Result table
| image | mrblock_id | pdb_id | cing | stage | position | program | type |
|
|
1216 | 1acz RC | cing | 1-original | 9 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 1H CYS 509 1H CYS 509 1.255 -27.870 -8.737
2 2H CYS 509 3H CYS 509 1.835 -28.272 -7.195
3 3H CYS 509 2H CYS 509 0.384 -28.953 -7.759
4 HA CYS 509 HA CYS 509 -0.732 -26.867 -7.683
5 1HB CYS 509 2HB CYS 509 -0.546 -28.153 -5.563
6 2HB CYS 509 1HB CYS 509 0.928 -27.267 -5.174
7 H THR 510 H THR 510 0.044 -25.198 -9.015
8 HA THR 510 HA THR 510 1.888 -23.301 -7.667
9 HB THR 510 HB THR 510 3.200 -22.989 -9.720
10 HG1 THR 510 HG1 THR 510 2.713 -24.033 -11.529
11 1HG2 THR 510 1HG2 THR 510 3.826 -24.754 -8.024
12 2HG2 THR 510 3HG2 THR 510 3.039 -25.940 -9.065
13 3HG2 THR 510 2HG2 THR 510 4.445 -25.049 -9.648
14 H THR 511 H THR 511 -1.065 -23.603 -8.583
15 HA THR 511 HA THR 511 -1.412 -21.514 -10.576
16 HB THR 511 HB THR 511 -3.747 -21.976 -8.907
17 HG1 THR 511 HG1 THR 511 -3.895 -24.168 -9.225
18 1HG2 THR 511 3HG2 THR 511 -3.627 -21.182 -11.304
19 2HG2 THR 511 2HG2 THR 511 -3.170 -22.825 -11.754
20 3HG2 THR 511 1HG2 THR 511 -4.747 -22.516 -11.028
21 HA PRO 512 HA PRO 512 -2.619 -18.898 -6.768
22 1HB PRO 512 2HB PRO 512 -2.263 -20.022 -4.285
23 2HB PRO 512 1HB PRO 512 -3.765 -20.159 -5.215
24 1HG PRO 512 2HG PRO 512 -1.664 -22.217 -4.732
25 2HG PRO 512 1HG PRO 512 -3.386 -22.434 -5.085
26 1HD PRO 512 2HD PRO 512 -1.259 -22.743 -6.928
27 2HD PRO 512 1HD PRO 512 -2.987 -22.645 -7.330
28 H THR 513 H THR 513 -0.474 -18.136 -7.677
29 HA THR 513 HA THR 513 1.756 -18.484 -5.717
30 HB THR 513 HB THR 513 3.225 -17.719 -7.593
31 HG1 THR 513 HG1 THR 513 2.369 -17.131 -9.429
32 1HG2 THR 513 2HG2 THR 513 1.571 -20.182 -7.620
33 2HG2 THR 513 1HG2 THR 513 2.460 -19.830 -9.103
34 3HG2 THR 513 3HG2 THR 513 3.325 -20.003 -7.575
35 H ALA 514 H ALA 514 -0.653 -16.357 -6.540
36 HA ALA 514 HA ALA 514 0.972 -13.911 -6.180
37 1HB ALA 514 2HB ALA 514 -1.363 -14.463 -7.593
38 2HB ALA 514 1HB ALA 514 -1.926 -13.555 -6.190
39 3HB ALA 514 3HB ALA 514 -0.711 -12.859 -7.262
40 H VAL 515 H VAL 515 -0.231 -12.247 -4.618
41 HA VAL 515 HA VAL 515 -1.065 -13.697 -2.159
42 HB VAL 515 HB VAL 515 0.883 -11.415 -2.221
43 1HG1 VAL 515 2HG1 VAL 515 -0.796 -11.516 -0.315
44 2HG1 VAL 515 1HG1 VAL 515 -0.079 -13.056 0.128
45 3HG1 VAL 515 3HG1 VAL 515 0.903 -11.588 0.159
46 1HG2 VAL 515 2HG2 VAL 515 1.180 -14.364 -1.652
47 2HG2 VAL 515 1HG2 VAL 515 1.932 -13.462 -2.965
48 3HG2 VAL 515 3HG2 VAL 515 2.424 -13.162 -1.299
49 H ALA 516 H ALA 516 -3.240 -13.037 -2.310
50 HA ALA 516 HA ALA 516 -3.859 -10.231 -2.852
51 1HB ALA 516 2HB ALA 516 -5.395 -12.164 -3.440
52 2HB ALA 516 1HB ALA 516 -5.718 -12.335 -1.714
53 3HB ALA 516 3HB ALA 516 -6.168 -10.848 -2.552
54 H VAL 517 H VAL 517 -3.425 -8.725 -1.274
55 HA VAL 517 HA VAL 517 -4.045 -9.568 1.528
56 HB VAL 517 HB VAL 517 -2.227 -7.299 1.318
57 1HG1 VAL 517 3HG1 VAL 517 -2.838 -8.623 3.335
58 2HG1 VAL 517 2HG1 VAL 517 -1.931 -9.978 2.665
59 3HG1 VAL 517 1HG1 VAL 517 -1.093 -8.472 3.079
60 1HG2 VAL 517 2HG2 VAL 517 -1.436 -8.713 -0.648
61 2HG2 VAL 517 1HG2 VAL 517 -0.249 -8.354 0.618
62 3HG2 VAL 517 3HG2 VAL 517 -1.017 -9.942 0.547
63 H THR 518 H THR 518 -5.496 -8.186 2.529
64 HA THR 518 HA THR 518 -6.371 -5.824 0.960
65 HB THR 518 HB THR 518 -8.076 -5.968 3.105
66 HG1 THR 518 HG1 THR 518 -7.120 -7.861 3.860
67 1HG2 THR 518 2HG2 THR 518 -8.227 -7.457 0.470
68 2HG2 THR 518 1HG2 THR 518 -9.604 -7.169 1.534
69 3HG2 THR 518 3HG2 THR 518 -8.773 -5.809 0.779
70 H PHE 519 H PHE 519 -5.627 -3.872 1.574
71 HA PHE 519 HA PHE 519 -4.627 -3.602 4.371
72 1HB PHE 519 2HB PHE 519 -3.749 -1.634 2.301
73 2HB PHE 519 1HB PHE 519 -2.907 -2.210 3.718
74 HD1 PHE 519 HD1 PHE 519 -4.231 -3.651 0.476
75 HD2 PHE 519 HD2 PHE 519 -1.088 -3.513 3.391
76 HE1 PHE 519 HE1 PHE 519 -2.921 -5.273 -0.862
77 HE2 PHE 519 HE2 PHE 519 0.224 -5.140 2.052
78 HZ PHE 519 HZ PHE 519 -0.701 -6.015 -0.062
79 H ASP 520 H ASP 520 -5.018 -1.598 5.404
80 HA ASP 520 HA ASP 520 -6.971 0.221 4.156
81 1HB ASP 520 2HB ASP 520 -7.451 -1.577 6.498
82 2HB ASP 520 1HB ASP 520 -8.087 0.059 6.584
83 H LEU 521 H LEU 521 -6.946 2.317 5.314
84 HA LEU 521 HA LEU 521 -5.122 2.654 7.550
85 1HB LEU 521 2HB LEU 521 -3.658 2.455 5.447
86 2HB LEU 521 1HB LEU 521 -4.313 4.034 5.004
87 HG LEU 521 HG LEU 521 -3.107 3.531 7.723
88 1HD1 LEU 521 2HD1 LEU 521 -1.741 3.435 5.242
89 2HD1 LEU 521 1HD1 LEU 521 -1.343 4.992 5.961
90 3HD1 LEU 521 3HD1 LEU 521 -1.023 3.500 6.845
91 1HD2 LEU 521 2HD2 LEU 521 -3.756 5.945 6.018
92 2HD2 LEU 521 1HD2 LEU 521 -4.446 5.532 7.590
93 3HD2 LEU 521 3HD2 LEU 521 -2.757 6.049 7.469
94 H THR 522 H THR 522 -6.106 4.151 8.762
95 HA THR 522 HA THR 522 -7.984 5.983 7.444
96 HB THR 522 HB THR 522 -7.182 6.081 10.351
97 HG1 THR 522 HG1 THR 522 -9.140 4.446 9.111
98 1HG2 THR 522 3HG2 THR 522 -8.637 7.876 9.262
99 2HG2 THR 522 2HG2 THR 522 -9.858 6.621 9.055
100 3HG2 THR 522 1HG2 THR 522 -9.326 7.075 10.674
101 H ALA 523 H ALA 523 -7.084 7.699 6.329
102 HA ALA 523 HA ALA 523 -5.324 9.455 7.916
103 1HB ALA 523 3HB ALA 523 -4.512 8.289 5.253
104 2HB ALA 523 2HB ALA 523 -3.620 9.558 6.109
105 3HB ALA 523 1HB ALA 523 -3.754 7.946 6.805
106 H THR 524 H THR 524 -7.931 9.353 6.254
107 HA THR 524 HA THR 524 -9.228 10.804 4.924
108 HB THR 524 HB THR 524 -8.565 12.130 7.052
109 HG1 THR 524 HG1 THR 524 -9.282 14.133 5.712
110 1HG2 THR 524 3HG2 THR 524 -6.468 12.837 5.199
111 2HG2 THR 524 2HG2 THR 524 -7.360 14.277 5.694
112 3HG2 THR 524 1HG2 THR 524 -6.617 13.236 6.909
113 H THR 525 H THR 525 -9.220 12.372 3.052
114 HA THR 525 HA THR 525 -6.553 12.707 1.777
115 HB THR 525 HB THR 525 -7.847 10.558 1.081
116 HG1 THR 525 HG1 THR 525 -6.509 10.630 -0.510
117 1HG2 THR 525 2HG2 THR 525 -9.812 12.356 0.494
118 2HG2 THR 525 1HG2 THR 525 -9.039 12.160 -1.078
119 3HG2 THR 525 3HG2 THR 525 -9.679 10.763 -0.230
120 H THR 526 H THR 526 -7.647 13.445 -0.779
121 HA THR 526 HA THR 526 -9.493 15.668 -0.316
122 HB THR 526 HB THR 526 -7.515 16.814 0.306
123 HG1 THR 526 HG1 THR 526 -7.420 18.338 -1.273
124 1HG2 THR 526 2HG2 THR 526 -6.289 15.029 -1.681
125 2HG2 THR 526 1HG2 THR 526 -5.663 16.676 -1.735
126 3HG2 THR 526 3HG2 THR 526 -5.582 15.750 -0.236
127 H TYR 527 H TYR 527 -10.224 13.753 -1.788
128 HA TYR 527 HA TYR 527 -10.681 12.901 -3.943
129 1HB TYR 527 2HB TYR 527 -11.915 15.195 -3.429
130 2HB TYR 527 1HB TYR 527 -10.927 15.763 -4.765
131 HD1 TYR 527 HD2 TYR 527 -13.384 13.044 -3.838
132 HD2 TYR 527 HD1 TYR 527 -11.576 15.327 -7.003
133 HE1 TYR 527 HE2 TYR 527 -14.877 12.009 -5.378
134 HE2 TYR 527 HE1 TYR 527 -13.163 14.286 -8.603
135 HH TYR 527 HH TYR 527 -15.350 13.188 -8.577
136 H GLY 528 H GLY 528 -7.754 13.454 -3.535
137 1HA GLY 528 2HA GLY 528 -6.896 13.047 -6.226
138 2HA GLY 528 1HA GLY 528 -6.631 14.739 -5.819
139 H GLU 529 H GLU 529 -5.646 11.422 -5.063
140 HA GLU 529 HA GLU 529 -2.953 11.931 -4.636
141 1HB GLU 529 2HB GLU 529 -2.855 11.833 -2.067
142 2HB GLU 529 1HB GLU 529 -3.299 13.375 -2.790
143 1HG GLU 529 2HG GLU 529 -5.685 12.848 -2.444
144 2HG GLU 529 1HG GLU 529 -5.228 11.311 -1.709
145 H ASN 530 H ASN 530 -1.990 10.130 -2.909
146 HA ASN 530 HA ASN 530 -3.748 7.737 -2.861
147 1HB ASN 530 2HB ASN 530 -2.699 7.875 -5.165
148 2HB ASN 530 1HB ASN 530 -1.144 7.616 -4.381
149 1HD2 ASN 530 2HD2 ASN 530 -2.051 4.257 -3.337
150 2HD2 ASN 530 1HD2 ASN 530 -1.354 5.631 -2.666
151 H ILE 531 H ILE 531 -3.313 6.430 -1.148
152 HA ILE 531 HA ILE 531 -0.687 6.911 0.269
153 HB ILE 531 HB ILE 531 -3.133 7.124 1.377
154 1HG1 ILE 531 2HG1 ILE 531 -1.017 5.831 2.999
155 2HG1 ILE 531 1HG1 ILE 531 -0.872 7.478 2.429
156 1HG2 ILE 531 1HG2 ILE 531 -2.420 4.222 1.587
157 2HG2 ILE 531 3HG2 ILE 531 -3.469 5.022 2.750
158 3HG2 ILE 531 2HG2 ILE 531 -3.926 4.944 1.051
159 1HD1 ILE 531 1HD1 ILE 531 -3.486 6.798 3.685
160 2HD1 ILE 531 3HD1 ILE 531 -2.080 6.824 4.781
161 3HD1 ILE 531 2HD1 ILE 531 -2.494 8.253 3.824
162 H TYR 532 H TYR 532 0.719 5.282 -0.126
163 HA TYR 532 HA TYR 532 -0.302 2.795 -1.336
164 1HB TYR 532 2HB TYR 532 2.086 4.443 -1.435
165 2HB TYR 532 1HB TYR 532 2.375 2.708 -1.547
166 HD1 TYR 532 HD1 TYR 532 0.424 5.535 -2.927
167 HD2 TYR 532 HD2 TYR 532 1.792 1.465 -3.384
168 HE1 TYR 532 HE1 TYR 532 -0.112 5.629 -5.376
169 HE2 TYR 532 HE2 TYR 532 1.231 1.556 -5.835
170 HH TYR 532 HH TYR 532 -0.023 2.764 -7.389
171 H LEU 533 H LEU 533 1.504 1.058 -1.219
172 HA LEU 533 HA LEU 533 2.293 0.510 1.555
173 1HB LEU 533 2HB LEU 533 0.095 -0.709 0.549
174 2HB LEU 533 1HB LEU 533 1.349 -1.813 -0.013
175 HG LEU 533 HG LEU 533 0.702 -2.649 2.104
176 1HD1 LEU 533 1HD1 LEU 533 3.152 -2.487 1.777
177 2HD1 LEU 533 3HD1 LEU 533 3.137 -0.890 2.530
178 3HD1 LEU 533 2HD1 LEU 533 2.716 -2.316 3.480
179 1HD2 LEU 533 3HD2 LEU 533 0.539 0.252 2.753
180 2HD2 LEU 533 2HD2 LEU 533 -0.548 -1.063 3.200
181 3HD2 LEU 533 1HD2 LEU 533 0.972 -0.845 4.067
182 H VAL 534 H VAL 534 4.447 1.093 0.660
183 HA VAL 534 HA VAL 534 5.489 -0.688 -1.429
184 HB VAL 534 HB VAL 534 5.993 1.870 -0.929
185 1HG1 VAL 534 1HG1 VAL 534 7.120 1.543 1.198
186 2HG1 VAL 534 3HG1 VAL 534 8.279 0.503 0.356
187 3HG1 VAL 534 2HG1 VAL 534 8.169 2.196 -0.075
188 1HG2 VAL 534 3HG2 VAL 534 7.482 -0.165 -2.285
189 2HG2 VAL 534 2HG2 VAL 534 7.062 1.450 -2.797
190 3HG2 VAL 534 1HG2 VAL 534 8.483 1.214 -1.784
191 H GLY 535 H GLY 535 5.715 -2.710 -0.690
192 1HA GLY 535 2HA GLY 535 7.245 -3.230 1.840
193 2HA GLY 535 1HA GLY 535 6.105 -4.382 1.129
194 H SER 536 H SER 536 9.082 -4.793 1.623
195 HA SER 536 HA SER 536 10.516 -4.446 -0.889
196 1HB SER 536 2HB SER 536 11.206 -6.435 1.262
197 2HB SER 536 1HB SER 536 12.260 -5.714 0.059
198 HG SER 536 HG SER 536 10.781 -4.079 1.769
199 H ILE 537 H ILE 537 8.947 -5.465 -2.445
200 HA ILE 537 HA ILE 537 9.892 -8.172 -2.642
201 HB ILE 537 HB ILE 537 7.083 -7.888 -3.428
202 1HG1 ILE 537 2HG1 ILE 537 8.020 -8.182 -0.569
203 2HG1 ILE 537 1HG1 ILE 537 7.130 -6.812 -1.202
204 1HG2 ILE 537 1HG2 ILE 537 8.982 -9.991 -2.552
205 2HG2 ILE 537 3HG2 ILE 537 7.286 -10.234 -2.130
206 3HG2 ILE 537 2HG2 ILE 537 7.756 -10.042 -3.820
207 1HD1 ILE 537 1HD1 ILE 537 6.044 -9.630 -1.277
208 2HD1 ILE 537 3HD1 ILE 537 5.730 -8.530 0.060
209 3HD1 ILE 537 2HD1 ILE 537 5.160 -8.131 -1.550
210 H SER 538 H SER 538 9.987 -8.987 -4.704
211 HA SER 538 HA SER 538 10.902 -7.219 -6.653
212 1HB SER 538 2HB SER 538 10.014 -10.000 -6.637
213 2HB SER 538 1HB SER 538 9.676 -9.216 -8.178
214 HG SER 538 HG SER 538 11.777 -10.067 -8.154
215 H GLN 539 H GLN 539 7.564 -8.406 -6.301
216 HA GLN 539 HA GLN 539 6.655 -6.498 -8.370
217 1HB GLN 539 2HB GLN 539 5.800 -8.985 -7.875
218 2HB GLN 539 1HB GLN 539 4.744 -8.126 -6.753
219 1HG GLN 539 2HG GLN 539 4.749 -6.641 -9.171
220 2HG GLN 539 1HG GLN 539 4.519 -8.334 -9.611
221 1HE2 GLN 539 2HE2 GLN 539 1.799 -7.026 -6.831
222 2HE2 GLN 539 1HE2 GLN 539 3.457 -6.775 -6.565
223 H LEU 540 H LEU 540 7.038 -6.710 -4.981
224 HA LEU 540 HA LEU 540 5.015 -4.657 -4.436
225 1HB LEU 540 2HB LEU 540 6.014 -6.824 -3.001
226 2HB LEU 540 1HB LEU 540 6.588 -5.415 -2.162
227 HG LEU 540 HG LEU 540 4.100 -6.674 -1.923
228 1HD1 LEU 540 2HD1 LEU 540 5.708 -4.909 -0.568
229 2HD1 LEU 540 1HD1 LEU 540 4.253 -3.949 -0.873
230 3HD1 LEU 540 3HD1 LEU 540 4.135 -5.488 -0.019
231 1HD2 LEU 540 2HD2 LEU 540 3.429 -5.328 -3.983
232 2HD2 LEU 540 1HD2 LEU 540 2.445 -5.098 -2.545
233 3HD2 LEU 540 3HD2 LEU 540 3.643 -3.883 -2.991
234 H GLY 541 H GLY 541 7.441 -3.952 -5.871
235 1HA GLY 541 2HA GLY 541 9.645 -2.875 -5.259
236 2HA GLY 541 1HA GLY 541 8.471 -1.781 -5.962
237 H ASP 542 H ASP 542 9.129 -3.142 -2.781
238 HA ASP 542 HA ASP 542 8.125 -1.164 -1.031
239 1HB ASP 542 2HB ASP 542 9.550 -3.259 -0.608
240 2HB ASP 542 1HB ASP 542 10.839 -2.176 -0.596
241 H TRP 543 H TRP 543 10.816 -0.994 -3.012
242 HA TRP 543 HA TRP 543 11.647 1.523 -1.728
243 1HB TRP 543 2HB TRP 543 13.441 -0.430 -3.118
244 2HB TRP 543 1HB TRP 543 13.841 0.774 -1.892
245 HD1 TRP 543 HD1 TRP 543 13.260 -2.919 -2.081
246 HE1 TRP 543 HE1 TRP 543 12.804 -3.872 0.199
247 HE3 TRP 543 HE3 TRP 543 11.968 1.350 0.469
248 HZ2 TRP 543 HZ2 TRP 543 11.850 -3.025 2.805
249 HZ3 TRP 543 HZ3 TRP 543 11.270 1.210 2.845
250 HH2 TRP 543 HH2 TRP 543 11.196 -0.989 4.002
251 H GLU 544 H GLU 544 9.774 1.421 -3.556
252 HA GLU 544 HA GLU 544 10.257 3.355 -5.457
253 1HB GLU 544 2HB GLU 544 11.714 1.566 -6.548
254 2HB GLU 544 1HB GLU 544 10.253 0.601 -6.723
255 1HG GLU 544 2HG GLU 544 9.262 2.131 -8.210
256 2HG GLU 544 1HG GLU 544 10.370 3.427 -7.753
257 H THR 545 H THR 545 8.184 3.823 -4.572
258 HA THR 545 HA THR 545 6.146 1.988 -4.138
259 HB THR 545 HB THR 545 4.577 3.821 -4.143
260 HG1 THR 545 HG1 THR 545 6.401 5.413 -5.583
261 1HG2 THR 545 2HG2 THR 545 6.678 3.964 -2.607
262 2HG2 THR 545 1HG2 THR 545 7.111 5.339 -3.620
263 3HG2 THR 545 3HG2 THR 545 5.600 5.351 -2.709
264 H SER 546 H SER 546 7.479 2.837 -7.203
265 HA SER 546 HA SER 546 5.290 2.830 -8.947
266 1HB SER 546 2HB SER 546 7.780 3.040 -9.522
267 2HB SER 546 1HB SER 546 7.831 1.280 -9.489
268 HG SER 546 HG SER 546 6.875 1.262 -11.356
269 H ASP 547 H ASP 547 6.427 0.284 -6.912
270 HA ASP 547 HA ASP 547 4.347 -1.488 -8.050
271 1HB ASP 547 2HB ASP 547 7.206 -2.313 -7.479
272 2HB ASP 547 1HB ASP 547 5.901 -3.417 -7.914
273 H GLY 548 H GLY 548 4.376 0.072 -5.523
274 1HA GLY 548 2HA GLY 548 4.767 -2.002 -3.458
275 2HA GLY 548 1HA GLY 548 4.328 -0.311 -3.164
276 H ILE 549 H ILE 549 2.249 -0.071 -2.526
277 HA ILE 549 HA ILE 549 0.165 -1.444 -4.016
278 HB ILE 549 HB ILE 549 -0.127 -1.815 -1.067
279 1HG1 ILE 549 2HG1 ILE 549 1.262 -3.847 -2.794
280 2HG1 ILE 549 1HG1 ILE 549 2.173 -2.682 -1.849
281 1HG2 ILE 549 2HG2 ILE 549 -1.064 -3.160 -3.586
282 2HG2 ILE 549 1HG2 ILE 549 -1.152 -3.991 -2.029
283 3HG2 ILE 549 3HG2 ILE 549 -2.030 -2.476 -2.277
284 1HD1 ILE 549 1HD1 ILE 549 0.299 -3.659 -0.043
285 2HD1 ILE 549 3HD1 ILE 549 0.783 -5.085 -0.961
286 3HD1 ILE 549 2HD1 ILE 549 1.998 -4.123 -0.119
287 H ALA 550 H ALA 550 -0.621 0.444 -4.634
288 HA ALA 550 HA ALA 550 -1.085 2.730 -2.999
289 1HB ALA 550 1HB ALA 550 -1.229 2.103 -5.683
290 2HB ALA 550 3HB ALA 550 -2.907 2.438 -5.255
291 3HB ALA 550 2HB ALA 550 -1.664 3.652 -4.963
292 H LEU 551 H LEU 551 -3.112 3.641 -2.381
293 HA LEU 551 HA LEU 551 -5.432 1.747 -2.028
294 1HB LEU 551 2HB LEU 551 -4.195 3.622 0.013
295 2HB LEU 551 1HB LEU 551 -5.760 2.849 0.226
296 HG LEU 551 HG LEU 551 -4.360 0.673 -0.296
297 1HD1 LEU 551 2HD1 LEU 551 -2.260 1.909 -0.734
298 2HD1 LEU 551 1HD1 LEU 551 -2.281 2.475 0.936
299 3HD1 LEU 551 3HD1 LEU 551 -2.103 0.756 0.590
300 1HD2 LEU 551 1HD2 LEU 551 -5.609 1.205 1.796
301 2HD2 LEU 551 3HD2 LEU 551 -4.101 0.349 2.115
302 3HD2 LEU 551 2HD2 LEU 551 -4.197 2.091 2.373
303 H SER 552 H SER 552 -7.475 2.776 -2.277
304 HA SER 552 HA SER 552 -7.389 5.726 -2.878
305 1HB SER 552 2HB SER 552 -7.368 3.992 -4.910
306 2HB SER 552 1HB SER 552 -9.101 4.074 -4.597
307 HG SER 552 HG SER 552 -8.641 5.703 -6.006
308 H ALA 553 H ALA 553 -9.929 6.189 -3.775
309 HA ALA 553 HA ALA 553 -11.731 5.407 -1.502
310 1HB ALA 553 1HB ALA 553 -11.544 8.026 -3.044
311 2HB ALA 553 3HB ALA 553 -12.923 7.639 -2.015
312 3HB ALA 553 2HB ALA 553 -11.307 7.781 -1.325
313 H ASP 554 H ASP 554 -12.619 3.585 -2.852
314 HA ASP 554 HA ASP 554 -13.931 4.286 -5.384
315 1HB ASP 554 2HB ASP 554 -14.858 2.022 -5.327
316 2HB ASP 554 1HB ASP 554 -13.145 1.951 -4.933
317 H LYS 555 H LYS 555 -14.694 4.072 -2.006
318 HA LYS 555 HA LYS 555 -17.536 4.825 -2.540
319 1HB LYS 555 2HB LYS 555 -16.893 4.301 0.255
320 2HB LYS 555 1HB LYS 555 -18.097 3.518 -0.767
321 1HG LYS 555 2HG LYS 555 -16.313 2.089 -1.744
322 2HG LYS 555 1HG LYS 555 -15.141 2.844 -0.666
323 1HD LYS 555 2HD LYS 555 -16.500 2.065 1.283
324 2HD LYS 555 1HD LYS 555 -17.552 1.205 0.157
325 1HE LYS 555 2HE LYS 555 -14.912 0.486 -0.553
326 2HE LYS 555 1HE LYS 555 -14.984 0.396 1.208
327 1HZ LYS 555 1HZ LYS 555 -17.221 -0.799 0.735
328 2HZ LYS 555 3HZ LYS 555 -16.542 -1.089 -0.792
329 3HZ LYS 555 2HZ LYS 555 -15.761 -1.658 0.605
330 H TYR 556 H TYR 556 -14.738 5.520 -0.472
331 HA TYR 556 HA TYR 556 -15.616 7.909 0.736
332 1HB TYR 556 2HB TYR 556 -13.057 6.527 0.204
333 2HB TYR 556 1HB TYR 556 -12.974 8.223 0.530
334 HD1 TYR 556 HD2 TYR 556 -15.627 6.184 1.860
335 HD2 TYR 556 HD1 TYR 556 -11.797 7.976 2.733
336 HE1 TYR 556 HE2 TYR 556 -15.960 5.739 4.247
337 HE2 TYR 556 HE1 TYR 556 -12.158 7.567 5.134
338 HH TYR 556 HH TYR 556 -14.428 5.445 6.324
339 H THR 557 H THR 557 -12.958 9.315 -0.486
340 HA THR 557 HA THR 557 -14.414 11.149 -2.191
341 HB THR 557 HB THR 557 -11.467 11.256 -2.393
342 HG1 THR 557 HG1 THR 557 -11.510 12.092 -0.141
343 1HG2 THR 557 2HG2 THR 557 -13.738 13.002 -2.204
344 2HG2 THR 557 1HG2 THR 557 -12.556 13.441 -0.977
345 3HG2 THR 557 3HG2 THR 557 -12.087 13.396 -2.669
346 H SER 558 H SER 558 -12.245 11.585 -4.089
347 HA SER 558 HA SER 558 -12.715 9.275 -5.898
348 1HB SER 558 2HB SER 558 -13.057 11.086 -7.287
349 2HB SER 558 1HB SER 558 -12.014 12.146 -6.341
350 HG SER 558 HG SER 558 -10.890 11.702 -8.164
351 H SER 559 H SER 559 -10.364 11.030 -4.016
352 HA SER 559 HA SER 559 -8.155 9.517 -5.220
353 1HB SER 559 2HB SER 559 -7.434 11.652 -4.685
354 2HB SER 559 1HB SER 559 -8.368 11.722 -3.195
355 HG SER 559 HG SER 559 -6.916 10.283 -2.276
356 H ASP 560 H ASP 560 -8.901 10.064 -1.734
357 HA ASP 560 HA ASP 560 -9.455 7.300 -1.148
358 1HB ASP 560 2HB ASP 560 -7.115 7.246 -2.219
359 2HB ASP 560 1HB ASP 560 -6.565 7.993 -0.742
360 HA PRO 561 HA PRO 561 -8.812 10.072 2.652
361 1HB PRO 561 2HB PRO 561 -11.410 10.087 3.618
362 2HB PRO 561 1HB PRO 561 -10.687 11.334 2.593
363 1HG PRO 561 2HG PRO 561 -12.699 9.324 1.871
364 2HG PRO 561 1HG PRO 561 -12.241 10.775 1.024
365 1HD PRO 561 2HD PRO 561 -11.410 8.075 0.393
366 2HD PRO 561 1HD PRO 561 -10.950 9.555 -0.451
367 H LEU 562 H LEU 562 -10.543 6.976 2.459
368 HA LEU 562 HA LEU 562 -9.640 6.406 5.247
369 1HB LEU 562 2HB LEU 562 -10.876 4.166 4.968
370 2HB LEU 562 1HB LEU 562 -11.840 5.582 5.265
371 HG LEU 562 HG LEU 562 -12.988 5.284 3.316
372 1HD1 LEU 562 1HD1 LEU 562 -10.281 5.260 2.152
373 2HD1 LEU 562 3HD1 LEU 562 -11.445 4.296 1.265
374 3HD1 LEU 562 2HD1 LEU 562 -11.746 6.008 1.551
375 1HD2 LEU 562 3HD2 LEU 562 -11.585 2.761 3.894
376 2HD2 LEU 562 2HD2 LEU 562 -13.307 3.075 3.675
377 3HD2 LEU 562 1HD2 LEU 562 -12.260 2.878 2.268
378 H TRP 563 H TRP 563 -8.650 6.162 2.156
379 HA TRP 563 HA TRP 563 -7.154 4.732 1.088
380 1HB TRP 563 2HB TRP 563 -5.953 4.658 3.792
381 2HB TRP 563 1HB TRP 563 -5.155 4.658 2.240
382 HD1 TRP 563 HD1 TRP 563 -7.082 6.945 4.588
383 HE1 TRP 563 HE1 TRP 563 -6.548 9.422 4.064
384 HE3 TRP 563 HE3 TRP 563 -4.645 6.346 0.158
385 HZ2 TRP 563 HZ2 TRP 563 -5.295 10.912 1.933
386 HZ3 TRP 563 HZ3 TRP 563 -3.899 8.319 -1.104
387 HH2 TRP 563 HH2 TRP 563 -4.200 10.585 -0.232
388 H TYR 564 H TYR 564 -8.666 3.027 0.698
389 HA TYR 564 HA TYR 564 -8.179 0.636 2.442
390 1HB TYR 564 2HB TYR 564 -10.223 -0.288 1.596
391 2HB TYR 564 1HB TYR 564 -10.573 1.405 1.939
392 HD1 TYR 564 HD1 TYR 564 -8.647 2.069 -0.592
393 HD2 TYR 564 HD2 TYR 564 -12.244 -0.141 -0.003
394 HE1 TYR 564 HE1 TYR 564 -9.153 2.440 -2.870
395 HE2 TYR 564 HE2 TYR 564 -12.817 0.215 -2.397
396 HH TYR 564 HH TYR 564 -10.607 1.173 -4.670
397 H VAL 565 H VAL 565 -8.386 -1.518 0.812
398 HA VAL 565 HA VAL 565 -7.472 -1.274 -1.840
399 HB VAL 565 HB VAL 565 -5.480 -0.239 -1.252
400 1HG1 VAL 565 1HG1 VAL 565 -5.788 -0.565 1.199
401 2HG1 VAL 565 3HG1 VAL 565 -5.217 -2.216 1.024
402 3HG1 VAL 565 2HG1 VAL 565 -4.132 -0.875 0.689
403 1HG2 VAL 565 1HG2 VAL 565 -4.869 -3.211 -1.252
404 2HG2 VAL 565 3HG2 VAL 565 -4.978 -2.167 -2.670
405 3HG2 VAL 565 2HG2 VAL 565 -3.676 -1.937 -1.504
406 H THR 566 H THR 566 -6.669 -3.164 -2.787
407 HA THR 566 HA THR 566 -6.468 -5.674 -1.301
408 HB THR 566 HB THR 566 -8.756 -5.314 -3.269
409 HG1 THR 566 HG1 THR 566 -9.897 -5.901 -1.201
410 1HG2 THR 566 1HG2 THR 566 -7.316 -7.612 -2.422
411 2HG2 THR 566 3HG2 THR 566 -8.886 -7.665 -1.619
412 3HG2 THR 566 2HG2 THR 566 -8.799 -7.560 -3.376
413 H VAL 567 H VAL 567 -4.404 -5.690 -2.349
414 HA VAL 567 HA VAL 567 -4.523 -5.962 -5.334
415 HB VAL 567 HB VAL 567 -2.036 -5.302 -3.760
416 1HG1 VAL 567 1HG1 VAL 567 -2.919 -5.328 -6.597
417 2HG1 VAL 567 3HG1 VAL 567 -1.904 -3.968 -6.118
418 3HG1 VAL 567 2HG1 VAL 567 -1.318 -5.618 -5.914
419 1HG2 VAL 567 2HG2 VAL 567 -4.325 -3.517 -4.565
420 2HG2 VAL 567 1HG2 VAL 567 -3.423 -3.545 -3.049
421 3HG2 VAL 567 3HG2 VAL 567 -2.682 -2.879 -4.504
422 H THR 568 H THR 568 -2.503 -7.328 -6.119
423 HA THR 568 HA THR 568 -2.216 -9.690 -4.313
424 HB THR 568 HB THR 568 -2.084 -10.921 -6.664
425 HG1 THR 568 HG1 THR 568 -3.271 -9.930 -8.199
426 1HG2 THR 568 2HG2 THR 568 -3.738 -11.241 -4.769
427 2HG2 THR 568 1HG2 THR 568 -4.758 -10.038 -5.559
428 3HG2 THR 568 3HG2 THR 568 -4.382 -11.552 -6.382
429 H LEU 569 H LEU 569 -0.144 -10.488 -4.139
430 HA LEU 569 HA LEU 569 1.939 -9.216 -5.856
431 1HB LEU 569 2HB LEU 569 2.256 -8.543 -3.561
432 2HB LEU 569 1HB LEU 569 2.063 -10.205 -2.986
433 HG LEU 569 HG LEU 569 4.110 -10.273 -4.946
434 1HD1 LEU 569 2HD1 LEU 569 4.064 -7.735 -3.456
435 2HD1 LEU 569 1HD1 LEU 569 5.580 -8.613 -3.301
436 3HD1 LEU 569 3HD1 LEU 569 4.981 -8.174 -4.894
437 1HD2 LEU 569 2HD2 LEU 569 4.116 -10.394 -1.918
438 2HD2 LEU 569 1HD2 LEU 569 4.015 -11.751 -3.037
439 3HD2 LEU 569 3HD2 LEU 569 5.509 -10.820 -2.915
440 HA PRO 570 HA PRO 570 2.441 -13.468 -7.189
441 1HB PRO 570 2HB PRO 570 4.322 -12.901 -9.111
442 2HB PRO 570 1HB PRO 570 2.580 -12.681 -9.347
443 1HG PRO 570 2HG PRO 570 4.687 -10.621 -8.870
444 2HG PRO 570 1HG PRO 570 3.146 -10.472 -9.731
445 1HD PRO 570 2HD PRO 570 3.651 -9.567 -7.109
446 2HD PRO 570 1HD PRO 570 2.047 -9.774 -7.841
447 H ALA 571 H ALA 571 3.513 -13.837 -5.012
448 HA ALA 571 HA ALA 571 6.303 -14.618 -5.409
449 1HB ALA 571 1HB ALA 571 6.100 -12.075 -4.642
450 2HB ALA 571 3HB ALA 571 5.888 -12.818 -3.058
451 3HB ALA 571 2HB ALA 571 7.356 -13.126 -3.988
452 H GLY 572 H GLY 572 7.076 -15.208 -2.869
453 1HA GLY 572 2HA GLY 572 4.981 -16.245 -1.181
454 2HA GLY 572 1HA GLY 572 5.651 -17.531 -2.184
455 H GLU 573 H GLU 573 6.882 -14.819 -0.190
456 HA GLU 573 HA GLU 573 8.472 -16.638 1.436
457 1HB GLU 573 2HB GLU 573 9.649 -15.767 -0.952
458 2HB GLU 573 1HB GLU 573 10.328 -14.711 0.288
459 1HG GLU 573 2HG GLU 573 10.244 -17.387 1.315
460 2HG GLU 573 1HG GLU 573 11.023 -17.415 -0.267
461 H SER 574 H SER 574 10.378 -14.660 2.278
462 HA SER 574 HA SER 574 8.630 -12.982 3.963
463 1HB SER 574 2HB SER 574 11.663 -12.994 3.734
464 2HB SER 574 1HB SER 574 10.710 -12.271 5.026
465 HG SER 574 HG SER 574 11.624 -14.468 5.363
466 H PHE 575 H PHE 575 8.191 -10.952 3.670
467 HA PHE 575 HA PHE 575 9.565 -9.427 1.479
468 1HB PHE 575 2HB PHE 575 6.606 -9.738 2.056
469 2HB PHE 575 1HB PHE 575 7.290 -8.605 0.902
470 HD1 PHE 575 HD1 PHE 575 9.546 -10.282 -0.178
471 HD2 PHE 575 HD2 PHE 575 5.454 -11.271 0.665
472 HE1 PHE 575 HE1 PHE 575 9.657 -12.134 -1.819
473 HE2 PHE 575 HE2 PHE 575 5.563 -13.122 -0.982
474 HZ PHE 575 HZ PHE 575 7.667 -13.555 -2.218
475 H GLU 576 H GLU 576 9.966 -7.298 2.125
476 HA GLU 576 HA GLU 576 9.300 -6.560 4.890
477 1HB GLU 576 2HB GLU 576 11.064 -5.562 2.864
478 2HB GLU 576 1HB GLU 576 10.257 -4.265 3.730
479 1HG GLU 576 2HG GLU 576 12.289 -4.811 4.920
480 2HG GLU 576 1HG GLU 576 10.944 -5.459 5.860
481 H TYR 577 H TYR 577 8.056 -4.554 5.359
482 HA TYR 577 HA TYR 577 6.165 -3.908 3.191
483 1HB TYR 577 2HB TYR 577 5.530 -5.400 5.659
484 2HB TYR 577 1HB TYR 577 4.385 -4.136 5.199
485 HD1 TYR 577 HD1 TYR 577 6.146 -7.236 3.899
486 HD2 TYR 577 HD2 TYR 577 2.960 -4.363 3.350
487 HE1 TYR 577 HE1 TYR 577 5.197 -8.591 2.061
488 HE2 TYR 577 HE2 TYR 577 2.031 -5.752 1.525
489 HH TYR 577 HH TYR 577 2.084 -7.948 0.677
490 H LYS 578 H LYS 578 7.559 -1.989 3.352
491 HA LYS 578 HA LYS 578 7.112 -0.231 5.662
492 1HB LYS 578 2HB LYS 578 8.717 -0.127 3.142
493 2HB LYS 578 1HB LYS 578 8.232 1.410 3.856
494 1HG LYS 578 2HG LYS 578 9.733 -0.814 5.272
495 2HG LYS 578 1HG LYS 578 10.419 0.721 4.737
496 1HD LYS 578 2HD LYS 578 8.577 1.820 6.187
497 2HD LYS 578 1HD LYS 578 8.407 0.229 6.930
498 1HE LYS 578 2HE LYS 578 11.101 1.565 6.673
499 2HE LYS 578 1HE LYS 578 10.045 1.878 8.050
500 1HZ LYS 578 3HZ LYS 578 9.938 -0.727 8.071
501 2HZ LYS 578 2HZ LYS 578 11.441 -0.581 7.293
502 3HZ LYS 578 1HZ LYS 578 11.207 0.104 8.830
503 H PHE 579 H PHE 579 5.846 1.726 5.497
504 HA PHE 579 HA PHE 579 3.856 1.574 3.254
505 1HB PHE 579 2HB PHE 579 2.994 1.143 5.587
506 2HB PHE 579 1HB PHE 579 3.468 2.793 6.005
507 HD1 PHE 579 HD2 PHE 579 2.711 4.621 4.273
508 HD2 PHE 579 HD1 PHE 579 0.829 0.812 4.780
509 HE1 PHE 579 HE2 PHE 579 0.703 5.493 3.207
510 HE2 PHE 579 HE1 PHE 579 -1.216 1.692 3.683
511 HZ PHE 579 HZ PHE 579 -1.240 4.045 2.898
512 H ILE 580 H ILE 580 3.300 3.338 2.185
513 HA ILE 580 HA ILE 580 4.726 5.820 2.859
514 HB ILE 580 HB ILE 580 5.372 6.135 0.569
515 1HG1 ILE 580 2HG1 ILE 580 3.211 4.169 0.217
516 2HG1 ILE 580 1HG1 ILE 580 3.715 5.514 -0.832
517 1HG2 ILE 580 3HG2 ILE 580 5.782 3.249 1.411
518 2HG2 ILE 580 2HG2 ILE 580 6.669 4.032 0.103
519 3HG2 ILE 580 1HG2 ILE 580 6.851 4.606 1.763
520 1HD1 ILE 580 1HD1 ILE 580 5.774 3.719 -1.124
521 2HD1 ILE 580 3HD1 ILE 580 4.372 2.665 -0.959
522 3HD1 ILE 580 2HD1 ILE 580 4.407 3.887 -2.224
523 H ARG 581 H ARG 581 3.489 7.684 2.657
524 HA ARG 581 HA ARG 581 0.705 7.165 1.704
525 1HB ARG 581 2HB ARG 581 0.570 7.729 4.003
526 2HB ARG 581 1HB ARG 581 1.787 8.987 3.847
527 1HG ARG 581 2HG ARG 581 -0.425 9.518 2.058
528 2HG ARG 581 1HG ARG 581 -1.008 9.304 3.705
529 1HD ARG 581 2HD ARG 581 1.022 10.886 4.300
530 2HD ARG 581 1HD ARG 581 0.852 11.380 2.617
531 HE ARG 581 HE ARG 581 -1.682 11.672 3.365
532 1HH1 ARG 581 2HH1 ARG 581 0.482 11.595 5.923
533 2HH1 ARG 581 1HH1 ARG 581 0.084 13.162 6.539
534 1HH2 ARG 581 1HH2 ARG 581 -1.923 14.008 3.846
535 2HH2 ARG 581 2HH2 ARG 581 -1.274 14.527 5.366
536 H ILE 582 H ILE 582 0.777 7.840 -0.443
537 HA ILE 582 HA ILE 582 2.225 10.321 -1.052
538 HB ILE 582 HB ILE 582 1.313 8.140 -2.647
539 1HG1 ILE 582 2HG1 ILE 582 3.482 9.212 -2.813
540 2HG1 ILE 582 1HG1 ILE 582 2.659 9.399 -4.367
541 1HG2 ILE 582 3HG2 ILE 582 -0.078 10.740 -3.272
542 2HG2 ILE 582 2HG2 ILE 582 0.535 9.768 -4.600
543 3HG2 ILE 582 1HG2 ILE 582 -0.647 9.092 -3.498
544 1HD1 ILE 582 2HD1 ILE 582 1.727 11.600 -3.346
545 2HD1 ILE 582 1HD1 ILE 582 3.049 11.430 -2.193
546 3HD1 ILE 582 3HD1 ILE 582 3.407 11.593 -3.910
547 H GLU 583 H GLU 583 1.435 12.327 -0.926
548 HA GLU 583 HA GLU 583 -1.396 12.668 -0.146
549 1HB GLU 583 2HB GLU 583 0.804 13.787 0.862
550 2HB GLU 583 1HB GLU 583 0.484 14.974 -0.402
551 1HG GLU 583 2HG GLU 583 -1.420 15.738 0.608
552 2HG GLU 583 1HG GLU 583 -1.863 14.140 1.212
553 H SER 584 H SER 584 -2.070 15.119 -1.007
554 HA SER 584 HA SER 584 -2.520 14.706 -3.880
555 1HB SER 584 2HB SER 584 -4.378 15.465 -2.476
556 2HB SER 584 1HB SER 584 -3.455 16.879 -1.980
557 HG SER 584 HG SER 584 -4.970 17.207 -3.751
558 H ASP 585 H ASP 585 -0.180 16.252 -2.005
559 HA ASP 585 HA ASP 585 0.316 18.396 -3.949
560 1HB ASP 585 2HB ASP 585 2.436 18.389 -2.231
561 2HB ASP 585 1HB ASP 585 0.992 19.355 -2.001
562 H ASP 586 H ASP 586 0.613 15.348 -4.362
563 HA ASP 586 HA ASP 586 2.139 13.918 -5.460
564 1HB ASP 586 2HB ASP 586 1.910 15.773 -7.142
565 2HB ASP 586 1HB ASP 586 3.329 16.536 -6.424
566 H SER 587 H SER 587 2.984 13.494 -3.219
567 HA SER 587 HA SER 587 5.883 13.697 -3.145
568 1HB SER 587 2HB SER 587 4.695 15.939 -2.253
569 2HB SER 587 1HB SER 587 4.615 14.965 -0.790
570 HG SER 587 HG SER 587 6.613 15.622 -0.562
571 H VAL 588 H VAL 588 6.147 11.543 -2.467
572 HA VAL 588 HA VAL 588 4.152 10.367 -0.695
573 HB VAL 588 HB VAL 588 6.731 8.967 -1.029
574 1HG1 VAL 588 3HG1 VAL 588 3.788 8.321 -1.222
575 2HG1 VAL 588 2HG1 VAL 588 5.055 7.126 -1.542
576 3HG1 VAL 588 1HG1 VAL 588 4.911 7.855 0.059
577 1HG2 VAL 588 3HG2 VAL 588 5.254 10.061 -3.298
578 2HG2 VAL 588 2HG2 VAL 588 6.847 9.305 -3.236
579 3HG2 VAL 588 1HG2 VAL 588 5.404 8.305 -3.346
580 H GLU 589 H GLU 589 4.165 10.532 1.436
581 HA GLU 589 HA GLU 589 6.663 11.267 2.861
582 1HB GLU 589 2HB GLU 589 5.143 11.343 4.856
583 2HB GLU 589 1HB GLU 589 4.593 12.425 3.572
584 1HG GLU 589 2HG GLU 589 2.662 11.291 3.387
585 2HG GLU 589 1HG GLU 589 3.537 9.760 3.200
586 H TRP 590 H TRP 590 7.375 9.039 1.977
587 HA TRP 590 HA TRP 590 6.329 6.589 2.530
588 1HB TRP 590 2HB TRP 590 9.139 7.571 2.499
589 2HB TRP 590 1HB TRP 590 8.835 5.924 3.060
590 HD1 TRP 590 HD1 TRP 590 6.827 7.736 0.359
591 HE1 TRP 590 HE1 TRP 590 7.011 6.421 -1.842
592 HE3 TRP 590 HE3 TRP 590 10.188 4.168 1.761
593 HZ2 TRP 590 HZ2 TRP 590 8.497 4.173 -2.887
594 HZ3 TRP 590 HZ3 TRP 590 10.903 2.452 0.126
595 HH2 TRP 590 HH2 TRP 590 10.105 2.449 -2.159
596 H GLU 591 H GLU 591 5.073 6.615 4.475
597 HA GLU 591 HA GLU 591 6.074 7.268 7.042
598 1HB GLU 591 2HB GLU 591 3.685 6.873 6.578
599 2HB GLU 591 1HB GLU 591 4.021 5.161 6.320
600 1HG GLU 591 2HG GLU 591 5.198 5.597 8.756
601 2HG GLU 591 1HG GLU 591 3.809 6.680 8.837
602 H SER 592 H SER 592 8.127 6.457 7.273
603 HA SER 592 HA SER 592 8.441 3.512 7.104
604 1HB SER 592 2HB SER 592 9.870 5.027 5.661
605 2HB SER 592 1HB SER 592 10.585 5.656 7.150
606 HG SER 592 HG SER 592 11.587 3.740 5.979
607 H ASP 593 H ASP 593 7.363 5.370 9.314
608 HA ASP 593 HA ASP 593 9.274 5.101 11.497
609 1HB ASP 593 2HB ASP 593 6.695 6.355 11.076
610 2HB ASP 593 1HB ASP 593 6.685 5.422 12.573
611 HA PRO 594 HA PRO 594 6.444 1.473 12.764
612 1HB PRO 594 2HB PRO 594 4.301 0.882 11.140
613 2HB PRO 594 1HB PRO 594 4.200 1.983 12.525
614 1HG PRO 594 2HG PRO 594 4.305 2.634 9.606
615 2HG PRO 594 1HG PRO 594 3.516 3.517 10.925
616 1HD PRO 594 2HD PRO 594 5.956 4.238 9.761
617 2HD PRO 594 1HD PRO 594 5.381 4.776 11.357
618 H ASN 595 H ASN 595 5.574 -0.748 11.289
619 HA ASN 595 HA ASN 595 6.886 -1.067 8.761
620 1HB ASN 595 2HB ASN 595 8.831 -2.385 9.413
621 2HB ASN 595 1HB ASN 595 8.913 -0.805 10.191
622 1HD2 ASN 595 2HD2 ASN 595 9.227 -3.897 12.570
623 2HD2 ASN 595 1HD2 ASN 595 9.727 -3.799 10.950
624 H ARG 596 H ARG 596 6.640 -3.198 7.916
625 HA ARG 596 HA ARG 596 5.248 -5.168 9.660
626 1HB ARG 596 2HB ARG 596 4.116 -3.717 7.359
627 2HB ARG 596 1HB ARG 596 3.935 -5.468 7.256
628 1HG ARG 596 2HG ARG 596 3.322 -4.151 9.869
629 2HG ARG 596 1HG ARG 596 2.154 -3.974 8.559
630 1HD ARG 596 2HD ARG 596 1.458 -6.108 8.778
631 2HD ARG 596 1HD ARG 596 3.114 -6.715 8.769
632 HE ARG 596 HE ARG 596 2.493 -5.483 11.304
633 1HH1 ARG 596 1HH2 ARG 596 3.280 -8.345 9.793
634 2HH1 ARG 596 2HH2 ARG 596 2.487 -9.384 10.929
635 1HH2 ARG 596 2HH1 ARG 596 0.904 -6.789 12.598
636 2HH2 ARG 596 1HH1 ARG 596 1.141 -8.503 12.517
637 H GLU 597 H GLU 597 5.316 -7.375 8.690
638 HA GLU 597 HA GLU 597 7.342 -7.684 6.528
639 1HB GLU 597 2HB GLU 597 8.387 -9.547 7.884
640 2HB GLU 597 1HB GLU 597 8.645 -7.932 8.544
641 1HG GLU 597 2HG GLU 597 7.579 -8.480 10.448
642 2HG GLU 597 1HG GLU 597 6.164 -9.024 9.546
643 H TYR 598 H TYR 598 5.464 -8.301 5.236
644 HA TYR 598 HA TYR 598 3.746 -10.471 6.004
645 1HB TYR 598 2HB TYR 598 3.552 -8.545 4.177
646 2HB TYR 598 1HB TYR 598 4.255 -9.794 3.148
647 HD1 TYR 598 HD1 TYR 598 3.162 -12.086 3.117
648 HD2 TYR 598 HD2 TYR 598 1.282 -8.590 4.744
649 HE1 TYR 598 HE1 TYR 598 0.967 -13.185 2.876
650 HE2 TYR 598 HE2 TYR 598 -0.926 -9.694 4.554
651 HH TYR 598 HH TYR 598 -1.390 -12.510 2.674
652 H THR 599 H THR 599 4.721 -12.437 6.358
653 HA THR 599 HA THR 599 6.858 -13.352 4.523
654 HB THR 599 HB THR 599 6.604 -15.450 6.108
655 HG1 THR 599 HG1 THR 599 4.628 -14.262 6.967
656 1HG2 THR 599 1HG2 THR 599 8.007 -12.911 6.333
657 2HG2 THR 599 3HG2 THR 599 7.740 -13.647 7.913
658 3HG2 THR 599 2HG2 THR 599 8.592 -14.543 6.655
659 H VAL 600 H VAL 600 5.195 -13.301 2.729
660 HA VAL 600 HA VAL 600 2.927 -15.036 2.787
661 HB VAL 600 HB VAL 600 4.272 -14.683 0.157
662 1HG1 VAL 600 2HG1 VAL 600 1.696 -15.200 1.269
663 2HG1 VAL 600 1HG1 VAL 600 1.627 -13.740 0.283
664 3HG1 VAL 600 3HG1 VAL 600 2.197 -15.251 -0.425
665 1HG2 VAL 600 1HG2 VAL 600 4.370 -12.423 1.616
666 2HG2 VAL 600 3HG2 VAL 600 3.963 -12.419 -0.093
667 3HG2 VAL 600 2HG2 VAL 600 2.681 -12.354 1.109
668 HA PRO 601 HA PRO 601 5.389 -18.772 2.573
669 1HB PRO 601 2HB PRO 601 3.282 -20.460 3.092
670 2HB PRO 601 1HB PRO 601 4.161 -19.576 4.352
671 1HG PRO 601 2HG PRO 601 1.446 -19.050 3.237
672 2HG PRO 601 1HG PRO 601 2.101 -18.648 4.833
673 1HD PRO 601 2HD PRO 601 1.788 -16.851 2.667
674 2HD PRO 601 1HD PRO 601 2.730 -16.555 4.144
675 H GLN 602 H GLN 602 5.761 -20.146 0.825
676 HA GLN 602 HA GLN 602 4.053 -19.808 -1.542
677 1HB GLN 602 2HB GLN 602 6.688 -20.033 -1.385
678 2HB GLN 602 1HB GLN 602 6.327 -21.758 -1.439
679 1HG GLN 602 2HG GLN 602 5.021 -21.420 -3.509
680 2HG GLN 602 1HG GLN 602 5.399 -19.698 -3.462
681 1HE2 GLN 602 2HE2 GLN 602 9.003 -20.479 -4.000
682 2HE2 GLN 602 1HE2 GLN 602 8.103 -19.669 -2.810
683 H ALA 603 H ALA 603 2.119 -20.884 -0.779
684 HA ALA 603 HA ALA 603 2.292 -23.828 -1.083
685 1HB ALA 603 1HB ALA 603 0.985 -22.455 1.287
686 2HB ALA 603 3HB ALA 603 0.872 -24.178 0.925
687 3HB ALA 603 2HB ALA 603 2.430 -23.464 1.343
688 H CYS 604 H CYS 604 -0.116 -24.697 -1.029
689 HA CYS 604 HA CYS 604 -1.551 -23.238 -3.084
690 1HB CYS 604 2HB CYS 604 -2.646 -25.510 -1.415
691 2HB CYS 604 1HB CYS 604 -3.095 -25.059 -3.059
692 H GLY 605 H GLY 605 -1.443 -22.994 0.301
693 1HA GLY 605 2HA GLY 605 -3.907 -21.317 0.244
694 2HA GLY 605 1HA GLY 605 -3.703 -22.510 1.528
695 H THR 606 H THR 606 -3.950 -20.129 2.569
696 HA THR 606 HA THR 606 -2.898 -18.510 3.901
697 HB THR 606 HB THR 606 -0.296 -19.978 3.626
698 HG1 THR 606 HG1 THR 606 -1.348 -21.300 5.414
699 1HG2 THR 606 2HG2 THR 606 -1.220 -17.939 5.233
700 2HG2 THR 606 1HG2 THR 606 -1.427 -19.355 6.263
701 3HG2 THR 606 3HG2 THR 606 0.162 -18.971 5.601
702 H SER 607 H SER 607 -3.045 -17.929 1.159
703 HA SER 607 HA SER 607 -0.443 -16.519 0.719
704 1HB SER 607 2HB SER 607 -0.833 -16.732 -1.694
705 2HB SER 607 1HB SER 607 -0.835 -18.324 -0.941
706 HG SER 607 HG SER 607 -2.843 -16.958 -2.205
707 H THR 608 H THR 608 -3.044 -15.704 2.061
708 HA THR 608 HA THR 608 -3.216 -13.057 0.801
709 HB THR 608 HB THR 608 -5.391 -13.152 -0.021
710 HG1 THR 608 HG1 THR 608 -6.965 -14.305 0.920
711 1HG2 THR 608 3HG2 THR 608 -4.429 -16.016 -0.197
712 2HG2 THR 608 2HG2 THR 608 -5.827 -15.400 -1.075
713 3HG2 THR 608 1HG2 THR 608 -4.225 -14.744 -1.402
714 H ALA 609 H ALA 609 -3.180 -11.744 2.552
715 HA ALA 609 HA ALA 609 -4.946 -12.513 4.854
716 1HB ALA 609 1HB ALA 609 -2.458 -13.187 5.194
717 2HB ALA 609 3HB ALA 609 -2.191 -11.461 5.434
718 3HB ALA 609 2HB ALA 609 -3.289 -12.340 6.498
719 H THR 610 H THR 610 -4.288 -10.474 6.609
720 HA THR 610 HA THR 610 -5.286 -8.103 5.098
721 HB THR 610 HB THR 610 -6.034 -7.268 7.270
722 HG1 THR 610 HG1 THR 610 -5.004 -9.662 8.366
723 1HG2 THR 610 3HG2 THR 610 -6.840 -9.827 6.148
724 2HG2 THR 610 2HG2 THR 610 -7.174 -9.746 7.878
725 3HG2 THR 610 1HG2 THR 610 -7.841 -8.526 6.793
726 H VAL 611 H VAL 611 -4.586 -5.992 6.035
727 HA VAL 611 HA VAL 611 -1.831 -5.849 7.057
728 HB VAL 611 HB VAL 611 -2.293 -4.484 4.459
729 1HG1 VAL 611 2HG1 VAL 611 -0.039 -5.456 6.046
730 2HG1 VAL 611 1HG1 VAL 611 0.093 -5.906 4.331
731 3HG1 VAL 611 3HG1 VAL 611 -0.057 -4.200 4.805
732 1HG2 VAL 611 3HG2 VAL 611 -3.187 -6.786 4.094
733 2HG2 VAL 611 2HG2 VAL 611 -1.805 -6.362 3.073
734 3HG2 VAL 611 1HG2 VAL 611 -1.573 -7.395 4.499
735 H THR 612 H THR 612 -3.704 -4.801 8.518
736 HA THR 612 HA THR 612 -4.616 -2.185 7.520
737 HB THR 612 HB THR 612 -5.498 -2.262 10.069
738 HG1 THR 612 HG1 THR 612 -6.217 -4.705 9.844
739 1HG2 THR 612 1HG2 THR 612 -6.621 -3.392 7.526
740 2HG2 THR 612 3HG2 THR 612 -7.568 -3.298 9.013
741 3HG2 THR 612 2HG2 THR 612 -6.927 -1.826 8.279
742 H ASP 613 H ASP 613 -4.302 -0.230 8.468
743 HA ASP 613 HA ASP 613 -2.694 0.119 10.802
744 1HB ASP 613 2HB ASP 613 -1.447 0.473 8.099
745 2HB ASP 613 1HB ASP 613 -0.974 1.567 9.399
746 H THR 614 H THR 614 -1.902 2.766 10.493
747 HA THR 614 HA THR 614 -3.932 4.377 9.194
748 HB THR 614 HB THR 614 -5.510 4.250 10.794
749 HG1 THR 614 HG1 THR 614 -3.822 5.486 12.647
750 1HG2 THR 614 1HG2 THR 614 -3.326 2.940 12.353
751 2HG2 THR 614 3HG2 THR 614 -4.725 3.547 13.241
752 3HG2 THR 614 2HG2 THR 614 -4.943 2.351 11.963
753 H TRP 615 H TRP 615 -3.679 6.623 9.631
754 HA TRP 615 HA TRP 615 -0.831 7.211 9.775
755 1HB TRP 615 2HB TRP 615 -3.156 8.275 8.468
756 2HB TRP 615 1HB TRP 615 -2.295 9.567 9.312
757 HD1 TRP 615 HD1 TRP 615 -1.134 10.545 7.245
758 HE1 TRP 615 HE1 TRP 615 0.853 9.773 5.789
759 HE3 TRP 615 HE3 TRP 615 -1.088 5.715 8.517
760 HZ2 TRP 615 HZ2 TRP 615 2.267 7.347 5.265
761 HZ3 TRP 615 HZ3 TRP 615 0.554 4.148 7.578
762 HH2 TRP 615 HH2 TRP 615 2.202 4.948 5.969
763 H ARG 616 H ARG 616 0.182 8.576 11.174
764 HA ARG 616 HA ARG 616 -1.281 9.082 13.718
765 1HB ARG 616 2HB ARG 616 1.173 8.051 13.347
766 2HB ARG 616 1HB ARG 616 1.607 9.759 13.422
767 1HG ARG 616 2HG ARG 616 0.020 9.759 15.530
768 2HG ARG 616 1HG ARG 616 0.363 8.029 15.532
769 1HD ARG 616 2HD ARG 616 2.396 8.393 16.422
770 2HD ARG 616 1HD ARG 616 2.810 9.483 15.099
771 HE ARG 616 HE ARG 616 1.117 10.892 16.898
772 1HH1 ARG 616 1HH1 ARG 616 3.190 9.139 18.514
773 2HH1 ARG 616 2HH1 ARG 616 4.372 10.357 18.858
774 1HH2 ARG 616 1HH2 ARG 616 3.095 12.619 16.560
775 2HH2 ARG 616 2HH2 ARG 616 4.318 12.328 17.752
No H/Q in entry = 775
Start of MODEL 2
1 1H CYS 509 1H CYS 509 15.948 21.264 4.484
2 2H CYS 509 3H CYS 509 16.914 21.077 5.865
3 3H CYS 509 2H CYS 509 16.707 19.776 4.793
4 HA CYS 509 HA CYS 509 14.782 19.153 5.696
5 1HB CYS 509 2HB CYS 509 15.577 21.172 7.816
6 2HB CYS 509 1HB CYS 509 14.546 19.760 8.050
7 H THR 510 H THR 510 12.695 19.609 5.189
8 HA THR 510 HA THR 510 11.751 22.423 5.482
9 HB THR 510 HB THR 510 11.160 20.650 3.093
10 HG1 THR 510 HG1 THR 510 12.799 22.954 3.296
11 1HG2 THR 510 1HG2 THR 510 9.957 23.043 4.164
12 2HG2 THR 510 3HG2 THR 510 10.669 23.385 2.587
13 3HG2 THR 510 2HG2 THR 510 9.475 22.098 2.755
14 H THR 511 H THR 511 10.653 19.103 4.693
15 HA THR 511 HA THR 511 8.396 19.550 6.604
16 HB THR 511 HB THR 511 7.477 17.664 4.774
17 HG1 THR 511 HG1 THR 511 8.801 18.040 3.154
18 1HG2 THR 511 1HG2 THR 511 7.034 20.618 5.154
19 2HG2 THR 511 3HG2 THR 511 6.147 19.722 3.921
20 3HG2 THR 511 2HG2 THR 511 5.988 19.277 5.621
21 HA PRO 512 HA PRO 512 10.780 15.772 7.741
22 1HB PRO 512 2HB PRO 512 11.105 16.493 10.374
23 2HB PRO 512 1HB PRO 512 12.242 16.937 9.090
24 1HG PRO 512 2HG PRO 512 10.230 18.639 10.486
25 2HG PRO 512 1HG PRO 512 11.749 19.110 9.706
26 1HD PRO 512 2HD PRO 512 9.159 19.418 8.608
27 2HD PRO 512 1HD PRO 512 10.693 19.568 7.723
28 H THR 513 H THR 513 7.787 17.069 8.270
29 HA THR 513 HA THR 513 6.985 15.051 10.305
30 HB THR 513 HB THR 513 4.799 16.323 10.262
31 HG1 THR 513 HG1 THR 513 4.609 17.554 8.583
32 1HG2 THR 513 2HG2 THR 513 7.435 17.341 11.133
33 2HG2 THR 513 1HG2 THR 513 6.147 18.544 11.079
34 3HG2 THR 513 3HG2 THR 513 5.958 17.094 12.064
35 H ALA 514 H ALA 514 6.193 16.156 7.012
36 HA ALA 514 HA ALA 514 4.273 13.993 6.592
37 1HB ALA 514 3HB ALA 514 5.479 16.142 4.866
38 2HB ALA 514 2HB ALA 514 4.567 14.822 4.135
39 3HB ALA 514 1HB ALA 514 3.788 15.892 5.301
40 H VAL 515 H VAL 515 4.889 11.919 6.152
41 HA VAL 515 HA VAL 515 7.614 11.528 5.055
42 HB VAL 515 HB VAL 515 5.865 9.865 6.794
43 1HG1 VAL 515 1HG1 VAL 515 7.553 8.832 4.566
44 2HG1 VAL 515 3HG1 VAL 515 7.863 8.106 6.146
45 3HG1 VAL 515 2HG1 VAL 515 6.240 8.044 5.455
46 1HG2 VAL 515 3HG2 VAL 515 8.581 11.046 6.721
47 2HG2 VAL 515 2HG2 VAL 515 7.495 10.810 8.084
48 3HG2 VAL 515 1HG2 VAL 515 8.462 9.461 7.482
49 H ALA 516 H ALA 516 7.688 11.247 2.918
50 HA ALA 516 HA ALA 516 5.333 10.047 1.543
51 1HB ALA 516 3HB ALA 516 7.800 11.404 0.403
52 2HB ALA 516 2HB ALA 516 6.433 10.810 -0.543
53 3HB ALA 516 1HB ALA 516 6.212 12.151 0.584
54 H VAL 517 H VAL 517 5.511 7.805 1.595
55 HA VAL 517 HA VAL 517 8.258 6.745 1.045
56 HB VAL 517 HB VAL 517 6.332 4.789 1.994
57 1HG1 VAL 517 1HG1 VAL 517 8.768 4.504 1.847
58 2HG1 VAL 517 3HG1 VAL 517 8.978 5.760 3.069
59 3HG1 VAL 517 2HG1 VAL 517 8.166 4.244 3.490
60 1HG2 VAL 517 3HG2 VAL 517 5.560 6.898 3.231
61 2HG2 VAL 517 2HG2 VAL 517 5.975 5.475 4.198
62 3HG2 VAL 517 1HG2 VAL 517 7.115 6.823 4.068
63 H THR 518 H THR 518 8.455 5.402 -0.754
64 HA THR 518 HA THR 518 5.989 5.053 -2.380
65 HB THR 518 HB THR 518 7.441 4.747 -4.270
66 HG1 THR 518 HG1 THR 518 9.545 4.265 -4.065
67 1HG2 THR 518 2HG2 THR 518 7.256 7.083 -3.207
68 2HG2 THR 518 1HG2 THR 518 8.892 6.807 -2.611
69 3HG2 THR 518 3HG2 THR 518 8.578 6.825 -4.346
70 H PHE 519 H PHE 519 5.101 3.083 -2.519
71 HA PHE 519 HA PHE 519 6.690 0.762 -1.529
72 1HB PHE 519 2HB PHE 519 3.711 0.556 -1.690
73 2HB PHE 519 1HB PHE 519 4.818 -0.160 -0.534
74 HD1 PHE 519 HD1 PHE 519 3.577 3.230 -1.594
75 HD2 PHE 519 HD2 PHE 519 4.929 0.694 1.576
76 HE1 PHE 519 HE1 PHE 519 3.174 5.058 0.021
77 HE2 PHE 519 HE2 PHE 519 4.541 2.535 3.207
78 HZ PHE 519 HZ PHE 519 3.664 4.697 2.411
79 H ASP 520 H ASP 520 6.502 -1.198 -2.692
80 HA ASP 520 HA ASP 520 5.228 -0.939 -5.365
81 1HB ASP 520 2HB ASP 520 8.033 -1.681 -4.636
82 2HB ASP 520 1HB ASP 520 7.277 -2.560 -5.958
83 H LEU 521 H LEU 521 4.368 -2.979 -6.132
84 HA LEU 521 HA LEU 521 4.693 -5.364 -4.485
85 1HB LEU 521 2HB LEU 521 3.168 -4.420 -2.989
86 2HB LEU 521 1HB LEU 521 2.286 -3.587 -4.263
87 HG LEU 521 HG LEU 521 1.092 -5.490 -4.867
88 1HD1 LEU 521 1HD1 LEU 521 3.558 -6.866 -4.003
89 2HD1 LEU 521 3HD1 LEU 521 2.062 -7.764 -3.706
90 3HD1 LEU 521 2HD1 LEU 521 2.467 -7.233 -5.354
91 1HD2 LEU 521 3HD2 LEU 521 1.465 -5.010 -2.037
92 2HD2 LEU 521 2HD2 LEU 521 0.001 -5.442 -2.916
93 3HD2 LEU 521 1HD2 LEU 521 1.062 -6.708 -2.324
94 H THR 522 H THR 522 5.214 -6.383 -6.451
95 HA THR 522 HA THR 522 3.301 -6.202 -8.668
96 HB THR 522 HB THR 522 5.649 -8.053 -8.203
97 HG1 THR 522 HG1 THR 522 6.430 -6.118 -8.716
98 1HG2 THR 522 3HG2 THR 522 3.463 -8.207 -10.122
99 2HG2 THR 522 2HG2 THR 522 5.027 -8.050 -10.922
100 3HG2 THR 522 1HG2 THR 522 4.744 -9.373 -9.790
101 H ALA 523 H ALA 523 1.363 -7.319 -8.837
102 HA ALA 523 HA ALA 523 1.258 -10.075 -7.838
103 1HB ALA 523 1HB ALA 523 0.889 -8.249 -5.919
104 2HB ALA 523 3HB ALA 523 -0.765 -8.424 -6.475
105 3HB ALA 523 2HB ALA 523 0.119 -9.849 -5.867
106 H THR 524 H THR 524 0.486 -8.685 -10.307
107 HA THR 524 HA THR 524 -1.242 -8.784 -11.894
108 HB THR 524 HB THR 524 -0.880 -11.220 -10.974
109 HG1 THR 524 HG1 THR 524 -1.708 -10.606 -13.033
110 1HG2 THR 524 3HG2 THR 524 -3.093 -10.293 -9.412
111 2HG2 THR 524 2HG2 THR 524 -3.677 -11.553 -10.506
112 3HG2 THR 524 1HG2 THR 524 -2.343 -11.891 -9.404
113 H THR 525 H THR 525 -3.557 -8.655 -12.318
114 HA THR 525 HA THR 525 -5.276 -7.797 -10.029
115 HB THR 525 HB THR 525 -4.280 -5.748 -11.268
116 HG1 THR 525 HG1 THR 525 -6.144 -4.679 -10.907
117 1HG2 THR 525 2HG2 THR 525 -5.384 -7.107 -13.493
118 2HG2 THR 525 1HG2 THR 525 -6.361 -5.663 -13.228
119 3HG2 THR 525 3HG2 THR 525 -4.624 -5.519 -13.467
120 H THR 526 H THR 526 -7.626 -7.366 -11.038
121 HA THR 526 HA THR 526 -8.104 -9.643 -12.885
122 HB THR 526 HB THR 526 -9.177 -10.030 -10.726
123 HG1 THR 526 HG1 THR 526 -11.332 -9.162 -12.252
124 1HG2 THR 526 2HG2 THR 526 -10.081 -7.210 -11.139
125 2HG2 THR 526 1HG2 THR 526 -11.112 -8.303 -10.215
126 3HG2 THR 526 3HG2 THR 526 -9.462 -7.986 -9.683
127 H TYR 527 H TYR 527 -7.314 -7.171 -13.663
128 HA TYR 527 HA TYR 527 -7.771 -5.484 -15.194
129 1HB TYR 527 2HB TYR 527 -8.530 -7.889 -16.150
130 2HB TYR 527 1HB TYR 527 -10.070 -7.054 -16.193
131 HD1 TYR 527 HD2 TYR 527 -10.163 -4.760 -17.403
132 HD2 TYR 527 HD1 TYR 527 -6.887 -7.545 -17.827
133 HE1 TYR 527 HE2 TYR 527 -9.469 -3.637 -19.503
134 HE2 TYR 527 HE1 TYR 527 -6.214 -6.416 -19.935
135 HH TYR 527 HH TYR 527 -6.830 -4.919 -21.494
136 H GLY 528 H GLY 528 -8.953 -5.148 -12.631
137 1HA GLY 528 2HA GLY 528 -10.659 -2.979 -12.971
138 2HA GLY 528 1HA GLY 528 -11.738 -4.368 -12.868
139 H GLU 529 H GLU 529 -9.134 -2.660 -11.057
140 HA GLU 529 HA GLU 529 -10.470 -2.775 -8.565
141 1HB GLU 529 2HB GLU 529 -9.008 -4.644 -7.526
142 2HB GLU 529 1HB GLU 529 -10.375 -5.132 -8.518
143 1HG GLU 529 2HG GLU 529 -9.037 -6.080 -10.068
144 2HG GLU 529 1HG GLU 529 -7.965 -4.680 -10.098
145 H ASN 530 H ASN 530 -9.087 -2.126 -6.701
146 HA ASN 530 HA ASN 530 -6.431 -0.983 -7.593
147 1HB ASN 530 2HB ASN 530 -8.161 0.706 -6.925
148 2HB ASN 530 1HB ASN 530 -8.197 -0.036 -5.331
149 1HD2 ASN 530 2HD2 ASN 530 -4.803 1.081 -4.552
150 2HD2 ASN 530 1HD2 ASN 530 -5.723 -0.323 -4.422
151 H ILE 531 H ILE 531 -4.623 -1.423 -6.299
152 HA ILE 531 HA ILE 531 -5.202 -3.371 -4.099
153 HB ILE 531 HB ILE 531 -3.795 -3.899 -6.314
154 1HG1 ILE 531 2HG1 ILE 531 -2.614 -4.982 -3.845
155 2HG1 ILE 531 1HG1 ILE 531 -4.297 -5.307 -4.189
156 1HG2 ILE 531 1HG2 ILE 531 -1.812 -2.692 -4.405
157 2HG2 ILE 531 3HG2 ILE 531 -1.346 -3.826 -5.660
158 3HG2 ILE 531 2HG2 ILE 531 -2.073 -2.274 -6.079
159 1HD1 ILE 531 1HD1 ILE 531 -2.222 -5.697 -6.319
160 2HD1 ILE 531 3HD1 ILE 531 -2.513 -6.948 -5.103
161 3HD1 ILE 531 2HD1 ILE 531 -3.827 -6.429 -6.159
162 H TYR 532 H TYR 532 -5.039 -2.390 -2.211
163 HA TYR 532 HA TYR 532 -3.484 0.081 -1.983
164 1HB TYR 532 2HB TYR 532 -5.800 -1.135 -0.756
165 2HB TYR 532 1HB TYR 532 -4.765 -0.238 0.358
166 HD1 TYR 532 HD1 TYR 532 -6.489 -0.069 -2.912
167 HD2 TYR 532 HD2 TYR 532 -4.591 2.036 0.348
168 HE1 TYR 532 HE1 TYR 532 -7.509 2.086 -3.702
169 HE2 TYR 532 HE2 TYR 532 -5.600 4.193 -0.459
170 HH TYR 532 HH TYR 532 -7.984 4.256 -3.046
171 H LEU 533 H LEU 533 -3.066 0.576 0.431
172 HA LEU 533 HA LEU 533 -1.353 -1.518 1.593
173 1HB LEU 533 2HB LEU 533 -0.189 0.361 0.185
174 2HB LEU 533 1HB LEU 533 -0.517 1.340 1.610
175 HG LEU 533 HG LEU 533 1.716 0.344 1.751
176 1HD1 LEU 533 1HD1 LEU 533 0.246 0.696 3.789
177 2HD1 LEU 533 3HD1 LEU 533 -0.193 -1.013 3.675
178 3HD1 LEU 533 2HD1 LEU 533 1.482 -0.555 3.981
179 1HD2 LEU 533 1HD2 LEU 533 0.260 -1.913 0.726
180 2HD2 LEU 533 3HD2 LEU 533 2.007 -1.721 0.908
181 3HD2 LEU 533 2HD2 LEU 533 1.047 -2.373 2.240
182 H VAL 534 H VAL 534 -3.112 -1.744 3.218
183 HA VAL 534 HA VAL 534 -3.329 0.625 5.020
184 HB VAL 534 HB VAL 534 -5.376 -0.750 3.988
185 1HG1 VAL 534 1HG1 VAL 534 -4.539 -2.805 5.328
186 2HG1 VAL 534 3HG1 VAL 534 -5.271 -1.926 6.691
187 3HG1 VAL 534 2HG1 VAL 534 -6.254 -2.366 5.292
188 1HG2 VAL 534 3HG2 VAL 534 -5.165 1.084 5.982
189 2HG2 VAL 534 2HG2 VAL 534 -6.660 0.464 5.292
190 3HG2 VAL 534 1HG2 VAL 534 -5.998 -0.282 6.766
191 H GLY 535 H GLY 535 -2.230 0.585 6.763
192 1HA GLY 535 2HA GLY 535 -1.370 -1.840 8.236
193 2HA GLY 535 1HA GLY 535 -0.229 -0.531 7.925
194 H SER 536 H SER 536 -0.104 1.058 9.710
195 HA SER 536 HA SER 536 -2.655 1.350 11.263
196 1HB SER 536 2HB SER 536 -1.119 -0.254 12.448
197 2HB SER 536 1HB SER 536 -0.001 1.078 12.679
198 HG SER 536 HG SER 536 -1.485 0.767 14.430
199 H ILE 537 H ILE 537 -2.793 3.544 10.214
200 HA ILE 537 HA ILE 537 -1.479 5.443 11.842
201 HB ILE 537 HB ILE 537 -1.010 5.363 8.922
202 1HG1 ILE 537 2HG1 ILE 537 0.536 4.184 10.432
203 2HG1 ILE 537 1HG1 ILE 537 1.314 5.555 9.659
204 1HG2 ILE 537 3HG2 ILE 537 -1.504 7.705 10.434
205 2HG2 ILE 537 2HG2 ILE 537 0.248 7.577 10.258
206 3HG2 ILE 537 1HG2 ILE 537 -0.780 7.613 8.825
207 1HD1 ILE 537 3HD1 ILE 537 -0.025 6.307 12.153
208 2HD1 ILE 537 2HD1 ILE 537 1.241 5.107 12.397
209 3HD1 ILE 537 1HD1 ILE 537 1.613 6.644 11.617
210 H SER 538 H SER 538 -2.497 7.313 12.211
211 HA SER 538 HA SER 538 -5.355 7.162 11.632
212 1HB SER 538 2HB SER 538 -3.781 9.404 12.943
213 2HB SER 538 1HB SER 538 -5.536 9.246 12.951
214 HG SER 538 HG SER 538 -3.750 7.264 13.920
215 H GLN 539 H GLN 539 -2.731 9.044 10.291
216 HA GLN 539 HA GLN 539 -4.576 10.674 8.671
217 1HB GLN 539 2HB GLN 539 -2.200 11.400 9.594
218 2HB GLN 539 1HB GLN 539 -1.609 10.520 8.183
219 1HG GLN 539 2HG GLN 539 -3.735 12.672 8.040
220 2HG GLN 539 1HG GLN 539 -2.023 12.978 7.769
221 1HE2 GLN 539 2HE2 GLN 539 -2.176 10.606 4.846
222 2HE2 GLN 539 1HE2 GLN 539 -1.364 10.571 6.336
223 H LEU 540 H LEU 540 -2.826 7.772 8.743
224 HA LEU 540 HA LEU 540 -3.663 7.131 6.011
225 1HB LEU 540 2HB LEU 540 -1.111 7.361 6.277
226 2HB LEU 540 1HB LEU 540 -1.236 5.973 7.341
227 HG LEU 540 HG LEU 540 -2.663 5.458 4.898
228 1HD1 LEU 540 3HD1 LEU 540 -0.444 7.120 4.516
229 2HD1 LEU 540 2HD1 LEU 540 0.147 5.497 4.152
230 3HD1 LEU 540 1HD1 LEU 540 -1.245 6.144 3.287
231 1HD2 LEU 540 2HD2 LEU 540 -0.813 4.172 6.757
232 2HD2 LEU 540 1HD2 LEU 540 -1.979 3.434 5.658
233 3HD2 LEU 540 3HD2 LEU 540 -0.359 3.824 5.082
234 H GLY 541 H GLY 541 -5.548 6.551 7.279
235 1HA GLY 541 2HA GLY 541 -6.189 5.246 9.444
236 2HA GLY 541 1HA GLY 541 -6.847 4.604 7.936
237 H ASP 542 H ASP 542 -4.896 3.586 6.737
238 HA ASP 542 HA ASP 542 -3.499 1.746 6.521
239 1HB ASP 542 2HB ASP 542 -2.657 3.434 8.527
240 2HB ASP 542 1HB ASP 542 -2.646 1.922 9.326
241 H TRP 543 H TRP 543 -6.177 1.759 8.614
242 HA TRP 543 HA TRP 543 -6.256 -1.186 8.680
243 1HB TRP 543 2HB TRP 543 -7.056 0.574 11.001
244 2HB TRP 543 1HB TRP 543 -7.475 -1.134 10.831
245 HD1 TRP 543 HD1 TRP 543 -5.074 0.817 12.529
246 HE1 TRP 543 HE1 TRP 543 -2.846 -0.379 12.853
247 HE3 TRP 543 HE3 TRP 543 -5.682 -3.017 9.239
248 HZ2 TRP 543 HZ2 TRP 543 -1.450 -2.634 11.762
249 HZ3 TRP 543 HZ3 TRP 543 -3.886 -4.693 8.909
250 HH2 TRP 543 HH2 TRP 543 -1.768 -4.515 10.193
251 H GLU 544 H GLU 544 -7.286 1.194 7.247
252 HA GLU 544 HA GLU 544 -9.947 0.236 6.668
253 1HB GLU 544 2HB GLU 544 -10.480 1.862 8.500
254 2HB GLU 544 1HB GLU 544 -9.502 3.075 7.672
255 1HG GLU 544 2HG GLU 544 -11.197 3.615 6.308
256 2HG GLU 544 1HG GLU 544 -11.408 1.929 5.836
257 H THR 545 H THR 545 -9.059 -0.080 4.609
258 HA THR 545 HA THR 545 -7.009 1.401 3.544
259 HB THR 545 HB THR 545 -7.474 0.431 1.431
260 HG1 THR 545 HG1 THR 545 -10.222 0.298 2.049
261 1HG2 THR 545 3HG2 THR 545 -7.703 -1.215 3.523
262 2HG2 THR 545 2HG2 THR 545 -9.332 -1.403 2.873
263 3HG2 THR 545 1HG2 THR 545 -7.937 -1.800 1.876
264 H SER 546 H SER 546 -10.175 2.612 4.153
265 HA SER 546 HA SER 546 -10.690 4.381 2.046
266 1HB SER 546 2HB SER 546 -11.738 4.007 4.557
267 2HB SER 546 1HB SER 546 -10.989 5.593 4.720
268 HG SER 546 HG SER 546 -13.264 4.960 3.520
269 H ASP 547 H ASP 547 -8.103 4.402 4.323
270 HA ASP 547 HA ASP 547 -6.942 6.756 2.986
271 1HB ASP 547 2HB ASP 547 -7.411 6.531 5.971
272 2HB ASP 547 1HB ASP 547 -6.298 7.693 5.246
273 H GLY 548 H GLY 548 -6.215 3.967 2.798
274 1HA GLY 548 2HA GLY 548 -3.801 3.685 4.481
275 2HA GLY 548 1HA GLY 548 -4.451 2.458 3.385
276 H ILE 549 H ILE 549 -3.269 2.201 1.541
277 HA ILE 549 HA ILE 549 -2.316 4.588 0.164
278 HB ILE 549 HB ILE 549 -0.135 2.594 0.404
279 1HG1 ILE 549 2HG1 ILE 549 -0.449 4.545 2.652
280 2HG1 ILE 549 1HG1 ILE 549 -1.239 2.985 2.770
281 1HG2 ILE 549 3HG2 ILE 549 -0.338 5.609 0.469
282 2HG2 ILE 549 2HG2 ILE 549 1.188 4.738 0.688
283 3HG2 ILE 549 1HG2 ILE 549 0.291 4.601 -0.833
284 1HD1 ILE 549 1HD1 ILE 549 1.140 2.091 2.027
285 2HD1 ILE 549 3HD1 ILE 549 1.680 3.629 2.698
286 3HD1 ILE 549 2HD1 ILE 549 0.816 2.478 3.716
287 H ALA 550 H ALA 550 -3.656 4.043 -1.503
288 HA ALA 550 HA ALA 550 -4.004 1.583 -2.797
289 1HB ALA 550 1HB ALA 550 -4.811 4.193 -3.225
290 2HB ALA 550 3HB ALA 550 -3.900 3.790 -4.679
291 3HB ALA 550 2HB ALA 550 -5.267 2.789 -4.191
292 H LEU 551 H LEU 551 -3.214 0.928 -4.956
293 HA LEU 551 HA LEU 551 -0.506 1.901 -5.723
294 1HB LEU 551 2HB LEU 551 -1.122 -1.008 -5.081
295 2HB LEU 551 1HB LEU 551 0.365 -0.441 -5.819
296 HG LEU 551 HG LEU 551 0.386 1.122 -3.643
297 1HD1 LEU 551 2HD1 LEU 551 -1.100 -1.380 -2.799
298 2HD1 LEU 551 1HD1 LEU 551 -0.398 -0.196 -1.696
299 3HD1 LEU 551 3HD1 LEU 551 -1.731 0.263 -2.751
300 1HD2 LEU 551 3HD2 LEU 551 2.057 -0.622 -4.460
301 2HD2 LEU 551 2HD2 LEU 551 1.964 -0.427 -2.709
302 3HD2 LEU 551 1HD2 LEU 551 1.170 -1.796 -3.488
303 H SER 552 H SER 552 -0.036 1.572 -7.921
304 HA SER 552 HA SER 552 -2.113 0.083 -9.511
305 1HB SER 552 2HB SER 552 -2.198 2.793 -9.378
306 2HB SER 552 1HB SER 552 -1.065 2.571 -10.710
307 HG SER 552 HG SER 552 -3.425 2.640 -11.177
308 H ALA 553 H ALA 553 -1.158 0.673 -12.087
309 HA ALA 553 HA ALA 553 1.747 0.227 -12.225
310 1HB ALA 553 1HB ALA 553 -0.156 -1.889 -13.291
311 2HB ALA 553 3HB ALA 553 1.600 -1.880 -13.561
312 3HB ALA 553 2HB ALA 553 0.927 -2.096 -11.931
313 H ASP 554 H ASP 554 1.458 2.297 -13.378
314 HA ASP 554 HA ASP 554 -0.165 2.751 -15.618
315 1HB ASP 554 2HB ASP 554 1.655 4.325 -16.371
316 2HB ASP 554 1HB ASP 554 1.188 4.557 -14.686
317 H LYS 555 H LYS 555 2.754 0.901 -15.193
318 HA LYS 555 HA LYS 555 3.447 0.455 -17.911
319 1HB LYS 555 2HB LYS 555 3.606 -1.702 -15.811
320 2HB LYS 555 1HB LYS 555 4.741 -1.340 -17.111
321 1HG LYS 555 2HG LYS 555 5.938 -0.120 -15.649
322 2HG LYS 555 1HG LYS 555 4.587 1.012 -15.568
323 1HD LYS 555 2HD LYS 555 3.631 -0.107 -13.691
324 2HD LYS 555 1HD LYS 555 4.686 -1.506 -13.898
325 1HE LYS 555 2HE LYS 555 6.543 0.457 -13.642
326 2HE LYS 555 1HE LYS 555 5.252 1.117 -12.638
327 1HZ LYS 555 2HZ LYS 555 5.474 -1.612 -12.086
328 2HZ LYS 555 1HZ LYS 555 7.039 -0.954 -12.033
329 3HZ LYS 555 3HZ LYS 555 5.814 -0.304 -11.057
330 H TYR 556 H TYR 556 1.639 -1.858 -15.771
331 HA TYR 556 HA TYR 556 0.481 -3.479 -17.687
332 1HB TYR 556 2HB TYR 556 -0.307 -2.381 -15.063
333 2HB TYR 556 1HB TYR 556 -1.600 -3.078 -16.022
334 HD1 TYR 556 HD1 TYR 556 -0.581 -5.320 -17.344
335 HD2 TYR 556 HD2 TYR 556 0.481 -3.873 -13.429
336 HE1 TYR 556 HE1 TYR 556 0.078 -7.601 -16.646
337 HE2 TYR 556 HE2 TYR 556 1.156 -6.121 -12.790
338 HH TYR 556 HH TYR 556 0.249 -8.731 -13.932
339 H THR 557 H THR 557 -1.737 -3.431 -18.548
340 HA THR 557 HA THR 557 -2.741 -0.691 -19.124
341 HB THR 557 HB THR 557 -2.202 -2.999 -20.915
342 HG1 THR 557 HG1 THR 557 -1.663 -1.330 -22.290
343 1HG2 THR 557 3HG2 THR 557 -4.677 -2.808 -20.944
344 2HG2 THR 557 2HG2 THR 557 -4.516 -1.116 -21.423
345 3HG2 THR 557 1HG2 THR 557 -3.946 -2.394 -22.498
346 H SER 558 H SER 558 -3.366 -3.647 -17.790
347 HA SER 558 HA SER 558 -6.215 -3.803 -18.235
348 1HB SER 558 2HB SER 558 -5.126 -5.864 -17.962
349 2HB SER 558 1HB SER 558 -4.205 -5.307 -16.571
350 HG SER 558 HG SER 558 -6.063 -6.706 -16.148
351 H SER 559 H SER 559 -5.457 -4.407 -14.918
352 HA SER 559 HA SER 559 -6.744 -1.781 -14.257
353 1HB SER 559 2HB SER 559 -7.638 -4.397 -13.711
354 2HB SER 559 1HB SER 559 -7.110 -3.723 -12.176
355 HG SER 559 HG SER 559 -8.881 -2.514 -14.041
356 H ASP 560 H ASP 560 -3.916 -2.082 -14.386
357 HA ASP 560 HA ASP 560 -2.068 -1.403 -13.045
358 1HB ASP 560 2HB ASP 560 -3.787 -1.219 -10.624
359 2HB ASP 560 1HB ASP 560 -2.543 -0.134 -11.223
360 HA PRO 561 HA PRO 561 -2.641 -5.647 -10.878
361 1HB PRO 561 2HB PRO 561 -1.632 -7.272 -12.839
362 2HB PRO 561 1HB PRO 561 -3.330 -6.908 -12.622
363 1HG PRO 561 2HG PRO 561 -1.495 -5.907 -14.637
364 2HG PRO 561 1HG PRO 561 -3.228 -6.132 -14.743
365 1HD PRO 561 2HD PRO 561 -1.968 -3.664 -14.328
366 2HD PRO 561 1HD PRO 561 -3.663 -4.024 -14.021
367 H LEU 562 H LEU 562 -0.196 -3.672 -11.866
368 HA LEU 562 HA LEU 562 1.885 -5.580 -10.935
369 1HB LEU 562 2HB LEU 562 2.271 -4.041 -13.047
370 2HB LEU 562 1HB LEU 562 2.521 -2.776 -11.861
371 HG LEU 562 HG LEU 562 4.569 -4.171 -12.714
372 1HD1 LEU 562 1HD1 LEU 562 4.370 -2.437 -10.812
373 2HD1 LEU 562 3HD1 LEU 562 4.275 -3.837 -9.733
374 3HD1 LEU 562 2HD1 LEU 562 5.708 -3.592 -10.727
375 1HD2 LEU 562 2HD2 LEU 562 3.194 -6.318 -11.971
376 2HD2 LEU 562 1HD2 LEU 562 4.946 -6.255 -11.731
377 3HD2 LEU 562 3HD2 LEU 562 3.858 -5.926 -10.384
378 H TRP 563 H TRP 563 0.210 -2.652 -10.351
379 HA TRP 563 HA TRP 563 -0.032 -1.343 -8.468
380 1HB TRP 563 2HB TRP 563 0.947 -3.664 -6.894
381 2HB TRP 563 1HB TRP 563 -0.346 -2.543 -6.553
382 HD1 TRP 563 HD1 TRP 563 0.418 -5.759 -8.433
383 HE1 TRP 563 HE1 TRP 563 -1.757 -6.895 -9.147
384 HE3 TRP 563 HE3 TRP 563 -2.865 -1.902 -7.613
385 HZ2 TRP 563 HZ2 TRP 563 -4.487 -6.205 -9.405
386 HZ3 TRP 563 HZ3 TRP 563 -5.233 -2.193 -8.176
387 HH2 TRP 563 HH2 TRP 563 -6.064 -4.330 -9.078
388 H TYR 564 H TYR 564 1.238 0.236 -7.785
389 HA TYR 564 HA TYR 564 3.794 -0.355 -6.439
390 1HB TYR 564 2HB TYR 564 4.820 1.618 -7.779
391 2HB TYR 564 1HB TYR 564 4.692 0.069 -8.618
392 HD1 TYR 564 HD2 TYR 564 1.769 2.045 -7.790
393 HD2 TYR 564 HD1 TYR 564 4.551 1.079 -10.865
394 HE1 TYR 564 HE2 TYR 564 0.280 3.090 -9.340
395 HE2 TYR 564 HE1 TYR 564 3.066 2.208 -12.520
396 HH TYR 564 HH TYR 564 0.807 4.322 -11.814
397 H VAL 565 H VAL 565 4.372 2.565 -6.137
398 HA VAL 565 HA VAL 565 2.109 4.111 -5.687
399 HB VAL 565 HB VAL 565 1.026 2.661 -4.249
400 1HG1 VAL 565 3HG1 VAL 565 3.698 2.101 -2.951
401 2HG1 VAL 565 2HG1 VAL 565 2.169 1.412 -2.430
402 3HG1 VAL 565 1HG1 VAL 565 2.829 1.013 -4.012
403 1HG2 VAL 565 3HG2 VAL 565 2.668 4.518 -2.515
404 2HG2 VAL 565 2HG2 VAL 565 1.040 4.775 -3.137
405 3HG2 VAL 565 1HG2 VAL 565 1.331 3.549 -1.905
406 H THR 566 H THR 566 2.323 5.891 -4.362
407 HA THR 566 HA THR 566 4.813 6.456 -2.922
408 HB THR 566 HB THR 566 4.156 7.963 -5.478
409 HG1 THR 566 HG1 THR 566 5.557 6.669 -6.312
410 1HG2 THR 566 2HG2 THR 566 5.426 8.844 -3.093
411 2HG2 THR 566 1HG2 THR 566 6.693 8.622 -4.300
412 3HG2 THR 566 3HG2 THR 566 5.330 9.687 -4.639
413 H VAL 567 H VAL 567 3.287 6.847 -1.207
414 HA VAL 567 HA VAL 567 1.635 9.318 -1.596
415 HB VAL 567 HB VAL 567 0.980 7.128 0.376
416 1HG1 VAL 567 3HG1 VAL 567 -0.290 9.599 -0.675
417 2HG1 VAL 567 2HG1 VAL 567 -1.360 8.212 -0.479
418 3HG1 VAL 567 1HG1 VAL 567 -0.460 8.831 0.905
419 1HG2 VAL 567 2HG2 VAL 567 0.099 7.373 -2.517
420 2HG2 VAL 567 1HG2 VAL 567 1.104 6.091 -1.841
421 3HG2 VAL 567 3HG2 VAL 567 -0.581 6.244 -1.345
422 H THR 568 H THR 568 1.054 10.220 0.761
423 HA THR 568 HA THR 568 3.633 10.318 2.259
424 HB THR 568 HB THR 568 2.486 12.588 3.046
425 HG1 THR 568 HG1 THR 568 1.572 12.455 0.400
426 1HG2 THR 568 2HG2 THR 568 4.110 11.891 0.641
427 2HG2 THR 568 1HG2 THR 568 3.513 13.545 0.780
428 3HG2 THR 568 3HG2 THR 568 4.543 12.870 2.043
429 H LEU 569 H LEU 569 3.342 10.954 4.590
430 HA LEU 569 HA LEU 569 0.821 10.334 5.913
431 1HB LEU 569 2HB LEU 569 2.041 8.076 5.319
432 2HB LEU 569 1HB LEU 569 3.120 8.518 6.645
433 HG LEU 569 HG LEU 569 0.116 8.555 6.979
434 1HD1 LEU 569 3HD1 LEU 569 2.010 6.219 7.415
435 2HD1 LEU 569 2HD1 LEU 569 0.364 6.280 8.048
436 3HD1 LEU 569 1HD1 LEU 569 0.644 6.269 6.311
437 1HD2 LEU 569 1HD2 LEU 569 2.359 9.269 8.563
438 2HD2 LEU 569 3HD2 LEU 569 0.662 9.237 9.047
439 3HD2 LEU 569 2HD2 LEU 569 1.668 7.811 9.265
440 HA PRO 570 HA PRO 570 3.504 13.300 8.063
441 1HB PRO 570 2HB PRO 570 1.429 14.870 8.935
442 2HB PRO 570 1HB PRO 570 2.187 15.024 7.340
443 1HG PRO 570 2HG PRO 570 -0.447 13.836 8.061
444 2HG PRO 570 1HG PRO 570 0.066 14.580 6.539
445 1HD PRO 570 2HD PRO 570 -0.141 11.803 7.028
446 2HD PRO 570 1HD PRO 570 0.697 12.558 5.656
447 H ALA 571 H ALA 571 4.130 11.858 9.724
448 HA ALA 571 HA ALA 571 2.873 12.365 12.290
449 1HB ALA 571 2HB ALA 571 2.532 9.708 10.926
450 2HB ALA 571 1HB ALA 571 2.695 9.766 12.681
451 3HB ALA 571 3HB ALA 571 1.371 10.620 11.890
452 H GLY 572 H GLY 572 4.149 10.312 13.777
453 1HA GLY 572 2HA GLY 572 6.919 10.072 12.842
454 2HA GLY 572 1HA GLY 572 6.721 11.201 14.180
455 H GLU 573 H GLU 573 5.924 7.839 13.264
456 HA GLU 573 HA GLU 573 6.907 6.851 15.824
457 1HB GLU 573 2HB GLU 573 4.110 5.979 15.500
458 2HB GLU 573 1HB GLU 573 4.979 6.443 16.959
459 1HG GLU 573 2HG GLU 573 4.560 8.753 16.605
460 2HG GLU 573 1HG GLU 573 4.085 8.493 14.926
461 H SER 574 H SER 574 5.354 4.428 15.783
462 HA SER 574 HA SER 574 6.580 3.088 13.415
463 1HB SER 574 2HB SER 574 5.396 1.143 15.025
464 2HB SER 574 1HB SER 574 7.101 1.585 15.027
465 HG SER 574 HG SER 574 6.769 2.884 16.743
466 H PHE 575 H PHE 575 5.133 3.598 11.823
467 HA PHE 575 HA PHE 575 2.234 3.254 12.132
468 1HB PHE 575 2HB PHE 575 3.945 3.676 9.649
469 2HB PHE 575 1HB PHE 575 2.217 3.920 9.767
470 HD1 PHE 575 HD1 PHE 575 3.602 4.904 12.868
471 HD2 PHE 575 HD2 PHE 575 3.202 6.266 8.816
472 HE1 PHE 575 HE1 PHE 575 4.132 7.187 13.586
473 HE2 PHE 575 HE2 PHE 575 3.761 8.558 9.548
474 HZ PHE 575 HZ PHE 575 4.231 9.011 11.932
475 H GLU 576 H GLU 576 1.182 1.316 11.560
476 HA GLU 576 HA GLU 576 2.849 -1.034 11.083
477 1HB GLU 576 2HB GLU 576 -0.156 -0.798 11.085
478 2HB GLU 576 1HB GLU 576 0.749 -2.302 11.042
479 1HG GLU 576 2HG GLU 576 1.182 -0.271 13.232
480 2HG GLU 576 1HG GLU 576 -0.065 -1.513 13.354
481 H TYR 577 H TYR 577 2.303 -2.541 9.219
482 HA TYR 577 HA TYR 577 1.376 -1.039 6.866
483 1HB TYR 577 2HB TYR 577 4.162 -2.103 7.248
484 2HB TYR 577 1HB TYR 577 3.476 -1.922 5.629
485 HD1 TYR 577 HD1 TYR 577 4.375 -0.099 8.754
486 HD2 TYR 577 HD2 TYR 577 3.097 0.239 4.658
487 HE1 TYR 577 HE1 TYR 577 4.782 2.332 8.818
488 HE2 TYR 577 HE2 TYR 577 3.509 2.682 4.736
489 HH TYR 577 HH TYR 577 3.621 4.445 7.204
490 H LYS 578 H LYS 578 -0.344 -2.440 6.813
491 HA LYS 578 HA LYS 578 0.226 -5.291 6.214
492 1HB LYS 578 2HB LYS 578 -1.764 -4.064 7.807
493 2HB LYS 578 1HB LYS 578 -2.592 -4.592 6.342
494 1HG LYS 578 2HG LYS 578 -2.648 -6.424 7.918
495 2HG LYS 578 1HG LYS 578 -1.511 -6.850 6.637
496 1HD LYS 578 2HD LYS 578 0.365 -6.460 7.998
497 2HD LYS 578 1HD LYS 578 -0.550 -5.469 9.135
498 1HE LYS 578 2HE LYS 578 -0.146 -7.622 10.172
499 2HE LYS 578 1HE LYS 578 -1.859 -7.522 9.765
500 1HZ LYS 578 1HZ LYS 578 -1.152 -8.631 7.588
501 2HZ LYS 578 3HZ LYS 578 0.273 -9.045 8.410
502 3HZ LYS 578 2HZ LYS 578 -1.228 -9.594 8.985
503 H PHE 579 H PHE 579 -0.756 -6.112 4.221
504 HA PHE 579 HA PHE 579 -1.259 -3.864 2.314
505 1HB PHE 579 2HB PHE 579 0.800 -5.236 1.815
506 2HB PHE 579 1HB PHE 579 -0.268 -6.617 1.520
507 HD1 PHE 579 HD1 PHE 579 -2.208 -6.341 0.003
508 HD2 PHE 579 HD2 PHE 579 1.066 -3.587 0.122
509 HE1 PHE 579 HE1 PHE 579 -2.942 -5.400 -2.133
510 HE2 PHE 579 HE2 PHE 579 0.335 -2.633 -2.050
511 HZ PHE 579 HZ PHE 579 -1.692 -3.553 -3.139
512 H ILE 580 H ILE 580 -2.915 -3.893 0.989
513 HA ILE 580 HA ILE 580 -4.881 -6.091 1.284
514 HB ILE 580 HB ILE 580 -6.604 -4.471 1.653
515 1HG1 ILE 580 2HG1 ILE 580 -4.526 -2.685 0.541
516 2HG1 ILE 580 1HG1 ILE 580 -6.284 -2.692 0.289
517 1HG2 ILE 580 1HG2 ILE 580 -4.988 -4.980 3.592
518 2HG2 ILE 580 3HG2 ILE 580 -4.238 -3.425 3.229
519 3HG2 ILE 580 2HG2 ILE 580 -5.922 -3.485 3.744
520 1HD1 ILE 580 2HD1 ILE 580 -6.167 -1.967 2.887
521 2HD1 ILE 580 1HD1 ILE 580 -4.661 -1.263 2.305
522 3HD1 ILE 580 3HD1 ILE 580 -6.192 -0.813 1.562
523 H ARG 581 H ARG 581 -6.020 -6.590 -0.589
524 HA ARG 581 HA ARG 581 -5.291 -4.974 -2.983
525 1HB ARG 581 2HB ARG 581 -4.537 -7.279 -3.213
526 2HB ARG 581 1HB ARG 581 -6.124 -7.882 -2.737
527 1HG ARG 581 2HG ARG 581 -7.127 -6.891 -4.741
528 2HG ARG 581 1HG ARG 581 -5.563 -6.227 -5.214
529 1HD ARG 581 2HD ARG 581 -6.506 -9.069 -5.259
530 2HD ARG 581 1HD ARG 581 -5.562 -8.186 -6.457
531 HE ARG 581 HE ARG 581 -3.599 -8.447 -4.951
532 1HH1 ARG 581 1HH2 ARG 581 -6.329 -9.711 -3.424
533 2HH1 ARG 581 2HH2 ARG 581 -5.568 -11.178 -2.907
534 1HH2 ARG 581 2HH1 ARG 581 -2.644 -10.598 -4.678
535 2HH2 ARG 581 1HH1 ARG 581 -3.481 -11.681 -3.618
536 H ILE 582 H ILE 582 -6.909 -3.462 -3.076
537 HA ILE 582 HA ILE 582 -9.628 -4.184 -2.328
538 HB ILE 582 HB ILE 582 -8.169 -1.822 -2.477
539 1HG1 ILE 582 2HG1 ILE 582 -9.876 -2.431 -0.828
540 2HG1 ILE 582 1HG1 ILE 582 -10.271 -0.867 -1.552
541 1HG2 ILE 582 3HG2 ILE 582 -8.998 -1.717 -4.917
542 2HG2 ILE 582 2HG2 ILE 582 -10.609 -1.515 -4.239
543 3HG2 ILE 582 1HG2 ILE 582 -9.355 -0.323 -3.902
544 1HD1 ILE 582 2HD1 ILE 582 -11.448 -2.539 -3.330
545 2HD1 ILE 582 1HD1 ILE 582 -11.638 -3.476 -1.827
546 3HD1 ILE 582 3HD1 ILE 582 -12.298 -1.838 -1.939
547 H GLU 583 H GLU 583 -11.438 -4.398 -3.513
548 HA GLU 583 HA GLU 583 -12.835 -4.937 -5.273
549 1HB GLU 583 2HB GLU 583 -12.385 -2.603 -5.831
550 2HB GLU 583 1HB GLU 583 -10.974 -3.092 -6.769
551 1HG GLU 583 2HG GLU 583 -12.233 -3.805 -8.520
552 2HG GLU 583 1HG GLU 583 -13.446 -4.535 -7.467
553 H SER 584 H SER 584 -9.617 -6.072 -5.484
554 HA SER 584 HA SER 584 -9.552 -7.003 -8.155
555 1HB SER 584 2HB SER 584 -7.916 -8.608 -7.474
556 2HB SER 584 1HB SER 584 -7.665 -7.173 -6.485
557 HG SER 584 HG SER 584 -8.969 -8.215 -4.869
558 H ASP 585 H ASP 585 -11.357 -8.211 -5.401
559 HA ASP 585 HA ASP 585 -12.545 -10.274 -7.178
560 1HB ASP 585 2HB ASP 585 -12.982 -11.122 -4.619
561 2HB ASP 585 1HB ASP 585 -11.704 -11.741 -5.653
562 H ASP 586 H ASP 586 -13.264 -9.011 -3.950
563 HA ASP 586 HA ASP 586 -15.891 -8.004 -4.962
564 1HB ASP 586 2HB ASP 586 -15.406 -10.097 -3.040
565 2HB ASP 586 1HB ASP 586 -16.158 -8.727 -2.223
566 H SER 587 H SER 587 -13.897 -7.995 -1.998
567 HA SER 587 HA SER 587 -14.034 -5.013 -2.057
568 1HB SER 587 2HB SER 587 -13.970 -5.022 0.402
569 2HB SER 587 1HB SER 587 -15.416 -5.836 -0.196
570 HG SER 587 HG SER 587 -14.515 -7.784 0.282
571 H VAL 588 H VAL 588 -12.149 -5.526 0.521
572 HA VAL 588 HA VAL 588 -9.760 -5.586 -1.228
573 HB VAL 588 HB VAL 588 -9.238 -5.353 1.629
574 1HG1 VAL 588 2HG1 VAL 588 -8.557 -3.739 -0.822
575 2HG1 VAL 588 1HG1 VAL 588 -7.927 -3.394 0.792
576 3HG1 VAL 588 3HG1 VAL 588 -7.538 -4.923 0.004
577 1HG2 VAL 588 3HG2 VAL 588 -11.434 -3.802 0.631
578 2HG2 VAL 588 2HG2 VAL 588 -10.697 -3.829 2.235
579 3HG2 VAL 588 1HG2 VAL 588 -10.067 -2.749 0.997
580 H GLU 589 H GLU 589 -7.867 -6.740 -0.338
581 HA GLU 589 HA GLU 589 -8.591 -9.216 1.147
582 1HB GLU 589 2HB GLU 589 -8.271 -9.987 -1.119
583 2HB GLU 589 1HB GLU 589 -6.865 -8.940 -1.338
584 1HG GLU 589 2HG GLU 589 -5.516 -10.536 -0.526
585 2HG GLU 589 1HG GLU 589 -6.437 -10.559 0.979
586 H TRP 590 H TRP 590 -7.751 -8.078 3.031
587 HA TRP 590 HA TRP 590 -5.162 -6.827 2.935
588 1HB TRP 590 2HB TRP 590 -6.826 -7.713 5.298
589 2HB TRP 590 1HB TRP 590 -5.345 -6.760 5.423
590 HD1 TRP 590 HD1 TRP 590 -7.444 -6.018 2.415
591 HE1 TRP 590 HE1 TRP 590 -8.631 -3.786 2.653
592 HE3 TRP 590 HE3 TRP 590 -6.385 -4.993 7.315
593 HZ2 TRP 590 HZ2 TRP 590 -9.146 -1.849 4.667
594 HZ3 TRP 590 HZ3 TRP 590 -7.213 -2.861 8.308
595 HH2 TRP 590 HH2 TRP 590 -8.581 -1.335 6.987
596 H GLU 591 H GLU 591 -3.871 -8.434 1.971
597 HA GLU 591 HA GLU 591 -3.258 -10.818 3.607
598 1HB GLU 591 2HB GLU 591 -3.735 -10.869 1.038
599 2HB GLU 591 1HB GLU 591 -2.097 -10.232 0.904
600 1HG GLU 591 2HG GLU 591 -1.366 -12.359 1.059
601 2HG GLU 591 1HG GLU 591 -1.875 -12.319 2.748
602 H SER 592 H SER 592 -0.568 -10.401 1.888
603 HA SER 592 HA SER 592 1.426 -9.159 2.134
604 1HB SER 592 2HB SER 592 -0.402 -7.356 2.967
605 2HB SER 592 1HB SER 592 0.387 -7.685 4.503
606 HG SER 592 HG SER 592 2.009 -6.534 3.851
607 H ASP 593 H ASP 593 1.802 -11.484 2.949
608 HA ASP 593 HA ASP 593 1.808 -12.207 5.667
609 1HB ASP 593 2HB ASP 593 2.858 -13.259 3.253
610 2HB ASP 593 1HB ASP 593 4.193 -13.212 4.405
611 HA PRO 594 HA PRO 594 6.157 -10.281 6.082
612 1HB PRO 594 2HB PRO 594 7.125 -8.848 3.945
613 2HB PRO 594 1HB PRO 594 7.397 -10.586 4.163
614 1HG PRO 594 2HG PRO 594 5.563 -9.198 2.267
615 2HG PRO 594 1HG PRO 594 6.324 -10.792 2.128
616 1HD PRO 594 2HD PRO 594 3.637 -10.288 2.869
617 2HD PRO 594 1HD PRO 594 4.495 -11.836 3.028
618 H ASN 595 H ASN 595 4.413 -8.974 7.277
619 HA ASN 595 HA ASN 595 3.576 -6.410 6.255
620 1HB ASN 595 2HB ASN 595 3.040 -5.952 8.691
621 2HB ASN 595 1HB ASN 595 2.296 -7.411 8.036
622 1HD2 ASN 595 2HD2 ASN 595 3.663 -8.799 11.065
623 2HD2 ASN 595 1HD2 ASN 595 2.265 -8.080 10.426
624 H ARG 596 H ARG 596 4.203 -4.456 7.980
625 HA ARG 596 HA ARG 596 7.058 -4.463 8.634
626 1HB ARG 596 2HB ARG 596 6.319 -3.696 6.039
627 2HB ARG 596 1HB ARG 596 6.579 -2.180 6.903
628 1HG ARG 596 2HG ARG 596 8.810 -2.490 6.916
629 2HG ARG 596 1HG ARG 596 8.632 -4.113 7.583
630 1HD ARG 596 2HD ARG 596 7.945 -4.808 5.186
631 2HD ARG 596 1HD ARG 596 8.645 -3.268 4.687
632 HE ARG 596 HE ARG 596 10.811 -4.103 5.266
633 1HH1 ARG 596 2HH1 ARG 596 11.540 -5.472 7.269
634 2HH1 ARG 596 1HH1 ARG 596 11.128 -7.145 7.096
635 1HH2 ARG 596 1HH2 ARG 596 8.848 -6.593 4.542
636 2HH2 ARG 596 2HH2 ARG 596 9.604 -7.780 5.552
637 H GLU 597 H GLU 597 7.701 -2.303 9.569
638 HA GLU 597 HA GLU 597 5.372 -0.723 10.561
639 1HB GLU 597 2HB GLU 597 6.653 -0.669 12.810
640 2HB GLU 597 1HB GLU 597 5.759 -2.139 12.420
641 1HG GLU 597 2HG GLU 597 8.633 -1.890 11.582
642 2HG GLU 597 1HG GLU 597 8.246 -2.324 13.247
643 H TYR 598 H TYR 598 6.212 0.794 8.919
644 HA TYR 598 HA TYR 598 8.765 1.868 8.748
645 1HB TYR 598 2HB TYR 598 6.573 2.395 7.455
646 2HB TYR 598 1HB TYR 598 6.311 3.612 8.703
647 HD1 TYR 598 HD1 TYR 598 8.009 5.465 9.003
648 HD2 TYR 598 HD2 TYR 598 8.164 2.630 5.773
649 HE1 TYR 598 HE1 TYR 598 9.487 7.002 7.777
650 HE2 TYR 598 HE2 TYR 598 9.695 4.135 4.537
651 HH TYR 598 HH TYR 598 11.373 6.561 5.851
652 H THR 599 H THR 599 10.010 2.870 10.264
653 HA THR 599 HA THR 599 8.711 3.855 12.733
654 HB THR 599 HB THR 599 11.292 4.443 13.143
655 HG1 THR 599 HG1 THR 599 12.577 3.542 11.760
656 1HG2 THR 599 1HG2 THR 599 9.553 2.387 13.869
657 2HG2 THR 599 3HG2 THR 599 10.998 1.549 13.300
658 3HG2 THR 599 2HG2 THR 599 11.121 2.733 14.601
659 H VAL 600 H VAL 600 7.701 5.411 10.887
660 HA VAL 600 HA VAL 600 9.173 7.445 9.697
661 HB VAL 600 HB VAL 600 6.433 7.762 10.983
662 1HG1 VAL 600 2HG1 VAL 600 8.222 9.403 9.280
663 2HG1 VAL 600 1HG1 VAL 600 6.471 9.608 9.146
664 3HG1 VAL 600 3HG1 VAL 600 7.281 9.911 10.690
665 1HG2 VAL 600 2HG2 VAL 600 7.294 7.215 8.114
666 2HG2 VAL 600 1HG2 VAL 600 6.272 6.172 9.125
667 3HG2 VAL 600 3HG2 VAL 600 5.680 7.736 8.570
668 HA PRO 601 HA PRO 601 10.747 9.239 13.511
669 1HB PRO 601 2HB PRO 601 12.744 10.658 12.263
670 2HB PRO 601 1HB PRO 601 12.880 8.943 12.688
671 1HG PRO 601 2HG PRO 601 12.455 10.185 10.011
672 2HG PRO 601 1HG PRO 601 13.200 8.631 10.422
673 1HD PRO 601 2HD PRO 601 10.570 9.002 9.440
674 2HD PRO 601 1HD PRO 601 11.217 7.512 10.160
675 H GLN 602 H GLN 602 11.386 11.697 13.964
676 HA GLN 602 HA GLN 602 9.322 13.389 12.612
677 1HB GLN 602 2HB GLN 602 9.324 14.728 14.708
678 2HB GLN 602 1HB GLN 602 8.865 13.049 14.996
679 1HG GLN 602 2HG GLN 602 10.638 12.716 16.348
680 2HG GLN 602 1HG GLN 602 11.748 13.392 15.155
681 1HE2 GLN 602 2HE2 GLN 602 12.151 16.338 17.020
682 2HE2 GLN 602 1HE2 GLN 602 12.805 15.216 15.928
683 H ALA 603 H ALA 603 12.688 13.063 13.421
684 HA ALA 603 HA ALA 603 13.334 15.864 12.857
685 1HB ALA 603 2HB ALA 603 14.958 13.381 13.402
686 2HB ALA 603 1HB ALA 603 15.729 14.870 12.856
687 3HB ALA 603 3HB ALA 603 14.832 14.847 14.374
688 H CYS 604 H CYS 604 14.257 16.649 10.937
689 HA CYS 604 HA CYS 604 13.539 15.323 8.500
690 1HB CYS 604 2HB CYS 604 14.740 17.116 7.380
691 2HB CYS 604 1HB CYS 604 13.864 17.800 8.750
692 H GLY 605 H GLY 605 14.677 13.878 7.259
693 1HA GLY 605 2HA GLY 605 17.441 13.642 6.964
694 2HA GLY 605 1HA GLY 605 17.049 12.640 8.362
695 H THR 606 H THR 606 14.351 11.999 7.228
696 HA THR 606 HA THR 606 14.780 10.657 4.696
697 HB THR 606 HB THR 606 16.113 9.177 6.166
698 HG1 THR 606 HG1 THR 606 14.867 7.258 5.705
699 1HG2 THR 606 2HG2 THR 606 13.883 9.633 7.929
700 2HG2 THR 606 1HG2 THR 606 14.074 7.901 7.657
701 3HG2 THR 606 3HG2 THR 606 15.424 8.849 8.279
702 H SER 607 H SER 607 12.787 12.391 5.950
703 HA SER 607 HA SER 607 10.470 11.106 6.868
704 1HB SER 607 2HB SER 607 10.474 13.385 4.874
705 2HB SER 607 1HB SER 607 9.228 13.009 6.061
706 HG SER 607 HG SER 607 11.737 14.187 6.380
707 H THR 608 H THR 608 11.834 11.150 3.655
708 HA THR 608 HA THR 608 9.498 9.548 2.712
709 HB THR 608 HB THR 608 9.853 10.384 0.518
710 HG1 THR 608 HG1 THR 608 11.769 10.897 -0.186
711 1HG2 THR 608 3HG2 THR 608 10.381 12.506 2.594
712 2HG2 THR 608 2HG2 THR 608 10.241 12.912 0.883
713 3HG2 THR 608 1HG2 THR 608 8.883 12.168 1.727
714 H ALA 609 H ALA 609 9.940 7.445 2.562
715 HA ALA 609 HA ALA 609 12.718 6.672 1.732
716 1HB ALA 609 1HB ALA 609 12.334 6.425 4.236
717 2HB ALA 609 3HB ALA 609 11.154 5.175 3.842
718 3HB ALA 609 2HB ALA 609 12.847 4.961 3.397
719 H THR 610 H THR 610 12.413 3.943 1.678
720 HA THR 610 HA THR 610 10.300 3.613 -0.414
721 HB THR 610 HB THR 610 11.810 1.448 -0.798
722 HG1 THR 610 HG1 THR 610 13.742 3.299 0.070
723 1HG2 THR 610 1HG2 THR 610 12.588 4.248 -1.661
724 2HG2 THR 610 3HG2 THR 610 13.120 2.759 -2.443
725 3HG2 THR 610 2HG2 THR 610 11.414 3.205 -2.463
726 H VAL 611 H VAL 611 9.435 1.408 -0.560
727 HA VAL 611 HA VAL 611 9.248 -0.144 1.919
728 HB VAL 611 HB VAL 611 6.641 0.837 0.920
729 1HG1 VAL 611 3HG1 VAL 611 7.703 -0.320 3.298
730 2HG1 VAL 611 2HG1 VAL 611 7.063 1.284 3.720
731 3HG1 VAL 611 1HG1 VAL 611 6.012 0.067 2.961
732 1HG2 VAL 611 2HG2 VAL 611 8.079 2.901 0.928
733 2HG2 VAL 611 1HG2 VAL 611 6.643 2.966 1.972
734 3HG2 VAL 611 3HG2 VAL 611 8.242 2.649 2.675
735 H THR 612 H THR 612 10.229 -1.062 -0.381
736 HA THR 612 HA THR 612 8.263 -1.863 -2.347
737 HB THR 612 HB THR 612 10.370 -3.460 -2.877
738 HG1 THR 612 HG1 THR 612 11.833 -2.935 -1.482
739 1HG2 THR 612 1HG2 THR 612 9.520 -0.742 -3.605
740 2HG2 THR 612 3HG2 THR 612 11.176 -1.167 -4.041
741 3HG2 THR 612 2HG2 THR 612 9.830 -2.156 -4.612
742 H ASP 613 H ASP 613 7.570 -3.874 -2.933
743 HA ASP 613 HA ASP 613 8.295 -6.218 -1.476
744 1HB ASP 613 2HB ASP 613 5.887 -4.712 -0.669
745 2HB ASP 613 1HB ASP 613 5.611 -6.431 -0.954
746 H THR 614 H THR 614 6.756 -8.114 -2.244
747 HA THR 614 HA THR 614 5.307 -7.586 -4.683
748 HB THR 614 HB THR 614 6.932 -7.747 -6.179
749 HG1 THR 614 HG1 THR 614 7.477 -9.754 -6.712
750 1HG2 THR 614 2HG2 THR 614 8.605 -8.361 -3.761
751 2HG2 THR 614 1HG2 THR 614 9.306 -8.494 -5.374
752 3HG2 THR 614 3HG2 THR 614 8.651 -6.952 -4.822
753 H TRP 615 H TRP 615 3.866 -8.787 -4.904
754 HA TRP 615 HA TRP 615 3.192 -10.938 -3.203
755 1HB TRP 615 2HB TRP 615 2.095 -9.254 -5.186
756 2HB TRP 615 1HB TRP 615 1.706 -10.909 -5.651
757 HD1 TRP 615 HD1 TRP 615 1.319 -12.239 -3.181
758 HE1 TRP 615 HE1 TRP 615 -0.567 -11.763 -1.460
759 HE3 TRP 615 HE3 TRP 615 0.262 -7.542 -4.547
760 HZ2 TRP 615 HZ2 TRP 615 -2.326 -9.549 -0.806
761 HZ3 TRP 615 HZ3 TRP 615 -1.491 -6.265 -3.441
762 HH2 TRP 615 HH2 TRP 615 -2.763 -7.219 -1.584
763 H ARG 616 H ARG 616 4.353 -12.841 -3.306
764 HA ARG 616 HA ARG 616 4.550 -14.147 -5.982
765 1HB ARG 616 2HB ARG 616 6.741 -13.301 -4.250
766 2HB ARG 616 1HB ARG 616 6.795 -15.033 -4.582
767 1HG ARG 616 2HG ARG 616 6.281 -13.118 -6.837
768 2HG ARG 616 1HG ARG 616 7.931 -13.353 -6.259
769 1HD ARG 616 2HD ARG 616 8.074 -15.314 -7.350
770 2HD ARG 616 1HD ARG 616 6.639 -15.913 -6.518
771 HE ARG 616 HE ARG 616 5.377 -15.408 -8.449
772 1HH1 ARG 616 1HH2 ARG 616 5.949 -12.570 -8.805
773 2HH1 ARG 616 2HH2 ARG 616 6.880 -12.522 -10.265
774 1HH2 ARG 616 1HH1 ARG 616 7.656 -15.901 -10.197
775 2HH2 ARG 616 2HH1 ARG 616 7.846 -14.407 -11.053
No H/Q in entry = 775
Start of MODEL 3
1 1H CYS 509 2H CYS 509 -3.202 20.345 14.587
2 2H CYS 509 1H CYS 509 -1.505 20.285 14.610
3 3H CYS 509 3H CYS 509 -2.381 20.012 16.036
4 HA CYS 509 HA CYS 509 -2.710 22.183 16.444
5 1HB CYS 509 2HB CYS 509 -0.820 23.548 15.654
6 2HB CYS 509 1HB CYS 509 -0.265 21.941 16.120
7 H THR 510 H THR 510 -2.873 21.367 13.052
8 HA THR 510 HA THR 510 -4.703 23.686 12.664
9 HB THR 510 HB THR 510 -2.704 22.838 10.559
10 HG1 THR 510 HG1 THR 510 -1.294 24.171 11.399
11 1HG2 THR 510 2HG2 THR 510 -4.970 24.540 10.593
12 2HG2 THR 510 1HG2 THR 510 -3.552 25.586 10.513
13 3HG2 THR 510 3HG2 THR 510 -3.796 24.337 9.292
14 H THR 511 H THR 511 -3.404 20.867 10.864
15 HA THR 511 HA THR 511 -6.048 20.393 9.676
16 HB THR 511 HB THR 511 -4.307 18.195 9.200
17 HG1 THR 511 HG1 THR 511 -2.989 20.581 8.567
18 1HG2 THR 511 1HG2 THR 511 -5.871 20.090 7.792
19 2HG2 THR 511 3HG2 THR 511 -4.253 20.155 7.093
20 3HG2 THR 511 2HG2 THR 511 -5.127 18.624 7.153
21 HA PRO 512 HA PRO 512 -7.340 17.166 12.375
22 1HB PRO 512 2HB PRO 512 -8.212 15.217 10.648
23 2HB PRO 512 1HB PRO 512 -9.074 16.742 10.917
24 1HG PRO 512 2HG PRO 512 -7.453 15.895 8.566
25 2HG PRO 512 1HG PRO 512 -8.768 17.079 8.654
26 1HD PRO 512 2HD PRO 512 -5.985 17.658 8.564
27 2HD PRO 512 1HD PRO 512 -7.292 18.810 8.913
28 H THR 513 H THR 513 -4.431 16.989 11.704
29 HA THR 513 HA THR 513 -2.661 15.469 11.920
30 HB THR 513 HB THR 513 -2.914 13.907 13.629
31 HG1 THR 513 HG1 THR 513 -5.024 12.921 13.982
32 1HG2 THR 513 3HG2 THR 513 -4.009 16.292 14.068
33 2HG2 THR 513 2HG2 THR 513 -5.471 15.323 14.248
34 3HG2 THR 513 1HG2 THR 513 -4.078 15.019 15.286
35 H ALA 514 H ALA 514 -4.507 15.306 9.551
36 HA ALA 514 HA ALA 514 -4.662 12.469 8.866
37 1HB ALA 514 2HB ALA 514 -5.219 15.049 7.426
38 2HB ALA 514 1HB ALA 514 -5.132 13.535 6.525
39 3HB ALA 514 3HB ALA 514 -6.328 13.732 7.806
40 H VAL 515 H VAL 515 -3.085 11.289 7.799
41 HA VAL 515 HA VAL 515 -0.679 12.822 6.948
42 HB VAL 515 HB VAL 515 -0.786 9.893 7.572
43 1HG1 VAL 515 1HG1 VAL 515 1.015 10.947 6.035
44 2HG1 VAL 515 3HG1 VAL 515 1.586 11.755 7.494
45 3HG1 VAL 515 2HG1 VAL 515 1.574 9.992 7.411
46 1HG2 VAL 515 3HG2 VAL 515 -1.392 11.368 9.512
47 2HG2 VAL 515 2HG2 VAL 515 0.109 10.473 9.744
48 3HG2 VAL 515 1HG2 VAL 515 0.158 12.182 9.306
49 H ALA 516 H ALA 516 -1.254 13.264 4.784
50 HA ALA 516 HA ALA 516 -2.141 11.074 3.050
51 1HB ALA 516 1HB ALA 516 -1.178 13.873 2.372
52 2HB ALA 516 3HB ALA 516 -1.897 12.741 1.224
53 3HB ALA 516 2HB ALA 516 -2.863 13.385 2.555
54 H VAL 517 H VAL 517 -0.664 9.572 2.299
55 HA VAL 517 HA VAL 517 2.133 10.587 1.954
56 HB VAL 517 HB VAL 517 1.929 7.711 2.375
57 1HG1 VAL 517 2HG1 VAL 517 3.999 9.037 2.355
58 2HG1 VAL 517 1HG1 VAL 517 3.455 9.892 3.800
59 3HG1 VAL 517 3HG1 VAL 517 3.793 8.156 3.878
60 1HG2 VAL 517 1HG2 VAL 517 0.088 8.514 3.917
61 2HG2 VAL 517 3HG2 VAL 517 1.419 7.639 4.685
62 3HG2 VAL 517 2HG2 VAL 517 1.331 9.404 4.801
63 H THR 518 H THR 518 3.028 10.063 -0.040
64 HA THR 518 HA THR 518 1.262 8.587 -1.913
65 HB THR 518 HB THR 518 1.946 10.651 -2.874
66 HG1 THR 518 HG1 THR 518 3.155 9.972 -4.583
67 1HG2 THR 518 1HG2 THR 518 4.670 9.986 -1.740
68 2HG2 THR 518 3HG2 THR 518 4.402 11.293 -2.893
69 3HG2 THR 518 2HG2 THR 518 3.627 11.342 -1.310
70 H PHE 519 H PHE 519 1.777 6.528 -2.424
71 HA PHE 519 HA PHE 519 4.559 5.626 -1.844
72 1HB PHE 519 2HB PHE 519 2.429 3.554 -1.968
73 2HB PHE 519 1HB PHE 519 3.863 3.623 -0.972
74 HD1 PHE 519 HD2 PHE 519 0.682 5.619 -1.368
75 HD2 PHE 519 HD1 PHE 519 3.522 3.801 1.271
76 HE1 PHE 519 HE2 PHE 519 -0.644 6.377 0.575
77 HE2 PHE 519 HE1 PHE 519 2.196 4.564 3.214
78 HZ PHE 519 HZ PHE 519 0.127 5.838 2.852
79 H ASP 520 H ASP 520 5.277 3.842 -3.203
80 HA ASP 520 HA ASP 520 3.889 3.679 -5.819
81 1HB ASP 520 2HB ASP 520 6.680 4.572 -5.217
82 2HB ASP 520 1HB ASP 520 6.431 3.567 -6.639
83 H LEU 521 H LEU 521 4.216 1.627 -6.836
84 HA LEU 521 HA LEU 521 5.868 -0.371 -5.385
85 1HB LEU 521 2HB LEU 521 3.469 -0.373 -4.462
86 2HB LEU 521 1HB LEU 521 2.951 -0.903 -6.056
87 HG LEU 521 HG LEU 521 3.186 -2.929 -4.917
88 1HD1 LEU 521 3HD1 LEU 521 4.530 -2.931 -7.000
89 2HD1 LEU 521 2HD1 LEU 521 5.941 -2.443 -6.075
90 3HD1 LEU 521 1HD1 LEU 521 5.209 -4.017 -5.784
91 1HD2 LEU 521 1HD2 LEU 521 4.704 -1.423 -3.133
92 2HD2 LEU 521 3HD2 LEU 521 4.337 -3.145 -2.977
93 3HD2 LEU 521 2HD2 LEU 521 5.844 -2.625 -3.738
94 H THR 522 H THR 522 7.160 -0.302 -7.285
95 HA THR 522 HA THR 522 5.920 -0.687 -9.862
96 HB THR 522 HB THR 522 8.816 -1.027 -9.045
97 HG1 THR 522 HG1 THR 522 7.684 1.116 -10.474
98 1HG2 THR 522 3HG2 THR 522 7.388 -1.478 -11.555
99 2HG2 THR 522 2HG2 THR 522 8.701 -0.313 -11.724
100 3HG2 THR 522 1HG2 THR 522 9.031 -1.930 -11.103
101 H ALA 523 H ALA 523 4.894 -2.518 -10.381
102 HA ALA 523 HA ALA 523 6.373 -5.054 -10.047
103 1HB ALA 523 1HB ALA 523 4.737 -4.584 -8.063
104 2HB ALA 523 3HB ALA 523 3.490 -4.961 -9.234
105 3HB ALA 523 2HB ALA 523 4.707 -6.165 -8.835
106 H THR 524 H THR 524 3.607 -6.194 -10.754
107 HA THR 524 HA THR 524 2.609 -5.237 -13.188
108 HB THR 524 HB THR 524 4.624 -5.275 -14.368
109 HG1 THR 524 HG1 THR 524 4.658 -7.248 -15.537
110 1HG2 THR 524 3HG2 THR 524 5.299 -6.967 -12.153
111 2HG2 THR 524 2HG2 THR 524 5.927 -7.670 -13.656
112 3HG2 THR 524 1HG2 THR 524 6.370 -6.025 -13.190
113 H THR 525 H THR 525 0.767 -6.427 -13.138
114 HA THR 525 HA THR 525 1.045 -9.358 -13.329
115 HB THR 525 HB THR 525 1.231 -8.668 -10.807
116 HG1 THR 525 HG1 THR 525 0.984 -10.792 -11.582
117 1HG2 THR 525 2HG2 THR 525 -1.076 -7.361 -11.250
118 2HG2 THR 525 1HG2 THR 525 -1.734 -8.932 -10.791
119 3HG2 THR 525 3HG2 THR 525 -0.675 -8.061 -9.682
120 H THR 526 H THR 526 -1.518 -10.107 -12.508
121 HA THR 526 HA THR 526 -3.135 -9.596 -14.746
122 HB THR 526 HB THR 526 -3.972 -11.312 -13.366
123 HG1 THR 526 HG1 THR 526 -5.771 -10.253 -13.881
124 1HG2 THR 526 1HG2 THR 526 -3.532 -9.347 -11.114
125 2HG2 THR 526 3HG2 THR 526 -4.457 -10.833 -10.904
126 3HG2 THR 526 2HG2 THR 526 -2.754 -10.911 -11.356
127 H TYR 527 H TYR 527 -3.232 -7.766 -15.513
128 HA TYR 527 HA TYR 527 -3.546 -5.367 -14.034
129 1HB TYR 527 2HB TYR 527 -2.818 -5.902 -16.556
130 2HB TYR 527 1HB TYR 527 -4.534 -5.618 -16.858
131 HD1 TYR 527 HD2 TYR 527 -4.717 -3.801 -14.394
132 HD2 TYR 527 HD1 TYR 527 -2.144 -3.768 -17.776
133 HE1 TYR 527 HE2 TYR 527 -4.558 -1.355 -14.240
134 HE2 TYR 527 HE1 TYR 527 -1.952 -1.323 -17.568
135 HH TYR 527 HH TYR 527 -4.084 0.520 -15.796
136 H GLY 528 H GLY 528 -5.183 -5.778 -12.560
137 1HA GLY 528 2HA GLY 528 -7.831 -5.076 -13.061
138 2HA GLY 528 1HA GLY 528 -7.785 -6.829 -13.238
139 H GLU 529 H GLU 529 -5.530 -6.928 -11.183
140 HA GLU 529 HA GLU 529 -7.226 -7.084 -8.776
141 1HB GLU 529 2HB GLU 529 -5.280 -8.203 -7.793
142 2HB GLU 529 1HB GLU 529 -5.612 -8.896 -9.384
143 1HG GLU 529 2HG GLU 529 -3.854 -7.643 -10.402
144 2HG GLU 529 1HG GLU 529 -3.663 -6.633 -8.970
145 H ASN 530 H ASN 530 -5.127 -6.512 -6.811
146 HA ASN 530 HA ASN 530 -4.326 -3.712 -7.463
147 1HB ASN 530 2HB ASN 530 -6.713 -4.015 -6.276
148 2HB ASN 530 1HB ASN 530 -5.689 -4.072 -4.842
149 1HD2 ASN 530 2HD2 ASN 530 -4.634 -0.654 -5.174
150 2HD2 ASN 530 1HD2 ASN 530 -4.145 -2.162 -4.562
151 H ILE 531 H ILE 531 -2.456 -3.054 -6.390
152 HA ILE 531 HA ILE 531 -1.261 -5.078 -4.519
153 HB ILE 531 HB ILE 531 -0.048 -4.306 -6.703
154 1HG1 ILE 531 2HG1 ILE 531 1.668 -3.909 -4.321
155 2HG1 ILE 531 1HG1 ILE 531 0.956 -5.484 -4.625
156 1HG2 ILE 531 1HG2 ILE 531 -0.412 -1.880 -6.322
157 2HG2 ILE 531 3HG2 ILE 531 0.602 -1.982 -4.892
158 3HG2 ILE 531 2HG2 ILE 531 1.298 -2.290 -6.475
159 1HD1 ILE 531 2HD1 ILE 531 2.290 -4.068 -6.913
160 2HD1 ILE 531 1HD1 ILE 531 3.315 -4.815 -5.653
161 3HD1 ILE 531 3HD1 ILE 531 2.151 -5.802 -6.552
162 H TYR 532 H TYR 532 -1.740 -4.496 -2.475
163 HA TYR 532 HA TYR 532 -2.331 -1.691 -1.850
164 1HB TYR 532 2HB TYR 532 -2.957 -4.326 -0.827
165 2HB TYR 532 1HB TYR 532 -2.755 -3.095 0.418
166 HD1 TYR 532 HD2 TYR 532 -4.421 -3.832 -2.812
167 HD2 TYR 532 HD1 TYR 532 -4.312 -1.438 0.790
168 HE1 TYR 532 HE2 TYR 532 -6.767 -3.072 -3.243
169 HE2 TYR 532 HE1 TYR 532 -6.662 -0.673 0.339
170 HH TYR 532 HH TYR 532 -8.266 -1.335 -2.679
171 H LEU 533 H LEU 533 -2.115 -1.345 0.659
172 HA LEU 533 HA LEU 533 0.610 -1.890 1.555
173 1HB LEU 533 2HB LEU 533 -0.055 0.514 0.324
174 2HB LEU 533 1HB LEU 533 -0.059 0.884 2.049
175 HG LEU 533 HG LEU 533 2.198 -0.797 1.318
176 1HD1 LEU 533 1HD1 LEU 533 1.847 0.437 -0.843
177 2HD1 LEU 533 3HD1 LEU 533 2.039 1.950 0.043
178 3HD1 LEU 533 2HD1 LEU 533 3.385 0.815 -0.062
179 1HD2 LEU 533 1HD2 LEU 533 1.490 1.466 3.006
180 2HD2 LEU 533 3HD2 LEU 533 2.795 0.295 3.208
181 3HD2 LEU 533 2HD2 LEU 533 3.043 1.730 2.211
182 H VAL 534 H VAL 534 -0.481 -3.175 3.158
183 HA VAL 534 HA VAL 534 -2.252 -1.800 5.070
184 HB VAL 534 HB VAL 534 -2.307 -4.277 4.108
185 1HG1 VAL 534 3HG1 VAL 534 -0.850 -4.659 6.662
186 2HG1 VAL 534 2HG1 VAL 534 -1.660 -5.899 5.724
187 3HG1 VAL 534 1HG1 VAL 534 -0.240 -5.074 5.055
188 1HG2 VAL 534 1HG2 VAL 534 -3.406 -3.173 6.503
189 2HG2 VAL 534 3HG2 VAL 534 -4.119 -4.263 5.341
190 3HG2 VAL 534 2HG2 VAL 534 -3.131 -4.930 6.638
191 H GLY 535 H GLY 535 -1.062 -0.375 6.245
192 1HA GLY 535 2HA GLY 535 1.446 -1.260 7.653
193 2HA GLY 535 1HA GLY 535 1.015 0.434 7.366
194 H SER 536 H SER 536 1.462 -0.889 10.085
195 HA SER 536 HA SER 536 -1.107 -1.538 11.309
196 1HB SER 536 2HB SER 536 0.991 -2.293 12.306
197 2HB SER 536 1HB SER 536 1.458 -0.643 12.658
198 HG SER 536 HG SER 536 0.404 -0.981 14.440
199 H ILE 537 H ILE 537 -2.432 0.172 10.712
200 HA ILE 537 HA ILE 537 -2.441 2.299 12.596
201 HB ILE 537 HB ILE 537 -3.037 3.176 9.873
202 1HG1 ILE 537 2HG1 ILE 537 -0.224 2.572 10.825
203 2HG1 ILE 537 1HG1 ILE 537 -1.048 1.790 9.487
204 1HG2 ILE 537 3HG2 ILE 537 -2.360 4.299 12.422
205 2HG2 ILE 537 2HG2 ILE 537 -1.166 4.827 11.240
206 3HG2 ILE 537 1HG2 ILE 537 -2.877 5.144 10.963
207 1HD1 ILE 537 1HD1 ILE 537 -0.447 4.749 9.578
208 2HD1 ILE 537 3HD1 ILE 537 0.590 3.567 8.789
209 3HD1 ILE 537 2HD1 ILE 537 -1.044 3.827 8.196
210 H SER 538 H SER 538 -4.534 3.187 12.901
211 HA SER 538 HA SER 538 -6.545 1.140 12.433
212 1HB SER 538 2HB SER 538 -6.501 2.853 14.370
213 2HB SER 538 1HB SER 538 -7.189 3.999 13.222
214 HG SER 538 HG SER 538 -8.980 3.096 13.925
215 H GLN 539 H GLN 539 -5.799 4.166 10.800
216 HA GLN 539 HA GLN 539 -8.113 3.894 8.998
217 1HB GLN 539 2HB GLN 539 -6.749 6.093 9.742
218 2HB GLN 539 1HB GLN 539 -5.784 5.654 8.333
219 1HG GLN 539 2HG GLN 539 -8.787 5.737 8.148
220 2HG GLN 539 1HG GLN 539 -7.844 7.219 7.994
221 1HE2 GLN 539 2HE2 GLN 539 -6.354 6.237 4.871
222 2HE2 GLN 539 1HE2 GLN 539 -6.086 7.175 6.260
223 H LEU 540 H LEU 540 -4.853 2.981 9.379
224 HA LEU 540 HA LEU 540 -4.788 1.664 6.736
225 1HB LEU 540 2HB LEU 540 -3.084 3.547 7.232
226 2HB LEU 540 1HB LEU 540 -2.400 2.412 8.377
227 HG LEU 540 HG LEU 540 -2.505 0.809 6.232
228 1HD1 LEU 540 3HD1 LEU 540 -2.326 3.657 5.225
229 2HD1 LEU 540 2HD1 LEU 540 -1.689 2.290 4.304
230 3HD1 LEU 540 1HD1 LEU 540 -3.410 2.377 4.680
231 1HD2 LEU 540 1HD2 LEU 540 -0.526 1.440 7.665
232 2HD2 LEU 540 3HD2 LEU 540 -0.128 1.311 5.948
233 3HD2 LEU 540 2HD2 LEU 540 -0.346 2.897 6.686
234 H GLY 541 H GLY 541 -6.148 0.255 8.328
235 1HA GLY 541 2HA GLY 541 -5.640 -0.992 10.596
236 2HA GLY 541 1HA GLY 541 -6.143 -1.959 9.225
237 H ASP 542 H ASP 542 -4.050 -2.095 7.715
238 HA ASP 542 HA ASP 542 -1.824 -3.036 7.413
239 1HB ASP 542 2HB ASP 542 -1.302 -1.909 9.701
240 2HB ASP 542 1HB ASP 542 -1.548 -3.483 10.300
241 H TRP 543 H TRP 543 -4.040 -4.220 9.669
242 HA TRP 543 HA TRP 543 -3.121 -6.957 9.147
243 1HB TRP 543 2HB TRP 543 -4.357 -5.945 11.695
244 2HB TRP 543 1HB TRP 543 -3.334 -7.361 11.442
245 HD1 TRP 543 HD1 TRP 543 -2.951 -3.892 12.779
246 HE1 TRP 543 HE1 TRP 543 -0.532 -3.193 12.789
247 HE3 TRP 543 HE3 TRP 543 -0.990 -7.253 9.435
248 HZ2 TRP 543 HZ2 TRP 543 1.930 -3.810 11.496
249 HZ3 TRP 543 HZ3 TRP 543 1.416 -7.152 8.855
250 HH2 TRP 543 HH2 TRP 543 2.875 -5.422 9.869
251 H GLU 544 H GLU 544 -4.864 -5.509 7.680
252 HA GLU 544 HA GLU 544 -7.025 -7.201 7.173
253 1HB GLU 544 2HB GLU 544 -7.913 -6.135 9.337
254 2HB GLU 544 1HB GLU 544 -7.912 -4.607 8.460
255 1HG GLU 544 2HG GLU 544 -9.366 -5.628 6.724
256 2HG GLU 544 1HG GLU 544 -9.441 -7.104 7.688
257 H THR 545 H THR 545 -6.219 -6.799 5.080
258 HA THR 545 HA THR 545 -5.379 -4.300 4.133
259 HB THR 545 HB THR 545 -5.982 -5.165 1.820
260 HG1 THR 545 HG1 THR 545 -6.862 -7.265 1.741
261 1HG2 THR 545 1HG2 THR 545 -4.027 -6.057 3.523
262 2HG2 THR 545 3HG2 THR 545 -4.803 -7.560 3.030
263 3HG2 THR 545 2HG2 THR 545 -4.138 -6.478 1.812
264 H SER 546 H SER 546 -8.564 -5.320 4.987
265 HA SER 546 HA SER 546 -10.261 -4.046 3.172
266 1HB SER 546 2HB SER 546 -11.101 -5.375 5.052
267 2HB SER 546 1HB SER 546 -10.522 -4.163 6.191
268 HG SER 546 HG SER 546 -12.811 -4.055 5.530
269 H ASP 547 H ASP 547 -8.013 -2.594 5.350
270 HA ASP 547 HA ASP 547 -8.880 0.065 4.392
271 1HB ASP 547 2HB ASP 547 -8.796 -0.853 7.251
272 2HB ASP 547 1HB ASP 547 -8.445 0.832 6.865
273 H GLY 548 H GLY 548 -6.516 -1.563 3.736
274 1HA GLY 548 2HA GLY 548 -4.304 -0.321 5.212
275 2HA GLY 548 1HA GLY 548 -4.153 -1.473 3.876
276 H ILE 549 H ILE 549 -3.353 -0.550 2.059
277 HA ILE 549 HA ILE 549 -4.523 1.934 1.141
278 HB ILE 549 HB ILE 549 -1.912 1.939 2.480
279 1HG1 ILE 549 2HG1 ILE 549 -3.851 4.090 1.586
280 2HG1 ILE 549 1HG1 ILE 549 -3.785 3.345 3.179
281 1HG2 ILE 549 1HG2 ILE 549 -2.178 3.183 -0.263
282 2HG2 ILE 549 3HG2 ILE 549 -1.026 3.776 0.943
283 3HG2 ILE 549 2HG2 ILE 549 -0.898 2.125 0.325
284 1HD1 ILE 549 3HD1 ILE 549 -1.272 4.146 3.115
285 2HD1 ILE 549 2HD1 ILE 549 -1.887 5.290 1.923
286 3HD1 ILE 549 1HD1 ILE 549 -2.551 5.276 3.557
287 H ALA 550 H ALA 550 -5.202 0.930 -0.607
288 HA ALA 550 HA ALA 550 -3.853 -0.866 -2.308
289 1HB ALA 550 3HB ALA 550 -6.349 0.279 -2.189
290 2HB ALA 550 2HB ALA 550 -5.691 0.907 -3.698
291 3HB ALA 550 1HB ALA 550 -5.780 -0.832 -3.434
292 H LEU 551 H LEU 551 -3.029 -0.594 -4.423
293 HA LEU 551 HA LEU 551 -2.115 2.151 -5.164
294 1HB LEU 551 2HB LEU 551 -0.419 -0.366 -5.166
295 2HB LEU 551 1HB LEU 551 0.078 1.157 -5.881
296 HG LEU 551 HG LEU 551 -0.491 2.112 -3.487
297 1HD1 LEU 551 3HD1 LEU 551 -1.385 -0.114 -2.710
298 2HD1 LEU 551 2HD1 LEU 551 0.258 -0.741 -2.821
299 3HD1 LEU 551 1HD1 LEU 551 -0.119 0.557 -1.687
300 1HD2 LEU 551 3HD2 LEU 551 1.766 1.832 -4.743
301 2HD2 LEU 551 2HD2 LEU 551 1.817 2.014 -2.989
302 3HD2 LEU 551 1HD2 LEU 551 1.987 0.418 -3.714
303 H SER 552 H SER 552 -2.442 2.595 -7.384
304 HA SER 552 HA SER 552 -3.227 0.234 -9.043
305 1HB SER 552 2HB SER 552 -4.853 2.349 -8.581
306 2HB SER 552 1HB SER 552 -4.001 2.885 -10.032
307 HG SER 552 HG SER 552 -5.770 0.782 -9.684
308 H ALA 553 H ALA 553 -2.891 0.962 -11.667
309 HA ALA 553 HA ALA 553 -0.033 1.622 -11.616
310 1HB ALA 553 3HB ALA 553 -1.748 0.481 -13.799
311 2HB ALA 553 2HB ALA 553 -0.128 1.055 -14.092
312 3HB ALA 553 1HB ALA 553 -0.385 -0.270 -12.975
313 H ASP 554 H ASP 554 0.852 3.364 -12.225
314 HA ASP 554 HA ASP 554 -0.169 5.874 -12.590
315 1HB ASP 554 2HB ASP 554 1.898 6.420 -13.868
316 2HB ASP 554 1HB ASP 554 2.198 5.534 -12.376
317 H LYS 555 H LYS 555 -2.159 5.630 -13.832
318 HA LYS 555 HA LYS 555 -3.353 6.060 -15.787
319 1HB LYS 555 2HB LYS 555 -0.686 6.613 -17.079
320 2HB LYS 555 1HB LYS 555 -2.249 7.356 -17.432
321 1HG LYS 555 2HG LYS 555 -1.807 8.965 -15.915
322 2HG LYS 555 1HG LYS 555 -1.747 7.734 -14.651
323 1HD LYS 555 2HD LYS 555 0.691 7.424 -15.914
324 2HD LYS 555 1HD LYS 555 0.450 9.171 -15.952
325 1HE LYS 555 2HE LYS 555 0.025 7.537 -13.440
326 2HE LYS 555 1HE LYS 555 1.587 8.250 -13.853
327 1HZ LYS 555 3HZ LYS 555 -0.676 10.042 -14.050
328 2HZ LYS 555 2HZ LYS 555 -0.318 9.515 -12.475
329 3HZ LYS 555 1HZ LYS 555 0.867 10.308 -13.398
330 H TYR 556 H TYR 556 -1.377 3.441 -15.471
331 HA TYR 556 HA TYR 556 -1.112 2.338 -18.068
332 1HB TYR 556 2HB TYR 556 -1.459 1.185 -15.340
333 2HB TYR 556 1HB TYR 556 -1.340 0.112 -16.695
334 HD1 TYR 556 HD2 TYR 556 0.459 2.819 -17.629
335 HD2 TYR 556 HD1 TYR 556 0.843 -0.507 -14.786
336 HE1 TYR 556 HE2 TYR 556 2.891 3.050 -17.668
337 HE2 TYR 556 HE1 TYR 556 3.260 -0.262 -14.961
338 HH TYR 556 HH TYR 556 4.812 2.498 -16.205
339 H THR 557 H THR 557 -2.445 0.014 -18.117
340 HA THR 557 HA THR 557 -5.051 0.717 -19.135
341 HB THR 557 HB THR 557 -3.831 -2.013 -18.854
342 HG1 THR 557 HG1 THR 557 -3.606 0.034 -20.785
343 1HG2 THR 557 3HG2 THR 557 -6.377 -1.118 -19.751
344 2HG2 THR 557 2HG2 THR 557 -5.456 -1.589 -21.180
345 3HG2 THR 557 1HG2 THR 557 -5.699 -2.743 -19.868
346 H SER 558 H SER 558 -5.390 -2.372 -17.882
347 HA SER 558 HA SER 558 -7.856 -1.949 -16.716
348 1HB SER 558 2HB SER 558 -5.878 -4.183 -16.332
349 2HB SER 558 1HB SER 558 -7.506 -4.224 -15.660
350 HG SER 558 HG SER 558 -8.098 -4.846 -17.568
351 H SER 559 H SER 559 -6.196 -3.696 -14.255
352 HA SER 559 HA SER 559 -7.011 -1.517 -12.416
353 1HB SER 559 2HB SER 559 -5.988 -4.281 -11.891
354 2HB SER 559 1HB SER 559 -6.188 -3.097 -10.616
355 HG SER 559 HG SER 559 -8.338 -2.986 -11.042
356 H ASP 560 H ASP 560 -3.777 -3.280 -12.708
357 HA ASP 560 HA ASP 560 -2.418 -0.746 -12.674
358 1HB ASP 560 2HB ASP 560 -1.660 -0.839 -10.263
359 2HB ASP 560 1HB ASP 560 -3.317 -0.360 -10.587
360 HA PRO 561 HA PRO 561 0.625 -4.384 -12.803
361 1HB PRO 561 2HB PRO 561 1.976 -3.665 -15.082
362 2HB PRO 561 1HB PRO 561 0.593 -4.771 -15.022
363 1HG PRO 561 2HG PRO 561 0.697 -1.939 -15.918
364 2HG PRO 561 1HG PRO 561 -0.398 -3.232 -16.415
365 1HD PRO 561 2HD PRO 561 -1.083 -1.172 -14.644
366 2HD PRO 561 1HD PRO 561 -1.933 -2.711 -14.815
367 H LEU 562 H LEU 562 1.357 -0.889 -13.072
368 HA LEU 562 HA LEU 562 3.970 -1.595 -11.785
369 1HB LEU 562 2HB LEU 562 5.019 0.422 -12.392
370 2HB LEU 562 1HB LEU 562 4.330 -0.236 -13.852
371 HG LEU 562 HG LEU 562 3.529 1.840 -14.144
372 1HD1 LEU 562 2HD1 LEU 562 1.529 0.457 -13.210
373 2HD1 LEU 562 1HD1 LEU 562 1.666 1.538 -11.841
374 3HD1 LEU 562 3HD1 LEU 562 1.350 2.169 -13.448
375 1HD2 LEU 562 2HD2 LEU 562 4.261 2.131 -11.273
376 2HD2 LEU 562 1HD2 LEU 562 4.733 3.122 -12.654
377 3HD2 LEU 562 3HD2 LEU 562 3.128 3.317 -11.936
378 H TRP 563 H TRP 563 0.955 -0.612 -11.160
379 HA TRP 563 HA TRP 563 -0.065 0.392 -9.329
380 1HB TRP 563 2HB TRP 563 2.205 -0.655 -7.746
381 2HB TRP 563 1HB TRP 563 0.477 -0.791 -7.478
382 HD1 TRP 563 HD1 TRP 563 3.092 -2.151 -10.041
383 HE1 TRP 563 HE1 TRP 563 2.477 -4.543 -10.709
384 HE3 TRP 563 HE3 TRP 563 -1.392 -2.472 -7.684
385 HZ2 TRP 563 HZ2 TRP 563 0.281 -6.318 -10.307
386 HZ3 TRP 563 HZ3 TRP 563 -2.731 -4.535 -7.906
387 HH2 TRP 563 HH2 TRP 563 -1.903 -6.443 -9.201
388 H TYR 564 H TYR 564 -0.156 2.163 -7.778
389 HA TYR 564 HA TYR 564 2.264 3.617 -7.000
390 1HB TYR 564 2HB TYR 564 1.480 5.790 -8.043
391 2HB TYR 564 1HB TYR 564 1.998 4.597 -9.231
392 HD1 TYR 564 HD1 TYR 564 -1.042 3.770 -7.613
393 HD2 TYR 564 HD2 TYR 564 0.512 6.016 -10.878
394 HE1 TYR 564 HE1 TYR 564 -3.236 3.818 -8.529
395 HE2 TYR 564 HE2 TYR 564 -1.783 6.106 -11.856
396 HH TYR 564 HH TYR 564 -4.579 4.989 -10.080
397 H VAL 565 H VAL 565 0.889 6.015 -6.065
398 HA VAL 565 HA VAL 565 -1.699 5.652 -5.121
399 HB VAL 565 HB VAL 565 -1.292 3.662 -3.980
400 1HG1 VAL 565 2HG1 VAL 565 1.255 4.935 -2.974
401 2HG1 VAL 565 1HG1 VAL 565 0.663 3.359 -2.468
402 3HG1 VAL 565 3HG1 VAL 565 1.133 3.631 -4.143
403 1HG2 VAL 565 1HG2 VAL 565 -0.987 5.908 -1.972
404 2HG2 VAL 565 3HG2 VAL 565 -2.484 5.146 -2.503
405 3HG2 VAL 565 2HG2 VAL 565 -1.324 4.236 -1.540
406 H THR 566 H THR 566 -2.379 6.946 -3.405
407 HA THR 566 HA THR 566 -0.608 8.794 -2.017
408 HB THR 566 HB THR 566 -2.468 9.823 -4.192
409 HG1 THR 566 HG1 THR 566 -0.627 10.515 -5.133
410 1HG2 THR 566 1HG2 THR 566 -1.710 10.991 -1.685
411 2HG2 THR 566 3HG2 THR 566 -0.921 11.888 -2.984
412 3HG2 THR 566 2HG2 THR 566 -2.675 11.704 -2.978
413 H VAL 567 H VAL 567 -1.856 7.445 -0.426
414 HA VAL 567 HA VAL 567 -4.730 8.210 -0.216
415 HB VAL 567 HB VAL 567 -3.490 6.203 1.616
416 1HG1 VAL 567 2HG1 VAL 567 -6.090 7.055 0.852
417 2HG1 VAL 567 1HG1 VAL 567 -5.895 5.410 0.247
418 3HG1 VAL 567 3HG1 VAL 567 -5.669 5.750 1.962
419 1HG2 VAL 567 1HG2 VAL 567 -3.684 5.974 -1.358
420 2HG2 VAL 567 3HG2 VAL 567 -2.511 5.257 -0.253
421 3HG2 VAL 567 2HG2 VAL 567 -4.127 4.564 -0.396
422 H THR 568 H THR 568 -5.017 7.709 2.568
423 HA THR 568 HA THR 568 -3.368 9.884 3.766
424 HB THR 568 HB THR 568 -5.625 10.274 5.107
425 HG1 THR 568 HG1 THR 568 -7.370 9.976 3.608
426 1HG2 THR 568 3HG2 THR 568 -4.481 11.363 2.645
427 2HG2 THR 568 2HG2 THR 568 -6.217 11.645 2.772
428 3HG2 THR 568 1HG2 THR 568 -5.136 12.208 4.047
429 H LEU 569 H LEU 569 -3.518 9.846 6.195
430 HA LEU 569 HA LEU 569 -4.230 7.332 7.502
431 1HB LEU 569 2HB LEU 569 -2.015 6.851 6.382
432 2HB LEU 569 1HB LEU 569 -1.302 8.143 7.343
433 HG LEU 569 HG LEU 569 -0.960 5.842 8.259
434 1HD1 LEU 569 1HD1 LEU 569 -0.993 7.998 9.628
435 2HD1 LEU 569 3HD1 LEU 569 -2.616 7.523 10.136
436 3HD1 LEU 569 2HD1 LEU 569 -1.238 6.500 10.527
437 1HD2 LEU 569 3HD2 LEU 569 -3.600 5.415 7.676
438 2HD2 LEU 569 2HD2 LEU 569 -2.682 4.427 8.815
439 3HD2 LEU 569 1HD2 LEU 569 -3.688 5.751 9.403
440 HA PRO 570 HA PRO 570 -4.332 11.150 10.042
441 1HB PRO 570 2HB PRO 570 -6.929 10.813 10.858
442 2HB PRO 570 1HB PRO 570 -6.474 11.642 9.360
443 1HG PRO 570 2HG PRO 570 -7.656 8.932 9.716
444 2HG PRO 570 1HG PRO 570 -7.732 10.013 8.315
445 1HD PRO 570 2HD PRO 570 -6.033 7.752 8.603
446 2HD PRO 570 1HD PRO 570 -5.938 8.986 7.331
447 H ALA 571 H ALA 571 -3.014 10.434 11.751
448 HA ALA 571 HA ALA 571 -4.405 9.306 14.044
449 1HB ALA 571 3HB ALA 571 -2.433 7.646 12.484
450 2HB ALA 571 2HB ALA 571 -2.683 7.382 14.211
451 3HB ALA 571 1HB ALA 571 -4.026 7.188 13.086
452 H GLY 572 H GLY 572 -0.977 9.334 12.952
453 1HA GLY 572 2HA GLY 572 0.691 10.909 13.691
454 2HA GLY 572 1HA GLY 572 -0.411 11.446 14.956
455 H GLU 573 H GLU 573 1.245 8.403 14.010
456 HA GLU 573 HA GLU 573 2.547 8.210 16.602
457 1HB GLU 573 2HB GLU 573 -0.057 7.276 16.561
458 2HB GLU 573 1HB GLU 573 0.887 5.815 16.269
459 1HG GLU 573 2HG GLU 573 2.077 6.030 18.292
460 2HG GLU 573 1HG GLU 573 1.654 7.734 18.462
461 H SER 574 H SER 574 3.222 5.578 16.707
462 HA SER 574 HA SER 574 4.895 5.217 14.297
463 1HB SER 574 2HB SER 574 5.432 4.631 16.844
464 2HB SER 574 1HB SER 574 4.616 3.124 16.437
465 HG SER 574 HG SER 574 6.859 3.019 16.014
466 H PHE 575 H PHE 575 3.870 4.598 12.614
467 HA PHE 575 HA PHE 575 1.703 2.551 12.762
468 1HB PHE 575 2HB PHE 575 2.658 4.423 10.582
469 2HB PHE 575 1HB PHE 575 1.252 3.377 10.493
470 HD1 PHE 575 HD2 PHE 575 0.307 3.612 13.345
471 HD2 PHE 575 HD1 PHE 575 1.655 6.584 10.554
472 HE1 PHE 575 HE2 PHE 575 -0.960 5.340 14.580
473 HE2 PHE 575 HE1 PHE 575 0.389 8.317 11.800
474 HZ PHE 575 HZ PHE 575 -0.905 7.692 13.814
475 H GLU 576 H GLU 576 2.152 0.523 11.952
476 HA GLU 576 HA GLU 576 4.854 -0.106 11.031
477 1HB GLU 576 2HB GLU 576 2.393 -1.833 11.265
478 2HB GLU 576 1HB GLU 576 3.924 -2.416 10.650
479 1HG GLU 576 2HG GLU 576 3.495 -2.825 13.135
480 2HG GLU 576 1HG GLU 576 5.025 -2.052 12.726
481 H TYR 577 H TYR 577 5.084 -1.268 8.839
482 HA TYR 577 HA TYR 577 3.010 -0.329 6.974
483 1HB TYR 577 2HB TYR 577 5.757 0.746 7.164
484 2HB TYR 577 1HB TYR 577 5.136 0.452 5.534
485 HD1 TYR 577 HD2 TYR 577 4.447 2.277 8.763
486 HD2 TYR 577 HD1 TYR 577 3.344 1.712 4.624
487 HE1 TYR 577 HE2 TYR 577 2.961 4.244 8.856
488 HE2 TYR 577 HE1 TYR 577 1.858 3.686 4.760
489 HH TYR 577 HH TYR 577 2.042 5.972 7.014
490 H LYS 578 H LYS 578 2.801 -2.736 7.200
491 HA LYS 578 HA LYS 578 4.726 -4.341 5.672
492 1HB LYS 578 2HB LYS 578 2.553 -4.852 7.486
493 2HB LYS 578 1HB LYS 578 2.217 -5.680 5.966
494 1HG LYS 578 2HG LYS 578 3.581 -7.022 7.631
495 2HG LYS 578 1HG LYS 578 4.319 -6.842 6.038
496 1HD LYS 578 2HD LYS 578 6.118 -5.872 6.971
497 2HD LYS 578 1HD LYS 578 5.092 -4.598 7.634
498 1HE LYS 578 2HE LYS 578 5.394 -5.426 9.702
499 2HE LYS 578 1HE LYS 578 4.681 -6.957 9.193
500 1HZ LYS 578 2HZ LYS 578 7.295 -6.746 8.167
501 2HZ LYS 578 1HZ LYS 578 7.334 -6.451 9.840
502 3HZ LYS 578 3HZ LYS 578 6.669 -7.895 9.249
503 H PHE 579 H PHE 579 4.649 -4.397 3.458
504 HA PHE 579 HA PHE 579 2.279 -3.172 2.151
505 1HB PHE 579 2HB PHE 579 4.621 -2.551 1.469
506 2HB PHE 579 1HB PHE 579 4.846 -4.209 0.904
507 HD1 PHE 579 HD1 PHE 579 2.850 -5.115 -0.590
508 HD2 PHE 579 HD2 PHE 579 3.874 -0.982 -0.099
509 HE1 PHE 579 HE1 PHE 579 1.693 -4.603 -2.669
510 HE2 PHE 579 HE2 PHE 579 2.702 -0.464 -2.229
511 HZ PHE 579 HZ PHE 579 1.611 -2.308 -3.477
512 H ILE 580 H ILE 580 0.954 -4.203 0.801
513 HA ILE 580 HA ILE 580 1.308 -7.123 0.604
514 HB ILE 580 HB ILE 580 -1.003 -7.461 1.151
515 1HG1 ILE 580 2HG1 ILE 580 -1.073 -4.603 0.409
516 2HG1 ILE 580 1HG1 ILE 580 -2.271 -5.889 0.125
517 1HG2 ILE 580 2HG2 ILE 580 0.228 -5.352 2.953
518 2HG2 ILE 580 1HG2 ILE 580 -1.204 -6.291 3.386
519 3HG2 ILE 580 3HG2 ILE 580 0.350 -7.099 3.146
520 1HD1 ILE 580 2HD1 ILE 580 -2.459 -5.590 2.816
521 2HD1 ILE 580 1HD1 ILE 580 -2.062 -3.943 2.328
522 3HD1 ILE 580 3HD1 ILE 580 -3.482 -4.743 1.659
523 H ARG 581 H ARG 581 0.607 -8.089 -1.286
524 HA ARG 581 HA ARG 581 -0.136 -6.164 -3.435
525 1HB ARG 581 2HB ARG 581 1.941 -7.218 -4.017
526 2HB ARG 581 1HB ARG 581 1.347 -8.803 -3.523
527 1HG ARG 581 2HG ARG 581 -0.101 -8.971 -5.384
528 2HG ARG 581 1HG ARG 581 -0.008 -7.242 -5.721
529 1HD ARG 581 2HD ARG 581 1.377 -8.291 -7.358
530 2HD ARG 581 1HD ARG 581 2.482 -7.605 -6.167
531 HE ARG 581 HE ARG 581 3.233 -9.804 -5.840
532 1HH1 ARG 581 1HH2 ARG 581 0.207 -9.879 -7.403
533 2HH1 ARG 581 2HH2 ARG 581 -0.132 -11.529 -6.998
534 1HH2 ARG 581 2HH1 ARG 581 2.673 -11.891 -4.993
535 2HH2 ARG 581 1HH1 ARG 581 1.265 -12.668 -5.633
536 H ILE 582 H ILE 582 -2.325 -6.219 -3.499
537 HA ILE 582 HA ILE 582 -3.761 -8.694 -2.934
538 HB ILE 582 HB ILE 582 -4.486 -5.956 -3.011
539 1HG1 ILE 582 2HG1 ILE 582 -5.060 -7.617 -1.307
540 2HG1 ILE 582 1HG1 ILE 582 -6.536 -6.890 -1.956
541 1HG2 ILE 582 1HG2 ILE 582 -5.909 -7.619 -5.089
542 2HG2 ILE 582 3HG2 ILE 582 -6.826 -6.462 -4.134
543 3HG2 ILE 582 2HG2 ILE 582 -5.495 -5.911 -5.133
544 1HD1 ILE 582 3HD1 ILE 582 -6.208 -8.889 -3.733
545 2HD1 ILE 582 2HD1 ILE 582 -5.474 -9.644 -2.303
546 3HD1 ILE 582 1HD1 ILE 582 -7.148 -9.084 -2.243
547 H GLU 583 H GLU 583 -4.884 -10.024 -4.345
548 HA GLU 583 HA GLU 583 -3.959 -9.852 -7.169
549 1HB GLU 583 2HB GLU 583 -3.468 -11.871 -5.547
550 2HB GLU 583 1HB GLU 583 -5.109 -12.345 -5.988
551 1HG GLU 583 2HG GLU 583 -4.560 -12.473 -8.303
552 2HG GLU 583 1HG GLU 583 -3.030 -11.630 -8.061
553 H SER 584 H SER 584 -5.497 -10.913 -8.747
554 HA SER 584 HA SER 584 -8.182 -9.753 -8.343
555 1HB SER 584 2HB SER 584 -7.157 -9.222 -10.457
556 2HB SER 584 1HB SER 584 -6.757 -10.911 -10.755
557 HG SER 584 HG SER 584 -8.605 -10.495 -11.884
558 H ASP 585 H ASP 585 -6.628 -12.882 -8.408
559 HA ASP 585 HA ASP 585 -9.287 -14.192 -8.494
560 1HB ASP 585 2HB ASP 585 -7.411 -16.169 -8.674
561 2HB ASP 585 1HB ASP 585 -8.225 -15.448 -10.051
562 H ASP 586 H ASP 586 -6.164 -15.217 -7.099
563 HA ASP 586 HA ASP 586 -7.374 -16.542 -4.891
564 1HB ASP 586 2HB ASP 586 -5.115 -17.104 -5.545
565 2HB ASP 586 1HB ASP 586 -4.569 -15.453 -5.249
566 H SER 587 H SER 587 -5.026 -14.170 -3.908
567 HA SER 587 HA SER 587 -6.933 -12.215 -2.949
568 1HB SER 587 2HB SER 587 -5.592 -13.748 -0.740
569 2HB SER 587 1HB SER 587 -6.968 -12.651 -0.654
570 HG SER 587 HG SER 587 -8.248 -14.249 -1.161
571 H VAL 588 H VAL 588 -5.138 -11.669 -0.552
572 HA VAL 588 HA VAL 588 -3.220 -10.070 -2.063
573 HB VAL 588 HB VAL 588 -2.880 -10.268 0.859
574 1HG1 VAL 588 1HG1 VAL 588 -2.999 -8.120 -1.237
575 2HG1 VAL 588 3HG1 VAL 588 -3.054 -7.711 0.479
576 3HG1 VAL 588 2HG1 VAL 588 -1.658 -8.562 -0.176
577 1HG2 VAL 588 2HG2 VAL 588 -5.415 -9.179 -0.364
578 2HG2 VAL 588 1HG2 VAL 588 -5.267 -10.452 0.848
579 3HG2 VAL 588 3HG2 VAL 588 -4.840 -8.795 1.261
580 H GLU 589 H GLU 589 -1.028 -9.912 -1.295
581 HA GLU 589 HA GLU 589 0.214 -12.433 -0.374
582 1HB GLU 589 2HB GLU 589 0.764 -12.581 -2.682
583 2HB GLU 589 1HB GLU 589 0.870 -10.826 -2.856
584 1HG GLU 589 2HG GLU 589 3.026 -10.783 -2.207
585 2HG GLU 589 1HG GLU 589 2.707 -11.860 -0.846
586 H TRP 590 H TRP 590 0.032 -11.074 1.593
587 HA TRP 590 HA TRP 590 1.013 -8.480 1.844
588 1HB TRP 590 2HB TRP 590 0.836 -10.752 3.808
589 2HB TRP 590 1HB TRP 590 1.454 -9.164 4.286
590 HD1 TRP 590 HD1 TRP 590 -1.150 -9.445 1.594
591 HE1 TRP 590 HE1 TRP 590 -3.340 -8.370 2.373
592 HE3 TRP 590 HE3 TRP 590 0.004 -8.672 6.490
593 HZ2 TRP 590 HZ2 TRP 590 -4.501 -7.384 4.875
594 HZ3 TRP 590 HZ3 TRP 590 -1.663 -7.642 8.001
595 HH2 TRP 590 HH2 TRP 590 -3.866 -7.020 7.249
596 H GLU 591 H GLU 591 2.890 -8.147 0.655
597 HA GLU 591 HA GLU 591 5.286 -9.711 1.077
598 1HB GLU 591 2HB GLU 591 4.501 -7.865 -0.754
599 2HB GLU 591 1HB GLU 591 5.626 -6.921 0.206
600 1HG GLU 591 2HG GLU 591 6.160 -9.557 -1.195
601 2HG GLU 591 1HG GLU 591 6.869 -7.990 -1.582
602 H SER 592 H SER 592 5.487 -9.737 3.340
603 HA SER 592 HA SER 592 5.644 -7.146 4.730
604 1HB SER 592 2HB SER 592 4.202 -8.950 5.616
605 2HB SER 592 1HB SER 592 5.621 -9.991 5.776
606 HG SER 592 HG SER 592 5.506 -9.069 7.728
607 H ASP 593 H ASP 593 7.742 -8.166 2.869
608 HA ASP 593 HA ASP 593 10.011 -8.673 4.697
609 1HB ASP 593 2HB ASP 593 9.515 -9.005 1.806
610 2HB ASP 593 1HB ASP 593 11.127 -8.414 2.208
611 HA PRO 594 HA PRO 594 11.347 -4.434 3.039
612 1HB PRO 594 2HB PRO 594 9.962 -3.288 0.962
613 2HB PRO 594 1HB PRO 594 11.347 -4.368 0.723
614 1HG PRO 594 2HG PRO 594 8.432 -4.936 0.363
615 2HG PRO 594 1HG PRO 594 9.824 -5.632 -0.483
616 1HD PRO 594 2HD PRO 594 8.399 -6.901 1.569
617 2HD PRO 594 1HD PRO 594 10.036 -7.329 1.024
618 H ASN 595 H ASN 595 10.069 -4.180 5.143
619 HA ASN 595 HA ASN 595 7.543 -2.637 4.752
620 1HB ASN 595 2HB ASN 595 6.940 -3.261 6.992
621 2HB ASN 595 1HB ASN 595 7.525 -4.723 6.197
622 1HD2 ASN 595 2HD2 ASN 595 9.211 -4.164 9.583
623 2HD2 ASN 595 1HD2 ASN 595 7.578 -4.079 9.127
624 H ARG 596 H ARG 596 7.239 -0.989 6.666
625 HA ARG 596 HA ARG 596 9.785 0.340 7.403
626 1HB ARG 596 2HB ARG 596 7.710 1.430 5.540
627 2HB ARG 596 1HB ARG 596 8.493 2.546 6.658
628 1HG ARG 596 2HG ARG 596 10.184 0.641 5.072
629 2HG ARG 596 1HG ARG 596 9.564 2.097 4.293
630 1HD ARG 596 2HD ARG 596 10.808 2.420 6.983
631 2HD ARG 596 1HD ARG 596 11.889 2.088 5.629
632 HE ARG 596 HE ARG 596 10.028 4.188 4.955
633 1HH1 ARG 596 1HH2 ARG 596 12.534 3.602 7.216
634 2HH1 ARG 596 2HH2 ARG 596 13.320 5.124 6.957
635 1HH2 ARG 596 2HH1 ARG 596 11.180 6.095 4.407
636 2HH2 ARG 596 1HH1 ARG 596 12.553 6.535 5.366
637 H GLU 597 H GLU 597 8.761 2.647 8.505
638 HA GLU 597 HA GLU 597 6.479 1.900 10.238
639 1HB GLU 597 2HB GLU 597 7.989 2.747 12.221
640 2HB GLU 597 1HB GLU 597 8.117 1.071 11.685
641 1HG GLU 597 2HG GLU 597 10.050 1.623 10.297
642 2HG GLU 597 1HG GLU 597 9.896 3.329 10.720
643 H TYR 598 H TYR 598 5.588 3.704 8.928
644 HA TYR 598 HA TYR 598 6.690 6.324 8.976
645 1HB TYR 598 2HB TYR 598 4.765 5.204 7.547
646 2HB TYR 598 1HB TYR 598 3.744 5.856 8.830
647 HD1 TYR 598 HD2 TYR 598 4.371 8.342 9.548
648 HD2 TYR 598 HD1 TYR 598 5.205 6.548 5.739
649 HE1 TYR 598 HE2 TYR 598 4.483 10.593 8.536
650 HE2 TYR 598 HE1 TYR 598 5.346 8.805 4.712
651 HH TYR 598 HH TYR 598 4.109 11.322 5.658
652 H THR 599 H THR 599 7.224 6.828 11.156
653 HA THR 599 HA THR 599 5.131 6.750 13.213
654 HB THR 599 HB THR 599 7.506 8.413 13.738
655 HG1 THR 599 HG1 THR 599 8.880 6.564 13.790
656 1HG2 THR 599 2HG2 THR 599 5.657 7.035 15.210
657 2HG2 THR 599 1HG2 THR 599 7.025 5.923 15.242
658 3HG2 THR 599 3HG2 THR 599 7.217 7.574 15.829
659 H VAL 600 H VAL 600 3.587 8.105 12.017
660 HA VAL 600 HA VAL 600 4.334 10.785 11.249
661 HB VAL 600 HB VAL 600 1.466 10.226 11.846
662 1HG1 VAL 600 3HG1 VAL 600 3.140 11.910 10.195
663 2HG1 VAL 600 2HG1 VAL 600 1.888 11.106 9.252
664 3HG1 VAL 600 1HG1 VAL 600 1.440 12.109 10.633
665 1HG2 VAL 600 3HG2 VAL 600 2.652 8.149 10.611
666 2HG2 VAL 600 2HG2 VAL 600 1.068 8.740 10.125
667 3HG2 VAL 600 1HG2 VAL 600 2.497 9.234 9.229
668 HA PRO 601 HA PRO 601 4.069 12.390 15.389
669 1HB PRO 601 2HB PRO 601 4.730 14.969 14.712
670 2HB PRO 601 1HB PRO 601 5.920 13.665 14.868
671 1HG PRO 601 2HG PRO 601 4.855 14.946 12.397
672 2HG PRO 601 1HG PRO 601 6.404 14.126 12.658
673 1HD PRO 601 2HD PRO 601 4.131 13.029 11.361
674 2HD PRO 601 1HD PRO 601 5.573 12.136 11.889
675 H GLN 602 H GLN 602 3.153 14.857 16.069
676 HA GLN 602 HA GLN 602 0.334 14.678 15.864
677 1HB GLN 602 2HB GLN 602 0.274 16.908 16.821
678 2HB GLN 602 1HB GLN 602 1.600 16.020 17.573
679 1HG GLN 602 2HG GLN 602 3.197 17.074 16.019
680 2HG GLN 602 1HG GLN 602 1.875 17.959 15.256
681 1HE2 GLN 602 2HE2 GLN 602 2.681 18.982 19.165
682 2HE2 GLN 602 1HE2 GLN 602 2.724 17.346 18.716
683 H ALA 603 H ALA 603 2.644 15.825 13.594
684 HA ALA 603 HA ALA 603 2.334 16.610 11.400
685 1HB ALA 603 3HB ALA 603 -0.106 15.301 12.052
686 2HB ALA 603 2HB ALA 603 -0.527 16.825 11.271
687 3HB ALA 603 1HB ALA 603 0.524 15.674 10.447
688 H CYS 604 H CYS 604 3.079 18.711 11.717
689 HA CYS 604 HA CYS 604 0.961 20.769 12.068
690 1HB CYS 604 2HB CYS 604 2.309 20.244 14.242
691 2HB CYS 604 1HB CYS 604 3.623 21.104 13.438
692 H GLY 605 H GLY 605 1.249 21.065 9.760
693 1HA GLY 605 2HA GLY 605 2.352 23.054 8.564
694 2HA GLY 605 1HA GLY 605 3.875 22.281 9.007
695 H THR 606 H THR 606 3.732 19.747 8.389
696 HA THR 606 HA THR 606 2.985 19.717 5.499
697 HB THR 606 HB THR 606 4.530 17.508 5.809
698 HG1 THR 606 HG1 THR 606 5.332 17.634 7.747
699 1HG2 THR 606 2HG2 THR 606 5.214 20.384 5.255
700 2HG2 THR 606 1HG2 THR 606 6.475 19.150 5.231
701 3HG2 THR 606 3HG2 THR 606 5.105 19.033 4.126
702 H SER 607 H SER 607 3.510 16.996 7.717
703 HA SER 607 HA SER 607 2.054 15.285 8.406
704 1HB SER 607 2HB SER 607 -0.310 16.685 7.220
705 2HB SER 607 1HB SER 607 -0.190 15.770 8.719
706 HG SER 607 HG SER 607 0.119 18.411 8.292
707 H THR 608 H THR 608 3.247 15.541 5.668
708 HA THR 608 HA THR 608 1.803 13.294 4.452
709 HB THR 608 HB THR 608 0.957 14.333 2.553
710 HG1 THR 608 HG1 THR 608 2.611 16.582 2.907
711 1HG2 THR 608 3HG2 THR 608 0.978 16.536 4.626
712 2HG2 THR 608 2HG2 THR 608 0.043 16.609 3.135
713 3HG2 THR 608 1HG2 THR 608 -0.303 15.361 4.329
714 H ALA 609 H ALA 609 3.401 12.000 3.708
715 HA ALA 609 HA ALA 609 5.792 13.338 2.492
716 1HB ALA 609 3HB ALA 609 6.105 12.577 4.972
717 2HB ALA 609 2HB ALA 609 6.202 10.959 4.277
718 3HB ALA 609 1HB ALA 609 7.359 12.198 3.791
719 H THR 610 H THR 610 7.303 11.090 1.938
720 HA THR 610 HA THR 610 5.545 9.703 -0.039
721 HB THR 610 HB THR 610 7.675 9.135 -1.183
722 HG1 THR 610 HG1 THR 610 9.110 9.098 0.478
723 1HG2 THR 610 3HG2 THR 610 6.363 11.471 -1.275
724 2HG2 THR 610 2HG2 THR 610 7.913 12.061 -0.674
725 3HG2 THR 610 1HG2 THR 610 7.835 11.188 -2.205
726 H VAL 611 H VAL 611 6.358 7.467 -0.575
727 HA VAL 611 HA VAL 611 7.360 5.879 1.684
728 HB VAL 611 HB VAL 611 4.685 5.083 0.683
729 1HG1 VAL 611 1HG1 VAL 611 6.363 4.624 2.999
730 2HG1 VAL 611 3HG1 VAL 611 4.747 5.157 3.499
731 3HG1 VAL 611 2HG1 VAL 611 4.944 3.711 2.480
732 1HG2 VAL 611 2HG2 VAL 611 4.457 7.540 1.086
733 2HG2 VAL 611 1HG2 VAL 611 3.408 6.533 2.103
734 3HG2 VAL 611 3HG2 VAL 611 4.901 7.220 2.771
735 H THR 612 H THR 612 8.871 5.552 -0.240
736 HA THR 612 HA THR 612 7.816 4.348 -2.656
737 HB THR 612 HB THR 612 10.460 3.834 -2.806
738 HG1 THR 612 HG1 THR 612 11.171 6.028 -1.857
739 1HG2 THR 612 2HG2 THR 612 8.883 6.326 -3.373
740 2HG2 THR 612 1HG2 THR 612 10.551 6.111 -3.909
741 3HG2 THR 612 3HG2 THR 612 9.296 5.004 -4.469
742 H ASP 613 H ASP 613 7.942 2.349 -3.443
743 HA ASP 613 HA ASP 613 9.415 0.256 -2.157
744 1HB ASP 613 2HB ASP 613 6.494 0.537 -1.625
745 2HB ASP 613 1HB ASP 613 7.100 -1.092 -1.928
746 H THR 614 H THR 614 9.103 -1.867 -3.388
747 HA THR 614 HA THR 614 7.576 -1.775 -5.856
748 HB THR 614 HB THR 614 9.116 -0.662 -7.055
749 HG1 THR 614 HG1 THR 614 9.493 -2.539 -8.035
750 1HG2 THR 614 1HG2 THR 614 10.914 -1.325 -4.759
751 2HG2 THR 614 3HG2 THR 614 11.652 -0.825 -6.282
752 3HG2 THR 614 2HG2 THR 614 10.517 0.245 -5.458
753 H TRP 615 H TRP 615 7.311 -3.735 -6.758
754 HA TRP 615 HA TRP 615 7.857 -5.992 -5.080
755 1HB TRP 615 2HB TRP 615 6.265 -5.402 -7.446
756 2HB TRP 615 1HB TRP 615 6.965 -7.026 -7.485
757 HD1 TRP 615 HD1 TRP 615 4.694 -8.217 -6.832
758 HE1 TRP 615 HE1 TRP 615 3.466 -8.458 -4.560
759 HE3 TRP 615 HE3 TRP 615 6.940 -4.508 -4.289
760 HZ2 TRP 615 HZ2 TRP 615 3.450 -7.172 -2.037
761 HZ3 TRP 615 HZ3 TRP 615 6.345 -4.011 -1.968
762 HH2 TRP 615 HH2 TRP 615 4.627 -5.335 -0.829
763 H ARG 616 H ARG 616 9.072 -7.805 -5.441
764 HA ARG 616 HA ARG 616 11.440 -7.343 -7.197
765 1HB ARG 616 2HB ARG 616 12.561 -9.012 -5.864
766 2HB ARG 616 1HB ARG 616 11.727 -7.927 -4.751
767 1HG ARG 616 2HG ARG 616 9.799 -9.550 -4.734
768 2HG ARG 616 1HG ARG 616 10.802 -10.663 -5.665
769 1HD ARG 616 2HD ARG 616 11.168 -11.347 -3.442
770 2HD ARG 616 1HD ARG 616 12.555 -10.311 -3.778
771 HE ARG 616 HE ARG 616 10.193 -9.515 -2.140
772 1HH1 ARG 616 1HH2 ARG 616 10.716 -7.006 -2.357
773 2HH1 ARG 616 2HH2 ARG 616 12.262 -6.631 -1.673
774 1HH2 ARG 616 1HH1 ARG 616 13.355 -9.922 -1.668
775 2HH2 ARG 616 2HH1 ARG 616 13.756 -8.281 -1.283
No H/Q in entry = 775
Start of MODEL 4
1 1H CYS 509 2H CYS 509 -20.162 -16.638 5.020
2 2H CYS 509 1H CYS 509 -21.041 -15.329 5.653
3 3H CYS 509 3H CYS 509 -21.860 -16.652 4.979
4 HA CYS 509 HA CYS 509 -21.476 -16.022 2.845
5 1HB CYS 509 2HB CYS 509 -22.512 -14.116 4.386
6 2HB CYS 509 1HB CYS 509 -21.024 -13.276 3.948
7 H THR 510 H THR 510 -19.021 -17.017 3.590
8 HA THR 510 HA THR 510 -16.793 -16.947 2.844
9 HB THR 510 HB THR 510 -16.936 -14.321 1.539
10 HG1 THR 510 HG1 THR 510 -18.584 -14.719 0.241
11 1HG2 THR 510 1HG2 THR 510 -15.456 -16.588 1.283
12 2HG2 THR 510 3HG2 THR 510 -16.640 -16.830 -0.001
13 3HG2 THR 510 2HG2 THR 510 -15.629 -15.385 0.005
14 H THR 511 H THR 511 -15.918 -16.614 4.915
15 HA THR 511 HA THR 511 -14.785 -15.449 6.605
16 HB THR 511 HB THR 511 -14.261 -12.944 5.375
17 HG1 THR 511 HG1 THR 511 -13.265 -14.148 3.431
18 1HG2 THR 511 2HG2 THR 511 -12.868 -14.783 6.731
19 2HG2 THR 511 1HG2 THR 511 -12.356 -15.222 5.101
20 3HG2 THR 511 3HG2 THR 511 -12.076 -13.588 5.704
21 HA PRO 512 HA PRO 512 -17.512 -12.592 8.517
22 1HB PRO 512 2HB PRO 512 -15.806 -10.866 9.808
23 2HB PRO 512 1HB PRO 512 -16.089 -12.536 10.330
24 1HG PRO 512 2HG PRO 512 -13.715 -11.380 8.946
25 2HG PRO 512 1HG PRO 512 -13.816 -12.794 10.009
26 1HD PRO 512 2HD PRO 512 -13.665 -12.848 7.180
27 2HD PRO 512 1HD PRO 512 -14.084 -14.217 8.232
28 H THR 513 H THR 513 -14.989 -10.156 8.070
29 HA THR 513 HA THR 513 -16.434 -8.880 5.843
30 HB THR 513 HB THR 513 -17.040 -6.893 6.974
31 HG1 THR 513 HG1 THR 513 -15.474 -7.856 9.134
32 1HG2 THR 513 3HG2 THR 513 -17.491 -9.181 8.911
33 2HG2 THR 513 2HG2 THR 513 -18.375 -7.655 8.916
34 3HG2 THR 513 1HG2 THR 513 -18.528 -8.758 7.549
35 H ALA 514 H ALA 514 -13.682 -9.954 6.674
36 HA ALA 514 HA ALA 514 -11.950 -7.600 6.651
37 1HB ALA 514 2HB ALA 514 -11.544 -10.064 7.587
38 2HB ALA 514 1HB ALA 514 -10.917 -10.313 5.957
39 3HB ALA 514 3HB ALA 514 -10.209 -9.076 6.995
40 H VAL 515 H VAL 515 -11.112 -6.610 4.834
41 HA VAL 515 HA VAL 515 -11.876 -7.796 2.225
42 HB VAL 515 HB VAL 515 -10.763 -5.061 2.743
43 1HG1 VAL 515 3HG1 VAL 515 -10.513 -6.246 0.452
44 2HG1 VAL 515 2HG1 VAL 515 -12.262 -6.108 0.338
45 3HG1 VAL 515 1HG1 VAL 515 -11.271 -4.651 0.463
46 1HG2 VAL 515 3HG2 VAL 515 -12.943 -5.469 3.864
47 2HG2 VAL 515 2HG2 VAL 515 -13.088 -4.324 2.531
48 3HG2 VAL 515 1HG2 VAL 515 -13.609 -5.997 2.322
49 H ALA 516 H ALA 516 -10.224 -9.365 1.929
50 HA ALA 516 HA ALA 516 -7.426 -8.552 2.173
51 1HB ALA 516 3HB ALA 516 -8.125 -10.934 2.516
52 2HB ALA 516 2HB ALA 516 -8.596 -11.005 0.818
53 3HB ALA 516 1HB ALA 516 -6.902 -10.763 1.253
54 H VAL 517 H VAL 517 -6.864 -6.953 0.686
55 HA VAL 517 HA VAL 517 -7.844 -7.406 -2.101
56 HB VAL 517 HB VAL 517 -6.527 -4.849 -1.616
57 1HG1 VAL 517 1HG1 VAL 517 -7.828 -5.410 -3.603
58 2HG1 VAL 517 3HG1 VAL 517 -9.268 -5.638 -2.607
59 3HG1 VAL 517 2HG1 VAL 517 -8.543 -4.027 -2.757
60 1HG2 VAL 517 2HG2 VAL 517 -7.681 -5.281 0.636
61 2HG2 VAL 517 1HG2 VAL 517 -8.074 -3.780 -0.218
62 3HG2 VAL 517 3HG2 VAL 517 -9.198 -5.144 -0.258
63 H THR 518 H THR 518 -6.280 -7.513 -3.735
64 HA THR 518 HA THR 518 -3.474 -7.762 -2.782
65 HB THR 518 HB THR 518 -3.062 -9.050 -4.787
66 HG1 THR 518 HG1 THR 518 -4.501 -9.127 -6.434
67 1HG2 THR 518 3HG2 THR 518 -4.868 -9.823 -2.831
68 2HG2 THR 518 2HG2 THR 518 -5.711 -10.204 -4.332
69 3HG2 THR 518 1HG2 THR 518 -4.118 -10.892 -4.017
70 H PHE 519 H PHE 519 -1.953 -6.280 -3.559
71 HA PHE 519 HA PHE 519 -2.926 -4.406 -5.661
72 1HB PHE 519 2HB PHE 519 -1.029 -3.260 -3.682
73 2HB PHE 519 1HB PHE 519 -2.346 -2.500 -4.520
74 HD1 PHE 519 HD2 PHE 519 -2.031 -5.319 -2.019
75 HD2 PHE 519 HD1 PHE 519 -3.990 -1.682 -3.165
76 HE1 PHE 519 HE2 PHE 519 -3.467 -5.456 -0.006
77 HE2 PHE 519 HE1 PHE 519 -5.421 -1.832 -1.157
78 HZ PHE 519 HZ PHE 519 -5.157 -3.707 0.398
79 H ASP 520 H ASP 520 -1.201 -3.379 -6.867
80 HA ASP 520 HA ASP 520 1.353 -4.909 -6.809
81 1HB ASP 520 2HB ASP 520 -0.481 -4.206 -9.072
82 2HB ASP 520 1HB ASP 520 1.252 -4.161 -9.379
83 H LEU 521 H LEU 521 3.219 -3.568 -7.484
84 HA LEU 521 HA LEU 521 2.814 -0.676 -7.787
85 1HB LEU 521 2HB LEU 521 2.480 -1.216 -5.337
86 2HB LEU 521 1HB LEU 521 4.151 -1.751 -5.298
87 HG LEU 521 HG LEU 521 4.357 0.406 -4.581
88 1HD1 LEU 521 1HD1 LEU 521 5.778 0.103 -6.591
89 2HD1 LEU 521 3HD1 LEU 521 4.494 0.806 -7.569
90 3HD1 LEU 521 2HD1 LEU 521 5.308 1.786 -6.354
91 1HD2 LEU 521 1HD2 LEU 521 1.783 0.701 -5.559
92 2HD2 LEU 521 3HD2 LEU 521 2.699 1.957 -4.719
93 3HD2 LEU 521 2HD2 LEU 521 2.702 1.882 -6.484
94 H THR 522 H THR 522 4.239 -0.645 -9.561
95 HA THR 522 HA THR 522 6.800 -2.078 -9.276
96 HB THR 522 HB THR 522 6.430 -0.139 -11.505
97 HG1 THR 522 HG1 THR 522 5.128 -1.920 -12.484
98 1HG2 THR 522 3HG2 THR 522 8.292 -1.958 -11.064
99 2HG2 THR 522 2HG2 THR 522 7.090 -3.051 -11.751
100 3HG2 THR 522 1HG2 THR 522 7.685 -1.687 -12.698
101 H ALA 523 H ALA 523 8.490 -1.269 -8.179
102 HA ALA 523 HA ALA 523 9.403 1.474 -8.641
103 1HB ALA 523 2HB ALA 523 7.558 1.312 -6.694
104 2HB ALA 523 1HB ALA 523 8.992 0.917 -5.754
105 3HB ALA 523 3HB ALA 523 8.902 2.462 -6.626
106 H THR 524 H THR 524 10.820 1.198 -5.947
107 HA THR 524 HA THR 524 12.853 -0.866 -6.754
108 HB THR 524 HB THR 524 13.574 1.462 -7.280
109 HG1 THR 524 HG1 THR 524 14.925 -0.322 -6.099
110 1HG2 THR 524 3HG2 THR 524 12.190 1.858 -4.890
111 2HG2 THR 524 2HG2 THR 524 13.874 2.271 -4.527
112 3HG2 THR 524 1HG2 THR 524 13.027 3.096 -5.840
113 H THR 525 H THR 525 13.967 -1.834 -4.979
114 HA THR 525 HA THR 525 12.561 -2.426 -2.636
115 HB THR 525 HB THR 525 14.585 -3.543 -3.834
116 HG1 THR 525 HG1 THR 525 13.636 -3.635 -1.287
117 1HG2 THR 525 1HG2 THR 525 16.114 -1.604 -3.253
118 2HG2 THR 525 3HG2 THR 525 16.066 -2.178 -1.589
119 3HG2 THR 525 2HG2 THR 525 16.718 -3.204 -2.849
120 H THR 526 H THR 526 14.539 -2.158 -0.533
121 HA THR 526 HA THR 526 13.755 0.374 0.480
122 HB THR 526 HB THR 526 14.773 -1.760 1.761
123 HG1 THR 526 HG1 THR 526 13.751 0.140 2.621
124 1HG2 THR 526 1HG2 THR 526 17.083 -0.824 0.682
125 2HG2 THR 526 3HG2 THR 526 17.045 0.076 2.201
126 3HG2 THR 526 2HG2 THR 526 17.007 -1.688 2.218
127 H TYR 527 H TYR 527 15.879 -0.346 -1.883
128 HA TYR 527 HA TYR 527 18.165 1.080 -1.879
129 1HB TYR 527 2HB TYR 527 16.361 0.145 -3.779
130 2HB TYR 527 1HB TYR 527 16.389 1.874 -4.092
131 HD1 TYR 527 HD2 TYR 527 18.984 2.878 -3.972
132 HD2 TYR 527 HD1 TYR 527 17.769 -1.116 -4.932
133 HE1 TYR 527 HE2 TYR 527 21.132 2.503 -5.172
134 HE2 TYR 527 HE1 TYR 527 19.880 -1.516 -6.111
135 HH TYR 527 HH TYR 527 22.337 1.084 -6.386
136 H GLY 528 H GLY 528 14.865 2.329 -1.790
137 1HA GLY 528 2HA GLY 528 15.509 4.715 -0.430
138 2HA GLY 528 1HA GLY 528 15.424 5.101 -2.146
139 H GLU 529 H GLU 529 13.286 2.578 -0.743
140 HA GLU 529 HA GLU 529 11.081 4.247 -0.087
141 1HB GLU 529 2HB GLU 529 9.806 3.855 -2.338
142 2HB GLU 529 1HB GLU 529 10.956 5.184 -2.215
143 1HG GLU 529 2HG GLU 529 12.644 3.954 -3.363
144 2HG GLU 529 1HG GLU 529 11.740 2.447 -3.211
145 H ASN 530 H ASN 530 9.256 3.098 0.573
146 HA ASN 530 HA ASN 530 9.042 0.207 -0.155
147 1HB ASN 530 2HB ASN 530 9.693 0.426 2.231
148 2HB ASN 530 1HB ASN 530 8.322 1.499 2.461
149 1HD2 ASN 530 2HD2 ASN 530 5.937 -1.263 2.127
150 2HD2 ASN 530 1HD2 ASN 530 6.115 0.341 1.617
151 H ILE 531 H ILE 531 6.733 -0.539 -0.474
152 HA ILE 531 HA ILE 531 5.202 1.990 -0.771
153 HB ILE 531 HB ILE 531 4.118 0.064 -2.585
154 1HG1 ILE 531 2HG1 ILE 531 6.721 -0.509 -2.402
155 2HG1 ILE 531 1HG1 ILE 531 5.907 -0.441 -3.957
156 1HG2 ILE 531 3HG2 ILE 531 5.431 2.774 -2.712
157 2HG2 ILE 531 2HG2 ILE 531 4.762 2.007 -4.133
158 3HG2 ILE 531 1HG2 ILE 531 3.708 2.415 -2.789
159 1HD1 ILE 531 1HD1 ILE 531 7.400 1.893 -2.696
160 2HD1 ILE 531 3HD1 ILE 531 8.043 0.823 -3.980
161 3HD1 ILE 531 2HD1 ILE 531 6.632 1.858 -4.313
162 H TYR 532 H TYR 532 4.032 2.191 0.739
163 HA TYR 532 HA TYR 532 2.504 -0.051 1.849
164 1HB TYR 532 2HB TYR 532 3.469 2.583 2.625
165 2HB TYR 532 1HB TYR 532 1.888 2.143 3.271
166 HD1 TYR 532 HD2 TYR 532 5.459 1.218 3.008
167 HD2 TYR 532 HD1 TYR 532 1.570 0.363 4.744
168 HE1 TYR 532 HE2 TYR 532 6.555 -0.087 4.851
169 HE2 TYR 532 HE1 TYR 532 2.694 -0.941 6.583
170 HH TYR 532 HH TYR 532 4.648 -1.897 7.230
171 H LEU 533 H LEU 533 0.317 0.501 2.594
172 HA LEU 533 HA LEU 533 -1.023 2.307 0.748
173 1HB LEU 533 2HB LEU 533 -1.220 -0.423 0.514
174 2HB LEU 533 1HB LEU 533 -2.645 -0.020 1.466
175 HG LEU 533 HG LEU 533 -3.372 0.138 -0.777
176 1HD1 LEU 533 3HD1 LEU 533 -3.815 2.163 0.719
177 2HD1 LEU 533 2HD1 LEU 533 -2.519 2.973 -0.166
178 3HD1 LEU 533 1HD1 LEU 533 -3.966 2.436 -1.019
179 1HD2 LEU 533 3HD2 LEU 533 -0.597 1.054 -1.199
180 2HD2 LEU 533 2HD2 LEU 533 -1.653 0.132 -2.272
181 3HD2 LEU 533 1HD2 LEU 533 -1.798 1.889 -2.185
182 H VAL 534 H VAL 534 -0.931 3.750 2.593
183 HA VAL 534 HA VAL 534 -2.519 3.005 4.935
184 HB VAL 534 HB VAL 534 -0.421 4.641 4.736
185 1HG1 VAL 534 2HG1 VAL 534 -2.726 6.510 4.367
186 2HG1 VAL 534 1HG1 VAL 534 -1.199 6.969 5.113
187 3HG1 VAL 534 3HG1 VAL 534 -1.232 6.434 3.418
188 1HG2 VAL 534 2HG2 VAL 534 -2.561 4.497 6.649
189 2HG2 VAL 534 1HG2 VAL 534 -0.842 4.666 6.904
190 3HG2 VAL 534 3HG2 VAL 534 -1.811 6.118 6.605
191 H GLY 535 H GLY 535 -4.546 2.619 4.282
192 1HA GLY 535 2HA GLY 535 -6.079 4.615 2.651
193 2HA GLY 535 1HA GLY 535 -6.557 2.928 2.855
194 H SER 536 H SER 536 -8.213 5.308 3.609
195 HA SER 536 HA SER 536 -7.972 5.914 6.456
196 1HB SER 536 2HB SER 536 -9.061 7.454 4.906
197 2HB SER 536 1HB SER 536 -10.388 6.327 4.678
198 HG SER 536 HG SER 536 -11.186 7.082 6.446
199 H ILE 537 H ILE 537 -7.924 3.722 7.296
200 HA ILE 537 HA ILE 537 -10.411 3.187 8.435
201 HB ILE 537 HB ILE 537 -9.466 1.396 6.340
202 1HG1 ILE 537 2HG1 ILE 537 -11.791 2.773 7.192
203 2HG1 ILE 537 1HG1 ILE 537 -11.606 1.792 5.751
204 1HG2 ILE 537 1HG2 ILE 537 -9.021 0.121 8.531
205 2HG2 ILE 537 3HG2 ILE 537 -10.763 0.139 8.772
206 3HG2 ILE 537 2HG2 ILE 537 -10.076 -0.668 7.367
207 1HD1 ILE 537 1HD1 ILE 537 -12.125 -0.216 7.273
208 2HD1 ILE 537 3HD1 ILE 537 -12.649 0.969 8.466
209 3HD1 ILE 537 2HD1 ILE 537 -13.467 0.864 6.906
210 H SER 538 H SER 538 -10.234 1.356 10.104
211 HA SER 538 HA SER 538 -8.075 2.249 11.802
212 1HB SER 538 2HB SER 538 -10.448 0.971 12.282
213 2HB SER 538 1HB SER 538 -9.306 -0.346 12.528
214 HG SER 538 HG SER 538 -8.686 2.139 13.630
215 H GLN 539 H GLN 539 -8.581 -1.054 10.530
216 HA GLN 539 HA GLN 539 -5.965 -1.973 11.207
217 1HB GLN 539 2HB GLN 539 -8.114 -3.274 10.308
218 2HB GLN 539 1HB GLN 539 -7.350 -2.988 8.744
219 1HG GLN 539 2HG GLN 539 -5.708 -4.077 11.011
220 2HG GLN 539 1HG GLN 539 -6.754 -5.163 10.095
221 1HE2 GLN 539 2HE2 GLN 539 -4.908 -4.527 6.989
222 2HE2 GLN 539 1HE2 GLN 539 -6.519 -4.600 7.520
223 H LEU 540 H LEU 540 -7.214 0.167 8.897
224 HA LEU 540 HA LEU 540 -4.635 0.337 7.511
225 1HB LEU 540 2HB LEU 540 -6.896 -0.467 6.304
226 2HB LEU 540 1HB LEU 540 -7.071 1.280 6.152
227 HG LEU 540 HG LEU 540 -4.561 1.139 5.348
228 1HD1 LEU 540 1HD1 LEU 540 -4.503 -1.343 5.867
229 2HD1 LEU 540 3HD1 LEU 540 -5.602 -1.569 4.506
230 3HD1 LEU 540 2HD1 LEU 540 -3.988 -0.904 4.236
231 1HD2 LEU 540 1HD2 LEU 540 -6.824 1.685 4.107
232 2HD2 LEU 540 3HD2 LEU 540 -5.377 1.334 3.154
233 3HD2 LEU 540 2HD2 LEU 540 -6.594 0.083 3.401
234 H GLY 541 H GLY 541 -4.758 1.707 9.739
235 1HA GLY 541 2HA GLY 541 -6.087 3.897 10.393
236 2HA GLY 541 1HA GLY 541 -4.334 4.009 10.320
237 H ASP 542 H ASP 542 -3.839 3.981 7.742
238 HA ASP 542 HA ASP 542 -3.901 5.212 5.670
239 1HB ASP 542 2HB ASP 542 -6.467 5.439 6.150
240 2HB ASP 542 1HB ASP 542 -6.017 7.021 6.641
241 H TRP 543 H TRP 543 -4.369 6.786 8.646
242 HA TRP 543 HA TRP 543 -2.782 9.026 7.670
243 1HB TRP 543 2HB TRP 543 -4.986 9.161 9.697
244 2HB TRP 543 1HB TRP 543 -4.283 10.456 8.734
245 HD1 TRP 543 HD1 TRP 543 -7.345 8.448 8.712
246 HE1 TRP 543 HE1 TRP 543 -8.434 8.319 6.438
247 HE3 TRP 543 HE3 TRP 543 -3.453 9.944 5.786
248 HZ2 TRP 543 HZ2 TRP 543 -7.772 8.723 3.708
249 HZ3 TRP 543 HZ3 TRP 543 -3.730 10.091 3.332
250 HH2 TRP 543 HH2 TRP 543 -5.894 9.475 2.286
251 H GLU 544 H GLU 544 -1.952 6.681 8.828
252 HA GLU 544 HA GLU 544 -0.076 7.533 10.778
253 1HB GLU 544 2HB GLU 544 -2.112 7.239 12.288
254 2HB GLU 544 1HB GLU 544 -2.157 5.559 11.758
255 1HG GLU 544 2HG GLU 544 -0.115 5.035 12.776
256 2HG GLU 544 1HG GLU 544 0.370 6.729 12.885
257 H THR 545 H THR 545 1.207 6.594 9.154
258 HA THR 545 HA THR 545 0.698 4.277 7.749
259 HB THR 545 HB THR 545 3.123 4.046 7.426
260 HG1 THR 545 HG1 THR 545 4.382 4.320 9.049
261 1HG2 THR 545 3HG2 THR 545 1.826 6.328 6.873
262 2HG2 THR 545 2HG2 THR 545 3.062 6.972 7.948
263 3HG2 THR 545 1HG2 THR 545 3.527 6.108 6.482
264 H SER 546 H SER 546 1.299 4.555 11.159
265 HA SER 546 HA SER 546 2.605 2.248 11.930
266 1HB SER 546 2HB SER 546 0.048 3.219 13.222
267 2HB SER 546 1HB SER 546 1.361 2.335 13.993
268 HG SER 546 HG SER 546 2.712 4.151 13.447
269 H ASP 547 H ASP 547 -0.464 2.400 10.300
270 HA ASP 547 HA ASP 547 -0.525 -0.547 10.299
271 1HB ASP 547 2HB ASP 547 -2.645 1.214 11.510
272 2HB ASP 547 1HB ASP 547 -3.050 -0.375 10.857
273 H GLY 548 H GLY 548 0.043 1.001 8.031
274 1HA GLY 548 2HA GLY 548 -2.506 1.303 6.567
275 2HA GLY 548 1HA GLY 548 -0.901 1.745 5.963
276 H ILE 549 H ILE 549 -0.364 0.433 4.306
277 HA ILE 549 HA ILE 549 -0.459 -2.447 4.777
278 HB ILE 549 HB ILE 549 -2.299 -1.081 2.917
279 1HG1 ILE 549 2HG1 ILE 549 -2.288 -3.817 4.206
280 2HG1 ILE 549 1HG1 ILE 549 -3.036 -2.373 4.883
281 1HG2 ILE 549 2HG2 ILE 549 -0.798 -3.567 2.084
282 2HG2 ILE 549 1HG2 ILE 549 -2.407 -3.171 1.458
283 3HG2 ILE 549 3HG2 ILE 549 -1.045 -2.092 1.156
284 1HD1 ILE 549 1HD1 ILE 549 -4.427 -2.203 2.783
285 2HD1 ILE 549 3HD1 ILE 549 -3.772 -3.761 2.292
286 3HD1 ILE 549 2HD1 ILE 549 -4.763 -3.643 3.745
287 H ALA 550 H ALA 550 1.733 -2.381 4.789
288 HA ALA 550 HA ALA 550 3.462 -1.235 2.869
289 1HB ALA 550 2HB ALA 550 3.761 -2.620 5.205
290 2HB ALA 550 1HB ALA 550 4.407 -3.750 4.017
291 3HB ALA 550 3HB ALA 550 5.077 -2.123 4.137
292 H LEU 551 H LEU 551 4.571 -2.041 1.142
293 HA LEU 551 HA LEU 551 3.640 -4.656 -0.043
294 1HB LEU 551 2HB LEU 551 4.410 -2.077 -1.468
295 2HB LEU 551 1HB LEU 551 4.276 -3.623 -2.270
296 HG LEU 551 HG LEU 551 2.025 -3.622 -2.232
297 1HD1 LEU 551 1HD1 LEU 551 2.101 -2.046 0.344
298 2HD1 LEU 551 3HD1 LEU 551 0.618 -2.485 -0.491
299 3HD1 LEU 551 2HD1 LEU 551 1.669 -3.738 0.150
300 1HD2 LEU 551 2HD2 LEU 551 2.997 -1.316 -3.062
301 2HD2 LEU 551 1HD2 LEU 551 1.257 -1.589 -2.987
302 3HD2 LEU 551 3HD2 LEU 551 2.063 -0.690 -1.702
303 H SER 552 H SER 552 5.398 -5.840 -1.163
304 HA SER 552 HA SER 552 8.118 -4.733 -0.658
305 1HB SER 552 2HB SER 552 7.178 -6.773 0.912
306 2HB SER 552 1HB SER 552 7.983 -7.640 -0.397
307 HG SER 552 HG SER 552 9.054 -5.787 1.413
308 H ALA 553 H ALA 553 7.898 -7.982 -1.948
309 HA ALA 553 HA ALA 553 7.661 -7.068 -4.626
310 1HB ALA 553 3HB ALA 553 10.544 -7.664 -3.792
311 2HB ALA 553 2HB ALA 553 10.009 -7.550 -5.444
312 3HB ALA 553 1HB ALA 553 9.930 -6.146 -4.418
313 H ASP 554 H ASP 554 6.842 -8.637 -5.665
314 HA ASP 554 HA ASP 554 6.304 -11.270 -4.970
315 1HB ASP 554 2HB ASP 554 6.230 -11.868 -7.328
316 2HB ASP 554 1HB ASP 554 5.557 -10.254 -7.110
317 H LYS 555 H LYS 555 7.930 -12.005 -3.632
318 HA LYS 555 HA LYS 555 9.791 -13.324 -3.208
319 1HB LYS 555 2HB LYS 555 10.174 -13.555 -6.199
320 2HB LYS 555 1HB LYS 555 10.515 -14.755 -4.949
321 1HG LYS 555 2HG LYS 555 7.776 -13.790 -5.855
322 2HG LYS 555 1HG LYS 555 8.447 -15.415 -6.046
323 1HD LYS 555 2HD LYS 555 7.540 -15.945 -4.056
324 2HD LYS 555 1HD LYS 555 8.633 -14.787 -3.296
325 1HE LYS 555 2HE LYS 555 6.839 -13.537 -2.750
326 2HE LYS 555 1HE LYS 555 6.573 -13.237 -4.470
327 1HZ LYS 555 2HZ LYS 555 5.632 -15.736 -3.210
328 2HZ LYS 555 1HZ LYS 555 4.707 -14.315 -3.103
329 3HZ LYS 555 3HZ LYS 555 5.074 -14.973 -4.622
330 H TYR 556 H TYR 556 11.049 -11.947 -6.276
331 HA TYR 556 HA TYR 556 12.932 -10.600 -6.572
332 1HB TYR 556 2HB TYR 556 10.845 -9.200 -5.023
333 2HB TYR 556 1HB TYR 556 12.414 -8.415 -5.010
334 HD1 TYR 556 HD1 TYR 556 11.625 -10.523 -7.832
335 HD2 TYR 556 HD2 TYR 556 11.327 -6.428 -6.416
336 HE1 TYR 556 HE1 TYR 556 11.292 -9.726 -10.153
337 HE2 TYR 556 HE2 TYR 556 11.066 -5.672 -8.731
338 HH TYR 556 HH TYR 556 11.384 -7.839 -11.483
339 H THR 557 H THR 557 13.442 -8.806 -3.774
340 HA THR 557 HA THR 557 14.918 -11.002 -2.429
341 HB THR 557 HB THR 557 16.516 -8.605 -3.256
342 HG1 THR 557 HG1 THR 557 17.010 -9.603 -5.088
343 1HG2 THR 557 3HG2 THR 557 17.009 -10.629 -1.478
344 2HG2 THR 557 2HG2 THR 557 17.703 -11.284 -2.962
345 3HG2 THR 557 1HG2 THR 557 18.261 -9.732 -2.338
346 H SER 558 H SER 558 16.620 -8.499 -1.402
347 HA SER 558 HA SER 558 15.960 -8.525 1.207
348 1HB SER 558 2HB SER 558 17.048 -6.292 -0.479
349 2HB SER 558 1HB SER 558 16.849 -6.110 1.262
350 HG SER 558 HG SER 558 18.501 -7.856 -0.198
351 H SER 559 H SER 559 15.294 -5.302 0.140
352 HA SER 559 HA SER 559 12.864 -5.374 1.748
353 1HB SER 559 2HB SER 559 13.502 -3.271 2.084
354 2HB SER 559 1HB SER 559 14.620 -3.331 0.731
355 HG SER 559 HG SER 559 12.620 -1.858 0.738
356 H ASP 560 H ASP 560 13.500 -6.191 -1.398
357 HA ASP 560 HA ASP 560 12.008 -6.908 -3.013
358 1HB ASP 560 2HB ASP 560 9.839 -6.007 -1.167
359 2HB ASP 560 1HB ASP 560 9.822 -7.318 -2.300
360 HA PRO 561 HA PRO 561 11.815 -2.723 -4.917
361 1HB PRO 561 2HB PRO 561 12.746 -3.601 -7.332
362 2HB PRO 561 1HB PRO 561 13.760 -3.132 -5.981
363 1HG PRO 561 2HG PRO 561 13.191 -5.804 -7.010
364 2HG PRO 561 1HG PRO 561 14.546 -5.213 -6.056
365 1HD PRO 561 2HD PRO 561 12.337 -6.735 -5.061
366 2HD PRO 561 1HD PRO 561 13.565 -5.963 -4.087
367 H LEU 562 H LEU 562 10.061 -5.530 -6.322
368 HA LEU 562 HA LEU 562 8.809 -3.544 -8.145
369 1HB LEU 562 2HB LEU 562 7.679 -5.364 -9.326
370 2HB LEU 562 1HB LEU 562 9.410 -5.562 -9.363
371 HG LEU 562 HG LEU 562 9.255 -7.612 -8.378
372 1HD1 LEU 562 1HD1 LEU 562 8.617 -6.211 -6.191
373 2HD1 LEU 562 3HD1 LEU 562 7.045 -6.940 -6.497
374 3HD1 LEU 562 2HD1 LEU 562 8.463 -7.953 -6.276
375 1HD2 LEU 562 3HD2 LEU 562 6.600 -6.894 -9.366
376 2HD2 LEU 562 2HD2 LEU 562 7.516 -8.385 -9.581
377 3HD2 LEU 562 1HD2 LEU 562 6.549 -8.146 -8.122
378 H TRP 563 H TRP 563 8.520 -4.298 -5.136
379 HA TRP 563 HA TRP 563 6.697 -4.531 -3.628
380 1HB TRP 563 2HB TRP 563 5.933 -2.111 -5.167
381 2HB TRP 563 1HB TRP 563 5.737 -2.418 -3.439
382 HD1 TRP 563 HD1 TRP 563 8.469 -1.972 -6.074
383 HE1 TRP 563 HE1 TRP 563 10.617 -1.182 -4.898
384 HE3 TRP 563 HE3 TRP 563 6.997 -2.524 -1.335
385 HZ2 TRP 563 HZ2 TRP 563 11.594 -1.000 -2.137
386 HZ3 TRP 563 HZ3 TRP 563 8.521 -2.166 0.574
387 HH2 TRP 563 HH2 TRP 563 10.839 -1.390 0.169
388 H TYR 564 H TYR 564 5.544 -6.140 -3.698
389 HA TYR 564 HA TYR 564 3.020 -6.035 -5.334
390 1HB TYR 564 2HB TYR 564 2.834 -8.486 -4.974
391 2HB TYR 564 1HB TYR 564 4.322 -8.071 -5.819
392 HD1 TYR 564 HD2 TYR 564 4.681 -6.979 -2.519
393 HD2 TYR 564 HD1 TYR 564 4.718 -10.543 -4.839
394 HE1 TYR 564 HE2 TYR 564 5.994 -8.020 -0.797
395 HE2 TYR 564 HE1 TYR 564 6.064 -11.671 -3.079
396 HH TYR 564 HH TYR 564 7.142 -9.860 -0.189
397 H VAL 565 H VAL 565 1.338 -7.653 -3.784
398 HA VAL 565 HA VAL 565 1.657 -7.337 -0.996
399 HB VAL 565 HB VAL 565 1.623 -5.030 -1.100
400 1HG1 VAL 565 2HG1 VAL 565 1.048 -4.887 -3.490
401 2HG1 VAL 565 1HG1 VAL 565 -0.633 -5.204 -3.095
402 3HG1 VAL 565 3HG1 VAL 565 0.137 -3.734 -2.518
403 1HG2 VAL 565 1HG2 VAL 565 -1.183 -6.018 -0.573
404 2HG2 VAL 565 3HG2 VAL 565 0.056 -5.555 0.590
405 3HG2 VAL 565 2HG2 VAL 565 -0.745 -4.324 -0.383
406 H THR 566 H THR 566 -0.062 -7.903 0.247
407 HA THR 566 HA THR 566 -2.693 -8.528 -0.860
408 HB THR 566 HB THR 566 -0.920 -10.814 0.072
409 HG1 THR 566 HG1 THR 566 -0.333 -10.277 -1.984
410 1HG2 THR 566 2HG2 THR 566 -3.741 -10.494 0.015
411 2HG2 THR 566 1HG2 THR 566 -3.322 -11.574 -1.316
412 3HG2 THR 566 3HG2 THR 566 -2.830 -11.972 0.330
413 H VAL 567 H VAL 567 -3.167 -7.050 0.894
414 HA VAL 567 HA VAL 567 -2.810 -8.258 3.614
415 HB VAL 567 HB VAL 567 -3.279 -5.334 3.079
416 1HG1 VAL 567 1HG1 VAL 567 -2.547 -7.061 5.365
417 2HG1 VAL 567 3HG1 VAL 567 -1.605 -5.577 5.229
418 3HG1 VAL 567 2HG1 VAL 567 -3.361 -5.495 5.354
419 1HG2 VAL 567 2HG2 VAL 567 -0.778 -6.944 2.747
420 2HG2 VAL 567 1HG2 VAL 567 -1.336 -5.542 1.833
421 3HG2 VAL 567 3HG2 VAL 567 -0.649 -5.328 3.443
422 H THR 568 H THR 568 -4.609 -7.127 5.148
423 HA THR 568 HA THR 568 -7.202 -7.544 3.730
424 HB THR 568 HB THR 568 -7.974 -7.922 6.213
425 HG1 THR 568 HG1 THR 568 -6.274 -8.753 7.462
426 1HG2 THR 568 1HG2 THR 568 -6.965 -9.607 4.129
427 2HG2 THR 568 3HG2 THR 568 -6.469 -10.279 5.682
428 3HG2 THR 568 2HG2 THR 568 -8.177 -9.986 5.353
429 H LEU 569 H LEU 569 -9.063 -6.387 4.821
430 HA LEU 569 HA LEU 569 -8.506 -3.884 6.226
431 1HB LEU 569 2HB LEU 569 -7.946 -3.179 3.960
432 2HB LEU 569 1HB LEU 569 -9.429 -3.898 3.328
433 HG LEU 569 HG LEU 569 -10.611 -2.319 5.029
434 1HD1 LEU 569 3HD1 LEU 569 -7.836 -1.134 4.830
435 2HD1 LEU 569 2HD1 LEU 569 -9.228 -0.115 5.202
436 3HD1 LEU 569 1HD1 LEU 569 -8.783 -1.446 6.281
437 1HD2 LEU 569 1HD2 LEU 569 -9.498 -1.885 2.329
438 2HD2 LEU 569 3HD2 LEU 569 -11.164 -1.730 2.893
439 3HD2 LEU 569 2HD2 LEU 569 -10.010 -0.414 3.154
440 HA PRO 570 HA PRO 570 -12.571 -5.941 6.899
441 1HB PRO 570 2HB PRO 570 -12.280 -6.135 9.615
442 2HB PRO 570 1HB PRO 570 -11.658 -7.336 8.471
443 1HG PRO 570 2HG PRO 570 -10.163 -5.298 10.043
444 2HG PRO 570 1HG PRO 570 -9.593 -6.833 9.370
445 1HD PRO 570 2HD PRO 570 -9.154 -4.229 8.274
446 2HD PRO 570 1HD PRO 570 -8.778 -5.788 7.505
447 H ALA 571 H ALA 571 -14.241 -4.495 6.791
448 HA ALA 571 HA ALA 571 -14.896 -2.914 9.126
449 1HB ALA 571 3HB ALA 571 -13.174 -1.522 7.784
450 2HB ALA 571 2HB ALA 571 -14.508 -1.243 6.663
451 3HB ALA 571 1HB ALA 571 -14.643 -0.730 8.343
452 H GLY 572 H GLY 572 -15.511 -3.589 5.706
453 1HA GLY 572 2HA GLY 572 -17.558 -4.072 4.643
454 2HA GLY 572 1HA GLY 572 -18.331 -4.043 6.230
455 H GLU 573 H GLU 573 -16.461 -1.484 4.606
456 HA GLU 573 HA GLU 573 -18.843 0.108 4.036
457 1HB GLU 573 2HB GLU 573 -18.294 0.280 6.584
458 2HB GLU 573 1HB GLU 573 -16.960 1.302 6.051
459 1HG GLU 573 2HG GLU 573 -18.527 2.959 6.181
460 2HG GLU 573 1HG GLU 573 -18.994 2.359 4.589
461 H SER 574 H SER 574 -16.856 2.488 4.576
462 HA SER 574 HA SER 574 -15.381 2.185 1.976
463 1HB SER 574 2HB SER 574 -15.999 4.822 3.300
464 2HB SER 574 1HB SER 574 -15.671 4.486 1.602
465 HG SER 574 HG SER 574 -18.017 4.390 3.002
466 H PHE 575 H PHE 575 -13.281 2.527 1.928
467 HA PHE 575 HA PHE 575 -11.871 3.395 4.444
468 1HB PHE 575 2HB PHE 575 -10.661 1.408 2.521
469 2HB PHE 575 1HB PHE 575 -10.318 1.650 4.226
470 HD1 PHE 575 HD1 PHE 575 -13.350 0.757 2.152
471 HD2 PHE 575 HD2 PHE 575 -10.974 -0.102 5.606
472 HE1 PHE 575 HE1 PHE 575 -14.852 -1.117 2.715
473 HE2 PHE 575 HE2 PHE 575 -12.480 -1.975 6.169
474 HZ PHE 575 HZ PHE 575 -14.424 -2.480 4.729
475 H GLU 576 H GLU 576 -10.256 4.992 3.853
476 HA GLU 576 HA GLU 576 -10.395 5.965 1.089
477 1HB GLU 576 2HB GLU 576 -8.569 6.898 3.318
478 2HB GLU 576 1HB GLU 576 -8.712 7.649 1.741
479 1HG GLU 576 2HG GLU 576 -11.235 7.219 3.269
480 2HG GLU 576 1HG GLU 576 -10.157 8.502 3.821
481 H TYR 577 H TYR 577 -8.169 6.301 -0.088
482 HA TYR 577 HA TYR 577 -6.452 3.972 0.535
483 1HB TYR 577 2HB TYR 577 -8.095 4.397 -1.902
484 2HB TYR 577 1HB TYR 577 -6.474 3.737 -2.138
485 HD1 TYR 577 HD2 TYR 577 -9.555 3.256 0.026
486 HD2 TYR 577 HD1 TYR 577 -6.089 1.469 -1.821
487 HE1 TYR 577 HE2 TYR 577 -10.264 1.029 0.807
488 HE2 TYR 577 HE1 TYR 577 -6.832 -0.754 -1.026
489 HH TYR 577 HH TYR 577 -8.221 -1.791 0.502
490 H LYS 578 H LYS 578 -4.666 5.081 1.067
491 HA LYS 578 HA LYS 578 -3.407 6.709 -1.080
492 1HB LYS 578 2HB LYS 578 -3.946 7.497 1.766
493 2HB LYS 578 1HB LYS 578 -2.481 8.086 0.978
494 1HG LYS 578 2HG LYS 578 -4.564 8.415 -0.903
495 2HG LYS 578 1HG LYS 578 -5.201 8.991 0.636
496 1HD LYS 578 2HD LYS 578 -2.440 9.846 0.167
497 2HD LYS 578 1HD LYS 578 -3.557 10.435 -1.064
498 1HE LYS 578 2HE LYS 578 -4.528 10.625 1.728
499 2HE LYS 578 1HE LYS 578 -3.173 11.678 1.323
500 1HZ LYS 578 3HZ LYS 578 -5.134 11.658 -0.739
501 2HZ LYS 578 2HZ LYS 578 -5.818 12.117 0.748
502 3HZ LYS 578 1HZ LYS 578 -4.490 12.972 0.120
503 H PHE 579 H PHE 579 -1.069 6.712 -0.932
504 HA PHE 579 HA PHE 579 0.008 4.392 0.658
505 1HB PHE 579 2HB PHE 579 0.504 3.639 -1.443
506 2HB PHE 579 1HB PHE 579 0.293 5.236 -2.168
507 HD1 PHE 579 HD2 PHE 579 2.012 6.987 -1.646
508 HD2 PHE 579 HD1 PHE 579 2.770 2.825 -1.065
509 HE1 PHE 579 HE2 PHE 579 4.433 7.443 -1.637
510 HE2 PHE 579 HE1 PHE 579 5.204 3.324 -1.023
511 HZ PHE 579 HZ PHE 579 6.016 5.593 -1.340
512 H ILE 580 H ILE 580 2.363 4.510 0.932
513 HA ILE 580 HA ILE 580 3.540 7.175 1.212
514 HB ILE 580 HB ILE 580 3.798 7.107 3.589
515 1HG1 ILE 580 2HG1 ILE 580 3.238 4.262 3.064
516 2HG1 ILE 580 1HG1 ILE 580 4.299 5.026 4.273
517 1HG2 ILE 580 3HG2 ILE 580 1.509 7.742 2.761
518 2HG2 ILE 580 2HG2 ILE 580 1.010 6.068 2.943
519 3HG2 ILE 580 1HG2 ILE 580 1.460 7.004 4.357
520 1HD1 ILE 580 3HD1 ILE 580 1.921 5.758 5.249
521 2HD1 ILE 580 2HD1 ILE 580 1.453 4.237 4.494
522 3HD1 ILE 580 1HD1 ILE 580 2.719 4.265 5.717
523 H ARG 581 H ARG 581 5.723 7.046 0.927
524 HA ARG 581 HA ARG 581 6.913 4.481 0.161
525 1HB ARG 581 2HB ARG 581 7.149 6.930 -0.827
526 2HB ARG 581 1HB ARG 581 8.473 7.017 0.334
527 1HG ARG 581 2HG ARG 581 9.765 5.793 -1.003
528 2HG ARG 581 1HG ARG 581 8.574 4.493 -1.016
529 1HD ARG 581 2HD ARG 581 8.072 4.984 -3.153
530 2HD ARG 581 1HD ARG 581 7.562 6.596 -2.651
531 HE ARG 581 HE ARG 581 9.929 6.041 -4.119
532 1HH1 ARG 581 2HH1 ARG 581 8.426 8.227 -2.001
533 2HH1 ARG 581 1HH1 ARG 581 9.816 9.242 -1.810
534 1HH2 ARG 581 1HH2 ARG 581 11.923 7.146 -3.595
535 2HH2 ARG 581 2HH2 ARG 581 11.796 8.630 -2.712
536 H ILE 582 H ILE 582 7.770 3.180 1.878
537 HA ILE 582 HA ILE 582 9.162 4.705 4.025
538 HB ILE 582 HB ILE 582 7.898 1.978 4.022
539 1HG1 ILE 582 2HG1 ILE 582 6.372 2.927 5.441
540 2HG1 ILE 582 1HG1 ILE 582 7.579 3.952 6.216
541 1HG2 ILE 582 3HG2 ILE 582 10.230 2.897 5.544
542 2HG2 ILE 582 2HG2 ILE 582 8.898 2.367 6.571
543 3HG2 ILE 582 1HG2 ILE 582 9.574 1.269 5.369
544 1HD1 ILE 582 1HD1 ILE 582 6.414 4.408 3.450
545 2HD1 ILE 582 3HD1 ILE 582 5.970 5.307 4.904
546 3HD1 ILE 582 2HD1 ILE 582 7.605 5.433 4.253
547 H GLU 583 H GLU 583 11.260 4.566 4.443
548 HA GLU 583 HA GLU 583 12.813 2.813 2.572
549 1HB GLU 583 2HB GLU 583 13.196 5.357 2.697
550 2HB GLU 583 1HB GLU 583 13.981 5.033 4.243
551 1HG GLU 583 2HG GLU 583 15.707 3.801 3.262
552 2HG GLU 583 1HG GLU 583 14.761 3.440 1.817
553 H SER 584 H SER 584 14.921 1.966 3.498
554 HA SER 584 HA SER 584 14.355 0.434 5.907
555 1HB SER 584 2HB SER 584 16.551 0.580 3.905
556 2HB SER 584 1HB SER 584 16.990 -0.003 5.507
557 HG SER 584 HG SER 584 16.245 -1.812 4.676
558 H ASP 585 H ASP 585 15.970 3.406 5.134
559 HA ASP 585 HA ASP 585 17.279 3.555 7.757
560 1HB ASP 585 2HB ASP 585 17.534 6.019 6.611
561 2HB ASP 585 1HB ASP 585 18.712 4.733 6.436
562 H ASP 586 H ASP 586 14.249 3.598 7.010
563 HA ASP 586 HA ASP 586 12.396 4.454 8.195
564 1HB ASP 586 2HB ASP 586 14.398 5.107 9.907
565 2HB ASP 586 1HB ASP 586 13.860 6.718 9.428
566 H SER 587 H SER 587 11.220 5.305 6.555
567 HA SER 587 HA SER 587 11.507 8.198 5.968
568 1HB SER 587 2HB SER 587 12.751 6.436 4.289
569 2HB SER 587 1HB SER 587 11.129 6.518 3.577
570 HG SER 587 HG SER 587 11.378 8.696 3.322
571 H VAL 588 H VAL 588 9.654 8.978 4.702
572 HA VAL 588 HA VAL 588 7.459 7.171 4.136
573 HB VAL 588 HB VAL 588 7.272 8.927 6.564
574 1HG1 VAL 588 1HG1 VAL 588 5.643 9.821 4.812
575 2HG1 VAL 588 3HG1 VAL 588 4.904 8.212 4.899
576 3HG1 VAL 588 2HG1 VAL 588 4.950 9.259 6.329
577 1HG2 VAL 588 3HG2 VAL 588 7.147 6.248 6.148
578 2HG2 VAL 588 2HG2 VAL 588 6.342 7.065 7.486
579 3HG2 VAL 588 1HG2 VAL 588 5.447 6.704 6.000
580 H GLU 589 H GLU 589 6.787 7.847 2.233
581 HA GLU 589 HA GLU 589 6.593 10.790 1.719
582 1HB GLU 589 2HB GLU 589 8.316 10.098 0.207
583 2HB GLU 589 1HB GLU 589 7.502 8.573 -0.131
584 1HG GLU 589 2HG GLU 589 6.215 9.469 -1.738
585 2HG GLU 589 1HG GLU 589 5.804 10.855 -0.717
586 H TRP 590 H TRP 590 4.340 10.601 2.442
587 HA TRP 590 HA TRP 590 2.574 8.629 1.491
588 1HB TRP 590 2HB TRP 590 2.071 11.436 2.442
589 2HB TRP 590 1HB TRP 590 0.760 10.332 2.005
590 HD1 TRP 590 HD1 TRP 590 3.995 9.218 3.664
591 HE1 TRP 590 HE1 TRP 590 3.466 8.203 5.980
592 HE3 TRP 590 HE3 TRP 590 -0.991 10.136 3.943
593 HZ2 TRP 590 HZ2 TRP 590 1.280 7.868 7.712
594 HZ3 TRP 590 HZ3 TRP 590 -2.222 9.369 5.932
595 HH2 TRP 590 HH2 TRP 590 -1.135 8.260 7.785
596 H GLU 591 H GLU 591 2.975 8.275 -0.752
597 HA GLU 591 HA GLU 591 2.774 10.368 -2.713
598 1HB GLU 591 2HB GLU 591 3.726 8.011 -3.184
599 2HB GLU 591 1HB GLU 591 2.044 7.488 -3.311
600 1HG GLU 591 2HG GLU 591 1.966 9.698 -4.866
601 2HG GLU 591 1HG GLU 591 3.635 9.194 -5.130
602 H SER 592 H SER 592 0.983 11.557 -2.260
603 HA SER 592 HA SER 592 -1.599 10.150 -1.957
604 1HB SER 592 2HB SER 592 -0.881 11.749 -0.205
605 2HB SER 592 1HB SER 592 -0.808 13.029 -1.419
606 HG SER 592 HG SER 592 -2.966 13.029 -1.581
607 H ASP 593 H ASP 593 -0.106 10.625 -4.532
608 HA ASP 593 HA ASP 593 -1.856 12.525 -5.954
609 1HB ASP 593 2HB ASP 593 0.693 11.174 -6.501
610 2HB ASP 593 1HB ASP 593 -0.397 11.186 -7.888
611 HA PRO 594 HA PRO 594 -3.401 8.501 -7.963
612 1HB PRO 594 2HB PRO 594 -2.147 6.135 -7.348
613 2HB PRO 594 1HB PRO 594 -1.651 7.173 -8.696
614 1HG PRO 594 2HG PRO 594 -0.354 6.809 -6.025
615 2HG PRO 594 1HG PRO 594 0.384 7.203 -7.587
616 1HD PRO 594 2HD PRO 594 -0.121 9.052 -5.543
617 2HD PRO 594 1HD PRO 594 0.168 9.450 -7.252
618 H ASN 595 H ASN 595 -4.881 9.179 -6.100
619 HA ASN 595 HA ASN 595 -4.908 7.181 -3.882
620 1HB ASN 595 2HB ASN 595 -6.411 8.834 -2.745
621 2HB ASN 595 1HB ASN 595 -4.810 9.482 -3.104
622 1HD2 ASN 595 2HD2 ASN 595 -8.084 11.114 -4.873
623 2HD2 ASN 595 1HD2 ASN 595 -8.225 9.794 -3.815
624 H ARG 596 H ARG 596 -7.178 6.582 -3.128
625 HA ARG 596 HA ARG 596 -9.320 6.758 -5.110
626 1HB ARG 596 2HB ARG 596 -7.519 4.449 -5.027
627 2HB ARG 596 1HB ARG 596 -9.213 4.002 -4.821
628 1HG ARG 596 2HG ARG 596 -8.165 5.775 -7.047
629 2HG ARG 596 1HG ARG 596 -8.515 4.055 -7.220
630 1HD ARG 596 2HD ARG 596 -10.719 5.566 -6.006
631 2HD ARG 596 1HD ARG 596 -10.331 6.094 -7.644
632 HE ARG 596 HE ARG 596 -10.934 3.237 -6.982
633 1HH1 ARG 596 2HH1 ARG 596 -10.182 3.024 -9.591
634 2HH1 ARG 596 1HH1 ARG 596 -11.500 3.586 -10.564
635 1HH2 ARG 596 1HH2 ARG 596 -13.048 5.274 -7.960
636 2HH2 ARG 596 2HH2 ARG 596 -13.123 4.860 -9.641
637 H GLU 597 H GLU 597 -10.979 4.785 -4.279
638 HA GLU 597 HA GLU 597 -11.064 4.780 -1.310
639 1HB GLU 597 2HB GLU 597 -13.548 5.477 -1.526
640 2HB GLU 597 1HB GLU 597 -12.335 6.750 -1.677
641 1HG GLU 597 2HG GLU 597 -12.768 7.082 -3.892
642 2HG GLU 597 1HG GLU 597 -13.034 5.366 -4.199
643 H TYR 598 H TYR 598 -11.019 2.548 -1.183
644 HA TYR 598 HA TYR 598 -12.548 0.878 -2.993
645 1HB TYR 598 2HB TYR 598 -10.288 0.418 -1.778
646 2HB TYR 598 1HB TYR 598 -11.298 0.045 -0.384
647 HD1 TYR 598 HD2 TYR 598 -13.462 -1.420 -1.124
648 HD2 TYR 598 HD1 TYR 598 -9.608 -1.409 -3.003
649 HE1 TYR 598 HE2 TYR 598 -13.888 -3.710 -1.977
650 HE2 TYR 598 HE1 TYR 598 -10.030 -3.688 -3.884
651 HH TYR 598 HH TYR 598 -12.523 -5.657 -2.724
652 H THR 599 H THR 599 -14.771 1.360 -2.634
653 HA THR 599 HA THR 599 -15.822 1.483 0.096
654 HB THR 599 HB THR 599 -18.054 1.210 -1.339
655 HG1 THR 599 HG1 THR 599 -17.692 1.164 -3.388
656 1HG2 THR 599 1HG2 THR 599 -16.526 3.359 -0.384
657 2HG2 THR 599 3HG2 THR 599 -16.935 3.792 -2.044
658 3HG2 THR 599 2HG2 THR 599 -18.214 3.410 -0.892
659 H VAL 600 H VAL 600 -15.124 -0.570 0.926
660 HA VAL 600 HA VAL 600 -15.964 -2.987 -0.503
661 HB VAL 600 HB VAL 600 -15.028 -3.228 2.306
662 1HG1 VAL 600 1HG1 VAL 600 -14.944 -4.634 -0.269
663 2HG1 VAL 600 3HG1 VAL 600 -13.479 -4.751 0.700
664 3HG1 VAL 600 2HG1 VAL 600 -15.023 -5.285 1.374
665 1HG2 VAL 600 3HG2 VAL 600 -13.591 -1.411 0.837
666 2HG2 VAL 600 2HG2 VAL 600 -12.895 -2.473 2.056
667 3HG2 VAL 600 1HG2 VAL 600 -12.829 -2.929 0.361
668 HA PRO 601 HA PRO 601 -19.853 -2.832 1.724
669 1HB PRO 601 2HB PRO 601 -21.039 -4.818 0.244
670 2HB PRO 601 1HB PRO 601 -20.912 -3.137 -0.303
671 1HG PRO 601 2HG PRO 601 -19.377 -5.525 -1.210
672 2HG PRO 601 1HG PRO 601 -19.739 -4.026 -2.082
673 1HD PRO 601 2HD PRO 601 -17.275 -4.681 -0.839
674 2HD PRO 601 1HD PRO 601 -17.751 -3.084 -1.452
675 H GLN 602 H GLN 602 -21.338 -5.032 2.303
676 HA GLN 602 HA GLN 602 -19.956 -6.327 4.406
677 1HB GLN 602 2HB GLN 602 -22.538 -6.677 3.013
678 2HB GLN 602 1HB GLN 602 -21.911 -8.138 3.775
679 1HG GLN 602 2HG GLN 602 -21.439 -6.387 5.766
680 2HG GLN 602 1HG GLN 602 -22.831 -5.598 5.022
681 1HE2 GLN 602 2HE2 GLN 602 -23.467 -9.462 6.301
682 2HE2 GLN 602 1HE2 GLN 602 -22.011 -9.083 5.515
683 H ALA 603 H ALA 603 -19.922 -8.937 4.367
684 HA ALA 603 HA ALA 603 -17.783 -9.678 2.631
685 1HB ALA 603 2HB ALA 603 -19.719 -11.279 4.309
686 2HB ALA 603 1HB ALA 603 -18.474 -12.060 3.335
687 3HB ALA 603 3HB ALA 603 -18.016 -10.947 4.623
688 H CYS 604 H CYS 604 -21.290 -10.237 2.413
689 HA CYS 604 HA CYS 604 -21.190 -11.878 0.064
690 1HB CYS 604 2HB CYS 604 -23.458 -10.004 0.755
691 2HB CYS 604 1HB CYS 604 -23.543 -11.562 -0.066
692 H GLY 605 H GLY 605 -19.860 -10.968 -1.531
693 1HA GLY 605 2HA GLY 605 -20.763 -9.432 -3.560
694 2HA GLY 605 1HA GLY 605 -20.331 -8.186 -2.389
695 H THR 606 H THR 606 -18.060 -8.183 -1.614
696 HA THR 606 HA THR 606 -16.127 -9.677 -3.278
697 HB THR 606 HB THR 606 -15.161 -7.016 -3.262
698 HG1 THR 606 HG1 THR 606 -17.042 -6.265 -4.658
699 1HG2 THR 606 1HG2 THR 606 -15.546 -9.183 -5.038
700 2HG2 THR 606 3HG2 THR 606 -16.288 -7.777 -5.801
701 3HG2 THR 606 2HG2 THR 606 -14.593 -7.726 -5.316
702 H SER 607 H SER 607 -15.696 -10.613 -1.147
703 HA SER 607 HA SER 607 -14.782 -8.926 1.035
704 1HB SER 607 2HB SER 607 -15.771 -11.291 1.211
705 2HB SER 607 1HB SER 607 -14.189 -11.871 0.699
706 HG SER 607 HG SER 607 -13.294 -10.792 2.487
707 H THR 608 H THR 608 -13.366 -9.883 -1.867
708 HA THR 608 HA THR 608 -10.741 -8.849 -1.035
709 HB THR 608 HB THR 608 -9.475 -10.852 -1.555
710 HG1 THR 608 HG1 THR 608 -10.292 -12.205 -2.898
711 1HG2 THR 608 3HG2 THR 608 -10.446 -10.799 0.723
712 2HG2 THR 608 2HG2 THR 608 -11.856 -11.673 0.129
713 3HG2 THR 608 1HG2 THR 608 -10.271 -12.447 0.126
714 H ALA 609 H ALA 609 -9.953 -7.742 -2.763
715 HA ALA 609 HA ALA 609 -10.706 -8.745 -5.488
716 1HB ALA 609 3HB ALA 609 -12.264 -6.870 -4.593
717 2HB ALA 609 2HB ALA 609 -10.896 -5.802 -4.914
718 3HB ALA 609 1HB ALA 609 -11.622 -6.726 -6.229
719 H THR 610 H THR 610 -9.647 -6.116 -6.593
720 HA THR 610 HA THR 610 -6.738 -6.630 -6.087
721 HB THR 610 HB THR 610 -6.277 -6.376 -8.408
722 HG1 THR 610 HG1 THR 610 -7.486 -5.175 -9.621
723 1HG2 THR 610 2HG2 THR 610 -8.830 -7.956 -8.022
724 2HG2 THR 610 1HG2 THR 610 -7.864 -8.011 -9.497
725 3HG2 THR 610 3HG2 THR 610 -7.176 -8.568 -7.972
726 H VAL 611 H VAL 611 -5.386 -4.792 -6.810
727 HA VAL 611 HA VAL 611 -6.580 -2.115 -6.701
728 HB VAL 611 HB VAL 611 -4.597 -2.667 -4.570
729 1HG1 VAL 611 2HG1 VAL 611 -6.581 -0.687 -5.186
730 2HG1 VAL 611 1HG1 VAL 611 -6.932 -1.382 -3.588
731 3HG1 VAL 611 3HG1 VAL 611 -5.357 -0.633 -3.916
732 1HG2 VAL 611 1HG2 VAL 611 -6.203 -4.593 -4.407
733 2HG2 VAL 611 3HG2 VAL 611 -6.100 -3.575 -2.957
734 3HG2 VAL 611 2HG2 VAL 611 -7.464 -3.390 -4.083
735 H THR 612 H THR 612 -5.267 -2.405 -8.830
736 HA THR 612 HA THR 612 -2.400 -2.795 -8.613
737 HB THR 612 HB THR 612 -2.698 -1.745 -11.082
738 HG1 THR 612 HG1 THR 612 -4.677 -2.301 -11.857
739 1HG2 THR 612 1HG2 THR 612 -3.151 -4.525 -10.039
740 2HG2 THR 612 3HG2 THR 612 -3.031 -4.156 -11.761
741 3HG2 THR 612 2HG2 THR 612 -1.672 -3.815 -10.688
742 H ASP 613 H ASP 613 -0.719 -1.420 -8.866
743 HA ASP 613 HA ASP 613 -1.116 1.342 -9.547
744 1HB ASP 613 2HB ASP 613 0.167 1.223 -6.885
745 2HB ASP 613 1HB ASP 613 -0.959 2.413 -7.534
746 H THR 614 H THR 614 1.084 2.593 -9.175
747 HA THR 614 HA THR 614 3.466 0.950 -9.039
748 HB THR 614 HB THR 614 3.526 0.317 -11.191
749 HG1 THR 614 HG1 THR 614 4.588 1.744 -12.423
750 1HG2 THR 614 1HG2 THR 614 1.353 2.364 -11.529
751 2HG2 THR 614 3HG2 THR 614 2.108 1.637 -12.949
752 3HG2 THR 614 2HG2 THR 614 1.286 0.618 -11.768
753 H TRP 615 H TRP 615 5.386 2.305 -9.884
754 HA TRP 615 HA TRP 615 4.998 4.958 -8.628
755 1HB TRP 615 2HB TRP 615 6.799 2.828 -8.056
756 2HB TRP 615 1HB TRP 615 7.756 4.199 -8.643
757 HD1 TRP 615 HD1 TRP 615 8.399 5.602 -6.688
758 HE1 TRP 615 HE1 TRP 615 7.200 6.674 -4.656
759 HE3 TRP 615 HE3 TRP 615 4.061 3.196 -7.050
760 HZ2 TRP 615 HZ2 TRP 615 4.719 6.445 -3.388
761 HZ3 TRP 615 HZ3 TRP 615 2.251 3.566 -5.427
762 HH2 TRP 615 HH2 TRP 615 2.557 5.140 -3.591
763 H ARG 616 H ARG 616 5.362 6.725 -9.789
764 HA ARG 616 HA ARG 616 6.600 6.395 -12.484
765 1HB ARG 616 2HB ARG 616 4.444 7.992 -11.409
766 2HB ARG 616 1HB ARG 616 5.655 9.037 -12.154
767 1HG ARG 616 2HG ARG 616 5.599 7.513 -14.171
768 2HG ARG 616 1HG ARG 616 4.216 6.701 -13.435
769 1HD ARG 616 2HD ARG 616 4.243 9.693 -13.818
770 2HD ARG 616 1HD ARG 616 3.726 8.611 -15.112
771 HE ARG 616 HE ARG 616 2.170 7.716 -13.102
772 1HH1 ARG 616 1HH2 ARG 616 3.121 10.655 -12.194
773 2HH1 ARG 616 2HH2 ARG 616 1.623 11.487 -12.450
774 1HH2 ARG 616 1HH1 ARG 616 0.184 8.891 -14.242
775 2HH2 ARG 616 2HH1 ARG 616 -0.040 10.488 -13.610
No H/Q in entry = 775
Start of MODEL 5
1 1H CYS 509 1H CYS 509 21.191 19.032 -3.672
2 2H CYS 509 3H CYS 509 20.070 18.496 -2.518
3 3H CYS 509 2H CYS 509 21.709 18.652 -2.099
4 HA CYS 509 HA CYS 509 22.334 16.857 -3.513
5 1HB CYS 509 2HB CYS 509 19.821 16.043 -2.030
6 2HB CYS 509 1HB CYS 509 21.233 15.044 -2.373
7 H THR 510 H THR 510 18.758 16.711 -3.474
8 HA THR 510 HA THR 510 18.382 17.058 -6.267
9 HB THR 510 HB THR 510 17.849 14.281 -6.198
10 HG1 THR 510 HG1 THR 510 19.315 14.110 -4.495
11 1HG2 THR 510 2HG2 THR 510 18.828 16.083 -7.956
12 2HG2 THR 510 1HG2 THR 510 20.323 15.259 -7.515
13 3HG2 THR 510 3HG2 THR 510 18.975 14.341 -8.188
14 H THR 511 H THR 511 17.062 17.707 -3.805
15 HA THR 511 HA THR 511 14.870 17.834 -2.979
16 HB THR 511 HB THR 511 13.752 16.197 -5.193
17 HG1 THR 511 HG1 THR 511 14.065 18.208 -6.503
18 1HG2 THR 511 3HG2 THR 511 13.119 18.658 -3.633
19 2HG2 THR 511 2HG2 THR 511 12.468 18.542 -5.268
20 3HG2 THR 511 1HG2 THR 511 12.075 17.306 -4.073
21 HA PRO 512 HA PRO 512 15.281 13.351 -1.750
22 1HB PRO 512 2HB PRO 512 16.438 13.804 0.702
23 2HB PRO 512 1HB PRO 512 17.368 13.539 -0.784
24 1HG PRO 512 2HG PRO 512 16.892 16.079 0.705
25 2HG PRO 512 1HG PRO 512 18.244 15.633 -0.349
26 1HD PRO 512 2HD PRO 512 16.066 17.298 -1.059
27 2HD PRO 512 1HD PRO 512 17.243 16.581 -2.179
28 H THR 513 H THR 513 13.919 16.252 -0.540
29 HA THR 513 HA THR 513 12.671 15.519 1.856
30 HB THR 513 HB THR 513 10.734 17.019 0.941
31 HG1 THR 513 HG1 THR 513 10.942 17.358 -1.109
32 1HG2 THR 513 1HG2 THR 513 13.595 17.974 1.218
33 2HG2 THR 513 3HG2 THR 513 12.193 19.043 1.212
34 3HG2 THR 513 2HG2 THR 513 12.389 17.855 2.500
35 H ALA 514 H ALA 514 11.361 15.063 -1.449
36 HA ALA 514 HA ALA 514 9.169 13.412 -0.447
37 1HB ALA 514 3HB ALA 514 10.020 14.538 -3.036
38 2HB ALA 514 2HB ALA 514 9.241 12.960 -3.149
39 3HB ALA 514 1HB ALA 514 8.396 14.308 -2.388
40 H VAL 515 H VAL 515 9.136 11.188 -0.325
41 HA VAL 515 HA VAL 515 11.547 9.762 -1.364
42 HB VAL 515 HB VAL 515 9.951 9.277 1.142
43 1HG1 VAL 515 1HG1 VAL 515 11.091 7.309 -0.561
44 2HG1 VAL 515 3HG1 VAL 515 12.197 7.496 0.796
45 3HG1 VAL 515 2HG1 VAL 515 10.505 7.092 1.087
46 1HG2 VAL 515 2HG2 VAL 515 12.175 10.822 0.617
47 2HG2 VAL 515 1HG2 VAL 515 11.756 10.160 2.196
48 3HG2 VAL 515 3HG2 VAL 515 12.889 9.302 1.153
49 H ALA 516 H ALA 516 10.803 8.882 -3.254
50 HA ALA 516 HA ALA 516 8.119 7.748 -3.455
51 1HB ALA 516 2HB ALA 516 9.472 8.773 -5.391
52 2HB ALA 516 1HB ALA 516 10.426 7.290 -5.356
53 3HB ALA 516 3HB ALA 516 8.701 7.219 -5.716
54 H VAL 517 H VAL 517 7.703 5.780 -2.493
55 HA VAL 517 HA VAL 517 10.044 3.930 -2.279
56 HB VAL 517 HB VAL 517 7.670 3.227 -0.722
57 1HG1 VAL 517 3HG1 VAL 517 9.887 2.193 -0.513
58 2HG1 VAL 517 2HG1 VAL 517 10.563 3.747 -0.017
59 3HG1 VAL 517 1HG1 VAL 517 9.368 2.928 1.011
60 1HG2 VAL 517 3HG2 VAL 517 7.603 5.767 -0.626
61 2HG2 VAL 517 2HG2 VAL 517 7.758 4.930 0.925
62 3HG2 VAL 517 1HG2 VAL 517 9.173 5.688 0.179
63 H THR 518 H THR 518 9.723 1.758 -2.952
64 HA THR 518 HA THR 518 7.351 1.387 -4.712
65 HB THR 518 HB THR 518 10.067 0.045 -4.617
66 HG1 THR 518 HG1 THR 518 8.684 1.404 -6.683
67 1HG2 THR 518 2HG2 THR 518 7.486 -0.864 -5.777
68 2HG2 THR 518 1HG2 THR 518 8.910 -1.020 -6.807
69 3HG2 THR 518 3HG2 THR 518 8.871 -1.809 -5.230
70 H PHE 519 H PHE 519 5.821 -0.069 -4.102
71 HA PHE 519 HA PHE 519 6.547 -1.969 -1.920
72 1HB PHE 519 2HB PHE 519 3.690 -1.167 -2.182
73 2HB PHE 519 1HB PHE 519 4.605 -1.599 -0.755
74 HD1 PHE 519 HD2 PHE 519 4.622 1.111 -3.376
75 HD2 PHE 519 HD1 PHE 519 5.044 0.046 0.753
76 HE1 PHE 519 HE2 PHE 519 4.991 3.496 -2.801
77 HE2 PHE 519 HE1 PHE 519 5.412 2.434 1.334
78 HZ PHE 519 HZ PHE 519 5.390 4.142 -0.444
79 H ASP 520 H ASP 520 5.379 -3.935 -1.905
80 HA ASP 520 HA ASP 520 3.844 -4.679 -4.293
81 1HB ASP 520 2HB ASP 520 6.601 -5.633 -3.629
82 2HB ASP 520 1HB ASP 520 5.450 -6.821 -4.220
83 H LEU 521 H LEU 521 2.696 -6.760 -3.845
84 HA LEU 521 HA LEU 521 2.951 -7.922 -1.174
85 1HB LEU 521 2HB LEU 521 1.631 -5.743 -0.918
86 2HB LEU 521 1HB LEU 521 0.352 -6.536 -1.837
87 HG LEU 521 HG LEU 521 1.567 -7.868 0.571
88 1HD1 LEU 521 1HD1 LEU 521 0.229 -5.381 0.650
89 2HD1 LEU 521 3HD1 LEU 521 -0.977 -6.572 1.145
90 3HD1 LEU 521 2HD1 LEU 521 0.549 -6.448 2.015
91 1HD2 LEU 521 2HD2 LEU 521 -1.002 -8.057 -1.015
92 2HD2 LEU 521 1HD2 LEU 521 0.228 -9.300 -0.803
93 3HD2 LEU 521 3HD2 LEU 521 -0.808 -8.842 0.552
94 H THR 522 H THR 522 2.435 -10.048 -1.320
95 HA THR 522 HA THR 522 1.253 -11.021 -3.793
96 HB THR 522 HB THR 522 1.787 -12.593 -1.262
97 HG1 THR 522 HG1 THR 522 3.427 -11.904 -3.460
98 1HG2 THR 522 3HG2 THR 522 1.534 -13.424 -4.166
99 2HG2 THR 522 2HG2 THR 522 1.943 -14.500 -2.830
100 3HG2 THR 522 1HG2 THR 522 0.353 -13.739 -2.895
101 H ALA 523 H ALA 523 -0.833 -11.468 -4.246
102 HA ALA 523 HA ALA 523 -2.764 -12.247 -2.263
103 1HB ALA 523 3HB ALA 523 -2.287 -9.429 -2.410
104 2HB ALA 523 2HB ALA 523 -3.900 -9.741 -3.021
105 3HB ALA 523 1HB ALA 523 -3.463 -10.288 -1.405
106 H THR 524 H THR 524 -4.943 -10.838 -3.904
107 HA THR 524 HA THR 524 -4.723 -11.611 -6.640
108 HB THR 524 HB THR 524 -4.421 -13.856 -6.182
109 HG1 THR 524 HG1 THR 524 -6.280 -14.770 -6.715
110 1HG2 THR 524 2HG2 THR 524 -5.248 -12.954 -3.612
111 2HG2 THR 524 1HG2 THR 524 -6.198 -14.399 -4.004
112 3HG2 THR 524 3HG2 THR 524 -4.433 -14.466 -4.025
113 H THR 525 H THR 525 -6.255 -10.280 -7.468
114 HA THR 525 HA THR 525 -8.982 -10.683 -6.224
115 HB THR 525 HB THR 525 -7.852 -8.486 -5.545
116 HG1 THR 525 HG1 THR 525 -10.183 -9.177 -5.626
117 1HG2 THR 525 1HG2 THR 525 -7.544 -8.212 -8.277
118 2HG2 THR 525 3HG2 THR 525 -8.954 -7.208 -7.946
119 3HG2 THR 525 2HG2 THR 525 -7.442 -6.895 -7.108
120 H THR 526 H THR 526 -10.153 -8.619 -8.006
121 HA THR 526 HA THR 526 -10.250 -10.252 -10.496
122 HB THR 526 HB THR 526 -12.332 -10.323 -9.353
123 HG1 THR 526 HG1 THR 526 -12.219 -9.557 -11.672
124 1HG2 THR 526 2HG2 THR 526 -12.050 -7.317 -9.053
125 2HG2 THR 526 1HG2 THR 526 -13.516 -8.208 -8.648
126 3HG2 THR 526 3HG2 THR 526 -12.025 -8.511 -7.757
127 H TYR 527 H TYR 527 -8.258 -8.455 -10.513
128 HA TYR 527 HA TYR 527 -7.423 -6.427 -11.404
129 1HB TYR 527 2HB TYR 527 -8.234 -8.154 -13.304
130 2HB TYR 527 1HB TYR 527 -9.289 -6.804 -13.683
131 HD1 TYR 527 HD2 TYR 527 -8.240 -4.497 -14.143
132 HD2 TYR 527 HD1 TYR 527 -5.916 -8.079 -13.774
133 HE1 TYR 527 HE2 TYR 527 -6.275 -3.357 -15.149
134 HE2 TYR 527 HE1 TYR 527 -3.990 -6.979 -14.710
135 HH TYR 527 HH TYR 527 -3.129 -5.001 -15.396
136 H GLY 528 H GLY 528 -9.702 -5.942 -9.639
137 1HA GLY 528 2HA GLY 528 -10.664 -3.432 -10.918
138 2HA GLY 528 1HA GLY 528 -11.857 -4.541 -10.246
139 H GLU 529 H GLU 529 -10.866 -5.310 -7.849
140 HA GLU 529 HA GLU 529 -11.256 -3.000 -6.204
141 1HB GLU 529 2HB GLU 529 -10.813 -4.394 -4.344
142 2HB GLU 529 1HB GLU 529 -11.609 -5.418 -5.531
143 1HG GLU 529 2HG GLU 529 -9.475 -6.329 -6.232
144 2HG GLU 529 1HG GLU 529 -8.623 -5.249 -5.131
145 H ASN 530 H ASN 530 -9.216 -3.363 -4.231
146 HA ASN 530 HA ASN 530 -6.645 -2.848 -5.574
147 1HB ASN 530 2HB ASN 530 -8.195 -0.672 -5.414
148 2HB ASN 530 1HB ASN 530 -7.533 -0.645 -3.778
149 1HD2 ASN 530 2HD2 ASN 530 -4.326 0.369 -4.815
150 2HD2 ASN 530 1HD2 ASN 530 -5.328 -0.059 -3.517
151 H ILE 531 H ILE 531 -4.960 -3.245 -4.279
152 HA ILE 531 HA ILE 531 -5.531 -3.719 -1.370
153 HB ILE 531 HB ILE 531 -4.862 -5.725 -3.065
154 1HG1 ILE 531 2HG1 ILE 531 -4.004 -5.296 -0.213
155 2HG1 ILE 531 1HG1 ILE 531 -5.422 -6.150 -0.803
156 1HG2 ILE 531 3HG2 ILE 531 -2.232 -4.569 -2.093
157 2HG2 ILE 531 2HG2 ILE 531 -2.418 -6.174 -2.788
158 3HG2 ILE 531 1HG2 ILE 531 -2.744 -4.744 -3.764
159 1HD1 ILE 531 2HD1 ILE 531 -3.066 -7.295 -2.023
160 2HD1 ILE 531 1HD1 ILE 531 -2.865 -7.241 -0.249
161 3HD1 ILE 531 3HD1 ILE 531 -4.263 -8.048 -0.963
162 H TYR 532 H TYR 532 -4.370 -2.159 -0.225
163 HA TYR 532 HA TYR 532 -1.687 -1.483 -1.150
164 1HB TYR 532 2HB TYR 532 -2.176 0.920 -1.249
165 2HB TYR 532 1HB TYR 532 -2.894 -0.004 -2.533
166 HD1 TYR 532 HD2 TYR 532 -5.474 -0.939 -1.510
167 HD2 TYR 532 HD1 TYR 532 -3.296 2.725 -0.694
168 HE1 TYR 532 HE2 TYR 532 -7.583 0.201 -0.884
169 HE2 TYR 532 HE1 TYR 532 -5.441 3.833 -0.084
170 HH TYR 532 HH TYR 532 -8.400 2.694 -0.885
171 H LEU 533 H LEU 533 -1.364 0.938 0.359
172 HA LEU 533 HA LEU 533 -2.253 -0.003 2.998
173 1HB LEU 533 2HB LEU 533 -0.093 -0.013 4.004
174 2HB LEU 533 1HB LEU 533 0.008 -0.982 2.544
175 HG LEU 533 HG LEU 533 0.670 1.878 2.217
176 1HD1 LEU 533 1HD1 LEU 533 1.687 0.719 4.457
177 2HD1 LEU 533 3HD1 LEU 533 2.915 0.312 3.256
178 3HD1 LEU 533 2HD1 LEU 533 2.485 2.002 3.541
179 1HD2 LEU 533 2HD2 LEU 533 1.756 -0.780 1.297
180 2HD2 LEU 533 1HD2 LEU 533 0.935 0.441 0.326
181 3HD2 LEU 533 3HD2 LEU 533 2.564 0.744 0.931
182 H VAL 534 H VAL 534 -3.054 1.441 4.118
183 HA VAL 534 HA VAL 534 -2.704 4.286 3.568
184 HB VAL 534 HB VAL 534 -4.879 3.190 4.337
185 1HG1 VAL 534 1HG1 VAL 534 -3.536 1.883 6.179
186 2HG1 VAL 534 3HG1 VAL 534 -3.858 3.358 7.104
187 3HG1 VAL 534 2HG1 VAL 534 -5.197 2.422 6.452
188 1HG2 VAL 534 3HG2 VAL 534 -3.743 5.587 5.482
189 2HG2 VAL 534 2HG2 VAL 534 -5.353 5.303 4.861
190 3HG2 VAL 534 1HG2 VAL 534 -4.971 4.827 6.517
191 H GLY 535 H GLY 535 -0.539 4.721 4.002
192 1HA GLY 535 2HA GLY 535 0.708 3.618 6.458
193 2HA GLY 535 1HA GLY 535 1.554 4.577 5.219
194 H SER 536 H SER 536 1.541 4.990 8.116
195 HA SER 536 HA SER 536 -0.274 7.193 8.878
196 1HB SER 536 2HB SER 536 0.285 5.636 10.524
197 2HB SER 536 1HB SER 536 1.998 5.735 10.190
198 HG SER 536 HG SER 536 0.948 6.965 12.069
199 H ILE 537 H ILE 537 1.299 8.270 6.720
200 HA ILE 537 HA ILE 537 2.896 10.116 8.264
201 HB ILE 537 HB ILE 537 2.981 9.916 5.293
202 1HG1 ILE 537 2HG1 ILE 537 4.092 8.160 7.374
203 2HG1 ILE 537 1HG1 ILE 537 3.760 7.815 5.691
204 1HG2 ILE 537 1HG2 ILE 537 4.182 11.656 7.223
205 2HG2 ILE 537 3HG2 ILE 537 5.442 10.789 6.351
206 3HG2 ILE 537 2HG2 ILE 537 4.251 11.728 5.468
207 1HD1 ILE 537 1HD1 ILE 537 5.930 9.591 5.637
208 2HD1 ILE 537 3HD1 ILE 537 6.276 8.481 6.958
209 3HD1 ILE 537 2HD1 ILE 537 5.970 7.856 5.340
210 H SER 538 H SER 538 2.660 12.321 8.146
211 HA SER 538 HA SER 538 0.068 13.310 8.136
212 1HB SER 538 2HB SER 538 2.710 14.555 7.613
213 2HB SER 538 1HB SER 538 1.315 15.488 7.079
214 HG SER 538 HG SER 538 2.226 14.976 9.593
215 H GLN 539 H GLN 539 1.897 12.440 5.313
216 HA GLN 539 HA GLN 539 -0.153 13.540 3.484
217 1HB GLN 539 2HB GLN 539 2.518 13.581 3.126
218 2HB GLN 539 1HB GLN 539 2.206 11.952 2.525
219 1HG GLN 539 2HG GLN 539 0.417 12.936 1.038
220 2HG GLN 539 1HG GLN 539 0.979 14.535 1.526
221 1HE2 GLN 539 2HE2 GLN 539 3.466 12.219 -0.802
222 2HE2 GLN 539 1HE2 GLN 539 2.318 11.456 0.190
223 H LEU 540 H LEU 540 1.596 10.699 4.529
224 HA LEU 540 HA LEU 540 -0.242 8.844 3.272
225 1HB LEU 540 2HB LEU 540 2.315 8.641 4.637
226 2HB LEU 540 1HB LEU 540 1.202 7.426 5.202
227 HG LEU 540 HG LEU 540 2.114 7.912 2.373
228 1HD1 LEU 540 3HD1 LEU 540 2.689 5.991 4.530
229 2HD1 LEU 540 2HD1 LEU 540 2.301 5.221 2.988
230 3HD1 LEU 540 1HD1 LEU 540 3.633 6.379 3.086
231 1HD2 LEU 540 1HD2 LEU 540 -0.389 6.776 3.394
232 2HD2 LEU 540 3HD2 LEU 540 0.043 7.236 1.747
233 3HD2 LEU 540 2HD2 LEU 540 0.506 5.652 2.369
234 H GLY 541 H GLY 541 -2.098 9.550 4.158
235 1HA GLY 541 2HA GLY 541 -2.708 9.836 6.927
236 2HA GLY 541 1HA GLY 541 -3.896 9.851 5.619
237 H ASP 542 H ASP 542 -1.702 7.673 7.205
238 HA ASP 542 HA ASP 542 -2.605 5.088 6.614
239 1HB ASP 542 2HB ASP 542 -0.753 5.745 8.115
240 2HB ASP 542 1HB ASP 542 -1.876 5.981 9.343
241 H TRP 543 H TRP 543 -4.201 7.447 8.238
242 HA TRP 543 HA TRP 543 -6.048 5.503 9.398
243 1HB TRP 543 2HB TRP 543 -5.357 8.236 10.416
244 2HB TRP 543 1HB TRP 543 -6.000 6.858 11.299
245 HD1 TRP 543 HD1 TRP 543 -2.717 8.539 10.859
246 HE1 TRP 543 HE1 TRP 543 -0.808 7.046 11.532
247 HE3 TRP 543 HE3 TRP 543 -4.964 3.938 10.536
248 HZ2 TRP 543 HZ2 TRP 543 -0.194 4.326 11.781
249 HZ3 TRP 543 HZ3 TRP 543 -3.598 1.907 10.947
250 HH2 TRP 543 HH2 TRP 543 -1.223 2.095 11.578
251 H GLU 544 H GLU 544 -6.127 6.336 6.886
252 HA GLU 544 HA GLU 544 -8.734 7.060 6.301
253 1HB GLU 544 2HB GLU 544 -7.998 9.344 7.153
254 2HB GLU 544 1HB GLU 544 -6.819 9.361 5.845
255 1HG GLU 544 2HG GLU 544 -8.471 9.400 4.173
256 2HG GLU 544 1HG GLU 544 -9.734 8.865 5.286
257 H THR 545 H THR 545 -8.320 5.371 4.826
258 HA THR 545 HA THR 545 -6.052 4.969 3.286
259 HB THR 545 HB THR 545 -7.646 3.992 1.526
260 HG1 THR 545 HG1 THR 545 -9.548 4.794 3.467
261 1HG2 THR 545 2HG2 THR 545 -6.935 3.080 4.049
262 2HG2 THR 545 1HG2 THR 545 -8.678 2.826 3.986
263 3HG2 THR 545 3HG2 THR 545 -7.637 2.104 2.761
264 H SER 546 H SER 546 -8.297 7.607 3.043
265 HA SER 546 HA SER 546 -8.332 8.327 0.366
266 1HB SER 546 2HB SER 546 -7.823 10.272 2.627
267 2HB SER 546 1HB SER 546 -8.603 10.615 1.086
268 HG SER 546 HG SER 546 -10.336 9.417 1.697
269 H ASP 547 H ASP 547 -5.527 8.211 2.415
270 HA ASP 547 HA ASP 547 -3.933 9.240 0.133
271 1HB ASP 547 2HB ASP 547 -3.531 10.129 3.002
272 2HB ASP 547 1HB ASP 547 -2.588 10.647 1.604
273 H GLY 548 H GLY 548 -4.168 6.501 0.818
274 1HA GLY 548 2HA GLY 548 -1.782 5.845 2.420
275 2HA GLY 548 1HA GLY 548 -2.927 4.686 1.725
276 H ILE 549 H ILE 549 -2.016 3.528 0.181
277 HA ILE 549 HA ILE 549 -0.734 4.855 -2.037
278 HB ILE 549 HB ILE 549 1.257 3.050 -1.740
279 1HG1 ILE 549 2HG1 ILE 549 0.413 3.881 1.048
280 2HG1 ILE 549 1HG1 ILE 549 0.437 2.238 0.406
281 1HG2 ILE 549 1HG2 ILE 549 1.288 5.636 -1.981
282 2HG2 ILE 549 3HG2 ILE 549 1.419 5.649 -0.223
283 3HG2 ILE 549 2HG2 ILE 549 2.668 4.860 -1.192
284 1HD1 ILE 549 3HD1 ILE 549 2.882 2.400 0.087
285 2HD1 ILE 549 2HD1 ILE 549 2.855 4.037 0.742
286 3HD1 ILE 549 1HD1 ILE 549 2.443 2.668 1.774
287 H ALA 550 H ALA 550 -2.532 3.989 -3.020
288 HA ALA 550 HA ALA 550 -3.442 1.379 -3.173
289 1HB ALA 550 2HB ALA 550 -4.596 3.310 -3.933
290 2HB ALA 550 1HB ALA 550 -3.452 3.501 -5.267
291 3HB ALA 550 3HB ALA 550 -4.524 2.099 -5.216
292 H LEU 551 H LEU 551 -2.907 -0.505 -4.212
293 HA LEU 551 HA LEU 551 -0.676 -0.504 -6.264
294 1HB LEU 551 2HB LEU 551 -1.464 -2.773 -4.384
295 2HB LEU 551 1HB LEU 551 -0.196 -2.829 -5.574
296 HG LEU 551 HG LEU 551 1.279 -1.792 -4.234
297 1HD1 LEU 551 3HD1 LEU 551 -0.969 -0.230 -2.975
298 2HD1 LEU 551 2HD1 LEU 551 0.747 0.003 -2.649
299 3HD1 LEU 551 1HD1 LEU 551 0.097 0.362 -4.245
300 1HD2 LEU 551 2HD2 LEU 551 -0.758 -3.122 -2.579
301 2HD2 LEU 551 1HD2 LEU 551 0.983 -3.387 -2.653
302 3HD2 LEU 551 3HD2 LEU 551 0.335 -2.053 -1.700
303 H SER 552 H SER 552 -1.180 -1.626 -8.182
304 HA SER 552 HA SER 552 -3.639 -3.304 -8.027
305 1HB SER 552 2HB SER 552 -3.797 -0.955 -9.463
306 2HB SER 552 1HB SER 552 -3.325 -2.167 -10.660
307 HG SER 552 HG SER 552 -5.665 -1.879 -10.143
308 H ALA 553 H ALA 553 -1.954 -2.828 -11.136
309 HA ALA 553 HA ALA 553 -0.679 -5.418 -10.532
310 1HB ALA 553 1HB ALA 553 -3.018 -5.158 -12.037
311 2HB ALA 553 3HB ALA 553 -1.738 -5.452 -13.210
312 3HB ALA 553 2HB ALA 553 -2.006 -6.584 -11.903
313 H ASP 554 H ASP 554 1.264 -5.599 -11.041
314 HA ASP 554 HA ASP 554 2.605 -3.902 -13.070
315 1HB ASP 554 2HB ASP 554 4.661 -4.914 -12.353
316 2HB ASP 554 1HB ASP 554 3.746 -4.621 -10.887
317 H LYS 555 H LYS 555 0.479 -5.999 -13.715
318 HA LYS 555 HA LYS 555 0.148 -7.428 -15.553
319 1HB LYS 555 2HB LYS 555 3.026 -7.173 -16.330
320 2HB LYS 555 1HB LYS 555 1.593 -7.143 -17.353
321 1HG LYS 555 2HG LYS 555 1.518 -4.871 -17.284
322 2HG LYS 555 1HG LYS 555 1.625 -4.825 -15.523
323 1HD LYS 555 2HD LYS 555 4.174 -5.623 -16.350
324 2HD LYS 555 1HD LYS 555 3.706 -4.380 -17.512
325 1HE LYS 555 2HE LYS 555 3.003 -2.953 -15.523
326 2HE LYS 555 1HE LYS 555 3.802 -4.141 -14.492
327 1HZ LYS 555 2HZ LYS 555 5.696 -3.703 -16.304
328 2HZ LYS 555 1HZ LYS 555 4.950 -2.177 -16.295
329 3HZ LYS 555 3HZ LYS 555 5.570 -2.824 -14.856
330 H TYR 556 H TYR 556 -0.071 -9.303 -14.071
331 HA TYR 556 HA TYR 556 2.469 -10.881 -13.773
332 1HB TYR 556 2HB TYR 556 0.338 -11.841 -12.036
333 2HB TYR 556 1HB TYR 556 1.943 -11.344 -11.581
334 HD1 TYR 556 HD2 TYR 556 1.328 -8.387 -12.665
335 HD2 TYR 556 HD1 TYR 556 -0.626 -10.957 -9.831
336 HE1 TYR 556 HE2 TYR 556 0.041 -6.573 -11.763
337 HE2 TYR 556 HE1 TYR 556 -1.848 -9.151 -9.034
338 HH TYR 556 HH TYR 556 -2.142 -7.039 -8.994
339 H THR 557 H THR 557 -1.065 -11.304 -13.990
340 HA THR 557 HA THR 557 -0.951 -13.193 -16.134
341 HB THR 557 HB THR 557 -1.690 -14.318 -13.440
342 HG1 THR 557 HG1 THR 557 0.403 -15.013 -15.202
343 1HG2 THR 557 2HG2 THR 557 -1.801 -15.401 -16.250
344 2HG2 THR 557 1HG2 THR 557 -1.759 -16.455 -14.837
345 3HG2 THR 557 3HG2 THR 557 -3.100 -15.332 -15.060
346 H SER 558 H SER 558 -3.366 -13.581 -13.702
347 HA SER 558 HA SER 558 -5.463 -12.814 -15.579
348 1HB SER 558 2HB SER 558 -5.914 -14.863 -14.697
349 2HB SER 558 1HB SER 558 -5.372 -14.416 -13.082
350 HG SER 558 HG SER 558 -7.782 -14.551 -13.711
351 H SER 559 H SER 559 -4.748 -11.232 -12.219
352 HA SER 559 HA SER 559 -6.787 -9.272 -13.085
353 1HB SER 559 2HB SER 559 -7.363 -10.044 -10.370
354 2HB SER 559 1HB SER 559 -8.429 -9.958 -11.761
355 HG SER 559 HG SER 559 -8.364 -12.071 -11.365
356 H ASP 560 H ASP 560 -5.712 -9.698 -9.724
357 HA ASP 560 HA ASP 560 -3.940 -7.237 -9.892
358 1HB ASP 560 2HB ASP 560 -6.533 -6.992 -9.161
359 2HB ASP 560 1HB ASP 560 -5.773 -7.278 -7.593
360 HA PRO 561 HA PRO 561 -3.343 -10.656 -6.173
361 1HB PRO 561 2HB PRO 561 -1.653 -12.427 -7.453
362 2HB PRO 561 1HB PRO 561 -3.373 -12.668 -7.120
363 1HG PRO 561 2HG PRO 561 -2.099 -11.674 -9.633
364 2HG PRO 561 1HG PRO 561 -3.462 -12.726 -9.411
365 1HD PRO 561 2HD PRO 561 -3.744 -10.228 -10.133
366 2HD PRO 561 1HD PRO 561 -4.896 -11.037 -9.045
367 H LEU 562 H LEU 562 -0.365 -10.079 -8.242
368 HA LEU 562 HA LEU 562 1.102 -10.120 -5.753
369 1HB LEU 562 2HB LEU 562 3.070 -9.341 -7.091
370 2HB LEU 562 1HB LEU 562 2.338 -10.809 -7.718
371 HG LEU 562 HG LEU 562 1.427 -9.704 -9.580
372 1HD1 LEU 562 2HD1 LEU 562 1.877 -7.116 -8.052
373 2HD1 LEU 562 1HD1 LEU 562 1.480 -7.149 -9.759
374 3HD1 LEU 562 3HD1 LEU 562 0.346 -7.798 -8.581
375 1HD2 LEU 562 3HD2 LEU 562 4.109 -9.571 -9.102
376 2HD2 LEU 562 2HD2 LEU 562 3.349 -9.149 -10.637
377 3HD2 LEU 562 1HD2 LEU 562 3.737 -7.886 -9.468
378 H TRP 563 H TRP 563 -0.864 -7.895 -7.229
379 HA TRP 563 HA TRP 563 -0.998 -5.538 -7.208
380 1HB TRP 563 2HB TRP 563 -0.465 -5.863 -4.286
381 2HB TRP 563 1HB TRP 563 -1.542 -4.721 -5.093
382 HD1 TRP 563 HD1 TRP 563 -1.121 -8.508 -4.885
383 HE1 TRP 563 HE1 TRP 563 -3.469 -9.648 -4.704
384 HE3 TRP 563 HE3 TRP 563 -4.009 -4.378 -5.309
385 HZ2 TRP 563 HZ2 TRP 563 -6.181 -8.788 -4.767
386 HZ3 TRP 563 HZ3 TRP 563 -6.476 -4.585 -5.263
387 HH2 TRP 563 HH2 TRP 563 -7.542 -6.765 -4.994
388 H TYR 564 H TYR 564 0.606 -4.461 -8.239
389 HA TYR 564 HA TYR 564 3.192 -4.029 -6.794
390 1HB TYR 564 2HB TYR 564 4.060 -3.192 -8.905
391 2HB TYR 564 1HB TYR 564 3.197 -4.699 -9.207
392 HD1 TYR 564 HD1 TYR 564 0.579 -2.810 -8.504
393 HD2 TYR 564 HD2 TYR 564 3.561 -2.943 -11.548
394 HE1 TYR 564 HE1 TYR 564 -0.916 -1.648 -9.943
395 HE2 TYR 564 HE2 TYR 564 2.022 -1.768 -13.088
396 HH TYR 564 HH TYR 564 -1.081 -1.555 -12.777
397 H VAL 565 H VAL 565 4.132 -1.627 -7.097
398 HA VAL 565 HA VAL 565 2.224 0.490 -7.408
399 HB VAL 565 HB VAL 565 1.281 -0.369 -5.360
400 1HG1 VAL 565 1HG1 VAL 565 4.141 -0.229 -4.526
401 2HG1 VAL 565 3HG1 VAL 565 2.897 -0.017 -3.302
402 3HG1 VAL 565 2HG1 VAL 565 2.982 -1.516 -4.235
403 1HG2 VAL 565 2HG2 VAL 565 1.334 2.091 -5.730
404 2HG2 VAL 565 1HG2 VAL 565 1.399 1.682 -4.016
405 3HG2 VAL 565 3HG2 VAL 565 2.868 2.164 -4.862
406 H THR 566 H THR 566 2.998 2.549 -6.954
407 HA THR 566 HA THR 566 5.757 2.931 -5.998
408 HB THR 566 HB THR 566 5.025 3.830 -8.801
409 HG1 THR 566 HG1 THR 566 6.286 2.131 -9.503
410 1HG2 THR 566 1HG2 THR 566 7.142 4.443 -6.947
411 2HG2 THR 566 3HG2 THR 566 7.815 3.627 -8.359
412 3HG2 THR 566 2HG2 THR 566 6.864 5.099 -8.561
413 H VAL 567 H VAL 567 5.047 4.413 -4.452
414 HA VAL 567 HA VAL 567 3.546 6.780 -5.515
415 HB VAL 567 HB VAL 567 3.338 6.031 -2.630
416 1HG1 VAL 567 2HG1 VAL 567 2.083 7.803 -4.502
417 2HG1 VAL 567 1HG1 VAL 567 0.870 6.668 -3.911
418 3HG1 VAL 567 3HG1 VAL 567 1.784 7.654 -2.770
419 1HG2 VAL 567 2HG2 VAL 567 2.440 4.360 -4.897
420 2HG2 VAL 567 1HG2 VAL 567 2.661 3.930 -3.201
421 3HG2 VAL 567 3HG2 VAL 567 1.181 4.735 -3.720
422 H THR 568 H THR 568 3.715 8.439 -3.311
423 HA THR 568 HA THR 568 6.663 8.783 -2.956
424 HB THR 568 HB THR 568 5.849 11.312 -2.749
425 HG1 THR 568 HG1 THR 568 4.007 11.693 -3.714
426 1HG2 THR 568 1HG2 THR 568 6.914 9.638 -4.847
427 2HG2 THR 568 3HG2 THR 568 5.911 10.912 -5.540
428 3HG2 THR 568 2HG2 THR 568 7.267 11.330 -4.493
429 H LEU 569 H LEU 569 7.227 10.102 -1.014
430 HA LEU 569 HA LEU 569 5.254 10.365 1.118
431 1HB LEU 569 2HB LEU 569 5.782 7.915 1.159
432 2HB LEU 569 1HB LEU 569 7.485 8.309 1.393
433 HG LEU 569 HG LEU 569 6.094 7.724 3.480
434 1HD1 LEU 569 1HD1 LEU 569 8.348 9.105 3.148
435 2HD1 LEU 569 3HD1 LEU 569 7.362 10.410 3.809
436 3HD1 LEU 569 2HD1 LEU 569 7.611 8.930 4.734
437 1HD2 LEU 569 3HD2 LEU 569 4.380 9.641 2.495
438 2HD2 LEU 569 2HD2 LEU 569 4.397 9.102 4.169
439 3HD2 LEU 569 1HD2 LEU 569 5.281 10.560 3.698
440 HA PRO 570 HA PRO 570 8.763 13.278 1.335
441 1HB PRO 570 2HB PRO 570 7.182 15.497 1.632
442 2HB PRO 570 1HB PRO 570 7.598 14.794 0.059
443 1HG PRO 570 2HG PRO 570 5.008 14.708 1.519
444 2HG PRO 570 1HG PRO 570 5.324 14.529 -0.214
445 1HD PRO 570 2HD PRO 570 4.806 12.428 1.655
446 2HD PRO 570 1HD PRO 570 5.303 12.249 -0.042
447 H ALA 571 H ALA 571 9.672 13.016 3.396
448 HA ALA 571 HA ALA 571 8.585 14.627 5.552
449 1HB ALA 571 3HB ALA 571 8.464 11.617 5.779
450 2HB ALA 571 2HB ALA 571 8.405 12.695 7.172
451 3HB ALA 571 1HB ALA 571 7.141 12.765 5.950
452 H GLY 572 H GLY 572 10.018 13.464 7.723
453 1HA GLY 572 2HA GLY 572 12.803 13.083 6.791
454 2HA GLY 572 1HA GLY 572 12.493 14.550 7.710
455 H GLU 573 H GLU 573 11.029 11.372 8.252
456 HA GLU 573 HA GLU 573 12.686 10.725 10.560
457 1HB GLU 573 2HB GLU 573 10.947 12.598 11.232
458 2HB GLU 573 1HB GLU 573 9.816 11.245 11.257
459 1HG GLU 573 2HG GLU 573 10.557 10.980 13.395
460 2HG GLU 573 1HG GLU 573 11.918 10.170 12.620
461 H SER 574 H SER 574 10.122 9.378 11.710
462 HA SER 574 HA SER 574 9.699 7.349 9.569
463 1HB SER 574 2HB SER 574 10.086 5.501 11.068
464 2HB SER 574 1HB SER 574 11.478 6.570 11.209
465 HG SER 574 HG SER 574 10.779 7.245 13.144
466 H PHE 575 H PHE 575 7.489 7.336 9.178
467 HA PHE 575 HA PHE 575 5.706 8.022 11.476
468 1HB PHE 575 2HB PHE 575 5.423 8.130 8.570
469 2HB PHE 575 1HB PHE 575 3.987 7.584 9.431
470 HD1 PHE 575 HD1 PHE 575 3.729 8.947 11.820
471 HD2 PHE 575 HD2 PHE 575 5.482 10.453 8.217
472 HE1 PHE 575 HE1 PHE 575 3.249 11.265 12.558
473 HE2 PHE 575 HE2 PHE 575 5.002 12.774 8.941
474 HZ PHE 575 HZ PHE 575 3.885 13.180 11.117
475 H GLU 576 H GLU 576 3.411 6.581 10.934
476 HA GLU 576 HA GLU 576 4.336 3.844 11.666
477 1HB GLU 576 2HB GLU 576 1.912 5.417 12.156
478 2HB GLU 576 1HB GLU 576 1.603 3.725 11.772
479 1HG GLU 576 2HG GLU 576 3.840 3.901 13.570
480 2HG GLU 576 1HG GLU 576 2.488 4.818 14.237
481 H TYR 577 H TYR 577 2.791 2.026 10.723
482 HA TYR 577 HA TYR 577 2.151 2.581 7.889
483 1HB TYR 577 2HB TYR 577 4.437 0.945 8.803
484 2HB TYR 577 1HB TYR 577 3.452 0.241 7.521
485 HD1 TYR 577 HD2 TYR 577 5.275 3.383 8.488
486 HD2 TYR 577 HD1 TYR 577 3.599 0.999 5.329
487 HE1 TYR 577 HE2 TYR 577 6.233 4.908 6.813
488 HE2 TYR 577 HE1 TYR 577 4.567 2.540 3.648
489 HH TYR 577 HH TYR 577 5.291 5.209 3.818
490 H LYS 578 H LYS 578 0.173 1.813 7.596
491 HA LYS 578 HA LYS 578 -0.516 -0.865 8.724
492 1HB LYS 578 2HB LYS 578 -1.615 1.341 9.780
493 2HB LYS 578 1HB LYS 578 -2.678 1.167 8.383
494 1HG LYS 578 2HG LYS 578 -3.835 -0.276 9.698
495 2HG LYS 578 1HG LYS 578 -2.548 -1.415 9.300
496 1HD LYS 578 2HD LYS 578 -2.145 0.486 11.582
497 2HD LYS 578 1HD LYS 578 -3.158 -0.934 11.824
498 1HE LYS 578 2HE LYS 578 -1.344 -2.257 11.975
499 2HE LYS 578 1HE LYS 578 -0.762 -1.689 10.411
500 1HZ LYS 578 3HZ LYS 578 -0.344 0.386 12.176
501 2HZ LYS 578 2HZ LYS 578 0.144 -1.011 13.010
502 3HZ LYS 578 1HZ LYS 578 0.832 -0.634 11.502
503 H PHE 579 H PHE 579 -1.189 -2.225 7.110
504 HA PHE 579 HA PHE 579 -1.681 -1.009 4.437
505 1HB PHE 579 2HB PHE 579 -0.021 -2.848 4.609
506 2HB PHE 579 1HB PHE 579 -1.291 -3.916 5.212
507 HD1 PHE 579 HD1 PHE 579 -3.475 -4.000 3.740
508 HD2 PHE 579 HD2 PHE 579 0.379 -2.789 2.296
509 HE1 PHE 579 HE1 PHE 579 -4.186 -4.478 1.446
510 HE2 PHE 579 HE2 PHE 579 -0.354 -3.276 -0.025
511 HZ PHE 579 HZ PHE 579 -2.656 -4.110 -0.419
512 H ILE 580 H ILE 580 -3.460 -1.407 3.273
513 HA ILE 580 HA ILE 580 -5.763 -2.581 4.653
514 HB ILE 580 HB ILE 580 -7.093 -0.689 3.955
515 1HG1 ILE 580 2HG1 ILE 580 -4.836 -0.449 2.076
516 2HG1 ILE 580 1HG1 ILE 580 -6.554 -0.061 1.852
517 1HG2 ILE 580 2HG2 ILE 580 -4.370 0.254 4.898
518 2HG2 ILE 580 1HG2 ILE 580 -5.855 1.203 4.989
519 3HG2 ILE 580 3HG2 ILE 580 -5.688 -0.277 5.938
520 1HD1 ILE 580 3HD1 ILE 580 -5.710 1.909 3.551
521 2HD1 ILE 580 2HD1 ILE 580 -4.288 1.666 2.536
522 3HD1 ILE 580 1HD1 ILE 580 -5.840 2.070 1.806
523 H ARG 581 H ARG 581 -6.173 -4.472 3.509
524 HA ARG 581 HA ARG 581 -5.757 -4.518 0.593
525 1HB ARG 581 2HB ARG 581 -5.305 -6.620 1.496
526 2HB ARG 581 1HB ARG 581 -6.648 -6.537 2.629
527 1HG ARG 581 2HG ARG 581 -8.218 -7.164 1.029
528 2HG ARG 581 1HG ARG 581 -7.262 -6.521 -0.304
529 1HD ARG 581 2HD ARG 581 -5.570 -8.395 0.292
530 2HD ARG 581 1HD ARG 581 -6.910 -9.120 1.178
531 HE ARG 581 HE ARG 581 -7.486 -8.383 -1.617
532 1HH1 ARG 581 2HH1 ARG 581 -9.183 -10.389 -0.440
533 2HH1 ARG 581 1HH1 ARG 581 -8.479 -11.892 -0.934
534 1HH2 ARG 581 1HH2 ARG 581 -5.423 -10.487 -1.778
535 2HH2 ARG 581 2HH2 ARG 581 -6.350 -11.948 -1.691
536 H ILE 582 H ILE 582 -7.177 -3.313 -0.520
537 HA ILE 582 HA ILE 582 -9.980 -3.201 0.373
538 HB ILE 582 HB ILE 582 -8.350 -1.416 -1.089
539 1HG1 ILE 582 2HG1 ILE 582 -10.000 -0.843 0.603
540 2HG1 ILE 582 1HG1 ILE 582 -10.454 -0.035 -0.904
541 1HG2 ILE 582 2HG2 ILE 582 -10.329 -2.761 -2.867
542 2HG2 ILE 582 1HG2 ILE 582 -10.429 -1.010 -2.823
543 3HG2 ILE 582 3HG2 ILE 582 -8.926 -1.789 -3.277
544 1HD1 ILE 582 3HD1 ILE 582 -11.785 -2.255 -1.365
545 2HD1 ILE 582 2HD1 ILE 582 -11.686 -2.451 0.387
546 3HD1 ILE 582 1HD1 ILE 582 -12.491 -1.037 -0.291
547 H GLU 583 H GLU 583 -11.724 -4.197 -0.533
548 HA GLU 583 HA GLU 583 -11.120 -6.449 -2.346
549 1HB GLU 583 2HB GLU 583 -12.549 -6.418 -0.109
550 2HB GLU 583 1HB GLU 583 -13.838 -5.990 -1.234
551 1HG GLU 583 2HG GLU 583 -13.637 -7.999 -2.434
552 2HG GLU 583 1HG GLU 583 -12.011 -8.308 -1.824
553 H SER 584 H SER 584 -12.965 -7.032 -3.921
554 HA SER 584 HA SER 584 -13.330 -4.795 -5.761
555 1HB SER 584 2HB SER 584 -14.396 -6.480 -7.215
556 2HB SER 584 1HB SER 584 -12.859 -7.073 -6.591
557 HG SER 584 HG SER 584 -13.917 -8.393 -5.222
558 H ASP 585 H ASP 585 -15.137 -6.141 -3.187
559 HA ASP 585 HA ASP 585 -17.681 -5.074 -4.213
560 1HB ASP 585 2HB ASP 585 -18.138 -5.876 -1.644
561 2HB ASP 585 1HB ASP 585 -18.383 -6.901 -3.045
562 H ASP 586 H ASP 586 -15.182 -3.519 -3.392
563 HA ASP 586 HA ASP 586 -14.732 -1.504 -2.246
564 1HB ASP 586 2HB ASP 586 -17.124 -1.140 -3.373
565 2HB ASP 586 1HB ASP 586 -17.646 -1.113 -1.688
566 H SER 587 H SER 587 -13.811 -2.727 -0.468
567 HA SER 587 HA SER 587 -15.040 -2.178 2.111
568 1HB SER 587 2HB SER 587 -16.050 -4.390 0.950
569 2HB SER 587 1HB SER 587 -14.602 -5.071 1.682
570 HG SER 587 HG SER 587 -15.381 -4.664 3.635
571 H VAL 588 H VAL 588 -13.071 -1.558 3.104
572 HA VAL 588 HA VAL 588 -10.644 -2.998 2.264
573 HB VAL 588 HB VAL 588 -10.421 -1.133 4.530
574 1HG1 VAL 588 1HG1 VAL 588 -9.028 -1.710 1.927
575 2HG1 VAL 588 3HG1 VAL 588 -8.590 -0.310 2.914
576 3HG1 VAL 588 2HG1 VAL 588 -8.428 -1.940 3.573
577 1HG2 VAL 588 3HG2 VAL 588 -11.250 -0.170 1.784
578 2HG2 VAL 588 2HG2 VAL 588 -12.137 0.053 3.292
579 3HG2 VAL 588 1HG2 VAL 588 -10.578 0.842 3.063
580 H GLU 589 H GLU 589 -9.404 -4.258 3.511
581 HA GLU 589 HA GLU 589 -10.436 -5.080 6.195
582 1HB GLU 589 2HB GLU 589 -8.745 -7.064 5.631
583 2HB GLU 589 1HB GLU 589 -10.397 -7.116 4.995
584 1HG GLU 589 2HG GLU 589 -9.694 -6.298 2.877
585 2HG GLU 589 1HG GLU 589 -8.103 -5.839 3.504
586 H TRP 590 H TRP 590 -9.249 -2.987 6.665
587 HA TRP 590 HA TRP 590 -6.634 -2.402 6.170
588 1HB TRP 590 2HB TRP 590 -8.374 -1.888 8.514
589 2HB TRP 590 1HB TRP 590 -6.650 -1.523 8.664
590 HD1 TRP 590 HD1 TRP 590 -8.591 -1.266 5.391
591 HE1 TRP 590 HE1 TRP 590 -8.554 1.163 4.585
592 HE3 TRP 590 HE3 TRP 590 -6.348 0.945 9.395
593 HZ2 TRP 590 HZ2 TRP 590 -7.738 3.775 5.570
594 HZ3 TRP 590 HZ3 TRP 590 -5.950 3.384 9.386
595 HH2 TRP 590 HH2 TRP 590 -6.630 4.798 7.558
596 H GLU 591 H GLU 591 -5.343 -4.257 5.960
597 HA GLU 591 HA GLU 591 -4.959 -6.248 7.944
598 1HB GLU 591 2HB GLU 591 -3.985 -6.622 5.789
599 2HB GLU 591 1HB GLU 591 -3.112 -5.090 5.849
600 1HG GLU 591 2HG GLU 591 -1.475 -5.917 7.234
601 2HG GLU 591 1HG GLU 591 -2.581 -7.027 8.044
602 H SER 592 H SER 592 -4.906 -5.266 9.961
603 HA SER 592 HA SER 592 -2.785 -3.249 10.423
604 1HB SER 592 2HB SER 592 -5.040 -2.540 10.991
605 2HB SER 592 1HB SER 592 -5.291 -3.995 11.957
606 HG SER 592 HG SER 592 -3.040 -2.596 12.665
607 H ASP 593 H ASP 593 -2.489 -6.242 10.225
608 HA ASP 593 HA ASP 593 -1.687 -6.964 12.976
609 1HB ASP 593 2HB ASP 593 -2.285 -8.423 10.505
610 2HB ASP 593 1HB ASP 593 -0.827 -9.008 11.308
611 HA PRO 594 HA PRO 594 2.596 -6.944 10.914
612 1HB PRO 594 2HB PRO 594 2.775 -6.548 8.200
613 2HB PRO 594 1HB PRO 594 2.616 -8.151 8.940
614 1HG PRO 594 2HG PRO 594 0.555 -6.526 7.507
615 2HG PRO 594 1HG PRO 594 0.704 -8.286 7.639
616 1HD PRO 594 2HD PRO 594 -1.087 -6.703 9.109
617 2HD PRO 594 1HD PRO 594 -0.603 -8.366 9.508
618 H ASN 595 H ASN 595 3.016 -4.897 11.839
619 HA ASN 595 HA ASN 595 2.274 -2.501 10.209
620 1HB ASN 595 2HB ASN 595 2.422 -1.222 12.289
621 2HB ASN 595 1HB ASN 595 1.338 -2.595 12.515
622 1HD2 ASN 595 2HD2 ASN 595 3.251 -3.862 15.172
623 2HD2 ASN 595 1HD2 ASN 595 1.746 -3.757 14.394
624 H ARG 596 H ARG 596 3.884 -0.669 10.341
625 HA ARG 596 HA ARG 596 6.646 -1.349 11.029
626 1HB ARG 596 2HB ARG 596 5.637 -1.618 8.278
627 2HB ARG 596 1HB ARG 596 7.072 -0.601 8.413
628 1HG ARG 596 2HG ARG 596 8.164 -2.419 9.753
629 2HG ARG 596 1HG ARG 596 6.764 -3.441 9.425
630 1HD ARG 596 2HD ARG 596 7.741 -2.248 6.974
631 2HD ARG 596 1HD ARG 596 9.034 -3.120 7.795
632 HE ARG 596 HE ARG 596 6.756 -4.329 6.493
633 1HH1 ARG 596 1HH2 ARG 596 5.824 -5.756 8.519
634 2HH1 ARG 596 2HH2 ARG 596 7.005 -6.936 8.979
635 1HH2 ARG 596 2HH1 ARG 596 9.622 -5.335 7.364
636 2HH2 ARG 596 1HH1 ARG 596 9.155 -6.698 8.325
637 H GLU 597 H GLU 597 7.951 0.612 9.524
638 HA GLU 597 HA GLU 597 6.442 3.131 9.916
639 1HB GLU 597 2HB GLU 597 8.583 4.018 11.120
640 2HB GLU 597 1HB GLU 597 7.419 3.073 12.049
641 1HG GLU 597 2HG GLU 597 8.793 1.018 11.495
642 2HG GLU 597 1HG GLU 597 10.018 2.103 10.836
643 H TYR 598 H TYR 598 7.510 4.960 8.821
644 HA TYR 598 HA TYR 598 9.917 4.859 7.428
645 1HB TYR 598 2HB TYR 598 8.442 3.067 6.182
646 2HB TYR 598 1HB TYR 598 7.619 4.477 5.536
647 HD1 TYR 598 HD1 TYR 598 10.390 6.146 5.762
648 HD2 TYR 598 HD2 TYR 598 9.098 2.502 3.829
649 HE1 TYR 598 HE1 TYR 598 12.124 6.429 3.995
650 HE2 TYR 598 HE2 TYR 598 10.846 2.784 2.124
651 HH TYR 598 HH TYR 598 13.371 5.091 2.417
652 H THR 599 H THR 599 10.019 7.011 7.940
653 HA THR 599 HA THR 599 8.066 8.736 6.529
654 HB THR 599 HB THR 599 8.946 8.952 9.327
655 HG1 THR 599 HG1 THR 599 6.915 9.512 9.604
656 1HG2 THR 599 3HG2 THR 599 9.324 11.151 7.601
657 2HG2 THR 599 2HG2 THR 599 7.969 11.474 8.663
658 3HG2 THR 599 1HG2 THR 599 9.538 11.058 9.336
659 H VAL 600 H VAL 600 11.085 7.541 6.790
660 HA VAL 600 HA VAL 600 13.007 7.893 5.681
661 HB VAL 600 HB VAL 600 12.007 10.229 4.186
662 1HG1 VAL 600 1HG1 VAL 600 13.598 7.814 3.910
663 2HG1 VAL 600 3HG1 VAL 600 12.538 8.098 2.537
664 3HG1 VAL 600 2HG1 VAL 600 13.705 9.337 3.012
665 1HG2 VAL 600 3HG2 VAL 600 10.397 7.739 4.497
666 2HG2 VAL 600 2HG2 VAL 600 9.883 9.362 4.048
667 3HG2 VAL 600 1HG2 VAL 600 10.637 8.315 2.847
668 HA PRO 601 HA PRO 601 14.633 11.216 8.185
669 1HB PRO 601 2HB PRO 601 17.265 10.491 7.884
670 2HB PRO 601 1HB PRO 601 16.153 9.688 9.007
671 1HG PRO 601 2HG PRO 601 17.210 8.713 6.397
672 2HG PRO 601 1HG PRO 601 16.629 7.785 7.790
673 1HD PRO 601 2HD PRO 601 15.186 8.290 5.399
674 2HD PRO 601 1HD PRO 601 14.524 7.621 6.905
675 H GLN 602 H GLN 602 16.944 12.553 7.691
676 HA GLN 602 HA GLN 602 16.328 14.046 5.260
677 1HB GLN 602 2HB GLN 602 18.276 14.308 7.518
678 2HB GLN 602 1HB GLN 602 18.621 15.165 6.015
679 1HG GLN 602 2HG GLN 602 16.380 16.211 6.104
680 2HG GLN 602 1HG GLN 602 16.060 15.377 7.625
681 1HE2 GLN 602 2HE2 GLN 602 17.325 18.734 8.559
682 2HE2 GLN 602 1HE2 GLN 602 15.940 18.106 7.805
683 H ALA 603 H ALA 603 19.616 13.115 6.199
684 HA ALA 603 HA ALA 603 21.334 12.129 4.942
685 1HB ALA 603 1HB ALA 603 18.998 10.543 4.548
686 2HB ALA 603 3HB ALA 603 19.813 10.682 2.990
687 3HB ALA 603 2HB ALA 603 20.683 10.048 4.387
688 H CYS 604 H CYS 604 22.087 11.899 2.537
689 HA CYS 604 HA CYS 604 20.783 13.880 0.758
690 1HB CYS 604 2HB CYS 604 22.382 15.248 1.966
691 2HB CYS 604 1HB CYS 604 23.660 14.061 1.702
692 H GLY 605 H GLY 605 20.374 11.694 -0.264
693 1HA GLY 605 2HA GLY 605 22.420 11.197 -2.301
694 2HA GLY 605 1HA GLY 605 22.161 9.843 -1.200
695 H THR 606 H THR 606 20.401 8.525 -1.547
696 HA THR 606 HA THR 606 18.782 9.079 -3.952
697 HB THR 606 HB THR 606 17.813 6.726 -3.038
698 HG1 THR 606 HG1 THR 606 20.495 6.505 -2.309
699 1HG2 THR 606 3HG2 THR 606 19.984 7.566 -4.828
700 2HG2 THR 606 2HG2 THR 606 20.142 5.903 -4.261
701 3HG2 THR 606 1HG2 THR 606 18.680 6.412 -5.106
702 H SER 607 H SER 607 16.382 8.787 -3.824
703 HA SER 607 HA SER 607 15.293 9.532 -1.144
704 1HB SER 607 2HB SER 607 13.749 11.107 -2.280
705 2HB SER 607 1HB SER 607 15.434 11.566 -2.512
706 HG SER 607 HG SER 607 14.136 11.576 -4.453
707 H THR 608 H THR 608 15.317 6.923 -2.277
708 HA THR 608 HA THR 608 12.426 6.360 -2.282
709 HB THR 608 HB THR 608 12.480 5.134 -4.429
710 HG1 THR 608 HG1 THR 608 14.519 5.956 -5.678
711 1HG2 THR 608 2HG2 THR 608 11.903 7.614 -4.293
712 2HG2 THR 608 1HG2 THR 608 13.530 7.930 -4.894
713 3HG2 THR 608 3HG2 THR 608 12.385 7.024 -5.884
714 H ALA 609 H ALA 609 12.036 4.253 -1.615
715 HA ALA 609 HA ALA 609 14.430 2.479 -1.332
716 1HB ALA 609 2HB ALA 609 13.977 3.771 0.804
717 2HB ALA 609 1HB ALA 609 12.440 2.912 0.908
718 3HB ALA 609 3HB ALA 609 13.958 2.016 0.976
719 H THR 610 H THR 610 12.994 0.513 0.210
720 HA THR 610 HA THR 610 10.965 -0.379 -1.808
721 HB THR 610 HB THR 610 11.681 -2.675 -1.402
722 HG1 THR 610 HG1 THR 610 13.492 -1.478 0.423
723 1HG2 THR 610 3HG2 THR 610 13.137 -0.812 -2.773
724 2HG2 THR 610 2HG2 THR 610 14.358 -1.467 -1.682
725 3HG2 THR 610 1HG2 THR 610 13.486 -2.541 -2.776
726 H VAL 611 H VAL 611 9.371 -1.870 -0.925
727 HA VAL 611 HA VAL 611 8.876 -1.764 1.969
728 HB VAL 611 HB VAL 611 6.700 -0.642 0.308
729 1HG1 VAL 611 3HG1 VAL 611 7.465 -0.699 3.063
730 2HG1 VAL 611 2HG1 VAL 611 7.393 0.997 2.539
731 3HG1 VAL 611 1HG1 VAL 611 5.971 -0.055 2.374
732 1HG2 VAL 611 1HG2 VAL 611 8.747 0.528 -0.539
733 2HG2 VAL 611 3HG2 VAL 611 7.517 1.587 0.177
734 3HG2 VAL 611 2HG2 VAL 611 8.965 1.145 1.108
735 H THR 612 H THR 612 9.122 -4.125 1.069
736 HA THR 612 HA THR 612 6.715 -5.026 -0.406
737 HB THR 612 HB THR 612 8.198 -7.262 -0.127
738 HG1 THR 612 HG1 THR 612 10.373 -6.341 -0.657
739 1HG2 THR 612 1HG2 THR 612 8.265 -5.064 -2.168
740 2HG2 THR 612 3HG2 THR 612 9.110 -6.596 -2.402
741 3HG2 THR 612 2HG2 THR 612 7.357 -6.578 -2.194
742 H ASP 613 H ASP 613 5.453 -6.728 0.183
743 HA ASP 613 HA ASP 613 5.829 -8.143 2.642
744 1HB ASP 613 2HB ASP 613 4.095 -5.757 2.605
745 2HB ASP 613 1HB ASP 613 3.325 -7.199 3.267
746 H THR 614 H THR 614 3.157 -9.040 3.015
747 HA THR 614 HA THR 614 1.966 -9.677 0.450
748 HB THR 614 HB THR 614 3.325 -11.391 -0.062
749 HG1 THR 614 HG1 THR 614 2.294 -13.150 0.470
750 1HG2 THR 614 3HG2 THR 614 4.157 -11.177 2.807
751 2HG2 THR 614 2HG2 THR 614 4.577 -12.634 1.906
752 3HG2 THR 614 1HG2 THR 614 5.134 -11.058 1.343
753 H TRP 615 H TRP 615 0.204 -11.224 0.667
754 HA TRP 615 HA TRP 615 -1.254 -10.576 3.128
755 1HB TRP 615 2HB TRP 615 -1.920 -10.850 0.357
756 2HB TRP 615 1HB TRP 615 -2.916 -11.960 1.295
757 HD1 TRP 615 HD1 TRP 615 -5.055 -10.537 1.256
758 HE1 TRP 615 HE1 TRP 615 -5.751 -8.369 2.495
759 HE3 TRP 615 HE3 TRP 615 -0.514 -8.872 2.493
760 HZ2 TRP 615 HZ2 TRP 615 -4.451 -6.165 3.803
761 HZ3 TRP 615 HZ3 TRP 615 -0.186 -6.760 3.688
762 HH2 TRP 615 HH2 TRP 615 -2.107 -5.404 4.326
763 H ARG 616 H ARG 616 -2.209 -12.058 4.471
764 HA ARG 616 HA ARG 616 -1.430 -14.920 4.008
765 1HB ARG 616 2HB ARG 616 -0.330 -13.436 5.950
766 2HB ARG 616 1HB ARG 616 -1.806 -13.912 6.791
767 1HG ARG 616 2HG ARG 616 0.022 -15.532 7.193
768 2HG ARG 616 1HG ARG 616 -1.322 -16.279 6.329
769 1HD ARG 616 2HD ARG 616 -0.159 -16.336 4.299
770 2HD ARG 616 1HD ARG 616 0.950 -15.055 4.787
771 HE ARG 616 HE ARG 616 2.318 -16.703 5.771
772 1HH1 ARG 616 1HH2 ARG 616 -0.888 -17.859 5.208
773 2HH1 ARG 616 2HH2 ARG 616 -0.524 -19.483 5.683
774 1HH2 ARG 616 1HH1 ARG 616 2.801 -18.816 6.403
775 2HH2 ARG 616 2HH1 ARG 616 1.561 -20.025 6.359
No H/Q in entry = 775