Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
584363 | 2mwf RC | 25315 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H SER 433 HT1 SER 433 -4.591 8.539 -1.021
2 HA SER 433 HA SER 433 -4.441 7.632 -3.217
3 HB2 SER 433 HB2 SER 433 -3.405 10.244 -4.251
4 HB3 SER 433 HB1 SER 433 -4.201 8.932 -5.121
5 HG SER 433 HG SER 433 -6.155 9.637 -4.457
6 H GLU 434 HN GLU 434 -2.712 8.815 -0.810
7 HA GLU 434 HA GLU 434 -0.162 9.259 -2.076
8 HB2 GLU 434 HB2 GLU 434 -0.318 8.991 0.876
9 HB3 GLU 434 HB1 GLU 434 0.523 10.182 -0.102
10 HG2 GLU 434 HG2 GLU 434 -2.413 10.124 0.567
11 HG3 GLU 434 HG1 GLU 434 -1.207 11.263 1.153
12 H TRP 435 HN TRP 435 -1.791 6.523 -1.132
13 HA TRP 435 HA TRP 435 0.544 5.083 -0.155
14 HB2 TRP 435 HB2 TRP 435 -2.261 4.031 -0.630
15 HB3 TRP 435 HB1 TRP 435 -0.994 3.272 0.334
16 HD1 TRP 435 HD1 TRP 435 -3.583 6.053 0.441
17 HE1 TRP 435 HE1 TRP 435 -3.755 6.976 2.849
18 HE3 TRP 435 HE3 TRP 435 0.284 3.489 2.558
19 HZ2 TRP 435 HZ2 TRP 435 -2.407 6.647 5.319
20 HZ3 TRP 435 HZ3 TRP 435 0.783 3.837 4.940
21 HH2 TRP 435 HH2 TRP 435 -0.518 5.400 6.290
22 H THR 436 HN THR 436 1.688 3.626 -1.362
23 HA THR 436 HA THR 436 1.139 3.686 -4.220
24 HB THR 436 HB THR 436 3.515 2.626 -2.677
25 HG1 THR 436 HG1 THR 436 2.914 5.046 -3.227
26 HG21 THR 436 HG21 THR 436 4.609 2.380 -4.881
27 HG22 THR 436 HG22 THR 436 3.081 2.773 -5.669
28 HG23 THR 436 HG23 THR 436 3.222 1.301 -4.704
29 H GLU 437 HN GLU 437 -0.355 2.309 -4.785
30 HA GLU 437 HA GLU 437 -0.356 -0.413 -3.769
31 HB2 GLU 437 HB2 GLU 437 -2.371 -0.617 -5.329
32 HB3 GLU 437 HB1 GLU 437 -2.545 0.452 -3.943
33 HG2 GLU 437 HG2 GLU 437 -2.127 2.383 -5.372
34 HG3 GLU 437 HG1 GLU 437 -1.927 1.317 -6.762
35 H ARG 438 HN ARG 438 1.302 -1.484 -4.604
36 HA ARG 438 HA ARG 438 1.691 -1.363 -7.519
37 HB2 ARG 438 HB2 ARG 438 3.536 -0.433 -6.097
38 HB3 ARG 438 HB1 ARG 438 3.746 -2.034 -5.407
39 HG2 ARG 438 HG2 ARG 438 4.434 -2.921 -7.519
40 HG3 ARG 438 HG1 ARG 438 4.051 -1.400 -8.335
41 HD2 ARG 438 HD2 ARG 438 5.743 -0.282 -6.890
42 HD3 ARG 438 HD1 ARG 438 6.179 -1.865 -6.247
43 HE ARG 438 HE ARG 438 6.344 -1.559 -9.137
44 HH11 ARG 438 HH11 ARG 438 8.002 -1.622 -6.056
45 HH12 ARG 438 HH12 ARG 438 9.585 -1.751 -6.761
46 HH21 ARG 438 HH21 ARG 438 8.410 -1.721 -10.077
47 HH22 ARG 438 HH22 ARG 438 9.819 -1.782 -9.060
48 H LYS 439 HN LYS 439 0.954 -3.128 -8.473
49 HA LYS 439 HA LYS 439 0.699 -5.569 -6.930
50 HB2 LYS 439 HB2 LYS 439 -0.610 -6.404 -8.863
51 HB3 LYS 439 HB1 LYS 439 -1.266 -4.947 -8.144
52 HG2 LYS 439 HG2 LYS 439 -0.213 -3.631 -9.966
53 HG3 LYS 439 HG1 LYS 439 0.288 -5.149 -10.712
54 HD2 LYS 439 HD2 LYS 439 -1.743 -4.422 -11.769
55 HD3 LYS 439 HD1 LYS 439 -2.110 -5.832 -10.777
56 HE2 LYS 439 HE2 LYS 439 -2.907 -4.333 -8.990
57 HE3 LYS 439 HE1 LYS 439 -2.600 -2.951 -10.038
58 HZ1 LYS 439 HZ1 LYS 439 -4.176 -4.045 -11.654
59 HZ2 LYS 439 HZ2 LYS 439 -4.876 -3.433 -10.238
60 HZ3 LYS 439 HZ3 LYS 439 -4.613 -5.101 -10.398
61 H THR 440 HN THR 440 2.589 -6.485 -6.738
62 HA THR 440 HA THR 440 4.363 -6.750 -9.011
63 HB THR 440 HB THR 440 5.875 -7.867 -7.348
64 HG1 THR 440 HG1 THR 440 3.577 -7.737 -5.853
65 HG21 THR 440 HG21 THR 440 4.809 -5.121 -6.701
66 HG22 THR 440 HG22 THR 440 6.142 -5.519 -7.786
67 HG23 THR 440 HG23 THR 440 6.305 -5.788 -6.046
68 H ALA 441 HN ALA 441 5.067 -8.628 -9.918
69 HA ALA 441 HA ALA 441 3.228 -10.755 -10.189
70 HB1 ALA 441 HB1 ALA 441 6.143 -10.685 -10.953
71 HB2 ALA 441 HB2 ALA 441 4.806 -10.109 -11.949
72 HB3 ALA 441 HB3 ALA 441 4.935 -11.822 -11.547
73 H ASP 442 HN ASP 442 5.227 -10.085 -7.675
74 HA ASP 442 HA ASP 442 6.054 -12.637 -6.790
75 HB2 ASP 442 HB2 ASP 442 6.868 -10.464 -5.883
76 HB3 ASP 442 HB1 ASP 442 5.292 -10.205 -5.152
77 H GLY 443 HN GLY 443 3.020 -11.292 -7.245
78 HA2 GLY 443 HA2 GLY 443 0.994 -12.449 -7.058
79 HA3 GLY 443 HA1 GLY 443 1.750 -13.549 -5.911
80 H LYS 444 HN LYS 444 2.066 -10.098 -5.587
81 HA LYS 444 HA LYS 444 0.047 -10.024 -3.478
82 HB2 LYS 444 HB2 LYS 444 2.939 -9.310 -2.932
83 HB3 LYS 444 HB1 LYS 444 1.597 -9.173 -1.804
84 HG2 LYS 444 HG2 LYS 444 1.360 -11.559 -1.712
85 HG3 LYS 444 HG1 LYS 444 2.582 -11.770 -2.967
86 HD2 LYS 444 HD2 LYS 444 4.224 -10.657 -1.442
87 HD3 LYS 444 HD1 LYS 444 2.991 -10.687 -0.180
88 HE2 LYS 444 HE2 LYS 444 4.608 -12.567 -0.041
89 HE3 LYS 444 HE1 LYS 444 2.931 -13.086 -0.209
90 HZ1 LYS 444 HZ1 LYS 444 3.274 -13.645 -2.453
91 HZ2 LYS 444 HZ2 LYS 444 4.622 -14.272 -1.635
92 HZ3 LYS 444 HZ3 LYS 444 4.763 -12.834 -2.528
93 H THR 445 HN THR 445 -0.877 -8.065 -3.288
94 HA THR 445 HA THR 445 0.292 -5.816 -4.758
95 HB THR 445 HB THR 445 -2.346 -5.596 -3.372
96 HG1 THR 445 HG1 THR 445 -1.851 -7.600 -5.040
97 HG21 THR 445 HG21 THR 445 -2.886 -4.238 -5.344
98 HG22 THR 445 HG22 THR 445 -1.316 -4.628 -6.047
99 HG23 THR 445 HG23 THR 445 -1.408 -3.675 -4.565
100 H TYR 446 HN TYR 446 1.776 -4.802 -3.446
101 HA TYR 446 HA TYR 446 0.991 -4.450 -0.657
102 HB2 TYR 446 HB2 TYR 446 3.293 -3.637 -0.259
103 HB3 TYR 446 HB1 TYR 446 3.209 -5.290 -0.829
104 HD1 TYR 446 HD1 TYR 446 3.613 -1.858 -2.325
105 HD2 TYR 446 HD2 TYR 446 4.845 -5.927 -2.260
106 HE1 TYR 446 HE1 TYR 446 5.377 -1.348 -3.960
107 HE2 TYR 446 HE2 TYR 446 6.601 -5.432 -3.900
108 HH TYR 446 HH TYR 446 7.370 -3.891 -5.378
109 H TYR 447 HN TYR 447 0.595 -2.567 0.273
110 HA TYR 447 HA TYR 447 0.807 -0.174 -1.414
111 HB2 TYR 447 HB2 TYR 447 -0.839 -0.670 1.082
112 HB3 TYR 447 HB1 TYR 447 -0.791 0.843 0.191
113 HD1 TYR 447 HD2 TYR 447 -1.431 -2.803 -0.633
114 HD2 TYR 447 HD1 TYR 447 -2.636 1.264 -1.103
115 HE1 TYR 447 HE2 TYR 447 -3.340 -3.530 -1.978
116 HE2 TYR 447 HE1 TYR 447 -4.554 0.528 -2.458
117 HH TYR 447 HH TYR 447 -5.347 -1.308 -3.726
118 H TYR 448 HN TYR 448 3.071 0.042 -0.987
119 HA TYR 448 HA TYR 448 3.881 0.644 1.730
120 HB2 TYR 448 HB2 TYR 448 5.545 -0.478 0.511
121 HB3 TYR 448 HB1 TYR 448 5.311 0.534 -0.909
122 HD1 TYR 448 HD1 TYR 448 6.283 0.987 2.700
123 HD2 TYR 448 HD2 TYR 448 6.966 2.032 -1.370
124 HE1 TYR 448 HE1 TYR 448 8.165 2.432 3.391
125 HE2 TYR 448 HE2 TYR 448 8.836 3.470 -0.694
126 HH TYR 448 HH TYR 448 9.681 4.631 1.212
127 H ASN 449 HN ASN 449 4.114 2.578 2.648
128 HA ASN 449 HA ASN 449 4.152 4.979 0.954
129 HB2 ASN 449 HB2 ASN 449 1.820 4.495 1.873
130 HB3 ASN 449 HB1 ASN 449 2.487 4.827 3.466
131 HD21 ASN 449 HD21 ASN 449 0.385 6.217 2.108
132 HD22 ASN 449 HD22 ASN 449 0.901 7.852 1.899
133 H ASN 450 HN ASN 450 5.166 6.753 1.893
134 HA ASN 450 HA ASN 450 7.286 5.972 3.730
135 HB2 ASN 450 HB2 ASN 450 7.740 7.109 1.501
136 HB3 ASN 450 HB1 ASN 450 7.001 8.556 2.174
137 HD21 ASN 450 HD21 ASN 450 8.123 9.761 3.693
138 HD22 ASN 450 HD22 ASN 450 9.791 9.478 4.063
139 H ARG 451 HN ARG 451 4.276 7.157 3.944
140 HA ARG 451 HA ARG 451 4.439 9.329 5.704
141 HB2 ARG 451 HB2 ARG 451 2.380 7.165 5.433
142 HB3 ARG 451 HB1 ARG 451 2.229 8.432 6.640
143 HG2 ARG 451 HG2 ARG 451 2.462 10.071 4.690
144 HG3 ARG 451 HG1 ARG 451 2.155 8.674 3.654
145 HD2 ARG 451 HD2 ARG 451 0.080 9.851 4.097
146 HD3 ARG 451 HD1 ARG 451 0.049 8.264 4.868
147 HE ARG 451 HE ARG 451 0.902 10.538 6.497
148 HH11 ARG 451 HH11 ARG 451 -1.669 8.310 5.641
149 HH12 ARG 451 HH12 ARG 451 -2.566 8.577 7.103
150 HH21 ARG 451 HH21 ARG 451 -0.259 10.870 8.428
151 HH22 ARG 451 HH22 ARG 451 -1.739 9.999 8.707
152 H THR 452 HN THR 452 4.205 5.878 6.452
153 HA THR 452 HA THR 452 5.482 6.470 9.029
154 HB THR 452 HB THR 452 4.368 4.212 9.692
155 HG1 THR 452 HG1 THR 452 2.608 3.645 8.492
156 HG21 THR 452 HG21 THR 452 2.331 5.392 10.396
157 HG22 THR 452 HG22 THR 452 2.718 6.713 9.292
158 HG23 THR 452 HG23 THR 452 3.769 6.377 10.668
159 H LEU 453 HN LEU 453 6.187 5.348 6.077
160 HA LEU 453 HA LEU 453 7.631 3.876 5.120
161 HB2 LEU 453 HB2 LEU 453 8.667 3.997 7.910
162 HB3 LEU 453 HB1 LEU 453 9.215 2.670 6.908
163 HG LEU 453 HG LEU 453 10.743 4.654 6.956
164 HD11 LEU 453 HD11 LEU 453 10.591 2.939 5.089
165 HD12 LEU 453 HD12 LEU 453 11.324 4.490 4.681
166 HD13 LEU 453 HD13 LEU 453 9.664 4.146 4.198
167 HD21 LEU 453 HD21 LEU 453 10.154 6.615 5.667
168 HD22 LEU 453 HD22 LEU 453 8.984 6.381 6.967
169 HD23 LEU 453 HD23 LEU 453 8.565 5.930 5.311
170 H GLU 454 HN GLU 454 5.027 3.123 6.065
171 HA GLU 454 HA GLU 454 5.411 0.325 6.878
172 HB2 GLU 454 HB2 GLU 454 3.016 2.144 7.111
173 HB3 GLU 454 HB1 GLU 454 2.935 0.412 7.393
174 HG2 GLU 454 HG2 GLU 454 4.678 0.716 9.165
175 HG3 GLU 454 HG1 GLU 454 4.476 2.458 8.957
176 H SER 455 HN SER 455 4.385 -1.306 5.809
177 HA SER 455 HA SER 455 3.153 -0.582 3.249
178 HB2 SER 455 HB2 SER 455 3.886 -2.885 2.496
179 HB3 SER 455 HB1 SER 455 5.196 -1.739 2.776
180 HG SER 455 HG SER 455 4.786 -2.936 5.078
181 H THR 456 HN THR 456 1.069 -0.790 3.337
182 HA THR 456 HA THR 456 -0.150 -2.685 5.185
183 HB THR 456 HB THR 456 -2.272 -1.518 4.543
184 HG1 THR 456 HG1 THR 456 -1.348 -0.815 2.445
185 HG21 THR 456 HG21 THR 456 -1.626 0.703 5.583
186 HG22 THR 456 HG22 THR 456 0.037 0.111 5.598
187 HG23 THR 456 HG23 THR 456 -1.208 -0.734 6.517
188 H TRP 457 HN TRP 457 -0.312 -4.685 4.389
189 HA TRP 457 HA TRP 457 -0.752 -5.065 1.532
190 HB2 TRP 457 HB2 TRP 457 -0.135 -7.091 3.713
191 HB3 TRP 457 HB1 TRP 457 -0.192 -7.433 1.980
192 HD1 TRP 457 HD1 TRP 457 1.700 -4.997 4.327
193 HE1 TRP 457 HE1 TRP 457 4.069 -4.628 3.418
194 HE3 TRP 457 HE3 TRP 457 1.458 -8.004 0.186
195 HZ2 TRP 457 HZ2 TRP 457 5.612 -5.442 1.233
196 HZ3 TRP 457 HZ3 TRP 457 3.460 -8.175 -1.242
197 HH2 TRP 457 HH2 TRP 457 5.500 -6.941 -0.723
198 H GLU 458 HN GLU 458 -2.510 -4.579 4.210
199 HA GLU 458 HA GLU 458 -4.896 -5.706 2.918
200 HB2 GLU 458 HB2 GLU 458 -4.588 -6.356 5.302
201 HB3 GLU 458 HB1 GLU 458 -4.591 -4.654 5.745
202 HG2 GLU 458 HG2 GLU 458 -6.750 -5.767 6.153
203 HG3 GLU 458 HG1 GLU 458 -6.871 -4.413 5.030
204 H LYS 459 HN LYS 459 -6.498 -4.260 2.292
205 HA LYS 459 HA LYS 459 -5.446 -1.745 1.471
206 HB2 LYS 459 HB2 LYS 459 -8.242 -2.840 1.197
207 HB3 LYS 459 HB1 LYS 459 -7.578 -1.471 0.312
208 HG2 LYS 459 HG2 LYS 459 -5.936 -2.924 -0.739
209 HG3 LYS 459 HG1 LYS 459 -6.557 -4.302 0.170
210 HD2 LYS 459 HD2 LYS 459 -8.752 -3.973 -0.934
211 HD3 LYS 459 HD1 LYS 459 -8.029 -2.688 -1.908
212 HE2 LYS 459 HE2 LYS 459 -8.034 -4.729 -3.185
213 HE3 LYS 459 HE1 LYS 459 -6.375 -4.312 -2.758
214 HZ1 LYS 459 HZ1 LYS 459 -6.670 -6.638 -2.408
215 HZ2 LYS 459 HZ2 LYS 459 -8.078 -6.393 -1.495
216 HZ3 LYS 459 HZ3 LYS 459 -6.577 -5.910 -0.876
217 HA PRO 460 HA PRO 460 -6.894 0.511 5.128
218 HB2 PRO 460 HB2 PRO 460 -5.724 2.816 3.756
219 HB3 PRO 460 HB1 PRO 460 -5.292 2.109 5.312
220 HG2 PRO 460 HG2 PRO 460 -3.698 1.937 3.147
221 HG3 PRO 460 HG1 PRO 460 -3.765 0.675 4.388
222 HD2 PRO 460 HD2 PRO 460 -5.013 0.737 1.675
223 HD3 PRO 460 HD1 PRO 460 -4.260 -0.612 2.554
224 H GLN 461 HN GLN 461 -8.503 2.028 5.507
225 HA GLN 461 HA GLN 461 -10.250 2.602 3.259
226 HB2 GLN 461 HB2 GLN 461 -11.217 1.742 5.345
227 HB3 GLN 461 HB1 GLN 461 -10.593 3.129 6.222
228 HG2 GLN 461 HG2 GLN 461 -12.463 3.540 3.929
229 HG3 GLN 461 HG1 GLN 461 -13.087 3.039 5.498
230 HE21 GLN 461 HE21 GLN 461 -13.460 5.536 3.987
231 HE22 GLN 461 HE22 GLN 461 -12.958 6.800 5.058
232 H GLU 462 HN GLU 462 -8.050 4.245 5.382
233 HA GLU 462 HA GLU 462 -8.947 6.899 4.654
234 HB2 GLU 462 HB2 GLU 462 -7.030 7.654 6.036
235 HB3 GLU 462 HB1 GLU 462 -8.107 6.565 6.894
236 HG2 GLU 462 HG2 GLU 462 -5.691 5.463 5.544
237 HG3 GLU 462 HG1 GLU 462 -5.519 6.311 7.080
238 H LEU 463 HN LEU 463 -7.739 4.879 2.688
239 HA LEU 463 HA LEU 463 -5.245 5.930 1.870
240 HB2 LEU 463 HB2 LEU 463 -6.046 3.651 1.330
241 HB3 LEU 463 HB1 LEU 463 -7.235 4.347 0.247
242 HG LEU 463 HG LEU 463 -4.379 5.040 -0.224
243 HD11 LEU 463 HD11 LEU 463 -3.871 3.038 -1.334
244 HD12 LEU 463 HD12 LEU 463 -5.521 2.434 -1.182
245 HD13 LEU 463 HD13 LEU 463 -4.494 2.567 0.247
246 HD21 LEU 463 HD21 LEU 463 -5.107 4.901 -2.565
247 HD22 LEU 463 HD22 LEU 463 -6.105 6.011 -1.626
248 HD23 LEU 463 HD23 LEU 463 -6.710 4.405 -2.023
249 H LYS 464 HN LYS 464 -8.541 6.745 1.137
250 HA LYS 464 HA LYS 464 -9.540 8.315 -0.145
251 HB2 LYS 464 HB2 LYS 464 -8.229 9.860 1.201
252 HB3 LYS 464 HB1 LYS 464 -6.852 9.663 0.133
253 HG2 LYS 464 HG2 LYS 464 -7.892 11.771 -0.318
254 HG3 LYS 464 HG1 LYS 464 -8.160 10.701 -1.693
255 HD2 LYS 464 HD2 LYS 464 -10.227 10.932 0.470
256 HD3 LYS 464 HD1 LYS 464 -10.121 12.161 -0.788
257 HE2 LYS 464 HE2 LYS 464 -10.568 9.205 -1.186
258 HE3 LYS 464 HE1 LYS 464 -11.763 10.486 -1.396
259 HZ1 LYS 464 HZ1 LYS 464 -9.322 10.038 -3.023
260 HZ2 LYS 464 HZ2 LYS 464 -10.319 11.396 -3.181
261 HZ3 LYS 464 HZ3 LYS 464 -10.927 9.849 -3.529
Start of MODEL 2
1 H SER 433 HT1 SER 433 3.153 10.718 -4.071
2 HA SER 433 HA SER 433 1.085 9.553 -4.159
3 HB2 SER 433 HB2 SER 433 2.788 7.122 -4.785
4 HB3 SER 433 HB1 SER 433 1.045 7.122 -4.517
5 HG SER 433 HG SER 433 0.954 7.421 -6.596
6 H GLU 434 HN GLU 434 0.453 9.415 -2.110
7 HA GLU 434 HA GLU 434 2.406 8.933 -0.035
8 HB2 GLU 434 HB2 GLU 434 -0.568 9.405 0.254
9 HB3 GLU 434 HB1 GLU 434 0.646 9.536 1.518
10 HG2 GLU 434 HG2 GLU 434 0.513 11.279 -0.927
11 HG3 GLU 434 HG1 GLU 434 -0.110 11.717 0.659
12 H TRP 435 HN TRP 435 0.013 7.160 -1.720
13 HA TRP 435 HA TRP 435 0.544 4.832 0.003
14 HB2 TRP 435 HB2 TRP 435 -1.994 5.261 -1.600
15 HB3 TRP 435 HB1 TRP 435 -1.672 3.975 -0.442
16 HD1 TRP 435 HD1 TRP 435 -3.411 7.166 -0.688
17 HE1 TRP 435 HE1 TRP 435 -3.937 8.150 1.633
18 HE3 TRP 435 HE3 TRP 435 -0.410 4.158 2.131
19 HZ2 TRP 435 HZ2 TRP 435 -3.165 7.693 4.320
20 HZ3 TRP 435 HZ3 TRP 435 -0.343 4.497 4.559
21 HH2 TRP 435 HH2 TRP 435 -1.653 6.251 5.634
22 H THR 436 HN THR 436 1.962 3.605 -1.107
23 HA THR 436 HA THR 436 1.854 3.570 -4.016
24 HB THR 436 HB THR 436 3.776 2.228 -2.104
25 HG1 THR 436 HG1 THR 436 4.110 4.443 -2.196
26 HG21 THR 436 HG21 THR 436 3.832 2.341 -5.130
27 HG22 THR 436 HG22 THR 436 3.568 0.897 -4.148
28 HG23 THR 436 HG23 THR 436 5.130 1.719 -4.109
29 H GLU 437 HN GLU 437 0.058 2.432 -4.560
30 HA GLU 437 HA GLU 437 -0.200 -0.306 -3.616
31 HB2 GLU 437 HB2 GLU 437 -2.267 0.985 -3.963
32 HB3 GLU 437 HB1 GLU 437 -1.838 1.234 -5.651
33 HG2 GLU 437 HG2 GLU 437 -1.920 -1.231 -5.969
34 HG3 GLU 437 HG1 GLU 437 -2.515 -1.377 -4.317
35 H ARG 438 HN ARG 438 1.676 -1.246 -4.406
36 HA ARG 438 HA ARG 438 1.935 -1.235 -7.328
37 HB2 ARG 438 HB2 ARG 438 3.943 -0.497 -6.123
38 HB3 ARG 438 HB1 ARG 438 3.989 -2.031 -5.260
39 HG2 ARG 438 HG2 ARG 438 4.323 -3.218 -7.358
40 HG3 ARG 438 HG1 ARG 438 4.247 -1.693 -8.240
41 HD2 ARG 438 HD2 ARG 438 6.237 -0.906 -7.131
42 HD3 ARG 438 HD1 ARG 438 6.279 -2.346 -6.115
43 HE ARG 438 HE ARG 438 6.445 -2.679 -9.021
44 HH11 ARG 438 HH11 ARG 438 8.002 -2.749 -5.884
45 HH12 ARG 438 HH12 ARG 438 9.374 -3.658 -6.447
46 HH21 ARG 438 HH21 ARG 438 8.227 -3.915 -9.754
47 HH22 ARG 438 HH22 ARG 438 9.495 -4.340 -8.638
48 H LYS 439 HN LYS 439 1.132 -2.878 -8.316
49 HA LYS 439 HA LYS 439 0.634 -5.338 -6.870
50 HB2 LYS 439 HB2 LYS 439 -0.638 -5.917 -9.006
51 HB3 LYS 439 HB1 LYS 439 -1.271 -4.612 -8.019
52 HG2 LYS 439 HG2 LYS 439 0.290 -3.191 -9.672
53 HG3 LYS 439 HG1 LYS 439 -0.121 -4.543 -10.730
54 HD2 LYS 439 HD2 LYS 439 -1.740 -2.759 -11.013
55 HD3 LYS 439 HD1 LYS 439 -2.513 -4.154 -10.258
56 HE2 LYS 439 HE2 LYS 439 -2.288 -3.092 -8.066
57 HE3 LYS 439 HE1 LYS 439 -1.508 -1.701 -8.815
58 HZ1 LYS 439 HZ1 LYS 439 -3.529 -1.225 -10.014
59 HZ2 LYS 439 HZ2 LYS 439 -3.869 -1.324 -8.353
60 HZ3 LYS 439 HZ3 LYS 439 -4.282 -2.611 -9.387
61 H THR 440 HN THR 440 2.247 -6.665 -6.770
62 HA THR 440 HA THR 440 4.115 -6.967 -8.976
63 HB THR 440 HB THR 440 5.280 -8.559 -7.460
64 HG1 THR 440 HG1 THR 440 3.358 -7.777 -5.502
65 HG21 THR 440 HG21 THR 440 4.598 -5.893 -6.213
66 HG22 THR 440 HG22 THR 440 5.862 -6.186 -7.406
67 HG23 THR 440 HG23 THR 440 5.987 -6.896 -5.799
68 H ALA 441 HN ALA 441 4.557 -8.980 -10.007
69 HA ALA 441 HA ALA 441 2.216 -10.258 -10.913
70 HB1 ALA 441 HB1 ALA 441 5.076 -11.128 -11.276
71 HB2 ALA 441 HB2 ALA 441 4.216 -9.971 -12.292
72 HB3 ALA 441 HB3 ALA 441 3.694 -11.654 -12.236
73 H ASP 442 HN ASP 442 4.049 -10.847 -8.140
74 HA ASP 442 HA ASP 442 3.574 -13.657 -7.902
75 HB2 ASP 442 HB2 ASP 442 5.386 -12.428 -6.677
76 HB3 ASP 442 HB1 ASP 442 4.145 -11.653 -5.700
77 H GLY 443 HN GLY 443 1.558 -11.047 -7.894
78 HA2 GLY 443 HA2 GLY 443 -0.768 -11.169 -7.743
79 HA3 GLY 443 HA1 GLY 443 -0.615 -12.667 -6.835
80 H LYS 444 HN LYS 444 1.191 -9.804 -6.016
81 HA LYS 444 HA LYS 444 -0.505 -9.498 -3.630
82 HB2 LYS 444 HB2 LYS 444 2.506 -9.680 -3.739
83 HB3 LYS 444 HB1 LYS 444 1.627 -9.086 -2.337
84 HG2 LYS 444 HG2 LYS 444 0.612 -11.192 -1.967
85 HG3 LYS 444 HG1 LYS 444 1.144 -11.797 -3.537
86 HD2 LYS 444 HD2 LYS 444 3.480 -11.629 -2.785
87 HD3 LYS 444 HD1 LYS 444 2.916 -11.090 -1.202
88 HE2 LYS 444 HE2 LYS 444 2.005 -13.169 -0.682
89 HE3 LYS 444 HE1 LYS 444 1.935 -13.667 -2.372
90 HZ1 LYS 444 HZ1 LYS 444 4.412 -13.344 -0.756
91 HZ2 LYS 444 HZ2 LYS 444 4.348 -13.786 -2.396
92 HZ3 LYS 444 HZ3 LYS 444 3.699 -14.816 -1.214
93 H THR 445 HN THR 445 -1.306 -7.558 -3.562
94 HA THR 445 HA THR 445 0.118 -5.288 -4.705
95 HB THR 445 HB THR 445 -1.976 -4.040 -3.882
96 HG1 THR 445 HG1 THR 445 -2.722 -5.659 -2.461
97 HG21 THR 445 HG21 THR 445 -3.346 -4.850 -5.782
98 HG22 THR 445 HG22 THR 445 -2.212 -6.188 -5.999
99 HG23 THR 445 HG23 THR 445 -1.672 -4.525 -6.228
100 H TYR 446 HN TYR 446 1.778 -4.739 -3.339
101 HA TYR 446 HA TYR 446 1.147 -4.530 -0.506
102 HB2 TYR 446 HB2 TYR 446 3.454 -4.245 -0.071
103 HB3 TYR 446 HB1 TYR 446 3.298 -5.570 -1.197
104 HD1 TYR 446 HD1 TYR 446 4.068 -5.273 -3.557
105 HD2 TYR 446 HD2 TYR 446 4.638 -2.268 -0.602
106 HE1 TYR 446 HE1 TYR 446 5.814 -4.235 -4.950
107 HE2 TYR 446 HE2 TYR 446 6.372 -1.220 -1.989
108 HH TYR 446 HH TYR 446 7.888 -1.744 -3.761
109 H TYR 447 HN TYR 447 0.953 -2.712 0.571
110 HA TYR 447 HA TYR 447 1.145 -0.248 -0.991
111 HB2 TYR 447 HB2 TYR 447 -0.424 -0.850 1.519
112 HB3 TYR 447 HB1 TYR 447 -0.316 0.739 0.779
113 HD1 TYR 447 HD2 TYR 447 -1.250 -2.775 -0.152
114 HD2 TYR 447 HD1 TYR 447 -2.015 1.383 -0.634
115 HE1 TYR 447 HE2 TYR 447 -3.197 -3.305 -1.551
116 HE2 TYR 447 HE1 TYR 447 -3.973 0.862 -2.028
117 HH TYR 447 HH TYR 447 -4.797 -0.973 -3.428
118 H TYR 448 HN TYR 448 3.335 0.132 -0.739
119 HA TYR 448 HA TYR 448 4.331 0.607 1.937
120 HB2 TYR 448 HB2 TYR 448 6.050 -0.102 0.514
121 HB3 TYR 448 HB1 TYR 448 5.489 0.898 -0.822
122 HD1 TYR 448 HD1 TYR 448 6.620 1.484 2.715
123 HD2 TYR 448 HD2 TYR 448 6.899 2.621 -1.379
124 HE1 TYR 448 HE1 TYR 448 8.241 3.243 3.319
125 HE2 TYR 448 HE2 TYR 448 8.522 4.367 -0.788
126 HH TYR 448 HH TYR 448 9.140 5.715 1.201
127 H ASN 449 HN ASN 449 4.075 2.335 3.020
128 HA ASN 449 HA ASN 449 2.903 4.706 1.743
129 HB2 ASN 449 HB2 ASN 449 1.307 4.031 3.239
130 HB3 ASN 449 HB1 ASN 449 2.481 3.266 4.304
131 HD21 ASN 449 HD21 ASN 449 1.137 6.329 3.297
132 HD22 ASN 449 HD22 ASN 449 1.467 7.159 4.770
133 H ASN 450 HN ASN 450 3.759 6.694 2.050
134 HA ASN 450 HA ASN 450 6.393 6.807 3.314
135 HB2 ASN 450 HB2 ASN 450 6.715 8.877 2.096
136 HB3 ASN 450 HB1 ASN 450 6.115 7.647 0.987
137 HD21 ASN 450 HD21 ASN 450 5.991 10.560 0.803
138 HD22 ASN 450 HD22 ASN 450 4.303 10.945 0.645
139 H ARG 451 HN ARG 451 3.178 7.598 4.030
140 HA ARG 451 HA ARG 451 3.491 9.992 5.455
141 HB2 ARG 451 HB2 ARG 451 1.460 7.825 5.881
142 HB3 ARG 451 HB1 ARG 451 1.418 9.396 6.665
143 HG2 ARG 451 HG2 ARG 451 1.049 8.755 3.759
144 HG3 ARG 451 HG1 ARG 451 -0.074 9.548 4.865
145 HD2 ARG 451 HD2 ARG 451 2.502 10.657 3.762
146 HD3 ARG 451 HD1 ARG 451 0.864 11.196 3.400
147 HE ARG 451 HE ARG 451 1.230 11.455 6.153
148 HH11 ARG 451 HH11 ARG 451 2.444 12.814 3.153
149 HH12 ARG 451 HH12 ARG 451 2.911 14.323 3.888
150 HH21 ARG 451 HH21 ARG 451 1.834 13.445 7.127
151 HH22 ARG 451 HH22 ARG 451 2.555 14.694 6.139
152 H THR 452 HN THR 452 3.577 6.642 6.532
153 HA THR 452 HA THR 452 4.895 7.557 9.000
154 HB THR 452 HB THR 452 3.504 4.919 8.857
155 HG1 THR 452 HG1 THR 452 1.543 5.789 9.006
156 HG21 THR 452 HG21 THR 452 4.779 5.520 10.849
157 HG22 THR 452 HG22 THR 452 3.056 5.417 11.211
158 HG23 THR 452 HG23 THR 452 3.825 6.993 11.023
159 H LEU 453 HN LEU 453 5.547 6.200 6.110
160 HA LEU 453 HA LEU 453 7.145 4.841 5.226
161 HB2 LEU 453 HB2 LEU 453 8.230 5.350 7.949
162 HB3 LEU 453 HB1 LEU 453 8.920 4.013 7.054
163 HG LEU 453 HG LEU 453 10.129 6.252 6.895
164 HD11 LEU 453 HD11 LEU 453 10.274 4.250 5.291
165 HD12 LEU 453 HD12 LEU 453 10.853 5.814 4.721
166 HD13 LEU 453 HD13 LEU 453 9.275 5.224 4.212
167 HD21 LEU 453 HD21 LEU 453 9.270 7.880 5.344
168 HD22 LEU 453 HD22 LEU 453 8.061 7.605 6.601
169 HD23 LEU 453 HD23 LEU 453 7.864 6.867 5.005
170 H GLU 454 HN GLU 454 4.698 3.829 6.190
171 HA GLU 454 HA GLU 454 5.314 1.298 7.515
172 HB2 GLU 454 HB2 GLU 454 2.670 2.578 6.802
173 HB3 GLU 454 HB1 GLU 454 2.842 1.030 7.614
174 HG2 GLU 454 HG2 GLU 454 4.025 2.198 9.457
175 HG3 GLU 454 HG1 GLU 454 3.663 3.726 8.652
176 H SER 455 HN SER 455 5.615 -0.488 6.369
177 HA SER 455 HA SER 455 4.493 -0.675 3.682
178 HB2 SER 455 HB2 SER 455 6.845 -1.471 4.141
179 HB3 SER 455 HB1 SER 455 6.162 -2.732 5.163
180 HG SER 455 HG SER 455 6.469 -2.707 2.500
181 H THR 456 HN THR 456 2.396 -1.179 3.662
182 HA THR 456 HA THR 456 1.437 -3.092 5.678
183 HB THR 456 HB THR 456 0.588 -0.963 6.371
184 HG1 THR 456 HG1 THR 456 -1.795 -1.546 5.367
185 HG21 THR 456 HG21 THR 456 -0.665 0.541 4.995
186 HG22 THR 456 HG22 THR 456 -0.645 -0.591 3.649
187 HG23 THR 456 HG23 THR 456 0.851 0.189 4.163
188 H TRP 457 HN TRP 457 0.204 -4.698 5.001
189 HA TRP 457 HA TRP 457 -0.107 -4.882 2.082
190 HB2 TRP 457 HB2 TRP 457 0.693 -7.007 4.100
191 HB3 TRP 457 HB1 TRP 457 0.378 -7.331 2.390
192 HD1 TRP 457 HD1 TRP 457 2.553 -4.749 4.321
193 HE1 TRP 457 HE1 TRP 457 4.785 -4.459 3.088
194 HE3 TRP 457 HE3 TRP 457 1.860 -8.169 0.570
195 HZ2 TRP 457 HZ2 TRP 457 6.064 -5.486 0.843
196 HZ3 TRP 457 HZ3 TRP 457 3.675 -8.481 -1.066
197 HH2 TRP 457 HH2 TRP 457 5.747 -7.187 -0.921
198 H GLU 458 HN GLU 458 -1.754 -4.158 4.535
199 HA GLU 458 HA GLU 458 -4.180 -5.624 3.754
200 HB2 GLU 458 HB2 GLU 458 -3.626 -3.878 6.166
201 HB3 GLU 458 HB1 GLU 458 -5.154 -4.681 5.824
202 HG2 GLU 458 HG2 GLU 458 -4.171 -6.831 6.107
203 HG3 GLU 458 HG1 GLU 458 -2.553 -6.135 6.210
204 H LYS 459 HN LYS 459 -5.796 -4.505 2.757
205 HA LYS 459 HA LYS 459 -5.009 -2.189 1.339
206 HB2 LYS 459 HB2 LYS 459 -7.705 -3.527 1.555
207 HB3 LYS 459 HB1 LYS 459 -7.266 -2.314 0.355
208 HG2 LYS 459 HG2 LYS 459 -5.889 -3.743 -0.795
209 HG3 LYS 459 HG1 LYS 459 -5.586 -4.760 0.610
210 HD2 LYS 459 HD2 LYS 459 -8.012 -5.464 0.456
211 HD3 LYS 459 HD1 LYS 459 -8.042 -4.663 -1.117
212 HE2 LYS 459 HE2 LYS 459 -6.406 -6.123 -2.000
213 HE3 LYS 459 HE1 LYS 459 -6.004 -6.752 -0.403
214 HZ1 LYS 459 HZ1 LYS 459 -7.319 -8.365 -1.493
215 HZ2 LYS 459 HZ2 LYS 459 -8.486 -7.224 -1.956
216 HZ3 LYS 459 HZ3 LYS 459 -8.314 -7.648 -0.320
217 HA PRO 460 HA PRO 460 -6.044 0.869 4.460
218 HB2 PRO 460 HB2 PRO 460 -5.688 2.637 2.100
219 HB3 PRO 460 HB1 PRO 460 -4.934 2.726 3.695
220 HG2 PRO 460 HG2 PRO 460 -3.568 1.888 1.566
221 HG3 PRO 460 HG1 PRO 460 -3.323 1.162 3.163
222 HD2 PRO 460 HD2 PRO 460 -4.809 0.105 0.803
223 HD3 PRO 460 HD1 PRO 460 -3.822 -0.758 2.000
224 H GLN 461 HN GLN 461 -7.960 1.648 5.044
225 HA GLN 461 HA GLN 461 -10.082 1.730 3.032
226 HB2 GLN 461 HB2 GLN 461 -11.626 1.765 4.991
227 HB3 GLN 461 HB1 GLN 461 -10.624 0.327 4.887
228 HG2 GLN 461 HG2 GLN 461 -9.109 1.310 6.575
229 HG3 GLN 461 HG1 GLN 461 -10.219 2.675 6.723
230 HE21 GLN 461 HE21 GLN 461 -10.607 2.223 8.896
231 HE22 GLN 461 HE22 GLN 461 -11.592 0.880 9.390
232 H GLU 462 HN GLU 462 -8.011 3.805 4.688
233 HA GLU 462 HA GLU 462 -9.827 6.069 4.586
234 HB2 GLU 462 HB2 GLU 462 -7.807 7.420 5.218
235 HB3 GLU 462 HB1 GLU 462 -8.255 6.181 6.374
236 HG2 GLU 462 HG2 GLU 462 -6.088 5.744 4.332
237 HG3 GLU 462 HG1 GLU 462 -5.788 6.516 5.884
238 H LEU 463 HN LEU 463 -8.147 4.331 2.388
239 HA LEU 463 HA LEU 463 -7.651 6.562 0.570
240 HB2 LEU 463 HB2 LEU 463 -6.005 4.721 0.732
241 HB3 LEU 463 HB1 LEU 463 -7.235 3.587 0.213
242 HG LEU 463 HG LEU 463 -7.354 4.722 -1.970
243 HD11 LEU 463 HD11 LEU 463 -5.676 6.384 -2.576
244 HD12 LEU 463 HD12 LEU 463 -5.064 6.379 -0.922
245 HD13 LEU 463 HD13 LEU 463 -6.695 6.961 -1.257
246 HD21 LEU 463 HD21 LEU 463 -5.177 3.976 -2.801
247 HD22 LEU 463 HD22 LEU 463 -5.876 2.812 -1.676
248 HD23 LEU 463 HD23 LEU 463 -4.578 3.881 -1.145
249 H LYS 464 HN LYS 464 -10.206 4.774 1.556
250 HA LYS 464 HA LYS 464 -11.545 4.876 -1.062
251 HB2 LYS 464 HB2 LYS 464 -11.399 2.620 -0.004
252 HB3 LYS 464 HB1 LYS 464 -12.287 3.240 1.379
253 HG2 LYS 464 HG2 LYS 464 -13.786 2.009 -0.020
254 HG3 LYS 464 HG1 LYS 464 -14.201 3.721 -0.113
255 HD2 LYS 464 HD2 LYS 464 -14.290 2.738 -2.320
256 HD3 LYS 464 HD1 LYS 464 -12.947 3.878 -2.234
257 HE2 LYS 464 HE2 LYS 464 -12.301 1.837 -3.409
258 HE3 LYS 464 HE1 LYS 464 -11.386 2.029 -1.915
259 HZ1 LYS 464 HZ1 LYS 464 -12.657 0.363 -0.862
260 HZ2 LYS 464 HZ2 LYS 464 -12.276 -0.260 -2.396
261 HZ3 LYS 464 HZ3 LYS 464 -13.826 0.353 -2.091
Start of MODEL 3
1 H SER 433 HT1 SER 433 -3.902 7.639 -5.462
2 HA SER 433 HA SER 433 -1.638 8.075 -6.012
3 HB2 SER 433 HB2 SER 433 -2.939 10.548 -4.846
4 HB3 SER 433 HB1 SER 433 -1.772 10.490 -6.169
5 HG SER 433 HG SER 433 -4.184 10.615 -6.626
6 H GLU 434 HN GLU 434 -2.431 8.801 -2.670
7 HA GLU 434 HA GLU 434 0.092 9.921 -1.974
8 HB2 GLU 434 HB2 GLU 434 -1.932 10.368 -0.685
9 HB3 GLU 434 HB1 GLU 434 -2.071 8.668 -0.272
10 HG2 GLU 434 HG2 GLU 434 -1.212 9.875 1.603
11 HG3 GLU 434 HG1 GLU 434 0.050 8.823 0.964
12 H TRP 435 HN TRP 435 -1.322 6.705 -1.580
13 HA TRP 435 HA TRP 435 1.119 5.711 -0.339
14 HB2 TRP 435 HB2 TRP 435 -1.524 4.305 -0.847
15 HB3 TRP 435 HB1 TRP 435 -0.219 3.732 0.190
16 HD1 TRP 435 HD1 TRP 435 -2.831 6.576 0.026
17 HE1 TRP 435 HE1 TRP 435 -3.254 7.451 2.409
18 HE3 TRP 435 HE3 TRP 435 0.614 3.755 2.532
19 HZ2 TRP 435 HZ2 TRP 435 -2.257 6.987 5.018
20 HZ3 TRP 435 HZ3 TRP 435 0.811 4.021 4.966
21 HH2 TRP 435 HH2 TRP 435 -0.573 5.622 6.179
22 H THR 436 HN THR 436 2.321 3.914 -1.226
23 HA THR 436 HA THR 436 2.099 3.754 -4.128
24 HB THR 436 HB THR 436 4.170 2.626 -2.232
25 HG1 THR 436 HG1 THR 436 3.898 4.988 -3.441
26 HG21 THR 436 HG21 THR 436 3.872 1.082 -4.119
27 HG22 THR 436 HG22 THR 436 5.419 1.925 -4.234
28 HG23 THR 436 HG23 THR 436 4.068 2.423 -5.250
29 H GLU 437 HN GLU 437 0.465 2.477 -4.701
30 HA GLU 437 HA GLU 437 0.223 -0.147 -3.473
31 HB2 GLU 437 HB2 GLU 437 -1.719 -0.449 -4.995
32 HB3 GLU 437 HB1 GLU 437 -1.877 0.940 -3.937
33 HG2 GLU 437 HG2 GLU 437 -0.959 1.150 -6.792
34 HG3 GLU 437 HG1 GLU 437 -2.650 1.234 -6.314
35 H ARG 438 HN ARG 438 2.058 -1.166 -4.047
36 HA ARG 438 HA ARG 438 2.771 -1.212 -6.880
37 HB2 ARG 438 HB2 ARG 438 4.518 -0.667 -5.196
38 HB3 ARG 438 HB1 ARG 438 4.320 -2.274 -4.514
39 HG2 ARG 438 HG2 ARG 438 5.143 -3.298 -6.514
40 HG3 ARG 438 HG1 ARG 438 5.160 -1.746 -7.359
41 HD2 ARG 438 HD2 ARG 438 6.857 -0.911 -5.849
42 HD3 ARG 438 HD1 ARG 438 6.791 -2.400 -4.911
43 HE ARG 438 HE ARG 438 7.433 -2.922 -7.637
44 HH11 ARG 438 HH11 ARG 438 8.753 -1.763 -4.615
45 HH12 ARG 438 HH12 ARG 438 10.380 -2.236 -4.992
46 HH21 ARG 438 HH21 ARG 438 9.574 -3.538 -8.151
47 HH22 ARG 438 HH22 ARG 438 10.849 -3.246 -7.004
48 H LYS 439 HN LYS 439 1.946 -2.726 -8.038
49 HA LYS 439 HA LYS 439 1.049 -5.191 -6.798
50 HB2 LYS 439 HB2 LYS 439 -0.015 -5.645 -9.010
51 HB3 LYS 439 HB1 LYS 439 -0.581 -4.178 -8.234
52 HG2 LYS 439 HG2 LYS 439 1.542 -4.145 -10.360
53 HG3 LYS 439 HG1 LYS 439 -0.179 -4.091 -10.738
54 HD2 LYS 439 HD2 LYS 439 1.270 -2.117 -8.968
55 HD3 LYS 439 HD1 LYS 439 0.876 -1.850 -10.666
56 HE2 LYS 439 HE2 LYS 439 -1.483 -1.954 -10.189
57 HE3 LYS 439 HE1 LYS 439 -1.164 -2.413 -8.516
58 HZ1 LYS 439 HZ1 LYS 439 -0.291 0.166 -9.708
59 HZ2 LYS 439 HZ2 LYS 439 -0.252 -0.276 -8.073
60 HZ3 LYS 439 HZ3 LYS 439 -1.742 -0.029 -8.847
61 H THR 440 HN THR 440 2.606 -6.596 -6.523
62 HA THR 440 HA THR 440 4.684 -6.930 -8.522
63 HB THR 440 HB THR 440 5.645 -8.583 -6.967
64 HG1 THR 440 HG1 THR 440 3.441 -7.962 -5.259
65 HG21 THR 440 HG21 THR 440 6.172 -6.199 -6.662
66 HG22 THR 440 HG22 THR 440 6.167 -7.069 -5.128
67 HG23 THR 440 HG23 THR 440 4.800 -6.046 -5.564
68 H ALA 441 HN ALA 441 5.110 -8.872 -9.621
69 HA ALA 441 HA ALA 441 2.823 -9.962 -10.839
70 HB1 ALA 441 HB1 ALA 441 4.368 -11.340 -12.105
71 HB2 ALA 441 HB2 ALA 441 5.665 -10.950 -10.976
72 HB3 ALA 441 HB3 ALA 441 4.966 -9.685 -11.988
73 H ASP 442 HN ASP 442 4.440 -10.884 -7.988
74 HA ASP 442 HA ASP 442 3.790 -13.662 -8.015
75 HB2 ASP 442 HB2 ASP 442 5.545 -12.528 -6.571
76 HB3 ASP 442 HB1 ASP 442 4.219 -11.940 -5.573
77 H GLY 443 HN GLY 443 1.864 -10.986 -7.901
78 HA2 GLY 443 HA2 GLY 443 -0.474 -10.986 -7.746
79 HA3 GLY 443 HA1 GLY 443 -0.402 -12.521 -6.890
80 H LYS 444 HN LYS 444 1.682 -9.946 -5.933
81 HA LYS 444 HA LYS 444 0.075 -9.675 -3.477
82 HB2 LYS 444 HB2 LYS 444 3.073 -9.354 -3.750
83 HB3 LYS 444 HB1 LYS 444 2.143 -9.250 -2.269
84 HG2 LYS 444 HG2 LYS 444 2.409 -11.729 -3.954
85 HG3 LYS 444 HG1 LYS 444 3.351 -11.379 -2.505
86 HD2 LYS 444 HD2 LYS 444 1.143 -11.177 -1.283
87 HD3 LYS 444 HD1 LYS 444 0.389 -11.865 -2.723
88 HE2 LYS 444 HE2 LYS 444 2.556 -13.157 -1.066
89 HE3 LYS 444 HE1 LYS 444 0.846 -13.577 -1.031
90 HZ1 LYS 444 HZ1 LYS 444 2.654 -13.852 -3.381
91 HZ2 LYS 444 HZ2 LYS 444 1.004 -14.259 -3.347
92 HZ3 LYS 444 HZ3 LYS 444 2.110 -15.114 -2.388
93 H THR 445 HN THR 445 -0.980 -7.800 -3.562
94 HA THR 445 HA THR 445 0.337 -5.405 -4.582
95 HB THR 445 HB THR 445 -1.976 -4.413 -3.839
96 HG1 THR 445 HG1 THR 445 -2.778 -6.208 -2.764
97 HG21 THR 445 HG21 THR 445 -2.921 -4.932 -6.003
98 HG22 THR 445 HG22 THR 445 -1.816 -6.294 -6.197
99 HG23 THR 445 HG23 THR 445 -1.190 -4.644 -6.173
100 H TYR 446 HN TYR 446 1.562 -4.277 -3.167
101 HA TYR 446 HA TYR 446 0.581 -4.157 -0.398
102 HB2 TYR 446 HB2 TYR 446 2.763 -4.209 0.462
103 HB3 TYR 446 HB1 TYR 446 2.707 -5.480 -0.740
104 HD1 TYR 446 HD1 TYR 446 3.937 -5.194 -2.903
105 HD2 TYR 446 HD2 TYR 446 4.231 -2.360 0.259
106 HE1 TYR 446 HE1 TYR 446 5.998 -4.293 -3.901
107 HE2 TYR 446 HE2 TYR 446 6.279 -1.449 -0.738
108 HH TYR 446 HH TYR 446 8.061 -2.153 -2.213
109 H TYR 447 HN TYR 447 0.487 -2.223 0.579
110 HA TYR 447 HA TYR 447 1.143 0.091 -1.095
111 HB2 TYR 447 HB2 TYR 447 -0.748 -0.182 1.249
112 HB3 TYR 447 HB1 TYR 447 -0.389 1.338 0.443
113 HD1 TYR 447 HD2 TYR 447 -1.434 -2.125 -0.601
114 HD2 TYR 447 HD1 TYR 447 -2.017 2.073 -0.993
115 HE1 TYR 447 HE2 TYR 447 -3.260 -2.535 -2.201
116 HE2 TYR 447 HE1 TYR 447 -3.842 1.675 -2.586
117 HH TYR 447 HH TYR 447 -4.611 -0.049 -4.111
118 H TYR 448 HN TYR 448 3.386 0.071 -0.538
119 HA TYR 448 HA TYR 448 4.060 0.845 2.182
120 HB2 TYR 448 HB2 TYR 448 5.726 -0.493 1.176
121 HB3 TYR 448 HB1 TYR 448 5.683 0.434 -0.318
122 HD1 TYR 448 HD1 TYR 448 6.204 1.314 3.306
123 HD2 TYR 448 HD2 TYR 448 7.644 1.549 -0.696
124 HE1 TYR 448 HE1 TYR 448 8.109 2.684 4.074
125 HE2 TYR 448 HE2 TYR 448 9.542 2.909 0.061
126 HH TYR 448 HH TYR 448 10.141 4.358 1.914
127 H ASN 449 HN ASN 449 4.294 2.836 2.923
128 HA ASN 449 HA ASN 449 4.653 5.046 1.040
129 HB2 ASN 449 HB2 ASN 449 2.185 4.715 1.661
130 HB3 ASN 449 HB1 ASN 449 2.642 5.219 3.282
131 HD21 ASN 449 HD21 ASN 449 0.800 6.501 1.511
132 HD22 ASN 449 HD22 ASN 449 1.415 8.087 1.188
133 H ASN 450 HN ASN 450 5.583 6.885 1.968
134 HA ASN 450 HA ASN 450 7.389 6.259 4.158
135 HB2 ASN 450 HB2 ASN 450 7.302 8.435 2.068
136 HB3 ASN 450 HB1 ASN 450 8.380 8.537 3.452
137 HD21 ASN 450 HD21 ASN 450 10.161 7.249 3.556
138 HD22 ASN 450 HD22 ASN 450 10.707 6.275 2.230
139 H ARG 451 HN ARG 451 4.409 7.443 3.838
140 HA ARG 451 HA ARG 451 4.284 9.660 5.542
141 HB2 ARG 451 HB2 ARG 451 2.313 7.417 5.151
142 HB3 ARG 451 HB1 ARG 451 1.974 8.840 6.123
143 HG2 ARG 451 HG2 ARG 451 2.696 8.929 3.202
144 HG3 ARG 451 HG1 ARG 451 1.045 8.898 3.814
145 HD2 ARG 451 HD2 ARG 451 1.580 11.168 3.355
146 HD3 ARG 451 HD1 ARG 451 1.578 10.976 5.106
147 HE ARG 451 HE ARG 451 3.947 11.151 5.106
148 HH11 ARG 451 HH11 ARG 451 2.523 11.597 1.934
149 HH12 ARG 451 HH12 ARG 451 3.878 12.487 1.314
150 HH21 ARG 451 HH21 ARG 451 5.751 12.297 4.274
151 HH22 ARG 451 HH22 ARG 451 5.703 12.895 2.639
152 H THR 452 HN THR 452 3.920 6.238 6.369
153 HA THR 452 HA THR 452 4.894 6.907 9.056
154 HB THR 452 HB THR 452 2.638 6.269 9.334
155 HG1 THR 452 HG1 THR 452 4.590 4.445 10.080
156 HG21 THR 452 HG21 THR 452 1.681 4.195 8.440
157 HG22 THR 452 HG22 THR 452 3.204 3.853 7.619
158 HG23 THR 452 HG23 THR 452 2.246 5.259 7.154
159 H LEU 453 HN LEU 453 5.852 5.583 6.254
160 HA LEU 453 HA LEU 453 7.472 4.139 5.581
161 HB2 LEU 453 HB2 LEU 453 8.159 4.538 8.446
162 HB3 LEU 453 HB1 LEU 453 8.906 3.183 7.624
163 HG LEU 453 HG LEU 453 10.311 5.234 7.644
164 HD11 LEU 453 HD11 LEU 453 10.402 3.443 5.859
165 HD12 LEU 453 HD12 LEU 453 11.051 5.020 5.413
166 HD13 LEU 453 HD13 LEU 453 9.454 4.536 4.849
167 HD21 LEU 453 HD21 LEU 453 9.714 7.104 6.236
168 HD22 LEU 453 HD22 LEU 453 8.458 6.853 7.451
169 HD23 LEU 453 HD23 LEU 453 8.202 6.311 5.788
170 H GLU 454 HN GLU 454 4.871 3.230 6.159
171 HA GLU 454 HA GLU 454 5.343 0.499 7.168
172 HB2 GLU 454 HB2 GLU 454 2.992 2.345 7.521
173 HB3 GLU 454 HB1 GLU 454 2.812 0.604 7.677
174 HG2 GLU 454 HG2 GLU 454 4.846 2.127 9.265
175 HG3 GLU 454 HG1 GLU 454 3.174 1.957 9.803
176 H SER 455 HN SER 455 4.417 -1.185 6.069
177 HA SER 455 HA SER 455 3.166 -0.482 3.515
178 HB2 SER 455 HB2 SER 455 3.845 -2.835 2.831
179 HB3 SER 455 HB1 SER 455 5.162 -1.685 3.050
180 HG SER 455 HG SER 455 5.737 -2.656 4.912
181 H THR 456 HN THR 456 1.092 -0.681 3.485
182 HA THR 456 HA THR 456 -0.240 -2.491 5.353
183 HB THR 456 HB THR 456 -2.315 -1.310 4.578
184 HG1 THR 456 HG1 THR 456 -1.329 -0.674 2.516
185 HG21 THR 456 HG21 THR 456 -1.667 0.934 5.590
186 HG22 THR 456 HG22 THR 456 -0.026 0.294 5.710
187 HG23 THR 456 HG23 THR 456 -1.345 -0.490 6.581
188 H TRP 457 HN TRP 457 -0.522 -4.491 4.626
189 HA TRP 457 HA TRP 457 -0.739 -4.959 1.759
190 HB2 TRP 457 HB2 TRP 457 -0.307 -6.904 4.052
191 HB3 TRP 457 HB1 TRP 457 -0.307 -7.336 2.337
192 HD1 TRP 457 HD1 TRP 457 1.573 -4.855 4.644
193 HE1 TRP 457 HE1 TRP 457 3.978 -4.594 3.791
194 HE3 TRP 457 HE3 TRP 457 1.353 -8.009 0.617
195 HZ2 TRP 457 HZ2 TRP 457 5.563 -5.554 1.695
196 HZ3 TRP 457 HZ3 TRP 457 3.387 -8.304 -0.742
197 HH2 TRP 457 HH2 TRP 457 5.450 -7.116 -0.208
198 H GLU 458 HN GLU 458 -2.684 -4.412 4.323
199 HA GLU 458 HA GLU 458 -4.994 -5.489 2.857
200 HB2 GLU 458 HB2 GLU 458 -4.715 -4.541 5.717
201 HB3 GLU 458 HB1 GLU 458 -6.268 -4.853 4.955
202 HG2 GLU 458 HG2 GLU 458 -4.070 -6.856 5.417
203 HG3 GLU 458 HG1 GLU 458 -5.587 -6.735 6.307
204 H LYS 459 HN LYS 459 -6.586 -4.010 2.196
205 HA LYS 459 HA LYS 459 -5.578 -1.560 1.284
206 HB2 LYS 459 HB2 LYS 459 -8.426 -2.531 1.469
207 HB3 LYS 459 HB1 LYS 459 -7.906 -1.121 0.553
208 HG2 LYS 459 HG2 LYS 459 -6.479 -2.559 -0.828
209 HG3 LYS 459 HG1 LYS 459 -7.037 -3.964 0.076
210 HD2 LYS 459 HD2 LYS 459 -8.276 -3.862 -1.967
211 HD3 LYS 459 HD1 LYS 459 -9.361 -3.419 -0.651
212 HE2 LYS 459 HE2 LYS 459 -7.904 -1.362 -2.283
213 HE3 LYS 459 HE1 LYS 459 -9.461 -2.020 -2.781
214 HZ1 LYS 459 HZ1 LYS 459 -10.504 -1.135 -0.888
215 HZ2 LYS 459 HZ2 LYS 459 -9.515 0.116 -1.475
216 HZ3 LYS 459 HZ3 LYS 459 -9.034 -0.789 -0.131
217 HA PRO 460 HA PRO 460 -6.068 0.740 5.123
218 HB2 PRO 460 HB2 PRO 460 -5.310 3.044 3.458
219 HB3 PRO 460 HB1 PRO 460 -4.527 2.392 4.899
220 HG2 PRO 460 HG2 PRO 460 -3.454 2.134 2.446
221 HG3 PRO 460 HG1 PRO 460 -3.262 0.900 3.702
222 HD2 PRO 460 HD2 PRO 460 -5.054 0.912 1.317
223 HD3 PRO 460 HD1 PRO 460 -4.169 -0.431 2.070
224 H GLN 461 HN GLN 461 -7.787 1.713 5.938
225 HA GLN 461 HA GLN 461 -9.990 2.513 4.324
226 HB2 GLN 461 HB2 GLN 461 -10.972 3.303 6.499
227 HB3 GLN 461 HB1 GLN 461 -10.485 1.615 6.486
228 HG2 GLN 461 HG2 GLN 461 -8.715 3.778 7.582
229 HG3 GLN 461 HG1 GLN 461 -9.944 2.977 8.558
230 HE21 GLN 461 HE21 GLN 461 -6.950 3.016 8.653
231 HE22 GLN 461 HE22 GLN 461 -6.499 1.336 8.700
232 H GLU 462 HN GLU 462 -7.165 4.080 5.290
233 HA GLU 462 HA GLU 462 -8.138 6.768 5.236
234 HB2 GLU 462 HB2 GLU 462 -5.430 5.491 5.222
235 HB3 GLU 462 HB1 GLU 462 -5.581 7.194 4.826
236 HG2 GLU 462 HG2 GLU 462 -5.010 6.793 7.179
237 HG3 GLU 462 HG1 GLU 462 -6.524 7.672 6.980
238 H LEU 463 HN LEU 463 -7.426 4.457 2.847
239 HA LEU 463 HA LEU 463 -7.221 6.571 0.808
240 HB2 LEU 463 HB2 LEU 463 -5.147 5.240 1.105
241 HB3 LEU 463 HB1 LEU 463 -6.043 3.799 0.665
242 HG LEU 463 HG LEU 463 -6.497 4.826 -1.561
243 HD11 LEU 463 HD11 LEU 463 -4.519 6.900 -0.623
244 HD12 LEU 463 HD12 LEU 463 -6.237 7.167 -0.916
245 HD13 LEU 463 HD13 LEU 463 -5.169 6.749 -2.256
246 HD21 LEU 463 HD21 LEU 463 -3.589 4.556 -0.823
247 HD22 LEU 463 HD22 LEU 463 -4.270 4.422 -2.444
248 HD23 LEU 463 HD23 LEU 463 -4.678 3.226 -1.214
249 H LYS 464 HN LYS 464 -8.664 3.488 1.666
250 HA LYS 464 HA LYS 464 -10.429 2.322 0.874
251 HB2 LYS 464 HB2 LYS 464 -11.046 4.935 -0.508
252 HB3 LYS 464 HB1 LYS 464 -12.099 3.530 -0.577
253 HG2 LYS 464 HG2 LYS 464 -12.304 3.596 1.874
254 HG3 LYS 464 HG1 LYS 464 -11.312 5.052 1.896
255 HD2 LYS 464 HD2 LYS 464 -13.611 5.710 2.029
256 HD3 LYS 464 HD1 LYS 464 -13.005 6.150 0.433
257 HE2 LYS 464 HE2 LYS 464 -14.459 3.565 0.915
258 HE3 LYS 464 HE1 LYS 464 -15.325 5.063 0.589
259 HZ1 LYS 464 HZ1 LYS 464 -15.051 3.875 -1.444
260 HZ2 LYS 464 HZ2 LYS 464 -13.385 3.700 -1.202
261 HZ3 LYS 464 HZ3 LYS 464 -14.037 5.233 -1.504
Start of MODEL 4
1 H SER 433 HT1 SER 433 -0.322 8.847 -5.342
2 HA SER 433 HA SER 433 1.899 7.802 -5.161
3 HB2 SER 433 HB2 SER 433 3.024 10.023 -4.556
4 HB3 SER 433 HB1 SER 433 1.828 10.074 -5.854
5 HG SER 433 HG SER 433 1.324 11.740 -4.514
6 H GLU 434 HN GLU 434 0.865 9.468 -2.202
7 HA GLU 434 HA GLU 434 2.951 8.502 -0.567
8 HB2 GLU 434 HB2 GLU 434 1.643 9.316 1.297
9 HB3 GLU 434 HB1 GLU 434 1.550 10.478 -0.017
10 HG2 GLU 434 HG2 GLU 434 -0.579 8.434 0.563
11 HG3 GLU 434 HG1 GLU 434 -0.585 10.070 1.212
12 H TRP 435 HN TRP 435 -0.107 7.220 -1.573
13 HA TRP 435 HA TRP 435 0.415 4.759 -0.055
14 HB2 TRP 435 HB2 TRP 435 -2.089 5.436 -1.626
15 HB3 TRP 435 HB1 TRP 435 -1.880 4.142 -0.449
16 HD1 TRP 435 HD1 TRP 435 -3.157 7.595 -0.718
17 HE1 TRP 435 HE1 TRP 435 -3.546 8.604 1.619
18 HE3 TRP 435 HE3 TRP 435 -0.724 4.108 2.101
19 HZ2 TRP 435 HZ2 TRP 435 -2.909 8.019 4.285
20 HZ3 TRP 435 HZ3 TRP 435 -0.640 4.415 4.538
21 HH2 TRP 435 HH2 TRP 435 -1.695 6.345 5.605
22 H THR 436 HN THR 436 1.843 3.592 -1.241
23 HA THR 436 HA THR 436 1.621 3.625 -4.140
24 HB THR 436 HB THR 436 3.669 2.346 -2.323
25 HG1 THR 436 HG1 THR 436 3.533 4.752 -2.738
26 HG21 THR 436 HG21 THR 436 3.412 1.018 -4.381
27 HG22 THR 436 HG22 THR 436 4.959 1.868 -4.357
28 HG23 THR 436 HG23 THR 436 3.635 2.479 -5.347
29 H GLU 437 HN GLU 437 -0.132 2.424 -4.688
30 HA GLU 437 HA GLU 437 -0.287 -0.334 -3.761
31 HB2 GLU 437 HB2 GLU 437 -2.394 0.898 -4.044
32 HB3 GLU 437 HB1 GLU 437 -2.006 1.203 -5.730
33 HG2 GLU 437 HG2 GLU 437 -2.086 -1.225 -6.153
34 HG3 GLU 437 HG1 GLU 437 -2.563 -1.479 -4.475
35 H ARG 438 HN ARG 438 1.563 -1.237 -4.575
36 HA ARG 438 HA ARG 438 1.841 -1.195 -7.504
37 HB2 ARG 438 HB2 ARG 438 3.793 -0.340 -6.242
38 HB3 ARG 438 HB1 ARG 438 3.929 -1.894 -5.431
39 HG2 ARG 438 HG2 ARG 438 4.389 -2.985 -7.549
40 HG3 ARG 438 HG1 ARG 438 4.195 -1.450 -8.398
41 HD2 ARG 438 HD2 ARG 438 6.088 -0.524 -7.191
42 HD3 ARG 438 HD1 ARG 438 6.257 -2.016 -6.273
43 HE ARG 438 HE ARG 438 6.476 -2.168 -9.190
44 HH11 ARG 438 HH11 ARG 438 8.021 -2.261 -6.042
45 HH12 ARG 438 HH12 ARG 438 9.500 -2.937 -6.655
46 HH21 ARG 438 HH21 ARG 438 8.415 -3.030 -9.990
47 HH22 ARG 438 HH22 ARG 438 9.742 -3.347 -8.910
48 H LYS 439 HN LYS 439 1.029 -2.889 -8.430
49 HA LYS 439 HA LYS 439 0.616 -5.325 -6.904
50 HB2 LYS 439 HB2 LYS 439 -1.158 -4.167 -8.337
51 HB3 LYS 439 HB1 LYS 439 -0.276 -4.780 -9.727
52 HG2 LYS 439 HG2 LYS 439 -0.696 -7.042 -9.082
53 HG3 LYS 439 HG1 LYS 439 -1.391 -6.521 -7.543
54 HD2 LYS 439 HD2 LYS 439 -2.501 -5.979 -10.298
55 HD3 LYS 439 HD1 LYS 439 -3.176 -7.067 -9.082
56 HE2 LYS 439 HE2 LYS 439 -3.689 -5.247 -7.626
57 HE3 LYS 439 HE1 LYS 439 -2.796 -4.112 -8.635
58 HZ1 LYS 439 HZ1 LYS 439 -5.349 -5.477 -9.288
59 HZ2 LYS 439 HZ2 LYS 439 -4.436 -4.605 -10.421
60 HZ3 LYS 439 HZ3 LYS 439 -5.087 -3.812 -9.068
61 H THR 440 HN THR 440 2.303 -6.618 -6.852
62 HA THR 440 HA THR 440 4.045 -6.904 -9.164
63 HB THR 440 HB THR 440 5.384 -8.386 -7.708
64 HG1 THR 440 HG1 THR 440 3.397 -7.791 -5.740
65 HG21 THR 440 HG21 THR 440 4.609 -5.763 -6.425
66 HG22 THR 440 HG22 THR 440 5.837 -5.995 -7.670
67 HG23 THR 440 HG23 THR 440 6.069 -6.685 -6.062
68 H ALA 441 HN ALA 441 4.474 -8.913 -10.184
69 HA ALA 441 HA ALA 441 2.086 -10.403 -10.707
70 HB1 ALA 441 HB1 ALA 441 3.402 -11.567 -12.378
71 HB2 ALA 441 HB2 ALA 441 4.888 -10.891 -11.711
72 HB3 ALA 441 HB3 ALA 441 3.703 -9.831 -12.474
73 H ASP 442 HN ASP 442 4.233 -10.606 -8.267
74 HA ASP 442 HA ASP 442 4.424 -13.453 -7.974
75 HB2 ASP 442 HB2 ASP 442 6.018 -11.729 -6.998
76 HB3 ASP 442 HB1 ASP 442 4.757 -11.339 -5.835
77 H GLY 443 HN GLY 443 1.883 -11.420 -7.891
78 HA2 GLY 443 HA2 GLY 443 -0.305 -11.827 -7.232
79 HA3 GLY 443 HA1 GLY 443 0.257 -13.218 -6.310
80 H LYS 444 HN LYS 444 1.698 -10.064 -5.995
81 HA LYS 444 HA LYS 444 0.503 -9.831 -3.313
82 HB2 LYS 444 HB2 LYS 444 3.365 -9.113 -3.963
83 HB3 LYS 444 HB1 LYS 444 2.604 -9.171 -2.386
84 HG2 LYS 444 HG2 LYS 444 3.133 -11.560 -4.136
85 HG3 LYS 444 HG1 LYS 444 4.122 -11.051 -2.769
86 HD2 LYS 444 HD2 LYS 444 2.056 -11.276 -1.342
87 HD3 LYS 444 HD1 LYS 444 1.284 -12.048 -2.728
88 HE2 LYS 444 HE2 LYS 444 3.808 -12.997 -1.370
89 HE3 LYS 444 HE1 LYS 444 2.204 -13.691 -1.143
90 HZ1 LYS 444 HZ1 LYS 444 3.797 -13.664 -3.656
91 HZ2 LYS 444 HZ2 LYS 444 2.198 -14.213 -3.545
92 HZ3 LYS 444 HZ3 LYS 444 3.422 -15.015 -2.696
93 H THR 445 HN THR 445 -0.584 -7.982 -3.130
94 HA THR 445 HA THR 445 0.285 -5.662 -4.726
95 HB THR 445 HB THR 445 -2.217 -5.651 -3.075
96 HG1 THR 445 HG1 THR 445 -2.279 -7.614 -4.320
97 HG21 THR 445 HG21 THR 445 -3.012 -4.219 -4.914
98 HG22 THR 445 HG22 THR 445 -1.482 -4.459 -5.759
99 HG23 THR 445 HG23 THR 445 -1.513 -3.608 -4.215
100 H TYR 446 HN TYR 446 1.997 -4.883 -3.444
101 HA TYR 446 HA TYR 446 1.390 -4.529 -0.624
102 HB2 TYR 446 HB2 TYR 446 3.664 -4.124 -0.204
103 HB3 TYR 446 HB1 TYR 446 3.596 -5.488 -1.290
104 HD1 TYR 446 HD1 TYR 446 4.182 -5.073 -3.767
105 HD2 TYR 446 HD2 TYR 446 4.919 -2.243 -0.672
106 HE1 TYR 446 HE1 TYR 446 5.867 -3.969 -5.177
107 HE2 TYR 446 HE2 TYR 446 6.592 -1.129 -2.078
108 HH TYR 446 HH TYR 446 8.035 -1.598 -3.944
109 H TYR 447 HN TYR 447 0.709 -2.764 0.180
110 HA TYR 447 HA TYR 447 1.069 -0.283 -1.299
111 HB2 TYR 447 HB2 TYR 447 -0.506 -0.781 1.244
112 HB3 TYR 447 HB1 TYR 447 -0.503 0.693 0.289
113 HD1 TYR 447 HD2 TYR 447 -1.201 -2.980 -0.254
114 HD2 TYR 447 HD1 TYR 447 -2.314 1.058 -1.047
115 HE1 TYR 447 HE2 TYR 447 -3.144 -3.769 -1.510
116 HE2 TYR 447 HE1 TYR 447 -4.263 0.266 -2.312
117 HH TYR 447 HH TYR 447 -4.982 -1.728 -3.526
118 H TYR 448 HN TYR 448 3.241 0.213 -0.917
119 HA TYR 448 HA TYR 448 4.120 0.413 1.821
120 HB2 TYR 448 HB2 TYR 448 5.920 -0.099 0.434
121 HB3 TYR 448 HB1 TYR 448 5.362 0.961 -0.855
122 HD1 TYR 448 HD1 TYR 448 6.525 1.255 2.705
123 HD2 TYR 448 HD2 TYR 448 6.586 2.869 -1.233
124 HE1 TYR 448 HE1 TYR 448 8.072 3.019 3.455
125 HE2 TYR 448 HE2 TYR 448 8.138 4.627 -0.495
126 HH TYR 448 HH TYR 448 8.739 5.775 1.638
127 H ASN 449 HN ASN 449 3.590 1.950 3.063
128 HA ASN 449 HA ASN 449 2.479 4.437 2.066
129 HB2 ASN 449 HB2 ASN 449 1.123 3.641 3.756
130 HB3 ASN 449 HB1 ASN 449 2.470 2.943 4.649
131 HD21 ASN 449 HD21 ASN 449 0.816 5.905 3.853
132 HD22 ASN 449 HD22 ASN 449 1.311 6.782 5.258
133 H ASN 450 HN ASN 450 3.600 6.234 1.926
134 HA ASN 450 HA ASN 450 6.256 6.333 3.141
135 HB2 ASN 450 HB2 ASN 450 5.757 6.893 0.673
136 HB3 ASN 450 HB1 ASN 450 5.085 8.401 1.286
137 HD21 ASN 450 HD21 ASN 450 6.446 9.969 2.087
138 HD22 ASN 450 HD22 ASN 450 8.165 9.898 1.889
139 H ARG 451 HN ARG 451 3.138 7.298 3.859
140 HA ARG 451 HA ARG 451 3.581 9.834 4.986
141 HB2 ARG 451 HB2 ARG 451 1.465 7.816 5.642
142 HB3 ARG 451 HB1 ARG 451 1.507 9.449 6.286
143 HG2 ARG 451 HG2 ARG 451 1.261 8.702 3.381
144 HG3 ARG 451 HG1 ARG 451 -0.040 9.273 4.425
145 HD2 ARG 451 HD2 ARG 451 2.425 10.821 3.633
146 HD3 ARG 451 HD1 ARG 451 0.795 11.073 3.014
147 HE ARG 451 HE ARG 451 1.630 11.591 5.800
148 HH11 ARG 451 HH11 ARG 451 -0.442 12.249 3.045
149 HH12 ARG 451 HH12 ARG 451 -1.187 13.639 3.775
150 HH21 ARG 451 HH21 ARG 451 0.650 13.419 6.761
151 HH22 ARG 451 HH22 ARG 451 -0.564 14.304 5.881
152 H THR 452 HN THR 452 3.525 6.620 6.434
153 HA THR 452 HA THR 452 4.880 7.734 8.799
154 HB THR 452 HB THR 452 3.161 5.256 8.847
155 HG1 THR 452 HG1 THR 452 1.964 7.470 9.887
156 HG21 THR 452 HG21 THR 452 3.970 7.232 10.987
157 HG22 THR 452 HG22 THR 452 4.659 5.624 10.759
158 HG23 THR 452 HG23 THR 452 2.967 5.804 11.227
159 H LEU 453 HN LEU 453 5.432 5.974 6.113
160 HA LEU 453 HA LEU 453 7.051 4.532 5.422
161 HB2 LEU 453 HB2 LEU 453 8.041 5.231 8.143
162 HB3 LEU 453 HB1 LEU 453 8.729 3.818 7.372
163 HG LEU 453 HG LEU 453 10.033 5.963 7.089
164 HD11 LEU 453 HD11 LEU 453 10.044 3.893 5.543
165 HD12 LEU 453 HD12 LEU 453 10.778 5.390 4.972
166 HD13 LEU 453 HD13 LEU 453 9.169 4.933 4.419
167 HD21 LEU 453 HD21 LEU 453 9.279 7.584 5.485
168 HD22 LEU 453 HD22 LEU 453 8.039 7.413 6.731
169 HD23 LEU 453 HD23 LEU 453 7.824 6.642 5.158
170 H GLU 454 HN GLU 454 4.536 3.695 6.362
171 HA GLU 454 HA GLU 454 5.000 1.201 7.822
172 HB2 GLU 454 HB2 GLU 454 2.499 2.720 7.079
173 HB3 GLU 454 HB1 GLU 454 2.461 1.120 7.804
174 HG2 GLU 454 HG2 GLU 454 3.805 3.487 9.075
175 HG3 GLU 454 HG1 GLU 454 2.127 3.035 9.375
176 H SER 455 HN SER 455 4.984 -0.731 6.816
177 HA SER 455 HA SER 455 4.222 -0.825 4.013
178 HB2 SER 455 HB2 SER 455 5.043 -3.206 4.163
179 HB3 SER 455 HB1 SER 455 6.259 -1.987 4.546
180 HG SER 455 HG SER 455 4.719 -3.092 6.622
181 H THR 456 HN THR 456 2.191 -1.151 3.500
182 HA THR 456 HA THR 456 0.454 -2.583 5.399
183 HB THR 456 HB THR 456 -1.391 -1.165 4.209
184 HG1 THR 456 HG1 THR 456 0.518 -0.296 2.812
185 HG21 THR 456 HG21 THR 456 -1.118 0.655 5.832
186 HG22 THR 456 HG22 THR 456 0.531 0.118 6.152
187 HG23 THR 456 HG23 THR 456 -0.829 -0.923 6.572
188 H TRP 457 HN TRP 457 -0.111 -4.480 4.618
189 HA TRP 457 HA TRP 457 -0.246 -4.803 1.709
190 HB2 TRP 457 HB2 TRP 457 0.366 -6.835 3.889
191 HB3 TRP 457 HB1 TRP 457 0.268 -7.211 2.162
192 HD1 TRP 457 HD1 TRP 457 2.144 -4.564 4.299
193 HE1 TRP 457 HE1 TRP 457 4.481 -4.214 3.318
194 HE3 TRP 457 HE3 TRP 457 1.953 -7.983 0.494
195 HZ2 TRP 457 HZ2 TRP 457 6.027 -5.189 1.219
196 HZ3 TRP 457 HZ3 TRP 457 3.947 -8.234 -0.937
197 HH2 TRP 457 HH2 TRP 457 5.949 -6.887 -0.569
198 H GLU 458 HN GLU 458 -2.081 -3.959 3.956
199 HA GLU 458 HA GLU 458 -4.481 -5.406 3.051
200 HB2 GLU 458 HB2 GLU 458 -4.334 -3.532 5.407
201 HB3 GLU 458 HB1 GLU 458 -5.530 -4.779 5.079
202 HG2 GLU 458 HG2 GLU 458 -4.013 -6.505 5.659
203 HG3 GLU 458 HG1 GLU 458 -2.658 -5.378 5.716
204 H LYS 459 HN LYS 459 -6.235 -4.025 2.332
205 HA LYS 459 HA LYS 459 -5.355 -1.700 0.957
206 HB2 LYS 459 HB2 LYS 459 -8.131 -2.772 1.463
207 HB3 LYS 459 HB1 LYS 459 -7.787 -1.389 0.430
208 HG2 LYS 459 HG2 LYS 459 -6.390 -2.821 -0.993
209 HG3 LYS 459 HG1 LYS 459 -6.798 -4.204 0.026
210 HD2 LYS 459 HD2 LYS 459 -9.149 -3.952 -0.538
211 HD3 LYS 459 HD1 LYS 459 -8.779 -2.523 -1.504
212 HE2 LYS 459 HE2 LYS 459 -7.726 -5.299 -2.031
213 HE3 LYS 459 HE1 LYS 459 -9.080 -4.554 -2.876
214 HZ1 LYS 459 HZ1 LYS 459 -6.280 -3.545 -2.872
215 HZ2 LYS 459 HZ2 LYS 459 -7.582 -2.833 -3.689
216 HZ3 LYS 459 HZ3 LYS 459 -7.037 -4.372 -4.145
217 HA PRO 460 HA PRO 460 -5.553 1.225 4.352
218 HB2 PRO 460 HB2 PRO 460 -5.570 3.136 2.072
219 HB3 PRO 460 HB1 PRO 460 -4.511 3.079 3.483
220 HG2 PRO 460 HG2 PRO 460 -3.642 2.321 1.085
221 HG3 PRO 460 HG1 PRO 460 -3.141 1.476 2.558
222 HD2 PRO 460 HD2 PRO 460 -5.135 0.660 0.487
223 HD3 PRO 460 HD1 PRO 460 -3.988 -0.340 1.399
224 H GLN 461 HN GLN 461 -7.325 1.857 5.361
225 HA GLN 461 HA GLN 461 -9.811 1.974 3.873
226 HB2 GLN 461 HB2 GLN 461 -9.229 1.985 6.835
227 HB3 GLN 461 HB1 GLN 461 -10.849 2.070 6.153
228 HG2 GLN 461 HG2 GLN 461 -10.597 -0.092 5.143
229 HG3 GLN 461 HG1 GLN 461 -8.908 -0.170 5.642
230 HE21 GLN 461 HE21 GLN 461 -9.406 0.975 8.248
231 HE22 GLN 461 HE22 GLN 461 -10.181 -0.254 9.194
232 H GLU 462 HN GLU 462 -7.538 4.180 5.178
233 HA GLU 462 HA GLU 462 -9.452 6.321 5.505
234 HB2 GLU 462 HB2 GLU 462 -7.443 7.777 5.816
235 HB3 GLU 462 HB1 GLU 462 -7.540 6.428 6.934
236 HG2 GLU 462 HG2 GLU 462 -5.902 6.200 4.444
237 HG3 GLU 462 HG1 GLU 462 -5.280 7.050 5.856
238 H LEU 463 HN LEU 463 -7.922 4.871 2.914
239 HA LEU 463 HA LEU 463 -7.977 7.271 1.249
240 HB2 LEU 463 HB2 LEU 463 -6.050 5.690 1.142
241 HB3 LEU 463 HB1 LEU 463 -7.139 4.457 0.539
242 HG LEU 463 HG LEU 463 -7.584 5.852 -1.455
243 HD11 LEU 463 HD11 LEU 463 -6.168 7.783 -1.917
244 HD12 LEU 463 HD12 LEU 463 -5.433 7.633 -0.321
245 HD13 LEU 463 HD13 LEU 463 -7.142 8.040 -0.468
246 HD21 LEU 463 HD21 LEU 463 -5.889 4.127 -1.560
247 HD22 LEU 463 HD22 LEU 463 -4.683 5.236 -0.907
248 HD23 LEU 463 HD23 LEU 463 -5.380 5.528 -2.500
249 H LYS 464 HN LYS 464 -10.116 5.014 2.283
250 HA LYS 464 HA LYS 464 -11.793 5.346 -0.102
251 HB2 LYS 464 HB2 LYS 464 -11.494 2.760 1.449
252 HB3 LYS 464 HB1 LYS 464 -12.596 3.034 0.107
253 HG2 LYS 464 HG2 LYS 464 -10.660 3.420 -1.369
254 HG3 LYS 464 HG1 LYS 464 -9.588 3.052 -0.017
255 HD2 LYS 464 HD2 LYS 464 -10.617 0.813 0.142
256 HD3 LYS 464 HD1 LYS 464 -11.603 1.192 -1.271
257 HE2 LYS 464 HE2 LYS 464 -8.593 1.072 -1.174
258 HE3 LYS 464 HE1 LYS 464 -9.661 -0.124 -1.905
259 HZ1 LYS 464 HZ1 LYS 464 -10.416 1.590 -3.466
260 HZ2 LYS 464 HZ2 LYS 464 -8.750 1.317 -3.585
261 HZ3 LYS 464 HZ3 LYS 464 -9.322 2.697 -2.786
Start of MODEL 5
1 H SER 433 HT1 SER 433 -1.822 10.977 -4.586
2 HA SER 433 HA SER 433 -2.767 10.232 -2.529
3 HB2 SER 433 HB2 SER 433 -3.361 7.798 -2.334
4 HB3 SER 433 HB1 SER 433 -4.455 8.718 -3.365
5 HG SER 433 HG SER 433 -3.654 7.748 -5.135
6 H GLU 434 HN GLU 434 -1.273 9.658 -1.041
7 HA GLU 434 HA GLU 434 1.370 9.109 -2.034
8 HB2 GLU 434 HB2 GLU 434 1.985 9.262 0.421
9 HB3 GLU 434 HB1 GLU 434 1.281 10.700 -0.303
10 HG2 GLU 434 HG2 GLU 434 -0.497 8.773 1.105
11 HG3 GLU 434 HG1 GLU 434 0.518 9.857 2.053
12 H TRP 435 HN TRP 435 -1.149 7.079 -1.220
13 HA TRP 435 HA TRP 435 0.537 5.023 -0.015
14 HB2 TRP 435 HB2 TRP 435 -2.396 4.857 -0.781
15 HB3 TRP 435 HB1 TRP 435 -1.505 3.681 0.175
16 HD1 TRP 435 HD1 TRP 435 -3.494 6.841 0.467
17 HE1 TRP 435 HE1 TRP 435 -3.591 7.604 2.925
18 HE3 TRP 435 HE3 TRP 435 -0.006 3.662 2.451
19 HZ2 TRP 435 HZ2 TRP 435 -2.354 6.955 5.370
20 HZ3 TRP 435 HZ3 TRP 435 0.487 3.810 4.861
21 HH2 TRP 435 HH2 TRP 435 -0.654 5.427 6.287
22 H THR 436 HN THR 436 1.783 3.881 -1.365
23 HA THR 436 HA THR 436 0.994 3.639 -4.154
24 HB THR 436 HB THR 436 3.541 2.873 -2.724
25 HG1 THR 436 HG1 THR 436 2.898 5.161 -3.345
26 HG21 THR 436 HG21 THR 436 3.139 1.265 -4.536
27 HG22 THR 436 HG22 THR 436 4.467 2.354 -4.954
28 HG23 THR 436 HG23 THR 436 2.873 2.593 -5.666
29 H GLU 437 HN GLU 437 -0.516 2.125 -4.415
30 HA GLU 437 HA GLU 437 -0.076 -0.566 -3.403
31 HB2 GLU 437 HB2 GLU 437 -2.397 0.141 -3.504
32 HB3 GLU 437 HB1 GLU 437 -2.227 0.600 -5.194
33 HG2 GLU 437 HG2 GLU 437 -1.738 -1.811 -5.698
34 HG3 GLU 437 HG1 GLU 437 -2.178 -2.176 -4.033
35 H ARG 438 HN ARG 438 1.813 -1.183 -4.392
36 HA ARG 438 HA ARG 438 1.795 -1.226 -7.325
37 HB2 ARG 438 HB2 ARG 438 3.791 -0.257 -6.204
38 HB3 ARG 438 HB1 ARG 438 4.082 -1.814 -5.436
39 HG2 ARG 438 HG2 ARG 438 4.375 -2.844 -7.626
40 HG3 ARG 438 HG1 ARG 438 4.082 -1.282 -8.398
41 HD2 ARG 438 HD2 ARG 438 6.037 -0.358 -7.247
42 HD3 ARG 438 HD1 ARG 438 6.326 -1.921 -6.489
43 HE ARG 438 HE ARG 438 6.328 -1.689 -9.418
44 HH11 ARG 438 HH11 ARG 438 8.008 -2.351 -6.417
45 HH12 ARG 438 HH12 ARG 438 9.390 -3.058 -7.200
46 HH21 ARG 438 HH21 ARG 438 8.142 -2.592 -10.453
47 HH22 ARG 438 HH22 ARG 438 9.494 -3.150 -9.504
48 H LYS 439 HN LYS 439 1.462 -3.048 -8.366
49 HA LYS 439 HA LYS 439 0.892 -5.401 -6.758
50 HB2 LYS 439 HB2 LYS 439 -0.770 -4.645 -8.399
51 HB3 LYS 439 HB1 LYS 439 0.407 -4.843 -9.689
52 HG2 LYS 439 HG2 LYS 439 0.463 -7.240 -9.299
53 HG3 LYS 439 HG1 LYS 439 -0.677 -7.060 -7.962
54 HD2 LYS 439 HD2 LYS 439 -1.224 -6.334 -10.842
55 HD3 LYS 439 HD1 LYS 439 -1.783 -7.801 -10.036
56 HE2 LYS 439 HE2 LYS 439 -2.451 -5.024 -9.083
57 HE3 LYS 439 HE1 LYS 439 -3.468 -5.936 -10.194
58 HZ1 LYS 439 HZ1 LYS 439 -4.115 -6.082 -7.807
59 HZ2 LYS 439 HZ2 LYS 439 -2.681 -6.938 -7.513
60 HZ3 LYS 439 HZ3 LYS 439 -3.852 -7.581 -8.557
61 H THR 440 HN THR 440 2.567 -6.636 -6.335
62 HA THR 440 HA THR 440 4.625 -7.102 -8.332
63 HB THR 440 HB THR 440 5.645 -8.588 -6.621
64 HG1 THR 440 HG1 THR 440 3.482 -7.711 -4.969
65 HG21 THR 440 HG21 THR 440 6.242 -6.224 -6.677
66 HG22 THR 440 HG22 THR 440 6.218 -6.818 -5.018
67 HG23 THR 440 HG23 THR 440 4.881 -5.842 -5.626
68 H ALA 441 HN ALA 441 5.144 -9.146 -9.182
69 HA ALA 441 HA ALA 441 2.890 -10.545 -10.164
70 HB1 ALA 441 HB1 ALA 441 4.929 -10.266 -11.462
71 HB2 ALA 441 HB2 ALA 441 4.521 -11.973 -11.293
72 HB3 ALA 441 HB3 ALA 441 5.810 -11.272 -10.313
73 H ASP 442 HN ASP 442 4.376 -10.835 -7.211
74 HA ASP 442 HA ASP 442 4.113 -13.670 -6.852
75 HB2 ASP 442 HB2 ASP 442 5.684 -12.157 -5.553
76 HB3 ASP 442 HB1 ASP 442 4.270 -11.560 -4.690
77 H GLY 443 HN GLY 443 1.941 -11.201 -7.174
78 HA2 GLY 443 HA2 GLY 443 -0.392 -11.418 -7.114
79 HA3 GLY 443 HA1 GLY 443 -0.214 -12.822 -6.071
80 H LYS 444 HN LYS 444 1.443 -9.818 -5.473
81 HA LYS 444 HA LYS 444 -0.332 -9.335 -3.188
82 HB2 LYS 444 HB2 LYS 444 2.678 -9.509 -3.132
83 HB3 LYS 444 HB1 LYS 444 1.714 -8.839 -1.820
84 HG2 LYS 444 HG2 LYS 444 0.652 -10.945 -1.435
85 HG3 LYS 444 HG1 LYS 444 1.398 -11.637 -2.876
86 HD2 LYS 444 HD2 LYS 444 3.605 -11.363 -1.864
87 HD3 LYS 444 HD1 LYS 444 2.857 -10.673 -0.422
88 HE2 LYS 444 HE2 LYS 444 1.734 -12.737 0.057
89 HE3 LYS 444 HE1 LYS 444 2.264 -13.431 -1.476
90 HZ1 LYS 444 HZ1 LYS 444 3.587 -14.203 0.404
91 HZ2 LYS 444 HZ2 LYS 444 4.064 -12.609 0.740
92 HZ3 LYS 444 HZ3 LYS 444 4.529 -13.347 -0.715
93 H THR 445 HN THR 445 -1.104 -7.379 -3.301
94 HA THR 445 HA THR 445 0.378 -5.222 -4.580
95 HB THR 445 HB THR 445 -1.670 -3.874 -3.844
96 HG1 THR 445 HG1 THR 445 -2.256 -5.565 -2.263
97 HG21 THR 445 HG21 THR 445 -3.085 -4.776 -5.622
98 HG22 THR 445 HG22 THR 445 -2.079 -6.221 -5.692
99 HG23 THR 445 HG23 THR 445 -1.401 -4.651 -6.132
100 H TYR 446 HN TYR 446 1.984 -4.398 -3.326
101 HA TYR 446 HA TYR 446 1.474 -4.182 -0.461
102 HB2 TYR 446 HB2 TYR 446 3.799 -3.840 -0.135
103 HB3 TYR 446 HB1 TYR 446 3.614 -5.191 -1.232
104 HD1 TYR 446 HD1 TYR 446 4.130 -4.830 -3.698
105 HD2 TYR 446 HD2 TYR 446 5.054 -1.951 -0.705
106 HE1 TYR 446 HE1 TYR 446 5.767 -3.787 -5.206
107 HE2 TYR 446 HE2 TYR 446 6.687 -0.897 -2.209
108 HH TYR 446 HH TYR 446 8.037 -1.438 -4.118
109 H TYR 447 HN TYR 447 0.831 -2.364 0.407
110 HA TYR 447 HA TYR 447 1.149 0.094 -1.132
111 HB2 TYR 447 HB2 TYR 447 -0.344 -0.386 1.458
112 HB3 TYR 447 HB1 TYR 447 -0.332 1.116 0.549
113 HD1 TYR 447 HD2 TYR 447 -1.041 -2.504 -0.159
114 HD2 TYR 447 HD1 TYR 447 -2.253 1.546 -0.622
115 HE1 TYR 447 HE2 TYR 447 -3.044 -3.252 -1.379
116 HE2 TYR 447 HE1 TYR 447 -4.260 0.810 -1.838
117 HH TYR 447 HH TYR 447 -5.166 -2.536 -1.973
118 H TYR 448 HN TYR 448 3.422 0.275 -0.836
119 HA TYR 448 HA TYR 448 4.312 0.905 1.863
120 HB2 TYR 448 HB2 TYR 448 5.976 -0.177 0.558
121 HB3 TYR 448 HB1 TYR 448 5.709 0.893 -0.812
122 HD1 TYR 448 HD1 TYR 448 6.417 1.547 2.827
123 HD2 TYR 448 HD2 TYR 448 7.600 2.119 -1.222
124 HE1 TYR 448 HE1 TYR 448 8.258 3.016 3.578
125 HE2 TYR 448 HE2 TYR 448 9.434 3.579 -0.486
126 HH TYR 448 HH TYR 448 10.046 4.965 1.420
127 H ASN 449 HN ASN 449 4.296 2.821 2.754
128 HA ASN 449 HA ASN 449 4.184 5.206 1.044
129 HB2 ASN 449 HB2 ASN 449 1.904 4.544 1.953
130 HB3 ASN 449 HB1 ASN 449 2.540 4.888 3.558
131 HD21 ASN 449 HD21 ASN 449 0.347 6.161 2.234
132 HD22 ASN 449 HD22 ASN 449 0.747 7.832 2.075
133 H ASN 450 HN ASN 450 5.161 7.016 1.893
134 HA ASN 450 HA ASN 450 7.226 6.465 3.859
135 HB2 ASN 450 HB2 ASN 450 8.144 8.655 3.158
136 HB3 ASN 450 HB1 ASN 450 7.902 7.578 1.788
137 HD21 ASN 450 HD21 ASN 450 8.043 10.537 2.031
138 HD22 ASN 450 HD22 ASN 450 6.595 11.115 1.268
139 H ARG 451 HN ARG 451 4.117 7.553 3.837
140 HA ARG 451 HA ARG 451 4.088 9.600 5.749
141 HB2 ARG 451 HB2 ARG 451 2.104 7.399 5.234
142 HB3 ARG 451 HB1 ARG 451 1.823 8.678 6.404
143 HG2 ARG 451 HG2 ARG 451 2.262 9.058 3.452
144 HG3 ARG 451 HG1 ARG 451 0.714 9.131 4.291
145 HD2 ARG 451 HD2 ARG 451 1.584 11.026 5.631
146 HD3 ARG 451 HD1 ARG 451 3.060 10.985 4.666
147 HE ARG 451 HE ARG 451 0.603 11.250 3.159
148 HH11 ARG 451 HH11 ARG 451 3.249 12.947 4.715
149 HH12 ARG 451 HH12 ARG 451 3.024 14.394 3.780
150 HH21 ARG 451 HH21 ARG 451 0.319 13.131 1.931
151 HH22 ARG 451 HH22 ARG 451 1.372 14.498 2.198
152 H THR 452 HN THR 452 4.013 6.099 6.202
153 HA THR 452 HA THR 452 4.845 6.527 8.989
154 HB THR 452 HB THR 452 3.835 4.158 9.285
155 HG1 THR 452 HG1 THR 452 2.270 3.621 7.778
156 HG21 THR 452 HG21 THR 452 2.892 6.175 10.300
157 HG22 THR 452 HG22 THR 452 1.617 5.101 9.731
158 HG23 THR 452 HG23 THR 452 2.039 6.537 8.801
159 H LEU 453 HN LEU 453 6.035 5.650 6.068
160 HA LEU 453 HA LEU 453 7.659 4.294 5.234
161 HB2 LEU 453 HB2 LEU 453 8.437 4.557 8.091
162 HB3 LEU 453 HB1 LEU 453 9.218 3.294 7.160
163 HG LEU 453 HG LEU 453 10.525 5.402 7.249
164 HD11 LEU 453 HD11 LEU 453 10.589 3.732 5.337
165 HD12 LEU 453 HD12 LEU 453 11.171 5.358 4.980
166 HD13 LEU 453 HD13 LEU 453 9.563 4.862 4.452
167 HD21 LEU 453 HD21 LEU 453 9.786 7.333 6.007
168 HD22 LEU 453 HD22 LEU 453 8.588 6.941 7.244
169 HD23 LEU 453 HD23 LEU 453 8.292 6.505 5.557
170 H GLU 454 HN GLU 454 5.093 3.278 6.047
171 HA GLU 454 HA GLU 454 5.724 0.514 6.829
172 HB2 GLU 454 HB2 GLU 454 3.357 2.280 7.314
173 HB3 GLU 454 HB1 GLU 454 3.138 0.536 7.275
174 HG2 GLU 454 HG2 GLU 454 5.016 2.022 9.095
175 HG3 GLU 454 HG1 GLU 454 3.435 1.376 9.541
176 H SER 455 HN SER 455 4.857 -1.170 5.727
177 HA SER 455 HA SER 455 3.514 -0.510 3.199
178 HB2 SER 455 HB2 SER 455 4.372 -2.729 2.403
179 HB3 SER 455 HB1 SER 455 5.644 -1.564 2.765
180 HG SER 455 HG SER 455 5.687 -2.645 4.915
181 H THR 456 HN THR 456 1.435 -0.895 3.277
182 HA THR 456 HA THR 456 0.395 -2.972 5.066
183 HB THR 456 HB THR 456 -1.814 -1.920 4.664
184 HG1 THR 456 HG1 THR 456 -1.108 -1.046 2.534
185 HG21 THR 456 HG21 THR 456 -1.275 0.321 5.740
186 HG22 THR 456 HG22 THR 456 0.424 -0.139 5.613
187 HG23 THR 456 HG23 THR 456 -0.683 -1.111 6.584
188 H TRP 457 HN TRP 457 -0.329 -4.852 4.211
189 HA TRP 457 HA TRP 457 -0.267 -5.031 1.280
190 HB2 TRP 457 HB2 TRP 457 0.242 -7.144 3.401
191 HB3 TRP 457 HB1 TRP 457 0.262 -7.447 1.659
192 HD1 TRP 457 HD1 TRP 457 2.001 -4.994 4.117
193 HE1 TRP 457 HE1 TRP 457 4.384 -4.545 3.282
194 HE3 TRP 457 HE3 TRP 457 1.966 -7.961 -0.055
195 HZ2 TRP 457 HZ2 TRP 457 6.009 -5.285 1.134
196 HZ3 TRP 457 HZ3 TRP 457 4.008 -8.057 -1.432
197 HH2 TRP 457 HH2 TRP 457 5.997 -6.765 -0.836
198 H GLU 458 HN GLU 458 -2.320 -4.464 3.498
199 HA GLU 458 HA GLU 458 -4.531 -5.883 2.173
200 HB2 GLU 458 HB2 GLU 458 -4.815 -4.560 4.857
201 HB3 GLU 458 HB1 GLU 458 -5.746 -5.885 4.179
202 HG2 GLU 458 HG2 GLU 458 -4.542 -6.950 5.812
203 HG3 GLU 458 HG1 GLU 458 -3.522 -7.213 4.401
204 H LYS 459 HN LYS 459 -6.220 -4.516 1.414
205 HA LYS 459 HA LYS 459 -5.512 -1.918 0.656
206 HB2 LYS 459 HB2 LYS 459 -8.201 -3.273 0.771
207 HB3 LYS 459 HB1 LYS 459 -7.988 -1.644 0.140
208 HG2 LYS 459 HG2 LYS 459 -6.307 -2.618 -1.464
209 HG3 LYS 459 HG1 LYS 459 -6.853 -4.209 -0.934
210 HD2 LYS 459 HD2 LYS 459 -9.101 -3.733 -1.687
211 HD3 LYS 459 HD1 LYS 459 -8.641 -2.081 -2.107
212 HE2 LYS 459 HE2 LYS 459 -7.455 -4.559 -3.350
213 HE3 LYS 459 HE1 LYS 459 -8.764 -3.614 -4.065
214 HZ1 LYS 459 HZ1 LYS 459 -7.184 -1.674 -3.992
215 HZ2 LYS 459 HZ2 LYS 459 -6.770 -2.901 -5.077
216 HZ3 LYS 459 HZ3 LYS 459 -5.955 -2.773 -3.607
217 HA PRO 460 HA PRO 460 -6.432 0.116 4.587
218 HB2 PRO 460 HB2 PRO 460 -5.367 2.526 3.409
219 HB3 PRO 460 HB1 PRO 460 -4.685 1.543 4.704
220 HG2 PRO 460 HG2 PRO 460 -3.607 1.779 2.188
221 HG3 PRO 460 HG1 PRO 460 -3.312 0.425 3.289
222 HD2 PRO 460 HD2 PRO 460 -5.094 0.583 0.911
223 HD3 PRO 460 HD1 PRO 460 -4.175 -0.791 1.557
224 H GLN 461 HN GLN 461 -8.258 1.144 5.139
225 HA GLN 461 HA GLN 461 -10.015 2.089 3.055
226 HB2 GLN 461 HB2 GLN 461 -10.699 0.848 5.191
227 HB3 GLN 461 HB1 GLN 461 -10.473 2.385 6.018
228 HG2 GLN 461 HG2 GLN 461 -12.129 3.408 4.518
229 HG3 GLN 461 HG1 GLN 461 -12.387 1.839 3.757
230 HE21 GLN 461 HE21 GLN 461 -14.521 1.695 4.318
231 HE22 GLN 461 HE22 GLN 461 -15.049 1.467 5.951
232 H GLU 462 HN GLU 462 -7.528 3.446 4.796
233 HA GLU 462 HA GLU 462 -8.570 6.116 5.054
234 HB2 GLU 462 HB2 GLU 462 -6.811 5.093 6.549
235 HB3 GLU 462 HB1 GLU 462 -5.688 5.212 5.203
236 HG2 GLU 462 HG2 GLU 462 -5.797 7.588 5.220
237 HG3 GLU 462 HG1 GLU 462 -7.127 7.574 6.379
238 H LEU 463 HN LEU 463 -7.481 4.274 2.500
239 HA LEU 463 HA LEU 463 -6.277 6.401 0.962
240 HB2 LEU 463 HB2 LEU 463 -5.590 4.056 0.683
241 HB3 LEU 463 HB1 LEU 463 -7.207 3.643 0.154
242 HG LEU 463 HG LEU 463 -6.930 4.998 -1.855
243 HD11 LEU 463 HD11 LEU 463 -5.457 6.715 -0.933
244 HD12 LEU 463 HD12 LEU 463 -4.787 6.009 -2.403
245 HD13 LEU 463 HD13 LEU 463 -4.148 5.536 -0.829
246 HD21 LEU 463 HD21 LEU 463 -5.256 3.639 -2.975
247 HD22 LEU 463 HD22 LEU 463 -6.230 2.646 -1.890
248 HD23 LEU 463 HD23 LEU 463 -4.602 3.134 -1.418
249 H LYS 464 HN LYS 464 -9.363 5.591 1.845
250 HA LYS 464 HA LYS 464 -10.609 6.630 -0.586
251 HB2 LYS 464 HB2 LYS 464 -11.601 4.607 0.306
252 HB3 LYS 464 HB1 LYS 464 -11.767 5.345 1.892
253 HG2 LYS 464 HG2 LYS 464 -13.309 7.030 0.805
254 HG3 LYS 464 HG1 LYS 464 -13.292 5.982 -0.617
255 HD2 LYS 464 HD2 LYS 464 -15.220 5.591 0.916
256 HD3 LYS 464 HD1 LYS 464 -14.223 4.162 0.634
257 HE2 LYS 464 HE2 LYS 464 -14.822 4.370 2.992
258 HE3 LYS 464 HE1 LYS 464 -13.083 4.528 2.759
259 HZ1 LYS 464 HZ1 LYS 464 -13.592 6.230 4.218
260 HZ2 LYS 464 HZ2 LYS 464 -15.056 6.608 3.454
261 HZ3 LYS 464 HZ3 LYS 464 -13.585 7.039 2.727
Start of MODEL 6
1 H SER 433 HT1 SER 433 -3.111 11.313 -2.928
2 HA SER 433 HA SER 433 -2.755 9.589 -1.275
3 HB2 SER 433 HB2 SER 433 -2.171 8.801 -4.143
4 HB3 SER 433 HB1 SER 433 -2.670 7.681 -2.875
5 HG SER 433 HG SER 433 -4.161 9.912 -3.843
6 H GLU 434 HN GLU 434 -1.225 9.207 0.131
7 HA GLU 434 HA GLU 434 1.581 9.110 -0.651
8 HB2 GLU 434 HB2 GLU 434 0.561 8.653 2.132
9 HB3 GLU 434 HB1 GLU 434 2.050 9.429 1.614
10 HG2 GLU 434 HG2 GLU 434 0.898 11.253 2.283
11 HG3 GLU 434 HG1 GLU 434 0.363 11.193 0.609
12 H TRP 435 HN TRP 435 -0.326 6.948 -1.363
13 HA TRP 435 HA TRP 435 0.835 4.710 0.154
14 HB2 TRP 435 HB2 TRP 435 -1.928 4.687 -1.062
15 HB3 TRP 435 HB1 TRP 435 -1.266 3.597 0.153
16 HD1 TRP 435 HD1 TRP 435 -2.880 7.026 -0.238
17 HE1 TRP 435 HE1 TRP 435 -3.473 7.956 2.083
18 HE3 TRP 435 HE3 TRP 435 -0.545 3.521 2.655
19 HZ2 TRP 435 HZ2 TRP 435 -3.004 7.294 4.782
20 HZ3 TRP 435 HZ3 TRP 435 -0.632 3.777 5.101
21 HH2 TRP 435 HH2 TRP 435 -1.847 5.605 6.141
22 H THR 436 HN THR 436 2.214 3.694 -1.167
23 HA THR 436 HA THR 436 1.718 3.647 -4.033
24 HB THR 436 HB THR 436 4.044 2.615 -2.399
25 HG1 THR 436 HG1 THR 436 4.387 4.727 -2.533
26 HG21 THR 436 HG21 THR 436 5.176 2.213 -4.549
27 HG22 THR 436 HG22 THR 436 3.703 2.656 -5.409
28 HG23 THR 436 HG23 THR 436 3.730 1.211 -4.397
29 H GLU 437 HN GLU 437 0.216 2.191 -4.600
30 HA GLU 437 HA GLU 437 0.462 -0.500 -3.509
31 HB2 GLU 437 HB2 GLU 437 -1.627 -0.992 -4.765
32 HB3 GLU 437 HB1 GLU 437 -1.805 0.261 -3.552
33 HG2 GLU 437 HG2 GLU 437 -1.891 1.957 -5.203
34 HG3 GLU 437 HG1 GLU 437 -1.405 0.831 -6.472
35 H ARG 438 HN ARG 438 2.295 -1.243 -4.444
36 HA ARG 438 HA ARG 438 2.475 -1.234 -7.350
37 HB2 ARG 438 HB2 ARG 438 4.530 -0.803 -6.096
38 HB3 ARG 438 HB1 ARG 438 4.366 -2.345 -5.264
39 HG2 ARG 438 HG2 ARG 438 4.681 -3.538 -7.348
40 HG3 ARG 438 HG1 ARG 438 4.758 -2.011 -8.233
41 HD2 ARG 438 HD2 ARG 438 6.777 -1.393 -7.095
42 HD3 ARG 438 HD1 ARG 438 6.655 -2.784 -6.024
43 HE ARG 438 HE ARG 438 6.761 -3.635 -8.724
44 HH11 ARG 438 HH11 ARG 438 8.785 -2.291 -6.194
45 HH12 ARG 438 HH12 ARG 438 10.243 -3.013 -6.807
46 HH21 ARG 438 HH21 ARG 438 8.679 -4.585 -9.514
47 HH22 ARG 438 HH22 ARG 438 10.182 -4.300 -8.694
48 H LYS 439 HN LYS 439 1.408 -2.723 -8.424
49 HA LYS 439 HA LYS 439 0.629 -5.155 -7.041
50 HB2 LYS 439 HB2 LYS 439 -1.059 -3.875 -8.314
51 HB3 LYS 439 HB1 LYS 439 -0.147 -4.167 -9.788
52 HG2 LYS 439 HG2 LYS 439 -0.592 -6.504 -9.693
53 HG3 LYS 439 HG1 LYS 439 -1.273 -6.365 -8.074
54 HD2 LYS 439 HD2 LYS 439 -2.471 -4.873 -10.385
55 HD3 LYS 439 HD1 LYS 439 -2.879 -6.563 -10.090
56 HE2 LYS 439 HE2 LYS 439 -4.545 -5.203 -9.042
57 HE3 LYS 439 HE1 LYS 439 -3.558 -5.931 -7.778
58 HZ1 LYS 439 HZ1 LYS 439 -2.337 -3.822 -7.629
59 HZ2 LYS 439 HZ2 LYS 439 -3.975 -3.640 -7.263
60 HZ3 LYS 439 HZ3 LYS 439 -3.384 -3.130 -8.765
61 H THR 440 HN THR 440 2.395 -6.373 -6.912
62 HA THR 440 HA THR 440 3.931 -6.993 -9.296
63 HB THR 440 HB THR 440 5.282 -8.427 -7.777
64 HG1 THR 440 HG1 THR 440 3.162 -7.856 -6.067
65 HG21 THR 440 HG21 THR 440 4.815 -5.610 -6.796
66 HG22 THR 440 HG22 THR 440 5.907 -6.095 -8.094
67 HG23 THR 440 HG23 THR 440 6.230 -6.598 -6.434
68 H ALA 441 HN ALA 441 4.126 -9.019 -10.234
69 HA ALA 441 HA ALA 441 1.711 -10.528 -10.363
70 HB1 ALA 441 HB1 ALA 441 2.875 -11.883 -12.013
71 HB2 ALA 441 HB2 ALA 441 4.412 -11.147 -11.553
72 HB3 ALA 441 HB3 ALA 441 3.154 -10.166 -12.307
73 H ASP 442 HN ASP 442 3.954 -10.522 -8.048
74 HA ASP 442 HA ASP 442 4.279 -13.307 -7.480
75 HB2 ASP 442 HB2 ASP 442 5.745 -11.399 -6.649
76 HB3 ASP 442 HB1 ASP 442 4.448 -10.995 -5.530
77 H GLY 443 HN GLY 443 1.607 -11.520 -7.662
78 HA2 GLY 443 HA2 GLY 443 -0.562 -12.136 -7.121
79 HA3 GLY 443 HA1 GLY 443 0.079 -13.340 -6.010
80 H LYS 444 HN LYS 444 1.304 -10.135 -5.816
81 HA LYS 444 HA LYS 444 -0.314 -9.641 -3.422
82 HB2 LYS 444 HB2 LYS 444 2.710 -9.540 -3.457
83 HB3 LYS 444 HB1 LYS 444 1.670 -9.176 -2.087
84 HG2 LYS 444 HG2 LYS 444 0.928 -11.482 -2.000
85 HG3 LYS 444 HG1 LYS 444 1.897 -11.866 -3.422
86 HD2 LYS 444 HD2 LYS 444 3.924 -11.192 -2.145
87 HD3 LYS 444 HD1 LYS 444 2.905 -10.990 -0.719
88 HE2 LYS 444 HE2 LYS 444 3.973 -13.159 -0.655
89 HE3 LYS 444 HE1 LYS 444 2.237 -13.358 -0.892
90 HZ1 LYS 444 HZ1 LYS 444 2.650 -13.670 -3.265
91 HZ2 LYS 444 HZ2 LYS 444 3.476 -14.825 -2.346
92 HZ3 LYS 444 HZ3 LYS 444 4.317 -13.508 -3.014
93 H THR 445 HN THR 445 -1.016 -7.615 -3.408
94 HA THR 445 HA THR 445 0.520 -5.572 -4.859
95 HB THR 445 HB THR 445 -2.253 -5.224 -3.715
96 HG1 THR 445 HG1 THR 445 -2.009 -6.967 -5.395
97 HG21 THR 445 HG21 THR 445 -1.028 -3.183 -4.262
98 HG22 THR 445 HG22 THR 445 -2.397 -3.415 -5.351
99 HG23 THR 445 HG23 THR 445 -0.760 -3.773 -5.902
100 H TYR 446 HN TYR 446 2.058 -4.870 -3.421
101 HA TYR 446 HA TYR 446 1.252 -4.598 -0.650
102 HB2 TYR 446 HB2 TYR 446 3.543 -4.284 -0.094
103 HB3 TYR 446 HB1 TYR 446 3.403 -5.666 -1.155
104 HD1 TYR 446 HD1 TYR 446 4.284 -5.529 -3.480
105 HD2 TYR 446 HD2 TYR 446 4.808 -2.374 -0.673
106 HE1 TYR 446 HE1 TYR 446 6.131 -4.631 -4.835
107 HE2 TYR 446 HE2 TYR 446 6.645 -1.465 -2.022
108 HH TYR 446 HH TYR 446 8.264 -2.238 -3.650
109 H TYR 447 HN TYR 447 0.906 -2.836 0.381
110 HA TYR 447 HA TYR 447 1.242 -0.315 -1.041
111 HB2 TYR 447 HB2 TYR 447 -0.458 -1.082 1.336
112 HB3 TYR 447 HB1 TYR 447 -0.229 0.581 0.823
113 HD1 TYR 447 HD2 TYR 447 -1.214 -2.707 -0.765
114 HD2 TYR 447 HD1 TYR 447 -1.912 1.489 -0.430
115 HE1 TYR 447 HE2 TYR 447 -3.114 -2.900 -2.304
116 HE2 TYR 447 HE1 TYR 447 -3.813 1.295 -1.980
117 HH TYR 447 HH TYR 447 -4.630 -0.179 -3.726
118 H TYR 448 HN TYR 448 3.501 -0.125 -0.676
119 HA TYR 448 HA TYR 448 4.327 0.369 2.050
120 HB2 TYR 448 HB2 TYR 448 6.143 -0.403 0.809
121 HB3 TYR 448 HB1 TYR 448 5.667 0.486 -0.632
122 HD1 TYR 448 HD1 TYR 448 6.698 1.301 2.896
123 HD2 TYR 448 HD2 TYR 448 7.047 2.202 -1.250
124 HE1 TYR 448 HE1 TYR 448 8.309 3.087 3.427
125 HE2 TYR 448 HE2 TYR 448 8.660 3.980 -0.735
126 HH TYR 448 HH TYR 448 10.220 4.257 2.179
127 H ASN 449 HN ASN 449 4.041 2.150 3.074
128 HA ASN 449 HA ASN 449 2.931 4.443 1.617
129 HB2 ASN 449 HB2 ASN 449 1.242 3.694 2.990
130 HB3 ASN 449 HB1 ASN 449 2.356 3.153 4.242
131 HD21 ASN 449 HD21 ASN 449 0.991 6.017 2.718
132 HD22 ASN 449 HD22 ASN 449 1.078 7.016 4.126
133 H ASN 450 HN ASN 450 3.538 6.501 2.070
134 HA ASN 450 HA ASN 450 6.176 6.752 3.298
135 HB2 ASN 450 HB2 ASN 450 5.781 7.580 0.973
136 HB3 ASN 450 HB1 ASN 450 4.639 8.750 1.619
137 HD21 ASN 450 HD21 ASN 450 5.393 10.592 2.596
138 HD22 ASN 450 HD22 ASN 450 7.066 11.028 2.627
139 H ARG 451 HN ARG 451 2.950 7.220 4.131
140 HA ARG 451 HA ARG 451 3.035 9.597 5.617
141 HB2 ARG 451 HB2 ARG 451 1.345 7.152 5.949
142 HB3 ARG 451 HB1 ARG 451 1.252 8.477 7.097
143 HG2 ARG 451 HG2 ARG 451 1.006 9.734 4.658
144 HG3 ARG 451 HG1 ARG 451 0.117 8.225 4.441
145 HD2 ARG 451 HD2 ARG 451 -0.320 10.343 6.540
146 HD3 ARG 451 HD1 ARG 451 -1.422 9.859 5.256
147 HE ARG 451 HE ARG 451 -0.690 7.952 7.374
148 HH11 ARG 451 HH11 ARG 451 -3.141 9.833 5.697
149 HH12 ARG 451 HH12 ARG 451 -4.474 9.028 6.480
150 HH21 ARG 451 HH21 ARG 451 -2.426 6.932 8.437
151 HH22 ARG 451 HH22 ARG 451 -4.063 7.381 8.051
152 H THR 452 HN THR 452 3.495 6.272 6.678
153 HA THR 452 HA THR 452 4.953 7.281 9.024
154 HB THR 452 HB THR 452 4.209 4.977 9.997
155 HG1 THR 452 HG1 THR 452 2.699 3.961 8.901
156 HG21 THR 452 HG21 THR 452 2.241 7.242 9.624
157 HG22 THR 452 HG22 THR 452 3.487 7.149 10.869
158 HG23 THR 452 HG23 THR 452 2.155 5.994 10.868
159 H LEU 453 HN LEU 453 5.464 5.870 6.138
160 HA LEU 453 HA LEU 453 7.158 4.679 5.194
161 HB2 LEU 453 HB2 LEU 453 8.278 5.224 7.893
162 HB3 LEU 453 HB1 LEU 453 9.037 3.955 6.956
163 HG LEU 453 HG LEU 453 10.062 6.292 6.812
164 HD11 LEU 453 HD11 LEU 453 10.385 4.336 5.203
165 HD12 LEU 453 HD12 LEU 453 10.773 5.949 4.608
166 HD13 LEU 453 HD13 LEU 453 9.257 5.182 4.143
167 HD21 LEU 453 HD21 LEU 453 9.056 7.845 5.259
168 HD22 LEU 453 HD22 LEU 453 7.916 7.496 6.561
169 HD23 LEU 453 HD23 LEU 453 7.711 6.736 4.980
170 H GLU 454 HN GLU 454 4.825 3.491 6.173
171 HA GLU 454 HA GLU 454 5.645 0.974 7.428
172 HB2 GLU 454 HB2 GLU 454 2.979 2.331 7.084
173 HB3 GLU 454 HB1 GLU 454 3.107 0.649 7.583
174 HG2 GLU 454 HG2 GLU 454 4.387 2.944 9.041
175 HG3 GLU 454 HG1 GLU 454 2.810 2.265 9.442
176 H SER 455 HN SER 455 5.599 -0.908 6.396
177 HA SER 455 HA SER 455 4.565 -0.997 3.666
178 HB2 SER 455 HB2 SER 455 6.849 -1.883 4.133
179 HB3 SER 455 HB1 SER 455 6.140 -3.082 5.211
180 HG SER 455 HG SER 455 6.554 -3.886 3.085
181 H THR 456 HN THR 456 2.393 -1.298 3.694
182 HA THR 456 HA THR 456 1.364 -3.392 5.487
183 HB THR 456 HB THR 456 0.478 -1.312 6.285
184 HG1 THR 456 HG1 THR 456 -1.021 -3.076 6.167
185 HG21 THR 456 HG21 THR 456 0.794 0.110 4.355
186 HG22 THR 456 HG22 THR 456 -0.897 0.170 4.856
187 HG23 THR 456 HG23 THR 456 -0.425 -0.791 3.457
188 H TRP 457 HN TRP 457 0.007 -4.884 4.661
189 HA TRP 457 HA TRP 457 -0.122 -4.902 1.723
190 HB2 TRP 457 HB2 TRP 457 0.404 -7.183 3.663
191 HB3 TRP 457 HB1 TRP 457 0.188 -7.390 1.920
192 HD1 TRP 457 HD1 TRP 457 2.377 -5.068 4.136
193 HE1 TRP 457 HE1 TRP 457 4.694 -4.851 3.068
194 HE3 TRP 457 HE3 TRP 457 1.742 -8.234 0.154
195 HZ2 TRP 457 HZ2 TRP 457 6.064 -5.833 0.865
196 HZ3 TRP 457 HZ3 TRP 457 3.652 -8.567 -1.371
197 HH2 TRP 457 HH2 TRP 457 5.776 -7.410 -1.014
198 H GLU 458 HN GLU 458 -1.869 -4.062 3.966
199 HA GLU 458 HA GLU 458 -4.325 -5.473 3.175
200 HB2 GLU 458 HB2 GLU 458 -3.826 -3.769 5.637
201 HB3 GLU 458 HB1 GLU 458 -5.302 -4.644 5.266
202 HG2 GLU 458 HG2 GLU 458 -4.211 -5.915 6.899
203 HG3 GLU 458 HG1 GLU 458 -3.921 -6.762 5.384
204 H LYS 459 HN LYS 459 -6.090 -4.119 2.520
205 HA LYS 459 HA LYS 459 -5.206 -1.790 1.115
206 HB2 LYS 459 HB2 LYS 459 -7.953 -2.986 1.447
207 HB3 LYS 459 HB1 LYS 459 -7.572 -1.653 0.362
208 HG2 LYS 459 HG2 LYS 459 -6.094 -3.044 -0.921
209 HG3 LYS 459 HG1 LYS 459 -6.281 -4.369 0.226
210 HD2 LYS 459 HD2 LYS 459 -8.653 -4.536 -0.353
211 HD3 LYS 459 HD1 LYS 459 -8.468 -3.202 -1.496
212 HE2 LYS 459 HE2 LYS 459 -6.926 -4.499 -2.824
213 HE3 LYS 459 HE1 LYS 459 -6.953 -5.805 -1.642
214 HZ1 LYS 459 HZ1 LYS 459 -9.327 -4.893 -3.180
215 HZ2 LYS 459 HZ2 LYS 459 -9.230 -6.248 -2.162
216 HZ3 LYS 459 HZ3 LYS 459 -8.356 -6.215 -3.613
217 HA PRO 460 HA PRO 460 -5.936 0.949 4.644
218 HB2 PRO 460 HB2 PRO 460 -5.027 3.036 2.788
219 HB3 PRO 460 HB1 PRO 460 -4.346 2.535 4.336
220 HG2 PRO 460 HG2 PRO 460 -3.131 2.008 1.996
221 HG3 PRO 460 HG1 PRO 460 -3.033 0.911 3.385
222 HD2 PRO 460 HD2 PRO 460 -4.707 0.703 0.917
223 HD3 PRO 460 HD1 PRO 460 -3.850 -0.562 1.824
224 H GLN 461 HN GLN 461 -7.588 2.197 5.222
225 HA GLN 461 HA GLN 461 -9.803 2.648 3.521
226 HB2 GLN 461 HB2 GLN 461 -10.129 2.330 5.886
227 HB3 GLN 461 HB1 GLN 461 -9.102 3.705 6.264
228 HG2 GLN 461 HG2 GLN 461 -10.805 5.142 5.081
229 HG3 GLN 461 HG1 GLN 461 -11.852 3.724 5.059
230 HE21 GLN 461 HE21 GLN 461 -10.279 6.098 7.066
231 HE22 GLN 461 HE22 GLN 461 -11.229 5.814 8.483
232 H GLU 462 HN GLU 462 -6.944 4.447 4.038
233 HA GLU 462 HA GLU 462 -7.997 7.074 3.775
234 HB2 GLU 462 HB2 GLU 462 -5.174 6.124 3.285
235 HB3 GLU 462 HB1 GLU 462 -5.683 7.780 3.584
236 HG2 GLU 462 HG2 GLU 462 -5.924 5.506 5.536
237 HG3 GLU 462 HG1 GLU 462 -4.665 6.737 5.547
238 H LEU 463 HN LEU 463 -7.705 4.658 1.510
239 HA LEU 463 HA LEU 463 -7.250 6.551 -0.692
240 HB2 LEU 463 HB2 LEU 463 -5.730 4.558 -0.441
241 HB3 LEU 463 HB1 LEU 463 -7.112 3.539 -0.788
242 HG LEU 463 HG LEU 463 -7.298 4.495 -3.022
243 HD11 LEU 463 HD11 LEU 463 -4.889 6.143 -2.263
244 HD12 LEU 463 HD12 LEU 463 -6.522 6.757 -2.517
245 HD13 LEU 463 HD13 LEU 463 -5.622 6.058 -3.864
246 HD21 LEU 463 HD21 LEU 463 -5.228 3.617 -3.965
247 HD22 LEU 463 HD22 LEU 463 -5.839 2.564 -2.690
248 HD23 LEU 463 HD23 LEU 463 -4.480 3.644 -2.365
249 H LYS 464 HN LYS 464 -9.752 5.438 0.963
250 HA LYS 464 HA LYS 464 -11.432 4.992 -1.411
251 HB2 LYS 464 HB2 LYS 464 -11.451 3.050 0.037
252 HB3 LYS 464 HB1 LYS 464 -11.834 4.049 1.434
253 HG2 LYS 464 HG2 LYS 464 -13.986 4.627 0.423
254 HG3 LYS 464 HG1 LYS 464 -13.600 3.605 -0.963
255 HD2 LYS 464 HD2 LYS 464 -13.622 1.639 0.387
256 HD3 LYS 464 HD1 LYS 464 -13.720 2.592 1.872
257 HE2 LYS 464 HE2 LYS 464 -15.828 2.560 -0.286
258 HE3 LYS 464 HE1 LYS 464 -15.887 1.588 1.186
259 HZ1 LYS 464 HZ1 LYS 464 -17.163 3.718 1.266
260 HZ2 LYS 464 HZ2 LYS 464 -15.692 4.554 1.202
261 HZ3 LYS 464 HZ3 LYS 464 -16.027 3.531 2.511
Start of MODEL 7
1 H SER 433 HT1 SER 433 2.568 11.268 -4.280
2 HA SER 433 HA SER 433 -0.096 10.043 -3.910
3 HB2 SER 433 HB2 SER 433 1.139 9.411 -5.998
4 HB3 SER 433 HB1 SER 433 2.474 8.854 -4.994
5 HG SER 433 HG SER 433 1.012 7.172 -5.644
6 H GLU 434 HN GLU 434 -0.403 9.223 -1.954
7 HA GLU 434 HA GLU 434 1.883 9.153 -0.123
8 HB2 GLU 434 HB2 GLU 434 0.097 9.095 1.650
9 HB3 GLU 434 HB1 GLU 434 0.138 10.555 0.670
10 HG2 GLU 434 HG2 GLU 434 -1.718 9.716 -0.670
11 HG3 GLU 434 HG1 GLU 434 -1.758 8.245 0.301
12 H TRP 435 HN TRP 435 -0.326 7.074 -1.742
13 HA TRP 435 HA TRP 435 0.614 4.830 -0.075
14 HB2 TRP 435 HB2 TRP 435 -1.972 4.931 -1.659
15 HB3 TRP 435 HB1 TRP 435 -1.446 3.640 -0.577
16 HD1 TRP 435 HD1 TRP 435 -3.554 6.644 -0.597
17 HE1 TRP 435 HE1 TRP 435 -4.077 7.439 1.796
18 HE3 TRP 435 HE3 TRP 435 -0.240 3.732 1.969
19 HZ2 TRP 435 HZ2 TRP 435 -3.211 6.893 4.418
20 HZ3 TRP 435 HZ3 TRP 435 -0.157 3.925 4.414
21 HH2 TRP 435 HH2 TRP 435 -1.591 5.489 5.614
22 H THR 436 HN THR 436 2.155 3.750 -1.126
23 HA THR 436 HA THR 436 2.060 3.589 -4.029
24 HB THR 436 HB THR 436 4.087 2.469 -2.078
25 HG1 THR 436 HG1 THR 436 3.758 4.906 -2.860
26 HG21 THR 436 HG21 THR 436 5.466 1.991 -4.056
27 HG22 THR 436 HG22 THR 436 4.160 2.538 -5.106
28 HG23 THR 436 HG23 THR 436 3.947 1.091 -4.117
29 H GLU 437 HN GLU 437 0.217 2.348 -4.327
30 HA GLU 437 HA GLU 437 0.295 -0.371 -3.316
31 HB2 GLU 437 HB2 GLU 437 -1.804 -0.376 -5.031
32 HB3 GLU 437 HB1 GLU 437 -1.919 0.059 -3.334
33 HG2 GLU 437 HG2 GLU 437 -3.102 1.685 -4.595
34 HG3 GLU 437 HG1 GLU 437 -1.632 2.440 -3.986
35 H ARG 438 HN ARG 438 2.086 -1.202 -4.291
36 HA ARG 438 HA ARG 438 2.199 -1.110 -7.203
37 HB2 ARG 438 HB2 ARG 438 4.278 -0.663 -5.947
38 HB3 ARG 438 HB1 ARG 438 4.185 -2.270 -5.238
39 HG2 ARG 438 HG2 ARG 438 4.511 -3.302 -7.376
40 HG3 ARG 438 HG1 ARG 438 4.404 -1.742 -8.194
41 HD2 ARG 438 HD2 ARG 438 6.430 -0.999 -7.077
42 HD3 ARG 438 HD1 ARG 438 6.523 -2.523 -6.197
43 HE ARG 438 HE ARG 438 6.674 -3.515 -8.572
44 HH11 ARG 438 HH11 ARG 438 8.016 -0.443 -7.574
45 HH12 ARG 438 HH12 ARG 438 9.316 -0.484 -8.725
46 HH21 ARG 438 HH21 ARG 438 8.371 -3.594 -10.071
47 HH22 ARG 438 HH22 ARG 438 9.512 -2.278 -10.171
48 H LYS 439 HN LYS 439 1.177 -2.573 -8.282
49 HA LYS 439 HA LYS 439 0.440 -5.049 -6.963
50 HB2 LYS 439 HB2 LYS 439 -0.935 -5.383 -9.079
51 HB3 LYS 439 HB1 LYS 439 -1.399 -4.053 -8.029
52 HG2 LYS 439 HG2 LYS 439 0.005 -2.576 -9.563
53 HG3 LYS 439 HG1 LYS 439 0.002 -3.943 -10.679
54 HD2 LYS 439 HD2 LYS 439 -1.791 -2.421 -11.246
55 HD3 LYS 439 HD1 LYS 439 -2.465 -3.934 -10.639
56 HE2 LYS 439 HE2 LYS 439 -3.695 -2.125 -9.667
57 HE3 LYS 439 HE1 LYS 439 -2.703 -2.854 -8.407
58 HZ1 LYS 439 HZ1 LYS 439 -2.582 -0.480 -8.243
59 HZ2 LYS 439 HZ2 LYS 439 -2.137 -0.333 -9.872
60 HZ3 LYS 439 HZ3 LYS 439 -1.073 -1.052 -8.768
61 H THR 440 HN THR 440 2.162 -6.295 -6.899
62 HA THR 440 HA THR 440 3.725 -6.803 -9.289
63 HB THR 440 HB THR 440 5.002 -8.363 -7.776
64 HG1 THR 440 HG1 THR 440 2.874 -7.765 -6.139
65 HG21 THR 440 HG21 THR 440 4.671 -5.511 -6.834
66 HG22 THR 440 HG22 THR 440 5.756 -6.070 -8.107
67 HG23 THR 440 HG23 THR 440 6.026 -6.565 -6.436
68 H ALA 441 HN ALA 441 3.975 -8.851 -10.252
69 HA ALA 441 HA ALA 441 1.480 -10.146 -10.671
70 HB1 ALA 441 HB1 ALA 441 4.222 -10.951 -11.630
71 HB2 ALA 441 HB2 ALA 441 3.129 -9.834 -12.449
72 HB3 ALA 441 HB3 ALA 441 2.683 -11.531 -12.267
73 H ASP 442 HN ASP 442 3.632 -10.521 -8.220
74 HA ASP 442 HA ASP 442 3.561 -13.357 -7.861
75 HB2 ASP 442 HB2 ASP 442 5.281 -11.720 -6.918
76 HB3 ASP 442 HB1 ASP 442 4.065 -11.273 -5.729
77 H GLY 443 HN GLY 443 1.184 -11.127 -7.788
78 HA2 GLY 443 HA2 GLY 443 -1.063 -11.647 -7.410
79 HA3 GLY 443 HA1 GLY 443 -0.561 -12.985 -6.391
80 H LYS 444 HN LYS 444 0.663 -9.722 -6.000
81 HA LYS 444 HA LYS 444 -1.064 -9.285 -3.711
82 HB2 LYS 444 HB2 LYS 444 0.935 -8.988 -2.190
83 HB3 LYS 444 HB1 LYS 444 0.546 -10.645 -2.637
84 HG2 LYS 444 HG2 LYS 444 2.301 -10.280 -4.512
85 HG3 LYS 444 HG1 LYS 444 2.837 -8.937 -3.500
86 HD2 LYS 444 HD2 LYS 444 4.120 -10.934 -2.994
87 HD3 LYS 444 HD1 LYS 444 3.113 -10.490 -1.613
88 HE2 LYS 444 HE2 LYS 444 1.591 -12.236 -2.027
89 HE3 LYS 444 HE1 LYS 444 2.205 -12.496 -3.659
90 HZ1 LYS 444 HZ1 LYS 444 4.274 -13.308 -2.712
91 HZ2 LYS 444 HZ2 LYS 444 2.960 -14.223 -2.165
92 HZ3 LYS 444 HZ3 LYS 444 3.674 -13.080 -1.138
93 H THR 445 HN THR 445 -1.563 -7.228 -3.572
94 HA THR 445 HA THR 445 0.158 -5.193 -4.758
95 HB THR 445 HB THR 445 -1.673 -3.616 -4.116
96 HG1 THR 445 HG1 THR 445 -2.413 -5.071 -2.352
97 HG21 THR 445 HG21 THR 445 -2.943 -5.889 -5.568
98 HG22 THR 445 HG22 THR 445 -1.595 -5.021 -6.297
99 HG23 THR 445 HG23 THR 445 -3.079 -4.162 -5.881
100 H TYR 446 HN TYR 446 1.867 -4.698 -3.426
101 HA TYR 446 HA TYR 446 1.306 -4.578 -0.574
102 HB2 TYR 446 HB2 TYR 446 3.617 -4.444 -0.156
103 HB3 TYR 446 HB1 TYR 446 3.393 -5.682 -1.364
104 HD1 TYR 446 HD1 TYR 446 4.147 -5.252 -3.712
105 HD2 TYR 446 HD2 TYR 446 4.909 -2.515 -0.545
106 HE1 TYR 446 HE1 TYR 446 5.935 -4.210 -5.042
107 HE2 TYR 446 HE2 TYR 446 6.686 -1.460 -1.870
108 HH TYR 446 HH TYR 446 8.227 -2.135 -3.738
109 H TYR 447 HN TYR 447 1.113 -2.836 0.557
110 HA TYR 447 HA TYR 447 1.335 -0.291 -0.859
111 HB2 TYR 447 HB2 TYR 447 -0.281 -1.120 1.551
112 HB3 TYR 447 HB1 TYR 447 -0.119 0.553 1.041
113 HD1 TYR 447 HD2 TYR 447 -0.978 -2.742 -0.572
114 HD2 TYR 447 HD1 TYR 447 -1.916 1.387 -0.116
115 HE1 TYR 447 HE2 TYR 447 -2.912 -3.027 -2.077
116 HE2 TYR 447 HE1 TYR 447 -3.854 1.113 -1.603
117 HH TYR 447 HH TYR 447 -4.606 -0.413 -3.407
118 H TYR 448 HN TYR 448 3.558 0.027 -0.555
119 HA TYR 448 HA TYR 448 4.472 0.506 2.138
120 HB2 TYR 448 HB2 TYR 448 6.226 -0.156 0.728
121 HB3 TYR 448 HB1 TYR 448 5.664 0.852 -0.600
122 HD1 TYR 448 HD1 TYR 448 6.747 1.417 2.956
123 HD2 TYR 448 HD2 TYR 448 7.057 2.588 -1.124
124 HE1 TYR 448 HE1 TYR 448 8.342 3.183 3.588
125 HE2 TYR 448 HE2 TYR 448 8.654 4.348 -0.505
126 HH TYR 448 HH TYR 448 9.206 5.694 1.541
127 H ASN 449 HN ASN 449 4.259 2.255 3.222
128 HA ASN 449 HA ASN 449 2.781 4.497 2.045
129 HB2 ASN 449 HB2 ASN 449 1.495 3.642 3.758
130 HB3 ASN 449 HB1 ASN 449 2.895 3.149 4.703
131 HD21 ASN 449 HD21 ASN 449 0.889 5.834 3.777
132 HD22 ASN 449 HD22 ASN 449 1.290 6.844 5.109
133 H ASN 450 HN ASN 450 3.445 6.603 2.249
134 HA ASN 450 HA ASN 450 6.092 7.016 3.446
135 HB2 ASN 450 HB2 ASN 450 6.152 9.126 2.106
136 HB3 ASN 450 HB1 ASN 450 6.080 7.658 1.142
137 HD21 ASN 450 HD21 ASN 450 5.308 8.801 -0.626
138 HD22 ASN 450 HD22 ASN 450 3.671 9.364 -0.712
139 H ARG 451 HN ARG 451 2.878 7.467 4.232
140 HA ARG 451 HA ARG 451 2.905 9.980 5.484
141 HB2 ARG 451 HB2 ARG 451 1.318 7.511 6.076
142 HB3 ARG 451 HB1 ARG 451 1.179 8.952 7.071
143 HG2 ARG 451 HG2 ARG 451 0.564 10.209 4.984
144 HG3 ARG 451 HG1 ARG 451 0.480 8.646 4.163
145 HD2 ARG 451 HD2 ARG 451 -1.173 7.890 5.828
146 HD3 ARG 451 HD1 ARG 451 -1.117 9.479 6.584
147 HE ARG 451 HE ARG 451 -1.757 9.778 3.853
148 HH11 ARG 451 HH11 ARG 451 -3.163 8.653 6.879
149 HH12 ARG 451 HH12 ARG 451 -4.805 8.893 6.336
150 HH21 ARG 451 HH21 ARG 451 -3.900 10.107 3.168
151 HH22 ARG 451 HH22 ARG 451 -5.216 9.732 4.249
152 H THR 452 HN THR 452 3.462 6.763 6.839
153 HA THR 452 HA THR 452 4.850 8.019 9.115
154 HB THR 452 HB THR 452 3.633 5.313 9.372
155 HG1 THR 452 HG1 THR 452 1.665 6.005 9.085
156 HG21 THR 452 HG21 THR 452 3.165 6.114 11.634
157 HG22 THR 452 HG22 THR 452 3.786 7.707 11.200
158 HG23 THR 452 HG23 THR 452 4.868 6.315 11.226
159 H LEU 453 HN LEU 453 5.432 6.383 6.371
160 HA LEU 453 HA LEU 453 6.972 4.929 5.566
161 HB2 LEU 453 HB2 LEU 453 8.257 5.744 8.134
162 HB3 LEU 453 HB1 LEU 453 8.909 4.360 7.284
163 HG LEU 453 HG LEU 453 9.972 6.683 6.885
164 HD11 LEU 453 HD11 LEU 453 10.214 4.490 5.539
165 HD12 LEU 453 HD12 LEU 453 10.730 6.008 4.807
166 HD13 LEU 453 HD13 LEU 453 9.182 5.300 4.359
167 HD21 LEU 453 HD21 LEU 453 8.974 8.035 5.170
168 HD22 LEU 453 HD22 LEU 453 7.795 7.823 6.468
169 HD23 LEU 453 HD23 LEU 453 7.652 6.883 4.977
170 H GLU 454 HN GLU 454 5.226 3.442 5.624
171 HA GLU 454 HA GLU 454 5.486 1.334 7.666
172 HB2 GLU 454 HB2 GLU 454 2.939 2.452 6.476
173 HB3 GLU 454 HB1 GLU 454 3.021 1.043 7.519
174 HG2 GLU 454 HG2 GLU 454 3.856 2.433 9.340
175 HG3 GLU 454 HG1 GLU 454 3.782 3.849 8.291
176 H SER 455 HN SER 455 5.147 -0.775 6.947
177 HA SER 455 HA SER 455 4.599 -1.083 4.068
178 HB2 SER 455 HB2 SER 455 6.837 -1.940 4.813
179 HB3 SER 455 HB1 SER 455 6.006 -3.063 5.888
180 HG SER 455 HG SER 455 6.632 -3.939 3.803
181 H THR 456 HN THR 456 2.524 -1.614 3.772
182 HA THR 456 HA THR 456 1.310 -3.468 5.682
183 HB THR 456 HB THR 456 0.548 -1.273 6.400
184 HG1 THR 456 HG1 THR 456 -0.939 -3.177 6.237
185 HG21 THR 456 HG21 THR 456 -0.706 0.225 5.012
186 HG22 THR 456 HG22 THR 456 -0.673 -0.914 3.670
187 HG23 THR 456 HG23 THR 456 0.817 -0.129 4.193
188 H TRP 457 HN TRP 457 0.034 -4.958 4.815
189 HA TRP 457 HA TRP 457 -0.036 -4.962 1.877
190 HB2 TRP 457 HB2 TRP 457 0.573 -7.218 3.814
191 HB3 TRP 457 HB1 TRP 457 0.334 -7.452 2.076
192 HD1 TRP 457 HD1 TRP 457 2.482 -5.026 4.228
193 HE1 TRP 457 HE1 TRP 457 4.771 -4.745 3.113
194 HE3 TRP 457 HE3 TRP 457 1.856 -8.243 0.296
195 HZ2 TRP 457 HZ2 TRP 457 6.119 -5.708 0.866
196 HZ3 TRP 457 HZ3 TRP 457 3.727 -8.531 -1.280
197 HH2 TRP 457 HH2 TRP 457 5.822 -7.311 -0.992
198 H GLU 458 HN GLU 458 -1.860 -4.282 4.167
199 HA GLU 458 HA GLU 458 -4.241 -5.596 3.050
200 HB2 GLU 458 HB2 GLU 458 -3.820 -4.427 5.815
201 HB3 GLU 458 HB1 GLU 458 -5.341 -5.076 5.213
202 HG2 GLU 458 HG2 GLU 458 -4.470 -7.271 5.104
203 HG3 GLU 458 HG1 GLU 458 -2.823 -6.703 5.364
204 H LYS 459 HN LYS 459 -5.667 -4.232 2.086
205 HA LYS 459 HA LYS 459 -4.726 -1.722 1.266
206 HB2 LYS 459 HB2 LYS 459 -7.543 -2.810 1.132
207 HB3 LYS 459 HB1 LYS 459 -6.944 -1.428 0.227
208 HG2 LYS 459 HG2 LYS 459 -5.377 -2.855 -0.960
209 HG3 LYS 459 HG1 LYS 459 -5.915 -4.248 -0.020
210 HD2 LYS 459 HD2 LYS 459 -7.091 -4.467 -2.015
211 HD3 LYS 459 HD1 LYS 459 -8.259 -3.690 -0.948
212 HE2 LYS 459 HE2 LYS 459 -6.523 -2.251 -2.955
213 HE3 LYS 459 HE1 LYS 459 -8.199 -2.715 -3.226
214 HZ1 LYS 459 HZ1 LYS 459 -8.787 -1.310 -1.279
215 HZ2 LYS 459 HZ2 LYS 459 -8.142 -0.440 -2.585
216 HZ3 LYS 459 HZ3 LYS 459 -7.181 -0.771 -1.233
217 HA PRO 460 HA PRO 460 -5.759 0.692 4.917
218 HB2 PRO 460 HB2 PRO 460 -5.128 3.085 3.625
219 HB3 PRO 460 HB1 PRO 460 -4.011 2.104 4.570
220 HG2 PRO 460 HG2 PRO 460 -4.361 2.273 1.630
221 HG3 PRO 460 HG1 PRO 460 -2.891 1.990 2.575
222 HD2 PRO 460 HD2 PRO 460 -4.158 0.012 1.243
223 HD3 PRO 460 HD1 PRO 460 -3.296 -0.267 2.769
224 H GLN 461 HN GLN 461 -7.556 1.770 5.521
225 HA GLN 461 HA GLN 461 -9.773 1.973 3.779
226 HB2 GLN 461 HB2 GLN 461 -10.952 2.992 5.619
227 HB3 GLN 461 HB1 GLN 461 -9.964 1.678 6.242
228 HG2 GLN 461 HG2 GLN 461 -9.148 4.571 6.318
229 HG3 GLN 461 HG1 GLN 461 -9.974 3.744 7.637
230 HE21 GLN 461 HE21 GLN 461 -7.292 4.986 7.432
231 HE22 GLN 461 HE22 GLN 461 -6.175 3.736 7.910
232 H GLU 462 HN GLU 462 -7.139 4.050 4.365
233 HA GLU 462 HA GLU 462 -8.288 6.568 3.878
234 HB2 GLU 462 HB2 GLU 462 -5.488 5.672 3.169
235 HB3 GLU 462 HB1 GLU 462 -6.031 7.327 3.399
236 HG2 GLU 462 HG2 GLU 462 -5.961 5.209 5.531
237 HG3 GLU 462 HG1 GLU 462 -4.755 6.473 5.305
238 H LEU 463 HN LEU 463 -7.408 3.949 1.802
239 HA LEU 463 HA LEU 463 -8.211 5.564 -0.513
240 HB2 LEU 463 HB2 LEU 463 -5.812 4.917 -0.543
241 HB3 LEU 463 HB1 LEU 463 -6.292 3.233 -0.516
242 HG LEU 463 HG LEU 463 -7.320 3.450 -2.708
243 HD11 LEU 463 HD11 LEU 463 -6.415 6.327 -2.594
244 HD12 LEU 463 HD12 LEU 463 -8.087 5.767 -2.514
245 HD13 LEU 463 HD13 LEU 463 -7.146 5.523 -3.986
246 HD21 LEU 463 HD21 LEU 463 -4.584 4.706 -2.758
247 HD22 LEU 463 HD22 LEU 463 -5.332 3.708 -4.007
248 HD23 LEU 463 HD23 LEU 463 -4.872 2.993 -2.461
249 H LYS 464 HN LYS 464 -10.357 4.947 0.064
250 HA LYS 464 HA LYS 464 -11.175 2.623 -1.429
251 HB2 LYS 464 HB2 LYS 464 -10.871 1.642 0.815
252 HB3 LYS 464 HB1 LYS 464 -11.925 2.873 1.499
253 HG2 LYS 464 HG2 LYS 464 -13.767 2.013 0.078
254 HG3 LYS 464 HG1 LYS 464 -12.698 0.720 -0.459
255 HD2 LYS 464 HD2 LYS 464 -13.319 1.193 2.445
256 HD3 LYS 464 HD1 LYS 464 -14.336 0.184 1.421
257 HE2 LYS 464 HE2 LYS 464 -12.887 -1.319 2.473
258 HE3 LYS 464 HE1 LYS 464 -12.205 -1.100 0.864
259 HZ1 LYS 464 HZ1 LYS 464 -10.640 0.509 1.830
260 HZ2 LYS 464 HZ2 LYS 464 -10.473 -1.036 2.503
261 HZ3 LYS 464 HZ3 LYS 464 -11.269 0.186 3.372
Start of MODEL 8
1 H SER 433 HT1 SER 433 -1.794 11.215 -2.941
2 HA SER 433 HA SER 433 -0.369 9.359 -3.602
3 HB2 SER 433 HB2 SER 433 1.175 11.753 -2.573
4 HB3 SER 433 HB1 SER 433 1.588 10.732 -3.952
5 HG SER 433 HG SER 433 0.475 12.832 -4.361
6 H GLU 434 HN GLU 434 -0.954 9.138 -0.604
7 HA GLU 434 HA GLU 434 1.713 8.758 0.516
8 HB2 GLU 434 HB2 GLU 434 -1.029 8.897 1.772
9 HB3 GLU 434 HB1 GLU 434 0.430 8.532 2.679
10 HG2 GLU 434 HG2 GLU 434 -0.238 10.877 2.895
11 HG3 GLU 434 HG1 GLU 434 1.351 10.700 2.156
12 H TRP 435 HN TRP 435 -0.646 6.942 -0.976
13 HA TRP 435 HA TRP 435 0.280 4.479 0.348
14 HB2 TRP 435 HB2 TRP 435 -2.508 4.758 -0.777
15 HB3 TRP 435 HB1 TRP 435 -1.897 3.558 0.360
16 HD1 TRP 435 HD1 TRP 435 -3.660 6.835 0.224
17 HE1 TRP 435 HE1 TRP 435 -3.966 7.788 2.601
18 HE3 TRP 435 HE3 TRP 435 -0.623 3.620 2.759
19 HZ2 TRP 435 HZ2 TRP 435 -3.015 7.240 5.206
20 HZ3 TRP 435 HZ3 TRP 435 -0.356 3.903 5.182
21 HH2 TRP 435 HH2 TRP 435 -1.514 5.691 6.381
22 H THR 436 HN THR 436 1.563 3.539 -1.124
23 HA THR 436 HA THR 436 0.849 3.643 -3.948
24 HB THR 436 HB THR 436 3.254 2.482 -2.530
25 HG1 THR 436 HG1 THR 436 3.064 4.813 -2.821
26 HG21 THR 436 HG21 THR 436 2.730 1.094 -4.491
27 HG22 THR 436 HG22 THR 436 4.199 2.035 -4.755
28 HG23 THR 436 HG23 THR 436 2.685 2.541 -5.504
29 H GLU 437 HN GLU 437 -0.874 2.302 -4.295
30 HA GLU 437 HA GLU 437 -0.647 -0.459 -3.418
31 HB2 GLU 437 HB2 GLU 437 -2.824 -0.735 -4.717
32 HB3 GLU 437 HB1 GLU 437 -2.874 0.250 -3.266
33 HG2 GLU 437 HG2 GLU 437 -2.839 2.270 -4.612
34 HG3 GLU 437 HG1 GLU 437 -2.726 1.299 -6.083
35 H ARG 438 HN ARG 438 0.879 -1.465 -4.452
36 HA ARG 438 HA ARG 438 0.926 -1.317 -7.396
37 HB2 ARG 438 HB2 ARG 438 2.804 -0.101 -6.260
38 HB3 ARG 438 HB1 ARG 438 3.299 -1.626 -5.546
39 HG2 ARG 438 HG2 ARG 438 3.698 -2.532 -7.789
40 HG3 ARG 438 HG1 ARG 438 3.236 -0.975 -8.484
41 HD2 ARG 438 HD2 ARG 438 5.045 0.097 -7.196
42 HD3 ARG 438 HD1 ARG 438 5.529 -1.484 -6.593
43 HE ARG 438 HE ARG 438 5.517 -0.968 -9.489
44 HH11 ARG 438 HH11 ARG 438 7.249 -1.646 -6.523
45 HH12 ARG 438 HH12 ARG 438 8.736 -2.047 -7.329
46 HH21 ARG 438 HH21 ARG 438 7.494 -1.475 -10.560
47 HH22 ARG 438 HH22 ARG 438 8.876 -1.941 -9.613
48 H LYS 439 HN LYS 439 0.850 -3.255 -8.408
49 HA LYS 439 HA LYS 439 0.823 -5.606 -6.668
50 HB2 LYS 439 HB2 LYS 439 -1.137 -5.157 -8.169
51 HB3 LYS 439 HB1 LYS 439 -0.074 -5.429 -9.543
52 HG2 LYS 439 HG2 LYS 439 0.379 -7.710 -8.685
53 HG3 LYS 439 HG1 LYS 439 -0.805 -7.422 -7.409
54 HD2 LYS 439 HD2 LYS 439 -1.360 -7.351 -10.372
55 HD3 LYS 439 HD1 LYS 439 -1.761 -8.680 -9.286
56 HE2 LYS 439 HE2 LYS 439 -2.824 -5.864 -9.074
57 HE3 LYS 439 HE1 LYS 439 -3.694 -7.232 -9.768
58 HZ1 LYS 439 HZ1 LYS 439 -3.432 -8.337 -7.548
59 HZ2 LYS 439 HZ2 LYS 439 -4.451 -6.983 -7.566
60 HZ3 LYS 439 HZ3 LYS 439 -2.883 -6.850 -6.938
61 H THR 440 HN THR 440 2.542 -6.770 -6.522
62 HA THR 440 HA THR 440 4.555 -6.757 -8.615
63 HB THR 440 HB THR 440 5.794 -8.291 -7.058
64 HG1 THR 440 HG1 THR 440 4.933 -8.702 -5.035
65 HG21 THR 440 HG21 THR 440 6.168 -5.875 -6.990
66 HG22 THR 440 HG22 THR 440 6.282 -6.574 -5.376
67 HG23 THR 440 HG23 THR 440 4.831 -5.694 -5.854
68 H ALA 441 HN ALA 441 5.291 -8.687 -9.649
69 HA ALA 441 HA ALA 441 3.113 -10.172 -10.694
70 HB1 ALA 441 HB1 ALA 441 5.054 -9.525 -12.035
71 HB2 ALA 441 HB2 ALA 441 4.768 -11.265 -12.088
72 HB3 ALA 441 HB3 ALA 441 6.066 -10.616 -11.087
73 H ASP 442 HN ASP 442 4.437 -10.565 -7.799
74 HA ASP 442 HA ASP 442 4.494 -13.463 -7.725
75 HB2 ASP 442 HB2 ASP 442 6.027 -12.212 -6.289
76 HB3 ASP 442 HB1 ASP 442 4.679 -11.371 -5.539
77 H GLY 443 HN GLY 443 2.197 -11.053 -7.760
78 HA2 GLY 443 HA2 GLY 443 -0.123 -11.402 -7.774
79 HA3 GLY 443 HA1 GLY 443 0.124 -12.926 -6.934
80 H LYS 444 HN LYS 444 1.274 -9.683 -6.080
81 HA LYS 444 HA LYS 444 -0.529 -9.691 -3.771
82 HB2 LYS 444 HB2 LYS 444 2.472 -9.415 -3.630
83 HB3 LYS 444 HB1 LYS 444 1.397 -8.927 -2.328
84 HG2 LYS 444 HG2 LYS 444 0.584 -11.221 -2.131
85 HG3 LYS 444 HG1 LYS 444 1.661 -11.713 -3.439
86 HD2 LYS 444 HD2 LYS 444 3.596 -11.137 -2.124
87 HD3 LYS 444 HD1 LYS 444 2.577 -10.477 -0.844
88 HE2 LYS 444 HE2 LYS 444 3.398 -12.706 -0.270
89 HE3 LYS 444 HE1 LYS 444 1.644 -12.691 -0.431
90 HZ1 LYS 444 HZ1 LYS 444 1.833 -13.683 -2.592
91 HZ2 LYS 444 HZ2 LYS 444 2.696 -14.629 -1.488
92 HZ3 LYS 444 HZ3 LYS 444 3.524 -13.592 -2.549
93 H THR 445 HN THR 445 -1.484 -7.786 -3.509
94 HA THR 445 HA THR 445 -0.371 -5.415 -4.809
95 HB THR 445 HB THR 445 -2.889 -5.339 -3.202
96 HG1 THR 445 HG1 THR 445 -3.228 -7.185 -4.444
97 HG21 THR 445 HG21 THR 445 -3.565 -3.775 -4.962
98 HG22 THR 445 HG22 THR 445 -2.059 -4.084 -5.826
99 HG23 THR 445 HG23 THR 445 -2.024 -3.299 -4.248
100 H TYR 446 HN TYR 446 1.349 -4.785 -3.499
101 HA TYR 446 HA TYR 446 0.829 -4.613 -0.643
102 HB2 TYR 446 HB2 TYR 446 3.117 -4.252 -0.292
103 HB3 TYR 446 HB1 TYR 446 3.017 -5.499 -1.509
104 HD1 TYR 446 HD1 TYR 446 3.386 -4.741 -3.981
105 HD2 TYR 446 HD2 TYR 446 4.421 -2.387 -0.595
106 HE1 TYR 446 HE1 TYR 446 4.972 -3.459 -5.360
107 HE2 TYR 446 HE2 TYR 446 6.004 -1.099 -1.956
108 HH TYR 446 HH TYR 446 7.280 -1.324 -4.014
109 H TYR 447 HN TYR 447 0.631 -2.819 0.481
110 HA TYR 447 HA TYR 447 0.718 -0.311 -1.016
111 HB2 TYR 447 HB2 TYR 447 -0.678 -1.054 1.556
112 HB3 TYR 447 HB1 TYR 447 -0.512 0.603 1.010
113 HD1 TYR 447 HD2 TYR 447 -1.687 -2.692 -0.433
114 HD2 TYR 447 HD1 TYR 447 -2.317 1.511 -0.040
115 HE1 TYR 447 HE2 TYR 447 -3.763 -2.879 -1.727
116 HE2 TYR 447 HE1 TYR 447 -4.390 1.319 -1.339
117 HH TYR 447 HH TYR 447 -5.406 -0.139 -2.967
118 H TYR 448 HN TYR 448 2.943 0.112 -0.912
119 HA TYR 448 HA TYR 448 4.099 0.457 1.702
120 HB2 TYR 448 HB2 TYR 448 5.787 -0.025 0.181
121 HB3 TYR 448 HB1 TYR 448 5.049 0.929 -1.103
122 HD1 TYR 448 HD1 TYR 448 6.606 1.418 2.275
123 HD2 TYR 448 HD2 TYR 448 6.023 2.953 -1.653
124 HE1 TYR 448 HE1 TYR 448 8.074 3.325 2.810
125 HE2 TYR 448 HE2 TYR 448 7.492 4.855 -1.135
126 HH TYR 448 HH TYR 448 9.494 4.968 1.569
127 H ASN 449 HN ASN 449 3.870 2.058 2.924
128 HA ASN 449 HA ASN 449 2.476 4.465 2.029
129 HB2 ASN 449 HB2 ASN 449 1.235 3.602 3.750
130 HB3 ASN 449 HB1 ASN 449 2.626 2.853 4.523
131 HD21 ASN 449 HD21 ASN 449 0.884 5.814 4.042
132 HD22 ASN 449 HD22 ASN 449 1.473 6.612 5.452
133 H ASN 450 HN ASN 450 3.344 6.443 2.211
134 HA ASN 450 HA ASN 450 6.116 6.584 3.150
135 HB2 ASN 450 HB2 ASN 450 5.583 7.252 0.795
136 HB3 ASN 450 HB1 ASN 450 4.618 8.576 1.436
137 HD21 ASN 450 HD21 ASN 450 7.871 7.252 1.237
138 HD22 ASN 450 HD22 ASN 450 8.690 8.752 1.498
139 H ARG 451 HN ARG 451 3.082 7.183 4.323
140 HA ARG 451 HA ARG 451 3.422 9.629 5.686
141 HB2 ARG 451 HB2 ARG 451 1.723 7.247 6.303
142 HB3 ARG 451 HB1 ARG 451 1.794 8.627 7.384
143 HG2 ARG 451 HG2 ARG 451 0.948 8.741 4.497
144 HG3 ARG 451 HG1 ARG 451 -0.147 8.673 5.878
145 HD2 ARG 451 HD2 ARG 451 -0.093 10.927 5.554
146 HD3 ARG 451 HD1 ARG 451 1.270 10.758 6.658
147 HE ARG 451 HE ARG 451 1.887 10.643 3.826
148 HH11 ARG 451 HH11 ARG 451 1.826 12.539 6.765
149 HH12 ARG 451 HH12 ARG 451 2.783 13.828 6.096
150 HH21 ARG 451 HH21 ARG 451 3.132 12.336 2.946
151 HH22 ARG 451 HH22 ARG 451 3.518 13.722 3.916
152 H THR 452 HN THR 452 3.940 6.297 6.708
153 HA THR 452 HA THR 452 5.625 7.264 8.924
154 HB THR 452 HB THR 452 4.143 4.645 8.974
155 HG1 THR 452 HG1 THR 452 3.126 7.078 10.050
156 HG21 THR 452 HG21 THR 452 4.271 4.987 11.402
157 HG22 THR 452 HG22 THR 452 5.107 6.517 11.141
158 HG23 THR 452 HG23 THR 452 5.873 5.002 10.662
159 H LEU 453 HN LEU 453 5.812 5.886 5.988
160 HA LEU 453 HA LEU 453 7.337 4.621 4.859
161 HB2 LEU 453 HB2 LEU 453 8.728 4.937 7.485
162 HB3 LEU 453 HB1 LEU 453 9.313 3.703 6.388
163 HG LEU 453 HG LEU 453 10.503 5.940 6.302
164 HD11 LEU 453 HD11 LEU 453 10.435 4.154 4.475
165 HD12 LEU 453 HD12 LEU 453 10.917 5.784 4.010
166 HD13 LEU 453 HD13 LEU 453 9.287 5.218 3.660
167 HD21 LEU 453 HD21 LEU 453 9.467 7.731 5.056
168 HD22 LEU 453 HD22 LEU 453 8.473 7.336 6.459
169 HD23 LEU 453 HD23 LEU 453 7.999 6.773 4.850
170 H GLU 454 HN GLU 454 5.010 3.621 6.116
171 HA GLU 454 HA GLU 454 5.683 1.032 7.277
172 HB2 GLU 454 HB2 GLU 454 3.084 2.528 6.920
173 HB3 GLU 454 HB1 GLU 454 3.165 0.891 7.550
174 HG2 GLU 454 HG2 GLU 454 4.685 3.144 8.803
175 HG3 GLU 454 HG1 GLU 454 3.004 2.802 9.214
176 H SER 455 HN SER 455 5.929 -0.673 5.927
177 HA SER 455 HA SER 455 4.446 -0.698 3.423
178 HB2 SER 455 HB2 SER 455 6.317 -2.808 4.533
179 HB3 SER 455 HB1 SER 455 5.690 -2.719 2.888
180 HG SER 455 HG SER 455 6.902 -0.403 3.641
181 H THR 456 HN THR 456 2.391 -1.278 3.541
182 HA THR 456 HA THR 456 1.629 -3.254 5.578
183 HB THR 456 HB THR 456 0.908 -1.043 6.322
184 HG1 THR 456 HG1 THR 456 -1.308 -1.549 6.580
185 HG21 THR 456 HG21 THR 456 0.728 0.162 4.248
186 HG22 THR 456 HG22 THR 456 -0.840 0.188 5.057
187 HG23 THR 456 HG23 THR 456 -0.569 -0.900 3.699
188 H TRP 457 HN TRP 457 0.247 -4.808 4.968
189 HA TRP 457 HA TRP 457 -0.227 -4.907 2.068
190 HB2 TRP 457 HB2 TRP 457 0.633 -7.114 3.972
191 HB3 TRP 457 HB1 TRP 457 0.236 -7.364 2.265
192 HD1 TRP 457 HD1 TRP 457 2.556 -4.928 4.221
193 HE1 TRP 457 HE1 TRP 457 4.714 -4.597 2.881
194 HE3 TRP 457 HE3 TRP 457 1.589 -8.093 0.305
195 HZ2 TRP 457 HZ2 TRP 457 5.837 -5.475 0.499
196 HZ3 TRP 457 HZ3 TRP 457 3.306 -8.317 -1.451
197 HH2 TRP 457 HH2 TRP 457 5.399 -7.056 -1.344
198 H GLU 458 HN GLU 458 -1.771 -4.244 4.636
199 HA GLU 458 HA GLU 458 -4.229 -5.660 3.860
200 HB2 GLU 458 HB2 GLU 458 -3.238 -5.318 6.377
201 HB3 GLU 458 HB1 GLU 458 -4.226 -3.872 6.228
202 HG2 GLU 458 HG2 GLU 458 -5.136 -6.726 5.961
203 HG3 GLU 458 HG1 GLU 458 -5.513 -5.602 7.264
204 H LYS 459 HN LYS 459 -5.966 -4.406 3.146
205 HA LYS 459 HA LYS 459 -5.173 -2.110 1.666
206 HB2 LYS 459 HB2 LYS 459 -7.943 -3.223 2.121
207 HB3 LYS 459 HB1 LYS 459 -7.473 -2.098 0.854
208 HG2 LYS 459 HG2 LYS 459 -6.073 -3.757 -0.174
209 HG3 LYS 459 HG1 LYS 459 -6.367 -4.880 1.154
210 HD2 LYS 459 HD2 LYS 459 -8.783 -4.846 0.565
211 HD3 LYS 459 HD1 LYS 459 -8.385 -3.857 -0.842
212 HE2 LYS 459 HE2 LYS 459 -6.935 -5.631 -1.686
213 HE3 LYS 459 HE1 LYS 459 -7.303 -6.614 -0.270
214 HZ1 LYS 459 HZ1 LYS 459 -9.199 -5.770 -2.390
215 HZ2 LYS 459 HZ2 LYS 459 -9.657 -6.575 -0.970
216 HZ3 LYS 459 HZ3 LYS 459 -8.637 -7.341 -2.087
217 HA PRO 460 HA PRO 460 -6.383 0.858 4.871
218 HB2 PRO 460 HB2 PRO 460 -5.037 2.878 3.346
219 HB3 PRO 460 HB1 PRO 460 -4.532 2.148 4.869
220 HG2 PRO 460 HG2 PRO 460 -3.257 1.817 2.434
221 HG3 PRO 460 HG1 PRO 460 -3.073 0.759 3.841
222 HD2 PRO 460 HD2 PRO 460 -4.682 0.367 1.369
223 HD3 PRO 460 HD1 PRO 460 -3.854 -0.829 2.389
224 H GLN 461 HN GLN 461 -8.259 1.925 4.851
225 HA GLN 461 HA GLN 461 -9.615 2.303 2.325
226 HB2 GLN 461 HB2 GLN 461 -10.730 1.355 4.368
227 HB3 GLN 461 HB1 GLN 461 -10.609 2.946 5.107
228 HG2 GLN 461 HG2 GLN 461 -12.824 2.598 4.211
229 HG3 GLN 461 HG1 GLN 461 -12.000 3.877 3.322
230 HE21 GLN 461 HE21 GLN 461 -13.229 3.662 1.487
231 HE22 GLN 461 HE22 GLN 461 -13.133 2.289 0.444
232 H GLU 462 HN GLU 462 -7.507 4.131 4.092
233 HA GLU 462 HA GLU 462 -8.779 6.684 3.903
234 HB2 GLU 462 HB2 GLU 462 -7.041 6.076 5.602
235 HB3 GLU 462 HB1 GLU 462 -5.842 6.094 4.317
236 HG2 GLU 462 HG2 GLU 462 -6.080 8.418 3.991
237 HG3 GLU 462 HG1 GLU 462 -7.546 8.481 4.971
238 H LEU 463 HN LEU 463 -7.474 4.719 1.565
239 HA LEU 463 HA LEU 463 -6.519 6.915 -0.117
240 HB2 LEU 463 HB2 LEU 463 -5.539 4.447 0.121
241 HB3 LEU 463 HB1 LEU 463 -6.746 4.098 -1.095
242 HG LEU 463 HG LEU 463 -4.461 6.061 -1.383
243 HD11 LEU 463 HD11 LEU 463 -3.743 3.740 -1.409
244 HD12 LEU 463 HD12 LEU 463 -3.600 4.465 -3.011
245 HD13 LEU 463 HD13 LEU 463 -4.938 3.372 -2.655
246 HD21 LEU 463 HD21 LEU 463 -6.531 5.206 -3.401
247 HD22 LEU 463 HD22 LEU 463 -5.120 6.212 -3.731
248 HD23 LEU 463 HD23 LEU 463 -6.396 6.801 -2.663
249 H LYS 464 HN LYS 464 -9.283 4.890 0.392
250 HA LYS 464 HA LYS 464 -10.349 5.493 -2.271
251 HB2 LYS 464 HB2 LYS 464 -11.469 3.560 -0.237
252 HB3 LYS 464 HB1 LYS 464 -11.878 3.672 -1.943
253 HG2 LYS 464 HG2 LYS 464 -9.209 2.830 -0.831
254 HG3 LYS 464 HG1 LYS 464 -10.446 1.754 -1.476
255 HD2 LYS 464 HD2 LYS 464 -10.216 2.704 -3.667
256 HD3 LYS 464 HD1 LYS 464 -9.125 3.955 -3.060
257 HE2 LYS 464 HE2 LYS 464 -7.508 2.207 -2.435
258 HE3 LYS 464 HE1 LYS 464 -8.591 0.983 -3.097
259 HZ1 LYS 464 HZ1 LYS 464 -8.310 1.871 -5.270
260 HZ2 LYS 464 HZ2 LYS 464 -6.758 1.671 -4.604
261 HZ3 LYS 464 HZ3 LYS 464 -7.457 3.216 -4.693
Start of MODEL 9
1 H SER 433 HT1 SER 433 -1.983 9.482 -5.874
2 HA SER 433 HA SER 433 -2.088 9.155 -3.521
3 HB2 SER 433 HB2 SER 433 -2.870 7.332 -4.982
4 HB3 SER 433 HB1 SER 433 -1.247 6.643 -5.001
5 HG SER 433 HG SER 433 -1.796 5.629 -3.250
6 H GLU 434 HN GLU 434 -1.000 9.182 -1.653
7 HA GLU 434 HA GLU 434 1.868 8.903 -1.676
8 HB2 GLU 434 HB2 GLU 434 1.762 9.433 0.715
9 HB3 GLU 434 HB1 GLU 434 0.836 10.589 -0.230
10 HG2 GLU 434 HG2 GLU 434 -0.543 8.244 1.003
11 HG3 GLU 434 HG1 GLU 434 -0.121 9.638 1.995
12 H TRP 435 HN TRP 435 -0.848 6.910 -1.067
13 HA TRP 435 HA TRP 435 0.758 4.821 0.174
14 HB2 TRP 435 HB2 TRP 435 -2.132 4.675 -0.745
15 HB3 TRP 435 HB1 TRP 435 -1.310 3.560 0.346
16 HD1 TRP 435 HD1 TRP 435 -3.268 6.768 0.303
17 HE1 TRP 435 HE1 TRP 435 -3.479 7.706 2.692
18 HE3 TRP 435 HE3 TRP 435 0.043 3.687 2.687
19 HZ2 TRP 435 HZ2 TRP 435 -2.356 7.228 5.238
20 HZ3 TRP 435 HZ3 TRP 435 0.434 4.017 5.095
21 HH2 TRP 435 HH2 TRP 435 -0.731 5.757 6.338
22 H THR 436 HN THR 436 2.032 3.654 -1.146
23 HA THR 436 HA THR 436 1.390 3.557 -3.985
24 HB THR 436 HB THR 436 3.827 2.621 -2.461
25 HG1 THR 436 HG1 THR 436 3.196 4.982 -3.183
26 HG21 THR 436 HG21 THR 436 3.438 1.131 -4.379
27 HG22 THR 436 HG22 THR 436 4.851 2.155 -4.651
28 HG23 THR 436 HG23 THR 436 3.326 2.533 -5.447
29 H GLU 437 HN GLU 437 -0.159 2.093 -4.383
30 HA GLU 437 HA GLU 437 0.183 -0.605 -3.381
31 HB2 GLU 437 HB2 GLU 437 -1.853 -1.087 -4.811
32 HB3 GLU 437 HB1 GLU 437 -2.107 0.023 -3.476
33 HG2 GLU 437 HG2 GLU 437 -2.072 1.907 -4.985
34 HG3 GLU 437 HG1 GLU 437 -1.681 0.849 -6.342
35 H ARG 438 HN ARG 438 2.095 -1.181 -4.269
36 HA ARG 438 HA ARG 438 2.346 -1.130 -7.170
37 HB2 ARG 438 HB2 ARG 438 4.290 -0.458 -5.799
38 HB3 ARG 438 HB1 ARG 438 4.304 -2.049 -5.053
39 HG2 ARG 438 HG2 ARG 438 4.882 -3.089 -7.127
40 HG3 ARG 438 HG1 ARG 438 4.674 -1.568 -7.998
41 HD2 ARG 438 HD2 ARG 438 6.702 -2.022 -5.816
42 HD3 ARG 438 HD1 ARG 438 7.046 -2.154 -7.540
43 HE ARG 438 HE ARG 438 6.192 0.286 -7.564
44 HH11 ARG 438 HH11 ARG 438 7.932 -1.197 -4.909
45 HH12 ARG 438 HH12 ARG 438 8.747 0.267 -4.443
46 HH21 ARG 438 HH21 ARG 438 7.259 2.231 -6.961
47 HH22 ARG 438 HH22 ARG 438 8.360 2.218 -5.606
48 H LYS 439 HN LYS 439 1.679 -2.791 -8.319
49 HA LYS 439 HA LYS 439 0.953 -5.201 -6.889
50 HB2 LYS 439 HB2 LYS 439 -0.345 -5.832 -8.813
51 HB3 LYS 439 HB1 LYS 439 -0.710 -4.168 -8.400
52 HG2 LYS 439 HG2 LYS 439 1.165 -4.980 -10.612
53 HG3 LYS 439 HG1 LYS 439 -0.549 -4.647 -10.839
54 HD2 LYS 439 HD2 LYS 439 -0.147 -2.365 -9.895
55 HD3 LYS 439 HD1 LYS 439 1.580 -2.725 -9.914
56 HE2 LYS 439 HE2 LYS 439 1.017 -1.489 -11.904
57 HE3 LYS 439 HE1 LYS 439 1.422 -3.148 -12.352
58 HZ1 LYS 439 HZ1 LYS 439 -1.313 -2.006 -12.094
59 HZ2 LYS 439 HZ2 LYS 439 -0.976 -3.635 -12.428
60 HZ3 LYS 439 HZ3 LYS 439 -0.531 -2.433 -13.540
61 H THR 440 HN THR 440 2.443 -6.603 -6.621
62 HA THR 440 HA THR 440 4.528 -7.018 -8.588
63 HB THR 440 HB THR 440 5.419 -8.656 -6.954
64 HG1 THR 440 HG1 THR 440 3.354 -7.821 -5.186
65 HG21 THR 440 HG21 THR 440 4.657 -5.997 -5.756
66 HG22 THR 440 HG22 THR 440 6.066 -6.312 -6.769
67 HG23 THR 440 HG23 THR 440 5.943 -7.055 -5.174
68 H ALA 441 HN ALA 441 4.930 -8.976 -9.647
69 HA ALA 441 HA ALA 441 2.624 -10.184 -10.726
70 HB1 ALA 441 HB1 ALA 441 4.701 -9.888 -11.994
71 HB2 ALA 441 HB2 ALA 441 4.158 -11.565 -12.006
72 HB3 ALA 441 HB3 ALA 441 5.493 -11.078 -10.961
73 H ASP 442 HN ASP 442 4.365 -10.854 -7.900
74 HA ASP 442 HA ASP 442 3.784 -13.662 -7.770
75 HB2 ASP 442 HB2 ASP 442 5.666 -12.459 -6.542
76 HB3 ASP 442 HB1 ASP 442 4.433 -11.857 -5.440
77 H GLY 443 HN GLY 443 1.886 -10.983 -7.626
78 HA2 GLY 443 HA2 GLY 443 -0.445 -11.040 -7.394
79 HA3 GLY 443 HA1 GLY 443 -0.295 -12.528 -6.471
80 H LYS 444 HN LYS 444 1.528 -9.592 -5.837
81 HA LYS 444 HA LYS 444 -0.031 -9.281 -3.364
82 HB2 LYS 444 HB2 LYS 444 2.972 -9.035 -3.603
83 HB3 LYS 444 HB1 LYS 444 2.027 -8.740 -2.149
84 HG2 LYS 444 HG2 LYS 444 1.285 -11.099 -2.208
85 HG3 LYS 444 HG1 LYS 444 2.371 -11.369 -3.576
86 HD2 LYS 444 HD2 LYS 444 4.274 -10.704 -2.179
87 HD3 LYS 444 HD1 LYS 444 3.179 -10.448 -0.817
88 HE2 LYS 444 HE2 LYS 444 3.804 -13.050 -2.207
89 HE3 LYS 444 HE1 LYS 444 4.193 -12.594 -0.547
90 HZ1 LYS 444 HZ1 LYS 444 2.303 -14.000 -0.478
91 HZ2 LYS 444 HZ2 LYS 444 1.509 -13.127 -1.693
92 HZ3 LYS 444 HZ3 LYS 444 1.741 -12.430 -0.162
93 H THR 445 HN THR 445 -1.102 -7.443 -3.608
94 HA THR 445 HA THR 445 0.226 -5.074 -4.663
95 HB THR 445 HB THR 445 -2.023 -4.009 -3.854
96 HG1 THR 445 HG1 THR 445 -2.716 -5.849 -2.670
97 HG21 THR 445 HG21 THR 445 -3.087 -4.537 -5.938
98 HG22 THR 445 HG22 THR 445 -2.074 -5.970 -6.145
99 HG23 THR 445 HG23 THR 445 -1.353 -4.360 -6.213
100 H TYR 446 HN TYR 446 1.824 -4.614 -3.155
101 HA TYR 446 HA TYR 446 0.968 -4.336 -0.376
102 HB2 TYR 446 HB2 TYR 446 3.261 -4.284 0.254
103 HB3 TYR 446 HB1 TYR 446 3.052 -5.609 -0.871
104 HD1 TYR 446 HD1 TYR 446 3.693 -5.072 -3.375
105 HD2 TYR 446 HD2 TYR 446 4.999 -2.808 -0.018
106 HE1 TYR 446 HE1 TYR 446 5.594 -4.220 -4.685
107 HE2 TYR 446 HE2 TYR 446 6.897 -1.953 -1.322
108 HH TYR 446 HH TYR 446 8.244 -2.727 -3.316
109 H TYR 447 HN TYR 447 0.632 -2.462 0.552
110 HA TYR 447 HA TYR 447 1.179 -0.058 -0.997
111 HB2 TYR 447 HB2 TYR 447 -0.443 -0.529 1.508
112 HB3 TYR 447 HB1 TYR 447 -0.171 1.063 0.816
113 HD1 TYR 447 HD2 TYR 447 -1.308 -2.302 -0.433
114 HD2 TYR 447 HD1 TYR 447 -1.930 1.910 -0.374
115 HE1 TYR 447 HE2 TYR 447 -3.286 -2.581 -1.877
116 HE2 TYR 447 HE1 TYR 447 -3.908 1.639 -1.804
117 HH TYR 447 HH TYR 447 -4.772 0.005 -3.455
118 H TYR 448 HN TYR 448 3.485 -0.040 -0.689
119 HA TYR 448 HA TYR 448 4.376 0.624 1.996
120 HB2 TYR 448 HB2 TYR 448 6.027 -0.553 0.782
121 HB3 TYR 448 HB1 TYR 448 5.791 0.430 -0.660
122 HD1 TYR 448 HD1 TYR 448 6.578 1.189 2.941
123 HD2 TYR 448 HD2 TYR 448 7.624 1.704 -1.153
124 HE1 TYR 448 HE1 TYR 448 8.446 2.666 3.611
125 HE2 TYR 448 HE2 TYR 448 9.486 3.164 -0.503
126 HH TYR 448 HH TYR 448 10.058 4.661 1.494
127 H ASN 449 HN ASN 449 4.375 2.546 2.823
128 HA ASN 449 HA ASN 449 3.923 4.851 1.056
129 HB2 ASN 449 HB2 ASN 449 1.802 4.499 1.860
130 HB3 ASN 449 HB1 ASN 449 2.372 3.854 3.397
131 HD21 ASN 449 HD21 ASN 449 1.776 6.746 1.541
132 HD22 ASN 449 HD22 ASN 449 1.736 7.820 2.899
133 H ASN 450 HN ASN 450 4.504 6.878 1.871
134 HA ASN 450 HA ASN 450 6.937 6.709 3.469
135 HB2 ASN 450 HB2 ASN 450 7.403 8.953 2.402
136 HB3 ASN 450 HB1 ASN 450 7.308 7.592 1.290
137 HD21 ASN 450 HD21 ASN 450 6.739 8.734 -0.504
138 HD22 ASN 450 HD22 ASN 450 5.228 9.569 -0.679
139 H ARG 451 HN ARG 451 3.769 7.518 3.917
140 HA ARG 451 HA ARG 451 4.058 9.847 5.526
141 HB2 ARG 451 HB2 ARG 451 1.836 7.863 5.251
142 HB3 ARG 451 HB1 ARG 451 1.781 9.130 6.469
143 HG2 ARG 451 HG2 ARG 451 1.962 10.823 4.720
144 HG3 ARG 451 HG1 ARG 451 2.032 9.555 3.498
145 HD2 ARG 451 HD2 ARG 451 -0.207 10.506 3.645
146 HD3 ARG 451 HD1 ARG 451 -0.209 8.813 4.131
147 HE ARG 451 HE ARG 451 0.057 10.660 6.334
148 HH11 ARG 451 HH11 ARG 451 -2.229 9.106 4.191
149 HH12 ARG 451 HH12 ARG 451 -3.514 9.062 5.358
150 HH21 ARG 451 HH21 ARG 451 -1.649 10.653 7.879
151 HH22 ARG 451 HH22 ARG 451 -3.185 9.953 7.449
152 H THR 452 HN THR 452 3.782 6.409 6.307
153 HA THR 452 HA THR 452 4.940 7.066 8.930
154 HB THR 452 HB THR 452 3.864 4.888 9.683
155 HG1 THR 452 HG1 THR 452 2.371 3.974 8.412
156 HG21 THR 452 HG21 THR 452 2.072 7.183 8.876
157 HG22 THR 452 HG22 THR 452 3.017 7.075 10.361
158 HG23 THR 452 HG23 THR 452 1.688 5.952 10.078
159 H LEU 453 HN LEU 453 5.776 5.803 6.035
160 HA LEU 453 HA LEU 453 7.378 4.393 5.250
161 HB2 LEU 453 HB2 LEU 453 8.325 4.965 8.010
162 HB3 LEU 453 HB1 LEU 453 9.064 3.617 7.170
163 HG LEU 453 HG LEU 453 10.258 5.859 7.005
164 HD11 LEU 453 HD11 LEU 453 10.501 3.825 5.473
165 HD12 LEU 453 HD12 LEU 453 11.048 5.383 4.849
166 HD13 LEU 453 HD13 LEU 453 9.498 4.723 4.333
167 HD21 LEU 453 HD21 LEU 453 9.451 7.439 5.378
168 HD22 LEU 453 HD22 LEU 453 8.194 7.191 6.593
169 HD23 LEU 453 HD23 LEU 453 8.067 6.407 5.013
170 H GLU 454 HN GLU 454 4.954 3.325 5.900
171 HA GLU 454 HA GLU 454 5.636 0.677 7.004
172 HB2 GLU 454 HB2 GLU 454 3.046 2.215 7.205
173 HB3 GLU 454 HB1 GLU 454 3.206 0.515 7.620
174 HG2 GLU 454 HG2 GLU 454 4.884 1.130 9.326
175 HG3 GLU 454 HG1 GLU 454 4.588 2.832 8.950
176 H SER 455 HN SER 455 4.780 -1.113 5.987
177 HA SER 455 HA SER 455 3.452 -0.593 3.428
178 HB2 SER 455 HB2 SER 455 4.231 -2.970 2.881
179 HB3 SER 455 HB1 SER 455 5.473 -1.722 2.951
180 HG SER 455 HG SER 455 6.351 -2.687 4.600
181 H THR 456 HN THR 456 1.386 -0.915 3.467
182 HA THR 456 HA THR 456 0.219 -2.765 5.420
183 HB THR 456 HB THR 456 -1.933 -1.611 4.857
184 HG1 THR 456 HG1 THR 456 -1.188 -0.846 2.767
185 HG21 THR 456 HG21 THR 456 -1.352 0.545 5.980
186 HG22 THR 456 HG22 THR 456 0.349 0.102 5.841
187 HG23 THR 456 HG23 THR 456 -0.742 -0.882 6.817
188 H TRP 457 HN TRP 457 -0.298 -4.686 4.709
189 HA TRP 457 HA TRP 457 -0.451 -5.104 1.827
190 HB2 TRP 457 HB2 TRP 457 -0.008 -7.059 4.109
191 HB3 TRP 457 HB1 TRP 457 -0.017 -7.496 2.394
192 HD1 TRP 457 HD1 TRP 457 1.846 -4.976 4.677
193 HE1 TRP 457 HE1 TRP 457 4.230 -4.648 3.784
194 HE3 TRP 457 HE3 TRP 457 1.646 -8.149 0.667
195 HZ2 TRP 457 HZ2 TRP 457 5.802 -5.567 1.656
196 HZ3 TRP 457 HZ3 TRP 457 3.661 -8.392 -0.729
197 HH2 TRP 457 HH2 TRP 457 5.703 -7.144 -0.233
198 H GLU 458 HN GLU 458 -2.490 -4.331 4.107
199 HA GLU 458 HA GLU 458 -4.715 -5.489 2.569
200 HB2 GLU 458 HB2 GLU 458 -6.166 -4.962 4.511
201 HB3 GLU 458 HB1 GLU 458 -4.923 -6.135 4.914
202 HG2 GLU 458 HG2 GLU 458 -3.668 -4.532 6.118
203 HG3 GLU 458 HG1 GLU 458 -4.646 -3.203 5.498
204 H LYS 459 HN LYS 459 -6.315 -3.931 1.870
205 HA LYS 459 HA LYS 459 -5.159 -1.452 1.101
206 HB2 LYS 459 HB2 LYS 459 -7.978 -2.496 0.923
207 HB3 LYS 459 HB1 LYS 459 -7.515 -0.908 0.328
208 HG2 LYS 459 HG2 LYS 459 -5.860 -2.018 -1.155
209 HG3 LYS 459 HG1 LYS 459 -6.504 -3.574 -0.632
210 HD2 LYS 459 HD2 LYS 459 -7.495 -2.945 -2.749
211 HD3 LYS 459 HD1 LYS 459 -8.725 -2.913 -1.487
212 HE2 LYS 459 HE2 LYS 459 -7.246 -0.421 -2.266
213 HE3 LYS 459 HE1 LYS 459 -8.629 -0.979 -3.203
214 HZ1 LYS 459 HZ1 LYS 459 -9.987 -0.866 -1.214
215 HZ2 LYS 459 HZ2 LYS 459 -9.283 0.644 -1.529
216 HZ3 LYS 459 HZ3 LYS 459 -8.663 -0.342 -0.302
217 HA PRO 460 HA PRO 460 -6.243 0.763 4.883
218 HB2 PRO 460 HB2 PRO 460 -5.035 3.063 3.539
219 HB3 PRO 460 HB1 PRO 460 -4.542 2.255 5.029
220 HG2 PRO 460 HG2 PRO 460 -3.121 2.110 2.723
221 HG3 PRO 460 HG1 PRO 460 -3.132 0.826 3.944
222 HD2 PRO 460 HD2 PRO 460 -4.569 0.974 1.329
223 HD3 PRO 460 HD1 PRO 460 -3.834 -0.423 2.143
224 H GLN 461 HN GLN 461 -8.333 1.282 5.005
225 HA GLN 461 HA GLN 461 -9.669 2.473 2.748
226 HB2 GLN 461 HB2 GLN 461 -11.712 2.270 4.101
227 HB3 GLN 461 HB1 GLN 461 -10.826 0.758 3.996
228 HG2 GLN 461 HG2 GLN 461 -9.888 1.193 6.232
229 HG3 GLN 461 HG1 GLN 461 -10.884 2.643 6.338
230 HE21 GLN 461 HE21 GLN 461 -12.041 1.875 8.112
231 HE22 GLN 461 HE22 GLN 461 -13.216 0.612 7.958
232 H GLU 462 HN GLU 462 -7.835 3.790 5.156
233 HA GLU 462 HA GLU 462 -9.303 6.190 5.599
234 HB2 GLU 462 HB2 GLU 462 -7.317 7.100 6.539
235 HB3 GLU 462 HB1 GLU 462 -7.324 5.401 6.980
236 HG2 GLU 462 HG2 GLU 462 -5.190 5.478 6.316
237 HG3 GLU 462 HG1 GLU 462 -5.878 5.310 4.701
238 H LEU 463 HN LEU 463 -7.332 4.917 3.083
239 HA LEU 463 HA LEU 463 -7.483 7.347 1.496
240 HB2 LEU 463 HB2 LEU 463 -5.508 5.864 1.318
241 HB3 LEU 463 HB1 LEU 463 -6.545 4.555 0.785
242 HG LEU 463 HG LEU 463 -7.164 6.015 -1.195
243 HD11 LEU 463 HD11 LEU 463 -6.435 8.147 -0.272
244 HD12 LEU 463 HD12 LEU 463 -5.609 7.793 -1.788
245 HD13 LEU 463 HD13 LEU 463 -4.766 7.578 -0.254
246 HD21 LEU 463 HD21 LEU 463 -5.079 5.476 -2.404
247 HD22 LEU 463 HD22 LEU 463 -5.678 4.131 -1.434
248 HD23 LEU 463 HD23 LEU 463 -4.316 5.090 -0.863
249 H LYS 464 HN LYS 464 -8.298 3.994 0.724
250 HA LYS 464 HA LYS 464 -11.036 4.118 0.747
251 HB2 LYS 464 HB2 LYS 464 -10.619 5.842 -1.117
252 HB3 LYS 464 HB1 LYS 464 -10.131 4.472 -2.108
253 HG2 LYS 464 HG2 LYS 464 -12.500 5.160 -2.416
254 HG3 LYS 464 HG1 LYS 464 -12.302 3.476 -1.915
255 HD2 LYS 464 HD2 LYS 464 -12.732 4.154 0.418
256 HD3 LYS 464 HD1 LYS 464 -12.997 5.807 -0.129
257 HE2 LYS 464 HE2 LYS 464 -14.923 5.140 -1.394
258 HE3 LYS 464 HE1 LYS 464 -14.607 3.437 -1.062
259 HZ1 LYS 464 HZ1 LYS 464 -15.208 5.462 1.026
260 HZ2 LYS 464 HZ2 LYS 464 -15.066 3.787 1.246
261 HZ3 LYS 464 HZ3 LYS 464 -16.363 4.417 0.351
Start of MODEL 10
1 H SER 433 HT1 SER 433 1.015 10.874 -5.119
2 HA SER 433 HA SER 433 -0.310 9.559 -3.592
3 HB2 SER 433 HB2 SER 433 1.904 7.960 -4.904
4 HB3 SER 433 HB1 SER 433 0.277 7.391 -4.531
5 HG SER 433 HG SER 433 0.293 7.967 -6.672
6 H GLU 434 HN GLU 434 -0.392 9.160 -1.482
7 HA GLU 434 HA GLU 434 2.091 8.709 -0.031
8 HB2 GLU 434 HB2 GLU 434 0.734 8.977 1.992
9 HB3 GLU 434 HB1 GLU 434 0.534 10.329 0.891
10 HG2 GLU 434 HG2 GLU 434 -1.413 8.059 0.880
11 HG3 GLU 434 HG1 GLU 434 -1.525 9.339 2.083
12 H TRP 435 HN TRP 435 -0.291 6.856 -1.466
13 HA TRP 435 HA TRP 435 0.518 4.510 0.126
14 HB2 TRP 435 HB2 TRP 435 -2.050 4.663 -1.470
15 HB3 TRP 435 HB1 TRP 435 -1.609 3.495 -0.229
16 HD1 TRP 435 HD1 TRP 435 -3.528 6.606 -0.712
17 HE1 TRP 435 HE1 TRP 435 -4.175 7.651 1.556
18 HE3 TRP 435 HE3 TRP 435 -0.645 3.735 2.365
19 HZ2 TRP 435 HZ2 TRP 435 -3.549 7.309 4.279
20 HZ3 TRP 435 HZ3 TRP 435 -0.728 4.147 4.784
21 HH2 TRP 435 HH2 TRP 435 -2.126 5.916 5.721
22 H THR 436 HN THR 436 1.887 3.288 -1.016
23 HA THR 436 HA THR 436 1.851 3.437 -3.919
24 HB THR 436 HB THR 436 3.702 1.970 -2.025
25 HG1 THR 436 HG1 THR 436 4.227 4.109 -2.015
26 HG21 THR 436 HG21 THR 436 3.519 0.680 -4.087
27 HG22 THR 436 HG22 THR 436 5.085 1.493 -4.026
28 HG23 THR 436 HG23 THR 436 3.800 2.134 -5.049
29 H GLU 437 HN GLU 437 0.020 2.391 -4.552
30 HA GLU 437 HA GLU 437 -0.359 -0.380 -3.759
31 HB2 GLU 437 HB2 GLU 437 -2.364 1.017 -4.026
32 HB3 GLU 437 HB1 GLU 437 -1.925 1.345 -5.697
33 HG2 GLU 437 HG2 GLU 437 -2.141 -1.075 -6.182
34 HG3 GLU 437 HG1 GLU 437 -2.702 -1.321 -4.529
35 H ARG 438 HN ARG 438 1.458 -1.359 -4.586
36 HA ARG 438 HA ARG 438 1.612 -1.383 -7.525
37 HB2 ARG 438 HB2 ARG 438 3.648 -0.439 -6.566
38 HB3 ARG 438 HB1 ARG 438 3.834 -1.845 -5.524
39 HG2 ARG 438 HG2 ARG 438 4.140 -3.264 -7.499
40 HG3 ARG 438 HG1 ARG 438 3.975 -1.845 -8.535
41 HD2 ARG 438 HD2 ARG 438 5.972 -0.893 -7.693
42 HD3 ARG 438 HD1 ARG 438 6.061 -2.069 -6.383
43 HE ARG 438 HE ARG 438 6.381 -2.833 -9.222
44 HH11 ARG 438 HH11 ARG 438 7.437 -2.853 -5.886
45 HH12 ARG 438 HH12 ARG 438 8.707 -4.020 -6.148
46 HH21 ARG 438 HH21 ARG 438 8.051 -4.379 -9.588
47 HH22 ARG 438 HH22 ARG 438 9.039 -4.894 -8.253
48 H LYS 439 HN LYS 439 1.039 -3.187 -8.432
49 HA LYS 439 HA LYS 439 0.728 -5.565 -6.804
50 HB2 LYS 439 HB2 LYS 439 -0.488 -6.511 -8.710
51 HB3 LYS 439 HB1 LYS 439 -1.147 -4.950 -8.257
52 HG2 LYS 439 HG2 LYS 439 0.809 -5.279 -10.513
53 HG3 LYS 439 HG1 LYS 439 -0.935 -5.429 -10.730
54 HD2 LYS 439 HD2 LYS 439 -1.279 -3.170 -10.016
55 HD3 LYS 439 HD1 LYS 439 0.418 -3.006 -9.553
56 HE2 LYS 439 HE2 LYS 439 1.068 -3.300 -11.903
57 HE3 LYS 439 HE1 LYS 439 -0.634 -3.428 -12.351
58 HZ1 LYS 439 HZ1 LYS 439 0.371 -1.185 -12.678
59 HZ2 LYS 439 HZ2 LYS 439 0.521 -1.057 -10.991
60 HZ3 LYS 439 HZ3 LYS 439 -1.013 -1.200 -11.698
61 H THR 440 HN THR 440 2.302 -6.920 -6.631
62 HA THR 440 HA THR 440 4.394 -7.065 -8.639
63 HB THR 440 HB THR 440 5.405 -8.743 -7.063
64 HG1 THR 440 HG1 THR 440 3.378 -7.888 -5.255
65 HG21 THR 440 HG21 THR 440 6.026 -6.373 -6.984
66 HG22 THR 440 HG22 THR 440 6.037 -7.091 -5.373
67 HG23 THR 440 HG23 THR 440 4.696 -6.059 -5.870
68 H ALA 441 HN ALA 441 5.004 -9.037 -9.677
69 HA ALA 441 HA ALA 441 2.765 -10.278 -10.887
70 HB1 ALA 441 HB1 ALA 441 5.669 -11.064 -11.078
71 HB2 ALA 441 HB2 ALA 441 4.877 -9.827 -12.055
72 HB3 ALA 441 HB3 ALA 441 4.382 -11.514 -12.197
73 H ASP 442 HN ASP 442 4.052 -10.933 -7.934
74 HA ASP 442 HA ASP 442 3.673 -13.814 -8.017
75 HB2 ASP 442 HB2 ASP 442 5.461 -12.684 -6.621
76 HB3 ASP 442 HB1 ASP 442 4.168 -12.076 -5.592
77 H GLY 443 HN GLY 443 1.740 -11.157 -7.872
78 HA2 GLY 443 HA2 GLY 443 -0.597 -11.194 -7.669
79 HA3 GLY 443 HA1 GLY 443 -0.476 -12.723 -6.809
80 H LYS 444 HN LYS 444 1.441 -9.914 -5.995
81 HA LYS 444 HA LYS 444 -0.116 -9.675 -3.498
82 HB2 LYS 444 HB2 LYS 444 2.847 -9.187 -3.853
83 HB3 LYS 444 HB1 LYS 444 1.949 -9.013 -2.354
84 HG2 LYS 444 HG2 LYS 444 1.456 -11.443 -2.433
85 HG3 LYS 444 HG1 LYS 444 2.503 -11.562 -3.852
86 HD2 LYS 444 HD2 LYS 444 4.337 -10.559 -2.466
87 HD3 LYS 444 HD1 LYS 444 3.279 -10.710 -1.064
88 HE2 LYS 444 HE2 LYS 444 4.309 -12.949 -2.800
89 HE3 LYS 444 HE1 LYS 444 4.819 -12.576 -1.156
90 HZ1 LYS 444 HZ1 LYS 444 2.483 -13.019 -0.464
91 HZ2 LYS 444 HZ2 LYS 444 3.308 -14.376 -1.058
92 HZ3 LYS 444 HZ3 LYS 444 2.171 -13.586 -2.036
93 H THR 445 HN THR 445 -1.262 -7.834 -3.576
94 HA THR 445 HA THR 445 -0.088 -5.433 -4.734
95 HB THR 445 HB THR 445 -2.239 -4.381 -3.762
96 HG1 THR 445 HG1 THR 445 -2.683 -6.251 -2.420
97 HG21 THR 445 HG21 THR 445 -3.575 -5.123 -5.669
98 HG22 THR 445 HG22 THR 445 -2.462 -6.467 -5.941
99 HG23 THR 445 HG23 THR 445 -1.909 -4.806 -6.154
100 H TYR 446 HN TYR 446 1.631 -4.921 -3.393
101 HA TYR 446 HA TYR 446 1.088 -4.717 -0.547
102 HB2 TYR 446 HB2 TYR 446 3.388 -4.318 -0.202
103 HB3 TYR 446 HB1 TYR 446 3.270 -5.626 -1.352
104 HD1 TYR 446 HD1 TYR 446 3.843 -5.178 -3.769
105 HD2 TYR 446 HD2 TYR 446 4.496 -2.311 -0.694
106 HE1 TYR 446 HE1 TYR 446 5.443 -3.990 -5.214
107 HE2 TYR 446 HE2 TYR 446 6.090 -1.115 -2.129
108 HH TYR 446 HH TYR 446 7.517 -1.523 -4.028
109 H TYR 447 HN TYR 447 0.952 -2.884 0.571
110 HA TYR 447 HA TYR 447 1.056 -0.417 -0.997
111 HB2 TYR 447 HB2 TYR 447 -0.510 -1.051 1.511
112 HB3 TYR 447 HB1 TYR 447 -0.385 0.554 0.807
113 HD1 TYR 447 HD2 TYR 447 -1.431 -2.930 -0.110
114 HD2 TYR 447 HD1 TYR 447 -1.988 1.251 -0.701
115 HE1 TYR 447 HE2 TYR 447 -3.392 -3.398 -1.510
116 HE2 TYR 447 HE1 TYR 447 -3.955 0.792 -2.104
117 HH TYR 447 HH TYR 447 -4.840 -1.108 -3.499
118 H TYR 448 HN TYR 448 3.195 0.072 -0.767
119 HA TYR 448 HA TYR 448 4.258 0.468 1.893
120 HB2 TYR 448 HB2 TYR 448 5.900 -0.146 0.311
121 HB3 TYR 448 HB1 TYR 448 5.284 0.974 -0.895
122 HD1 TYR 448 HD1 TYR 448 6.492 1.329 2.648
123 HD2 TYR 448 HD2 TYR 448 6.791 2.615 -1.398
124 HE1 TYR 448 HE1 TYR 448 8.196 2.985 3.304
125 HE2 TYR 448 HE2 TYR 448 8.491 4.266 -0.757
126 HH TYR 448 HH TYR 448 10.090 4.208 2.183
127 H ASN 449 HN ASN 449 3.695 2.070 3.060
128 HA ASN 449 HA ASN 449 2.292 4.351 1.946
129 HB2 ASN 449 HB2 ASN 449 1.080 3.544 3.714
130 HB3 ASN 449 HB1 ASN 449 2.511 3.013 4.593
131 HD21 ASN 449 HD21 ASN 449 0.576 5.775 3.715
132 HD22 ASN 449 HD22 ASN 449 1.023 6.750 5.065
133 H ASN 450 HN ASN 450 2.974 6.383 1.939
134 HA ASN 450 HA ASN 450 5.714 6.893 2.839
135 HB2 ASN 450 HB2 ASN 450 4.720 7.358 0.440
136 HB3 ASN 450 HB1 ASN 450 4.120 8.827 1.196
137 HD21 ASN 450 HD21 ASN 450 6.399 9.201 2.949
138 HD22 ASN 450 HD22 ASN 450 7.719 9.683 1.936
139 H ARG 451 HN ARG 451 2.578 7.342 3.938
140 HA ARG 451 HA ARG 451 2.751 9.940 5.038
141 HB2 ARG 451 HB2 ARG 451 1.070 7.582 5.809
142 HB3 ARG 451 HB1 ARG 451 0.991 9.116 6.666
143 HG2 ARG 451 HG2 ARG 451 0.443 8.726 3.730
144 HG3 ARG 451 HG1 ARG 451 -0.777 8.907 4.993
145 HD2 ARG 451 HD2 ARG 451 0.027 11.130 5.502
146 HD3 ARG 451 HD1 ARG 451 1.339 10.954 4.338
147 HE ARG 451 HE ARG 451 -1.260 10.616 3.174
148 HH11 ARG 451 HH11 ARG 451 1.177 12.949 4.116
149 HH12 ARG 451 HH12 ARG 451 0.609 14.169 3.011
150 HH21 ARG 451 HH21 ARG 451 -1.940 12.165 1.648
151 HH22 ARG 451 HH22 ARG 451 -1.134 13.709 1.576
152 H THR 452 HN THR 452 3.262 6.752 6.509
153 HA THR 452 HA THR 452 4.860 8.074 8.605
154 HB THR 452 HB THR 452 3.589 5.426 9.115
155 HG1 THR 452 HG1 THR 452 1.644 6.207 8.923
156 HG21 THR 452 HG21 THR 452 3.429 6.323 11.382
157 HG22 THR 452 HG22 THR 452 4.033 7.881 10.816
158 HG23 THR 452 HG23 THR 452 5.078 6.461 10.769
159 H LEU 453 HN LEU 453 5.160 6.256 5.914
160 HA LEU 453 HA LEU 453 6.791 4.922 5.040
161 HB2 LEU 453 HB2 LEU 453 8.052 5.732 7.615
162 HB3 LEU 453 HB1 LEU 453 8.720 4.333 6.802
163 HG LEU 453 HG LEU 453 9.767 6.673 6.370
164 HD11 LEU 453 HD11 LEU 453 10.098 4.442 5.117
165 HD12 LEU 453 HD12 LEU 453 10.577 5.940 4.321
166 HD13 LEU 453 HD13 LEU 453 9.059 5.161 3.885
167 HD21 LEU 453 HD21 LEU 453 8.784 7.919 4.551
168 HD22 LEU 453 HD22 LEU 453 7.612 7.781 5.864
169 HD23 LEU 453 HD23 LEU 453 7.461 6.759 4.432
170 H GLU 454 HN GLU 454 4.492 3.867 5.992
171 HA GLU 454 HA GLU 454 5.181 1.524 7.633
172 HB2 GLU 454 HB2 GLU 454 2.478 2.649 6.859
173 HB3 GLU 454 HB1 GLU 454 2.743 1.276 7.923
174 HG2 GLU 454 HG2 GLU 454 3.891 2.729 9.510
175 HG3 GLU 454 HG1 GLU 454 3.618 4.104 8.443
176 H SER 455 HN SER 455 5.409 -0.407 6.682
177 HA SER 455 HA SER 455 4.435 -0.753 3.952
178 HB2 SER 455 HB2 SER 455 6.749 -1.468 4.533
179 HB3 SER 455 HB1 SER 455 6.080 -2.635 5.671
180 HG SER 455 HG SER 455 6.274 -2.743 2.935
181 H THR 456 HN THR 456 2.405 -1.451 3.700
182 HA THR 456 HA THR 456 1.374 -3.397 5.630
183 HB THR 456 HB THR 456 0.484 -1.259 6.381
184 HG1 THR 456 HG1 THR 456 -0.891 -3.265 6.197
185 HG21 THR 456 HG21 THR 456 -0.907 0.155 5.011
186 HG22 THR 456 HG22 THR 456 -0.776 -0.967 3.656
187 HG23 THR 456 HG23 THR 456 0.644 -0.073 4.199
188 H TRP 457 HN TRP 457 0.240 -5.005 4.756
189 HA TRP 457 HA TRP 457 0.087 -4.946 1.824
190 HB2 TRP 457 HB2 TRP 457 0.805 -7.201 3.724
191 HB3 TRP 457 HB1 TRP 457 0.569 -7.420 1.983
192 HD1 TRP 457 HD1 TRP 457 2.599 -4.922 4.159
193 HE1 TRP 457 HE1 TRP 457 4.868 -4.505 3.046
194 HE3 TRP 457 HE3 TRP 457 2.149 -8.134 0.194
195 HZ2 TRP 457 HZ2 TRP 457 6.266 -5.369 0.793
196 HZ3 TRP 457 HZ3 TRP 457 4.040 -8.307 -1.378
197 HH2 TRP 457 HH2 TRP 457 6.066 -6.973 -1.075
198 H GLU 458 HN GLU 458 -1.781 -4.310 4.053
199 HA GLU 458 HA GLU 458 -4.101 -5.824 3.051
200 HB2 GLU 458 HB2 GLU 458 -3.873 -4.125 5.556
201 HB3 GLU 458 HB1 GLU 458 -5.286 -5.034 5.055
202 HG2 GLU 458 HG2 GLU 458 -4.258 -6.247 6.799
203 HG3 GLU 458 HG1 GLU 458 -3.926 -7.117 5.302
204 H LYS 459 HN LYS 459 -5.863 -4.554 2.253
205 HA LYS 459 HA LYS 459 -5.026 -2.143 0.982
206 HB2 LYS 459 HB2 LYS 459 -7.801 -3.311 1.209
207 HB3 LYS 459 HB1 LYS 459 -7.310 -2.038 0.102
208 HG2 LYS 459 HG2 LYS 459 -5.730 -3.621 -0.953
209 HG3 LYS 459 HG1 LYS 459 -6.354 -4.890 0.100
210 HD2 LYS 459 HD2 LYS 459 -7.676 -5.262 -1.711
211 HD3 LYS 459 HD1 LYS 459 -8.666 -4.047 -0.904
212 HE2 LYS 459 HE2 LYS 459 -6.697 -3.546 -3.136
213 HE3 LYS 459 HE1 LYS 459 -8.450 -3.577 -3.289
214 HZ1 LYS 459 HZ1 LYS 459 -7.787 -1.327 -3.181
215 HZ2 LYS 459 HZ2 LYS 459 -6.799 -1.594 -1.839
216 HZ3 LYS 459 HZ3 LYS 459 -8.484 -1.677 -1.674
217 HA PRO 460 HA PRO 460 -5.913 0.521 4.519
218 HB2 PRO 460 HB2 PRO 460 -5.322 2.612 2.510
219 HB3 PRO 460 HB1 PRO 460 -4.596 2.337 4.095
220 HG2 PRO 460 HG2 PRO 460 -3.265 1.777 1.850
221 HG3 PRO 460 HG1 PRO 460 -3.114 0.757 3.293
222 HD2 PRO 460 HD2 PRO 460 -4.690 0.287 0.792
223 HD3 PRO 460 HD1 PRO 460 -3.748 -0.859 1.772
224 H GLN 461 HN GLN 461 -7.821 1.254 5.121
225 HA GLN 461 HA GLN 461 -9.918 1.704 3.182
226 HB2 GLN 461 HB2 GLN 461 -10.363 0.459 5.248
227 HB3 GLN 461 HB1 GLN 461 -9.922 1.869 6.202
228 HG2 GLN 461 HG2 GLN 461 -11.818 3.091 5.246
229 HG3 GLN 461 HG1 GLN 461 -12.263 1.655 4.322
230 HE21 GLN 461 HE21 GLN 461 -11.476 -0.133 6.491
231 HE22 GLN 461 HE22 GLN 461 -12.726 -0.031 7.681
232 H GLU 462 HN GLU 462 -7.653 3.566 4.959
233 HA GLU 462 HA GLU 462 -9.222 6.008 4.777
234 HB2 GLU 462 HB2 GLU 462 -7.228 7.073 5.860
235 HB3 GLU 462 HB1 GLU 462 -7.986 5.800 6.799
236 HG2 GLU 462 HG2 GLU 462 -5.597 5.245 5.080
237 HG3 GLU 462 HG1 GLU 462 -5.431 5.902 6.709
238 H LEU 463 HN LEU 463 -7.711 4.349 2.529
239 HA LEU 463 HA LEU 463 -6.046 6.308 1.298
240 HB2 LEU 463 HB2 LEU 463 -6.110 3.754 0.912
241 HB3 LEU 463 HB1 LEU 463 -7.454 4.079 -0.162
242 HG LEU 463 HG LEU 463 -4.790 5.425 -0.553
243 HD11 LEU 463 HD11 LEU 463 -4.181 3.160 -0.577
244 HD12 LEU 463 HD12 LEU 463 -4.395 3.608 -2.270
245 HD13 LEU 463 HD13 LEU 463 -5.647 2.686 -1.436
246 HD21 LEU 463 HD21 LEU 463 -5.511 5.620 -2.848
247 HD22 LEU 463 HD22 LEU 463 -6.741 6.300 -1.783
248 HD23 LEU 463 HD23 LEU 463 -6.970 4.709 -2.492
249 H LYS 464 HN LYS 464 -9.436 5.669 1.385
250 HA LYS 464 HA LYS 464 -9.946 7.564 -0.788
251 HB2 LYS 464 HB2 LYS 464 -11.122 5.417 -0.927
252 HB3 LYS 464 HB1 LYS 464 -11.813 5.677 0.670
253 HG2 LYS 464 HG2 LYS 464 -12.985 7.670 -0.208
254 HG3 LYS 464 HG1 LYS 464 -12.368 7.286 -1.816
255 HD2 LYS 464 HD2 LYS 464 -13.576 5.224 -1.861
256 HD3 LYS 464 HD1 LYS 464 -14.020 5.381 -0.161
257 HE2 LYS 464 HE2 LYS 464 -14.901 7.214 -2.388
258 HE3 LYS 464 HE1 LYS 464 -15.883 5.945 -1.652
259 HZ1 LYS 464 HZ1 LYS 464 -16.431 8.074 -0.694
260 HZ2 LYS 464 HZ2 LYS 464 -14.810 8.356 -0.283
261 HZ3 LYS 464 HZ3 LYS 464 -15.669 7.112 0.479
Start of MODEL 11
1 H SER 433 HT1 SER 433 0.281 10.622 -4.791
2 HA SER 433 HA SER 433 1.393 8.462 -4.647
3 HB2 SER 433 HB2 SER 433 3.040 10.750 -3.540
4 HB3 SER 433 HB1 SER 433 3.639 9.363 -4.449
5 HG SER 433 HG SER 433 2.897 11.663 -5.416
6 H GLU 434 HN GLU 434 0.191 9.488 -1.786
7 HA GLU 434 HA GLU 434 2.188 8.751 0.073
8 HB2 GLU 434 HB2 GLU 434 -0.789 8.889 0.562
9 HB3 GLU 434 HB1 GLU 434 0.478 8.953 1.776
10 HG2 GLU 434 HG2 GLU 434 -0.162 11.159 1.558
11 HG3 GLU 434 HG1 GLU 434 1.269 11.058 0.533
12 H TRP 435 HN TRP 435 -0.226 6.942 -1.626
13 HA TRP 435 HA TRP 435 0.542 4.562 -0.070
14 HB2 TRP 435 HB2 TRP 435 -2.074 4.897 -1.565
15 HB3 TRP 435 HB1 TRP 435 -1.645 3.624 -0.424
16 HD1 TRP 435 HD1 TRP 435 -3.536 6.750 -0.557
17 HE1 TRP 435 HE1 TRP 435 -3.928 7.721 1.799
18 HE3 TRP 435 HE3 TRP 435 -0.243 3.861 2.063
19 HZ2 TRP 435 HZ2 TRP 435 -2.931 7.337 4.415
20 HZ3 TRP 435 HZ3 TRP 435 -0.009 4.229 4.477
21 HH2 TRP 435 HH2 TRP 435 -1.299 5.953 5.630
22 H THR 436 HN THR 436 2.003 3.491 -1.234
23 HA THR 436 HA THR 436 1.850 3.537 -4.138
24 HB THR 436 HB THR 436 3.905 2.349 -2.264
25 HG1 THR 436 HG1 THR 436 3.941 4.639 -2.498
26 HG21 THR 436 HG21 THR 436 3.739 0.961 -4.286
27 HG22 THR 436 HG22 THR 436 5.251 1.869 -4.264
28 HG23 THR 436 HG23 THR 436 3.922 2.402 -5.290
29 H GLU 437 HN GLU 437 0.184 2.268 -4.742
30 HA GLU 437 HA GLU 437 0.119 -0.496 -3.854
31 HB2 GLU 437 HB2 GLU 437 -1.802 -0.664 -5.493
32 HB3 GLU 437 HB1 GLU 437 -2.052 0.442 -4.150
33 HG2 GLU 437 HG2 GLU 437 -1.796 2.329 -5.505
34 HG3 GLU 437 HG1 GLU 437 -1.041 1.406 -6.800
35 H ARG 438 HN ARG 438 2.073 -1.293 -4.634
36 HA ARG 438 HA ARG 438 2.393 -1.207 -7.548
37 HB2 ARG 438 HB2 ARG 438 4.359 -0.551 -6.187
38 HB3 ARG 438 HB1 ARG 438 4.372 -2.155 -5.467
39 HG2 ARG 438 HG2 ARG 438 4.858 -3.165 -7.597
40 HG3 ARG 438 HG1 ARG 438 4.697 -1.608 -8.409
41 HD2 ARG 438 HD2 ARG 438 6.751 -2.248 -6.295
42 HD3 ARG 438 HD1 ARG 438 7.050 -2.285 -8.032
43 HE ARG 438 HE ARG 438 6.010 0.236 -7.285
44 HH11 ARG 438 HH11 ARG 438 8.938 -1.678 -7.027
45 HH12 ARG 438 HH12 ARG 438 9.990 -0.297 -7.000
46 HH21 ARG 438 HH21 ARG 438 7.386 2.059 -7.245
47 HH22 ARG 438 HH22 ARG 438 9.109 1.828 -7.089
48 H LYS 439 HN LYS 439 1.797 -2.858 -8.711
49 HA LYS 439 HA LYS 439 0.871 -5.243 -7.339
50 HB2 LYS 439 HB2 LYS 439 -0.605 -4.143 -8.972
51 HB3 LYS 439 HB1 LYS 439 0.601 -4.378 -10.227
52 HG2 LYS 439 HG2 LYS 439 -1.057 -6.032 -10.531
53 HG3 LYS 439 HG1 LYS 439 0.364 -6.843 -9.872
54 HD2 LYS 439 HD2 LYS 439 -1.610 -7.684 -8.776
55 HD3 LYS 439 HD1 LYS 439 -0.667 -6.736 -7.626
56 HE2 LYS 439 HE2 LYS 439 -3.053 -6.260 -7.419
57 HE3 LYS 439 HE1 LYS 439 -2.160 -4.837 -7.948
58 HZ1 LYS 439 HZ1 LYS 439 -2.949 -5.107 -10.148
59 HZ2 LYS 439 HZ2 LYS 439 -4.299 -5.264 -9.131
60 HZ3 LYS 439 HZ3 LYS 439 -3.586 -6.642 -9.817
61 H THR 440 HN THR 440 2.496 -6.602 -6.920
62 HA THR 440 HA THR 440 4.506 -7.152 -8.944
63 HB THR 440 HB THR 440 5.530 -8.643 -7.300
64 HG1 THR 440 HG1 THR 440 3.315 -7.981 -5.616
65 HG21 THR 440 HG21 THR 440 4.674 -6.017 -6.081
66 HG22 THR 440 HG22 THR 440 6.056 -6.267 -7.148
67 HG23 THR 440 HG23 THR 440 6.035 -7.003 -5.547
68 H ALA 441 HN ALA 441 4.693 -8.998 -10.112
69 HA ALA 441 HA ALA 441 2.265 -10.352 -10.723
70 HB1 ALA 441 HB1 ALA 441 5.057 -10.937 -11.689
71 HB2 ALA 441 HB2 ALA 441 3.931 -9.794 -12.424
72 HB3 ALA 441 HB3 ALA 441 3.557 -11.517 -12.412
73 H ASP 442 HN ASP 442 4.004 -10.811 -8.108
74 HA ASP 442 HA ASP 442 4.035 -13.715 -8.068
75 HB2 ASP 442 HB2 ASP 442 5.773 -12.389 -6.878
76 HB3 ASP 442 HB1 ASP 442 4.524 -11.729 -5.830
77 H GLY 443 HN GLY 443 1.752 -11.381 -7.886
78 HA2 GLY 443 HA2 GLY 443 -0.537 -11.786 -7.600
79 HA3 GLY 443 HA1 GLY 443 -0.144 -13.243 -6.699
80 H LYS 444 HN LYS 444 1.237 -10.071 -6.039
81 HA LYS 444 HA LYS 444 -0.539 -9.736 -3.767
82 HB2 LYS 444 HB2 LYS 444 1.306 -9.524 -2.144
83 HB3 LYS 444 HB1 LYS 444 1.172 -11.144 -2.804
84 HG2 LYS 444 HG2 LYS 444 3.064 -10.691 -4.291
85 HG3 LYS 444 HG1 LYS 444 3.198 -9.066 -3.615
86 HD2 LYS 444 HD2 LYS 444 3.502 -10.134 -1.362
87 HD3 LYS 444 HD1 LYS 444 3.594 -11.688 -2.185
88 HE2 LYS 444 HE2 LYS 444 5.441 -9.344 -2.623
89 HE3 LYS 444 HE1 LYS 444 5.813 -10.788 -1.685
90 HZ1 LYS 444 HZ1 LYS 444 5.382 -10.590 -4.607
91 HZ2 LYS 444 HZ2 LYS 444 5.403 -12.073 -3.785
92 HZ3 LYS 444 HZ3 LYS 444 6.784 -11.083 -3.794
93 H THR 445 HN THR 445 -1.093 -7.715 -3.565
94 HA THR 445 HA THR 445 0.537 -5.612 -4.800
95 HB THR 445 HB THR 445 -2.105 -5.105 -3.473
96 HG1 THR 445 HG1 THR 445 -2.625 -6.860 -4.730
97 HG21 THR 445 HG21 THR 445 -2.333 -3.495 -5.324
98 HG22 THR 445 HG22 THR 445 -0.773 -4.022 -5.962
99 HG23 THR 445 HG23 THR 445 -0.859 -3.222 -4.395
100 H TYR 446 HN TYR 446 2.013 -4.669 -3.463
101 HA TYR 446 HA TYR 446 1.350 -4.586 -0.615
102 HB2 TYR 446 HB2 TYR 446 3.622 -4.196 -0.124
103 HB3 TYR 446 HB1 TYR 446 3.585 -5.480 -1.307
104 HD1 TYR 446 HD1 TYR 446 4.337 -5.000 -3.663
105 HD2 TYR 446 HD2 TYR 446 4.716 -2.154 -0.522
106 HE1 TYR 446 HE1 TYR 446 6.016 -3.771 -4.978
107 HE2 TYR 446 HE2 TYR 446 6.382 -0.916 -1.831
108 HH TYR 446 HH TYR 446 6.908 -1.393 -5.085
109 H TYR 447 HN TYR 447 0.895 -2.793 0.416
110 HA TYR 447 HA TYR 447 1.149 -0.278 -1.045
111 HB2 TYR 447 HB2 TYR 447 -0.490 -1.051 1.359
112 HB3 TYR 447 HB1 TYR 447 -0.294 0.618 0.846
113 HD1 TYR 447 HD2 TYR 447 -1.529 -2.707 -0.317
114 HD2 TYR 447 HD1 TYR 447 -1.686 1.520 -0.796
115 HE1 TYR 447 HE2 TYR 447 -3.425 -2.956 -1.868
116 HE2 TYR 447 HE1 TYR 447 -3.580 1.280 -2.342
117 HH TYR 447 HH TYR 447 -4.568 -0.367 -3.801
118 H TYR 448 HN TYR 448 3.342 -0.004 -0.773
119 HA TYR 448 HA TYR 448 4.358 0.476 1.895
120 HB2 TYR 448 HB2 TYR 448 5.992 -0.375 0.419
121 HB3 TYR 448 HB1 TYR 448 5.506 0.700 -0.885
122 HD1 TYR 448 HD1 TYR 448 6.734 1.086 2.647
123 HD2 TYR 448 HD2 TYR 448 7.037 2.318 -1.417
124 HE1 TYR 448 HE1 TYR 448 8.534 2.654 3.261
125 HE2 TYR 448 HE2 TYR 448 8.834 3.878 -0.817
126 HH TYR 448 HH TYR 448 10.502 3.736 2.047
127 H ASN 449 HN ASN 449 4.243 2.292 2.939
128 HA ASN 449 HA ASN 449 3.118 4.641 1.580
129 HB2 ASN 449 HB2 ASN 449 1.550 3.920 3.136
130 HB3 ASN 449 HB1 ASN 449 2.777 3.460 4.311
131 HD21 ASN 449 HD21 ASN 449 1.358 6.237 2.681
132 HD22 ASN 449 HD22 ASN 449 1.537 7.329 4.014
133 H ASN 450 HN ASN 450 3.919 6.652 1.900
134 HA ASN 450 HA ASN 450 6.553 6.836 3.171
135 HB2 ASN 450 HB2 ASN 450 6.714 8.997 1.877
136 HB3 ASN 450 HB1 ASN 450 6.598 7.545 0.888
137 HD21 ASN 450 HD21 ASN 450 4.962 10.438 1.949
138 HD22 ASN 450 HD22 ASN 450 3.681 10.360 0.786
139 H ARG 451 HN ARG 451 3.379 7.482 3.928
140 HA ARG 451 HA ARG 451 3.560 10.031 5.134
141 HB2 ARG 451 HB2 ARG 451 1.661 7.764 5.527
142 HB3 ARG 451 HB1 ARG 451 1.607 9.174 6.577
143 HG2 ARG 451 HG2 ARG 451 1.393 10.573 4.492
144 HG3 ARG 451 HG1 ARG 451 1.160 9.061 3.609
145 HD2 ARG 451 HD2 ARG 451 -0.746 8.531 5.082
146 HD3 ARG 451 HD1 ARG 451 -0.533 10.086 5.887
147 HE ARG 451 HE ARG 451 -0.806 10.710 3.239
148 HH11 ARG 451 HH11 ARG 451 -2.729 9.122 5.681
149 HH12 ARG 451 HH12 ARG 451 -4.242 9.359 4.852
150 HH21 ARG 451 HH21 ARG 451 -2.790 11.074 2.143
151 HH22 ARG 451 HH22 ARG 451 -4.275 10.494 2.837
152 H THR 452 HN THR 452 3.676 6.803 6.590
153 HA THR 452 HA THR 452 5.220 7.972 8.804
154 HB THR 452 HB THR 452 3.096 7.348 9.693
155 HG1 THR 452 HG1 THR 452 5.134 5.449 10.283
156 HG21 THR 452 HG21 THR 452 2.182 5.081 9.508
157 HG22 THR 452 HG22 THR 452 3.521 4.632 8.451
158 HG23 THR 452 HG23 THR 452 2.352 5.844 7.928
159 H LEU 453 HN LEU 453 5.588 6.189 6.143
160 HA LEU 453 HA LEU 453 7.051 4.648 5.367
161 HB2 LEU 453 HB2 LEU 453 8.374 5.468 7.901
162 HB3 LEU 453 HB1 LEU 453 8.926 3.987 7.152
163 HG LEU 453 HG LEU 453 10.153 6.210 6.617
164 HD11 LEU 453 HD11 LEU 453 10.212 3.874 5.440
165 HD12 LEU 453 HD12 LEU 453 10.945 5.282 4.670
166 HD13 LEU 453 HD13 LEU 453 9.353 4.730 4.162
167 HD21 LEU 453 HD21 LEU 453 9.285 7.499 4.812
168 HD22 LEU 453 HD22 LEU 453 8.021 7.407 6.044
169 HD23 LEU 453 HD23 LEU 453 7.928 6.388 4.601
170 H GLU 454 HN GLU 454 5.112 3.364 5.534
171 HA GLU 454 HA GLU 454 5.425 1.086 7.354
172 HB2 GLU 454 HB2 GLU 454 3.103 2.921 7.059
173 HB3 GLU 454 HB1 GLU 454 2.758 1.211 7.260
174 HG2 GLU 454 HG2 GLU 454 4.619 2.582 9.145
175 HG3 GLU 454 HG1 GLU 454 2.873 2.761 9.331
176 H SER 455 HN SER 455 5.269 -0.798 6.351
177 HA SER 455 HA SER 455 4.100 -0.883 3.668
178 HB2 SER 455 HB2 SER 455 5.068 -3.254 3.701
179 HB3 SER 455 HB1 SER 455 6.237 -1.931 3.711
180 HG SER 455 HG SER 455 5.575 -2.547 6.237
181 H THR 456 HN THR 456 1.996 -1.320 3.578
182 HA THR 456 HA THR 456 0.880 -3.083 5.648
183 HB THR 456 HB THR 456 0.215 -0.816 6.201
184 HG1 THR 456 HG1 THR 456 -1.391 -2.760 6.064
185 HG21 THR 456 HG21 THR 456 0.404 0.272 4.048
186 HG22 THR 456 HG22 THR 456 -1.218 0.512 4.701
187 HG23 THR 456 HG23 THR 456 -0.950 -0.674 3.428
188 H TRP 457 HN TRP 457 -0.336 -4.699 4.953
189 HA TRP 457 HA TRP 457 -0.603 -4.910 2.031
190 HB2 TRP 457 HB2 TRP 457 0.021 -7.064 4.075
191 HB3 TRP 457 HB1 TRP 457 -0.198 -7.349 2.345
192 HD1 TRP 457 HD1 TRP 457 1.995 -4.994 4.527
193 HE1 TRP 457 HE1 TRP 457 4.298 -4.772 3.425
194 HE3 TRP 457 HE3 TRP 457 1.274 -8.077 0.509
195 HZ2 TRP 457 HZ2 TRP 457 5.624 -5.714 1.154
196 HZ3 TRP 457 HZ3 TRP 457 3.139 -8.397 -1.065
197 HH2 TRP 457 HH2 TRP 457 5.279 -7.257 -0.739
198 H GLU 458 HN GLU 458 -2.289 -4.500 4.767
199 HA GLU 458 HA GLU 458 -4.731 -5.613 3.603
200 HB2 GLU 458 HB2 GLU 458 -5.793 -4.745 5.718
201 HB3 GLU 458 HB1 GLU 458 -4.608 -6.016 5.966
202 HG2 GLU 458 HG2 GLU 458 -3.811 -3.147 6.197
203 HG3 GLU 458 HG1 GLU 458 -4.635 -3.955 7.528
204 H LYS 459 HN LYS 459 -6.218 -4.284 2.661
205 HA LYS 459 HA LYS 459 -5.202 -1.951 1.475
206 HB2 LYS 459 HB2 LYS 459 -8.082 -2.839 1.670
207 HB3 LYS 459 HB1 LYS 459 -7.448 -1.649 0.542
208 HG2 LYS 459 HG2 LYS 459 -5.997 -3.416 -0.418
209 HG3 LYS 459 HG1 LYS 459 -6.801 -4.584 0.633
210 HD2 LYS 459 HD2 LYS 459 -8.970 -3.923 -0.391
211 HD3 LYS 459 HD1 LYS 459 -8.078 -2.893 -1.512
212 HE2 LYS 459 HE2 LYS 459 -6.866 -4.867 -2.333
213 HE3 LYS 459 HE1 LYS 459 -7.804 -5.886 -1.241
214 HZ1 LYS 459 HZ1 LYS 459 -8.846 -6.015 -3.332
215 HZ2 LYS 459 HZ2 LYS 459 -8.771 -4.339 -3.573
216 HZ3 LYS 459 HZ3 LYS 459 -9.824 -4.977 -2.408
217 HA PRO 460 HA PRO 460 -5.952 1.018 4.771
218 HB2 PRO 460 HB2 PRO 460 -5.370 2.923 2.580
219 HB3 PRO 460 HB1 PRO 460 -4.611 2.769 4.169
220 HG2 PRO 460 HG2 PRO 460 -3.349 1.991 1.946
221 HG3 PRO 460 HG1 PRO 460 -3.175 1.102 3.469
222 HD2 PRO 460 HD2 PRO 460 -4.808 0.426 1.054
223 HD3 PRO 460 HD1 PRO 460 -3.875 -0.638 2.126
224 H GLN 461 HN GLN 461 -7.963 1.513 5.300
225 HA GLN 461 HA GLN 461 -9.975 1.831 3.239
226 HB2 GLN 461 HB2 GLN 461 -10.178 1.752 6.252
227 HB3 GLN 461 HB1 GLN 461 -11.559 1.854 5.169
228 HG2 GLN 461 HG2 GLN 461 -10.974 -0.293 4.190
229 HG3 GLN 461 HG1 GLN 461 -9.557 -0.394 5.236
230 HE21 GLN 461 HE21 GLN 461 -13.017 -0.591 5.059
231 HE22 GLN 461 HE22 GLN 461 -13.264 -1.289 6.620
232 H GLU 462 HN GLU 462 -7.899 3.941 4.691
233 HA GLU 462 HA GLU 462 -9.743 6.106 5.130
234 HB2 GLU 462 HB2 GLU 462 -7.849 7.422 5.741
235 HB3 GLU 462 HB1 GLU 462 -7.623 5.823 6.426
236 HG2 GLU 462 HG2 GLU 462 -5.537 6.132 5.625
237 HG3 GLU 462 HG1 GLU 462 -6.269 5.482 4.158
238 H LEU 463 HN LEU 463 -8.309 4.736 2.440
239 HA LEU 463 HA LEU 463 -8.088 7.137 0.850
240 HB2 LEU 463 HB2 LEU 463 -6.625 5.146 0.527
241 HB3 LEU 463 HB1 LEU 463 -8.027 4.238 0.000
242 HG LEU 463 HG LEU 463 -8.284 5.813 -1.911
243 HD11 LEU 463 HD11 LEU 463 -6.414 7.285 -2.476
244 HD12 LEU 463 HD12 LEU 463 -5.632 6.879 -0.947
245 HD13 LEU 463 HD13 LEU 463 -7.167 7.748 -0.949
246 HD21 LEU 463 HD21 LEU 463 -6.398 4.933 -3.198
247 HD22 LEU 463 HD22 LEU 463 -7.135 3.684 -2.194
248 HD23 LEU 463 HD23 LEU 463 -5.613 4.426 -1.701
249 H LYS 464 HN LYS 464 -10.591 5.309 1.957
250 HA LYS 464 HA LYS 464 -12.814 5.212 1.532
251 HB2 LYS 464 HB2 LYS 464 -12.514 7.673 1.124
252 HB3 LYS 464 HB1 LYS 464 -12.321 7.309 -0.585
253 HG2 LYS 464 HG2 LYS 464 -14.616 6.143 -0.351
254 HG3 LYS 464 HG1 LYS 464 -14.758 7.094 1.128
255 HD2 LYS 464 HD2 LYS 464 -15.704 8.544 -0.370
256 HD3 LYS 464 HD1 LYS 464 -14.020 9.057 -0.468
257 HE2 LYS 464 HE2 LYS 464 -15.430 7.173 -2.354
258 HE3 LYS 464 HE1 LYS 464 -14.995 8.844 -2.691
259 HZ1 LYS 464 HZ1 LYS 464 -13.086 6.616 -2.174
260 HZ2 LYS 464 HZ2 LYS 464 -12.659 8.232 -2.481
261 HZ3 LYS 464 HZ3 LYS 464 -13.429 7.314 -3.683
Start of MODEL 12
1 H SER 433 HT1 SER 433 -1.520 10.583 -4.277
2 HA SER 433 HA SER 433 0.358 9.168 -4.784
3 HB2 SER 433 HB2 SER 433 1.192 11.857 -3.665
4 HB3 SER 433 HB1 SER 433 1.995 10.953 -4.951
5 HG SER 433 HG SER 433 0.747 12.154 -6.171
6 H GLU 434 HN GLU 434 -0.322 9.268 -1.614
7 HA GLU 434 HA GLU 434 2.413 8.769 -0.700
8 HB2 GLU 434 HB2 GLU 434 1.517 8.988 1.570
9 HB3 GLU 434 HB1 GLU 434 1.153 10.402 0.594
10 HG2 GLU 434 HG2 GLU 434 -0.825 8.180 0.981
11 HG3 GLU 434 HG1 GLU 434 -0.677 9.515 2.120
12 H TRP 435 HN TRP 435 -0.375 7.086 -1.634
13 HA TRP 435 HA TRP 435 0.496 4.702 -0.138
14 HB2 TRP 435 HB2 TRP 435 -2.162 5.023 -1.550
15 HB3 TRP 435 HB1 TRP 435 -1.706 3.791 -0.378
16 HD1 TRP 435 HD1 TRP 435 -3.306 7.124 -0.649
17 HE1 TRP 435 HE1 TRP 435 -3.786 8.108 1.686
18 HE3 TRP 435 HE3 TRP 435 -0.680 3.787 2.172
19 HZ2 TRP 435 HZ2 TRP 435 -3.141 7.529 4.355
20 HZ3 TRP 435 HZ3 TRP 435 -0.660 4.077 4.614
21 HH2 TRP 435 HH2 TRP 435 -1.855 5.917 5.680
22 H THR 436 HN THR 436 1.951 3.675 -1.380
23 HA THR 436 HA THR 436 1.492 3.430 -4.244
24 HB THR 436 HB THR 436 3.769 2.406 -2.531
25 HG1 THR 436 HG1 THR 436 3.436 4.686 -4.190
26 HG21 THR 436 HG21 THR 436 3.439 0.984 -4.509
27 HG22 THR 436 HG22 THR 436 4.915 1.941 -4.659
28 HG23 THR 436 HG23 THR 436 3.467 2.411 -5.547
29 H GLU 437 HN GLU 437 -0.205 2.012 -4.528
30 HA GLU 437 HA GLU 437 0.114 -0.641 -3.376
31 HB2 GLU 437 HB2 GLU 437 -2.047 -1.082 -4.746
32 HB3 GLU 437 HB1 GLU 437 -2.137 -0.128 -3.277
33 HG2 GLU 437 HG2 GLU 437 -3.381 1.204 -4.597
34 HG3 GLU 437 HG1 GLU 437 -1.801 1.854 -5.021
35 H ARG 438 HN ARG 438 1.907 -1.412 -4.344
36 HA ARG 438 HA ARG 438 2.091 -1.291 -7.246
37 HB2 ARG 438 HB2 ARG 438 4.107 -0.766 -5.999
38 HB3 ARG 438 HB1 ARG 438 4.031 -2.316 -5.167
39 HG2 ARG 438 HG2 ARG 438 4.455 -3.494 -7.223
40 HG3 ARG 438 HG1 ARG 438 4.395 -1.986 -8.140
41 HD2 ARG 438 HD2 ARG 438 6.380 -1.191 -7.120
42 HD3 ARG 438 HD1 ARG 438 6.358 -2.479 -5.917
43 HE ARG 438 HE ARG 438 6.503 -3.672 -8.434
44 HH11 ARG 438 HH11 ARG 438 8.444 -1.604 -6.388
45 HH12 ARG 438 HH12 ARG 438 9.955 -2.217 -6.995
46 HH21 ARG 438 HH21 ARG 438 8.481 -4.491 -9.221
47 HH22 ARG 438 HH22 ARG 438 9.977 -3.846 -8.611
48 H LYS 439 HN LYS 439 1.566 -2.878 -8.533
49 HA LYS 439 HA LYS 439 0.682 -5.387 -7.363
50 HB2 LYS 439 HB2 LYS 439 -0.716 -4.180 -9.050
51 HB3 LYS 439 HB1 LYS 439 0.543 -4.467 -10.243
52 HG2 LYS 439 HG2 LYS 439 -1.144 -6.093 -10.586
53 HG3 LYS 439 HG1 LYS 439 0.227 -6.922 -9.846
54 HD2 LYS 439 HD2 LYS 439 -0.848 -6.913 -7.704
55 HD3 LYS 439 HD1 LYS 439 -2.156 -5.894 -8.310
56 HE2 LYS 439 HE2 LYS 439 -2.669 -7.768 -9.936
57 HE3 LYS 439 HE1 LYS 439 -1.561 -8.764 -8.990
58 HZ1 LYS 439 HZ1 LYS 439 -3.759 -9.145 -8.200
59 HZ2 LYS 439 HZ2 LYS 439 -4.069 -7.484 -8.055
60 HZ3 LYS 439 HZ3 LYS 439 -2.958 -8.233 -7.018
61 H THR 440 HN THR 440 2.342 -6.679 -6.938
62 HA THR 440 HA THR 440 4.511 -6.985 -8.845
63 HB THR 440 HB THR 440 5.416 -8.629 -7.205
64 HG1 THR 440 HG1 THR 440 3.185 -7.849 -5.597
65 HG21 THR 440 HG21 THR 440 5.941 -6.195 -7.055
66 HG22 THR 440 HG22 THR 440 6.018 -7.031 -5.505
67 HG23 THR 440 HG23 THR 440 4.623 -6.024 -5.895
68 H ALA 441 HN ALA 441 4.942 -8.837 -10.026
69 HA ALA 441 HA ALA 441 2.717 -10.264 -11.003
70 HB1 ALA 441 HB1 ALA 441 4.718 -9.830 -12.339
71 HB2 ALA 441 HB2 ALA 441 4.330 -11.550 -12.297
72 HB3 ALA 441 HB3 ALA 441 5.645 -10.918 -11.305
73 H ASP 442 HN ASP 442 4.588 -10.721 -8.237
74 HA ASP 442 HA ASP 442 4.296 -13.522 -7.888
75 HB2 ASP 442 HB2 ASP 442 5.921 -12.066 -6.656
76 HB3 ASP 442 HB1 ASP 442 4.566 -11.385 -5.764
77 H GLY 443 HN GLY 443 2.043 -11.067 -7.992
78 HA2 GLY 443 HA2 GLY 443 -0.271 -11.396 -7.931
79 HA3 GLY 443 HA1 GLY 443 -0.014 -12.885 -7.036
80 H LYS 444 HN LYS 444 1.293 -9.707 -6.219
81 HA LYS 444 HA LYS 444 -0.564 -9.542 -3.962
82 HB2 LYS 444 HB2 LYS 444 2.446 -9.554 -3.643
83 HB3 LYS 444 HB1 LYS 444 1.303 -9.127 -2.377
84 HG2 LYS 444 HG2 LYS 444 0.377 -11.359 -2.408
85 HG3 LYS 444 HG1 LYS 444 1.427 -11.802 -3.753
86 HD2 LYS 444 HD2 LYS 444 3.389 -11.395 -2.316
87 HD3 LYS 444 HD1 LYS 444 2.306 -11.029 -0.971
88 HE2 LYS 444 HE2 LYS 444 3.153 -13.343 -0.895
89 HE3 LYS 444 HE1 LYS 444 1.397 -13.273 -1.047
90 HZ1 LYS 444 HZ1 LYS 444 1.633 -13.681 -3.422
91 HZ2 LYS 444 HZ2 LYS 444 2.333 -14.932 -2.528
92 HZ3 LYS 444 HZ3 LYS 444 3.317 -13.760 -3.267
93 H THR 445 HN THR 445 -1.355 -7.568 -3.869
94 HA THR 445 HA THR 445 0.142 -5.277 -4.860
95 HB THR 445 HB THR 445 -1.982 -4.125 -3.735
96 HG1 THR 445 HG1 THR 445 -2.980 -5.858 -2.857
97 HG21 THR 445 HG21 THR 445 -3.129 -4.215 -5.849
98 HG22 THR 445 HG22 THR 445 -2.188 -5.622 -6.343
99 HG23 THR 445 HG23 THR 445 -1.395 -4.061 -6.128
100 H TYR 446 HN TYR 446 1.794 -4.766 -3.446
101 HA TYR 446 HA TYR 446 1.067 -4.653 -0.622
102 HB2 TYR 446 HB2 TYR 446 3.356 -4.492 -0.070
103 HB3 TYR 446 HB1 TYR 446 3.202 -5.765 -1.253
104 HD1 TYR 446 HD1 TYR 446 4.021 -5.343 -3.612
105 HD2 TYR 446 HD2 TYR 446 4.719 -2.624 -0.413
106 HE1 TYR 446 HE1 TYR 446 5.865 -4.323 -4.880
107 HE2 TYR 446 HE2 TYR 446 6.555 -1.595 -1.677
108 HH TYR 446 HH TYR 446 8.141 -2.280 -3.485
109 H TYR 447 HN TYR 447 0.695 -2.881 0.400
110 HA TYR 447 HA TYR 447 1.056 -0.371 -1.028
111 HB2 TYR 447 HB2 TYR 447 -0.430 -0.969 1.545
112 HB3 TYR 447 HB1 TYR 447 -0.362 0.598 0.749
113 HD1 TYR 447 HD2 TYR 447 -1.276 -2.939 -0.100
114 HD2 TYR 447 HD1 TYR 447 -2.185 1.196 -0.519
115 HE1 TYR 447 HE2 TYR 447 -3.283 -3.518 -1.396
116 HE2 TYR 447 HE1 TYR 447 -4.206 0.625 -1.798
117 HH TYR 447 HH TYR 447 -4.997 -1.347 -3.236
118 H TYR 448 HN TYR 448 3.241 0.033 -0.787
119 HA TYR 448 HA TYR 448 4.279 0.344 1.885
120 HB2 TYR 448 HB2 TYR 448 5.984 -0.225 0.404
121 HB3 TYR 448 HB1 TYR 448 5.352 0.798 -0.880
122 HD1 TYR 448 HD1 TYR 448 6.608 1.280 2.627
123 HD2 TYR 448 HD2 TYR 448 6.667 2.592 -1.422
124 HE1 TYR 448 HE1 TYR 448 8.197 3.059 3.235
125 HE2 TYR 448 HE2 TYR 448 8.257 4.368 -0.829
126 HH TYR 448 HH TYR 448 8.908 5.653 1.175
127 H ASN 449 HN ASN 449 3.810 1.924 3.085
128 HA ASN 449 HA ASN 449 2.420 4.257 2.067
129 HB2 ASN 449 HB2 ASN 449 1.239 3.393 3.842
130 HB3 ASN 449 HB1 ASN 449 2.689 2.844 4.675
131 HD21 ASN 449 HD21 ASN 449 0.703 5.603 3.935
132 HD22 ASN 449 HD22 ASN 449 1.189 6.556 5.289
133 H ASN 450 HN ASN 450 3.224 6.247 2.014
134 HA ASN 450 HA ASN 450 5.970 6.629 2.959
135 HB2 ASN 450 HB2 ASN 450 4.289 8.229 1.019
136 HB3 ASN 450 HB1 ASN 450 5.928 8.654 1.497
137 HD21 ASN 450 HD21 ASN 450 3.951 6.517 -0.369
138 HD22 ASN 450 HD22 ASN 450 5.234 5.753 -1.238
139 H ARG 451 HN ARG 451 2.917 7.135 4.069
140 HA ARG 451 HA ARG 451 3.170 9.759 5.140
141 HB2 ARG 451 HB2 ARG 451 1.316 7.497 5.789
142 HB3 ARG 451 HB1 ARG 451 1.298 9.005 6.694
143 HG2 ARG 451 HG2 ARG 451 0.885 8.780 3.717
144 HG3 ARG 451 HG1 ARG 451 -0.403 8.931 4.916
145 HD2 ARG 451 HD2 ARG 451 0.415 11.093 5.592
146 HD3 ARG 451 HD1 ARG 451 1.822 10.929 4.543
147 HE ARG 451 HE ARG 451 -0.737 10.801 3.199
148 HH11 ARG 451 HH11 ARG 451 1.901 12.843 4.273
149 HH12 ARG 451 HH12 ARG 451 1.563 14.094 3.112
150 HH21 ARG 451 HH21 ARG 451 -1.144 12.410 1.642
151 HH22 ARG 451 HH22 ARG 451 -0.147 13.843 1.598
152 H THR 452 HN THR 452 3.521 6.528 6.572
153 HA THR 452 HA THR 452 5.091 7.767 8.739
154 HB THR 452 HB THR 452 3.771 5.112 9.105
155 HG1 THR 452 HG1 THR 452 1.848 5.944 9.005
156 HG21 THR 452 HG21 THR 452 3.608 5.917 11.433
157 HG22 THR 452 HG22 THR 452 4.349 7.441 10.942
158 HG23 THR 452 HG23 THR 452 5.267 5.939 10.839
159 H LEU 453 HN LEU 453 5.428 6.032 5.997
160 HA LEU 453 HA LEU 453 7.044 4.686 5.113
161 HB2 LEU 453 HB2 LEU 453 8.271 5.326 7.760
162 HB3 LEU 453 HB1 LEU 453 8.935 3.989 6.848
163 HG LEU 453 HG LEU 453 10.053 6.287 6.604
164 HD11 LEU 453 HD11 LEU 453 10.256 4.220 5.091
165 HD12 LEU 453 HD12 LEU 453 10.766 5.780 4.449
166 HD13 LEU 453 HD13 LEU 453 9.206 5.109 3.985
167 HD21 LEU 453 HD21 LEU 453 9.088 7.774 4.948
168 HD22 LEU 453 HD22 LEU 453 7.979 7.574 6.307
169 HD23 LEU 453 HD23 LEU 453 7.684 6.717 4.790
170 H GLU 454 HN GLU 454 4.665 3.719 6.152
171 HA GLU 454 HA GLU 454 5.254 1.344 7.754
172 HB2 GLU 454 HB2 GLU 454 2.628 2.502 6.796
173 HB3 GLU 454 HB1 GLU 454 2.789 1.105 7.847
174 HG2 GLU 454 HG2 GLU 454 3.785 2.486 9.570
175 HG3 GLU 454 HG1 GLU 454 3.698 3.893 8.509
176 H SER 455 HN SER 455 5.086 -0.736 6.997
177 HA SER 455 HA SER 455 4.402 -1.090 4.187
178 HB2 SER 455 HB2 SER 455 5.109 -3.479 4.627
179 HB3 SER 455 HB1 SER 455 6.378 -2.274 4.852
180 HG SER 455 HG SER 455 5.644 -4.067 6.567
181 H THR 456 HN THR 456 2.348 -1.438 3.671
182 HA THR 456 HA THR 456 0.584 -2.628 5.712
183 HB THR 456 HB THR 456 -1.241 -1.208 4.548
184 HG1 THR 456 HG1 THR 456 0.783 -0.458 3.087
185 HG21 THR 456 HG21 THR 456 -0.785 0.698 6.038
186 HG22 THR 456 HG22 THR 456 0.851 0.087 6.294
187 HG23 THR 456 HG23 THR 456 -0.537 -0.851 6.845
188 H TRP 457 HN TRP 457 -0.233 -4.481 5.097
189 HA TRP 457 HA TRP 457 -0.430 -5.010 2.215
190 HB2 TRP 457 HB2 TRP 457 0.368 -6.898 4.449
191 HB3 TRP 457 HB1 TRP 457 0.089 -7.401 2.778
192 HD1 TRP 457 HD1 TRP 457 2.247 -4.711 4.571
193 HE1 TRP 457 HE1 TRP 457 4.476 -4.488 3.324
194 HE3 TRP 457 HE3 TRP 457 1.514 -8.231 0.922
195 HZ2 TRP 457 HZ2 TRP 457 5.746 -5.589 1.107
196 HZ3 TRP 457 HZ3 TRP 457 3.321 -8.610 -0.711
197 HH2 TRP 457 HH2 TRP 457 5.404 -7.335 -0.610
198 H GLU 458 HN GLU 458 -2.184 -4.366 4.826
199 HA GLU 458 HA GLU 458 -4.534 -5.724 3.696
200 HB2 GLU 458 HB2 GLU 458 -4.186 -4.310 6.355
201 HB3 GLU 458 HB1 GLU 458 -5.701 -4.988 5.773
202 HG2 GLU 458 HG2 GLU 458 -4.653 -7.219 5.744
203 HG3 GLU 458 HG1 GLU 458 -3.184 -6.512 6.416
204 H LYS 459 HN LYS 459 -6.104 -4.446 2.756
205 HA LYS 459 HA LYS 459 -5.161 -2.102 1.552
206 HB2 LYS 459 HB2 LYS 459 -7.984 -3.158 1.713
207 HB3 LYS 459 HB1 LYS 459 -7.444 -1.883 0.628
208 HG2 LYS 459 HG2 LYS 459 -5.872 -3.465 -0.412
209 HG3 LYS 459 HG1 LYS 459 -6.488 -4.738 0.641
210 HD2 LYS 459 HD2 LYS 459 -7.568 -4.975 -1.469
211 HD3 LYS 459 HD1 LYS 459 -8.757 -4.330 -0.339
212 HE2 LYS 459 HE2 LYS 459 -7.162 -2.455 -2.036
213 HE3 LYS 459 HE1 LYS 459 -8.518 -3.328 -2.747
214 HZ1 LYS 459 HZ1 LYS 459 -9.952 -2.399 -1.019
215 HZ2 LYS 459 HZ2 LYS 459 -9.225 -1.184 -1.952
216 HZ3 LYS 459 HZ3 LYS 459 -8.649 -1.513 -0.393
217 HA PRO 460 HA PRO 460 -5.836 0.844 4.840
218 HB2 PRO 460 HB2 PRO 460 -5.435 2.813 2.697
219 HB3 PRO 460 HB1 PRO 460 -4.518 2.569 4.183
220 HG2 PRO 460 HG2 PRO 460 -3.594 1.915 1.712
221 HG3 PRO 460 HG1 PRO 460 -3.073 1.115 3.199
222 HD2 PRO 460 HD2 PRO 460 -4.864 0.147 1.057
223 HD3 PRO 460 HD1 PRO 460 -3.848 -0.768 2.187
224 H GLN 461 HN GLN 461 -7.587 1.946 5.527
225 HA GLN 461 HA GLN 461 -9.836 2.255 3.710
226 HB2 GLN 461 HB2 GLN 461 -10.193 1.358 5.995
227 HB3 GLN 461 HB1 GLN 461 -9.625 2.882 6.665
228 HG2 GLN 461 HG2 GLN 461 -11.490 4.050 5.649
229 HG3 GLN 461 HG1 GLN 461 -12.046 2.551 4.909
230 HE21 GLN 461 HE21 GLN 461 -10.735 2.703 8.150
231 HE22 GLN 461 HE22 GLN 461 -12.227 2.378 8.963
232 H GLU 462 HN GLU 462 -7.214 4.041 4.823
233 HA GLU 462 HA GLU 462 -8.303 6.661 4.775
234 HB2 GLU 462 HB2 GLU 462 -6.131 5.951 5.834
235 HB3 GLU 462 HB1 GLU 462 -5.448 5.830 4.221
236 HG2 GLU 462 HG2 GLU 462 -4.785 7.906 5.189
237 HG3 GLU 462 HG1 GLU 462 -5.924 8.233 3.884
238 H LEU 463 HN LEU 463 -7.781 4.434 2.317
239 HA LEU 463 HA LEU 463 -7.079 6.417 0.298
240 HB2 LEU 463 HB2 LEU 463 -5.877 4.254 0.411
241 HB3 LEU 463 HB1 LEU 463 -7.376 3.425 0.045
242 HG LEU 463 HG LEU 463 -7.445 4.495 -2.161
243 HD11 LEU 463 HD11 LEU 463 -6.310 6.579 -1.615
244 HD12 LEU 463 HD12 LEU 463 -5.522 5.774 -2.971
245 HD13 LEU 463 HD13 LEU 463 -4.799 5.704 -1.363
246 HD21 LEU 463 HD21 LEU 463 -5.589 3.298 -3.161
247 HD22 LEU 463 HD22 LEU 463 -6.303 2.335 -1.866
248 HD23 LEU 463 HD23 LEU 463 -4.783 3.196 -1.594
249 H LYS 464 HN LYS 464 -9.900 5.148 1.600
250 HA LYS 464 HA LYS 464 -11.356 5.192 -0.922
251 HB2 LYS 464 HB2 LYS 464 -13.300 4.441 0.356
252 HB3 LYS 464 HB1 LYS 464 -11.911 3.409 0.669
253 HG2 LYS 464 HG2 LYS 464 -12.050 3.791 2.839
254 HG3 LYS 464 HG1 LYS 464 -11.997 5.537 2.585
255 HD2 LYS 464 HD2 LYS 464 -14.534 5.049 1.848
256 HD3 LYS 464 HD1 LYS 464 -14.307 3.743 3.016
257 HE2 LYS 464 HE2 LYS 464 -15.172 5.644 4.190
258 HE3 LYS 464 HE1 LYS 464 -13.479 5.444 4.646
259 HZ1 LYS 464 HZ1 LYS 464 -13.718 7.716 4.237
260 HZ2 LYS 464 HZ2 LYS 464 -14.676 7.474 2.862
261 HZ3 LYS 464 HZ3 LYS 464 -13.018 7.130 2.802
Start of MODEL 13
1 H SER 433 HT1 SER 433 -0.606 9.756 -3.233
2 HA SER 433 HA SER 433 1.320 8.985 -4.415
3 HB2 SER 433 HB2 SER 433 2.686 11.451 -3.300
4 HB3 SER 433 HB1 SER 433 3.395 10.237 -4.366
5 HG SER 433 HG SER 433 2.328 11.040 -6.044
6 H GLU 434 HN GLU 434 0.056 9.380 -1.542
7 HA GLU 434 HA GLU 434 2.393 8.825 0.105
8 HB2 GLU 434 HB2 GLU 434 -0.480 9.293 0.928
9 HB3 GLU 434 HB1 GLU 434 0.890 9.152 2.018
10 HG2 GLU 434 HG2 GLU 434 0.436 11.447 1.853
11 HG3 GLU 434 HG1 GLU 434 1.858 11.175 0.850
12 H TRP 435 HN TRP 435 0.025 7.111 -1.542
13 HA TRP 435 HA TRP 435 0.530 4.742 0.129
14 HB2 TRP 435 HB2 TRP 435 -2.044 5.301 -1.371
15 HB3 TRP 435 HB1 TRP 435 -1.712 3.916 -0.336
16 HD1 TRP 435 HD1 TRP 435 -3.359 7.185 -0.233
17 HE1 TRP 435 HE1 TRP 435 -3.736 7.969 2.200
18 HE3 TRP 435 HE3 TRP 435 -0.364 3.825 2.170
19 HZ2 TRP 435 HZ2 TRP 435 -2.865 7.259 4.777
20 HZ3 TRP 435 HZ3 TRP 435 -0.175 3.955 4.616
21 HH2 TRP 435 HH2 TRP 435 -1.371 5.659 5.886
22 H THR 436 HN THR 436 2.030 3.695 -1.054
23 HA THR 436 HA THR 436 1.700 3.514 -3.937
24 HB THR 436 HB THR 436 3.867 2.377 -2.155
25 HG1 THR 436 HG1 THR 436 3.568 4.779 -3.590
26 HG21 THR 436 HG21 THR 436 5.099 1.965 -4.245
27 HG22 THR 436 HG22 THR 436 3.704 2.510 -5.174
28 HG23 THR 436 HG23 THR 436 3.595 1.044 -4.196
29 H GLU 437 HN GLU 437 -0.170 2.235 -4.109
30 HA GLU 437 HA GLU 437 0.104 -0.507 -3.198
31 HB2 GLU 437 HB2 GLU 437 -2.075 -0.872 -4.405
32 HB3 GLU 437 HB1 GLU 437 -2.137 0.241 -3.051
33 HG2 GLU 437 HG2 GLU 437 -2.400 2.096 -4.430
34 HG3 GLU 437 HG1 GLU 437 -1.815 1.234 -5.854
35 H ARG 438 HN ARG 438 1.821 -1.289 -4.268
36 HA ARG 438 HA ARG 438 1.778 -1.154 -7.184
37 HB2 ARG 438 HB2 ARG 438 3.903 -0.545 -6.227
38 HB3 ARG 438 HB1 ARG 438 3.947 -2.017 -5.265
39 HG2 ARG 438 HG2 ARG 438 4.309 -3.364 -7.167
40 HG3 ARG 438 HG1 ARG 438 3.901 -2.048 -8.268
41 HD2 ARG 438 HD2 ARG 438 6.256 -2.006 -6.396
42 HD3 ARG 438 HD1 ARG 438 6.342 -2.538 -8.075
43 HE ARG 438 HE ARG 438 5.239 -0.098 -8.320
44 HH11 ARG 438 HH11 ARG 438 8.002 -1.200 -6.481
45 HH12 ARG 438 HH12 ARG 438 8.887 0.288 -6.657
46 HH21 ARG 438 HH21 ARG 438 6.396 1.851 -8.599
47 HH22 ARG 438 HH22 ARG 438 7.981 2.023 -7.897
48 H LYS 439 HN LYS 439 0.835 -2.701 -8.210
49 HA LYS 439 HA LYS 439 0.431 -5.262 -6.922
50 HB2 LYS 439 HB2 LYS 439 -1.054 -5.721 -8.876
51 HB3 LYS 439 HB1 LYS 439 -1.528 -4.324 -7.925
52 HG2 LYS 439 HG2 LYS 439 -0.319 -2.902 -9.620
53 HG3 LYS 439 HG1 LYS 439 -0.192 -4.352 -10.616
54 HD2 LYS 439 HD2 LYS 439 -2.738 -3.058 -9.644
55 HD3 LYS 439 HD1 LYS 439 -2.113 -3.036 -11.293
56 HE2 LYS 439 HE2 LYS 439 -2.310 -5.490 -11.369
57 HE3 LYS 439 HE1 LYS 439 -3.003 -5.467 -9.749
58 HZ1 LYS 439 HZ1 LYS 439 -4.756 -5.589 -11.341
59 HZ2 LYS 439 HZ2 LYS 439 -4.159 -4.254 -12.197
60 HZ3 LYS 439 HZ3 LYS 439 -4.800 -4.046 -10.640
61 H THR 440 HN THR 440 2.206 -6.439 -6.976
62 HA THR 440 HA THR 440 3.804 -6.582 -9.401
63 HB THR 440 HB THR 440 5.104 -6.485 -7.410
64 HG1 THR 440 HG1 THR 440 5.798 -8.953 -7.411
65 HG21 THR 440 HG21 THR 440 3.532 -8.850 -6.385
66 HG22 THR 440 HG22 THR 440 3.405 -7.189 -5.804
67 HG23 THR 440 HG23 THR 440 4.903 -8.089 -5.574
68 H ALA 441 HN ALA 441 4.211 -8.462 -10.566
69 HA ALA 441 HA ALA 441 1.918 -10.062 -11.038
70 HB1 ALA 441 HB1 ALA 441 3.283 -11.168 -12.724
71 HB2 ALA 441 HB2 ALA 441 4.728 -10.398 -12.069
72 HB3 ALA 441 HB3 ALA 441 3.465 -9.416 -12.809
73 H ASP 442 HN ASP 442 4.236 -10.294 -8.688
74 HA ASP 442 HA ASP 442 4.377 -13.133 -8.390
75 HB2 ASP 442 HB2 ASP 442 6.035 -11.582 -7.396
76 HB3 ASP 442 HB1 ASP 442 4.786 -10.938 -6.339
77 H GLY 443 HN GLY 443 1.902 -10.947 -8.109
78 HA2 GLY 443 HA2 GLY 443 -0.329 -11.523 -7.704
79 HA3 GLY 443 HA1 GLY 443 0.217 -12.936 -6.817
80 H LYS 444 HN LYS 444 1.557 -9.794 -6.141
81 HA LYS 444 HA LYS 444 -0.079 -9.701 -3.693
82 HB2 LYS 444 HB2 LYS 444 2.889 -9.188 -3.918
83 HB3 LYS 444 HB1 LYS 444 1.924 -8.828 -2.497
84 HG2 LYS 444 HG2 LYS 444 1.426 -11.156 -2.182
85 HG3 LYS 444 HG1 LYS 444 2.247 -11.572 -3.690
86 HD2 LYS 444 HD2 LYS 444 4.360 -10.770 -2.762
87 HD3 LYS 444 HD1 LYS 444 3.541 -10.325 -1.264
88 HE2 LYS 444 HE2 LYS 444 4.743 -12.471 -1.095
89 HE3 LYS 444 HE1 LYS 444 3.008 -12.634 -0.818
90 HZ1 LYS 444 HZ1 LYS 444 2.707 -13.582 -2.939
91 HZ2 LYS 444 HZ2 LYS 444 4.066 -14.360 -2.285
92 HZ3 LYS 444 HZ3 LYS 444 4.265 -13.149 -3.458
93 H THR 445 HN THR 445 -1.179 -7.854 -3.518
94 HA THR 445 HA THR 445 -0.081 -5.448 -4.773
95 HB THR 445 HB THR 445 -2.697 -5.402 -3.338
96 HG1 THR 445 HG1 THR 445 -3.196 -7.119 -4.585
97 HG21 THR 445 HG21 THR 445 -3.268 -3.810 -5.080
98 HG22 THR 445 HG22 THR 445 -1.763 -4.161 -5.933
99 HG23 THR 445 HG23 THR 445 -1.722 -3.368 -4.357
100 H TYR 446 HN TYR 446 1.573 -4.955 -3.338
101 HA TYR 446 HA TYR 446 0.880 -4.841 -0.522
102 HB2 TYR 446 HB2 TYR 446 3.217 -4.456 -0.073
103 HB3 TYR 446 HB1 TYR 446 3.024 -5.858 -1.098
104 HD1 TYR 446 HD1 TYR 446 3.588 -5.618 -3.580
105 HD2 TYR 446 HD2 TYR 446 4.565 -2.661 -0.680
106 HE1 TYR 446 HE1 TYR 446 5.289 -4.693 -5.098
107 HE2 TYR 446 HE2 TYR 446 6.259 -1.725 -2.189
108 HH TYR 446 HH TYR 446 7.683 -2.600 -4.103
109 H TYR 447 HN TYR 447 0.727 -3.092 0.658
110 HA TYR 447 HA TYR 447 0.849 -0.548 -0.762
111 HB2 TYR 447 HB2 TYR 447 -0.648 -1.434 1.696
112 HB3 TYR 447 HB1 TYR 447 -0.480 0.264 1.267
113 HD1 TYR 447 HD2 TYR 447 -1.551 -2.976 -0.356
114 HD2 TYR 447 HD1 TYR 447 -2.168 1.223 0.064
115 HE1 TYR 447 HE2 TYR 447 -3.516 -3.118 -1.824
116 HE2 TYR 447 HE1 TYR 447 -4.127 1.078 -1.404
117 HH TYR 447 HH TYR 447 -4.971 -0.396 -3.206
118 H TYR 448 HN TYR 448 3.027 -0.165 -0.625
119 HA TYR 448 HA TYR 448 4.212 0.222 1.973
120 HB2 TYR 448 HB2 TYR 448 5.828 -0.383 0.404
121 HB3 TYR 448 HB1 TYR 448 5.095 0.583 -0.870
122 HD1 TYR 448 HD1 TYR 448 6.506 1.302 2.534
123 HD2 TYR 448 HD2 TYR 448 6.439 2.273 -1.608
124 HE1 TYR 448 HE1 TYR 448 8.121 3.107 2.936
125 HE2 TYR 448 HE2 TYR 448 8.059 4.080 -1.219
126 HH TYR 448 HH TYR 448 8.889 5.467 0.523
127 H ASN 449 HN ASN 449 3.974 1.903 3.147
128 HA ASN 449 HA ASN 449 2.478 4.200 2.176
129 HB2 ASN 449 HB2 ASN 449 1.474 3.420 4.095
130 HB3 ASN 449 HB1 ASN 449 2.998 2.910 4.810
131 HD21 ASN 449 HD21 ASN 449 0.953 5.664 4.127
132 HD22 ASN 449 HD22 ASN 449 1.589 6.672 5.377
133 H ASN 450 HN ASN 450 3.221 6.232 2.090
134 HA ASN 450 HA ASN 450 6.046 6.675 2.761
135 HB2 ASN 450 HB2 ASN 450 5.192 7.135 0.434
136 HB3 ASN 450 HB1 ASN 450 4.215 8.432 1.114
137 HD21 ASN 450 HD21 ASN 450 7.480 7.567 2.113
138 HD22 ASN 450 HD22 ASN 450 8.220 9.030 1.578
139 H ARG 451 HN ARG 451 3.056 7.146 4.142
140 HA ARG 451 HA ARG 451 3.375 9.819 5.064
141 HB2 ARG 451 HB2 ARG 451 1.400 7.692 5.660
142 HB3 ARG 451 HB1 ARG 451 1.508 9.098 6.717
143 HG2 ARG 451 HG2 ARG 451 1.071 10.585 4.892
144 HG3 ARG 451 HG1 ARG 451 1.139 9.257 3.734
145 HD2 ARG 451 HD2 ARG 451 -1.158 9.945 4.235
146 HD3 ARG 451 HD1 ARG 451 -0.847 8.274 4.701
147 HE ARG 451 HE ARG 451 -0.391 9.803 6.964
148 HH11 ARG 451 HH11 ARG 451 -3.064 9.209 4.789
149 HH12 ARG 451 HH12 ARG 451 -4.279 9.348 6.018
150 HH21 ARG 451 HH21 ARG 451 -1.961 10.038 8.585
151 HH22 ARG 451 HH22 ARG 451 -3.649 9.867 8.195
152 H THR 452 HN THR 452 3.740 6.669 6.672
153 HA THR 452 HA THR 452 5.328 8.056 8.736
154 HB THR 452 HB THR 452 4.339 5.421 9.503
155 HG1 THR 452 HG1 THR 452 2.282 5.680 9.135
156 HG21 THR 452 HG21 THR 452 3.677 6.649 11.527
157 HG22 THR 452 HG22 THR 452 4.073 8.169 10.725
158 HG23 THR 452 HG23 THR 452 5.344 6.995 11.069
159 H LEU 453 HN LEU 453 5.653 6.227 6.088
160 HA LEU 453 HA LEU 453 7.093 4.694 5.253
161 HB2 LEU 453 HB2 LEU 453 8.620 5.637 7.648
162 HB3 LEU 453 HB1 LEU 453 9.181 4.210 6.806
163 HG LEU 453 HG LEU 453 10.250 6.451 6.180
164 HD11 LEU 453 HD11 LEU 453 10.155 4.218 4.837
165 HD12 LEU 453 HD12 LEU 453 10.733 5.695 4.068
166 HD13 LEU 453 HD13 LEU 453 9.089 5.139 3.774
167 HD21 LEU 453 HD21 LEU 453 9.107 7.836 4.596
168 HD22 LEU 453 HD22 LEU 453 8.087 7.684 6.029
169 HD23 LEU 453 HD23 LEU 453 7.719 6.744 4.577
170 H GLU 454 HN GLU 454 5.235 3.325 5.672
171 HA GLU 454 HA GLU 454 5.861 1.176 7.580
172 HB2 GLU 454 HB2 GLU 454 3.120 2.357 7.076
173 HB3 GLU 454 HB1 GLU 454 3.458 0.960 8.085
174 HG2 GLU 454 HG2 GLU 454 4.757 2.390 9.598
175 HG3 GLU 454 HG1 GLU 454 4.366 3.783 8.589
176 H SER 455 HN SER 455 5.688 -0.832 6.705
177 HA SER 455 HA SER 455 4.509 -1.056 4.051
178 HB2 SER 455 HB2 SER 455 5.382 -3.466 4.276
179 HB3 SER 455 HB1 SER 455 6.586 -2.183 4.171
180 HG SER 455 HG SER 455 7.199 -2.578 6.157
181 H THR 456 HN THR 456 2.400 -1.535 3.866
182 HA THR 456 HA THR 456 1.190 -3.154 5.995
183 HB THR 456 HB THR 456 0.476 -0.928 6.526
184 HG1 THR 456 HG1 THR 456 -1.906 -1.304 5.585
185 HG21 THR 456 HG21 THR 456 -0.692 0.530 4.976
186 HG22 THR 456 HG22 THR 456 -0.525 -0.664 3.692
187 HG23 THR 456 HG23 THR 456 0.906 0.135 4.343
188 H TRP 457 HN TRP 457 -0.048 -4.758 5.317
189 HA TRP 457 HA TRP 457 -0.355 -4.971 2.406
190 HB2 TRP 457 HB2 TRP 457 0.386 -7.108 4.435
191 HB3 TRP 457 HB1 TRP 457 0.053 -7.432 2.728
192 HD1 TRP 457 HD1 TRP 457 2.316 -4.915 4.644
193 HE1 TRP 457 HE1 TRP 457 4.538 -4.691 3.395
194 HE3 TRP 457 HE3 TRP 457 1.479 -8.279 0.874
195 HZ2 TRP 457 HZ2 TRP 457 5.766 -5.726 1.123
196 HZ3 TRP 457 HZ3 TRP 457 3.269 -8.629 -0.785
197 HH2 TRP 457 HH2 TRP 457 5.379 -7.395 -0.654
198 H GLU 458 HN GLU 458 -2.033 -4.163 4.827
199 HA GLU 458 HA GLU 458 -4.459 -5.466 3.798
200 HB2 GLU 458 HB2 GLU 458 -4.048 -4.202 6.521
201 HB3 GLU 458 HB1 GLU 458 -5.541 -4.925 5.934
202 HG2 GLU 458 HG2 GLU 458 -4.265 -7.078 5.684
203 HG3 GLU 458 HG1 GLU 458 -2.947 -6.302 6.559
204 H LYS 459 HN LYS 459 -5.931 -4.125 2.890
205 HA LYS 459 HA LYS 459 -4.962 -1.727 1.828
206 HB2 LYS 459 HB2 LYS 459 -7.832 -2.647 1.938
207 HB3 LYS 459 HB1 LYS 459 -7.149 -1.489 0.806
208 HG2 LYS 459 HG2 LYS 459 -5.748 -3.237 -0.156
209 HG3 LYS 459 HG1 LYS 459 -6.408 -4.402 0.996
210 HD2 LYS 459 HD2 LYS 459 -8.677 -3.915 0.063
211 HD3 LYS 459 HD1 LYS 459 -7.895 -2.939 -1.182
212 HE2 LYS 459 HE2 LYS 459 -6.645 -4.900 -1.938
213 HE3 LYS 459 HE1 LYS 459 -7.407 -5.875 -0.680
214 HZ1 LYS 459 HZ1 LYS 459 -8.580 -6.263 -2.688
215 HZ2 LYS 459 HZ2 LYS 459 -8.715 -4.607 -3.021
216 HZ3 LYS 459 HZ3 LYS 459 -9.583 -5.285 -1.731
217 HA PRO 460 HA PRO 460 -6.030 1.228 5.076
218 HB2 PRO 460 HB2 PRO 460 -5.397 3.139 2.909
219 HB3 PRO 460 HB1 PRO 460 -4.718 3.019 4.536
220 HG2 PRO 460 HG2 PRO 460 -3.303 2.291 2.383
221 HG3 PRO 460 HG1 PRO 460 -3.176 1.410 3.916
222 HD2 PRO 460 HD2 PRO 460 -4.670 0.676 1.431
223 HD3 PRO 460 HD1 PRO 460 -3.727 -0.353 2.529
224 H GLN 461 HN GLN 461 -8.045 1.806 5.498
225 HA GLN 461 HA GLN 461 -10.052 1.694 3.470
226 HB2 GLN 461 HB2 GLN 461 -10.348 0.906 5.813
227 HB3 GLN 461 HB1 GLN 461 -10.304 2.578 6.350
228 HG2 GLN 461 HG2 GLN 461 -12.320 3.039 5.020
229 HG3 GLN 461 HG1 GLN 461 -12.369 1.342 4.541
230 HE21 GLN 461 HE21 GLN 461 -14.380 1.014 5.494
231 HE22 GLN 461 HE22 GLN 461 -14.585 0.940 7.209
232 H GLU 462 HN GLU 462 -8.022 4.212 4.395
233 HA GLU 462 HA GLU 462 -10.007 6.300 4.046
234 HB2 GLU 462 HB2 GLU 462 -8.300 7.867 4.615
235 HB3 GLU 462 HB1 GLU 462 -8.162 6.512 5.724
236 HG2 GLU 462 HG2 GLU 462 -6.108 5.943 4.980
237 HG3 GLU 462 HG1 GLU 462 -6.494 6.341 3.305
238 H LEU 463 HN LEU 463 -8.169 4.432 1.988
239 HA LEU 463 HA LEU 463 -7.410 6.571 0.179
240 HB2 LEU 463 HB2 LEU 463 -6.183 4.283 0.715
241 HB3 LEU 463 HB1 LEU 463 -7.216 3.686 -0.569
242 HG LEU 463 HG LEU 463 -5.174 5.904 -0.819
243 HD11 LEU 463 HD11 LEU 463 -3.951 4.350 -2.203
244 HD12 LEU 463 HD12 LEU 463 -5.209 3.133 -1.989
245 HD13 LEU 463 HD13 LEU 463 -4.233 3.645 -0.611
246 HD21 LEU 463 HD21 LEU 463 -6.984 4.692 -2.901
247 HD22 LEU 463 HD22 LEU 463 -5.648 5.795 -3.230
248 HD23 LEU 463 HD23 LEU 463 -7.039 6.348 -2.295
249 H LYS 464 HN LYS 464 -9.510 3.693 0.026
250 HA LYS 464 HA LYS 464 -10.588 4.694 -2.505
251 HB2 LYS 464 HB2 LYS 464 -10.863 1.955 -1.250
252 HB3 LYS 464 HB1 LYS 464 -11.398 2.417 -2.860
253 HG2 LYS 464 HG2 LYS 464 -9.106 2.793 -3.546
254 HG3 LYS 464 HG1 LYS 464 -8.537 2.434 -1.916
255 HD2 LYS 464 HD2 LYS 464 -9.531 0.156 -2.152
256 HD3 LYS 464 HD1 LYS 464 -9.890 0.543 -3.837
257 HE2 LYS 464 HE2 LYS 464 -7.136 0.596 -2.605
258 HE3 LYS 464 HE1 LYS 464 -7.790 -0.748 -3.537
259 HZ1 LYS 464 HZ1 LYS 464 -6.342 0.793 -4.815
260 HZ2 LYS 464 HZ2 LYS 464 -7.507 2.009 -4.609
261 HZ3 LYS 464 HZ3 LYS 464 -7.896 0.604 -5.471
Start of MODEL 14
1 H SER 433 HT1 SER 433 -3.167 8.501 -1.804
2 HA SER 433 HA SER 433 -2.997 9.096 -4.081
3 HB2 SER 433 HB2 SER 433 -4.128 11.337 -3.717
4 HB3 SER 433 HB1 SER 433 -2.577 11.947 -3.149
5 HG SER 433 HG SER 433 -2.717 12.442 -5.302
6 H GLU 434 HN GLU 434 -1.350 9.323 -1.235
7 HA GLU 434 HA GLU 434 1.263 9.516 -2.580
8 HB2 GLU 434 HB2 GLU 434 1.762 9.824 0.124
9 HB3 GLU 434 HB1 GLU 434 1.705 11.106 -1.074
10 HG2 GLU 434 HG2 GLU 434 0.366 11.634 0.899
11 HG3 GLU 434 HG1 GLU 434 -0.620 11.537 -0.556
12 H TRP 435 HN TRP 435 -0.761 7.235 -1.710
13 HA TRP 435 HA TRP 435 1.088 5.548 -0.217
14 HB2 TRP 435 HB2 TRP 435 -1.699 4.978 -1.287
15 HB3 TRP 435 HB1 TRP 435 -0.744 3.846 -0.339
16 HD1 TRP 435 HD1 TRP 435 -3.076 6.775 -0.004
17 HE1 TRP 435 HE1 TRP 435 -3.438 7.327 2.488
18 HE3 TRP 435 HE3 TRP 435 0.524 3.760 2.022
19 HZ2 TRP 435 HZ2 TRP 435 -2.326 6.578 4.977
20 HZ3 TRP 435 HZ3 TRP 435 0.820 3.752 4.464
21 HH2 TRP 435 HH2 TRP 435 -0.556 5.144 5.911
22 H THR 436 HN THR 436 2.339 4.009 -1.151
23 HA THR 436 HA THR 436 2.323 3.912 -4.055
24 HB THR 436 HB THR 436 4.219 2.616 -2.082
25 HG1 THR 436 HG1 THR 436 4.685 4.735 -2.014
26 HG21 THR 436 HG21 THR 436 5.657 2.193 -4.033
27 HG22 THR 436 HG22 THR 436 4.411 2.848 -5.095
28 HG23 THR 436 HG23 THR 436 4.105 1.362 -4.192
29 H GLU 437 HN GLU 437 0.595 2.749 -4.607
30 HA GLU 437 HA GLU 437 0.305 0.029 -3.631
31 HB2 GLU 437 HB2 GLU 437 -1.693 1.496 -4.101
32 HB3 GLU 437 HB1 GLU 437 -1.252 1.470 -5.801
33 HG2 GLU 437 HG2 GLU 437 -1.638 -1.126 -4.411
34 HG3 GLU 437 HG1 GLU 437 -3.061 -0.162 -4.792
35 H ARG 438 HN ARG 438 2.136 -0.944 -4.319
36 HA ARG 438 HA ARG 438 2.659 -0.922 -7.209
37 HB2 ARG 438 HB2 ARG 438 4.482 -0.254 -5.553
38 HB3 ARG 438 HB1 ARG 438 4.507 -1.936 -5.049
39 HG2 ARG 438 HG2 ARG 438 5.263 -2.656 -7.174
40 HG3 ARG 438 HG1 ARG 438 4.965 -1.069 -7.890
41 HD2 ARG 438 HD2 ARG 438 6.684 -0.101 -6.437
42 HD3 ARG 438 HD1 ARG 438 6.983 -1.691 -5.735
43 HE ARG 438 HE ARG 438 7.427 -1.136 -8.601
44 HH11 ARG 438 HH11 ARG 438 8.467 -2.449 -5.529
45 HH12 ARG 438 HH12 ARG 438 9.996 -3.012 -6.133
46 HH21 ARG 438 HH21 ARG 438 9.452 -1.880 -9.409
47 HH22 ARG 438 HH22 ARG 438 10.551 -2.682 -8.327
48 H LYS 439 HN LYS 439 1.636 -2.491 -8.157
49 HA LYS 439 HA LYS 439 0.823 -4.821 -6.642
50 HB2 LYS 439 HB2 LYS 439 -0.682 -3.364 -8.138
51 HB3 LYS 439 HB1 LYS 439 0.083 -4.188 -9.488
52 HG2 LYS 439 HG2 LYS 439 -0.821 -6.268 -8.867
53 HG3 LYS 439 HG1 LYS 439 -1.294 -5.672 -7.272
54 HD2 LYS 439 HD2 LYS 439 -2.445 -4.817 -9.928
55 HD3 LYS 439 HD1 LYS 439 -3.249 -5.806 -8.704
56 HE2 LYS 439 HE2 LYS 439 -3.222 -3.966 -7.143
57 HE3 LYS 439 HE1 LYS 439 -2.288 -2.980 -8.266
58 HZ1 LYS 439 HZ1 LYS 439 -4.178 -3.079 -9.812
59 HZ2 LYS 439 HZ2 LYS 439 -4.575 -2.338 -8.343
60 HZ3 LYS 439 HZ3 LYS 439 -5.076 -3.929 -8.646
61 H THR 440 HN THR 440 2.486 -6.200 -6.502
62 HA THR 440 HA THR 440 3.940 -6.952 -8.899
63 HB THR 440 HB THR 440 4.980 -8.651 -7.223
64 HG1 THR 440 HG1 THR 440 3.135 -7.729 -5.677
65 HG21 THR 440 HG21 THR 440 5.387 -5.668 -7.002
66 HG22 THR 440 HG22 THR 440 6.217 -6.775 -8.094
67 HG23 THR 440 HG23 THR 440 6.494 -6.879 -6.354
68 H ALA 441 HN ALA 441 3.770 -8.824 -9.996
69 HA ALA 441 HA ALA 441 1.175 -10.031 -9.917
70 HB1 ALA 441 HB1 ALA 441 1.843 -11.157 -11.949
71 HB2 ALA 441 HB2 ALA 441 3.523 -10.684 -11.690
72 HB3 ALA 441 HB3 ALA 441 2.301 -9.456 -12.019
73 H ASP 442 HN ASP 442 3.468 -10.637 -7.861
74 HA ASP 442 HA ASP 442 3.548 -13.529 -8.010
75 HB2 ASP 442 HB2 ASP 442 5.423 -12.102 -7.073
76 HB3 ASP 442 HB1 ASP 442 4.380 -11.758 -5.698
77 H GLY 443 HN GLY 443 1.194 -11.448 -7.394
78 HA2 GLY 443 HA2 GLY 443 -0.958 -12.015 -6.666
79 HA3 GLY 443 HA1 GLY 443 -0.278 -13.379 -5.789
80 H LYS 444 HN LYS 444 0.868 -10.058 -5.578
81 HA LYS 444 HA LYS 444 -0.438 -9.686 -3.021
82 HB2 LYS 444 HB2 LYS 444 1.642 -9.300 -1.788
83 HB3 LYS 444 HB1 LYS 444 1.561 -10.944 -2.398
84 HG2 LYS 444 HG2 LYS 444 3.076 -10.361 -4.213
85 HG3 LYS 444 HG1 LYS 444 3.131 -8.694 -3.637
86 HD2 LYS 444 HD2 LYS 444 4.935 -9.342 -2.483
87 HD3 LYS 444 HD1 LYS 444 3.786 -10.115 -1.390
88 HE2 LYS 444 HE2 LYS 444 5.105 -11.429 -3.760
89 HE3 LYS 444 HE1 LYS 444 5.595 -11.627 -2.079
90 HZ1 LYS 444 HZ1 LYS 444 2.867 -12.288 -3.004
91 HZ2 LYS 444 HZ2 LYS 444 3.638 -12.775 -1.575
92 HZ3 LYS 444 HZ3 LYS 444 4.133 -13.409 -3.076
93 H THR 445 HN THR 445 -1.062 -7.647 -2.854
94 HA THR 445 HA THR 445 0.394 -5.556 -4.325
95 HB THR 445 HB THR 445 -2.188 -5.070 -2.861
96 HG1 THR 445 HG1 THR 445 -2.429 -6.932 -4.318
97 HG21 THR 445 HG21 THR 445 -2.477 -3.388 -4.614
98 HG22 THR 445 HG22 THR 445 -0.971 -3.911 -5.370
99 HG23 THR 445 HG23 THR 445 -0.945 -3.173 -3.767
100 H TYR 446 HN TYR 446 1.629 -4.133 -3.192
101 HA TYR 446 HA TYR 446 1.127 -4.016 -0.295
102 HB2 TYR 446 HB2 TYR 446 3.563 -3.458 -0.044
103 HB3 TYR 446 HB1 TYR 446 3.192 -5.115 -0.483
104 HD1 TYR 446 HD2 TYR 446 3.770 -5.973 -2.678
105 HD2 TYR 446 HD1 TYR 446 4.763 -1.989 -1.567
106 HE1 TYR 446 HE2 TYR 446 5.384 -5.871 -4.518
107 HE2 TYR 446 HE1 TYR 446 6.389 -1.879 -3.412
108 HH TYR 446 HH TYR 446 6.556 -4.315 -5.856
109 H TYR 447 HN TYR 447 0.855 -2.121 0.605
110 HA TYR 447 HA TYR 447 1.281 0.247 -1.081
111 HB2 TYR 447 HB2 TYR 447 -0.495 -0.075 1.349
112 HB3 TYR 447 HB1 TYR 447 -0.349 1.376 0.372
113 HD1 TYR 447 HD2 TYR 447 -1.155 -2.278 -0.173
114 HD2 TYR 447 HD1 TYR 447 -2.063 1.789 -1.073
115 HE1 TYR 447 HE2 TYR 447 -3.052 -3.009 -1.543
116 HE2 TYR 447 HE1 TYR 447 -3.963 1.057 -2.445
117 HH TYR 447 HH TYR 447 -4.672 -0.972 -3.684
118 H TYR 448 HN TYR 448 3.553 0.328 -0.528
119 HA TYR 448 HA TYR 448 4.188 1.160 2.184
120 HB2 TYR 448 HB2 TYR 448 5.902 -0.089 1.149
121 HB3 TYR 448 HB1 TYR 448 5.808 0.857 -0.330
122 HD1 TYR 448 HD1 TYR 448 6.411 1.617 3.320
123 HD2 TYR 448 HD2 TYR 448 7.655 2.133 -0.722
124 HE1 TYR 448 HE1 TYR 448 8.296 3.029 4.084
125 HE2 TYR 448 HE2 TYR 448 9.525 3.534 0.026
126 HH TYR 448 HH TYR 448 10.474 3.750 3.299
127 H ASN 449 HN ASN 449 4.262 3.075 2.979
128 HA ASN 449 HA ASN 449 4.507 5.435 1.252
129 HB2 ASN 449 HB2 ASN 449 2.076 4.968 1.804
130 HB3 ASN 449 HB1 ASN 449 2.484 5.207 3.493
131 HD21 ASN 449 HD21 ASN 449 0.564 6.641 1.974
132 HD22 ASN 449 HD22 ASN 449 1.043 8.302 1.954
133 H ASN 450 HN ASN 450 5.387 7.239 2.361
134 HA ASN 450 HA ASN 450 7.139 6.463 4.548
135 HB2 ASN 450 HB2 ASN 450 7.028 8.956 2.833
136 HB3 ASN 450 HB1 ASN 450 8.209 8.683 4.111
137 HD21 ASN 450 HD21 ASN 450 9.893 7.275 3.773
138 HD22 ASN 450 HD22 ASN 450 10.235 6.570 2.228
139 H ARG 451 HN ARG 451 4.120 7.737 4.172
140 HA ARG 451 HA ARG 451 4.014 9.537 6.349
141 HB2 ARG 451 HB2 ARG 451 2.007 7.990 4.831
142 HB3 ARG 451 HB1 ARG 451 1.532 8.588 6.417
143 HG2 ARG 451 HG2 ARG 451 2.115 10.863 5.734
144 HG3 ARG 451 HG1 ARG 451 2.585 10.260 4.142
145 HD2 ARG 451 HD2 ARG 451 0.297 11.255 4.252
146 HD3 ARG 451 HD1 ARG 451 0.355 9.599 3.651
147 HE ARG 451 HE ARG 451 -0.194 9.941 6.487
148 HH11 ARG 451 HH11 ARG 451 -1.437 9.406 3.263
149 HH12 ARG 451 HH12 ARG 451 -2.948 8.731 3.827
150 HH21 ARG 451 HH21 ARG 451 -2.169 9.010 7.227
151 HH22 ARG 451 HH22 ARG 451 -3.351 8.482 6.063
152 H THR 452 HN THR 452 3.929 6.073 6.154
153 HA THR 452 HA THR 452 3.904 5.975 9.093
154 HB THR 452 HB THR 452 3.106 3.572 8.718
155 HG1 THR 452 HG1 THR 452 2.183 3.150 6.713
156 HG21 THR 452 HG21 THR 452 1.629 5.335 9.557
157 HG22 THR 452 HG22 THR 452 0.762 4.267 8.451
158 HG23 THR 452 HG23 THR 452 1.297 5.856 7.904
159 H LEU 453 HN LEU 453 5.756 5.446 6.320
160 HA LEU 453 HA LEU 453 7.552 4.207 5.735
161 HB2 LEU 453 HB2 LEU 453 7.939 4.527 8.661
162 HB3 LEU 453 HB1 LEU 453 8.911 3.313 7.852
163 HG LEU 453 HG LEU 453 10.075 5.482 8.059
164 HD11 LEU 453 HD11 LEU 453 10.362 3.814 6.125
165 HD12 LEU 453 HD12 LEU 453 10.994 5.445 5.911
166 HD13 LEU 453 HD13 LEU 453 9.464 4.987 5.162
167 HD21 LEU 453 HD21 LEU 453 9.351 7.373 6.736
168 HD22 LEU 453 HD22 LEU 453 8.072 6.911 7.862
169 HD23 LEU 453 HD23 LEU 453 7.957 6.458 6.154
170 H GLU 454 HN GLU 454 5.022 2.989 6.044
171 HA GLU 454 HA GLU 454 5.799 0.258 6.846
172 HB2 GLU 454 HB2 GLU 454 3.102 1.583 7.152
173 HB3 GLU 454 HB1 GLU 454 3.420 -0.117 7.458
174 HG2 GLU 454 HG2 GLU 454 5.030 0.559 9.218
175 HG3 GLU 454 HG1 GLU 454 4.546 2.236 8.949
176 H SER 455 HN SER 455 5.607 -1.244 5.344
177 HA SER 455 HA SER 455 3.995 -0.741 2.982
178 HB2 SER 455 HB2 SER 455 6.267 -1.889 2.900
179 HB3 SER 455 HB1 SER 455 5.489 -3.267 3.683
180 HG SER 455 HG SER 455 4.130 -3.470 1.907
181 H THR 456 HN THR 456 1.904 -1.012 3.174
182 HA THR 456 HA THR 456 0.882 -2.864 5.174
183 HB THR 456 HB THR 456 -1.350 -1.843 4.578
184 HG1 THR 456 HG1 THR 456 0.330 -0.073 3.091
185 HG21 THR 456 HG21 THR 456 -0.839 0.326 5.693
186 HG22 THR 456 HG22 THR 456 0.876 -0.053 5.544
187 HG23 THR 456 HG23 THR 456 -0.171 -1.076 6.526
188 H TRP 457 HN TRP 457 0.177 -4.804 4.691
189 HA TRP 457 HA TRP 457 -0.197 -5.482 1.857
190 HB2 TRP 457 HB2 TRP 457 0.572 -7.282 4.185
191 HB3 TRP 457 HB1 TRP 457 0.454 -7.774 2.488
192 HD1 TRP 457 HD1 TRP 457 2.499 -5.391 4.730
193 HE1 TRP 457 HE1 TRP 457 4.728 -4.861 3.575
194 HE3 TRP 457 HE3 TRP 457 1.805 -8.004 0.388
195 HZ2 TRP 457 HZ2 TRP 457 6.002 -5.402 1.134
196 HZ3 TRP 457 HZ3 TRP 457 3.606 -7.981 -1.287
197 HH2 TRP 457 HH2 TRP 457 5.672 -6.731 -0.915
198 H GLU 458 HN GLU 458 -1.801 -4.794 4.591
199 HA GLU 458 HA GLU 458 -4.249 -6.022 3.524
200 HB2 GLU 458 HB2 GLU 458 -3.423 -6.029 6.117
201 HB3 GLU 458 HB1 GLU 458 -4.319 -4.516 6.088
202 HG2 GLU 458 HG2 GLU 458 -5.422 -7.200 5.287
203 HG3 GLU 458 HG1 GLU 458 -5.671 -6.420 6.846
204 H LYS 459 HN LYS 459 -5.798 -4.619 2.719
205 HA LYS 459 HA LYS 459 -4.697 -2.295 1.560
206 HB2 LYS 459 HB2 LYS 459 -7.531 -3.313 1.644
207 HB3 LYS 459 HB1 LYS 459 -7.005 -1.949 0.664
208 HG2 LYS 459 HG2 LYS 459 -5.479 -3.399 -0.556
209 HG3 LYS 459 HG1 LYS 459 -5.967 -4.768 0.444
210 HD2 LYS 459 HD2 LYS 459 -7.130 -4.888 -1.654
211 HD3 LYS 459 HD1 LYS 459 -8.285 -4.488 -0.386
212 HE2 LYS 459 HE2 LYS 459 -6.993 -2.381 -2.099
213 HE3 LYS 459 HE1 LYS 459 -8.457 -3.222 -2.599
214 HZ1 LYS 459 HZ1 LYS 459 -9.540 -2.432 -0.564
215 HZ2 LYS 459 HZ2 LYS 459 -9.004 -1.148 -1.537
216 HZ3 LYS 459 HZ3 LYS 459 -8.138 -1.578 -0.149
217 HA PRO 460 HA PRO 460 -5.605 0.765 4.755
218 HB2 PRO 460 HB2 PRO 460 -4.955 2.574 2.497
219 HB3 PRO 460 HB1 PRO 460 -4.263 2.514 4.120
220 HG2 PRO 460 HG2 PRO 460 -2.886 1.650 2.003
221 HG3 PRO 460 HG1 PRO 460 -2.779 0.831 3.573
222 HD2 PRO 460 HD2 PRO 460 -4.297 0.034 1.115
223 HD3 PRO 460 HD1 PRO 460 -3.396 -0.979 2.263
224 H GLN 461 HN GLN 461 -7.463 1.862 5.172
225 HA GLN 461 HA GLN 461 -9.540 1.556 3.161
226 HB2 GLN 461 HB2 GLN 461 -9.783 0.834 5.592
227 HB3 GLN 461 HB1 GLN 461 -9.908 2.544 5.982
228 HG2 GLN 461 HG2 GLN 461 -11.850 2.718 4.481
229 HG3 GLN 461 HG1 GLN 461 -11.745 0.985 4.179
230 HE21 GLN 461 HE21 GLN 461 -10.944 0.508 7.004
231 HE22 GLN 461 HE22 GLN 461 -12.411 0.635 7.909
232 H GLU 462 HN GLU 462 -7.543 4.063 4.377
233 HA GLU 462 HA GLU 462 -9.433 6.184 4.021
234 HB2 GLU 462 HB2 GLU 462 -7.605 7.707 4.389
235 HB3 GLU 462 HB1 GLU 462 -7.492 6.385 5.543
236 HG2 GLU 462 HG2 GLU 462 -5.622 5.483 4.524
237 HG3 GLU 462 HG1 GLU 462 -5.943 6.292 2.988
238 H LEU 463 HN LEU 463 -7.697 4.317 1.843
239 HA LEU 463 HA LEU 463 -7.270 6.428 -0.096
240 HB2 LEU 463 HB2 LEU 463 -5.677 4.495 0.302
241 HB3 LEU 463 HB1 LEU 463 -6.856 3.467 -0.490
242 HG LEU 463 HG LEU 463 -6.647 4.833 -2.542
243 HD11 LEU 463 HD11 LEU 463 -4.457 6.239 -1.019
244 HD12 LEU 463 HD12 LEU 463 -5.992 6.946 -1.530
245 HD13 LEU 463 HD13 LEU 463 -4.810 6.434 -2.736
246 HD21 LEU 463 HD21 LEU 463 -5.326 2.839 -2.369
247 HD22 LEU 463 HD22 LEU 463 -4.097 3.684 -1.428
248 HD23 LEU 463 HD23 LEU 463 -4.351 4.103 -3.122
249 H LYS 464 HN LYS 464 -9.901 4.732 0.850
250 HA LYS 464 HA LYS 464 -11.201 5.336 -1.689
251 HB2 LYS 464 HB2 LYS 464 -10.713 2.897 -1.734
252 HB3 LYS 464 HB1 LYS 464 -11.635 2.711 -0.248
253 HG2 LYS 464 HG2 LYS 464 -13.633 3.563 -1.419
254 HG3 LYS 464 HG1 LYS 464 -12.697 3.635 -2.912
255 HD2 LYS 464 HD2 LYS 464 -13.205 1.141 -1.291
256 HD3 LYS 464 HD1 LYS 464 -14.089 1.603 -2.744
257 HE2 LYS 464 HE2 LYS 464 -11.950 1.557 -3.999
258 HE3 LYS 464 HE1 LYS 464 -11.150 0.970 -2.541
259 HZ1 LYS 464 HZ1 LYS 464 -11.700 -0.861 -3.991
260 HZ2 LYS 464 HZ2 LYS 464 -13.333 -0.403 -4.011
261 HZ3 LYS 464 HZ3 LYS 464 -12.629 -0.960 -2.573
Start of MODEL 15
1 H SER 433 HT1 SER 433 -0.836 9.952 -3.505
2 HA SER 433 HA SER 433 1.091 9.115 -4.609
3 HB2 SER 433 HB2 SER 433 2.534 11.581 -3.614
4 HB3 SER 433 HB1 SER 433 3.136 10.355 -4.731
5 HG SER 433 HG SER 433 2.489 12.064 -5.972
6 H GLU 434 HN GLU 434 -0.179 9.589 -1.797
7 HA GLU 434 HA GLU 434 2.088 9.226 -0.036
8 HB2 GLU 434 HB2 GLU 434 -0.868 9.328 0.591
9 HB3 GLU 434 HB1 GLU 434 0.425 9.313 1.777
10 HG2 GLU 434 HG2 GLU 434 -0.275 11.543 1.625
11 HG3 GLU 434 HG1 GLU 434 1.241 11.463 0.733
12 H TRP 435 HN TRP 435 -0.073 7.283 -1.754
13 HA TRP 435 HA TRP 435 0.668 4.941 -0.136
14 HB2 TRP 435 HB2 TRP 435 -1.927 5.180 -1.688
15 HB3 TRP 435 HB1 TRP 435 -1.498 3.965 -0.486
16 HD1 TRP 435 HD1 TRP 435 -3.290 7.186 -0.822
17 HE1 TRP 435 HE1 TRP 435 -3.820 8.190 1.491
18 HE3 TRP 435 HE3 TRP 435 -0.443 4.094 2.056
19 HZ2 TRP 435 HZ2 TRP 435 -3.096 7.730 4.193
20 HZ3 TRP 435 HZ3 TRP 435 -0.409 4.428 4.479
21 HH2 TRP 435 HH2 TRP 435 -1.677 6.225 5.537
22 H THR 436 HN THR 436 1.992 3.667 -1.269
23 HA THR 436 HA THR 436 2.043 3.882 -4.170
24 HB THR 436 HB THR 436 3.810 2.328 -2.267
25 HG1 THR 436 HG1 THR 436 4.438 4.391 -2.108
26 HG21 THR 436 HG21 THR 436 3.697 1.145 -4.400
27 HG22 THR 436 HG22 THR 436 5.267 1.932 -4.231
28 HG23 THR 436 HG23 THR 436 4.035 2.644 -5.270
29 H GLU 437 HN GLU 437 0.243 2.867 -4.884
30 HA GLU 437 HA GLU 437 -0.224 0.104 -4.130
31 HB2 GLU 437 HB2 GLU 437 -2.151 0.283 -5.745
32 HB3 GLU 437 HB1 GLU 437 -2.229 1.371 -4.367
33 HG2 GLU 437 HG2 GLU 437 -1.519 3.222 -5.728
34 HG3 GLU 437 HG1 GLU 437 -1.276 2.154 -7.110
35 H ARG 438 HN ARG 438 1.395 -1.077 -4.939
36 HA ARG 438 HA ARG 438 1.654 -1.091 -7.863
37 HB2 ARG 438 HB2 ARG 438 3.633 -0.042 -6.747
38 HB3 ARG 438 HB1 ARG 438 3.904 -1.560 -5.901
39 HG2 ARG 438 HG2 ARG 438 4.227 -2.694 -8.041
40 HG3 ARG 438 HG1 ARG 438 3.974 -1.164 -8.886
41 HD2 ARG 438 HD2 ARG 438 5.903 -0.220 -7.663
42 HD3 ARG 438 HD1 ARG 438 6.172 -1.793 -6.918
43 HE ARG 438 HE ARG 438 6.129 -1.819 -9.817
44 HH11 ARG 438 HH11 ARG 438 8.078 -1.482 -6.928
45 HH12 ARG 438 HH12 ARG 438 9.567 -1.913 -7.716
46 HH21 ARG 438 HH21 ARG 438 8.067 -2.379 -10.869
47 HH22 ARG 438 HH22 ARG 438 9.564 -2.436 -9.982
48 H LYS 439 HN LYS 439 0.940 -2.955 -8.615
49 HA LYS 439 HA LYS 439 0.799 -5.196 -6.779
50 HB2 LYS 439 HB2 LYS 439 -0.631 -6.253 -8.539
51 HB3 LYS 439 HB1 LYS 439 -1.274 -4.783 -7.833
52 HG2 LYS 439 HG2 LYS 439 -0.654 -3.518 -9.780
53 HG3 LYS 439 HG1 LYS 439 0.146 -4.926 -10.482
54 HD2 LYS 439 HD2 LYS 439 -1.936 -6.098 -10.669
55 HD3 LYS 439 HD1 LYS 439 -2.784 -4.838 -9.774
56 HE2 LYS 439 HE2 LYS 439 -1.407 -4.367 -12.409
57 HE3 LYS 439 HE1 LYS 439 -3.107 -4.807 -12.265
58 HZ1 LYS 439 HZ1 LYS 439 -3.350 -2.805 -10.808
59 HZ2 LYS 439 HZ2 LYS 439 -3.014 -2.474 -12.433
60 HZ3 LYS 439 HZ3 LYS 439 -1.785 -2.346 -11.270
61 H THR 440 HN THR 440 2.402 -6.497 -6.672
62 HA THR 440 HA THR 440 4.053 -7.028 -9.003
63 HB THR 440 HB THR 440 5.353 -8.498 -7.443
64 HG1 THR 440 HG1 THR 440 3.186 -7.973 -5.843
65 HG21 THR 440 HG21 THR 440 4.921 -5.649 -6.535
66 HG22 THR 440 HG22 THR 440 6.008 -6.177 -7.819
67 HG23 THR 440 HG23 THR 440 6.321 -6.649 -6.148
68 H ALA 441 HN ALA 441 4.248 -8.973 -10.031
69 HA ALA 441 HA ALA 441 1.786 -10.321 -10.391
70 HB1 ALA 441 HB1 ALA 441 4.493 -11.014 -11.508
71 HB2 ALA 441 HB2 ALA 441 3.364 -9.853 -12.206
72 HB3 ALA 441 HB3 ALA 441 2.933 -11.561 -12.122
73 H ASP 442 HN ASP 442 3.797 -10.799 -7.904
74 HA ASP 442 HA ASP 442 3.854 -13.675 -7.844
75 HB2 ASP 442 HB2 ASP 442 5.572 -12.376 -6.664
76 HB3 ASP 442 HB1 ASP 442 4.335 -11.636 -5.653
77 H GLY 443 HN GLY 443 1.442 -11.474 -7.575
78 HA2 GLY 443 HA2 GLY 443 -0.807 -11.927 -7.076
79 HA3 GLY 443 HA1 GLY 443 -0.295 -13.345 -6.167
80 H LYS 444 HN LYS 444 1.286 -10.314 -5.679
81 HA LYS 444 HA LYS 444 -0.290 -9.818 -3.261
82 HB2 LYS 444 HB2 LYS 444 1.827 -9.332 -2.005
83 HB3 LYS 444 HB1 LYS 444 1.584 -11.028 -2.390
84 HG2 LYS 444 HG2 LYS 444 3.292 -11.049 -3.954
85 HG3 LYS 444 HG1 LYS 444 3.253 -9.297 -4.169
86 HD2 LYS 444 HD2 LYS 444 5.231 -9.932 -2.921
87 HD3 LYS 444 HD1 LYS 444 4.135 -9.017 -1.889
88 HE2 LYS 444 HE2 LYS 444 4.831 -10.761 -0.522
89 HE3 LYS 444 HE1 LYS 444 3.273 -11.323 -1.127
90 HZ1 LYS 444 HZ1 LYS 444 5.918 -12.088 -2.239
91 HZ2 LYS 444 HZ2 LYS 444 4.414 -12.671 -2.762
92 HZ3 LYS 444 HZ3 LYS 444 4.976 -13.050 -1.210
93 H THR 445 HN THR 445 -0.691 -7.717 -2.890
94 HA THR 445 HA THR 445 0.649 -5.778 -4.646
95 HB THR 445 HB THR 445 -2.048 -5.347 -3.367
96 HG1 THR 445 HG1 THR 445 -1.658 -7.252 -5.003
97 HG21 THR 445 HG21 THR 445 -2.329 -3.720 -5.147
98 HG22 THR 445 HG22 THR 445 -0.778 -4.174 -5.850
99 HG23 THR 445 HG23 THR 445 -0.835 -3.386 -4.271
100 H TYR 446 HN TYR 446 2.074 -4.550 -3.569
101 HA TYR 446 HA TYR 446 1.630 -4.232 -0.704
102 HB2 TYR 446 HB2 TYR 446 3.911 -3.635 -0.460
103 HB3 TYR 446 HB1 TYR 446 3.838 -5.074 -1.449
104 HD1 TYR 446 HD1 TYR 446 4.108 -4.727 -4.024
105 HD2 TYR 446 HD2 TYR 446 5.145 -1.811 -1.101
106 HE1 TYR 446 HE1 TYR 446 5.646 -3.662 -5.630
107 HE2 TYR 446 HE2 TYR 446 6.673 -0.742 -2.699
108 HH TYR 446 HH TYR 446 7.978 -1.393 -4.708
109 H TYR 447 HN TYR 447 0.810 -2.491 0.064
110 HA TYR 447 HA TYR 447 1.086 -0.008 -1.443
111 HB2 TYR 447 HB2 TYR 447 -0.575 -0.644 1.009
112 HB3 TYR 447 HB1 TYR 447 -0.509 0.924 0.221
113 HD1 TYR 447 HD2 TYR 447 -1.395 -2.655 -0.468
114 HD2 TYR 447 HD1 TYR 447 -2.015 1.442 -1.458
115 HE1 TYR 447 HE2 TYR 447 -3.255 -3.292 -1.941
116 HE2 TYR 447 HE1 TYR 447 -3.870 0.804 -2.937
117 HH TYR 447 HH TYR 447 -5.168 -2.394 -2.992
118 H TYR 448 HN TYR 448 3.275 0.400 -1.056
119 HA TYR 448 HA TYR 448 4.146 0.732 1.681
120 HB2 TYR 448 HB2 TYR 448 5.849 -0.016 0.193
121 HB3 TYR 448 HB1 TYR 448 5.459 1.224 -0.989
122 HD1 TYR 448 HD1 TYR 448 6.269 1.311 2.679
123 HD2 TYR 448 HD2 TYR 448 7.183 2.726 -1.232
124 HE1 TYR 448 HE1 TYR 448 7.980 2.809 3.626
125 HE2 TYR 448 HE2 TYR 448 8.898 4.218 -0.296
126 HH TYR 448 HH TYR 448 10.077 3.940 2.844
127 H ASN 449 HN ASN 449 3.921 2.426 2.847
128 HA ASN 449 HA ASN 449 2.926 4.911 1.643
129 HB2 ASN 449 HB2 ASN 449 1.287 4.108 3.085
130 HB3 ASN 449 HB1 ASN 449 2.466 3.504 4.248
131 HD21 ASN 449 HD21 ASN 449 1.109 6.441 2.868
132 HD22 ASN 449 HD22 ASN 449 1.312 7.404 4.292
133 H ASN 450 HN ASN 450 3.782 6.874 2.151
134 HA ASN 450 HA ASN 450 6.367 6.851 3.540
135 HB2 ASN 450 HB2 ASN 450 6.207 7.679 1.158
136 HB3 ASN 450 HB1 ASN 450 5.234 9.017 1.759
137 HD21 ASN 450 HD21 ASN 450 8.016 7.575 3.365
138 HD22 ASN 450 HD22 ASN 450 9.023 8.974 3.260
139 H ARG 451 HN ARG 451 3.196 7.541 4.221
140 HA ARG 451 HA ARG 451 3.405 10.047 5.522
141 HB2 ARG 451 HB2 ARG 451 1.358 7.874 5.759
142 HB3 ARG 451 HB1 ARG 451 1.266 9.377 6.670
143 HG2 ARG 451 HG2 ARG 451 1.279 9.104 3.673
144 HG3 ARG 451 HG1 ARG 451 -0.105 9.516 4.687
145 HD2 ARG 451 HD2 ARG 451 2.414 11.159 4.591
146 HD3 ARG 451 HD1 ARG 451 1.041 11.446 3.523
147 HE ARG 451 HE ARG 451 0.026 11.426 6.100
148 HH11 ARG 451 HH11 ARG 451 2.503 13.260 4.425
149 HH12 ARG 451 HH12 ARG 451 2.075 14.769 5.182
150 HH21 ARG 451 HH21 ARG 451 -0.512 13.390 7.121
151 HH22 ARG 451 HH22 ARG 451 0.370 14.840 6.737
152 H THR 452 HN THR 452 3.197 6.770 6.857
153 HA THR 452 HA THR 452 4.604 7.782 9.239
154 HB THR 452 HB THR 452 2.344 7.214 9.863
155 HG1 THR 452 HG1 THR 452 4.413 5.488 10.704
156 HG21 THR 452 HG21 THR 452 2.880 4.496 8.670
157 HG22 THR 452 HG22 THR 452 1.792 5.722 8.020
158 HG23 THR 452 HG23 THR 452 1.434 4.957 9.568
159 H LEU 453 HN LEU 453 5.036 6.059 6.544
160 HA LEU 453 HA LEU 453 6.559 4.565 5.799
161 HB2 LEU 453 HB2 LEU 453 7.674 5.210 8.478
162 HB3 LEU 453 HB1 LEU 453 8.268 3.760 7.695
163 HG LEU 453 HG LEU 453 9.598 5.937 7.377
164 HD11 LEU 453 HD11 LEU 453 9.610 3.723 5.979
165 HD12 LEU 453 HD12 LEU 453 10.447 5.159 5.392
166 HD13 LEU 453 HD13 LEU 453 8.859 4.745 4.753
167 HD21 LEU 453 HD21 LEU 453 8.882 7.431 5.664
168 HD22 LEU 453 HD22 LEU 453 7.563 7.293 6.832
169 HD23 LEU 453 HD23 LEU 453 7.484 6.418 5.297
170 H GLU 454 HN GLU 454 4.585 3.292 5.735
171 HA GLU 454 HA GLU 454 4.941 0.822 7.272
172 HB2 GLU 454 HB2 GLU 454 2.328 2.263 6.820
173 HB3 GLU 454 HB1 GLU 454 2.431 0.582 7.312
174 HG2 GLU 454 HG2 GLU 454 3.839 1.507 9.278
175 HG3 GLU 454 HG1 GLU 454 3.095 3.050 8.843
176 H SER 455 HN SER 455 4.714 -0.998 6.080
177 HA SER 455 HA SER 455 3.700 -0.685 3.351
178 HB2 SER 455 HB2 SER 455 4.601 -2.999 3.007
179 HB3 SER 455 HB1 SER 455 5.834 -1.819 3.444
180 HG SER 455 HG SER 455 4.987 -2.796 5.714
181 H THR 456 HN THR 456 1.599 -0.936 3.189
182 HA THR 456 HA THR 456 0.209 -2.637 5.132
183 HB THR 456 HB THR 456 -1.853 -1.418 4.304
184 HG1 THR 456 HG1 THR 456 -0.558 -0.672 2.352
185 HG21 THR 456 HG21 THR 456 -1.325 0.678 5.534
186 HG22 THR 456 HG22 THR 456 0.372 0.189 5.565
187 HG23 THR 456 HG23 THR 456 -0.842 -0.781 6.401
188 H TRP 457 HN TRP 457 -0.147 -4.597 4.439
189 HA TRP 457 HA TRP 457 -0.529 -5.068 1.574
190 HB2 TRP 457 HB2 TRP 457 0.174 -7.009 3.807
191 HB3 TRP 457 HB1 TRP 457 0.082 -7.408 2.083
192 HD1 TRP 457 HD1 TRP 457 2.005 -4.928 4.360
193 HE1 TRP 457 HE1 TRP 457 4.301 -4.465 3.321
194 HE3 TRP 457 HE3 TRP 457 1.620 -7.863 0.181
195 HZ2 TRP 457 HZ2 TRP 457 5.741 -5.177 1.038
196 HZ3 TRP 457 HZ3 TRP 457 3.538 -7.948 -1.360
197 HH2 TRP 457 HH2 TRP 457 5.568 -6.656 -0.929
198 H GLU 458 HN GLU 458 -2.116 -4.802 4.490
199 HA GLU 458 HA GLU 458 -4.630 -5.641 3.230
200 HB2 GLU 458 HB2 GLU 458 -4.119 -4.512 6.002
201 HB3 GLU 458 HB1 GLU 458 -5.652 -5.139 5.410
202 HG2 GLU 458 HG2 GLU 458 -4.691 -7.368 5.237
203 HG3 GLU 458 HG1 GLU 458 -3.130 -6.748 5.773
204 H LYS 459 HN LYS 459 -6.050 -4.028 2.488
205 HA LYS 459 HA LYS 459 -4.789 -1.727 1.512
206 HB2 LYS 459 HB2 LYS 459 -7.739 -2.319 1.736
207 HB3 LYS 459 HB1 LYS 459 -7.050 -1.012 0.789
208 HG2 LYS 459 HG2 LYS 459 -5.836 -2.718 -0.559
209 HG3 LYS 459 HG1 LYS 459 -6.727 -3.967 0.321
210 HD2 LYS 459 HD2 LYS 459 -7.914 -3.543 -1.708
211 HD3 LYS 459 HD1 LYS 459 -8.844 -2.825 -0.392
212 HE2 LYS 459 HE2 LYS 459 -7.429 -0.694 -0.995
213 HE3 LYS 459 HE1 LYS 459 -7.273 -1.503 -2.553
214 HZ1 LYS 459 HZ1 LYS 459 -9.832 -1.736 -2.330
215 HZ2 LYS 459 HZ2 LYS 459 -9.163 -0.272 -2.852
216 HZ3 LYS 459 HZ3 LYS 459 -9.683 -0.433 -1.246
217 HA PRO 460 HA PRO 460 -5.096 1.125 4.984
218 HB2 PRO 460 HB2 PRO 460 -4.674 3.304 3.252
219 HB3 PRO 460 HB1 PRO 460 -3.448 2.488 4.217
220 HG2 PRO 460 HG2 PRO 460 -4.077 2.217 1.344
221 HG3 PRO 460 HG1 PRO 460 -2.545 1.965 2.191
222 HD2 PRO 460 HD2 PRO 460 -4.071 -0.076 1.252
223 HD3 PRO 460 HD1 PRO 460 -3.030 -0.224 2.682
224 H GLN 461 HN GLN 461 -6.993 1.849 5.720
225 HA GLN 461 HA GLN 461 -9.259 1.857 3.995
226 HB2 GLN 461 HB2 GLN 461 -8.952 2.540 6.915
227 HB3 GLN 461 HB1 GLN 461 -10.501 2.507 6.079
228 HG2 GLN 461 HG2 GLN 461 -10.132 0.146 5.517
229 HG3 GLN 461 HG1 GLN 461 -8.605 0.189 6.394
230 HE21 GLN 461 HE21 GLN 461 -11.436 1.896 7.497
231 HE22 GLN 461 HE22 GLN 461 -11.761 0.875 8.858
232 H GLU 462 HN GLU 462 -6.995 4.240 4.685
233 HA GLU 462 HA GLU 462 -8.790 6.464 4.320
234 HB2 GLU 462 HB2 GLU 462 -6.613 6.630 5.561
235 HB3 GLU 462 HB1 GLU 462 -5.783 6.432 4.023
236 HG2 GLU 462 HG2 GLU 462 -5.879 8.767 4.647
237 HG3 GLU 462 HG1 GLU 462 -6.827 8.475 3.190
238 H LEU 463 HN LEU 463 -7.240 4.187 2.316
239 HA LEU 463 HA LEU 463 -7.676 5.859 -0.062
240 HB2 LEU 463 HB2 LEU 463 -5.457 4.719 0.273
241 HB3 LEU 463 HB1 LEU 463 -6.285 3.183 0.115
242 HG LEU 463 HG LEU 463 -6.908 3.736 -2.189
243 HD11 LEU 463 HD11 LEU 463 -5.324 6.262 -1.742
244 HD12 LEU 463 HD12 LEU 463 -7.071 6.161 -1.950
245 HD13 LEU 463 HD13 LEU 463 -5.998 5.722 -3.277
246 HD21 LEU 463 HD21 LEU 463 -4.873 2.533 -1.933
247 HD22 LEU 463 HD22 LEU 463 -3.994 3.993 -1.487
248 HD23 LEU 463 HD23 LEU 463 -4.581 3.792 -3.135
249 H LYS 464 HN LYS 464 -9.078 3.508 1.819
250 HA LYS 464 HA LYS 464 -10.929 2.236 1.689
251 HB2 LYS 464 HB2 LYS 464 -11.524 4.114 -0.599
252 HB3 LYS 464 HB1 LYS 464 -12.667 2.914 -0.016
253 HG2 LYS 464 HG2 LYS 464 -13.310 4.906 1.015
254 HG3 LYS 464 HG1 LYS 464 -12.430 4.028 2.264
255 HD2 LYS 464 HD2 LYS 464 -10.443 5.372 1.821
256 HD3 LYS 464 HD1 LYS 464 -11.293 6.221 0.529
257 HE2 LYS 464 HE2 LYS 464 -12.920 7.054 2.183
258 HE3 LYS 464 HE1 LYS 464 -12.010 6.247 3.460
259 HZ1 LYS 464 HZ1 LYS 464 -10.774 8.261 1.673
260 HZ2 LYS 464 HZ2 LYS 464 -10.203 7.702 3.169
261 HZ3 LYS 464 HZ3 LYS 464 -11.567 8.700 3.104
Start of MODEL 16
1 H SER 433 HT1 SER 433 0.230 10.343 -4.920
2 HA SER 433 HA SER 433 2.144 8.859 -4.845
3 HB2 SER 433 HB2 SER 433 2.376 11.286 -5.350
4 HB3 SER 433 HB1 SER 433 2.653 11.595 -3.638
5 HG SER 433 HG SER 433 4.336 9.679 -4.425
6 H GLU 434 HN GLU 434 0.636 9.233 -1.953
7 HA GLU 434 HA GLU 434 2.985 8.559 -0.338
8 HB2 GLU 434 HB2 GLU 434 0.223 9.075 0.736
9 HB3 GLU 434 HB1 GLU 434 1.759 9.186 1.579
10 HG2 GLU 434 HG2 GLU 434 1.235 11.395 1.293
11 HG3 GLU 434 HG1 GLU 434 2.243 11.095 -0.121
12 H TRP 435 HN TRP 435 0.319 7.171 -1.861
13 HA TRP 435 HA TRP 435 0.541 4.747 -0.205
14 HB2 TRP 435 HB2 TRP 435 -1.848 5.544 -1.887
15 HB3 TRP 435 HB1 TRP 435 -1.749 4.210 -0.744
16 HD1 TRP 435 HD1 TRP 435 -2.928 7.685 -0.993
17 HE1 TRP 435 HE1 TRP 435 -3.460 8.640 1.341
18 HE3 TRP 435 HE3 TRP 435 -0.683 4.114 1.889
19 HZ2 TRP 435 HZ2 TRP 435 -2.990 7.976 4.037
20 HZ3 TRP 435 HZ3 TRP 435 -0.756 4.361 4.329
21 HH2 TRP 435 HH2 TRP 435 -1.880 6.252 5.383
22 H THR 436 HN THR 436 2.030 3.591 -1.330
23 HA THR 436 HA THR 436 1.843 3.473 -4.230
24 HB THR 436 HB THR 436 3.848 2.232 -2.337
25 HG1 THR 436 HG1 THR 436 4.638 4.188 -2.436
26 HG21 THR 436 HG21 THR 436 3.871 2.323 -5.363
27 HG22 THR 436 HG22 THR 436 3.614 0.880 -4.378
28 HG23 THR 436 HG23 THR 436 5.169 1.712 -4.339
29 H GLU 437 HN GLU 437 0.065 2.228 -4.728
30 HA GLU 437 HA GLU 437 0.016 -0.503 -3.732
31 HB2 GLU 437 HB2 GLU 437 -2.145 0.652 -4.164
32 HB3 GLU 437 HB1 GLU 437 -1.716 0.762 -5.869
33 HG2 GLU 437 HG2 GLU 437 -1.457 -1.788 -5.758
34 HG3 GLU 437 HG1 GLU 437 -2.358 -1.670 -4.248
35 H ARG 438 HN ARG 438 1.879 -1.405 -4.492
36 HA ARG 438 HA ARG 438 2.216 -1.387 -7.406
37 HB2 ARG 438 HB2 ARG 438 4.165 -0.634 -6.071
38 HB3 ARG 438 HB1 ARG 438 4.211 -2.211 -5.292
39 HG2 ARG 438 HG2 ARG 438 4.697 -3.285 -7.395
40 HG3 ARG 438 HG1 ARG 438 4.538 -1.748 -8.248
41 HD2 ARG 438 HD2 ARG 438 6.444 -0.854 -7.067
42 HD3 ARG 438 HD1 ARG 438 6.568 -2.321 -6.097
43 HE ARG 438 HE ARG 438 6.985 -2.285 -9.019
44 HH11 ARG 438 HH11 ARG 438 7.887 -3.278 -5.799
45 HH12 ARG 438 HH12 ARG 438 9.177 -4.321 -6.330
46 HH21 ARG 438 HH21 ARG 438 8.694 -3.612 -9.746
47 HH22 ARG 438 HH22 ARG 438 9.652 -4.497 -8.587
48 H LYS 439 HN LYS 439 1.521 -3.063 -8.453
49 HA LYS 439 HA LYS 439 0.917 -5.495 -6.984
50 HB2 LYS 439 HB2 LYS 439 -0.183 -6.194 -9.160
51 HB3 LYS 439 HB1 LYS 439 -0.899 -4.821 -8.340
52 HG2 LYS 439 HG2 LYS 439 1.112 -4.351 -10.489
53 HG3 LYS 439 HG1 LYS 439 -0.541 -4.791 -10.918
54 HD2 LYS 439 HD2 LYS 439 -0.073 -2.577 -8.966
55 HD3 LYS 439 HD1 LYS 439 0.159 -2.270 -10.686
56 HE2 LYS 439 HE2 LYS 439 -2.079 -1.644 -10.108
57 HE3 LYS 439 HE1 LYS 439 -2.153 -3.106 -11.084
58 HZ1 LYS 439 HZ1 LYS 439 -3.671 -3.244 -9.240
59 HZ2 LYS 439 HZ2 LYS 439 -2.436 -2.946 -8.133
60 HZ3 LYS 439 HZ3 LYS 439 -2.441 -4.388 -9.031
61 H THR 440 HN THR 440 2.545 -6.802 -6.732
62 HA THR 440 HA THR 440 4.575 -7.092 -8.788
63 HB THR 440 HB THR 440 5.653 -8.661 -7.139
64 HG1 THR 440 HG1 THR 440 3.335 -7.938 -5.678
65 HG21 THR 440 HG21 THR 440 6.173 -6.223 -7.277
66 HG22 THR 440 HG22 THR 440 6.431 -6.923 -5.680
67 HG23 THR 440 HG23 THR 440 4.994 -5.950 -5.990
68 H ALA 441 HN ALA 441 5.209 -9.148 -9.645
69 HA ALA 441 HA ALA 441 3.035 -10.261 -10.999
70 HB1 ALA 441 HB1 ALA 441 5.301 -10.068 -11.921
71 HB2 ALA 441 HB2 ALA 441 4.651 -11.700 -12.075
72 HB3 ALA 441 HB3 ALA 441 5.840 -11.343 -10.823
73 H ASP 442 HN ASP 442 4.457 -11.244 -8.010
74 HA ASP 442 HA ASP 442 3.681 -13.959 -8.032
75 HB2 ASP 442 HB2 ASP 442 5.234 -13.151 -6.367
76 HB3 ASP 442 HB1 ASP 442 4.037 -12.027 -5.733
77 H GLY 443 HN GLY 443 1.829 -11.168 -8.088
78 HA2 GLY 443 HA2 GLY 443 -0.509 -11.080 -8.226
79 HA3 GLY 443 HA1 GLY 443 -0.593 -12.676 -7.490
80 H LYS 444 HN LYS 444 1.397 -10.196 -6.125
81 HA LYS 444 HA LYS 444 -0.575 -9.873 -3.966
82 HB2 LYS 444 HB2 LYS 444 1.382 -9.575 -2.408
83 HB3 LYS 444 HB1 LYS 444 1.158 -11.203 -3.027
84 HG2 LYS 444 HG2 LYS 444 3.059 -11.124 -4.311
85 HG3 LYS 444 HG1 LYS 444 3.034 -9.364 -4.432
86 HD2 LYS 444 HD2 LYS 444 4.862 -10.044 -3.014
87 HD3 LYS 444 HD1 LYS 444 3.643 -9.221 -2.045
88 HE2 LYS 444 HE2 LYS 444 4.367 -11.104 -0.797
89 HE3 LYS 444 HE1 LYS 444 2.762 -11.487 -1.414
90 HZ1 LYS 444 HZ1 LYS 444 5.274 -12.356 -2.727
91 HZ2 LYS 444 HZ2 LYS 444 3.697 -12.869 -3.083
92 HZ3 LYS 444 HZ3 LYS 444 4.421 -13.304 -1.613
93 H THR 445 HN THR 445 -1.298 -7.911 -3.810
94 HA THR 445 HA THR 445 0.190 -5.643 -4.842
95 HB THR 445 HB THR 445 -1.977 -4.509 -3.755
96 HG1 THR 445 HG1 THR 445 -2.868 -6.356 -2.877
97 HG21 THR 445 HG21 THR 445 -3.070 -4.646 -5.893
98 HG22 THR 445 HG22 THR 445 -2.094 -6.045 -6.349
99 HG23 THR 445 HG23 THR 445 -1.333 -4.468 -6.138
100 H TYR 446 HN TYR 446 1.700 -4.755 -3.506
101 HA TYR 446 HA TYR 446 1.027 -4.700 -0.650
102 HB2 TYR 446 HB2 TYR 446 3.297 -4.433 -0.100
103 HB3 TYR 446 HB1 TYR 446 3.223 -5.724 -1.270
104 HD1 TYR 446 HD1 TYR 446 4.032 -5.267 -3.635
105 HD2 TYR 446 HD2 TYR 446 4.565 -2.502 -0.446
106 HE1 TYR 446 HE1 TYR 446 5.826 -4.157 -4.900
107 HE2 TYR 446 HE2 TYR 446 6.353 -1.379 -1.703
108 HH TYR 446 HH TYR 446 7.961 -1.910 -3.493
109 H TYR 447 HN TYR 447 0.829 -2.888 0.429
110 HA TYR 447 HA TYR 447 1.093 -0.420 -1.107
111 HB2 TYR 447 HB2 TYR 447 -0.519 -1.029 1.373
112 HB3 TYR 447 HB1 TYR 447 -0.377 0.568 0.655
113 HD1 TYR 447 HD2 TYR 447 -1.499 -2.910 -0.128
114 HD2 TYR 447 HD1 TYR 447 -1.893 1.239 -0.992
115 HE1 TYR 447 HE2 TYR 447 -3.430 -3.402 -1.574
116 HE2 TYR 447 HE1 TYR 447 -3.829 0.758 -2.433
117 HH TYR 447 HH TYR 447 -4.722 -1.212 -3.754
118 H TYR 448 HN TYR 448 3.195 0.070 -0.842
119 HA TYR 448 HA TYR 448 4.284 0.409 1.797
120 HB2 TYR 448 HB2 TYR 448 6.018 -0.067 0.359
121 HB3 TYR 448 HB1 TYR 448 5.257 0.748 -1.002
122 HD1 TYR 448 HD1 TYR 448 7.156 1.346 2.145
123 HD2 TYR 448 HD2 TYR 448 5.836 2.950 -1.570
124 HE1 TYR 448 HE1 TYR 448 8.591 3.312 2.478
125 HE2 TYR 448 HE2 TYR 448 7.272 4.914 -1.240
126 HH TYR 448 HH TYR 448 9.712 5.062 1.018
127 H ASN 449 HN ASN 449 3.870 2.003 3.018
128 HA ASN 449 HA ASN 449 2.547 4.403 2.039
129 HB2 ASN 449 HB2 ASN 449 1.403 3.492 3.861
130 HB3 ASN 449 HB1 ASN 449 2.889 3.059 4.699
131 HD21 ASN 449 HD21 ASN 449 0.676 5.607 3.935
132 HD22 ASN 449 HD22 ASN 449 1.208 6.704 5.159
133 H ASN 450 HN ASN 450 3.496 6.335 1.923
134 HA ASN 450 HA ASN 450 6.189 6.619 3.055
135 HB2 ASN 450 HB2 ASN 450 5.795 7.039 0.598
136 HB3 ASN 450 HB1 ASN 450 4.827 8.433 1.057
137 HD21 ASN 450 HD21 ASN 450 8.036 7.058 1.002
138 HD22 ASN 450 HD22 ASN 450 8.891 8.552 1.220
139 H ARG 451 HN ARG 451 3.076 7.276 3.923
140 HA ARG 451 HA ARG 451 3.244 9.942 4.840
141 HB2 ARG 451 HB2 ARG 451 1.439 7.672 5.583
142 HB3 ARG 451 HB1 ARG 451 1.354 9.220 6.412
143 HG2 ARG 451 HG2 ARG 451 1.075 8.904 3.433
144 HG3 ARG 451 HG1 ARG 451 -0.286 8.934 4.558
145 HD2 ARG 451 HD2 ARG 451 0.341 11.162 5.292
146 HD3 ARG 451 HD1 ARG 451 1.755 11.134 4.239
147 HE ARG 451 HE ARG 451 -0.092 10.807 2.426
148 HH11 ARG 451 HH11 ARG 451 -0.236 12.908 5.226
149 HH12 ARG 451 HH12 ARG 451 -1.311 14.047 4.458
150 HH21 ARG 451 HH21 ARG 451 -1.446 12.310 1.405
151 HH22 ARG 451 HH22 ARG 451 -1.992 13.716 2.283
152 H THR 452 HN THR 452 3.583 6.860 6.574
153 HA THR 452 HA THR 452 5.096 8.308 8.651
154 HB THR 452 HB THR 452 3.782 5.686 9.223
155 HG1 THR 452 HG1 THR 452 1.863 6.506 8.941
156 HG21 THR 452 HG21 THR 452 3.587 6.665 11.466
157 HG22 THR 452 HG22 THR 452 4.295 8.165 10.866
158 HG23 THR 452 HG23 THR 452 5.254 6.684 10.890
159 H LEU 453 HN LEU 453 5.526 6.414 6.076
160 HA LEU 453 HA LEU 453 6.921 4.791 5.362
161 HB2 LEU 453 HB2 LEU 453 8.357 5.750 7.780
162 HB3 LEU 453 HB1 LEU 453 8.844 4.199 7.125
163 HG LEU 453 HG LEU 453 10.134 6.279 6.366
164 HD11 LEU 453 HD11 LEU 453 9.128 4.001 4.827
165 HD12 LEU 453 HD12 LEU 453 10.783 4.551 5.087
166 HD13 LEU 453 HD13 LEU 453 9.782 5.316 3.852
167 HD21 LEU 453 HD21 LEU 453 9.200 7.511 4.495
168 HD22 LEU 453 HD22 LEU 453 8.161 7.687 5.910
169 HD23 LEU 453 HD23 LEU 453 7.700 6.586 4.608
170 H GLU 454 HN GLU 454 5.061 3.494 5.567
171 HA GLU 454 HA GLU 454 5.268 1.439 7.657
172 HB2 GLU 454 HB2 GLU 454 2.675 2.638 6.660
173 HB3 GLU 454 HB1 GLU 454 2.854 1.419 7.912
174 HG2 GLU 454 HG2 GLU 454 3.983 3.043 9.338
175 HG3 GLU 454 HG1 GLU 454 3.821 4.264 8.076
176 H SER 455 HN SER 455 5.422 -0.534 6.734
177 HA SER 455 HA SER 455 4.473 -0.900 4.007
178 HB2 SER 455 HB2 SER 455 6.671 -1.872 4.977
179 HB3 SER 455 HB1 SER 455 5.632 -3.066 5.758
180 HG SER 455 HG SER 455 6.371 -2.793 3.118
181 H THR 456 HN THR 456 2.393 -1.417 3.681
182 HA THR 456 HA THR 456 1.038 -2.945 5.783
183 HB THR 456 HB THR 456 0.385 -0.687 6.249
184 HG1 THR 456 HG1 THR 456 -1.270 -2.352 6.242
185 HG21 THR 456 HG21 THR 456 -0.587 0.824 4.676
186 HG22 THR 456 HG22 THR 456 -0.621 -0.413 3.425
187 HG23 THR 456 HG23 THR 456 0.922 0.237 3.975
188 H TRP 457 HN TRP 457 -0.157 -4.541 5.078
189 HA TRP 457 HA TRP 457 -0.278 -4.843 2.162
190 HB2 TRP 457 HB2 TRP 457 0.423 -6.880 4.298
191 HB3 TRP 457 HB1 TRP 457 0.156 -7.291 2.597
192 HD1 TRP 457 HD1 TRP 457 2.298 -4.670 4.503
193 HE1 TRP 457 HE1 TRP 457 4.546 -4.408 3.300
194 HE3 TRP 457 HE3 TRP 457 1.641 -8.139 0.796
195 HZ2 TRP 457 HZ2 TRP 457 5.851 -5.472 1.085
196 HZ3 TRP 457 HZ3 TRP 457 3.477 -8.486 -0.808
197 HH2 TRP 457 HH2 TRP 457 5.551 -7.196 -0.659
198 H GLU 458 HN GLU 458 -2.130 -3.949 4.346
199 HA GLU 458 HA GLU 458 -4.442 -5.469 3.346
200 HB2 GLU 458 HB2 GLU 458 -4.129 -5.391 5.860
201 HB3 GLU 458 HB1 GLU 458 -4.361 -3.650 5.763
202 HG2 GLU 458 HG2 GLU 458 -6.402 -4.815 6.417
203 HG3 GLU 458 HG1 GLU 458 -6.590 -3.961 4.885
204 H LYS 459 HN LYS 459 -6.168 -4.200 2.481
205 HA LYS 459 HA LYS 459 -5.191 -1.962 1.021
206 HB2 LYS 459 HB2 LYS 459 -8.004 -3.043 1.248
207 HB3 LYS 459 HB1 LYS 459 -7.456 -1.868 0.057
208 HG2 LYS 459 HG2 LYS 459 -5.874 -3.521 -0.829
209 HG3 LYS 459 HG1 LYS 459 -6.464 -4.699 0.339
210 HD2 LYS 459 HD2 LYS 459 -7.599 -5.231 -1.630
211 HD3 LYS 459 HD1 LYS 459 -8.771 -4.293 -0.708
212 HE2 LYS 459 HE2 LYS 459 -6.979 -3.065 -2.791
213 HE3 LYS 459 HE1 LYS 459 -8.554 -3.751 -3.181
214 HZ1 LYS 459 HZ1 LYS 459 -8.866 -1.456 -2.872
215 HZ2 LYS 459 HZ2 LYS 459 -7.971 -1.425 -1.436
216 HZ3 LYS 459 HZ3 LYS 459 -9.485 -2.187 -1.471
217 HA PRO 460 HA PRO 460 -5.609 1.260 4.031
218 HB2 PRO 460 HB2 PRO 460 -6.040 2.744 1.461
219 HB3 PRO 460 HB1 PRO 460 -5.026 3.172 2.846
220 HG2 PRO 460 HG2 PRO 460 -3.910 2.136 0.694
221 HG3 PRO 460 HG1 PRO 460 -3.396 1.593 2.302
222 HD2 PRO 460 HD2 PRO 460 -5.111 0.210 0.295
223 HD3 PRO 460 HD1 PRO 460 -3.949 -0.469 1.450
224 H GLN 461 HN GLN 461 -7.263 2.057 5.138
225 HA GLN 461 HA GLN 461 -9.934 1.784 3.966
226 HB2 GLN 461 HB2 GLN 461 -10.777 1.551 6.206
227 HB3 GLN 461 HB1 GLN 461 -9.400 0.476 6.017
228 HG2 GLN 461 HG2 GLN 461 -9.231 3.191 7.297
229 HG3 GLN 461 HG1 GLN 461 -9.519 1.703 8.192
230 HE21 GLN 461 HE21 GLN 461 -7.756 0.077 6.600
231 HE22 GLN 461 HE22 GLN 461 -6.140 0.553 7.006
232 H GLU 462 HN GLU 462 -7.713 4.197 4.787
233 HA GLU 462 HA GLU 462 -9.784 6.131 5.464
234 HB2 GLU 462 HB2 GLU 462 -7.732 7.728 5.521
235 HB3 GLU 462 HB1 GLU 462 -7.958 6.564 6.813
236 HG2 GLU 462 HG2 GLU 462 -5.616 6.780 6.030
237 HG3 GLU 462 HG1 GLU 462 -6.257 5.141 5.930
238 H LEU 463 HN LEU 463 -8.249 4.922 2.749
239 HA LEU 463 HA LEU 463 -8.710 7.294 1.127
240 HB2 LEU 463 HB2 LEU 463 -6.675 5.846 0.862
241 HB3 LEU 463 HB1 LEU 463 -7.727 4.564 0.292
242 HG LEU 463 HG LEU 463 -8.397 5.997 -1.616
243 HD11 LEU 463 HD11 LEU 463 -6.264 7.857 -0.576
244 HD12 LEU 463 HD12 LEU 463 -7.998 8.174 -0.582
245 HD13 LEU 463 HD13 LEU 463 -7.127 8.017 -2.107
246 HD21 LEU 463 HD21 LEU 463 -6.595 4.367 -1.854
247 HD22 LEU 463 HD22 LEU 463 -5.425 5.576 -1.323
248 HD23 LEU 463 HD23 LEU 463 -6.293 5.795 -2.842
249 H LYS 464 HN LYS 464 -10.578 4.964 2.368
250 HA LYS 464 HA LYS 464 -12.121 4.168 0.087
251 HB2 LYS 464 HB2 LYS 464 -12.751 4.036 3.044
252 HB3 LYS 464 HB1 LYS 464 -13.727 3.301 1.782
253 HG2 LYS 464 HG2 LYS 464 -10.865 2.601 2.393
254 HG3 LYS 464 HG1 LYS 464 -12.278 1.691 2.924
255 HD2 LYS 464 HD2 LYS 464 -12.891 1.331 0.558
256 HD3 LYS 464 HD1 LYS 464 -11.417 2.171 0.072
257 HE2 LYS 464 HE2 LYS 464 -11.023 -0.200 -0.021
258 HE3 LYS 464 HE1 LYS 464 -10.101 0.481 1.319
259 HZ1 LYS 464 HZ1 LYS 464 -12.673 -0.992 1.516
260 HZ2 LYS 464 HZ2 LYS 464 -11.877 -0.267 2.827
261 HZ3 LYS 464 HZ3 LYS 464 -11.149 -1.555 2.001
Start of MODEL 17
1 H SER 433 HT1 SER 433 -3.152 12.504 -3.210
2 HA SER 433 HA SER 433 -2.433 11.372 -1.240
3 HB2 SER 433 HB2 SER 433 -3.608 9.431 -3.247
4 HB3 SER 433 HB1 SER 433 -3.752 9.334 -1.493
5 HG SER 433 HG SER 433 -5.539 10.342 -2.838
6 H GLU 434 HN GLU 434 -0.557 10.674 -0.453
7 HA GLU 434 HA GLU 434 1.332 9.380 -2.226
8 HB2 GLU 434 HB2 GLU 434 2.031 11.215 -0.745
9 HB3 GLU 434 HB1 GLU 434 1.625 10.237 0.656
10 HG2 GLU 434 HG2 GLU 434 3.344 8.615 0.002
11 HG3 GLU 434 HG1 GLU 434 3.765 9.633 -1.375
12 H TRP 435 HN TRP 435 0.291 7.361 -2.495
13 HA TRP 435 HA TRP 435 0.995 5.462 -0.392
14 HB2 TRP 435 HB2 TRP 435 -1.755 5.479 -1.690
15 HB3 TRP 435 HB1 TRP 435 -1.171 4.296 -0.523
16 HD1 TRP 435 HD1 TRP 435 -2.736 7.722 -0.767
17 HE1 TRP 435 HE1 TRP 435 -3.170 8.654 1.594
18 HE3 TRP 435 HE3 TRP 435 -0.240 4.203 1.969
19 HZ2 TRP 435 HZ2 TRP 435 -2.533 7.986 4.268
20 HZ3 TRP 435 HZ3 TRP 435 -0.179 4.432 4.417
21 HH2 TRP 435 HH2 TRP 435 -1.264 6.304 5.541
22 H THR 436 HN THR 436 2.236 3.933 -1.355
23 HA THR 436 HA THR 436 2.162 3.752 -4.257
24 HB THR 436 HB THR 436 4.084 2.561 -2.252
25 HG1 THR 436 HG1 THR 436 5.188 4.210 -4.064
26 HG21 THR 436 HG21 THR 436 3.883 1.067 -4.189
27 HG22 THR 436 HG22 THR 436 5.442 1.895 -4.200
28 HG23 THR 436 HG23 THR 436 4.152 2.430 -5.277
29 H GLU 437 HN GLU 437 0.440 2.575 -4.832
30 HA GLU 437 HA GLU 437 0.120 -0.137 -3.837
31 HB2 GLU 437 HB2 GLU 437 -1.926 1.097 -4.349
32 HB3 GLU 437 HB1 GLU 437 -1.361 1.416 -5.983
33 HG2 GLU 437 HG2 GLU 437 -1.376 -1.055 -6.377
34 HG3 GLU 437 HG1 GLU 437 -2.158 -1.236 -4.808
35 H ARG 438 HN ARG 438 1.967 -1.182 -4.479
36 HA ARG 438 HA ARG 438 2.464 -1.226 -7.376
37 HB2 ARG 438 HB2 ARG 438 4.305 -0.441 -5.756
38 HB3 ARG 438 HB1 ARG 438 4.435 -2.134 -5.294
39 HG2 ARG 438 HG2 ARG 438 4.998 -2.755 -7.555
40 HG3 ARG 438 HG1 ARG 438 4.747 -1.097 -8.104
41 HD2 ARG 438 HD2 ARG 438 6.539 -0.431 -6.448
42 HD3 ARG 438 HD1 ARG 438 6.890 -2.149 -6.284
43 HE ARG 438 HE ARG 438 6.934 -1.594 -8.993
44 HH11 ARG 438 HH11 ARG 438 8.710 -0.716 -6.120
45 HH12 ARG 438 HH12 ARG 438 10.169 -0.316 -6.973
46 HH21 ARG 438 HH21 ARG 438 8.821 -1.029 -10.148
47 HH22 ARG 438 HH22 ARG 438 10.224 -0.455 -9.278
48 H LYS 439 HN LYS 439 1.688 -2.931 -8.318
49 HA LYS 439 HA LYS 439 1.068 -5.257 -6.713
50 HB2 LYS 439 HB2 LYS 439 -0.200 -5.964 -8.799
51 HB3 LYS 439 HB1 LYS 439 -0.804 -4.572 -7.922
52 HG2 LYS 439 HG2 LYS 439 0.449 -3.133 -9.571
53 HG3 LYS 439 HG1 LYS 439 0.715 -4.604 -10.512
54 HD2 LYS 439 HD2 LYS 439 -1.983 -3.522 -9.696
55 HD3 LYS 439 HD1 LYS 439 -1.244 -3.316 -11.285
56 HE2 LYS 439 HE2 LYS 439 -1.798 -6.003 -10.043
57 HE3 LYS 439 HE1 LYS 439 -2.931 -5.172 -11.108
58 HZ1 LYS 439 HZ1 LYS 439 -1.563 -6.790 -12.290
59 HZ2 LYS 439 HZ2 LYS 439 -0.157 -5.953 -11.843
60 HZ3 LYS 439 HZ3 LYS 439 -1.297 -5.214 -12.863
61 H THR 440 HN THR 440 2.659 -6.625 -6.481
62 HA THR 440 HA THR 440 4.431 -7.236 -8.703
63 HB THR 440 HB THR 440 5.554 -8.773 -7.089
64 HG1 THR 440 HG1 THR 440 3.292 -8.187 -5.624
65 HG21 THR 440 HG21 THR 440 5.127 -5.947 -6.128
66 HG22 THR 440 HG22 THR 440 6.329 -6.481 -7.305
67 HG23 THR 440 HG23 THR 440 6.445 -7.005 -5.624
68 H ALA 441 HN ALA 441 4.640 -9.225 -9.691
69 HA ALA 441 HA ALA 441 2.158 -10.615 -10.053
70 HB1 ALA 441 HB1 ALA 441 4.881 -11.145 -11.239
71 HB2 ALA 441 HB2 ALA 441 3.614 -10.137 -11.946
72 HB3 ALA 441 HB3 ALA 441 3.365 -11.874 -11.767
73 H ASP 442 HN ASP 442 4.158 -10.832 -7.605
74 HA ASP 442 HA ASP 442 4.487 -13.674 -7.355
75 HB2 ASP 442 HB2 ASP 442 5.966 -11.945 -6.264
76 HB3 ASP 442 HB1 ASP 442 4.628 -11.565 -5.189
77 H GLY 443 HN GLY 443 1.857 -11.769 -7.368
78 HA2 GLY 443 HA2 GLY 443 -0.340 -12.507 -7.006
79 HA3 GLY 443 HA1 GLY 443 0.280 -13.753 -5.931
80 H LYS 444 HN LYS 444 1.274 -10.424 -5.643
81 HA LYS 444 HA LYS 444 -0.509 -9.964 -3.399
82 HB2 LYS 444 HB2 LYS 444 1.525 -9.440 -1.923
83 HB3 LYS 444 HB1 LYS 444 1.107 -11.130 -2.167
84 HG2 LYS 444 HG2 LYS 444 2.873 -11.394 -3.772
85 HG3 LYS 444 HG1 LYS 444 3.228 -9.667 -3.725
86 HD2 LYS 444 HD2 LYS 444 4.825 -10.990 -2.402
87 HD3 LYS 444 HD1 LYS 444 3.928 -9.839 -1.414
88 HE2 LYS 444 HE2 LYS 444 4.110 -11.967 -0.269
89 HE3 LYS 444 HE1 LYS 444 2.432 -11.645 -0.692
90 HZ1 LYS 444 HZ1 LYS 444 3.380 -13.971 -1.100
91 HZ2 LYS 444 HZ2 LYS 444 4.142 -13.290 -2.458
92 HZ3 LYS 444 HZ3 LYS 444 2.450 -13.269 -2.325
93 H THR 445 HN THR 445 -0.972 -7.881 -3.171
94 HA THR 445 HA THR 445 0.643 -5.939 -4.652
95 HB THR 445 HB THR 445 -2.083 -5.378 -3.505
96 HG1 THR 445 HG1 THR 445 -2.277 -7.221 -4.881
97 HG21 THR 445 HG21 THR 445 -2.174 -3.726 -5.307
98 HG22 THR 445 HG22 THR 445 -0.590 -4.251 -5.884
99 HG23 THR 445 HG23 THR 445 -0.743 -3.480 -4.301
100 H TYR 446 HN TYR 446 2.014 -4.743 -3.465
101 HA TYR 446 HA TYR 446 1.349 -4.468 -0.625
102 HB2 TYR 446 HB2 TYR 446 3.630 -4.201 -0.110
103 HB3 TYR 446 HB1 TYR 446 3.517 -5.573 -1.189
104 HD1 TYR 446 HD1 TYR 446 4.098 -5.095 -3.708
105 HD2 TYR 446 HD2 TYR 446 5.169 -2.542 -0.476
106 HE1 TYR 446 HE1 TYR 446 5.917 -4.135 -5.065
107 HE2 TYR 446 HE2 TYR 446 6.978 -1.575 -1.828
108 HH TYR 446 HH TYR 446 8.431 -2.452 -3.845
109 H TYR 447 HN TYR 447 0.752 -2.629 0.131
110 HA TYR 447 HA TYR 447 1.267 -0.228 -1.447
111 HB2 TYR 447 HB2 TYR 447 -0.509 -0.633 0.971
112 HB3 TYR 447 HB1 TYR 447 -0.340 0.871 0.080
113 HD1 TYR 447 HD2 TYR 447 -1.190 -2.727 -0.636
114 HD2 TYR 447 HD1 TYR 447 -2.019 1.382 -1.391
115 HE1 TYR 447 HE2 TYR 447 -3.066 -3.375 -2.074
116 HE2 TYR 447 HE1 TYR 447 -3.903 0.735 -2.830
117 HH TYR 447 HH TYR 447 -4.604 -1.220 -4.177
118 H TYR 448 HN TYR 448 3.500 -0.084 -0.940
119 HA TYR 448 HA TYR 448 4.191 0.413 1.833
120 HB2 TYR 448 HB2 TYR 448 5.889 -0.717 0.622
121 HB3 TYR 448 HB1 TYR 448 5.788 0.410 -0.724
122 HD1 TYR 448 HD1 TYR 448 6.182 1.019 2.964
123 HD2 TYR 448 HD2 TYR 448 7.850 1.408 -0.935
124 HE1 TYR 448 HE1 TYR 448 8.055 2.337 3.902
125 HE2 TYR 448 HE2 TYR 448 9.717 2.708 -0.012
126 HH TYR 448 HH TYR 448 10.467 2.816 3.219
127 H ASN 449 HN ASN 449 4.164 2.261 2.785
128 HA ASN 449 HA ASN 449 3.716 4.670 1.163
129 HB2 ASN 449 HB2 ASN 449 1.653 4.293 2.113
130 HB3 ASN 449 HB1 ASN 449 2.337 3.585 3.573
131 HD21 ASN 449 HD21 ASN 449 1.685 6.570 1.874
132 HD22 ASN 449 HD22 ASN 449 1.771 7.586 3.269
133 H ASN 450 HN ASN 450 4.693 6.528 1.727
134 HA ASN 450 HA ASN 450 6.940 6.312 3.567
135 HB2 ASN 450 HB2 ASN 450 7.601 7.125 1.462
136 HB3 ASN 450 HB1 ASN 450 6.202 8.180 1.327
137 HD21 ASN 450 HD21 ASN 450 6.246 10.186 2.224
138 HD22 ASN 450 HD22 ASN 450 7.694 10.897 2.879
139 H ARG 451 HN ARG 451 3.784 7.539 3.534
140 HA ARG 451 HA ARG 451 4.036 9.809 5.142
141 HB2 ARG 451 HB2 ARG 451 1.799 7.989 4.538
142 HB3 ARG 451 HB1 ARG 451 1.646 9.020 5.957
143 HG2 ARG 451 HG2 ARG 451 2.159 9.918 3.128
144 HG3 ARG 451 HG1 ARG 451 0.671 10.134 4.060
145 HD2 ARG 451 HD2 ARG 451 1.816 11.557 5.636
146 HD3 ARG 451 HD1 ARG 451 3.358 11.259 4.840
147 HE ARG 451 HE ARG 451 1.326 12.453 3.164
148 HH11 ARG 451 HH11 ARG 451 3.974 13.008 5.384
149 HH12 ARG 451 HH12 ARG 451 4.318 14.598 4.782
150 HH21 ARG 451 HH21 ARG 451 1.769 14.550 2.365
151 HH22 ARG 451 HH22 ARG 451 3.061 15.486 3.075
152 H THR 452 HN THR 452 3.488 6.457 6.119
153 HA THR 452 HA THR 452 4.516 7.238 8.760
154 HB THR 452 HB THR 452 2.213 6.670 9.018
155 HG1 THR 452 HG1 THR 452 4.102 4.791 9.943
156 HG21 THR 452 HG21 THR 452 2.843 4.074 7.616
157 HG22 THR 452 HG22 THR 452 1.873 5.400 6.974
158 HG23 THR 452 HG23 THR 452 1.302 4.484 8.370
159 H LEU 453 HN LEU 453 5.434 5.738 6.040
160 HA LEU 453 HA LEU 453 6.987 4.201 5.447
161 HB2 LEU 453 HB2 LEU 453 7.745 4.761 8.261
162 HB3 LEU 453 HB1 LEU 453 8.423 3.322 7.526
163 HG LEU 453 HG LEU 453 9.833 5.443 7.419
164 HD11 LEU 453 HD11 LEU 453 10.002 3.337 5.964
165 HD12 LEU 453 HD12 LEU 453 10.776 4.807 5.373
166 HD13 LEU 453 HD13 LEU 453 9.222 4.301 4.710
167 HD21 LEU 453 HD21 LEU 453 9.328 7.019 5.661
168 HD22 LEU 453 HD22 LEU 453 7.971 6.954 6.788
169 HD23 LEU 453 HD23 LEU 453 7.871 6.118 5.234
170 H GLU 454 HN GLU 454 4.393 3.349 6.000
171 HA GLU 454 HA GLU 454 4.802 0.739 7.276
172 HB2 GLU 454 HB2 GLU 454 2.362 2.409 6.833
173 HB3 GLU 454 HB1 GLU 454 2.200 0.667 6.984
174 HG2 GLU 454 HG2 GLU 454 3.621 1.012 9.146
175 HG3 GLU 454 HG1 GLU 454 3.040 2.674 9.008
176 H SER 455 HN SER 455 4.815 -1.045 6.126
177 HA SER 455 HA SER 455 3.915 -0.978 3.369
178 HB2 SER 455 HB2 SER 455 4.725 -3.463 3.550
179 HB3 SER 455 HB1 SER 455 5.918 -2.165 3.485
180 HG SER 455 HG SER 455 5.387 -3.944 5.481
181 H THR 456 HN THR 456 1.781 -1.012 3.260
182 HA THR 456 HA THR 456 0.265 -2.735 5.077
183 HB THR 456 HB THR 456 -1.724 -1.453 4.186
184 HG1 THR 456 HG1 THR 456 0.109 -0.549 2.474
185 HG21 THR 456 HG21 THR 456 -1.125 0.670 5.412
186 HG22 THR 456 HG22 THR 456 0.503 0.012 5.596
187 HG23 THR 456 HG23 THR 456 -0.873 -0.822 6.317
188 H TRP 457 HN TRP 457 -0.513 -4.593 4.373
189 HA TRP 457 HA TRP 457 -0.430 -5.085 1.476
190 HB2 TRP 457 HB2 TRP 457 -0.051 -7.012 3.790
191 HB3 TRP 457 HB1 TRP 457 -0.060 -7.478 2.082
192 HD1 TRP 457 HD1 TRP 457 1.870 -5.025 4.380
193 HE1 TRP 457 HE1 TRP 457 4.256 -4.764 3.480
194 HE3 TRP 457 HE3 TRP 457 1.550 -8.106 0.306
195 HZ2 TRP 457 HZ2 TRP 457 5.783 -5.667 1.328
196 HZ3 TRP 457 HZ3 TRP 457 3.552 -8.382 -1.104
197 HH2 TRP 457 HH2 TRP 457 5.633 -7.208 -0.591
198 H GLU 458 HN GLU 458 -2.446 -4.524 3.986
199 HA GLU 458 HA GLU 458 -4.694 -5.536 2.386
200 HB2 GLU 458 HB2 GLU 458 -4.362 -5.721 5.106
201 HB3 GLU 458 HB1 GLU 458 -5.281 -4.228 4.966
202 HG2 GLU 458 HG2 GLU 458 -6.065 -6.970 4.027
203 HG3 GLU 458 HG1 GLU 458 -6.836 -5.986 5.268
204 H LYS 459 HN LYS 459 -6.073 -4.015 1.496
205 HA LYS 459 HA LYS 459 -4.833 -1.624 0.704
206 HB2 LYS 459 HB2 LYS 459 -7.754 -2.378 0.514
207 HB3 LYS 459 HB1 LYS 459 -6.951 -1.120 -0.418
208 HG2 LYS 459 HG2 LYS 459 -5.561 -2.768 -1.511
209 HG3 LYS 459 HG1 LYS 459 -6.261 -4.048 -0.518
210 HD2 LYS 459 HD2 LYS 459 -8.466 -3.579 -1.503
211 HD3 LYS 459 HD1 LYS 459 -7.732 -2.341 -2.526
212 HE2 LYS 459 HE2 LYS 459 -6.342 -4.004 -3.597
213 HE3 LYS 459 HE1 LYS 459 -6.961 -5.256 -2.522
214 HZ1 LYS 459 HZ1 LYS 459 -9.171 -4.901 -3.465
215 HZ2 LYS 459 HZ2 LYS 459 -8.046 -5.350 -4.657
216 HZ3 LYS 459 HZ3 LYS 459 -8.539 -3.734 -4.523
217 HA PRO 460 HA PRO 460 -5.360 1.064 4.213
218 HB2 PRO 460 HB2 PRO 460 -5.432 3.005 1.928
219 HB3 PRO 460 HB1 PRO 460 -4.536 3.099 3.449
220 HG2 PRO 460 HG2 PRO 460 -3.298 2.387 1.220
221 HG3 PRO 460 HG1 PRO 460 -2.933 1.566 2.751
222 HD2 PRO 460 HD2 PRO 460 -4.503 0.607 0.413
223 HD3 PRO 460 HD1 PRO 460 -3.505 -0.311 1.558
224 H GLN 461 HN GLN 461 -7.092 1.888 5.251
225 HA GLN 461 HA GLN 461 -9.606 1.961 3.744
226 HB2 GLN 461 HB2 GLN 461 -9.359 0.475 5.776
227 HB3 GLN 461 HB1 GLN 461 -9.263 1.939 6.743
228 HG2 GLN 461 HG2 GLN 461 -11.491 2.583 6.055
229 HG3 GLN 461 HG1 GLN 461 -11.591 1.182 4.989
230 HE21 GLN 461 HE21 GLN 461 -11.697 2.309 8.260
231 HE22 GLN 461 HE22 GLN 461 -12.254 0.835 8.972
232 H GLU 462 HN GLU 462 -7.279 4.001 5.127
233 HA GLU 462 HA GLU 462 -9.150 6.180 5.590
234 HB2 GLU 462 HB2 GLU 462 -7.118 7.520 6.144
235 HB3 GLU 462 HB1 GLU 462 -7.339 6.100 7.148
236 HG2 GLU 462 HG2 GLU 462 -5.474 6.133 4.781
237 HG3 GLU 462 HG1 GLU 462 -4.985 6.626 6.398
238 H LEU 463 HN LEU 463 -7.790 4.830 2.940
239 HA LEU 463 HA LEU 463 -7.733 7.387 1.480
240 HB2 LEU 463 HB2 LEU 463 -5.669 6.039 1.363
241 HB3 LEU 463 HB1 LEU 463 -6.584 4.709 0.681
242 HG LEU 463 HG LEU 463 -7.145 6.169 -1.268
243 HD11 LEU 463 HD11 LEU 463 -5.094 8.005 -0.039
244 HD12 LEU 463 HD12 LEU 463 -6.824 8.327 -0.165
245 HD13 LEU 463 HD13 LEU 463 -5.845 8.191 -1.626
246 HD21 LEU 463 HD21 LEU 463 -4.213 5.721 -0.729
247 HD22 LEU 463 HD22 LEU 463 -4.944 5.984 -2.312
248 HD23 LEU 463 HD23 LEU 463 -5.343 4.537 -1.386
249 H LYS 464 HN LYS 464 -9.528 4.570 2.003
250 HA LYS 464 HA LYS 464 -11.445 5.204 -0.027
251 HB2 LYS 464 HB2 LYS 464 -11.250 2.704 -0.873
252 HB3 LYS 464 HB1 LYS 464 -10.291 3.986 -1.600
253 HG2 LYS 464 HG2 LYS 464 -8.342 3.211 -0.738
254 HG3 LYS 464 HG1 LYS 464 -9.108 2.563 0.711
255 HD2 LYS 464 HD2 LYS 464 -9.384 1.354 -2.034
256 HD3 LYS 464 HD1 LYS 464 -8.188 0.839 -0.844
257 HE2 LYS 464 HE2 LYS 464 -11.188 0.701 -0.618
258 HE3 LYS 464 HE1 LYS 464 -10.054 -0.646 -0.695
259 HZ1 LYS 464 HZ1 LYS 464 -9.109 0.249 1.445
260 HZ2 LYS 464 HZ2 LYS 464 -10.663 -0.413 1.556
261 HZ3 LYS 464 HZ3 LYS 464 -10.462 1.272 1.531
Start of MODEL 18
1 H SER 433 HT1 SER 433 3.567 10.008 -4.296
2 HA SER 433 HA SER 433 0.663 9.434 -4.311
3 HB2 SER 433 HB2 SER 433 3.038 7.586 -4.694
4 HB3 SER 433 HB1 SER 433 1.335 7.127 -4.752
5 HG SER 433 HG SER 433 2.501 7.546 -6.821
6 H GLU 434 HN GLU 434 -0.130 9.172 -2.320
7 HA GLU 434 HA GLU 434 1.741 8.918 -0.110
8 HB2 GLU 434 HB2 GLU 434 -0.189 9.344 1.347
9 HB3 GLU 434 HB1 GLU 434 -0.012 10.585 0.119
10 HG2 GLU 434 HG2 GLU 434 -1.941 8.290 -0.106
11 HG3 GLU 434 HG1 GLU 434 -2.355 9.852 0.593
12 H TRP 435 HN TRP 435 -0.744 7.041 -1.722
13 HA TRP 435 HA TRP 435 0.154 4.736 -0.122
14 HB2 TRP 435 HB2 TRP 435 -2.623 5.022 -1.305
15 HB3 TRP 435 HB1 TRP 435 -2.049 3.749 -0.234
16 HD1 TRP 435 HD1 TRP 435 -3.884 6.938 -0.177
17 HE1 TRP 435 HE1 TRP 435 -4.121 7.835 2.228
18 HE3 TRP 435 HE3 TRP 435 -0.564 3.849 2.174
19 HZ2 TRP 435 HZ2 TRP 435 -3.044 7.301 4.778
20 HZ3 TRP 435 HZ3 TRP 435 -0.219 4.117 4.592
21 HH2 TRP 435 HH2 TRP 435 -1.410 5.818 5.867
22 H THR 436 HN THR 436 1.603 3.848 -1.509
23 HA THR 436 HA THR 436 0.967 3.707 -4.344
24 HB THR 436 HB THR 436 3.450 2.923 -2.812
25 HG1 THR 436 HG1 THR 436 4.242 4.801 -3.574
26 HG21 THR 436 HG21 THR 436 4.509 2.510 -4.989
27 HG22 THR 436 HG22 THR 436 2.975 2.811 -5.802
28 HG23 THR 436 HG23 THR 436 3.149 1.411 -4.740
29 H GLU 437 HN GLU 437 -0.494 2.140 -4.771
30 HA GLU 437 HA GLU 437 -0.028 -0.520 -3.706
31 HB2 GLU 437 HB2 GLU 437 -2.012 -1.168 -5.087
32 HB3 GLU 437 HB1 GLU 437 -2.337 0.028 -3.845
33 HG2 GLU 437 HG2 GLU 437 -2.662 1.725 -5.380
34 HG3 GLU 437 HG1 GLU 437 -1.750 0.892 -6.641
35 H ARG 438 HN ARG 438 1.932 -1.040 -4.594
36 HA ARG 438 HA ARG 438 2.075 -1.182 -7.506
37 HB2 ARG 438 HB2 ARG 438 4.038 -0.339 -6.230
38 HB3 ARG 438 HB1 ARG 438 4.170 -1.910 -5.451
39 HG2 ARG 438 HG2 ARG 438 4.547 -2.948 -7.642
40 HG3 ARG 438 HG1 ARG 438 4.468 -1.351 -8.394
41 HD2 ARG 438 HD2 ARG 438 6.377 -0.629 -7.061
42 HD3 ARG 438 HD1 ARG 438 6.448 -2.212 -6.293
43 HE ARG 438 HE ARG 438 6.724 -2.067 -9.205
44 HH11 ARG 438 HH11 ARG 438 8.152 -2.563 -6.057
45 HH12 ARG 438 HH12 ARG 438 9.606 -3.297 -6.674
46 HH21 ARG 438 HH21 ARG 438 8.635 -3.010 -10.047
47 HH22 ARG 438 HH22 ARG 438 9.883 -3.552 -8.959
48 H LYS 439 HN LYS 439 1.088 -2.898 -8.343
49 HA LYS 439 HA LYS 439 0.916 -5.298 -6.730
50 HB2 LYS 439 HB2 LYS 439 -0.659 -6.107 -8.495
51 HB3 LYS 439 HB1 LYS 439 -1.175 -4.654 -7.656
52 HG2 LYS 439 HG2 LYS 439 -0.288 -3.338 -9.602
53 HG3 LYS 439 HG1 LYS 439 -0.068 -4.877 -10.441
54 HD2 LYS 439 HD2 LYS 439 -2.185 -3.934 -11.098
55 HD3 LYS 439 HD1 LYS 439 -2.482 -5.353 -10.094
56 HE2 LYS 439 HE2 LYS 439 -3.994 -3.667 -9.369
57 HE3 LYS 439 HE1 LYS 439 -2.735 -3.790 -8.140
58 HZ1 LYS 439 HZ1 LYS 439 -3.089 -1.502 -8.502
59 HZ2 LYS 439 HZ2 LYS 439 -3.086 -1.674 -10.187
60 HZ3 LYS 439 HZ3 LYS 439 -1.641 -1.861 -9.320
61 H THR 440 HN THR 440 2.649 -6.423 -6.746
62 HA THR 440 HA THR 440 4.140 -6.913 -9.191
63 HB THR 440 HB THR 440 5.674 -8.207 -7.739
64 HG1 THR 440 HG1 THR 440 4.975 -7.639 -5.332
65 HG21 THR 440 HG21 THR 440 5.843 -5.694 -7.984
66 HG22 THR 440 HG22 THR 440 6.604 -6.374 -6.548
67 HG23 THR 440 HG23 THR 440 5.038 -5.574 -6.415
68 H ALA 441 HN ALA 441 4.512 -9.006 -10.044
69 HA ALA 441 HA ALA 441 2.166 -10.636 -10.090
70 HB1 ALA 441 HB1 ALA 441 3.364 -11.967 -11.735
71 HB2 ALA 441 HB2 ALA 441 4.860 -11.114 -11.355
72 HB3 ALA 441 HB3 ALA 441 3.513 -10.245 -12.089
73 H ASP 442 HN ASP 442 4.229 -10.421 -7.723
74 HA ASP 442 HA ASP 442 4.751 -13.190 -7.133
75 HB2 ASP 442 HB2 ASP 442 6.150 -11.283 -6.272
76 HB3 ASP 442 HB1 ASP 442 4.789 -10.794 -5.270
77 H GLY 443 HN GLY 443 2.067 -11.299 -7.257
78 HA2 GLY 443 HA2 GLY 443 -0.119 -12.014 -6.835
79 HA3 GLY 443 HA1 GLY 443 0.515 -13.236 -5.742
80 H LYS 444 HN LYS 444 1.308 -9.796 -5.663
81 HA LYS 444 HA LYS 444 -0.267 -9.496 -3.219
82 HB2 LYS 444 HB2 LYS 444 2.724 -9.089 -3.336
83 HB3 LYS 444 HB1 LYS 444 1.697 -8.602 -1.995
84 HG2 LYS 444 HG2 LYS 444 1.117 -10.899 -1.553
85 HG3 LYS 444 HG1 LYS 444 2.038 -11.430 -2.961
86 HD2 LYS 444 HD2 LYS 444 4.088 -10.557 -1.931
87 HD3 LYS 444 HD1 LYS 444 3.156 -10.064 -0.515
88 HE2 LYS 444 HE2 LYS 444 4.303 -12.192 -0.140
89 HE3 LYS 444 HE1 LYS 444 2.551 -12.381 -0.084
90 HZ1 LYS 444 HZ1 LYS 444 4.223 -12.979 -2.471
91 HZ2 LYS 444 HZ2 LYS 444 2.571 -13.303 -2.278
92 HZ3 LYS 444 HZ3 LYS 444 3.708 -14.141 -1.347
93 H THR 445 HN THR 445 -1.372 -7.683 -3.449
94 HA THR 445 HA THR 445 -0.238 -5.386 -4.834
95 HB THR 445 HB THR 445 -2.413 -4.286 -4.130
96 HG1 THR 445 HG1 THR 445 -2.811 -5.815 -2.398
97 HG21 THR 445 HG21 THR 445 -3.773 -5.468 -5.788
98 HG22 THR 445 HG22 THR 445 -2.612 -6.796 -5.795
99 HG23 THR 445 HG23 THR 445 -2.129 -5.201 -6.374
100 H TYR 446 HN TYR 446 1.457 -4.651 -3.528
101 HA TYR 446 HA TYR 446 0.809 -4.280 -0.705
102 HB2 TYR 446 HB2 TYR 446 3.081 -4.173 -0.212
103 HB3 TYR 446 HB1 TYR 446 2.940 -5.436 -1.413
104 HD1 TYR 446 HD1 TYR 446 3.821 -5.044 -3.720
105 HD2 TYR 446 HD2 TYR 446 4.342 -2.204 -0.594
106 HE1 TYR 446 HE1 TYR 446 5.645 -3.977 -4.989
107 HE2 TYR 446 HE2 TYR 446 6.154 -1.132 -1.859
108 HH TYR 446 HH TYR 446 7.791 -1.777 -3.596
109 H TYR 447 HN TYR 447 0.506 -2.435 0.208
110 HA TYR 447 HA TYR 447 0.942 -0.016 -1.373
111 HB2 TYR 447 HB2 TYR 447 -0.737 -0.493 1.100
112 HB3 TYR 447 HB1 TYR 447 -0.506 1.082 0.354
113 HD1 TYR 447 HD2 TYR 447 -1.547 -2.369 -0.725
114 HD2 TYR 447 HD1 TYR 447 -2.228 1.826 -0.964
115 HE1 TYR 447 HE2 TYR 447 -3.484 -2.773 -2.188
116 HE2 TYR 447 HE1 TYR 447 -4.168 1.430 -2.419
117 HH TYR 447 HH TYR 447 -4.935 -0.378 -4.017
118 H TYR 448 HN TYR 448 3.190 0.232 -1.011
119 HA TYR 448 HA TYR 448 4.042 0.646 1.722
120 HB2 TYR 448 HB2 TYR 448 5.767 -0.256 0.407
121 HB3 TYR 448 HB1 TYR 448 5.425 0.818 -0.946
122 HD1 TYR 448 HD1 TYR 448 6.273 1.311 2.693
123 HD2 TYR 448 HD2 TYR 448 7.121 2.297 -1.363
124 HE1 TYR 448 HE1 TYR 448 8.039 2.873 3.446
125 HE2 TYR 448 HE2 TYR 448 8.883 3.841 -0.625
126 HH TYR 448 HH TYR 448 10.109 3.876 2.518
127 H ASN 449 HN ASN 449 4.132 2.465 2.756
128 HA ASN 449 HA ASN 449 3.201 4.886 1.372
129 HB2 ASN 449 HB2 ASN 449 1.347 4.221 2.570
130 HB3 ASN 449 HB1 ASN 449 2.310 3.512 3.864
131 HD21 ASN 449 HD21 ASN 449 1.158 6.498 2.467
132 HD22 ASN 449 HD22 ASN 449 1.295 7.432 3.917
133 H ASN 450 HN ASN 450 4.063 6.822 1.951
134 HA ASN 450 HA ASN 450 6.560 6.694 3.459
135 HB2 ASN 450 HB2 ASN 450 6.519 7.686 1.162
136 HB3 ASN 450 HB1 ASN 450 5.449 8.945 1.765
137 HD21 ASN 450 HD21 ASN 450 6.846 10.602 1.320
138 HD22 ASN 450 HD22 ASN 450 8.321 10.857 2.184
139 H ARG 451 HN ARG 451 3.340 7.526 3.971
140 HA ARG 451 HA ARG 451 3.561 9.764 5.644
141 HB2 ARG 451 HB2 ARG 451 1.533 7.563 5.621
142 HB3 ARG 451 HB1 ARG 451 1.450 8.907 6.750
143 HG2 ARG 451 HG2 ARG 451 1.316 9.057 3.745
144 HG3 ARG 451 HG1 ARG 451 0.006 9.346 4.889
145 HD2 ARG 451 HD2 ARG 451 2.500 10.994 4.522
146 HD3 ARG 451 HD1 ARG 451 0.853 11.452 4.095
147 HE ARG 451 HE ARG 451 0.979 10.859 6.848
148 HH11 ARG 451 HH11 ARG 451 1.989 13.286 4.540
149 HH12 ARG 451 HH12 ARG 451 2.033 14.571 5.713
150 HH21 ARG 451 HH21 ARG 451 1.056 12.527 8.405
151 HH22 ARG 451 HH22 ARG 451 1.482 14.144 7.914
152 H THR 452 HN THR 452 3.536 6.324 6.471
153 HA THR 452 HA THR 452 4.828 7.041 9.020
154 HB THR 452 HB THR 452 3.844 4.737 9.740
155 HG1 THR 452 HG1 THR 452 1.850 4.317 8.642
156 HG21 THR 452 HG21 THR 452 3.197 6.892 10.710
157 HG22 THR 452 HG22 THR 452 1.799 5.836 10.517
158 HG23 THR 452 HG23 THR 452 2.070 7.156 9.379
159 H LEU 453 HN LEU 453 5.533 5.795 6.094
160 HA LEU 453 HA LEU 453 7.133 4.432 5.225
161 HB2 LEU 453 HB2 LEU 453 8.142 4.854 7.990
162 HB3 LEU 453 HB1 LEU 453 8.841 3.532 7.077
163 HG LEU 453 HG LEU 453 10.099 5.728 6.992
164 HD11 LEU 453 HD11 LEU 453 10.209 3.806 5.306
165 HD12 LEU 453 HD12 LEU 453 10.793 5.384 4.780
166 HD13 LEU 453 HD13 LEU 453 9.202 4.821 4.275
167 HD21 LEU 453 HD21 LEU 453 9.283 7.435 5.483
168 HD22 LEU 453 HD22 LEU 453 8.109 7.177 6.775
169 HD23 LEU 453 HD23 LEU 453 7.826 6.491 5.170
170 H GLU 454 HN GLU 454 4.676 3.438 6.002
171 HA GLU 454 HA GLU 454 5.250 0.785 7.134
172 HB2 GLU 454 HB2 GLU 454 2.799 2.519 7.121
173 HB3 GLU 454 HB1 GLU 454 2.654 0.781 7.341
174 HG2 GLU 454 HG2 GLU 454 4.350 2.569 9.062
175 HG3 GLU 454 HG1 GLU 454 2.700 2.077 9.449
176 H SER 455 HN SER 455 4.947 -0.985 5.936
177 HA SER 455 HA SER 455 3.704 -0.663 3.314
178 HB2 SER 455 HB2 SER 455 4.650 -2.942 2.863
179 HB3 SER 455 HB1 SER 455 5.870 -1.721 3.223
180 HG SER 455 HG SER 455 6.388 -2.742 4.998
181 H THR 456 HN THR 456 1.617 -0.976 3.276
182 HA THR 456 HA THR 456 0.398 -2.814 5.206
183 HB THR 456 HB THR 456 -1.759 -1.734 4.486
184 HG1 THR 456 HG1 THR 456 -0.644 -0.936 2.456
185 HG21 THR 456 HG21 THR 456 0.282 0.248 5.500
186 HG22 THR 456 HG22 THR 456 -0.460 -1.002 6.497
187 HG23 THR 456 HG23 THR 456 -1.459 0.265 5.783
188 H TRP 457 HN TRP 457 0.102 -4.789 4.490
189 HA TRP 457 HA TRP 457 -0.262 -5.223 1.622
190 HB2 TRP 457 HB2 TRP 457 0.506 -7.158 3.837
191 HB3 TRP 457 HB1 TRP 457 0.378 -7.574 2.120
192 HD1 TRP 457 HD1 TRP 457 2.321 -5.053 4.335
193 HE1 TRP 457 HE1 TRP 457 4.581 -4.553 3.232
194 HE3 TRP 457 HE3 TRP 457 1.864 -7.985 0.162
195 HZ2 TRP 457 HZ2 TRP 457 5.968 -5.245 0.902
196 HZ3 TRP 457 HZ3 TRP 457 3.737 -8.029 -1.441
197 HH2 TRP 457 HH2 TRP 457 5.751 -6.704 -1.074
198 H GLU 458 HN GLU 458 -1.983 -4.648 4.230
199 HA GLU 458 HA GLU 458 -4.387 -5.794 2.979
200 HB2 GLU 458 HB2 GLU 458 -4.232 -6.330 5.370
201 HB3 GLU 458 HB1 GLU 458 -3.975 -4.635 5.754
202 HG2 GLU 458 HG2 GLU 458 -6.244 -5.280 6.264
203 HG3 GLU 458 HG1 GLU 458 -6.225 -4.112 4.944
204 H LYS 459 HN LYS 459 -5.800 -4.324 2.071
205 HA LYS 459 HA LYS 459 -4.642 -1.894 1.218
206 HB2 LYS 459 HB2 LYS 459 -7.496 -2.860 0.985
207 HB3 LYS 459 HB1 LYS 459 -6.808 -1.509 0.092
208 HG2 LYS 459 HG2 LYS 459 -5.298 -2.960 -1.064
209 HG3 LYS 459 HG1 LYS 459 -5.769 -4.328 -0.059
210 HD2 LYS 459 HD2 LYS 459 -8.059 -4.167 -0.978
211 HD3 LYS 459 HD1 LYS 459 -7.513 -2.862 -2.037
212 HE2 LYS 459 HE2 LYS 459 -5.979 -4.331 -3.155
213 HE3 LYS 459 HE1 LYS 459 -6.305 -5.626 -2.003
214 HZ1 LYS 459 HZ1 LYS 459 -8.623 -5.636 -2.807
215 HZ2 LYS 459 HZ2 LYS 459 -7.501 -6.051 -4.007
216 HZ3 LYS 459 HZ3 LYS 459 -8.197 -4.506 -4.004
217 HA PRO 460 HA PRO 460 -5.629 0.559 4.817
218 HB2 PRO 460 HB2 PRO 460 -4.916 2.963 3.614
219 HB3 PRO 460 HB1 PRO 460 -3.831 1.899 4.513
220 HG2 PRO 460 HG2 PRO 460 -4.164 2.225 1.588
221 HG3 PRO 460 HG1 PRO 460 -2.721 1.806 2.518
222 HD2 PRO 460 HD2 PRO 460 -4.145 -0.012 1.078
223 HD3 PRO 460 HD1 PRO 460 -3.221 -0.428 2.533
224 H GLN 461 HN GLN 461 -7.534 1.255 5.398
225 HA GLN 461 HA GLN 461 -9.602 1.643 3.476
226 HB2 GLN 461 HB2 GLN 461 -11.092 1.798 5.345
227 HB3 GLN 461 HB1 GLN 461 -9.924 0.533 5.683
228 HG2 GLN 461 HG2 GLN 461 -9.818 3.334 6.784
229 HG3 GLN 461 HG1 GLN 461 -10.426 1.925 7.645
230 HE21 GLN 461 HE21 GLN 461 -8.199 3.765 8.240
231 HE22 GLN 461 HE22 GLN 461 -6.797 2.757 8.413
232 H GLU 462 HN GLU 462 -7.388 3.797 4.934
233 HA GLU 462 HA GLU 462 -9.203 6.043 4.935
234 HB2 GLU 462 HB2 GLU 462 -7.369 7.350 5.784
235 HB3 GLU 462 HB1 GLU 462 -7.468 5.835 6.665
236 HG2 GLU 462 HG2 GLU 462 -5.612 4.963 5.275
237 HG3 GLU 462 HG1 GLU 462 -5.485 6.554 4.522
238 H LEU 463 HN LEU 463 -7.759 4.458 2.519
239 HA LEU 463 HA LEU 463 -6.939 6.678 0.882
240 HB2 LEU 463 HB2 LEU 463 -6.363 4.087 0.756
241 HB3 LEU 463 HB1 LEU 463 -7.796 4.039 -0.246
242 HG LEU 463 HG LEU 463 -5.475 5.867 -0.851
243 HD11 LEU 463 HD11 LEU 463 -4.659 3.576 -0.780
244 HD12 LEU 463 HD12 LEU 463 -4.718 4.175 -2.439
245 HD13 LEU 463 HD13 LEU 463 -5.964 3.070 -1.856
246 HD21 LEU 463 HD21 LEU 463 -7.706 4.761 -2.554
247 HD22 LEU 463 HD22 LEU 463 -6.395 5.798 -3.120
248 HD23 LEU 463 HD23 LEU 463 -7.575 6.418 -1.964
249 H LYS 464 HN LYS 464 -9.829 5.191 1.833
250 HA LYS 464 HA LYS 464 -12.009 5.601 1.499
251 HB2 LYS 464 HB2 LYS 464 -10.969 8.036 0.054
252 HB3 LYS 464 HB1 LYS 464 -12.677 7.726 0.333
253 HG2 LYS 464 HG2 LYS 464 -10.549 8.147 2.418
254 HG3 LYS 464 HG1 LYS 464 -11.859 9.248 1.996
255 HD2 LYS 464 HD2 LYS 464 -12.298 6.472 3.090
256 HD3 LYS 464 HD1 LYS 464 -12.210 7.912 4.099
257 HE2 LYS 464 HE2 LYS 464 -14.511 7.496 3.755
258 HE3 LYS 464 HE1 LYS 464 -14.102 8.851 2.708
259 HZ1 LYS 464 HZ1 LYS 464 -14.107 7.434 0.820
260 HZ2 LYS 464 HZ2 LYS 464 -15.530 7.115 1.673
261 HZ3 LYS 464 HZ3 LYS 464 -14.230 6.036 1.768
Start of MODEL 19
1 H SER 433 HT1 SER 433 1.915 10.260 -4.808
2 HA SER 433 HA SER 433 -0.572 10.470 -3.229
3 HB2 SER 433 HB2 SER 433 0.550 8.216 -4.914
4 HB3 SER 433 HB1 SER 433 -1.007 8.226 -4.086
5 HG SER 433 HG SER 433 -0.816 8.848 -6.478
6 H GLU 434 HN GLU 434 -0.463 9.818 -1.186
7 HA GLU 434 HA GLU 434 2.115 9.175 -0.102
8 HB2 GLU 434 HB2 GLU 434 0.921 9.296 2.079
9 HB3 GLU 434 HB1 GLU 434 0.709 10.726 1.075
10 HG2 GLU 434 HG2 GLU 434 -1.447 9.501 0.282
11 HG3 GLU 434 HG1 GLU 434 -1.253 8.601 1.783
12 H TRP 435 HN TRP 435 -0.312 7.271 -1.383
13 HA TRP 435 HA TRP 435 0.624 4.926 0.139
14 HB2 TRP 435 HB2 TRP 435 -2.091 5.148 -1.184
15 HB3 TRP 435 HB1 TRP 435 -1.543 3.909 -0.061
16 HD1 TRP 435 HD1 TRP 435 -3.437 7.074 -0.147
17 HE1 TRP 435 HE1 TRP 435 -3.774 8.010 2.222
18 HE3 TRP 435 HE3 TRP 435 -0.214 4.039 2.385
19 HZ2 TRP 435 HZ2 TRP 435 -2.784 7.549 4.817
20 HZ3 TRP 435 HZ3 TRP 435 0.040 4.352 4.805
21 HH2 TRP 435 HH2 TRP 435 -1.187 6.097 5.994
22 H THR 436 HN THR 436 1.885 3.691 -1.098
23 HA THR 436 HA THR 436 1.563 3.734 -3.995
24 HB THR 436 HB THR 436 3.643 2.400 -2.250
25 HG1 THR 436 HG1 THR 436 4.548 4.296 -2.410
26 HG21 THR 436 HG21 THR 436 3.283 1.063 -4.272
27 HG22 THR 436 HG22 THR 436 4.836 1.902 -4.358
28 HG23 THR 436 HG23 THR 436 3.454 2.509 -5.270
29 H GLU 437 HN GLU 437 -0.143 2.510 -4.600
30 HA GLU 437 HA GLU 437 -0.378 -0.169 -3.481
31 HB2 GLU 437 HB2 GLU 437 -2.466 -0.361 -4.736
32 HB3 GLU 437 HB1 GLU 437 -2.463 1.097 -3.765
33 HG2 GLU 437 HG2 GLU 437 -1.892 1.007 -6.721
34 HG3 GLU 437 HG1 GLU 437 -3.460 1.375 -6.010
35 H ARG 438 HN ARG 438 1.418 -1.207 -4.267
36 HA ARG 438 HA ARG 438 1.728 -1.201 -7.184
37 HB2 ARG 438 HB2 ARG 438 3.742 -0.578 -5.894
38 HB3 ARG 438 HB1 ARG 438 3.705 -2.150 -5.101
39 HG2 ARG 438 HG2 ARG 438 3.975 -3.246 -7.272
40 HG3 ARG 438 HG1 ARG 438 4.039 -1.669 -8.053
41 HD2 ARG 438 HD2 ARG 438 6.058 -1.125 -6.777
42 HD3 ARG 438 HD1 ARG 438 5.991 -2.713 -6.007
43 HE ARG 438 HE ARG 438 6.148 -2.543 -8.932
44 HH11 ARG 438 HH11 ARG 438 7.650 -3.380 -5.883
45 HH12 ARG 438 HH12 ARG 438 8.881 -4.369 -6.608
46 HH21 ARG 438 HH21 ARG 438 7.763 -3.829 -9.902
47 HH22 ARG 438 HH22 ARG 438 8.972 -4.596 -8.906
48 H LYS 439 HN LYS 439 1.007 -2.826 -8.276
49 HA LYS 439 HA LYS 439 0.377 -5.332 -6.933
50 HB2 LYS 439 HB2 LYS 439 -1.225 -4.197 -8.535
51 HB3 LYS 439 HB1 LYS 439 -0.097 -4.574 -9.828
52 HG2 LYS 439 HG2 LYS 439 -1.272 -6.704 -8.068
53 HG3 LYS 439 HG1 LYS 439 -2.094 -6.121 -9.512
54 HD2 LYS 439 HD2 LYS 439 0.737 -7.102 -9.633
55 HD3 LYS 439 HD1 LYS 439 -0.615 -8.231 -9.679
56 HE2 LYS 439 HE2 LYS 439 0.106 -7.713 -11.927
57 HE3 LYS 439 HE1 LYS 439 -1.503 -7.056 -11.650
58 HZ1 LYS 439 HZ1 LYS 439 -0.643 -4.881 -11.493
59 HZ2 LYS 439 HZ2 LYS 439 0.108 -5.573 -12.842
60 HZ3 LYS 439 HZ3 LYS 439 0.963 -5.422 -11.394
61 H THR 440 HN THR 440 2.076 -6.594 -6.673
62 HA THR 440 HA THR 440 4.166 -6.724 -8.687
63 HB THR 440 HB THR 440 5.237 -8.341 -7.105
64 HG1 THR 440 HG1 THR 440 3.085 -7.624 -5.370
65 HG21 THR 440 HG21 THR 440 5.778 -5.973 -6.992
66 HG22 THR 440 HG22 THR 440 5.743 -6.667 -5.369
67 HG23 THR 440 HG23 THR 440 4.391 -5.688 -5.939
68 H ALA 441 HN ALA 441 4.830 -8.673 -9.705
69 HA ALA 441 HA ALA 441 2.661 -10.007 -10.918
70 HB1 ALA 441 HB1 ALA 441 4.755 -9.518 -12.081
71 HB2 ALA 441 HB2 ALA 441 4.356 -11.233 -12.166
72 HB3 ALA 441 HB3 ALA 441 5.599 -10.669 -11.046
73 H ASP 442 HN ASP 442 4.269 -10.657 -8.024
74 HA ASP 442 HA ASP 442 3.931 -13.508 -8.026
75 HB2 ASP 442 HB2 ASP 442 5.597 -12.172 -6.616
76 HB3 ASP 442 HB1 ASP 442 4.229 -11.741 -5.597
77 H GLY 443 HN GLY 443 1.835 -10.945 -7.877
78 HA2 GLY 443 HA2 GLY 443 -0.495 -11.073 -7.686
79 HA3 GLY 443 HA1 GLY 443 -0.324 -12.615 -6.859
80 H LYS 444 HN LYS 444 1.437 -9.701 -5.988
81 HA LYS 444 HA LYS 444 -0.175 -9.560 -3.522
82 HB2 LYS 444 HB2 LYS 444 2.748 -8.831 -3.707
83 HB3 LYS 444 HB1 LYS 444 1.770 -8.976 -2.258
84 HG2 LYS 444 HG2 LYS 444 1.602 -11.410 -2.662
85 HG3 LYS 444 HG1 LYS 444 2.680 -11.220 -4.049
86 HD2 LYS 444 HD2 LYS 444 4.282 -10.084 -2.384
87 HD3 LYS 444 HD1 LYS 444 3.274 -10.815 -1.136
88 HE2 LYS 444 HE2 LYS 444 4.660 -12.320 -3.346
89 HE3 LYS 444 HE1 LYS 444 5.271 -12.157 -1.703
90 HZ1 LYS 444 HZ1 LYS 444 2.682 -13.426 -2.422
91 HZ2 LYS 444 HZ2 LYS 444 3.382 -13.354 -0.874
92 HZ3 LYS 444 HZ3 LYS 444 4.118 -14.262 -2.101
93 H THR 445 HN THR 445 -1.372 -7.745 -3.637
94 HA THR 445 HA THR 445 -0.244 -5.318 -4.792
95 HB THR 445 HB THR 445 -2.792 -5.213 -3.247
96 HG1 THR 445 HG1 THR 445 -3.704 -5.966 -5.478
97 HG21 THR 445 HG21 THR 445 -3.447 -3.751 -5.108
98 HG22 THR 445 HG22 THR 445 -1.936 -4.124 -5.936
99 HG23 THR 445 HG23 THR 445 -1.908 -3.247 -4.408
100 H TYR 446 HN TYR 446 1.394 -4.663 -3.410
101 HA TYR 446 HA TYR 446 0.675 -4.482 -0.581
102 HB2 TYR 446 HB2 TYR 446 2.940 -4.458 -0.014
103 HB3 TYR 446 HB1 TYR 446 2.803 -5.669 -1.267
104 HD1 TYR 446 HD1 TYR 446 3.606 -5.068 -3.615
105 HD2 TYR 446 HD2 TYR 446 4.378 -2.642 -0.206
106 HE1 TYR 446 HE1 TYR 446 5.460 -3.974 -4.809
107 HE2 TYR 446 HE2 TYR 446 6.226 -1.546 -1.393
108 HH TYR 446 HH TYR 446 7.739 -1.971 -3.223
109 H TYR 447 HN TYR 447 0.492 -2.665 0.440
110 HA TYR 447 HA TYR 447 0.897 -0.197 -1.066
111 HB2 TYR 447 HB2 TYR 447 -0.659 -0.762 1.466
112 HB3 TYR 447 HB1 TYR 447 -0.468 0.833 0.756
113 HD1 TYR 447 HD2 TYR 447 -1.584 -2.596 -0.443
114 HD2 TYR 447 HD1 TYR 447 -2.277 1.615 -0.369
115 HE1 TYR 447 HE2 TYR 447 -3.644 -2.906 -1.731
116 HE2 TYR 447 HE1 TYR 447 -4.336 1.295 -1.658
117 HH TYR 447 HH TYR 447 -5.367 -0.294 -3.145
118 H TYR 448 HN TYR 448 3.131 0.101 -0.790
119 HA TYR 448 HA TYR 448 4.159 0.334 1.899
120 HB2 TYR 448 HB2 TYR 448 5.740 -0.447 0.319
121 HB3 TYR 448 HB1 TYR 448 5.330 0.811 -0.840
122 HD1 TYR 448 HD1 TYR 448 6.324 0.911 2.780
123 HD2 TYR 448 HD2 TYR 448 7.156 2.138 -1.208
124 HE1 TYR 448 HE1 TYR 448 8.203 2.283 3.603
125 HE2 TYR 448 HE2 TYR 448 9.034 3.502 -0.404
126 HH TYR 448 HH TYR 448 10.345 3.185 2.670
127 H ASN 449 HN ASN 449 3.934 2.006 3.105
128 HA ASN 449 HA ASN 449 2.752 4.441 2.063
129 HB2 ASN 449 HB2 ASN 449 1.594 3.714 3.926
130 HB3 ASN 449 HB1 ASN 449 3.053 3.165 4.748
131 HD21 ASN 449 HD21 ASN 449 1.249 5.989 3.764
132 HD22 ASN 449 HD22 ASN 449 1.818 7.019 5.027
133 H ASN 450 HN ASN 450 3.648 6.412 2.057
134 HA ASN 450 HA ASN 450 6.455 6.611 2.905
135 HB2 ASN 450 HB2 ASN 450 5.507 7.156 0.481
136 HB3 ASN 450 HB1 ASN 450 5.147 8.709 1.226
137 HD21 ASN 450 HD21 ASN 450 6.979 8.171 -0.904
138 HD22 ASN 450 HD22 ASN 450 8.553 8.646 -0.362
139 H ARG 451 HN ARG 451 3.467 7.301 4.112
140 HA ARG 451 HA ARG 451 3.795 9.955 5.066
141 HB2 ARG 451 HB2 ARG 451 2.013 7.741 5.999
142 HB3 ARG 451 HB1 ARG 451 2.064 9.307 6.791
143 HG2 ARG 451 HG2 ARG 451 1.741 9.905 4.104
144 HG3 ARG 451 HG1 ARG 451 0.704 8.505 4.382
145 HD2 ARG 451 HD2 ARG 451 0.686 11.110 5.900
146 HD3 ARG 451 HD1 ARG 451 -0.550 10.526 4.789
147 HE ARG 451 HE ARG 451 0.048 9.295 7.410
148 HH11 ARG 451 HH11 ARG 451 -2.178 10.098 4.818
149 HH12 ARG 451 HH12 ARG 451 -3.581 9.558 5.699
150 HH21 ARG 451 HH21 ARG 451 -1.801 8.546 8.548
151 HH22 ARG 451 HH22 ARG 451 -3.368 8.636 7.784
152 H THR 452 HN THR 452 3.980 6.861 6.762
153 HA THR 452 HA THR 452 5.664 8.162 8.796
154 HB THR 452 HB THR 452 4.213 5.785 9.674
155 HG1 THR 452 HG1 THR 452 2.325 6.320 8.874
156 HG21 THR 452 HG21 THR 452 3.622 7.269 11.541
157 HG22 THR 452 HG22 THR 452 4.309 8.637 10.666
158 HG23 THR 452 HG23 THR 452 5.353 7.317 11.198
159 H LEU 453 HN LEU 453 5.814 6.111 6.306
160 HA LEU 453 HA LEU 453 7.152 4.425 5.625
161 HB2 LEU 453 HB2 LEU 453 8.559 5.232 8.117
162 HB3 LEU 453 HB1 LEU 453 8.941 3.655 7.459
163 HG LEU 453 HG LEU 453 10.432 5.649 6.798
164 HD11 LEU 453 HD11 LEU 453 10.121 3.293 5.690
165 HD12 LEU 453 HD12 LEU 453 11.041 4.553 4.869
166 HD13 LEU 453 HD13 LEU 453 9.374 4.234 4.399
167 HD21 LEU 453 HD21 LEU 453 9.703 6.991 4.951
168 HD22 LEU 453 HD22 LEU 453 8.501 7.142 6.235
169 HD23 LEU 453 HD23 LEU 453 8.184 6.100 4.843
170 H GLU 454 HN GLU 454 5.184 3.297 5.739
171 HA GLU 454 HA GLU 454 5.146 1.193 7.787
172 HB2 GLU 454 HB2 GLU 454 2.728 2.731 6.809
173 HB3 GLU 454 HB1 GLU 454 2.709 1.397 7.953
174 HG2 GLU 454 HG2 GLU 454 3.938 2.711 9.564
175 HG3 GLU 454 HG1 GLU 454 4.081 4.035 8.408
176 H SER 455 HN SER 455 5.003 -0.770 6.910
177 HA SER 455 HA SER 455 4.301 -0.980 4.086
178 HB2 SER 455 HB2 SER 455 6.347 -2.105 5.281
179 HB3 SER 455 HB1 SER 455 5.156 -3.302 5.793
180 HG SER 455 HG SER 455 6.368 -2.982 3.399
181 H THR 456 HN THR 456 2.222 -1.262 3.620
182 HA THR 456 HA THR 456 0.532 -2.694 5.565
183 HB THR 456 HB THR 456 -1.377 -1.307 4.558
184 HG1 THR 456 HG1 THR 456 0.621 -0.382 3.074
185 HG21 THR 456 HG21 THR 456 -0.891 0.646 6.008
186 HG22 THR 456 HG22 THR 456 0.750 0.030 6.226
187 HG23 THR 456 HG23 THR 456 -0.627 -0.906 6.810
188 H TRP 457 HN TRP 457 -0.052 -4.593 4.815
189 HA TRP 457 HA TRP 457 -0.285 -4.923 1.911
190 HB2 TRP 457 HB2 TRP 457 0.400 -6.939 4.072
191 HB3 TRP 457 HB1 TRP 457 0.177 -7.346 2.364
192 HD1 TRP 457 HD1 TRP 457 2.250 -4.708 4.321
193 HE1 TRP 457 HE1 TRP 457 4.518 -4.414 3.160
194 HE3 TRP 457 HE3 TRP 457 1.692 -8.161 0.579
195 HZ2 TRP 457 HZ2 TRP 457 5.873 -5.457 0.954
196 HZ3 TRP 457 HZ3 TRP 457 3.554 -8.473 -1.000
197 HH2 TRP 457 HH2 TRP 457 5.614 -7.166 -0.807
198 H GLU 458 HN GLU 458 -2.055 -4.231 4.361
199 HA GLU 458 HA GLU 458 -4.465 -5.616 3.420
200 HB2 GLU 458 HB2 GLU 458 -5.507 -4.583 5.442
201 HB3 GLU 458 HB1 GLU 458 -4.170 -5.656 5.840
202 HG2 GLU 458 HG2 GLU 458 -2.692 -3.680 6.026
203 HG3 GLU 458 HG1 GLU 458 -4.090 -2.647 5.739
204 H LYS 459 HN LYS 459 -6.241 -4.260 2.692
205 HA LYS 459 HA LYS 459 -5.377 -1.919 1.302
206 HB2 LYS 459 HB2 LYS 459 -8.187 -2.947 1.758
207 HB3 LYS 459 HB1 LYS 459 -7.743 -1.671 0.637
208 HG2 LYS 459 HG2 LYS 459 -6.338 -3.309 -0.587
209 HG3 LYS 459 HG1 LYS 459 -6.951 -4.569 0.485
210 HD2 LYS 459 HD2 LYS 459 -8.481 -4.809 -1.166
211 HD3 LYS 459 HD1 LYS 459 -9.278 -3.499 -0.294
212 HE2 LYS 459 HE2 LYS 459 -7.539 -3.276 -2.746
213 HE3 LYS 459 HE1 LYS 459 -9.271 -2.985 -2.639
214 HZ1 LYS 459 HZ1 LYS 459 -7.104 -1.352 -1.448
215 HZ2 LYS 459 HZ2 LYS 459 -8.746 -1.113 -1.104
216 HZ3 LYS 459 HZ3 LYS 459 -8.170 -0.900 -2.679
217 HA PRO 460 HA PRO 460 -6.001 0.832 4.817
218 HB2 PRO 460 HB2 PRO 460 -5.287 2.916 2.883
219 HB3 PRO 460 HB1 PRO 460 -4.486 2.470 4.391
220 HG2 PRO 460 HG2 PRO 460 -3.425 1.964 1.956
221 HG3 PRO 460 HG1 PRO 460 -3.133 0.937 3.369
222 HD2 PRO 460 HD2 PRO 460 -4.946 0.495 1.042
223 HD3 PRO 460 HD1 PRO 460 -3.989 -0.679 1.966
224 H GLN 461 HN GLN 461 -7.856 1.729 5.391
225 HA GLN 461 HA GLN 461 -10.024 2.052 3.580
226 HB2 GLN 461 HB2 GLN 461 -10.119 1.477 6.051
227 HB3 GLN 461 HB1 GLN 461 -9.790 3.171 6.374
228 HG2 GLN 461 HG2 GLN 461 -11.852 3.808 5.278
229 HG3 GLN 461 HG1 GLN 461 -12.173 2.122 4.865
230 HE21 GLN 461 HE21 GLN 461 -13.759 3.967 6.457
231 HE22 GLN 461 HE22 GLN 461 -13.939 3.227 8.013
232 H GLU 462 HN GLU 462 -7.377 3.944 4.246
233 HA GLU 462 HA GLU 462 -8.568 6.541 3.980
234 HB2 GLU 462 HB2 GLU 462 -6.468 6.044 5.274
235 HB3 GLU 462 HB1 GLU 462 -5.652 5.770 3.741
236 HG2 GLU 462 HG2 GLU 462 -5.152 7.975 4.522
237 HG3 GLU 462 HG1 GLU 462 -6.170 8.091 3.088
238 H LEU 463 HN LEU 463 -7.305 4.131 1.819
239 HA LEU 463 HA LEU 463 -7.530 6.067 -0.398
240 HB2 LEU 463 HB2 LEU 463 -5.210 5.218 0.074
241 HB3 LEU 463 HB1 LEU 463 -5.774 3.614 -0.362
242 HG LEU 463 HG LEU 463 -6.332 4.451 -2.626
243 HD11 LEU 463 HD11 LEU 463 -4.978 6.981 -1.702
244 HD12 LEU 463 HD12 LEU 463 -6.695 6.795 -2.059
245 HD13 LEU 463 HD13 LEU 463 -5.504 6.622 -3.347
246 HD21 LEU 463 HD21 LEU 463 -3.479 4.932 -1.783
247 HD22 LEU 463 HD22 LEU 463 -4.043 4.623 -3.426
248 HD23 LEU 463 HD23 LEU 463 -4.185 3.369 -2.196
249 H LYS 464 HN LYS 464 -9.010 3.537 1.021
250 HA LYS 464 HA LYS 464 -10.742 2.195 0.447
251 HB2 LYS 464 HB2 LYS 464 -10.626 3.450 -2.305
252 HB3 LYS 464 HB1 LYS 464 -11.978 2.577 -1.598
253 HG2 LYS 464 HG2 LYS 464 -10.889 5.219 -0.642
254 HG3 LYS 464 HG1 LYS 464 -12.361 4.980 -1.583
255 HD2 LYS 464 HD2 LYS 464 -13.412 3.819 0.211
256 HD3 LYS 464 HD1 LYS 464 -11.903 3.735 1.121
257 HE2 LYS 464 HE2 LYS 464 -13.388 5.455 2.013
258 HE3 LYS 464 HE1 LYS 464 -11.901 6.155 1.376
259 HZ1 LYS 464 HZ1 LYS 464 -13.902 7.411 0.767
260 HZ2 LYS 464 HZ2 LYS 464 -14.488 6.065 -0.088
261 HZ3 LYS 464 HZ3 LYS 464 -13.065 6.842 -0.595
Start of MODEL 20
1 H SER 433 HT1 SER 433 3.176 10.985 -4.043
2 HA SER 433 HA SER 433 0.402 10.467 -3.154
3 HB2 SER 433 HB2 SER 433 0.950 9.806 -5.519
4 HB3 SER 433 HB1 SER 433 2.228 8.772 -4.883
5 HG SER 433 HG SER 433 -0.559 8.496 -4.695
6 H GLU 434 HN GLU 434 0.321 9.595 -1.201
7 HA GLU 434 HA GLU 434 2.839 8.736 0.017
8 HB2 GLU 434 HB2 GLU 434 0.179 9.185 1.371
9 HB3 GLU 434 HB1 GLU 434 1.759 9.075 2.132
10 HG2 GLU 434 HG2 GLU 434 0.803 11.276 0.312
11 HG3 GLU 434 HG1 GLU 434 0.999 11.371 2.060
12 H TRP 435 HN TRP 435 0.296 7.338 -1.550
13 HA TRP 435 HA TRP 435 0.548 4.847 -0.004
14 HB2 TRP 435 HB2 TRP 435 -1.815 5.645 -1.726
15 HB3 TRP 435 HB1 TRP 435 -1.701 4.242 -0.665
16 HD1 TRP 435 HD1 TRP 435 -3.146 7.580 -0.709
17 HE1 TRP 435 HE1 TRP 435 -3.652 8.440 1.672
18 HE3 TRP 435 HE3 TRP 435 -0.474 4.152 1.970
19 HZ2 TRP 435 HZ2 TRP 435 -2.999 7.749 4.320
20 HZ3 TRP 435 HZ3 TRP 435 -0.439 4.338 4.417
21 HH2 TRP 435 HH2 TRP 435 -1.638 6.128 5.568
22 H THR 436 HN THR 436 1.893 3.536 -1.053
23 HA THR 436 HA THR 436 2.065 3.621 -3.955
24 HB THR 436 HB THR 436 3.597 1.912 -1.980
25 HG1 THR 436 HG1 THR 436 4.244 3.990 -1.663
26 HG21 THR 436 HG21 THR 436 3.545 0.887 -4.194
27 HG22 THR 436 HG22 THR 436 5.153 1.538 -3.867
28 HG23 THR 436 HG23 THR 436 4.050 2.411 -4.930
29 H GLU 437 HN GLU 437 0.160 2.704 -4.686
30 HA GLU 437 HA GLU 437 -0.417 -0.040 -3.895
31 HB2 GLU 437 HB2 GLU 437 -2.336 1.448 -4.279
32 HB3 GLU 437 HB1 GLU 437 -1.794 1.732 -5.928
33 HG2 GLU 437 HG2 GLU 437 -2.078 -0.679 -6.396
34 HG3 GLU 437 HG1 GLU 437 -2.723 -0.889 -4.771
35 H ARG 438 HN ARG 438 1.324 -1.162 -4.621
36 HA ARG 438 HA ARG 438 1.737 -1.155 -7.537
37 HB2 ARG 438 HB2 ARG 438 3.611 -0.157 -6.161
38 HB3 ARG 438 HB1 ARG 438 3.829 -1.743 -5.440
39 HG2 ARG 438 HG2 ARG 438 4.316 -2.665 -7.671
40 HG3 ARG 438 HG1 ARG 438 4.171 -1.037 -8.346
41 HD2 ARG 438 HD2 ARG 438 5.964 -0.294 -6.822
42 HD3 ARG 438 HD1 ARG 438 6.137 -1.947 -6.254
43 HE ARG 438 HE ARG 438 6.522 -1.346 -9.099
44 HH11 ARG 438 HH11 ARG 438 7.782 -2.362 -6.007
45 HH12 ARG 438 HH12 ARG 438 9.294 -2.927 -6.652
46 HH21 ARG 438 HH21 ARG 438 8.503 -2.071 -9.974
47 HH22 ARG 438 HH22 ARG 438 9.693 -2.795 -8.934
48 H LYS 439 HN LYS 439 1.070 -3.022 -8.394
49 HA LYS 439 HA LYS 439 0.958 -5.300 -6.581
50 HB2 LYS 439 HB2 LYS 439 -0.844 -6.160 -7.718
51 HB3 LYS 439 HB1 LYS 439 -1.107 -4.438 -7.906
52 HG2 LYS 439 HG2 LYS 439 0.116 -6.246 -9.977
53 HG3 LYS 439 HG1 LYS 439 -1.563 -5.716 -9.944
54 HD2 LYS 439 HD2 LYS 439 -0.854 -3.405 -10.206
55 HD3 LYS 439 HD1 LYS 439 0.838 -3.907 -10.181
56 HE2 LYS 439 HE2 LYS 439 -1.251 -4.571 -12.244
57 HE3 LYS 439 HE1 LYS 439 0.197 -3.587 -12.462
58 HZ1 LYS 439 HZ1 LYS 439 0.444 -5.829 -13.369
59 HZ2 LYS 439 HZ2 LYS 439 0.185 -6.497 -11.835
60 HZ3 LYS 439 HZ3 LYS 439 1.558 -5.542 -12.122
61 H THR 440 HN THR 440 2.439 -6.743 -6.643
62 HA THR 440 HA THR 440 4.123 -7.025 -8.994
63 HB THR 440 HB THR 440 5.419 -8.628 -7.616
64 HG1 THR 440 HG1 THR 440 3.241 -8.231 -5.858
65 HG21 THR 440 HG21 THR 440 5.885 -6.188 -7.518
66 HG22 THR 440 HG22 THR 440 6.305 -7.034 -6.031
67 HG23 THR 440 HG23 THR 440 4.827 -6.074 -6.110
68 H ALA 441 HN ALA 441 4.194 -8.784 -10.323
69 HA ALA 441 HA ALA 441 1.790 -10.268 -10.624
70 HB1 ALA 441 HB1 ALA 441 3.171 -9.587 -12.526
71 HB2 ALA 441 HB2 ALA 441 2.900 -11.331 -12.508
72 HB3 ALA 441 HB3 ALA 441 4.449 -10.675 -11.982
73 H ASP 442 HN ASP 442 4.178 -10.676 -8.449
74 HA ASP 442 HA ASP 442 4.356 -13.508 -8.294
75 HB2 ASP 442 HB2 ASP 442 5.972 -12.035 -7.187
76 HB3 ASP 442 HB1 ASP 442 4.700 -11.380 -6.163
77 H GLY 443 HN GLY 443 1.811 -11.408 -7.887
78 HA2 GLY 443 HA2 GLY 443 -0.399 -12.070 -7.499
79 HA3 GLY 443 HA1 GLY 443 0.195 -13.522 -6.708
80 H LYS 444 HN LYS 444 1.381 -10.339 -5.909
81 HA LYS 444 HA LYS 444 -0.370 -10.202 -3.589
82 HB2 LYS 444 HB2 LYS 444 1.591 -9.744 -2.079
83 HB3 LYS 444 HB1 LYS 444 1.418 -11.409 -2.608
84 HG2 LYS 444 HG2 LYS 444 3.262 -11.257 -4.051
85 HG3 LYS 444 HG1 LYS 444 3.269 -9.493 -3.991
86 HD2 LYS 444 HD2 LYS 444 5.086 -10.425 -2.645
87 HD3 LYS 444 HD1 LYS 444 3.923 -9.570 -1.633
88 HE2 LYS 444 HE2 LYS 444 4.282 -11.487 -0.410
89 HE3 LYS 444 HE1 LYS 444 2.857 -11.928 -1.345
90 HZ1 LYS 444 HZ1 LYS 444 4.454 -12.956 -2.982
91 HZ2 LYS 444 HZ2 LYS 444 4.335 -13.734 -1.477
92 HZ3 LYS 444 HZ3 LYS 444 5.665 -12.743 -1.809
93 H THR 445 HN THR 445 -1.069 -8.217 -3.282
94 HA THR 445 HA THR 445 0.305 -6.000 -4.588
95 HB THR 445 HB THR 445 -2.288 -5.723 -3.102
96 HG1 THR 445 HG1 THR 445 -1.809 -7.190 -5.422
97 HG21 THR 445 HG21 THR 445 -2.706 -4.008 -4.818
98 HG22 THR 445 HG22 THR 445 -1.147 -4.376 -5.557
99 HG23 THR 445 HG23 THR 445 -1.215 -3.695 -3.931
100 H TYR 446 HN TYR 446 1.498 -4.567 -3.452
101 HA TYR 446 HA TYR 446 1.051 -4.559 -0.550
102 HB2 TYR 446 HB2 TYR 446 3.329 -4.198 -0.113
103 HB3 TYR 446 HB1 TYR 446 3.247 -5.537 -1.230
104 HD1 TYR 446 HD1 TYR 446 3.767 -5.010 -3.726
105 HD2 TYR 446 HD2 TYR 446 4.680 -2.389 -0.502
106 HE1 TYR 446 HE1 TYR 446 5.466 -3.887 -5.116
107 HE2 TYR 446 HE2 TYR 446 6.370 -1.265 -1.880
108 HH TYR 446 HH TYR 446 7.727 -1.657 -3.795
109 H TYR 447 HN TYR 447 0.729 -2.730 0.431
110 HA TYR 447 HA TYR 447 0.965 -0.283 -1.154
111 HB2 TYR 447 HB2 TYR 447 -0.731 -0.927 1.259
112 HB3 TYR 447 HB1 TYR 447 -0.572 0.689 0.589
113 HD1 TYR 447 HD2 TYR 447 -1.525 -2.793 -0.471
114 HD2 TYR 447 HD1 TYR 447 -2.134 1.399 -0.952
115 HE1 TYR 447 HE2 TYR 447 -3.395 -3.239 -1.987
116 HE2 TYR 447 HE1 TYR 447 -4.010 0.951 -2.474
117 HH TYR 447 HH TYR 447 -4.829 -0.813 -3.925
118 H TYR 448 HN TYR 448 3.094 0.170 -0.825
119 HA TYR 448 HA TYR 448 4.095 0.485 1.868
120 HB2 TYR 448 HB2 TYR 448 5.698 -0.280 0.301
121 HB3 TYR 448 HB1 TYR 448 5.250 0.945 -0.877
122 HD1 TYR 448 HD1 TYR 448 6.071 1.431 2.742
123 HD2 TYR 448 HD2 TYR 448 7.252 2.024 -1.300
124 HE1 TYR 448 HE1 TYR 448 7.934 2.859 3.500
125 HE2 TYR 448 HE2 TYR 448 9.113 3.440 -0.557
126 HH TYR 448 HH TYR 448 10.110 3.612 2.684
127 H ASN 449 HN ASN 449 3.816 2.157 3.043
128 HA ASN 449 HA ASN 449 2.575 4.550 1.926
129 HB2 ASN 449 HB2 ASN 449 1.221 3.842 3.627
130 HB3 ASN 449 HB1 ASN 449 2.547 3.118 4.528
131 HD21 ASN 449 HD21 ASN 449 0.883 6.067 3.779
132 HD22 ASN 449 HD22 ASN 449 1.418 6.947 5.162
133 H ASN 450 HN ASN 450 3.439 6.521 2.003
134 HA ASN 450 HA ASN 450 6.181 6.768 3.005
135 HB2 ASN 450 HB2 ASN 450 4.590 8.533 1.130
136 HB3 ASN 450 HB1 ASN 450 6.235 8.869 1.654
137 HD21 ASN 450 HD21 ASN 450 5.257 8.479 -1.028
138 HD22 ASN 450 HD22 ASN 450 6.119 7.125 -1.674
139 H ARG 451 HN ARG 451 3.116 7.369 4.070
140 HA ARG 451 HA ARG 451 3.455 9.941 5.219
141 HB2 ARG 451 HB2 ARG 451 1.425 7.822 5.540
142 HB3 ARG 451 HB1 ARG 451 1.511 9.104 6.743
143 HG2 ARG 451 HG2 ARG 451 1.155 10.782 5.084
144 HG3 ARG 451 HG1 ARG 451 1.293 9.596 3.785
145 HD2 ARG 451 HD2 ARG 451 -1.035 10.258 4.284
146 HD3 ARG 451 HD1 ARG 451 -0.738 8.530 4.461
147 HE ARG 451 HE ARG 451 -0.403 9.456 6.983
148 HH11 ARG 451 HH11 ARG 451 -2.895 9.906 4.589
149 HH12 ARG 451 HH12 ARG 451 -4.192 9.956 5.736
150 HH21 ARG 451 HH21 ARG 451 -2.098 9.574 8.540
151 HH22 ARG 451 HH22 ARG 451 -3.737 9.806 7.997
152 H THR 452 HN THR 452 3.605 6.686 6.626
153 HA THR 452 HA THR 452 5.197 7.860 8.817
154 HB THR 452 HB THR 452 3.721 5.267 9.114
155 HG1 THR 452 HG1 THR 452 1.858 6.233 9.211
156 HG21 THR 452 HG21 THR 452 4.498 7.444 11.053
157 HG22 THR 452 HG22 THR 452 5.331 5.906 10.832
158 HG23 THR 452 HG23 THR 452 3.688 5.934 11.470
159 H LEU 453 HN LEU 453 5.506 6.172 6.071
160 HA LEU 453 HA LEU 453 7.024 4.728 5.175
161 HB2 LEU 453 HB2 LEU 453 8.269 5.257 7.827
162 HB3 LEU 453 HB1 LEU 453 8.818 3.843 6.953
163 HG LEU 453 HG LEU 453 10.158 6.003 6.669
164 HD11 LEU 453 HD11 LEU 453 10.173 3.915 5.200
165 HD12 LEU 453 HD12 LEU 453 10.789 5.409 4.498
166 HD13 LEU 453 HD13 LEU 453 9.172 4.846 4.085
167 HD21 LEU 453 HD21 LEU 453 9.363 7.584 5.035
168 HD22 LEU 453 HD22 LEU 453 8.181 7.468 6.342
169 HD23 LEU 453 HD23 LEU 453 7.883 6.650 4.803
170 H GLU 454 HN GLU 454 4.573 3.909 6.123
171 HA GLU 454 HA GLU 454 4.965 1.462 7.683
172 HB2 GLU 454 HB2 GLU 454 2.428 2.828 6.769
173 HB3 GLU 454 HB1 GLU 454 2.501 1.407 7.799
174 HG2 GLU 454 HG2 GLU 454 3.622 2.692 9.523
175 HG3 GLU 454 HG1 GLU 454 3.603 4.117 8.485
176 H SER 455 HN SER 455 5.140 -0.453 6.669
177 HA SER 455 HA SER 455 4.150 -0.695 3.940
178 HB2 SER 455 HB2 SER 455 6.391 -1.670 4.810
179 HB3 SER 455 HB1 SER 455 5.394 -2.919 5.557
180 HG SER 455 HG SER 455 6.076 -2.522 2.924
181 H THR 456 HN THR 456 2.073 -1.229 3.638
182 HA THR 456 HA THR 456 0.812 -2.978 5.630
183 HB THR 456 HB THR 456 -0.061 -0.858 6.233
184 HG1 THR 456 HG1 THR 456 -2.191 -1.620 4.591
185 HG21 THR 456 HG21 THR 456 0.540 0.458 4.291
186 HG22 THR 456 HG22 THR 456 -1.177 0.662 4.646
187 HG23 THR 456 HG23 THR 456 -0.670 -0.380 3.322
188 H TRP 457 HN TRP 457 -0.211 -4.642 4.822
189 HA TRP 457 HA TRP 457 -0.298 -4.796 1.888
190 HB2 TRP 457 HB2 TRP 457 0.354 -6.921 3.953
191 HB3 TRP 457 HB1 TRP 457 0.148 -7.256 2.228
192 HD1 TRP 457 HD1 TRP 457 2.163 -4.641 4.273
193 HE1 TRP 457 HE1 TRP 457 4.459 -4.313 3.178
194 HE3 TRP 457 HE3 TRP 457 1.743 -8.082 0.507
195 HZ2 TRP 457 HZ2 TRP 457 5.888 -5.336 1.014
196 HZ3 TRP 457 HZ3 TRP 457 3.655 -8.370 -1.018
197 HH2 TRP 457 HH2 TRP 457 5.694 -7.047 -0.763
198 H GLU 458 HN GLU 458 -2.156 -4.248 4.326
199 HA GLU 458 HA GLU 458 -4.511 -5.415 3.007
200 HB2 GLU 458 HB2 GLU 458 -4.438 -5.878 5.405
201 HB3 GLU 458 HB1 GLU 458 -4.164 -4.177 5.753
202 HG2 GLU 458 HG2 GLU 458 -6.375 -3.619 4.980
203 HG3 GLU 458 HG1 GLU 458 -6.656 -5.287 4.486
204 H LYS 459 HN LYS 459 -5.949 -3.979 2.052
205 HA LYS 459 HA LYS 459 -4.809 -1.615 1.051
206 HB2 LYS 459 HB2 LYS 459 -7.720 -2.431 1.015
207 HB3 LYS 459 HB1 LYS 459 -6.969 -1.227 -0.025
208 HG2 LYS 459 HG2 LYS 459 -5.470 -3.065 -0.871
209 HG3 LYS 459 HG1 LYS 459 -6.515 -4.198 -0.013
210 HD2 LYS 459 HD2 LYS 459 -8.437 -3.383 -1.308
211 HD3 LYS 459 HD1 LYS 459 -7.372 -2.272 -2.173
212 HE2 LYS 459 HE2 LYS 459 -6.053 -4.265 -2.918
213 HE3 LYS 459 HE1 LYS 459 -7.304 -5.284 -2.217
214 HZ1 LYS 459 HZ1 LYS 459 -8.910 -4.127 -3.705
215 HZ2 LYS 459 HZ2 LYS 459 -7.746 -5.047 -4.525
216 HZ3 LYS 459 HZ3 LYS 459 -7.598 -3.357 -4.458
217 HA PRO 460 HA PRO 460 -5.336 1.236 4.430
218 HB2 PRO 460 HB2 PRO 460 -5.349 3.116 2.109
219 HB3 PRO 460 HB1 PRO 460 -4.433 3.203 3.619
220 HG2 PRO 460 HG2 PRO 460 -3.252 2.419 1.373
221 HG3 PRO 460 HG1 PRO 460 -2.876 1.634 2.919
222 HD2 PRO 460 HD2 PRO 460 -4.519 0.644 0.638
223 HD3 PRO 460 HD1 PRO 460 -3.497 -0.260 1.773
224 H GLN 461 HN GLN 461 -7.130 1.784 5.411
225 HA GLN 461 HA GLN 461 -9.621 1.499 4.066
226 HB2 GLN 461 HB2 GLN 461 -10.654 1.782 6.226
227 HB3 GLN 461 HB1 GLN 461 -9.271 0.710 6.375
228 HG2 GLN 461 HG2 GLN 461 -9.319 3.624 7.143
229 HG3 GLN 461 HG1 GLN 461 -9.458 2.266 8.255
230 HE21 GLN 461 HE21 GLN 461 -7.637 0.943 8.609
231 HE22 GLN 461 HE22 GLN 461 -6.035 1.521 8.283
232 H GLU 462 HN GLU 462 -7.639 4.233 4.807
233 HA GLU 462 HA GLU 462 -9.885 6.060 4.569
234 HB2 GLU 462 HB2 GLU 462 -8.405 7.819 5.115
235 HB3 GLU 462 HB1 GLU 462 -7.967 6.473 6.151
236 HG2 GLU 462 HG2 GLU 462 -6.009 6.020 4.866
237 HG3 GLU 462 HG1 GLU 462 -6.523 7.134 3.599
238 H LEU 463 HN LEU 463 -7.859 4.441 2.473
239 HA LEU 463 HA LEU 463 -7.778 6.548 0.469
240 HB2 LEU 463 HB2 LEU 463 -5.849 5.019 0.814
241 HB3 LEU 463 HB1 LEU 463 -6.848 3.679 0.290
242 HG LEU 463 HG LEU 463 -7.078 4.750 -1.930
243 HD11 LEU 463 HD11 LEU 463 -5.075 6.725 -0.842
244 HD12 LEU 463 HD12 LEU 463 -6.756 7.071 -1.243
245 HD13 LEU 463 HD13 LEU 463 -5.621 6.619 -2.516
246 HD21 LEU 463 HD21 LEU 463 -5.355 3.068 -1.532
247 HD22 LEU 463 HD22 LEU 463 -4.238 4.328 -1.007
248 HD23 LEU 463 HD23 LEU 463 -4.799 4.287 -2.679
249 H LYS 464 HN LYS 464 -9.816 4.051 1.452
250 HA LYS 464 HA LYS 464 -11.473 4.430 -0.916
251 HB2 LYS 464 HB2 LYS 464 -11.965 1.901 -0.825
252 HB3 LYS 464 HB1 LYS 464 -10.467 2.423 -1.583
253 HG2 LYS 464 HG2 LYS 464 -9.162 1.643 0.156
254 HG3 LYS 464 HG1 LYS 464 -10.497 1.673 1.310
255 HD2 LYS 464 HD2 LYS 464 -10.281 -0.222 -1.031
256 HD3 LYS 464 HD1 LYS 464 -9.830 -0.619 0.629
257 HE2 LYS 464 HE2 LYS 464 -12.571 0.111 -0.394
258 HE3 LYS 464 HE1 LYS 464 -12.043 -1.457 0.216
259 HZ1 LYS 464 HZ1 LYS 464 -13.252 -0.402 1.939
260 HZ2 LYS 464 HZ2 LYS 464 -12.404 1.058 1.754
261 HZ3 LYS 464 HZ3 LYS 464 -11.615 -0.308 2.384