Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
619487 | 5m9z RC | 34061 | cing | 1-original | 5 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H GLY 548 HN GLY 548 2.654 9.051 1.173
2 HA2 GLY 548 HA2 GLY 548 4.225 9.524 -0.525
3 HA3 GLY 548 HA3 GLY 548 4.366 11.166 0.084
4 H LYS 549 HN LYS 549 4.495 9.300 2.743
5 HA LYS 549 HA LYS 549 7.356 9.532 2.884
6 HB2 LYS 549 HB2 LYS 549 5.278 8.699 4.889
7 HB3 LYS 549 HB3 LYS 549 6.992 8.534 5.221
8 HG2 LYS 549 HG2 LYS 549 6.048 10.580 6.171
9 HG3 LYS 549 HG3 LYS 549 7.313 10.918 4.991
10 HD2 LYS 549 HD2 LYS 549 5.342 11.156 3.321
11 HD3 LYS 549 HD3 LYS 549 4.355 11.329 4.776
12 HE2 LYS 549 HE2 LYS 549 5.736 13.198 5.509
13 HE3 LYS 549 HE3 LYS 549 6.757 13.016 4.082
14 HZ1 LYS 549 HZ1 LYS 549 4.807 13.513 2.703
15 HZ2 LYS 549 HZ2 LYS 549 5.186 14.782 3.757
16 HZ3 LYS 549 HZ3 LYS 549 3.881 13.755 4.108
17 H TYR 550 HN TYR 550 8.782 7.874 3.407
18 HA TYR 550 HA TYR 550 8.044 5.323 2.142
19 HB2 TYR 550 HB2 TYR 550 10.201 5.170 1.238
20 HB3 TYR 550 HB3 TYR 550 9.783 6.866 1.038
21 HD1 TYR 550 HD1 TYR 550 12.036 4.499 2.592
22 HD2 TYR 550 HD2 TYR 550 10.799 8.573 2.581
23 HE1 TYR 550 HE1 TYR 550 14.075 5.108 3.818
24 HE2 TYR 550 HE2 TYR 550 12.842 9.195 3.802
25 HH TYR 550 HH TYR 550 14.502 8.156 5.267
26 H VAL 551 HN VAL 551 9.241 3.450 2.909
27 HA VAL 551 HA VAL 551 9.939 3.662 5.771
28 HB VAL 551 HB VAL 551 8.711 1.307 4.308
29 HG11 VAL 551 HG11 VAL 551 9.459 1.590 7.218
30 HG12 VAL 551 HG12 VAL 551 10.260 0.560 6.032
31 HG13 VAL 551 HG13 VAL 551 8.592 0.231 6.499
32 HG21 VAL 551 HG21 VAL 551 7.105 3.088 4.723
33 HG22 VAL 551 HG22 VAL 551 7.554 3.105 6.429
34 HG23 VAL 551 HG23 VAL 551 6.769 1.687 5.740
35 H VAL 552 HN VAL 552 11.873 2.909 6.350
36 HA VAL 552 HA VAL 552 13.861 2.396 4.418
37 HB VAL 552 HB VAL 552 13.951 1.819 7.389
38 HG11 VAL 552 HG11 VAL 552 16.195 2.222 5.413
39 HG12 VAL 552 HG12 VAL 552 15.737 0.698 6.171
40 HG13 VAL 552 HG13 VAL 552 16.379 2.012 7.151
41 HG21 VAL 552 HG21 VAL 552 14.758 4.313 5.889
42 HG22 VAL 552 HG22 VAL 552 15.008 4.019 7.612
43 HG23 VAL 552 HG23 VAL 552 13.371 4.149 6.968
44 H VAL 553 HN VAL 553 14.685 0.533 3.627
45 HA VAL 553 HA VAL 553 13.059 -1.745 3.577
46 HB VAL 553 HB VAL 553 15.979 -1.521 2.844
47 HG11 VAL 553 HG11 VAL 553 15.512 -3.486 1.405
48 HG12 VAL 553 HG12 VAL 553 13.923 -3.620 2.162
49 HG13 VAL 553 HG13 VAL 553 15.383 -3.836 3.127
50 HG21 VAL 553 HG21 VAL 553 14.609 0.050 1.606
51 HG22 VAL 553 HG22 VAL 553 13.486 -1.237 1.170
52 HG23 VAL 553 HG23 VAL 553 15.136 -1.257 0.547
53 HA PRO 554 HA PRO 554 14.146 -3.539 7.490
54 HB2 PRO 554 HB2 PRO 554 12.735 -5.890 6.447
55 HB3 PRO 554 HB3 PRO 554 12.356 -4.887 7.849
56 HG2 PRO 554 HG2 PRO 554 10.882 -4.862 5.568
57 HG3 PRO 554 HG3 PRO 554 11.044 -3.454 6.630
58 HD2 PRO 554 HD2 PRO 554 12.345 -4.018 4.008
59 HD3 PRO 554 HD3 PRO 554 11.827 -2.472 4.706
60 H GLU 555 HN GLU 555 15.753 -4.796 8.163
61 HA GLU 555 HA GLU 555 17.421 -6.064 6.169
62 HB2 GLU 555 HB2 GLU 555 19.077 -6.229 7.899
63 HB3 GLU 555 HB3 GLU 555 18.360 -4.629 7.984
64 HG2 GLU 555 HG2 GLU 555 17.694 -6.948 9.793
65 HG3 GLU 555 HG3 GLU 555 18.746 -5.596 10.195
66 H THR 556 HN THR 556 15.296 -6.950 8.762
67 HA THR 556 HA THR 556 16.102 -9.710 8.835
68 HB THR 556 HB THR 556 14.094 -9.894 10.400
69 HG1 THR 556 HG1 THR 556 14.224 -7.049 10.392
70 HG21 THR 556 HG21 THR 556 16.383 -9.685 11.217
71 HG22 THR 556 HG22 THR 556 15.281 -8.758 12.236
72 HG23 THR 556 HG23 THR 556 16.299 -7.932 11.056
73 H SER 557 HN SER 557 14.468 -8.135 6.551
74 HA SER 557 HA SER 557 12.422 -10.127 6.068
75 HB2 SER 557 HB2 SER 557 13.394 -7.818 4.362
76 HB3 SER 557 HB3 SER 557 12.003 -8.838 3.993
77 HG SER 557 HG SER 557 10.868 -7.871 5.510
78 H GLN 558 HN GLN 558 15.670 -10.039 5.798
79 HA GLN 558 HA GLN 558 17.236 -11.328 4.804
80 HB2 GLN 558 HB2 GLN 558 14.918 -12.845 3.593
81 HB3 GLN 558 HB3 GLN 558 16.594 -13.373 3.616
82 HG2 GLN 558 HG2 GLN 558 14.814 -12.985 6.013
83 HG3 GLN 558 HG3 GLN 558 15.311 -14.521 5.310
84 HE21 GLN 558 HE21 GLN 558 15.691 -13.510 7.996
85 HE22 GLN 558 HE22 GLN 558 17.398 -13.521 8.281
86 H ASP 559 HN ASP 559 14.697 -11.305 2.302
87 HA ASP 559 HA ASP 559 16.646 -10.196 0.424
88 HB2 ASP 559 HB2 ASP 559 15.316 -12.178 -0.277
89 HB3 ASP 559 HB3 ASP 559 13.844 -11.223 -0.112
90 H MET 560 HN MET 560 16.221 -8.274 -0.747
91 HA MET 560 HA MET 560 14.725 -6.380 0.889
92 HB2 MET 560 HB2 MET 560 16.710 -5.956 -1.346
93 HB3 MET 560 HB3 MET 560 15.923 -4.663 -0.453
94 HG2 MET 560 HG2 MET 560 16.962 -5.405 1.608
95 HG3 MET 560 HG3 MET 560 17.694 -6.769 0.769
96 HE1 MET 560 HE1 MET 560 19.657 -6.542 -1.011
97 HE2 MET 560 HE2 MET 560 20.235 -4.989 -1.609
98 HE3 MET 560 HE3 MET 560 18.592 -5.516 -1.972
99 H ALA 561 HN ALA 561 13.330 -8.211 -0.930
100 HA ALA 561 HA ALA 561 11.743 -6.186 -2.301
101 HB1 ALA 561 HB1 ALA 561 11.636 -7.475 -4.371
102 HB2 ALA 561 HB2 ALA 561 12.759 -8.660 -3.706
103 HB3 ALA 561 HB3 ALA 561 13.300 -7.010 -4.012
104 H PHE 562 HN PHE 562 9.589 -6.923 -2.810
105 HA PHE 562 HA PHE 562 8.802 -9.584 -1.989
106 HB2 PHE 562 HB2 PHE 562 7.199 -8.970 -0.335
107 HB3 PHE 562 HB3 PHE 562 8.703 -8.188 0.118
108 HD1 PHE 562 HD1 PHE 562 5.272 -7.707 -0.972
109 HD2 PHE 562 HD2 PHE 562 8.940 -5.745 -0.069
110 HE1 PHE 562 HE1 PHE 562 4.078 -5.561 -0.819
111 HE2 PHE 562 HE2 PHE 562 7.749 -3.593 0.084
112 HZ PHE 562 HZ PHE 562 5.314 -3.500 -0.292
113 H LYS 563 HN LYS 563 6.574 -10.075 -2.649
114 HA LYS 563 HA LYS 563 5.877 -8.629 -5.080
115 HB2 LYS 563 HB2 LYS 563 5.971 -11.117 -5.052
116 HB3 LYS 563 HB3 LYS 563 4.662 -11.128 -3.880
117 HG2 LYS 563 HG2 LYS 563 3.678 -11.583 -5.967
118 HG3 LYS 563 HG3 LYS 563 3.279 -9.905 -5.594
119 HD2 LYS 563 HD2 LYS 563 3.939 -10.112 -7.919
120 HD3 LYS 563 HD3 LYS 563 5.125 -9.157 -7.025
121 HE2 LYS 563 HE2 LYS 563 6.248 -10.717 -8.515
122 HE3 LYS 563 HE3 LYS 563 6.564 -11.133 -6.832
123 HZ1 LYS 563 HZ1 LYS 563 6.066 -13.066 -8.248
124 HZ2 LYS 563 HZ2 LYS 563 4.498 -12.458 -8.516
125 HZ3 LYS 563 HZ3 LYS 563 4.978 -12.909 -6.956
126 H CYS 564 HN CYS 564 4.276 -7.126 -5.153
127 HA CYS 564 HA CYS 564 2.670 -6.569 -2.864
128 HB2 CYS 564 HB2 CYS 564 3.300 -4.804 -4.431
129 HB3 CYS 564 HB3 CYS 564 2.434 -5.614 -5.725
130 HA PRO 565 HA PRO 565 -0.104 -9.929 -3.815
131 HB2 PRO 565 HB2 PRO 565 -1.580 -9.072 -1.429
132 HB3 PRO 565 HB3 PRO 565 -0.706 -10.578 -1.726
133 HG2 PRO 565 HG2 PRO 565 0.215 -8.743 -0.001
134 HG3 PRO 565 HG3 PRO 565 1.310 -9.709 -1.003
135 HD2 PRO 565 HD2 PRO 565 0.354 -6.896 -1.428
136 HD3 PRO 565 HD3 PRO 565 2.000 -7.554 -1.558
137 H ILE 566 HN ILE 566 -1.046 -6.605 -3.562
138 HA ILE 566 HA ILE 566 -3.844 -7.233 -4.027
139 HB ILE 566 HB ILE 566 -2.524 -4.551 -3.584
140 HG12 ILE 566 HG12 ILE 566 -4.104 -6.293 -1.679
141 HG13 ILE 566 HG13 ILE 566 -2.349 -6.185 -1.696
142 HG21 ILE 566 HG21 ILE 566 -4.633 -4.360 -4.783
143 HG22 ILE 566 HG22 ILE 566 -4.806 -3.771 -3.129
144 HG23 ILE 566 HG23 ILE 566 -5.433 -5.362 -3.570
145 HD11 ILE 566 HD11 ILE 566 -4.210 -3.883 -1.162
146 HD12 ILE 566 HD12 ILE 566 -2.447 -3.861 -1.068
147 HD13 ILE 566 HD13 ILE 566 -3.380 -4.835 0.064
148 H CYS 567 HN CYS 567 -1.398 -5.114 -5.612
149 HA CYS 567 HA CYS 567 -2.998 -5.425 -8.056
150 HB2 CYS 567 HB2 CYS 567 -1.923 -3.401 -8.914
151 HB3 CYS 567 HB3 CYS 567 -2.726 -3.096 -7.381
152 H LYS 568 HN LYS 568 -0.175 -6.469 -6.597
153 HA LYS 568 HA LYS 568 1.128 -8.176 -7.204
154 HB2 LYS 568 HB2 LYS 568 -0.618 -8.210 -9.647
155 HB3 LYS 568 HB3 LYS 568 0.617 -9.421 -9.311
156 HG2 LYS 568 HG2 LYS 568 -0.482 -10.033 -7.254
157 HG3 LYS 568 HG3 LYS 568 -1.675 -8.754 -7.473
158 HD2 LYS 568 HD2 LYS 568 -2.422 -9.878 -9.550
159 HD3 LYS 568 HD3 LYS 568 -1.293 -11.192 -9.207
160 HE2 LYS 568 HE2 LYS 568 -2.433 -11.701 -7.148
161 HE3 LYS 568 HE3 LYS 568 -3.489 -10.303 -7.345
162 HZ1 LYS 568 HZ1 LYS 568 -3.426 -12.758 -9.016
163 HZ2 LYS 568 HZ2 LYS 568 -4.325 -11.369 -9.404
164 HZ3 LYS 568 HZ3 LYS 568 -4.676 -12.234 -7.991
165 H GLU 569 HN GLU 569 1.993 -5.435 -7.826
166 HA GLU 569 HA GLU 569 3.914 -6.129 -9.928
167 HB2 GLU 569 HB2 GLU 569 4.612 -3.626 -8.781
168 HB3 GLU 569 HB3 GLU 569 4.024 -3.952 -10.401
169 HG2 GLU 569 HG2 GLU 569 2.423 -2.518 -9.813
170 HG3 GLU 569 HG3 GLU 569 1.694 -3.925 -9.049
171 H THR 570 HN THR 570 5.989 -6.614 -9.485
172 HA THR 570 HA THR 570 6.647 -7.484 -6.877
173 HB THR 570 HB THR 570 8.475 -7.066 -9.259
174 HG1 THR 570 HG1 THR 570 6.736 -8.501 -9.709
175 HG21 THR 570 HG21 THR 570 9.843 -8.824 -8.171
176 HG22 THR 570 HG22 THR 570 8.785 -8.734 -6.762
177 HG23 THR 570 HG23 THR 570 9.754 -7.336 -7.231
178 H VAL 571 HN VAL 571 7.324 -6.296 -5.228
179 HA VAL 571 HA VAL 571 8.083 -3.528 -5.701
180 HB VAL 571 HB VAL 571 7.708 -4.923 -3.051
181 HG11 VAL 571 HG11 VAL 571 7.327 -2.654 -2.207
182 HG12 VAL 571 HG12 VAL 571 7.654 -2.006 -3.816
183 HG13 VAL 571 HG13 VAL 571 8.932 -2.830 -2.919
184 HG21 VAL 571 HG21 VAL 571 5.673 -3.388 -4.660
185 HG22 VAL 571 HG22 VAL 571 5.439 -4.031 -3.035
186 HG23 VAL 571 HG23 VAL 571 5.677 -5.131 -4.394
187 H THR 572 HN THR 572 10.124 -3.075 -5.986
188 HA THR 572 HA THR 572 12.146 -4.438 -4.349
189 HB THR 572 HB THR 572 13.790 -3.602 -6.074
190 HG1 THR 572 HG1 THR 572 13.036 -2.773 -7.959
191 HG21 THR 572 HG21 THR 572 13.003 -5.932 -6.036
192 HG22 THR 572 HG22 THR 572 13.318 -5.376 -7.679
193 HG23 THR 572 HG23 THR 572 11.658 -5.491 -7.089
194 H GLY 573 HN GLY 573 13.970 -2.979 -3.667
195 HA2 GLY 573 HA2 GLY 573 12.989 -0.215 -3.374
196 HA3 GLY 573 HA3 GLY 573 13.672 -1.107 -2.016
197 H VAL 574 HN VAL 574 14.637 1.348 -2.976
198 HA VAL 574 HA VAL 574 17.108 0.597 -4.390
199 HB VAL 574 HB VAL 574 15.663 3.255 -4.477
200 HG11 VAL 574 HG11 VAL 574 17.220 3.807 -6.291
201 HG12 VAL 574 HG12 VAL 574 18.053 2.271 -6.037
202 HG13 VAL 574 HG13 VAL 574 18.066 3.502 -4.772
203 HG21 VAL 574 HG21 VAL 574 14.395 1.535 -5.635
204 HG22 VAL 574 HG22 VAL 574 15.827 1.080 -6.557
205 HG23 VAL 574 HG23 VAL 574 15.100 2.669 -6.788
206 H TYR 575 HN TYR 575 19.024 1.345 -3.616
207 HA TYR 575 HA TYR 575 19.054 2.378 -0.932
208 HB2 TYR 575 HB2 TYR 575 20.742 0.747 -1.619
209 HB3 TYR 575 HB3 TYR 575 21.309 1.840 -2.878
210 HD1 TYR 575 HD1 TYR 575 23.314 2.862 -2.394
211 HD2 TYR 575 HD2 TYR 575 20.596 2.090 0.785
212 HE1 TYR 575 HE1 TYR 575 24.893 3.882 -0.807
213 HE2 TYR 575 HE2 TYR 575 22.171 3.107 2.381
214 HH TYR 575 HH TYR 575 24.911 4.909 1.383
215 H ASP 576 HN ASP 576 18.864 4.460 -0.478
216 HA ASP 576 HA ASP 576 19.408 6.430 -2.555
217 HB2 ASP 576 HB2 ASP 576 17.329 6.744 -1.327
218 HB3 ASP 576 HB3 ASP 576 18.202 6.744 0.205
219 H GLU 577 HN GLU 577 21.372 7.058 -2.750
220 HA GLU 577 HA GLU 577 23.373 6.634 -0.778
221 HB2 GLU 577 HB2 GLU 577 23.477 8.244 -3.330
222 HB3 GLU 577 HB3 GLU 577 24.859 7.645 -2.418
223 HG2 GLU 577 HG2 GLU 577 24.317 5.385 -2.926
224 HG3 GLU 577 HG3 GLU 577 22.765 5.849 -3.616
225 H GLU 578 HN GLU 578 21.252 9.251 -1.517
226 HA GLU 578 HA GLU 578 22.975 11.302 -0.482
227 HB2 GLU 578 HB2 GLU 578 20.987 11.447 -2.216
228 HB3 GLU 578 HB3 GLU 578 20.033 11.716 -0.761
229 HG2 GLU 578 HG2 GLU 578 20.716 13.818 -1.772
230 HG3 GLU 578 HG3 GLU 578 21.432 13.612 -0.173
231 H SER 579 HN SER 579 20.309 9.357 0.773
232 HA SER 579 HA SER 579 20.592 10.687 3.375
233 HB2 SER 579 HB2 SER 579 18.592 9.379 4.032
234 HB3 SER 579 HB3 SER 579 18.294 10.375 2.606
235 HG SER 579 HG SER 579 18.078 8.643 1.408
236 H GLY 580 HN GLY 580 21.451 7.845 1.680
237 HA2 GLY 580 HA2 GLY 580 23.063 6.296 2.269
238 HA3 GLY 580 HA3 GLY 580 23.111 6.998 3.876
239 H GLU 581 HN GLU 581 20.082 5.948 2.478
240 HA GLU 581 HA GLU 581 20.238 3.416 3.946
241 HB2 GLU 581 HB2 GLU 581 18.001 5.419 4.279
242 HB3 GLU 581 HB3 GLU 581 17.984 3.779 4.904
243 HG2 GLU 581 HG2 GLU 581 20.311 4.713 5.937
244 HG3 GLU 581 HG3 GLU 581 19.314 6.168 5.927
245 H TRP 582 HN TRP 582 18.512 1.893 3.370
246 HA TRP 582 HA TRP 582 17.822 2.055 0.554
247 HB2 TRP 582 HB2 TRP 582 17.348 -0.090 2.629
248 HB3 TRP 582 HB3 TRP 582 16.888 -0.239 0.935
249 HD1 TRP 582 HD1 TRP 582 20.027 -0.088 3.168
250 HE1 TRP 582 HE1 TRP 582 21.985 -1.146 1.867
251 HE3 TRP 582 HE3 TRP 582 17.723 -0.758 -1.335
252 HZ2 TRP 582 HZ2 TRP 582 22.485 -2.120 -0.745
253 HZ3 TRP 582 HZ3 TRP 582 19.003 -1.749 -3.184
254 HH2 TRP 582 HH2 TRP 582 21.330 -2.415 -2.895
255 H VAL 583 HN VAL 583 15.796 2.379 -0.258
256 HA VAL 583 HA VAL 583 13.784 3.191 1.743
257 HB VAL 583 HB VAL 583 13.024 4.910 0.240
258 HG11 VAL 583 HG11 VAL 583 16.031 4.964 0.464
259 HG12 VAL 583 HG12 VAL 583 14.886 5.469 1.708
260 HG13 VAL 583 HG13 VAL 583 14.989 6.361 0.189
261 HG21 VAL 583 HG21 VAL 583 13.328 3.819 -1.884
262 HG22 VAL 583 HG22 VAL 583 15.081 3.844 -1.691
263 HG23 VAL 583 HG23 VAL 583 14.195 5.355 -1.898
264 H TRP 584 HN TRP 584 11.817 2.316 1.672
265 HA TRP 584 HA TRP 584 10.865 1.173 -0.873
266 HB2 TRP 584 HB2 TRP 584 10.218 0.506 1.989
267 HB3 TRP 584 HB3 TRP 584 9.024 0.203 0.732
268 HD1 TRP 584 HD1 TRP 584 12.095 -0.472 -0.959
269 HE1 TRP 584 HE1 TRP 584 12.727 -2.951 -0.915
270 HE3 TRP 584 HE3 TRP 584 8.988 -1.998 2.780
271 HZ2 TRP 584 HZ2 TRP 584 12.021 -5.261 0.537
272 HZ3 TRP 584 HZ3 TRP 584 9.029 -4.367 3.449
273 HH2 TRP 584 HH2 TRP 584 10.512 -5.964 2.350
274 H LYS 585 HN LYS 585 9.797 2.758 -1.924
275 HA LYS 585 HA LYS 585 8.446 4.824 -0.391
276 HB2 LYS 585 HB2 LYS 585 8.519 6.167 -2.283
277 HB3 LYS 585 HB3 LYS 585 9.990 5.223 -2.422
278 HG2 LYS 585 HG2 LYS 585 7.419 4.762 -3.921
279 HG3 LYS 585 HG3 LYS 585 8.905 5.448 -4.570
280 HD2 LYS 585 HD2 LYS 585 10.057 3.329 -4.194
281 HD3 LYS 585 HD3 LYS 585 8.591 2.646 -3.489
282 HE2 LYS 585 HE2 LYS 585 9.096 3.453 -6.343
283 HE3 LYS 585 HE3 LYS 585 8.637 1.868 -5.719
284 HZ1 LYS 585 HZ1 LYS 585 6.692 2.738 -6.649
285 HZ2 LYS 585 HZ2 LYS 585 6.960 4.289 -6.023
286 HZ3 LYS 585 HZ3 LYS 585 6.502 3.029 -4.992
287 H ASN 586 HN ASN 586 6.276 5.494 -0.803
288 HA ASN 586 HA ASN 586 4.061 5.033 -0.652
289 HB2 ASN 586 HB2 ASN 586 4.394 3.213 -3.058
290 HB3 ASN 586 HB3 ASN 586 2.964 4.078 -2.543
291 HD21 ASN 586 HD21 ASN 586 2.720 6.216 -3.019
292 HD22 ASN 586 HD22 ASN 586 3.736 7.062 -4.138
293 H THR 587 HN THR 587 5.503 3.523 1.092
294 HA THR 587 HA THR 587 4.247 0.866 0.915
295 HB THR 587 HB THR 587 7.082 1.411 1.820
296 HG1 THR 587 HG1 THR 587 6.529 1.474 -0.543
297 HG21 THR 587 HG21 THR 587 6.099 -0.466 3.015
298 HG22 THR 587 HG22 THR 587 7.283 -1.053 1.847
299 HG23 THR 587 HG23 THR 587 5.558 -1.181 1.499
300 H ILE 588 HN ILE 588 3.451 0.032 2.769
301 HA ILE 588 HA ILE 588 4.057 1.309 5.328
302 HB ILE 588 HB ILE 588 2.028 2.438 4.471
303 HG12 ILE 588 HG12 ILE 588 1.448 0.576 6.787
304 HG13 ILE 588 HG13 ILE 588 2.323 2.098 6.902
305 HG21 ILE 588 HG21 ILE 588 1.117 0.721 3.053
306 HG22 ILE 588 HG22 ILE 588 -0.082 1.152 4.271
307 HG23 ILE 588 HG23 ILE 588 0.846 -0.337 4.440
308 HD11 ILE 588 HD11 ILE 588 -0.557 1.770 6.102
309 HD12 ILE 588 HD12 ILE 588 0.313 3.299 6.186
310 HD13 ILE 588 HD13 ILE 588 0.038 2.364 7.653
311 H GLU 589 HN GLU 589 3.728 -0.093 7.125
312 HA GLU 589 HA GLU 589 3.328 -2.904 6.382
313 HB2 GLU 589 HB2 GLU 589 5.477 -2.237 7.511
314 HB3 GLU 589 HB3 GLU 589 4.534 -1.815 8.931
315 HG2 GLU 589 HG2 GLU 589 4.275 -4.566 7.805
316 HG3 GLU 589 HG3 GLU 589 5.728 -4.142 8.711
317 H VAL 590 HN VAL 590 1.449 -3.768 6.831
318 HA VAL 590 HA VAL 590 -0.076 -2.746 9.132
319 HB VAL 590 HB VAL 590 -1.273 -3.665 6.502
320 HG11 VAL 590 HG11 VAL 590 -2.638 -4.200 8.481
321 HG12 VAL 590 HG12 VAL 590 -3.402 -2.983 7.459
322 HG13 VAL 590 HG13 VAL 590 -2.598 -2.499 8.950
323 HG21 VAL 590 HG21 VAL 590 -1.987 -1.325 6.239
324 HG22 VAL 590 HG22 VAL 590 -0.230 -1.475 6.269
325 HG23 VAL 590 HG23 VAL 590 -1.094 -0.898 7.694
326 H ASN 591 HN ASN 591 -0.193 -4.246 10.612
327 HA ASN 591 HA ASN 591 -0.453 -6.205 11.685
328 HB2 ASN 591 HB2 ASN 591 -2.039 -6.795 9.225
329 HB3 ASN 591 HB3 ASN 591 -1.946 -7.916 10.571
330 HD21 ASN 591 HD21 ASN 591 -4.267 -6.554 9.523
331 HD22 ASN 591 HD22 ASN 591 -4.910 -5.600 10.816
332 H GLY 592 HN GLY 592 1.994 -5.938 10.456
333 HA2 GLY 592 HA2 GLY 592 3.826 -7.368 10.544
334 HA3 GLY 592 HA3 GLY 592 2.729 -8.741 10.525
335 H LYS 593 HN LYS 593 1.946 -6.563 8.114
336 HA LYS 593 HA LYS 593 3.560 -8.021 6.145
337 HB2 LYS 593 HB2 LYS 593 0.593 -7.461 5.975
338 HB3 LYS 593 HB3 LYS 593 1.565 -8.129 4.672
339 HG2 LYS 593 HG2 LYS 593 1.944 -10.137 5.848
340 HG3 LYS 593 HG3 LYS 593 1.334 -9.456 7.355
341 HD2 LYS 593 HD2 LYS 593 -0.415 -9.709 4.928
342 HD3 LYS 593 HD3 LYS 593 -0.180 -11.062 6.033
343 HE2 LYS 593 HE2 LYS 593 -2.147 -9.999 6.757
344 HE3 LYS 593 HE3 LYS 593 -0.896 -9.490 7.883
345 HZ1 LYS 593 HZ1 LYS 593 -0.730 -7.390 6.731
346 HZ2 LYS 593 HZ2 LYS 593 -2.340 -7.661 7.187
347 HZ3 LYS 593 HZ3 LYS 593 -1.872 -7.891 5.582
348 H TYR 594 HN TYR 594 4.339 -6.856 4.480
349 HA TYR 594 HA TYR 594 3.925 -3.975 4.613
350 HB2 TYR 594 HB2 TYR 594 6.011 -5.674 3.249
351 HB3 TYR 594 HB3 TYR 594 5.860 -3.946 2.954
352 HD1 TYR 594 HD1 TYR 594 6.519 -2.332 4.622
353 HD2 TYR 594 HD2 TYR 594 6.789 -6.506 5.407
354 HE1 TYR 594 HE1 TYR 594 7.950 -1.871 6.565
355 HE2 TYR 594 HE2 TYR 594 8.220 -6.055 7.354
356 HH TYR 594 HH TYR 594 8.613 -2.932 8.661
357 H PHE 595 HN PHE 595 2.875 -2.853 3.140
358 HA PHE 595 HA PHE 595 2.341 -4.026 0.498
359 HB2 PHE 595 HB2 PHE 595 0.246 -2.592 2.157
360 HB3 PHE 595 HB3 PHE 595 0.023 -3.254 0.547
361 HD1 PHE 595 HD1 PHE 595 -0.104 -5.701 0.229
362 HD2 PHE 595 HD2 PHE 595 0.077 -3.934 4.096
363 HE1 PHE 595 HE1 PHE 595 -0.949 -7.784 1.225
364 HE2 PHE 595 HE2 PHE 595 -0.759 -6.022 5.092
365 HZ PHE 595 HZ PHE 595 -1.272 -7.949 3.653
366 H HIS 596 HN HIS 596 1.950 -2.388 -1.123
367 HA HIS 596 HA HIS 596 3.033 0.192 -0.722
368 HB2 HIS 596 HB2 HIS 596 1.094 -0.882 -2.793
369 HB3 HIS 596 HB3 HIS 596 1.627 0.793 -2.791
370 HD2 HIS 596 HD2 HIS 596 4.793 0.365 -2.347
371 HE1 HIS 596 HE1 HIS 596 4.512 -2.062 -5.804
372 HE2 HIS 596 HE2 HIS 596 6.091 -0.907 -4.199
373 H SER 597 HN SER 597 2.164 1.923 0.273
374 HA SER 597 HA SER 597 -0.176 1.818 1.798
375 HB2 SER 597 HB2 SER 597 0.971 4.393 0.724
376 HB3 SER 597 HB3 SER 597 0.201 4.105 2.285
377 HG SER 597 HG SER 597 2.064 3.513 3.062
378 H THR 598 HN THR 598 0.447 2.912 -1.437
379 HA THR 598 HA THR 598 -2.004 4.021 -2.125
380 HB THR 598 HB THR 598 0.006 2.464 -3.778
381 HG1 THR 598 HG1 THR 598 0.232 4.901 -4.413
382 HG21 THR 598 HG21 THR 598 -0.982 3.546 -5.740
383 HG22 THR 598 HG22 THR 598 -2.214 4.291 -4.726
384 HG23 THR 598 HG23 THR 598 -2.179 2.540 -4.922
385 H CYS 599 HN CYS 599 -0.933 0.657 -2.027
386 HA CYS 599 HA CYS 599 -3.303 -0.406 -3.214
387 HB2 CYS 599 HB2 CYS 599 -1.123 -1.774 -1.637
388 HB3 CYS 599 HB3 CYS 599 -2.386 -2.593 -2.550
389 H TYR 600 HN TYR 600 -2.222 0.123 0.123
390 HA TYR 600 HA TYR 600 -4.150 -1.519 1.350
391 HB2 TYR 600 HB2 TYR 600 -2.231 -0.588 2.606
392 HB3 TYR 600 HB3 TYR 600 -2.930 1.023 2.463
393 HD1 TYR 600 HD1 TYR 600 -4.305 1.804 4.183
394 HD2 TYR 600 HD2 TYR 600 -3.771 -2.386 3.698
395 HE1 TYR 600 HE1 TYR 600 -5.642 1.404 6.211
396 HE2 TYR 600 HE2 TYR 600 -5.090 -2.802 5.726
397 HH TYR 600 HH TYR 600 -6.935 -0.327 7.261
398 H HIS 601 HN HIS 601 -4.243 1.759 0.150
399 HA HIS 601 HA HIS 601 -6.804 2.421 1.154
400 HB2 HIS 601 HB2 HIS 601 -5.067 4.038 0.325
401 HB3 HIS 601 HB3 HIS 601 -5.437 3.516 -1.313
402 HD2 HIS 601 HD2 HIS 601 -7.918 4.388 -2.319
403 HE1 HIS 601 HE1 HIS 601 -8.582 7.102 0.857
404 HE2 HIS 601 HE2 HIS 601 -9.211 6.498 -1.532
405 H GLU 602 HN GLU 602 -5.663 0.992 -1.902
406 HA GLU 602 HA GLU 602 -8.228 1.072 -3.128
407 HB2 GLU 602 HB2 GLU 602 -7.296 -0.104 -4.958
408 HB3 GLU 602 HB3 GLU 602 -6.058 0.995 -4.383
409 HG2 GLU 602 HG2 GLU 602 -4.910 -0.844 -3.273
410 HG3 GLU 602 HG3 GLU 602 -6.168 -1.962 -3.790
411 H THR 603 HN THR 603 -6.564 -1.362 -1.207
412 HA THR 603 HA THR 603 -8.455 -3.412 -1.853
413 HB THR 603 HB THR 603 -6.130 -3.949 -1.182
414 HG1 THR 603 HG1 THR 603 -8.355 -5.002 0.196
415 HG21 THR 603 HG21 THR 603 -7.037 -3.096 1.565
416 HG22 THR 603 HG22 THR 603 -5.828 -2.278 0.574
417 HG23 THR 603 HG23 THR 603 -5.517 -3.903 1.190
Start of MODEL 2
1 H GLY 548 HN GLY 548 3.032 9.339 2.077
2 HA2 GLY 548 HA2 GLY 548 5.019 9.871 1.005
3 HA3 GLY 548 HA3 GLY 548 5.154 11.300 2.021
4 H LYS 549 HN LYS 549 4.575 8.646 3.953
5 HA LYS 549 HA LYS 549 7.325 8.593 4.796
6 HB2 LYS 549 HB2 LYS 549 4.912 7.091 5.814
7 HB3 LYS 549 HB3 LYS 549 6.525 6.947 6.501
8 HG2 LYS 549 HG2 LYS 549 6.377 9.534 6.703
9 HG3 LYS 549 HG3 LYS 549 4.641 9.255 6.568
10 HD2 LYS 549 HD2 LYS 549 5.339 9.353 8.903
11 HD3 LYS 549 HD3 LYS 549 4.738 7.749 8.492
12 HE2 LYS 549 HE2 LYS 549 6.910 6.830 8.444
13 HE3 LYS 549 HE3 LYS 549 7.664 8.424 8.411
14 HZ1 LYS 549 HZ1 LYS 549 7.835 7.387 10.594
15 HZ2 LYS 549 HZ2 LYS 549 6.145 7.296 10.709
16 HZ3 LYS 549 HZ3 LYS 549 6.913 8.808 10.663
17 H TYR 550 HN TYR 550 8.764 7.026 4.532
18 HA TYR 550 HA TYR 550 8.039 4.794 2.769
19 HB2 TYR 550 HB2 TYR 550 10.202 4.848 1.863
20 HB3 TYR 550 HB3 TYR 550 9.782 6.543 2.022
21 HD1 TYR 550 HD1 TYR 550 11.944 3.855 3.191
22 HD2 TYR 550 HD2 TYR 550 10.895 7.941 3.721
23 HE1 TYR 550 HE1 TYR 550 14.018 4.208 4.458
24 HE2 TYR 550 HE2 TYR 550 12.964 8.311 4.998
25 HH TYR 550 HH TYR 550 15.523 6.115 5.045
26 H VAL 551 HN VAL 551 9.239 2.795 3.173
27 HA VAL 551 HA VAL 551 9.881 2.471 6.038
28 HB VAL 551 HB VAL 551 8.798 0.374 4.138
29 HG11 VAL 551 HG11 VAL 551 9.356 0.238 7.098
30 HG12 VAL 551 HG12 VAL 551 10.274 -0.569 5.828
31 HG13 VAL 551 HG13 VAL 551 8.599 -1.033 6.131
32 HG21 VAL 551 HG21 VAL 551 6.746 0.480 5.487
33 HG22 VAL 551 HG22 VAL 551 7.095 2.024 4.709
34 HG23 VAL 551 HG23 VAL 551 7.442 1.805 6.422
35 H VAL 552 HN VAL 552 11.819 1.635 6.536
36 HA VAL 552 HA VAL 552 13.845 1.606 4.561
37 HB VAL 552 HB VAL 552 13.988 0.576 7.397
38 HG11 VAL 552 HG11 VAL 552 16.389 0.953 7.202
39 HG12 VAL 552 HG12 VAL 552 16.181 1.480 5.531
40 HG13 VAL 552 HG13 VAL 552 15.836 -0.190 5.980
41 HG21 VAL 552 HG21 VAL 552 14.640 3.320 6.325
42 HG22 VAL 552 HG22 VAL 552 14.840 2.775 7.991
43 HG23 VAL 552 HG23 VAL 552 13.225 2.907 7.294
44 H VAL 553 HN VAL 553 14.677 -0.000 3.415
45 HA VAL 553 HA VAL 553 13.290 -2.397 3.050
46 HB VAL 553 HB VAL 553 16.147 -1.777 2.260
47 HG11 VAL 553 HG11 VAL 553 14.235 -3.861 1.211
48 HG12 VAL 553 HG12 VAL 553 15.678 -4.167 2.179
49 HG13 VAL 553 HG13 VAL 553 15.830 -3.506 0.550
50 HG21 VAL 553 HG21 VAL 553 13.562 -1.430 0.742
51 HG22 VAL 553 HG22 VAL 553 15.179 -1.186 0.082
52 HG23 VAL 553 HG23 VAL 553 14.588 -0.138 1.371
53 HA PRO 554 HA PRO 554 14.769 -4.785 6.516
54 HB2 PRO 554 HB2 PRO 554 13.646 -6.990 4.901
55 HB3 PRO 554 HB3 PRO 554 13.274 -6.517 6.560
56 HG2 PRO 554 HG2 PRO 554 11.552 -6.056 4.562
57 HG3 PRO 554 HG3 PRO 554 11.746 -4.909 5.902
58 HD2 PRO 554 HD2 PRO 554 12.803 -4.762 3.105
59 HD3 PRO 554 HD3 PRO 554 12.167 -3.469 4.144
60 H GLU 555 HN GLU 555 16.532 -6.126 6.851
61 HA GLU 555 HA GLU 555 18.658 -5.834 5.143
62 HB2 GLU 555 HB2 GLU 555 18.823 -6.466 7.526
63 HB3 GLU 555 HB3 GLU 555 18.276 -8.088 7.120
64 HG2 GLU 555 HG2 GLU 555 20.255 -8.376 5.702
65 HG3 GLU 555 HG3 GLU 555 20.811 -6.772 6.172
66 H THR 556 HN THR 556 16.609 -8.710 5.450
67 HA THR 556 HA THR 556 17.872 -9.763 3.023
68 HB THR 556 HB THR 556 16.867 -11.963 3.791
69 HG1 THR 556 HG1 THR 556 16.599 -11.820 6.254
70 HG21 THR 556 HG21 THR 556 18.901 -10.642 5.593
71 HG22 THR 556 HG22 THR 556 19.244 -11.421 4.051
72 HG23 THR 556 HG23 THR 556 18.655 -12.381 5.407
73 H SER 557 HN SER 557 14.713 -10.335 4.555
74 HA SER 557 HA SER 557 12.618 -10.562 3.725
75 HB2 SER 557 HB2 SER 557 12.933 -8.146 3.123
76 HB3 SER 557 HB3 SER 557 13.500 -8.652 1.533
77 HG SER 557 HG SER 557 11.492 -8.848 0.954
78 H GLN 558 HN GLN 558 14.033 -10.028 0.554
79 HA GLN 558 HA GLN 558 14.291 -12.870 0.023
80 HB2 GLN 558 HB2 GLN 558 12.466 -11.056 -1.580
81 HB3 GLN 558 HB3 GLN 558 13.058 -12.601 -2.168
82 HG2 GLN 558 HG2 GLN 558 11.376 -12.232 0.301
83 HG3 GLN 558 HG3 GLN 558 10.765 -12.711 -1.280
84 HE21 GLN 558 HE21 GLN 558 13.163 -14.328 -1.826
85 HE22 GLN 558 HE22 GLN 558 12.985 -15.769 -0.880
86 H ASP 559 HN ASP 559 13.949 -10.304 -2.317
87 HA ASP 559 HA ASP 559 16.873 -10.138 -2.603
88 HB2 ASP 559 HB2 ASP 559 16.483 -9.608 -5.007
89 HB3 ASP 559 HB3 ASP 559 15.936 -11.220 -4.570
90 H MET 560 HN MET 560 15.751 -8.620 -0.741
91 HA MET 560 HA MET 560 15.304 -6.543 0.045
92 HB2 MET 560 HB2 MET 560 16.813 -5.792 -2.460
93 HB3 MET 560 HB3 MET 560 16.276 -4.604 -1.279
94 HG2 MET 560 HG2 MET 560 17.596 -5.775 0.444
95 HG3 MET 560 HG3 MET 560 18.177 -6.890 -0.790
96 HE1 MET 560 HE1 MET 560 21.230 -4.516 0.154
97 HE2 MET 560 HE2 MET 560 20.637 -6.176 0.190
98 HE3 MET 560 HE3 MET 560 19.913 -4.956 1.238
99 H ALA 561 HN ALA 561 13.316 -7.870 -1.416
100 HA ALA 561 HA ALA 561 11.693 -5.642 -2.360
101 HB1 ALA 561 HB1 ALA 561 12.796 -6.552 -4.358
102 HB2 ALA 561 HB2 ALA 561 11.056 -6.832 -4.394
103 HB3 ALA 561 HB3 ALA 561 12.151 -8.152 -3.983
104 H PHE 562 HN PHE 562 9.405 -6.182 -2.462
105 HA PHE 562 HA PHE 562 8.635 -8.786 -1.349
106 HB2 PHE 562 HB2 PHE 562 7.033 -7.887 0.160
107 HB3 PHE 562 HB3 PHE 562 8.507 -6.978 0.449
108 HD1 PHE 562 HD1 PHE 562 5.083 -6.856 -0.773
109 HD2 PHE 562 HD2 PHE 562 8.650 -4.611 -0.176
110 HE1 PHE 562 HE1 PHE 562 3.809 -4.774 -1.042
111 HE2 PHE 562 HE2 PHE 562 7.378 -2.520 -0.447
112 HZ PHE 562 HZ PHE 562 4.948 -2.602 -0.875
113 H LYS 563 HN LYS 563 6.231 -9.188 -1.849
114 HA LYS 563 HA LYS 563 5.711 -8.014 -4.487
115 HB2 LYS 563 HB2 LYS 563 6.311 -10.420 -4.486
116 HB3 LYS 563 HB3 LYS 563 4.895 -10.749 -3.500
117 HG2 LYS 563 HG2 LYS 563 3.425 -10.330 -5.233
118 HG3 LYS 563 HG3 LYS 563 4.596 -9.350 -6.119
119 HD2 LYS 563 HD2 LYS 563 4.231 -11.534 -7.185
120 HD3 LYS 563 HD3 LYS 563 5.898 -11.329 -6.648
121 HE2 LYS 563 HE2 LYS 563 5.283 -12.587 -4.566
122 HE3 LYS 563 HE3 LYS 563 3.728 -12.941 -5.317
123 HZ1 LYS 563 HZ1 LYS 563 6.406 -13.770 -6.308
124 HZ2 LYS 563 HZ2 LYS 563 4.949 -14.024 -7.144
125 HZ3 LYS 563 HZ3 LYS 563 5.213 -14.773 -5.650
126 H CYS 564 HN CYS 564 3.993 -6.825 -4.700
127 HA CYS 564 HA CYS 564 2.170 -6.408 -2.520
128 HB2 CYS 564 HB2 CYS 564 2.901 -4.559 -3.928
129 HB3 CYS 564 HB3 CYS 564 2.275 -5.358 -5.361
130 HA PRO 565 HA PRO 565 -0.312 -9.846 -3.970
131 HB2 PRO 565 HB2 PRO 565 -2.000 -9.248 -1.648
132 HB3 PRO 565 HB3 PRO 565 -1.053 -10.696 -1.999
133 HG2 PRO 565 HG2 PRO 565 -0.333 -9.001 -0.059
134 HG3 PRO 565 HG3 PRO 565 0.871 -9.833 -1.060
135 HD2 PRO 565 HD2 PRO 565 -0.164 -7.022 -1.293
136 HD3 PRO 565 HD3 PRO 565 1.515 -7.611 -1.367
137 H ILE 566 HN ILE 566 -1.503 -6.620 -3.378
138 HA ILE 566 HA ILE 566 -4.234 -7.160 -3.949
139 HB ILE 566 HB ILE 566 -2.834 -4.493 -4.189
140 HG12 ILE 566 HG12 ILE 566 -3.976 -5.840 -1.729
141 HG13 ILE 566 HG13 ILE 566 -2.293 -5.412 -2.011
142 HG21 ILE 566 HG21 ILE 566 -5.090 -4.561 -5.090
143 HG22 ILE 566 HG22 ILE 566 -5.040 -3.595 -3.615
144 HG23 ILE 566 HG23 ILE 566 -5.693 -5.234 -3.574
145 HD11 ILE 566 HD11 ILE 566 -3.364 -3.860 -0.481
146 HD12 ILE 566 HD12 ILE 566 -4.553 -3.451 -1.718
147 HD13 ILE 566 HD13 ILE 566 -2.852 -3.058 -1.965
148 H CYS 567 HN CYS 567 -1.465 -6.092 -5.840
149 HA CYS 567 HA CYS 567 -3.090 -6.267 -8.271
150 HB2 CYS 567 HB2 CYS 567 -1.936 -4.284 -9.165
151 HB3 CYS 567 HB3 CYS 567 -2.870 -3.924 -7.716
152 H LYS 568 HN LYS 568 -0.564 -7.554 -6.698
153 HA LYS 568 HA LYS 568 0.949 -9.119 -7.305
154 HB2 LYS 568 HB2 LYS 568 -0.167 -8.705 -10.074
155 HB3 LYS 568 HB3 LYS 568 0.997 -9.949 -9.642
156 HG2 LYS 568 HG2 LYS 568 -0.628 -10.904 -8.069
157 HG3 LYS 568 HG3 LYS 568 -1.797 -9.672 -8.556
158 HD2 LYS 568 HD2 LYS 568 -2.181 -11.788 -9.739
159 HD3 LYS 568 HD3 LYS 568 -1.730 -10.495 -10.854
160 HE2 LYS 568 HE2 LYS 568 0.604 -11.330 -10.803
161 HE3 LYS 568 HE3 LYS 568 0.070 -12.669 -9.788
162 HZ1 LYS 568 HZ1 LYS 568 0.216 -13.346 -12.081
163 HZ2 LYS 568 HZ2 LYS 568 -0.828 -12.098 -12.560
164 HZ3 LYS 568 HZ3 LYS 568 -1.409 -13.363 -11.595
165 H GLU 569 HN GLU 569 1.692 -6.266 -7.268
166 HA GLU 569 HA GLU 569 3.749 -6.066 -9.315
167 HB2 GLU 569 HB2 GLU 569 3.230 -4.330 -6.896
168 HB3 GLU 569 HB3 GLU 569 4.377 -3.979 -8.175
169 HG2 GLU 569 HG2 GLU 569 2.615 -3.675 -9.753
170 HG3 GLU 569 HG3 GLU 569 1.407 -4.212 -8.583
171 H THR 570 HN THR 570 5.806 -6.839 -9.032
172 HA THR 570 HA THR 570 6.744 -7.559 -6.404
173 HB THR 570 HB THR 570 8.288 -7.414 -9.009
174 HG1 THR 570 HG1 THR 570 7.939 -9.824 -8.744
175 HG21 THR 570 HG21 THR 570 9.824 -8.969 -7.866
176 HG22 THR 570 HG22 THR 570 8.876 -8.794 -6.389
177 HG23 THR 570 HG23 THR 570 9.733 -7.405 -7.056
178 H VAL 571 HN VAL 571 7.535 -6.104 -5.039
179 HA VAL 571 HA VAL 571 8.047 -3.407 -6.056
180 HB VAL 571 HB VAL 571 7.729 -4.233 -3.178
181 HG11 VAL 571 HG11 VAL 571 7.342 -1.586 -4.564
182 HG12 VAL 571 HG12 VAL 571 8.717 -2.042 -3.556
183 HG13 VAL 571 HG13 VAL 571 7.109 -1.901 -2.844
184 HG21 VAL 571 HG21 VAL 571 5.557 -3.371 -5.086
185 HG22 VAL 571 HG22 VAL 571 5.370 -3.616 -3.349
186 HG23 VAL 571 HG23 VAL 571 5.757 -4.982 -4.396
187 H THR 572 HN THR 572 10.060 -2.862 -6.364
188 HA THR 572 HA THR 572 12.175 -4.080 -4.737
189 HB THR 572 HB THR 572 13.700 -3.127 -6.514
190 HG1 THR 572 HG1 THR 572 12.049 -1.600 -7.279
191 HG21 THR 572 HG21 THR 572 11.589 -5.078 -7.435
192 HG22 THR 572 HG22 THR 572 13.052 -5.479 -6.536
193 HG23 THR 572 HG23 THR 572 13.173 -4.849 -8.178
194 H GLY 573 HN GLY 573 13.968 -2.588 -4.098
195 HA2 GLY 573 HA2 GLY 573 12.887 0.103 -3.566
196 HA3 GLY 573 HA3 GLY 573 13.644 -0.858 -2.302
197 H VAL 574 HN VAL 574 14.481 1.684 -3.011
198 HA VAL 574 HA VAL 574 16.922 1.245 -4.595
199 HB VAL 574 HB VAL 574 15.417 3.833 -4.133
200 HG11 VAL 574 HG11 VAL 574 17.808 4.186 -4.457
201 HG12 VAL 574 HG12 VAL 574 16.886 4.771 -5.843
202 HG13 VAL 574 HG13 VAL 574 17.756 3.239 -5.946
203 HG21 VAL 574 HG21 VAL 574 14.780 3.672 -6.497
204 HG22 VAL 574 HG22 VAL 574 14.138 2.332 -5.549
205 HG23 VAL 574 HG23 VAL 574 15.542 2.084 -6.588
206 H TYR 575 HN TYR 575 18.878 1.991 -3.803
207 HA TYR 575 HA TYR 575 19.023 2.467 -0.972
208 HB2 TYR 575 HB2 TYR 575 20.795 1.183 -2.122
209 HB3 TYR 575 HB3 TYR 575 21.190 2.600 -3.088
210 HD1 TYR 575 HD1 TYR 575 23.114 3.655 -2.461
211 HD2 TYR 575 HD2 TYR 575 20.693 1.889 0.554
212 HE1 TYR 575 HE1 TYR 575 24.709 4.410 -0.746
213 HE2 TYR 575 HE2 TYR 575 22.279 2.637 2.283
214 HH TYR 575 HH TYR 575 24.683 4.918 1.713
215 H ASP 576 HN ASP 576 18.709 4.379 -0.087
216 HA ASP 576 HA ASP 576 18.782 6.767 -1.754
217 HB2 ASP 576 HB2 ASP 576 16.834 6.368 -0.288
218 HB3 ASP 576 HB3 ASP 576 17.896 6.395 1.115
219 H GLU 577 HN GLU 577 20.806 7.502 -1.990
220 HA GLU 577 HA GLU 577 22.854 7.079 -0.084
221 HB2 GLU 577 HB2 GLU 577 22.790 8.981 -2.426
222 HB3 GLU 577 HB3 GLU 577 24.227 8.516 -1.525
223 HG2 GLU 577 HG2 GLU 577 23.775 6.145 -2.204
224 HG3 GLU 577 HG3 GLU 577 22.501 6.757 -3.255
225 H GLU 578 HN GLU 578 20.491 9.548 -0.446
226 HA GLU 578 HA GLU 578 21.866 11.683 0.798
227 HB2 GLU 578 HB2 GLU 578 18.889 11.159 0.736
228 HB3 GLU 578 HB3 GLU 578 19.670 12.704 1.033
229 HG2 GLU 578 HG2 GLU 578 19.840 11.151 -1.538
230 HG3 GLU 578 HG3 GLU 578 18.763 12.508 -1.240
231 H SER 579 HN SER 579 19.645 9.210 2.055
232 HA SER 579 HA SER 579 20.287 10.015 4.791
233 HB2 SER 579 HB2 SER 579 18.529 8.366 5.412
234 HB3 SER 579 HB3 SER 579 17.942 9.602 4.299
235 HG SER 579 HG SER 579 18.101 8.124 2.612
236 H GLY 580 HN GLY 580 21.159 7.649 2.466
237 HA2 GLY 580 HA2 GLY 580 22.921 6.143 2.548
238 HA3 GLY 580 HA3 GLY 580 23.129 6.515 4.251
239 H GLU 581 HN GLU 581 19.967 5.649 3.165
240 HA GLU 581 HA GLU 581 20.359 2.880 4.081
241 HB2 GLU 581 HB2 GLU 581 18.076 4.694 4.908
242 HB3 GLU 581 HB3 GLU 581 18.213 2.984 5.304
243 HG2 GLU 581 HG2 GLU 581 20.323 3.496 6.511
244 HG3 GLU 581 HG3 GLU 581 20.025 5.207 6.215
245 H TRP 582 HN TRP 582 18.715 1.381 3.309
246 HA TRP 582 HA TRP 582 17.861 2.001 0.628
247 HB2 TRP 582 HB2 TRP 582 17.503 -0.461 2.339
248 HB3 TRP 582 HB3 TRP 582 16.962 -0.338 0.666
249 HD1 TRP 582 HD1 TRP 582 20.214 -0.392 2.743
250 HE1 TRP 582 HE1 TRP 582 22.129 -1.175 1.211
251 HE3 TRP 582 HE3 TRP 582 17.659 -0.614 -1.674
252 HZ2 TRP 582 HZ2 TRP 582 22.494 -1.819 -1.518
253 HZ3 TRP 582 HZ3 TRP 582 18.849 -1.332 -3.698
254 HH2 TRP 582 HH2 TRP 582 21.223 -1.926 -3.625
255 H VAL 583 HN VAL 583 15.802 2.323 -0.093
256 HA VAL 583 HA VAL 583 13.806 2.769 2.037
257 HB VAL 583 HB VAL 583 12.938 4.655 0.804
258 HG11 VAL 583 HG11 VAL 583 14.727 5.097 2.383
259 HG12 VAL 583 HG12 VAL 583 14.822 6.203 1.012
260 HG13 VAL 583 HG13 VAL 583 15.929 4.835 1.119
261 HG21 VAL 583 HG21 VAL 583 13.445 3.780 -1.449
262 HG22 VAL 583 HG22 VAL 583 15.143 4.197 -1.199
263 HG23 VAL 583 HG23 VAL 583 13.918 5.468 -1.238
264 H TRP 584 HN TRP 584 11.811 1.992 1.813
265 HA TRP 584 HA TRP 584 10.869 1.216 -0.869
266 HB2 TRP 584 HB2 TRP 584 10.083 0.270 1.888
267 HB3 TRP 584 HB3 TRP 584 8.988 0.085 0.522
268 HD1 TRP 584 HD1 TRP 584 12.066 -0.475 -1.131
269 HE1 TRP 584 HE1 TRP 584 12.743 -2.949 -1.202
270 HE3 TRP 584 HE3 TRP 584 8.966 -2.242 2.518
271 HZ2 TRP 584 HZ2 TRP 584 12.048 -5.344 0.121
272 HZ3 TRP 584 HZ3 TRP 584 9.033 -4.642 3.051
273 HH2 TRP 584 HH2 TRP 584 10.543 -6.162 1.880
274 H LYS 585 HN LYS 585 9.872 2.978 -1.721
275 HA LYS 585 HA LYS 585 8.536 4.855 0.064
276 HB2 LYS 585 HB2 LYS 585 8.773 5.140 -2.931
277 HB3 LYS 585 HB3 LYS 585 8.514 6.398 -1.726
278 HG2 LYS 585 HG2 LYS 585 11.052 4.794 -1.972
279 HG3 LYS 585 HG3 LYS 585 10.799 6.381 -2.702
280 HD2 LYS 585 HD2 LYS 585 10.511 5.842 0.251
281 HD3 LYS 585 HD3 LYS 585 12.020 6.368 -0.499
282 HE2 LYS 585 HE2 LYS 585 9.456 7.894 -0.844
283 HE3 LYS 585 HE3 LYS 585 10.514 8.162 0.541
284 HZ1 LYS 585 HZ1 LYS 585 11.114 8.621 -2.333
285 HZ2 LYS 585 HZ2 LYS 585 12.324 8.589 -1.143
286 HZ3 LYS 585 HZ3 LYS 585 11.099 9.756 -1.071
287 H ASN 586 HN ASN 586 6.385 5.604 -0.337
288 HA ASN 586 HA ASN 586 4.161 5.168 -0.308
289 HB2 ASN 586 HB2 ASN 586 4.581 3.602 -2.881
290 HB3 ASN 586 HB3 ASN 586 3.102 4.337 -2.308
291 HD21 ASN 586 HD21 ASN 586 2.776 5.556 -4.106
292 HD22 ASN 586 HD22 ASN 586 3.779 6.897 -4.538
293 H THR 587 HN THR 587 5.589 3.511 1.307
294 HA THR 587 HA THR 587 4.270 0.907 0.926
295 HB THR 587 HB THR 587 7.072 1.329 1.997
296 HG1 THR 587 HG1 THR 587 6.410 1.437 -0.448
297 HG21 THR 587 HG21 THR 587 7.230 -1.115 1.916
298 HG22 THR 587 HG22 THR 587 5.546 -1.210 1.401
299 HG23 THR 587 HG23 THR 587 5.944 -0.600 3.007
300 H ILE 588 HN ILE 588 3.387 -0.027 2.691
301 HA ILE 588 HA ILE 588 3.770 1.254 5.301
302 HB ILE 588 HB ILE 588 1.733 2.234 4.313
303 HG12 ILE 588 HG12 ILE 588 1.123 0.303 6.564
304 HG13 ILE 588 HG13 ILE 588 1.867 1.886 6.758
305 HG21 ILE 588 HG21 ILE 588 -0.239 0.833 3.885
306 HG22 ILE 588 HG22 ILE 588 0.731 -0.610 4.185
307 HG23 ILE 588 HG23 ILE 588 1.107 0.437 2.816
308 HD11 ILE 588 HD11 ILE 588 -0.481 1.958 7.326
309 HD12 ILE 588 HD12 ILE 588 -0.907 1.350 5.727
310 HD13 ILE 588 HD13 ILE 588 -0.157 2.936 5.896
311 H GLU 589 HN GLU 589 3.540 -0.174 7.051
312 HA GLU 589 HA GLU 589 3.403 -3.005 6.293
313 HB2 GLU 589 HB2 GLU 589 5.468 -2.199 7.430
314 HB3 GLU 589 HB3 GLU 589 4.501 -1.794 8.838
315 HG2 GLU 589 HG2 GLU 589 4.266 -4.570 7.863
316 HG3 GLU 589 HG3 GLU 589 5.829 -4.105 8.534
317 H VAL 590 HN VAL 590 1.655 -4.083 6.737
318 HA VAL 590 HA VAL 590 -0.022 -3.295 9.023
319 HB VAL 590 HB VAL 590 -1.089 -4.159 6.327
320 HG11 VAL 590 HG11 VAL 590 -2.503 -3.176 8.805
321 HG12 VAL 590 HG12 VAL 590 -2.497 -4.827 8.190
322 HG13 VAL 590 HG13 VAL 590 -3.273 -3.545 7.261
323 HG21 VAL 590 HG21 VAL 590 -0.135 -1.907 6.187
324 HG22 VAL 590 HG22 VAL 590 -1.111 -1.402 7.565
325 HG23 VAL 590 HG23 VAL 590 -1.893 -1.865 6.053
326 H ASN 591 HN ASN 591 -0.423 -4.965 10.324
327 HA ASN 591 HA ASN 591 -0.584 -7.063 11.181
328 HB2 ASN 591 HB2 ASN 591 -2.341 -7.150 9.306
329 HB3 ASN 591 HB3 ASN 591 -1.141 -8.044 8.377
330 HD21 ASN 591 HD21 ASN 591 -3.254 -8.098 11.132
331 HD22 ASN 591 HD22 ASN 591 -3.169 -9.801 11.414
332 H GLY 592 HN GLY 592 1.961 -6.070 10.270
333 HA2 GLY 592 HA2 GLY 592 4.111 -6.908 10.379
334 HA3 GLY 592 HA3 GLY 592 3.444 -8.533 10.413
335 H LYS 593 HN LYS 593 2.207 -6.689 7.872
336 HA LYS 593 HA LYS 593 4.093 -7.965 5.999
337 HB2 LYS 593 HB2 LYS 593 1.114 -7.618 5.608
338 HB3 LYS 593 HB3 LYS 593 2.220 -8.404 4.494
339 HG2 LYS 593 HG2 LYS 593 1.500 -9.356 7.253
340 HG3 LYS 593 HG3 LYS 593 0.925 -10.035 5.730
341 HD2 LYS 593 HD2 LYS 593 3.071 -10.847 5.174
342 HD3 LYS 593 HD3 LYS 593 3.845 -9.881 6.430
343 HE2 LYS 593 HE2 LYS 593 2.739 -11.207 8.149
344 HE3 LYS 593 HE3 LYS 593 1.932 -12.165 6.907
345 HZ1 LYS 593 HZ1 LYS 593 4.882 -11.963 7.065
346 HZ2 LYS 593 HZ2 LYS 593 3.945 -13.125 6.250
347 HZ3 LYS 593 HZ3 LYS 593 4.018 -13.126 7.942
348 H TYR 594 HN TYR 594 4.600 -6.816 4.132
349 HA TYR 594 HA TYR 594 4.108 -3.954 4.380
350 HB2 TYR 594 HB2 TYR 594 6.173 -5.485 2.788
351 HB3 TYR 594 HB3 TYR 594 6.021 -3.729 2.795
352 HD1 TYR 594 HD1 TYR 594 6.497 -2.451 4.852
353 HD2 TYR 594 HD2 TYR 594 7.201 -6.645 4.630
354 HE1 TYR 594 HE1 TYR 594 7.897 -2.323 6.869
355 HE2 TYR 594 HE2 TYR 594 8.598 -6.523 6.646
356 HH TYR 594 HH TYR 594 9.932 -4.821 7.857
357 H PHE 595 HN PHE 595 3.007 -2.799 2.958
358 HA PHE 595 HA PHE 595 2.331 -3.936 0.334
359 HB2 PHE 595 HB2 PHE 595 0.361 -2.582 2.195
360 HB3 PHE 595 HB3 PHE 595 0.014 -3.140 0.569
361 HD1 PHE 595 HD1 PHE 595 -0.379 -5.459 0.109
362 HD2 PHE 595 HD2 PHE 595 0.578 -4.154 4.044
363 HE1 PHE 595 HE1 PHE 595 -1.147 -7.615 1.007
364 HE2 PHE 595 HE2 PHE 595 -0.168 -6.318 4.948
365 HZ PHE 595 HZ PHE 595 -1.033 -8.054 3.425
366 H HIS 596 HN HIS 596 1.667 -2.262 -1.206
367 HA HIS 596 HA HIS 596 2.909 0.274 -0.911
368 HB2 HIS 596 HB2 HIS 596 0.796 -0.745 -2.822
369 HB3 HIS 596 HB3 HIS 596 1.390 0.907 -2.877
370 HD2 HIS 596 HD2 HIS 596 4.540 0.478 -2.746
371 HE1 HIS 596 HE1 HIS 596 3.935 -2.162 -5.999
372 HE2 HIS 596 HE2 HIS 596 5.582 -0.609 -4.858
373 H SER 597 HN SER 597 2.188 2.043 0.122
374 HA SER 597 HA SER 597 -0.162 2.048 1.686
375 HB2 SER 597 HB2 SER 597 1.254 4.533 0.721
376 HB3 SER 597 HB3 SER 597 0.380 4.292 2.237
377 HG SER 597 HG SER 597 2.023 2.918 2.919
378 H THR 598 HN THR 598 0.629 3.284 -1.470
379 HA THR 598 HA THR 598 -1.735 4.668 -2.033
380 HB THR 598 HB THR 598 0.208 3.262 -3.883
381 HG1 THR 598 HG1 THR 598 0.034 6.029 -3.313
382 HG21 THR 598 HG21 THR 598 -1.863 5.378 -4.509
383 HG22 THR 598 HG22 THR 598 -1.906 3.698 -5.048
384 HG23 THR 598 HG23 THR 598 -0.638 4.780 -5.629
385 H CYS 599 HN CYS 599 -0.821 1.284 -2.566
386 HA CYS 599 HA CYS 599 -3.215 0.644 -4.000
387 HB2 CYS 599 HB2 CYS 599 -1.074 -1.138 -2.836
388 HB3 CYS 599 HB3 CYS 599 -2.354 -1.667 -3.923
389 H TYR 600 HN TYR 600 -2.234 0.506 -0.656
390 HA TYR 600 HA TYR 600 -3.685 -1.708 0.199
391 HB2 TYR 600 HB2 TYR 600 -1.930 -0.675 1.545
392 HB3 TYR 600 HB3 TYR 600 -2.920 0.766 1.755
393 HD1 TYR 600 HD1 TYR 600 -4.357 0.940 3.571
394 HD2 TYR 600 HD2 TYR 600 -2.886 -2.885 2.459
395 HE1 TYR 600 HE1 TYR 600 -5.343 -0.021 5.604
396 HE2 TYR 600 HE2 TYR 600 -3.870 -3.864 4.487
397 HH TYR 600 HH TYR 600 -4.566 -3.103 6.740
398 H HIS 601 HN HIS 601 -4.758 1.626 -0.210
399 HA HIS 601 HA HIS 601 -7.036 1.431 1.427
400 HB2 HIS 601 HB2 HIS 601 -6.217 3.352 -0.717
401 HB3 HIS 601 HB3 HIS 601 -7.829 3.439 -0.007
402 HD2 HIS 601 HD2 HIS 601 -7.013 2.870 3.084
403 HE1 HIS 601 HE1 HIS 601 -4.579 6.292 2.578
404 HE2 HIS 601 HE2 HIS 601 -5.789 4.833 4.266
405 H GLU 602 HN GLU 602 -6.526 0.396 -1.871
406 HA GLU 602 HA GLU 602 -9.287 0.419 -2.574
407 HB2 GLU 602 HB2 GLU 602 -8.712 -0.789 -4.540
408 HB3 GLU 602 HB3 GLU 602 -7.449 0.394 -4.256
409 HG2 GLU 602 HG2 GLU 602 -5.947 -1.312 -3.477
410 HG3 GLU 602 HG3 GLU 602 -7.228 -2.524 -3.534
411 H THR 603 HN THR 603 -7.318 -1.769 -0.773
412 HA THR 603 HA THR 603 -9.170 -3.982 -0.980
413 HB THR 603 HB THR 603 -6.845 -3.542 0.911
414 HG1 THR 603 HG1 THR 603 -6.879 -4.114 -1.684
415 HG21 THR 603 HG21 THR 603 -6.945 -5.959 1.287
416 HG22 THR 603 HG22 THR 603 -8.383 -6.062 0.272
417 HG23 THR 603 HG23 THR 603 -8.437 -5.170 1.795
Start of MODEL 3
1 H GLY 548 HN GLY 548 3.473 9.534 1.112
2 HA2 GLY 548 HA2 GLY 548 4.942 9.347 -0.751
3 HA3 GLY 548 HA3 GLY 548 5.448 11.010 -0.485
4 H LYS 549 HN LYS 549 5.321 9.595 2.479
5 HA LYS 549 HA LYS 549 8.169 9.416 2.621
6 HB2 LYS 549 HB2 LYS 549 6.019 8.987 4.682
7 HB3 LYS 549 HB3 LYS 549 7.726 8.735 5.027
8 HG2 LYS 549 HG2 LYS 549 6.395 11.311 4.204
9 HG3 LYS 549 HG3 LYS 549 7.148 10.926 5.758
10 HD2 LYS 549 HD2 LYS 549 9.311 10.655 4.612
11 HD3 LYS 549 HD3 LYS 549 8.551 11.122 3.092
12 HE2 LYS 549 HE2 LYS 549 9.682 13.035 3.975
13 HE3 LYS 549 HE3 LYS 549 7.946 13.298 4.151
14 HZ1 LYS 549 HZ1 LYS 549 8.056 13.119 6.406
15 HZ2 LYS 549 HZ2 LYS 549 9.601 13.754 6.114
16 HZ3 LYS 549 HZ3 LYS 549 9.405 12.095 6.391
17 H TYR 550 HN TYR 550 9.347 7.638 3.387
18 HA TYR 550 HA TYR 550 8.372 5.147 2.164
19 HB2 TYR 550 HB2 TYR 550 10.631 4.753 1.399
20 HB3 TYR 550 HB3 TYR 550 10.136 6.363 0.881
21 HD1 TYR 550 HD1 TYR 550 12.449 4.455 2.959
22 HD2 TYR 550 HD2 TYR 550 11.078 8.360 1.982
23 HE1 TYR 550 HE1 TYR 550 14.456 5.420 4.005
24 HE2 TYR 550 HE2 TYR 550 13.073 9.333 3.032
25 HH TYR 550 HH TYR 550 15.791 7.585 3.802
26 H VAL 551 HN VAL 551 9.397 3.196 2.951
27 HA VAL 551 HA VAL 551 10.273 3.394 5.763
28 HB VAL 551 HB VAL 551 8.874 1.067 4.412
29 HG11 VAL 551 HG11 VAL 551 10.389 0.285 6.119
30 HG12 VAL 551 HG12 VAL 551 8.731 0.127 6.695
31 HG13 VAL 551 HG13 VAL 551 9.740 1.449 7.277
32 HG21 VAL 551 HG21 VAL 551 7.334 2.917 4.756
33 HG22 VAL 551 HG22 VAL 551 7.819 3.034 6.448
34 HG23 VAL 551 HG23 VAL 551 6.971 1.598 5.872
35 H VAL 552 HN VAL 552 12.182 2.462 6.274
36 HA VAL 552 HA VAL 552 14.056 2.021 4.214
37 HB VAL 552 HB VAL 552 14.252 1.273 7.147
38 HG11 VAL 552 HG11 VAL 552 16.418 1.666 5.083
39 HG12 VAL 552 HG12 VAL 552 15.924 0.125 5.785
40 HG13 VAL 552 HG13 VAL 552 16.679 1.357 6.800
41 HG21 VAL 552 HG21 VAL 552 15.413 3.410 7.408
42 HG22 VAL 552 HG22 VAL 552 13.771 3.647 6.809
43 HG23 VAL 552 HG23 VAL 552 15.138 3.769 5.702
44 H VAL 553 HN VAL 553 14.812 0.207 3.267
45 HA VAL 553 HA VAL 553 13.189 -2.069 3.137
46 HB VAL 553 HB VAL 553 16.094 -1.798 2.338
47 HG11 VAL 553 HG11 VAL 553 14.034 -3.835 1.490
48 HG12 VAL 553 HG12 VAL 553 15.410 -4.140 2.550
49 HG13 VAL 553 HG13 VAL 553 15.678 -3.700 0.864
50 HG21 VAL 553 HG21 VAL 553 13.557 -1.434 0.748
51 HG22 VAL 553 HG22 VAL 553 15.186 -1.434 0.075
52 HG23 VAL 553 HG23 VAL 553 14.700 -0.169 1.207
53 HA PRO 554 HA PRO 554 14.233 -4.017 6.988
54 HB2 PRO 554 HB2 PRO 554 13.083 -6.360 5.586
55 HB3 PRO 554 HB3 PRO 554 12.634 -5.650 7.138
56 HG2 PRO 554 HG2 PRO 554 11.110 -5.332 4.966
57 HG3 PRO 554 HG3 PRO 554 11.299 -4.037 6.164
58 HD2 PRO 554 HD2 PRO 554 12.520 -4.317 3.454
59 HD3 PRO 554 HD3 PRO 554 11.982 -2.857 4.307
60 H GLU 555 HN GLU 555 15.825 -5.268 7.747
61 HA GLU 555 HA GLU 555 17.916 -6.110 5.995
62 HB2 GLU 555 HB2 GLU 555 17.529 -6.631 8.948
63 HB3 GLU 555 HB3 GLU 555 19.033 -6.815 8.053
64 HG2 GLU 555 HG2 GLU 555 19.363 -4.551 7.859
65 HG3 GLU 555 HG3 GLU 555 17.648 -4.181 8.022
66 H THR 556 HN THR 556 15.095 -7.551 7.172
67 HA THR 556 HA THR 556 16.059 -10.254 6.581
68 HB THR 556 HB THR 556 13.848 -10.940 7.617
69 HG1 THR 556 HG1 THR 556 13.012 -9.180 9.041
70 HG21 THR 556 HG21 THR 556 15.784 -9.378 9.332
71 HG22 THR 556 HG22 THR 556 15.940 -11.073 8.867
72 HG23 THR 556 HG23 THR 556 14.622 -10.565 9.923
73 H SER 557 HN SER 557 15.298 -8.054 4.656
74 HA SER 557 HA SER 557 12.856 -8.870 3.420
75 HB2 SER 557 HB2 SER 557 13.746 -6.558 3.232
76 HB3 SER 557 HB3 SER 557 15.094 -7.174 2.285
77 HG SER 557 HG SER 557 12.570 -6.582 1.504
78 H GLN 558 HN GLN 558 12.604 -9.909 1.399
79 HA GLN 558 HA GLN 558 14.617 -11.963 0.939
80 HB2 GLN 558 HB2 GLN 558 11.855 -11.638 -0.251
81 HB3 GLN 558 HB3 GLN 558 12.885 -13.054 -0.409
82 HG2 GLN 558 HG2 GLN 558 11.724 -12.007 2.166
83 HG3 GLN 558 HG3 GLN 558 11.114 -13.376 1.246
84 HE21 GLN 558 HE21 GLN 558 13.782 -14.325 0.570
85 HE22 GLN 558 HE22 GLN 558 14.418 -15.041 2.007
86 H ASP 559 HN ASP 559 16.200 -10.804 -0.091
87 HA ASP 559 HA ASP 559 17.384 -9.988 -1.842
88 HB2 ASP 559 HB2 ASP 559 16.118 -11.912 -3.010
89 HB3 ASP 559 HB3 ASP 559 15.101 -10.651 -3.697
90 H MET 560 HN MET 560 15.695 -8.308 -0.305
91 HA MET 560 HA MET 560 15.077 -6.140 -0.164
92 HB2 MET 560 HB2 MET 560 16.604 -5.986 -2.759
93 HB3 MET 560 HB3 MET 560 15.920 -4.573 -1.972
94 HG2 MET 560 HG2 MET 560 18.215 -4.684 -1.393
95 HG3 MET 560 HG3 MET 560 17.282 -5.108 0.034
96 HE1 MET 560 HE1 MET 560 20.412 -5.597 -0.333
97 HE2 MET 560 HE2 MET 560 20.603 -7.220 0.327
98 HE3 MET 560 HE3 MET 560 19.557 -6.064 1.145
99 H ALA 561 HN ALA 561 13.282 -8.071 -1.496
100 HA ALA 561 HA ALA 561 11.537 -6.106 -2.759
101 HB1 ALA 561 HB1 ALA 561 12.252 -8.726 -4.090
102 HB2 ALA 561 HB2 ALA 561 12.768 -7.123 -4.614
103 HB3 ALA 561 HB3 ALA 561 11.061 -7.560 -4.668
104 H PHE 562 HN PHE 562 9.335 -6.671 -2.757
105 HA PHE 562 HA PHE 562 8.601 -9.288 -1.698
106 HB2 PHE 562 HB2 PHE 562 7.046 -8.478 -0.082
107 HB3 PHE 562 HB3 PHE 562 8.559 -7.644 0.231
108 HD1 PHE 562 HD1 PHE 562 5.106 -7.310 -0.875
109 HD2 PHE 562 HD2 PHE 562 8.765 -5.261 -0.174
110 HE1 PHE 562 HE1 PHE 562 3.909 -5.169 -0.923
111 HE2 PHE 562 HE2 PHE 562 7.573 -3.110 -0.228
112 HZ PHE 562 HZ PHE 562 5.141 -3.062 -0.601
113 H LYS 563 HN LYS 563 6.271 -9.766 -2.140
114 HA LYS 563 HA LYS 563 5.653 -8.617 -4.770
115 HB2 LYS 563 HB2 LYS 563 5.995 -11.079 -4.569
116 HB3 LYS 563 HB3 LYS 563 4.599 -11.158 -3.504
117 HG2 LYS 563 HG2 LYS 563 3.808 -11.807 -5.606
118 HG3 LYS 563 HG3 LYS 563 3.286 -10.133 -5.417
119 HD2 LYS 563 HD2 LYS 563 5.048 -9.346 -6.819
120 HD3 LYS 563 HD3 LYS 563 5.784 -10.946 -6.875
121 HE2 LYS 563 HE2 LYS 563 3.090 -10.200 -7.987
122 HE3 LYS 563 HE3 LYS 563 4.556 -10.460 -8.930
123 HZ1 LYS 563 HZ1 LYS 563 4.537 -12.765 -7.843
124 HZ2 LYS 563 HZ2 LYS 563 3.432 -12.462 -9.085
125 HZ3 LYS 563 HZ3 LYS 563 2.915 -12.439 -7.473
126 H CYS 564 HN CYS 564 4.016 -7.228 -4.964
127 HA CYS 564 HA CYS 564 2.206 -6.739 -2.777
128 HB2 CYS 564 HB2 CYS 564 3.066 -4.925 -4.205
129 HB3 CYS 564 HB3 CYS 564 2.259 -5.634 -5.598
130 HA PRO 565 HA PRO 565 -0.425 -10.057 -4.158
131 HB2 PRO 565 HB2 PRO 565 -2.254 -9.219 -2.033
132 HB3 PRO 565 HB3 PRO 565 -1.344 -10.720 -2.198
133 HG2 PRO 565 HG2 PRO 565 -0.743 -8.866 -0.345
134 HG3 PRO 565 HG3 PRO 565 0.492 -9.886 -1.099
135 HD2 PRO 565 HD2 PRO 565 -0.219 -7.036 -1.676
136 HD3 PRO 565 HD3 PRO 565 1.379 -7.807 -1.599
137 H ILE 566 HN ILE 566 -1.609 -6.779 -3.678
138 HA ILE 566 HA ILE 566 -4.225 -7.255 -4.677
139 HB ILE 566 HB ILE 566 -2.748 -4.619 -4.520
140 HG12 ILE 566 HG12 ILE 566 -4.574 -5.861 -2.449
141 HG13 ILE 566 HG13 ILE 566 -2.815 -5.929 -2.365
142 HG21 ILE 566 HG21 ILE 566 -4.976 -3.639 -4.410
143 HG22 ILE 566 HG22 ILE 566 -5.697 -5.243 -4.534
144 HG23 ILE 566 HG23 ILE 566 -4.779 -4.586 -5.887
145 HD11 ILE 566 HD11 ILE 566 -4.501 -3.432 -2.330
146 HD12 ILE 566 HD12 ILE 566 -2.739 -3.489 -2.259
147 HD13 ILE 566 HD13 ILE 566 -3.693 -4.175 -0.946
148 H CYS 567 HN CYS 567 -1.398 -5.617 -6.105
149 HA CYS 567 HA CYS 567 -2.745 -5.754 -8.706
150 HB2 CYS 567 HB2 CYS 567 -1.310 -3.850 -9.359
151 HB3 CYS 567 HB3 CYS 567 -2.340 -3.488 -7.978
152 H LYS 568 HN LYS 568 -0.454 -7.357 -7.040
153 HA LYS 568 HA LYS 568 0.871 -9.087 -7.640
154 HB2 LYS 568 HB2 LYS 568 -0.006 -8.570 -10.484
155 HB3 LYS 568 HB3 LYS 568 0.695 -10.051 -9.855
156 HG2 LYS 568 HG2 LYS 568 -1.999 -8.902 -9.154
157 HG3 LYS 568 HG3 LYS 568 -1.689 -10.315 -10.164
158 HD2 LYS 568 HD2 LYS 568 -0.687 -11.451 -8.220
159 HD3 LYS 568 HD3 LYS 568 -1.044 -10.034 -7.227
160 HE2 LYS 568 HE2 LYS 568 -3.088 -11.738 -8.658
161 HE3 LYS 568 HE3 LYS 568 -2.724 -11.801 -6.935
162 HZ1 LYS 568 HZ1 LYS 568 -3.441 -9.494 -6.744
163 HZ2 LYS 568 HZ2 LYS 568 -4.687 -10.470 -7.350
164 HZ3 LYS 568 HZ3 LYS 568 -3.823 -9.456 -8.398
165 H GLU 569 HN GLU 569 1.907 -6.315 -7.638
166 HA GLU 569 HA GLU 569 4.007 -6.512 -9.668
167 HB2 GLU 569 HB2 GLU 569 4.501 -4.191 -9.182
168 HB3 GLU 569 HB3 GLU 569 2.777 -4.368 -9.479
169 HG2 GLU 569 HG2 GLU 569 2.438 -4.446 -7.017
170 HG3 GLU 569 HG3 GLU 569 4.147 -4.060 -6.824
171 H THR 570 HN THR 570 6.069 -6.969 -9.146
172 HA THR 570 HA THR 570 6.756 -7.613 -6.428
173 HB THR 570 HB THR 570 8.502 -7.518 -8.901
174 HG1 THR 570 HG1 THR 570 8.055 -9.997 -8.033
175 HG21 THR 570 HG21 THR 570 9.023 -8.817 -6.216
176 HG22 THR 570 HG22 THR 570 9.807 -7.354 -6.809
177 HG23 THR 570 HG23 THR 570 10.081 -8.891 -7.630
178 H VAL 571 HN VAL 571 7.483 -6.187 -4.993
179 HA VAL 571 HA VAL 571 8.130 -3.481 -5.886
180 HB VAL 571 HB VAL 571 7.850 -4.433 -3.041
181 HG11 VAL 571 HG11 VAL 571 8.877 -2.260 -3.287
182 HG12 VAL 571 HG12 VAL 571 7.249 -2.071 -2.638
183 HG13 VAL 571 HG13 VAL 571 7.568 -1.725 -4.338
184 HG21 VAL 571 HG21 VAL 571 5.677 -3.454 -4.891
185 HG22 VAL 571 HG22 VAL 571 5.500 -3.720 -3.155
186 HG23 VAL 571 HG23 VAL 571 5.837 -5.080 -4.229
187 H THR 572 HN THR 572 10.181 -2.992 -6.220
188 HA THR 572 HA THR 572 12.264 -4.257 -4.582
189 HB THR 572 HB THR 572 13.810 -3.355 -6.367
190 HG1 THR 572 HG1 THR 572 12.599 -1.802 -7.362
191 HG21 THR 572 HG21 THR 572 11.660 -5.291 -7.246
192 HG22 THR 572 HG22 THR 572 13.138 -5.697 -6.376
193 HG23 THR 572 HG23 THR 572 13.234 -5.086 -8.026
194 H GLY 573 HN GLY 573 14.044 -2.819 -3.844
195 HA2 GLY 573 HA2 GLY 573 13.170 -0.015 -3.626
196 HA3 GLY 573 HA3 GLY 573 13.743 -0.901 -2.219
197 H VAL 574 HN VAL 574 14.849 1.489 -3.177
198 HA VAL 574 HA VAL 574 17.410 0.628 -4.359
199 HB VAL 574 HB VAL 574 16.192 3.398 -4.461
200 HG11 VAL 574 HG11 VAL 574 17.840 3.832 -6.204
201 HG12 VAL 574 HG12 VAL 574 18.481 2.199 -6.018
202 HG13 VAL 574 HG13 VAL 574 18.620 3.358 -4.696
203 HG21 VAL 574 HG21 VAL 574 15.652 2.929 -6.815
204 HG22 VAL 574 HG22 VAL 574 14.754 1.899 -5.700
205 HG23 VAL 574 HG23 VAL 574 16.138 1.250 -6.580
206 H TYR 575 HN TYR 575 19.312 1.489 -3.469
207 HA TYR 575 HA TYR 575 19.131 2.379 -0.723
208 HB2 TYR 575 HB2 TYR 575 20.919 0.814 -1.504
209 HB3 TYR 575 HB3 TYR 575 21.567 2.110 -2.507
210 HD1 TYR 575 HD1 TYR 575 23.370 3.240 -1.661
211 HD2 TYR 575 HD2 TYR 575 20.568 1.578 1.074
212 HE1 TYR 575 HE1 TYR 575 24.718 4.080 0.220
213 HE2 TYR 575 HE2 TYR 575 21.916 2.395 2.964
214 HH TYR 575 HH TYR 575 24.247 3.069 3.427
215 H ASP 576 HN ASP 576 18.878 4.445 -0.210
216 HA ASP 576 HA ASP 576 19.323 6.478 -2.250
217 HB2 ASP 576 HB2 ASP 576 17.204 6.533 -0.995
218 HB3 ASP 576 HB3 ASP 576 18.097 6.671 0.514
219 H GLU 577 HN GLU 577 21.351 7.126 -2.395
220 HA GLU 577 HA GLU 577 23.234 6.913 -0.287
221 HB2 GLU 577 HB2 GLU 577 23.335 8.297 -2.962
222 HB3 GLU 577 HB3 GLU 577 24.716 8.181 -1.875
223 HG2 GLU 577 HG2 GLU 577 24.855 5.861 -2.115
224 HG3 GLU 577 HG3 GLU 577 23.226 5.738 -2.779
225 H GLU 578 HN GLU 578 21.000 9.359 -1.147
226 HA GLU 578 HA GLU 578 22.409 11.634 -0.201
227 HB2 GLU 578 HB2 GLU 578 20.433 11.627 -1.773
228 HB3 GLU 578 HB3 GLU 578 19.416 11.261 -0.388
229 HG2 GLU 578 HG2 GLU 578 19.823 13.355 0.597
230 HG3 GLU 578 HG3 GLU 578 21.175 13.691 -0.484
231 H SER 579 HN SER 579 19.948 9.524 1.254
232 HA SER 579 HA SER 579 20.456 10.719 3.876
233 HB2 SER 579 HB2 SER 579 18.554 9.293 4.612
234 HB3 SER 579 HB3 SER 579 18.125 10.371 3.283
235 HG SER 579 HG SER 579 18.251 8.651 1.859
236 H GLY 580 HN GLY 580 21.216 7.938 2.010
237 HA2 GLY 580 HA2 GLY 580 22.832 6.321 2.424
238 HA3 GLY 580 HA3 GLY 580 22.997 6.932 4.060
239 H GLU 581 HN GLU 581 19.906 5.993 2.671
240 HA GLU 581 HA GLU 581 19.953 3.486 4.206
241 HB2 GLU 581 HB2 GLU 581 17.817 5.625 4.393
242 HB3 GLU 581 HB3 GLU 581 17.647 3.997 5.037
243 HG2 GLU 581 HG2 GLU 581 19.584 4.405 6.503
244 HG3 GLU 581 HG3 GLU 581 19.669 6.058 5.894
245 H TRP 582 HN TRP 582 18.466 1.882 3.454
246 HA TRP 582 HA TRP 582 17.825 2.044 0.650
247 HB2 TRP 582 HB2 TRP 582 17.185 -0.062 2.728
248 HB3 TRP 582 HB3 TRP 582 16.784 -0.216 1.017
249 HD1 TRP 582 HD1 TRP 582 19.828 -0.126 3.377
250 HE1 TRP 582 HE1 TRP 582 21.797 -1.305 2.198
251 HE3 TRP 582 HE3 TRP 582 17.680 -0.886 -1.191
252 HZ2 TRP 582 HZ2 TRP 582 22.353 -2.401 -0.345
253 HZ3 TRP 582 HZ3 TRP 582 18.986 -2.001 -2.945
254 HH2 TRP 582 HH2 TRP 582 21.281 -2.748 -2.533
255 H VAL 583 HN VAL 583 15.819 2.330 -0.276
256 HA VAL 583 HA VAL 583 13.746 3.225 1.628
257 HB VAL 583 HB VAL 583 13.012 4.873 0.013
258 HG11 VAL 583 HG11 VAL 583 15.999 4.987 0.410
259 HG12 VAL 583 HG12 VAL 583 14.770 5.526 1.555
260 HG13 VAL 583 HG13 VAL 583 14.956 6.352 0.009
261 HG21 VAL 583 HG21 VAL 583 15.240 3.889 -1.770
262 HG22 VAL 583 HG22 VAL 583 14.189 5.273 -2.084
263 HG23 VAL 583 HG23 VAL 583 13.513 3.644 -2.041
264 H TRP 584 HN TRP 584 11.857 2.188 1.613
265 HA TRP 584 HA TRP 584 10.805 1.229 -0.971
266 HB2 TRP 584 HB2 TRP 584 10.274 0.376 1.865
267 HB3 TRP 584 HB3 TRP 584 9.033 0.154 0.644
268 HD1 TRP 584 HD1 TRP 584 12.015 -0.453 -1.231
269 HE1 TRP 584 HE1 TRP 584 12.609 -2.948 -1.338
270 HE3 TRP 584 HE3 TRP 584 9.066 -2.127 2.581
271 HZ2 TRP 584 HZ2 TRP 584 11.919 -5.324 0.030
272 HZ3 TRP 584 HZ3 TRP 584 9.089 -4.527 3.125
273 HH2 TRP 584 HH2 TRP 584 10.483 -6.090 1.877
274 H LYS 585 HN LYS 585 9.718 2.933 -1.844
275 HA LYS 585 HA LYS 585 8.515 4.857 -0.046
276 HB2 LYS 585 HB2 LYS 585 8.172 6.219 -2.099
277 HB3 LYS 585 HB3 LYS 585 9.844 5.813 -1.764
278 HG2 LYS 585 HG2 LYS 585 9.710 5.510 -4.036
279 HG3 LYS 585 HG3 LYS 585 9.451 3.873 -3.437
280 HD2 LYS 585 HD2 LYS 585 7.104 4.022 -3.791
281 HD3 LYS 585 HD3 LYS 585 7.195 5.755 -4.113
282 HE2 LYS 585 HE2 LYS 585 8.491 3.628 -5.807
283 HE3 LYS 585 HE3 LYS 585 6.918 4.346 -6.145
284 HZ1 LYS 585 HZ1 LYS 585 8.705 5.383 -7.417
285 HZ2 LYS 585 HZ2 LYS 585 9.480 5.842 -5.978
286 HZ3 LYS 585 HZ3 LYS 585 7.967 6.489 -6.369
287 H ASN 586 HN ASN 586 6.406 5.655 -0.262
288 HA ASN 586 HA ASN 586 4.184 5.295 -0.006
289 HB2 ASN 586 HB2 ASN 586 4.283 3.802 -2.635
290 HB3 ASN 586 HB3 ASN 586 2.920 4.640 -1.926
291 HD21 ASN 586 HD21 ASN 586 3.993 4.989 -4.529
292 HD22 ASN 586 HD22 ASN 586 4.528 6.631 -4.651
293 H THR 587 HN THR 587 5.716 3.500 1.369
294 HA THR 587 HA THR 587 4.229 0.980 1.072
295 HB THR 587 HB THR 587 7.053 1.316 2.112
296 HG1 THR 587 HG1 THR 587 6.403 1.537 -0.316
297 HG21 THR 587 HG21 THR 587 7.131 -1.153 1.887
298 HG22 THR 587 HG22 THR 587 5.416 -1.145 1.477
299 HG23 THR 587 HG23 THR 587 5.941 -0.623 3.077
300 H ILE 588 HN ILE 588 3.369 0.065 2.883
301 HA ILE 588 HA ILE 588 3.862 1.333 5.481
302 HB ILE 588 HB ILE 588 1.838 2.404 4.593
303 HG12 ILE 588 HG12 ILE 588 1.223 0.412 6.793
304 HG13 ILE 588 HG13 ILE 588 1.981 1.988 7.012
305 HG21 ILE 588 HG21 ILE 588 0.743 -0.399 4.384
306 HG22 ILE 588 HG22 ILE 588 1.093 0.697 3.047
307 HG23 ILE 588 HG23 ILE 588 -0.202 1.076 4.183
308 HD11 ILE 588 HD11 ILE 588 -0.349 2.073 7.628
309 HD12 ILE 588 HD12 ILE 588 -0.817 1.464 6.041
310 HD13 ILE 588 HD13 ILE 588 -0.075 3.056 6.189
311 H GLU 589 HN GLU 589 3.769 -0.096 7.201
312 HA GLU 589 HA GLU 589 3.472 -2.912 6.464
313 HB2 GLU 589 HB2 GLU 589 5.541 -2.055 7.679
314 HB3 GLU 589 HB3 GLU 589 4.508 -1.809 9.077
315 HG2 GLU 589 HG2 GLU 589 4.486 -4.500 7.836
316 HG3 GLU 589 HG3 GLU 589 5.933 -4.016 8.713
317 H VAL 590 HN VAL 590 1.664 -3.915 6.894
318 HA VAL 590 HA VAL 590 0.012 -2.989 9.145
319 HB VAL 590 HB VAL 590 -1.029 -3.959 6.473
320 HG11 VAL 590 HG11 VAL 590 -2.464 -4.594 8.341
321 HG12 VAL 590 HG12 VAL 590 -3.231 -3.363 7.336
322 HG13 VAL 590 HG13 VAL 590 -2.511 -2.920 8.886
323 HG21 VAL 590 HG21 VAL 590 -0.116 -1.719 6.270
324 HG22 VAL 590 HG22 VAL 590 -1.039 -1.186 7.677
325 HG23 VAL 590 HG23 VAL 590 -1.876 -1.662 6.198
326 H ASN 591 HN ASN 591 -0.084 -4.508 10.609
327 HA ASN 591 HA ASN 591 -0.311 -6.489 11.674
328 HB2 ASN 591 HB2 ASN 591 -2.382 -6.467 10.177
329 HB3 ASN 591 HB3 ASN 591 -1.507 -7.578 9.127
330 HD21 ASN 591 HD21 ASN 591 -3.027 -9.214 9.502
331 HD22 ASN 591 HD22 ASN 591 -3.086 -10.083 10.993
332 H GLY 592 HN GLY 592 2.171 -5.991 10.387
333 HA2 GLY 592 HA2 GLY 592 4.120 -7.259 10.539
334 HA3 GLY 592 HA3 GLY 592 3.157 -8.726 10.499
335 H LYS 593 HN LYS 593 2.161 -6.705 8.027
336 HA LYS 593 HA LYS 593 4.078 -7.899 6.143
337 HB2 LYS 593 HB2 LYS 593 1.077 -7.797 5.881
338 HB3 LYS 593 HB3 LYS 593 2.148 -8.108 4.521
339 HG2 LYS 593 HG2 LYS 593 3.010 -10.097 5.664
340 HG3 LYS 593 HG3 LYS 593 1.914 -9.786 7.012
341 HD2 LYS 593 HD2 LYS 593 -0.001 -10.118 5.600
342 HD3 LYS 593 HD3 LYS 593 1.022 -10.227 4.165
343 HE2 LYS 593 HE2 LYS 593 2.034 -12.262 5.016
344 HE3 LYS 593 HE3 LYS 593 1.084 -12.142 6.495
345 HZ1 LYS 593 HZ1 LYS 593 -0.903 -12.563 5.311
346 HZ2 LYS 593 HZ2 LYS 593 0.216 -13.718 4.775
347 HZ3 LYS 593 HZ3 LYS 593 -0.146 -12.375 3.806
348 H TYR 594 HN TYR 594 4.726 -6.652 4.461
349 HA TYR 594 HA TYR 594 4.096 -3.813 4.688
350 HB2 TYR 594 HB2 TYR 594 6.243 -5.324 3.200
351 HB3 TYR 594 HB3 TYR 594 5.998 -3.590 3.015
352 HD1 TYR 594 HD1 TYR 594 6.594 -2.057 4.798
353 HD2 TYR 594 HD2 TYR 594 7.133 -6.246 5.269
354 HE1 TYR 594 HE1 TYR 594 8.020 -1.646 6.758
355 HE2 TYR 594 HE2 TYR 594 8.561 -5.845 7.231
356 HH TYR 594 HH TYR 594 8.744 -2.867 8.798
357 H PHE 595 HN PHE 595 2.852 -2.762 3.312
358 HA PHE 595 HA PHE 595 2.378 -3.884 0.630
359 HB2 PHE 595 HB2 PHE 595 0.241 -2.730 2.457
360 HB3 PHE 595 HB3 PHE 595 -0.001 -3.219 0.787
361 HD1 PHE 595 HD1 PHE 595 0.747 -5.738 0.311
362 HD2 PHE 595 HD2 PHE 595 -0.409 -4.181 4.093
363 HE1 PHE 595 HE1 PHE 595 0.166 -8.007 1.062
364 HE2 PHE 595 HE2 PHE 595 -0.991 -6.443 4.849
365 HZ PHE 595 HZ PHE 595 -0.708 -8.360 3.340
366 H HIS 596 HN HIS 596 1.625 -2.226 -0.907
367 HA HIS 596 HA HIS 596 2.835 0.320 -0.531
368 HB2 HIS 596 HB2 HIS 596 0.858 -0.667 -2.592
369 HB3 HIS 596 HB3 HIS 596 1.537 0.951 -2.613
370 HD2 HIS 596 HD2 HIS 596 4.634 0.362 -2.209
371 HE1 HIS 596 HE1 HIS 596 4.181 -2.275 -5.484
372 HE2 HIS 596 HE2 HIS 596 5.801 -0.808 -4.198
373 H SER 597 HN SER 597 2.054 2.095 0.357
374 HA SER 597 HA SER 597 -0.365 2.077 1.817
375 HB2 SER 597 HB2 SER 597 1.659 3.440 2.385
376 HB3 SER 597 HB3 SER 597 1.298 4.475 1.005
377 HG SER 597 HG SER 597 0.209 4.469 3.486
378 H THR 598 HN THR 598 0.553 3.200 -1.351
379 HA THR 598 HA THR 598 -1.780 4.620 -2.013
380 HB THR 598 HB THR 598 -0.213 3.034 -4.018
381 HG1 THR 598 HG1 THR 598 1.478 4.443 -3.853
382 HG21 THR 598 HG21 THR 598 -2.078 4.369 -4.828
383 HG22 THR 598 HG22 THR 598 -0.554 5.069 -5.379
384 HG23 THR 598 HG23 THR 598 -1.430 5.799 -4.031
385 H CYS 599 HN CYS 599 -0.837 1.251 -2.329
386 HA CYS 599 HA CYS 599 -3.179 0.389 -3.707
387 HB2 CYS 599 HB2 CYS 599 -1.046 -1.204 -2.280
388 HB3 CYS 599 HB3 CYS 599 -2.295 -1.887 -3.313
389 H TYR 600 HN TYR 600 -2.334 0.759 -0.363
390 HA TYR 600 HA TYR 600 -3.895 -1.212 0.821
391 HB2 TYR 600 HB2 TYR 600 -2.235 0.112 2.052
392 HB3 TYR 600 HB3 TYR 600 -3.238 1.549 1.891
393 HD1 TYR 600 HD1 TYR 600 -5.099 1.921 3.354
394 HD2 TYR 600 HD2 TYR 600 -2.964 -1.758 3.503
395 HE1 TYR 600 HE1 TYR 600 -6.230 1.357 5.462
396 HE2 TYR 600 HE2 TYR 600 -4.089 -2.332 5.616
397 HH TYR 600 HH TYR 600 -6.805 -0.645 6.753
398 H HIS 601 HN HIS 601 -4.816 1.971 -0.370
399 HA HIS 601 HA HIS 601 -7.398 2.089 0.756
400 HB2 HIS 601 HB2 HIS 601 -6.337 3.301 -1.809
401 HB3 HIS 601 HB3 HIS 601 -7.883 3.711 -1.075
402 HD2 HIS 601 HD2 HIS 601 -5.352 3.403 1.687
403 HE1 HIS 601 HE1 HIS 601 -5.322 7.457 0.494
404 HE2 HIS 601 HE2 HIS 601 -4.396 5.765 2.130
405 H GLU 602 HN GLU 602 -6.123 0.376 -1.982
406 HA GLU 602 HA GLU 602 -8.585 -0.154 -3.314
407 HB2 GLU 602 HB2 GLU 602 -6.443 -0.287 -4.473
408 HB3 GLU 602 HB3 GLU 602 -5.904 -1.559 -3.388
409 HG2 GLU 602 HG2 GLU 602 -6.480 -2.600 -5.408
410 HG3 GLU 602 HG3 GLU 602 -7.787 -2.961 -4.284
411 H THR 603 HN THR 603 -6.703 -1.815 -0.843
412 HA THR 603 HA THR 603 -8.441 -4.136 -0.943
413 HB THR 603 HB THR 603 -6.028 -4.492 -0.616
414 HG1 THR 603 HG1 THR 603 -7.993 -5.479 0.966
415 HG21 THR 603 HG21 THR 603 -6.410 -3.125 2.047
416 HG22 THR 603 HG22 THR 603 -5.523 -2.466 0.675
417 HG23 THR 603 HG23 THR 603 -4.939 -3.919 1.487
Start of MODEL 4
1 H GLY 548 HN GLY 548 3.133 9.187 1.680
2 HA2 GLY 548 HA2 GLY 548 5.160 9.700 0.682
3 HA3 GLY 548 HA3 GLY 548 5.311 11.084 1.755
4 H LYS 549 HN LYS 549 4.583 8.327 3.490
5 HA LYS 549 HA LYS 549 7.246 8.220 4.566
6 HB2 LYS 549 HB2 LYS 549 4.759 6.628 5.216
7 HB3 LYS 549 HB3 LYS 549 6.278 6.503 6.094
8 HG2 LYS 549 HG2 LYS 549 4.555 8.965 5.857
9 HG3 LYS 549 HG3 LYS 549 4.701 7.923 7.272
10 HD2 LYS 549 HD2 LYS 549 7.072 8.497 7.460
11 HD3 LYS 549 HD3 LYS 549 6.941 9.521 6.027
12 HE2 LYS 549 HE2 LYS 549 5.294 10.921 7.206
13 HE3 LYS 549 HE3 LYS 549 5.476 9.908 8.636
14 HZ1 LYS 549 HZ1 LYS 549 6.815 11.879 8.853
15 HZ2 LYS 549 HZ2 LYS 549 7.599 11.568 7.378
16 HZ3 LYS 549 HZ3 LYS 549 7.839 10.532 8.694
17 H TYR 550 HN TYR 550 8.779 6.815 4.098
18 HA TYR 550 HA TYR 550 8.120 4.482 2.445
19 HB2 TYR 550 HB2 TYR 550 10.349 4.521 1.587
20 HB3 TYR 550 HB3 TYR 550 9.735 6.162 1.481
21 HD1 TYR 550 HD1 TYR 550 12.180 3.962 3.082
22 HD2 TYR 550 HD2 TYR 550 10.642 7.926 2.911
23 HE1 TYR 550 HE1 TYR 550 14.141 4.776 4.328
24 HE2 TYR 550 HE2 TYR 550 12.591 8.749 4.161
25 HH TYR 550 HH TYR 550 14.269 7.821 5.763
26 H VAL 551 HN VAL 551 9.380 2.535 2.902
27 HA VAL 551 HA VAL 551 10.108 2.359 5.757
28 HB VAL 551 HB VAL 551 8.964 0.174 3.990
29 HG11 VAL 551 HG11 VAL 551 10.535 -0.695 5.649
30 HG12 VAL 551 HG12 VAL 551 8.879 -1.175 6.020
31 HG13 VAL 551 HG13 VAL 551 9.643 0.129 6.928
32 HG21 VAL 551 HG21 VAL 551 7.251 1.783 4.573
33 HG22 VAL 551 HG22 VAL 551 7.714 1.696 6.272
34 HG23 VAL 551 HG23 VAL 551 7.004 0.290 5.479
35 H VAL 552 HN VAL 552 12.085 1.582 6.204
36 HA VAL 552 HA VAL 552 14.035 1.497 4.170
37 HB VAL 552 HB VAL 552 14.212 0.517 7.026
38 HG11 VAL 552 HG11 VAL 552 16.395 1.207 5.066
39 HG12 VAL 552 HG12 VAL 552 15.996 -0.410 5.649
40 HG13 VAL 552 HG13 VAL 552 16.631 0.801 6.764
41 HG21 VAL 552 HG21 VAL 552 14.885 3.180 5.790
42 HG22 VAL 552 HG22 VAL 552 15.277 2.707 7.443
43 HG23 VAL 552 HG23 VAL 552 13.590 2.845 6.941
44 H VAL 553 HN VAL 553 14.807 -0.135 2.984
45 HA VAL 553 HA VAL 553 13.485 -2.592 2.787
46 HB VAL 553 HB VAL 553 16.289 -1.932 1.854
47 HG11 VAL 553 HG11 VAL 553 15.852 -4.346 1.948
48 HG12 VAL 553 HG12 VAL 553 16.019 -3.774 0.288
49 HG13 VAL 553 HG13 VAL 553 14.418 -4.118 0.948
50 HG21 VAL 553 HG21 VAL 553 13.635 -1.751 0.428
51 HG22 VAL 553 HG22 VAL 553 15.212 -1.525 -0.332
52 HG23 VAL 553 HG23 VAL 553 14.663 -0.402 0.913
53 HA PRO 554 HA PRO 554 14.902 -4.622 6.426
54 HB2 PRO 554 HB2 PRO 554 14.196 -7.047 4.863
55 HB3 PRO 554 HB3 PRO 554 13.634 -6.533 6.457
56 HG2 PRO 554 HG2 PRO 554 12.064 -6.353 4.294
57 HG3 PRO 554 HG3 PRO 554 12.010 -5.138 5.586
58 HD2 PRO 554 HD2 PRO 554 13.224 -4.969 2.866
59 HD3 PRO 554 HD3 PRO 554 12.458 -3.707 3.850
60 H GLU 555 HN GLU 555 16.792 -5.455 7.079
61 HA GLU 555 HA GLU 555 18.806 -5.991 5.041
62 HB2 GLU 555 HB2 GLU 555 19.355 -4.393 6.815
63 HB3 GLU 555 HB3 GLU 555 19.052 -5.620 8.037
64 HG2 GLU 555 HG2 GLU 555 21.435 -5.282 7.652
65 HG3 GLU 555 HG3 GLU 555 20.930 -6.918 7.244
66 H THR 556 HN THR 556 20.012 -7.857 4.934
67 HA THR 556 HA THR 556 20.153 -10.114 4.710
68 HB THR 556 HB THR 556 20.320 -11.366 6.895
69 HG1 THR 556 HG1 THR 556 19.018 -9.257 7.823
70 HG21 THR 556 HG21 THR 556 21.926 -8.831 6.610
71 HG22 THR 556 HG22 THR 556 22.264 -10.370 5.816
72 HG23 THR 556 HG23 THR 556 22.385 -10.234 7.572
73 H SER 557 HN SER 557 17.532 -9.189 4.254
74 HA SER 557 HA SER 557 15.842 -11.268 5.437
75 HB2 SER 557 HB2 SER 557 15.137 -8.856 5.601
76 HB3 SER 557 HB3 SER 557 14.985 -8.837 3.845
77 HG SER 557 HG SER 557 13.380 -10.387 4.000
78 H GLN 558 HN GLN 558 17.561 -12.282 3.701
79 HA GLN 558 HA GLN 558 17.694 -13.720 1.966
80 HB2 GLN 558 HB2 GLN 558 14.791 -13.056 1.454
81 HB3 GLN 558 HB3 GLN 558 15.689 -14.361 0.699
82 HG2 GLN 558 HG2 GLN 558 15.273 -14.163 3.668
83 HG3 GLN 558 HG3 GLN 558 14.165 -15.005 2.593
84 HE21 GLN 558 HE21 GLN 558 17.665 -14.997 2.192
85 HE22 GLN 558 HE22 GLN 558 17.887 -16.664 2.570
86 H ASP 559 HN ASP 559 15.568 -11.075 0.826
87 HA ASP 559 HA ASP 559 17.598 -10.342 -1.147
88 HB2 ASP 559 HB2 ASP 559 15.915 -12.072 -2.092
89 HB3 ASP 559 HB3 ASP 559 14.747 -10.760 -2.043
90 H MET 560 HN MET 560 16.016 -8.505 -2.580
91 HA MET 560 HA MET 560 15.527 -6.527 -0.438
92 HB2 MET 560 HB2 MET 560 16.607 -6.062 -3.224
93 HB3 MET 560 HB3 MET 560 16.352 -4.827 -2.001
94 HG2 MET 560 HG2 MET 560 18.106 -5.661 -0.658
95 HG3 MET 560 HG3 MET 560 18.224 -7.140 -1.610
96 HE1 MET 560 HE1 MET 560 19.722 -5.838 -4.979
97 HE2 MET 560 HE2 MET 560 18.026 -6.083 -4.573
98 HE3 MET 560 HE3 MET 560 19.233 -7.262 -4.057
99 H ALA 561 HN ALA 561 13.711 -8.376 -2.130
100 HA ALA 561 HA ALA 561 11.833 -6.297 -2.972
101 HB1 ALA 561 HB1 ALA 561 13.159 -6.855 -4.953
102 HB2 ALA 561 HB2 ALA 561 11.474 -7.341 -5.141
103 HB3 ALA 561 HB3 ALA 561 12.707 -8.550 -4.778
104 H PHE 562 HN PHE 562 9.714 -6.843 -2.857
105 HA PHE 562 HA PHE 562 8.959 -9.648 -2.425
106 HB2 PHE 562 HB2 PHE 562 7.468 -9.140 -0.637
107 HB3 PHE 562 HB3 PHE 562 8.973 -8.336 -0.217
108 HD1 PHE 562 HD1 PHE 562 5.472 -7.947 -0.959
109 HD2 PHE 562 HD2 PHE 562 9.144 -5.849 -0.497
110 HE1 PHE 562 HE1 PHE 562 4.229 -5.848 -0.701
111 HE2 PHE 562 HE2 PHE 562 7.902 -3.739 -0.226
112 HZ PHE 562 HZ PHE 562 5.440 -3.738 -0.330
113 H LYS 563 HN LYS 563 6.506 -9.897 -2.943
114 HA LYS 563 HA LYS 563 5.937 -7.999 -5.111
115 HB2 LYS 563 HB2 LYS 563 6.158 -10.382 -5.785
116 HB3 LYS 563 HB3 LYS 563 4.766 -10.759 -4.772
117 HG2 LYS 563 HG2 LYS 563 3.352 -9.329 -6.114
118 HG3 LYS 563 HG3 LYS 563 4.732 -8.823 -7.082
119 HD2 LYS 563 HD2 LYS 563 3.460 -11.552 -6.969
120 HD3 LYS 563 HD3 LYS 563 3.520 -10.440 -8.339
121 HE2 LYS 563 HE2 LYS 563 5.959 -10.683 -8.414
122 HE3 LYS 563 HE3 LYS 563 5.874 -11.824 -7.072
123 HZ1 LYS 563 HZ1 LYS 563 4.310 -13.130 -8.576
124 HZ2 LYS 563 HZ2 LYS 563 5.963 -13.155 -8.950
125 HZ3 LYS 563 HZ3 LYS 563 4.909 -12.168 -9.840
126 H CYS 564 HN CYS 564 4.206 -6.791 -5.141
127 HA CYS 564 HA CYS 564 2.586 -6.477 -2.801
128 HB2 CYS 564 HB2 CYS 564 3.210 -4.559 -4.143
129 HB3 CYS 564 HB3 CYS 564 2.516 -5.279 -5.584
130 HA PRO 565 HA PRO 565 -0.041 -9.845 -4.080
131 HB2 PRO 565 HB2 PRO 565 -1.844 -9.670 -2.038
132 HB3 PRO 565 HB3 PRO 565 -0.252 -10.417 -1.882
133 HG2 PRO 565 HG2 PRO 565 -1.144 -7.675 -1.108
134 HG3 PRO 565 HG3 PRO 565 -0.115 -8.814 -0.220
135 HD2 PRO 565 HD2 PRO 565 0.918 -6.737 -1.602
136 HD3 PRO 565 HD3 PRO 565 1.757 -8.297 -1.483
137 H ILE 566 HN ILE 566 -1.317 -6.624 -3.426
138 HA ILE 566 HA ILE 566 -3.994 -7.218 -4.167
139 HB ILE 566 HB ILE 566 -2.644 -4.520 -4.064
140 HG12 ILE 566 HG12 ILE 566 -4.040 -6.091 -1.879
141 HG13 ILE 566 HG13 ILE 566 -2.327 -5.693 -1.949
142 HG21 ILE 566 HG21 ILE 566 -5.550 -5.280 -3.814
143 HG22 ILE 566 HG22 ILE 566 -4.797 -4.509 -5.210
144 HG23 ILE 566 HG23 ILE 566 -4.888 -3.653 -3.671
145 HD11 ILE 566 HD11 ILE 566 -4.590 -3.747 -1.621
146 HD12 ILE 566 HD12 ILE 566 -2.888 -3.316 -1.753
147 HD13 ILE 566 HD13 ILE 566 -3.450 -4.266 -0.376
148 H CYS 567 HN CYS 567 -1.463 -5.300 -5.809
149 HA CYS 567 HA CYS 567 -2.983 -5.620 -8.305
150 HB2 CYS 567 HB2 CYS 567 -1.828 -3.611 -9.115
151 HB3 CYS 567 HB3 CYS 567 -2.710 -3.297 -7.625
152 H LYS 568 HN LYS 568 -0.426 -6.912 -6.755
153 HA LYS 568 HA LYS 568 1.048 -8.493 -7.366
154 HB2 LYS 568 HB2 LYS 568 -0.393 -8.266 -10.003
155 HB3 LYS 568 HB3 LYS 568 0.823 -9.491 -9.656
156 HG2 LYS 568 HG2 LYS 568 -0.507 -10.441 -7.924
157 HG3 LYS 568 HG3 LYS 568 -1.646 -9.100 -7.982
158 HD2 LYS 568 HD2 LYS 568 -2.327 -9.777 -10.231
159 HD3 LYS 568 HD3 LYS 568 -1.175 -11.115 -10.174
160 HE2 LYS 568 HE2 LYS 568 -3.503 -11.796 -9.640
161 HE3 LYS 568 HE3 LYS 568 -2.354 -12.128 -8.343
162 HZ1 LYS 568 HZ1 LYS 568 -4.374 -11.185 -7.454
163 HZ2 LYS 568 HZ2 LYS 568 -4.244 -9.833 -8.474
164 HZ3 LYS 568 HZ3 LYS 568 -3.102 -10.084 -7.247
165 H GLU 569 HN GLU 569 1.745 -5.642 -7.626
166 HA GLU 569 HA GLU 569 3.763 -5.523 -9.680
167 HB2 GLU 569 HB2 GLU 569 3.527 -3.919 -7.128
168 HB3 GLU 569 HB3 GLU 569 4.579 -3.546 -8.479
169 HG2 GLU 569 HG2 GLU 569 2.742 -2.961 -9.853
170 HG3 GLU 569 HG3 GLU 569 1.586 -3.621 -8.693
171 H THR 570 HN THR 570 5.785 -6.444 -9.541
172 HA THR 570 HA THR 570 6.785 -7.496 -7.084
173 HB THR 570 HB THR 570 8.304 -6.864 -9.628
174 HG1 THR 570 HG1 THR 570 7.728 -8.859 -10.313
175 HG21 THR 570 HG21 THR 570 9.886 -8.571 -8.816
176 HG22 THR 570 HG22 THR 570 8.951 -8.714 -7.326
177 HG23 THR 570 HG23 THR 570 9.777 -7.203 -7.711
178 H VAL 571 HN VAL 571 7.630 -6.307 -5.473
179 HA VAL 571 HA VAL 571 8.105 -3.477 -6.005
180 HB VAL 571 HB VAL 571 7.937 -4.851 -3.321
181 HG11 VAL 571 HG11 VAL 571 9.058 -2.710 -3.235
182 HG12 VAL 571 HG12 VAL 571 7.462 -2.582 -2.493
183 HG13 VAL 571 HG13 VAL 571 7.731 -1.948 -4.116
184 HG21 VAL 571 HG21 VAL 571 5.626 -4.038 -3.212
185 HG22 VAL 571 HG22 VAL 571 5.856 -5.194 -4.522
186 HG23 VAL 571 HG23 VAL 571 5.753 -3.470 -4.878
187 H THR 572 HN THR 572 10.096 -2.864 -6.359
188 HA THR 572 HA THR 572 12.291 -4.187 -4.921
189 HB THR 572 HB THR 572 13.757 -3.133 -6.695
190 HG1 THR 572 HG1 THR 572 11.756 -2.998 -8.542
191 HG21 THR 572 HG21 THR 572 11.695 -5.130 -7.629
192 HG22 THR 572 HG22 THR 572 13.177 -5.502 -6.748
193 HG23 THR 572 HG23 THR 572 13.265 -4.841 -8.381
194 H GLY 573 HN GLY 573 14.073 -2.700 -4.233
195 HA2 GLY 573 HA2 GLY 573 13.032 0.003 -3.682
196 HA3 GLY 573 HA3 GLY 573 13.731 -0.977 -2.399
197 H VAL 574 HN VAL 574 14.596 1.564 -3.192
198 HA VAL 574 HA VAL 574 17.170 1.020 -4.520
199 HB VAL 574 HB VAL 574 15.724 3.675 -4.320
200 HG11 VAL 574 HG11 VAL 574 18.143 3.880 -4.562
201 HG12 VAL 574 HG12 VAL 574 17.314 4.415 -6.023
202 HG13 VAL 574 HG13 VAL 574 18.098 2.836 -5.982
203 HG21 VAL 574 HG21 VAL 574 15.141 3.387 -6.671
204 HG22 VAL 574 HG22 VAL 574 14.446 2.101 -5.687
205 HG23 VAL 574 HG23 VAL 574 15.878 1.785 -6.666
206 H TYR 575 HN TYR 575 19.045 1.938 -3.586
207 HA TYR 575 HA TYR 575 18.864 2.430 -0.750
208 HB2 TYR 575 HB2 TYR 575 20.696 1.061 -1.594
209 HB3 TYR 575 HB3 TYR 575 21.228 2.379 -2.633
210 HD1 TYR 575 HD1 TYR 575 23.040 3.572 -1.921
211 HD2 TYR 575 HD2 TYR 575 20.475 1.843 0.997
212 HE1 TYR 575 HE1 TYR 575 24.492 4.448 -0.142
213 HE2 TYR 575 HE2 TYR 575 21.926 2.705 2.791
214 HH TYR 575 HH TYR 575 24.375 3.372 3.013
215 H ASP 576 HN ASP 576 18.473 4.394 0.048
216 HA ASP 576 HA ASP 576 19.141 6.735 -1.545
217 HB2 ASP 576 HB2 ASP 576 16.957 6.773 -0.504
218 HB3 ASP 576 HB3 ASP 576 17.670 6.492 1.086
219 H GLU 577 HN GLU 577 21.169 7.279 -1.449
220 HA GLU 577 HA GLU 577 22.959 6.663 0.629
221 HB2 GLU 577 HB2 GLU 577 23.221 8.826 -1.468
222 HB3 GLU 577 HB3 GLU 577 24.531 8.072 -0.570
223 HG2 GLU 577 HG2 GLU 577 24.056 5.938 -1.636
224 HG3 GLU 577 HG3 GLU 577 22.720 6.669 -2.522
225 H GLU 578 HN GLU 578 20.711 9.223 0.227
226 HA GLU 578 HA GLU 578 22.105 11.211 1.717
227 HB2 GLU 578 HB2 GLU 578 20.355 11.604 -0.048
228 HB3 GLU 578 HB3 GLU 578 19.155 11.065 1.119
229 HG2 GLU 578 HG2 GLU 578 19.329 12.954 2.380
230 HG3 GLU 578 HG3 GLU 578 20.998 13.264 1.889
231 H SER 579 HN SER 579 19.342 9.066 2.495
232 HA SER 579 HA SER 579 19.585 9.773 5.300
233 HB2 SER 579 HB2 SER 579 17.706 8.175 5.622
234 HB3 SER 579 HB3 SER 579 17.346 9.408 4.414
235 HG SER 579 HG SER 579 17.638 7.918 2.800
236 H GLY 580 HN GLY 580 20.895 7.478 3.165
237 HA2 GLY 580 HA2 GLY 580 22.646 6.016 3.580
238 HA3 GLY 580 HA3 GLY 580 22.470 6.350 5.297
239 H GLU 581 HN GLU 581 19.577 5.504 3.722
240 HA GLU 581 HA GLU 581 19.885 2.685 4.448
241 HB2 GLU 581 HB2 GLU 581 17.612 4.500 5.280
242 HB3 GLU 581 HB3 GLU 581 17.568 2.748 5.413
243 HG2 GLU 581 HG2 GLU 581 19.549 2.854 6.890
244 HG3 GLU 581 HG3 GLU 581 19.461 4.615 6.824
245 H TRP 582 HN TRP 582 18.450 1.260 3.368
246 HA TRP 582 HA TRP 582 17.809 2.016 0.690
247 HB2 TRP 582 HB2 TRP 582 17.073 -0.442 2.287
248 HB3 TRP 582 HB3 TRP 582 16.798 -0.253 0.561
249 HD1 TRP 582 HD1 TRP 582 19.675 -0.634 3.093
250 HE1 TRP 582 HE1 TRP 582 21.705 -1.619 1.853
251 HE3 TRP 582 HE3 TRP 582 17.832 -0.534 -1.670
252 HZ2 TRP 582 HZ2 TRP 582 22.427 -2.259 -0.796
253 HZ3 TRP 582 HZ3 TRP 582 19.254 -1.354 -3.502
254 HH2 TRP 582 HH2 TRP 582 21.508 -2.201 -3.072
255 H VAL 583 HN VAL 583 15.708 2.163 -0.259
256 HA VAL 583 HA VAL 583 13.631 2.831 1.725
257 HB VAL 583 HB VAL 583 12.863 4.640 0.338
258 HG11 VAL 583 HG11 VAL 583 14.597 5.212 1.904
259 HG12 VAL 583 HG12 VAL 583 14.842 6.130 0.417
260 HG13 VAL 583 HG13 VAL 583 15.846 4.721 0.757
261 HG21 VAL 583 HG21 VAL 583 15.086 3.940 -1.576
262 HG22 VAL 583 HG22 VAL 583 13.960 5.289 -1.727
263 HG23 VAL 583 HG23 VAL 583 13.373 3.628 -1.844
264 H TRP 584 HN TRP 584 11.774 1.793 1.557
265 HA TRP 584 HA TRP 584 10.814 0.992 -1.114
266 HB2 TRP 584 HB2 TRP 584 10.072 0.074 1.665
267 HB3 TRP 584 HB3 TRP 584 8.975 -0.160 0.311
268 HD1 TRP 584 HD1 TRP 584 12.020 -0.715 -1.377
269 HE1 TRP 584 HE1 TRP 584 12.743 -3.167 -1.393
270 HE3 TRP 584 HE3 TRP 584 9.077 -2.419 2.419
271 HZ2 TRP 584 HZ2 TRP 584 12.145 -5.534 0.037
272 HZ3 TRP 584 HZ3 TRP 584 9.214 -4.790 3.040
273 HH2 TRP 584 HH2 TRP 584 10.718 -6.319 1.873
274 H LYS 585 HN LYS 585 9.778 2.731 -1.980
275 HA LYS 585 HA LYS 585 8.538 4.674 -0.235
276 HB2 LYS 585 HB2 LYS 585 8.554 4.658 -3.255
277 HB3 LYS 585 HB3 LYS 585 8.181 6.013 -2.196
278 HG2 LYS 585 HG2 LYS 585 10.865 4.668 -2.390
279 HG3 LYS 585 HG3 LYS 585 10.422 6.170 -3.199
280 HD2 LYS 585 HD2 LYS 585 10.415 5.724 -0.216
281 HD3 LYS 585 HD3 LYS 585 11.681 6.552 -1.126
282 HE2 LYS 585 HE2 LYS 585 8.792 7.421 -0.990
283 HE3 LYS 585 HE3 LYS 585 10.096 8.104 -0.022
284 HZ1 LYS 585 HZ1 LYS 585 11.205 8.697 -2.157
285 HZ2 LYS 585 HZ2 LYS 585 9.740 9.517 -1.876
286 HZ3 LYS 585 HZ3 LYS 585 9.790 8.231 -2.972
287 H ASN 586 HN ASN 586 6.383 5.384 -0.402
288 HA ASN 586 HA ASN 586 4.156 5.019 -0.173
289 HB2 ASN 586 HB2 ASN 586 4.270 3.350 -2.699
290 HB3 ASN 586 HB3 ASN 586 2.910 4.227 -2.051
291 HD21 ASN 586 HD21 ASN 586 2.624 5.238 -4.027
292 HD22 ASN 586 HD22 ASN 586 3.632 6.543 -4.542
293 H THR 587 HN THR 587 5.684 3.356 1.341
294 HA THR 587 HA THR 587 4.299 0.765 1.118
295 HB THR 587 HB THR 587 7.110 1.224 2.139
296 HG1 THR 587 HG1 THR 587 6.474 1.278 -0.284
297 HG21 THR 587 HG21 THR 587 7.277 -1.225 2.152
298 HG22 THR 587 HG22 THR 587 5.588 -1.349 1.661
299 HG23 THR 587 HG23 THR 587 6.000 -0.672 3.237
300 H ILE 588 HN ILE 588 3.477 -0.119 2.936
301 HA ILE 588 HA ILE 588 3.810 1.294 5.481
302 HB ILE 588 HB ILE 588 1.818 2.261 4.393
303 HG12 ILE 588 HG12 ILE 588 1.084 0.451 6.701
304 HG13 ILE 588 HG13 ILE 588 1.876 2.014 6.855
305 HG21 ILE 588 HG21 ILE 588 -0.159 0.898 3.953
306 HG22 ILE 588 HG22 ILE 588 0.734 -0.552 4.413
307 HG23 ILE 588 HG23 ILE 588 1.217 0.366 2.986
308 HD11 ILE 588 HD11 ILE 588 -0.481 2.198 7.333
309 HD12 ILE 588 HD12 ILE 588 -0.872 1.521 5.752
310 HD13 ILE 588 HD13 ILE 588 -0.081 3.094 5.865
311 H GLU 589 HN GLU 589 3.619 -0.034 7.266
312 HA GLU 589 HA GLU 589 3.371 -2.887 6.702
313 HB2 GLU 589 HB2 GLU 589 5.357 -2.146 7.957
314 HB3 GLU 589 HB3 GLU 589 4.324 -1.470 9.205
315 HG2 GLU 589 HG2 GLU 589 4.105 -4.380 8.526
316 HG3 GLU 589 HG3 GLU 589 5.448 -3.803 9.519
317 H VAL 590 HN VAL 590 1.534 -3.840 6.990
318 HA VAL 590 HA VAL 590 -0.304 -2.857 9.071
319 HB VAL 590 HB VAL 590 -1.180 -3.937 6.378
320 HG11 VAL 590 HG11 VAL 590 -3.388 -3.143 7.061
321 HG12 VAL 590 HG12 VAL 590 -2.721 -2.622 8.608
322 HG13 VAL 590 HG13 VAL 590 -2.749 -4.335 8.193
323 HG21 VAL 590 HG21 VAL 590 -1.162 -1.077 7.337
324 HG22 VAL 590 HG22 VAL 590 -1.854 -1.654 5.823
325 HG23 VAL 590 HG23 VAL 590 -0.115 -1.753 6.091
326 H ASN 591 HN ASN 591 -0.659 -4.410 10.538
327 HA ASN 591 HA ASN 591 -0.814 -6.424 11.562
328 HB2 ASN 591 HB2 ASN 591 -1.653 -7.261 8.809
329 HB3 ASN 591 HB3 ASN 591 -1.705 -8.343 10.192
330 HD21 ASN 591 HD21 ASN 591 -3.264 -8.021 11.781
331 HD22 ASN 591 HD22 ASN 591 -4.614 -6.958 11.549
332 H GLY 592 HN GLY 592 1.743 -5.581 10.546
333 HA2 GLY 592 HA2 GLY 592 3.844 -6.522 10.774
334 HA3 GLY 592 HA3 GLY 592 3.096 -8.109 10.889
335 H LYS 593 HN LYS 593 2.062 -6.258 8.227
336 HA LYS 593 HA LYS 593 3.874 -7.777 6.478
337 HB2 LYS 593 HB2 LYS 593 0.954 -7.166 5.981
338 HB3 LYS 593 HB3 LYS 593 2.020 -8.056 4.898
339 HG2 LYS 593 HG2 LYS 593 1.218 -8.936 7.669
340 HG3 LYS 593 HG3 LYS 593 0.490 -9.504 6.165
341 HD2 LYS 593 HD2 LYS 593 2.581 -10.487 5.467
342 HD3 LYS 593 HD3 LYS 593 3.409 -9.800 6.867
343 HE2 LYS 593 HE2 LYS 593 1.145 -11.784 7.010
344 HE3 LYS 593 HE3 LYS 593 2.856 -12.205 7.128
345 HZ1 LYS 593 HZ1 LYS 593 1.755 -11.979 9.308
346 HZ2 LYS 593 HZ2 LYS 593 1.444 -10.344 8.974
347 HZ3 LYS 593 HZ3 LYS 593 3.042 -10.895 9.110
348 H TYR 594 HN TYR 594 4.714 -6.717 4.744
349 HA TYR 594 HA TYR 594 4.343 -3.837 4.704
350 HB2 TYR 594 HB2 TYR 594 6.317 -5.596 3.234
351 HB3 TYR 594 HB3 TYR 594 6.287 -3.836 3.167
352 HD1 TYR 594 HD1 TYR 594 6.425 -2.631 5.486
353 HD2 TYR 594 HD2 TYR 594 7.688 -6.634 4.806
354 HE1 TYR 594 HE1 TYR 594 7.837 -2.517 7.488
355 HE2 TYR 594 HE2 TYR 594 9.107 -6.532 6.810
356 HH TYR 594 HH TYR 594 8.872 -4.060 9.120
357 H PHE 595 HN PHE 595 3.031 -2.877 3.362
358 HA PHE 595 HA PHE 595 2.496 -4.115 0.739
359 HB2 PHE 595 HB2 PHE 595 0.415 -2.818 2.529
360 HB3 PHE 595 HB3 PHE 595 0.134 -3.393 0.893
361 HD1 PHE 595 HD1 PHE 595 -0.476 -4.100 4.151
362 HD2 PHE 595 HD2 PHE 595 1.028 -5.989 0.652
363 HE1 PHE 595 HE1 PHE 595 -1.133 -6.288 5.058
364 HE2 PHE 595 HE2 PHE 595 0.371 -8.182 1.553
365 HZ PHE 595 HZ PHE 595 -0.716 -8.334 3.749
366 H HIS 596 HN HIS 596 1.718 -2.547 -0.869
367 HA HIS 596 HA HIS 596 2.894 0.044 -0.665
368 HB2 HIS 596 HB2 HIS 596 0.991 -1.231 -2.636
369 HB3 HIS 596 HB3 HIS 596 1.357 0.485 -2.722
370 HD2 HIS 596 HD2 HIS 596 4.638 -0.139 -1.998
371 HE1 HIS 596 HE1 HIS 596 4.407 -1.767 -5.899
372 HE2 HIS 596 HE2 HIS 596 5.937 -0.757 -4.153
373 H SER 597 HN SER 597 2.059 1.817 0.230
374 HA SER 597 HA SER 597 -0.319 1.767 1.740
375 HB2 SER 597 HB2 SER 597 1.106 4.242 0.745
376 HB3 SER 597 HB3 SER 597 0.122 4.080 2.199
377 HG SER 597 HG SER 597 1.711 2.806 3.110
378 H THR 598 HN THR 598 0.414 2.714 -1.513
379 HA THR 598 HA THR 598 -1.905 4.205 -2.030
380 HB THR 598 HB THR 598 -0.042 4.487 -3.499
381 HG1 THR 598 HG1 THR 598 -2.082 4.696 -4.509
382 HG21 THR 598 HG21 THR 598 -0.347 1.567 -4.215
383 HG22 THR 598 HG22 THR 598 0.977 2.282 -3.296
384 HG23 THR 598 HG23 THR 598 0.754 2.705 -4.992
385 H CYS 599 HN CYS 599 -1.143 0.787 -2.263
386 HA CYS 599 HA CYS 599 -3.492 0.089 -3.743
387 HB2 CYS 599 HB2 CYS 599 -1.476 -1.649 -2.317
388 HB3 CYS 599 HB3 CYS 599 -2.713 -2.224 -3.431
389 H TYR 600 HN TYR 600 -2.620 0.160 -0.351
390 HA TYR 600 HA TYR 600 -4.282 -1.866 0.605
391 HB2 TYR 600 HB2 TYR 600 -2.499 -0.881 1.961
392 HB3 TYR 600 HB3 TYR 600 -3.377 0.643 2.040
393 HD1 TYR 600 HD1 TYR 600 -4.813 1.039 3.833
394 HD2 TYR 600 HD2 TYR 600 -3.736 -2.969 2.901
395 HE1 TYR 600 HE1 TYR 600 -6.006 0.256 5.833
396 HE2 TYR 600 HE2 TYR 600 -4.924 -3.757 4.902
397 HH TYR 600 HH TYR 600 -5.691 -2.907 7.064
398 H HIS 601 HN HIS 601 -5.018 1.449 -0.181
399 HA HIS 601 HA HIS 601 -7.345 1.801 1.328
400 HB2 HIS 601 HB2 HIS 601 -6.600 3.043 -1.325
401 HB3 HIS 601 HB3 HIS 601 -7.853 3.634 -0.234
402 HD2 HIS 601 HD2 HIS 601 -5.981 3.275 2.516
403 HE1 HIS 601 HE1 HIS 601 -3.556 6.117 0.519
404 HE2 HIS 601 HE2 HIS 601 -4.266 5.217 2.780
405 H GLU 602 HN GLU 602 -6.858 0.057 -1.646
406 HA GLU 602 HA GLU 602 -9.557 0.200 -2.538
407 HB2 GLU 602 HB2 GLU 602 -8.956 -1.315 -4.245
408 HB3 GLU 602 HB3 GLU 602 -7.536 -0.319 -3.986
409 HG2 GLU 602 HG2 GLU 602 -6.501 -2.322 -4.086
410 HG3 GLU 602 HG3 GLU 602 -6.915 -2.367 -2.373
411 H THR 603 HN THR 603 -7.844 -1.863 -0.305
412 HA THR 603 HA THR 603 -9.975 -3.849 -0.411
413 HB THR 603 HB THR 603 -7.503 -4.486 -0.277
414 HG1 THR 603 HG1 THR 603 -9.376 -5.878 0.159
415 HG21 THR 603 HG21 THR 603 -6.573 -4.679 1.995
416 HG22 THR 603 HG22 THR 603 -7.969 -3.807 2.629
417 HG23 THR 603 HG23 THR 603 -6.845 -2.995 1.541
Start of MODEL 5
1 H GLY 548 HN GLY 548 3.294 9.458 1.750
2 HA2 GLY 548 HA2 GLY 548 5.438 9.737 0.919
3 HA3 GLY 548 HA3 GLY 548 5.706 11.017 2.096
4 H LYS 549 HN LYS 549 4.429 8.212 3.445
5 HA LYS 549 HA LYS 549 6.780 7.731 4.966
6 HB2 LYS 549 HB2 LYS 549 4.154 6.265 4.750
7 HB3 LYS 549 HB3 LYS 549 5.436 5.774 5.849
8 HG2 LYS 549 HG2 LYS 549 4.080 8.470 5.869
9 HG3 LYS 549 HG3 LYS 549 3.706 7.124 6.952
10 HD2 LYS 549 HD2 LYS 549 5.884 7.205 7.920
11 HD3 LYS 549 HD3 LYS 549 6.443 8.352 6.703
12 HE2 LYS 549 HE2 LYS 549 4.922 10.040 7.572
13 HE3 LYS 549 HE3 LYS 549 4.302 8.889 8.754
14 HZ1 LYS 549 HZ1 LYS 549 7.168 9.609 8.631
15 HZ2 LYS 549 HZ2 LYS 549 6.322 8.881 9.908
16 HZ3 LYS 549 HZ3 LYS 549 6.057 10.517 9.530
17 H TYR 550 HN TYR 550 8.351 6.336 4.676
18 HA TYR 550 HA TYR 550 8.064 4.262 2.619
19 HB2 TYR 550 HB2 TYR 550 10.273 4.614 1.850
20 HB3 TYR 550 HB3 TYR 550 9.560 6.214 1.953
21 HD1 TYR 550 HD1 TYR 550 12.255 4.089 3.021
22 HD2 TYR 550 HD2 TYR 550 10.141 7.658 3.955
23 HE1 TYR 550 HE1 TYR 550 14.129 4.826 4.441
24 HE2 TYR 550 HE2 TYR 550 12.002 8.410 5.368
25 HH TYR 550 HH TYR 550 15.044 7.031 5.300
26 H VAL 551 HN VAL 551 9.453 2.394 2.992
27 HA VAL 551 HA VAL 551 10.105 2.027 5.850
28 HB VAL 551 HB VAL 551 9.196 -0.094 3.884
29 HG11 VAL 551 HG11 VAL 551 9.136 -1.587 5.824
30 HG12 VAL 551 HG12 VAL 551 9.759 -0.291 6.843
31 HG13 VAL 551 HG13 VAL 551 10.761 -0.957 5.556
32 HG21 VAL 551 HG21 VAL 551 7.365 1.387 4.516
33 HG22 VAL 551 HG22 VAL 551 7.734 1.129 6.222
34 HG23 VAL 551 HG23 VAL 551 7.158 -0.212 5.231
35 H VAL 552 HN VAL 552 12.158 1.427 6.293
36 HA VAL 552 HA VAL 552 14.136 1.458 4.262
37 HB VAL 552 HB VAL 552 14.338 0.386 7.089
38 HG11 VAL 552 HG11 VAL 552 16.499 1.201 5.152
39 HG12 VAL 552 HG12 VAL 552 16.165 -0.435 5.720
40 HG13 VAL 552 HG13 VAL 552 16.755 0.791 6.846
41 HG21 VAL 552 HG21 VAL 552 15.018 3.106 5.983
42 HG22 VAL 552 HG22 VAL 552 15.283 2.569 7.644
43 HG23 VAL 552 HG23 VAL 552 13.641 2.725 7.016
44 H VAL 553 HN VAL 553 14.872 -0.125 2.994
45 HA VAL 553 HA VAL 553 13.471 -2.532 2.719
46 HB VAL 553 HB VAL 553 16.237 -1.898 1.685
47 HG11 VAL 553 HG11 VAL 553 15.722 -3.563 -0.044
48 HG12 VAL 553 HG12 VAL 553 14.205 -3.931 0.774
49 HG13 VAL 553 HG13 VAL 553 15.739 -4.272 1.572
50 HG21 VAL 553 HG21 VAL 553 13.535 -1.472 0.410
51 HG22 VAL 553 HG22 VAL 553 15.094 -1.228 -0.379
52 HG23 VAL 553 HG23 VAL 553 14.631 -0.216 0.987
53 HA PRO 554 HA PRO 554 15.291 -4.868 6.052
54 HB2 PRO 554 HB2 PRO 554 14.003 -7.104 4.594
55 HB3 PRO 554 HB3 PRO 554 13.797 -6.590 6.271
56 HG2 PRO 554 HG2 PRO 554 11.895 -6.160 4.431
57 HG3 PRO 554 HG3 PRO 554 12.215 -4.989 5.722
58 HD2 PRO 554 HD2 PRO 554 13.012 -4.900 2.838
59 HD3 PRO 554 HD3 PRO 554 12.490 -3.581 3.906
60 H GLU 555 HN GLU 555 17.205 -5.879 6.195
61 HA GLU 555 HA GLU 555 18.642 -6.494 3.773
62 HB2 GLU 555 HB2 GLU 555 20.529 -6.994 5.364
63 HB3 GLU 555 HB3 GLU 555 19.895 -5.359 5.444
64 HG2 GLU 555 HG2 GLU 555 18.677 -5.878 7.450
65 HG3 GLU 555 HG3 GLU 555 19.157 -7.572 7.341
66 H THR 556 HN THR 556 16.502 -8.170 5.582
67 HA THR 556 HA THR 556 17.730 -10.763 5.433
68 HB THR 556 HB THR 556 15.399 -11.555 6.014
69 HG1 THR 556 HG1 THR 556 13.875 -9.999 6.507
70 HG21 THR 556 HG21 THR 556 17.110 -11.181 7.724
71 HG22 THR 556 HG22 THR 556 15.510 -10.736 8.318
72 HG23 THR 556 HG23 THR 556 16.646 -9.483 7.822
73 H SER 557 HN SER 557 15.713 -8.750 3.466
74 HA SER 557 HA SER 557 14.988 -10.844 1.617
75 HB2 SER 557 HB2 SER 557 13.458 -8.956 1.938
76 HB3 SER 557 HB3 SER 557 14.708 -7.829 1.422
77 HG SER 557 HG SER 557 12.951 -9.092 -0.092
78 H GLN 558 HN GLN 558 16.556 -11.702 0.417
79 HA GLN 558 HA GLN 558 18.906 -10.233 -0.320
80 HB2 GLN 558 HB2 GLN 558 17.938 -12.948 -1.245
81 HB3 GLN 558 HB3 GLN 558 19.540 -12.279 -1.543
82 HG2 GLN 558 HG2 GLN 558 19.904 -12.167 0.895
83 HG3 GLN 558 HG3 GLN 558 18.339 -12.940 1.138
84 HE21 GLN 558 HE21 GLN 558 18.688 -14.698 -1.197
85 HE22 GLN 558 HE22 GLN 558 19.832 -15.900 -0.704
86 H ASP 559 HN ASP 559 15.841 -10.153 -1.454
87 HA ASP 559 HA ASP 559 16.605 -9.580 -4.227
88 HB2 ASP 559 HB2 ASP 559 13.901 -9.893 -2.907
89 HB3 ASP 559 HB3 ASP 559 14.121 -9.413 -4.582
90 H MET 560 HN MET 560 15.941 -8.080 -1.262
91 HA MET 560 HA MET 560 15.491 -5.977 -0.545
92 HB2 MET 560 HB2 MET 560 16.607 -5.289 -3.267
93 HB3 MET 560 HB3 MET 560 16.170 -4.078 -2.072
94 HG2 MET 560 HG2 MET 560 18.486 -4.359 -1.874
95 HG3 MET 560 HG3 MET 560 17.784 -5.210 -0.504
96 HE1 MET 560 HE1 MET 560 20.782 -5.616 -1.362
97 HE2 MET 560 HE2 MET 560 20.951 -7.370 -1.302
98 HE3 MET 560 HE3 MET 560 20.047 -6.528 -0.042
99 H ALA 561 HN ALA 561 13.499 -7.573 -2.008
100 HA ALA 561 HA ALA 561 11.631 -5.463 -2.740
101 HB1 ALA 561 HB1 ALA 561 12.787 -6.044 -4.822
102 HB2 ALA 561 HB2 ALA 561 11.088 -6.514 -4.869
103 HB3 ALA 561 HB3 ALA 561 12.333 -7.734 -4.600
104 H PHE 562 HN PHE 562 9.427 -6.202 -2.925
105 HA PHE 562 HA PHE 562 8.885 -8.988 -2.238
106 HB2 PHE 562 HB2 PHE 562 7.281 -8.491 -0.537
107 HB3 PHE 562 HB3 PHE 562 8.728 -7.589 -0.117
108 HD1 PHE 562 HD1 PHE 562 5.215 -7.382 -0.971
109 HD2 PHE 562 HD2 PHE 562 8.800 -5.133 -0.502
110 HE1 PHE 562 HE1 PHE 562 3.900 -5.303 -0.864
111 HE2 PHE 562 HE2 PHE 562 7.486 -3.056 -0.386
112 HZ PHE 562 HZ PHE 562 4.966 -3.190 -0.488
113 H LYS 563 HN LYS 563 6.662 -9.602 -2.952
114 HA LYS 563 HA LYS 563 5.989 -7.939 -5.282
115 HB2 LYS 563 HB2 LYS 563 6.592 -10.318 -5.675
116 HB3 LYS 563 HB3 LYS 563 5.186 -10.800 -4.733
117 HG2 LYS 563 HG2 LYS 563 3.688 -10.003 -6.350
118 HG3 LYS 563 HG3 LYS 563 4.936 -9.043 -7.150
119 HD2 LYS 563 HD2 LYS 563 6.076 -11.144 -7.801
120 HD3 LYS 563 HD3 LYS 563 4.744 -12.058 -7.089
121 HE2 LYS 563 HE2 LYS 563 3.187 -11.042 -8.647
122 HE3 LYS 563 HE3 LYS 563 4.474 -10.054 -9.327
123 HZ1 LYS 563 HZ1 LYS 563 4.284 -13.018 -9.459
124 HZ2 LYS 563 HZ2 LYS 563 5.586 -12.109 -10.046
125 HZ3 LYS 563 HZ3 LYS 563 4.052 -11.934 -10.741
126 H CYS 564 HN CYS 564 4.261 -6.747 -5.300
127 HA CYS 564 HA CYS 564 2.630 -6.469 -3.018
128 HB2 CYS 564 HB2 CYS 564 3.116 -4.589 -4.454
129 HB3 CYS 564 HB3 CYS 564 2.357 -5.382 -5.825
130 HA PRO 565 HA PRO 565 -0.280 -9.746 -3.998
131 HB2 PRO 565 HB2 PRO 565 -1.633 -8.756 -1.573
132 HB3 PRO 565 HB3 PRO 565 -0.969 -10.356 -1.914
133 HG2 PRO 565 HG2 PRO 565 0.224 -8.723 -0.179
134 HG3 PRO 565 HG3 PRO 565 1.166 -9.757 -1.264
135 HD2 PRO 565 HD2 PRO 565 0.539 -6.827 -1.528
136 HD3 PRO 565 HD3 PRO 565 2.087 -7.671 -1.762
137 H ILE 566 HN ILE 566 -1.013 -6.367 -3.510
138 HA ILE 566 HA ILE 566 -3.815 -6.570 -4.029
139 HB ILE 566 HB ILE 566 -2.035 -4.136 -4.214
140 HG12 ILE 566 HG12 ILE 566 -1.953 -5.241 -1.993
141 HG13 ILE 566 HG13 ILE 566 -2.700 -3.648 -1.930
142 HG21 ILE 566 HG21 ILE 566 -5.026 -4.399 -3.932
143 HG22 ILE 566 HG22 ILE 566 -4.151 -3.825 -5.352
144 HG23 ILE 566 HG23 ILE 566 -4.120 -2.886 -3.860
145 HD11 ILE 566 HD11 ILE 566 -3.884 -5.242 -0.535
146 HD12 ILE 566 HD12 ILE 566 -4.154 -6.288 -1.930
147 HD13 ILE 566 HD13 ILE 566 -4.907 -4.695 -1.865
148 H CYS 567 HN CYS 567 -0.977 -5.791 -6.010
149 HA CYS 567 HA CYS 567 -2.739 -5.741 -8.363
150 HB2 CYS 567 HB2 CYS 567 -1.325 -4.004 -9.354
151 HB3 CYS 567 HB3 CYS 567 -2.036 -3.474 -7.836
152 H LYS 568 HN LYS 568 -0.389 -7.419 -6.889
153 HA LYS 568 HA LYS 568 0.957 -9.123 -7.491
154 HB2 LYS 568 HB2 LYS 568 -0.812 -8.919 -9.900
155 HB3 LYS 568 HB3 LYS 568 0.549 -10.027 -9.913
156 HG2 LYS 568 HG2 LYS 568 -1.447 -11.204 -9.273
157 HG3 LYS 568 HG3 LYS 568 -0.351 -11.119 -7.894
158 HD2 LYS 568 HD2 LYS 568 -1.648 -9.221 -7.013
159 HD3 LYS 568 HD3 LYS 568 -2.766 -9.368 -8.370
160 HE2 LYS 568 HE2 LYS 568 -2.211 -11.500 -6.316
161 HE3 LYS 568 HE3 LYS 568 -3.618 -10.436 -6.327
162 HZ1 LYS 568 HZ1 LYS 568 -2.906 -12.419 -8.430
163 HZ2 LYS 568 HZ2 LYS 568 -4.241 -11.375 -8.479
164 HZ3 LYS 568 HZ3 LYS 568 -4.145 -12.576 -7.282
165 H GLU 569 HN GLU 569 1.809 -6.350 -7.962
166 HA GLU 569 HA GLU 569 3.789 -6.812 -10.076
167 HB2 GLU 569 HB2 GLU 569 2.735 -4.284 -8.825
168 HB3 GLU 569 HB3 GLU 569 4.166 -4.312 -9.850
169 HG2 GLU 569 HG2 GLU 569 1.477 -5.332 -10.735
170 HG3 GLU 569 HG3 GLU 569 2.025 -3.676 -10.992
171 H THR 570 HN THR 570 5.910 -6.816 -9.630
172 HA THR 570 HA THR 570 6.748 -7.337 -6.972
173 HB THR 570 HB THR 570 8.439 -6.720 -9.407
174 HG1 THR 570 HG1 THR 570 7.290 -8.478 -9.996
175 HG21 THR 570 HG21 THR 570 9.090 -8.271 -6.891
176 HG22 THR 570 HG22 THR 570 9.676 -6.655 -7.282
177 HG23 THR 570 HG23 THR 570 10.162 -8.030 -8.270
178 H VAL 571 HN VAL 571 7.318 -5.930 -5.439
179 HA VAL 571 HA VAL 571 7.689 -3.113 -6.158
180 HB VAL 571 HB VAL 571 7.516 -4.294 -3.392
181 HG11 VAL 571 HG11 VAL 571 6.811 -2.019 -2.763
182 HG12 VAL 571 HG12 VAL 571 7.067 -1.499 -4.430
183 HG13 VAL 571 HG13 VAL 571 8.431 -2.061 -3.462
184 HG21 VAL 571 HG21 VAL 571 5.506 -4.940 -4.562
185 HG22 VAL 571 HG22 VAL 571 5.259 -3.283 -5.111
186 HG23 VAL 571 HG23 VAL 571 5.132 -3.672 -3.395
187 H THR 572 HN THR 572 9.709 -2.478 -6.472
188 HA THR 572 HA THR 572 11.869 -3.781 -4.982
189 HB THR 572 HB THR 572 13.353 -2.703 -6.738
190 HG1 THR 572 HG1 THR 572 12.176 -2.173 -8.719
191 HG21 THR 572 HG21 THR 572 12.842 -5.061 -6.863
192 HG22 THR 572 HG22 THR 572 12.782 -4.372 -8.484
193 HG23 THR 572 HG23 THR 572 11.288 -4.721 -7.618
194 H GLY 573 HN GLY 573 13.650 -2.363 -4.244
195 HA2 GLY 573 HA2 GLY 573 12.680 0.358 -3.670
196 HA3 GLY 573 HA3 GLY 573 13.355 -0.656 -2.399
197 H VAL 574 HN VAL 574 14.342 1.845 -3.091
198 HA VAL 574 HA VAL 574 16.785 1.282 -4.634
199 HB VAL 574 HB VAL 574 15.433 3.959 -4.194
200 HG11 VAL 574 HG11 VAL 574 17.678 3.170 -6.042
201 HG12 VAL 574 HG12 VAL 574 17.822 4.166 -4.594
202 HG13 VAL 574 HG13 VAL 574 16.905 4.754 -5.981
203 HG21 VAL 574 HG21 VAL 574 15.396 2.193 -6.638
204 HG22 VAL 574 HG22 VAL 574 14.728 3.819 -6.527
205 HG23 VAL 574 HG23 VAL 574 14.032 2.516 -5.570
206 H TYR 575 HN TYR 575 18.755 1.993 -3.790
207 HA TYR 575 HA TYR 575 18.810 2.505 -0.943
208 HB2 TYR 575 HB2 TYR 575 20.496 1.043 -1.958
209 HB3 TYR 575 HB3 TYR 575 21.033 2.360 -2.991
210 HD1 TYR 575 HD1 TYR 575 20.416 1.854 0.662
211 HD2 TYR 575 HD2 TYR 575 23.019 3.326 -2.365
212 HE1 TYR 575 HE1 TYR 575 22.040 2.528 2.390
213 HE2 TYR 575 HE2 TYR 575 24.642 4.004 -0.650
214 HH TYR 575 HH TYR 575 24.696 4.559 1.731
215 H ASP 576 HN ASP 576 18.688 4.490 -0.093
216 HA ASP 576 HA ASP 576 19.018 6.773 -1.868
217 HB2 ASP 576 HB2 ASP 576 17.074 6.708 -0.348
218 HB3 ASP 576 HB3 ASP 576 18.164 6.671 1.035
219 H GLU 577 HN GLU 577 20.981 7.494 -2.150
220 HA GLU 577 HA GLU 577 23.137 6.693 -0.495
221 HB2 GLU 577 HB2 GLU 577 23.072 8.714 -2.738
222 HB3 GLU 577 HB3 GLU 577 24.527 8.033 -2.017
223 HG2 GLU 577 HG2 GLU 577 23.818 5.801 -2.735
224 HG3 GLU 577 HG3 GLU 577 22.396 6.513 -3.496
225 H GLU 578 HN GLU 578 21.073 9.449 -0.469
226 HA GLU 578 HA GLU 578 22.930 11.211 0.801
227 HB2 GLU 578 HB2 GLU 578 21.044 12.062 -0.535
228 HB3 GLU 578 HB3 GLU 578 19.917 11.386 0.631
229 HG2 GLU 578 HG2 GLU 578 20.810 12.856 2.359
230 HG3 GLU 578 HG3 GLU 578 21.943 13.540 1.194
231 H SER 579 HN SER 579 20.117 9.321 1.932
232 HA SER 579 HA SER 579 20.746 9.954 4.690
233 HB2 SER 579 HB2 SER 579 18.766 8.539 5.205
234 HB3 SER 579 HB3 SER 579 18.405 9.816 4.038
235 HG SER 579 HG SER 579 18.468 8.312 2.389
236 H GLY 580 HN GLY 580 21.513 7.521 2.423
237 HA2 GLY 580 HA2 GLY 580 23.078 5.834 2.616
238 HA3 GLY 580 HA3 GLY 580 23.223 6.205 4.327
239 H GLU 581 HN GLU 581 20.079 5.618 3.011
240 HA GLU 581 HA GLU 581 20.107 2.874 4.057
241 HB2 GLU 581 HB2 GLU 581 18.091 5.016 4.757
242 HB3 GLU 581 HB3 GLU 581 17.901 3.310 5.142
243 HG2 GLU 581 HG2 GLU 581 19.916 3.399 6.516
244 HG3 GLU 581 HG3 GLU 581 20.106 5.106 6.128
245 H TRP 582 HN TRP 582 18.514 1.509 3.207
246 HA TRP 582 HA TRP 582 17.708 2.111 0.506
247 HB2 TRP 582 HB2 TRP 582 17.171 -0.292 2.269
248 HB3 TRP 582 HB3 TRP 582 16.718 -0.183 0.570
249 HD1 TRP 582 HD1 TRP 582 19.876 -0.337 2.783
250 HE1 TRP 582 HE1 TRP 582 21.795 -1.328 1.367
251 HE3 TRP 582 HE3 TRP 582 17.481 -0.591 -1.715
252 HZ2 TRP 582 HZ2 TRP 582 22.219 -2.110 -1.318
253 HZ3 TRP 582 HZ3 TRP 582 18.706 -1.470 -3.662
254 HH2 TRP 582 HH2 TRP 582 21.027 -2.214 -3.465
255 H VAL 583 HN VAL 583 15.581 2.297 -0.260
256 HA VAL 583 HA VAL 583 13.609 2.897 1.853
257 HB VAL 583 HB VAL 583 12.746 4.727 0.501
258 HG11 VAL 583 HG11 VAL 583 14.619 6.289 0.710
259 HG12 VAL 583 HG12 VAL 583 15.729 4.930 0.905
260 HG13 VAL 583 HG13 VAL 583 14.489 5.239 2.122
261 HG21 VAL 583 HG21 VAL 583 13.933 5.490 -1.517
262 HG22 VAL 583 HG22 VAL 583 13.263 3.866 -1.714
263 HG23 VAL 583 HG23 VAL 583 14.989 4.078 -1.414
264 H TRP 584 HN TRP 584 11.723 1.856 1.698
265 HA TRP 584 HA TRP 584 10.710 1.157 -0.980
266 HB2 TRP 584 HB2 TRP 584 10.007 0.163 1.779
267 HB3 TRP 584 HB3 TRP 584 8.890 -0.032 0.436
268 HD1 TRP 584 HD1 TRP 584 11.925 -0.522 -1.288
269 HE1 TRP 584 HE1 TRP 584 12.655 -2.974 -1.396
270 HE3 TRP 584 HE3 TRP 584 8.970 -2.373 2.433
271 HZ2 TRP 584 HZ2 TRP 584 12.048 -5.396 -0.076
272 HZ3 TRP 584 HZ3 TRP 584 9.101 -4.776 2.946
273 HH2 TRP 584 HH2 TRP 584 10.604 -6.256 1.722
274 H LYS 585 HN LYS 585 9.741 2.960 -1.748
275 HA LYS 585 HA LYS 585 8.272 4.671 0.087
276 HB2 LYS 585 HB2 LYS 585 8.053 6.189 -1.916
277 HB3 LYS 585 HB3 LYS 585 9.682 5.916 -1.326
278 HG2 LYS 585 HG2 LYS 585 9.832 5.863 -3.664
279 HG3 LYS 585 HG3 LYS 585 9.902 4.175 -3.155
280 HD2 LYS 585 HD2 LYS 585 7.648 3.803 -3.788
281 HD3 LYS 585 HD3 LYS 585 7.362 5.528 -4.022
282 HE2 LYS 585 HE2 LYS 585 9.271 3.853 -5.647
283 HE3 LYS 585 HE3 LYS 585 7.638 4.283 -6.145
284 HZ1 LYS 585 HZ1 LYS 585 9.108 5.793 -7.178
285 HZ2 LYS 585 HZ2 LYS 585 9.946 6.107 -5.741
286 HZ3 LYS 585 HZ3 LYS 585 8.352 6.663 -5.929
287 H ASN 586 HN ASN 586 6.121 5.429 -0.398
288 HA ASN 586 HA ASN 586 3.915 4.857 -0.397
289 HB2 ASN 586 HB2 ASN 586 4.582 3.402 -2.966
290 HB3 ASN 586 HB3 ASN 586 2.988 3.861 -2.427
291 HD21 ASN 586 HD21 ASN 586 2.223 5.808 -2.945
292 HD22 ASN 586 HD22 ASN 586 3.127 7.037 -3.763
293 H THR 587 HN THR 587 5.380 3.332 1.260
294 HA THR 587 HA THR 587 4.105 0.693 1.001
295 HB THR 587 HB THR 587 6.980 1.084 1.874
296 HG1 THR 587 HG1 THR 587 6.259 1.284 -0.511
297 HG21 THR 587 HG21 THR 587 5.390 -1.420 1.316
298 HG22 THR 587 HG22 THR 587 5.869 -0.840 2.909
299 HG23 THR 587 HG23 THR 587 7.098 -1.355 1.754
300 H ILE 588 HN ILE 588 3.386 -0.182 2.905
301 HA ILE 588 HA ILE 588 4.054 1.144 5.426
302 HB ILE 588 HB ILE 588 2.038 2.289 4.611
303 HG12 ILE 588 HG12 ILE 588 1.423 0.425 6.915
304 HG13 ILE 588 HG13 ILE 588 2.352 1.917 7.043
305 HG21 ILE 588 HG21 ILE 588 1.126 0.531 3.204
306 HG22 ILE 588 HG22 ILE 588 -0.078 1.088 4.367
307 HG23 ILE 588 HG23 ILE 588 0.763 -0.439 4.631
308 HD11 ILE 588 HD11 ILE 588 0.386 3.189 6.354
309 HD12 ILE 588 HD12 ILE 588 0.075 2.231 7.801
310 HD13 ILE 588 HD13 ILE 588 -0.538 1.691 6.240
311 H GLU 589 HN GLU 589 3.885 -0.201 7.235
312 HA GLU 589 HA GLU 589 3.442 -3.036 6.668
313 HB2 GLU 589 HB2 GLU 589 5.477 -2.403 7.930
314 HB3 GLU 589 HB3 GLU 589 4.464 -1.715 9.191
315 HG2 GLU 589 HG2 GLU 589 3.451 -3.986 9.502
316 HG3 GLU 589 HG3 GLU 589 4.674 -4.619 8.397
317 H VAL 590 HN VAL 590 1.535 -3.895 7.025
318 HA VAL 590 HA VAL 590 -0.139 -2.794 9.186
319 HB VAL 590 HB VAL 590 -1.138 -3.878 6.542
320 HG11 VAL 590 HG11 VAL 590 -2.650 -4.367 8.390
321 HG12 VAL 590 HG12 VAL 590 -3.343 -3.147 7.322
322 HG13 VAL 590 HG13 VAL 590 -2.637 -2.670 8.865
323 HG21 VAL 590 HG21 VAL 590 -0.087 -1.656 6.346
324 HG22 VAL 590 HG22 VAL 590 -1.191 -1.045 7.580
325 HG23 VAL 590 HG23 VAL 590 -1.822 -1.615 6.034
326 H ASN 591 HN ASN 591 -0.511 -4.245 10.702
327 HA ASN 591 HA ASN 591 -0.670 -6.196 11.833
328 HB2 ASN 591 HB2 ASN 591 -2.166 -6.588 9.405
329 HB3 ASN 591 HB3 ASN 591 -1.468 -8.109 9.946
330 HD21 ASN 591 HD21 ASN 591 -2.107 -8.981 11.896
331 HD22 ASN 591 HD22 ASN 591 -3.512 -8.435 12.744
332 H GLY 592 HN GLY 592 1.843 -5.547 10.623
333 HA2 GLY 592 HA2 GLY 592 3.907 -6.588 10.860
334 HA3 GLY 592 HA3 GLY 592 3.093 -8.139 10.971
335 H LYS 593 HN LYS 593 1.807 -6.696 8.326
336 HA LYS 593 HA LYS 593 3.802 -7.955 6.569
337 HB2 LYS 593 HB2 LYS 593 0.806 -7.801 6.368
338 HB3 LYS 593 HB3 LYS 593 1.807 -8.177 4.970
339 HG2 LYS 593 HG2 LYS 593 1.831 -9.751 7.542
340 HG3 LYS 593 HG3 LYS 593 0.867 -10.172 6.121
341 HD2 LYS 593 HD2 LYS 593 2.961 -10.267 4.791
342 HD3 LYS 593 HD3 LYS 593 3.870 -9.960 6.270
343 HE2 LYS 593 HE2 LYS 593 3.111 -12.023 7.238
344 HE3 LYS 593 HE3 LYS 593 2.017 -12.305 5.884
345 HZ1 LYS 593 HZ1 LYS 593 4.014 -13.626 5.648
346 HZ2 LYS 593 HZ2 LYS 593 4.986 -12.240 5.754
347 HZ3 LYS 593 HZ3 LYS 593 3.955 -12.454 4.421
348 H TYR 594 HN TYR 594 4.328 -6.972 4.608
349 HA TYR 594 HA TYR 594 3.945 -4.072 4.692
350 HB2 TYR 594 HB2 TYR 594 5.984 -5.738 3.206
351 HB3 TYR 594 HB3 TYR 594 5.902 -3.976 3.173
352 HD1 TYR 594 HD1 TYR 594 7.257 -6.799 4.821
353 HD2 TYR 594 HD2 TYR 594 6.051 -2.774 5.467
354 HE1 TYR 594 HE1 TYR 594 8.695 -6.697 6.806
355 HE2 TYR 594 HE2 TYR 594 7.476 -2.663 7.468
356 HH TYR 594 HH TYR 594 9.888 -4.793 8.094
357 H PHE 595 HN PHE 595 2.750 -3.037 3.288
358 HA PHE 595 HA PHE 595 2.233 -4.239 0.652
359 HB2 PHE 595 HB2 PHE 595 0.131 -2.895 2.383
360 HB3 PHE 595 HB3 PHE 595 -0.117 -3.521 0.761
361 HD1 PHE 595 HD1 PHE 595 0.088 -4.301 4.282
362 HD2 PHE 595 HD2 PHE 595 -0.161 -5.956 0.373
363 HE1 PHE 595 HE1 PHE 595 -0.604 -6.454 5.249
364 HE2 PHE 595 HE2 PHE 595 -0.856 -8.112 1.332
365 HZ PHE 595 HZ PHE 595 -1.076 -8.365 3.766
366 H HIS 596 HN HIS 596 1.572 -2.628 -0.961
367 HA HIS 596 HA HIS 596 2.881 -0.147 -0.837
368 HB2 HIS 596 HB2 HIS 596 0.709 -1.265 -2.580
369 HB3 HIS 596 HB3 HIS 596 1.058 0.455 -2.654
370 HD2 HIS 596 HD2 HIS 596 4.346 0.172 -2.546
371 HE1 HIS 596 HE1 HIS 596 3.703 -1.978 -6.133
372 HE2 HIS 596 HE2 HIS 596 5.357 -0.591 -4.804
373 H SER 597 HN SER 597 2.373 1.684 0.143
374 HA SER 597 HA SER 597 0.124 1.974 1.829
375 HB2 SER 597 HB2 SER 597 2.217 3.210 2.225
376 HB3 SER 597 HB3 SER 597 1.990 4.088 0.713
377 HG SER 597 HG SER 597 -0.227 4.409 2.081
378 H THR 598 HN THR 598 0.787 2.794 -1.494
379 HA THR 598 HA THR 598 -1.460 4.416 -1.966
380 HB THR 598 HB THR 598 -0.186 2.617 -4.014
381 HG1 THR 598 HG1 THR 598 1.269 4.479 -4.304
382 HG21 THR 598 HG21 THR 598 -1.455 5.358 -4.173
383 HG22 THR 598 HG22 THR 598 -2.138 3.846 -4.776
384 HG23 THR 598 HG23 THR 598 -0.684 4.514 -5.518
385 H CYS 599 HN CYS 599 -0.869 0.956 -2.270
386 HA CYS 599 HA CYS 599 -3.395 0.383 -3.456
387 HB2 CYS 599 HB2 CYS 599 -1.320 -1.448 -2.269
388 HB3 CYS 599 HB3 CYS 599 -2.730 -1.978 -3.180
389 H TYR 600 HN TYR 600 -2.184 0.422 -0.169
390 HA TYR 600 HA TYR 600 -3.934 -1.414 0.988
391 HB2 TYR 600 HB2 TYR 600 -1.983 -0.491 2.180
392 HB3 TYR 600 HB3 TYR 600 -2.781 1.078 2.262
393 HD1 TYR 600 HD1 TYR 600 -3.231 -2.478 3.300
394 HD2 TYR 600 HD2 TYR 600 -4.125 1.609 4.081
395 HE1 TYR 600 HE1 TYR 600 -4.283 -3.122 5.433
396 HE2 TYR 600 HE2 TYR 600 -5.176 0.979 6.208
397 HH TYR 600 HH TYR 600 -4.747 -1.881 7.719
398 H HIS 601 HN HIS 601 -4.389 1.978 0.201
399 HA HIS 601 HA HIS 601 -6.834 2.325 1.574
400 HB2 HIS 601 HB2 HIS 601 -5.623 3.786 -0.770
401 HB3 HIS 601 HB3 HIS 601 -7.122 4.285 0.009
402 HD2 HIS 601 HD2 HIS 601 -5.923 3.683 3.092
403 HE1 HIS 601 HE1 HIS 601 -3.313 6.834 2.000
404 HE2 HIS 601 HE2 HIS 601 -4.448 5.654 3.933
405 H GLU 602 HN GLU 602 -6.046 0.882 -1.497
406 HA GLU 602 HA GLU 602 -8.538 1.258 -2.756
407 HB2 GLU 602 HB2 GLU 602 -7.707 0.025 -4.491
408 HB3 GLU 602 HB3 GLU 602 -6.198 0.412 -3.688
409 HG2 GLU 602 HG2 GLU 602 -5.902 -1.820 -4.108
410 HG3 GLU 602 HG3 GLU 602 -6.587 -1.890 -2.487
411 H THR 603 HN THR 603 -7.384 -1.096 -0.455
412 HA THR 603 HA THR 603 -9.739 -2.749 -0.865
413 HB THR 603 HB THR 603 -7.514 -3.808 -0.457
414 HG1 THR 603 HG1 THR 603 -9.252 -5.094 -0.036
415 HG21 THR 603 HG21 THR 603 -6.695 -2.212 1.251
416 HG22 THR 603 HG22 THR 603 -6.602 -3.890 1.788
417 HG23 THR 603 HG23 THR 603 -7.893 -2.845 2.380
Start of MODEL 6
1 H GLY 548 HN GLY 548 3.530 9.774 1.007
2 HA2 GLY 548 HA2 GLY 548 5.325 9.559 -0.563
3 HA3 GLY 548 HA3 GLY 548 5.857 11.174 -0.118
4 H LYS 549 HN LYS 549 4.971 9.351 2.565
5 HA LYS 549 HA LYS 549 7.622 9.216 3.540
6 HB2 LYS 549 HB2 LYS 549 5.075 7.940 4.533
7 HB3 LYS 549 HB3 LYS 549 6.612 7.840 5.383
8 HG2 LYS 549 HG2 LYS 549 6.673 10.291 5.533
9 HG3 LYS 549 HG3 LYS 549 5.101 10.360 4.736
10 HD2 LYS 549 HD2 LYS 549 4.103 9.113 6.574
11 HD3 LYS 549 HD3 LYS 549 5.682 8.989 7.359
12 HE2 LYS 549 HE2 LYS 549 4.267 11.577 6.718
13 HE3 LYS 549 HE3 LYS 549 4.243 10.781 8.294
14 HZ1 LYS 549 HZ1 LYS 549 6.469 11.245 8.657
15 HZ2 LYS 549 HZ2 LYS 549 5.948 12.647 7.858
16 HZ3 LYS 549 HZ3 LYS 549 6.815 11.459 7.014
17 H TYR 550 HN TYR 550 8.856 7.386 4.027
18 HA TYR 550 HA TYR 550 8.441 5.161 2.158
19 HB2 TYR 550 HB2 TYR 550 10.769 5.193 1.605
20 HB3 TYR 550 HB3 TYR 550 10.160 6.834 1.419
21 HD1 TYR 550 HD1 TYR 550 12.758 4.881 2.766
22 HD2 TYR 550 HD2 TYR 550 10.443 8.360 3.577
23 HE1 TYR 550 HE1 TYR 550 14.504 5.668 4.316
24 HE2 TYR 550 HE2 TYR 550 12.172 9.156 5.128
25 HH TYR 550 HH TYR 550 15.260 7.877 5.278
26 H VAL 551 HN VAL 551 9.511 3.187 2.736
27 HA VAL 551 HA VAL 551 10.266 2.968 5.583
28 HB VAL 551 HB VAL 551 9.012 0.848 3.808
29 HG11 VAL 551 HG11 VAL 551 9.890 0.668 6.689
30 HG12 VAL 551 HG12 VAL 551 10.674 -0.119 5.319
31 HG13 VAL 551 HG13 VAL 551 9.038 -0.585 5.784
32 HG21 VAL 551 HG21 VAL 551 7.154 0.926 5.394
33 HG22 VAL 551 HG22 VAL 551 7.398 2.487 4.609
34 HG23 VAL 551 HG23 VAL 551 7.952 2.234 6.265
35 H VAL 552 HN VAL 552 12.247 2.173 5.981
36 HA VAL 552 HA VAL 552 14.155 2.045 3.907
37 HB VAL 552 HB VAL 552 14.425 1.001 6.741
38 HG11 VAL 552 HG11 VAL 552 16.544 1.869 4.773
39 HG12 VAL 552 HG12 VAL 552 16.184 0.205 5.237
40 HG13 VAL 552 HG13 VAL 552 16.818 1.335 6.432
41 HG21 VAL 552 HG21 VAL 552 13.719 3.318 6.780
42 HG22 VAL 552 HG22 VAL 552 14.991 3.754 5.638
43 HG23 VAL 552 HG23 VAL 552 15.413 3.197 7.257
44 H VAL 553 HN VAL 553 14.889 0.376 2.732
45 HA VAL 553 HA VAL 553 13.449 -2.044 2.625
46 HB VAL 553 HB VAL 553 16.209 -1.566 1.496
47 HG11 VAL 553 HG11 VAL 553 15.584 -3.246 -0.151
48 HG12 VAL 553 HG12 VAL 553 14.016 -3.450 0.635
49 HG13 VAL 553 HG13 VAL 553 15.498 -3.902 1.485
50 HG21 VAL 553 HG21 VAL 553 15.091 -0.854 -0.561
51 HG22 VAL 553 HG22 VAL 553 14.712 0.219 0.786
52 HG23 VAL 553 HG23 VAL 553 13.531 -0.975 0.250
53 HA PRO 554 HA PRO 554 15.189 -4.030 6.172
54 HB2 PRO 554 HB2 PRO 554 14.175 -6.448 4.780
55 HB3 PRO 554 HB3 PRO 554 13.852 -5.879 6.420
56 HG2 PRO 554 HG2 PRO 554 12.007 -5.656 4.499
57 HG3 PRO 554 HG3 PRO 554 12.218 -4.393 5.727
58 HD2 PRO 554 HD2 PRO 554 13.076 -4.411 2.863
59 HD3 PRO 554 HD3 PRO 554 12.490 -3.067 3.861
60 H GLU 555 HN GLU 555 17.166 -4.795 6.571
61 HA GLU 555 HA GLU 555 18.626 -6.126 4.403
62 HB2 GLU 555 HB2 GLU 555 19.635 -4.879 6.960
63 HB3 GLU 555 HB3 GLU 555 20.651 -5.611 5.725
64 HG2 GLU 555 HG2 GLU 555 19.788 -3.915 4.115
65 HG3 GLU 555 HG3 GLU 555 18.952 -3.139 5.458
66 H THR 556 HN THR 556 16.864 -6.808 7.098
67 HA THR 556 HA THR 556 18.343 -9.142 7.966
68 HB THR 556 HB THR 556 16.274 -9.528 9.386
69 HG1 THR 556 HG1 THR 556 14.594 -8.286 9.085
70 HG21 THR 556 HG21 THR 556 16.737 -7.637 10.910
71 HG22 THR 556 HG22 THR 556 17.696 -6.878 9.638
72 HG23 THR 556 HG23 THR 556 18.212 -8.419 10.325
73 H SER 557 HN SER 557 16.464 -8.383 5.392
74 HA SER 557 HA SER 557 15.175 -10.997 5.170
75 HB2 SER 557 HB2 SER 557 14.828 -8.504 3.483
76 HB3 SER 557 HB3 SER 557 13.879 -9.987 3.350
77 HG SER 557 HG SER 557 12.801 -9.475 5.097
78 H GLN 558 HN GLN 558 15.734 -12.429 3.634
79 HA GLN 558 HA GLN 558 18.275 -12.180 2.342
80 HB2 GLN 558 HB2 GLN 558 16.103 -14.261 1.999
81 HB3 GLN 558 HB3 GLN 558 17.759 -14.406 1.425
82 HG2 GLN 558 HG2 GLN 558 18.617 -14.548 3.607
83 HG3 GLN 558 HG3 GLN 558 17.103 -13.995 4.318
84 HE21 GLN 558 HE21 GLN 558 16.967 -15.783 5.644
85 HE22 GLN 558 HE22 GLN 558 16.560 -17.361 5.055
86 H ASP 559 HN ASP 559 14.911 -12.044 1.383
87 HA ASP 559 HA ASP 559 15.728 -11.005 -1.230
88 HB2 ASP 559 HB2 ASP 559 13.308 -11.352 -1.850
89 HB3 ASP 559 HB3 ASP 559 14.190 -12.829 -1.494
90 H MET 560 HN MET 560 15.943 -8.870 -1.221
91 HA MET 560 HA MET 560 14.667 -7.232 0.788
92 HB2 MET 560 HB2 MET 560 16.371 -6.388 -1.567
93 HB3 MET 560 HB3 MET 560 15.974 -5.406 -0.167
94 HG2 MET 560 HG2 MET 560 17.244 -6.888 1.274
95 HG3 MET 560 HG3 MET 560 17.603 -7.941 -0.092
96 HE1 MET 560 HE1 MET 560 19.267 -3.682 0.507
97 HE2 MET 560 HE2 MET 560 18.339 -4.569 1.709
98 HE3 MET 560 HE3 MET 560 17.554 -4.013 0.234
99 H ALA 561 HN ALA 561 12.775 -8.459 -0.838
100 HA ALA 561 HA ALA 561 11.470 -6.154 -2.047
101 HB1 ALA 561 HB1 ALA 561 12.658 -7.173 -3.906
102 HB2 ALA 561 HB2 ALA 561 10.922 -7.439 -4.085
103 HB3 ALA 561 HB3 ALA 561 11.963 -8.748 -3.520
104 H PHE 562 HN PHE 562 9.129 -6.590 -2.398
105 HA PHE 562 HA PHE 562 8.190 -9.086 -1.201
106 HB2 PHE 562 HB2 PHE 562 6.553 -8.063 0.197
107 HB3 PHE 562 HB3 PHE 562 8.079 -7.271 0.545
108 HD1 PHE 562 HD1 PHE 562 4.730 -6.889 -0.789
109 HD2 PHE 562 HD2 PHE 562 8.454 -4.939 -0.117
110 HE1 PHE 562 HE1 PHE 562 3.642 -4.712 -1.125
111 HE2 PHE 562 HE2 PHE 562 7.369 -2.756 -0.459
112 HZ PHE 562 HZ PHE 562 4.957 -2.643 -0.957
113 H LYS 563 HN LYS 563 6.246 -9.840 -2.001
114 HA LYS 563 HA LYS 563 5.620 -8.817 -4.646
115 HB2 LYS 563 HB2 LYS 563 5.967 -11.229 -4.306
116 HB3 LYS 563 HB3 LYS 563 4.638 -11.262 -3.159
117 HG2 LYS 563 HG2 LYS 563 3.706 -12.107 -5.103
118 HG3 LYS 563 HG3 LYS 563 3.193 -10.421 -5.103
119 HD2 LYS 563 HD2 LYS 563 4.970 -9.867 -6.673
120 HD3 LYS 563 HD3 LYS 563 5.542 -11.535 -6.631
121 HE2 LYS 563 HE2 LYS 563 3.325 -12.260 -7.480
122 HE3 LYS 563 HE3 LYS 563 2.870 -10.566 -7.631
123 HZ1 LYS 563 HZ1 LYS 563 3.597 -11.395 -9.740
124 HZ2 LYS 563 HZ2 LYS 563 5.060 -11.940 -9.084
125 HZ3 LYS 563 HZ3 LYS 563 4.748 -10.283 -9.179
126 H CYS 564 HN CYS 564 4.122 -7.205 -4.756
127 HA CYS 564 HA CYS 564 2.205 -6.750 -2.694
128 HB2 CYS 564 HB2 CYS 564 3.088 -4.952 -4.170
129 HB3 CYS 564 HB3 CYS 564 2.253 -5.683 -5.530
130 HA PRO 565 HA PRO 565 -0.402 -10.085 -4.173
131 HB2 PRO 565 HB2 PRO 565 -2.127 -9.362 -1.909
132 HB3 PRO 565 HB3 PRO 565 -1.245 -10.861 -2.206
133 HG2 PRO 565 HG2 PRO 565 -0.503 -9.176 -0.262
134 HG3 PRO 565 HG3 PRO 565 0.691 -10.084 -1.212
135 HD2 PRO 565 HD2 PRO 565 -0.194 -7.231 -1.530
136 HD3 PRO 565 HD3 PRO 565 1.454 -7.897 -1.528
137 H ILE 566 HN ILE 566 -1.218 -6.814 -3.685
138 HA ILE 566 HA ILE 566 -3.978 -7.023 -4.469
139 HB ILE 566 HB ILE 566 -2.271 -4.541 -4.218
140 HG12 ILE 566 HG12 ILE 566 -4.108 -5.732 -2.138
141 HG13 ILE 566 HG13 ILE 566 -2.376 -6.044 -2.169
142 HG21 ILE 566 HG21 ILE 566 -4.326 -4.161 -5.451
143 HG22 ILE 566 HG22 ILE 566 -4.443 -3.424 -3.851
144 HG23 ILE 566 HG23 ILE 566 -5.260 -4.952 -4.179
145 HD11 ILE 566 HD11 ILE 566 -3.657 -3.338 -1.891
146 HD12 ILE 566 HD12 ILE 566 -1.928 -3.685 -1.865
147 HD13 ILE 566 HD13 ILE 566 -2.969 -4.298 -0.582
148 H CYS 567 HN CYS 567 -1.033 -5.649 -5.935
149 HA CYS 567 HA CYS 567 -2.485 -5.470 -8.481
150 HB2 CYS 567 HB2 CYS 567 -0.784 -3.841 -9.175
151 HB3 CYS 567 HB3 CYS 567 -1.577 -3.339 -7.687
152 H LYS 568 HN LYS 568 -0.390 -7.451 -6.902
153 HA LYS 568 HA LYS 568 0.718 -9.313 -7.522
154 HB2 LYS 568 HB2 LYS 568 -0.574 -8.704 -10.173
155 HB3 LYS 568 HB3 LYS 568 0.410 -10.136 -9.897
156 HG2 LYS 568 HG2 LYS 568 -1.118 -10.906 -8.193
157 HG3 LYS 568 HG3 LYS 568 -2.074 -9.430 -8.345
158 HD2 LYS 568 HD2 LYS 568 -1.616 -11.357 -10.616
159 HD3 LYS 568 HD3 LYS 568 -3.007 -11.434 -9.535
160 HE2 LYS 568 HE2 LYS 568 -2.264 -9.036 -11.207
161 HE3 LYS 568 HE3 LYS 568 -3.469 -10.242 -11.663
162 HZ1 LYS 568 HZ1 LYS 568 -4.748 -9.678 -9.711
163 HZ2 LYS 568 HZ2 LYS 568 -4.475 -8.286 -10.644
164 HZ3 LYS 568 HZ3 LYS 568 -3.583 -8.548 -9.230
165 H GLU 569 HN GLU 569 1.930 -6.544 -7.874
166 HA GLU 569 HA GLU 569 4.081 -7.307 -9.727
167 HB2 GLU 569 HB2 GLU 569 3.271 -4.617 -8.614
168 HB3 GLU 569 HB3 GLU 569 4.771 -4.875 -9.494
169 HG2 GLU 569 HG2 GLU 569 2.029 -5.431 -10.601
170 HG3 GLU 569 HG3 GLU 569 2.945 -3.950 -10.881
171 H THR 570 HN THR 570 6.097 -7.690 -9.008
172 HA THR 570 HA THR 570 6.577 -7.940 -6.194
173 HB THR 570 HB THR 570 8.545 -8.139 -8.490
174 HG1 THR 570 HG1 THR 570 7.058 -9.721 -8.834
175 HG21 THR 570 HG21 THR 570 9.873 -9.490 -6.924
176 HG22 THR 570 HG22 THR 570 8.685 -9.187 -5.656
177 HG23 THR 570 HG23 THR 570 9.632 -7.854 -6.317
178 H VAL 571 HN VAL 571 7.428 -6.435 -4.871
179 HA VAL 571 HA VAL 571 8.220 -3.872 -6.062
180 HB VAL 571 HB VAL 571 7.599 -4.447 -3.169
181 HG11 VAL 571 HG11 VAL 571 8.814 -2.388 -3.527
182 HG12 VAL 571 HG12 VAL 571 7.147 -2.025 -3.082
183 HG13 VAL 571 HG13 VAL 571 7.658 -1.891 -4.762
184 HG21 VAL 571 HG21 VAL 571 5.677 -5.096 -4.473
185 HG22 VAL 571 HG22 VAL 571 5.720 -3.565 -5.350
186 HG23 VAL 571 HG23 VAL 571 5.339 -3.581 -3.626
187 H THR 572 HN THR 572 10.311 -3.609 -6.295
188 HA THR 572 HA THR 572 12.162 -4.644 -4.268
189 HB THR 572 HB THR 572 13.933 -4.050 -5.976
190 HG1 THR 572 HG1 THR 572 13.243 -2.906 -7.614
191 HG21 THR 572 HG21 THR 572 13.215 -6.355 -5.706
192 HG22 THR 572 HG22 THR 572 13.509 -6.009 -7.409
193 HG23 THR 572 HG23 THR 572 11.855 -6.088 -6.798
194 H GLY 573 HN GLY 573 13.985 -3.112 -3.670
195 HA2 GLY 573 HA2 GLY 573 12.990 -0.342 -3.801
196 HA3 GLY 573 HA3 GLY 573 13.593 -1.045 -2.302
197 H VAL 574 HN VAL 574 14.590 1.288 -3.521
198 HA VAL 574 HA VAL 574 17.112 0.393 -4.744
199 HB VAL 574 HB VAL 574 15.743 3.076 -5.055
200 HG11 VAL 574 HG11 VAL 574 17.334 3.395 -6.915
201 HG12 VAL 574 HG12 VAL 574 18.132 1.888 -6.465
202 HG13 VAL 574 HG13 VAL 574 18.131 3.253 -5.347
203 HG21 VAL 574 HG21 VAL 574 15.839 0.744 -6.969
204 HG22 VAL 574 HG22 VAL 574 15.177 2.341 -7.325
205 HG23 VAL 574 HG23 VAL 574 14.420 1.327 -6.098
206 H TYR 575 HN TYR 575 19.019 1.226 -4.020
207 HA TYR 575 HA TYR 575 19.053 2.402 -1.405
208 HB2 TYR 575 HB2 TYR 575 20.782 0.794 -2.196
209 HB3 TYR 575 HB3 TYR 575 21.322 1.986 -3.372
210 HD1 TYR 575 HD1 TYR 575 20.532 1.993 0.276
211 HD2 TYR 575 HD2 TYR 575 23.276 3.017 -2.805
212 HE1 TYR 575 HE1 TYR 575 22.066 2.930 1.959
213 HE2 TYR 575 HE2 TYR 575 24.806 3.972 -1.139
214 HH TYR 575 HH TYR 575 24.419 3.455 2.215
215 H ASP 576 HN ASP 576 18.797 4.498 -1.037
216 HA ASP 576 HA ASP 576 18.968 6.350 -3.278
217 HB2 ASP 576 HB2 ASP 576 17.000 6.416 -1.753
218 HB3 ASP 576 HB3 ASP 576 18.072 6.831 -0.421
219 H GLU 577 HN GLU 577 21.053 6.732 -3.658
220 HA GLU 577 HA GLU 577 23.084 6.780 -1.722
221 HB2 GLU 577 HB2 GLU 577 23.012 7.876 -4.534
222 HB3 GLU 577 HB3 GLU 577 24.470 7.779 -3.554
223 HG2 GLU 577 HG2 GLU 577 24.286 5.370 -3.448
224 HG3 GLU 577 HG3 GLU 577 22.766 5.422 -4.339
225 H GLU 578 HN GLU 578 20.886 9.209 -2.733
226 HA GLU 578 HA GLU 578 22.410 11.500 -2.085
227 HB2 GLU 578 HB2 GLU 578 19.402 11.261 -1.949
228 HB3 GLU 578 HB3 GLU 578 20.354 12.717 -2.215
229 HG2 GLU 578 HG2 GLU 578 19.967 10.411 -4.110
230 HG3 GLU 578 HG3 GLU 578 19.399 12.069 -4.293
231 H SER 579 HN SER 579 20.112 9.530 -0.252
232 HA SER 579 HA SER 579 20.738 11.059 2.169
233 HB2 SER 579 HB2 SER 579 18.784 9.853 3.135
234 HB3 SER 579 HB3 SER 579 18.382 10.795 1.693
235 HG SER 579 HG SER 579 18.372 8.908 0.486
236 H GLY 580 HN GLY 580 21.382 8.071 0.646
237 HA2 GLY 580 HA2 GLY 580 22.964 6.485 1.234
238 HA3 GLY 580 HA3 GLY 580 23.167 7.294 2.776
239 H GLU 581 HN GLU 581 20.016 6.241 1.615
240 HA GLU 581 HA GLU 581 20.132 3.915 3.396
241 HB2 GLU 581 HB2 GLU 581 17.912 4.535 4.318
242 HB3 GLU 581 HB3 GLU 581 19.181 5.676 4.739
243 HG2 GLU 581 HG2 GLU 581 18.399 7.076 2.798
244 HG3 GLU 581 HG3 GLU 581 16.998 6.010 2.711
245 H TRP 582 HN TRP 582 18.506 2.314 2.963
246 HA TRP 582 HA TRP 582 17.734 2.181 0.181
247 HB2 TRP 582 HB2 TRP 582 17.250 0.304 2.502
248 HB3 TRP 582 HB3 TRP 582 16.772 -0.027 0.835
249 HD1 TRP 582 HD1 TRP 582 19.886 0.178 3.068
250 HE1 TRP 582 HE1 TRP 582 21.828 -1.003 1.856
251 HE3 TRP 582 HE3 TRP 582 17.628 -0.632 -1.438
252 HZ2 TRP 582 HZ2 TRP 582 22.331 -2.126 -0.696
253 HZ3 TRP 582 HZ3 TRP 582 18.905 -1.759 -3.213
254 HH2 TRP 582 HH2 TRP 582 21.206 -2.492 -2.852
255 H VAL 583 HN VAL 583 15.690 2.477 -0.621
256 HA VAL 583 HA VAL 583 13.699 3.335 1.378
257 HB VAL 583 HB VAL 583 12.913 5.037 -0.196
258 HG11 VAL 583 HG11 VAL 583 14.542 5.699 1.462
259 HG12 VAL 583 HG12 VAL 583 14.839 6.565 -0.042
260 HG13 VAL 583 HG13 VAL 583 15.864 5.204 0.406
261 HG21 VAL 583 HG21 VAL 583 15.232 4.138 -1.904
262 HG22 VAL 583 HG22 VAL 583 14.258 5.581 -2.190
263 HG23 VAL 583 HG23 VAL 583 13.516 3.982 -2.286
264 H TRP 584 HN TRP 584 11.793 2.365 1.323
265 HA TRP 584 HA TRP 584 10.672 1.543 -1.281
266 HB2 TRP 584 HB2 TRP 584 10.033 0.715 1.557
267 HB3 TRP 584 HB3 TRP 584 8.895 0.453 0.246
268 HD1 TRP 584 HD1 TRP 584 11.929 -0.241 -1.452
269 HE1 TRP 584 HE1 TRP 584 12.562 -2.725 -1.387
270 HE3 TRP 584 HE3 TRP 584 8.925 -1.728 2.389
271 HZ2 TRP 584 HZ2 TRP 584 11.875 -5.031 0.096
272 HZ3 TRP 584 HZ3 TRP 584 8.959 -4.097 3.074
273 HH2 TRP 584 HH2 TRP 584 10.406 -5.713 1.950
274 H LYS 585 HN LYS 585 9.654 3.352 -2.081
275 HA LYS 585 HA LYS 585 8.565 5.304 -0.235
276 HB2 LYS 585 HB2 LYS 585 8.417 5.303 -3.260
277 HB3 LYS 585 HB3 LYS 585 8.074 6.653 -2.185
278 HG2 LYS 585 HG2 LYS 585 10.773 5.345 -2.394
279 HG3 LYS 585 HG3 LYS 585 10.285 6.755 -3.335
280 HD2 LYS 585 HD2 LYS 585 9.859 7.972 -1.228
281 HD3 LYS 585 HD3 LYS 585 10.425 6.563 -0.328
282 HE2 LYS 585 HE2 LYS 585 12.213 8.170 -0.484
283 HE3 LYS 585 HE3 LYS 585 12.616 6.759 -1.462
284 HZ1 LYS 585 HZ1 LYS 585 13.155 8.772 -2.641
285 HZ2 LYS 585 HZ2 LYS 585 11.573 9.359 -2.468
286 HZ3 LYS 585 HZ3 LYS 585 11.873 7.995 -3.434
287 H ASN 586 HN ASN 586 6.473 5.862 0.051
288 HA ASN 586 HA ASN 586 4.263 5.486 0.407
289 HB2 ASN 586 HB2 ASN 586 4.166 4.305 -2.378
290 HB3 ASN 586 HB3 ASN 586 2.864 5.058 -1.481
291 HD21 ASN 586 HD21 ASN 586 4.000 5.642 -4.114
292 HD22 ASN 586 HD22 ASN 586 4.430 7.316 -4.070
293 H THR 587 HN THR 587 5.733 3.647 1.591
294 HA THR 587 HA THR 587 4.279 1.138 1.095
295 HB THR 587 HB THR 587 7.143 1.382 2.054
296 HG1 THR 587 HG1 THR 587 6.572 1.824 -0.278
297 HG21 THR 587 HG21 THR 587 5.986 -0.593 2.943
298 HG22 THR 587 HG22 THR 587 7.217 -1.050 1.765
299 HG23 THR 587 HG23 THR 587 5.512 -1.056 1.311
300 H ILE 588 HN ILE 588 3.506 0.086 2.894
301 HA ILE 588 HA ILE 588 4.072 1.216 5.539
302 HB ILE 588 HB ILE 588 2.067 2.389 4.745
303 HG12 ILE 588 HG12 ILE 588 1.405 0.311 6.844
304 HG13 ILE 588 HG13 ILE 588 2.243 1.831 7.141
305 HG21 ILE 588 HG21 ILE 588 0.844 -0.354 4.444
306 HG22 ILE 588 HG22 ILE 588 1.279 0.745 3.132
307 HG23 ILE 588 HG23 ILE 588 -0.005 1.184 4.259
308 HD11 ILE 588 HD11 ILE 588 0.250 3.061 6.465
309 HD12 ILE 588 HD12 ILE 588 -0.095 1.950 7.790
310 HD13 ILE 588 HD13 ILE 588 -0.583 1.538 6.146
311 H GLU 589 HN GLU 589 3.895 -0.278 7.205
312 HA GLU 589 HA GLU 589 3.522 -3.056 6.357
313 HB2 GLU 589 HB2 GLU 589 5.603 -2.431 7.587
314 HB3 GLU 589 HB3 GLU 589 4.620 -1.967 8.968
315 HG2 GLU 589 HG2 GLU 589 4.326 -4.733 7.898
316 HG3 GLU 589 HG3 GLU 589 5.788 -4.329 8.800
317 H VAL 590 HN VAL 590 1.643 -3.982 6.701
318 HA VAL 590 HA VAL 590 -0.042 -2.987 8.902
319 HB VAL 590 HB VAL 590 -1.039 -3.905 6.191
320 HG11 VAL 590 HG11 VAL 590 -2.532 -2.802 8.572
321 HG12 VAL 590 HG12 VAL 590 -2.598 -4.457 7.968
322 HG13 VAL 590 HG13 VAL 590 -3.235 -3.137 6.989
323 HG21 VAL 590 HG21 VAL 590 0.009 -1.724 6.019
324 HG22 VAL 590 HG22 VAL 590 -0.948 -1.130 7.376
325 HG23 VAL 590 HG23 VAL 590 -1.743 -1.575 5.865
326 H ASN 591 HN ASN 591 -0.308 -4.522 10.351
327 HA ASN 591 HA ASN 591 -0.654 -6.524 11.350
328 HB2 ASN 591 HB2 ASN 591 -1.998 -6.959 8.724
329 HB3 ASN 591 HB3 ASN 591 -1.926 -8.254 9.907
330 HD21 ASN 591 HD21 ASN 591 -3.013 -8.034 11.856
331 HD22 ASN 591 HD22 ASN 591 -4.266 -6.857 12.080
332 H GLY 592 HN GLY 592 1.900 -6.118 10.136
333 HA2 GLY 592 HA2 GLY 592 3.782 -7.479 10.337
334 HA3 GLY 592 HA3 GLY 592 2.747 -8.896 10.270
335 H LYS 593 HN LYS 593 1.934 -6.854 7.747
336 HA LYS 593 HA LYS 593 3.936 -8.058 5.965
337 HB2 LYS 593 HB2 LYS 593 0.969 -7.849 5.446
338 HB3 LYS 593 HB3 LYS 593 2.158 -8.230 4.207
339 HG2 LYS 593 HG2 LYS 593 2.840 -10.198 5.573
340 HG3 LYS 593 HG3 LYS 593 1.478 -9.856 6.642
341 HD2 LYS 593 HD2 LYS 593 0.823 -11.552 5.057
342 HD3 LYS 593 HD3 LYS 593 -0.044 -10.061 4.692
343 HE2 LYS 593 HE2 LYS 593 0.801 -11.192 2.672
344 HE3 LYS 593 HE3 LYS 593 1.475 -9.576 2.878
345 HZ1 LYS 593 HZ1 LYS 593 2.893 -12.027 3.768
346 HZ2 LYS 593 HZ2 LYS 593 3.527 -10.467 3.576
347 HZ3 LYS 593 HZ3 LYS 593 3.088 -11.373 2.214
348 H TYR 594 HN TYR 594 4.591 -6.839 4.222
349 HA TYR 594 HA TYR 594 4.137 -3.976 4.516
350 HB2 TYR 594 HB2 TYR 594 6.118 -5.542 2.856
351 HB3 TYR 594 HB3 TYR 594 5.984 -3.788 2.823
352 HD1 TYR 594 HD1 TYR 594 7.116 -6.686 4.721
353 HD2 TYR 594 HD2 TYR 594 6.681 -2.454 4.750
354 HE1 TYR 594 HE1 TYR 594 8.642 -6.548 6.641
355 HE2 TYR 594 HE2 TYR 594 8.215 -2.303 6.665
356 HH TYR 594 HH TYR 594 9.043 -3.698 8.477
357 H PHE 595 HN PHE 595 3.023 -2.760 3.162
358 HA PHE 595 HA PHE 595 2.384 -3.769 0.478
359 HB2 PHE 595 HB2 PHE 595 0.370 -2.517 2.371
360 HB3 PHE 595 HB3 PHE 595 0.067 -2.938 0.693
361 HD1 PHE 595 HD1 PHE 595 0.320 -4.149 4.101
362 HD2 PHE 595 HD2 PHE 595 -0.103 -5.297 0.025
363 HE1 PHE 595 HE1 PHE 595 -0.415 -6.385 4.805
364 HE2 PHE 595 HE2 PHE 595 -0.842 -7.537 0.727
365 HZ PHE 595 HZ PHE 595 -1.057 -8.062 3.123
366 H HIS 596 HN HIS 596 1.833 -2.045 -1.017
367 HA HIS 596 HA HIS 596 3.070 0.472 -0.565
368 HB2 HIS 596 HB2 HIS 596 0.928 -0.295 -2.573
369 HB3 HIS 596 HB3 HIS 596 1.819 1.216 -2.589
370 HD2 HIS 596 HD2 HIS 596 4.820 0.437 -2.613
371 HE1 HIS 596 HE1 HIS 596 3.816 -2.392 -5.604
372 HE2 HIS 596 HE2 HIS 596 5.709 -1.122 -4.478
373 H SER 597 HN SER 597 2.300 2.222 0.442
374 HA SER 597 HA SER 597 -0.013 2.156 2.022
375 HB2 SER 597 HB2 SER 597 1.393 4.648 1.039
376 HB3 SER 597 HB3 SER 597 0.453 4.460 2.519
377 HG SER 597 HG SER 597 2.068 3.374 3.438
378 H THR 598 HN THR 598 0.573 3.321 -1.227
379 HA THR 598 HA THR 598 -1.946 4.555 -1.585
380 HB THR 598 HB THR 598 -0.204 5.142 -3.109
381 HG1 THR 598 HG1 THR 598 -2.017 5.274 -4.279
382 HG21 THR 598 HG21 THR 598 0.799 3.556 -4.672
383 HG22 THR 598 HG22 THR 598 -0.125 2.242 -3.944
384 HG23 THR 598 HG23 THR 598 1.107 3.082 -3.000
385 H CYS 599 HN CYS 599 -0.767 1.285 -1.893
386 HA CYS 599 HA CYS 599 -2.990 0.276 -3.367
387 HB2 CYS 599 HB2 CYS 599 -0.755 -1.114 -1.896
388 HB3 CYS 599 HB3 CYS 599 -1.986 -1.964 -2.829
389 H TYR 600 HN TYR 600 -2.279 0.588 0.042
390 HA TYR 600 HA TYR 600 -4.015 -1.365 1.036
391 HB2 TYR 600 HB2 TYR 600 -2.385 -0.124 2.438
392 HB3 TYR 600 HB3 TYR 600 -3.361 1.330 2.267
393 HD1 TYR 600 HD1 TYR 600 -3.986 -2.241 3.198
394 HD2 TYR 600 HD2 TYR 600 -4.574 1.864 4.167
395 HE1 TYR 600 HE1 TYR 600 -5.263 -2.903 5.191
396 HE2 TYR 600 HE2 TYR 600 -5.864 1.212 6.161
397 HH TYR 600 HH TYR 600 -7.107 -0.663 7.035
398 H HIS 601 HN HIS 601 -4.586 1.890 -0.114
399 HA HIS 601 HA HIS 601 -7.366 1.940 0.529
400 HB2 HIS 601 HB2 HIS 601 -5.765 3.640 -1.388
401 HB3 HIS 601 HB3 HIS 601 -7.434 3.943 -0.921
402 HD2 HIS 601 HD2 HIS 601 -3.958 3.698 0.914
403 HE1 HIS 601 HE1 HIS 601 -6.506 6.407 2.941
404 HE2 HIS 601 HE2 HIS 601 -4.133 5.536 2.756
405 H GLU 602 HN GLU 602 -5.517 1.114 -2.403
406 HA GLU 602 HA GLU 602 -7.809 0.986 -4.075
407 HB2 GLU 602 HB2 GLU 602 -6.398 0.009 -5.754
408 HB3 GLU 602 HB3 GLU 602 -5.485 1.267 -4.937
409 HG2 GLU 602 HG2 GLU 602 -4.397 -0.505 -3.568
410 HG3 GLU 602 HG3 GLU 602 -5.214 -1.706 -4.565
411 H THR 603 HN THR 603 -6.377 -1.247 -1.847
412 HA THR 603 HA THR 603 -7.840 -3.506 -2.947
413 HB THR 603 HB THR 603 -5.563 -3.828 -1.994
414 HG1 THR 603 HG1 THR 603 -7.812 -5.239 -1.032
415 HG21 THR 603 HG21 THR 603 -5.309 -3.944 0.446
416 HG22 THR 603 HG22 THR 603 -6.955 -3.339 0.643
417 HG23 THR 603 HG23 THR 603 -5.718 -2.311 -0.081
Start of MODEL 7
1 H GLY 548 HN GLY 548 3.000 9.513 0.704
2 HA2 GLY 548 HA2 GLY 548 4.784 9.329 -0.795
3 HA3 GLY 548 HA3 GLY 548 5.308 10.947 -0.334
4 H LYS 549 HN LYS 549 4.561 8.997 2.286
5 HA LYS 549 HA LYS 549 7.260 8.960 3.185
6 HB2 LYS 549 HB2 LYS 549 4.704 7.859 4.349
7 HB3 LYS 549 HB3 LYS 549 6.269 7.664 5.135
8 HG2 LYS 549 HG2 LYS 549 5.079 10.323 4.381
9 HG3 LYS 549 HG3 LYS 549 4.940 9.588 5.982
10 HD2 LYS 549 HD2 LYS 549 7.272 9.694 6.336
11 HD3 LYS 549 HD3 LYS 549 7.585 10.051 4.636
12 HE2 LYS 549 HE2 LYS 549 6.059 11.878 6.483
13 HE3 LYS 549 HE3 LYS 549 7.792 12.008 6.197
14 HZ1 LYS 549 HZ1 LYS 549 6.775 13.535 4.748
15 HZ2 LYS 549 HZ2 LYS 549 5.589 12.437 4.265
16 HZ3 LYS 549 HZ3 LYS 549 7.195 12.219 3.759
17 H TYR 550 HN TYR 550 8.530 7.221 3.655
18 HA TYR 550 HA TYR 550 7.955 4.795 2.098
19 HB2 TYR 550 HB2 TYR 550 10.183 4.748 1.290
20 HB3 TYR 550 HB3 TYR 550 9.615 6.397 1.049
21 HD1 TYR 550 HD1 TYR 550 12.006 4.268 2.759
22 HD2 TYR 550 HD2 TYR 550 10.463 8.226 2.534
23 HE1 TYR 550 HE1 TYR 550 13.953 5.085 4.016
24 HE2 TYR 550 HE2 TYR 550 12.408 9.055 3.794
25 HH TYR 550 HH TYR 550 14.091 8.125 5.421
26 H VAL 551 HN VAL 551 9.187 2.917 2.833
27 HA VAL 551 HA VAL 551 9.906 3.088 5.691
28 HB VAL 551 HB VAL 551 8.818 0.702 4.175
29 HG11 VAL 551 HG11 VAL 551 9.531 0.986 7.094
30 HG12 VAL 551 HG12 VAL 551 10.394 0.021 5.897
31 HG13 VAL 551 HG13 VAL 551 8.749 -0.413 6.360
32 HG21 VAL 551 HG21 VAL 551 6.835 0.941 5.581
33 HG22 VAL 551 HG22 VAL 551 7.106 2.384 4.602
34 HG23 VAL 551 HG23 VAL 551 7.526 2.389 6.316
35 H VAL 552 HN VAL 552 11.894 2.422 6.240
36 HA VAL 552 HA VAL 552 13.888 2.095 4.286
37 HB VAL 552 HB VAL 552 14.016 1.356 7.222
38 HG11 VAL 552 HG11 VAL 552 16.431 1.688 6.967
39 HG12 VAL 552 HG12 VAL 552 16.208 1.973 5.241
40 HG13 VAL 552 HG13 VAL 552 15.838 0.392 5.929
41 HG21 VAL 552 HG21 VAL 552 13.323 3.687 6.870
42 HG22 VAL 552 HG22 VAL 552 14.755 3.953 5.874
43 HG23 VAL 552 HG23 VAL 552 14.928 3.575 7.588
44 H VAL 553 HN VAL 553 14.736 0.327 3.353
45 HA VAL 553 HA VAL 553 13.211 -2.018 3.232
46 HB VAL 553 HB VAL 553 16.080 -1.615 2.374
47 HG11 VAL 553 HG11 VAL 553 14.072 -3.718 1.578
48 HG12 VAL 553 HG12 VAL 553 15.524 -3.971 2.544
49 HG13 VAL 553 HG13 VAL 553 15.662 -3.498 0.850
50 HG21 VAL 553 HG21 VAL 553 15.133 -1.212 0.152
51 HG22 VAL 553 HG22 VAL 553 14.576 -0.017 1.325
52 HG23 VAL 553 HG23 VAL 553 13.508 -1.331 0.825
53 HA PRO 554 HA PRO 554 14.752 -4.124 6.864
54 HB2 PRO 554 HB2 PRO 554 13.061 -6.304 5.893
55 HB3 PRO 554 HB3 PRO 554 12.926 -5.368 7.382
56 HG2 PRO 554 HG2 PRO 554 11.161 -5.141 5.338
57 HG3 PRO 554 HG3 PRO 554 11.554 -3.799 6.425
58 HD2 PRO 554 HD2 PRO 554 12.501 -4.315 3.635
59 HD3 PRO 554 HD3 PRO 554 12.089 -2.780 4.426
60 H GLU 555 HN GLU 555 16.404 -5.492 7.116
61 HA GLU 555 HA GLU 555 17.734 -6.600 4.832
62 HB2 GLU 555 HB2 GLU 555 18.249 -7.155 7.763
63 HB3 GLU 555 HB3 GLU 555 19.357 -7.455 6.433
64 HG2 GLU 555 HG2 GLU 555 19.599 -5.081 6.053
65 HG3 GLU 555 HG3 GLU 555 18.396 -4.731 7.295
66 H THR 556 HN THR 556 15.660 -7.821 7.355
67 HA THR 556 HA THR 556 16.096 -10.572 6.517
68 HB THR 556 HB THR 556 14.624 -11.088 8.521
69 HG1 THR 556 HG1 THR 556 13.597 -9.124 8.843
70 HG21 THR 556 HG21 THR 556 17.156 -9.517 9.041
71 HG22 THR 556 HG22 THR 556 17.081 -11.225 8.612
72 HG23 THR 556 HG23 THR 556 16.408 -10.673 10.144
73 H SER 557 HN SER 557 15.020 -10.421 4.480
74 HA SER 557 HA SER 557 12.252 -11.156 4.726
75 HB2 SER 557 HB2 SER 557 12.093 -8.688 4.566
76 HB3 SER 557 HB3 SER 557 12.981 -8.736 3.048
77 HG SER 557 HG SER 557 10.351 -9.372 3.595
78 H GLN 558 HN GLN 558 13.226 -9.884 1.690
79 HA GLN 558 HA GLN 558 14.260 -12.503 0.835
80 HB2 GLN 558 HB2 GLN 558 12.470 -10.638 -0.744
81 HB3 GLN 558 HB3 GLN 558 13.252 -12.066 -1.402
82 HG2 GLN 558 HG2 GLN 558 12.009 -13.410 0.316
83 HG3 GLN 558 HG3 GLN 558 11.097 -11.948 0.683
84 HE21 GLN 558 HE21 GLN 558 10.227 -14.522 -0.392
85 HE22 GLN 558 HE22 GLN 558 9.427 -14.161 -1.883
86 H ASP 559 HN ASP 559 14.436 -10.991 -1.883
87 HA ASP 559 HA ASP 559 17.164 -10.141 -1.583
88 HB2 ASP 559 HB2 ASP 559 15.398 -9.659 -3.987
89 HB3 ASP 559 HB3 ASP 559 17.147 -9.834 -3.947
90 H MET 560 HN MET 560 15.829 -8.578 0.140
91 HA MET 560 HA MET 560 15.166 -6.497 0.768
92 HB2 MET 560 HB2 MET 560 16.878 -5.747 -1.606
93 HB3 MET 560 HB3 MET 560 16.159 -4.559 -0.529
94 HG2 MET 560 HG2 MET 560 17.378 -5.529 1.355
95 HG3 MET 560 HG3 MET 560 18.111 -6.708 0.267
96 HE1 MET 560 HE1 MET 560 19.738 -4.724 2.230
97 HE2 MET 560 HE2 MET 560 21.071 -4.271 1.169
98 HE3 MET 560 HE3 MET 560 20.500 -5.939 1.204
99 H ALA 561 HN ALA 561 13.485 -8.045 -0.950
100 HA ALA 561 HA ALA 561 11.807 -5.942 -2.062
101 HB1 ALA 561 HB1 ALA 561 13.235 -6.678 -3.917
102 HB2 ALA 561 HB2 ALA 561 11.544 -7.103 -4.186
103 HB3 ALA 561 HB3 ALA 561 12.693 -8.341 -3.671
104 H PHE 562 HN PHE 562 9.643 -6.690 -2.540
105 HA PHE 562 HA PHE 562 8.877 -9.365 -1.712
106 HB2 PHE 562 HB2 PHE 562 7.225 -8.716 -0.112
107 HB3 PHE 562 HB3 PHE 562 8.704 -7.894 0.363
108 HD1 PHE 562 HD1 PHE 562 5.302 -7.522 -0.821
109 HD2 PHE 562 HD2 PHE 562 8.918 -5.455 0.043
110 HE1 PHE 562 HE1 PHE 562 4.073 -5.397 -0.810
111 HE2 PHE 562 HE2 PHE 562 7.692 -3.320 0.062
112 HZ PHE 562 HZ PHE 562 5.261 -3.290 -0.364
113 H LYS 563 HN LYS 563 6.509 -9.737 -2.393
114 HA LYS 563 HA LYS 563 6.013 -8.019 -4.727
115 HB2 LYS 563 HB2 LYS 563 6.378 -10.487 -5.140
116 HB3 LYS 563 HB3 LYS 563 4.867 -10.782 -4.286
117 HG2 LYS 563 HG2 LYS 563 4.029 -8.938 -6.048
118 HG3 LYS 563 HG3 LYS 563 5.339 -9.660 -6.976
119 HD2 LYS 563 HD2 LYS 563 2.888 -11.000 -5.868
120 HD3 LYS 563 HD3 LYS 563 3.361 -10.801 -7.555
121 HE2 LYS 563 HE2 LYS 563 4.983 -12.388 -5.590
122 HE3 LYS 563 HE3 LYS 563 3.682 -13.101 -6.541
123 HZ1 LYS 563 HZ1 LYS 563 6.102 -11.770 -7.649
124 HZ2 LYS 563 HZ2 LYS 563 4.848 -12.476 -8.550
125 HZ3 LYS 563 HZ3 LYS 563 5.832 -13.443 -7.568
126 H CYS 564 HN CYS 564 4.306 -6.777 -4.780
127 HA CYS 564 HA CYS 564 2.624 -6.443 -2.501
128 HB2 CYS 564 HB2 CYS 564 3.381 -4.611 -3.983
129 HB3 CYS 564 HB3 CYS 564 2.464 -5.305 -5.308
130 HA PRO 565 HA PRO 565 -0.046 -9.793 -3.836
131 HB2 PRO 565 HB2 PRO 565 -1.583 -9.135 -1.415
132 HB3 PRO 565 HB3 PRO 565 -0.736 -10.627 -1.835
133 HG2 PRO 565 HG2 PRO 565 0.185 -8.990 0.078
134 HG3 PRO 565 HG3 PRO 565 1.291 -9.859 -1.004
135 HD2 PRO 565 HD2 PRO 565 0.370 -7.004 -1.137
136 HD3 PRO 565 HD3 PRO 565 2.009 -7.664 -1.336
137 H ILE 566 HN ILE 566 -1.212 -6.612 -2.929
138 HA ILE 566 HA ILE 566 -3.939 -7.128 -3.497
139 HB ILE 566 HB ILE 566 -2.574 -4.434 -3.344
140 HG12 ILE 566 HG12 ILE 566 -3.793 -6.137 -1.154
141 HG13 ILE 566 HG13 ILE 566 -2.089 -5.730 -1.320
142 HG21 ILE 566 HG21 ILE 566 -4.819 -4.290 -4.262
143 HG22 ILE 566 HG22 ILE 566 -4.813 -3.657 -2.611
144 HG23 ILE 566 HG23 ILE 566 -5.443 -5.270 -2.935
145 HD11 ILE 566 HD11 ILE 566 -4.327 -3.792 -0.784
146 HD12 ILE 566 HD12 ILE 566 -2.618 -3.379 -0.932
147 HD13 ILE 566 HD13 ILE 566 -3.171 -4.397 0.401
148 H CYS 567 HN CYS 567 -1.251 -5.930 -5.420
149 HA CYS 567 HA CYS 567 -3.075 -5.754 -7.705
150 HB2 CYS 567 HB2 CYS 567 -1.885 -3.778 -8.531
151 HB3 CYS 567 HB3 CYS 567 -2.629 -3.489 -6.959
152 H LYS 568 HN LYS 568 -0.520 -7.401 -6.541
153 HA LYS 568 HA LYS 568 0.813 -8.983 -7.502
154 HB2 LYS 568 HB2 LYS 568 -0.400 -8.066 -10.107
155 HB3 LYS 568 HB3 LYS 568 0.605 -9.487 -9.903
156 HG2 LYS 568 HG2 LYS 568 -1.920 -9.192 -8.339
157 HG3 LYS 568 HG3 LYS 568 -1.962 -9.740 -10.013
158 HD2 LYS 568 HD2 LYS 568 -0.425 -11.569 -9.438
159 HD3 LYS 568 HD3 LYS 568 -0.433 -11.031 -7.755
160 HE2 LYS 568 HE2 LYS 568 -2.741 -11.545 -7.515
161 HE3 LYS 568 HE3 LYS 568 -2.939 -11.781 -9.250
162 HZ1 LYS 568 HZ1 LYS 568 -2.833 -13.867 -7.935
163 HZ2 LYS 568 HZ2 LYS 568 -1.224 -13.499 -7.536
164 HZ3 LYS 568 HZ3 LYS 568 -1.656 -13.766 -9.152
165 H GLU 569 HN GLU 569 1.771 -6.169 -7.154
166 HA GLU 569 HA GLU 569 3.699 -5.873 -9.339
167 HB2 GLU 569 HB2 GLU 569 3.306 -4.303 -6.787
168 HB3 GLU 569 HB3 GLU 569 4.541 -3.945 -7.977
169 HG2 GLU 569 HG2 GLU 569 2.868 -3.355 -9.600
170 HG3 GLU 569 HG3 GLU 569 1.582 -3.845 -8.488
171 H THR 570 HN THR 570 5.703 -6.851 -9.218
172 HA THR 570 HA THR 570 6.820 -7.723 -6.745
173 HB THR 570 HB THR 570 8.259 -7.170 -9.359
174 HG1 THR 570 HG1 THR 570 7.156 -8.862 -10.007
175 HG21 THR 570 HG21 THR 570 9.931 -8.732 -8.508
176 HG22 THR 570 HG22 THR 570 9.012 -8.927 -7.016
177 HG23 THR 570 HG23 THR 570 9.742 -7.370 -7.401
178 H VAL 571 HN VAL 571 7.674 -6.431 -5.207
179 HA VAL 571 HA VAL 571 8.126 -3.614 -5.903
180 HB VAL 571 HB VAL 571 7.824 -4.795 -3.139
181 HG11 VAL 571 HG11 VAL 571 8.896 -2.627 -3.160
182 HG12 VAL 571 HG12 VAL 571 7.259 -2.479 -2.511
183 HG13 VAL 571 HG13 VAL 571 7.603 -1.969 -4.166
184 HG21 VAL 571 HG21 VAL 571 5.815 -5.262 -4.449
185 HG22 VAL 571 HG22 VAL 571 5.694 -3.555 -4.875
186 HG23 VAL 571 HG23 VAL 571 5.502 -4.057 -3.197
187 H THR 572 HN THR 572 10.151 -3.032 -6.200
188 HA THR 572 HA THR 572 12.277 -4.300 -4.615
189 HB THR 572 HB THR 572 13.816 -3.353 -6.373
190 HG1 THR 572 HG1 THR 572 12.060 -1.841 -7.111
191 HG21 THR 572 HG21 THR 572 13.295 -5.065 -8.059
192 HG22 THR 572 HG22 THR 572 11.698 -5.283 -7.342
193 HG23 THR 572 HG23 THR 572 13.142 -5.705 -6.421
194 H GLY 573 HN GLY 573 14.064 -2.809 -3.909
195 HA2 GLY 573 HA2 GLY 573 13.033 -0.069 -3.529
196 HA3 GLY 573 HA3 GLY 573 13.709 -0.987 -2.187
197 H VAL 574 HN VAL 574 14.642 1.515 -3.054
198 HA VAL 574 HA VAL 574 17.209 0.847 -4.351
199 HB VAL 574 HB VAL 574 15.720 3.467 -4.573
200 HG11 VAL 574 HG11 VAL 574 18.094 2.426 -6.111
201 HG12 VAL 574 HG12 VAL 574 18.140 3.659 -4.851
202 HG13 VAL 574 HG13 VAL 574 17.288 3.976 -6.362
203 HG21 VAL 574 HG21 VAL 574 15.190 2.818 -6.877
204 HG22 VAL 574 HG22 VAL 574 14.443 1.737 -5.698
205 HG23 VAL 574 HG23 VAL 574 15.883 1.224 -6.579
206 H TYR 575 HN TYR 575 19.050 1.918 -3.585
207 HA TYR 575 HA TYR 575 18.842 2.867 -0.861
208 HB2 TYR 575 HB2 TYR 575 20.695 1.394 -1.485
209 HB3 TYR 575 HB3 TYR 575 21.241 2.563 -2.682
210 HD1 TYR 575 HD1 TYR 575 22.988 3.928 -2.098
211 HD2 TYR 575 HD2 TYR 575 20.453 2.435 0.966
212 HE1 TYR 575 HE1 TYR 575 24.397 5.026 -0.405
213 HE2 TYR 575 HE2 TYR 575 21.852 3.518 2.670
214 HH TYR 575 HH TYR 575 24.247 5.824 1.888
215 H ASP 576 HN ASP 576 18.475 4.917 -0.378
216 HA ASP 576 HA ASP 576 19.019 6.973 -2.387
217 HB2 ASP 576 HB2 ASP 576 16.792 7.063 -1.415
218 HB3 ASP 576 HB3 ASP 576 17.472 7.113 0.211
219 H GLU 577 HN GLU 577 20.890 7.981 -2.304
220 HA GLU 577 HA GLU 577 22.723 7.556 -0.186
221 HB2 GLU 577 HB2 GLU 577 22.909 9.525 -2.469
222 HB3 GLU 577 HB3 GLU 577 24.242 8.935 -1.485
223 HG2 GLU 577 HG2 GLU 577 23.714 6.629 -2.316
224 HG3 GLU 577 HG3 GLU 577 22.576 7.371 -3.440
225 H GLU 578 HN GLU 578 20.383 10.032 -0.773
226 HA GLU 578 HA GLU 578 21.728 12.087 0.705
227 HB2 GLU 578 HB2 GLU 578 18.811 11.878 -0.062
228 HB3 GLU 578 HB3 GLU 578 19.633 13.328 0.502
229 HG2 GLU 578 HG2 GLU 578 21.128 13.148 -1.499
230 HG3 GLU 578 HG3 GLU 578 20.084 11.857 -2.088
231 H SER 579 HN SER 579 19.120 9.793 1.397
232 HA SER 579 HA SER 579 19.028 10.612 4.175
233 HB2 SER 579 HB2 SER 579 17.334 8.805 4.390
234 HB3 SER 579 HB3 SER 579 16.941 9.964 3.120
235 HG SER 579 HG SER 579 17.516 8.501 1.588
236 H GLY 580 HN GLY 580 20.568 8.202 2.245
237 HA2 GLY 580 HA2 GLY 580 22.384 6.878 2.804
238 HA3 GLY 580 HA3 GLY 580 22.220 7.408 4.473
239 H GLU 581 HN GLU 581 19.363 6.245 3.021
240 HA GLU 581 HA GLU 581 19.729 3.595 4.247
241 HB2 GLU 581 HB2 GLU 581 17.421 5.504 4.604
242 HB3 GLU 581 HB3 GLU 581 17.273 3.784 4.933
243 HG2 GLU 581 HG2 GLU 581 19.282 5.589 6.259
244 HG3 GLU 581 HG3 GLU 581 17.699 5.205 6.931
245 H TRP 582 HN TRP 582 18.227 1.979 3.431
246 HA TRP 582 HA TRP 582 17.679 2.284 0.605
247 HB2 TRP 582 HB2 TRP 582 17.235 -0.016 2.518
248 HB3 TRP 582 HB3 TRP 582 16.852 -0.086 0.798
249 HD1 TRP 582 HD1 TRP 582 19.892 0.228 3.155
250 HE1 TRP 582 HE1 TRP 582 21.977 -0.618 1.899
251 HE3 TRP 582 HE3 TRP 582 17.785 -0.557 -1.421
252 HZ2 TRP 582 HZ2 TRP 582 22.628 -1.503 -0.708
253 HZ3 TRP 582 HZ3 TRP 582 19.192 -1.398 -3.247
254 HH2 TRP 582 HH2 TRP 582 21.572 -1.864 -2.896
255 H VAL 583 HN VAL 583 15.680 2.533 -0.311
256 HA VAL 583 HA VAL 583 13.559 3.158 1.642
257 HB VAL 583 HB VAL 583 12.731 4.841 0.117
258 HG11 VAL 583 HG11 VAL 583 15.719 5.078 0.468
259 HG12 VAL 583 HG12 VAL 583 14.495 5.536 1.651
260 HG13 VAL 583 HG13 VAL 583 14.619 6.409 0.124
261 HG21 VAL 583 HG21 VAL 583 13.268 3.698 -1.984
262 HG22 VAL 583 HG22 VAL 583 14.978 4.045 -1.729
263 HG23 VAL 583 HG23 VAL 583 13.838 5.369 -1.984
264 H TRP 584 HN TRP 584 11.717 2.051 1.566
265 HA TRP 584 HA TRP 584 10.753 1.118 -1.056
266 HB2 TRP 584 HB2 TRP 584 9.984 0.378 1.769
267 HB3 TRP 584 HB3 TRP 584 8.902 0.058 0.420
268 HD1 TRP 584 HD1 TRP 584 11.988 -0.574 -1.179
269 HE1 TRP 584 HE1 TRP 584 12.708 -3.024 -1.050
270 HE3 TRP 584 HE3 TRP 584 8.949 -2.079 2.626
271 HZ2 TRP 584 HZ2 TRP 584 12.068 -5.324 0.486
272 HZ3 TRP 584 HZ3 TRP 584 9.061 -4.422 3.379
273 HH2 TRP 584 HH2 TRP 584 10.592 -6.008 2.326
274 H LYS 585 HN LYS 585 9.813 2.846 -2.007
275 HA LYS 585 HA LYS 585 8.643 4.948 -0.458
276 HB2 LYS 585 HB2 LYS 585 8.416 6.163 -2.461
277 HB3 LYS 585 HB3 LYS 585 9.899 5.246 -2.656
278 HG2 LYS 585 HG2 LYS 585 7.254 4.364 -3.778
279 HG3 LYS 585 HG3 LYS 585 8.407 5.356 -4.670
280 HD2 LYS 585 HD2 LYS 585 9.018 2.630 -3.522
281 HD3 LYS 585 HD3 LYS 585 8.546 2.925 -5.194
282 HE2 LYS 585 HE2 LYS 585 10.977 4.082 -3.832
283 HE3 LYS 585 HE3 LYS 585 10.979 2.711 -4.943
284 HZ1 LYS 585 HZ1 LYS 585 11.583 4.681 -6.135
285 HZ2 LYS 585 HZ2 LYS 585 10.219 5.513 -5.574
286 HZ3 LYS 585 HZ3 LYS 585 10.035 4.207 -6.648
287 H ASN 586 HN ASN 586 6.528 5.609 -0.373
288 HA ASN 586 HA ASN 586 4.316 5.275 -0.000
289 HB2 ASN 586 HB2 ASN 586 4.325 4.017 -2.753
290 HB3 ASN 586 HB3 ASN 586 2.979 4.797 -1.944
291 HD21 ASN 586 HD21 ASN 586 4.247 5.357 -4.514
292 HD22 ASN 586 HD22 ASN 586 4.733 7.018 -4.458
293 H THR 587 HN THR 587 5.641 3.442 1.328
294 HA THR 587 HA THR 587 4.116 0.957 0.899
295 HB THR 587 HB THR 587 6.975 1.139 1.891
296 HG1 THR 587 HG1 THR 587 6.478 1.505 -0.468
297 HG21 THR 587 HG21 THR 587 5.706 -0.746 2.836
298 HG22 THR 587 HG22 THR 587 6.971 -1.291 1.735
299 HG23 THR 587 HG23 THR 587 5.289 -1.272 1.205
300 H ILE 588 HN ILE 588 3.293 -0.007 2.747
301 HA ILE 588 HA ILE 588 3.908 1.210 5.346
302 HB ILE 588 HB ILE 588 1.884 2.356 4.493
303 HG12 ILE 588 HG12 ILE 588 1.305 0.453 6.773
304 HG13 ILE 588 HG13 ILE 588 2.154 1.989 6.917
305 HG21 ILE 588 HG21 ILE 588 -0.207 1.109 4.215
306 HG22 ILE 588 HG22 ILE 588 0.675 -0.402 4.438
307 HG23 ILE 588 HG23 ILE 588 1.020 0.625 3.046
308 HD11 ILE 588 HD11 ILE 588 -0.720 1.602 6.111
309 HD12 ILE 588 HD12 ILE 588 0.123 3.150 6.195
310 HD13 ILE 588 HD13 ILE 588 -0.128 2.204 7.662
311 H GLU 589 HN GLU 589 3.594 -0.211 7.099
312 HA GLU 589 HA GLU 589 3.280 -3.019 6.306
313 HB2 GLU 589 HB2 GLU 589 5.415 -2.439 7.396
314 HB3 GLU 589 HB3 GLU 589 4.545 -1.844 8.802
315 HG2 GLU 589 HG2 GLU 589 4.143 -4.673 7.919
316 HG3 GLU 589 HG3 GLU 589 5.611 -4.229 8.794
317 H VAL 590 HN VAL 590 1.477 -3.999 6.790
318 HA VAL 590 HA VAL 590 -0.046 -3.205 9.168
319 HB VAL 590 HB VAL 590 -1.261 -3.761 6.449
320 HG11 VAL 590 HG11 VAL 590 -2.630 -4.606 8.281
321 HG12 VAL 590 HG12 VAL 590 -3.394 -3.230 7.487
322 HG13 VAL 590 HG13 VAL 590 -2.596 -3.016 9.045
323 HG21 VAL 590 HG21 VAL 590 -1.122 -1.188 8.014
324 HG22 VAL 590 HG22 VAL 590 -1.994 -1.430 6.501
325 HG23 VAL 590 HG23 VAL 590 -0.237 -1.559 6.535
326 H ASN 591 HN ASN 591 -0.602 -4.921 10.362
327 HA ASN 591 HA ASN 591 -0.880 -7.052 11.090
328 HB2 ASN 591 HB2 ASN 591 -2.696 -6.963 9.363
329 HB3 ASN 591 HB3 ASN 591 -1.576 -7.662 8.200
330 HD21 ASN 591 HD21 ASN 591 -1.772 -8.583 11.599
331 HD22 ASN 591 HD22 ASN 591 -2.355 -10.185 11.301
332 H GLY 592 HN GLY 592 1.750 -6.184 10.203
333 HA2 GLY 592 HA2 GLY 592 3.820 -7.208 10.268
334 HA3 GLY 592 HA3 GLY 592 3.017 -8.769 10.241
335 H LYS 593 HN LYS 593 1.968 -6.706 7.769
336 HA LYS 593 HA LYS 593 3.814 -7.979 5.868
337 HB2 LYS 593 HB2 LYS 593 0.854 -7.505 5.467
338 HB3 LYS 593 HB3 LYS 593 1.954 -8.206 4.290
339 HG2 LYS 593 HG2 LYS 593 1.306 -9.417 6.968
340 HG3 LYS 593 HG3 LYS 593 0.548 -9.875 5.440
341 HD2 LYS 593 HD2 LYS 593 2.667 -10.625 4.567
342 HD3 LYS 593 HD3 LYS 593 3.511 -10.025 5.997
343 HE2 LYS 593 HE2 LYS 593 3.213 -12.429 6.122
344 HE3 LYS 593 HE3 LYS 593 2.291 -11.615 7.385
345 HZ1 LYS 593 HZ1 LYS 593 1.225 -12.737 4.848
346 HZ2 LYS 593 HZ2 LYS 593 0.309 -11.836 5.954
347 HZ3 LYS 593 HZ3 LYS 593 0.960 -13.329 6.416
348 H TYR 594 HN TYR 594 4.572 -6.719 4.258
349 HA TYR 594 HA TYR 594 3.997 -3.880 4.449
350 HB2 TYR 594 HB2 TYR 594 6.074 -5.424 2.888
351 HB3 TYR 594 HB3 TYR 594 5.876 -3.677 2.785
352 HD1 TYR 594 HD1 TYR 594 6.475 -2.241 4.650
353 HD2 TYR 594 HD2 TYR 594 7.037 -6.443 4.873
354 HE1 TYR 594 HE1 TYR 594 7.940 -1.931 6.600
355 HE2 TYR 594 HE2 TYR 594 8.503 -6.156 6.825
356 HH TYR 594 HH TYR 594 8.719 -3.263 8.554
357 H PHE 595 HN PHE 595 2.795 -2.794 3.065
358 HA PHE 595 HA PHE 595 2.248 -3.923 0.405
359 HB2 PHE 595 HB2 PHE 595 0.180 -2.546 2.154
360 HB3 PHE 595 HB3 PHE 595 -0.080 -3.159 0.530
361 HD1 PHE 595 HD1 PHE 595 -0.172 -5.606 0.140
362 HD2 PHE 595 HD2 PHE 595 0.066 -3.938 4.047
363 HE1 PHE 595 HE1 PHE 595 -0.948 -7.737 1.093
364 HE2 PHE 595 HE2 PHE 595 -0.695 -6.067 5.003
365 HZ PHE 595 HZ PHE 595 -1.204 -7.972 3.528
366 H HIS 596 HN HIS 596 1.908 -2.310 -1.211
367 HA HIS 596 HA HIS 596 3.063 0.226 -0.808
368 HB2 HIS 596 HB2 HIS 596 1.112 -0.765 -2.901
369 HB3 HIS 596 HB3 HIS 596 1.737 0.879 -2.902
370 HD2 HIS 596 HD2 HIS 596 4.882 0.201 -2.348
371 HE1 HIS 596 HE1 HIS 596 4.476 -2.099 -5.874
372 HE2 HIS 596 HE2 HIS 596 6.092 -0.820 -4.394
373 H SER 597 HN SER 597 2.291 2.004 0.094
374 HA SER 597 HA SER 597 -0.062 1.943 1.644
375 HB2 SER 597 HB2 SER 597 1.939 3.314 2.186
376 HB3 SER 597 HB3 SER 597 1.589 4.347 0.804
377 HG SER 597 HG SER 597 0.262 4.128 3.257
378 H THR 598 HN THR 598 0.654 3.097 -1.560
379 HA THR 598 HA THR 598 -1.732 4.518 -2.006
380 HB THR 598 HB THR 598 0.030 4.943 -3.516
381 HG1 THR 598 HG1 THR 598 -2.160 4.703 -4.460
382 HG21 THR 598 HG21 THR 598 1.030 3.223 -4.971
383 HG22 THR 598 HG22 THR 598 0.077 1.989 -4.144
384 HG23 THR 598 HG23 THR 598 1.305 2.896 -3.260
385 H CYS 599 HN CYS 599 -0.830 1.141 -2.448
386 HA CYS 599 HA CYS 599 -3.263 0.385 -3.756
387 HB2 CYS 599 HB2 CYS 599 -1.115 -1.324 -2.485
388 HB3 CYS 599 HB3 CYS 599 -2.402 -1.909 -3.529
389 H TYR 600 HN TYR 600 -2.115 0.486 -0.476
390 HA TYR 600 HA TYR 600 -3.679 -1.488 0.706
391 HB2 TYR 600 HB2 TYR 600 -1.845 -0.547 1.919
392 HB3 TYR 600 HB3 TYR 600 -2.530 1.070 1.825
393 HD1 TYR 600 HD1 TYR 600 -3.805 1.885 3.572
394 HD2 TYR 600 HD2 TYR 600 -3.217 -2.308 3.241
395 HE1 TYR 600 HE1 TYR 600 -4.901 1.572 5.749
396 HE2 TYR 600 HE2 TYR 600 -4.312 -2.645 5.419
397 HH TYR 600 HH TYR 600 -4.764 -1.341 7.469
398 H HIS 601 HN HIS 601 -4.522 1.760 -0.209
399 HA HIS 601 HA HIS 601 -6.632 2.226 1.544
400 HB2 HIS 601 HB2 HIS 601 -6.124 3.312 -1.223
401 HB3 HIS 601 HB3 HIS 601 -7.373 3.928 -0.140
402 HD2 HIS 601 HD2 HIS 601 -5.507 3.919 2.592
403 HE1 HIS 601 HE1 HIS 601 -3.149 6.627 0.365
404 HE2 HIS 601 HE2 HIS 601 -3.564 5.627 2.651
405 H GLU 602 HN GLU 602 -6.589 0.238 -1.340
406 HA GLU 602 HA GLU 602 -9.347 0.357 -1.910
407 HB2 GLU 602 HB2 GLU 602 -9.042 -1.669 -3.222
408 HB3 GLU 602 HB3 GLU 602 -7.726 -0.547 -3.514
409 HG2 GLU 602 HG2 GLU 602 -6.682 -2.619 -3.404
410 HG3 GLU 602 HG3 GLU 602 -6.412 -1.928 -1.810
411 H THR 603 HN THR 603 -7.541 -1.390 0.486
412 HA THR 603 HA THR 603 -9.585 -3.315 1.044
413 HB THR 603 HB THR 603 -6.907 -2.638 2.110
414 HG1 THR 603 HG1 THR 603 -7.457 -4.337 0.553
415 HG21 THR 603 HG21 THR 603 -7.156 -4.052 4.095
416 HG22 THR 603 HG22 THR 603 -8.881 -4.216 3.774
417 HG23 THR 603 HG23 THR 603 -8.208 -2.643 4.195
Start of MODEL 8
1 H GLY 548 HN GLY 548 3.051 8.918 1.664
2 HA2 GLY 548 HA2 GLY 548 5.059 9.648 0.648
3 HA3 GLY 548 HA3 GLY 548 5.024 11.079 1.662
4 H LYS 549 HN LYS 549 4.387 8.388 3.554
5 HA LYS 549 HA LYS 549 7.034 8.478 4.690
6 HB2 LYS 549 HB2 LYS 549 4.597 6.846 5.412
7 HB3 LYS 549 HB3 LYS 549 6.125 6.755 6.279
8 HG2 LYS 549 HG2 LYS 549 5.902 9.231 6.699
9 HG3 LYS 549 HG3 LYS 549 4.259 9.104 6.067
10 HD2 LYS 549 HD2 LYS 549 4.132 8.942 8.444
11 HD3 LYS 549 HD3 LYS 549 3.830 7.332 7.788
12 HE2 LYS 549 HE2 LYS 549 5.304 7.168 9.698
13 HE3 LYS 549 HE3 LYS 549 6.179 6.736 8.229
14 HZ1 LYS 549 HZ1 LYS 549 7.447 8.197 9.750
15 HZ2 LYS 549 HZ2 LYS 549 6.291 9.414 9.513
16 HZ3 LYS 549 HZ3 LYS 549 7.231 8.873 8.211
17 H TYR 550 HN TYR 550 8.572 6.917 4.652
18 HA TYR 550 HA TYR 550 8.096 4.587 2.907
19 HB2 TYR 550 HB2 TYR 550 10.350 4.652 2.198
20 HB3 TYR 550 HB3 TYR 550 9.816 6.322 2.136
21 HD1 TYR 550 HD1 TYR 550 12.068 3.949 3.738
22 HD2 TYR 550 HD2 TYR 550 10.610 7.946 3.803
23 HE1 TYR 550 HE1 TYR 550 13.958 4.616 5.161
24 HE2 TYR 550 HE2 TYR 550 12.490 8.629 5.229
25 HH TYR 550 HH TYR 550 15.209 6.628 5.741
26 H VAL 551 HN VAL 551 9.283 2.647 3.544
27 HA VAL 551 HA VAL 551 9.882 2.565 6.438
28 HB VAL 551 HB VAL 551 8.816 0.275 4.764
29 HG11 VAL 551 HG11 VAL 551 9.178 0.544 7.747
30 HG12 VAL 551 HG12 VAL 551 10.195 -0.408 6.664
31 HG13 VAL 551 HG13 VAL 551 8.505 -0.851 6.903
32 HG21 VAL 551 HG21 VAL 551 7.346 2.000 6.759
33 HG22 VAL 551 HG22 VAL 551 6.696 0.576 5.942
34 HG23 VAL 551 HG23 VAL 551 7.115 2.014 5.010
35 H VAL 552 HN VAL 552 11.831 1.643 7.015
36 HA VAL 552 HA VAL 552 13.831 1.433 5.016
37 HB VAL 552 HB VAL 552 13.937 0.500 7.894
38 HG11 VAL 552 HG11 VAL 552 15.689 -0.524 6.539
39 HG12 VAL 552 HG12 VAL 552 16.372 0.666 7.648
40 HG13 VAL 552 HG13 VAL 552 16.172 1.065 5.942
41 HG21 VAL 552 HG21 VAL 552 15.030 2.639 8.340
42 HG22 VAL 552 HG22 VAL 552 13.406 2.877 7.692
43 HG23 VAL 552 HG23 VAL 552 14.810 3.108 6.653
44 H VAL 553 HN VAL 553 14.647 -0.283 3.953
45 HA VAL 553 HA VAL 553 13.073 -2.591 3.663
46 HB VAL 553 HB VAL 553 15.944 -2.171 2.819
47 HG11 VAL 553 HG11 VAL 553 15.319 -4.542 2.862
48 HG12 VAL 553 HG12 VAL 553 15.565 -3.959 1.217
49 HG13 VAL 553 HG13 VAL 553 13.930 -4.189 1.835
50 HG21 VAL 553 HG21 VAL 553 14.425 -0.502 1.891
51 HG22 VAL 553 HG22 VAL 553 13.372 -1.785 1.295
52 HG23 VAL 553 HG23 VAL 553 14.999 -1.607 0.639
53 HA PRO 554 HA PRO 554 14.524 -4.871 7.198
54 HB2 PRO 554 HB2 PRO 554 12.962 -7.080 6.131
55 HB3 PRO 554 HB3 PRO 554 12.695 -6.137 7.596
56 HG2 PRO 554 HG2 PRO 554 11.102 -6.011 5.369
57 HG3 PRO 554 HG3 PRO 554 11.254 -4.716 6.564
58 HD2 PRO 554 HD2 PRO 554 12.427 -4.928 3.836
59 HD3 PRO 554 HD3 PRO 554 11.932 -3.492 4.751
60 H GLU 555 HN GLU 555 16.252 -6.160 7.459
61 HA GLU 555 HA GLU 555 17.369 -7.523 5.146
62 HB2 GLU 555 HB2 GLU 555 18.446 -7.285 7.962
63 HB3 GLU 555 HB3 GLU 555 19.318 -7.918 6.571
64 HG2 GLU 555 HG2 GLU 555 19.216 -5.736 5.500
65 HG3 GLU 555 HG3 GLU 555 18.310 -5.099 6.871
66 H THR 556 HN THR 556 15.139 -8.208 7.443
67 HA THR 556 HA THR 556 15.806 -10.977 7.901
68 HB THR 556 HB THR 556 13.459 -11.050 8.863
69 HG1 THR 556 HG1 THR 556 12.355 -9.125 9.046
70 HG21 THR 556 HG21 THR 556 15.376 -8.983 9.951
71 HG22 THR 556 HG22 THR 556 15.415 -10.715 10.281
72 HG23 THR 556 HG23 THR 556 14.065 -9.738 10.858
73 H SER 557 HN SER 557 15.838 -10.366 5.243
74 HA SER 557 HA SER 557 13.908 -12.178 4.117
75 HB2 SER 557 HB2 SER 557 12.636 -10.048 4.096
76 HB3 SER 557 HB3 SER 557 13.969 -9.264 3.250
77 HG SER 557 HG SER 557 13.089 -9.946 1.483
78 H GLN 558 HN GLN 558 14.745 -13.078 2.239
79 HA GLN 558 HA GLN 558 17.538 -12.587 1.751
80 HB2 GLN 558 HB2 GLN 558 15.628 -14.405 0.274
81 HB3 GLN 558 HB3 GLN 558 17.380 -14.424 0.147
82 HG2 GLN 558 HG2 GLN 558 15.896 -14.959 2.704
83 HG3 GLN 558 HG3 GLN 558 16.364 -16.219 1.569
84 HE21 GLN 558 HE21 GLN 558 18.362 -13.413 2.301
85 HE22 GLN 558 HE22 GLN 558 19.599 -14.292 3.127
86 H ASP 559 HN ASP 559 14.520 -11.729 0.307
87 HA ASP 559 HA ASP 559 15.899 -10.430 -1.938
88 HB2 ASP 559 HB2 ASP 559 12.967 -11.045 -1.492
89 HB3 ASP 559 HB3 ASP 559 13.583 -10.133 -2.865
90 H MET 560 HN MET 560 15.949 -8.247 -2.097
91 HA MET 560 HA MET 560 15.047 -6.695 0.175
92 HB2 MET 560 HB2 MET 560 16.466 -5.852 -2.362
93 HB3 MET 560 HB3 MET 560 16.122 -4.789 -1.009
94 HG2 MET 560 HG2 MET 560 18.381 -5.415 -0.819
95 HG3 MET 560 HG3 MET 560 17.511 -6.320 0.417
96 HE1 MET 560 HE1 MET 560 19.798 -7.820 0.585
97 HE2 MET 560 HE2 MET 560 20.508 -6.908 -0.749
98 HE3 MET 560 HE3 MET 560 20.482 -8.671 -0.801
99 H ALA 561 HN ALA 561 13.206 -7.968 -1.853
100 HA ALA 561 HA ALA 561 11.515 -5.645 -2.330
101 HB1 ALA 561 HB1 ALA 561 12.828 -5.927 -4.392
102 HB2 ALA 561 HB2 ALA 561 11.117 -6.263 -4.655
103 HB3 ALA 561 HB3 ALA 561 12.265 -7.597 -4.512
104 H PHE 562 HN PHE 562 9.281 -6.201 -2.535
105 HA PHE 562 HA PHE 562 8.671 -9.036 -2.042
106 HB2 PHE 562 HB2 PHE 562 6.964 -8.478 -0.442
107 HB3 PHE 562 HB3 PHE 562 8.461 -7.714 0.065
108 HD1 PHE 562 HD1 PHE 562 5.062 -7.174 -1.142
109 HD2 PHE 562 HD2 PHE 562 8.712 -5.298 -0.016
110 HE1 PHE 562 HE1 PHE 562 3.895 -5.016 -0.954
111 HE2 PHE 562 HE2 PHE 562 7.550 -3.141 0.175
112 HZ PHE 562 HZ PHE 562 5.135 -2.997 -0.294
113 H LYS 563 HN LYS 563 6.654 -9.763 -2.856
114 HA LYS 563 HA LYS 563 5.869 -8.270 -5.229
115 HB2 LYS 563 HB2 LYS 563 6.384 -10.742 -5.287
116 HB3 LYS 563 HB3 LYS 563 4.945 -11.007 -4.316
117 HG2 LYS 563 HG2 LYS 563 4.273 -11.439 -6.506
118 HG3 LYS 563 HG3 LYS 563 3.678 -9.811 -6.179
119 HD2 LYS 563 HD2 LYS 563 5.602 -8.857 -7.330
120 HD3 LYS 563 HD3 LYS 563 6.243 -10.475 -7.625
121 HE2 LYS 563 HE2 LYS 563 4.162 -10.978 -8.904
122 HE3 LYS 563 HE3 LYS 563 3.705 -9.285 -8.728
123 HZ1 LYS 563 HZ1 LYS 563 4.729 -9.469 -10.815
124 HZ2 LYS 563 HZ2 LYS 563 6.001 -10.411 -10.216
125 HZ3 LYS 563 HZ3 LYS 563 5.909 -8.769 -9.816
126 H CYS 564 HN CYS 564 4.252 -6.859 -5.067
127 HA CYS 564 HA CYS 564 2.659 -6.543 -2.766
128 HB2 CYS 564 HB2 CYS 564 3.230 -4.717 -4.282
129 HB3 CYS 564 HB3 CYS 564 2.325 -5.479 -5.577
130 HA PRO 565 HA PRO 565 -0.171 -9.887 -3.732
131 HB2 PRO 565 HB2 PRO 565 -1.515 -8.990 -1.259
132 HB3 PRO 565 HB3 PRO 565 -0.800 -10.558 -1.642
133 HG2 PRO 565 HG2 PRO 565 0.374 -8.903 0.096
134 HG3 PRO 565 HG3 PRO 565 1.333 -9.886 -1.023
135 HD2 PRO 565 HD2 PRO 565 0.579 -6.989 -1.223
136 HD3 PRO 565 HD3 PRO 565 2.153 -7.762 -1.515
137 H ILE 566 HN ILE 566 -1.099 -6.586 -3.011
138 HA ILE 566 HA ILE 566 -3.874 -6.905 -3.485
139 HB ILE 566 HB ILE 566 -2.237 -4.366 -3.539
140 HG12 ILE 566 HG12 ILE 566 -3.700 -5.730 -1.267
141 HG13 ILE 566 HG13 ILE 566 -1.954 -5.560 -1.427
142 HG21 ILE 566 HG21 ILE 566 -4.428 -4.096 -4.562
143 HG22 ILE 566 HG22 ILE 566 -4.361 -3.259 -3.012
144 HG23 ILE 566 HG23 ILE 566 -5.195 -4.804 -3.142
145 HD11 ILE 566 HD11 ILE 566 -2.167 -3.144 -1.223
146 HD12 ILE 566 HD12 ILE 566 -2.862 -3.975 0.169
147 HD13 ILE 566 HD13 ILE 566 -3.915 -3.308 -1.077
148 H CYS 567 HN CYS 567 -1.157 -5.962 -5.534
149 HA CYS 567 HA CYS 567 -3.032 -5.858 -7.791
150 HB2 CYS 567 HB2 CYS 567 -1.806 -3.960 -8.747
151 HB3 CYS 567 HB3 CYS 567 -2.508 -3.566 -7.183
152 H LYS 568 HN LYS 568 -0.466 -7.432 -6.549
153 HA LYS 568 HA LYS 568 0.930 -9.000 -7.367
154 HB2 LYS 568 HB2 LYS 568 -0.680 -8.578 -9.887
155 HB3 LYS 568 HB3 LYS 568 0.496 -9.868 -9.668
156 HG2 LYS 568 HG2 LYS 568 -0.809 -10.978 -8.115
157 HG3 LYS 568 HG3 LYS 568 -1.726 -9.529 -7.702
158 HD2 LYS 568 HD2 LYS 568 -3.113 -11.051 -8.965
159 HD3 LYS 568 HD3 LYS 568 -2.793 -9.603 -9.917
160 HE2 LYS 568 HE2 LYS 568 -1.047 -10.808 -11.142
161 HE3 LYS 568 HE3 LYS 568 -1.389 -12.257 -10.194
162 HZ1 LYS 568 HZ1 LYS 568 -3.659 -12.219 -11.069
163 HZ2 LYS 568 HZ2 LYS 568 -2.507 -12.373 -12.304
164 HZ3 LYS 568 HZ3 LYS 568 -3.267 -10.877 -12.036
165 H GLU 569 HN GLU 569 1.680 -6.219 -7.419
166 HA GLU 569 HA GLU 569 3.539 -6.150 -9.693
167 HB2 GLU 569 HB2 GLU 569 2.508 -3.974 -7.875
168 HB3 GLU 569 HB3 GLU 569 3.830 -3.729 -9.009
169 HG2 GLU 569 HG2 GLU 569 1.057 -4.613 -9.765
170 HG3 GLU 569 HG3 GLU 569 1.662 -2.957 -9.870
171 H THR 570 HN THR 570 5.684 -6.226 -9.381
172 HA THR 570 HA THR 570 6.721 -7.061 -6.867
173 HB THR 570 HB THR 570 8.228 -6.150 -9.330
174 HG1 THR 570 HG1 THR 570 8.304 -8.506 -9.675
175 HG21 THR 570 HG21 THR 570 10.025 -7.587 -8.457
176 HG22 THR 570 HG22 THR 570 9.061 -7.904 -7.014
177 HG23 THR 570 HG23 THR 570 9.644 -6.273 -7.345
178 H VAL 571 HN VAL 571 7.239 -5.777 -5.188
179 HA VAL 571 HA VAL 571 7.616 -2.910 -5.678
180 HB VAL 571 HB VAL 571 7.378 -4.282 -3.004
181 HG11 VAL 571 HG11 VAL 571 6.944 -1.419 -3.851
182 HG12 VAL 571 HG12 VAL 571 8.322 -2.040 -2.941
183 HG13 VAL 571 HG13 VAL 571 6.710 -2.056 -2.223
184 HG21 VAL 571 HG21 VAL 571 5.186 -3.136 -4.723
185 HG22 VAL 571 HG22 VAL 571 5.005 -3.609 -3.034
186 HG23 VAL 571 HG23 VAL 571 5.392 -4.824 -4.252
187 H THR 572 HN THR 572 9.622 -2.214 -5.880
188 HA THR 572 HA THR 572 11.782 -3.631 -4.479
189 HB THR 572 HB THR 572 13.269 -2.414 -6.140
190 HG1 THR 572 HG1 THR 572 11.419 -2.112 -8.046
191 HG21 THR 572 HG21 THR 572 11.218 -4.354 -7.213
192 HG22 THR 572 HG22 THR 572 12.749 -4.766 -6.441
193 HG23 THR 572 HG23 THR 572 12.742 -3.952 -8.003
194 H GLY 573 HN GLY 573 13.505 -2.322 -3.547
195 HA2 GLY 573 HA2 GLY 573 12.692 0.443 -2.945
196 HA3 GLY 573 HA3 GLY 573 13.253 -0.642 -1.678
197 H VAL 574 HN VAL 574 14.470 1.811 -2.287
198 HA VAL 574 HA VAL 574 16.930 0.992 -3.691
199 HB VAL 574 HB VAL 574 15.809 3.798 -3.517
200 HG11 VAL 574 HG11 VAL 574 18.062 2.636 -5.152
201 HG12 VAL 574 HG12 VAL 574 18.206 3.777 -3.814
202 HG13 VAL 574 HG13 VAL 574 17.430 4.274 -5.319
203 HG21 VAL 574 HG21 VAL 574 15.686 1.873 -5.836
204 HG22 VAL 574 HG22 VAL 574 15.141 3.549 -5.846
205 HG23 VAL 574 HG23 VAL 574 14.325 2.365 -4.831
206 H TYR 575 HN TYR 575 18.893 1.631 -2.797
207 HA TYR 575 HA TYR 575 18.883 2.211 0.013
208 HB2 TYR 575 HB2 TYR 575 20.578 0.721 -0.903
209 HB3 TYR 575 HB3 TYR 575 21.150 1.991 -1.978
210 HD1 TYR 575 HD1 TYR 575 23.073 3.076 -1.349
211 HD2 TYR 575 HD2 TYR 575 20.530 1.498 1.675
212 HE1 TYR 575 HE1 TYR 575 24.679 3.801 0.364
213 HE2 TYR 575 HE2 TYR 575 22.138 2.217 3.402
214 HH TYR 575 HH TYR 575 24.578 2.715 3.553
215 H ASP 576 HN ASP 576 18.768 4.178 0.851
216 HA ASP 576 HA ASP 576 19.162 6.482 -0.887
217 HB2 ASP 576 HB2 ASP 576 17.137 6.501 0.443
218 HB3 ASP 576 HB3 ASP 576 18.066 6.266 1.923
219 H GLU 577 HN GLU 577 21.065 7.344 -1.012
220 HA GLU 577 HA GLU 577 23.195 6.794 0.758
221 HB2 GLU 577 HB2 GLU 577 22.967 9.029 -1.265
222 HB3 GLU 577 HB3 GLU 577 24.452 8.419 -0.549
223 HG2 GLU 577 HG2 GLU 577 24.039 6.238 -1.608
224 HG3 GLU 577 HG3 GLU 577 22.597 6.907 -2.372
225 H GLU 578 HN GLU 578 20.678 9.148 0.803
226 HA GLU 578 HA GLU 578 22.152 11.170 2.201
227 HB2 GLU 578 HB2 GLU 578 20.042 11.387 0.684
228 HB3 GLU 578 HB3 GLU 578 19.160 11.021 2.161
229 HG2 GLU 578 HG2 GLU 578 19.310 13.415 1.793
230 HG3 GLU 578 HG3 GLU 578 20.172 12.940 3.258
231 H SER 579 HN SER 579 19.593 8.868 3.150
232 HA SER 579 HA SER 579 20.027 9.496 5.949
233 HB2 SER 579 HB2 SER 579 18.225 7.826 6.337
234 HB3 SER 579 HB3 SER 579 17.746 9.080 5.192
235 HG SER 579 HG SER 579 17.851 7.674 3.554
236 H GLY 580 HN GLY 580 21.048 7.185 3.623
237 HA2 GLY 580 HA2 GLY 580 22.723 5.597 3.786
238 HA3 GLY 580 HA3 GLY 580 22.841 5.937 5.508
239 H GLU 581 HN GLU 581 19.737 5.263 4.150
240 HA GLU 581 HA GLU 581 19.870 2.503 5.153
241 HB2 GLU 581 HB2 GLU 581 17.474 4.294 5.563
242 HB3 GLU 581 HB3 GLU 581 17.774 2.712 6.273
243 HG2 GLU 581 HG2 GLU 581 19.871 3.954 7.282
244 HG3 GLU 581 HG3 GLU 581 18.857 5.371 7.025
245 H TRP 582 HN TRP 582 18.191 1.105 4.254
246 HA TRP 582 HA TRP 582 17.669 1.693 1.472
247 HB2 TRP 582 HB2 TRP 582 16.975 -0.683 3.203
248 HB3 TRP 582 HB3 TRP 582 16.601 -0.578 1.479
249 HD1 TRP 582 HD1 TRP 582 19.657 -0.799 3.838
250 HE1 TRP 582 HE1 TRP 582 21.618 -1.789 2.494
251 HE3 TRP 582 HE3 TRP 582 17.469 -0.947 -0.773
252 HZ2 TRP 582 HZ2 TRP 582 22.152 -2.545 -0.181
253 HZ3 TRP 582 HZ3 TRP 582 18.763 -1.819 -2.671
254 HH2 TRP 582 HH2 TRP 582 21.060 -2.602 -2.380
255 H VAL 583 HN VAL 583 15.715 2.222 0.587
256 HA VAL 583 HA VAL 583 13.588 2.790 2.555
257 HB VAL 583 HB VAL 583 12.855 4.622 1.153
258 HG11 VAL 583 HG11 VAL 583 14.798 6.108 1.360
259 HG12 VAL 583 HG12 VAL 583 15.829 4.705 1.634
260 HG13 VAL 583 HG13 VAL 583 14.571 5.112 2.796
261 HG21 VAL 583 HG21 VAL 583 13.975 5.272 -0.879
262 HG22 VAL 583 HG22 VAL 583 13.472 3.582 -1.017
263 HG23 VAL 583 HG23 VAL 583 15.158 3.977 -0.684
264 H TRP 584 HN TRP 584 11.712 1.745 2.359
265 HA TRP 584 HA TRP 584 10.834 0.943 -0.324
266 HB2 TRP 584 HB2 TRP 584 10.043 0.066 2.435
267 HB3 TRP 584 HB3 TRP 584 8.890 -0.100 1.114
268 HD1 TRP 584 HD1 TRP 584 11.932 -0.668 -0.603
269 HE1 TRP 584 HE1 TRP 584 12.569 -3.136 -0.755
270 HE3 TRP 584 HE3 TRP 584 8.863 -2.484 3.043
271 HZ2 TRP 584 HZ2 TRP 584 11.858 -5.560 0.512
272 HZ3 TRP 584 HZ3 TRP 584 8.900 -4.898 3.512
273 HH2 TRP 584 HH2 TRP 584 10.369 -6.403 2.271
274 H LYS 585 HN LYS 585 9.947 2.600 -1.304
275 HA LYS 585 HA LYS 585 8.474 4.590 0.225
276 HB2 LYS 585 HB2 LYS 585 8.514 5.597 -2.294
277 HB3 LYS 585 HB3 LYS 585 9.746 5.901 -1.081
278 HG2 LYS 585 HG2 LYS 585 10.771 5.337 -3.188
279 HG3 LYS 585 HG3 LYS 585 11.092 4.066 -2.011
280 HD2 LYS 585 HD2 LYS 585 9.283 2.730 -2.982
281 HD3 LYS 585 HD3 LYS 585 8.993 3.998 -4.174
282 HE2 LYS 585 HE2 LYS 585 11.298 3.715 -5.000
283 HE3 LYS 585 HE3 LYS 585 11.536 2.409 -3.840
284 HZ1 LYS 585 HZ1 LYS 585 10.961 1.686 -6.142
285 HZ2 LYS 585 HZ2 LYS 585 9.423 2.372 -5.924
286 HZ3 LYS 585 HZ3 LYS 585 9.929 1.089 -4.939
287 H ASN 586 HN ASN 586 6.452 5.412 -0.491
288 HA ASN 586 HA ASN 586 4.223 5.018 -0.666
289 HB2 ASN 586 HB2 ASN 586 4.875 3.453 -3.178
290 HB3 ASN 586 HB3 ASN 586 3.371 4.248 -2.779
291 HD21 ASN 586 HD21 ASN 586 3.297 5.519 -4.587
292 HD22 ASN 586 HD22 ASN 586 4.399 6.819 -4.870
293 H THR 587 HN THR 587 5.499 3.356 1.045
294 HA THR 587 HA THR 587 4.109 0.792 0.668
295 HB THR 587 HB THR 587 6.874 1.131 1.869
296 HG1 THR 587 HG1 THR 587 6.521 1.315 -0.558
297 HG21 THR 587 HG21 THR 587 6.953 -1.314 1.831
298 HG22 THR 587 HG22 THR 587 5.304 -1.367 1.205
299 HG23 THR 587 HG23 THR 587 5.616 -0.746 2.827
300 H ILE 588 HN ILE 588 3.117 -0.023 2.452
301 HA ILE 588 HA ILE 588 3.479 1.370 5.018
302 HB ILE 588 HB ILE 588 1.399 2.195 3.958
303 HG12 ILE 588 HG12 ILE 588 0.911 0.386 6.337
304 HG13 ILE 588 HG13 ILE 588 1.528 2.034 6.406
305 HG21 ILE 588 HG21 ILE 588 0.539 -0.694 4.022
306 HG22 ILE 588 HG22 ILE 588 0.849 0.278 2.584
307 HG23 ILE 588 HG23 ILE 588 -0.508 0.674 3.641
308 HD11 ILE 588 HD11 ILE 588 -0.816 1.977 6.981
309 HD12 ILE 588 HD12 ILE 588 -1.196 1.188 5.450
310 HD13 ILE 588 HD13 ILE 588 -0.585 2.844 5.462
311 H GLU 589 HN GLU 589 3.335 0.028 6.831
312 HA GLU 589 HA GLU 589 3.247 -2.840 6.200
313 HB2 GLU 589 HB2 GLU 589 5.374 -2.042 7.142
314 HB3 GLU 589 HB3 GLU 589 4.525 -1.442 8.559
315 HG2 GLU 589 HG2 GLU 589 4.284 -4.335 7.851
316 HG3 GLU 589 HG3 GLU 589 5.776 -3.742 8.592
317 H VAL 590 HN VAL 590 1.542 -3.902 6.773
318 HA VAL 590 HA VAL 590 -0.023 -2.998 9.097
319 HB VAL 590 HB VAL 590 -1.184 -4.071 6.512
320 HG11 VAL 590 HG11 VAL 590 -3.354 -3.495 7.515
321 HG12 VAL 590 HG12 VAL 590 -2.529 -3.054 9.014
322 HG13 VAL 590 HG13 VAL 590 -2.495 -4.723 8.446
323 HG21 VAL 590 HG21 VAL 590 -1.316 -1.276 7.644
324 HG22 VAL 590 HG22 VAL 590 -2.096 -1.845 6.166
325 HG23 VAL 590 HG23 VAL 590 -0.336 -1.778 6.266
326 H ASN 591 HN ASN 591 -0.046 -4.524 10.583
327 HA ASN 591 HA ASN 591 -0.111 -6.531 11.646
328 HB2 ASN 591 HB2 ASN 591 -2.150 -6.672 10.022
329 HB3 ASN 591 HB3 ASN 591 -1.150 -7.820 9.137
330 HD21 ASN 591 HD21 ASN 591 -0.509 -9.759 10.198
331 HD22 ASN 591 HD22 ASN 591 -1.433 -10.393 11.518
332 H GLY 592 HN GLY 592 2.325 -5.818 10.393
333 HA2 GLY 592 HA2 GLY 592 4.387 -6.874 10.378
334 HA3 GLY 592 HA3 GLY 592 3.566 -8.424 10.504
335 H LYS 593 HN LYS 593 2.297 -6.534 8.020
336 HA LYS 593 HA LYS 593 4.027 -7.850 6.050
337 HB2 LYS 593 HB2 LYS 593 1.026 -7.547 5.891
338 HB3 LYS 593 HB3 LYS 593 2.042 -8.164 4.602
339 HG2 LYS 593 HG2 LYS 593 2.696 -10.044 6.031
340 HG3 LYS 593 HG3 LYS 593 1.640 -9.429 7.304
341 HD2 LYS 593 HD2 LYS 593 -0.291 -9.677 5.830
342 HD3 LYS 593 HD3 LYS 593 0.760 -10.262 4.540
343 HE2 LYS 593 HE2 LYS 593 0.322 -11.592 7.211
344 HE3 LYS 593 HE3 LYS 593 -0.375 -12.107 5.675
345 HZ1 LYS 593 HZ1 LYS 593 1.942 -12.402 4.858
346 HZ2 LYS 593 HZ2 LYS 593 1.507 -13.455 6.112
347 HZ3 LYS 593 HZ3 LYS 593 2.496 -12.117 6.439
348 H TYR 594 HN TYR 594 4.442 -6.759 4.171
349 HA TYR 594 HA TYR 594 3.923 -3.888 4.354
350 HB2 TYR 594 HB2 TYR 594 6.051 -5.410 2.840
351 HB3 TYR 594 HB3 TYR 594 5.850 -3.661 2.802
352 HD1 TYR 594 HD1 TYR 594 6.479 -2.294 4.703
353 HD2 TYR 594 HD2 TYR 594 6.901 -6.525 4.832
354 HE1 TYR 594 HE1 TYR 594 7.905 -2.085 6.695
355 HE2 TYR 594 HE2 TYR 594 8.326 -6.326 6.820
356 HH TYR 594 HH TYR 594 9.772 -4.652 7.895
357 H PHE 595 HN PHE 595 2.856 -2.820 2.858
358 HA PHE 595 HA PHE 595 2.259 -4.083 0.269
359 HB2 PHE 595 HB2 PHE 595 0.170 -2.666 1.957
360 HB3 PHE 595 HB3 PHE 595 -0.082 -3.434 0.399
361 HD1 PHE 595 HD1 PHE 595 -0.121 -5.882 0.217
362 HD2 PHE 595 HD2 PHE 595 0.164 -3.919 3.979
363 HE1 PHE 595 HE1 PHE 595 -0.807 -7.955 1.350
364 HE2 PHE 595 HE2 PHE 595 -0.515 -5.988 5.119
365 HZ PHE 595 HZ PHE 595 -1.001 -8.010 3.800
366 H HIS 596 HN HIS 596 1.778 -2.451 -1.391
367 HA HIS 596 HA HIS 596 2.913 0.109 -1.084
368 HB2 HIS 596 HB2 HIS 596 0.853 -0.987 -2.999
369 HB3 HIS 596 HB3 HIS 596 1.285 0.715 -3.021
370 HD2 HIS 596 HD2 HIS 596 4.461 0.614 -2.977
371 HE1 HIS 596 HE1 HIS 596 4.046 -2.029 -6.259
372 HE2 HIS 596 HE2 HIS 596 5.667 -0.633 -4.902
373 H SER 597 HN SER 597 2.179 1.861 -0.018
374 HA SER 597 HA SER 597 -0.201 1.741 1.513
375 HB2 SER 597 HB2 SER 597 0.311 4.230 1.894
376 HB3 SER 597 HB3 SER 597 1.532 3.070 2.419
377 HG SER 597 HG SER 597 2.753 4.377 1.276
378 H THR 598 HN THR 598 0.613 3.009 -1.606
379 HA THR 598 HA THR 598 -1.751 4.494 -2.047
380 HB THR 598 HB THR 598 0.545 4.472 -3.337
381 HG1 THR 598 HG1 THR 598 -0.450 5.662 -4.841
382 HG21 THR 598 HG21 THR 598 0.416 2.128 -4.058
383 HG22 THR 598 HG22 THR 598 0.500 3.235 -5.428
384 HG23 THR 598 HG23 THR 598 -1.039 2.496 -4.985
385 H CYS 599 HN CYS 599 -0.913 1.123 -2.342
386 HA CYS 599 HA CYS 599 -3.244 0.377 -3.859
387 HB2 CYS 599 HB2 CYS 599 -1.104 -1.257 -2.484
388 HB3 CYS 599 HB3 CYS 599 -2.453 -1.969 -3.367
389 H TYR 600 HN TYR 600 -2.558 0.707 -0.471
390 HA TYR 600 HA TYR 600 -3.764 -1.569 0.540
391 HB2 TYR 600 HB2 TYR 600 -2.286 -0.162 1.869
392 HB3 TYR 600 HB3 TYR 600 -3.490 1.120 1.877
393 HD1 TYR 600 HD1 TYR 600 -5.109 1.211 3.551
394 HD2 TYR 600 HD2 TYR 600 -2.937 -2.403 2.967
395 HE1 TYR 600 HE1 TYR 600 -6.101 0.292 5.603
396 HE2 TYR 600 HE2 TYR 600 -3.925 -3.330 5.018
397 HH TYR 600 HH TYR 600 -6.579 -1.976 6.562
398 H HIS 601 HN HIS 601 -5.299 1.489 -0.285
399 HA HIS 601 HA HIS 601 -7.673 1.098 1.140
400 HB2 HIS 601 HB2 HIS 601 -8.677 2.804 -0.287
401 HB3 HIS 601 HB3 HIS 601 -7.079 3.281 0.259
402 HD2 HIS 601 HD2 HIS 601 -5.633 1.500 -2.309
403 HE1 HIS 601 HE1 HIS 601 -7.530 4.587 -4.487
404 HE2 HIS 601 HE2 HIS 601 -5.601 2.948 -4.457
405 H GLU 602 HN GLU 602 -6.617 -0.328 -1.835
406 HA GLU 602 HA GLU 602 -9.086 -1.059 -2.967
407 HB2 GLU 602 HB2 GLU 602 -7.149 -1.274 -4.305
408 HB3 GLU 602 HB3 GLU 602 -6.307 -2.211 -3.084
409 HG2 GLU 602 HG2 GLU 602 -6.816 -3.754 -4.736
410 HG3 GLU 602 HG3 GLU 602 -8.050 -4.019 -3.508
411 H THR 603 HN THR 603 -7.120 -2.596 -0.464
412 HA THR 603 HA THR 603 -8.906 -4.892 -0.377
413 HB THR 603 HB THR 603 -6.420 -5.188 -0.183
414 HG1 THR 603 HG1 THR 603 -8.210 -6.114 1.811
415 HG21 THR 603 HG21 THR 603 -5.908 -3.261 1.226
416 HG22 THR 603 HG22 THR 603 -5.363 -4.752 1.991
417 HG23 THR 603 HG23 THR 603 -6.839 -3.964 2.548
Start of MODEL 9
1 H GLY 548 HN GLY 548 3.397 9.188 0.908
2 HA2 GLY 548 HA2 GLY 548 5.040 8.943 -0.777
3 HA3 GLY 548 HA3 GLY 548 5.514 10.618 -0.525
4 H LYS 549 HN LYS 549 5.084 9.102 2.409
5 HA LYS 549 HA LYS 549 7.852 9.119 3.033
6 HB2 LYS 549 HB2 LYS 549 5.491 7.960 4.528
7 HB3 LYS 549 HB3 LYS 549 7.130 8.002 5.165
8 HG2 LYS 549 HG2 LYS 549 7.022 10.524 4.781
9 HG3 LYS 549 HG3 LYS 549 5.284 10.293 4.595
10 HD2 LYS 549 HD2 LYS 549 6.871 9.432 7.018
11 HD3 LYS 549 HD3 LYS 549 5.992 10.956 6.902
12 HE2 LYS 549 HE2 LYS 549 4.458 9.643 7.994
13 HE3 LYS 549 HE3 LYS 549 3.973 9.399 6.321
14 HZ1 LYS 549 HZ1 LYS 549 5.684 7.554 7.913
15 HZ2 LYS 549 HZ2 LYS 549 5.193 7.315 6.311
16 HZ3 LYS 549 HZ3 LYS 549 4.036 7.320 7.552
17 H TYR 550 HN TYR 550 9.178 7.341 3.559
18 HA TYR 550 HA TYR 550 8.462 4.929 2.046
19 HB2 TYR 550 HB2 TYR 550 10.747 4.685 1.405
20 HB3 TYR 550 HB3 TYR 550 10.294 6.349 1.064
21 HD1 TYR 550 HD1 TYR 550 12.368 4.144 3.096
22 HD2 TYR 550 HD2 TYR 550 11.230 8.190 2.426
23 HE1 TYR 550 HE1 TYR 550 14.301 4.899 4.412
24 HE2 TYR 550 HE2 TYR 550 13.161 8.955 3.745
25 HH TYR 550 HH TYR 550 15.712 6.894 4.645
26 H VAL 551 HN VAL 551 9.421 2.945 2.786
27 HA VAL 551 HA VAL 551 10.046 2.958 5.671
28 HB VAL 551 HB VAL 551 8.770 0.742 4.046
29 HG11 VAL 551 HG11 VAL 551 10.156 -0.151 5.828
30 HG12 VAL 551 HG12 VAL 551 8.449 -0.386 6.205
31 HG13 VAL 551 HG13 VAL 551 9.358 0.900 7.001
32 HG21 VAL 551 HG21 VAL 551 7.568 2.575 6.118
33 HG22 VAL 551 HG22 VAL 551 6.763 1.173 5.414
34 HG23 VAL 551 HG23 VAL 551 7.197 2.544 4.393
35 H VAL 552 HN VAL 552 11.933 2.018 6.258
36 HA VAL 552 HA VAL 552 13.957 1.660 4.342
37 HB VAL 552 HB VAL 552 13.950 0.596 7.175
38 HG11 VAL 552 HG11 VAL 552 16.213 1.411 5.357
39 HG12 VAL 552 HG12 VAL 552 15.792 -0.236 5.833
40 HG13 VAL 552 HG13 VAL 552 16.376 0.910 7.040
41 HG21 VAL 552 HG21 VAL 552 14.943 2.737 7.826
42 HG22 VAL 552 HG22 VAL 552 13.310 2.937 7.190
43 HG23 VAL 552 HG23 VAL 552 14.703 3.340 6.187
44 H VAL 553 HN VAL 553 14.718 -0.127 3.306
45 HA VAL 553 HA VAL 553 13.064 -2.385 3.054
46 HB VAL 553 HB VAL 553 15.983 -2.098 2.314
47 HG11 VAL 553 HG11 VAL 553 15.610 -3.965 0.789
48 HG12 VAL 553 HG12 VAL 553 13.954 -4.121 1.375
49 HG13 VAL 553 HG13 VAL 553 15.307 -4.443 2.459
50 HG21 VAL 553 HG21 VAL 553 14.551 -0.448 1.215
51 HG22 VAL 553 HG22 VAL 553 13.507 -1.745 0.632
52 HG23 VAL 553 HG23 VAL 553 15.174 -1.631 0.065
53 HA PRO 554 HA PRO 554 14.098 -4.365 6.890
54 HB2 PRO 554 HB2 PRO 554 12.834 -6.679 5.538
55 HB3 PRO 554 HB3 PRO 554 12.442 -5.930 7.088
56 HG2 PRO 554 HG2 PRO 554 10.881 -5.584 4.943
57 HG3 PRO 554 HG3 PRO 554 11.142 -4.286 6.124
58 HD2 PRO 554 HD2 PRO 554 12.300 -4.630 3.391
59 HD3 PRO 554 HD3 PRO 554 11.820 -3.149 4.243
60 H GLU 555 HN GLU 555 15.858 -5.422 7.505
61 HA GLU 555 HA GLU 555 17.561 -6.760 5.620
62 HB2 GLU 555 HB2 GLU 555 17.766 -6.715 8.638
63 HB3 GLU 555 HB3 GLU 555 19.052 -7.089 7.498
64 HG2 GLU 555 HG2 GLU 555 19.009 -4.785 6.682
65 HG3 GLU 555 HG3 GLU 555 17.698 -4.412 7.798
66 H THR 556 HN THR 556 14.864 -7.544 7.392
67 HA THR 556 HA THR 556 15.505 -10.382 7.656
68 HB THR 556 HB THR 556 13.294 -10.432 8.906
69 HG1 THR 556 HG1 THR 556 12.172 -8.632 9.039
70 HG21 THR 556 HG21 THR 556 15.440 -8.567 9.926
71 HG22 THR 556 HG22 THR 556 15.429 -10.321 10.094
72 HG23 THR 556 HG23 THR 556 14.208 -9.352 10.919
73 H SER 557 HN SER 557 14.933 -8.967 5.082
74 HA SER 557 HA SER 557 12.383 -10.165 4.315
75 HB2 SER 557 HB2 SER 557 12.666 -8.870 2.211
76 HB3 SER 557 HB3 SER 557 12.699 -7.844 3.644
77 HG SER 557 HG SER 557 14.786 -7.435 3.337
78 H GLN 558 HN GLN 558 12.519 -11.003 1.862
79 HA GLN 558 HA GLN 558 14.248 -13.274 1.938
80 HB2 GLN 558 HB2 GLN 558 12.506 -12.253 -0.317
81 HB3 GLN 558 HB3 GLN 558 13.291 -13.824 -0.275
82 HG2 GLN 558 HG2 GLN 558 11.100 -14.278 0.348
83 HG3 GLN 558 HG3 GLN 558 11.965 -14.220 1.884
84 HE21 GLN 558 HE21 GLN 558 11.094 -11.380 0.011
85 HE22 GLN 558 HE22 GLN 558 9.925 -10.779 1.129
86 H ASP 559 HN ASP 559 13.891 -10.940 -0.722
87 HA ASP 559 HA ASP 559 16.816 -10.778 -0.891
88 HB2 ASP 559 HB2 ASP 559 14.885 -11.348 -3.139
89 HB3 ASP 559 HB3 ASP 559 16.499 -10.712 -3.432
90 H MET 560 HN MET 560 15.433 -8.910 0.423
91 HA MET 560 HA MET 560 15.131 -6.670 0.621
92 HB2 MET 560 HB2 MET 560 16.619 -6.552 -2.008
93 HB3 MET 560 HB3 MET 560 16.287 -5.175 -0.967
94 HG2 MET 560 HG2 MET 560 17.674 -6.089 0.767
95 HG3 MET 560 HG3 MET 560 17.917 -7.571 -0.158
96 HE1 MET 560 HE1 MET 560 20.000 -6.241 -3.223
97 HE2 MET 560 HE2 MET 560 18.252 -6.430 -3.106
98 HE3 MET 560 HE3 MET 560 19.318 -7.671 -2.446
99 H ALA 561 HN ALA 561 13.279 -8.417 -1.032
100 HA ALA 561 HA ALA 561 11.674 -6.250 -2.129
101 HB1 ALA 561 HB1 ALA 561 12.382 -8.693 -3.747
102 HB2 ALA 561 HB2 ALA 561 13.025 -7.072 -4.012
103 HB3 ALA 561 HB3 ALA 561 11.304 -7.391 -4.241
104 H PHE 562 HN PHE 562 9.456 -6.773 -2.402
105 HA PHE 562 HA PHE 562 8.556 -9.450 -1.624
106 HB2 PHE 562 HB2 PHE 562 6.947 -8.692 -0.051
107 HB3 PHE 562 HB3 PHE 562 8.436 -7.878 0.399
108 HD1 PHE 562 HD1 PHE 562 4.997 -7.458 -0.603
109 HD2 PHE 562 HD2 PHE 562 8.750 -5.489 -0.232
110 HE1 PHE 562 HE1 PHE 562 3.860 -5.273 -0.713
111 HE2 PHE 562 HE2 PHE 562 7.628 -3.307 -0.334
112 HZ PHE 562 HZ PHE 562 5.069 -3.252 -0.519
113 H LYS 563 HN LYS 563 6.310 -9.857 -2.444
114 HA LYS 563 HA LYS 563 5.913 -8.219 -4.845
115 HB2 LYS 563 HB2 LYS 563 6.204 -10.676 -5.136
116 HB3 LYS 563 HB3 LYS 563 4.719 -10.921 -4.226
117 HG2 LYS 563 HG2 LYS 563 3.440 -9.766 -5.904
118 HG3 LYS 563 HG3 LYS 563 4.909 -9.355 -6.790
119 HD2 LYS 563 HD2 LYS 563 3.723 -12.093 -6.368
120 HD3 LYS 563 HD3 LYS 563 3.861 -11.203 -7.885
121 HE2 LYS 563 HE2 LYS 563 6.314 -11.320 -7.709
122 HE3 LYS 563 HE3 LYS 563 6.147 -12.261 -6.225
123 HZ1 LYS 563 HZ1 LYS 563 6.535 -13.674 -8.152
124 HZ2 LYS 563 HZ2 LYS 563 5.146 -13.077 -8.906
125 HZ3 LYS 563 HZ3 LYS 563 5.018 -13.988 -7.478
126 H CYS 564 HN CYS 564 4.247 -6.910 -5.044
127 HA CYS 564 HA CYS 564 2.418 -6.496 -2.901
128 HB2 CYS 564 HB2 CYS 564 3.237 -4.672 -4.293
129 HB3 CYS 564 HB3 CYS 564 2.498 -5.398 -5.710
130 HA PRO 565 HA PRO 565 -0.303 -9.720 -4.251
131 HB2 PRO 565 HB2 PRO 565 -2.150 -9.422 -2.265
132 HB3 PRO 565 HB3 PRO 565 -0.589 -10.212 -2.041
133 HG2 PRO 565 HG2 PRO 565 -1.456 -7.467 -1.288
134 HG3 PRO 565 HG3 PRO 565 -0.386 -8.597 -0.446
135 HD2 PRO 565 HD2 PRO 565 0.488 -6.464 -1.925
136 HD3 PRO 565 HD3 PRO 565 1.450 -7.916 -1.598
137 H ILE 566 HN ILE 566 -1.395 -6.392 -3.850
138 HA ILE 566 HA ILE 566 -4.049 -7.017 -4.759
139 HB ILE 566 HB ILE 566 -2.765 -4.354 -4.169
140 HG12 ILE 566 HG12 ILE 566 -4.646 -6.077 -2.540
141 HG13 ILE 566 HG13 ILE 566 -2.917 -5.912 -2.255
142 HG21 ILE 566 HG21 ILE 566 -5.676 -5.027 -4.585
143 HG22 ILE 566 HG22 ILE 566 -4.654 -4.134 -5.714
144 HG23 ILE 566 HG23 ILE 566 -5.024 -3.454 -4.129
145 HD11 ILE 566 HD11 ILE 566 -4.318 -4.580 -0.726
146 HD12 ILE 566 HD12 ILE 566 -4.886 -3.646 -2.109
147 HD13 ILE 566 HD13 ILE 566 -3.182 -3.609 -1.663
148 H CYS 567 HN CYS 567 -1.367 -5.029 -6.086
149 HA CYS 567 HA CYS 567 -2.744 -5.180 -8.675
150 HB2 CYS 567 HB2 CYS 567 -1.416 -3.249 -9.391
151 HB3 CYS 567 HB3 CYS 567 -2.328 -2.886 -7.932
152 H LYS 568 HN LYS 568 -0.368 -6.682 -7.015
153 HA LYS 568 HA LYS 568 0.788 -8.523 -7.599
154 HB2 LYS 568 HB2 LYS 568 -0.262 -8.046 -10.381
155 HB3 LYS 568 HB3 LYS 568 0.448 -9.538 -9.779
156 HG2 LYS 568 HG2 LYS 568 -1.389 -9.772 -8.185
157 HG3 LYS 568 HG3 LYS 568 -2.101 -8.277 -8.792
158 HD2 LYS 568 HD2 LYS 568 -3.235 -10.075 -9.848
159 HD3 LYS 568 HD3 LYS 568 -2.178 -9.336 -11.053
160 HE2 LYS 568 HE2 LYS 568 -2.041 -11.743 -11.216
161 HE3 LYS 568 HE3 LYS 568 -0.509 -11.097 -10.628
162 HZ1 LYS 568 HZ1 LYS 568 -2.591 -12.093 -8.773
163 HZ2 LYS 568 HZ2 LYS 568 -0.933 -11.856 -8.472
164 HZ3 LYS 568 HZ3 LYS 568 -1.444 -13.133 -9.463
165 H GLU 569 HN GLU 569 2.048 -5.821 -7.795
166 HA GLU 569 HA GLU 569 4.138 -6.428 -9.772
167 HB2 GLU 569 HB2 GLU 569 3.545 -3.942 -8.163
168 HB3 GLU 569 HB3 GLU 569 4.954 -4.121 -9.196
169 HG2 GLU 569 HG2 GLU 569 2.395 -4.697 -10.490
170 HG3 GLU 569 HG3 GLU 569 2.605 -3.030 -9.959
171 H THR 570 HN THR 570 6.071 -7.186 -9.131
172 HA THR 570 HA THR 570 6.685 -7.681 -6.401
173 HB THR 570 HB THR 570 8.566 -7.658 -8.779
174 HG1 THR 570 HG1 THR 570 8.049 -9.814 -9.001
175 HG21 THR 570 HG21 THR 570 9.723 -7.611 -6.610
176 HG22 THR 570 HG22 THR 570 9.951 -9.156 -7.426
177 HG23 THR 570 HG23 THR 570 8.808 -9.027 -6.089
178 H VAL 571 HN VAL 571 7.375 -6.251 -4.957
179 HA VAL 571 HA VAL 571 8.218 -3.615 -5.868
180 HB VAL 571 HB VAL 571 7.730 -4.538 -3.034
181 HG11 VAL 571 HG11 VAL 571 7.449 -2.146 -2.578
182 HG12 VAL 571 HG12 VAL 571 7.815 -1.781 -4.265
183 HG13 VAL 571 HG13 VAL 571 9.050 -2.497 -3.228
184 HG21 VAL 571 HG21 VAL 571 5.803 -3.202 -4.930
185 HG22 VAL 571 HG22 VAL 571 5.503 -3.562 -3.230
186 HG23 VAL 571 HG23 VAL 571 5.721 -4.877 -4.384
187 H THR 572 HN THR 572 10.282 -3.290 -6.166
188 HA THR 572 HA THR 572 12.243 -4.587 -4.410
189 HB THR 572 HB THR 572 13.911 -3.820 -6.146
190 HG1 THR 572 HG1 THR 572 12.209 -2.261 -7.003
191 HG21 THR 572 HG21 THR 572 11.703 -5.660 -7.074
192 HG22 THR 572 HG22 THR 572 13.127 -6.119 -6.138
193 HG23 THR 572 HG23 THR 572 13.307 -5.548 -7.797
194 H GLY 573 HN GLY 573 14.065 -3.172 -3.683
195 HA2 GLY 573 HA2 GLY 573 13.173 -0.372 -3.461
196 HA3 GLY 573 HA3 GLY 573 13.729 -1.273 -2.055
197 H VAL 574 HN VAL 574 14.824 1.136 -3.006
198 HA VAL 574 HA VAL 574 17.415 0.278 -4.114
199 HB VAL 574 HB VAL 574 16.182 3.037 -4.323
200 HG11 VAL 574 HG11 VAL 574 18.598 3.052 -4.488
201 HG12 VAL 574 HG12 VAL 574 17.878 3.390 -6.062
202 HG13 VAL 574 HG13 VAL 574 18.543 1.792 -5.722
203 HG21 VAL 574 HG21 VAL 574 16.248 0.856 -6.404
204 HG22 VAL 574 HG22 VAL 574 15.690 2.510 -6.654
205 HG23 VAL 574 HG23 VAL 574 14.815 1.440 -5.559
206 H TYR 575 HN TYR 575 19.286 1.257 -3.250
207 HA TYR 575 HA TYR 575 19.050 2.035 -0.482
208 HB2 TYR 575 HB2 TYR 575 20.838 0.510 -1.148
209 HB3 TYR 575 HB3 TYR 575 21.470 1.703 -2.276
210 HD1 TYR 575 HD1 TYR 575 23.431 2.662 -1.565
211 HD2 TYR 575 HD2 TYR 575 20.461 1.697 1.327
212 HE1 TYR 575 HE1 TYR 575 24.874 3.569 0.206
213 HE2 TYR 575 HE2 TYR 575 21.900 2.600 3.104
214 HH TYR 575 HH TYR 575 24.731 4.431 2.430
215 H ASP 576 HN ASP 576 18.802 4.086 0.145
216 HA ASP 576 HA ASP 576 19.507 6.230 -1.691
217 HB2 ASP 576 HB2 ASP 576 17.338 6.319 -0.475
218 HB3 ASP 576 HB3 ASP 576 18.225 6.395 1.045
219 H GLU 577 HN GLU 577 21.457 7.038 -1.645
220 HA GLU 577 HA GLU 577 23.337 6.003 0.200
221 HB2 GLU 577 HB2 GLU 577 23.663 8.103 -1.937
222 HB3 GLU 577 HB3 GLU 577 24.979 7.321 -1.068
223 HG2 GLU 577 HG2 GLU 577 24.270 5.153 -1.941
224 HG3 GLU 577 HG3 GLU 577 22.972 5.939 -2.834
225 H GLU 578 HN GLU 578 21.726 9.121 -0.078
226 HA GLU 578 HA GLU 578 23.589 10.445 1.645
227 HB2 GLU 578 HB2 GLU 578 22.324 11.678 -0.079
228 HB3 GLU 578 HB3 GLU 578 20.836 11.359 0.803
229 HG2 GLU 578 HG2 GLU 578 21.690 12.599 2.718
230 HG3 GLU 578 HG3 GLU 578 23.191 12.907 1.850
231 H SER 579 HN SER 579 20.450 8.912 2.076
232 HA SER 579 HA SER 579 20.291 9.775 4.828
233 HB2 SER 579 HB2 SER 579 18.267 8.344 4.918
234 HB3 SER 579 HB3 SER 579 18.221 9.487 3.575
235 HG SER 579 HG SER 579 18.616 7.874 2.159
236 H GLY 580 HN GLY 580 21.514 7.084 3.053
237 HA2 GLY 580 HA2 GLY 580 23.039 5.502 3.780
238 HA3 GLY 580 HA3 GLY 580 22.832 6.087 5.422
239 H GLU 581 HN GLU 581 19.994 5.278 3.658
240 HA GLU 581 HA GLU 581 19.937 2.567 4.704
241 HB2 GLU 581 HB2 GLU 581 17.668 2.982 5.722
242 HB3 GLU 581 HB3 GLU 581 19.020 3.715 6.569
243 HG2 GLU 581 HG2 GLU 581 18.441 5.837 5.259
244 HG3 GLU 581 HG3 GLU 581 16.914 5.034 4.894
245 H TRP 582 HN TRP 582 18.230 1.262 3.811
246 HA TRP 582 HA TRP 582 17.802 1.854 1.031
247 HB2 TRP 582 HB2 TRP 582 16.853 -0.473 2.712
248 HB3 TRP 582 HB3 TRP 582 16.763 -0.381 0.958
249 HD1 TRP 582 HD1 TRP 582 19.405 -0.568 3.767
250 HE1 TRP 582 HE1 TRP 582 21.524 -1.668 2.803
251 HE3 TRP 582 HE3 TRP 582 17.941 -0.948 -1.105
252 HZ2 TRP 582 HZ2 TRP 582 22.433 -2.599 0.284
253 HZ3 TRP 582 HZ3 TRP 582 19.480 -1.956 -2.727
254 HH2 TRP 582 HH2 TRP 582 21.685 -2.767 -2.048
255 H VAL 583 HN VAL 583 15.738 1.930 -0.028
256 HA VAL 583 HA VAL 583 13.624 2.934 1.773
257 HB VAL 583 HB VAL 583 13.052 4.647 0.152
258 HG11 VAL 583 HG11 VAL 583 16.000 4.657 0.779
259 HG12 VAL 583 HG12 VAL 583 14.705 5.193 1.849
260 HG13 VAL 583 HG13 VAL 583 15.028 6.066 0.351
261 HG21 VAL 583 HG21 VAL 583 13.641 3.509 -1.910
262 HG22 VAL 583 HG22 VAL 583 15.352 3.572 -1.491
263 HG23 VAL 583 HG23 VAL 583 14.470 5.065 -1.830
264 H TRP 584 HN TRP 584 11.710 2.038 1.600
265 HA TRP 584 HA TRP 584 10.755 1.106 -1.037
266 HB2 TRP 584 HB2 TRP 584 10.015 0.295 1.771
267 HB3 TRP 584 HB3 TRP 584 8.885 0.066 0.446
268 HD1 TRP 584 HD1 TRP 584 11.952 -0.650 -1.223
269 HE1 TRP 584 HE1 TRP 584 12.544 -3.146 -1.182
270 HE3 TRP 584 HE3 TRP 584 8.810 -2.148 2.526
271 HZ2 TRP 584 HZ2 TRP 584 11.785 -5.454 0.255
272 HZ3 TRP 584 HZ3 TRP 584 8.800 -4.524 3.168
273 HH2 TRP 584 HH2 TRP 584 10.253 -6.142 2.057
274 H LYS 585 HN LYS 585 9.740 2.865 -1.945
275 HA LYS 585 HA LYS 585 8.474 4.785 -0.169
276 HB2 LYS 585 HB2 LYS 585 8.427 6.323 -1.928
277 HB3 LYS 585 HB3 LYS 585 9.946 5.471 -2.129
278 HG2 LYS 585 HG2 LYS 585 7.477 4.723 -3.660
279 HG3 LYS 585 HG3 LYS 585 8.599 5.961 -4.215
280 HD2 LYS 585 HD2 LYS 585 10.421 4.261 -4.112
281 HD3 LYS 585 HD3 LYS 585 9.197 3.043 -3.739
282 HE2 LYS 585 HE2 LYS 585 9.717 3.011 -6.112
283 HE3 LYS 585 HE3 LYS 585 8.064 3.566 -5.863
284 HZ1 LYS 585 HZ1 LYS 585 8.887 5.870 -6.083
285 HZ2 LYS 585 HZ2 LYS 585 9.120 4.950 -7.485
286 HZ3 LYS 585 HZ3 LYS 585 10.428 5.266 -6.454
287 H ASN 586 HN ASN 586 6.346 5.537 -0.394
288 HA ASN 586 HA ASN 586 4.117 5.155 -0.260
289 HB2 ASN 586 HB2 ASN 586 4.459 3.778 -2.939
290 HB3 ASN 586 HB3 ASN 586 2.961 4.362 -2.258
291 HD21 ASN 586 HD21 ASN 586 2.512 6.558 -2.267
292 HD22 ASN 586 HD22 ASN 586 3.426 7.688 -3.207
293 H THR 587 HN THR 587 5.627 3.373 1.153
294 HA THR 587 HA THR 587 4.163 0.843 0.818
295 HB THR 587 HB THR 587 6.951 1.207 1.944
296 HG1 THR 587 HG1 THR 587 6.520 1.434 -0.453
297 HG21 THR 587 HG21 THR 587 5.372 -1.294 1.319
298 HG22 THR 587 HG22 THR 587 5.789 -0.706 2.930
299 HG23 THR 587 HG23 THR 587 7.060 -1.251 1.834
300 H ILE 588 HN ILE 588 3.285 -0.091 2.627
301 HA ILE 588 HA ILE 588 3.563 1.340 5.182
302 HB ILE 588 HB ILE 588 1.474 2.091 4.069
303 HG12 ILE 588 HG12 ILE 588 0.962 0.317 6.468
304 HG13 ILE 588 HG13 ILE 588 1.606 1.956 6.543
305 HG21 ILE 588 HG21 ILE 588 0.719 -0.824 4.192
306 HG22 ILE 588 HG22 ILE 588 0.995 0.138 2.740
307 HG23 ILE 588 HG23 ILE 588 -0.383 0.491 3.783
308 HD11 ILE 588 HD11 ILE 588 -0.467 2.812 5.589
309 HD12 ILE 588 HD12 ILE 588 -0.766 1.901 7.070
310 HD13 ILE 588 HD13 ILE 588 -1.108 1.173 5.500
311 H GLU 589 HN GLU 589 3.314 -0.013 7.031
312 HA GLU 589 HA GLU 589 3.212 -2.889 6.406
313 HB2 GLU 589 HB2 GLU 589 5.424 -2.057 7.236
314 HB3 GLU 589 HB3 GLU 589 4.640 -1.589 8.736
315 HG2 GLU 589 HG2 GLU 589 4.271 -4.395 7.892
316 HG3 GLU 589 HG3 GLU 589 5.900 -3.922 8.378
317 H VAL 590 HN VAL 590 1.483 -3.864 7.090
318 HA VAL 590 HA VAL 590 0.049 -2.775 9.423
319 HB VAL 590 HB VAL 590 -1.241 -4.007 6.977
320 HG11 VAL 590 HG11 VAL 590 -2.524 -4.390 9.004
321 HG12 VAL 590 HG12 VAL 590 -3.343 -3.209 7.982
322 HG13 VAL 590 HG13 VAL 590 -2.448 -2.673 9.402
323 HG21 VAL 590 HG21 VAL 590 -2.080 -1.736 6.502
324 HG22 VAL 590 HG22 VAL 590 -0.324 -1.851 6.395
325 HG23 VAL 590 HG23 VAL 590 -1.074 -1.117 7.811
326 H ASN 591 HN ASN 591 0.053 -4.209 11.012
327 HA ASN 591 HA ASN 591 0.002 -6.133 12.188
328 HB2 ASN 591 HB2 ASN 591 -1.595 -6.964 9.805
329 HB3 ASN 591 HB3 ASN 591 -1.326 -8.048 11.161
330 HD21 ASN 591 HD21 ASN 591 -3.805 -7.011 10.197
331 HD22 ASN 591 HD22 ASN 591 -4.518 -6.121 11.493
332 H GLY 592 HN GLY 592 2.337 -5.635 10.622
333 HA2 GLY 592 HA2 GLY 592 4.335 -6.830 10.670
334 HA3 GLY 592 HA3 GLY 592 3.423 -8.316 10.872
335 H LYS 593 HN LYS 593 2.153 -6.529 8.319
336 HA LYS 593 HA LYS 593 3.899 -7.913 6.403
337 HB2 LYS 593 HB2 LYS 593 0.900 -7.686 6.338
338 HB3 LYS 593 HB3 LYS 593 1.854 -8.153 4.937
339 HG2 LYS 593 HG2 LYS 593 2.805 -10.002 6.364
340 HG3 LYS 593 HG3 LYS 593 1.552 -9.608 7.541
341 HD2 LYS 593 HD2 LYS 593 -0.175 -10.126 5.963
342 HD3 LYS 593 HD3 LYS 593 1.001 -10.318 4.663
343 HE2 LYS 593 HE2 LYS 593 0.764 -12.044 7.126
344 HE3 LYS 593 HE3 LYS 593 0.271 -12.488 5.489
345 HZ1 LYS 593 HZ1 LYS 593 3.048 -11.897 6.385
346 HZ2 LYS 593 HZ2 LYS 593 2.593 -12.277 4.794
347 HZ3 LYS 593 HZ3 LYS 593 2.420 -13.428 6.024
348 H TYR 594 HN TYR 594 4.474 -6.875 4.600
349 HA TYR 594 HA TYR 594 4.039 -3.998 4.613
350 HB2 TYR 594 HB2 TYR 594 6.020 -5.718 3.106
351 HB3 TYR 594 HB3 TYR 594 5.926 -3.965 2.980
352 HD1 TYR 594 HD1 TYR 594 6.596 -2.548 4.835
353 HD2 TYR 594 HD2 TYR 594 6.969 -6.779 5.061
354 HE1 TYR 594 HE1 TYR 594 8.085 -2.305 6.768
355 HE2 TYR 594 HE2 TYR 594 8.464 -6.547 6.999
356 HH TYR 594 HH TYR 594 8.812 -3.668 8.713
357 H PHE 595 HN PHE 595 2.939 -2.956 3.142
358 HA PHE 595 HA PHE 595 2.268 -4.228 0.584
359 HB2 PHE 595 HB2 PHE 595 0.259 -2.811 2.373
360 HB3 PHE 595 HB3 PHE 595 -0.053 -3.400 0.749
361 HD1 PHE 595 HD1 PHE 595 0.182 -5.934 0.362
362 HD2 PHE 595 HD2 PHE 595 -0.161 -4.157 4.214
363 HE1 PHE 595 HE1 PHE 595 -0.523 -8.100 1.299
364 HE2 PHE 595 HE2 PHE 595 -0.869 -6.325 5.143
365 HZ PHE 595 HZ PHE 595 -1.142 -8.274 3.653
366 H HIS 596 HN HIS 596 1.735 -2.614 -1.067
367 HA HIS 596 HA HIS 596 2.899 -0.049 -0.748
368 HB2 HIS 596 HB2 HIS 596 1.048 -1.253 -2.784
369 HB3 HIS 596 HB3 HIS 596 1.274 0.489 -2.763
370 HD2 HIS 596 HD2 HIS 596 4.521 0.530 -2.314
371 HE1 HIS 596 HE1 HIS 596 4.539 -1.742 -5.891
372 HE2 HIS 596 HE2 HIS 596 5.951 -0.375 -4.278
373 H SER 597 HN SER 597 2.122 1.718 0.160
374 HA SER 597 HA SER 597 -0.177 1.667 1.773
375 HB2 SER 597 HB2 SER 597 1.702 3.133 2.273
376 HB3 SER 597 HB3 SER 597 1.467 4.000 0.756
377 HG SER 597 HG SER 597 -0.489 3.861 2.812
378 H THR 598 HN THR 598 0.420 2.733 -1.485
379 HA THR 598 HA THR 598 -2.029 4.077 -1.899
380 HB THR 598 HB THR 598 0.042 4.317 -3.334
381 HG1 THR 598 HG1 THR 598 -2.367 4.673 -3.976
382 HG21 THR 598 HG21 THR 598 0.383 2.719 -5.147
383 HG22 THR 598 HG22 THR 598 -0.896 1.692 -4.500
384 HG23 THR 598 HG23 THR 598 0.585 1.946 -3.574
385 H CYS 599 HN CYS 599 -1.011 0.717 -2.150
386 HA CYS 599 HA CYS 599 -3.387 -0.169 -3.480
387 HB2 CYS 599 HB2 CYS 599 -1.217 -1.728 -2.079
388 HB3 CYS 599 HB3 CYS 599 -2.529 -2.443 -3.007
389 H TYR 600 HN TYR 600 -2.378 0.105 -0.119
390 HA TYR 600 HA TYR 600 -4.355 -1.658 0.917
391 HB2 TYR 600 HB2 TYR 600 -2.340 -0.970 2.195
392 HB3 TYR 600 HB3 TYR 600 -2.972 0.669 2.290
393 HD1 TYR 600 HD1 TYR 600 -4.699 1.230 3.887
394 HD2 TYR 600 HD2 TYR 600 -3.402 -2.787 3.429
395 HE1 TYR 600 HE1 TYR 600 -5.881 0.617 5.960
396 HE2 TYR 600 HE2 TYR 600 -4.572 -3.418 5.492
397 HH TYR 600 HH TYR 600 -5.396 -2.353 7.552
398 H HIS 601 HN HIS 601 -4.228 1.771 0.231
399 HA HIS 601 HA HIS 601 -6.869 2.376 1.114
400 HB2 HIS 601 HB2 HIS 601 -5.096 4.066 0.872
401 HB3 HIS 601 HB3 HIS 601 -5.049 3.778 -0.862
402 HD2 HIS 601 HD2 HIS 601 -6.983 5.019 -2.342
403 HE1 HIS 601 HE1 HIS 601 -8.683 7.112 0.920
404 HE2 HIS 601 HE2 HIS 601 -8.365 7.090 -1.594
405 H GLU 602 HN GLU 602 -5.410 1.243 -1.849
406 HA GLU 602 HA GLU 602 -7.528 1.537 -3.659
407 HB2 GLU 602 HB2 GLU 602 -5.441 1.022 -4.581
408 HB3 GLU 602 HB3 GLU 602 -5.134 -0.258 -3.421
409 HG2 GLU 602 HG2 GLU 602 -5.520 -1.552 -5.214
410 HG3 GLU 602 HG3 GLU 602 -7.197 -1.351 -4.703
411 H THR 603 HN THR 603 -6.868 -0.970 -1.271
412 HA THR 603 HA THR 603 -8.907 -2.694 -2.408
413 HB THR 603 HB THR 603 -6.766 -3.665 -1.629
414 HG1 THR 603 HG1 THR 603 -9.268 -4.491 -0.652
415 HG21 THR 603 HG21 THR 603 -6.375 -3.979 0.769
416 HG22 THR 603 HG22 THR 603 -7.809 -3.021 1.134
417 HG23 THR 603 HG23 THR 603 -6.417 -2.263 0.361
Start of MODEL 10
1 H GLY 548 HN GLY 548 3.368 8.929 1.883
2 HA2 GLY 548 HA2 GLY 548 5.338 9.845 0.918
3 HA3 GLY 548 HA3 GLY 548 5.216 11.203 2.029
4 H LYS 549 HN LYS 549 4.613 8.477 3.789
5 HA LYS 549 HA LYS 549 7.273 8.429 4.880
6 HB2 LYS 549 HB2 LYS 549 4.794 6.841 5.545
7 HB3 LYS 549 HB3 LYS 549 6.337 6.604 6.356
8 HG2 LYS 549 HG2 LYS 549 6.243 9.078 6.931
9 HG3 LYS 549 HG3 LYS 549 4.554 9.013 6.415
10 HD2 LYS 549 HD2 LYS 549 4.085 7.293 8.064
11 HD3 LYS 549 HD3 LYS 549 5.784 7.258 8.538
12 HE2 LYS 549 HE2 LYS 549 5.577 9.641 9.224
13 HE3 LYS 549 HE3 LYS 549 3.853 9.548 8.874
14 HZ1 LYS 549 HZ1 LYS 549 3.706 7.731 10.526
15 HZ2 LYS 549 HZ2 LYS 549 4.206 9.206 11.209
16 HZ3 LYS 549 HZ3 LYS 549 5.338 7.981 10.917
17 H TYR 550 HN TYR 550 8.723 6.778 4.797
18 HA TYR 550 HA TYR 550 8.247 4.694 2.764
19 HB2 TYR 550 HB2 TYR 550 10.574 4.810 2.159
20 HB3 TYR 550 HB3 TYR 550 9.949 6.457 2.141
21 HD1 TYR 550 HD1 TYR 550 10.458 7.969 4.110
22 HD2 TYR 550 HD2 TYR 550 12.375 4.210 3.556
23 HE1 TYR 550 HE1 TYR 550 12.222 8.644 5.684
24 HE2 TYR 550 HE2 TYR 550 14.151 4.869 5.121
25 HH TYR 550 HH TYR 550 15.008 6.534 6.333
26 H VAL 551 HN VAL 551 9.455 2.691 3.190
27 HA VAL 551 HA VAL 551 9.952 2.281 6.076
28 HB VAL 551 HB VAL 551 8.962 0.247 4.060
29 HG11 VAL 551 HG11 VAL 551 10.364 -0.775 5.755
30 HG12 VAL 551 HG12 VAL 551 8.678 -1.226 5.999
31 HG13 VAL 551 HG13 VAL 551 9.423 -0.004 7.029
32 HG21 VAL 551 HG21 VAL 551 6.868 0.280 5.341
33 HG22 VAL 551 HG22 VAL 551 7.223 1.846 4.611
34 HG23 VAL 551 HG23 VAL 551 7.506 1.591 6.332
35 H VAL 552 HN VAL 552 11.897 1.437 6.629
36 HA VAL 552 HA VAL 552 13.984 1.468 4.701
37 HB VAL 552 HB VAL 552 14.097 0.308 7.493
38 HG11 VAL 552 HG11 VAL 552 15.996 -0.307 6.123
39 HG12 VAL 552 HG12 VAL 552 16.489 0.871 7.338
40 HG13 VAL 552 HG13 VAL 552 16.242 1.382 5.670
41 HG21 VAL 552 HG21 VAL 552 14.865 2.511 8.217
42 HG22 VAL 552 HG22 VAL 552 13.236 2.597 7.545
43 HG23 VAL 552 HG23 VAL 552 14.615 3.137 6.587
44 H VAL 553 HN VAL 553 14.742 -0.095 3.455
45 HA VAL 553 HA VAL 553 13.341 -2.506 3.105
46 HB VAL 553 HB VAL 553 16.107 -1.836 2.085
47 HG11 VAL 553 HG11 VAL 553 14.052 -3.825 1.119
48 HG12 VAL 553 HG12 VAL 553 15.579 -4.208 1.910
49 HG13 VAL 553 HG13 VAL 553 15.576 -3.459 0.314
50 HG21 VAL 553 HG21 VAL 553 14.459 -0.132 1.476
51 HG22 VAL 553 HG22 VAL 553 13.409 -1.386 0.813
52 HG23 VAL 553 HG23 VAL 553 14.975 -1.057 0.065
53 HA PRO 554 HA PRO 554 15.295 -5.051 6.228
54 HB2 PRO 554 HB2 PRO 554 13.985 -7.242 4.778
55 HB3 PRO 554 HB3 PRO 554 13.750 -6.706 6.446
56 HG2 PRO 554 HG2 PRO 554 11.891 -6.329 4.522
57 HG3 PRO 554 HG3 PRO 554 12.116 -5.198 5.866
58 HD2 PRO 554 HD2 PRO 554 13.004 -4.969 3.020
59 HD3 PRO 554 HD3 PRO 554 12.399 -3.715 4.121
60 H GLU 555 HN GLU 555 17.157 -6.218 6.236
61 HA GLU 555 HA GLU 555 18.561 -6.411 3.728
62 HB2 GLU 555 HB2 GLU 555 20.511 -7.010 5.060
63 HB3 GLU 555 HB3 GLU 555 19.715 -5.603 5.747
64 HG2 GLU 555 HG2 GLU 555 19.261 -8.388 6.783
65 HG3 GLU 555 HG3 GLU 555 20.555 -7.347 7.375
66 H THR 556 HN THR 556 17.012 -8.597 5.975
67 HA THR 556 HA THR 556 18.017 -10.920 4.521
68 HB THR 556 HB THR 556 16.782 -12.234 6.270
69 HG1 THR 556 HG1 THR 556 15.369 -11.134 7.382
70 HG21 THR 556 HG21 THR 556 18.758 -10.190 7.285
71 HG22 THR 556 HG22 THR 556 19.160 -11.732 6.529
72 HG23 THR 556 HG23 THR 556 18.340 -11.701 8.091
73 H SER 557 HN SER 557 16.214 -9.069 3.225
74 HA SER 557 HA SER 557 13.668 -10.483 3.086
75 HB2 SER 557 HB2 SER 557 13.764 -7.974 3.166
76 HB3 SER 557 HB3 SER 557 14.551 -8.005 1.589
77 HG SER 557 HG SER 557 12.608 -9.269 0.929
78 H GLN 558 HN GLN 558 16.123 -11.718 2.161
79 HA GLN 558 HA GLN 558 16.925 -13.014 0.503
80 HB2 GLN 558 HB2 GLN 558 14.204 -12.600 -0.746
81 HB3 GLN 558 HB3 GLN 558 15.385 -13.798 -1.255
82 HG2 GLN 558 HG2 GLN 558 15.240 -14.830 0.990
83 HG3 GLN 558 HG3 GLN 558 13.966 -13.680 1.394
84 HE21 GLN 558 HE21 GLN 558 14.366 -15.134 -1.768
85 HE22 GLN 558 HE22 GLN 558 12.931 -16.101 -1.707
86 H ASP 559 HN ASP 559 14.884 -11.098 -1.662
87 HA ASP 559 HA ASP 559 17.351 -10.093 -2.922
88 HB2 ASP 559 HB2 ASP 559 16.168 -10.110 -5.057
89 HB3 ASP 559 HB3 ASP 559 16.156 -11.711 -4.330
90 H MET 560 HN MET 560 15.311 -9.068 -0.852
91 HA MET 560 HA MET 560 14.653 -7.040 -0.100
92 HB2 MET 560 HB2 MET 560 16.507 -6.089 -2.281
93 HB3 MET 560 HB3 MET 560 15.705 -5.004 -1.160
94 HG2 MET 560 HG2 MET 560 17.875 -5.329 -0.316
95 HG3 MET 560 HG3 MET 560 16.802 -6.276 0.711
96 HE1 MET 560 HE1 MET 560 19.619 -8.050 -2.492
97 HE2 MET 560 HE2 MET 560 19.556 -6.336 -2.068
98 HE3 MET 560 HE3 MET 560 18.197 -7.091 -2.903
99 H ALA 561 HN ALA 561 13.198 -8.394 -2.322
100 HA ALA 561 HA ALA 561 11.452 -6.140 -2.925
101 HB1 ALA 561 HB1 ALA 561 12.914 -6.360 -4.892
102 HB2 ALA 561 HB2 ALA 561 11.238 -6.759 -5.271
103 HB3 ALA 561 HB3 ALA 561 12.426 -8.047 -5.060
104 H PHE 562 HN PHE 562 9.298 -6.727 -3.132
105 HA PHE 562 HA PHE 562 8.652 -9.582 -2.971
106 HB2 PHE 562 HB2 PHE 562 7.085 -9.274 -1.167
107 HB3 PHE 562 HB3 PHE 562 8.643 -8.640 -0.654
108 HD1 PHE 562 HD1 PHE 562 5.176 -7.867 -1.391
109 HD2 PHE 562 HD2 PHE 562 8.984 -6.224 -0.444
110 HE1 PHE 562 HE1 PHE 562 4.105 -5.730 -0.819
111 HE2 PHE 562 HE2 PHE 562 7.922 -4.077 0.121
112 HZ PHE 562 HZ PHE 562 5.455 -3.863 0.018
113 H LYS 563 HN LYS 563 6.448 -10.070 -3.630
114 HA LYS 563 HA LYS 563 5.588 -8.199 -5.687
115 HB2 LYS 563 HB2 LYS 563 5.850 -10.621 -6.212
116 HB3 LYS 563 HB3 LYS 563 4.559 -10.974 -5.069
117 HG2 LYS 563 HG2 LYS 563 3.472 -10.987 -7.103
118 HG3 LYS 563 HG3 LYS 563 3.156 -9.364 -6.492
119 HD2 LYS 563 HD2 LYS 563 3.735 -9.206 -8.804
120 HD3 LYS 563 HD3 LYS 563 5.061 -8.536 -7.849
121 HE2 LYS 563 HE2 LYS 563 6.319 -10.594 -8.106
122 HE3 LYS 563 HE3 LYS 563 4.975 -11.333 -8.979
123 HZ1 LYS 563 HZ1 LYS 563 5.252 -9.732 -10.742
124 HZ2 LYS 563 HZ2 LYS 563 6.719 -10.529 -10.464
125 HZ3 LYS 563 HZ3 LYS 563 6.490 -8.943 -9.895
126 H CYS 564 HN CYS 564 3.971 -6.849 -5.418
127 HA CYS 564 HA CYS 564 2.408 -6.659 -3.078
128 HB2 CYS 564 HB2 CYS 564 2.852 -4.743 -4.497
129 HB3 CYS 564 HB3 CYS 564 2.054 -5.517 -5.857
130 HA PRO 565 HA PRO 565 -0.126 -10.156 -4.161
131 HB2 PRO 565 HB2 PRO 565 -1.734 -10.127 -1.965
132 HB3 PRO 565 HB3 PRO 565 -0.078 -10.739 -1.942
133 HG2 PRO 565 HG2 PRO 565 -1.144 -8.100 -1.050
134 HG3 PRO 565 HG3 PRO 565 0.087 -9.130 -0.302
135 HD2 PRO 565 HD2 PRO 565 0.676 -6.926 -1.785
136 HD3 PRO 565 HD3 PRO 565 1.759 -8.325 -1.659
137 H ILE 566 HN ILE 566 -1.300 -6.945 -3.697
138 HA ILE 566 HA ILE 566 -4.049 -7.578 -4.240
139 HB ILE 566 HB ILE 566 -2.714 -4.877 -4.145
140 HG12 ILE 566 HG12 ILE 566 -4.201 -6.402 -1.979
141 HG13 ILE 566 HG13 ILE 566 -2.462 -6.140 -2.033
142 HG21 ILE 566 HG21 ILE 566 -4.830 -4.816 -5.314
143 HG22 ILE 566 HG22 ILE 566 -5.005 -4.056 -3.729
144 HG23 ILE 566 HG23 ILE 566 -5.613 -5.691 -3.999
145 HD11 ILE 566 HD11 ILE 566 -3.512 -4.638 -0.469
146 HD12 ILE 566 HD12 ILE 566 -4.560 -4.009 -1.738
147 HD13 ILE 566 HD13 ILE 566 -2.819 -3.740 -1.816
148 H CYS 567 HN CYS 567 -1.364 -6.120 -6.051
149 HA CYS 567 HA CYS 567 -3.027 -6.341 -8.456
150 HB2 CYS 567 HB2 CYS 567 -2.168 -4.178 -9.254
151 HB3 CYS 567 HB3 CYS 567 -3.090 -4.023 -7.763
152 H LYS 568 HN LYS 568 -0.288 -7.372 -7.027
153 HA LYS 568 HA LYS 568 1.413 -8.646 -7.748
154 HB2 LYS 568 HB2 LYS 568 -0.212 -8.519 -10.258
155 HB3 LYS 568 HB3 LYS 568 1.347 -9.333 -10.245
156 HG2 LYS 568 HG2 LYS 568 0.634 -10.912 -8.656
157 HG3 LYS 568 HG3 LYS 568 -0.801 -9.969 -8.252
158 HD2 LYS 568 HD2 LYS 568 -0.304 -11.229 -10.946
159 HD3 LYS 568 HD3 LYS 568 -1.254 -11.978 -9.665
160 HE2 LYS 568 HE2 LYS 568 -2.682 -9.893 -9.672
161 HE3 LYS 568 HE3 LYS 568 -1.842 -9.422 -11.146
162 HZ1 LYS 568 HZ1 LYS 568 -3.448 -11.894 -10.766
163 HZ2 LYS 568 HZ2 LYS 568 -2.616 -11.482 -12.185
164 HZ3 LYS 568 HZ3 LYS 568 -3.911 -10.528 -11.655
165 H GLU 569 HN GLU 569 1.661 -5.696 -7.813
166 HA GLU 569 HA GLU 569 3.720 -5.203 -9.789
167 HB2 GLU 569 HB2 GLU 569 3.147 -3.717 -7.213
168 HB3 GLU 569 HB3 GLU 569 4.168 -3.155 -8.524
169 HG2 GLU 569 HG2 GLU 569 2.309 -2.805 -9.938
170 HG3 GLU 569 HG3 GLU 569 1.236 -3.682 -8.839
171 H THR 570 HN THR 570 5.891 -5.690 -9.522
172 HA THR 570 HA THR 570 6.774 -6.918 -7.071
173 HB THR 570 HB THR 570 8.434 -5.910 -9.409
174 HG1 THR 570 HG1 THR 570 8.375 -8.045 -10.109
175 HG21 THR 570 HG21 THR 570 9.769 -6.159 -7.385
176 HG22 THR 570 HG22 THR 570 10.160 -7.433 -8.540
177 HG23 THR 570 HG23 THR 570 9.135 -7.788 -7.148
178 H VAL 571 HN VAL 571 7.280 -5.782 -5.292
179 HA VAL 571 HA VAL 571 7.730 -2.910 -5.523
180 HB VAL 571 HB VAL 571 7.570 -4.589 -3.013
181 HG11 VAL 571 HG11 VAL 571 7.081 -2.464 -1.898
182 HG12 VAL 571 HG12 VAL 571 7.293 -1.612 -3.427
183 HG13 VAL 571 HG13 VAL 571 8.660 -2.441 -2.683
184 HG21 VAL 571 HG21 VAL 571 5.242 -3.846 -2.827
185 HG22 VAL 571 HG22 VAL 571 5.501 -4.812 -4.279
186 HG23 VAL 571 HG23 VAL 571 5.365 -3.058 -4.402
187 H THR 572 HN THR 572 9.712 -2.182 -5.768
188 HA THR 572 HA THR 572 11.953 -3.676 -4.580
189 HB THR 572 HB THR 572 13.355 -2.516 -6.333
190 HG1 THR 572 HG1 THR 572 12.321 -0.960 -7.340
191 HG21 THR 572 HG21 THR 572 12.670 -4.852 -6.608
192 HG22 THR 572 HG22 THR 572 12.672 -4.018 -8.163
193 HG23 THR 572 HG23 THR 572 11.149 -4.327 -7.332
194 H GLY 573 HN GLY 573 13.739 -2.358 -3.763
195 HA2 GLY 573 HA2 GLY 573 12.898 0.389 -3.117
196 HA3 GLY 573 HA3 GLY 573 13.583 -0.679 -1.896
197 H VAL 574 HN VAL 574 14.640 1.831 -2.614
198 HA VAL 574 HA VAL 574 17.065 1.105 -4.123
199 HB VAL 574 HB VAL 574 15.804 3.846 -3.878
200 HG11 VAL 574 HG11 VAL 574 17.356 4.461 -5.688
201 HG12 VAL 574 HG12 VAL 574 18.084 2.856 -5.590
202 HG13 VAL 574 HG13 VAL 574 18.200 3.963 -4.218
203 HG21 VAL 574 HG21 VAL 574 15.135 3.577 -6.214
204 HG22 VAL 574 HG22 VAL 574 14.381 2.366 -5.176
205 HG23 VAL 574 HG23 VAL 574 15.750 1.924 -6.196
206 H TYR 575 HN TYR 575 19.045 1.792 -3.278
207 HA TYR 575 HA TYR 575 19.052 2.555 -0.492
208 HB2 TYR 575 HB2 TYR 575 20.703 0.934 -1.384
209 HB3 TYR 575 HB3 TYR 575 21.353 2.196 -2.426
210 HD1 TYR 575 HD1 TYR 575 23.317 3.142 -1.713
211 HD2 TYR 575 HD2 TYR 575 20.534 1.779 1.206
212 HE1 TYR 575 HE1 TYR 575 24.845 3.864 0.078
213 HE2 TYR 575 HE2 TYR 575 22.056 2.485 3.005
214 HH TYR 575 HH TYR 575 24.486 2.900 3.310
215 H ASP 576 HN ASP 576 18.883 4.598 0.096
216 HA ASP 576 HA ASP 576 19.537 6.705 -1.831
217 HB2 ASP 576 HB2 ASP 576 17.323 6.838 -0.743
218 HB3 ASP 576 HB3 ASP 576 18.105 6.882 0.837
219 H GLU 577 HN GLU 577 21.574 7.296 -1.802
220 HA GLU 577 HA GLU 577 23.317 6.691 0.344
221 HB2 GLU 577 HB2 GLU 577 23.805 8.510 -2.018
222 HB3 GLU 577 HB3 GLU 577 25.036 7.811 -0.979
223 HG2 GLU 577 HG2 GLU 577 25.126 6.387 -2.759
224 HG3 GLU 577 HG3 GLU 577 23.964 5.543 -1.737
225 H GLU 578 HN GLU 578 21.378 9.458 -0.341
226 HA GLU 578 HA GLU 578 23.006 11.340 1.092
227 HB2 GLU 578 HB2 GLU 578 20.117 11.539 0.229
228 HB3 GLU 578 HB3 GLU 578 21.108 12.869 0.819
229 HG2 GLU 578 HG2 GLU 578 22.654 12.454 -1.099
230 HG3 GLU 578 HG3 GLU 578 21.473 11.298 -1.715
231 H SER 579 HN SER 579 20.197 9.345 1.842
232 HA SER 579 HA SER 579 20.193 10.322 4.592
233 HB2 SER 579 HB2 SER 579 18.201 8.838 4.854
234 HB3 SER 579 HB3 SER 579 18.016 10.020 3.558
235 HG SER 579 HG SER 579 18.422 8.420 2.058
236 H GLY 580 HN GLY 580 21.314 7.669 2.697
237 HA2 GLY 580 HA2 GLY 580 22.967 6.151 3.263
238 HA3 GLY 580 HA3 GLY 580 22.888 6.716 4.924
239 H GLU 581 HN GLU 581 19.987 5.687 3.265
240 HA GLU 581 HA GLU 581 20.137 3.048 4.488
241 HB2 GLU 581 HB2 GLU 581 17.848 3.387 5.479
242 HB3 GLU 581 HB3 GLU 581 19.147 4.281 6.256
243 HG2 GLU 581 HG2 GLU 581 18.474 6.284 4.963
244 HG3 GLU 581 HG3 GLU 581 17.105 5.370 4.329
245 H TRP 582 HN TRP 582 18.386 1.619 3.799
246 HA TRP 582 HA TRP 582 17.722 2.016 1.009
247 HB2 TRP 582 HB2 TRP 582 17.160 -0.265 2.908
248 HB3 TRP 582 HB3 TRP 582 16.723 -0.271 1.198
249 HD1 TRP 582 HD1 TRP 582 19.842 -0.346 3.469
250 HE1 TRP 582 HE1 TRP 582 21.794 -1.348 2.108
251 HE3 TRP 582 HE3 TRP 582 17.560 -0.675 -1.087
252 HZ2 TRP 582 HZ2 TRP 582 22.279 -2.176 -0.547
253 HZ3 TRP 582 HZ3 TRP 582 18.829 -1.591 -2.984
254 HH2 TRP 582 HH2 TRP 582 21.139 -2.325 -2.714
255 H VAL 583 HN VAL 583 15.678 2.318 0.174
256 HA VAL 583 HA VAL 583 13.614 2.929 2.202
257 HB VAL 583 HB VAL 583 12.815 4.742 0.778
258 HG11 VAL 583 HG11 VAL 583 14.494 5.243 2.461
259 HG12 VAL 583 HG12 VAL 583 14.695 6.281 1.047
260 HG13 VAL 583 HG13 VAL 583 15.776 4.909 1.297
261 HG21 VAL 583 HG21 VAL 583 14.006 5.442 -1.216
262 HG22 VAL 583 HG22 VAL 583 13.470 3.764 -1.393
263 HG23 VAL 583 HG23 VAL 583 15.160 4.118 -1.020
264 H TRP 584 HN TRP 584 11.786 1.772 2.023
265 HA TRP 584 HA TRP 584 10.812 1.051 -0.650
266 HB2 TRP 584 HB2 TRP 584 10.154 0.081 2.113
267 HB3 TRP 584 HB3 TRP 584 8.946 -0.062 0.841
268 HD1 TRP 584 HD1 TRP 584 11.884 -0.580 -1.044
269 HE1 TRP 584 HE1 TRP 584 12.526 -3.044 -1.274
270 HE3 TRP 584 HE3 TRP 584 9.073 -2.475 2.770
271 HZ2 TRP 584 HZ2 TRP 584 11.923 -5.494 -0.005
272 HZ3 TRP 584 HZ3 TRP 584 9.162 -4.895 3.204
273 HH2 TRP 584 HH2 TRP 584 10.561 -6.373 1.842
274 H LYS 585 HN LYS 585 9.839 2.738 -1.519
275 HA LYS 585 HA LYS 585 8.386 4.601 0.176
276 HB2 LYS 585 HB2 LYS 585 8.344 5.959 -2.030
277 HB3 LYS 585 HB3 LYS 585 9.848 5.823 -1.132
278 HG2 LYS 585 HG2 LYS 585 10.386 5.539 -3.418
279 HG3 LYS 585 HG3 LYS 585 10.476 3.938 -2.683
280 HD2 LYS 585 HD2 LYS 585 8.331 3.348 -3.575
281 HD3 LYS 585 HD3 LYS 585 8.084 4.987 -4.181
282 HE2 LYS 585 HE2 LYS 585 8.747 3.824 -6.075
283 HE3 LYS 585 HE3 LYS 585 10.245 4.570 -5.531
284 HZ1 LYS 585 HZ1 LYS 585 10.794 2.369 -6.033
285 HZ2 LYS 585 HZ2 LYS 585 9.402 1.745 -5.287
286 HZ3 LYS 585 HZ3 LYS 585 10.653 2.380 -4.341
287 H ASN 586 HN ASN 586 6.326 5.449 -0.507
288 HA ASN 586 HA ASN 586 4.097 5.019 -0.648
289 HB2 ASN 586 HB2 ASN 586 4.786 3.388 -3.117
290 HB3 ASN 586 HB3 ASN 586 3.225 4.062 -2.708
291 HD21 ASN 586 HD21 ASN 586 3.086 5.180 -4.642
292 HD22 ASN 586 HD22 ASN 586 4.036 6.586 -4.964
293 H THR 587 HN THR 587 5.447 3.465 1.106
294 HA THR 587 HA THR 587 4.122 0.850 0.893
295 HB THR 587 HB THR 587 6.998 1.200 1.781
296 HG1 THR 587 HG1 THR 587 6.455 1.453 -0.580
297 HG21 THR 587 HG21 THR 587 5.809 -0.701 2.814
298 HG22 THR 587 HG22 THR 587 7.076 -1.242 1.715
299 HG23 THR 587 HG23 THR 587 5.388 -1.296 1.207
300 H ILE 588 HN ILE 588 3.408 0.006 2.822
301 HA ILE 588 HA ILE 588 4.080 1.410 5.307
302 HB ILE 588 HB ILE 588 2.049 2.506 4.432
303 HG12 ILE 588 HG12 ILE 588 1.488 0.759 6.839
304 HG13 ILE 588 HG13 ILE 588 2.350 2.293 6.869
305 HG21 ILE 588 HG21 ILE 588 1.144 0.701 3.112
306 HG22 ILE 588 HG22 ILE 588 -0.060 1.260 4.273
307 HG23 ILE 588 HG23 ILE 588 0.823 -0.240 4.569
308 HD11 ILE 588 HD11 ILE 588 0.057 2.552 7.615
309 HD12 ILE 588 HD12 ILE 588 -0.529 1.909 6.078
310 HD13 ILE 588 HD13 ILE 588 0.341 3.445 6.122
311 H GLU 589 HN GLU 589 3.821 0.081 7.171
312 HA GLU 589 HA GLU 589 3.514 -2.759 6.574
313 HB2 GLU 589 HB2 GLU 589 5.469 -2.125 7.895
314 HB3 GLU 589 HB3 GLU 589 4.434 -1.373 9.101
315 HG2 GLU 589 HG2 GLU 589 3.432 -3.566 9.575
316 HG3 GLU 589 HG3 GLU 589 4.525 -4.298 8.405
317 H VAL 590 HN VAL 590 1.627 -3.685 6.822
318 HA VAL 590 HA VAL 590 -0.208 -2.692 8.904
319 HB VAL 590 HB VAL 590 -0.998 -3.728 6.170
320 HG11 VAL 590 HG11 VAL 590 -2.590 -4.340 7.918
321 HG12 VAL 590 HG12 VAL 590 -3.273 -3.147 6.814
322 HG13 VAL 590 HG13 VAL 590 -2.706 -2.648 8.408
323 HG21 VAL 590 HG21 VAL 590 -0.081 -1.490 6.003
324 HG22 VAL 590 HG22 VAL 590 -1.127 -0.938 7.309
325 HG23 VAL 590 HG23 VAL 590 -1.829 -1.440 5.773
326 H ASN 591 HN ASN 591 -0.796 -4.214 10.305
327 HA ASN 591 HA ASN 591 -1.053 -6.219 11.339
328 HB2 ASN 591 HB2 ASN 591 -2.679 -6.507 9.444
329 HB3 ASN 591 HB3 ASN 591 -1.414 -7.336 8.548
330 HD21 ASN 591 HD21 ASN 591 -1.989 -7.647 12.017
331 HD22 ASN 591 HD22 ASN 591 -2.490 -9.308 11.961
332 H GLY 592 HN GLY 592 1.567 -5.340 10.716
333 HA2 GLY 592 HA2 GLY 592 3.682 -6.171 11.081
334 HA3 GLY 592 HA3 GLY 592 2.980 -7.773 11.243
335 H LYS 593 HN LYS 593 2.129 -6.214 8.345
336 HA LYS 593 HA LYS 593 4.232 -7.665 6.879
337 HB2 LYS 593 HB2 LYS 593 1.278 -7.554 6.224
338 HB3 LYS 593 HB3 LYS 593 2.510 -8.277 5.198
339 HG2 LYS 593 HG2 LYS 593 2.940 -9.995 6.774
340 HG3 LYS 593 HG3 LYS 593 1.974 -9.186 8.013
341 HD2 LYS 593 HD2 LYS 593 0.893 -10.260 5.408
342 HD3 LYS 593 HD3 LYS 593 0.816 -11.107 6.954
343 HE2 LYS 593 HE2 LYS 593 -0.477 -9.235 7.889
344 HE3 LYS 593 HE3 LYS 593 -0.429 -8.434 6.318
345 HZ1 LYS 593 HZ1 LYS 593 -1.606 -10.357 5.377
346 HZ2 LYS 593 HZ2 LYS 593 -2.507 -9.582 6.585
347 HZ3 LYS 593 HZ3 LYS 593 -1.725 -11.037 6.927
348 H TYR 594 HN TYR 594 4.966 -6.698 5.000
349 HA TYR 594 HA TYR 594 4.447 -3.849 4.834
350 HB2 TYR 594 HB2 TYR 594 6.409 -5.579 3.317
351 HB3 TYR 594 HB3 TYR 594 6.332 -3.820 3.253
352 HD1 TYR 594 HD1 TYR 594 8.060 -6.462 4.649
353 HD2 TYR 594 HD2 TYR 594 6.343 -2.727 5.746
354 HE1 TYR 594 HE1 TYR 594 9.573 -6.341 6.576
355 HE2 TYR 594 HE2 TYR 594 7.852 -2.597 7.683
356 HH TYR 594 HH TYR 594 9.155 -4.111 9.104
357 H PHE 595 HN PHE 595 3.149 -2.936 3.442
358 HA PHE 595 HA PHE 595 2.502 -4.287 0.907
359 HB2 PHE 595 HB2 PHE 595 0.499 -3.071 2.828
360 HB3 PHE 595 HB3 PHE 595 0.124 -3.562 1.181
361 HD1 PHE 595 HD1 PHE 595 -0.059 -4.515 4.502
362 HD2 PHE 595 HD2 PHE 595 0.865 -6.084 0.655
363 HE1 PHE 595 HE1 PHE 595 -0.544 -6.783 5.310
364 HE2 PHE 595 HE2 PHE 595 0.380 -8.356 1.468
365 HZ PHE 595 HZ PHE 595 -0.409 -8.704 3.739
366 H HIS 596 HN HIS 596 1.688 -2.791 -0.742
367 HA HIS 596 HA HIS 596 2.895 -0.241 -0.779
368 HB2 HIS 596 HB2 HIS 596 0.827 -1.632 -2.420
369 HB3 HIS 596 HB3 HIS 596 0.897 0.120 -2.542
370 HD2 HIS 596 HD2 HIS 596 4.305 0.084 -2.367
371 HE1 HIS 596 HE1 HIS 596 3.764 -1.782 -6.126
372 HE2 HIS 596 HE2 HIS 596 5.338 -0.416 -4.692
373 H SER 597 HN SER 597 2.324 1.592 0.150
374 HA SER 597 HA SER 597 0.103 1.782 1.894
375 HB2 SER 597 HB2 SER 597 2.212 3.073 2.200
376 HB3 SER 597 HB3 SER 597 1.812 4.022 0.769
377 HG SER 597 HG SER 597 0.017 3.840 2.939
378 H THR 598 HN THR 598 0.675 2.665 -1.410
379 HA THR 598 HA THR 598 -1.594 4.320 -1.772
380 HB THR 598 HB THR 598 0.442 4.308 -3.253
381 HG1 THR 598 HG1 THR 598 -0.754 5.028 -4.885
382 HG21 THR 598 HG21 THR 598 0.836 1.955 -3.500
383 HG22 THR 598 HG22 THR 598 0.498 2.637 -5.093
384 HG23 THR 598 HG23 THR 598 -0.744 1.717 -4.245
385 H CYS 599 HN CYS 599 -1.009 0.883 -1.991
386 HA CYS 599 HA CYS 599 -3.449 0.240 -3.341
387 HB2 CYS 599 HB2 CYS 599 -1.476 -1.536 -1.905
388 HB3 CYS 599 HB3 CYS 599 -2.831 -2.111 -2.874
389 H TYR 600 HN TYR 600 -2.513 0.556 -0.024
390 HA TYR 600 HA TYR 600 -4.195 -1.250 1.223
391 HB2 TYR 600 HB2 TYR 600 -2.393 -0.090 2.390
392 HB3 TYR 600 HB3 TYR 600 -3.251 1.441 2.237
393 HD1 TYR 600 HD1 TYR 600 -4.511 2.166 4.036
394 HD2 TYR 600 HD2 TYR 600 -3.787 -2.006 3.597
395 HE1 TYR 600 HE1 TYR 600 -5.635 1.749 6.183
396 HE2 TYR 600 HE2 TYR 600 -4.906 -2.429 5.743
397 HH TYR 600 HH TYR 600 -5.410 -1.166 7.842
398 H HIS 601 HN HIS 601 -4.938 1.903 -0.071
399 HA HIS 601 HA HIS 601 -7.344 2.416 1.257
400 HB2 HIS 601 HB2 HIS 601 -6.395 3.224 -1.494
401 HB3 HIS 601 HB3 HIS 601 -7.878 3.835 -0.762
402 HD2 HIS 601 HD2 HIS 601 -4.540 3.498 1.255
403 HE1 HIS 601 HE1 HIS 601 -5.488 7.592 0.769
404 HE2 HIS 601 HE2 HIS 601 -3.813 5.948 1.709
405 H GLU 602 HN GLU 602 -6.650 0.166 -1.333
406 HA GLU 602 HA GLU 602 -9.308 0.089 -2.365
407 HB2 GLU 602 HB2 GLU 602 -8.613 -1.671 -3.777
408 HB3 GLU 602 HB3 GLU 602 -7.234 -0.602 -3.638
409 HG2 GLU 602 HG2 GLU 602 -6.242 -2.661 -3.489
410 HG3 GLU 602 HG3 GLU 602 -6.472 -2.263 -1.787
411 H THR 603 HN THR 603 -7.664 -1.622 0.191
412 HA THR 603 HA THR 603 -9.782 -3.596 0.403
413 HB THR 603 HB THR 603 -7.448 -4.310 0.768
414 HG1 THR 603 HG1 THR 603 -9.468 -5.097 2.053
415 HG21 THR 603 HG21 THR 603 -6.573 -2.276 1.813
416 HG22 THR 603 HG22 THR 603 -6.267 -3.694 2.814
417 HG23 THR 603 HG23 THR 603 -7.563 -2.579 3.244
Start of MODEL 11
1 H GLY 548 HN GLY 548 3.132 9.108 2.012
2 HA2 GLY 548 HA2 GLY 548 5.046 9.810 0.901
3 HA3 GLY 548 HA3 GLY 548 5.125 11.205 1.970
4 H LYS 549 HN LYS 549 4.726 8.525 3.846
5 HA LYS 549 HA LYS 549 7.488 8.543 4.637
6 HB2 LYS 549 HB2 LYS 549 5.150 6.913 5.627
7 HB3 LYS 549 HB3 LYS 549 6.761 6.867 6.324
8 HG2 LYS 549 HG2 LYS 549 4.932 9.255 6.224
9 HG3 LYS 549 HG3 LYS 549 5.317 8.282 7.642
10 HD2 LYS 549 HD2 LYS 549 7.273 9.938 6.051
11 HD3 LYS 549 HD3 LYS 549 6.585 10.370 7.615
12 HE2 LYS 549 HE2 LYS 549 7.658 8.451 8.646
13 HE3 LYS 549 HE3 LYS 549 8.295 7.938 7.085
14 HZ1 LYS 549 HZ1 LYS 549 10.005 9.079 8.281
15 HZ2 LYS 549 HZ2 LYS 549 9.003 10.414 8.573
16 HZ3 LYS 549 HZ3 LYS 549 9.522 10.070 6.996
17 H TYR 550 HN TYR 550 9.000 7.070 4.229
18 HA TYR 550 HA TYR 550 8.273 4.770 2.551
19 HB2 TYR 550 HB2 TYR 550 10.557 4.784 1.730
20 HB3 TYR 550 HB3 TYR 550 9.897 6.407 1.566
21 HD1 TYR 550 HD1 TYR 550 12.322 4.306 3.325
22 HD2 TYR 550 HD2 TYR 550 10.734 8.233 2.941
23 HE1 TYR 550 HE1 TYR 550 14.223 5.188 4.613
24 HE2 TYR 550 HE2 TYR 550 12.623 9.131 4.233
25 HH TYR 550 HH TYR 550 15.251 7.023 5.384
26 H VAL 551 HN VAL 551 9.483 2.797 2.999
27 HA VAL 551 HA VAL 551 10.182 2.593 5.860
28 HB VAL 551 HB VAL 551 9.047 0.421 4.075
29 HG11 VAL 551 HG11 VAL 551 8.807 -0.866 6.149
30 HG12 VAL 551 HG12 VAL 551 9.589 0.434 7.048
31 HG13 VAL 551 HG13 VAL 551 10.494 -0.466 5.830
32 HG21 VAL 551 HG21 VAL 551 7.706 1.998 6.266
33 HG22 VAL 551 HG22 VAL 551 7.006 0.626 5.407
34 HG23 VAL 551 HG23 VAL 551 7.370 2.118 4.539
35 H VAL 552 HN VAL 552 12.130 1.780 6.343
36 HA VAL 552 HA VAL 552 14.080 1.557 4.303
37 HB VAL 552 HB VAL 552 14.321 0.618 7.169
38 HG11 VAL 552 HG11 VAL 552 16.115 -0.201 5.751
39 HG12 VAL 552 HG12 VAL 552 16.724 1.038 6.849
40 HG13 VAL 552 HG13 VAL 552 16.420 1.433 5.157
41 HG21 VAL 552 HG21 VAL 552 14.898 3.342 6.008
42 HG22 VAL 552 HG22 VAL 552 15.249 2.832 7.659
43 HG23 VAL 552 HG23 VAL 552 13.578 2.936 7.105
44 H VAL 553 HN VAL 553 14.794 -0.175 3.202
45 HA VAL 553 HA VAL 553 13.203 -2.476 3.059
46 HB VAL 553 HB VAL 553 16.066 -2.176 2.134
47 HG11 VAL 553 HG11 VAL 553 15.542 -3.973 0.569
48 HG12 VAL 553 HG12 VAL 553 13.922 -4.106 1.253
49 HG13 VAL 553 HG13 VAL 553 15.328 -4.505 2.238
50 HG21 VAL 553 HG21 VAL 553 15.126 -1.590 -0.036
51 HG22 VAL 553 HG22 VAL 553 14.608 -0.446 1.203
52 HG23 VAL 553 HG23 VAL 553 13.497 -1.689 0.632
53 HA PRO 554 HA PRO 554 14.560 -4.495 6.765
54 HB2 PRO 554 HB2 PRO 554 13.260 -6.828 5.501
55 HB3 PRO 554 HB3 PRO 554 12.936 -6.070 7.062
56 HG2 PRO 554 HG2 PRO 554 11.262 -5.802 4.974
57 HG3 PRO 554 HG3 PRO 554 11.508 -4.508 6.161
58 HD2 PRO 554 HD2 PRO 554 12.545 -4.746 3.374
59 HD3 PRO 554 HD3 PRO 554 12.067 -3.304 4.288
60 H GLU 555 HN GLU 555 16.358 -5.565 7.241
61 HA GLU 555 HA GLU 555 18.021 -6.612 5.149
62 HB2 GLU 555 HB2 GLU 555 19.625 -7.066 6.983
63 HB3 GLU 555 HB3 GLU 555 19.044 -5.406 6.994
64 HG2 GLU 555 HG2 GLU 555 17.406 -6.065 8.743
65 HG3 GLU 555 HG3 GLU 555 18.182 -7.647 8.803
66 H THR 556 HN THR 556 15.743 -7.850 7.377
67 HA THR 556 HA THR 556 16.553 -10.612 7.033
68 HB THR 556 HB THR 556 14.476 -11.034 8.437
69 HG1 THR 556 HG1 THR 556 14.155 -8.753 9.600
70 HG21 THR 556 HG21 THR 556 16.639 -9.255 9.562
71 HG22 THR 556 HG22 THR 556 16.699 -11.013 9.424
72 HG23 THR 556 HG23 THR 556 15.541 -10.251 10.516
73 H SER 557 HN SER 557 15.057 -8.465 5.127
74 HA SER 557 HA SER 557 13.121 -10.369 4.035
75 HB2 SER 557 HB2 SER 557 12.461 -7.949 4.344
76 HB3 SER 557 HB3 SER 557 13.651 -7.533 3.109
77 HG SER 557 HG SER 557 12.208 -8.042 1.690
78 H GLN 558 HN GLN 558 13.717 -11.651 2.433
79 HA GLN 558 HA GLN 558 16.373 -11.570 1.435
80 HB2 GLN 558 HB2 GLN 558 14.029 -13.252 0.514
81 HB3 GLN 558 HB3 GLN 558 15.720 -13.545 0.135
82 HG2 GLN 558 HG2 GLN 558 14.448 -13.657 2.859
83 HG3 GLN 558 HG3 GLN 558 15.012 -15.023 1.896
84 HE21 GLN 558 HE21 GLN 558 15.768 -14.079 4.583
85 HE22 GLN 558 HE22 GLN 558 17.486 -13.856 4.528
86 H ASP 559 HN ASP 559 17.189 -10.923 -0.442
87 HA ASP 559 HA ASP 559 17.418 -10.046 -2.513
88 HB2 ASP 559 HB2 ASP 559 14.575 -10.985 -2.743
89 HB3 ASP 559 HB3 ASP 559 15.387 -10.154 -4.067
90 H MET 560 HN MET 560 15.813 -8.645 -0.134
91 HA MET 560 HA MET 560 15.202 -6.526 0.374
92 HB2 MET 560 HB2 MET 560 16.860 -5.978 -2.083
93 HB3 MET 560 HB3 MET 560 16.172 -4.699 -1.091
94 HG2 MET 560 HG2 MET 560 18.428 -4.985 -0.423
95 HG3 MET 560 HG3 MET 560 17.412 -5.643 0.854
96 HE1 MET 560 HE1 MET 560 18.403 -7.197 -2.618
97 HE2 MET 560 HE2 MET 560 19.774 -8.208 -2.166
98 HE3 MET 560 HE3 MET 560 19.903 -6.451 -2.069
99 H ALA 561 HN ALA 561 13.423 -8.116 -1.323
100 HA ALA 561 HA ALA 561 11.794 -5.942 -2.377
101 HB1 ALA 561 HB1 ALA 561 13.144 -6.727 -4.273
102 HB2 ALA 561 HB2 ALA 561 11.429 -7.076 -4.497
103 HB3 ALA 561 HB3 ALA 561 12.538 -8.361 -4.018
104 H PHE 562 HN PHE 562 9.564 -6.500 -2.607
105 HA PHE 562 HA PHE 562 8.800 -9.180 -1.724
106 HB2 PHE 562 HB2 PHE 562 7.188 -8.455 -0.141
107 HB3 PHE 562 HB3 PHE 562 8.664 -7.590 0.252
108 HD1 PHE 562 HD1 PHE 562 5.203 -7.294 -0.785
109 HD2 PHE 562 HD2 PHE 562 8.861 -5.192 -0.276
110 HE1 PHE 562 HE1 PHE 562 3.992 -5.150 -0.901
111 HE2 PHE 562 HE2 PHE 562 7.662 -3.053 -0.385
112 HZ PHE 562 HZ PHE 562 5.117 -3.087 -0.557
113 H LYS 563 HN LYS 563 6.439 -9.583 -2.188
114 HA LYS 563 HA LYS 563 5.835 -8.378 -4.797
115 HB2 LYS 563 HB2 LYS 563 6.178 -10.848 -4.666
116 HB3 LYS 563 HB3 LYS 563 4.789 -10.949 -3.596
117 HG2 LYS 563 HG2 LYS 563 4.038 -11.564 -5.749
118 HG3 LYS 563 HG3 LYS 563 3.423 -9.935 -5.440
119 HD2 LYS 563 HD2 LYS 563 5.022 -8.947 -6.861
120 HD3 LYS 563 HD3 LYS 563 5.987 -10.424 -6.929
121 HE2 LYS 563 HE2 LYS 563 3.181 -10.234 -7.990
122 HE3 LYS 563 HE3 LYS 563 4.608 -9.913 -8.971
123 HZ1 LYS 563 HZ1 LYS 563 3.739 -12.211 -9.150
124 HZ2 LYS 563 HZ2 LYS 563 4.152 -12.465 -7.529
125 HZ3 LYS 563 HZ3 LYS 563 5.361 -12.125 -8.671
126 H CYS 564 HN CYS 564 4.139 -7.049 -4.977
127 HA CYS 564 HA CYS 564 2.455 -6.539 -2.679
128 HB2 CYS 564 HB2 CYS 564 3.310 -4.727 -4.126
129 HB3 CYS 564 HB3 CYS 564 2.419 -5.398 -5.482
130 HA PRO 565 HA PRO 565 -0.249 -9.783 -4.121
131 HB2 PRO 565 HB2 PRO 565 -2.031 -9.697 -2.077
132 HB3 PRO 565 HB3 PRO 565 -0.431 -10.426 -1.929
133 HG2 PRO 565 HG2 PRO 565 -1.372 -7.739 -1.035
134 HG3 PRO 565 HG3 PRO 565 -0.293 -8.888 -0.220
135 HD2 PRO 565 HD2 PRO 565 0.593 -6.696 -1.575
136 HD3 PRO 565 HD3 PRO 565 1.543 -8.183 -1.396
137 H ILE 566 HN ILE 566 -1.403 -6.546 -3.379
138 HA ILE 566 HA ILE 566 -4.115 -7.045 -4.108
139 HB ILE 566 HB ILE 566 -2.722 -4.376 -3.884
140 HG12 ILE 566 HG12 ILE 566 -4.143 -6.041 -1.794
141 HG13 ILE 566 HG13 ILE 566 -2.429 -5.639 -1.831
142 HG21 ILE 566 HG21 ILE 566 -5.643 -5.117 -3.711
143 HG22 ILE 566 HG22 ILE 566 -4.864 -4.249 -5.034
144 HG23 ILE 566 HG23 ILE 566 -4.978 -3.506 -3.438
145 HD11 ILE 566 HD11 ILE 566 -2.984 -3.284 -1.504
146 HD12 ILE 566 HD12 ILE 566 -3.597 -4.299 -0.197
147 HD13 ILE 566 HD13 ILE 566 -4.697 -3.703 -1.440
148 H CYS 567 HN CYS 567 -1.310 -5.782 -5.815
149 HA CYS 567 HA CYS 567 -2.936 -5.648 -8.255
150 HB2 CYS 567 HB2 CYS 567 -1.662 -3.655 -8.954
151 HB3 CYS 567 HB3 CYS 567 -2.554 -3.376 -7.457
152 H LYS 568 HN LYS 568 -0.481 -7.186 -6.777
153 HA LYS 568 HA LYS 568 1.020 -8.717 -7.473
154 HB2 LYS 568 HB2 LYS 568 -0.128 -8.210 -10.216
155 HB3 LYS 568 HB3 LYS 568 0.917 -9.556 -9.779
156 HG2 LYS 568 HG2 LYS 568 -0.776 -10.385 -8.232
157 HG3 LYS 568 HG3 LYS 568 -1.816 -9.017 -8.634
158 HD2 LYS 568 HD2 LYS 568 -2.536 -10.959 -9.859
159 HD3 LYS 568 HD3 LYS 568 -1.848 -9.783 -10.980
160 HE2 LYS 568 HE2 LYS 568 -1.086 -12.011 -11.536
161 HE3 LYS 568 HE3 LYS 568 0.267 -11.031 -10.972
162 HZ1 LYS 568 HZ1 LYS 568 0.224 -12.123 -8.880
163 HZ2 LYS 568 HZ2 LYS 568 0.171 -13.335 -10.069
164 HZ3 LYS 568 HZ3 LYS 568 -1.237 -12.905 -9.229
165 H GLU 569 HN GLU 569 1.685 -5.810 -7.467
166 HA GLU 569 HA GLU 569 3.744 -5.515 -9.462
167 HB2 GLU 569 HB2 GLU 569 3.193 -3.979 -6.919
168 HB3 GLU 569 HB3 GLU 569 4.452 -3.560 -8.067
169 HG2 GLU 569 HG2 GLU 569 2.821 -3.066 -9.753
170 HG3 GLU 569 HG3 GLU 569 1.522 -3.655 -8.712
171 H THR 570 HN THR 570 5.854 -6.105 -9.265
172 HA THR 570 HA THR 570 6.723 -7.376 -6.799
173 HB THR 570 HB THR 570 8.275 -6.863 -9.358
174 HG1 THR 570 HG1 THR 570 6.746 -8.299 -9.959
175 HG21 THR 570 HG21 THR 570 9.715 -7.253 -7.423
176 HG22 THR 570 HG22 THR 570 9.771 -8.627 -8.527
177 HG23 THR 570 HG23 THR 570 8.823 -8.727 -7.044
178 H VAL 571 HN VAL 571 7.623 -6.145 -5.209
179 HA VAL 571 HA VAL 571 8.229 -3.362 -5.907
180 HB VAL 571 HB VAL 571 7.936 -4.517 -3.141
181 HG11 VAL 571 HG11 VAL 571 7.696 -1.681 -4.154
182 HG12 VAL 571 HG12 VAL 571 9.065 -2.353 -3.269
183 HG13 VAL 571 HG13 VAL 571 7.493 -2.208 -2.483
184 HG21 VAL 571 HG21 VAL 571 5.625 -3.762 -3.145
185 HG22 VAL 571 HG22 VAL 571 5.894 -4.960 -4.412
186 HG23 VAL 571 HG23 VAL 571 5.778 -3.249 -4.824
187 H THR 572 HN THR 572 10.277 -2.910 -6.251
188 HA THR 572 HA THR 572 12.335 -4.208 -4.605
189 HB THR 572 HB THR 572 13.923 -3.316 -6.368
190 HG1 THR 572 HG1 THR 572 13.112 -2.146 -7.935
191 HG21 THR 572 HG21 THR 572 13.427 -5.090 -7.989
192 HG22 THR 572 HG22 THR 572 11.813 -5.270 -7.298
193 HG23 THR 572 HG23 THR 572 13.236 -5.667 -6.335
194 H GLY 573 HN GLY 573 14.113 -2.752 -3.887
195 HA2 GLY 573 HA2 GLY 573 13.173 0.025 -3.589
196 HA3 GLY 573 HA3 GLY 573 13.734 -0.897 -2.200
197 H VAL 574 HN VAL 574 14.794 1.552 -3.077
198 HA VAL 574 HA VAL 574 17.406 0.787 -4.210
199 HB VAL 574 HB VAL 574 16.099 3.523 -4.246
200 HG11 VAL 574 HG11 VAL 574 18.511 2.499 -5.743
201 HG12 VAL 574 HG12 VAL 574 18.556 3.561 -4.336
202 HG13 VAL 574 HG13 VAL 574 17.828 4.123 -5.840
203 HG21 VAL 574 HG21 VAL 574 16.310 1.512 -6.478
204 HG22 VAL 574 HG22 VAL 574 15.665 3.147 -6.608
205 HG23 VAL 574 HG23 VAL 574 14.835 1.948 -5.617
206 H TYR 575 HN TYR 575 19.264 1.774 -3.273
207 HA TYR 575 HA TYR 575 18.967 2.352 -0.458
208 HB2 TYR 575 HB2 TYR 575 20.813 0.905 -1.303
209 HB3 TYR 575 HB3 TYR 575 21.478 2.305 -2.138
210 HD1 TYR 575 HD1 TYR 575 23.224 3.395 -1.074
211 HD2 TYR 575 HD2 TYR 575 20.309 1.408 1.299
212 HE1 TYR 575 HE1 TYR 575 24.477 3.994 0.957
213 HE2 TYR 575 HE2 TYR 575 21.550 2.000 3.339
214 HH TYR 575 HH TYR 575 23.868 2.596 3.983
215 H ASP 576 HN ASP 576 18.654 4.327 0.283
216 HA ASP 576 HA ASP 576 19.176 6.642 -1.420
217 HB2 ASP 576 HB2 ASP 576 17.014 6.443 -0.190
218 HB3 ASP 576 HB3 ASP 576 17.896 6.477 1.330
219 H GLU 577 HN GLU 577 21.284 7.058 -1.411
220 HA GLU 577 HA GLU 577 23.033 6.427 0.704
221 HB2 GLU 577 HB2 GLU 577 23.506 8.269 -1.645
222 HB3 GLU 577 HB3 GLU 577 24.747 7.526 -0.645
223 HG2 GLU 577 HG2 GLU 577 23.971 5.302 -1.389
224 HG3 GLU 577 HG3 GLU 577 22.806 6.092 -2.446
225 H GLU 578 HN GLU 578 21.111 9.224 0.091
226 HA GLU 578 HA GLU 578 22.753 11.083 1.518
227 HB2 GLU 578 HB2 GLU 578 20.986 11.617 -0.252
228 HB3 GLU 578 HB3 GLU 578 19.794 11.346 1.010
229 HG2 GLU 578 HG2 GLU 578 20.220 13.692 0.819
230 HG3 GLU 578 HG3 GLU 578 20.867 13.109 2.353
231 H SER 579 HN SER 579 19.758 9.302 2.280
232 HA SER 579 HA SER 579 19.899 10.112 5.058
233 HB2 SER 579 HB2 SER 579 17.867 8.700 5.315
234 HB3 SER 579 HB3 SER 579 17.707 9.894 4.025
235 HG SER 579 HG SER 579 18.144 8.264 2.521
236 H GLY 580 HN GLY 580 21.040 7.535 3.116
237 HA2 GLY 580 HA2 GLY 580 22.574 5.899 3.696
238 HA3 GLY 580 HA3 GLY 580 22.408 6.367 5.379
239 H GLU 581 HN GLU 581 19.562 5.690 3.526
240 HA GLU 581 HA GLU 581 19.320 3.063 4.835
241 HB2 GLU 581 HB2 GLU 581 17.085 5.081 4.583
242 HB3 GLU 581 HB3 GLU 581 17.017 3.523 5.398
243 HG2 GLU 581 HG2 GLU 581 18.655 4.339 7.035
244 HG3 GLU 581 HG3 GLU 581 18.656 5.908 6.228
245 H TRP 582 HN TRP 582 18.253 1.500 3.690
246 HA TRP 582 HA TRP 582 17.704 1.846 0.911
247 HB2 TRP 582 HB2 TRP 582 16.900 -0.328 2.854
248 HB3 TRP 582 HB3 TRP 582 16.635 -0.406 1.116
249 HD1 TRP 582 HD1 TRP 582 19.450 -0.590 3.717
250 HE1 TRP 582 HE1 TRP 582 21.516 -1.675 2.601
251 HE3 TRP 582 HE3 TRP 582 17.746 -0.772 -1.094
252 HZ2 TRP 582 HZ2 TRP 582 22.294 -2.500 0.006
253 HZ3 TRP 582 HZ3 TRP 582 19.201 -1.727 -2.833
254 HH2 TRP 582 HH2 TRP 582 21.424 -2.571 -2.293
255 H VAL 583 HN VAL 583 15.633 2.056 -0.082
256 HA VAL 583 HA VAL 583 13.553 2.870 1.841
257 HB VAL 583 HB VAL 583 12.850 4.636 0.341
258 HG11 VAL 583 HG11 VAL 583 15.799 4.733 0.949
259 HG12 VAL 583 HG12 VAL 583 14.487 5.194 2.035
260 HG13 VAL 583 HG13 VAL 583 14.786 6.128 0.569
261 HG21 VAL 583 HG21 VAL 583 14.117 5.235 -1.637
262 HG22 VAL 583 HG22 VAL 583 13.524 3.578 -1.771
263 HG23 VAL 583 HG23 VAL 583 15.214 3.877 -1.367
264 H TRP 584 HN TRP 584 11.664 1.905 1.674
265 HA TRP 584 HA TRP 584 10.697 1.093 -0.988
266 HB2 TRP 584 HB2 TRP 584 9.893 0.277 1.807
267 HB3 TRP 584 HB3 TRP 584 8.812 0.027 0.443
268 HD1 TRP 584 HD1 TRP 584 11.887 -0.644 -1.142
269 HE1 TRP 584 HE1 TRP 584 12.558 -3.109 -1.071
270 HE3 TRP 584 HE3 TRP 584 8.783 -2.186 2.594
271 HZ2 TRP 584 HZ2 TRP 584 11.846 -5.434 0.382
272 HZ3 TRP 584 HZ3 TRP 584 8.833 -4.550 3.266
273 HH2 TRP 584 HH2 TRP 584 10.331 -6.139 2.188
274 H LYS 585 HN LYS 585 9.749 2.850 -1.900
275 HA LYS 585 HA LYS 585 8.498 4.873 -0.238
276 HB2 LYS 585 HB2 LYS 585 8.573 4.796 -3.259
277 HB3 LYS 585 HB3 LYS 585 8.290 6.187 -2.220
278 HG2 LYS 585 HG2 LYS 585 10.899 4.698 -2.196
279 HG3 LYS 585 HG3 LYS 585 10.564 5.998 -3.337
280 HD2 LYS 585 HD2 LYS 585 10.029 7.461 -1.354
281 HD3 LYS 585 HD3 LYS 585 10.666 6.170 -0.329
282 HE2 LYS 585 HE2 LYS 585 12.823 6.323 -1.424
283 HE3 LYS 585 HE3 LYS 585 12.198 7.524 -2.551
284 HZ1 LYS 585 HZ1 LYS 585 11.748 8.928 -0.518
285 HZ2 LYS 585 HZ2 LYS 585 13.379 8.707 -0.930
286 HZ3 LYS 585 HZ3 LYS 585 12.708 7.834 0.352
287 H ASN 586 HN ASN 586 6.332 5.599 -0.499
288 HA ASN 586 HA ASN 586 4.104 5.175 -0.251
289 HB2 ASN 586 HB2 ASN 586 4.487 3.832 -2.952
290 HB3 ASN 586 HB3 ASN 586 2.945 4.266 -2.243
291 HD21 ASN 586 HD21 ASN 586 2.345 5.645 -3.847
292 HD22 ASN 586 HD22 ASN 586 3.122 7.168 -4.141
293 H THR 587 HN THR 587 5.552 3.467 1.238
294 HA THR 587 HA THR 587 4.154 0.904 0.876
295 HB THR 587 HB THR 587 6.996 1.261 1.853
296 HG1 THR 587 HG1 THR 587 6.460 1.461 -0.499
297 HG21 THR 587 HG21 THR 587 5.387 -1.257 1.380
298 HG22 THR 587 HG22 THR 587 5.880 -0.627 2.952
299 HG23 THR 587 HG23 THR 587 7.096 -1.195 1.808
300 H ILE 588 HN ILE 588 3.312 -0.034 2.678
301 HA ILE 588 HA ILE 588 3.814 1.238 5.280
302 HB ILE 588 HB ILE 588 1.720 2.200 4.373
303 HG12 ILE 588 HG12 ILE 588 1.265 0.271 6.661
304 HG13 ILE 588 HG13 ILE 588 1.960 1.882 6.801
305 HG21 ILE 588 HG21 ILE 588 0.749 -0.657 4.317
306 HG22 ILE 588 HG22 ILE 588 1.033 0.386 2.923
307 HG23 ILE 588 HG23 ILE 588 -0.256 0.770 4.062
308 HD11 ILE 588 HD11 ILE 588 -0.146 2.859 6.064
309 HD12 ILE 588 HD12 ILE 588 -0.368 1.845 7.489
310 HD13 ILE 588 HD13 ILE 588 -0.842 1.246 5.900
311 H GLU 589 HN GLU 589 3.705 -0.195 7.014
312 HA GLU 589 HA GLU 589 3.407 -3.021 6.305
313 HB2 GLU 589 HB2 GLU 589 5.494 -2.417 7.460
314 HB3 GLU 589 HB3 GLU 589 4.568 -1.742 8.796
315 HG2 GLU 589 HG2 GLU 589 3.671 -3.961 9.285
316 HG3 GLU 589 HG3 GLU 589 4.599 -4.629 7.940
317 H VAL 590 HN VAL 590 1.571 -4.003 6.785
318 HA VAL 590 HA VAL 590 -0.094 -2.904 8.954
319 HB VAL 590 HB VAL 590 -1.103 -4.124 6.373
320 HG11 VAL 590 HG11 VAL 590 -3.306 -3.384 7.164
321 HG12 VAL 590 HG12 VAL 590 -2.574 -2.865 8.682
322 HG13 VAL 590 HG13 VAL 590 -2.573 -4.572 8.241
323 HG21 VAL 590 HG21 VAL 590 -0.176 -1.944 5.930
324 HG22 VAL 590 HG22 VAL 590 -1.062 -1.250 7.287
325 HG23 VAL 590 HG23 VAL 590 -1.936 -1.852 5.878
326 H ASN 591 HN ASN 591 -0.245 -4.298 10.533
327 HA ASN 591 HA ASN 591 -0.393 -6.200 11.750
328 HB2 ASN 591 HB2 ASN 591 -2.432 -6.410 10.190
329 HB3 ASN 591 HB3 ASN 591 -1.471 -7.592 9.303
330 HD21 ASN 591 HD21 ASN 591 -2.696 -9.345 9.775
331 HD22 ASN 591 HD22 ASN 591 -2.858 -10.000 11.369
332 H GLY 592 HN GLY 592 2.057 -5.674 10.451
333 HA2 GLY 592 HA2 GLY 592 4.091 -6.786 10.612
334 HA3 GLY 592 HA3 GLY 592 3.221 -8.306 10.725
335 H LYS 593 HN LYS 593 1.983 -6.733 8.093
336 HA LYS 593 HA LYS 593 3.925 -8.056 6.318
337 HB2 LYS 593 HB2 LYS 593 0.932 -7.792 5.996
338 HB3 LYS 593 HB3 LYS 593 2.010 -8.444 4.770
339 HG2 LYS 593 HG2 LYS 593 2.631 -10.264 6.268
340 HG3 LYS 593 HG3 LYS 593 1.590 -9.590 7.524
341 HD2 LYS 593 HD2 LYS 593 -0.356 -9.902 6.060
342 HD3 LYS 593 HD3 LYS 593 0.696 -10.600 4.823
343 HE2 LYS 593 HE2 LYS 593 -0.431 -12.352 6.093
344 HE3 LYS 593 HE3 LYS 593 1.309 -12.399 6.365
345 HZ1 LYS 593 HZ1 LYS 593 -0.629 -11.110 8.209
346 HZ2 LYS 593 HZ2 LYS 593 1.029 -11.351 8.483
347 HZ3 LYS 593 HZ3 LYS 593 -0.023 -12.680 8.412
348 H TYR 594 HN TYR 594 4.380 -7.061 4.309
349 HA TYR 594 HA TYR 594 4.101 -4.161 4.456
350 HB2 TYR 594 HB2 TYR 594 5.950 -5.874 2.788
351 HB3 TYR 594 HB3 TYR 594 5.964 -4.112 2.843
352 HD1 TYR 594 HD1 TYR 594 6.548 -2.971 5.005
353 HD2 TYR 594 HD2 TYR 594 7.057 -7.152 4.431
354 HE1 TYR 594 HE1 TYR 594 8.100 -3.038 6.907
355 HE2 TYR 594 HE2 TYR 594 8.608 -7.233 6.331
356 HH TYR 594 HH TYR 594 10.133 -5.630 7.519
357 H PHE 595 HN PHE 595 3.098 -2.980 2.994
358 HA PHE 595 HA PHE 595 2.276 -4.138 0.432
359 HB2 PHE 595 HB2 PHE 595 0.345 -2.724 2.305
360 HB3 PHE 595 HB3 PHE 595 -0.021 -3.317 0.692
361 HD1 PHE 595 HD1 PHE 595 -0.335 -5.680 0.269
362 HD2 PHE 595 HD2 PHE 595 0.470 -4.224 4.186
363 HE1 PHE 595 HE1 PHE 595 -1.106 -7.813 1.219
364 HE2 PHE 595 HE2 PHE 595 -0.288 -6.361 5.138
365 HZ PHE 595 HZ PHE 595 -1.078 -8.157 3.647
366 H HIS 596 HN HIS 596 1.917 -2.491 -1.186
367 HA HIS 596 HA HIS 596 2.997 0.094 -0.779
368 HB2 HIS 596 HB2 HIS 596 1.088 -1.045 -2.822
369 HB3 HIS 596 HB3 HIS 596 1.488 0.664 -2.817
370 HD2 HIS 596 HD2 HIS 596 4.676 0.521 -2.482
371 HE1 HIS 596 HE1 HIS 596 4.495 -1.906 -5.938
372 HE2 HIS 596 HE2 HIS 596 5.894 -0.241 -4.635
373 H SER 597 HN SER 597 2.120 1.807 0.246
374 HA SER 597 HA SER 597 -0.312 1.544 1.678
375 HB2 SER 597 HB2 SER 597 0.066 4.050 2.114
376 HB3 SER 597 HB3 SER 597 1.310 2.937 2.679
377 HG SER 597 HG SER 597 2.219 4.717 1.582
378 H THR 598 HN THR 598 0.588 3.031 -1.337
379 HA THR 598 HA THR 598 -1.798 4.341 -1.962
380 HB THR 598 HB THR 598 0.208 2.963 -3.777
381 HG1 THR 598 HG1 THR 598 -0.055 5.655 -2.888
382 HG21 THR 598 HG21 THR 598 -1.904 3.366 -4.971
383 HG22 THR 598 HG22 THR 598 -0.626 4.432 -5.551
384 HG23 THR 598 HG23 THR 598 -1.868 5.055 -4.465
385 H CYS 599 HN CYS 599 -0.788 0.987 -2.449
386 HA CYS 599 HA CYS 599 -3.196 0.214 -3.779
387 HB2 CYS 599 HB2 CYS 599 -1.025 -1.474 -2.527
388 HB3 CYS 599 HB3 CYS 599 -2.317 -2.077 -3.560
389 H TYR 600 HN TYR 600 -2.083 0.230 -0.449
390 HA TYR 600 HA TYR 600 -4.002 -1.469 0.677
391 HB2 TYR 600 HB2 TYR 600 -2.054 -0.620 1.921
392 HB3 TYR 600 HB3 TYR 600 -2.735 1.001 1.888
393 HD1 TYR 600 HD1 TYR 600 -4.240 1.704 3.549
394 HD2 TYR 600 HD2 TYR 600 -3.318 -2.435 3.180
395 HE1 TYR 600 HE1 TYR 600 -5.438 1.257 5.652
396 HE2 TYR 600 HE2 TYR 600 -4.515 -2.890 5.282
397 HH TYR 600 HH TYR 600 -5.187 -1.678 7.323
398 H HIS 601 HN HIS 601 -4.137 1.911 -0.251
399 HA HIS 601 HA HIS 601 -6.744 2.412 0.787
400 HB2 HIS 601 HB2 HIS 601 -5.142 4.217 0.313
401 HB3 HIS 601 HB3 HIS 601 -5.211 3.829 -1.402
402 HD2 HIS 601 HD2 HIS 601 -7.378 4.802 -2.773
403 HE1 HIS 601 HE1 HIS 601 -9.060 6.862 0.517
404 HE2 HIS 601 HE2 HIS 601 -9.300 6.362 -1.958
405 H GLU 602 HN GLU 602 -5.491 1.071 -2.164
406 HA GLU 602 HA GLU 602 -7.747 1.270 -3.822
407 HB2 GLU 602 HB2 GLU 602 -5.946 0.637 -5.053
408 HB3 GLU 602 HB3 GLU 602 -5.229 -0.258 -3.727
409 HG2 GLU 602 HG2 GLU 602 -5.640 -1.875 -5.323
410 HG3 GLU 602 HG3 GLU 602 -7.001 -2.037 -4.218
411 H THR 603 HN THR 603 -6.866 -1.086 -1.357
412 HA THR 603 HA THR 603 -9.172 -2.744 -1.997
413 HB THR 603 HB THR 603 -6.980 -3.801 -1.407
414 HG1 THR 603 HG1 THR 603 -9.265 -4.366 0.202
415 HG21 THR 603 HG21 THR 603 -6.274 -2.288 0.373
416 HG22 THR 603 HG22 THR 603 -6.355 -3.947 0.967
417 HG23 THR 603 HG23 THR 603 -7.636 -2.802 1.368
Start of MODEL 12
1 H GLY 548 HN GLY 548 3.222 9.532 0.975
2 HA2 GLY 548 HA2 GLY 548 4.797 9.252 -0.798
3 HA3 GLY 548 HA3 GLY 548 5.396 10.873 -0.472
4 H LYS 549 HN LYS 549 4.853 9.119 2.343
5 HA LYS 549 HA LYS 549 7.567 9.081 3.090
6 HB2 LYS 549 HB2 LYS 549 5.160 7.674 4.238
7 HB3 LYS 549 HB3 LYS 549 6.760 7.575 4.958
8 HG2 LYS 549 HG2 LYS 549 5.248 10.142 4.511
9 HG3 LYS 549 HG3 LYS 549 5.264 9.238 6.026
10 HD2 LYS 549 HD2 LYS 549 7.816 9.441 5.907
11 HD3 LYS 549 HD3 LYS 549 7.536 10.666 4.668
12 HE2 LYS 549 HE2 LYS 549 6.174 11.946 6.256
13 HE3 LYS 549 HE3 LYS 549 6.461 10.718 7.490
14 HZ1 LYS 549 HZ1 LYS 549 8.450 12.547 6.253
15 HZ2 LYS 549 HZ2 LYS 549 8.891 11.208 7.192
16 HZ3 LYS 549 HZ3 LYS 549 7.982 12.459 7.884
17 H TYR 550 HN TYR 550 8.982 7.375 3.391
18 HA TYR 550 HA TYR 550 8.371 4.938 1.873
19 HB2 TYR 550 HB2 TYR 550 10.629 4.851 1.069
20 HB3 TYR 550 HB3 TYR 550 10.004 6.456 0.718
21 HD1 TYR 550 HD1 TYR 550 12.478 4.533 2.558
22 HD2 TYR 550 HD2 TYR 550 10.794 8.400 2.019
23 HE1 TYR 550 HE1 TYR 550 14.409 5.530 3.708
24 HE2 TYR 550 HE2 TYR 550 12.717 9.407 3.164
25 HH TYR 550 HH TYR 550 14.439 8.668 4.852
26 H VAL 551 HN VAL 551 9.565 3.047 2.591
27 HA VAL 551 HA VAL 551 10.311 3.208 5.443
28 HB VAL 551 HB VAL 551 9.120 0.836 3.985
29 HG11 VAL 551 HG11 VAL 551 8.978 -0.203 6.199
30 HG12 VAL 551 HG12 VAL 551 9.763 1.205 6.912
31 HG13 VAL 551 HG13 VAL 551 10.649 0.182 5.782
32 HG21 VAL 551 HG21 VAL 551 7.162 1.216 5.492
33 HG22 VAL 551 HG22 VAL 551 7.396 2.463 4.269
34 HG23 VAL 551 HG23 VAL 551 7.880 2.765 5.939
35 H VAL 552 HN VAL 552 12.268 2.428 5.975
36 HA VAL 552 HA VAL 552 14.177 2.046 3.912
37 HB VAL 552 HB VAL 552 14.492 1.466 6.868
38 HG11 VAL 552 HG11 VAL 552 16.268 0.512 5.507
39 HG12 VAL 552 HG12 VAL 552 16.876 1.870 6.454
40 HG13 VAL 552 HG13 VAL 552 16.535 2.073 4.734
41 HG21 VAL 552 HG21 VAL 552 13.703 3.742 6.517
42 HG22 VAL 552 HG22 VAL 552 14.988 4.019 5.342
43 HG23 VAL 552 HG23 VAL 552 15.390 3.743 7.037
44 H VAL 553 HN VAL 553 15.026 0.232 3.083
45 HA VAL 553 HA VAL 553 13.488 -2.101 3.103
46 HB VAL 553 HB VAL 553 16.363 -1.802 2.244
47 HG11 VAL 553 HG11 VAL 553 15.797 -4.130 2.524
48 HG12 VAL 553 HG12 VAL 553 15.887 -3.750 0.804
49 HG13 VAL 553 HG13 VAL 553 14.317 -3.913 1.591
50 HG21 VAL 553 HG21 VAL 553 14.934 -0.237 1.079
51 HG22 VAL 553 HG22 VAL 553 13.793 -1.527 0.692
52 HG23 VAL 553 HG23 VAL 553 15.409 -1.537 -0.014
53 HA PRO 554 HA PRO 554 14.717 -3.970 6.967
54 HB2 PRO 554 HB2 PRO 554 13.520 -6.345 5.655
55 HB3 PRO 554 HB3 PRO 554 13.131 -5.610 7.212
56 HG2 PRO 554 HG2 PRO 554 11.501 -5.348 5.107
57 HG3 PRO 554 HG3 PRO 554 11.735 -4.025 6.262
58 HD2 PRO 554 HD2 PRO 554 12.848 -4.360 3.511
59 HD3 PRO 554 HD3 PRO 554 12.306 -2.888 4.343
60 H GLU 555 HN GLU 555 16.361 -5.195 7.638
61 HA GLU 555 HA GLU 555 18.464 -5.874 5.913
62 HB2 GLU 555 HB2 GLU 555 18.751 -5.322 8.299
63 HB3 GLU 555 HB3 GLU 555 17.924 -6.805 8.743
64 HG2 GLU 555 HG2 GLU 555 20.281 -7.098 9.018
65 HG3 GLU 555 HG3 GLU 555 19.734 -8.097 7.671
66 H THR 556 HN THR 556 15.885 -7.805 7.331
67 HA THR 556 HA THR 556 17.007 -10.251 6.216
68 HB THR 556 HB THR 556 15.103 -11.333 7.490
69 HG1 THR 556 HG1 THR 556 13.706 -10.053 8.432
70 HG21 THR 556 HG21 THR 556 17.033 -9.654 9.099
71 HG22 THR 556 HG22 THR 556 17.411 -11.206 8.352
72 HG23 THR 556 HG23 THR 556 16.215 -11.120 9.645
73 H SER 557 HN SER 557 16.115 -8.533 4.239
74 HA SER 557 HA SER 557 13.548 -9.701 3.418
75 HB2 SER 557 HB2 SER 557 13.441 -7.807 1.796
76 HB3 SER 557 HB3 SER 557 13.471 -7.281 3.478
77 HG SER 557 HG SER 557 15.457 -6.498 3.229
78 H GLN 558 HN GLN 558 13.556 -11.188 1.885
79 HA GLN 558 HA GLN 558 15.940 -12.062 0.637
80 HB2 GLN 558 HB2 GLN 558 13.072 -12.669 -0.119
81 HB3 GLN 558 HB3 GLN 558 14.489 -13.581 -0.624
82 HG2 GLN 558 HG2 GLN 558 14.920 -14.242 1.666
83 HG3 GLN 558 HG3 GLN 558 13.569 -13.259 2.226
84 HE21 GLN 558 HE21 GLN 558 14.022 -16.119 2.550
85 HE22 GLN 558 HE22 GLN 558 12.654 -16.903 1.824
86 H ASP 559 HN ASP 559 16.982 -11.006 -0.892
87 HA ASP 559 HA ASP 559 17.498 -9.796 -2.730
88 HB2 ASP 559 HB2 ASP 559 14.739 -10.702 -3.471
89 HB3 ASP 559 HB3 ASP 559 15.551 -9.501 -4.469
90 H MET 560 HN MET 560 15.897 -8.688 -0.308
91 HA MET 560 HA MET 560 15.187 -6.679 0.459
92 HB2 MET 560 HB2 MET 560 16.833 -5.750 -1.891
93 HB3 MET 560 HB3 MET 560 16.119 -4.644 -0.724
94 HG2 MET 560 HG2 MET 560 17.372 -5.775 1.071
95 HG3 MET 560 HG3 MET 560 18.143 -6.794 -0.146
96 HE1 MET 560 HE1 MET 560 20.939 -4.260 1.074
97 HE2 MET 560 HE2 MET 560 20.481 -5.961 0.972
98 HE3 MET 560 HE3 MET 560 19.609 -4.876 2.054
99 H ALA 561 HN ALA 561 13.369 -8.079 -1.177
100 HA ALA 561 HA ALA 561 11.746 -5.856 -2.155
101 HB1 ALA 561 HB1 ALA 561 12.947 -6.694 -4.108
102 HB2 ALA 561 HB2 ALA 561 11.219 -7.031 -4.219
103 HB3 ALA 561 HB3 ALA 561 12.339 -8.322 -3.785
104 H PHE 562 HN PHE 562 9.477 -6.451 -2.456
105 HA PHE 562 HA PHE 562 8.684 -9.080 -1.459
106 HB2 PHE 562 HB2 PHE 562 7.113 -8.289 0.141
107 HB3 PHE 562 HB3 PHE 562 8.609 -7.435 0.481
108 HD1 PHE 562 HD1 PHE 562 5.142 -7.114 -0.633
109 HD2 PHE 562 HD2 PHE 562 8.819 -5.062 0.016
110 HE1 PHE 562 HE1 PHE 562 3.962 -4.955 -0.767
111 HE2 PHE 562 HE2 PHE 562 7.650 -2.909 -0.123
112 HZ PHE 562 HZ PHE 562 5.105 -2.907 -0.432
113 H LYS 563 HN LYS 563 6.556 -9.687 -2.185
114 HA LYS 563 HA LYS 563 5.810 -8.291 -4.627
115 HB2 LYS 563 HB2 LYS 563 5.926 -10.707 -4.782
116 HB3 LYS 563 HB3 LYS 563 4.836 -10.889 -3.417
117 HG2 LYS 563 HG2 LYS 563 3.541 -11.320 -5.330
118 HG3 LYS 563 HG3 LYS 563 3.098 -9.695 -4.797
119 HD2 LYS 563 HD2 LYS 563 3.318 -9.508 -7.112
120 HD3 LYS 563 HD3 LYS 563 4.838 -8.873 -6.485
121 HE2 LYS 563 HE2 LYS 563 5.958 -10.951 -6.962
122 HE3 LYS 563 HE3 LYS 563 4.437 -11.701 -7.447
123 HZ1 LYS 563 HZ1 LYS 563 5.865 -9.494 -8.841
124 HZ2 LYS 563 HZ2 LYS 563 4.321 -10.036 -9.268
125 HZ3 LYS 563 HZ3 LYS 563 5.652 -11.084 -9.391
126 H CYS 564 HN CYS 564 4.205 -6.842 -4.711
127 HA CYS 564 HA CYS 564 2.459 -6.434 -2.453
128 HB2 CYS 564 HB2 CYS 564 3.267 -4.551 -3.825
129 HB3 CYS 564 HB3 CYS 564 2.441 -5.219 -5.226
130 HA PRO 565 HA PRO 565 -0.169 -9.730 -3.870
131 HB2 PRO 565 HB2 PRO 565 -1.946 -8.710 -1.731
132 HB3 PRO 565 HB3 PRO 565 -1.273 -10.325 -1.962
133 HG2 PRO 565 HG2 PRO 565 -0.319 -8.752 -0.054
134 HG3 PRO 565 HG3 PRO 565 0.777 -9.751 -1.028
135 HD2 PRO 565 HD2 PRO 565 0.153 -6.824 -1.286
136 HD3 PRO 565 HD3 PRO 565 1.730 -7.644 -1.335
137 H ILE 566 HN ILE 566 -1.449 -6.473 -3.316
138 HA ILE 566 HA ILE 566 -3.992 -7.044 -4.458
139 HB ILE 566 HB ILE 566 -2.707 -4.365 -3.899
140 HG12 ILE 566 HG12 ILE 566 -4.619 -6.049 -2.260
141 HG13 ILE 566 HG13 ILE 566 -2.913 -5.804 -1.901
142 HG21 ILE 566 HG21 ILE 566 -4.967 -3.470 -3.971
143 HG22 ILE 566 HG22 ILE 566 -5.611 -5.070 -4.339
144 HG23 ILE 566 HG23 ILE 566 -4.575 -4.247 -5.505
145 HD11 ILE 566 HD11 ILE 566 -3.320 -3.446 -1.514
146 HD12 ILE 566 HD12 ILE 566 -4.363 -4.438 -0.494
147 HD13 ILE 566 HD13 ILE 566 -5.019 -3.654 -1.933
148 H CYS 567 HN CYS 567 -1.002 -5.652 -5.745
149 HA CYS 567 HA CYS 567 -2.392 -5.347 -8.321
150 HB2 CYS 567 HB2 CYS 567 -0.774 -3.613 -8.918
151 HB3 CYS 567 HB3 CYS 567 -1.643 -3.197 -7.447
152 H LYS 568 HN LYS 568 -0.303 -7.332 -6.767
153 HA LYS 568 HA LYS 568 0.882 -9.128 -7.463
154 HB2 LYS 568 HB2 LYS 568 -0.200 -8.346 -10.169
155 HB3 LYS 568 HB3 LYS 568 0.690 -9.829 -9.852
156 HG2 LYS 568 HG2 LYS 568 -1.036 -10.581 -8.336
157 HG3 LYS 568 HG3 LYS 568 -1.905 -9.056 -8.533
158 HD2 LYS 568 HD2 LYS 568 -2.208 -9.527 -10.904
159 HD3 LYS 568 HD3 LYS 568 -1.310 -11.037 -10.729
160 HE2 LYS 568 HE2 LYS 568 -3.002 -11.917 -9.252
161 HE3 LYS 568 HE3 LYS 568 -3.870 -10.384 -9.277
162 HZ1 LYS 568 HZ1 LYS 568 -4.295 -10.672 -11.620
163 HZ2 LYS 568 HZ2 LYS 568 -4.865 -12.020 -10.762
164 HZ3 LYS 568 HZ3 LYS 568 -3.414 -12.123 -11.638
165 H GLU 569 HN GLU 569 1.951 -6.162 -7.832
166 HA GLU 569 HA GLU 569 4.227 -6.872 -9.532
167 HB2 GLU 569 HB2 GLU 569 2.992 -4.296 -8.699
168 HB3 GLU 569 HB3 GLU 569 4.718 -4.312 -9.035
169 HG2 GLU 569 HG2 GLU 569 2.602 -5.273 -10.944
170 HG3 GLU 569 HG3 GLU 569 3.322 -3.663 -10.966
171 H THR 570 HN THR 570 6.203 -7.148 -8.785
172 HA THR 570 HA THR 570 6.641 -7.382 -5.967
173 HB THR 570 HB THR 570 8.679 -7.436 -8.219
174 HG1 THR 570 HG1 THR 570 8.251 -9.569 -8.395
175 HG21 THR 570 HG21 THR 570 8.808 -8.603 -5.434
176 HG22 THR 570 HG22 THR 570 9.632 -7.135 -5.957
177 HG23 THR 570 HG23 THR 570 10.069 -8.692 -6.664
178 H VAL 571 HN VAL 571 7.402 -5.882 -4.614
179 HA VAL 571 HA VAL 571 8.197 -3.279 -5.688
180 HB VAL 571 HB VAL 571 7.759 -4.032 -2.797
181 HG11 VAL 571 HG11 VAL 571 7.755 -1.372 -4.222
182 HG12 VAL 571 HG12 VAL 571 9.008 -1.980 -3.139
183 HG13 VAL 571 HG13 VAL 571 7.402 -1.616 -2.509
184 HG21 VAL 571 HG21 VAL 571 5.733 -4.546 -4.006
185 HG22 VAL 571 HG22 VAL 571 5.759 -2.964 -4.780
186 HG23 VAL 571 HG23 VAL 571 5.490 -3.087 -3.042
187 H THR 572 HN THR 572 10.282 -3.031 -6.032
188 HA THR 572 HA THR 572 12.213 -4.338 -4.266
189 HB THR 572 HB THR 572 13.866 -3.713 -6.084
190 HG1 THR 572 HG1 THR 572 13.158 -2.582 -7.720
191 HG21 THR 572 HG21 THR 572 11.587 -5.526 -6.882
192 HG22 THR 572 HG22 THR 572 12.966 -5.981 -5.883
193 HG23 THR 572 HG23 THR 572 13.215 -5.541 -7.572
194 H GLY 573 HN GLY 573 14.143 -3.001 -3.682
195 HA2 GLY 573 HA2 GLY 573 13.397 -0.151 -3.541
196 HA3 GLY 573 HA3 GLY 573 13.975 -1.020 -2.127
197 H VAL 574 HN VAL 574 15.090 1.297 -3.206
198 HA VAL 574 HA VAL 574 17.639 0.358 -4.341
199 HB VAL 574 HB VAL 574 16.209 2.960 -4.940
200 HG11 VAL 574 HG11 VAL 574 17.907 3.328 -6.629
201 HG12 VAL 574 HG12 VAL 574 18.699 1.815 -6.188
202 HG13 VAL 574 HG13 VAL 574 18.651 3.151 -5.038
203 HG21 VAL 574 HG21 VAL 574 16.567 0.524 -6.677
204 HG22 VAL 574 HG22 VAL 574 15.855 2.056 -7.186
205 HG23 VAL 574 HG23 VAL 574 15.056 1.077 -5.956
206 H TYR 575 HN TYR 575 19.507 1.407 -3.561
207 HA TYR 575 HA TYR 575 19.198 2.713 -1.010
208 HB2 TYR 575 HB2 TYR 575 21.060 1.156 -1.386
209 HB3 TYR 575 HB3 TYR 575 21.664 2.184 -2.683
210 HD1 TYR 575 HD1 TYR 575 23.481 3.482 -2.141
211 HD2 TYR 575 HD2 TYR 575 20.631 2.577 0.886
212 HE1 TYR 575 HE1 TYR 575 24.810 4.761 -0.501
213 HE2 TYR 575 HE2 TYR 575 21.947 3.842 2.526
214 HH TYR 575 HH TYR 575 24.273 4.585 2.844
215 H ASP 576 HN ASP 576 18.806 4.809 -0.829
216 HA ASP 576 HA ASP 576 19.370 6.570 -3.085
217 HB2 ASP 576 HB2 ASP 576 17.129 6.709 -2.117
218 HB3 ASP 576 HB3 ASP 576 17.816 7.089 -0.539
219 H GLU 577 HN GLU 577 21.185 7.612 -3.150
220 HA GLU 577 HA GLU 577 23.062 7.522 -1.028
221 HB2 GLU 577 HB2 GLU 577 23.084 9.078 -3.614
222 HB3 GLU 577 HB3 GLU 577 24.478 8.830 -2.568
223 HG2 GLU 577 HG2 GLU 577 24.534 6.511 -3.024
224 HG3 GLU 577 HG3 GLU 577 22.935 6.543 -3.762
225 H GLU 578 HN GLU 578 20.652 9.816 -1.913
226 HA GLU 578 HA GLU 578 21.918 12.084 -0.692
227 HB2 GLU 578 HB2 GLU 578 19.051 11.671 -1.544
228 HB3 GLU 578 HB3 GLU 578 19.769 13.208 -1.080
229 HG2 GLU 578 HG2 GLU 578 21.368 12.965 -2.969
230 HG3 GLU 578 HG3 GLU 578 20.488 11.520 -3.463
231 H SER 579 HN SER 579 19.195 9.973 0.213
232 HA SER 579 HA SER 579 19.062 11.179 2.848
233 HB2 SER 579 HB2 SER 579 17.211 9.554 3.211
234 HB3 SER 579 HB3 SER 579 16.982 10.530 1.759
235 HG SER 579 HG SER 579 17.533 8.822 0.501
236 H GLY 580 HN GLY 580 20.583 8.482 1.334
237 HA2 GLY 580 HA2 GLY 580 22.278 7.150 2.196
238 HA3 GLY 580 HA3 GLY 580 22.002 7.869 3.774
239 H GLU 581 HN GLU 581 19.236 6.623 2.176
240 HA GLU 581 HA GLU 581 19.292 4.256 3.942
241 HB2 GLU 581 HB2 GLU 581 16.875 5.885 3.143
242 HB3 GLU 581 HB3 GLU 581 16.886 4.502 4.225
243 HG2 GLU 581 HG2 GLU 581 18.333 7.080 4.759
244 HG3 GLU 581 HG3 GLU 581 16.712 6.720 5.341
245 H TRP 582 HN TRP 582 18.387 2.331 3.128
246 HA TRP 582 HA TRP 582 17.833 2.123 0.305
247 HB2 TRP 582 HB2 TRP 582 17.434 0.189 2.603
248 HB3 TRP 582 HB3 TRP 582 16.988 -0.184 0.938
249 HD1 TRP 582 HD1 TRP 582 20.083 0.332 3.157
250 HE1 TRP 582 HE1 TRP 582 22.107 -0.743 1.963
251 HE3 TRP 582 HE3 TRP 582 17.862 -0.799 -1.308
252 HZ2 TRP 582 HZ2 TRP 582 22.663 -1.905 -0.559
253 HZ3 TRP 582 HZ3 TRP 582 19.199 -1.888 -3.059
254 HH2 TRP 582 HH2 TRP 582 21.557 -2.430 -2.689
255 H VAL 583 HN VAL 583 15.838 2.304 -0.635
256 HA VAL 583 HA VAL 583 13.742 3.133 1.265
257 HB VAL 583 HB VAL 583 12.927 4.725 -0.383
258 HG11 VAL 583 HG11 VAL 583 15.913 4.977 -0.018
259 HG12 VAL 583 HG12 VAL 583 14.685 5.472 1.146
260 HG13 VAL 583 HG13 VAL 583 14.801 6.287 -0.413
261 HG21 VAL 583 HG21 VAL 583 15.177 3.738 -2.139
262 HG22 VAL 583 HG22 VAL 583 14.142 5.125 -2.482
263 HG23 VAL 583 HG23 VAL 583 13.450 3.503 -2.418
264 H TRP 584 HN TRP 584 11.872 2.126 1.280
265 HA TRP 584 HA TRP 584 10.797 1.017 -1.240
266 HB2 TRP 584 HB2 TRP 584 10.184 0.390 1.657
267 HB3 TRP 584 HB3 TRP 584 9.036 0.006 0.382
268 HD1 TRP 584 HD1 TRP 584 12.130 -0.655 -1.265
269 HE1 TRP 584 HE1 TRP 584 12.833 -3.113 -1.087
270 HE3 TRP 584 HE3 TRP 584 9.060 -2.054 2.569
271 HZ2 TRP 584 HZ2 TRP 584 12.158 -5.373 0.492
272 HZ3 TRP 584 HZ3 TRP 584 9.149 -4.388 3.354
273 HH2 TRP 584 HH2 TRP 584 10.665 -6.005 2.335
274 H LYS 585 HN LYS 585 9.698 2.655 -2.216
275 HA LYS 585 HA LYS 585 8.596 4.773 -0.582
276 HB2 LYS 585 HB2 LYS 585 8.118 5.876 -2.809
277 HB3 LYS 585 HB3 LYS 585 9.805 5.597 -2.416
278 HG2 LYS 585 HG2 LYS 585 9.671 5.029 -4.659
279 HG3 LYS 585 HG3 LYS 585 9.568 3.467 -3.849
280 HD2 LYS 585 HD2 LYS 585 7.207 3.370 -4.173
281 HD3 LYS 585 HD3 LYS 585 7.160 5.049 -4.716
282 HE2 LYS 585 HE2 LYS 585 8.562 2.795 -6.145
283 HE3 LYS 585 HE3 LYS 585 6.989 3.459 -6.583
284 HZ1 LYS 585 HZ1 LYS 585 9.617 4.831 -6.680
285 HZ2 LYS 585 HZ2 LYS 585 8.142 5.650 -6.833
286 HZ3 LYS 585 HZ3 LYS 585 8.585 4.481 -7.977
287 H ASN 586 HN ASN 586 6.507 5.484 -0.553
288 HA ASN 586 HA ASN 586 4.300 5.193 -0.197
289 HB2 ASN 586 HB2 ASN 586 4.291 3.779 -2.886
290 HB3 ASN 586 HB3 ASN 586 2.917 4.478 -2.061
291 HD21 ASN 586 HD21 ASN 586 2.558 6.653 -2.132
292 HD22 ASN 586 HD22 ASN 586 3.465 7.737 -3.126
293 H THR 587 HN THR 587 5.805 3.363 1.138
294 HA THR 587 HA THR 587 4.319 0.844 0.812
295 HB THR 587 HB THR 587 7.091 1.237 1.955
296 HG1 THR 587 HG1 THR 587 6.549 1.371 -0.482
297 HG21 THR 587 HG21 THR 587 7.218 -1.222 1.879
298 HG22 THR 587 HG22 THR 587 5.525 -1.285 1.387
299 HG23 THR 587 HG23 THR 587 5.958 -0.663 2.979
300 H ILE 588 HN ILE 588 3.435 -0.106 2.576
301 HA ILE 588 HA ILE 588 3.700 1.198 5.194
302 HB ILE 588 HB ILE 588 1.655 2.088 4.053
303 HG12 ILE 588 HG12 ILE 588 1.078 0.304 6.428
304 HG13 ILE 588 HG13 ILE 588 1.787 1.913 6.519
305 HG21 ILE 588 HG21 ILE 588 -0.273 0.597 3.731
306 HG22 ILE 588 HG22 ILE 588 0.732 -0.786 4.167
307 HG23 ILE 588 HG23 ILE 588 1.090 0.140 2.710
308 HD11 ILE 588 HD11 ILE 588 -0.954 1.269 5.455
309 HD12 ILE 588 HD12 ILE 588 -0.247 2.878 5.616
310 HD13 ILE 588 HD13 ILE 588 -0.589 1.916 7.054
311 H GLU 589 HN GLU 589 3.304 -0.218 6.940
312 HA GLU 589 HA GLU 589 3.169 -3.052 6.199
313 HB2 GLU 589 HB2 GLU 589 5.282 -2.405 7.289
314 HB3 GLU 589 HB3 GLU 589 4.389 -1.792 8.672
315 HG2 GLU 589 HG2 GLU 589 3.979 -4.643 7.892
316 HG3 GLU 589 HG3 GLU 589 5.505 -4.187 8.655
317 H VAL 590 HN VAL 590 1.382 -4.065 6.720
318 HA VAL 590 HA VAL 590 -0.238 -3.063 8.964
319 HB VAL 590 HB VAL 590 -1.324 -4.179 6.367
320 HG11 VAL 590 HG11 VAL 590 -2.762 -3.052 8.766
321 HG12 VAL 590 HG12 VAL 590 -2.715 -4.747 8.282
322 HG13 VAL 590 HG13 VAL 590 -3.515 -3.557 7.254
323 HG21 VAL 590 HG21 VAL 590 -0.438 -1.941 6.042
324 HG22 VAL 590 HG22 VAL 590 -1.364 -1.355 7.424
325 HG23 VAL 590 HG23 VAL 590 -2.201 -1.920 5.978
326 H ASN 591 HN ASN 591 -0.268 -4.517 10.492
327 HA ASN 591 HA ASN 591 -0.397 -6.465 11.641
328 HB2 ASN 591 HB2 ASN 591 -2.485 -6.571 10.078
329 HB3 ASN 591 HB3 ASN 591 -1.571 -7.792 9.208
330 HD21 ASN 591 HD21 ASN 591 -0.310 -8.931 11.548
331 HD22 ASN 591 HD22 ASN 591 -1.539 -9.798 12.409
332 H GLY 592 HN GLY 592 2.038 -5.923 10.318
333 HA2 GLY 592 HA2 GLY 592 4.041 -7.087 10.318
334 HA3 GLY 592 HA3 GLY 592 3.148 -8.591 10.491
335 H LYS 593 HN LYS 593 2.043 -6.604 7.974
336 HA LYS 593 HA LYS 593 3.632 -8.101 6.016
337 HB2 LYS 593 HB2 LYS 593 0.648 -7.627 5.971
338 HB3 LYS 593 HB3 LYS 593 1.566 -8.218 4.592
339 HG2 LYS 593 HG2 LYS 593 2.101 -10.239 5.692
340 HG3 LYS 593 HG3 LYS 593 1.525 -9.632 7.245
341 HD2 LYS 593 HD2 LYS 593 -0.233 -10.032 4.825
342 HD3 LYS 593 HD3 LYS 593 -0.037 -11.221 6.115
343 HE2 LYS 593 HE2 LYS 593 -0.856 -9.567 7.738
344 HE3 LYS 593 HE3 LYS 593 -1.088 -8.410 6.430
345 HZ1 LYS 593 HZ1 LYS 593 -2.437 -11.052 6.575
346 HZ2 LYS 593 HZ2 LYS 593 -2.742 -9.812 5.460
347 HZ3 LYS 593 HZ3 LYS 593 -3.132 -9.594 7.097
348 H TYR 594 HN TYR 594 4.227 -7.024 4.193
349 HA TYR 594 HA TYR 594 3.945 -4.126 4.375
350 HB2 TYR 594 HB2 TYR 594 5.854 -5.845 2.782
351 HB3 TYR 594 HB3 TYR 594 5.820 -4.085 2.726
352 HD1 TYR 594 HD1 TYR 594 6.428 -2.779 4.758
353 HD2 TYR 594 HD2 TYR 594 6.898 -7.002 4.578
354 HE1 TYR 594 HE1 TYR 594 7.962 -2.679 6.675
355 HE2 TYR 594 HE2 TYR 594 8.432 -6.920 6.502
356 HH TYR 594 HH TYR 594 9.944 -5.262 7.580
357 H PHE 595 HN PHE 595 2.928 -2.928 2.937
358 HA PHE 595 HA PHE 595 2.207 -4.010 0.313
359 HB2 PHE 595 HB2 PHE 595 0.236 -2.560 2.111
360 HB3 PHE 595 HB3 PHE 595 -0.084 -3.173 0.499
361 HD1 PHE 595 HD1 PHE 595 -0.530 -5.522 0.126
362 HD2 PHE 595 HD2 PHE 595 0.314 -4.031 4.023
363 HE1 PHE 595 HE1 PHE 595 -1.419 -7.594 1.107
364 HE2 PHE 595 HE2 PHE 595 -0.567 -6.107 5.007
365 HZ PHE 595 HZ PHE 595 -1.435 -7.892 3.549
366 H HIS 596 HN HIS 596 1.605 -2.221 -1.187
367 HA HIS 596 HA HIS 596 2.913 0.260 -0.697
368 HB2 HIS 596 HB2 HIS 596 0.817 -0.562 -2.713
369 HB3 HIS 596 HB3 HIS 596 1.430 1.085 -2.625
370 HD2 HIS 596 HD2 HIS 596 4.553 0.733 -2.607
371 HE1 HIS 596 HE1 HIS 596 3.977 -1.898 -5.882
372 HE2 HIS 596 HE2 HIS 596 5.617 -0.345 -4.711
373 H SER 597 HN SER 597 2.204 1.988 0.385
374 HA SER 597 HA SER 597 -0.058 1.903 2.049
375 HB2 SER 597 HB2 SER 597 1.919 3.304 2.508
376 HB3 SER 597 HB3 SER 597 1.536 4.304 1.106
377 HG SER 597 HG SER 597 -0.576 4.608 2.268
378 H THR 598 HN THR 598 0.487 3.108 -1.150
379 HA THR 598 HA THR 598 -1.933 4.492 -1.542
380 HB THR 598 HB THR 598 -0.101 3.086 -3.513
381 HG1 THR 598 HG1 THR 598 -0.085 5.817 -3.424
382 HG21 THR 598 HG21 THR 598 -2.312 3.506 -4.515
383 HG22 THR 598 HG22 THR 598 -1.087 4.568 -5.208
384 HG23 THR 598 HG23 THR 598 -2.223 5.193 -4.013
385 H CYS 599 HN CYS 599 -1.048 1.098 -1.760
386 HA CYS 599 HA CYS 599 -3.426 0.287 -3.133
387 HB2 CYS 599 HB2 CYS 599 -1.353 -1.332 -1.657
388 HB3 CYS 599 HB3 CYS 599 -2.678 -2.018 -2.591
389 H TYR 600 HN TYR 600 -2.516 0.571 0.253
390 HA TYR 600 HA TYR 600 -4.491 -1.131 1.326
391 HB2 TYR 600 HB2 TYR 600 -2.590 -0.275 2.652
392 HB3 TYR 600 HB3 TYR 600 -3.278 1.344 2.588
393 HD1 TYR 600 HD1 TYR 600 -4.879 2.033 4.151
394 HD2 TYR 600 HD2 TYR 600 -3.923 -2.099 3.845
395 HE1 TYR 600 HE1 TYR 600 -6.170 1.596 6.199
396 HE2 TYR 600 HE2 TYR 600 -5.208 -2.551 5.892
397 HH TYR 600 HH TYR 600 -6.027 -1.445 7.824
398 H HIS 601 HN HIS 601 -4.547 2.218 0.349
399 HA HIS 601 HA HIS 601 -7.154 2.840 1.239
400 HB2 HIS 601 HB2 HIS 601 -5.549 4.573 0.683
401 HB3 HIS 601 HB3 HIS 601 -5.470 4.016 -0.982
402 HD2 HIS 601 HD2 HIS 601 -7.383 4.964 -2.647
403 HE1 HIS 601 HE1 HIS 601 -9.458 7.205 0.285
404 HE2 HIS 601 HE2 HIS 601 -9.404 6.536 -2.156
405 H GLU 602 HN GLU 602 -5.886 1.337 -1.663
406 HA GLU 602 HA GLU 602 -8.221 1.438 -3.247
407 HB2 GLU 602 HB2 GLU 602 -6.671 0.770 -4.713
408 HB3 GLU 602 HB3 GLU 602 -5.568 0.339 -3.420
409 HG2 GLU 602 HG2 GLU 602 -5.784 -1.609 -4.682
410 HG3 GLU 602 HG3 GLU 602 -6.837 -1.873 -3.296
411 H THR 603 HN THR 603 -7.094 -0.854 -0.830
412 HA THR 603 HA THR 603 -9.296 -2.667 -1.387
413 HB THR 603 HB THR 603 -7.068 -3.568 -0.761
414 HG1 THR 603 HG1 THR 603 -9.415 -4.143 0.678
415 HG21 THR 603 HG21 THR 603 -6.374 -3.510 1.591
416 HG22 THR 603 HG22 THR 603 -7.696 -2.397 1.948
417 HG23 THR 603 HG23 THR 603 -6.390 -1.901 0.871
Start of MODEL 13
1 H GLY 548 HN GLY 548 3.528 9.392 2.012
2 HA2 GLY 548 HA2 GLY 548 5.391 9.402 0.513
3 HA3 GLY 548 HA3 GLY 548 5.898 10.934 1.211
4 H LYS 549 HN LYS 549 4.897 8.817 3.592
5 HA LYS 549 HA LYS 549 7.454 8.469 4.714
6 HB2 LYS 549 HB2 LYS 549 4.864 6.996 5.234
7 HB3 LYS 549 HB3 LYS 549 6.315 6.816 6.207
8 HG2 LYS 549 HG2 LYS 549 4.797 9.390 5.828
9 HG3 LYS 549 HG3 LYS 549 4.663 8.317 7.223
10 HD2 LYS 549 HD2 LYS 549 7.225 9.637 6.327
11 HD3 LYS 549 HD3 LYS 549 6.166 10.271 7.588
12 HE2 LYS 549 HE2 LYS 549 7.489 7.555 7.645
13 HE3 LYS 549 HE3 LYS 549 8.090 8.985 8.479
14 HZ1 LYS 549 HZ1 LYS 549 6.877 7.701 10.035
15 HZ2 LYS 549 HZ2 LYS 549 5.548 7.538 8.989
16 HZ3 LYS 549 HZ3 LYS 549 5.916 9.044 9.665
17 H TYR 550 HN TYR 550 8.955 6.965 4.412
18 HA TYR 550 HA TYR 550 8.314 4.669 2.704
19 HB2 TYR 550 HB2 TYR 550 10.597 4.637 1.990
20 HB3 TYR 550 HB3 TYR 550 10.051 6.304 1.876
21 HD1 TYR 550 HD1 TYR 550 12.273 3.981 3.631
22 HD2 TYR 550 HD2 TYR 550 10.921 8.010 3.382
23 HE1 TYR 550 HE1 TYR 550 14.178 4.703 5.001
24 HE2 TYR 550 HE2 TYR 550 12.823 8.746 4.756
25 HH TYR 550 HH TYR 550 15.484 6.731 5.419
26 H VAL 551 HN VAL 551 9.445 2.665 3.215
27 HA VAL 551 HA VAL 551 10.086 2.435 6.086
28 HB VAL 551 HB VAL 551 8.949 0.276 4.290
29 HG11 VAL 551 HG11 VAL 551 8.692 -1.007 6.356
30 HG12 VAL 551 HG12 VAL 551 9.463 0.294 7.261
31 HG13 VAL 551 HG13 VAL 551 10.379 -0.601 6.051
32 HG21 VAL 551 HG21 VAL 551 7.588 1.838 6.484
33 HG22 VAL 551 HG22 VAL 551 6.883 0.500 5.574
34 HG23 VAL 551 HG23 VAL 551 7.285 2.011 4.754
35 H VAL 552 HN VAL 552 12.039 1.591 6.579
36 HA VAL 552 HA VAL 552 14.057 1.425 4.628
37 HB VAL 552 HB VAL 552 14.080 0.268 7.429
38 HG11 VAL 552 HG11 VAL 552 16.519 0.553 7.284
39 HG12 VAL 552 HG12 VAL 552 16.352 1.028 5.594
40 HG13 VAL 552 HG13 VAL 552 15.904 -0.601 6.103
41 HG21 VAL 552 HG21 VAL 552 14.929 3.006 6.483
42 HG22 VAL 552 HG22 VAL 552 15.091 2.368 8.120
43 HG23 VAL 552 HG23 VAL 552 13.490 2.635 7.433
44 H VAL 553 HN VAL 553 14.681 -0.172 3.352
45 HA VAL 553 HA VAL 553 13.046 -2.397 2.936
46 HB VAL 553 HB VAL 553 15.897 -2.011 2.008
47 HG11 VAL 553 HG11 VAL 553 15.341 -3.582 0.220
48 HG12 VAL 553 HG12 VAL 553 13.745 -3.828 0.926
49 HG13 VAL 553 HG13 VAL 553 15.185 -4.337 1.806
50 HG21 VAL 553 HG21 VAL 553 13.297 -1.315 0.652
51 HG22 VAL 553 HG22 VAL 553 14.905 -1.174 -0.060
52 HG23 VAL 553 HG23 VAL 553 14.463 -0.173 1.323
53 HA PRO 554 HA PRO 554 14.728 -5.144 6.036
54 HB2 PRO 554 HB2 PRO 554 12.800 -7.054 4.988
55 HB3 PRO 554 HB3 PRO 554 12.858 -6.295 6.579
56 HG2 PRO 554 HG2 PRO 554 10.952 -5.734 4.717
57 HG3 PRO 554 HG3 PRO 554 11.491 -4.573 5.944
58 HD2 PRO 554 HD2 PRO 554 12.217 -4.753 3.047
59 HD3 PRO 554 HD3 PRO 554 11.942 -3.318 4.056
60 H GLU 555 HN GLU 555 16.300 -6.592 5.888
61 HA GLU 555 HA GLU 555 17.235 -7.471 3.320
62 HB2 GLU 555 HB2 GLU 555 18.730 -6.818 5.198
63 HB3 GLU 555 HB3 GLU 555 18.175 -8.221 6.095
64 HG2 GLU 555 HG2 GLU 555 20.344 -8.629 5.101
65 HG3 GLU 555 HG3 GLU 555 19.126 -9.693 4.404
66 H THR 556 HN THR 556 15.053 -8.631 5.599
67 HA THR 556 HA THR 556 15.462 -11.447 5.111
68 HB THR 556 HB THR 556 13.378 -11.642 6.545
69 HG1 THR 556 HG1 THR 556 12.356 -9.847 7.049
70 HG21 THR 556 HG21 THR 556 14.559 -11.038 8.614
71 HG22 THR 556 HG22 THR 556 15.731 -10.117 7.675
72 HG23 THR 556 HG23 THR 556 15.630 -11.867 7.485
73 H SER 557 HN SER 557 13.797 -8.939 3.561
74 HA SER 557 HA SER 557 11.546 -10.505 2.670
75 HB2 SER 557 HB2 SER 557 12.528 -7.794 1.753
76 HB3 SER 557 HB3 SER 557 10.974 -8.518 1.339
77 HG SER 557 HG SER 557 10.712 -7.122 3.078
78 H GLN 558 HN GLN 558 12.861 -12.254 1.780
79 HA GLN 558 HA GLN 558 13.633 -13.487 0.050
80 HB2 GLN 558 HB2 GLN 558 12.382 -11.324 -1.652
81 HB3 GLN 558 HB3 GLN 558 12.838 -12.926 -2.201
82 HG2 GLN 558 HG2 GLN 558 10.728 -12.319 -0.145
83 HG3 GLN 558 HG3 GLN 558 10.437 -12.720 -1.833
84 HE21 GLN 558 HE21 GLN 558 9.244 -14.519 -1.402
85 HE22 GLN 558 HE22 GLN 558 9.920 -15.969 -0.734
86 H ASP 559 HN ASP 559 13.947 -10.605 -1.885
87 HA ASP 559 HA ASP 559 16.837 -10.490 -1.419
88 HB2 ASP 559 HB2 ASP 559 16.454 -11.862 -3.463
89 HB3 ASP 559 HB3 ASP 559 15.575 -10.515 -4.178
90 H MET 560 HN MET 560 15.555 -8.777 -0.131
91 HA MET 560 HA MET 560 15.128 -6.580 0.293
92 HB2 MET 560 HB2 MET 560 16.576 -6.125 -2.322
93 HB3 MET 560 HB3 MET 560 16.204 -4.884 -1.139
94 HG2 MET 560 HG2 MET 560 17.682 -5.885 0.462
95 HG3 MET 560 HG3 MET 560 17.955 -7.268 -0.598
96 HE1 MET 560 HE1 MET 560 20.559 -6.969 -0.345
97 HE2 MET 560 HE2 MET 560 20.339 -5.566 0.704
98 HE3 MET 560 HE3 MET 560 21.421 -5.469 -0.685
99 H ALA 561 HN ALA 561 13.254 -8.226 -1.298
100 HA ALA 561 HA ALA 561 11.677 -6.084 -2.497
101 HB1 ALA 561 HB1 ALA 561 13.026 -6.946 -4.355
102 HB2 ALA 561 HB2 ALA 561 11.315 -7.317 -4.580
103 HB3 ALA 561 HB3 ALA 561 12.428 -8.573 -4.037
104 H PHE 562 HN PHE 562 9.471 -6.510 -2.589
105 HA PHE 562 HA PHE 562 8.563 -9.156 -1.687
106 HB2 PHE 562 HB2 PHE 562 6.940 -8.264 -0.201
107 HB3 PHE 562 HB3 PHE 562 8.438 -7.432 0.186
108 HD1 PHE 562 HD1 PHE 562 5.041 -7.096 -0.920
109 HD2 PHE 562 HD2 PHE 562 8.758 -5.061 -0.573
110 HE1 PHE 562 HE1 PHE 562 3.873 -4.945 -1.164
111 HE2 PHE 562 HE2 PHE 562 7.598 -2.905 -0.818
112 HZ PHE 562 HZ PHE 562 5.147 -2.846 -1.108
113 H LYS 563 HN LYS 563 6.188 -9.481 -2.303
114 HA LYS 563 HA LYS 563 5.730 -8.080 -4.846
115 HB2 LYS 563 HB2 LYS 563 6.210 -10.460 -5.150
116 HB3 LYS 563 HB3 LYS 563 4.888 -10.877 -4.071
117 HG2 LYS 563 HG2 LYS 563 3.266 -10.110 -5.608
118 HG3 LYS 563 HG3 LYS 563 4.486 -9.329 -6.616
119 HD2 LYS 563 HD2 LYS 563 3.686 -11.438 -7.594
120 HD3 LYS 563 HD3 LYS 563 5.408 -11.484 -7.224
121 HE2 LYS 563 HE2 LYS 563 4.988 -12.750 -5.218
122 HE3 LYS 563 HE3 LYS 563 3.248 -12.610 -5.447
123 HZ1 LYS 563 HZ1 LYS 563 5.098 -13.992 -7.315
124 HZ2 LYS 563 HZ2 LYS 563 3.411 -13.919 -7.442
125 HZ3 LYS 563 HZ3 LYS 563 4.129 -14.770 -6.161
126 H CYS 564 HN CYS 564 3.978 -6.938 -5.087
127 HA CYS 564 HA CYS 564 2.176 -6.541 -2.893
128 HB2 CYS 564 HB2 CYS 564 2.899 -4.709 -4.383
129 HB3 CYS 564 HB3 CYS 564 2.136 -5.508 -5.747
130 HA PRO 565 HA PRO 565 -0.382 -9.968 -4.272
131 HB2 PRO 565 HB2 PRO 565 -2.110 -9.943 -2.198
132 HB3 PRO 565 HB3 PRO 565 -0.463 -10.564 -2.056
133 HG2 PRO 565 HG2 PRO 565 -1.551 -7.890 -1.254
134 HG3 PRO 565 HG3 PRO 565 -0.452 -8.961 -0.365
135 HD2 PRO 565 HD2 PRO 565 0.414 -6.813 -1.776
136 HD3 PRO 565 HD3 PRO 565 1.387 -8.282 -1.570
137 H ILE 566 HN ILE 566 -1.429 -6.718 -3.759
138 HA ILE 566 HA ILE 566 -4.194 -7.222 -4.348
139 HB ILE 566 HB ILE 566 -2.739 -4.589 -4.057
140 HG12 ILE 566 HG12 ILE 566 -4.319 -6.059 -1.939
141 HG13 ILE 566 HG13 ILE 566 -2.578 -6.257 -2.113
142 HG21 ILE 566 HG21 ILE 566 -5.666 -5.307 -3.873
143 HG22 ILE 566 HG22 ILE 566 -4.898 -4.320 -5.114
144 HG23 ILE 566 HG23 ILE 566 -4.987 -3.736 -3.453
145 HD11 ILE 566 HD11 ILE 566 -2.255 -3.891 -1.672
146 HD12 ILE 566 HD12 ILE 566 -3.146 -4.669 -0.363
147 HD13 ILE 566 HD13 ILE 566 -3.997 -3.668 -1.540
148 H CYS 567 HN CYS 567 -1.419 -5.863 -6.054
149 HA CYS 567 HA CYS 567 -3.018 -5.983 -8.489
150 HB2 CYS 567 HB2 CYS 567 -1.978 -3.922 -9.329
151 HB3 CYS 567 HB3 CYS 567 -2.943 -3.664 -7.882
152 H LYS 568 HN LYS 568 -0.487 -7.296 -6.984
153 HA LYS 568 HA LYS 568 0.808 -9.015 -7.710
154 HB2 LYS 568 HB2 LYS 568 -0.052 -8.377 -10.525
155 HB3 LYS 568 HB3 LYS 568 0.580 -9.899 -9.920
156 HG2 LYS 568 HG2 LYS 568 -2.016 -8.735 -8.947
157 HG3 LYS 568 HG3 LYS 568 -1.911 -9.776 -10.363
158 HD2 LYS 568 HD2 LYS 568 -0.833 -10.608 -7.684
159 HD3 LYS 568 HD3 LYS 568 -2.516 -10.874 -8.146
160 HE2 LYS 568 HE2 LYS 568 -1.526 -11.978 -10.246
161 HE3 LYS 568 HE3 LYS 568 -0.023 -12.040 -9.322
162 HZ1 LYS 568 HZ1 LYS 568 -2.623 -13.269 -8.582
163 HZ2 LYS 568 HZ2 LYS 568 -1.272 -13.232 -7.562
164 HZ3 LYS 568 HZ3 LYS 568 -1.208 -14.086 -9.026
165 H GLU 569 HN GLU 569 1.902 -6.248 -7.574
166 HA GLU 569 HA GLU 569 3.941 -6.268 -9.674
167 HB2 GLU 569 HB2 GLU 569 3.780 -4.368 -7.345
168 HB3 GLU 569 HB3 GLU 569 4.605 -4.131 -8.874
169 HG2 GLU 569 HG2 GLU 569 2.687 -3.569 -9.975
170 HG3 GLU 569 HG3 GLU 569 1.655 -4.470 -8.858
171 H THR 570 HN THR 570 5.984 -7.056 -9.351
172 HA THR 570 HA THR 570 6.896 -7.745 -6.704
173 HB THR 570 HB THR 570 8.433 -7.657 -9.314
174 HG1 THR 570 HG1 THR 570 7.632 -10.048 -8.056
175 HG21 THR 570 HG21 THR 570 10.033 -9.119 -8.161
176 HG22 THR 570 HG22 THR 570 9.091 -8.974 -6.678
177 HG23 THR 570 HG23 THR 570 9.891 -7.554 -7.352
178 H VAL 571 HN VAL 571 7.765 -6.326 -5.321
179 HA VAL 571 HA VAL 571 8.333 -3.627 -6.345
180 HB VAL 571 HB VAL 571 7.747 -4.427 -3.494
181 HG11 VAL 571 HG11 VAL 571 7.274 -2.051 -3.182
182 HG12 VAL 571 HG12 VAL 571 7.679 -1.745 -4.872
183 HG13 VAL 571 HG13 VAL 571 8.924 -2.302 -3.754
184 HG21 VAL 571 HG21 VAL 571 5.471 -3.521 -3.929
185 HG22 VAL 571 HG22 VAL 571 5.824 -5.013 -4.799
186 HG23 VAL 571 HG23 VAL 571 5.870 -3.468 -5.648
187 H THR 572 HN THR 572 10.339 -2.935 -6.377
188 HA THR 572 HA THR 572 12.348 -4.185 -4.638
189 HB THR 572 HB THR 572 13.998 -3.185 -6.285
190 HG1 THR 572 HG1 THR 572 13.263 -2.130 -7.984
191 HG21 THR 572 HG21 THR 572 13.397 -5.566 -6.339
192 HG22 THR 572 HG22 THR 572 13.682 -4.941 -7.963
193 HG23 THR 572 HG23 THR 572 12.032 -5.198 -7.393
194 H GLY 573 HN GLY 573 14.087 -2.679 -3.848
195 HA2 GLY 573 HA2 GLY 573 13.022 0.037 -3.433
196 HA3 GLY 573 HA3 GLY 573 13.601 -0.917 -2.077
197 H VAL 574 HN VAL 574 14.587 1.601 -2.763
198 HA VAL 574 HA VAL 574 17.189 1.034 -4.031
199 HB VAL 574 HB VAL 574 15.812 3.721 -3.821
200 HG11 VAL 574 HG11 VAL 574 18.136 2.809 -5.511
201 HG12 VAL 574 HG12 VAL 574 18.229 3.842 -4.084
202 HG13 VAL 574 HG13 VAL 574 17.405 4.413 -5.534
203 HG21 VAL 574 HG21 VAL 574 15.858 1.818 -6.161
204 HG22 VAL 574 HG22 VAL 574 15.253 3.472 -6.200
205 HG23 VAL 574 HG23 VAL 574 14.448 2.262 -5.202
206 H TYR 575 HN TYR 575 19.045 1.940 -3.106
207 HA TYR 575 HA TYR 575 18.908 2.326 -0.245
208 HB2 TYR 575 HB2 TYR 575 20.641 0.899 -1.288
209 HB3 TYR 575 HB3 TYR 575 21.302 2.314 -2.096
210 HD1 TYR 575 HD1 TYR 575 23.158 3.299 -1.120
211 HD2 TYR 575 HD2 TYR 575 20.381 1.238 1.360
212 HE1 TYR 575 HE1 TYR 575 24.603 3.708 0.825
213 HE2 TYR 575 HE2 TYR 575 21.824 1.644 3.316
214 HH TYR 575 HH TYR 575 24.300 2.076 3.714
215 H ASP 576 HN ASP 576 18.729 4.267 0.687
216 HA ASP 576 HA ASP 576 19.447 6.660 -0.824
217 HB2 ASP 576 HB2 ASP 576 17.318 6.661 0.431
218 HB3 ASP 576 HB3 ASP 576 18.210 6.383 1.925
219 H GLU 577 HN GLU 577 21.513 7.189 -0.784
220 HA GLU 577 HA GLU 577 23.350 6.091 1.059
221 HB2 GLU 577 HB2 GLU 577 23.668 8.254 -1.020
222 HB3 GLU 577 HB3 GLU 577 25.004 7.540 -0.124
223 HG2 GLU 577 HG2 GLU 577 24.536 5.373 -1.064
224 HG3 GLU 577 HG3 GLU 577 23.103 6.001 -1.877
225 H GLU 578 HN GLU 578 21.599 9.095 1.025
226 HA GLU 578 HA GLU 578 23.369 10.537 2.727
227 HB2 GLU 578 HB2 GLU 578 20.439 10.933 2.122
228 HB3 GLU 578 HB3 GLU 578 21.405 12.051 3.075
229 HG2 GLU 578 HG2 GLU 578 22.893 12.360 1.126
230 HG3 GLU 578 HG3 GLU 578 21.821 11.329 0.183
231 H SER 579 HN SER 579 20.348 8.766 3.339
232 HA SER 579 HA SER 579 20.599 9.149 6.195
233 HB2 SER 579 HB2 SER 579 18.549 7.755 6.286
234 HB3 SER 579 HB3 SER 579 18.383 9.110 5.165
235 HG SER 579 HG SER 579 18.524 7.754 3.466
236 H GLY 580 HN GLY 580 21.540 6.829 3.834
237 HA2 GLY 580 HA2 GLY 580 22.904 4.965 4.065
238 HA3 GLY 580 HA3 GLY 580 22.892 5.210 5.809
239 H GLU 581 HN GLU 581 19.864 5.200 4.216
240 HA GLU 581 HA GLU 581 19.326 2.487 5.224
241 HB2 GLU 581 HB2 GLU 581 17.492 4.895 5.309
242 HB3 GLU 581 HB3 GLU 581 17.085 3.279 5.871
243 HG2 GLU 581 HG2 GLU 581 18.737 3.406 7.607
244 HG3 GLU 581 HG3 GLU 581 19.323 4.950 6.990
245 H TRP 582 HN TRP 582 18.232 1.142 3.916
246 HA TRP 582 HA TRP 582 17.696 1.829 1.201
247 HB2 TRP 582 HB2 TRP 582 16.940 -0.577 2.873
248 HB3 TRP 582 HB3 TRP 582 16.564 -0.432 1.162
249 HD1 TRP 582 HD1 TRP 582 19.545 -0.876 3.532
250 HE1 TRP 582 HE1 TRP 582 21.517 -1.844 2.178
251 HE3 TRP 582 HE3 TRP 582 17.514 -0.624 -1.145
252 HZ2 TRP 582 HZ2 TRP 582 22.122 -2.416 -0.522
253 HZ3 TRP 582 HZ3 TRP 582 18.849 -1.398 -3.060
254 HH2 TRP 582 HH2 TRP 582 21.106 -2.275 -2.753
255 H VAL 583 HN VAL 583 15.695 2.241 0.221
256 HA VAL 583 HA VAL 583 13.568 2.899 2.164
257 HB VAL 583 HB VAL 583 12.936 4.805 0.782
258 HG11 VAL 583 HG11 VAL 583 15.890 4.831 1.392
259 HG12 VAL 583 HG12 VAL 583 14.600 5.156 2.550
260 HG13 VAL 583 HG13 VAL 583 14.858 6.245 1.186
261 HG21 VAL 583 HG21 VAL 583 13.656 3.831 -1.386
262 HG22 VAL 583 HG22 VAL 583 15.331 4.171 -0.935
263 HG23 VAL 583 HG23 VAL 583 14.187 5.502 -1.148
264 H TRP 584 HN TRP 584 11.640 2.055 1.868
265 HA TRP 584 HA TRP 584 10.759 1.346 -0.855
266 HB2 TRP 584 HB2 TRP 584 9.924 0.347 1.861
267 HB3 TRP 584 HB3 TRP 584 8.823 0.224 0.495
268 HD1 TRP 584 HD1 TRP 584 11.864 -0.353 -1.193
269 HE1 TRP 584 HE1 TRP 584 12.497 -2.828 -1.333
270 HE3 TRP 584 HE3 TRP 584 8.763 -2.154 2.445
271 HZ2 TRP 584 HZ2 TRP 584 11.765 -5.252 -0.073
272 HZ3 TRP 584 HZ3 TRP 584 8.778 -4.570 2.913
273 HH2 TRP 584 HH2 TRP 584 10.248 -6.087 1.679
274 H LYS 585 HN LYS 585 9.799 3.093 -1.729
275 HA LYS 585 HA LYS 585 8.554 5.078 -0.032
276 HB2 LYS 585 HB2 LYS 585 8.652 5.103 -3.050
277 HB3 LYS 585 HB3 LYS 585 8.442 6.464 -1.958
278 HG2 LYS 585 HG2 LYS 585 10.946 4.826 -1.985
279 HG3 LYS 585 HG3 LYS 585 10.706 6.209 -3.052
280 HD2 LYS 585 HD2 LYS 585 10.445 6.351 -0.051
281 HD3 LYS 585 HD3 LYS 585 11.948 6.689 -0.911
282 HE2 LYS 585 HE2 LYS 585 10.744 8.448 -2.203
283 HE3 LYS 585 HE3 LYS 585 9.322 8.148 -1.204
284 HZ1 LYS 585 HZ1 LYS 585 10.675 10.061 -0.465
285 HZ2 LYS 585 HZ2 LYS 585 11.962 9.000 -0.139
286 HZ3 LYS 585 HZ3 LYS 585 10.512 8.865 0.724
287 H ASN 586 HN ASN 586 6.399 5.784 -0.225
288 HA ASN 586 HA ASN 586 4.191 5.316 0.054
289 HB2 ASN 586 HB2 ASN 586 4.400 4.163 -2.741
290 HB3 ASN 586 HB3 ASN 586 2.943 4.711 -1.942
291 HD21 ASN 586 HD21 ASN 586 4.255 5.550 -4.439
292 HD22 ASN 586 HD22 ASN 586 4.452 7.265 -4.301
293 H THR 587 HN THR 587 5.786 3.426 1.217
294 HA THR 587 HA THR 587 4.247 0.955 0.786
295 HB THR 587 HB THR 587 7.085 1.200 1.812
296 HG1 THR 587 HG1 THR 587 6.470 1.510 -0.583
297 HG21 THR 587 HG21 THR 587 7.142 -1.245 1.611
298 HG22 THR 587 HG22 THR 587 5.446 -1.246 1.119
299 HG23 THR 587 HG23 THR 587 5.893 -0.732 2.748
300 H ILE 588 HN ILE 588 3.400 -0.033 2.591
301 HA ILE 588 HA ILE 588 3.878 1.231 5.191
302 HB ILE 588 HB ILE 588 1.822 2.233 4.232
303 HG12 ILE 588 HG12 ILE 588 1.285 0.381 6.570
304 HG13 ILE 588 HG13 ILE 588 2.084 1.947 6.682
305 HG21 ILE 588 HG21 ILE 588 1.067 0.420 2.836
306 HG22 ILE 588 HG22 ILE 588 -0.198 0.817 4.000
307 HG23 ILE 588 HG23 ILE 588 0.815 -0.606 4.245
308 HD11 ILE 588 HD11 ILE 588 0.048 3.049 5.950
309 HD12 ILE 588 HD12 ILE 588 -0.256 2.040 7.366
310 HD13 ILE 588 HD13 ILE 588 -0.748 1.485 5.766
311 H GLU 589 HN GLU 589 3.686 -0.148 6.939
312 HA GLU 589 HA GLU 589 3.343 -2.978 6.281
313 HB2 GLU 589 HB2 GLU 589 5.477 -2.465 7.319
314 HB3 GLU 589 HB3 GLU 589 4.674 -1.627 8.638
315 HG2 GLU 589 HG2 GLU 589 4.044 -4.504 8.179
316 HG3 GLU 589 HG3 GLU 589 5.591 -4.069 8.911
317 H VAL 590 HN VAL 590 1.521 -3.909 6.809
318 HA VAL 590 HA VAL 590 -0.085 -2.790 9.011
319 HB VAL 590 HB VAL 590 -1.164 -3.922 6.418
320 HG11 VAL 590 HG11 VAL 590 -2.615 -2.702 8.767
321 HG12 VAL 590 HG12 VAL 590 -2.603 -4.412 8.330
322 HG13 VAL 590 HG13 VAL 590 -3.353 -3.231 7.254
323 HG21 VAL 590 HG21 VAL 590 -1.186 -1.083 7.433
324 HG22 VAL 590 HG22 VAL 590 -1.939 -1.662 5.947
325 HG23 VAL 590 HG23 VAL 590 -0.184 -1.704 6.119
326 H ASN 591 HN ASN 591 -0.235 -4.216 10.575
327 HA ASN 591 HA ASN 591 -0.427 -6.145 11.749
328 HB2 ASN 591 HB2 ASN 591 -2.506 -6.261 10.321
329 HB3 ASN 591 HB3 ASN 591 -1.623 -7.320 9.232
330 HD21 ASN 591 HD21 ASN 591 -1.322 -7.345 12.746
331 HD22 ASN 591 HD22 ASN 591 -2.041 -8.905 12.957
332 H GLY 592 HN GLY 592 2.023 -5.628 10.402
333 HA2 GLY 592 HA2 GLY 592 4.022 -6.808 10.559
334 HA3 GLY 592 HA3 GLY 592 3.114 -8.306 10.642
335 H LYS 593 HN LYS 593 1.997 -6.466 8.068
336 HA LYS 593 HA LYS 593 3.806 -7.901 6.246
337 HB2 LYS 593 HB2 LYS 593 0.873 -7.332 5.823
338 HB3 LYS 593 HB3 LYS 593 1.934 -8.122 4.667
339 HG2 LYS 593 HG2 LYS 593 1.125 -9.175 7.371
340 HG3 LYS 593 HG3 LYS 593 0.564 -9.755 5.803
341 HD2 LYS 593 HD2 LYS 593 3.399 -9.878 6.842
342 HD3 LYS 593 HD3 LYS 593 2.277 -11.232 6.714
343 HE2 LYS 593 HE2 LYS 593 2.240 -11.017 4.300
344 HE3 LYS 593 HE3 LYS 593 3.273 -9.588 4.393
345 HZ1 LYS 593 HZ1 LYS 593 4.009 -12.357 5.177
346 HZ2 LYS 593 HZ2 LYS 593 5.000 -10.996 5.399
347 HZ3 LYS 593 HZ3 LYS 593 4.595 -11.499 3.831
348 H TYR 594 HN TYR 594 4.611 -6.860 4.510
349 HA TYR 594 HA TYR 594 4.281 -3.962 4.486
350 HB2 TYR 594 HB2 TYR 594 6.283 -5.767 3.119
351 HB3 TYR 594 HB3 TYR 594 6.240 -4.017 2.936
352 HD1 TYR 594 HD1 TYR 594 6.576 -2.577 5.009
353 HD2 TYR 594 HD2 TYR 594 7.390 -6.756 4.930
354 HE1 TYR 594 HE1 TYR 594 7.993 -2.339 7.006
355 HE2 TYR 594 HE2 TYR 594 8.800 -6.524 6.922
356 HH TYR 594 HH TYR 594 8.801 -3.752 8.860
357 H PHE 595 HN PHE 595 3.039 -2.982 3.079
358 HA PHE 595 HA PHE 595 2.688 -4.135 0.397
359 HB2 PHE 595 HB2 PHE 595 0.411 -2.927 1.991
360 HB3 PHE 595 HB3 PHE 595 0.311 -3.604 0.377
361 HD1 PHE 595 HD1 PHE 595 1.180 -6.161 0.284
362 HD2 PHE 595 HD2 PHE 595 -0.417 -4.174 3.690
363 HE1 PHE 595 HE1 PHE 595 0.531 -8.332 1.241
364 HE2 PHE 595 HE2 PHE 595 -1.066 -6.341 4.655
365 HZ PHE 595 HZ PHE 595 -0.596 -8.425 3.431
366 H HIS 596 HN HIS 596 1.982 -2.475 -1.195
367 HA HIS 596 HA HIS 596 3.081 0.093 -0.857
368 HB2 HIS 596 HB2 HIS 596 0.951 -0.954 -2.719
369 HB3 HIS 596 HB3 HIS 596 1.457 0.730 -2.741
370 HD2 HIS 596 HD2 HIS 596 4.715 0.106 -2.504
371 HE1 HIS 596 HE1 HIS 596 3.996 -1.825 -6.204
372 HE2 HIS 596 HE2 HIS 596 5.726 -0.651 -4.766
373 H SER 597 HN SER 597 2.360 1.832 0.179
374 HA SER 597 HA SER 597 0.109 1.734 1.874
375 HB2 SER 597 HB2 SER 597 2.088 3.165 2.308
376 HB3 SER 597 HB3 SER 597 1.655 4.160 0.919
377 HG SER 597 HG SER 597 0.331 3.882 3.394
378 H THR 598 HN THR 598 0.641 2.895 -1.360
379 HA THR 598 HA THR 598 -1.722 4.302 -1.787
380 HB THR 598 HB THR 598 -0.305 2.605 -3.845
381 HG1 THR 598 HG1 THR 598 0.522 5.169 -3.815
382 HG21 THR 598 HG21 THR 598 -2.401 3.629 -4.580
383 HG22 THR 598 HG22 THR 598 -1.023 4.392 -5.373
384 HG23 THR 598 HG23 THR 598 -1.830 5.207 -4.035
385 H CYS 599 HN CYS 599 -0.970 0.882 -1.902
386 HA CYS 599 HA CYS 599 -3.384 0.050 -3.170
387 HB2 CYS 599 HB2 CYS 599 -1.309 -1.551 -1.678
388 HB3 CYS 599 HB3 CYS 599 -2.604 -2.223 -2.665
389 H TYR 600 HN TYR 600 -2.455 0.542 0.146
390 HA TYR 600 HA TYR 600 -4.101 -1.321 1.400
391 HB2 TYR 600 HB2 TYR 600 -2.384 -0.060 2.600
392 HB3 TYR 600 HB3 TYR 600 -3.290 1.432 2.364
393 HD1 TYR 600 HD1 TYR 600 -4.597 2.176 4.106
394 HD2 TYR 600 HD2 TYR 600 -3.777 -1.986 3.815
395 HE1 TYR 600 HE1 TYR 600 -5.797 1.804 6.219
396 HE2 TYR 600 HE2 TYR 600 -4.969 -2.378 5.935
397 HH TYR 600 HH TYR 600 -6.891 0.064 7.432
398 H HIS 601 HN HIS 601 -4.858 1.858 0.116
399 HA HIS 601 HA HIS 601 -7.450 2.011 1.296
400 HB2 HIS 601 HB2 HIS 601 -6.290 3.541 -1.041
401 HB3 HIS 601 HB3 HIS 601 -7.776 3.949 -0.184
402 HD2 HIS 601 HD2 HIS 601 -3.938 3.662 0.675
403 HE1 HIS 601 HE1 HIS 601 -5.775 6.517 3.197
404 HE2 HIS 601 HE2 HIS 601 -3.626 5.275 2.682
405 H GLU 602 HN GLU 602 -6.214 0.923 -1.853
406 HA GLU 602 HA GLU 602 -8.792 0.698 -3.036
407 HB2 GLU 602 HB2 GLU 602 -7.699 -0.421 -4.879
408 HB3 GLU 602 HB3 GLU 602 -6.740 0.961 -4.379
409 HG2 GLU 602 HG2 GLU 602 -5.302 -0.664 -3.084
410 HG3 GLU 602 HG3 GLU 602 -6.176 -1.958 -3.897
411 H THR 603 HN THR 603 -6.758 -1.487 -1.192
412 HA THR 603 HA THR 603 -8.344 -3.794 -1.910
413 HB THR 603 HB THR 603 -5.891 -3.959 -1.459
414 HG1 THR 603 HG1 THR 603 -7.799 -5.532 -0.080
415 HG21 THR 603 HG21 THR 603 -5.784 -2.459 0.488
416 HG22 THR 603 HG22 THR 603 -5.113 -4.049 0.853
417 HG23 THR 603 HG23 THR 603 -6.723 -3.615 1.427
Start of MODEL 14
1 H GLY 548 HN GLY 548 3.385 9.777 1.087
2 HA2 GLY 548 HA2 GLY 548 5.420 9.905 -0.015
3 HA3 GLY 548 HA3 GLY 548 5.733 11.439 0.791
4 H LYS 549 HN LYS 549 4.784 9.034 2.936
5 HA LYS 549 HA LYS 549 7.329 8.906 4.205
6 HB2 LYS 549 HB2 LYS 549 4.847 7.227 4.634
7 HB3 LYS 549 HB3 LYS 549 6.250 7.254 5.694
8 HG2 LYS 549 HG2 LYS 549 4.530 9.648 5.096
9 HG3 LYS 549 HG3 LYS 549 4.362 8.614 6.513
10 HD2 LYS 549 HD2 LYS 549 6.863 10.137 5.786
11 HD3 LYS 549 HD3 LYS 549 5.656 10.691 6.948
12 HE2 LYS 549 HE2 LYS 549 6.068 8.643 8.277
13 HE3 LYS 549 HE3 LYS 549 7.332 8.189 7.136
14 HZ1 LYS 549 HZ1 LYS 549 7.308 10.633 8.825
15 HZ2 LYS 549 HZ2 LYS 549 8.525 10.221 7.724
16 HZ3 LYS 549 HZ3 LYS 549 8.260 9.255 9.091
17 H TYR 550 HN TYR 550 8.802 7.242 4.246
18 HA TYR 550 HA TYR 550 8.288 4.968 2.462
19 HB2 TYR 550 HB2 TYR 550 10.487 5.016 1.594
20 HB3 TYR 550 HB3 TYR 550 9.936 6.684 1.537
21 HD1 TYR 550 HD1 TYR 550 12.333 4.356 2.967
22 HD2 TYR 550 HD2 TYR 550 10.872 8.357 3.131
23 HE1 TYR 550 HE1 TYR 550 14.362 5.035 4.177
24 HE2 TYR 550 HE2 TYR 550 12.899 9.050 4.341
25 HH TYR 550 HH TYR 550 15.671 7.151 4.537
26 H VAL 551 HN VAL 551 9.506 3.054 3.026
27 HA VAL 551 HA VAL 551 10.209 2.967 5.894
28 HB VAL 551 HB VAL 551 9.106 0.708 4.194
29 HG11 VAL 551 HG11 VAL 551 10.562 -0.116 5.947
30 HG12 VAL 551 HG12 VAL 551 8.881 -0.478 6.347
31 HG13 VAL 551 HG13 VAL 551 9.710 0.858 7.145
32 HG21 VAL 551 HG21 VAL 551 7.748 2.340 6.336
33 HG22 VAL 551 HG22 VAL 551 7.067 0.919 5.539
34 HG23 VAL 551 HG23 VAL 551 7.394 2.384 4.611
35 H VAL 552 HN VAL 552 12.209 2.211 6.359
36 HA VAL 552 HA VAL 552 14.134 1.921 4.314
37 HB VAL 552 HB VAL 552 14.325 1.070 7.213
38 HG11 VAL 552 HG11 VAL 552 16.751 1.330 6.893
39 HG12 VAL 552 HG12 VAL 552 16.473 1.634 5.180
40 HG13 VAL 552 HG13 VAL 552 16.075 0.060 5.870
41 HG21 VAL 552 HG21 VAL 552 15.151 3.663 5.923
42 HG22 VAL 552 HG22 VAL 552 15.375 3.211 7.612
43 HG23 VAL 552 HG23 VAL 552 13.749 3.440 6.972
44 H VAL 553 HN VAL 553 14.841 0.154 3.256
45 HA VAL 553 HA VAL 553 13.202 -2.112 3.114
46 HB VAL 553 HB VAL 553 16.064 -1.832 2.175
47 HG11 VAL 553 HG11 VAL 553 15.375 -4.162 2.283
48 HG12 VAL 553 HG12 VAL 553 15.510 -3.629 0.607
49 HG13 VAL 553 HG13 VAL 553 13.922 -3.787 1.358
50 HG21 VAL 553 HG21 VAL 553 13.465 -1.362 0.720
51 HG22 VAL 553 HG22 VAL 553 15.072 -1.294 -0.002
52 HG23 VAL 553 HG23 VAL 553 14.607 -0.118 1.230
53 HA PRO 554 HA PRO 554 14.418 -4.227 6.798
54 HB2 PRO 554 HB2 PRO 554 13.218 -6.538 5.380
55 HB3 PRO 554 HB3 PRO 554 12.833 -5.866 6.969
56 HG2 PRO 554 HG2 PRO 554 11.214 -5.497 4.865
57 HG3 PRO 554 HG3 PRO 554 11.448 -4.240 6.092
58 HD2 PRO 554 HD2 PRO 554 12.559 -4.418 3.324
59 HD3 PRO 554 HD3 PRO 554 12.045 -2.995 4.250
60 H GLU 555 HN GLU 555 16.203 -5.256 7.371
61 HA GLU 555 HA GLU 555 17.892 -6.393 5.287
62 HB2 GLU 555 HB2 GLU 555 18.487 -5.919 8.208
63 HB3 GLU 555 HB3 GLU 555 19.653 -6.348 6.965
64 HG2 GLU 555 HG2 GLU 555 19.299 -4.245 5.846
65 HG3 GLU 555 HG3 GLU 555 18.035 -3.812 6.996
66 H THR 556 HN THR 556 15.564 -7.480 7.315
67 HA THR 556 HA THR 556 16.786 -10.003 8.028
68 HB THR 556 HB THR 556 14.449 -10.483 8.919
69 HG1 THR 556 HG1 THR 556 13.483 -8.102 9.172
70 HG21 THR 556 HG21 THR 556 16.238 -9.701 10.379
71 HG22 THR 556 HG22 THR 556 14.708 -8.958 10.841
72 HG23 THR 556 HG23 THR 556 15.901 -8.029 9.933
73 H SER 557 HN SER 557 15.041 -8.704 5.408
74 HA SER 557 HA SER 557 13.996 -11.258 4.523
75 HB2 SER 557 HB2 SER 557 14.013 -8.616 3.053
76 HB3 SER 557 HB3 SER 557 12.990 -10.014 2.720
77 HG SER 557 HG SER 557 11.657 -9.294 4.154
78 H GLN 558 HN GLN 558 16.476 -8.923 3.586
79 HA GLN 558 HA GLN 558 18.457 -9.118 2.536
80 HB2 GLN 558 HB2 GLN 558 17.908 -12.044 2.944
81 HB3 GLN 558 HB3 GLN 558 19.355 -11.484 2.117
82 HG2 GLN 558 HG2 GLN 558 20.007 -10.222 4.106
83 HG3 GLN 558 HG3 GLN 558 18.554 -10.775 4.938
84 HE21 GLN 558 HE21 GLN 558 21.668 -11.676 3.686
85 HE22 GLN 558 HE22 GLN 558 21.806 -13.163 4.555
86 H ASP 559 HN ASP 559 15.601 -9.966 1.102
87 HA ASP 559 HA ASP 559 16.886 -10.295 -1.520
88 HB2 ASP 559 HB2 ASP 559 14.720 -11.059 -2.342
89 HB3 ASP 559 HB3 ASP 559 15.207 -11.994 -0.935
90 H MET 560 HN MET 560 15.181 -8.117 0.454
91 HA MET 560 HA MET 560 14.718 -5.916 0.283
92 HB2 MET 560 HB2 MET 560 16.485 -6.160 -2.142
93 HB3 MET 560 HB3 MET 560 15.776 -4.632 -1.646
94 HG2 MET 560 HG2 MET 560 17.987 -4.714 -0.811
95 HG3 MET 560 HG3 MET 560 16.900 -4.901 0.557
96 HE1 MET 560 HE1 MET 560 18.912 -5.740 2.065
97 HE2 MET 560 HE2 MET 560 20.009 -5.530 0.700
98 HE3 MET 560 HE3 MET 560 19.998 -7.047 1.602
99 H ALA 561 HN ALA 561 13.029 -7.993 -1.092
100 HA ALA 561 HA ALA 561 11.399 -6.076 -2.564
101 HB1 ALA 561 HB1 ALA 561 11.088 -7.558 -4.461
102 HB2 ALA 561 HB2 ALA 561 12.161 -8.756 -3.734
103 HB3 ALA 561 HB3 ALA 561 12.801 -7.195 -4.251
104 H PHE 562 HN PHE 562 9.187 -6.592 -2.632
105 HA PHE 562 HA PHE 562 8.373 -9.185 -1.570
106 HB2 PHE 562 HB2 PHE 562 6.786 -8.334 -0.012
107 HB3 PHE 562 HB3 PHE 562 8.306 -7.531 0.341
108 HD1 PHE 562 HD1 PHE 562 4.904 -7.112 -0.956
109 HD2 PHE 562 HD2 PHE 562 8.569 -5.167 0.001
110 HE1 PHE 562 HE1 PHE 562 3.794 -4.921 -1.148
111 HE2 PHE 562 HE2 PHE 562 7.463 -2.981 -0.177
112 HZ PHE 562 HZ PHE 562 4.999 -2.881 -0.614
113 H LYS 563 HN LYS 563 6.260 -9.812 -2.248
114 HA LYS 563 HA LYS 563 5.596 -8.639 -4.823
115 HB2 LYS 563 HB2 LYS 563 5.816 -11.123 -4.489
116 HB3 LYS 563 HB3 LYS 563 4.404 -11.055 -3.443
117 HG2 LYS 563 HG2 LYS 563 3.551 -11.759 -5.479
118 HG3 LYS 563 HG3 LYS 563 3.207 -10.028 -5.463
119 HD2 LYS 563 HD2 LYS 563 4.096 -10.827 -7.633
120 HD3 LYS 563 HD3 LYS 563 5.095 -9.579 -6.884
121 HE2 LYS 563 HE2 LYS 563 6.438 -11.409 -7.846
122 HE3 LYS 563 HE3 LYS 563 6.662 -11.259 -6.105
123 HZ1 LYS 563 HZ1 LYS 563 6.440 -13.566 -6.782
124 HZ2 LYS 563 HZ2 LYS 563 4.915 -13.254 -7.461
125 HZ3 LYS 563 HZ3 LYS 563 5.145 -13.120 -5.787
126 H CYS 564 HN CYS 564 4.102 -7.068 -4.938
127 HA CYS 564 HA CYS 564 2.408 -6.402 -2.746
128 HB2 CYS 564 HB2 CYS 564 3.166 -4.714 -4.348
129 HB3 CYS 564 HB3 CYS 564 2.342 -5.550 -5.655
130 HA PRO 565 HA PRO 565 -0.443 -9.700 -3.734
131 HB2 PRO 565 HB2 PRO 565 -1.939 -8.736 -1.401
132 HB3 PRO 565 HB3 PRO 565 -1.147 -10.291 -1.652
133 HG2 PRO 565 HG2 PRO 565 -0.171 -8.500 0.076
134 HG3 PRO 565 HG3 PRO 565 0.898 -9.525 -0.893
135 HD2 PRO 565 HD2 PRO 565 0.099 -6.667 -1.352
136 HD3 PRO 565 HD3 PRO 565 1.713 -7.412 -1.447
137 H ILE 566 HN ILE 566 -1.221 -6.331 -3.534
138 HA ILE 566 HA ILE 566 -4.038 -6.794 -4.041
139 HB ILE 566 HB ILE 566 -2.574 -4.167 -3.774
140 HG12 ILE 566 HG12 ILE 566 -4.042 -5.851 -1.725
141 HG13 ILE 566 HG13 ILE 566 -2.322 -5.483 -1.733
142 HG21 ILE 566 HG21 ILE 566 -5.501 -4.877 -3.681
143 HG22 ILE 566 HG22 ILE 566 -4.680 -3.903 -4.902
144 HG23 ILE 566 HG23 ILE 566 -4.840 -3.300 -3.250
145 HD11 ILE 566 HD11 ILE 566 -4.538 -3.486 -1.357
146 HD12 ILE 566 HD12 ILE 566 -2.808 -3.146 -1.322
147 HD13 ILE 566 HD13 ILE 566 -3.531 -4.169 -0.080
148 H CYS 567 HN CYS 567 -1.232 -5.484 -5.796
149 HA CYS 567 HA CYS 567 -2.891 -5.671 -8.206
150 HB2 CYS 567 HB2 CYS 567 -1.801 -3.707 -9.192
151 HB3 CYS 567 HB3 CYS 567 -2.678 -3.309 -7.718
152 H LYS 568 HN LYS 568 -0.229 -6.805 -6.645
153 HA LYS 568 HA LYS 568 0.985 -8.600 -7.206
154 HB2 LYS 568 HB2 LYS 568 -0.469 -8.441 -9.842
155 HB3 LYS 568 HB3 LYS 568 0.495 -9.810 -9.287
156 HG2 LYS 568 HG2 LYS 568 -1.003 -10.162 -7.425
157 HG3 LYS 568 HG3 LYS 568 -1.920 -8.717 -7.845
158 HD2 LYS 568 HD2 LYS 568 -3.125 -10.660 -8.583
159 HD3 LYS 568 HD3 LYS 568 -2.522 -9.791 -9.993
160 HE2 LYS 568 HE2 LYS 568 -0.818 -11.373 -10.367
161 HE3 LYS 568 HE3 LYS 568 -1.042 -12.098 -8.774
162 HZ1 LYS 568 HZ1 LYS 568 -3.100 -13.018 -9.436
163 HZ2 LYS 568 HZ2 LYS 568 -1.995 -13.384 -10.672
164 HZ3 LYS 568 HZ3 LYS 568 -3.128 -12.137 -10.886
165 H GLU 569 HN GLU 569 2.073 -5.887 -7.727
166 HA GLU 569 HA GLU 569 4.073 -6.592 -9.759
167 HB2 GLU 569 HB2 GLU 569 4.619 -4.175 -8.194
168 HB3 GLU 569 HB3 GLU 569 4.605 -4.398 -9.933
169 HG2 GLU 569 HG2 GLU 569 2.735 -3.234 -10.051
170 HG3 GLU 569 HG3 GLU 569 1.914 -4.428 -9.044
171 H THR 570 HN THR 570 6.272 -6.898 -9.189
172 HA THR 570 HA THR 570 6.746 -7.642 -6.430
173 HB THR 570 HB THR 570 8.689 -7.563 -8.761
174 HG1 THR 570 HG1 THR 570 7.370 -9.165 -9.337
175 HG21 THR 570 HG21 THR 570 9.808 -7.531 -6.585
176 HG22 THR 570 HG22 THR 570 10.043 -9.086 -7.383
177 HG23 THR 570 HG23 THR 570 8.873 -8.934 -6.072
178 H VAL 571 HN VAL 571 7.348 -6.191 -4.955
179 HA VAL 571 HA VAL 571 8.020 -3.511 -5.819
180 HB VAL 571 HB VAL 571 7.735 -4.567 -3.003
181 HG11 VAL 571 HG11 VAL 571 7.562 -1.755 -4.087
182 HG12 VAL 571 HG12 VAL 571 8.927 -2.428 -3.199
183 HG13 VAL 571 HG13 VAL 571 7.366 -2.239 -2.402
184 HG21 VAL 571 HG21 VAL 571 5.657 -3.311 -4.802
185 HG22 VAL 571 HG22 VAL 571 5.433 -3.713 -3.099
186 HG23 VAL 571 HG23 VAL 571 5.701 -4.995 -4.281
187 H THR 572 HN THR 572 10.028 -2.955 -6.193
188 HA THR 572 HA THR 572 12.193 -4.200 -4.650
189 HB THR 572 HB THR 572 13.672 -3.211 -6.452
190 HG1 THR 572 HG1 THR 572 11.962 -1.720 -7.196
191 HG21 THR 572 HG21 THR 572 13.043 -5.582 -6.432
192 HG22 THR 572 HG22 THR 572 13.167 -4.962 -8.080
193 HG23 THR 572 HG23 THR 572 11.581 -5.201 -7.344
194 H GLY 573 HN GLY 573 13.984 -2.730 -3.993
195 HA2 GLY 573 HA2 GLY 573 12.993 0.006 -3.544
196 HA3 GLY 573 HA3 GLY 573 13.671 -0.937 -2.223
197 H VAL 574 HN VAL 574 14.656 1.568 -3.057
198 HA VAL 574 HA VAL 574 17.188 0.846 -4.388
199 HB VAL 574 HB VAL 574 15.804 3.535 -4.486
200 HG11 VAL 574 HG11 VAL 574 18.225 3.686 -4.701
201 HG12 VAL 574 HG12 VAL 574 17.436 4.076 -6.229
202 HG13 VAL 574 HG13 VAL 574 18.196 2.499 -6.005
203 HG21 VAL 574 HG21 VAL 574 14.518 1.868 -5.711
204 HG22 VAL 574 HG22 VAL 574 15.959 1.414 -6.621
205 HG23 VAL 574 HG23 VAL 574 15.267 3.026 -6.812
206 H TYR 575 HN TYR 575 19.071 1.814 -3.580
207 HA TYR 575 HA TYR 575 18.944 2.574 -0.791
208 HB2 TYR 575 HB2 TYR 575 20.693 1.030 -1.547
209 HB3 TYR 575 HB3 TYR 575 21.287 2.238 -2.680
210 HD1 TYR 575 HD1 TYR 575 20.463 2.119 0.970
211 HD2 TYR 575 HD2 TYR 575 23.239 3.259 -2.044
212 HE1 TYR 575 HE1 TYR 575 21.979 2.982 2.703
213 HE2 TYR 575 HE2 TYR 575 24.768 4.127 -0.322
214 HH TYR 575 HH TYR 575 24.323 3.490 3.020
215 H ASP 576 HN ASP 576 18.685 4.626 -0.197
216 HA ASP 576 HA ASP 576 19.415 6.751 -2.069
217 HB2 ASP 576 HB2 ASP 576 17.189 6.963 -1.129
218 HB3 ASP 576 HB3 ASP 576 17.836 6.856 0.507
219 H GLU 577 HN GLU 577 21.336 7.556 -1.929
220 HA GLU 577 HA GLU 577 23.087 6.949 0.214
221 HB2 GLU 577 HB2 GLU 577 23.457 8.824 -2.125
222 HB3 GLU 577 HB3 GLU 577 24.736 8.252 -1.058
223 HG2 GLU 577 HG2 GLU 577 24.299 5.958 -1.746
224 HG3 GLU 577 HG3 GLU 577 23.018 6.518 -2.817
225 H GLU 578 HN GLU 578 20.966 9.612 -0.390
226 HA GLU 578 HA GLU 578 22.421 11.501 1.207
227 HB2 GLU 578 HB2 GLU 578 20.878 12.216 -0.581
228 HB3 GLU 578 HB3 GLU 578 19.526 11.570 0.338
229 HG2 GLU 578 HG2 GLU 578 19.844 14.044 0.485
230 HG3 GLU 578 HG3 GLU 578 19.775 13.202 2.031
231 H SER 579 HN SER 579 19.493 9.514 1.771
232 HA SER 579 HA SER 579 19.507 10.203 4.575
233 HB2 SER 579 HB2 SER 579 17.637 8.576 4.739
234 HB3 SER 579 HB3 SER 579 17.375 9.786 3.484
235 HG SER 579 HG SER 579 17.758 8.303 1.933
236 H GLY 580 HN GLY 580 20.910 7.801 2.564
237 HA2 GLY 580 HA2 GLY 580 22.673 6.403 3.108
238 HA3 GLY 580 HA3 GLY 580 22.480 6.861 4.793
239 H GLU 581 HN GLU 581 19.692 5.790 3.103
240 HA GLU 581 HA GLU 581 19.925 3.093 4.230
241 HB2 GLU 581 HB2 GLU 581 17.652 5.023 4.711
242 HB3 GLU 581 HB3 GLU 581 17.544 3.300 5.030
243 HG2 GLU 581 HG2 GLU 581 19.573 5.113 6.296
244 HG3 GLU 581 HG3 GLU 581 18.016 4.716 7.017
245 H TRP 582 HN TRP 582 18.397 1.584 3.349
246 HA TRP 582 HA TRP 582 17.776 2.025 0.570
247 HB2 TRP 582 HB2 TRP 582 17.213 -0.279 2.446
248 HB3 TRP 582 HB3 TRP 582 16.811 -0.287 0.735
249 HD1 TRP 582 HD1 TRP 582 19.871 -0.297 3.067
250 HE1 TRP 582 HE1 TRP 582 21.878 -1.246 1.756
251 HE3 TRP 582 HE3 TRP 582 17.702 -0.672 -1.532
252 HZ2 TRP 582 HZ2 TRP 582 22.454 -2.052 -0.895
253 HZ3 TRP 582 HZ3 TRP 582 19.037 -1.538 -3.410
254 HH2 TRP 582 HH2 TRP 582 21.367 -2.216 -3.098
255 H VAL 583 HN VAL 583 15.714 2.349 -0.306
256 HA VAL 583 HA VAL 583 13.699 3.064 1.724
257 HB VAL 583 HB VAL 583 12.933 4.854 0.272
258 HG11 VAL 583 HG11 VAL 583 14.890 6.323 0.383
259 HG12 VAL 583 HG12 VAL 583 15.929 4.920 0.632
260 HG13 VAL 583 HG13 VAL 583 14.731 5.355 1.853
261 HG21 VAL 583 HG21 VAL 583 14.099 5.442 -1.790
262 HG22 VAL 583 HG22 VAL 583 13.431 3.811 -1.898
263 HG23 VAL 583 HG23 VAL 583 15.155 4.039 -1.604
264 H TRP 584 HN TRP 584 11.815 2.065 1.669
265 HA TRP 584 HA TRP 584 10.687 1.323 -0.953
266 HB2 TRP 584 HB2 TRP 584 10.092 0.358 1.852
267 HB3 TRP 584 HB3 TRP 584 8.928 0.151 0.550
268 HD1 TRP 584 HD1 TRP 584 11.932 -0.399 -1.236
269 HE1 TRP 584 HE1 TRP 584 12.608 -2.869 -1.330
270 HE3 TRP 584 HE3 TRP 584 9.018 -2.154 2.565
271 HZ2 TRP 584 HZ2 TRP 584 12.002 -5.256 0.038
272 HZ3 TRP 584 HZ3 TRP 584 9.115 -4.555 3.114
273 HH2 TRP 584 HH2 TRP 584 10.573 -6.073 1.874
274 H LYS 585 HN LYS 585 9.645 3.162 -1.675
275 HA LYS 585 HA LYS 585 8.274 4.806 0.320
276 HB2 LYS 585 HB2 LYS 585 8.340 6.631 -1.179
277 HB3 LYS 585 HB3 LYS 585 9.926 5.888 -1.225
278 HG2 LYS 585 HG2 LYS 585 7.839 5.262 -3.278
279 HG3 LYS 585 HG3 LYS 585 8.896 6.664 -3.417
280 HD2 LYS 585 HD2 LYS 585 10.607 4.556 -2.847
281 HD3 LYS 585 HD3 LYS 585 9.429 3.880 -3.974
282 HE2 LYS 585 HE2 LYS 585 11.121 6.342 -4.373
283 HE3 LYS 585 HE3 LYS 585 11.268 4.801 -5.217
284 HZ1 LYS 585 HZ1 LYS 585 9.066 5.175 -6.174
285 HZ2 LYS 585 HZ2 LYS 585 10.140 6.419 -6.586
286 HZ3 LYS 585 HZ3 LYS 585 8.960 6.675 -5.390
287 H ASN 586 HN ASN 586 6.166 5.713 -0.189
288 HA ASN 586 HA ASN 586 3.935 5.251 -0.314
289 HB2 ASN 586 HB2 ASN 586 4.511 3.825 -2.917
290 HB3 ASN 586 HB3 ASN 586 3.017 4.579 -2.408
291 HD21 ASN 586 HD21 ASN 586 4.599 5.010 -4.796
292 HD22 ASN 586 HD22 ASN 586 4.982 6.693 -4.817
293 H THR 587 HN THR 587 5.354 3.597 1.243
294 HA THR 587 HA THR 587 4.078 0.974 0.845
295 HB THR 587 HB THR 587 6.942 1.363 1.756
296 HG1 THR 587 HG1 THR 587 6.368 1.705 -0.581
297 HG21 THR 587 HG21 THR 587 7.097 -1.083 1.524
298 HG22 THR 587 HG22 THR 587 5.380 -1.151 1.126
299 HG23 THR 587 HG23 THR 587 5.892 -0.624 2.729
300 H ILE 588 HN ILE 588 3.364 -0.022 2.698
301 HA ILE 588 HA ILE 588 3.949 1.230 5.279
302 HB ILE 588 HB ILE 588 1.912 2.339 4.445
303 HG12 ILE 588 HG12 ILE 588 1.352 0.407 6.709
304 HG13 ILE 588 HG13 ILE 588 2.159 1.961 6.865
305 HG21 ILE 588 HG21 ILE 588 0.743 -0.435 4.362
306 HG22 ILE 588 HG22 ILE 588 1.072 0.607 2.977
307 HG23 ILE 588 HG23 ILE 588 -0.166 1.061 4.150
308 HD11 ILE 588 HD11 ILE 588 -0.146 2.112 7.587
309 HD12 ILE 588 HD12 ILE 588 -0.698 1.527 6.017
310 HD13 ILE 588 HD13 ILE 588 0.109 3.092 6.142
311 H GLU 589 HN GLU 589 3.640 -0.179 7.058
312 HA GLU 589 HA GLU 589 3.443 -3.007 6.318
313 HB2 GLU 589 HB2 GLU 589 5.402 -2.252 7.675
314 HB3 GLU 589 HB3 GLU 589 4.294 -1.794 8.961
315 HG2 GLU 589 HG2 GLU 589 3.509 -4.197 8.962
316 HG3 GLU 589 HG3 GLU 589 4.894 -4.556 7.933
317 H VAL 590 HN VAL 590 1.617 -4.077 6.672
318 HA VAL 590 HA VAL 590 -0.234 -3.068 8.737
319 HB VAL 590 HB VAL 590 -1.064 -4.358 6.130
320 HG11 VAL 590 HG11 VAL 590 -3.314 -3.574 6.783
321 HG12 VAL 590 HG12 VAL 590 -2.648 -3.035 8.325
322 HG13 VAL 590 HG13 VAL 590 -2.639 -4.750 7.913
323 HG21 VAL 590 HG21 VAL 590 -1.840 -2.144 5.433
324 HG22 VAL 590 HG22 VAL 590 -0.094 -2.159 5.698
325 HG23 VAL 590 HG23 VAL 590 -1.162 -1.444 6.906
326 H ASN 591 HN ASN 591 -0.404 -4.481 10.291
327 HA ASN 591 HA ASN 591 -0.516 -6.386 11.492
328 HB2 ASN 591 HB2 ASN 591 -2.504 -6.584 9.816
329 HB3 ASN 591 HB3 ASN 591 -1.532 -7.843 9.064
330 HD21 ASN 591 HD21 ASN 591 -1.172 -9.772 10.176
331 HD22 ASN 591 HD22 ASN 591 -2.127 -10.231 11.545
332 H GLY 592 HN GLY 592 1.976 -5.854 10.336
333 HA2 GLY 592 HA2 GLY 592 3.979 -7.009 10.633
334 HA3 GLY 592 HA3 GLY 592 3.086 -8.519 10.638
335 H LYS 593 HN LYS 593 2.128 -6.773 7.952
336 HA LYS 593 HA LYS 593 4.295 -7.901 6.307
337 HB2 LYS 593 HB2 LYS 593 1.326 -8.069 5.833
338 HB3 LYS 593 HB3 LYS 593 2.488 -8.250 4.525
339 HG2 LYS 593 HG2 LYS 593 3.547 -10.090 5.885
340 HG3 LYS 593 HG3 LYS 593 2.136 -9.996 6.939
341 HD2 LYS 593 HD2 LYS 593 0.661 -10.578 5.163
342 HD3 LYS 593 HD3 LYS 593 1.942 -10.403 3.965
343 HE2 LYS 593 HE2 LYS 593 1.537 -12.744 4.385
344 HE3 LYS 593 HE3 LYS 593 3.131 -12.304 4.995
345 HZ1 LYS 593 HZ1 LYS 593 1.845 -13.735 6.517
346 HZ2 LYS 593 HZ2 LYS 593 0.686 -12.511 6.670
347 HZ3 LYS 593 HZ3 LYS 593 2.275 -12.253 7.217
348 H TYR 594 HN TYR 594 4.917 -6.722 4.512
349 HA TYR 594 HA TYR 594 4.148 -3.922 4.613
350 HB2 TYR 594 HB2 TYR 594 6.365 -5.319 3.095
351 HB3 TYR 594 HB3 TYR 594 6.092 -3.580 3.107
352 HD1 TYR 594 HD1 TYR 594 6.338 -2.317 5.277
353 HD2 TYR 594 HD2 TYR 594 7.533 -6.379 4.852
354 HE1 TYR 594 HE1 TYR 594 7.759 -2.099 7.269
355 HE2 TYR 594 HE2 TYR 594 8.951 -6.172 6.847
356 HH TYR 594 HH TYR 594 10.171 -4.163 8.012
357 H PHE 595 HN PHE 595 3.003 -2.909 3.150
358 HA PHE 595 HA PHE 595 2.418 -4.219 0.570
359 HB2 PHE 595 HB2 PHE 595 0.409 -2.732 2.289
360 HB3 PHE 595 HB3 PHE 595 0.099 -3.440 0.713
361 HD1 PHE 595 HD1 PHE 595 -0.396 -5.752 0.479
362 HD2 PHE 595 HD2 PHE 595 0.757 -4.183 4.258
363 HE1 PHE 595 HE1 PHE 595 -1.063 -7.861 1.559
364 HE2 PHE 595 HE2 PHE 595 0.094 -6.290 5.341
365 HZ PHE 595 HZ PHE 595 -0.980 -8.070 4.002
366 H HIS 596 HN HIS 596 2.012 -2.685 -1.151
367 HA HIS 596 HA HIS 596 3.113 -0.104 -0.960
368 HB2 HIS 596 HB2 HIS 596 1.192 -1.407 -2.867
369 HB3 HIS 596 HB3 HIS 596 1.412 0.335 -2.936
370 HD2 HIS 596 HD2 HIS 596 4.740 0.218 -2.520
371 HE1 HIS 596 HE1 HIS 596 4.496 -1.869 -6.194
372 HE2 HIS 596 HE2 HIS 596 5.970 -0.426 -4.713
373 H SER 597 HN SER 597 2.362 1.683 -0.057
374 HA SER 597 HA SER 597 0.068 1.639 1.594
375 HB2 SER 597 HB2 SER 597 2.111 3.031 2.014
376 HB3 SER 597 HB3 SER 597 1.634 4.058 0.662
377 HG SER 597 HG SER 597 -0.152 3.562 2.789
378 H THR 598 HN THR 598 0.680 2.680 -1.656
379 HA THR 598 HA THR 598 -1.616 4.248 -2.051
380 HB THR 598 HB THR 598 -0.324 2.606 -4.215
381 HG1 THR 598 HG1 THR 598 0.933 4.910 -4.040
382 HG21 THR 598 HG21 THR 598 -1.414 5.426 -4.149
383 HG22 THR 598 HG22 THR 598 -2.252 4.020 -4.810
384 HG23 THR 598 HG23 THR 598 -0.765 4.596 -5.564
385 H CYS 599 HN CYS 599 -0.971 0.805 -2.331
386 HA CYS 599 HA CYS 599 -3.383 0.153 -3.721
387 HB2 CYS 599 HB2 CYS 599 -1.404 -1.610 -2.272
388 HB3 CYS 599 HB3 CYS 599 -2.682 -2.180 -3.343
389 H TYR 600 HN TYR 600 -2.430 0.296 -0.362
390 HA TYR 600 HA TYR 600 -4.180 -1.583 0.720
391 HB2 TYR 600 HB2 TYR 600 -2.307 -0.627 1.963
392 HB3 TYR 600 HB3 TYR 600 -3.101 0.943 1.985
393 HD1 TYR 600 HD1 TYR 600 -4.330 1.528 3.853
394 HD2 TYR 600 HD2 TYR 600 -3.718 -2.601 3.026
395 HE1 TYR 600 HE1 TYR 600 -5.428 0.942 5.974
396 HE2 TYR 600 HE2 TYR 600 -4.825 -3.198 5.140
397 HH TYR 600 HH TYR 600 -5.278 -2.140 7.341
398 H HIS 601 HN HIS 601 -4.712 1.738 -0.188
399 HA HIS 601 HA HIS 601 -7.082 2.234 1.228
400 HB2 HIS 601 HB2 HIS 601 -5.981 3.441 -1.306
401 HB3 HIS 601 HB3 HIS 601 -7.440 4.031 -0.513
402 HD2 HIS 601 HD2 HIS 601 -3.888 3.219 1.024
403 HE1 HIS 601 HE1 HIS 601 -5.111 7.113 2.126
404 HE2 HIS 601 HE2 HIS 601 -3.230 5.426 2.224
405 H GLU 602 HN GLU 602 -6.551 0.444 -1.736
406 HA GLU 602 HA GLU 602 -9.228 0.701 -2.691
407 HB2 GLU 602 HB2 GLU 602 -8.666 -0.796 -4.398
408 HB3 GLU 602 HB3 GLU 602 -7.156 0.020 -4.045
409 HG2 GLU 602 HG2 GLU 602 -6.397 -2.116 -4.184
410 HG3 GLU 602 HG3 GLU 602 -6.796 -2.070 -2.472
411 H THR 603 HN THR 603 -7.626 -1.358 -0.427
412 HA THR 603 HA THR 603 -9.783 -3.296 -0.347
413 HB THR 603 HB THR 603 -7.251 -3.036 1.288
414 HG1 THR 603 HG1 THR 603 -7.745 -4.000 -1.175
415 HG21 THR 603 HG21 THR 603 -9.022 -4.212 2.543
416 HG22 THR 603 HG22 THR 603 -7.679 -5.270 2.117
417 HG23 THR 603 HG23 THR 603 -9.186 -5.349 1.205
Start of MODEL 15
1 H GLY 548 HN GLY 548 3.224 9.391 1.160
2 HA2 GLY 548 HA2 GLY 548 5.155 9.505 -0.231
3 HA3 GLY 548 HA3 GLY 548 5.470 11.119 0.384
4 H LYS 549 HN LYS 549 4.663 8.971 2.858
5 HA LYS 549 HA LYS 549 7.333 8.974 3.873
6 HB2 LYS 549 HB2 LYS 549 4.819 7.598 4.816
7 HB3 LYS 549 HB3 LYS 549 6.363 7.430 5.637
8 HG2 LYS 549 HG2 LYS 549 6.423 9.849 6.002
9 HG3 LYS 549 HG3 LYS 549 4.859 9.998 5.199
10 HD2 LYS 549 HD2 LYS 549 3.770 8.748 6.899
11 HD3 LYS 549 HD3 LYS 549 5.308 8.262 7.616
12 HE2 LYS 549 HE2 LYS 549 4.338 11.109 7.455
13 HE3 LYS 549 HE3 LYS 549 4.107 10.068 8.858
14 HZ1 LYS 549 HZ1 LYS 549 6.499 9.863 9.070
15 HZ2 LYS 549 HZ2 LYS 549 6.045 11.495 9.111
16 HZ3 LYS 549 HZ3 LYS 549 6.736 10.845 7.709
17 H TYR 550 HN TYR 550 8.844 7.454 3.786
18 HA TYR 550 HA TYR 550 8.235 5.001 2.281
19 HB2 TYR 550 HB2 TYR 550 10.480 4.980 1.473
20 HB3 TYR 550 HB3 TYR 550 9.902 6.625 1.262
21 HD1 TYR 550 HD1 TYR 550 12.312 4.473 2.921
22 HD2 TYR 550 HD2 TYR 550 10.723 8.424 2.757
23 HE1 TYR 550 HE1 TYR 550 14.259 5.298 4.180
24 HE2 TYR 550 HE2 TYR 550 12.666 9.255 4.003
25 HH TYR 550 HH TYR 550 15.454 7.377 4.573
26 H VAL 551 HN VAL 551 9.402 3.085 2.934
27 HA VAL 551 HA VAL 551 10.217 3.135 5.774
28 HB VAL 551 HB VAL 551 9.036 0.809 4.226
29 HG11 VAL 551 HG11 VAL 551 10.580 0.037 5.907
30 HG12 VAL 551 HG12 VAL 551 8.932 -0.282 6.450
31 HG13 VAL 551 HG13 VAL 551 9.835 1.077 7.120
32 HG21 VAL 551 HG21 VAL 551 7.353 2.506 4.663
33 HG22 VAL 551 HG22 VAL 551 7.802 2.538 6.368
34 HG23 VAL 551 HG23 VAL 551 7.072 1.090 5.678
35 H VAL 552 HN VAL 552 12.231 2.472 6.188
36 HA VAL 552 HA VAL 552 14.097 2.091 4.113
37 HB VAL 552 HB VAL 552 14.373 1.404 7.050
38 HG11 VAL 552 HG11 VAL 552 16.107 0.355 5.713
39 HG12 VAL 552 HG12 VAL 552 16.781 1.676 6.669
40 HG13 VAL 552 HG13 VAL 552 16.476 1.899 4.946
41 HG21 VAL 552 HG21 VAL 552 15.408 3.609 7.258
42 HG22 VAL 552 HG22 VAL 552 13.731 3.721 6.727
43 HG23 VAL 552 HG23 VAL 552 15.040 3.940 5.565
44 H VAL 553 HN VAL 553 14.897 0.321 3.176
45 HA VAL 553 HA VAL 553 13.416 -2.049 3.127
46 HB VAL 553 HB VAL 553 16.278 -1.610 2.258
47 HG11 VAL 553 HG11 VAL 553 15.945 -3.572 0.818
48 HG12 VAL 553 HG12 VAL 553 14.355 -3.822 1.538
49 HG13 VAL 553 HG13 VAL 553 15.807 -3.985 2.526
50 HG21 VAL 553 HG21 VAL 553 13.698 -1.487 0.705
51 HG22 VAL 553 HG22 VAL 553 15.318 -1.337 0.023
52 HG23 VAL 553 HG23 VAL 553 14.716 -0.116 1.146
53 HA PRO 554 HA PRO 554 14.566 -3.814 7.001
54 HB2 PRO 554 HB2 PRO 554 13.735 -6.322 5.649
55 HB3 PRO 554 HB3 PRO 554 13.169 -5.627 7.171
56 HG2 PRO 554 HG2 PRO 554 11.679 -5.552 4.943
57 HG3 PRO 554 HG3 PRO 554 11.661 -4.232 6.124
58 HD2 PRO 554 HD2 PRO 554 12.944 -4.353 3.437
59 HD3 PRO 554 HD3 PRO 554 12.260 -2.967 4.309
60 H GLU 555 HN GLU 555 16.413 -4.639 7.766
61 HA GLU 555 HA GLU 555 18.427 -5.527 5.900
62 HB2 GLU 555 HB2 GLU 555 18.578 -5.296 8.909
63 HB3 GLU 555 HB3 GLU 555 19.937 -5.468 7.810
64 HG2 GLU 555 HG2 GLU 555 19.307 -3.297 6.788
65 HG3 GLU 555 HG3 GLU 555 18.075 -3.125 8.035
66 H THR 556 HN THR 556 15.982 -6.986 7.558
67 HA THR 556 HA THR 556 17.305 -9.457 8.207
68 HB THR 556 HB THR 556 14.926 -10.218 8.664
69 HG1 THR 556 HG1 THR 556 13.539 -8.167 8.899
70 HG21 THR 556 HG21 THR 556 14.703 -8.841 10.700
71 HG22 THR 556 HG22 THR 556 15.935 -7.745 10.075
72 HG23 THR 556 HG23 THR 556 16.354 -9.415 10.460
73 H SER 557 HN SER 557 16.260 -8.067 5.390
74 HA SER 557 HA SER 557 15.568 -10.646 4.164
75 HB2 SER 557 HB2 SER 557 13.841 -8.879 3.967
76 HB3 SER 557 HB3 SER 557 15.011 -7.848 3.143
77 HG SER 557 HG SER 557 14.176 -8.800 1.431
78 H GLN 558 HN GLN 558 16.681 -11.354 2.396
79 HA GLN 558 HA GLN 558 19.165 -9.936 1.774
80 HB2 GLN 558 HB2 GLN 558 18.306 -12.792 1.292
81 HB3 GLN 558 HB3 GLN 558 19.801 -12.108 0.667
82 HG2 GLN 558 HG2 GLN 558 20.528 -11.640 2.963
83 HG3 GLN 558 HG3 GLN 558 19.042 -12.375 3.562
84 HE21 GLN 558 HE21 GLN 558 20.702 -13.636 0.781
85 HE22 GLN 558 HE22 GLN 558 21.283 -15.078 1.534
86 H ASP 559 HN ASP 559 16.156 -9.912 0.722
87 HA ASP 559 HA ASP 559 16.984 -9.289 -2.023
88 HB2 ASP 559 HB2 ASP 559 15.791 -11.484 -1.992
89 HB3 ASP 559 HB3 ASP 559 14.400 -10.686 -1.264
90 H MET 560 HN MET 560 16.523 -7.235 -2.466
91 HA MET 560 HA MET 560 15.083 -5.657 -0.542
92 HB2 MET 560 HB2 MET 560 16.393 -4.882 -3.156
93 HB3 MET 560 HB3 MET 560 15.699 -3.744 -2.010
94 HG2 MET 560 HG2 MET 560 18.007 -3.711 -1.621
95 HG3 MET 560 HG3 MET 560 17.321 -4.665 -0.310
96 HE1 MET 560 HE1 MET 560 19.339 -4.734 -3.669
97 HE2 MET 560 HE2 MET 560 17.945 -5.746 -4.052
98 HE3 MET 560 HE3 MET 560 19.550 -6.465 -3.930
99 H ALA 561 HN ALA 561 13.390 -7.534 -1.782
100 HA ALA 561 HA ALA 561 11.479 -5.752 -3.064
101 HB1 ALA 561 HB1 ALA 561 12.314 -8.371 -4.311
102 HB2 ALA 561 HB2 ALA 561 12.774 -6.772 -4.895
103 HB3 ALA 561 HB3 ALA 561 11.080 -7.265 -4.917
104 H PHE 562 HN PHE 562 9.377 -6.282 -2.693
105 HA PHE 562 HA PHE 562 8.752 -8.970 -1.689
106 HB2 PHE 562 HB2 PHE 562 7.275 -8.169 0.001
107 HB3 PHE 562 HB3 PHE 562 8.772 -7.279 0.219
108 HD1 PHE 562 HD1 PHE 562 5.242 -7.053 -0.691
109 HD2 PHE 562 HD2 PHE 562 8.896 -4.909 -0.292
110 HE1 PHE 562 HE1 PHE 562 4.008 -4.926 -0.823
111 HE2 PHE 562 HE2 PHE 562 7.670 -2.783 -0.414
112 HZ PHE 562 HZ PHE 562 5.148 -2.827 -0.542
113 H LYS 563 HN LYS 563 6.592 -9.661 -2.328
114 HA LYS 563 HA LYS 563 5.835 -8.274 -4.777
115 HB2 LYS 563 HB2 LYS 563 6.319 -10.703 -4.844
116 HB3 LYS 563 HB3 LYS 563 4.945 -10.979 -3.782
117 HG2 LYS 563 HG2 LYS 563 3.404 -10.481 -5.424
118 HG3 LYS 563 HG3 LYS 563 4.558 -9.530 -6.363
119 HD2 LYS 563 HD2 LYS 563 5.788 -11.589 -6.894
120 HD3 LYS 563 HD3 LYS 563 4.577 -12.525 -6.015
121 HE2 LYS 563 HE2 LYS 563 2.867 -11.852 -7.579
122 HE3 LYS 563 HE3 LYS 563 3.999 -10.772 -8.399
123 HZ1 LYS 563 HZ1 LYS 563 4.208 -13.730 -8.244
124 HZ2 LYS 563 HZ2 LYS 563 5.335 -12.702 -8.991
125 HZ3 LYS 563 HZ3 LYS 563 3.766 -12.833 -9.616
126 H CYS 564 HN CYS 564 4.209 -6.964 -4.847
127 HA CYS 564 HA CYS 564 2.445 -6.601 -2.616
128 HB2 CYS 564 HB2 CYS 564 3.184 -4.659 -3.759
129 HB3 CYS 564 HB3 CYS 564 2.748 -5.322 -5.324
130 HA PRO 565 HA PRO 565 -0.441 -9.656 -4.227
131 HB2 PRO 565 HB2 PRO 565 -1.981 -8.914 -1.819
132 HB3 PRO 565 HB3 PRO 565 -1.315 -10.482 -2.281
133 HG2 PRO 565 HG2 PRO 565 -0.247 -9.090 -0.275
134 HG3 PRO 565 HG3 PRO 565 0.783 -9.997 -1.401
135 HD2 PRO 565 HD2 PRO 565 0.144 -7.059 -1.380
136 HD3 PRO 565 HD3 PRO 565 1.723 -7.859 -1.549
137 H ILE 566 HN ILE 566 -1.186 -6.339 -3.396
138 HA ILE 566 HA ILE 566 -3.941 -6.439 -4.022
139 HB ILE 566 HB ILE 566 -2.080 -4.072 -3.835
140 HG12 ILE 566 HG12 ILE 566 -3.814 -5.473 -1.786
141 HG13 ILE 566 HG13 ILE 566 -2.062 -5.320 -1.770
142 HG21 ILE 566 HG21 ILE 566 -5.089 -4.207 -3.731
143 HG22 ILE 566 HG22 ILE 566 -4.116 -3.509 -5.028
144 HG23 ILE 566 HG23 ILE 566 -4.116 -2.767 -3.428
145 HD11 ILE 566 HD11 ILE 566 -2.261 -2.929 -1.403
146 HD12 ILE 566 HD12 ILE 566 -3.111 -3.843 -0.155
147 HD13 ILE 566 HD13 ILE 566 -4.017 -3.061 -1.452
148 H CYS 567 HN CYS 567 -1.064 -5.546 -5.900
149 HA CYS 567 HA CYS 567 -2.798 -5.516 -8.270
150 HB2 CYS 567 HB2 CYS 567 -1.369 -3.832 -9.313
151 HB3 CYS 567 HB3 CYS 567 -2.078 -3.242 -7.816
152 H LYS 568 HN LYS 568 -0.496 -7.190 -6.728
153 HA LYS 568 HA LYS 568 0.562 -9.099 -7.285
154 HB2 LYS 568 HB2 LYS 568 -0.592 -8.665 -10.038
155 HB3 LYS 568 HB3 LYS 568 0.148 -10.149 -9.456
156 HG2 LYS 568 HG2 LYS 568 -1.605 -10.450 -7.840
157 HG3 LYS 568 HG3 LYS 568 -2.318 -8.895 -8.270
158 HD2 LYS 568 HD2 LYS 568 -3.560 -10.663 -9.343
159 HD3 LYS 568 HD3 LYS 568 -2.680 -9.743 -10.568
160 HE2 LYS 568 HE2 LYS 568 -2.470 -12.081 -11.064
161 HE3 LYS 568 HE3 LYS 568 -0.907 -11.480 -10.514
162 HZ1 LYS 568 HZ1 LYS 568 -2.867 -13.000 -8.878
163 HZ2 LYS 568 HZ2 LYS 568 -1.394 -12.387 -8.308
164 HZ3 LYS 568 HZ3 LYS 568 -1.404 -13.595 -9.497
165 H GLU 569 HN GLU 569 1.783 -6.294 -7.916
166 HA GLU 569 HA GLU 569 3.859 -7.306 -9.724
167 HB2 GLU 569 HB2 GLU 569 2.863 -4.539 -9.170
168 HB3 GLU 569 HB3 GLU 569 4.491 -4.783 -9.795
169 HG2 GLU 569 HG2 GLU 569 1.963 -5.781 -11.088
170 HG3 GLU 569 HG3 GLU 569 2.864 -4.346 -11.572
171 H THR 570 HN THR 570 5.896 -7.451 -9.131
172 HA THR 570 HA THR 570 6.548 -7.617 -6.392
173 HB THR 570 HB THR 570 8.397 -7.582 -8.786
174 HG1 THR 570 HG1 THR 570 6.904 -9.211 -9.088
175 HG21 THR 570 HG21 THR 570 8.733 -8.702 -5.996
176 HG22 THR 570 HG22 THR 570 9.609 -7.340 -6.694
177 HG23 THR 570 HG23 THR 570 9.852 -8.965 -7.335
178 H VAL 571 HN VAL 571 7.302 -6.136 -5.049
179 HA VAL 571 HA VAL 571 7.830 -3.436 -6.052
180 HB VAL 571 HB VAL 571 7.634 -4.333 -3.180
181 HG11 VAL 571 HG11 VAL 571 8.621 -2.145 -3.484
182 HG12 VAL 571 HG12 VAL 571 7.013 -1.989 -2.777
183 HG13 VAL 571 HG13 VAL 571 7.263 -1.643 -4.489
184 HG21 VAL 571 HG21 VAL 571 5.400 -3.409 -4.977
185 HG22 VAL 571 HG22 VAL 571 5.276 -3.657 -3.235
186 HG23 VAL 571 HG23 VAL 571 5.603 -5.024 -4.300
187 H THR 572 HN THR 572 9.882 -2.893 -6.403
188 HA THR 572 HA THR 572 11.966 -4.077 -4.693
189 HB THR 572 HB THR 572 13.560 -3.302 -6.496
190 HG1 THR 572 HG1 THR 572 11.287 -2.228 -7.483
191 HG21 THR 572 HG21 THR 572 13.052 -5.170 -8.006
192 HG22 THR 572 HG22 THR 572 11.448 -5.309 -7.289
193 HG23 THR 572 HG23 THR 572 12.881 -5.635 -6.314
194 H GLY 573 HN GLY 573 13.743 -2.600 -4.040
195 HA2 GLY 573 HA2 GLY 573 12.797 0.187 -3.852
196 HA3 GLY 573 HA3 GLY 573 13.408 -0.682 -2.449
197 H VAL 574 HN VAL 574 14.457 1.740 -3.377
198 HA VAL 574 HA VAL 574 16.981 0.938 -4.667
199 HB VAL 574 HB VAL 574 15.742 3.695 -4.698
200 HG11 VAL 574 HG11 VAL 574 18.145 3.667 -5.056
201 HG12 VAL 574 HG12 VAL 574 17.311 4.091 -6.550
202 HG13 VAL 574 HG13 VAL 574 17.960 2.465 -6.332
203 HG21 VAL 574 HG21 VAL 574 14.237 2.200 -5.854
204 HG22 VAL 574 HG22 VAL 574 15.572 1.533 -6.794
205 HG23 VAL 574 HG23 VAL 574 15.080 3.211 -7.027
206 H TYR 575 HN TYR 575 18.896 1.816 -3.869
207 HA TYR 575 HA TYR 575 18.900 2.642 -1.112
208 HB2 TYR 575 HB2 TYR 575 20.668 1.166 -1.932
209 HB3 TYR 575 HB3 TYR 575 21.131 2.355 -3.143
210 HD1 TYR 575 HD1 TYR 575 23.123 3.392 -2.674
211 HD2 TYR 575 HD2 TYR 575 20.525 2.412 0.554
212 HE1 TYR 575 HE1 TYR 575 24.711 4.403 -1.091
213 HE2 TYR 575 HE2 TYR 575 22.109 3.420 2.142
214 HH TYR 575 HH TYR 575 24.476 3.957 2.279
215 H ASP 576 HN ASP 576 18.713 4.706 -0.479
216 HA ASP 576 HA ASP 576 19.123 6.821 -2.447
217 HB2 ASP 576 HB2 ASP 576 17.130 6.895 -0.925
218 HB3 ASP 576 HB3 ASP 576 18.234 7.077 0.437
219 H GLU 577 HN GLU 577 21.133 7.409 -2.722
220 HA GLU 577 HA GLU 577 23.207 6.618 -0.975
221 HB2 GLU 577 HB2 GLU 577 23.246 8.481 -3.347
222 HB3 GLU 577 HB3 GLU 577 24.671 7.792 -2.577
223 HG2 GLU 577 HG2 GLU 577 24.067 5.590 -3.240
224 HG3 GLU 577 HG3 GLU 577 22.472 6.125 -3.757
225 H GLU 578 HN GLU 578 21.409 9.573 -1.308
226 HA GLU 578 HA GLU 578 23.294 11.218 0.057
227 HB2 GLU 578 HB2 GLU 578 20.385 11.613 -0.641
228 HB3 GLU 578 HB3 GLU 578 21.349 12.835 0.176
229 HG2 GLU 578 HG2 GLU 578 21.598 13.548 -1.959
230 HG3 GLU 578 HG3 GLU 578 22.958 12.434 -1.880
231 H SER 579 HN SER 579 20.245 9.630 1.038
232 HA SER 579 HA SER 579 20.623 10.556 3.754
233 HB2 SER 579 HB2 SER 579 18.551 9.277 4.240
234 HB3 SER 579 HB3 SER 579 18.354 10.411 2.905
235 HG SER 579 HG SER 579 18.445 8.744 1.466
236 H GLY 580 HN GLY 580 21.457 7.801 1.898
237 HA2 GLY 580 HA2 GLY 580 22.970 6.138 2.466
238 HA3 GLY 580 HA3 GLY 580 22.966 6.738 4.117
239 H GLU 581 HN GLU 581 19.919 6.076 2.659
240 HA GLU 581 HA GLU 581 19.769 3.503 4.073
241 HB2 GLU 581 HB2 GLU 581 17.717 5.728 4.125
242 HB3 GLU 581 HB3 GLU 581 17.460 4.116 4.783
243 HG2 GLU 581 HG2 GLU 581 19.219 4.453 6.397
244 HG3 GLU 581 HG3 GLU 581 19.595 6.028 5.698
245 H TRP 582 HN TRP 582 18.440 1.957 3.156
246 HA TRP 582 HA TRP 582 17.758 2.274 0.376
247 HB2 TRP 582 HB2 TRP 582 17.245 0.018 2.320
248 HB3 TRP 582 HB3 TRP 582 16.862 -0.049 0.600
249 HD1 TRP 582 HD1 TRP 582 19.899 0.033 2.977
250 HE1 TRP 582 HE1 TRP 582 21.927 -0.941 1.715
251 HE3 TRP 582 HE3 TRP 582 17.796 -0.465 -1.647
252 HZ2 TRP 582 HZ2 TRP 582 22.541 -1.813 -0.907
253 HZ3 TRP 582 HZ3 TRP 582 19.155 -1.376 -3.478
254 HH2 TRP 582 HH2 TRP 582 21.483 -2.039 -3.118
255 H VAL 583 HN VAL 583 15.726 2.579 -0.473
256 HA VAL 583 HA VAL 583 13.711 3.277 1.556
257 HB VAL 583 HB VAL 583 12.839 4.950 0.017
258 HG11 VAL 583 HG11 VAL 583 14.545 5.640 1.590
259 HG12 VAL 583 HG12 VAL 583 14.718 6.526 0.075
260 HG13 VAL 583 HG13 VAL 583 15.814 5.195 0.448
261 HG21 VAL 583 HG21 VAL 583 15.129 4.205 -1.800
262 HG22 VAL 583 HG22 VAL 583 13.962 5.505 -2.061
263 HG23 VAL 583 HG23 VAL 583 13.431 3.821 -2.081
264 H TRP 584 HN TRP 584 11.912 2.131 1.596
265 HA TRP 584 HA TRP 584 10.776 1.203 -0.958
266 HB2 TRP 584 HB2 TRP 584 10.329 0.357 1.898
267 HB3 TRP 584 HB3 TRP 584 9.087 0.073 0.687
268 HD1 TRP 584 HD1 TRP 584 12.121 -0.394 -1.160
269 HE1 TRP 584 HE1 TRP 584 12.813 -2.856 -1.295
270 HE3 TRP 584 HE3 TRP 584 9.187 -2.240 2.574
271 HZ2 TRP 584 HZ2 TRP 584 12.198 -5.278 0.016
272 HZ3 TRP 584 HZ3 TRP 584 9.287 -4.645 3.069
273 HH2 TRP 584 HH2 TRP 584 10.768 -6.136 1.812
274 H LYS 585 HN LYS 585 9.653 2.876 -1.798
275 HA LYS 585 HA LYS 585 8.384 4.759 0.032
276 HB2 LYS 585 HB2 LYS 585 8.271 6.270 -1.863
277 HB3 LYS 585 HB3 LYS 585 9.900 5.640 -1.691
278 HG2 LYS 585 HG2 LYS 585 9.756 5.312 -3.903
279 HG3 LYS 585 HG3 LYS 585 8.833 3.872 -3.460
280 HD2 LYS 585 HD2 LYS 585 6.766 5.140 -3.624
281 HD3 LYS 585 HD3 LYS 585 7.677 6.591 -4.041
282 HE2 LYS 585 HE2 LYS 585 8.581 5.288 -6.017
283 HE3 LYS 585 HE3 LYS 585 7.358 4.070 -5.655
284 HZ1 LYS 585 HZ1 LYS 585 5.678 5.880 -5.855
285 HZ2 LYS 585 HZ2 LYS 585 6.489 5.529 -7.299
286 HZ3 LYS 585 HZ3 LYS 585 6.913 6.905 -6.405
287 H ASN 586 HN ASN 586 6.203 5.476 -0.319
288 HA ASN 586 HA ASN 586 3.974 4.970 -0.301
289 HB2 ASN 586 HB2 ASN 586 4.638 3.577 -2.917
290 HB3 ASN 586 HB3 ASN 586 3.027 3.976 -2.347
291 HD21 ASN 586 HD21 ASN 586 2.620 5.229 -4.131
292 HD22 ASN 586 HD22 ASN 586 3.294 6.811 -4.317
293 H THR 587 HN THR 587 5.530 3.368 1.252
294 HA THR 587 HA THR 587 4.253 0.720 0.994
295 HB THR 587 HB THR 587 7.011 1.265 2.124
296 HG1 THR 587 HG1 THR 587 6.465 1.338 -0.339
297 HG21 THR 587 HG21 THR 587 5.629 -1.344 1.480
298 HG22 THR 587 HG22 THR 587 5.900 -0.703 3.100
299 HG23 THR 587 HG23 THR 587 7.272 -1.165 2.092
300 H ILE 588 HN ILE 588 3.384 -0.148 2.830
301 HA ILE 588 HA ILE 588 3.830 1.213 5.386
302 HB ILE 588 HB ILE 588 1.762 2.183 4.406
303 HG12 ILE 588 HG12 ILE 588 1.238 0.406 6.806
304 HG13 ILE 588 HG13 ILE 588 2.041 1.973 6.860
305 HG21 ILE 588 HG21 ILE 588 1.003 0.324 3.068
306 HG22 ILE 588 HG22 ILE 588 -0.253 0.754 4.232
307 HG23 ILE 588 HG23 ILE 588 0.764 -0.656 4.514
308 HD11 ILE 588 HD11 ILE 588 -0.004 3.046 6.065
309 HD12 ILE 588 HD12 ILE 588 -0.281 2.137 7.551
310 HD13 ILE 588 HD13 ILE 588 -0.801 1.473 6.003
311 H GLU 589 HN GLU 589 3.567 -0.139 7.197
312 HA GLU 589 HA GLU 589 3.384 -2.988 6.547
313 HB2 GLU 589 HB2 GLU 589 5.417 -2.314 7.741
314 HB3 GLU 589 HB3 GLU 589 4.445 -1.622 9.030
315 HG2 GLU 589 HG2 GLU 589 4.051 -4.497 8.392
316 HG3 GLU 589 HG3 GLU 589 5.537 -4.023 9.215
317 H VAL 590 HN VAL 590 1.558 -3.962 6.889
318 HA VAL 590 HA VAL 590 -0.171 -3.103 9.111
319 HB VAL 590 HB VAL 590 -1.153 -3.914 6.362
320 HG11 VAL 590 HG11 VAL 590 -2.692 -2.992 8.791
321 HG12 VAL 590 HG12 VAL 590 -2.623 -4.642 8.174
322 HG13 VAL 590 HG13 VAL 590 -3.376 -3.373 7.209
323 HG21 VAL 590 HG21 VAL 590 -1.956 -1.609 6.157
324 HG22 VAL 590 HG22 VAL 590 -0.202 -1.670 6.335
325 HG23 VAL 590 HG23 VAL 590 -1.211 -1.212 7.706
326 H ASN 591 HN ASN 591 -0.665 -4.724 10.412
327 HA ASN 591 HA ASN 591 -0.890 -6.798 11.303
328 HB2 ASN 591 HB2 ASN 591 -2.633 -6.860 9.432
329 HB3 ASN 591 HB3 ASN 591 -1.458 -7.775 8.498
330 HD21 ASN 591 HD21 ASN 591 -3.469 -7.790 11.361
331 HD22 ASN 591 HD22 ASN 591 -3.479 -9.506 11.578
332 H GLY 592 HN GLY 592 1.714 -5.901 10.365
333 HA2 GLY 592 HA2 GLY 592 3.786 -6.886 10.760
334 HA3 GLY 592 HA3 GLY 592 3.037 -8.468 10.650
335 H LYS 593 HN LYS 593 2.023 -6.765 7.992
336 HA LYS 593 HA LYS 593 4.270 -7.781 6.386
337 HB2 LYS 593 HB2 LYS 593 1.314 -7.931 5.824
338 HB3 LYS 593 HB3 LYS 593 2.521 -8.138 4.563
339 HG2 LYS 593 HG2 LYS 593 2.380 -9.814 7.059
340 HG3 LYS 593 HG3 LYS 593 1.654 -10.262 5.512
341 HD2 LYS 593 HD2 LYS 593 3.896 -10.140 4.462
342 HD3 LYS 593 HD3 LYS 593 4.591 -9.770 6.042
343 HE2 LYS 593 HE2 LYS 593 3.045 -12.276 5.397
344 HE3 LYS 593 HE3 LYS 593 4.805 -12.159 5.377
345 HZ1 LYS 593 HZ1 LYS 593 4.014 -13.073 7.463
346 HZ2 LYS 593 HZ2 LYS 593 3.056 -11.699 7.737
347 HZ3 LYS 593 HZ3 LYS 593 4.748 -11.564 7.722
348 H TYR 594 HN TYR 594 4.860 -6.657 4.556
349 HA TYR 594 HA TYR 594 4.161 -3.829 4.625
350 HB2 TYR 594 HB2 TYR 594 6.336 -5.296 3.109
351 HB3 TYR 594 HB3 TYR 594 6.092 -3.553 3.094
352 HD1 TYR 594 HD1 TYR 594 7.495 -6.356 4.874
353 HD2 TYR 594 HD2 TYR 594 6.407 -2.257 5.213
354 HE1 TYR 594 HE1 TYR 594 8.925 -6.148 6.860
355 HE2 TYR 594 HE2 TYR 594 7.844 -2.032 7.191
356 HH TYR 594 HH TYR 594 10.147 -4.320 8.081
357 H PHE 595 HN PHE 595 3.014 -2.848 3.152
358 HA PHE 595 HA PHE 595 2.497 -4.121 0.543
359 HB2 PHE 595 HB2 PHE 595 0.414 -2.826 2.339
360 HB3 PHE 595 HB3 PHE 595 0.131 -3.341 0.686
361 HD1 PHE 595 HD1 PHE 595 0.696 -4.457 4.127
362 HD2 PHE 595 HD2 PHE 595 -0.269 -5.635 0.155
363 HE1 PHE 595 HE1 PHE 595 0.025 -6.671 4.947
364 HE2 PHE 595 HE2 PHE 595 -0.952 -7.850 0.976
365 HZ PHE 595 HZ PHE 595 -0.908 -8.345 3.365
366 H HIS 596 HN HIS 596 1.857 -2.495 -1.106
367 HA HIS 596 HA HIS 596 2.940 0.110 -0.749
368 HB2 HIS 596 HB2 HIS 596 0.931 -0.995 -2.729
369 HB3 HIS 596 HB3 HIS 596 1.404 0.698 -2.723
370 HD2 HIS 596 HD2 HIS 596 4.576 0.528 -2.650
371 HE1 HIS 596 HE1 HIS 596 4.138 -2.103 -5.948
372 HE2 HIS 596 HE2 HIS 596 5.701 -0.489 -4.757
373 H SER 597 HN SER 597 2.088 1.730 0.404
374 HA SER 597 HA SER 597 -0.416 1.506 1.711
375 HB2 SER 597 HB2 SER 597 0.114 4.057 2.131
376 HB3 SER 597 HB3 SER 597 1.078 2.800 2.911
377 HG SER 597 HG SER 597 2.678 3.821 1.999
378 H THR 598 HN THR 598 0.693 2.978 -1.229
379 HA THR 598 HA THR 598 -1.583 4.462 -1.912
380 HB THR 598 HB THR 598 0.313 3.009 -3.780
381 HG1 THR 598 HG1 THR 598 0.685 5.695 -3.145
382 HG21 THR 598 HG21 THR 598 -0.225 4.815 -5.349
383 HG22 THR 598 HG22 THR 598 -1.347 5.512 -4.179
384 HG23 THR 598 HG23 THR 598 -1.680 3.933 -4.892
385 H CYS 599 HN CYS 599 -0.759 1.060 -2.356
386 HA CYS 599 HA CYS 599 -3.123 0.409 -3.841
387 HB2 CYS 599 HB2 CYS 599 -1.158 -1.367 -2.389
388 HB3 CYS 599 HB3 CYS 599 -2.438 -1.937 -3.448
389 H TYR 600 HN TYR 600 -2.232 0.602 -0.508
390 HA TYR 600 HA TYR 600 -3.960 -1.206 0.688
391 HB2 TYR 600 HB2 TYR 600 -2.141 -0.121 1.890
392 HB3 TYR 600 HB3 TYR 600 -2.930 1.441 1.736
393 HD1 TYR 600 HD1 TYR 600 -3.302 -1.922 3.274
394 HD2 TYR 600 HD2 TYR 600 -4.453 2.172 3.371
395 HE1 TYR 600 HE1 TYR 600 -4.431 -2.299 5.424
396 HE2 TYR 600 HE2 TYR 600 -5.592 1.806 5.522
397 HH TYR 600 HH TYR 600 -6.579 -0.065 6.799
398 H HIS 601 HN HIS 601 -4.581 2.029 -0.482
399 HA HIS 601 HA HIS 601 -6.926 2.551 0.937
400 HB2 HIS 601 HB2 HIS 601 -5.971 3.567 -1.735
401 HB3 HIS 601 HB3 HIS 601 -7.410 4.175 -0.921
402 HD2 HIS 601 HD2 HIS 601 -5.386 3.771 1.993
403 HE1 HIS 601 HE1 HIS 601 -3.929 7.387 0.350
404 HE2 HIS 601 HE2 HIS 601 -4.231 6.042 2.482
405 H GLU 602 HN GLU 602 -6.444 0.651 -2.007
406 HA GLU 602 HA GLU 602 -9.230 0.661 -2.652
407 HB2 GLU 602 HB2 GLU 602 -8.782 -0.818 -4.419
408 HB3 GLU 602 HB3 GLU 602 -7.375 0.223 -4.326
409 HG2 GLU 602 HG2 GLU 602 -5.999 -1.485 -3.567
410 HG3 GLU 602 HG3 GLU 602 -7.359 -2.443 -2.967
411 H THR 603 HN THR 603 -7.175 -1.366 -0.662
412 HA THR 603 HA THR 603 -9.280 -3.361 -0.441
413 HB THR 603 HB THR 603 -6.983 -4.195 -0.598
414 HG1 THR 603 HG1 THR 603 -8.741 -4.797 1.363
415 HG21 THR 603 HG21 THR 603 -6.544 -2.745 2.015
416 HG22 THR 603 HG22 THR 603 -5.778 -2.387 0.467
417 HG23 THR 603 HG23 THR 603 -5.425 -3.902 1.297