LYS 464 HB2 LYS 464 1.413 10.419 -2.884
261 HB3 LYS 464 HB1 LYS 464 0.360 11.470 -3.822
262 HG2 LYS 464 HG2 LYS 464 0.600 13.203 -2.079
263 HG3 LYS 464 HG1 LYS 464 1.738 12.153 -1.234
264 HD2 LYS 464 HD2 LYS 464 3.196 12.172 -3.214
265 HD3 LYS 464 HD1 LYS 464 2.062 13.260 -4.020
266 HE2 LYS 464 HE2 LYS 464 3.584 13.835 -1.479
267 HE3 LYS 464 HE1 LYS 464 3.937 14.499 -3.074
268 HZ1 LYS 464 HZ1 LYS 464 1.507 14.990 -1.437
269 HZ2 LYS 464 HZ2 LYS 464 1.695 15.519 -3.036
270 HZ3 LYS 464 HZ3 LYS 464 2.723 16.110 -1.821
Start of MODEL 17
1 H ALA 431 HN ALA 431 -10.721 5.239 -10.900
2 HA ALA 431 HA ALA 431 -9.777 7.883 -10.094
3 HB1 ALA 431 HB1 ALA 431 -12.136 7.662 -10.708
4 HB2 ALA 431 HB2 ALA 431 -11.959 8.119 -9.013
5 HB3 ALA 431 HB3 ALA 431 -12.355 6.455 -9.441
6 H VAL 432 HN VAL 432 -10.915 4.883 -8.570
7 HA VAL 432 HA VAL 432 -9.751 5.646 -6.034
8 HB VAL 432 HB VAL 432 -11.115 3.070 -6.842
9 HG11 VAL 432 HG11 VAL 432 -9.645 2.761 -4.921
10 HG12 VAL 432 HG12 VAL 432 -11.337 2.664 -4.433
11 HG13 VAL 432 HG13 VAL 432 -10.406 4.127 -4.105
12 HG21 VAL 432 HG21 VAL 432 -12.189 5.464 -5.361
13 HG22 VAL 432 HG22 VAL 432 -13.056 3.955 -5.645
14 HG23 VAL 432 HG23 VAL 432 -12.606 4.985 -7.006
15 H SER 433 HN SER 433 -7.794 5.126 -5.377
16 HA SER 433 HA SER 433 -6.424 2.861 -6.689
17 HB2 SER 433 HB2 SER 433 -5.091 5.315 -5.512
18 HB3 SER 433 HB1 SER 433 -4.320 4.016 -6.426
19 HG SER 433 HG SER 433 -6.432 5.251 -7.702
20 H GLU 434 HN GLU 434 -6.504 1.231 -5.292
21 HA GLU 434 HA GLU 434 -6.676 1.823 -2.440
22 HB2 GLU 434 HB2 GLU 434 -7.425 -0.548 -2.287
23 HB3 GLU 434 HB1 GLU 434 -8.478 0.498 -3.228
24 HG2 GLU 434 HG2 GLU 434 -7.469 -0.371 -5.291
25 HG3 GLU 434 HG1 GLU 434 -6.464 -1.453 -4.330
26 H TRP 435 HN TRP 435 -5.148 1.357 -1.058
27 HA TRP 435 HA TRP 435 -3.196 -0.743 -1.646
28 HB2 TRP 435 HB2 TRP 435 -2.393 1.992 -0.616
29 HB3 TRP 435 HB1 TRP 435 -1.320 0.651 -1.001
30 HD1 TRP 435 HD1 TRP 435 -3.521 3.294 -2.720
31 HE1 TRP 435 HE1 TRP 435 -2.721 3.577 -5.144
32 HE3 TRP 435 HE3 TRP 435 -0.114 -0.503 -2.890
33 HZ2 TRP 435 HZ2 TRP 435 -0.916 2.350 -6.891
34 HZ3 TRP 435 HZ3 TRP 435 1.075 -0.917 -5.011
35 HH2 TRP 435 HH2 TRP 435 0.682 0.481 -6.968
36 H THR 436 HN THR 436 -3.361 -2.117 0.031
37 HA THR 436 HA THR 436 -4.438 -1.147 2.554
38 HB THR 436 HB THR 436 -3.753 -3.974 1.718
39 HG1 THR 436 HG1 THR 436 -6.284 -2.645 1.780
40 HG21 THR 436 HG21 THR 436 -5.432 -2.936 4.009
41 HG22 THR 436 HG22 THR 436 -3.843 -3.686 4.149
42 HG23 THR 436 HG23 THR 436 -5.217 -4.631 3.578
43 H GLU 437 HN GLU 437 -3.128 -0.472 4.108
44 HA GLU 437 HA GLU 437 -0.314 -1.207 4.020
45 HB2 GLU 437 HB2 GLU 437 -0.084 0.488 5.842
46 HB3 GLU 437 HB1 GLU 437 -0.724 1.126 4.336
47 HG2 GLU 437 HG2 GLU 437 -2.933 1.201 5.223
48 HG3 GLU 437 HG1 GLU 437 -2.434 0.336 6.676
49 H TYR 438 HN TYR 438 0.516 -2.762 5.204
50 HA TYR 438 HA TYR 438 -0.830 -3.478 7.724
51 HB2 TYR 438 HB2 TYR 438 1.085 -5.089 6.020
52 HB3 TYR 438 HB1 TYR 438 0.494 -5.595 7.597
53 HD1 TYR 438 HD2 TYR 438 -1.836 -6.289 7.890
54 HD2 TYR 438 HD1 TYR 438 -0.322 -5.210 4.061
55 HE1 TYR 438 HE2 TYR 438 -3.775 -7.361 6.825
56 HE2 TYR 438 HE1 TYR 438 -2.258 -6.283 2.990
57 HH TYR 438 HH TYR 438 -3.907 -8.000 3.471
58 H LYS 439 HN LYS 439 0.092 -2.345 9.343
59 HA LYS 439 HA LYS 439 2.952 -1.857 9.252
60 HB2 LYS 439 HB2 LYS 439 2.579 -0.562 11.357
61 HB3 LYS 439 HB1 LYS 439 1.695 0.037 9.964
62 HG2 LYS 439 HG2 LYS 439 -0.350 -0.961 10.779
63 HG3 LYS 439 HG1 LYS 439 0.516 -1.673 12.142
64 HD2 LYS 439 HD2 LYS 439 -0.706 0.383 12.762
65 HD3 LYS 439 HD1 LYS 439 1.035 0.521 13.013
66 HE2 LYS 439 HE2 LYS 439 0.135 2.552 12.012
67 HE3 LYS 439 HE1 LYS 439 1.244 1.743 10.908
68 HZ1 LYS 439 HZ1 LYS 439 -0.697 2.493 9.728
69 HZ2 LYS 439 HZ2 LYS 439 -1.722 1.669 10.790
70 HZ3 LYS 439 HZ3 LYS 439 -0.699 0.796 9.763
71 H THR 440 HN THR 440 4.181 -3.488 9.799
72 HA THR 440 HA THR 440 3.319 -5.285 11.925
73 HB THR 440 HB THR 440 4.144 -6.418 9.959
74 HG1 THR 440 HG1 THR 440 5.645 -7.725 10.961
75 HG21 THR 440 HG21 THR 440 5.555 -4.563 9.103
76 HG22 THR 440 HG22 THR 440 6.366 -6.127 9.062
77 HG23 THR 440 HG23 THR 440 6.764 -4.957 10.323
78 H ALA 441 HN ALA 441 4.431 -5.571 13.819
79 HA ALA 441 HA ALA 441 5.772 -3.310 14.877
80 HB1 ALA 441 HB1 ALA 441 5.593 -6.103 16.003
81 HB2 ALA 441 HB2 ALA 441 4.417 -4.811 16.250
82 HB3 ALA 441 HB3 ALA 441 6.052 -4.650 16.892
83 H ASP 442 HN ASP 442 6.844 -5.612 12.815
84 HA ASP 442 HA ASP 442 9.522 -6.011 13.641
85 HB2 ASP 442 HB2 ASP 442 8.173 -7.272 11.852
86 HB3 ASP 442 HB1 ASP 442 8.563 -5.931 10.783
87 H GLY 443 HN GLY 443 7.889 -3.249 12.746
88 HA2 GLY 443 HA2 GLY 443 8.812 -1.108 12.969
89 HA3 GLY 443 HA1 GLY 443 10.405 -1.781 12.668
90 H LYS 444 HN LYS 444 7.679 -2.514 10.619
91 HA LYS 444 HA LYS 444 8.386 -0.411 8.755
92 HB2 LYS 444 HB2 LYS 444 8.527 -2.202 6.869
93 HB3 LYS 444 HB1 LYS 444 9.942 -1.791 7.820
94 HG2 LYS 444 HG2 LYS 444 9.722 -3.801 9.117
95 HG3 LYS 444 HG1 LYS 444 8.185 -4.186 8.328
96 HD2 LYS 444 HD2 LYS 444 9.227 -4.572 6.254
97 HD3 LYS 444 HD1 LYS 444 10.721 -3.794 6.769
98 HE2 LYS 444 HE2 LYS 444 10.920 -6.230 6.627
99 HE3 LYS 444 HE1 LYS 444 11.208 -5.626 8.255
100 HZ1 LYS 444 HZ1 LYS 444 9.821 -7.666 8.105
101 HZ2 LYS 444 HZ2 LYS 444 8.603 -6.744 7.368
102 HZ3 LYS 444 HZ3 LYS 444 9.100 -6.394 8.948
103 H THR 445 HN THR 445 6.775 0.256 7.527
104 HA THR 445 HA THR 445 4.211 -1.145 7.702
105 HB THR 445 HB THR 445 3.337 1.010 6.670
106 HG1 THR 445 HG1 THR 445 5.515 1.649 5.951
107 HG21 THR 445 HG21 THR 445 3.478 2.288 8.779
108 HG22 THR 445 HG22 THR 445 4.717 1.166 9.353
109 HG23 THR 445 HG23 THR 445 3.079 0.591 9.045
110 H TYR 446 HN TYR 446 3.884 -2.565 6.057
111 HA TYR 446 HA TYR 446 4.885 -1.769 3.412
112 HB2 TYR 446 HB2 TYR 446 4.899 -4.150 2.807
113 HB3 TYR 446 HB1 TYR 446 5.933 -3.813 4.186
114 HD1 TYR 446 HD1 TYR 446 5.269 -4.583 6.446
115 HD2 TYR 446 HD2 TYR 446 3.019 -5.605 2.985
116 HE1 TYR 446 HE1 TYR 446 4.188 -6.408 7.691
117 HE2 TYR 446 HE2 TYR 446 1.935 -7.430 4.218
118 HH TYR 446 HH TYR 446 2.432 -8.860 6.174
119 H TYR 447 HN TYR 447 3.549 -1.441 1.826
120 HA TYR 447 HA TYR 447 0.687 -1.791 2.294
121 HB2 TYR 447 HB2 TYR 447 2.254 -0.153 0.288
122 HB3 TYR 447 HB1 TYR 447 0.504 -0.324 0.228
123 HD1 TYR 447 HD2 TYR 447 3.143 0.579 2.741
124 HD2 TYR 447 HD1 TYR 447 -0.734 1.369 1.171
125 HE1 TYR 447 HE2 TYR 447 2.893 2.453 4.316
126 HE2 TYR 447 HE1 TYR 447 -0.993 3.242 2.740
127 HH TYR 447 HH TYR 447 -0.053 3.897 4.987
128 H TYR 448 HN TYR 448 -0.265 -3.510 1.502
129 HA TYR 448 HA TYR 448 0.990 -4.963 -0.716
130 HB2 TYR 448 HB2 TYR 448 0.474 -6.201 1.386
131 HB3 TYR 448 HB1 TYR 448 -1.230 -5.832 1.150
132 HD1 TYR 448 HD1 TYR 448 1.631 -7.756 -0.149
133 HD2 TYR 448 HD2 TYR 448 -2.561 -7.070 -0.423
134 HE1 TYR 448 HE1 TYR 448 1.391 -9.792 -1.507
135 HE2 TYR 448 HE2 TYR 448 -2.809 -9.106 -1.779
136 HH TYR 448 HH TYR 448 -0.466 -11.457 -2.001
137 H ASN 449 HN ASN 449 0.104 -4.938 -2.683
138 HA ASN 449 HA ASN 449 -2.660 -3.937 -2.927
139 HB2 ASN 449 HB2 ASN 449 -2.049 -2.836 -5.008
140 HB3 ASN 449 HB1 ASN 449 -1.024 -2.259 -3.703
141 HD21 ASN 449 HD21 ASN 449 -0.568 -2.241 -6.589
142 HD22 ASN 449 HD22 ASN 449 0.905 -3.115 -6.850
143 H ASN 450 HN ASN 450 -3.995 -4.932 -4.326
144 HA ASN 450 HA ASN 450 -3.196 -7.483 -5.411
145 HB2 ASN 450 HB2 ASN 450 -5.576 -7.569 -6.213
146 HB3 ASN 450 HB1 ASN 450 -5.405 -7.375 -4.472
147 HD21 ASN 450 HD21 ASN 450 -6.149 -5.551 -3.504
148 HD22 ASN 450 HD22 ASN 450 -7.058 -4.321 -4.326
149 H ARG 451 HN ARG 451 -2.664 -4.440 -6.417
150 HA ARG 451 HA ARG 451 -3.330 -4.685 -9.175
151 HB2 ARG 451 HB2 ARG 451 -1.755 -2.711 -7.602
152 HB3 ARG 451 HB1 ARG 451 -1.606 -2.733 -9.357
153 HG2 ARG 451 HG2 ARG 451 -4.083 -2.519 -9.499
154 HG3 ARG 451 HG1 ARG 451 -4.110 -2.299 -7.746
155 HD2 ARG 451 HD2 ARG 451 -2.809 -0.306 -7.906
156 HD3 ARG 451 HD1 ARG 451 -2.498 -0.580 -9.621
157 HE ARG 451 HE ARG 451 -5.239 -0.438 -9.387
158 HH11 ARG 451 HH11 ARG 451 -2.515 1.656 -8.718
159 HH12 ARG 451 HH12 ARG 451 -3.412 3.119 -8.999
160 HH21 ARG 451 HH21 ARG 451 -6.419 1.492 -9.759
161 HH22 ARG 451 HH22 ARG 451 -5.625 3.025 -9.578
162 H THR 452 HN THR 452 -0.302 -4.994 -7.349
163 HA THR 452 HA THR 452 0.752 -6.491 -9.649
164 HB THR 452 HB THR 452 3.011 -5.992 -8.399
165 HG1 THR 452 HG1 THR 452 2.976 -4.284 -7.081
166 HG21 THR 452 HG21 THR 452 3.278 -3.972 -9.758
167 HG22 THR 452 HG22 THR 452 1.533 -3.906 -10.005
168 HG23 THR 452 HG23 THR 452 2.466 -5.251 -10.661
169 H LEU 453 HN LEU 453 -0.604 -7.082 -6.737
170 HA LEU 453 HA LEU 453 -0.552 -8.726 -5.183
171 HB2 LEU 453 HB2 LEU 453 0.747 -10.154 -7.498
172 HB3 LEU 453 HB1 LEU 453 0.421 -10.952 -5.974
173 HG LEU 453 HG LEU 453 -2.022 -10.312 -6.323
174 HD11 LEU 453 HD11 LEU 453 -1.013 -9.795 -9.113
175 HD12 LEU 453 HD12 LEU 453 -1.736 -8.614 -8.020
176 HD13 LEU 453 HD13 LEU 453 -2.708 -9.945 -8.649
177 HD21 LEU 453 HD21 LEU 453 -2.425 -12.222 -7.780
178 HD22 LEU 453 HD22 LEU 453 -1.161 -12.580 -6.602
179 HD23 LEU 453 HD23 LEU 453 -0.732 -12.213 -8.272
180 H GLU 454 HN GLU 454 1.239 -6.885 -4.630
181 HA GLU 454 HA GLU 454 3.560 -8.370 -3.661
182 HB2 GLU 454 HB2 GLU 454 4.193 -7.458 -5.880
183 HB3 GLU 454 HB1 GLU 454 3.817 -5.843 -5.299
184 HG2 GLU 454 HG2 GLU 454 6.212 -6.293 -5.276
185 HG3 GLU 454 HG1 GLU 454 5.586 -5.980 -3.657
186 H SER 455 HN SER 455 4.561 -7.446 -1.883
187 HA SER 455 HA SER 455 3.083 -5.274 -0.589
188 HB2 SER 455 HB2 SER 455 4.468 -5.994 1.421
189 HB3 SER 455 HB1 SER 455 3.314 -7.188 0.825
190 HG SER 455 HG SER 455 5.922 -7.214 -0.193
191 H THR 456 HN THR 456 3.873 -3.312 -1.099
192 HA THR 456 HA THR 456 6.765 -3.045 -1.491
193 HB THR 456 HB THR 456 5.404 -2.171 -3.321
194 HG1 THR 456 HG1 THR 456 7.362 -1.077 -2.809
195 HG21 THR 456 HG21 THR 456 3.379 -1.600 -2.050
196 HG22 THR 456 HG22 THR 456 3.937 -0.241 -3.025
197 HG23 THR 456 HG23 THR 456 4.239 -0.262 -1.288
198 H PHE 457 HN PHE 457 8.009 -1.711 -0.249
199 HA PHE 457 HA PHE 457 6.795 -0.929 2.291
200 HB2 PHE 457 HB2 PHE 457 9.699 -1.115 1.455
201 HB3 PHE 457 HB1 PHE 457 9.141 -0.679 3.067
202 HD1 PHE 457 HD2 PHE 457 9.461 -3.390 0.624
203 HD2 PHE 457 HD1 PHE 457 8.272 -2.343 4.578
204 HE1 PHE 457 HE2 PHE 457 9.401 -5.775 1.232
205 HE2 PHE 457 HE1 PHE 457 8.216 -4.733 5.195
206 HZ PHE 457 HZ PHE 457 8.780 -6.445 3.514
207 H GLU 458 HN GLU 458 7.257 0.448 -0.611
208 HA GLU 458 HA GLU 458 7.897 3.106 0.408
209 HB2 GLU 458 HB2 GLU 458 7.390 2.059 -2.381
210 HB3 GLU 458 HB1 GLU 458 7.568 3.769 -2.022
211 HG2 GLU 458 HG2 GLU 458 9.660 3.044 -2.797
212 HG3 GLU 458 HG1 GLU 458 9.824 3.210 -1.052
213 H LYS 459 HN LYS 459 6.396 4.652 0.731
214 HA LYS 459 HA LYS 459 3.661 3.793 0.932
215 HB2 LYS 459 HB2 LYS 459 4.965 6.456 1.509
216 HB3 LYS 459 HB1 LYS 459 3.309 6.030 1.927
217 HG2 LYS 459 HG2 LYS 459 3.991 4.463 3.523
218 HG3 LYS 459 HG1 LYS 459 5.639 4.412 2.897
219 HD2 LYS 459 HD2 LYS 459 5.995 6.713 3.662
220 HD3 LYS 459 HD1 LYS 459 4.346 6.757 4.291
221 HE2 LYS 459 HE2 LYS 459 4.831 5.055 5.890
222 HE3 LYS 459 HE1 LYS 459 6.406 4.743 5.163
223 HZ1 LYS 459 HZ1 LYS 459 5.633 7.304 6.455
224 HZ2 LYS 459 HZ2 LYS 459 7.172 6.880 5.881
225 HZ3 LYS 459 HZ3 LYS 459 6.513 6.068 7.216
226 HA PRO 460 HA PRO 460 2.841 5.111 -3.303
227 HB2 PRO 460 HB2 PRO 460 0.082 4.365 -2.554
228 HB3 PRO 460 HB1 PRO 460 1.078 3.785 -3.890
229 HG2 PRO 460 HG2 PRO 460 0.562 2.240 -1.772
230 HG3 PRO 460 HG1 PRO 460 2.138 2.197 -2.586
231 HD2 PRO 460 HD2 PRO 460 1.363 3.532 -0.023
232 HD3 PRO 460 HD1 PRO 460 2.848 2.650 -0.440
233 H GLN 461 HN GLN 461 2.505 7.141 -3.890
234 HA GLN 461 HA GLN 461 1.109 8.959 -2.126
235 HB2 GLN 461 HB2 GLN 461 3.289 9.496 -3.288
236 HB3 GLN 461 HB1 GLN 461 2.387 9.568 -4.796
237 HG2 GLN 461 HG2 GLN 461 2.742 11.789 -3.903
238 HG3 GLN 461 HG1 GLN 461 1.026 11.388 -3.896
239 HE21 GLN 461 HE21 GLN 461 3.839 11.992 -1.965
240 HE22 GLN 461 HE22 GLN 461 3.020 12.086 -0.438
241 H GLU 462 HN GLU 462 0.165 6.906 -4.531
242 HA GLU 462 HA GLU 462 -1.834 8.706 -5.664
243 HB2 GLU 462 HB2 GLU 462 -2.314 6.791 -7.198
244 HB3 GLU 462 HB1 GLU 462 -0.681 7.440 -7.320
245 HG2 GLU 462 HG2 GLU 462 0.130 5.562 -5.951
246 HG3 GLU 462 HG1 GLU 462 -1.513 4.924 -5.889
247 H LEU 463 HN LEU 463 -1.642 6.834 -3.019
248 HA LEU 463 HA LEU 463 -3.913 5.186 -3.108
249 HB2 LEU 463 HB2 LEU 463 -2.008 5.147 -1.447
250 HB3 LEU 463 HB1 LEU 463 -2.763 6.519 -0.654
251 HG LEU 463 HG LEU 463 -4.145 3.854 -1.004
252 HD11 LEU 463 HD11 LEU 463 -2.114 3.531 0.287
253 HD12 LEU 463 HD12 LEU 463 -3.536 3.405 1.322
254 HD13 LEU 463 HD13 LEU 463 -2.554 4.871 1.346
255 HD21 LEU 463 HD21 LEU 463 -4.681 6.170 0.861
256 HD22 LEU 463 HD22 LEU 463 -5.572 4.648 0.812
257 HD23 LEU 463 HD23 LEU 463 -5.634 5.751 -0.563
258 H LYS 464 HN LYS 464 -5.980 5.699 -3.225
259 HA LYS 464 HA LYS 464 -7.179 7.805 -1.748
260 HB2 LYS 464 HB2 LYS 464 -7.981 9.133 -3.707
261 HB3 LYS 464 HB1 LYS 464 -6.253 9.264 -3.421
262 HG2 LYS 464 HG2 LYS 464 -5.860 7.624 -5.224
263 HG3 LYS 464 HG1 LYS 464 -7.596 7.590 -5.534
264 HD2 LYS 464 HD2 LYS 464 -7.552 9.983 -6.035
265 HD3 LYS 464 HD1 LYS 464 -5.812 10.014 -5.733
266 HE2 LYS 464 HE2 LYS 464 -7.197 8.375 -7.852
267 HE3 LYS 464 HE1 LYS 464 -6.347 9.896 -8.130
268 HZ1 LYS 464 HZ1 LYS 464 -4.294 8.909 -7.646
269 HZ2 LYS 464 HZ2 LYS 464 -5.093 7.758 -8.601
270 HZ3 LYS 464 HZ3 LYS 464 -5.000 7.550 -6.923
Start of MODEL 18
1 H ALA 431 HN ALA 431 -10.386 7.865 -4.685
2 HA ALA 431 HA ALA 431 -7.884 6.992 -5.950
3 HB1 ALA 431 HB1 ALA 431 -7.416 5.792 -3.880
4 HB2 ALA 431 HB2 ALA 431 -8.961 6.317 -3.210
5 HB3 ALA 431 HB3 ALA 431 -7.700 7.501 -3.556
6 H VAL 432 HN VAL 432 -8.393 5.592 -7.514
7 HA VAL 432 HA VAL 432 -10.669 3.844 -7.320
8 HB VAL 432 HB VAL 432 -8.457 3.827 -9.385
9 HG11 VAL 432 HG11 VAL 432 -10.102 2.686 -10.798
10 HG12 VAL 432 HG12 VAL 432 -11.248 2.681 -9.458
11 HG13 VAL 432 HG13 VAL 432 -9.748 1.761 -9.338
12 HG21 VAL 432 HG21 VAL 432 -11.124 5.237 -9.428
13 HG22 VAL 432 HG22 VAL 432 -9.986 5.148 -10.772
14 HG23 VAL 432 HG23 VAL 432 -9.543 6.006 -9.296
15 H SER 433 HN SER 433 -7.143 3.385 -7.446
16 HA SER 433 HA SER 433 -7.354 0.581 -6.850
17 HB2 SER 433 HB2 SER 433 -4.896 2.347 -6.801
18 HB3 SER 433 HB1 SER 433 -4.933 0.586 -6.903
19 HG SER 433 HG SER 433 -5.927 2.416 -8.843
20 H GLU 434 HN GLU 434 -7.608 -0.250 -4.871
21 HA GLU 434 HA GLU 434 -7.060 1.412 -2.536
22 HB2 GLU 434 HB2 GLU 434 -9.219 0.253 -2.618
23 HB3 GLU 434 HB1 GLU 434 -8.398 -1.296 -2.761
24 HG2 GLU 434 HG2 GLU 434 -9.218 -0.908 -0.499
25 HG3 GLU 434 HG1 GLU 434 -7.460 -1.036 -0.542
26 H TRP 435 HN TRP 435 -5.324 1.164 -1.311
27 HA TRP 435 HA TRP 435 -3.593 -1.176 -1.781
28 HB2 TRP 435 HB2 TRP 435 -2.761 1.554 -0.768
29 HB3 TRP 435 HB1 TRP 435 -1.697 0.225 -1.203
30 HD1 TRP 435 HD1 TRP 435 -4.300 2.501 -2.972
31 HE1 TRP 435 HE1 TRP 435 -3.475 2.938 -5.366
32 HE3 TRP 435 HE3 TRP 435 -0.072 -0.359 -2.894
33 HZ2 TRP 435 HZ2 TRP 435 -1.308 2.168 -7.008
34 HZ3 TRP 435 HZ3 TRP 435 1.315 -0.458 -4.924
35 HH2 TRP 435 HH2 TRP 435 0.716 0.787 -6.932
36 H THR 436 HN THR 436 -3.514 -2.548 -0.093
37 HA THR 436 HA THR 436 -4.760 -1.686 2.388
38 HB THR 436 HB THR 436 -3.773 -4.468 1.802
39 HG1 THR 436 HG1 THR 436 -6.079 -3.127 0.824
40 HG21 THR 436 HG21 THR 436 -4.549 -3.975 4.080
41 HG22 THR 436 HG22 THR 436 -5.629 -5.104 3.264
42 HG23 THR 436 HG23 THR 436 -6.089 -3.410 3.430
43 H GLU 437 HN GLU 437 -3.491 -0.772 3.840
44 HA GLU 437 HA GLU 437 -0.667 -1.441 3.957
45 HB2 GLU 437 HB2 GLU 437 -0.544 0.540 5.477
46 HB3 GLU 437 HB1 GLU 437 -1.157 0.901 3.871
47 HG2 GLU 437 HG2 GLU 437 -3.435 0.930 4.724
48 HG3 GLU 437 HG1 GLU 437 -2.847 0.526 6.336
49 H TYR 438 HN TYR 438 0.151 -2.769 5.420
50 HA TYR 438 HA TYR 438 -1.235 -3.013 8.012
51 HB2 TYR 438 HB2 TYR 438 0.315 -5.129 6.506
52 HB3 TYR 438 HB1 TYR 438 -0.258 -5.308 8.158
53 HD1 TYR 438 HD2 TYR 438 -2.809 -5.107 8.526
54 HD2 TYR 438 HD1 TYR 438 -1.026 -5.787 4.723
55 HE1 TYR 438 HE2 TYR 438 -4.935 -6.015 7.698
56 HE2 TYR 438 HE1 TYR 438 -3.152 -6.694 3.881
57 HH TYR 438 HH TYR 438 -6.093 -6.349 5.572
58 H LYS 439 HN LYS 439 -0.030 -2.480 9.747
59 HA LYS 439 HA LYS 439 2.824 -2.018 9.269
60 HB2 LYS 439 HB2 LYS 439 2.723 -0.655 11.382
61 HB3 LYS 439 HB1 LYS 439 1.814 -0.019 10.022
62 HG2 LYS 439 HG2 LYS 439 -0.248 -0.983 11.033
63 HG3 LYS 439 HG1 LYS 439 0.718 -1.432 12.443
64 HD2 LYS 439 HD2 LYS 439 1.344 0.931 12.737
65 HD3 LYS 439 HD1 LYS 439 0.321 1.359 11.366
66 HE2 LYS 439 HE2 LYS 439 -0.849 1.799 13.439
67 HE3 LYS 439 HE1 LYS 439 -1.633 0.476 12.576
68 HZ1 LYS 439 HZ1 LYS 439 -0.822 -1.080 14.071
69 HZ2 LYS 439 HZ2 LYS 439 -1.242 0.225 15.068
70 HZ3 LYS 439 HZ3 LYS 439 0.382 -0.047 14.668
71 H THR 440 HN THR 440 4.191 -3.453 9.933
72 HA THR 440 HA THR 440 3.383 -5.436 11.899
73 HB THR 440 HB THR 440 4.442 -6.369 9.969
74 HG1 THR 440 HG1 THR 440 5.615 -7.686 11.142
75 HG21 THR 440 HG21 THR 440 5.638 -4.392 9.182
76 HG22 THR 440 HG22 THR 440 6.723 -5.782 9.277
77 HG23 THR 440 HG23 THR 440 6.773 -4.534 10.524
78 H ALA 441 HN ALA 441 4.591 -5.919 13.746
79 HA ALA 441 HA ALA 441 5.368 -3.714 15.291
80 HB1 ALA 441 HB1 ALA 441 6.079 -5.357 16.953
81 HB2 ALA 441 HB2 ALA 441 5.974 -6.635 15.741
82 HB3 ALA 441 HB3 ALA 441 4.518 -5.784 16.251
83 H ASP 442 HN ASP 442 7.094 -5.342 12.904
84 HA ASP 442 HA ASP 442 9.747 -4.972 13.861
85 HB2 ASP 442 HB2 ASP 442 9.112 -6.535 12.016
86 HB3 ASP 442 HB1 ASP 442 8.770 -5.143 10.997
87 H GLY 443 HN GLY 443 7.352 -2.825 12.853
88 HA2 GLY 443 HA2 GLY 443 7.531 -0.495 13.139
89 HA3 GLY 443 HA1 GLY 443 9.280 -0.640 13.024
90 H LYS 444 HN LYS 444 6.943 -2.000 10.791
91 HA LYS 444 HA LYS 444 7.711 -0.049 8.750
92 HB2 LYS 444 HB2 LYS 444 8.402 -2.967 8.696
93 HB3 LYS 444 HB1 LYS 444 8.117 -2.106 7.190
94 HG2 LYS 444 HG2 LYS 444 10.063 -0.991 7.305
95 HG3 LYS 444 HG1 LYS 444 9.952 -0.768 9.051
96 HD2 LYS 444 HD2 LYS 444 11.855 -2.175 8.450
97 HD3 LYS 444 HD1 LYS 444 10.670 -3.069 9.401
98 HE2 LYS 444 HE2 LYS 444 9.762 -3.999 7.282
99 HE3 LYS 444 HE1 LYS 444 11.074 -3.200 6.417
100 HZ1 LYS 444 HZ1 LYS 444 11.470 -5.178 8.598
101 HZ2 LYS 444 HZ2 LYS 444 12.669 -4.499 7.610
102 HZ3 LYS 444 HZ3 LYS 444 11.528 -5.555 6.942
103 H THR 445 HN THR 445 6.137 0.394 7.346
104 HA THR 445 HA THR 445 3.644 -1.116 7.537
105 HB THR 445 HB THR 445 2.813 0.878 6.112
106 HG1 THR 445 HG1 THR 445 4.766 1.804 5.548
107 HG21 THR 445 HG21 THR 445 2.499 2.258 8.114
108 HG22 THR 445 HG22 THR 445 3.734 1.323 8.957
109 HG23 THR 445 HG23 THR 445 2.224 0.553 8.465
110 H TYR 446 HN TYR 446 3.223 -2.615 6.034
111 HA TYR 446 HA TYR 446 4.394 -2.200 3.366
112 HB2 TYR 446 HB2 TYR 446 4.183 -4.646 3.025
113 HB3 TYR 446 HB1 TYR 446 5.260 -4.229 4.347
114 HD1 TYR 446 HD1 TYR 446 4.568 -4.656 6.684
115 HD2 TYR 446 HD2 TYR 446 2.178 -5.911 3.396
116 HE1 TYR 446 HE1 TYR 446 3.339 -6.181 8.167
117 HE2 TYR 446 HE2 TYR 446 0.937 -7.437 4.874
118 HH TYR 446 HH TYR 446 1.268 -7.341 8.313
119 H TYR 447 HN TYR 447 3.106 -1.755 1.787
120 HA TYR 447 HA TYR 447 0.212 -2.029 2.119
121 HB2 TYR 447 HB2 TYR 447 1.869 -0.595 0.023
122 HB3 TYR 447 HB1 TYR 447 0.114 -0.634 0.046
123 HD1 TYR 447 HD2 TYR 447 2.975 0.326 2.261
124 HD2 TYR 447 HD1 TYR 447 -1.000 1.148 0.989
125 HE1 TYR 447 HE2 TYR 447 2.963 2.361 3.639
126 HE2 TYR 447 HE1 TYR 447 -1.019 3.193 2.355
127 HH TYR 447 HH TYR 447 0.126 4.138 4.297
128 H TYR 448 HN TYR 448 -0.692 -3.872 1.339
129 HA TYR 448 HA TYR 448 0.678 -5.294 -0.808
130 HB2 TYR 448 HB2 TYR 448 -0.198 -6.682 1.006
131 HB3 TYR 448 HB1 TYR 448 -1.818 -6.039 0.743
132 HD1 TYR 448 HD1 TYR 448 0.882 -7.972 -0.941
133 HD2 TYR 448 HD2 TYR 448 -3.274 -7.085 -0.760
134 HE1 TYR 448 HE1 TYR 448 0.442 -9.731 -2.602
135 HE2 TYR 448 HE2 TYR 448 -3.728 -8.841 -2.417
136 HH TYR 448 HH TYR 448 -1.349 -11.136 -3.380
137 H ASN 449 HN ASN 449 0.244 -4.904 -2.839
138 HA ASN 449 HA ASN 449 -2.375 -3.735 -3.478
139 HB2 ASN 449 HB2 ASN 449 -1.365 -2.581 -5.328
140 HB3 ASN 449 HB1 ASN 449 -0.444 -2.228 -3.879
141 HD21 ASN 449 HD21 ASN 449 0.372 -1.956 -6.592
142 HD22 ASN 449 HD22 ASN 449 1.745 -2.984 -6.838
143 H ASN 450 HN ASN 450 -3.634 -4.674 -4.905
144 HA ASN 450 HA ASN 450 -2.990 -7.233 -6.006
145 HB2 ASN 450 HB2 ASN 450 -5.194 -7.095 -7.077
146 HB3 ASN 450 HB1 ASN 450 -5.300 -6.649 -5.378
147 HD21 ASN 450 HD21 ASN 450 -7.069 -6.023 -7.605
148 HD22 ASN 450 HD22 ASN 450 -7.168 -4.294 -7.659
149 H ARG 451 HN ARG 451 -2.221 -4.114 -6.881
150 HA ARG 451 HA ARG 451 -2.312 -4.315 -9.706
151 HB2 ARG 451 HB2 ARG 451 -2.252 -2.146 -8.621
152 HB3 ARG 451 HB1 ARG 451 -0.680 -2.512 -7.925
153 HG2 ARG 451 HG2 ARG 451 0.290 -2.588 -10.174
154 HG3 ARG 451 HG1 ARG 451 -1.289 -2.195 -10.858
155 HD2 ARG 451 HD2 ARG 451 0.260 -0.462 -8.935
156 HD3 ARG 451 HD1 ARG 451 0.203 -0.235 -10.680
157 HE ARG 451 HE ARG 451 -2.426 -0.279 -9.642
158 HH11 ARG 451 HH11 ARG 451 0.419 1.773 -9.729
159 HH12 ARG 451 HH12 ARG 451 -0.479 3.254 -9.556
160 HH21 ARG 451 HH21 ARG 451 -3.608 1.646 -9.440
161 HH22 ARG 451 HH22 ARG 451 -2.784 3.175 -9.433
162 H THR 452 HN THR 452 0.288 -4.743 -7.330
163 HA THR 452 HA THR 452 1.925 -5.959 -9.452
164 HB THR 452 HB THR 452 2.962 -4.968 -6.799
165 HG1 THR 452 HG1 THR 452 3.094 -3.408 -9.161
166 HG21 THR 452 HG21 THR 452 4.273 -5.323 -9.499
167 HG22 THR 452 HG22 THR 452 4.453 -6.405 -8.119
168 HG23 THR 452 HG23 THR 452 5.070 -4.755 -8.030
169 H LEU 453 HN LEU 453 -0.057 -6.888 -6.975
170 HA LEU 453 HA LEU 453 -0.311 -8.711 -5.640
171 HB2 LEU 453 HB2 LEU 453 1.639 -9.878 -7.639
172 HB3 LEU 453 HB1 LEU 453 0.863 -10.820 -6.382
173 HG LEU 453 HG LEU 453 -1.358 -10.050 -7.430
174 HD11 LEU 453 HD11 LEU 453 -1.264 -9.531 -9.812
175 HD12 LEU 453 HD12 LEU 453 0.497 -9.476 -9.738
176 HD13 LEU 453 HD13 LEU 453 -0.461 -8.289 -8.852
177 HD21 LEU 453 HD21 LEU 453 0.469 -11.920 -8.931
178 HD22 LEU 453 HD22 LEU 453 -1.291 -11.876 -9.053
179 HD23 LEU 453 HD23 LEU 453 -0.523 -12.330 -7.531
180 H GLU 454 HN GLU 454 1.548 -6.733 -4.849
181 HA GLU 454 HA GLU 454 3.667 -8.312 -3.546
182 HB2 GLU 454 HB2 GLU 454 4.635 -7.339 -5.558
183 HB3 GLU 454 HB1 GLU 454 4.038 -5.747 -5.111
184 HG2 GLU 454 HG2 GLU 454 6.393 -5.890 -4.663
185 HG3 GLU 454 HG1 GLU 454 5.510 -5.771 -3.142
186 H SER 455 HN SER 455 4.423 -7.501 -1.596
187 HA SER 455 HA SER 455 2.806 -5.394 -0.370
188 HB2 SER 455 HB2 SER 455 4.918 -7.161 0.899
189 HB3 SER 455 HB1 SER 455 3.775 -6.113 1.741
190 HG SER 455 HG SER 455 2.420 -7.725 0.105
191 H THR 456 HN THR 456 3.529 -3.456 -1.014
192 HA THR 456 HA THR 456 6.402 -3.023 -1.345
193 HB THR 456 HB THR 456 5.014 -2.354 -3.222
194 HG1 THR 456 HG1 THR 456 5.548 0.036 -3.109
195 HG21 THR 456 HG21 THR 456 2.917 -1.921 -2.046
196 HG22 THR 456 HG22 THR 456 3.372 -0.546 -3.050
197 HG23 THR 456 HG23 THR 456 3.619 -0.483 -1.305
198 H PHE 457 HN PHE 457 7.551 -1.443 -0.257
199 HA PHE 457 HA PHE 457 6.284 -0.442 2.197
200 HB2 PHE 457 HB2 PHE 457 9.202 -0.661 1.413
201 HB3 PHE 457 HB1 PHE 457 8.627 0.011 2.936
202 HD1 PHE 457 HD1 PHE 457 7.511 -1.455 4.584
203 HD2 PHE 457 HD2 PHE 457 9.321 -3.004 1.061
204 HE1 PHE 457 HE1 PHE 457 7.523 -3.703 5.584
205 HE2 PHE 457 HE2 PHE 457 9.334 -5.256 2.050
206 HZ PHE 457 HZ PHE 457 8.433 -5.605 4.314
207 H GLU 458 HN GLU 458 6.658 0.521 -0.822
208 HA GLU 458 HA GLU 458 7.374 3.297 -0.270
209 HB2 GLU 458 HB2 GLU 458 8.408 2.370 -2.225
210 HB3 GLU 458 HB1 GLU 458 6.873 1.752 -2.815
211 HG2 GLU 458 HG2 GLU 458 6.117 4.148 -3.004
212 HG3 GLU 458 HG1 GLU 458 7.790 4.609 -2.690
213 H LYS 459 HN LYS 459 5.809 4.707 0.227
214 HA LYS 459 HA LYS 459 3.056 4.119 0.029
215 HB2 LYS 459 HB2 LYS 459 4.533 6.711 0.445
216 HB3 LYS 459 HB1 LYS 459 2.777 6.631 0.385
217 HG2 LYS 459 HG2 LYS 459 2.910 4.941 2.252
218 HG3 LYS 459 HG1 LYS 459 4.617 5.361 2.393
219 HD2 LYS 459 HD2 LYS 459 3.418 6.653 4.007
220 HD3 LYS 459 HD1 LYS 459 3.925 7.745 2.719
221 HE2 LYS 459 HE2 LYS 459 1.190 6.487 2.804
222 HE3 LYS 459 HE1 LYS 459 1.556 8.015 3.599
223 HZ1 LYS 459 HZ1 LYS 459 2.244 8.906 1.436
224 HZ2 LYS 459 HZ2 LYS 459 0.618 8.422 1.433
225 HZ3 LYS 459 HZ3 LYS 459 1.792 7.455 0.694
226 HA PRO 460 HA PRO 460 2.643 5.032 -4.299
227 HB2 PRO 460 HB2 PRO 460 0.103 4.156 -4.536
228 HB3 PRO 460 HB1 PRO 460 1.478 3.056 -4.412
229 HG2 PRO 460 HG2 PRO 460 -0.536 3.811 -2.367
230 HG3 PRO 460 HG1 PRO 460 0.306 2.274 -2.605
231 HD2 PRO 460 HD2 PRO 460 0.949 4.208 -0.704
232 HD3 PRO 460 HD1 PRO 460 2.001 2.883 -1.232
233 H GLN 461 HN GLN 461 1.892 6.738 -5.413
234 HA GLN 461 HA GLN 461 0.806 8.928 -3.956
235 HB2 GLN 461 HB2 GLN 461 0.910 10.116 -6.119
236 HB3 GLN 461 HB1 GLN 461 2.422 9.316 -5.714
237 HG2 GLN 461 HG2 GLN 461 1.805 7.460 -7.220
238 HG3 GLN 461 HG1 GLN 461 0.348 8.350 -7.669
239 HE21 GLN 461 HE21 GLN 461 0.540 10.232 -8.895
240 HE22 GLN 461 HE22 GLN 461 1.977 10.595 -9.794
241 H GLU 462 HN GLU 462 -0.605 6.315 -5.571
242 HA GLU 462 HA GLU 462 -3.013 7.501 -6.454
243 HB2 GLU 462 HB2 GLU 462 -2.353 4.675 -5.628
244 HB3 GLU 462 HB1 GLU 462 -3.930 5.148 -6.239
245 HG2 GLU 462 HG2 GLU 462 -2.828 4.251 -8.074
246 HG3 GLU 462 HG1 GLU 462 -2.701 5.992 -8.298
247 H LEU 463 HN LEU 463 -1.862 6.610 -3.320
248 HA LEU 463 HA LEU 463 -4.571 6.980 -2.219
249 HB2 LEU 463 HB2 LEU 463 -3.523 4.696 -1.965
250 HB3 LEU 463 HB1 LEU 463 -2.315 5.441 -0.938
251 HG LEU 463 HG LEU 463 -4.092 6.132 0.634
252 HD11 LEU 463 HD11 LEU 463 -5.890 4.536 -1.187
253 HD12 LEU 463 HD12 LEU 463 -5.936 6.284 -0.944
254 HD13 LEU 463 HD13 LEU 463 -6.338 5.197 0.386
255 HD21 LEU 463 HD21 LEU 463 -4.520 3.943 1.560
256 HD22 LEU 463 HD22 LEU 463 -2.873 4.010 0.931
257 HD23 LEU 463 HD23 LEU 463 -4.135 3.183 0.017
258 H LYS 464 HN LYS 464 -1.995 8.698 -2.755
259 HA LYS 464 HA LYS 464 -1.246 10.680 -1.949
260 HB2 LYS 464 HB2 LYS 464 -3.539 11.075 -1.131
261 HB3 LYS 464 HB1 LYS 464 -3.154 10.220 0.353
262 HG2 LYS 464 HG2 LYS 464 -1.567 11.926 0.974
263 HG3 LYS 464 HG1 LYS 464 -1.817 12.756 -0.566
264 HD2 LYS 464 HD2 LYS 464 -4.163 13.129 0.013
265 HD3 LYS 464 HD1 LYS 464 -3.924 12.285 1.542
266 HE2 LYS 464 HE2 LYS 464 -2.497 14.807 0.708
267 HE3 LYS 464 HE1 LYS 464 -3.893 14.741 1.781
268 HZ1 LYS 464 HZ1 LYS 464 -1.174 13.657 2.277
269 HZ2 LYS 464 HZ2 LYS 464 -2.513 13.263 3.240
270 HZ3 LYS 464 HZ3 LYS 464 -1.989 14.873 3.135
Start of MODEL 19
1 H ALA 431 HN ALA 431 -6.430 4.306 -11.094
2 HA ALA 431 HA ALA 431 -4.827 3.741 -8.703
3 HB1 ALA 431 HB1 ALA 431 -4.699 6.009 -9.619
4 HB2 ALA 431 HB2 ALA 431 -5.413 6.011 -8.006
5 HB3 ALA 431 HB3 ALA 431 -6.444 6.185 -9.427
6 H VAL 432 HN VAL 432 -7.518 2.575 -9.774
7 HA VAL 432 HA VAL 432 -9.349 3.191 -7.625
8 HB VAL 432 HB VAL 432 -10.848 1.551 -8.721
9 HG11 VAL 432 HG11 VAL 432 -9.646 3.585 -10.601
10 HG12 VAL 432 HG12 VAL 432 -10.902 3.893 -9.403
11 HG13 VAL 432 HG13 VAL 432 -11.232 2.833 -10.773
12 HG21 VAL 432 HG21 VAL 432 -9.165 0.012 -9.584
13 HG22 VAL 432 HG22 VAL 432 -8.595 1.249 -10.704
14 HG23 VAL 432 HG23 VAL 432 -10.218 0.580 -10.881
15 H SER 433 HN SER 433 -6.681 1.368 -7.745
16 HA SER 433 HA SER 433 -7.705 -0.823 -6.107
17 HB2 SER 433 HB2 SER 433 -4.853 -0.309 -6.977
18 HB3 SER 433 HB1 SER 433 -5.535 -1.817 -6.365
19 HG SER 433 HG SER 433 -6.836 -1.913 -8.252
20 H GLU 434 HN GLU 434 -7.654 -0.699 -3.947
21 HA GLU 434 HA GLU 434 -6.664 1.614 -2.635
22 HB2 GLU 434 HB2 GLU 434 -7.359 0.515 -0.568
23 HB3 GLU 434 HB1 GLU 434 -8.605 0.381 -1.799
24 HG2 GLU 434 HG2 GLU 434 -7.832 -1.914 -2.279
25 HG3 GLU 434 HG1 GLU 434 -6.666 -1.763 -0.965
26 H TRP 435 HN TRP 435 -4.867 1.948 -1.471
27 HA TRP 435 HA TRP 435 -2.858 -0.191 -1.419
28 HB2 TRP 435 HB2 TRP 435 -2.399 2.743 -0.832
29 HB3 TRP 435 HB1 TRP 435 -1.189 1.513 -1.181
30 HD1 TRP 435 HD1 TRP 435 -3.866 3.644 -2.940
31 HE1 TRP 435 HE1 TRP 435 -3.323 3.735 -5.444
32 HE3 TRP 435 HE3 TRP 435 0.024 0.314 -3.067
33 HZ2 TRP 435 HZ2 TRP 435 -1.498 2.566 -7.235
34 HZ3 TRP 435 HZ3 TRP 435 1.091 -0.151 -5.241
35 HH2 TRP 435 HH2 TRP 435 0.351 0.961 -7.275
36 H THR 436 HN THR 436 -3.382 -1.340 0.383
37 HA THR 436 HA THR 436 -4.347 0.072 2.737
38 HB THR 436 HB THR 436 -3.976 -2.896 2.662
39 HG1 THR 436 HG1 THR 436 -6.338 -1.790 1.590
40 HG21 THR 436 HG21 THR 436 -4.835 -1.817 4.685
41 HG22 THR 436 HG22 THR 436 -6.065 -2.842 3.944
42 HG23 THR 436 HG23 THR 436 -6.141 -1.090 3.749
43 H GLU 437 HN GLU 437 -3.070 0.614 4.378
44 HA GLU 437 HA GLU 437 -0.317 -0.317 4.333
45 HB2 GLU 437 HB2 GLU 437 -1.100 1.516 6.480
46 HB3 GLU 437 HB1 GLU 437 0.231 1.621 5.338
47 HG2 GLU 437 HG2 GLU 437 -0.981 3.414 4.697
48 HG3 GLU 437 HG1 GLU 437 -1.697 2.193 3.653
49 H TYR 438 HN TYR 438 0.371 -1.896 5.518
50 HA TYR 438 HA TYR 438 -0.886 -2.357 8.141
51 HB2 TYR 438 HB2 TYR 438 0.312 -4.441 6.300
52 HB3 TYR 438 HB1 TYR 438 -0.329 -4.746 7.909
53 HD1 TYR 438 HD2 TYR 438 -2.848 -3.863 8.205
54 HD2 TYR 438 HD1 TYR 438 -1.036 -4.956 4.517
55 HE1 TYR 438 HE2 TYR 438 -5.069 -4.276 7.245
56 HE2 TYR 438 HE1 TYR 438 -3.257 -5.369 3.543
57 HH TYR 438 HH TYR 438 -5.562 -5.943 4.381
58 H LYS 439 HN LYS 439 0.483 -1.995 9.770
59 HA LYS 439 HA LYS 439 3.344 -2.121 9.146
60 HB2 LYS 439 HB2 LYS 439 3.709 -0.567 11.013
61 HB3 LYS 439 HB1 LYS 439 2.685 0.109 9.762
62 HG2 LYS 439 HG2 LYS 439 0.708 -0.389 11.160
63 HG3 LYS 439 HG1 LYS 439 1.790 -0.969 12.428
64 HD2 LYS 439 HD2 LYS 439 1.788 1.818 11.265
65 HD3 LYS 439 HD1 LYS 439 1.079 1.356 12.813
66 HE2 LYS 439 HE2 LYS 439 3.983 0.928 12.147
67 HE3 LYS 439 HE1 LYS 439 3.381 2.403 12.903
68 HZ1 LYS 439 HZ1 LYS 439 2.843 -0.264 14.066
69 HZ2 LYS 439 HZ2 LYS 439 2.754 1.255 14.813
70 HZ3 LYS 439 HZ3 LYS 439 4.265 0.592 14.420
71 H THR 440 HN THR 440 4.408 -3.733 9.871
72 HA THR 440 HA THR 440 3.262 -5.408 11.950
73 HB THR 440 HB THR 440 4.028 -6.579 9.989
74 HG1 THR 440 HG1 THR 440 4.521 -7.998 11.484
75 HG21 THR 440 HG21 THR 440 5.709 -4.850 9.298
76 HG22 THR 440 HG22 THR 440 6.273 -6.513 9.150
77 HG23 THR 440 HG23 THR 440 6.804 -5.519 10.509
78 H ALA 441 HN ALA 441 4.379 -6.042 13.799
79 HA ALA 441 HA ALA 441 5.731 -3.983 15.161
80 HB1 ALA 441 HB1 ALA 441 5.974 -5.580 16.971
81 HB2 ALA 441 HB2 ALA 441 5.578 -6.907 15.880
82 HB3 ALA 441 HB3 ALA 441 4.360 -5.694 16.269
83 H ASP 442 HN ASP 442 6.891 -6.161 12.892
84 HA ASP 442 HA ASP 442 9.578 -6.420 13.782
85 HB2 ASP 442 HB2 ASP 442 8.671 -7.894 12.058
86 HB3 ASP 442 HB1 ASP 442 8.395 -6.518 10.996
87 H GLY 443 HN GLY 443 7.758 -3.808 12.661
88 HA2 GLY 443 HA2 GLY 443 8.476 -1.572 12.662
89 HA3 GLY 443 HA1 GLY 443 10.140 -2.131 12.555
90 H LYS 444 HN LYS 444 7.510 -3.210 10.499
91 HA LYS 444 HA LYS 444 8.662 -1.658 8.277
92 HB2 LYS 444 HB2 LYS 444 7.964 -4.598 8.213
93 HB3 LYS 444 HB1 LYS 444 8.266 -3.635 6.776
94 HG2 LYS 444 HG2 LYS 444 10.535 -3.103 7.972
95 HG3 LYS 444 HG1 LYS 444 10.173 -4.586 8.859
96 HD2 LYS 444 HD2 LYS 444 10.291 -4.332 5.852
97 HD3 LYS 444 HD1 LYS 444 11.567 -4.999 6.868
98 HE2 LYS 444 HE2 LYS 444 8.780 -6.120 6.880
99 HE3 LYS 444 HE1 LYS 444 9.983 -6.638 5.700
100 HZ1 LYS 444 HZ1 LYS 444 10.405 -6.754 8.642
101 HZ2 LYS 444 HZ2 LYS 444 11.371 -7.439 7.430
102 HZ3 LYS 444 HZ3 LYS 444 9.822 -8.055 7.717
103 H THR 445 HN THR 445 7.193 -0.589 7.127
104 HA THR 445 HA THR 445 4.363 -1.224 7.527
105 HB THR 445 HB THR 445 5.314 1.235 6.106
106 HG1 THR 445 HG1 THR 445 6.054 2.075 7.921
107 HG21 THR 445 HG21 THR 445 3.274 2.179 7.090
108 HG22 THR 445 HG22 THR 445 2.969 0.650 7.921
109 HG23 THR 445 HG23 THR 445 2.920 0.724 6.158
110 H TYR 446 HN TYR 446 3.675 -2.658 6.041
111 HA TYR 446 HA TYR 446 4.622 -2.293 3.288
112 HB2 TYR 446 HB2 TYR 446 3.942 -4.644 2.891
113 HB3 TYR 446 HB1 TYR 446 5.196 -4.488 4.111
114 HD1 TYR 446 HD1 TYR 446 4.570 -4.766 6.536
115 HD2 TYR 446 HD2 TYR 446 1.880 -5.683 3.371
116 HE1 TYR 446 HE1 TYR 446 3.221 -6.122 8.080
117 HE2 TYR 446 HE2 TYR 446 0.521 -7.033 4.910
118 HH TYR 446 HH TYR 446 0.830 -6.891 8.245
119 H TYR 447 HN TYR 447 3.315 -1.492 1.883
120 HA TYR 447 HA TYR 447 0.457 -1.316 2.403
121 HB2 TYR 447 HB2 TYR 447 2.252 -0.160 0.259
122 HB3 TYR 447 HB1 TYR 447 0.502 0.012 0.230
123 HD1 TYR 447 HD2 TYR 447 3.253 0.496 2.750
124 HD2 TYR 447 HD1 TYR 447 -0.275 2.043 0.936
125 HE1 TYR 447 HE2 TYR 447 3.419 2.506 4.154
126 HE2 TYR 447 HE1 TYR 447 -0.115 4.058 2.332
127 HH TYR 447 HH TYR 447 0.879 4.694 4.526
128 H TYR 448 HN TYR 448 -0.830 -2.897 1.735
129 HA TYR 448 HA TYR 448 0.111 -4.740 -0.311
130 HB2 TYR 448 HB2 TYR 448 -0.859 -5.750 1.663
131 HB3 TYR 448 HB1 TYR 448 -2.319 -4.781 1.497
132 HD1 TYR 448 HD1 TYR 448 -0.303 -7.279 -0.419
133 HD2 TYR 448 HD2 TYR 448 -4.163 -5.738 0.493
134 HE1 TYR 448 HE1 TYR 448 -1.326 -9.060 -1.772
135 HE2 TYR 448 HE2 TYR 448 -5.196 -7.513 -0.856
136 HH TYR 448 HH TYR 448 -4.625 -9.017 -2.679
137 H ASN 449 HN ASN 449 -0.321 -4.359 -2.363
138 HA ASN 449 HA ASN 449 -2.889 -3.078 -3.018
139 HB2 ASN 449 HB2 ASN 449 -1.836 -1.958 -4.900
140 HB3 ASN 449 HB1 ASN 449 -1.017 -1.533 -3.404
141 HD21 ASN 449 HD21 ASN 449 -0.731 -2.950 -6.491
142 HD22 ASN 449 HD22 ASN 449 0.963 -3.288 -6.436
143 H ASN 450 HN ASN 450 -4.150 -4.091 -4.408
144 HA ASN 450 HA ASN 450 -3.453 -6.733 -5.242
145 HB2 ASN 450 HB2 ASN 450 -5.701 -6.903 -6.051
146 HB3 ASN 450 HB1 ASN 450 -5.758 -6.005 -4.538
147 HD21 ASN 450 HD21 ASN 450 -6.304 -5.931 -7.923
148 HD22 ASN 450 HD22 ASN 450 -6.987 -4.336 -8.003
149 H ARG 451 HN ARG 451 -2.877 -3.705 -6.586
150 HA ARG 451 HA ARG 451 -3.134 -4.196 -9.325
151 HB2 ARG 451 HB2 ARG 451 -1.290 -2.401 -7.784
152 HB3 ARG 451 HB1 ARG 451 -1.181 -2.538 -9.534
153 HG2 ARG 451 HG2 ARG 451 -3.577 -1.884 -9.670
154 HG3 ARG 451 HG1 ARG 451 -3.542 -1.589 -7.929
155 HD2 ARG 451 HD2 ARG 451 -3.216 0.462 -9.273
156 HD3 ARG 451 HD1 ARG 451 -1.855 0.110 -8.208
157 HE ARG 451 HE ARG 451 -1.145 -1.061 -10.551
158 HH11 ARG 451 HH11 ARG 451 -2.267 2.167 -9.786
159 HH12 ARG 451 HH12 ARG 451 -1.282 2.930 -11.002
160 HH21 ARG 451 HH21 ARG 451 0.109 -0.086 -12.150
161 HH22 ARG 451 HH22 ARG 451 0.057 1.643 -12.365
162 H THR 452 HN THR 452 -0.419 -4.794 -7.146
163 HA THR 452 HA THR 452 0.866 -6.356 -9.277
164 HB THR 452 HB THR 452 2.299 -5.606 -6.762
165 HG1 THR 452 HG1 THR 452 2.837 -3.616 -8.248
166 HG21 THR 452 HG21 THR 452 3.135 -5.709 -9.668
167 HG22 THR 452 HG22 THR 452 3.393 -6.990 -8.483
168 HG23 THR 452 HG23 THR 452 4.200 -5.435 -8.289
169 H LEU 453 HN LEU 453 -1.062 -6.831 -6.621
170 HA LEU 453 HA LEU 453 -1.362 -8.386 -4.993
171 HB2 LEU 453 HB2 LEU 453 0.067 -10.018 -7.083
172 HB3 LEU 453 HB1 LEU 453 -0.416 -10.725 -5.555
173 HG LEU 453 HG LEU 453 -2.083 -11.297 -7.139
174 HD11 LEU 453 HD11 LEU 453 -3.088 -8.990 -5.488
175 HD12 LEU 453 HD12 LEU 453 -2.943 -10.668 -4.965
176 HD13 LEU 453 HD13 LEU 453 -4.085 -10.236 -6.236
177 HD21 LEU 453 HD21 LEU 453 -2.258 -8.374 -7.852
178 HD22 LEU 453 HD22 LEU 453 -3.287 -9.657 -8.489
179 HD23 LEU 453 HD23 LEU 453 -1.560 -9.649 -8.850
180 H GLU 454 HN GLU 454 0.854 -6.606 -4.813
181 HA GLU 454 HA GLU 454 2.803 -8.225 -3.336
182 HB2 GLU 454 HB2 GLU 454 3.628 -7.624 -5.641
183 HB3 GLU 454 HB1 GLU 454 3.536 -5.933 -5.167
184 HG2 GLU 454 HG2 GLU 454 5.807 -6.868 -4.995
185 HG3 GLU 454 HG1 GLU 454 5.185 -6.263 -3.458
186 H SER 455 HN SER 455 3.818 -7.181 -1.619
187 HA SER 455 HA SER 455 2.406 -4.818 -0.642
188 HB2 SER 455 HB2 SER 455 3.711 -5.368 1.488
189 HB3 SER 455 HB1 SER 455 2.504 -6.550 0.981
190 HG SER 455 HG SER 455 5.107 -6.864 0.020
191 H THR 456 HN THR 456 3.252 -2.905 -1.169
192 HA THR 456 HA THR 456 6.148 -2.676 -1.548
193 HB THR 456 HB THR 456 4.973 -1.762 -3.398
194 HG1 THR 456 HG1 THR 456 6.719 -0.446 -2.582
195 HG21 THR 456 HG21 THR 456 3.255 -0.024 -3.218
196 HG22 THR 456 HG22 THR 456 3.354 -0.101 -1.458
197 HG23 THR 456 HG23 THR 456 2.764 -1.491 -2.370
198 H PHE 457 HN PHE 457 7.424 -1.653 -0.145
199 HA PHE 457 HA PHE 457 6.245 -0.625 2.304
200 HB2 PHE 457 HB2 PHE 457 9.137 -0.991 1.480
201 HB3 PHE 457 HB1 PHE 457 8.614 -0.447 3.069
202 HD1 PHE 457 HD1 PHE 457 7.447 -2.007 4.585
203 HD2 PHE 457 HD2 PHE 457 9.055 -3.280 0.853
204 HE1 PHE 457 HE1 PHE 457 7.325 -4.349 5.339
205 HE2 PHE 457 HE2 PHE 457 8.931 -5.624 1.594
206 HZ PHE 457 HZ PHE 457 8.069 -6.159 3.839
207 H GLU 458 HN GLU 458 6.539 0.682 -0.574
208 HA GLU 458 HA GLU 458 7.617 3.261 0.327
209 HB2 GLU 458 HB2 GLU 458 7.090 2.274 -2.484
210 HB3 GLU 458 HB1 GLU 458 7.834 3.808 -2.054
211 HG2 GLU 458 HG2 GLU 458 9.800 2.808 -2.176
212 HG3 GLU 458 HG1 GLU 458 9.356 1.871 -0.752
213 H LYS 459 HN LYS 459 6.239 4.865 0.729
214 HA LYS 459 HA LYS 459 3.455 4.599 0.549
215 HB2 LYS 459 HB2 LYS 459 5.234 7.004 0.907
216 HB3 LYS 459 HB1 LYS 459 3.480 7.130 0.905
217 HG2 LYS 459 HG2 LYS 459 3.332 5.688 2.831
218 HG3 LYS 459 HG1 LYS 459 5.077 5.412 2.792
219 HD2 LYS 459 HD2 LYS 459 5.504 7.727 3.293
220 HD3 LYS 459 HD1 LYS 459 3.786 8.114 3.162
221 HE2 LYS 459 HE2 LYS 459 4.964 6.219 5.190
222 HE3 LYS 459 HE1 LYS 459 4.602 7.915 5.504
223 HZ1 LYS 459 HZ1 LYS 459 2.608 5.870 4.679
224 HZ2 LYS 459 HZ2 LYS 459 2.278 7.491 5.056
225 HZ3 LYS 459 HZ3 LYS 459 2.826 6.434 6.263
226 HA PRO 460 HA PRO 460 3.017 5.776 -3.759
227 HB2 PRO 460 HB2 PRO 460 0.616 4.604 -4.104
228 HB3 PRO 460 HB1 PRO 460 2.117 3.676 -4.049
229 HG2 PRO 460 HG2 PRO 460 -0.026 3.914 -2.034
230 HG3 PRO 460 HG1 PRO 460 1.128 2.599 -2.300
231 HD2 PRO 460 HD2 PRO 460 1.258 4.666 -0.337
232 HD3 PRO 460 HD1 PRO 460 2.464 3.408 -0.669
233 H GLN 461 HN GLN 461 2.126 7.581 -4.615
234 HA GLN 461 HA GLN 461 0.504 9.217 -2.862
235 HB2 GLN 461 HB2 GLN 461 0.934 11.012 -4.408
236 HB3 GLN 461 HB1 GLN 461 2.438 10.159 -4.086
237 HG2 GLN 461 HG2 GLN 461 2.423 9.123 -6.200
238 HG3 GLN 461 HG1 GLN 461 0.742 9.574 -6.491
239 HE21 GLN 461 HE21 GLN 461 0.251 11.710 -7.020
240 HE22 GLN 461 HE22 GLN 461 1.452 12.800 -7.618
241 H GLU 462 HN GLU 462 -0.326 6.844 -4.922
242 HA GLU 462 HA GLU 462 -2.326 8.076 -6.518
243 HB2 GLU 462 HB2 GLU 462 -2.159 5.192 -5.630
244 HB3 GLU 462 HB1 GLU 462 -3.157 5.816 -6.936
245 HG2 GLU 462 HG2 GLU 462 -0.158 5.764 -6.832
246 HG3 GLU 462 HG1 GLU 462 -1.199 4.747 -7.826
247 H LEU 463 HN LEU 463 -2.328 6.555 -3.351
248 HA LEU 463 HA LEU 463 -5.180 6.748 -3.043
249 HB2 LEU 463 HB2 LEU 463 -3.719 4.991 -1.966
250 HB3 LEU 463 HB1 LEU 463 -3.101 6.249 -0.912
251 HG LEU 463 HG LEU 463 -5.453 6.625 -0.111
252 HD11 LEU 463 HD11 LEU 463 -6.601 5.633 -2.033
253 HD12 LEU 463 HD12 LEU 463 -7.096 4.885 -0.514
254 HD13 LEU 463 HD13 LEU 463 -5.973 4.048 -1.585
255 HD21 LEU 463 HD21 LEU 463 -5.469 4.655 1.344
256 HD22 LEU 463 HD22 LEU 463 -3.852 5.343 1.197
257 HD23 LEU 463 HD23 LEU 463 -4.273 3.881 0.305
258 H LYS 464 HN LYS 464 -5.961 8.772 -3.003
259 HA LYS 464 HA LYS 464 -4.753 10.651 -1.106
260 HB2 LYS 464 HB2 LYS 464 -5.322 12.485 -2.739
261 HB3 LYS 464 HB1 LYS 464 -3.996 11.431 -3.207
262 HG2 LYS 464 HG2 LYS 464 -5.542 10.194 -4.681
263 HG3 LYS 464 HG1 LYS 464 -6.821 11.333 -4.251
264 HD2 LYS 464 HD2 LYS 464 -5.812 11.954 -6.377
265 HD3 LYS 464 HD1 LYS 464 -5.462 13.174 -5.149
266 HE2 LYS 464 HE2 LYS 464 -3.465 12.755 -6.412
267 HE3 LYS 464 HE1 LYS 464 -3.256 12.106 -4.787
268 HZ1 LYS 464 HZ1 LYS 464 -2.484 10.403 -6.083
269 HZ2 LYS 464 HZ2 LYS 464 -3.594 10.678 -7.333
270 HZ3 LYS 464 HZ3 LYS 464 -4.101 9.934 -5.893
Start of MODEL 20
1 H ALA 431 HN ALA 431 -14.393 5.077 -4.506
2 HA ALA 431 HA ALA 431 -11.829 6.522 -4.619
3 HB1 ALA 431 HB1 ALA 431 -12.225 7.110 -2.283
4 HB2 ALA 431 HB2 ALA 431 -13.724 6.183 -2.296
5 HB3 ALA 431 HB3 ALA 431 -13.570 7.623 -3.301
6 H VAL 432 HN VAL 432 -12.196 3.645 -5.111
7 HA VAL 432 HA VAL 432 -11.270 2.219 -2.818
8 HB VAL 432 HB VAL 432 -11.174 1.429 -5.739
9 HG11 VAL 432 HG11 VAL 432 -10.858 -0.256 -3.257
10 HG12 VAL 432 HG12 VAL 432 -9.588 0.147 -4.411
11 HG13 VAL 432 HG13 VAL 432 -10.944 -0.864 -4.910
12 HG21 VAL 432 HG21 VAL 432 -13.446 1.835 -4.979
13 HG22 VAL 432 HG22 VAL 432 -13.186 0.783 -3.588
14 HG23 VAL 432 HG23 VAL 432 -13.177 0.109 -5.217
15 H SER 433 HN SER 433 -9.326 2.553 -1.955
16 HA SER 433 HA SER 433 -7.088 3.466 -3.524
17 HB2 SER 433 HB2 SER 433 -7.191 2.490 -0.657
18 HB3 SER 433 HB1 SER 433 -5.839 3.336 -1.410
19 HG SER 433 HG SER 433 -8.417 4.474 -1.379
20 H GLU 434 HN GLU 434 -5.801 2.187 -4.676
21 HA GLU 434 HA GLU 434 -6.227 -0.646 -4.633
22 HB2 GLU 434 HB2 GLU 434 -4.197 0.907 -6.235
23 HB3 GLU 434 HB1 GLU 434 -4.812 -0.706 -6.577
24 HG2 GLU 434 HG2 GLU 434 -7.067 0.279 -6.882
25 HG3 GLU 434 HG1 GLU 434 -6.348 1.877 -6.689
26 H TRP 435 HN TRP 435 -4.289 1.327 -2.828
27 HA TRP 435 HA TRP 435 -2.331 -0.828 -2.371
28 HB2 TRP 435 HB2 TRP 435 -1.858 2.051 -1.612
29 HB3 TRP 435 HB1 TRP 435 -0.679 0.764 -1.817
30 HD1 TRP 435 HD1 TRP 435 -2.694 3.334 -3.789
31 HE1 TRP 435 HE1 TRP 435 -1.712 3.533 -6.157
32 HE3 TRP 435 HE3 TRP 435 0.625 -0.562 -3.631
33 HZ2 TRP 435 HZ2 TRP 435 0.208 2.217 -7.744
34 HZ3 TRP 435 HZ3 TRP 435 1.986 -1.027 -5.631
35 HH2 TRP 435 HH2 TRP 435 1.784 0.340 -7.637
36 H THR 436 HN THR 436 -2.936 -1.906 -0.568
37 HA THR 436 HA THR 436 -4.283 -0.409 1.567
38 HB THR 436 HB THR 436 -4.001 -3.410 1.303
39 HG1 THR 436 HG1 THR 436 -5.310 -1.965 -0.315
40 HG21 THR 436 HG21 THR 436 -4.490 -2.615 3.575
41 HG22 THR 436 HG22 THR 436 -5.869 -3.469 2.880
42 HG23 THR 436 HG23 THR 436 -5.869 -1.707 2.957
43 H GLU 437 HN GLU 437 -3.227 0.130 3.360
44 HA GLU 437 HA GLU 437 -0.455 -0.737 3.624
45 HB2 GLU 437 HB2 GLU 437 -0.894 1.650 3.648
46 HB3 GLU 437 HB1 GLU 437 -2.023 1.463 4.981
47 HG2 GLU 437 HG2 GLU 437 -0.186 0.742 6.427
48 HG3 GLU 437 HG1 GLU 437 0.942 0.942 5.088
49 H TYR 438 HN TYR 438 0.073 -2.314 4.962
50 HA TYR 438 HA TYR 438 -1.430 -2.583 7.483
51 HB2 TYR 438 HB2 TYR 438 0.080 -4.721 5.957
52 HB3 TYR 438 HB1 TYR 438 -0.689 -4.948 7.522
53 HD1 TYR 438 HD2 TYR 438 -3.224 -4.647 7.656
54 HD2 TYR 438 HD1 TYR 438 -1.123 -5.037 3.974
55 HE1 TYR 438 HE2 TYR 438 -5.314 -5.297 6.540
56 HE2 TYR 438 HE1 TYR 438 -3.211 -5.684 2.845
57 HH TYR 438 HH TYR 438 -6.271 -5.313 4.290
58 H LYS 439 HN LYS 439 -0.300 -2.167 9.287
59 HA LYS 439 HA LYS 439 2.603 -1.803 9.022
60 HB2 LYS 439 HB2 LYS 439 1.327 0.117 9.902
61 HB3 LYS 439 HB1 LYS 439 0.750 -0.884 11.233
62 HG2 LYS 439 HG2 LYS 439 3.176 -1.229 11.855
63 HG3 LYS 439 HG1 LYS 439 3.559 0.038 10.691
64 HD2 LYS 439 HD2 LYS 439 2.098 1.588 11.931
65 HD3 LYS 439 HD1 LYS 439 1.781 0.315 13.112
66 HE2 LYS 439 HE2 LYS 439 4.244 0.205 13.528
67 HE3 LYS 439 HE1 LYS 439 4.427 1.621 12.497
68 HZ1 LYS 439 HZ1 LYS 439 2.906 1.461 15.039
69 HZ2 LYS 439 HZ2 LYS 439 2.924 2.819 14.021
70 HZ3 LYS 439 HZ3 LYS 439 4.349 2.305 14.777
71 H THR 440 HN THR 440 3.899 -3.344 9.742
72 HA THR 440 HA THR 440 2.912 -5.259 11.704
73 HB THR 440 HB THR 440 4.177 -6.131 9.779
74 HG1 THR 440 HG1 THR 440 5.699 -7.370 11.054
75 HG21 THR 440 HG21 THR 440 5.696 -4.254 9.403
76 HG22 THR 440 HG22 THR 440 6.597 -5.756 9.616
77 HG23 THR 440 HG23 THR 440 6.503 -4.590 10.934
78 H ALA 441 HN ALA 441 3.974 -5.641 13.693
79 HA ALA 441 HA ALA 441 4.672 -3.270 15.082
80 HB1 ALA 441 HB1 ALA 441 4.967 -4.694 17.016
81 HB2 ALA 441 HB2 ALA 441 4.993 -6.128 15.991
82 HB3 ALA 441 HB3 ALA 441 3.519 -5.168 16.131
83 H ASP 442 HN ASP 442 6.516 -5.029 13.008
84 HA ASP 442 HA ASP 442 9.052 -4.784 14.359
85 HB2 ASP 442 HB2 ASP 442 8.463 -6.504 12.569
86 HB3 ASP 442 HB1 ASP 442 8.603 -5.198 11.399
87 H GLY 443 HN GLY 443 6.949 -2.642 12.952
88 HA2 GLY 443 HA2 GLY 443 7.270 -0.316 12.899
89 HA3 GLY 443 HA1 GLY 443 9.007 -0.572 12.897
90 H LYS 444 HN LYS 444 6.749 -2.169 10.751
91 HA LYS 444 HA LYS 444 7.845 -0.630 8.491
92 HB2 LYS 444 HB2 LYS 444 7.583 -3.648 8.586
93 HB3 LYS 444 HB1 LYS 444 8.174 -2.702 7.224
94 HG2 LYS 444 HG2 LYS 444 10.147 -2.105 8.367
95 HG3 LYS 444 HG1 LYS 444 9.510 -2.666 9.912
96 HD2 LYS 444 HD2 LYS 444 11.047 -4.308 9.190
97 HD3 LYS 444 HD1 LYS 444 9.439 -4.976 8.916
98 HE2 LYS 444 HE2 LYS 444 9.589 -4.359 6.555
99 HE3 LYS 444 HE1 LYS 444 11.198 -3.691 6.834
100 HZ1 LYS 444 HZ1 LYS 444 11.798 -5.988 7.660
101 HZ2 LYS 444 HZ2 LYS 444 11.544 -5.839 5.991
102 HZ3 LYS 444 HZ3 LYS 444 10.343 -6.524 6.974
103 H THR 445 HN THR 445 6.327 0.002 7.078
104 HA THR 445 HA THR 445 3.670 -1.237 7.275
105 HB THR 445 HB THR 445 2.864 0.801 6.039
106 HG1 THR 445 HG1 THR 445 5.535 1.275 5.880
107 HG21 THR 445 HG21 THR 445 3.002 2.299 7.982
108 HG22 THR 445 HG22 THR 445 4.262 1.276 8.670
109 HG23 THR 445 HG23 THR 445 2.632 0.641 8.453
110 H TYR 446 HN TYR 446 3.148 -2.647 5.743
111 HA TYR 446 HA TYR 446 4.477 -2.364 3.136
112 HB2 TYR 446 HB2 TYR 446 4.052 -4.800 2.815
113 HB3 TYR 446 HB1 TYR 446 5.153 -4.439 4.133
114 HD1 TYR 446 HD1 TYR 446 4.382 -4.694 6.485
115 HD2 TYR 446 HD2 TYR 446 1.995 -5.944 3.193
116 HE1 TYR 446 HE1 TYR 446 3.038 -6.092 7.992
117 HE2 TYR 446 HE2 TYR 446 0.650 -7.349 4.694
118 HH TYR 446 HH TYR 446 0.892 -8.466 6.884
119 H TYR 447 HN TYR 447 3.322 -1.844 1.500
120 HA TYR 447 HA TYR 447 0.418 -1.750 1.730
121 HB2 TYR 447 HB2 TYR 447 2.354 -0.570 -0.269
122 HB3 TYR 447 HB1 TYR 447 0.608 -0.430 -0.413
123 HD1 TYR 447 HD2 TYR 447 3.298 0.212 2.107
124 HD2 TYR 447 HD1 TYR 447 -0.387 1.476 0.393
125 HE1 TYR 447 HE2 TYR 447 3.339 2.215 3.518
126 HE2 TYR 447 HE1 TYR 447 -0.353 3.493 1.800
127 HH TYR 447 HH TYR 447 0.665 4.173 4.008
128 H TYR 448 HN TYR 448 -0.684 -3.434 1.046
129 HA TYR 448 HA TYR 448 0.441 -5.222 -0.956
130 HB2 TYR 448 HB2 TYR 448 -0.532 -6.399 0.850
131 HB3 TYR 448 HB1 TYR 448 -1.946 -5.352 0.886
132 HD1 TYR 448 HD1 TYR 448 -0.233 -7.837 -1.324
133 HD2 TYR 448 HD2 TYR 448 -3.908 -6.065 -0.115
134 HE1 TYR 448 HE1 TYR 448 -1.466 -9.431 -2.740
135 HE2 TYR 448 HE2 TYR 448 -5.145 -7.652 -1.524
136 HH TYR 448 HH TYR 448 -4.777 -9.044 -3.488
137 H ASN 449 HN ASN 449 -0.093 -5.157 -3.033
138 HA ASN 449 HA ASN 449 -2.606 -3.851 -3.799
139 HB2 ASN 449 HB2 ASN 449 -1.583 -2.474 -5.418
140 HB3 ASN 449 HB1 ASN 449 -0.599 -2.291 -3.974
141 HD21 ASN 449 HD21 ASN 449 1.477 -3.221 -3.929
142 HD22 ASN 449 HD22 ASN 449 2.280 -3.688 -5.388
143 H ASN 450 HN ASN 450 -3.509 -4.548 -5.698
144 HA ASN 450 HA ASN 450 -2.800 -7.254 -6.459
145 HB2 ASN 450 HB2 ASN 450 -4.938 -7.204 -7.689
146 HB3 ASN 450 HB1 ASN 450 -5.141 -6.706 -6.013
147 HD21 ASN 450 HD21 ASN 450 -5.274 -5.723 -9.327
148 HD22 ASN 450 HD22 ASN 450 -5.944 -4.144 -9.056
149 H ARG 451 HN ARG 451 -1.669 -4.373 -7.450
150 HA ARG 451 HA ARG 451 -1.890 -4.775 -10.302
151 HB2 ARG 451 HB2 ARG 451 -1.922 -2.500 -9.429
152 HB3 ARG 451 HB1 ARG 451 -0.331 -2.730 -8.722
153 HG2 ARG 451 HG2 ARG 451 0.747 -2.518 -10.724
154 HG3 ARG 451 HG1 ARG 451 -0.623 -3.141 -11.650
155 HD2 ARG 451 HD2 ARG 451 -0.541 -0.443 -10.293
156 HD3 ARG 451 HD1 ARG 451 -0.233 -0.721 -12.011
157 HE ARG 451 HE ARG 451 -2.565 -1.683 -12.054
158 HH11 ARG 451 HH11 ARG 451 -1.634 0.869 -9.816
159 HH12 ARG 451 HH12 ARG 451 -3.281 1.376 -9.538
160 HH21 ARG 451 HH21 ARG 451 -4.690 -0.984 -11.704
161 HH22 ARG 451 HH22 ARG 451 -5.010 0.315 -10.592
162 H THR 452 HN THR 452 0.691 -4.890 -7.863
163 HA THR 452 HA THR 452 2.229 -6.521 -9.767
164 HB THR 452 HB THR 452 4.132 -6.133 -8.131
165 HG1 THR 452 HG1 THR 452 3.780 -4.907 -6.439
166 HG21 THR 452 HG21 THR 452 2.915 -3.731 -9.500
167 HG22 THR 452 HG22 THR 452 3.973 -4.928 -10.247
168 HG23 THR 452 HG23 THR 452 4.593 -3.873 -8.977
169 H LEU 453 HN LEU 453 0.077 -6.942 -7.348
170 HA LEU 453 HA LEU 453 -0.557 -8.661 -6.021
171 HB2 LEU 453 HB2 LEU 453 1.311 -10.121 -7.879
172 HB3 LEU 453 HB1 LEU 453 0.422 -10.945 -6.613
173 HG LEU 453 HG LEU 453 -1.691 -9.998 -7.707
174 HD11 LEU 453 HD11 LEU 453 -1.514 -9.488 -10.092
175 HD12 LEU 453 HD12 LEU 453 0.246 -9.564 -9.977
176 HD13 LEU 453 HD13 LEU 453 -0.643 -8.315 -9.105
177 HD21 LEU 453 HD21 LEU 453 -0.010 -11.999 -9.212
178 HD22 LEU 453 HD22 LEU 453 -1.760 -11.815 -9.335
179 HD23 LEU 453 HD23 LEU 453 -1.034 -12.344 -7.818
180 H GLU 454 HN GLU 454 1.508 -6.980 -5.052
181 HA GLU 454 HA GLU 454 2.852 -8.763 -3.191
182 HB2 GLU 454 HB2 GLU 454 5.094 -8.050 -3.695
183 HB3 GLU 454 HB1 GLU 454 4.368 -8.692 -5.162
184 HG2 GLU 454 HG2 GLU 454 3.930 -6.390 -5.918
185 HG3 GLU 454 HG1 GLU 454 4.725 -5.784 -4.465
186 H SER 455 HN SER 455 3.642 -7.725 -1.345
187 HA SER 455 HA SER 455 2.534 -5.071 -0.904
188 HB2 SER 455 HB2 SER 455 3.278 -5.551 1.490
189 HB3 SER 455 HB1 SER 455 2.021 -6.599 0.839
190 HG SER 455 HG SER 455 4.594 -7.485 0.383
191 H THR 456 HN THR 456 3.738 -3.341 -1.284
192 HA THR 456 HA THR 456 6.657 -3.562 -1.233
193 HB THR 456 HB THR 456 5.791 -2.569 -3.250
194 HG1 THR 456 HG1 THR 456 7.608 -1.487 -2.923
195 HG21 THR 456 HG21 THR 456 4.511 -0.470 -3.239
196 HG22 THR 456 HG22 THR 456 4.451 -0.519 -1.478
197 HG23 THR 456 HG23 THR 456 3.635 -1.766 -2.421
198 H PHE 457 HN PHE 457 7.959 -2.044 -0.047
199 HA PHE 457 HA PHE 457 6.633 -1.289 2.439
200 HB2 PHE 457 HB2 PHE 457 9.555 -1.462 1.702
201 HB3 PHE 457 HB1 PHE 457 8.967 -0.938 3.276
202 HD1 PHE 457 HD1 PHE 457 7.720 -2.526 4.709
203 HD2 PHE 457 HD2 PHE 457 9.645 -3.754 1.120
204 HE1 PHE 457 HE1 PHE 457 7.615 -4.868 5.458
205 HE2 PHE 457 HE2 PHE 457 9.543 -6.098 1.861
206 HZ PHE 457 HZ PHE 457 8.526 -6.658 4.032
207 H GLU 458 HN GLU 458 7.268 0.180 -0.426
208 HA GLU 458 HA GLU 458 7.917 2.796 0.648
209 HB2 GLU 458 HB2 GLU 458 7.326 1.808 -2.138
210 HB3 GLU 458 HB1 GLU 458 7.555 3.510 -1.765
211 HG2 GLU 458 HG2 GLU 458 9.803 2.834 -0.800
212 HG3 GLU 458 HG1 GLU 458 9.545 1.278 -1.591
213 H LYS 459 HN LYS 459 6.541 4.579 0.616
214 HA LYS 459 HA LYS 459 3.701 3.930 0.660
215 HB2 LYS 459 HB2 LYS 459 5.169 6.446 1.451
216 HB3 LYS 459 HB1 LYS 459 3.429 6.221 1.582
217 HG2 LYS 459 HG2 LYS 459 3.915 4.244 3.060
218 HG3 LYS 459 HG1 LYS 459 5.596 4.769 3.078
219 HD2 LYS 459 HD2 LYS 459 4.966 6.872 4.079
220 HD3 LYS 459 HD1 LYS 459 3.254 6.466 3.940
221 HE2 LYS 459 HE2 LYS 459 5.308 5.077 5.661
222 HE3 LYS 459 HE1 LYS 459 3.987 6.103 6.213
223 HZ1 LYS 459 HZ1 LYS 459 2.607 4.305 4.860
224 HZ2 LYS 459 HZ2 LYS 459 3.007 4.095 6.489
225 HZ3 LYS 459 HZ3 LYS 459 3.929 3.334 5.293
226 HA PRO 460 HA PRO 460 3.617 5.262 -3.657
227 HB2 PRO 460 HB2 PRO 460 0.739 4.679 -3.319
228 HB3 PRO 460 HB1 PRO 460 1.889 4.036 -4.494
229 HG2 PRO 460 HG2 PRO 460 0.985 2.540 -2.477
230 HG3 PRO 460 HG1 PRO 460 2.656 2.406 -3.054
231 HD2 PRO 460 HD2 PRO 460 1.593 3.794 -0.629
232 HD3 PRO 460 HD1 PRO 460 3.069 2.827 -0.828
233 H GLN 461 HN GLN 461 3.186 7.151 -4.596
234 HA GLN 461 HA GLN 461 1.717 9.161 -3.063
235 HB2 GLN 461 HB2 GLN 461 3.564 9.386 -5.444
236 HB3 GLN 461 HB1 GLN 461 2.690 10.749 -4.760
237 HG2 GLN 461 HG2 GLN 461 4.586 9.043 -3.177
238 HG3 GLN 461 HG1 GLN 461 5.075 10.503 -4.035
239 HE21 GLN 461 HE21 GLN 461 5.701 11.477 -2.120
240 HE22 GLN 461 HE22 GLN 461 4.546 12.103 -0.986
241 H GLU 462 HN GLU 462 1.306 7.053 -5.669
242 HA GLU 462 HA GLU 462 -0.741 8.647 -6.966
243 HB2 GLU 462 HB2 GLU 462 -1.090 6.545 -8.339
244 HB3 GLU 462 HB1 GLU 462 0.494 7.295 -8.468
245 HG2 GLU 462 HG2 GLU 462 0.062 5.077 -6.516
246 HG3 GLU 462 HG1 GLU 462 0.274 4.719 -8.228
247 H LEU 463 HN LEU 463 -0.634 7.110 -4.157
248 HA LEU 463 HA LEU 463 -3.111 5.649 -4.184
249 HB2 LEU 463 HB2 LEU 463 -1.082 5.286 -2.663
250 HB3 LEU 463 HB1 LEU 463 -1.616 6.699 -1.783
251 HG LEU 463 HG LEU 463 -3.379 4.273 -2.111
252 HD11 LEU 463 HD11 LEU 463 -1.295 3.554 -1.091
253 HD12 LEU 463 HD12 LEU 463 -2.593 3.572 0.102
254 HD13 LEU 463 HD13 LEU 463 -1.396 4.867 0.081
255 HD21 LEU 463 HD21 LEU 463 -3.323 6.494 -0.065
256 HD22 LEU 463 HD22 LEU 463 -4.446 5.135 -0.089
257 HD23 LEU 463 HD23 LEU 463 -4.486 6.334 -1.380
258 H LYS 464 HN LYS 464 -2.160 8.920 -3.856
259 HA LYS 464 HA LYS 464 -4.689 9.603 -2.521
260 HB2 LYS 464 HB2 LYS 464 -3.519 11.532 -1.549
261 HB3 LYS 464 HB1 LYS 464 -2.769 10.012 -1.084
262 HG2 LYS 464 HG2 LYS 464 -1.186 10.474 -3.088
263 HG3 LYS 464 HG1 LYS 464 -1.758 12.136 -2.921
264 HD2 LYS 464 HD2 LYS 464 0.208 11.979 -1.613
265 HD3 LYS 464 HD1 LYS 464 -1.144 11.968 -0.477
266 HE2 LYS 464 HE2 LYS 464 -1.006 9.459 -0.492
267 HE3 LYS 464 HE1 LYS 464 0.484 9.615 -1.422
268 HZ1 LYS 464 HZ1 LYS 464 -0.045 10.398 1.368
269 HZ2 LYS 464 HZ2 LYS 464 1.207 11.135 0.498
270 HZ3 LYS 464 HZ3 LYS 464 1.226 9.459 0.747
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