NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
572805 |
2m5f   |
19052 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 ALA 507 1HT ALA 507 -18.604 6.594 2.741
2 H2 ALA 507 2HT ALA 507 -18.945 5.203 1.795
3 H3 ALA 507 3HT ALA 507 -18.091 6.524 1.108
4 HA ALA 507 HA ALA 507 -16.205 6.103 2.276
5 HB1 ALA 507 2HB ALA 507 -16.149 5.336 4.372
6 HB2 ALA 507 3HB ALA 507 -17.132 3.925 3.978
7 HB3 ALA 507 1HB ALA 507 -17.906 5.469 4.333
8 H GLN 508 H GLN 508 -14.791 4.111 2.289
9 HA GLN 508 HA GLN 508 -15.086 2.717 -0.121
10 HB2 GLN 508 2HB GLN 508 -13.423 1.759 2.204
11 HB3 GLN 508 1HB GLN 508 -13.131 1.508 0.488
12 HG2 GLN 508 2HG GLN 508 -13.197 4.274 0.817
13 HG3 GLN 508 1HG GLN 508 -12.289 3.661 2.199
14 HE21 GLN 508 1HE2 GLN 508 -10.216 3.239 1.908
15 HE22 GLN 508 2HE2 GLN 508 -9.421 3.071 0.384
16 HA PRO 509 HA PRO 509 -17.397 -0.846 1.170
17 HB2 PRO 509 2HB PRO 509 -16.736 -2.575 -0.779
18 HB3 PRO 509 1HB PRO 509 -17.627 -1.088 -1.118
19 HG2 PRO 509 2HG PRO 509 -14.839 -1.780 -1.748
20 HG3 PRO 509 1HG PRO 509 -15.880 -0.545 -2.471
21 HD2 PRO 509 2HD PRO 509 -13.856 -0.238 -0.418
22 HD3 PRO 509 1HD PRO 509 -14.797 1.022 -1.243
23 H LYS 510 H LYS 510 -14.502 -0.619 2.213
24 HA LYS 510 HA LYS 510 -13.022 -1.853 3.418
25 HB2 LYS 510 2HB LYS 510 -15.622 -3.277 3.777
26 HB3 LYS 510 1HB LYS 510 -14.159 -3.993 4.435
27 HG2 LYS 510 2HG LYS 510 -13.843 -1.568 5.428
28 HG3 LYS 510 1HG LYS 510 -15.598 -1.530 5.242
29 HD2 LYS 510 2HD LYS 510 -15.916 -3.292 6.731
30 HD3 LYS 510 1HD LYS 510 -14.251 -3.853 6.572
31 HE2 LYS 510 2HE LYS 510 -15.106 -1.280 7.892
32 HE3 LYS 510 1HE LYS 510 -14.680 -2.765 8.740
33 HZ1 LYS 510 3HZ LYS 510 -12.915 -1.017 7.130
34 HZ2 LYS 510 1HZ LYS 510 -12.470 -2.590 7.569
35 HZ3 LYS 510 2HZ LYS 510 -12.767 -1.430 8.764
36 H CYS 511 H CYS 511 -12.058 -2.217 1.184
37 HA CYS 511 HA CYS 511 -11.742 -5.106 0.806
38 HB2 CYS 511 2HB CYS 511 -11.736 -4.798 -1.654
39 HB3 CYS 511 1HB CYS 511 -13.295 -4.428 -0.925
40 H ASN 512 H ASN 512 -10.170 -2.752 1.949
41 HA ASN 512 HA ASN 512 -7.867 -2.610 0.196
42 HB2 ASN 512 2HB ASN 512 -6.916 -1.146 1.927
43 HB3 ASN 512 1HB ASN 512 -8.533 -0.622 1.469
44 HD21 ASN 512 1HD2 ASN 512 -10.219 -0.843 2.923
45 HD22 ASN 512 2HD2 ASN 512 -9.957 -1.154 4.602
46 HA PRO 513 HA PRO 513 -5.638 -5.863 2.137
47 HB2 PRO 513 2HB PRO 513 -3.063 -5.085 1.828
48 HB3 PRO 513 1HB PRO 513 -4.073 -5.639 0.491
49 HG2 PRO 513 2HG PRO 513 -3.227 -2.893 1.208
50 HG3 PRO 513 1HG PRO 513 -3.596 -3.583 -0.376
51 HD2 PRO 513 2HD PRO 513 -5.278 -1.952 1.160
52 HD3 PRO 513 1HD PRO 513 -5.752 -2.904 -0.259
53 H ASN 514 H ASN 514 -3.398 -3.284 3.016
54 HA ASN 514 HA ASN 514 -3.982 -3.757 5.861
55 HB2 ASN 514 2HB ASN 514 -1.476 -4.130 4.360
56 HB3 ASN 514 1HB ASN 514 -1.313 -3.257 5.878
57 HD21 ASN 514 1HD2 ASN 514 -2.083 -6.283 4.377
58 HD22 ASN 514 2HD2 ASN 514 -2.075 -7.239 5.816
59 H LEU 515 H LEU 515 -1.742 -1.823 3.955
60 HA LEU 515 HA LEU 515 -0.996 0.315 4.228
61 HB2 LEU 515 2HB LEU 515 -2.615 1.872 3.461
62 HB3 LEU 515 1HB LEU 515 -2.901 0.332 2.668
63 HG LEU 515 HG LEU 515 -4.545 0.199 4.864
64 HD11 LEU 515 1HD1 LEU 515 -5.294 2.196 5.503
65 HD12 LEU 515 2HD1 LEU 515 -5.480 2.740 3.837
66 HD13 LEU 515 3HD1 LEU 515 -3.920 2.889 4.644
67 HD21 LEU 515 3HD2 LEU 515 -5.316 1.201 2.134
68 HD22 LEU 515 1HD2 LEU 515 -6.337 0.342 3.286
69 HD23 LEU 515 2HD2 LEU 515 -4.983 -0.487 2.519
70 H HIS 516 H HIS 516 -1.033 -0.771 6.699
71 HA HIS 516 HA HIS 516 -2.436 1.074 8.468
72 HB2 HIS 516 2HB HIS 516 -1.169 -1.588 8.759
73 HB3 HIS 516 1HB HIS 516 -1.087 -0.528 10.163
74 HD1 HIS 516 1HD HIS 516 -3.777 0.723 10.303
75 HD2 HIS 516 2HD HIS 516 -3.252 -3.247 9.192
76 HE1 HIS 516 1HE HIS 516 -5.980 -0.400 10.761
77 HE2 HIS 516 2HE HIS 516 -5.613 -2.819 10.158
78 H TYR 517 H TYR 517 0.569 0.917 6.932
79 HA TYR 517 HA TYR 517 1.931 2.302 9.120
80 HB2 TYR 517 2HB TYR 517 3.960 1.769 8.123
81 HB3 TYR 517 1HB TYR 517 2.969 0.385 7.687
82 HD1 TYR 517 1HD TYR 517 3.807 3.764 6.302
83 HD2 TYR 517 2HD TYR 517 3.162 -0.369 5.515
84 HE1 TYR 517 1HE TYR 517 4.322 4.142 3.940
85 HE2 TYR 517 2HE TYR 517 3.679 0.001 3.145
86 HH TYR 517 HH TYR 517 3.747 1.770 1.522
87 H TRP 518 H TRP 518 0.477 2.880 6.035
88 HA TRP 518 HA TRP 518 1.411 5.661 6.099
89 HB2 TRP 518 2HB TRP 518 1.811 3.997 4.062
90 HB3 TRP 518 1HB TRP 518 0.184 4.519 3.647
91 HD1 TRP 518 HD TRP 518 0.117 6.563 2.133
92 HE1 TRP 518 1HE TRP 518 1.674 8.548 1.625
93 HE3 TRP 518 3HE TRP 518 3.849 5.537 5.468
94 HZ2 TRP 518 2HZ TRP 518 4.158 9.548 2.522
95 HZ3 TRP 518 3HZ TRP 518 5.781 7.056 5.582
96 HH2 TRP 518 HH TRP 518 5.931 9.019 4.138
97 H THR 519 H THR 519 -0.012 7.150 6.480
98 HA THR 519 HA THR 519 -2.331 7.253 7.552
99 HB THR 519 HB THR 519 -1.475 9.296 6.794
100 HG1 THR 519 1HG THR 519 -3.791 8.953 5.201
101 HG21 THR 519 3HG2 THR 519 -0.653 9.746 4.783
102 HG22 THR 519 1HG2 THR 519 -2.092 9.141 3.961
103 HG23 THR 519 2HG2 THR 519 -0.824 8.020 4.460
104 H THR 520 H THR 520 -2.315 6.807 3.999
105 HA THR 520 HA THR 520 -4.223 4.778 3.950
106 HB THR 520 HB THR 520 -5.602 6.806 4.817
107 HG1 THR 520 1HG THR 520 -6.529 5.362 2.564
108 HG21 THR 520 3HG2 THR 520 -6.663 8.135 3.076
109 HG22 THR 520 1HG2 THR 520 -5.583 7.432 1.870
110 HG23 THR 520 2HG2 THR 520 -4.930 8.450 3.155
111 H GLN 521 H GLN 521 -3.264 7.733 2.238
112 HA GLN 521 HA GLN 521 -3.827 7.159 -0.343
113 HB2 GLN 521 2HB GLN 521 -1.828 8.461 -0.986
114 HB3 GLN 521 1HB GLN 521 -2.771 9.237 0.281
115 HG2 GLN 521 2HG GLN 521 -1.128 8.117 1.903
116 HG3 GLN 521 1HG GLN 521 -0.118 7.870 0.481
117 HE21 GLN 521 1HE2 GLN 521 0.691 9.690 -0.625
118 HE22 GLN 521 2HE2 GLN 521 0.818 11.227 0.153
119 H ASP 522 H ASP 522 -2.640 6.308 -2.123
120 HA ASP 522 HA ASP 522 -1.849 3.704 -1.897
121 HB2 ASP 522 2HB ASP 522 -1.118 5.778 -3.957
122 HB3 ASP 522 1HB ASP 522 -0.651 4.087 -4.116
123 H GLU 523 H GLU 523 -0.442 3.286 -0.244
124 HA GLU 523 HA GLU 523 2.192 4.543 -0.281
125 HB2 GLU 523 2HB GLU 523 2.522 3.528 1.886
126 HB3 GLU 523 1HB GLU 523 0.990 4.378 1.848
127 HG2 GLU 523 2HG GLU 523 1.100 1.438 1.332
128 HG3 GLU 523 1HG GLU 523 1.124 2.065 2.979
129 H GLY 524 H GLY 524 2.153 3.265 -2.442
130 HA2 GLY 524 2HA GLY 524 3.872 1.806 -3.330
131 HA3 GLY 524 1HA GLY 524 3.583 0.732 -1.964
132 H ALA 525 H ALA 525 0.766 2.107 -3.181
133 HA ALA 525 HA ALA 525 -0.337 -0.364 -3.977
134 HB1 ALA 525 1HB ALA 525 -1.443 2.345 -4.667
135 HB2 ALA 525 2HB ALA 525 -1.553 1.654 -3.048
136 HB3 ALA 525 3HB ALA 525 -2.322 0.838 -4.410
137 H ALA 526 H ALA 526 1.759 -0.496 -5.519
138 HA ALA 526 HA ALA 526 2.533 -0.751 -7.629
139 HB1 ALA 526 1HB ALA 526 0.502 -2.052 -7.907
140 HB2 ALA 526 2HB ALA 526 0.882 -1.177 -9.389
141 HB3 ALA 526 3HB ALA 526 -0.395 -0.592 -8.324
142 H ILE 527 H ILE 527 3.614 1.221 -7.570
143 HA ILE 527 HA ILE 527 3.054 2.950 -9.709
144 HB ILE 527 HB ILE 527 1.384 3.853 -8.280
145 HG12 ILE 527 2HG1 ILE 527 3.651 5.794 -7.929
146 HG13 ILE 527 1HG1 ILE 527 3.058 5.399 -9.540
147 HG21 ILE 527 1HG2 ILE 527 2.614 2.909 -6.225
148 HG22 ILE 527 2HG2 ILE 527 1.605 4.348 -6.050
149 HG23 ILE 527 3HG2 ILE 527 3.360 4.508 -6.157
150 HD11 ILE 527 3HD1 ILE 527 0.858 6.030 -7.823
151 HD12 ILE 527 1HD1 ILE 527 1.381 6.818 -9.312
152 HD13 ILE 527 2HD1 ILE 527 2.064 7.315 -7.764
153 H GLY 528 H GLY 528 4.583 2.854 -6.501
154 HA2 GLY 528 2HA GLY 528 6.752 3.159 -5.838
155 HA3 GLY 528 1HA GLY 528 7.204 2.726 -7.474
156 H ALA 529 H ALA 529 5.501 5.197 -8.343
157 HA ALA 529 HA ALA 529 6.097 7.258 -9.134
158 HB1 ALA 529 1HB ALA 529 5.429 7.412 -6.557
159 HB2 ALA 529 2HB ALA 529 5.900 8.823 -7.506
160 HB3 ALA 529 3HB ALA 529 7.076 8.037 -6.452
161 H ALA 530 H ALA 530 8.203 5.287 -9.354
162 HA ALA 530 HA ALA 530 10.317 6.709 -10.317
163 HB1 ALA 530 1HB ALA 530 11.735 5.893 -8.009
164 HB2 ALA 530 2HB ALA 530 10.338 6.811 -7.451
165 HB3 ALA 530 3HB ALA 530 11.469 7.537 -8.593
166 H TRP 531 H TRP 531 9.114 4.486 -11.105
167 HA TRP 531 HA TRP 531 9.200 2.175 -11.340
168 HB2 TRP 531 2HB TRP 531 11.553 1.645 -12.353
169 HB3 TRP 531 1HB TRP 531 10.410 2.658 -13.230
170 HD1 TRP 531 HD TRP 531 13.052 3.483 -10.508
171 HE1 TRP 531 1HE TRP 531 14.468 5.462 -11.351
172 HE3 TRP 531 3HE TRP 531 10.865 4.152 -15.077
173 HZ2 TRP 531 2HZ TRP 531 14.634 7.090 -13.653
174 HZ3 TRP 531 3HZ TRP 531 11.710 5.940 -16.541
175 HH2 TRP 531 HH TRP 531 13.555 7.379 -15.841
176 H ILE 532 H ILE 532 9.440 2.650 -8.753
177 HA ILE 532 HA ILE 532 11.356 0.609 -7.934
178 HB ILE 532 HB ILE 532 12.224 2.876 -7.525
179 HG12 ILE 532 2HG1 ILE 532 11.510 1.500 -4.927
180 HG13 ILE 532 1HG1 ILE 532 12.737 0.894 -6.029
181 HG21 ILE 532 1HG2 ILE 532 9.717 3.593 -7.066
182 HG22 ILE 532 2HG2 ILE 532 11.087 4.486 -6.392
183 HG23 ILE 532 3HG2 ILE 532 10.213 3.325 -5.390
184 HD11 ILE 532 3HD1 ILE 532 13.530 2.263 -4.057
185 HD12 ILE 532 1HD1 ILE 532 12.839 3.661 -4.883
186 HD13 ILE 532 2HD1 ILE 532 14.131 2.738 -5.649
187 HA PRO 533 HA PRO 533 6.973 0.727 -5.842
188 HB2 PRO 533 2HB PRO 533 5.490 -0.817 -7.546
189 HB3 PRO 533 1HB PRO 533 5.483 0.947 -7.571
190 HG2 PRO 533 2HG PRO 533 6.975 -0.962 -9.314
191 HG3 PRO 533 1HG PRO 533 6.147 0.543 -9.749
192 HD2 PRO 533 2HD PRO 533 8.821 0.392 -9.468
193 HD3 PRO 533 1HD PRO 533 7.897 1.854 -9.068
194 H TYR 534 H TYR 534 9.029 -1.430 -7.473
195 HA TYR 534 HA TYR 534 8.178 -3.929 -6.602
196 HB2 TYR 534 2HB TYR 534 10.984 -2.936 -7.172
197 HB3 TYR 534 1HB TYR 534 10.501 -4.627 -7.080
198 HD1 TYR 534 2HD TYR 534 10.146 -1.498 -9.088
199 HD2 TYR 534 1HD TYR 534 9.447 -5.709 -8.907
200 HE1 TYR 534 2HE TYR 534 9.594 -1.516 -11.477
201 HE2 TYR 534 1HE TYR 534 8.897 -5.719 -11.300
202 HH TYR 534 HH TYR 534 8.175 -3.020 -13.035
203 H PHE 535 H PHE 535 10.758 -1.863 -5.252
204 HA PHE 535 HA PHE 535 10.140 -2.970 -2.602
205 HB2 PHE 535 2HB PHE 535 12.695 -2.703 -2.189
206 HB3 PHE 535 1HB PHE 535 12.099 -4.128 -3.031
207 HD1 PHE 535 2HD PHE 535 12.110 -4.042 -5.607
208 HD2 PHE 535 1HD PHE 535 14.355 -1.398 -3.140
209 HE1 PHE 535 2HE PHE 535 13.603 -3.550 -7.499
210 HE2 PHE 535 1HE PHE 535 15.852 -0.901 -5.028
211 HZ PHE 535 HZ PHE 535 15.477 -1.979 -7.211
212 H GLY 536 H GLY 536 9.775 -0.333 -4.231
213 HA2 GLY 536 2HA GLY 536 11.244 1.688 -2.919
214 HA3 GLY 536 1HA GLY 536 9.726 1.919 -3.779
215 HA PRO 537 HA PRO 537 8.063 2.656 0.311
216 HB2 PRO 537 2HB PRO 537 5.568 3.226 -0.351
217 HB3 PRO 537 1HB PRO 537 6.869 4.271 -0.953
218 HG2 PRO 537 2HG PRO 537 5.530 1.965 -2.341
219 HG3 PRO 537 1HG PRO 537 5.741 3.626 -2.940
220 HD2 PRO 537 2HD PRO 537 7.417 1.595 -3.589
221 HD3 PRO 537 1HD PRO 537 7.980 3.275 -3.427
222 H ALA 538 H ALA 538 8.257 -0.040 -0.989
223 HA ALA 538 HA ALA 538 6.065 -1.369 0.395
224 HB1 ALA 538 1HB ALA 538 6.018 -3.042 -1.321
225 HB2 ALA 538 2HB ALA 538 7.439 -2.347 -2.107
226 HB3 ALA 538 3HB ALA 538 5.910 -1.467 -2.107
227 H ALA 539 H ALA 539 9.403 -0.984 -0.281
228 HA ALA 539 HA ALA 539 10.068 -2.787 1.858
229 HB1 ALA 539 1HB ALA 539 9.986 -4.322 0.004
230 HB2 ALA 539 2HB ALA 539 11.649 -4.124 0.558
231 HB3 ALA 539 3HB ALA 539 11.105 -3.311 -0.909
232 H GLU 540 H GLU 540 10.469 0.146 0.806
233 HA GLU 540 HA GLU 540 13.339 0.423 0.749
234 HB2 GLU 540 2HB GLU 540 12.900 2.831 0.929
235 HB3 GLU 540 1HB GLU 540 11.939 2.099 -0.345
236 HG2 GLU 540 2HG GLU 540 10.151 3.039 0.557
237 HG3 GLU 540 1HG GLU 540 10.350 1.963 1.939
238 H GLY 541 H GLY 541 13.143 -1.074 2.765
239 HA2 GLY 541 2HA GLY 541 14.045 -1.064 4.957
240 HA3 GLY 541 1HA GLY 541 13.531 0.614 5.126
241 H ILE 542 H ILE 542 11.013 -0.650 3.670
242 HA ILE 542 HA ILE 542 9.345 -0.725 5.945
243 HB ILE 542 HB ILE 542 9.052 -0.871 3.033
244 HG12 ILE 542 2HG1 ILE 542 7.129 0.086 5.148
245 HG13 ILE 542 1HG1 ILE 542 8.506 1.037 4.599
246 HG21 ILE 542 1HG2 ILE 542 8.065 -2.988 3.332
247 HG22 ILE 542 2HG2 ILE 542 6.727 -1.841 3.209
248 HG23 ILE 542 3HG2 ILE 542 7.205 -2.471 4.784
249 HD11 ILE 542 3HD1 ILE 542 7.504 0.635 2.246
250 HD12 ILE 542 1HD1 ILE 542 6.804 1.859 3.305
251 HD13 ILE 542 2HD1 ILE 542 6.026 0.285 3.141
252 H TYR 543 H TYR 543 10.638 -3.224 3.782
253 HA TYR 543 HA TYR 543 9.309 -5.457 4.540
254 HB2 TYR 543 2HB TYR 543 11.331 -6.752 4.034
255 HB3 TYR 543 1HB TYR 543 11.057 -5.481 2.847
256 HD1 TYR 543 2HD TYR 543 12.367 -3.333 3.090
257 HD2 TYR 543 1HD TYR 543 13.353 -6.880 5.195
258 HE1 TYR 543 2HE TYR 543 14.641 -2.461 3.466
259 HE2 TYR 543 1HE TYR 543 15.631 -6.031 5.586
260 HH TYR 543 HH TYR 543 16.497 -2.831 5.143
261 H ALA 544 H ALA 544 11.590 -3.681 6.475
262 HA ALA 544 HA ALA 544 12.337 -5.534 8.389
263 HB1 ALA 544 1HB ALA 544 11.638 -2.649 8.885
264 HB2 ALA 544 2HB ALA 544 13.181 -3.223 8.252
265 HB3 ALA 544 3HB ALA 544 12.675 -3.667 9.882
266 H GLU 545 H GLU 545 9.238 -4.291 7.727
267 HA GLU 545 HA GLU 545 7.910 -4.333 10.148
268 HB2 GLU 545 2HB GLU 545 5.916 -5.030 8.679
269 HB3 GLU 545 1HB GLU 545 6.720 -3.520 8.276
270 HG2 GLU 545 2HG GLU 545 6.610 -4.379 6.197
271 HG3 GLU 545 1HG GLU 545 8.106 -5.163 6.694
272 H GLY 546 H GLY 546 8.544 -6.907 7.843
273 HA2 GLY 546 2HA GLY 546 8.422 -9.178 7.991
274 HA3 GLY 546 1HA GLY 546 9.032 -8.927 9.614
275 H LEU 547 H LEU 547 5.861 -7.759 8.620
276 HA LEU 547 HA LEU 547 4.576 -10.056 9.851
277 HB2 LEU 547 2HB LEU 547 3.493 -8.960 11.574
278 HB3 LEU 547 1HB LEU 547 5.113 -8.297 11.625
279 HG LEU 547 HG LEU 547 2.849 -6.876 10.237
280 HD11 LEU 547 1HD1 LEU 547 2.301 -5.727 12.179
281 HD12 LEU 547 2HD1 LEU 547 3.770 -6.238 13.013
282 HD13 LEU 547 3HD1 LEU 547 2.470 -7.396 12.725
283 HD21 LEU 547 3HD2 LEU 547 4.265 -5.095 10.074
284 HD22 LEU 547 1HD2 LEU 547 5.435 -6.411 9.987
285 HD23 LEU 547 2HD2 LEU 547 5.186 -5.555 11.506
286 H MET 548 H MET 548 4.043 -6.864 8.361
287 HA MET 548 HA MET 548 2.385 -7.868 6.336
288 HB2 MET 548 2HB MET 548 0.185 -7.110 7.035
289 HB3 MET 548 1HB MET 548 0.811 -8.291 8.177
290 HG2 MET 548 2HG MET 548 1.618 -5.770 9.117
291 HG3 MET 548 1HG MET 548 -0.070 -5.613 8.637
292 HE1 MET 548 3HE MET 548 0.366 -4.906 11.316
293 HE2 MET 548 1HE MET 548 -0.409 -5.991 12.469
294 HE3 MET 548 2HE MET 548 -1.315 -5.384 11.082
295 H HIS 549 H HIS 549 3.502 -5.187 8.243
296 HA HIS 549 HA HIS 549 2.442 -3.006 6.954
297 HB2 HIS 549 2HB HIS 549 4.722 -3.538 8.639
298 HB3 HIS 549 1HB HIS 549 5.115 -2.314 7.436
299 HD1 HIS 549 1HD HIS 549 1.596 -2.334 8.479
300 HD2 HIS 549 2HD HIS 549 5.123 -0.501 9.687
301 HE1 HIS 549 1HE HIS 549 0.891 -0.439 9.958
302 HE2 HIS 549 2HE HIS 549 3.043 0.591 10.770
303 H ASN 550 H ASN 550 4.587 -5.334 5.605
304 HA ASN 550 HA ASN 550 5.693 -3.630 3.585
305 HB2 ASN 550 2HB ASN 550 6.592 -5.715 2.631
306 HB3 ASN 550 1HB ASN 550 6.932 -5.585 4.354
307 HD21 ASN 550 1HD2 ASN 550 7.201 -7.995 3.434
308 HD22 ASN 550 2HD2 ASN 550 5.863 -9.014 3.830
309 H GLN 551 H GLN 551 2.635 -4.317 3.941
310 HA GLN 551 HA GLN 551 1.630 -5.629 1.744
311 HB2 GLN 551 2HB GLN 551 -0.390 -4.252 2.062
312 HB3 GLN 551 1HB GLN 551 0.246 -4.853 3.589
313 HG2 GLN 551 2HG GLN 551 -0.139 -2.698 4.177
314 HG3 GLN 551 1HG GLN 551 1.506 -2.536 3.570
315 HE21 GLN 551 1HE2 GLN 551 1.893 -1.365 1.754
316 HE22 GLN 551 2HE2 GLN 551 0.684 -0.458 0.921
317 H ASP 552 H ASP 552 0.097 -4.143 0.177
318 HA ASP 552 HA ASP 552 1.976 -2.426 -1.310
319 HB2 ASP 552 2HB ASP 552 -0.168 -4.320 -2.250
320 HB3 ASP 552 1HB ASP 552 0.436 -3.033 -3.289
321 H GLY 553 H GLY 553 -1.562 -2.929 -1.033
322 HA2 GLY 553 2HA GLY 553 -2.893 -1.103 -0.064
323 HA3 GLY 553 1HA GLY 553 -1.825 0.013 -0.898
324 H LEU 554 H LEU 554 -3.407 -2.932 -2.110
325 HA LEU 554 HA LEU 554 -4.023 -2.045 -4.598
326 HB2 LEU 554 2HB LEU 554 -6.138 -3.597 -4.319
327 HB3 LEU 554 1HB LEU 554 -4.516 -4.245 -4.441
328 HG LEU 554 HG LEU 554 -5.052 -3.767 -1.686
329 HD11 LEU 554 1HD1 LEU 554 -7.036 -5.747 -2.571
330 HD12 LEU 554 2HD1 LEU 554 -7.455 -4.060 -2.865
331 HD13 LEU 554 3HD1 LEU 554 -7.088 -4.606 -1.230
332 HD21 LEU 554 3HD2 LEU 554 -5.161 -6.520 -2.702
333 HD22 LEU 554 1HD2 LEU 554 -4.115 -5.800 -1.479
334 HD23 LEU 554 2HD2 LEU 554 -3.741 -5.595 -3.191
335 H ILE 555 H ILE 555 -6.665 -2.243 -2.213
336 HA ILE 555 HA ILE 555 -8.487 -0.933 -1.860
337 HB ILE 555 HB ILE 555 -6.553 1.145 -2.864
338 HG12 ILE 555 2HG1 ILE 555 -6.443 1.828 -0.589
339 HG13 ILE 555 1HG1 ILE 555 -7.851 0.873 -0.154
340 HG21 ILE 555 1HG2 ILE 555 -9.429 1.528 -2.068
341 HG22 ILE 555 2HG2 ILE 555 -8.633 2.037 -3.557
342 HG23 ILE 555 3HG2 ILE 555 -8.241 2.832 -2.032
343 HD11 ILE 555 3HD1 ILE 555 -5.489 0.060 0.497
344 HD12 ILE 555 1HD1 ILE 555 -5.397 -0.464 -1.182
345 HD13 ILE 555 2HD1 ILE 555 -6.662 -1.096 -0.134
346 H CYS 556 H CYS 556 -10.314 -1.030 -2.960
347 HA CYS 556 HA CYS 556 -10.421 -1.416 -5.749
348 HB2 CYS 556 2HB CYS 556 -12.684 -0.590 -3.924
349 HB3 CYS 556 1HB CYS 556 -12.832 -1.367 -5.496
350 H GLY 557 H GLY 557 -10.743 1.437 -3.745
351 HA2 GLY 557 2HA GLY 557 -10.220 3.603 -4.658
352 HA3 GLY 557 1HA GLY 557 -10.848 3.048 -6.207
353 H LEU 558 H LEU 558 -13.139 1.771 -4.835
354 HA LEU 558 HA LEU 558 -14.674 3.711 -3.497
355 HB2 LEU 558 2HB LEU 558 -16.210 4.311 -5.294
356 HB3 LEU 558 1HB LEU 558 -14.576 4.829 -5.661
357 HG LEU 558 HG LEU 558 -15.692 2.260 -6.767
358 HD11 LEU 558 1HD1 LEU 558 -17.120 4.265 -7.346
359 HD12 LEU 558 2HD1 LEU 558 -16.443 3.366 -8.704
360 HD13 LEU 558 3HD1 LEU 558 -15.717 4.895 -8.209
361 HD21 LEU 558 3HD2 LEU 558 -13.248 3.868 -7.099
362 HD22 LEU 558 1HD2 LEU 558 -13.955 3.229 -8.582
363 HD23 LEU 558 2HD2 LEU 558 -13.504 2.131 -7.277
364 H ARG 559 H ARG 559 -14.664 1.031 -5.752
365 HA ARG 559 HA ARG 559 -15.621 -1.029 -4.401
366 HB2 ARG 559 2HB ARG 559 -18.101 -1.058 -4.764
367 HB3 ARG 559 1HB ARG 559 -17.577 0.123 -3.570
368 HG2 ARG 559 2HG ARG 559 -17.550 1.579 -5.885
369 HG3 ARG 559 1HG ARG 559 -18.922 0.498 -6.131
370 HD2 ARG 559 2HD ARG 559 -20.034 1.294 -4.228
371 HD3 ARG 559 1HD ARG 559 -18.572 2.036 -3.579
372 HE ARG 559 HE ARG 559 -19.449 3.141 -6.092
373 HH11 ARG 559 1HH1 ARG 559 -19.723 3.322 -2.616
374 HH12 ARG 559 2HH1 ARG 559 -20.235 4.976 -2.618
375 HH21 ARG 559 1HH2 ARG 559 -20.124 5.316 -6.095
376 HH22 ARG 559 2HH2 ARG 559 -20.466 6.108 -4.592
377 H GLN 560 H GLN 560 -15.782 -2.750 -5.786
378 HA GLN 560 HA GLN 560 -16.632 -2.314 -8.504
379 HB2 GLN 560 2HB GLN 560 -14.549 -3.146 -9.519
380 HB3 GLN 560 1HB GLN 560 -14.302 -1.638 -8.647
381 HG2 GLN 560 2HG GLN 560 -13.232 -2.744 -6.852
382 HG3 GLN 560 1HG GLN 560 -13.721 -4.330 -7.449
383 HE21 GLN 560 1HE2 GLN 560 -11.853 -1.474 -8.392
384 HE22 GLN 560 2HE2 GLN 560 -10.626 -2.341 -9.244
Start of MODEL 2
1 H1 ALA 507 1HT ALA 507 -16.833 6.504 -0.089
2 H2 ALA 507 2HT ALA 507 -18.460 6.910 -0.448
3 H3 ALA 507 3HT ALA 507 -17.467 6.194 -1.651
4 HA ALA 507 HA ALA 507 -18.014 4.846 0.885
5 HB1 ALA 507 2HB ALA 507 -19.744 3.628 -0.745
6 HB2 ALA 507 3HB ALA 507 -19.834 5.260 -1.410
7 HB3 ALA 507 1HB ALA 507 -20.197 4.980 0.294
8 H GLN 508 H GLN 508 -17.140 2.846 0.930
9 HA GLN 508 HA GLN 508 -16.005 1.779 -1.566
10 HB2 GLN 508 2HB GLN 508 -14.654 1.983 1.127
11 HB3 GLN 508 1HB GLN 508 -14.064 0.957 -0.173
12 HG2 GLN 508 2HG GLN 508 -13.568 2.805 -1.545
13 HG3 GLN 508 1HG GLN 508 -14.486 3.907 -0.520
14 HE21 GLN 508 1HE2 GLN 508 -12.177 1.421 0.439
15 HE22 GLN 508 2HE2 GLN 508 -11.042 2.499 1.169
16 HA PRO 509 HA PRO 509 -17.698 -2.035 -0.041
17 HB2 PRO 509 2HB PRO 509 -16.623 -3.716 -1.821
18 HB3 PRO 509 1HB PRO 509 -17.740 -2.443 -2.325
19 HG2 PRO 509 2HG PRO 509 -14.821 -2.638 -2.711
20 HG3 PRO 509 1HG PRO 509 -16.019 -1.724 -3.639
21 HD2 PRO 509 2HD PRO 509 -14.277 -0.786 -1.536
22 HD3 PRO 509 1HD PRO 509 -15.424 0.151 -2.517
23 H LYS 510 H LYS 510 -15.030 -1.127 1.159
24 HA LYS 510 HA LYS 510 -13.459 -1.939 2.584
25 HB2 LYS 510 2HB LYS 510 -15.434 -4.208 2.569
26 HB3 LYS 510 1HB LYS 510 -13.982 -4.245 3.557
27 HG2 LYS 510 2HG LYS 510 -15.078 -1.790 4.145
28 HG3 LYS 510 1HG LYS 510 -16.486 -2.839 3.976
29 HD2 LYS 510 2HD LYS 510 -16.045 -3.273 6.156
30 HD3 LYS 510 1HD LYS 510 -14.920 -4.438 5.454
31 HE2 LYS 510 2HE LYS 510 -13.655 -1.878 5.606
32 HE3 LYS 510 1HE LYS 510 -14.350 -2.275 7.177
33 HZ1 LYS 510 3HZ LYS 510 -12.032 -3.071 6.826
34 HZ2 LYS 510 1HZ LYS 510 -12.616 -4.128 5.641
35 HZ3 LYS 510 2HZ LYS 510 -13.126 -4.291 7.246
36 H CYS 511 H CYS 511 -12.409 -1.936 0.251
37 HA CYS 511 HA CYS 511 -11.266 -4.618 -0.181
38 HB2 CYS 511 2HB CYS 511 -12.695 -3.789 -2.056
39 HB3 CYS 511 1HB CYS 511 -11.583 -2.438 -2.249
40 H ASN 512 H ASN 512 -10.272 -2.703 1.692
41 HA ASN 512 HA ASN 512 -7.779 -1.835 0.397
42 HB2 ASN 512 2HB ASN 512 -7.506 -0.293 2.296
43 HB3 ASN 512 1HB ASN 512 -9.027 -0.016 1.455
44 HD21 ASN 512 1HD2 ASN 512 -10.917 -0.282 2.518
45 HD22 ASN 512 2HD2 ASN 512 -11.036 -0.698 4.191
46 HA PRO 513 HA PRO 513 -5.684 -4.931 2.735
47 HB2 PRO 513 2HB PRO 513 -3.136 -4.115 2.446
48 HB3 PRO 513 1HB PRO 513 -4.076 -4.761 1.097
49 HG2 PRO 513 2HG PRO 513 -3.455 -1.917 1.782
50 HG3 PRO 513 1HG PRO 513 -3.479 -2.709 0.201
51 HD2 PRO 513 2HD PRO 513 -5.523 -1.159 1.189
52 HD3 PRO 513 1HD PRO 513 -5.733 -2.419 -0.041
53 H ASN 514 H ASN 514 -3.303 -2.512 3.502
54 HA ASN 514 HA ASN 514 -4.293 -2.326 6.265
55 HB2 ASN 514 2HB ASN 514 -1.741 -3.399 5.244
56 HB3 ASN 514 1HB ASN 514 -1.601 -2.287 6.599
57 HD21 ASN 514 1HD2 ASN 514 -3.323 -5.184 5.532
58 HD22 ASN 514 2HD2 ASN 514 -3.446 -5.904 7.097
59 H LEU 515 H LEU 515 -1.496 -1.223 4.432
60 HA LEU 515 HA LEU 515 -0.403 0.786 4.451
61 HB2 LEU 515 2HB LEU 515 -1.583 2.391 3.139
62 HB3 LEU 515 1HB LEU 515 -1.967 0.776 2.571
63 HG LEU 515 HG LEU 515 -3.989 1.288 4.366
64 HD11 LEU 515 1HD1 LEU 515 -4.495 3.451 4.493
65 HD12 LEU 515 2HD1 LEU 515 -4.285 3.674 2.757
66 HD13 LEU 515 3HD1 LEU 515 -2.893 3.777 3.833
67 HD21 LEU 515 3HD2 LEU 515 -3.907 1.660 1.380
68 HD22 LEU 515 1HD2 LEU 515 -5.384 1.547 2.336
69 HD23 LEU 515 2HD2 LEU 515 -4.276 0.176 2.257
70 H HIS 516 H HIS 516 -0.981 0.297 7.023
71 HA HIS 516 HA HIS 516 -2.147 2.766 8.091
72 HB2 HIS 516 2HB HIS 516 -2.085 -0.006 8.978
73 HB3 HIS 516 1HB HIS 516 -1.582 1.105 10.247
74 HD1 HIS 516 1HD HIS 516 -4.274 1.739 7.658
75 HD2 HIS 516 2HD HIS 516 -3.857 1.169 11.753
76 HE1 HIS 516 1HE HIS 516 -6.547 2.193 8.634
77 HE2 HIS 516 2HE HIS 516 -6.249 1.926 11.121
78 H TYR 517 H TYR 517 0.868 1.479 7.343
79 HA TYR 517 HA TYR 517 2.290 2.489 9.623
80 HB2 TYR 517 2HB TYR 517 4.257 1.706 8.609
81 HB3 TYR 517 1HB TYR 517 3.030 0.569 8.072
82 HD1 TYR 517 2HD TYR 517 4.461 3.830 6.907
83 HD2 TYR 517 1HD TYR 517 3.202 -0.098 5.866
84 HE1 TYR 517 2HE TYR 517 5.095 4.256 4.583
85 HE2 TYR 517 1HE TYR 517 3.843 0.315 3.533
86 HH TYR 517 HH TYR 517 5.713 3.008 2.589
87 H TRP 518 H TRP 518 1.225 3.765 6.594
88 HA TRP 518 HA TRP 518 2.769 6.217 7.031
89 HB2 TRP 518 2HB TRP 518 2.661 4.719 4.771
90 HB3 TRP 518 1HB TRP 518 1.388 5.897 4.467
91 HD1 TRP 518 HD TRP 518 2.409 7.623 2.922
92 HE1 TRP 518 1HE TRP 518 4.549 9.055 2.883
93 HE3 TRP 518 3HE TRP 518 4.759 5.644 6.989
94 HZ2 TRP 518 2HZ TRP 518 6.921 9.307 4.394
95 HZ3 TRP 518 3HZ TRP 518 6.959 6.532 7.634
96 HH2 TRP 518 HH TRP 518 8.016 8.328 6.362
97 H THR 519 H THR 519 1.773 7.965 7.565
98 HA THR 519 HA THR 519 -0.397 8.567 8.730
99 HB THR 519 HB THR 519 0.894 10.394 8.028
100 HG1 THR 519 1HG THR 519 -1.460 10.746 8.127
101 HG21 THR 519 3HG2 THR 519 1.673 10.797 5.987
102 HG22 THR 519 1HG2 THR 519 0.091 10.574 5.238
103 HG23 THR 519 2HG2 THR 519 1.105 9.174 5.593
104 H THR 520 H THR 520 -0.658 8.350 5.164
105 HA THR 520 HA THR 520 -3.028 6.870 5.171
106 HB THR 520 HB THR 520 -3.798 9.132 6.164
107 HG1 THR 520 1HG THR 520 -5.770 8.940 5.007
108 HG21 THR 520 3HG2 THR 520 -4.519 10.791 4.538
109 HG22 THR 520 1HG2 THR 520 -3.708 9.896 3.253
110 HG23 THR 520 2HG2 THR 520 -2.763 10.629 4.550
111 H GLN 521 H GLN 521 -1.399 9.525 3.458
112 HA GLN 521 HA GLN 521 -2.235 9.171 0.905
113 HB2 GLN 521 2HB GLN 521 0.007 9.917 0.156
114 HB3 GLN 521 1HB GLN 521 -0.663 10.908 1.445
115 HG2 GLN 521 2HG GLN 521 0.726 9.651 3.063
116 HG3 GLN 521 1HG GLN 521 1.451 8.785 1.709
117 HE21 GLN 521 1HE2 GLN 521 2.107 11.080 3.818
118 HE22 GLN 521 2HE2 GLN 521 3.105 12.131 2.877
119 H ASP 522 H ASP 522 -1.544 8.011 -0.912
120 HA ASP 522 HA ASP 522 -1.307 5.289 -0.625
121 HB2 ASP 522 2HB ASP 522 -0.538 7.095 -2.912
122 HB3 ASP 522 1HB ASP 522 -0.448 5.340 -3.029
123 H GLU 523 H GLU 523 0.265 4.701 0.858
124 HA GLU 523 HA GLU 523 3.044 5.383 0.320
125 HB2 GLU 523 2HB GLU 523 3.513 4.231 2.422
126 HB3 GLU 523 1HB GLU 523 2.268 5.451 2.621
127 HG2 GLU 523 2HG GLU 523 1.374 2.685 2.071
128 HG3 GLU 523 1HG GLU 523 2.069 3.014 3.658
129 H GLY 524 H GLY 524 2.483 4.137 -1.779
130 HA2 GLY 524 2HA GLY 524 3.753 2.363 -2.840
131 HA3 GLY 524 1HA GLY 524 3.427 1.366 -1.423
132 H ALA 525 H ALA 525 0.793 3.253 -2.274
133 HA ALA 525 HA ALA 525 -0.838 1.043 -2.905
134 HB1 ALA 525 1HB ALA 525 -2.604 2.531 -2.923
135 HB2 ALA 525 2HB ALA 525 -1.625 3.845 -3.576
136 HB3 ALA 525 3HB ALA 525 -1.436 3.359 -1.891
137 H ALA 526 H ALA 526 0.971 0.551 -4.707
138 HA ALA 526 HA ALA 526 1.408 0.200 -6.898
139 HB1 ALA 526 1HB ALA 526 -0.502 0.085 -8.419
140 HB2 ALA 526 2HB ALA 526 -1.506 0.897 -7.218
141 HB3 ALA 526 3HB ALA 526 -0.852 -0.706 -6.882
142 H ILE 527 H ILE 527 2.820 1.948 -6.992
143 HA ILE 527 HA ILE 527 2.308 3.778 -9.057
144 HB ILE 527 HB ILE 527 1.027 4.947 -7.437
145 HG12 ILE 527 2HG1 ILE 527 3.637 6.437 -7.394
146 HG13 ILE 527 1HG1 ILE 527 2.778 6.186 -8.911
147 HG21 ILE 527 1HG2 ILE 527 3.330 5.222 -5.580
148 HG22 ILE 527 2HG2 ILE 527 2.334 3.763 -5.550
149 HG23 ILE 527 3HG2 ILE 527 1.598 5.340 -5.256
150 HD11 ILE 527 3HD1 ILE 527 2.370 8.190 -6.970
151 HD12 ILE 527 1HD1 ILE 527 0.935 7.167 -6.984
152 HD13 ILE 527 2HD1 ILE 527 1.491 7.925 -8.476
153 H GLY 528 H GLY 528 4.197 3.351 -6.078
154 HA2 GLY 528 2HA GLY 528 6.451 3.251 -5.703
155 HA3 GLY 528 1HA GLY 528 6.604 2.771 -7.380
156 H ALA 529 H ALA 529 5.283 5.524 -8.041
157 HA ALA 529 HA ALA 529 6.142 7.454 -8.916
158 HB1 ALA 529 1HB ALA 529 6.435 8.998 -7.286
159 HB2 ALA 529 2HB ALA 529 7.583 8.002 -6.393
160 HB3 ALA 529 3HB ALA 529 5.853 7.679 -6.269
161 H ALA 530 H ALA 530 7.809 5.124 -9.371
162 HA ALA 530 HA ALA 530 10.003 6.144 -10.618
163 HB1 ALA 530 1HB ALA 530 11.495 6.739 -9.066
164 HB2 ALA 530 2HB ALA 530 11.536 5.069 -8.499
165 HB3 ALA 530 3HB ALA 530 10.409 6.216 -7.779
166 H TRP 531 H TRP 531 8.330 4.182 -11.218
167 HA TRP 531 HA TRP 531 7.969 1.895 -11.421
168 HB2 TRP 531 2HB TRP 531 10.037 0.953 -12.713
169 HB3 TRP 531 1HB TRP 531 8.997 2.165 -13.454
170 HD1 TRP 531 HD TRP 531 12.063 2.482 -11.094
171 HE1 TRP 531 1HE TRP 531 13.699 4.173 -12.145
172 HE3 TRP 531 3HE TRP 531 9.485 3.549 -15.375
173 HZ2 TRP 531 2HZ TRP 531 13.870 5.748 -14.483
174 HZ3 TRP 531 3HZ TRP 531 10.452 5.156 -16.967
175 HH2 TRP 531 HH TRP 531 12.599 6.233 -16.528
176 H ILE 532 H ILE 532 8.609 2.294 -8.894
177 HA ILE 532 HA ILE 532 10.212 -0.064 -8.289
178 HB ILE 532 HB ILE 532 11.521 2.008 -8.032
179 HG12 ILE 532 2HG1 ILE 532 10.910 0.733 -5.355
180 HG13 ILE 532 1HG1 ILE 532 11.886 -0.036 -6.596
181 HG21 ILE 532 1HG2 ILE 532 10.852 3.784 -6.782
182 HG22 ILE 532 2HG2 ILE 532 9.916 2.790 -5.663
183 HG23 ILE 532 3HG2 ILE 532 9.268 3.162 -7.265
184 HD11 ILE 532 3HD1 ILE 532 13.116 1.147 -4.734
185 HD12 ILE 532 1HD1 ILE 532 12.560 2.655 -5.463
186 HD13 ILE 532 2HD1 ILE 532 13.590 1.560 -6.385
187 HA PRO 533 HA PRO 533 6.231 0.835 -5.660
188 HB2 PRO 533 2HB PRO 533 4.286 -0.409 -7.131
189 HB3 PRO 533 1HB PRO 533 4.591 1.328 -7.185
190 HG2 PRO 533 2HG PRO 533 5.460 -0.803 -9.080
191 HG3 PRO 533 1HG PRO 533 4.888 0.839 -9.421
192 HD2 PRO 533 2HD PRO 533 7.501 0.155 -9.481
193 HD3 PRO 533 1HD PRO 533 6.935 1.773 -9.017
194 H TYR 534 H TYR 534 7.624 -1.652 -7.507
195 HA TYR 534 HA TYR 534 6.461 -3.962 -6.493
196 HB2 TYR 534 2HB TYR 534 9.304 -3.479 -7.423
197 HB3 TYR 534 1HB TYR 534 8.550 -5.059 -7.242
198 HD1 TYR 534 2HD TYR 534 8.510 -1.912 -9.251
199 HD2 TYR 534 1HD TYR 534 7.080 -5.922 -8.896
200 HE1 TYR 534 2HE TYR 534 7.662 -1.819 -11.550
201 HE2 TYR 534 1HE TYR 534 6.234 -5.821 -11.200
202 HH TYR 534 HH TYR 534 5.692 -3.139 -12.848
203 H PHE 535 H PHE 535 9.505 -2.390 -5.493
204 HA PHE 535 HA PHE 535 9.039 -3.401 -2.774
205 HB2 PHE 535 2HB PHE 535 11.629 -3.583 -2.676
206 HB3 PHE 535 1HB PHE 535 10.707 -4.871 -3.442
207 HD1 PHE 535 1HD PHE 535 12.181 -1.588 -4.445
208 HD2 PHE 535 2HD PHE 535 11.605 -5.701 -5.374
209 HE1 PHE 535 1HE PHE 535 13.501 -1.305 -6.502
210 HE2 PHE 535 2HE PHE 535 12.926 -5.425 -7.432
211 HZ PHE 535 HZ PHE 535 13.876 -3.225 -7.998
212 H GLY 536 H GLY 536 9.009 -0.722 -4.438
213 HA2 GLY 536 2HA GLY 536 10.926 1.003 -3.330
214 HA3 GLY 536 1HA GLY 536 9.371 1.499 -3.985
215 HA PRO 537 HA PRO 537 8.427 2.477 0.281
216 HB2 PRO 537 2HB PRO 537 6.022 3.515 -0.057
217 HB3 PRO 537 1HB PRO 537 7.406 4.306 -0.838
218 HG2 PRO 537 2HG PRO 537 5.489 2.306 -2.008
219 HG3 PRO 537 1HG PRO 537 5.922 3.907 -2.650
220 HD2 PRO 537 2HD PRO 537 7.093 1.611 -3.490
221 HD3 PRO 537 1HD PRO 537 7.975 3.155 -3.422
222 H ALA 538 H ALA 538 7.959 -0.190 -0.986
223 HA ALA 538 HA ALA 538 5.744 -1.103 0.673
224 HB1 ALA 538 1HB ALA 538 5.186 -2.735 -0.999
225 HB2 ALA 538 2HB ALA 538 6.597 -2.295 -1.967
226 HB3 ALA 538 3HB ALA 538 5.259 -1.158 -1.788
227 H ALA 539 H ALA 539 8.990 -1.303 -0.378
228 HA ALA 539 HA ALA 539 9.577 -3.216 1.679
229 HB1 ALA 539 1HB ALA 539 10.737 -4.794 0.201
230 HB2 ALA 539 2HB ALA 539 10.125 -3.899 -1.189
231 HB3 ALA 539 3HB ALA 539 9.002 -4.713 -0.100
232 H GLU 540 H GLU 540 10.376 -0.401 0.465
233 HA GLU 540 HA GLU 540 13.222 -0.656 0.094
234 HB2 GLU 540 2HB GLU 540 13.252 1.789 0.212
235 HB3 GLU 540 1HB GLU 540 12.017 1.226 -0.902
236 HG2 GLU 540 2HG GLU 540 10.421 1.458 1.108
237 HG3 GLU 540 1HG GLU 540 11.696 2.460 1.800
238 H GLY 541 H GLY 541 12.951 -2.050 2.191
239 HA2 GLY 541 2HA GLY 541 14.169 -2.119 4.247
240 HA3 GLY 541 1HA GLY 541 13.864 -0.391 4.437
241 H ILE 542 H ILE 542 11.058 -1.069 3.384
242 HA ILE 542 HA ILE 542 9.696 -1.052 5.812
243 HB ILE 542 HB ILE 542 9.009 -1.177 2.953
244 HG12 ILE 542 2HG1 ILE 542 7.357 0.083 5.093
245 HG13 ILE 542 1HG1 ILE 542 8.958 0.734 4.766
246 HG21 ILE 542 1HG2 ILE 542 7.251 -2.508 4.987
247 HG22 ILE 542 2HG2 ILE 542 7.721 -3.069 3.381
248 HG23 ILE 542 3HG2 ILE 542 6.578 -1.732 3.554
249 HD11 ILE 542 3HD1 ILE 542 7.055 0.292 2.517
250 HD12 ILE 542 1HD1 ILE 542 8.387 1.438 2.658
251 HD13 ILE 542 2HD1 ILE 542 6.892 1.710 3.552
252 H TYR 543 H TYR 543 10.206 -3.682 3.468
253 HA TYR 543 HA TYR 543 8.762 -5.716 4.499
254 HB2 TYR 543 2HB TYR 543 10.355 -7.272 3.565
255 HB3 TYR 543 1HB TYR 543 10.196 -5.883 2.494
256 HD1 TYR 543 2HD TYR 543 11.948 -3.980 2.895
257 HD2 TYR 543 1HD TYR 543 12.463 -8.010 4.118
258 HE1 TYR 543 2HE TYR 543 14.386 -3.636 2.953
259 HE2 TYR 543 1HE TYR 543 14.904 -7.689 4.186
260 HH TYR 543 HH TYR 543 16.468 -5.531 4.515
261 H ALA 544 H ALA 544 11.621 -4.334 5.928
262 HA ALA 544 HA ALA 544 12.396 -6.326 7.701
263 HB1 ALA 544 1HB ALA 544 13.337 -4.535 9.058
264 HB2 ALA 544 2HB ALA 544 12.384 -3.351 8.163
265 HB3 ALA 544 3HB ALA 544 13.652 -4.263 7.345
266 H GLU 545 H GLU 545 9.509 -4.534 7.626
267 HA GLU 545 HA GLU 545 8.735 -4.305 10.267
268 HB2 GLU 545 2HB GLU 545 6.383 -4.601 9.278
269 HB3 GLU 545 1HB GLU 545 7.359 -3.288 8.639
270 HG2 GLU 545 2HG GLU 545 6.562 -4.163 6.699
271 HG3 GLU 545 1HG GLU 545 8.041 -5.104 6.861
272 H GLY 546 H GLY 546 8.433 -6.988 8.024
273 HA2 GLY 546 2HA GLY 546 7.967 -9.198 8.302
274 HA3 GLY 546 1HA GLY 546 8.905 -9.029 9.768
275 H LEU 547 H LEU 547 5.601 -7.992 8.788
276 HA LEU 547 HA LEU 547 4.331 -9.852 10.491
277 HB2 LEU 547 2HB LEU 547 3.364 -7.609 11.805
278 HB3 LEU 547 1HB LEU 547 4.396 -8.857 12.467
279 HG LEU 547 HG LEU 547 6.375 -7.520 11.911
280 HD11 LEU 547 1HD1 LEU 547 4.317 -5.619 10.830
281 HD12 LEU 547 2HD1 LEU 547 5.731 -6.286 10.014
282 HD13 LEU 547 3HD1 LEU 547 5.935 -5.097 11.299
283 HD21 LEU 547 3HD2 LEU 547 4.689 -5.577 13.353
284 HD22 LEU 547 1HD2 LEU 547 6.235 -6.298 13.803
285 HD23 LEU 547 2HD2 LEU 547 4.742 -7.214 14.007
286 H MET 548 H MET 548 3.986 -6.630 9.019
287 HA MET 548 HA MET 548 1.896 -7.434 7.324
288 HB2 MET 548 2HB MET 548 0.016 -6.180 8.370
289 HB3 MET 548 1HB MET 548 0.521 -7.593 9.286
290 HG2 MET 548 2HG MET 548 1.713 -6.209 10.854
291 HG3 MET 548 1HG MET 548 1.364 -4.771 9.898
292 HE1 MET 548 3HE MET 548 0.612 -3.488 11.633
293 HE2 MET 548 1HE MET 548 -0.939 -3.582 12.467
294 HE3 MET 548 2HE MET 548 -0.883 -3.177 10.751
295 H HIS 549 H HIS 549 3.573 -4.852 8.981
296 HA HIS 549 HA HIS 549 2.669 -2.619 7.644
297 HB2 HIS 549 2HB HIS 549 4.987 -3.330 9.217
298 HB3 HIS 549 1HB HIS 549 5.414 -2.195 7.940
299 HD1 HIS 549 1HD HIS 549 1.999 -1.933 9.327
300 HD2 HIS 549 2HD HIS 549 5.722 -0.204 9.957
301 HE1 HIS 549 1HE HIS 549 1.559 0.112 10.707
302 HE2 HIS 549 2HE HIS 549 3.837 1.087 11.171
303 H ASN 550 H ASN 550 4.291 -5.264 6.232
304 HA ASN 550 HA ASN 550 5.659 -3.856 4.164
305 HB2 ASN 550 2HB ASN 550 5.851 -6.115 3.111
306 HB3 ASN 550 1HB ASN 550 6.439 -6.046 4.769
307 HD21 ASN 550 1HD2 ASN 550 6.164 -8.209 5.158
308 HD22 ASN 550 2HD2 ASN 550 4.611 -8.952 5.296
309 H GLN 551 H GLN 551 2.544 -3.740 4.658
310 HA GLN 551 HA GLN 551 1.142 -4.681 2.490
311 HB2 GLN 551 2HB GLN 551 -0.363 -2.685 2.906
312 HB3 GLN 551 1HB GLN 551 -0.034 -3.703 4.304
313 HG2 GLN 551 2HG GLN 551 1.947 -1.650 4.133
314 HG3 GLN 551 1HG GLN 551 0.342 -0.931 4.051
315 HE21 GLN 551 1HE2 GLN 551 1.228 -0.034 6.127
316 HE22 GLN 551 2HE2 GLN 551 0.904 -0.930 7.569
317 H ASP 552 H ASP 552 -0.012 -2.836 1.003
318 HA ASP 552 HA ASP 552 2.064 -1.222 -0.290
319 HB2 ASP 552 2HB ASP 552 0.210 -3.038 -1.844
320 HB3 ASP 552 1HB ASP 552 1.514 -2.045 -2.489
321 H GLY 553 H GLY 553 -1.397 -2.108 -0.402
322 HA2 GLY 553 2HA GLY 553 -2.998 -0.333 0.176
323 HA3 GLY 553 1HA GLY 553 -1.977 0.773 -0.729
324 H LEU 554 H LEU 554 -3.109 -2.480 -1.598
325 HA LEU 554 HA LEU 554 -3.558 -2.102 -4.230
326 HB2 LEU 554 2HB LEU 554 -5.586 -3.751 -3.846
327 HB3 LEU 554 1HB LEU 554 -3.921 -4.273 -3.707
328 HG LEU 554 HG LEU 554 -4.689 -3.376 -1.140
329 HD11 LEU 554 1HD1 LEU 554 -6.897 -3.669 -1.077
330 HD12 LEU 554 2HD1 LEU 554 -6.543 -5.396 -1.133
331 HD13 LEU 554 3HD1 LEU 554 -6.916 -4.524 -2.619
332 HD21 LEU 554 3HD2 LEU 554 -3.088 -5.073 -1.363
333 HD22 LEU 554 1HD2 LEU 554 -4.145 -6.053 -2.380
334 HD23 LEU 554 2HD2 LEU 554 -4.496 -5.869 -0.661
335 H ILE 555 H ILE 555 -6.353 -2.033 -2.022
336 HA ILE 555 HA ILE 555 -8.303 -0.859 -2.077
337 HB ILE 555 HB ILE 555 -6.781 1.244 -3.606
338 HG12 ILE 555 2HG1 ILE 555 -5.421 1.020 -1.743
339 HG13 ILE 555 1HG1 ILE 555 -6.574 2.232 -1.199
340 HG21 ILE 555 1HG2 ILE 555 -9.438 1.116 -2.980
341 HG22 ILE 555 2HG2 ILE 555 -8.536 2.594 -3.308
342 HG23 ILE 555 3HG2 ILE 555 -8.778 2.060 -1.645
343 HD11 ILE 555 3HD1 ILE 555 -6.220 0.639 0.546
344 HD12 ILE 555 1HD1 ILE 555 -6.586 -0.695 -0.546
345 HD13 ILE 555 2HD1 ILE 555 -7.855 0.438 -0.087
346 H CYS 556 H CYS 556 -9.890 -1.647 -3.296
347 HA CYS 556 HA CYS 556 -9.682 -2.355 -5.989
348 HB2 CYS 556 2HB CYS 556 -11.950 -1.984 -4.087
349 HB3 CYS 556 1HB CYS 556 -12.318 -2.144 -5.801
350 H GLY 557 H GLY 557 -10.647 0.661 -4.484
351 HA2 GLY 557 2HA GLY 557 -10.389 2.741 -5.640
352 HA3 GLY 557 1HA GLY 557 -10.668 1.890 -7.154
353 H LEU 558 H LEU 558 -12.915 0.397 -6.038
354 HA LEU 558 HA LEU 558 -14.931 2.117 -5.121
355 HB2 LEU 558 2HB LEU 558 -16.218 2.421 -7.153
356 HB3 LEU 558 1HB LEU 558 -14.624 3.124 -7.335
357 HG LEU 558 HG LEU 558 -15.174 0.358 -8.365
358 HD11 LEU 558 1HD1 LEU 558 -15.424 2.679 -10.197
359 HD12 LEU 558 2HD1 LEU 558 -16.805 2.274 -9.177
360 HD13 LEU 558 3HD1 LEU 558 -16.149 1.074 -10.291
361 HD21 LEU 558 3HD2 LEU 558 -13.011 2.295 -8.470
362 HD22 LEU 558 1HD2 LEU 558 -13.484 1.719 -10.069
363 HD23 LEU 558 2HD2 LEU 558 -13.006 0.566 -8.823
364 H ARG 559 H ARG 559 -14.124 -0.646 -7.109
365 HA ARG 559 HA ARG 559 -14.934 -2.769 -5.817
366 HB2 ARG 559 2HB ARG 559 -17.330 -3.210 -6.475
367 HB3 ARG 559 1HB ARG 559 -17.123 -1.976 -5.240
368 HG2 ARG 559 2HG ARG 559 -17.073 -0.515 -7.559
369 HG3 ARG 559 1HG ARG 559 -18.245 -1.784 -7.920
370 HD2 ARG 559 2HD ARG 559 -19.013 -1.080 -5.421
371 HD3 ARG 559 1HD ARG 559 -18.405 0.461 -6.022
372 HE ARG 559 HE ARG 559 -20.081 -0.663 -7.966
373 HH11 ARG 559 1HH1 ARG 559 -20.271 0.726 -4.771
374 HH12 ARG 559 2HH1 ARG 559 -21.892 1.298 -4.981
375 HH21 ARG 559 1HH2 ARG 559 -22.211 0.089 -8.244
376 HH22 ARG 559 2HH2 ARG 559 -22.994 0.937 -6.953
377 H GLN 560 H GLN 560 -14.763 -4.569 -7.115
378 HA GLN 560 HA GLN 560 -15.275 -4.352 -9.941
379 HB2 GLN 560 2HB GLN 560 -12.997 -4.899 -10.645
380 HB3 GLN 560 1HB GLN 560 -13.040 -3.371 -9.774
381 HG2 GLN 560 2HG GLN 560 -11.336 -4.184 -8.602
382 HG3 GLN 560 1HG GLN 560 -12.541 -5.170 -7.775
383 HE21 GLN 560 1HE2 GLN 560 -12.411 -7.315 -7.929
384 HE22 GLN 560 2HE2 GLN 560 -11.322 -8.175 -8.958
Start of MODEL 3
1 H1 ALA 507 1HT ALA 507 -19.980 4.436 -0.436
2 H2 ALA 507 2HT ALA 507 -18.511 4.049 0.363
3 H3 ALA 507 3HT ALA 507 -19.520 2.797 -0.236
4 HA ALA 507 HA ALA 507 -19.195 3.772 -2.475
5 HB1 ALA 507 2HB ALA 507 -18.390 5.940 -1.890
6 HB2 ALA 507 3HB ALA 507 -17.079 5.084 -2.700
7 HB3 ALA 507 1HB ALA 507 -17.068 5.256 -0.945
8 H GLN 508 H GLN 508 -16.828 2.915 0.032
9 HA GLN 508 HA GLN 508 -15.474 1.104 -1.791
10 HB2 GLN 508 2HB GLN 508 -14.892 1.479 1.143
11 HB3 GLN 508 1HB GLN 508 -13.816 0.859 -0.102
12 HG2 GLN 508 2HG GLN 508 -13.081 2.889 -0.589
13 HG3 GLN 508 1HG GLN 508 -14.721 3.514 -0.758
14 HE21 GLN 508 1HE2 GLN 508 -15.777 4.346 1.088
15 HE22 GLN 508 2HE2 GLN 508 -14.877 4.906 2.452
16 HA PRO 509 HA PRO 509 -17.643 -2.407 -0.131
17 HB2 PRO 509 2HB PRO 509 -16.463 -4.305 -1.600
18 HB3 PRO 509 1HB PRO 509 -17.484 -3.071 -2.348
19 HG2 PRO 509 2HG PRO 509 -14.546 -3.368 -2.409
20 HG3 PRO 509 1HG PRO 509 -15.619 -2.559 -3.560
21 HD2 PRO 509 2HD PRO 509 -14.063 -1.384 -1.440
22 HD3 PRO 509 1HD PRO 509 -15.113 -0.566 -2.613
23 H LYS 510 H LYS 510 -14.968 -1.454 1.115
24 HA LYS 510 HA LYS 510 -13.492 -2.147 2.698
25 HB2 LYS 510 2HB LYS 510 -15.896 -3.854 3.100
26 HB3 LYS 510 1HB LYS 510 -14.440 -4.253 3.999
27 HG2 LYS 510 2HG LYS 510 -14.435 -2.182 5.116
28 HG3 LYS 510 1HG LYS 510 -15.619 -1.494 4.004
29 HD2 LYS 510 2HD LYS 510 -16.296 -3.878 5.689
30 HD3 LYS 510 1HD LYS 510 -16.405 -2.246 6.347
31 HE2 LYS 510 2HE LYS 510 -18.155 -1.666 4.987
32 HE3 LYS 510 1HE LYS 510 -17.687 -2.801 3.721
33 HZ1 LYS 510 3HZ LYS 510 -19.746 -3.387 4.988
34 HZ2 LYS 510 1HZ LYS 510 -18.770 -3.663 6.343
35 HZ3 LYS 510 2HZ LYS 510 -18.568 -4.599 4.949
36 H CYS 511 H CYS 511 -12.029 -2.744 0.924
37 HA CYS 511 HA CYS 511 -11.336 -5.577 1.110
38 HB2 CYS 511 2HB CYS 511 -10.861 -5.580 -1.377
39 HB3 CYS 511 1HB CYS 511 -12.564 -5.569 -0.928
40 H ASN 512 H ASN 512 -10.271 -2.995 2.138
41 HA ASN 512 HA ASN 512 -7.802 -2.579 0.704
42 HB2 ASN 512 2HB ASN 512 -7.305 -0.948 2.483
43 HB3 ASN 512 1HB ASN 512 -8.903 -0.684 1.790
44 HD21 ASN 512 1HD2 ASN 512 -10.125 0.075 3.367
45 HD22 ASN 512 2HD2 ASN 512 -10.286 -0.614 4.943
46 HA PRO 513 HA PRO 513 -5.444 -5.531 2.974
47 HB2 PRO 513 2HB PRO 513 -2.944 -4.650 2.528
48 HB3 PRO 513 1HB PRO 513 -3.942 -5.324 1.235
49 HG2 PRO 513 2HG PRO 513 -3.381 -2.459 1.890
50 HG3 PRO 513 1HG PRO 513 -3.441 -3.253 0.312
51 HD2 PRO 513 2HD PRO 513 -5.495 -1.779 1.366
52 HD3 PRO 513 1HD PRO 513 -5.717 -3.073 0.173
53 H ASN 514 H ASN 514 -3.090 -3.041 3.575
54 HA ASN 514 HA ASN 514 -3.947 -2.813 6.376
55 HB2 ASN 514 2HB ASN 514 -1.413 -3.857 5.271
56 HB3 ASN 514 1HB ASN 514 -1.252 -2.721 6.605
57 HD21 ASN 514 1HD2 ASN 514 -2.825 -5.717 5.623
58 HD22 ASN 514 2HD2 ASN 514 -2.924 -6.398 7.208
59 H LEU 515 H LEU 515 -1.204 -1.690 4.471
60 HA LEU 515 HA LEU 515 -0.172 0.361 4.465
61 HB2 LEU 515 2HB LEU 515 -1.378 1.888 3.066
62 HB3 LEU 515 1HB LEU 515 -1.649 0.241 2.524
63 HG LEU 515 HG LEU 515 -3.773 0.701 4.231
64 HD11 LEU 515 1HD1 LEU 515 -3.916 2.927 4.461
65 HD12 LEU 515 2HD1 LEU 515 -4.550 2.885 2.816
66 HD13 LEU 515 3HD1 LEU 515 -2.845 3.238 3.094
67 HD21 LEU 515 3HD2 LEU 515 -4.970 1.068 1.932
68 HD22 LEU 515 1HD2 LEU 515 -4.237 -0.487 2.326
69 HD23 LEU 515 2HD2 LEU 515 -3.385 0.648 1.279
70 H HIS 516 H HIS 516 -0.750 -0.016 7.020
71 HA HIS 516 HA HIS 516 -2.101 2.408 7.962
72 HB2 HIS 516 2HB HIS 516 -2.029 -0.297 8.892
73 HB3 HIS 516 1HB HIS 516 -1.379 0.752 10.146
74 HD1 HIS 516 1HD HIS 516 -4.063 2.031 7.891
75 HD2 HIS 516 2HD HIS 516 -3.688 0.438 11.710
76 HE1 HIS 516 1HE HIS 516 -6.272 2.454 9.016
77 HE2 HIS 516 2HE HIS 516 -6.050 1.405 11.295
78 H TYR 517 H TYR 517 1.023 1.331 7.324
79 HA TYR 517 HA TYR 517 2.282 2.530 9.617
80 HB2 TYR 517 2HB TYR 517 4.353 1.894 8.694
81 HB3 TYR 517 1HB TYR 517 3.248 0.613 8.228
82 HD1 TYR 517 2HD TYR 517 4.245 3.933 6.766
83 HD2 TYR 517 1HD TYR 517 3.708 -0.245 6.144
84 HE1 TYR 517 2HE TYR 517 4.905 4.206 4.429
85 HE2 TYR 517 1HE TYR 517 4.381 0.020 3.801
86 HH TYR 517 HH TYR 517 5.681 3.009 2.579
87 H TRP 518 H TRP 518 1.075 3.674 6.637
88 HA TRP 518 HA TRP 518 2.593 6.157 6.886
89 HB2 TRP 518 2HB TRP 518 2.480 4.698 4.698
90 HB3 TRP 518 1HB TRP 518 0.932 5.511 4.491
91 HD1 TRP 518 HD TRP 518 1.035 7.748 3.271
92 HE1 TRP 518 1HE TRP 518 2.875 9.457 2.698
93 HE3 TRP 518 3HE TRP 518 4.919 5.628 5.813
94 HZ2 TRP 518 2HZ TRP 518 5.616 9.849 3.255
95 HZ3 TRP 518 3HZ TRP 518 7.120 6.728 5.746
96 HH2 TRP 518 HH TRP 518 7.459 8.796 4.492
97 H THR 519 H THR 519 1.615 7.984 7.238
98 HA THR 519 HA THR 519 -0.447 8.601 8.651
99 HB THR 519 HB THR 519 0.757 10.390 7.713
100 HG1 THR 519 1HG THR 519 -0.864 11.768 7.111
101 HG21 THR 519 3HG2 THR 519 1.299 10.690 5.575
102 HG22 THR 519 1HG2 THR 519 -0.341 10.371 5.013
103 HG23 THR 519 2HG2 THR 519 0.751 9.027 5.356
104 H THR 520 H THR 520 -0.990 8.090 5.151
105 HA THR 520 HA THR 520 -3.344 6.620 5.473
106 HB THR 520 HB THR 520 -4.022 9.002 6.290
107 HG1 THR 520 1HG THR 520 -5.468 7.433 4.443
108 HG21 THR 520 3HG2 THR 520 -4.941 10.436 4.555
109 HG22 THR 520 1HG2 THR 520 -4.255 9.388 3.313
110 HG23 THR 520 2HG2 THR 520 -3.192 10.285 4.399
111 H GLN 521 H GLN 521 -1.911 9.127 3.389
112 HA GLN 521 HA GLN 521 -2.951 8.409 0.965
113 HB2 GLN 521 2HB GLN 521 -0.893 9.299 -0.069
114 HB3 GLN 521 1HB GLN 521 -1.545 10.354 1.178
115 HG2 GLN 521 2HG GLN 521 0.122 9.457 2.757
116 HG3 GLN 521 1HG GLN 521 0.801 8.491 1.447
117 HE21 GLN 521 1HE2 GLN 521 0.928 10.103 -0.640
118 HE22 GLN 521 2HE2 GLN 521 1.908 11.490 -0.321
119 H ASP 522 H ASP 522 -2.217 7.163 -0.784
120 HA ASP 522 HA ASP 522 -1.744 4.518 -0.281
121 HB2 ASP 522 2HB ASP 522 -1.256 6.208 -2.714
122 HB3 ASP 522 1HB ASP 522 -0.888 4.487 -2.722
123 H GLU 523 H GLU 523 -0.097 3.849 0.970
124 HA GLU 523 HA GLU 523 2.605 4.825 0.428
125 HB2 GLU 523 2HB GLU 523 3.149 3.373 2.469
126 HB3 GLU 523 1HB GLU 523 2.237 4.847 2.722
127 HG2 GLU 523 2HG GLU 523 0.693 3.675 3.788
128 HG3 GLU 523 1HG GLU 523 0.352 2.800 2.297
129 H GLY 524 H GLY 524 2.215 3.605 -1.689
130 HA2 GLY 524 2HA GLY 524 3.581 1.949 -2.787
131 HA3 GLY 524 1HA GLY 524 3.362 0.909 -1.381
132 H ALA 525 H ALA 525 0.592 2.608 -2.254
133 HA ALA 525 HA ALA 525 -0.898 0.294 -2.829
134 HB1 ALA 525 1HB ALA 525 -1.846 3.005 -3.631
135 HB2 ALA 525 2HB ALA 525 -1.626 2.629 -1.923
136 HB3 ALA 525 3HB ALA 525 -2.742 1.676 -2.901
137 H ALA 526 H ALA 526 0.967 -0.152 -4.600
138 HA ALA 526 HA ALA 526 1.464 -0.537 -6.772
139 HB1 ALA 526 1HB ALA 526 -0.784 -1.585 -6.637
140 HB2 ALA 526 2HB ALA 526 -0.360 -1.014 -8.251
141 HB3 ALA 526 3HB ALA 526 -1.473 -0.083 -7.250
142 H ILE 527 H ILE 527 2.713 1.318 -6.968
143 HA ILE 527 HA ILE 527 2.034 3.002 -9.107
144 HB ILE 527 HB ILE 527 0.648 4.116 -7.528
145 HG12 ILE 527 2HG1 ILE 527 3.100 5.852 -7.577
146 HG13 ILE 527 1HG1 ILE 527 2.274 5.441 -9.077
147 HG21 ILE 527 1HG2 ILE 527 2.004 3.155 -5.590
148 HG22 ILE 527 2HG2 ILE 527 1.234 4.730 -5.380
149 HG23 ILE 527 3HG2 ILE 527 2.962 4.629 -5.723
150 HD11 ILE 527 3HD1 ILE 527 0.597 6.860 -8.675
151 HD12 ILE 527 1HD1 ILE 527 1.719 7.595 -7.528
152 HD13 ILE 527 2HD1 ILE 527 0.514 6.436 -6.965
153 H GLY 528 H GLY 528 3.950 2.866 -6.118
154 HA2 GLY 528 2HA GLY 528 6.207 2.993 -5.748
155 HA3 GLY 528 1HA GLY 528 6.404 2.481 -7.412
156 H ALA 529 H ALA 529 4.821 5.072 -8.149
157 HA ALA 529 HA ALA 529 5.478 7.053 -9.079
158 HB1 ALA 529 1HB ALA 529 5.160 7.354 -6.464
159 HB2 ALA 529 2HB ALA 529 5.686 8.679 -7.502
160 HB3 ALA 529 3HB ALA 529 6.870 7.773 -6.560
161 H ALA 530 H ALA 530 7.348 4.905 -9.538
162 HA ALA 530 HA ALA 530 9.420 6.097 -10.823
163 HB1 ALA 530 1HB ALA 530 10.822 6.915 -9.286
164 HB2 ALA 530 2HB ALA 530 11.114 5.260 -8.745
165 HB3 ALA 530 3HB ALA 530 9.862 6.231 -7.974
166 H TRP 531 H TRP 531 7.954 3.961 -11.356
167 HA TRP 531 HA TRP 531 7.825 1.643 -11.496
168 HB2 TRP 531 2HB TRP 531 9.972 0.884 -12.781
169 HB3 TRP 531 1HB TRP 531 8.808 1.964 -13.545
170 HD1 TRP 531 HD TRP 531 11.841 2.658 -11.221
171 HE1 TRP 531 1HE TRP 531 13.287 4.478 -12.331
172 HE3 TRP 531 3HE TRP 531 9.139 3.337 -15.505
173 HZ2 TRP 531 2HZ TRP 531 13.281 5.998 -14.711
174 HZ3 TRP 531 3HZ TRP 531 9.926 4.992 -17.147
175 HH2 TRP 531 HH TRP 531 11.954 6.295 -16.756
176 H ILE 532 H ILE 532 8.440 2.179 -8.985
177 HA ILE 532 HA ILE 532 10.284 0.017 -8.333
178 HB ILE 532 HB ILE 532 11.371 2.219 -8.144
179 HG12 ILE 532 2HG1 ILE 532 10.910 0.962 -5.429
180 HG13 ILE 532 1HG1 ILE 532 11.962 0.272 -6.655
181 HG21 ILE 532 1HG2 ILE 532 9.704 2.896 -5.785
182 HG22 ILE 532 2HG2 ILE 532 9.018 3.159 -7.393
183 HG23 ILE 532 3HG2 ILE 532 10.531 3.950 -6.935
184 HD11 ILE 532 3HD1 ILE 532 13.059 1.633 -4.832
185 HD12 ILE 532 1HD1 ILE 532 12.337 3.051 -5.598
186 HD13 ILE 532 2HD1 ILE 532 13.479 2.051 -6.496
187 HA PRO 533 HA PRO 533 6.247 0.572 -5.687
188 HB2 PRO 533 2HB PRO 533 4.430 -0.900 -7.111
189 HB3 PRO 533 1HB PRO 533 4.552 0.858 -7.207
190 HG2 PRO 533 2HG PRO 533 5.635 -1.216 -9.058
191 HG3 PRO 533 1HG PRO 533 4.881 0.341 -9.436
192 HD2 PRO 533 2HD PRO 533 7.549 -0.036 -9.510
193 HD3 PRO 533 1HD PRO 533 6.811 1.514 -9.055
194 H TYR 534 H TYR 534 7.860 -1.812 -7.507
195 HA TYR 534 HA TYR 534 6.956 -4.204 -6.454
196 HB2 TYR 534 2HB TYR 534 9.746 -3.419 -7.335
197 HB3 TYR 534 1HB TYR 534 9.186 -5.073 -7.112
198 HD1 TYR 534 1HD TYR 534 8.801 -2.021 -9.227
199 HD2 TYR 534 2HD TYR 534 7.878 -6.167 -8.762
200 HE1 TYR 534 1HE TYR 534 8.004 -2.110 -11.544
201 HE2 TYR 534 2HE TYR 534 7.082 -6.248 -11.084
202 HH TYR 534 HH TYR 534 7.631 -3.705 -13.309
203 H PHE 535 H PHE 535 9.804 -2.317 -5.419
204 HA PHE 535 HA PHE 535 9.362 -3.303 -2.688
205 HB2 PHE 535 2HB PHE 535 12.019 -3.119 -4.108
206 HB3 PHE 535 1HB PHE 535 11.820 -3.480 -2.397
207 HD1 PHE 535 2HD PHE 535 9.952 -5.450 -2.050
208 HD2 PHE 535 1HD PHE 535 12.491 -4.924 -5.424
209 HE1 PHE 535 2HE PHE 535 9.735 -7.842 -2.581
210 HE2 PHE 535 1HE PHE 535 12.278 -7.315 -5.962
211 HZ PHE 535 HZ PHE 535 10.899 -8.778 -4.540
212 H GLY 536 H GLY 536 9.251 -0.663 -4.498
213 HA2 GLY 536 2HA GLY 536 10.931 1.252 -3.373
214 HA3 GLY 536 1HA GLY 536 9.349 1.589 -4.064
215 HA PRO 537 HA PRO 537 8.195 2.584 0.144
216 HB2 PRO 537 2HB PRO 537 5.667 3.236 -0.255
217 HB3 PRO 537 1HB PRO 537 6.926 4.187 -1.065
218 HG2 PRO 537 2HG PRO 537 5.349 1.866 -2.149
219 HG3 PRO 537 1HG PRO 537 5.537 3.485 -2.862
220 HD2 PRO 537 2HD PRO 537 7.055 1.369 -3.598
221 HD3 PRO 537 1HD PRO 537 7.696 3.029 -3.580
222 H ALA 538 H ALA 538 8.140 -0.175 -1.013
223 HA ALA 538 HA ALA 538 6.064 -1.344 0.665
224 HB1 ALA 538 1HB ALA 538 5.697 -1.528 -1.841
225 HB2 ALA 538 2HB ALA 538 5.709 -3.050 -0.948
226 HB3 ALA 538 3HB ALA 538 7.129 -2.560 -1.878
227 H ALA 539 H ALA 539 9.318 -1.154 -0.417
228 HA ALA 539 HA ALA 539 10.160 -2.859 1.744
229 HB1 ALA 539 1HB ALA 539 11.720 -4.051 -0.029
230 HB2 ALA 539 2HB ALA 539 10.348 -3.696 -1.076
231 HB3 ALA 539 3HB ALA 539 10.116 -4.656 0.384
232 H GLU 540 H GLU 540 10.535 -0.008 0.512
233 HA GLU 540 HA GLU 540 13.386 0.143 0.090
234 HB2 GLU 540 2HB GLU 540 13.059 2.577 0.199
235 HB3 GLU 540 1HB GLU 540 11.940 1.823 -0.924
236 HG2 GLU 540 2HG GLU 540 10.284 1.834 1.035
237 HG3 GLU 540 1HG GLU 540 11.391 2.989 1.776
238 H GLY 541 H GLY 541 13.339 -1.249 2.201
239 HA2 GLY 541 2HA GLY 541 14.515 -1.180 4.260
240 HA3 GLY 541 1HA GLY 541 14.102 0.530 4.400
241 H ILE 542 H ILE 542 11.375 -0.716 3.319
242 HA ILE 542 HA ILE 542 9.990 -0.560 5.768
243 HB ILE 542 HB ILE 542 9.338 -0.894 2.932
244 HG12 ILE 542 2HG1 ILE 542 7.721 0.287 5.182
245 HG13 ILE 542 1HG1 ILE 542 9.064 1.134 4.423
246 HG21 ILE 542 1HG2 ILE 542 7.015 -1.742 3.459
247 HG22 ILE 542 2HG2 ILE 542 7.661 -2.287 5.007
248 HG23 ILE 542 3HG2 ILE 542 8.313 -2.939 3.499
249 HD11 ILE 542 3HD1 ILE 542 6.443 0.338 3.230
250 HD12 ILE 542 1HD1 ILE 542 7.835 0.748 2.231
251 HD13 ILE 542 2HD1 ILE 542 7.170 1.941 3.347
252 H TYR 543 H TYR 543 10.860 -3.284 3.649
253 HA TYR 543 HA TYR 543 9.548 -5.363 4.796
254 HB2 TYR 543 2HB TYR 543 11.458 -6.813 4.144
255 HB3 TYR 543 1HB TYR 543 10.937 -5.715 2.870
256 HD1 TYR 543 2HD TYR 543 12.271 -3.680 2.402
257 HD2 TYR 543 1HD TYR 543 13.651 -6.724 5.012
258 HE1 TYR 543 2HE TYR 543 14.567 -2.813 2.177
259 HE2 TYR 543 1HE TYR 543 15.954 -5.877 4.805
260 HH TYR 543 HH TYR 543 17.235 -4.473 2.924
261 H ALA 544 H ALA 544 12.188 -3.585 6.189
262 HA ALA 544 HA ALA 544 13.143 -5.332 8.114
263 HB1 ALA 544 1HB ALA 544 12.692 -2.372 8.431
264 HB2 ALA 544 2HB ALA 544 14.093 -3.116 7.659
265 HB3 ALA 544 3HB ALA 544 13.795 -3.369 9.379
266 H GLU 545 H GLU 545 10.047 -3.941 7.841
267 HA GLU 545 HA GLU 545 9.136 -3.708 10.437
268 HB2 GLU 545 2HB GLU 545 6.890 -4.386 9.375
269 HB3 GLU 545 1HB GLU 545 7.689 -2.961 8.729
270 HG2 GLU 545 2HG GLU 545 7.162 -3.972 6.778
271 HG3 GLU 545 1HG GLU 545 8.709 -4.760 7.063
272 H GLY 546 H GLY 546 9.250 -6.491 8.297
273 HA2 GLY 546 2HA GLY 546 9.037 -8.732 8.665
274 HA3 GLY 546 1HA GLY 546 9.924 -8.389 10.137
275 H LEU 547 H LEU 547 6.553 -7.759 9.054
276 HA LEU 547 HA LEU 547 5.448 -9.631 10.853
277 HB2 LEU 547 2HB LEU 547 4.670 -8.369 12.631
278 HB3 LEU 547 1HB LEU 547 6.307 -7.790 12.396
279 HG LEU 547 HG LEU 547 3.924 -6.353 11.248
280 HD11 LEU 547 1HD1 LEU 547 4.925 -6.441 14.015
281 HD12 LEU 547 2HD1 LEU 547 3.330 -6.019 13.393
282 HD13 LEU 547 3HD1 LEU 547 4.634 -4.834 13.350
283 HD21 LEU 547 3HD2 LEU 547 6.463 -6.041 10.588
284 HD22 LEU 547 1HD2 LEU 547 6.474 -5.067 12.058
285 HD23 LEU 547 2HD2 LEU 547 5.370 -4.665 10.742
286 H MET 548 H MET 548 4.843 -6.564 9.161
287 HA MET 548 HA MET 548 2.853 -7.603 7.510
288 HB2 MET 548 2HB MET 548 1.922 -6.825 10.170
289 HB3 MET 548 1HB MET 548 1.043 -6.029 8.872
290 HG2 MET 548 2HG MET 548 1.436 -8.892 8.452
291 HG3 MET 548 1HG MET 548 0.488 -8.497 9.885
292 HE1 MET 548 3HE MET 548 -0.368 -10.169 7.407
293 HE2 MET 548 1HE MET 548 -1.911 -9.549 6.817
294 HE3 MET 548 2HE MET 548 -1.691 -9.878 8.535
295 H HIS 549 H HIS 549 4.258 -4.835 9.095
296 HA HIS 549 HA HIS 549 3.085 -2.736 7.738
297 HB2 HIS 549 2HB HIS 549 5.490 -3.152 9.289
298 HB3 HIS 549 1HB HIS 549 5.768 -2.000 7.987
299 HD1 HIS 549 1HD HIS 549 2.370 -2.125 9.443
300 HD2 HIS 549 2HD HIS 549 5.863 0.065 9.946
301 HE1 HIS 549 1HE HIS 549 1.711 -0.121 10.795
302 HE2 HIS 549 2HE HIS 549 3.859 1.145 11.177
303 H ASN 550 H ASN 550 4.981 -5.213 6.360
304 HA ASN 550 HA ASN 550 6.136 -3.712 4.229
305 HB2 ASN 550 2HB ASN 550 6.589 -5.947 3.232
306 HB3 ASN 550 1HB ASN 550 7.154 -5.796 4.894
307 HD21 ASN 550 1HD2 ASN 550 7.077 -8.223 4.430
308 HD22 ASN 550 2HD2 ASN 550 5.627 -9.032 4.909
309 H GLN 551 H GLN 551 3.041 -3.936 4.799
310 HA GLN 551 HA GLN 551 1.677 -5.089 2.724
311 HB2 GLN 551 2HB GLN 551 0.016 -3.191 3.092
312 HB3 GLN 551 1HB GLN 551 0.439 -4.154 4.502
313 HG2 GLN 551 2HG GLN 551 2.260 -1.968 4.279
314 HG3 GLN 551 1HG GLN 551 0.610 -1.363 4.182
315 HE21 GLN 551 1HE2 GLN 551 1.446 -0.360 6.239
316 HE22 GLN 551 2HE2 GLN 551 1.178 -1.243 7.700
317 H ASP 552 H ASP 552 0.305 -3.481 1.183
318 HA ASP 552 HA ASP 552 2.196 -1.794 -0.310
319 HB2 ASP 552 2HB ASP 552 0.714 -4.186 -1.256
320 HB3 ASP 552 1HB ASP 552 0.744 -2.803 -2.345
321 H GLY 553 H GLY 553 -1.243 -2.799 -0.259
322 HA2 GLY 553 2HA GLY 553 -2.883 -1.094 0.412
323 HA3 GLY 553 1HA GLY 553 -1.923 0.068 -0.487
324 H LEU 554 H LEU 554 -3.000 -3.192 -1.433
325 HA LEU 554 HA LEU 554 -3.521 -2.787 -4.029
326 HB2 LEU 554 2HB LEU 554 -5.594 -4.379 -3.614
327 HB3 LEU 554 1HB LEU 554 -3.941 -4.949 -3.526
328 HG LEU 554 HG LEU 554 -4.646 -4.043 -0.932
329 HD11 LEU 554 1HD1 LEU 554 -6.861 -4.327 -0.876
330 HD12 LEU 554 2HD1 LEU 554 -6.488 -6.051 -0.866
331 HD13 LEU 554 3HD1 LEU 554 -6.878 -5.241 -2.384
332 HD21 LEU 554 3HD2 LEU 554 -3.022 -5.751 -1.329
333 HD22 LEU 554 1HD2 LEU 554 -4.219 -6.775 -2.121
334 HD23 LEU 554 2HD2 LEU 554 -4.339 -6.454 -0.391
335 H ILE 555 H ILE 555 -6.308 -2.683 -1.811
336 HA ILE 555 HA ILE 555 -8.228 -1.458 -1.842
337 HB ILE 555 HB ILE 555 -6.605 0.642 -3.271
338 HG12 ILE 555 2HG1 ILE 555 -5.346 0.234 -1.343
339 HG13 ILE 555 1HG1 ILE 555 -6.392 1.569 -0.880
340 HG21 ILE 555 1HG2 ILE 555 -8.305 2.003 -1.713
341 HG22 ILE 555 2HG2 ILE 555 -9.277 0.566 -2.031
342 HG23 ILE 555 3HG2 ILE 555 -8.674 1.538 -3.373
343 HD11 ILE 555 3HD1 ILE 555 -6.738 -1.325 -0.192
344 HD12 ILE 555 1HD1 ILE 555 -7.913 -0.066 0.174
345 HD13 ILE 555 2HD1 ILE 555 -6.306 -0.013 0.902
346 H CYS 556 H CYS 556 -9.887 -2.010 -3.082
347 HA CYS 556 HA CYS 556 -9.678 -2.631 -5.823
348 HB2 CYS 556 2HB CYS 556 -12.212 -1.962 -4.322
349 HB3 CYS 556 1HB CYS 556 -12.067 -2.937 -5.781
350 H GLY 557 H GLY 557 -10.342 0.330 -4.139
351 HA2 GLY 557 2HA GLY 557 -10.276 2.482 -5.032
352 HA3 GLY 557 1HA GLY 557 -10.245 1.782 -6.647
353 H LEU 558 H LEU 558 -12.607 0.793 -4.317
354 HA LEU 558 HA LEU 558 -14.858 0.886 -4.269
355 HB2 LEU 558 2HB LEU 558 -15.762 2.961 -4.097
356 HB3 LEU 558 1HB LEU 558 -14.065 3.389 -3.991
357 HG LEU 558 HG LEU 558 -14.976 3.354 -6.741
358 HD11 LEU 558 1HD1 LEU 558 -17.124 3.954 -5.907
359 HD12 LEU 558 2HD1 LEU 558 -16.363 5.413 -6.542
360 HD13 LEU 558 3HD1 LEU 558 -16.426 5.138 -4.801
361 HD21 LEU 558 3HD2 LEU 558 -13.579 5.112 -6.921
362 HD22 LEU 558 1HD2 LEU 558 -12.983 4.502 -5.379
363 HD23 LEU 558 2HD2 LEU 558 -14.125 5.847 -5.413
364 H ARG 559 H ARG 559 -13.267 0.491 -7.010
365 HA ARG 559 HA ARG 559 -13.841 -0.268 -9.076
366 HB2 ARG 559 2HB ARG 559 -16.721 -0.097 -8.186
367 HB3 ARG 559 1HB ARG 559 -16.060 -1.082 -9.482
368 HG2 ARG 559 2HG ARG 559 -16.078 -2.724 -7.976
369 HG3 ARG 559 1HG ARG 559 -14.622 -1.954 -7.343
370 HD2 ARG 559 2HD ARG 559 -16.166 -2.378 -5.533
371 HD3 ARG 559 1HD ARG 559 -16.027 -0.643 -5.794
372 HE ARG 559 HE ARG 559 -18.230 -0.579 -6.437
373 HH11 ARG 559 1HH1 ARG 559 -17.168 -3.901 -6.268
374 HH12 ARG 559 2HH1 ARG 559 -18.766 -4.550 -6.422
375 HH21 ARG 559 1HH2 ARG 559 -20.331 -1.433 -6.639
376 HH22 ARG 559 2HH2 ARG 559 -20.561 -3.150 -6.634
377 H GLN 560 H GLN 560 -14.642 0.492 -11.108
378 HA GLN 560 HA GLN 560 -16.240 2.768 -11.443
379 HB2 GLN 560 2HB GLN 560 -13.619 3.378 -10.563
380 HB3 GLN 560 1HB GLN 560 -13.704 3.832 -12.259
381 HG2 GLN 560 2HG GLN 560 -16.043 4.840 -11.306
382 HG3 GLN 560 1HG GLN 560 -14.975 5.035 -9.918
383 HE21 GLN 560 1HE2 GLN 560 -12.833 6.033 -10.420
384 HE22 GLN 560 2HE2 GLN 560 -12.814 7.341 -11.550
Start of MODEL 4
1 H1 ALA 507 1HT ALA 507 -19.965 1.710 4.103
2 H2 ALA 507 2HT ALA 507 -19.179 2.162 2.645
3 H3 ALA 507 3HT ALA 507 -18.422 2.453 4.157
4 HA ALA 507 HA ALA 507 -17.966 0.273 4.519
5 HB1 ALA 507 2HB ALA 507 -19.737 -0.525 2.222
6 HB2 ALA 507 3HB ALA 507 -20.305 -0.434 3.889
7 HB3 ALA 507 1HB ALA 507 -19.019 -1.560 3.456
8 H GLN 508 H GLN 508 -16.285 -0.899 3.550
9 HA GLN 508 HA GLN 508 -14.870 0.521 1.516
10 HB2 GLN 508 2HB GLN 508 -14.352 -1.736 3.327
11 HB3 GLN 508 1HB GLN 508 -13.531 -1.856 1.777
12 HG2 GLN 508 2HG GLN 508 -12.017 -0.775 3.184
13 HG3 GLN 508 1HG GLN 508 -12.714 0.508 2.195
14 HE21 GLN 508 1HE2 GLN 508 -14.481 1.743 3.156
15 HE22 GLN 508 2HE2 GLN 508 -14.460 2.037 4.858
16 HA PRO 509 HA PRO 509 -15.994 -2.014 -1.944
17 HB2 PRO 509 2HB PRO 509 -13.802 -1.838 -3.496
18 HB3 PRO 509 1HB PRO 509 -14.785 -0.424 -3.104
19 HG2 PRO 509 2HG PRO 509 -12.103 -1.153 -2.149
20 HG3 PRO 509 1HG PRO 509 -12.895 0.428 -2.173
21 HD2 PRO 509 2HD PRO 509 -12.637 -1.432 0.029
22 HD3 PRO 509 1HD PRO 509 -13.325 0.205 0.038
23 H LYS 510 H LYS 510 -14.405 -3.431 0.325
24 HA LYS 510 HA LYS 510 -13.564 -5.494 0.770
25 HB2 LYS 510 2HB LYS 510 -15.429 -5.887 -1.507
26 HB3 LYS 510 1HB LYS 510 -14.384 -7.233 -1.076
27 HG2 LYS 510 2HG LYS 510 -15.247 -7.208 1.193
28 HG3 LYS 510 1HG LYS 510 -16.258 -5.816 0.804
29 HD2 LYS 510 2HD LYS 510 -16.576 -8.120 -0.993
30 HD3 LYS 510 1HD LYS 510 -17.078 -8.403 0.675
31 HE2 LYS 510 2HE LYS 510 -18.060 -5.860 -0.086
32 HE3 LYS 510 1HE LYS 510 -18.436 -6.981 -1.393
33 HZ1 LYS 510 3HZ LYS 510 -19.178 -7.258 1.467
34 HZ2 LYS 510 1HZ LYS 510 -19.400 -8.477 0.314
35 HZ3 LYS 510 2HZ LYS 510 -20.222 -7.006 0.160
36 H CYS 511 H CYS 511 -11.646 -3.960 -0.306
37 HA CYS 511 HA CYS 511 -9.861 -5.856 -1.419
38 HB2 CYS 511 2HB CYS 511 -9.454 -4.377 -3.534
39 HB3 CYS 511 1HB CYS 511 -10.743 -5.575 -3.546
40 H ASN 512 H ASN 512 -9.755 -4.315 0.826
41 HA ASN 512 HA ASN 512 -7.656 -2.351 0.183
42 HB2 ASN 512 2HB ASN 512 -9.513 -2.291 2.570
43 HB3 ASN 512 1HB ASN 512 -8.324 -1.068 2.134
44 HD21 ASN 512 1HD2 ASN 512 -10.207 0.345 2.278
45 HD22 ASN 512 2HD2 ASN 512 -11.220 0.522 0.890
46 HA PRO 513 HA PRO 513 -5.284 -5.060 2.813
47 HB2 PRO 513 2HB PRO 513 -2.870 -4.129 2.287
48 HB3 PRO 513 1HB PRO 513 -3.836 -4.826 0.981
49 HG2 PRO 513 2HG PRO 513 -3.385 -1.948 1.672
50 HG3 PRO 513 1HG PRO 513 -3.358 -2.731 0.082
51 HD2 PRO 513 2HD PRO 513 -5.533 -1.385 1.166
52 HD3 PRO 513 1HD PRO 513 -5.627 -2.565 -0.153
53 H ASN 514 H ASN 514 -2.894 -4.116 3.987
54 HA ASN 514 HA ASN 514 -3.777 -3.186 6.479
55 HB2 ASN 514 2HB ASN 514 -1.214 -3.767 5.157
56 HB3 ASN 514 1HB ASN 514 -1.122 -2.624 6.489
57 HD21 ASN 514 1HD2 ASN 514 -2.539 -3.395 8.432
58 HD22 ASN 514 2HD2 ASN 514 -2.275 -5.034 8.909
59 H LEU 515 H LEU 515 -1.406 -1.554 4.452
60 HA LEU 515 HA LEU 515 -0.728 0.618 4.403
61 HB2 LEU 515 2HB LEU 515 -2.295 2.008 3.260
62 HB3 LEU 515 1HB LEU 515 -2.440 0.364 2.667
63 HG LEU 515 HG LEU 515 -4.336 0.450 4.650
64 HD11 LEU 515 1HD1 LEU 515 -5.241 2.787 3.233
65 HD12 LEU 515 2HD1 LEU 515 -3.750 3.123 4.113
66 HD13 LEU 515 3HD1 LEU 515 -5.156 2.488 4.969
67 HD21 LEU 515 3HD2 LEU 515 -4.221 -0.214 2.051
68 HD22 LEU 515 1HD2 LEU 515 -5.242 1.221 1.961
69 HD23 LEU 515 2HD2 LEU 515 -5.719 -0.139 2.978
70 H HIS 516 H HIS 516 -0.947 -0.009 6.994
71 HA HIS 516 HA HIS 516 -2.285 2.324 8.196
72 HB2 HIS 516 2HB HIS 516 -2.369 -0.470 8.887
73 HB3 HIS 516 1HB HIS 516 -1.710 0.458 10.230
74 HD1 HIS 516 1HD HIS 516 -4.408 1.705 7.901
75 HD2 HIS 516 2HD HIS 516 -3.944 0.429 11.828
76 HE1 HIS 516 1HE HIS 516 -6.595 2.212 9.035
77 HE2 HIS 516 2HE HIS 516 -6.319 1.353 11.388
78 H TYR 517 H TYR 517 0.732 1.053 7.433
79 HA TYR 517 HA TYR 517 2.103 1.974 9.795
80 HB2 TYR 517 2HB TYR 517 4.065 1.113 8.863
81 HB3 TYR 517 1HB TYR 517 2.823 0.049 8.222
82 HD1 TYR 517 2HD TYR 517 4.508 3.257 7.257
83 HD2 TYR 517 1HD TYR 517 3.029 -0.528 5.997
84 HE1 TYR 517 2HE TYR 517 5.280 3.721 4.978
85 HE2 TYR 517 1HE TYR 517 3.802 -0.073 3.714
86 HH TYR 517 HH TYR 517 4.376 1.780 2.300
87 H TRP 518 H TRP 518 1.158 3.308 6.757
88 HA TRP 518 HA TRP 518 2.803 5.684 7.236
89 HB2 TRP 518 2HB TRP 518 2.785 4.254 4.994
90 HB3 TRP 518 1HB TRP 518 1.394 5.277 4.653
91 HD1 TRP 518 HD TRP 518 2.007 7.363 3.367
92 HE1 TRP 518 1HE TRP 518 4.071 8.888 3.151
93 HE3 TRP 518 3HE TRP 518 5.084 5.018 6.695
94 HZ2 TRP 518 2HZ TRP 518 6.663 9.068 4.255
95 HZ3 TRP 518 3HZ TRP 518 7.341 5.928 7.062
96 HH2 TRP 518 HH TRP 518 8.113 7.911 5.865
97 H THR 519 H THR 519 1.889 7.457 7.803
98 HA THR 519 HA THR 519 -0.273 8.148 8.940
99 HB THR 519 HB THR 519 1.128 9.919 8.324
100 HG1 THR 519 1HG THR 519 -1.212 10.414 6.808
101 HG21 THR 519 3HG2 THR 519 2.015 10.301 6.326
102 HG22 THR 519 1HG2 THR 519 0.450 10.222 5.518
103 HG23 THR 519 2HG2 THR 519 1.340 8.738 5.860
104 H THR 520 H THR 520 -0.458 8.046 5.362
105 HA THR 520 HA THR 520 -2.907 6.701 5.277
106 HB THR 520 HB THR 520 -3.568 8.977 6.318
107 HG1 THR 520 1HG THR 520 -5.515 8.621 5.543
108 HG21 THR 520 3HG2 THR 520 -2.421 10.457 4.769
109 HG22 THR 520 1HG2 THR 520 -4.164 10.713 4.718
110 HG23 THR 520 2HG2 THR 520 -3.368 9.807 3.430
111 H GLN 521 H GLN 521 -1.088 9.301 3.672
112 HA GLN 521 HA GLN 521 -1.903 9.052 1.095
113 HB2 GLN 521 2HB GLN 521 0.374 9.720 0.395
114 HB3 GLN 521 1HB GLN 521 -0.261 10.701 1.710
115 HG2 GLN 521 2HG GLN 521 1.029 9.081 3.240
116 HG3 GLN 521 1HG GLN 521 1.891 8.629 1.770
117 HE21 GLN 521 1HE2 GLN 521 3.554 9.840 1.151
118 HE22 GLN 521 2HE2 GLN 521 3.972 11.381 1.809
119 H ASP 522 H ASP 522 -1.204 7.921 -0.743
120 HA ASP 522 HA ASP 522 -1.127 5.185 -0.528
121 HB2 ASP 522 2HB ASP 522 -0.216 5.241 -2.903
122 HB3 ASP 522 1HB ASP 522 -1.719 6.116 -2.625
123 H GLU 523 H GLU 523 0.355 4.423 0.947
124 HA GLU 523 HA GLU 523 3.182 4.988 0.557
125 HB2 GLU 523 2HB GLU 523 3.506 3.656 2.586
126 HB3 GLU 523 1HB GLU 523 2.332 4.935 2.828
127 HG2 GLU 523 2HG GLU 523 1.311 2.261 2.063
128 HG3 GLU 523 1HG GLU 523 1.937 2.467 3.699
129 H GLY 524 H GLY 524 2.626 3.923 -1.646
130 HA2 GLY 524 2HA GLY 524 3.830 2.181 -2.817
131 HA3 GLY 524 1HA GLY 524 3.466 1.103 -1.472
132 H ALA 525 H ALA 525 0.904 3.136 -2.233
133 HA ALA 525 HA ALA 525 -0.787 1.017 -3.005
134 HB1 ALA 525 1HB ALA 525 -1.521 3.858 -3.523
135 HB2 ALA 525 2HB ALA 525 -1.297 3.312 -1.862
136 HB3 ALA 525 3HB ALA 525 -2.505 2.539 -2.889
137 H ALA 526 H ALA 526 1.026 0.597 -4.830
138 HA ALA 526 HA ALA 526 1.487 0.397 -7.035
139 HB1 ALA 526 1HB ALA 526 -0.637 -0.615 -7.234
140 HB2 ALA 526 2HB ALA 526 -0.520 0.532 -8.569
141 HB3 ALA 526 3HB ALA 526 -1.467 0.938 -7.138
142 H ILE 527 H ILE 527 2.886 2.132 -7.119
143 HA ILE 527 HA ILE 527 2.358 4.054 -9.069
144 HB ILE 527 HB ILE 527 1.019 5.112 -7.404
145 HG12 ILE 527 2HG1 ILE 527 3.618 6.644 -7.416
146 HG13 ILE 527 1HG1 ILE 527 2.614 6.493 -8.856
147 HG21 ILE 527 1HG2 ILE 527 1.632 5.521 -5.215
148 HG22 ILE 527 2HG2 ILE 527 3.353 5.354 -5.567
149 HG23 ILE 527 3HG2 ILE 527 2.313 3.927 -5.547
150 HD11 ILE 527 3HD1 ILE 527 2.089 8.565 -7.867
151 HD12 ILE 527 1HD1 ILE 527 1.940 7.845 -6.264
152 HD13 ILE 527 2HD1 ILE 527 0.740 7.486 -7.505
153 H GLY 528 H GLY 528 4.197 3.556 -6.071
154 HA2 GLY 528 2HA GLY 528 6.445 3.517 -5.645
155 HA3 GLY 528 1HA GLY 528 6.642 3.067 -7.325
156 H ALA 529 H ALA 529 5.282 5.803 -7.975
157 HA ALA 529 HA ALA 529 6.115 7.765 -8.798
158 HB1 ALA 529 1HB ALA 529 5.715 7.994 -6.205
159 HB2 ALA 529 2HB ALA 529 6.439 9.304 -7.139
160 HB3 ALA 529 3HB ALA 529 7.464 8.229 -6.188
161 H ALA 530 H ALA 530 7.828 5.489 -9.285
162 HA ALA 530 HA ALA 530 10.018 6.559 -10.480
163 HB1 ALA 530 1HB ALA 530 10.393 6.573 -7.620
164 HB2 ALA 530 2HB ALA 530 11.437 7.218 -8.885
165 HB3 ALA 530 3HB ALA 530 11.588 5.531 -8.391
166 H TRP 531 H TRP 531 8.404 4.555 -11.112
167 HA TRP 531 HA TRP 531 8.109 2.256 -11.325
168 HB2 TRP 531 2HB TRP 531 10.217 1.377 -12.596
169 HB3 TRP 531 1HB TRP 531 9.154 2.564 -13.346
170 HD1 TRP 531 HD TRP 531 12.179 2.967 -10.940
171 HE1 TRP 531 1HE TRP 531 13.779 4.704 -11.970
172 HE3 TRP 531 3HE TRP 531 9.633 3.953 -15.260
173 HZ2 TRP 531 2HZ TRP 531 13.938 6.280 -14.308
174 HZ3 TRP 531 3HZ TRP 531 10.575 5.587 -16.840
175 HH2 TRP 531 HH TRP 531 12.683 6.726 -16.372
176 H ILE 532 H ILE 532 8.712 2.668 -8.791
177 HA ILE 532 HA ILE 532 10.374 0.354 -8.173
178 HB ILE 532 HB ILE 532 11.615 2.469 -7.901
179 HG12 ILE 532 2HG1 ILE 532 11.018 1.124 -5.253
180 HG13 ILE 532 1HG1 ILE 532 12.077 0.452 -6.485
181 HG21 ILE 532 1HG2 ILE 532 10.874 4.219 -6.665
182 HG22 ILE 532 2HG2 ILE 532 9.985 3.193 -5.535
183 HG23 ILE 532 3HG2 ILE 532 9.311 3.535 -7.136
184 HD11 ILE 532 3HD1 ILE 532 12.552 3.162 -5.307
185 HD12 ILE 532 1HD1 ILE 532 13.677 2.118 -6.175
186 HD13 ILE 532 2HD1 ILE 532 13.153 1.687 -4.543
187 HA PRO 533 HA PRO 533 6.330 1.140 -5.601
188 HB2 PRO 533 2HB PRO 533 4.454 -0.180 -7.096
189 HB3 PRO 533 1HB PRO 533 4.698 1.567 -7.154
190 HG2 PRO 533 2HG PRO 533 5.680 -0.542 -9.022
191 HG3 PRO 533 1HG PRO 533 5.048 1.072 -9.384
192 HD2 PRO 533 2HD PRO 533 7.684 0.503 -9.401
193 HD3 PRO 533 1HD PRO 533 7.046 2.095 -8.943
194 H TYR 534 H TYR 534 7.834 -1.304 -7.420
195 HA TYR 534 HA TYR 534 6.745 -3.648 -6.398
196 HB2 TYR 534 2HB TYR 534 9.575 -3.076 -7.317
197 HB3 TYR 534 1HB TYR 534 8.865 -4.678 -7.139
198 HD1 TYR 534 2HD TYR 534 8.753 -1.536 -9.154
199 HD2 TYR 534 1HD TYR 534 7.429 -5.583 -8.799
200 HE1 TYR 534 2HE TYR 534 7.920 -1.473 -11.459
201 HE2 TYR 534 1HE TYR 534 6.597 -5.511 -11.110
202 HH TYR 534 HH TYR 534 5.913 -2.966 -12.743
203 H PHE 535 H PHE 535 9.732 -1.963 -5.407
204 HA PHE 535 HA PHE 535 9.296 -2.971 -2.680
205 HB2 PHE 535 2HB PHE 535 11.901 -3.051 -2.593
206 HB3 PHE 535 1HB PHE 535 11.011 -4.388 -3.312
207 HD1 PHE 535 1HD PHE 535 12.988 -1.364 -4.076
208 HD2 PHE 535 2HD PHE 535 11.296 -4.968 -5.577
209 HE1 PHE 535 1HE PHE 535 14.277 -1.099 -6.155
210 HE2 PHE 535 2HE PHE 535 12.582 -4.710 -7.659
211 HZ PHE 535 HZ PHE 535 14.076 -2.774 -7.949
212 H GLY 536 H GLY 536 9.133 -0.305 -4.321
213 HA2 GLY 536 2HA GLY 536 11.009 1.486 -3.213
214 HA3 GLY 536 1HA GLY 536 9.452 1.930 -3.902
215 HA PRO 537 HA PRO 537 8.369 2.889 0.339
216 HB2 PRO 537 2HB PRO 537 5.941 3.836 -0.063
217 HB3 PRO 537 1HB PRO 537 7.309 4.665 -0.832
218 HG2 PRO 537 2HG PRO 537 5.492 2.576 -2.003
219 HG3 PRO 537 1HG PRO 537 5.871 4.183 -2.662
220 HD2 PRO 537 2HD PRO 537 7.148 1.922 -3.444
221 HD3 PRO 537 1HD PRO 537 7.964 3.501 -3.391
222 H ALA 538 H ALA 538 8.089 0.195 -0.852
223 HA ALA 538 HA ALA 538 5.863 -0.802 0.740
224 HB1 ALA 538 1HB ALA 538 5.378 -2.446 -0.933
225 HB2 ALA 538 2HB ALA 538 6.792 -1.976 -1.880
226 HB3 ALA 538 3HB ALA 538 5.421 -0.875 -1.734
227 H ALA 539 H ALA 539 9.121 -0.893 -0.292
228 HA ALA 539 HA ALA 539 9.761 -2.804 1.769
229 HB1 ALA 539 1HB ALA 539 11.015 -4.300 0.295
230 HB2 ALA 539 2HB ALA 539 10.420 -3.396 -1.098
231 HB3 ALA 539 3HB ALA 539 9.291 -4.279 -0.071
232 H GLU 540 H GLU 540 10.434 0.074 0.627
233 HA GLU 540 HA GLU 540 13.295 -0.034 0.313
234 HB2 GLU 540 2HB GLU 540 13.201 2.414 0.475
235 HB3 GLU 540 1HB GLU 540 12.045 1.802 -0.695
236 HG2 GLU 540 2HG GLU 540 10.347 1.930 1.228
237 HG3 GLU 540 1HG GLU 540 11.543 2.957 2.019
238 H GLY 541 H GLY 541 13.066 -1.467 2.380
239 HA2 GLY 541 2HA GLY 541 14.267 -1.476 4.457
240 HA3 GLY 541 1HA GLY 541 13.815 0.215 4.673
241 H ILE 542 H ILE 542 11.098 -0.668 3.550
242 HA ILE 542 HA ILE 542 9.705 -0.832 5.963
243 HB ILE 542 HB ILE 542 9.061 -0.897 3.088
244 HG12 ILE 542 2HG1 ILE 542 7.299 0.194 5.226
245 HG13 ILE 542 1HG1 ILE 542 8.874 0.939 4.988
246 HG21 ILE 542 1HG2 ILE 542 6.671 -1.623 3.629
247 HG22 ILE 542 2HG2 ILE 542 7.355 -2.370 5.074
248 HG23 ILE 542 3HG2 ILE 542 7.898 -2.885 3.473
249 HD11 ILE 542 3HD1 ILE 542 6.803 0.577 2.839
250 HD12 ILE 542 1HD1 ILE 542 8.343 1.421 2.693
251 HD13 ILE 542 2HD1 ILE 542 7.083 2.065 3.746
252 H TYR 543 H TYR 543 10.459 -3.321 3.533
253 HA TYR 543 HA TYR 543 9.132 -5.493 4.403
254 HB2 TYR 543 2HB TYR 543 10.920 -6.895 3.543
255 HB3 TYR 543 1HB TYR 543 10.662 -5.511 2.486
256 HD1 TYR 543 2HD TYR 543 12.190 -3.453 2.960
257 HD2 TYR 543 1HD TYR 543 13.069 -7.415 4.198
258 HE1 TYR 543 2HE TYR 543 14.577 -2.862 3.116
259 HE2 TYR 543 1HE TYR 543 15.458 -6.847 4.366
260 HH TYR 543 HH TYR 543 16.791 -4.105 3.015
261 H ALA 544 H ALA 544 11.806 -3.988 6.060
262 HA ALA 544 HA ALA 544 12.619 -5.992 7.792
263 HB1 ALA 544 1HB ALA 544 12.324 -3.062 8.418
264 HB2 ALA 544 2HB ALA 544 13.705 -3.804 7.609
265 HB3 ALA 544 3HB ALA 544 13.338 -4.215 9.284
266 H GLU 545 H GLU 545 9.610 -4.405 7.624
267 HA GLU 545 HA GLU 545 8.660 -4.408 10.218
268 HB2 GLU 545 2HB GLU 545 6.402 -4.804 9.063
269 HB3 GLU 545 1HB GLU 545 7.311 -3.382 8.572
270 HG2 GLU 545 2HG GLU 545 6.698 -4.177 6.534
271 HG3 GLU 545 1HG GLU 545 8.231 -5.020 6.728
272 H GLY 546 H GLY 546 8.689 -6.950 7.791
273 HA2 GLY 546 2HA GLY 546 8.349 -9.200 7.908
274 HA3 GLY 546 1HA GLY 546 9.197 -9.065 9.434
275 H LEU 547 H LEU 547 5.889 -8.166 8.327
276 HA LEU 547 HA LEU 547 4.674 -10.170 9.917
277 HB2 LEU 547 2HB LEU 547 3.861 -9.041 11.757
278 HB3 LEU 547 1HB LEU 547 5.501 -8.441 11.616
279 HG LEU 547 HG LEU 547 3.132 -6.938 10.518
280 HD11 LEU 547 1HD1 LEU 547 4.366 -6.843 13.257
281 HD12 LEU 547 2HD1 LEU 547 2.676 -7.113 12.830
282 HD13 LEU 547 3HD1 LEU 547 3.406 -5.526 12.584
283 HD21 LEU 547 3HD2 LEU 547 4.584 -5.159 10.248
284 HD22 LEU 547 1HD2 LEU 547 5.590 -6.539 9.809
285 HD23 LEU 547 2HD2 LEU 547 5.751 -5.804 11.403
286 H MET 548 H MET 548 4.162 -6.961 8.474
287 HA MET 548 HA MET 548 2.229 -7.843 6.659
288 HB2 MET 548 2HB MET 548 1.218 -7.322 9.325
289 HB3 MET 548 1HB MET 548 0.457 -6.269 8.140
290 HG2 MET 548 2HG MET 548 -0.472 -8.034 6.972
291 HG3 MET 548 1HG MET 548 0.672 -9.201 7.630
292 HE1 MET 548 3HE MET 548 -2.538 -7.069 8.283
293 HE2 MET 548 1HE MET 548 -3.458 -8.331 9.103
294 HE3 MET 548 2HE MET 548 -2.822 -8.614 7.482
295 H HIS 549 H HIS 549 3.646 -5.248 8.493
296 HA HIS 549 HA HIS 549 2.604 -3.028 7.189
297 HB2 HIS 549 2HB HIS 549 4.969 -3.613 8.829
298 HB3 HIS 549 1HB HIS 549 5.155 -2.234 7.750
299 HD1 HIS 549 1HD HIS 549 1.708 -2.652 8.817
300 HD2 HIS 549 2HD HIS 549 5.110 -0.782 10.300
301 HE1 HIS 549 1HE HIS 549 0.882 -1.027 10.532
302 HE2 HIS 549 2HE HIS 549 2.946 0.153 11.369
303 H ASN 550 H ASN 550 4.542 -5.470 5.841
304 HA ASN 550 HA ASN 550 5.964 -3.867 3.951
305 HB2 ASN 550 2HB ASN 550 6.395 -6.100 2.838
306 HB3 ASN 550 1HB ASN 550 6.941 -5.960 4.506
307 HD21 ASN 550 1HD2 ASN 550 6.909 -8.322 4.350
308 HD22 ASN 550 2HD2 ASN 550 5.430 -9.150 4.683
309 H GLN 551 H GLN 551 2.780 -4.270 4.192
310 HA GLN 551 HA GLN 551 1.767 -5.174 1.797
311 HB2 GLN 551 2HB GLN 551 -0.155 -3.698 2.267
312 HB3 GLN 551 1HB GLN 551 0.369 -4.580 3.694
313 HG2 GLN 551 2HG GLN 551 0.115 -2.510 4.595
314 HG3 GLN 551 1HG GLN 551 1.802 -2.416 4.101
315 HE21 GLN 551 1HE2 GLN 551 -1.279 -2.080 2.368
316 HE22 GLN 551 2HE2 GLN 551 -0.924 -0.530 1.692
317 H ASP 552 H ASP 552 0.400 -3.338 0.454
318 HA ASP 552 HA ASP 552 2.375 -1.411 -0.575
319 HB2 ASP 552 2HB ASP 552 0.749 -3.446 -2.038
320 HB3 ASP 552 1HB ASP 552 1.048 -1.898 -2.822
321 H GLY 553 H GLY 553 -1.088 -2.282 -0.614
322 HA2 GLY 553 2HA GLY 553 -2.641 -0.637 0.343
323 HA3 GLY 553 1HA GLY 553 -1.677 0.608 -0.434
324 H LEU 554 H LEU 554 -2.875 -2.468 -1.757
325 HA LEU 554 HA LEU 554 -3.488 -1.687 -4.259
326 HB2 LEU 554 2HB LEU 554 -5.580 -3.316 -3.935
327 HB3 LEU 554 1HB LEU 554 -3.933 -3.887 -4.107
328 HG LEU 554 HG LEU 554 -4.485 -3.390 -1.330
329 HD11 LEU 554 1HD1 LEU 554 -6.113 -5.642 -1.711
330 HD12 LEU 554 2HD1 LEU 554 -6.731 -4.394 -2.793
331 HD13 LEU 554 3HD1 LEU 554 -6.576 -4.067 -1.068
332 HD21 LEU 554 3HD2 LEU 554 -3.377 -5.347 -1.057
333 HD22 LEU 554 1HD2 LEU 554 -2.880 -5.001 -2.713
334 HD23 LEU 554 2HD2 LEU 554 -4.199 -6.130 -2.407
335 H ILE 555 H ILE 555 -6.388 -2.135 -2.286
336 HA ILE 555 HA ILE 555 -8.290 -0.890 -2.076
337 HB ILE 555 HB ILE 555 -6.585 1.495 -2.770
338 HG12 ILE 555 2HG1 ILE 555 -5.680 0.013 -0.903
339 HG13 ILE 555 1HG1 ILE 555 -5.943 1.708 -0.512
340 HG21 ILE 555 1HG2 ILE 555 -9.320 1.115 -1.782
341 HG22 ILE 555 2HG2 ILE 555 -8.611 2.452 -2.688
342 HG23 ILE 555 3HG2 ILE 555 -8.377 2.348 -0.943
343 HD11 ILE 555 3HD1 ILE 555 -8.332 0.464 0.126
344 HD12 ILE 555 1HD1 ILE 555 -7.087 1.013 1.244
345 HD13 ILE 555 2HD1 ILE 555 -7.083 -0.652 0.668
346 H CYS 556 H CYS 556 -9.901 -0.886 -3.504
347 HA CYS 556 HA CYS 556 -9.409 -0.714 -6.314
348 HB2 CYS 556 2HB CYS 556 -11.992 -0.815 -4.744
349 HB3 CYS 556 1HB CYS 556 -11.897 -0.897 -6.500
350 H GLY 557 H GLY 557 -10.574 1.473 -3.848
351 HA2 GLY 557 2HA GLY 557 -10.223 3.849 -4.161
352 HA3 GLY 557 1HA GLY 557 -10.587 3.623 -5.866
353 H LEU 558 H LEU 558 -12.865 1.931 -5.417
354 HA LEU 558 HA LEU 558 -14.823 3.019 -3.768
355 HB2 LEU 558 2HB LEU 558 -16.035 4.478 -5.214
356 HB3 LEU 558 1HB LEU 558 -14.373 5.032 -5.167
357 HG LEU 558 HG LEU 558 -15.280 3.217 -7.360
358 HD11 LEU 558 1HD1 LEU 558 -15.478 6.219 -7.475
359 HD12 LEU 558 2HD1 LEU 558 -16.857 5.155 -7.197
360 HD13 LEU 558 3HD1 LEU 558 -15.958 5.057 -8.712
361 HD21 LEU 558 3HD2 LEU 558 -13.506 4.467 -8.581
362 HD22 LEU 558 1HD2 LEU 558 -12.924 3.548 -7.191
363 HD23 LEU 558 2HD2 LEU 558 -13.124 5.298 -7.072
364 H ARG 559 H ARG 559 -13.931 0.527 -4.980
365 HA ARG 559 HA ARG 559 -14.682 -1.364 -5.981
366 HB2 ARG 559 2HB ARG 559 -16.961 -2.024 -5.513
367 HB3 ARG 559 1HB ARG 559 -16.237 -1.293 -4.087
368 HG2 ARG 559 2HG ARG 559 -17.823 0.467 -5.869
369 HG3 ARG 559 1HG ARG 559 -18.695 -0.734 -4.924
370 HD2 ARG 559 2HD ARG 559 -17.535 0.131 -2.888
371 HD3 ARG 559 1HD ARG 559 -16.870 1.425 -3.878
372 HE ARG 559 HE ARG 559 -18.934 2.441 -3.919
373 HH11 ARG 559 1HH1 ARG 559 -19.228 -0.757 -2.545
374 HH12 ARG 559 2HH1 ARG 559 -20.840 -0.497 -1.970
375 HH21 ARG 559 1HH2 ARG 559 -21.055 2.780 -3.164
376 HH22 ARG 559 2HH2 ARG 559 -21.878 1.509 -2.323
377 H GLN 560 H GLN 560 -15.106 -2.077 -7.971
378 HA GLN 560 HA GLN 560 -17.059 -0.798 -9.622
379 HB2 GLN 560 2HB GLN 560 -14.476 0.260 -9.697
380 HB3 GLN 560 1HB GLN 560 -14.579 -0.756 -11.128
381 HG2 GLN 560 2HG GLN 560 -16.076 0.585 -12.142
382 HG3 GLN 560 1HG GLN 560 -16.879 1.014 -10.633
383 HE21 GLN 560 1HE2 GLN 560 -15.876 2.606 -9.282
384 HE22 GLN 560 2HE2 GLN 560 -14.862 3.820 -9.979
Start of MODEL 5
1 H1 ALA 507 1HT ALA 507 -17.048 7.241 -0.199
2 H2 ALA 507 2HT ALA 507 -17.838 6.046 -1.144
3 H3 ALA 507 3HT ALA 507 -16.166 6.358 -1.374
4 HA ALA 507 HA ALA 507 -15.964 5.748 1.067
5 HB1 ALA 507 2HB ALA 507 -18.644 5.598 0.948
6 HB2 ALA 507 3HB ALA 507 -17.666 4.675 2.089
7 HB3 ALA 507 1HB ALA 507 -18.229 3.920 0.599
8 H GLN 508 H GLN 508 -15.900 3.144 1.449
9 HA GLN 508 HA GLN 508 -14.846 1.981 -1.043
10 HB2 GLN 508 2HB GLN 508 -13.104 0.865 0.319
11 HB3 GLN 508 1HB GLN 508 -12.971 2.617 0.346
12 HG2 GLN 508 2HG GLN 508 -14.554 2.124 2.517
13 HG3 GLN 508 1HG GLN 508 -13.468 0.735 2.517
14 HE21 GLN 508 1HE2 GLN 508 -12.023 1.139 4.044
15 HE22 GLN 508 2HE2 GLN 508 -11.090 2.586 4.193
16 HA PRO 509 HA PRO 509 -17.245 -1.562 0.170
17 HB2 PRO 509 2HB PRO 509 -16.483 -3.262 -1.702
18 HB3 PRO 509 1HB PRO 509 -17.215 -1.722 -2.172
19 HG2 PRO 509 2HG PRO 509 -14.355 -2.556 -2.231
20 HG3 PRO 509 1HG PRO 509 -15.239 -1.506 -3.349
21 HD2 PRO 509 2HD PRO 509 -13.601 -0.701 -1.165
22 HD3 PRO 509 1HD PRO 509 -14.636 0.341 -2.161
23 H LYS 510 H LYS 510 -14.488 -1.191 1.472
24 HA LYS 510 HA LYS 510 -13.128 -2.348 2.875
25 HB2 LYS 510 2HB LYS 510 -15.410 -4.283 2.599
26 HB3 LYS 510 1HB LYS 510 -14.020 -4.624 3.614
27 HG2 LYS 510 2HG LYS 510 -14.494 -2.806 5.047
28 HG3 LYS 510 1HG LYS 510 -15.681 -2.144 3.922
29 HD2 LYS 510 2HD LYS 510 -17.304 -3.371 4.827
30 HD3 LYS 510 1HD LYS 510 -16.369 -4.851 4.609
31 HE2 LYS 510 2HE LYS 510 -16.104 -2.924 6.914
32 HE3 LYS 510 1HE LYS 510 -16.948 -4.471 6.961
33 HZ1 LYS 510 3HZ LYS 510 -14.187 -4.540 6.053
34 HZ2 LYS 510 1HZ LYS 510 -15.027 -5.618 7.050
35 HZ3 LYS 510 2HZ LYS 510 -14.418 -4.175 7.688
36 H CYS 511 H CYS 511 -12.181 -2.321 0.405
37 HA CYS 511 HA CYS 511 -11.304 -5.087 -0.109
38 HB2 CYS 511 2HB CYS 511 -10.942 -4.363 -2.468
39 HB3 CYS 511 1HB CYS 511 -12.629 -4.300 -1.962
40 H ASN 512 H ASN 512 -10.030 -3.520 1.802
41 HA ASN 512 HA ASN 512 -7.564 -2.637 0.473
42 HB2 ASN 512 2HB ASN 512 -7.044 -1.498 2.607
43 HB3 ASN 512 1HB ASN 512 -8.568 -0.952 1.914
44 HD21 ASN 512 1HD2 ASN 512 -10.505 -1.540 2.898
45 HD22 ASN 512 2HD2 ASN 512 -10.563 -2.123 4.523
46 HA PRO 513 HA PRO 513 -5.519 -6.197 2.070
47 HB2 PRO 513 2HB PRO 513 -2.942 -5.439 1.801
48 HB3 PRO 513 1HB PRO 513 -3.970 -5.850 0.423
49 HG2 PRO 513 2HG PRO 513 -3.135 -3.178 1.434
50 HG3 PRO 513 1HG PRO 513 -3.392 -3.723 -0.226
51 HD2 PRO 513 2HD PRO 513 -5.188 -2.225 1.259
52 HD3 PRO 513 1HD PRO 513 -5.601 -3.184 -0.173
53 H ASN 514 H ASN 514 -3.197 -3.766 3.119
54 HA ASN 514 HA ASN 514 -3.809 -4.387 5.929
55 HB2 ASN 514 2HB ASN 514 -1.302 -4.739 4.410
56 HB3 ASN 514 1HB ASN 514 -1.134 -3.998 5.997
57 HD21 ASN 514 1HD2 ASN 514 -2.266 -6.830 4.275
58 HD22 ASN 514 2HD2 ASN 514 -2.201 -7.912 5.620
59 H LEU 515 H LEU 515 -1.493 -2.417 4.144
60 HA LEU 515 HA LEU 515 -0.686 -0.319 4.564
61 HB2 LEU 515 2HB LEU 515 -2.260 1.325 3.886
62 HB3 LEU 515 1HB LEU 515 -2.565 -0.150 2.985
63 HG LEU 515 HG LEU 515 -4.242 -0.375 5.161
64 HD11 LEU 515 1HD1 LEU 515 -5.092 2.236 4.215
65 HD12 LEU 515 2HD1 LEU 515 -3.569 2.298 5.100
66 HD13 LEU 515 3HD1 LEU 515 -5.001 1.602 5.858
67 HD21 LEU 515 3HD2 LEU 515 -4.660 0.490 2.324
68 HD22 LEU 515 1HD2 LEU 515 -6.008 0.266 3.437
69 HD23 LEU 515 2HD2 LEU 515 -4.947 -1.089 3.052
70 H HIS 516 H HIS 516 -0.768 -1.536 6.957
71 HA HIS 516 HA HIS 516 -2.261 0.028 8.863
72 HB2 HIS 516 2HB HIS 516 -1.645 -2.469 9.020
73 HB3 HIS 516 1HB HIS 516 -0.066 -1.901 9.547
74 HD1 HIS 516 1HD HIS 516 -2.548 0.370 10.804
75 HD2 HIS 516 2HD HIS 516 -1.071 -3.337 11.964
76 HE1 HIS 516 1HE HIS 516 -3.198 0.114 13.220
77 HE2 HIS 516 2HE HIS 516 -2.368 -2.173 13.875
78 H TYR 517 H TYR 517 0.645 0.552 7.228
79 HA TYR 517 HA TYR 517 1.773 2.020 9.503
80 HB2 TYR 517 2HB TYR 517 3.873 2.050 8.377
81 HB3 TYR 517 1HB TYR 517 3.241 0.417 8.250
82 HD1 TYR 517 1HD TYR 517 2.946 3.575 6.255
83 HD2 TYR 517 2HD TYR 517 3.721 -0.605 6.250
84 HE1 TYR 517 1HE TYR 517 3.273 3.652 3.831
85 HE2 TYR 517 2HE TYR 517 4.054 -0.543 3.818
86 HH TYR 517 HH TYR 517 3.467 0.821 1.911
87 H TRP 518 H TRP 518 0.181 2.486 6.489
88 HA TRP 518 HA TRP 518 0.873 5.318 6.417
89 HB2 TRP 518 2HB TRP 518 0.639 3.578 4.373
90 HB3 TRP 518 1HB TRP 518 -1.004 4.212 4.428
91 HD1 TRP 518 HD TRP 518 -1.304 6.176 2.838
92 HE1 TRP 518 1HE TRP 518 0.157 8.108 1.969
93 HE3 TRP 518 3HE TRP 518 3.026 5.119 5.338
94 HZ2 TRP 518 2HZ TRP 518 2.791 9.057 2.295
95 HZ3 TRP 518 3HZ TRP 518 4.969 6.588 5.006
96 HH2 TRP 518 HH TRP 518 4.853 8.517 3.515
97 H THR 519 H THR 519 -1.462 6.253 5.262
98 HA THR 519 HA THR 519 -3.371 5.961 7.474
99 HB THR 519 HB THR 519 -2.657 8.071 7.902
100 HG1 THR 519 1HG THR 519 -4.195 9.399 7.262
101 HG21 THR 519 3HG2 THR 519 -0.935 7.999 6.099
102 HG22 THR 519 1HG2 THR 519 -1.625 9.592 6.418
103 HG23 THR 519 2HG2 THR 519 -2.148 8.670 5.007
104 H THR 520 H THR 520 -2.867 6.240 4.040
105 HA THR 520 HA THR 520 -5.243 4.972 3.355
106 HB THR 520 HB THR 520 -6.110 7.256 4.268
107 HG1 THR 520 1HG THR 520 -7.279 5.618 3.022
108 HG21 THR 520 3HG2 THR 520 -5.377 8.068 1.463
109 HG22 THR 520 1HG2 THR 520 -4.698 8.736 2.949
110 HG23 THR 520 2HG2 THR 520 -6.406 8.973 2.576
111 H GLN 521 H GLN 521 -3.207 7.661 2.200
112 HA GLN 521 HA GLN 521 -3.434 7.350 -0.496
113 HB2 GLN 521 2HB GLN 521 -1.767 8.780 1.165
114 HB3 GLN 521 1HB GLN 521 -0.649 7.744 0.286
115 HG2 GLN 521 2HG GLN 521 -1.662 8.542 -1.832
116 HG3 GLN 521 1HG GLN 521 -2.628 9.677 -0.890
117 HE21 GLN 521 1HE2 GLN 521 0.441 8.988 -2.245
118 HE22 GLN 521 2HE2 GLN 521 1.231 10.449 -1.772
119 H ASP 522 H ASP 522 -2.259 6.284 -2.116
120 HA ASP 522 HA ASP 522 -1.913 3.549 -1.754
121 HB2 ASP 522 2HB ASP 522 -0.856 5.384 -3.909
122 HB3 ASP 522 1HB ASP 522 -0.759 3.628 -3.989
123 H GLU 523 H GLU 523 -0.572 3.276 0.067
124 HA GLU 523 HA GLU 523 2.166 4.188 -0.019
125 HB2 GLU 523 2HB GLU 523 2.400 3.132 2.137
126 HB3 GLU 523 1HB GLU 523 0.939 4.095 2.100
127 HG2 GLU 523 2HG GLU 523 0.870 1.145 1.595
128 HG3 GLU 523 1HG GLU 523 0.849 1.801 3.231
129 H GLY 524 H GLY 524 2.069 2.917 -2.196
130 HA2 GLY 524 2HA GLY 524 3.679 1.355 -3.084
131 HA3 GLY 524 1HA GLY 524 3.357 0.316 -1.697
132 H ALA 525 H ALA 525 0.604 1.816 -2.948
133 HA ALA 525 HA ALA 525 -0.618 -0.623 -3.661
134 HB1 ALA 525 1HB ALA 525 -1.695 2.007 -4.573
135 HB2 ALA 525 2HB ALA 525 -1.647 1.628 -2.852
136 HB3 ALA 525 3HB ALA 525 -2.553 0.595 -3.959
137 H ALA 526 H ALA 526 1.466 -0.904 -5.206
138 HA ALA 526 HA ALA 526 2.258 -1.191 -7.308
139 HB1 ALA 526 1HB ALA 526 0.606 -1.820 -8.999
140 HB2 ALA 526 2HB ALA 526 -0.683 -1.205 -7.964
141 HB3 ALA 526 3HB ALA 526 0.274 -2.594 -7.450
142 H ILE 527 H ILE 527 3.270 0.794 -7.458
143 HA ILE 527 HA ILE 527 2.611 2.348 -9.683
144 HB ILE 527 HB ILE 527 0.887 3.249 -8.301
145 HG12 ILE 527 2HG1 ILE 527 3.062 5.329 -8.207
146 HG13 ILE 527 1HG1 ILE 527 2.391 4.784 -9.740
147 HG21 ILE 527 1HG2 ILE 527 2.136 2.564 -6.193
148 HG22 ILE 527 2HG2 ILE 527 1.144 4.024 -6.132
149 HG23 ILE 527 3HG2 ILE 527 2.897 4.153 -6.291
150 HD11 ILE 527 3HD1 ILE 527 0.319 5.498 -7.857
151 HD12 ILE 527 1HD1 ILE 527 0.602 6.070 -9.501
152 HD13 ILE 527 2HD1 ILE 527 1.441 6.828 -8.147
153 H GLY 528 H GLY 528 4.137 2.508 -6.481
154 HA2 GLY 528 2HA GLY 528 6.281 2.989 -5.834
155 HA3 GLY 528 1HA GLY 528 6.764 2.484 -7.441
156 H ALA 529 H ALA 529 4.931 4.807 -8.457
157 HA ALA 529 HA ALA 529 5.389 6.858 -9.342
158 HB1 ALA 529 1HB ALA 529 4.718 7.191 -6.844
159 HB2 ALA 529 2HB ALA 529 5.337 8.550 -7.782
160 HB3 ALA 529 3HB ALA 529 6.398 7.697 -6.662
161 H ALA 530 H ALA 530 7.559 4.957 -9.546
162 HA ALA 530 HA ALA 530 9.572 6.388 -10.678
163 HB1 ALA 530 1HB ALA 530 11.144 5.816 -8.417
164 HB2 ALA 530 2HB ALA 530 9.713 6.649 -7.812
165 HB3 ALA 530 3HB ALA 530 10.715 7.406 -9.051
166 H TRP 531 H TRP 531 8.432 4.062 -11.253
167 HA TRP 531 HA TRP 531 8.618 1.745 -11.332
168 HB2 TRP 531 2HB TRP 531 10.955 1.257 -12.415
169 HB3 TRP 531 1HB TRP 531 9.717 2.135 -13.307
170 HD1 TRP 531 HD TRP 531 12.436 3.296 -10.796
171 HE1 TRP 531 1HE TRP 531 13.693 5.286 -11.849
172 HE3 TRP 531 3HE TRP 531 9.981 3.522 -15.269
173 HZ2 TRP 531 2HZ TRP 531 13.643 6.752 -14.262
174 HZ3 TRP 531 3HZ TRP 531 10.644 5.246 -16.896
175 HH2 TRP 531 HH TRP 531 12.438 6.827 -16.401
176 H ILE 532 H ILE 532 8.946 2.405 -8.798
177 HA ILE 532 HA ILE 532 11.011 0.534 -7.937
178 HB ILE 532 HB ILE 532 11.771 2.857 -7.712
179 HG12 ILE 532 2HG1 ILE 532 11.211 1.723 -4.967
180 HG13 ILE 532 1HG1 ILE 532 12.362 0.976 -6.065
181 HG21 ILE 532 1HG2 ILE 532 9.229 3.464 -7.191
182 HG22 ILE 532 2HG2 ILE 532 10.579 4.494 -6.697
183 HG23 ILE 532 3HG2 ILE 532 9.839 3.392 -5.534
184 HD11 ILE 532 3HD1 ILE 532 13.820 2.782 -5.944
185 HD12 ILE 532 1HD1 ILE 532 13.241 2.585 -4.287
186 HD13 ILE 532 2HD1 ILE 532 12.578 3.863 -5.310
187 HA PRO 533 HA PRO 533 6.738 0.545 -5.638
188 HB2 PRO 533 2HB PRO 533 5.245 -1.165 -7.162
189 HB3 PRO 533 1HB PRO 533 5.154 0.592 -7.297
190 HG2 PRO 533 2HG PRO 533 6.638 -1.359 -8.998
191 HG3 PRO 533 1HG PRO 533 5.722 0.080 -9.478
192 HD2 PRO 533 2HD PRO 533 8.416 0.049 -9.327
193 HD3 PRO 533 1HD PRO 533 7.450 1.499 -8.988
194 H TYR 534 H TYR 534 8.805 -1.615 -7.258
195 HA TYR 534 HA TYR 534 8.116 -4.088 -6.179
196 HB2 TYR 534 2HB TYR 534 10.836 -3.035 -6.993
197 HB3 TYR 534 1HB TYR 534 10.426 -4.732 -6.769
198 HD1 TYR 534 2HD TYR 534 9.845 -1.750 -8.934
199 HD2 TYR 534 1HD TYR 534 9.281 -5.957 -8.451
200 HE1 TYR 534 2HE TYR 534 9.147 -1.931 -11.278
201 HE2 TYR 534 1HE TYR 534 8.582 -6.131 -10.800
202 HH TYR 534 HH TYR 534 7.562 -3.745 -12.601
203 H PHE 535 H PHE 535 10.588 -1.754 -5.107
204 HA PHE 535 HA PHE 535 10.276 -2.803 -2.380
205 HB2 PHE 535 2HB PHE 535 12.796 -2.278 -2.146
206 HB3 PHE 535 1HB PHE 535 12.316 -3.763 -2.958
207 HD1 PHE 535 2HD PHE 535 13.276 -0.236 -3.645
208 HD2 PHE 535 1HD PHE 535 13.130 -4.243 -5.069
209 HE1 PHE 535 2HE PHE 535 14.591 0.421 -5.618
210 HE2 PHE 535 1HE PHE 535 14.446 -3.594 -7.045
211 HZ PHE 535 HZ PHE 535 15.178 -1.259 -7.321
212 H GLY 536 H GLY 536 9.628 -0.257 -4.151
213 HA2 GLY 536 2HA GLY 536 10.917 1.946 -2.988
214 HA3 GLY 536 1HA GLY 536 9.330 1.983 -3.747
215 HA PRO 537 HA PRO 537 7.890 2.728 0.432
216 HB2 PRO 537 2HB PRO 537 5.322 3.079 -0.077
217 HB3 PRO 537 1HB PRO 537 6.491 4.206 -0.791
218 HG2 PRO 537 2HG PRO 537 5.259 1.755 -2.027
219 HG3 PRO 537 1HG PRO 537 5.290 3.411 -2.680
220 HD2 PRO 537 2HD PRO 537 7.086 1.511 -3.393
221 HD3 PRO 537 1HD PRO 537 7.516 3.234 -3.305
222 H ALA 538 H ALA 538 8.215 0.017 -0.817
223 HA ALA 538 HA ALA 538 6.219 -1.441 0.729
224 HB1 ALA 538 1HB ALA 538 6.057 -3.071 -0.941
225 HB2 ALA 538 2HB ALA 538 7.556 -2.553 -1.718
226 HB3 ALA 538 3HB ALA 538 6.104 -1.561 -1.852
227 H ALA 539 H ALA 539 9.477 -0.831 -0.170
228 HA ALA 539 HA ALA 539 10.402 -2.486 1.993
229 HB1 ALA 539 1HB ALA 539 10.287 -4.043 0.098
230 HB2 ALA 539 2HB ALA 539 11.924 -3.829 0.717
231 HB3 ALA 539 3HB ALA 539 11.433 -3.024 -0.772
232 H GLU 540 H GLU 540 10.512 0.425 0.837
233 HA GLU 540 HA GLU 540 13.340 0.917 0.567
234 HB2 GLU 540 2HB GLU 540 12.730 3.291 0.736
235 HB3 GLU 540 1HB GLU 540 11.744 2.457 -0.455
236 HG2 GLU 540 2HG GLU 540 9.950 3.264 0.553
237 HG3 GLU 540 1HG GLU 540 10.335 2.250 1.942
238 H GLY 541 H GLY 541 13.453 -0.525 2.610
239 HA2 GLY 541 2HA GLY 541 14.457 -0.439 4.738
240 HA3 GLY 541 1HA GLY 541 13.920 1.234 4.892
241 H ILE 542 H ILE 542 11.426 -0.435 3.626
242 HA ILE 542 HA ILE 542 9.879 -0.361 6.020
243 HB ILE 542 HB ILE 542 9.407 -0.621 3.145
244 HG12 ILE 542 2HG1 ILE 542 7.703 0.361 5.438
245 HG13 ILE 542 1HG1 ILE 542 8.856 1.340 4.538
246 HG21 ILE 542 1HG2 ILE 542 7.186 -1.722 3.429
247 HG22 ILE 542 2HG2 ILE 542 7.693 -2.211 5.045
248 HG23 ILE 542 3HG2 ILE 542 8.572 -2.796 3.628
249 HD11 ILE 542 3HD1 ILE 542 7.381 1.738 2.946
250 HD12 ILE 542 1HD1 ILE 542 6.170 0.993 3.985
251 HD13 ILE 542 2HD1 ILE 542 7.007 0.023 2.772
252 H TYR 543 H TYR 543 11.253 -2.892 3.959
253 HA TYR 543 HA TYR 543 10.015 -5.142 4.862
254 HB2 TYR 543 2HB TYR 543 12.207 -6.336 4.484
255 HB3 TYR 543 1HB TYR 543 11.623 -5.367 3.135
256 HD1 TYR 543 2HD TYR 543 12.677 -3.214 2.626
257 HD2 TYR 543 1HD TYR 543 14.244 -5.805 5.595
258 HE1 TYR 543 2HE TYR 543 14.814 -1.986 2.550
259 HE2 TYR 543 1HE TYR 543 16.388 -4.594 5.540
260 HH TYR 543 HH TYR 543 17.653 -3.164 3.988
261 H ALA 544 H ALA 544 12.244 -3.147 6.627
262 HA ALA 544 HA ALA 544 13.161 -4.839 8.611
263 HB1 ALA 544 1HB ALA 544 13.812 -2.466 8.317
264 HB2 ALA 544 2HB ALA 544 13.430 -2.887 9.988
265 HB3 ALA 544 3HB ALA 544 12.262 -1.995 9.015
266 H GLU 545 H GLU 545 9.967 -3.831 7.981
267 HA GLU 545 HA GLU 545 8.708 -3.856 10.439
268 HB2 GLU 545 2HB GLU 545 6.727 -4.748 9.059
269 HB3 GLU 545 1HB GLU 545 7.415 -3.206 8.572
270 HG2 GLU 545 2HG GLU 545 7.328 -4.149 6.532
271 HG3 GLU 545 1HG GLU 545 8.869 -4.841 7.026
272 H GLY 546 H GLY 546 9.439 -6.478 8.219
273 HA2 GLY 546 2HA GLY 546 9.474 -8.744 8.462
274 HA3 GLY 546 1HA GLY 546 10.119 -8.386 10.051
275 H LEU 547 H LEU 547 6.849 -7.448 9.151
276 HA LEU 547 HA LEU 547 5.773 -9.770 10.542
277 HB2 LEU 547 2HB LEU 547 4.642 -8.641 12.213
278 HB3 LEU 547 1HB LEU 547 6.204 -7.851 12.173
279 HG LEU 547 HG LEU 547 3.826 -6.711 10.723
280 HD11 LEU 547 1HD1 LEU 547 3.738 -7.125 13.378
281 HD12 LEU 547 2HD1 LEU 547 2.995 -5.741 12.577
282 HD13 LEU 547 3HD1 LEU 547 4.580 -5.577 13.333
283 HD21 LEU 547 3HD2 LEU 547 6.381 -6.059 10.475
284 HD22 LEU 547 1HD2 LEU 547 6.018 -5.112 11.917
285 HD23 LEU 547 2HD2 LEU 547 5.099 -4.849 10.435
286 H MET 548 H MET 548 5.018 -6.788 8.766
287 HA MET 548 HA MET 548 3.419 -8.009 6.861
288 HB2 MET 548 2HB MET 548 2.044 -7.563 9.386
289 HB3 MET 548 1HB MET 548 1.243 -6.750 8.049
290 HG2 MET 548 2HG MET 548 2.064 -9.573 7.666
291 HG3 MET 548 1HG MET 548 0.687 -9.242 8.715
292 HE1 MET 548 3HE MET 548 2.042 -8.829 4.919
293 HE2 MET 548 1HE MET 548 0.624 -9.693 4.323
294 HE3 MET 548 2HE MET 548 1.629 -10.409 5.584
295 H HIS 549 H HIS 549 4.242 -5.165 8.674
296 HA HIS 549 HA HIS 549 2.953 -3.137 7.362
297 HB2 HIS 549 2HB HIS 549 5.389 -3.407 8.917
298 HB3 HIS 549 1HB HIS 549 5.524 -2.134 7.709
299 HD1 HIS 549 1HD HIS 549 2.097 -2.508 8.861
300 HD2 HIS 549 2HD HIS 549 5.491 -0.477 10.131
301 HE1 HIS 549 1HE HIS 549 1.273 -0.765 10.460
302 HE2 HIS 549 2HE HIS 549 3.351 0.383 11.303
303 H ASN 550 H ASN 550 5.316 -5.264 6.011
304 HA ASN 550 HA ASN 550 6.214 -3.550 3.928
305 HB2 ASN 550 2HB ASN 550 7.153 -5.605 2.938
306 HB3 ASN 550 1HB ASN 550 7.558 -5.447 4.646
307 HD21 ASN 550 1HD2 ASN 550 7.721 -7.857 3.336
308 HD22 ASN 550 2HD2 ASN 550 6.509 -8.925 3.947
309 H GLN 551 H GLN 551 3.190 -4.493 4.398
310 HA GLN 551 HA GLN 551 2.225 -5.775 2.166
311 HB2 GLN 551 2HB GLN 551 0.108 -4.518 2.608
312 HB3 GLN 551 1HB GLN 551 0.796 -5.287 4.033
313 HG2 GLN 551 2HG GLN 551 0.144 -3.177 4.768
314 HG3 GLN 551 1HG GLN 551 1.882 -3.035 4.520
315 HE21 GLN 551 1HE2 GLN 551 2.657 -1.658 3.002
316 HE22 GLN 551 2HE2 GLN 551 1.668 -0.589 2.075
317 H ASP 552 H ASP 552 0.515 -4.353 0.723
318 HA ASP 552 HA ASP 552 2.206 -2.440 -0.745
319 HB2 ASP 552 2HB ASP 552 0.242 -4.509 -1.618
320 HB3 ASP 552 1HB ASP 552 0.389 -3.047 -2.589
321 H GLY 553 H GLY 553 -1.306 -3.080 -0.650
322 HA2 GLY 553 2HA GLY 553 -2.770 -1.478 0.508
323 HA3 GLY 553 1HA GLY 553 -1.686 -0.211 -0.043
324 H LEU 554 H LEU 554 -3.052 -2.949 -1.846
325 HA LEU 554 HA LEU 554 -3.495 -1.806 -4.222
326 HB2 LEU 554 2HB LEU 554 -5.721 -3.256 -4.218
327 HB3 LEU 554 1HB LEU 554 -4.124 -3.965 -4.345
328 HG LEU 554 HG LEU 554 -4.745 -3.764 -1.580
329 HD11 LEU 554 1HD1 LEU 554 -7.118 -3.847 -2.935
330 HD12 LEU 554 2HD1 LEU 554 -6.858 -4.412 -1.285
331 HD13 LEU 554 3HD1 LEU 554 -6.793 -5.554 -2.628
332 HD21 LEU 554 3HD2 LEU 554 -3.368 -5.501 -2.034
333 HD22 LEU 554 1HD2 LEU 554 -4.138 -5.849 -3.582
334 HD23 LEU 554 2HD2 LEU 554 -4.894 -6.383 -2.080
335 H ILE 555 H ILE 555 -6.374 -2.114 -2.160
336 HA ILE 555 HA ILE 555 -8.151 -0.743 -1.819
337 HB ILE 555 HB ILE 555 -6.303 1.504 -2.613
338 HG12 ILE 555 2HG1 ILE 555 -5.120 0.678 -0.836
339 HG13 ILE 555 1HG1 ILE 555 -6.286 1.660 0.039
340 HG21 ILE 555 1HG2 ILE 555 -7.920 2.593 -0.805
341 HG22 ILE 555 2HG2 ILE 555 -9.012 1.356 -1.429
342 HG23 ILE 555 3HG2 ILE 555 -8.316 2.550 -2.523
343 HD11 ILE 555 3HD1 ILE 555 -7.688 -0.461 0.186
344 HD12 ILE 555 1HD1 ILE 555 -6.240 -0.360 1.184
345 HD13 ILE 555 2HD1 ILE 555 -6.221 -1.305 -0.303
346 H CYS 556 H CYS 556 -9.864 -0.545 -3.077
347 HA CYS 556 HA CYS 556 -9.713 -0.644 -5.887
348 HB2 CYS 556 2HB CYS 556 -12.068 0.145 -4.156
349 HB3 CYS 556 1HB CYS 556 -12.149 -0.354 -5.841
350 H GLY 557 H GLY 557 -10.039 1.997 -3.612
351 HA2 GLY 557 2HA GLY 557 -9.169 4.160 -4.203
352 HA3 GLY 557 1HA GLY 557 -9.690 3.871 -5.854
353 H LEU 558 H LEU 558 -12.314 2.891 -5.113
354 HA LEU 558 HA LEU 558 -13.748 4.649 -3.495
355 HB2 LEU 558 2HB LEU 558 -14.616 6.276 -4.958
356 HB3 LEU 558 1HB LEU 558 -12.886 6.262 -5.236
357 HG LEU 558 HG LEU 558 -14.376 4.479 -7.025
358 HD11 LEU 558 1HD1 LEU 558 -16.057 5.915 -7.395
359 HD12 LEU 558 2HD1 LEU 558 -14.854 6.764 -8.368
360 HD13 LEU 558 3HD1 LEU 558 -15.182 7.287 -6.716
361 HD21 LEU 558 3HD2 LEU 558 -12.943 5.656 -8.691
362 HD22 LEU 558 1HD2 LEU 558 -12.056 4.872 -7.383
363 HD23 LEU 558 2HD2 LEU 558 -12.291 6.621 -7.367
364 H ARG 559 H ARG 559 -13.586 1.927 -5.160
365 HA ARG 559 HA ARG 559 -15.003 0.381 -6.010
366 HB2 ARG 559 2HB ARG 559 -17.149 0.100 -4.792
367 HB3 ARG 559 1HB ARG 559 -15.747 0.213 -3.747
368 HG2 ARG 559 2HG ARG 559 -17.449 1.447 -2.709
369 HG3 ARG 559 1HG ARG 559 -16.350 2.636 -3.392
370 HD2 ARG 559 2HD ARG 559 -17.846 2.983 -5.270
371 HD3 ARG 559 1HD ARG 559 -18.902 1.695 -4.696
372 HE ARG 559 HE ARG 559 -18.779 4.403 -3.738
373 HH11 ARG 559 1HH1 ARG 559 -19.680 1.124 -2.952
374 HH12 ARG 559 2HH1 ARG 559 -20.827 1.595 -1.744
375 HH21 ARG 559 1HH2 ARG 559 -20.288 5.025 -2.149
376 HH22 ARG 559 2HH2 ARG 559 -21.173 3.810 -1.288
377 H GLN 560 H GLN 560 -17.313 0.014 -6.935
378 HA GLN 560 HA GLN 560 -18.650 2.270 -8.033
379 HB2 GLN 560 2HB GLN 560 -16.665 2.325 -9.459
380 HB3 GLN 560 1HB GLN 560 -16.912 0.638 -9.893
381 HG2 GLN 560 2HG GLN 560 -19.240 1.497 -10.707
382 HG3 GLN 560 1HG GLN 560 -18.421 3.057 -10.748
383 HE21 GLN 560 1HE2 GLN 560 -19.129 0.319 -12.473
384 HE22 GLN 560 2HE2 GLN 560 -17.943 0.463 -13.721
Start of MODEL 6
1 H1 ALA 507 1HT ALA 507 -18.137 6.027 -2.552
2 H2 ALA 507 2HT ALA 507 -17.490 4.980 -3.750
3 H3 ALA 507 3HT ALA 507 -16.481 5.584 -2.499
4 HA ALA 507 HA ALA 507 -17.649 4.379 -0.876
5 HB1 ALA 507 2HB ALA 507 -19.666 3.409 -1.168
6 HB2 ALA 507 3HB ALA 507 -19.305 2.906 -2.819
7 HB3 ALA 507 1HB ALA 507 -19.790 4.569 -2.491
8 H GLN 508 H GLN 508 -16.242 2.860 -0.334
9 HA GLN 508 HA GLN 508 -14.805 1.397 -2.368
10 HB2 GLN 508 2HB GLN 508 -14.574 1.079 0.623
11 HB3 GLN 508 1HB GLN 508 -13.389 0.632 -0.596
12 HG2 GLN 508 2HG GLN 508 -12.668 2.775 -0.888
13 HG3 GLN 508 1HG GLN 508 -14.215 3.478 -0.421
14 HE21 GLN 508 1HE2 GLN 508 -14.166 4.520 1.424
15 HE22 GLN 508 2HE2 GLN 508 -13.148 4.166 2.774
16 HA PRO 509 HA PRO 509 -17.273 -2.270 -1.842
17 HB2 PRO 509 2HB PRO 509 -16.010 -3.807 -3.639
18 HB3 PRO 509 1HB PRO 509 -16.937 -2.386 -4.128
19 HG2 PRO 509 2HG PRO 509 -14.022 -2.792 -4.081
20 HG3 PRO 509 1HG PRO 509 -14.979 -1.632 -5.013
21 HD2 PRO 509 2HD PRO 509 -13.549 -1.213 -2.532
22 HD3 PRO 509 1HD PRO 509 -14.413 -0.022 -3.524
23 H LYS 510 H LYS 510 -14.796 -1.830 -0.083
24 HA LYS 510 HA LYS 510 -13.641 -2.984 1.485
25 HB2 LYS 510 2HB LYS 510 -15.662 -5.077 0.713
26 HB3 LYS 510 1HB LYS 510 -14.490 -5.312 1.999
27 HG2 LYS 510 2HG LYS 510 -15.636 -4.047 3.440
28 HG3 LYS 510 1HG LYS 510 -15.991 -2.820 2.222
29 HD2 LYS 510 2HD LYS 510 -17.772 -4.238 1.316
30 HD3 LYS 510 1HD LYS 510 -17.417 -5.462 2.536
31 HE2 LYS 510 2HE LYS 510 -18.449 -4.309 4.181
32 HE3 LYS 510 1HE LYS 510 -17.915 -2.747 3.563
33 HZ1 LYS 510 3HZ LYS 510 -19.767 -2.502 2.340
34 HZ2 LYS 510 1HZ LYS 510 -20.431 -3.613 3.432
35 HZ3 LYS 510 2HZ LYS 510 -19.864 -4.139 1.928
36 H CYS 511 H CYS 511 -12.098 -2.735 -0.523
37 HA CYS 511 HA CYS 511 -10.918 -5.389 -0.951
38 HB2 CYS 511 2HB CYS 511 -10.283 -4.668 -3.264
39 HB3 CYS 511 1HB CYS 511 -12.013 -4.888 -3.030
40 H ASN 512 H ASN 512 -10.180 -3.608 1.037
41 HA ASN 512 HA ASN 512 -7.623 -2.520 0.052
42 HB2 ASN 512 2HB ASN 512 -9.024 -1.766 2.618
43 HB3 ASN 512 1HB ASN 512 -7.669 -0.944 1.853
44 HD21 ASN 512 1HD2 ASN 512 -9.967 0.388 2.594
45 HD22 ASN 512 2HD2 ASN 512 -10.797 0.921 1.176
46 HA PRO 513 HA PRO 513 -5.773 -5.606 2.640
47 HB2 PRO 513 2HB PRO 513 -3.187 -4.966 2.311
48 HB3 PRO 513 1HB PRO 513 -4.157 -5.662 1.008
49 HG2 PRO 513 2HG PRO 513 -3.265 -2.861 1.414
50 HG3 PRO 513 1HG PRO 513 -3.523 -3.752 -0.088
51 HD2 PRO 513 2HD PRO 513 -5.294 -1.912 1.090
52 HD3 PRO 513 1HD PRO 513 -5.670 -3.027 -0.234
53 H ASN 514 H ASN 514 -3.330 -3.157 3.204
54 HA ASN 514 HA ASN 514 -4.268 -2.838 5.972
55 HB2 ASN 514 2HB ASN 514 -1.705 -3.911 4.965
56 HB3 ASN 514 1HB ASN 514 -1.597 -2.774 6.304
57 HD21 ASN 514 1HD2 ASN 514 -2.330 -5.951 5.350
58 HD22 ASN 514 2HD2 ASN 514 -2.814 -6.557 6.893
59 H LEU 515 H LEU 515 -1.442 -1.756 4.155
60 HA LEU 515 HA LEU 515 -0.390 0.279 4.139
61 HB2 LEU 515 2HB LEU 515 -1.543 1.818 2.738
62 HB3 LEU 515 1HB LEU 515 -1.945 0.190 2.218
63 HG LEU 515 HG LEU 515 -3.959 0.789 3.997
64 HD11 LEU 515 1HD1 LEU 515 -2.844 3.244 3.363
65 HD12 LEU 515 2HD1 LEU 515 -4.453 2.961 4.027
66 HD13 LEU 515 3HD1 LEU 515 -4.233 3.109 2.283
67 HD21 LEU 515 3HD2 LEU 515 -3.827 0.952 1.001
68 HD22 LEU 515 1HD2 LEU 515 -5.333 1.064 1.911
69 HD23 LEU 515 2HD2 LEU 515 -4.360 -0.404 1.996
70 H HIS 516 H HIS 516 -1.000 -0.146 6.706
71 HA HIS 516 HA HIS 516 -2.177 2.384 7.641
72 HB2 HIS 516 2HB HIS 516 -2.656 -0.332 8.408
73 HB3 HIS 516 1HB HIS 516 -2.012 0.547 9.789
74 HD1 HIS 516 1HD HIS 516 -4.158 2.331 7.307
75 HD2 HIS 516 2HD HIS 516 -4.516 0.559 11.048
76 HE1 HIS 516 1HE HIS 516 -6.397 3.064 8.186
77 HE2 HIS 516 2HE HIS 516 -6.635 1.897 10.405
78 H TYR 517 H TYR 517 0.808 0.830 7.327
79 HA TYR 517 HA TYR 517 1.948 1.492 9.825
80 HB2 TYR 517 2HB TYR 517 4.027 0.879 8.950
81 HB3 TYR 517 1HB TYR 517 2.882 -0.116 8.064
82 HD1 TYR 517 1HD TYR 517 4.552 3.219 7.731
83 HD2 TYR 517 2HD TYR 517 3.233 -0.335 5.804
84 HE1 TYR 517 1HE TYR 517 5.508 4.016 5.621
85 HE2 TYR 517 2HE TYR 517 4.185 0.454 3.689
86 HH TYR 517 HH TYR 517 5.370 3.681 3.287
87 H TRP 518 H TRP 518 1.203 3.423 7.064
88 HA TRP 518 HA TRP 518 2.877 5.612 8.021
89 HB2 TRP 518 2HB TRP 518 2.474 4.847 5.494
90 HB3 TRP 518 1HB TRP 518 1.134 5.982 5.660
91 HD1 TRP 518 HD TRP 518 1.791 8.277 4.820
92 HE1 TRP 518 1HE TRP 518 3.908 9.742 4.839
93 HE3 TRP 518 3HE TRP 518 4.957 5.076 7.221
94 HZ2 TRP 518 2HZ TRP 518 6.571 9.560 5.757
95 HZ3 TRP 518 3HZ TRP 518 7.272 5.795 7.637
96 HH2 TRP 518 HH TRP 518 8.061 7.991 6.920
97 H THR 519 H THR 519 1.275 7.741 7.166
98 HA THR 519 HA THR 519 -1.125 7.466 8.797
99 HB THR 519 HB THR 519 0.068 8.413 10.475
100 HG1 THR 519 1HG THR 519 -0.327 10.792 8.996
101 HG21 THR 519 3HG2 THR 519 2.196 8.433 9.188
102 HG22 THR 519 1HG2 THR 519 2.001 9.782 10.307
103 HG23 THR 519 2HG2 THR 519 1.748 10.026 8.579
104 H THR 520 H THR 520 0.090 8.416 5.866
105 HA THR 520 HA THR 520 -2.335 9.890 5.320
106 HB THR 520 HB THR 520 0.198 11.281 5.768
107 HG1 THR 520 1HG THR 520 -1.183 12.889 6.302
108 HG21 THR 520 3HG2 THR 520 -1.336 11.806 3.243
109 HG22 THR 520 1HG2 THR 520 0.403 11.605 3.455
110 HG23 THR 520 2HG2 THR 520 -0.395 13.057 4.056
111 H GLN 521 H GLN 521 0.899 9.576 3.822
112 HA GLN 521 HA GLN 521 -0.158 9.487 1.213
113 HB2 GLN 521 2HB GLN 521 2.053 8.926 0.463
114 HB3 GLN 521 1HB GLN 521 2.167 10.148 1.721
115 HG2 GLN 521 2HG GLN 521 3.432 8.845 2.987
116 HG3 GLN 521 1HG GLN 521 2.326 7.483 2.821
117 HE21 GLN 521 1HE2 GLN 521 5.041 7.110 2.944
118 HE22 GLN 521 2HE2 GLN 521 5.621 6.560 1.412
119 H ASP 522 H ASP 522 0.021 7.768 -0.320
120 HA ASP 522 HA ASP 522 -1.403 5.509 0.378
121 HB2 ASP 522 2HB ASP 522 0.259 6.277 -1.974
122 HB3 ASP 522 1HB ASP 522 -0.262 4.602 -1.841
123 H GLU 523 H GLU 523 1.918 6.157 0.774
124 HA GLU 523 HA GLU 523 3.743 4.896 1.315
125 HB2 GLU 523 2HB GLU 523 3.390 3.581 3.354
126 HB3 GLU 523 1HB GLU 523 2.673 5.175 3.441
127 HG2 GLU 523 2HG GLU 523 1.094 3.791 4.422
128 HG3 GLU 523 1HG GLU 523 0.487 4.012 2.787
129 H GLY 524 H GLY 524 2.302 3.791 -0.923
130 HA2 GLY 524 2HA GLY 524 3.261 1.875 -2.106
131 HA3 GLY 524 1HA GLY 524 3.099 0.965 -0.609
132 H ALA 525 H ALA 525 0.503 3.032 -1.220
133 HA ALA 525 HA ALA 525 -1.336 0.906 -1.448
134 HB1 ALA 525 1HB ALA 525 -2.289 3.552 -2.269
135 HB2 ALA 525 2HB ALA 525 -1.516 3.499 -0.685
136 HB3 ALA 525 3HB ALA 525 -2.899 2.459 -1.027
137 H ALA 526 H ALA 526 0.159 0.195 -3.454
138 HA ALA 526 HA ALA 526 0.279 -0.276 -5.664
139 HB1 ALA 526 1HB ALA 526 -1.997 -0.151 -6.869
140 HB2 ALA 526 2HB ALA 526 -2.638 0.257 -5.277
141 HB3 ALA 526 3HB ALA 526 -1.808 -1.278 -5.526
142 H ILE 527 H ILE 527 1.669 1.407 -6.151
143 HA ILE 527 HA ILE 527 0.875 3.085 -8.233
144 HB ILE 527 HB ILE 527 -0.205 4.373 -6.547
145 HG12 ILE 527 2HG1 ILE 527 2.361 5.865 -7.053
146 HG13 ILE 527 1HG1 ILE 527 1.243 5.505 -8.365
147 HG21 ILE 527 1HG2 ILE 527 2.356 4.793 -5.087
148 HG22 ILE 527 2HG2 ILE 527 1.338 3.387 -4.757
149 HG23 ILE 527 3HG2 ILE 527 0.696 5.016 -4.527
150 HD11 ILE 527 3HD1 ILE 527 -0.361 6.939 -7.567
151 HD12 ILE 527 1HD1 ILE 527 1.125 7.781 -7.123
152 HD13 ILE 527 2HD1 ILE 527 0.238 6.858 -5.909
153 H GLY 528 H GLY 528 3.127 2.902 -5.492
154 HA2 GLY 528 2HA GLY 528 5.413 2.853 -5.395
155 HA3 GLY 528 1HA GLY 528 5.359 2.219 -7.026
156 H ALA 529 H ALA 529 3.934 4.901 -7.767
157 HA ALA 529 HA ALA 529 4.650 6.741 -8.916
158 HB1 ALA 529 1HB ALA 529 5.197 8.443 -7.502
159 HB2 ALA 529 2HB ALA 529 6.376 7.478 -6.614
160 HB3 ALA 529 3HB ALA 529 4.651 7.250 -6.322
161 H ALA 530 H ALA 530 6.268 4.391 -9.390
162 HA ALA 530 HA ALA 530 8.271 5.297 -10.992
163 HB1 ALA 530 1HB ALA 530 9.043 5.605 -8.237
164 HB2 ALA 530 2HB ALA 530 9.923 6.060 -9.696
165 HB3 ALA 530 3HB ALA 530 10.099 4.436 -9.028
166 H TRP 531 H TRP 531 6.569 3.278 -11.184
167 HA TRP 531 HA TRP 531 6.224 0.979 -11.130
168 HB2 TRP 531 2HB TRP 531 8.121 -0.065 -12.595
169 HB3 TRP 531 1HB TRP 531 6.972 1.069 -13.298
170 HD1 TRP 531 HD TRP 531 10.315 1.621 -11.400
171 HE1 TRP 531 1HE TRP 531 11.769 3.215 -12.810
172 HE3 TRP 531 3HE TRP 531 7.180 2.266 -15.384
173 HZ2 TRP 531 2HZ TRP 531 11.605 4.564 -15.285
174 HZ3 TRP 531 3HZ TRP 531 7.901 3.723 -17.230
175 HH2 TRP 531 HH TRP 531 10.068 4.847 -17.181
176 H ILE 532 H ILE 532 7.191 1.621 -8.758
177 HA ILE 532 HA ILE 532 8.899 -0.665 -8.157
178 HB ILE 532 HB ILE 532 10.193 1.429 -8.268
179 HG12 ILE 532 2HG1 ILE 532 9.961 0.403 -5.429
180 HG13 ILE 532 1HG1 ILE 532 10.784 -0.468 -6.713
181 HG21 ILE 532 1HG2 ILE 532 9.654 3.313 -7.122
182 HG22 ILE 532 2HG2 ILE 532 8.913 2.427 -5.787
183 HG23 ILE 532 3HG2 ILE 532 8.034 2.630 -7.308
184 HD11 ILE 532 3HD1 ILE 532 11.549 2.324 -5.947
185 HD12 ILE 532 1HD1 ILE 532 12.478 1.134 -6.860
186 HD13 ILE 532 2HD1 ILE 532 12.210 0.905 -5.129
187 HA PRO 533 HA PRO 533 5.279 0.450 -5.124
188 HB2 PRO 533 2HB PRO 533 3.186 -0.942 -6.206
189 HB3 PRO 533 1HB PRO 533 3.448 0.784 -6.463
190 HG2 PRO 533 2HG PRO 533 4.112 -1.514 -8.245
191 HG3 PRO 533 1HG PRO 533 3.462 0.080 -8.662
192 HD2 PRO 533 2HD PRO 533 6.058 -0.572 -9.000
193 HD3 PRO 533 1HD PRO 533 5.520 1.075 -8.613
194 H TYR 534 H TYR 534 6.459 -2.191 -6.913
195 HA TYR 534 HA TYR 534 5.490 -4.394 -5.509
196 HB2 TYR 534 2HB TYR 534 8.146 -4.028 -6.921
197 HB3 TYR 534 1HB TYR 534 7.424 -5.574 -6.486
198 HD1 TYR 534 1HD TYR 534 7.102 -2.624 -8.743
199 HD2 TYR 534 2HD TYR 534 5.695 -6.545 -7.797
200 HE1 TYR 534 1HE TYR 534 5.910 -2.719 -10.885
201 HE2 TYR 534 2HE TYR 534 4.504 -6.634 -9.944
202 HH TYR 534 HH TYR 534 4.547 -5.614 -12.118
203 H PHE 535 H PHE 535 8.605 -2.683 -5.161
204 HA PHE 535 HA PHE 535 8.631 -3.493 -2.335
205 HB2 PHE 535 2HB PHE 535 11.209 -3.580 -2.667
206 HB3 PHE 535 1HB PHE 535 10.227 -4.956 -3.154
207 HD1 PHE 535 2HD PHE 535 9.536 -5.090 -5.616
208 HD2 PHE 535 1HD PHE 535 12.648 -2.567 -4.180
209 HE1 PHE 535 2HE PHE 535 10.471 -4.957 -7.888
210 HE2 PHE 535 1HE PHE 535 13.588 -2.427 -6.449
211 HZ PHE 535 HZ PHE 535 12.499 -3.624 -8.307
212 H GLY 536 H GLY 536 8.225 -0.943 -4.151
213 HA2 GLY 536 2HA GLY 536 10.225 0.911 -3.481
214 HA3 GLY 536 1HA GLY 536 8.568 1.315 -3.912
215 HA PRO 537 HA PRO 537 8.267 2.552 0.387
216 HB2 PRO 537 2HB PRO 537 5.818 3.533 0.357
217 HB3 PRO 537 1HB PRO 537 7.047 4.293 -0.672
218 HG2 PRO 537 2HG PRO 537 5.025 2.198 -1.413
219 HG3 PRO 537 1HG PRO 537 5.316 3.760 -2.208
220 HD2 PRO 537 2HD PRO 537 6.400 1.433 -3.078
221 HD3 PRO 537 1HD PRO 537 7.243 2.991 -3.242
222 H ALA 538 H ALA 538 7.682 -0.193 -0.639
223 HA ALA 538 HA ALA 538 5.760 -1.049 1.378
224 HB1 ALA 538 1HB ALA 538 4.907 -2.690 -0.079
225 HB2 ALA 538 2HB ALA 538 6.260 -2.514 -1.200
226 HB3 ALA 538 3HB ALA 538 5.041 -1.244 -1.080
227 H ALA 539 H ALA 539 8.821 -1.249 -0.130
228 HA ALA 539 HA ALA 539 9.755 -3.030 1.926
229 HB1 ALA 539 1HB ALA 539 10.021 -3.840 -0.951
230 HB2 ALA 539 2HB ALA 539 8.959 -4.589 0.241
231 HB3 ALA 539 3HB ALA 539 10.709 -4.683 0.435
232 H GLU 540 H GLU 540 10.278 -0.255 0.499
233 HA GLU 540 HA GLU 540 13.062 -0.463 -0.233
234 HB2 GLU 540 2HB GLU 540 13.030 1.988 -0.263
235 HB3 GLU 540 1HB GLU 540 11.696 1.321 -1.189
236 HG2 GLU 540 2HG GLU 540 10.326 1.643 0.966
237 HG3 GLU 540 1HG GLU 540 11.641 2.711 1.455
238 H GLY 541 H GLY 541 13.131 -1.729 1.943
239 HA2 GLY 541 2HA GLY 541 14.581 -1.642 3.836
240 HA3 GLY 541 1HA GLY 541 14.253 0.086 3.958
241 H ILE 542 H ILE 542 11.349 -0.809 3.306
242 HA ILE 542 HA ILE 542 10.312 -0.618 5.892
243 HB ILE 542 HB ILE 542 9.276 -0.926 3.170
244 HG12 ILE 542 2HG1 ILE 542 7.944 0.347 5.540
245 HG13 ILE 542 1HG1 ILE 542 9.339 1.093 4.770
246 HG21 ILE 542 1HG2 ILE 542 7.810 -2.218 5.456
247 HG22 ILE 542 2HG2 ILE 542 8.190 -2.890 3.868
248 HG23 ILE 542 3HG2 ILE 542 6.982 -1.609 4.022
249 HD11 ILE 542 3HD1 ILE 542 6.598 0.655 3.690
250 HD12 ILE 542 1HD1 ILE 542 7.971 0.829 2.599
251 HD13 ILE 542 2HD1 ILE 542 7.573 2.126 3.727
252 H TYR 543 H TYR 543 10.835 -3.411 3.771
253 HA TYR 543 HA TYR 543 9.518 -5.417 5.016
254 HB2 TYR 543 2HB TYR 543 11.321 -6.952 4.295
255 HB3 TYR 543 1HB TYR 543 10.826 -5.829 3.033
256 HD1 TYR 543 2HD TYR 543 12.244 -3.791 2.631
257 HD2 TYR 543 1HD TYR 543 13.554 -7.060 4.991
258 HE1 TYR 543 2HE TYR 543 14.576 -3.049 2.339
259 HE2 TYR 543 1HE TYR 543 15.893 -6.339 4.717
260 HH TYR 543 HH TYR 543 16.723 -3.282 3.379
261 H ALA 544 H ALA 544 12.303 -3.734 6.252
262 HA ALA 544 HA ALA 544 13.300 -5.466 8.148
263 HB1 ALA 544 1HB ALA 544 14.049 -3.520 9.367
264 HB2 ALA 544 2HB ALA 544 12.888 -2.505 8.510
265 HB3 ALA 544 3HB ALA 544 14.229 -3.244 7.634
266 H GLU 545 H GLU 545 10.218 -3.971 8.048
267 HA GLU 545 HA GLU 545 9.459 -3.814 10.705
268 HB2 GLU 545 2HB GLU 545 7.131 -4.300 9.756
269 HB3 GLU 545 1HB GLU 545 7.985 -2.921 9.077
270 HG2 GLU 545 2HG GLU 545 7.230 -3.883 7.166
271 HG3 GLU 545 1HG GLU 545 8.776 -4.713 7.314
272 H GLY 546 H GLY 546 9.377 -6.507 8.447
273 HA2 GLY 546 2HA GLY 546 9.131 -8.755 8.726
274 HA3 GLY 546 1HA GLY 546 10.092 -8.495 10.166
275 H LEU 547 H LEU 547 6.672 -7.803 9.283
276 HA LEU 547 HA LEU 547 5.694 -9.750 11.106
277 HB2 LEU 547 2HB LEU 547 4.807 -8.432 12.839
278 HB3 LEU 547 1HB LEU 547 6.481 -7.946 12.658
279 HG LEU 547 HG LEU 547 4.254 -6.395 11.369
280 HD11 LEU 547 1HD1 LEU 547 3.509 -6.018 13.459
281 HD12 LEU 547 2HD1 LEU 547 4.878 -4.909 13.524
282 HD13 LEU 547 3HD1 LEU 547 5.022 -6.528 14.206
283 HD21 LEU 547 3HD2 LEU 547 5.854 -4.635 11.293
284 HD22 LEU 547 1HD2 LEU 547 6.636 -6.087 10.670
285 HD23 LEU 547 2HD2 LEU 547 6.980 -5.536 12.309
286 H MET 548 H MET 548 4.965 -6.768 9.358
287 HA MET 548 HA MET 548 3.045 -7.792 7.690
288 HB2 MET 548 2HB MET 548 0.946 -6.816 8.814
289 HB3 MET 548 1HB MET 548 1.549 -8.361 9.395
290 HG2 MET 548 2HG MET 548 2.509 -7.350 11.322
291 HG3 MET 548 1HG MET 548 2.205 -5.732 10.694
292 HE1 MET 548 3HE MET 548 0.447 -5.076 13.262
293 HE2 MET 548 1HE MET 548 -0.799 -4.647 12.090
294 HE3 MET 548 2HE MET 548 0.905 -4.451 11.677
295 H HIS 549 H HIS 549 4.342 -5.112 9.436
296 HA HIS 549 HA HIS 549 3.003 -2.963 8.307
297 HB2 HIS 549 2HB HIS 549 5.458 -3.392 9.778
298 HB3 HIS 549 1HB HIS 549 5.645 -2.109 8.585
299 HD1 HIS 549 1HD HIS 549 2.264 -2.480 9.998
300 HD2 HIS 549 2HD HIS 549 5.705 -0.299 10.811
301 HE1 HIS 549 1HE HIS 549 1.546 -0.657 11.561
302 HE2 HIS 549 2HE HIS 549 3.662 0.595 12.121
303 H ASN 550 H ASN 550 4.991 -5.212 6.692
304 HA ASN 550 HA ASN 550 6.018 -3.447 4.694
305 HB2 ASN 550 2HB ASN 550 6.716 -5.499 3.541
306 HB3 ASN 550 1HB ASN 550 7.169 -5.533 5.242
307 HD21 ASN 550 1HD2 ASN 550 5.378 -7.020 2.749
308 HD22 ASN 550 2HD2 ASN 550 4.714 -8.313 3.683
309 H GLN 551 H GLN 551 2.950 -3.973 5.248
310 HA GLN 551 HA GLN 551 1.712 -5.066 3.054
311 HB2 GLN 551 2HB GLN 551 -0.110 -3.309 3.562
312 HB3 GLN 551 1HB GLN 551 0.308 -4.471 4.814
313 HG2 GLN 551 2HG GLN 551 1.981 -2.167 5.058
314 HG3 GLN 551 1HG GLN 551 0.294 -1.666 4.982
315 HE21 GLN 551 1HE2 GLN 551 1.369 -1.072 7.240
316 HE22 GLN 551 2HE2 GLN 551 0.959 -2.172 8.506
317 H ASP 552 H ASP 552 0.230 -3.519 1.591
318 HA ASP 552 HA ASP 552 2.015 -1.575 0.274
319 HB2 ASP 552 2HB ASP 552 0.369 -3.784 -0.932
320 HB3 ASP 552 1HB ASP 552 0.782 -2.355 -1.874
321 H GLY 553 H GLY 553 -1.377 -2.632 -0.176
322 HA2 GLY 553 2HA GLY 553 -3.164 -1.166 0.676
323 HA3 GLY 553 1HA GLY 553 -2.145 0.194 0.242
324 H LEU 554 H LEU 554 -2.940 -2.727 -1.618
325 HA LEU 554 HA LEU 554 -3.103 -1.771 -4.092
326 HB2 LEU 554 2HB LEU 554 -5.262 -3.318 -4.299
327 HB3 LEU 554 1HB LEU 554 -3.638 -3.959 -4.157
328 HG LEU 554 HG LEU 554 -4.591 -3.633 -1.522
329 HD11 LEU 554 1HD1 LEU 554 -6.804 -3.803 -3.128
330 HD12 LEU 554 2HD1 LEU 554 -6.728 -4.228 -1.417
331 HD13 LEU 554 3HD1 LEU 554 -6.530 -5.477 -2.647
332 HD21 LEU 554 3HD2 LEU 554 -4.663 -6.298 -2.794
333 HD22 LEU 554 1HD2 LEU 554 -3.889 -5.774 -1.299
334 HD23 LEU 554 2HD2 LEU 554 -3.133 -5.424 -2.853
335 H ILE 555 H ILE 555 -6.190 -2.009 -2.332
336 HA ILE 555 HA ILE 555 -8.066 -0.723 -2.369
337 HB ILE 555 HB ILE 555 -6.229 1.557 -3.107
338 HG12 ILE 555 2HG1 ILE 555 -5.256 1.214 -1.104
339 HG13 ILE 555 1HG1 ILE 555 -6.751 1.834 -0.422
340 HG21 ILE 555 1HG2 ILE 555 -8.412 2.278 -1.411
341 HG22 ILE 555 2HG2 ILE 555 -9.023 1.414 -2.821
342 HG23 ILE 555 3HG2 ILE 555 -8.023 2.851 -3.032
343 HD11 ILE 555 3HD1 ILE 555 -7.518 -0.631 -0.492
344 HD12 ILE 555 1HD1 ILE 555 -6.404 -0.105 0.766
345 HD13 ILE 555 2HD1 ILE 555 -5.797 -0.983 -0.635
346 H CYS 556 H CYS 556 -9.586 -0.794 -3.873
347 HA CYS 556 HA CYS 556 -9.000 -0.981 -6.633
348 HB2 CYS 556 2HB CYS 556 -11.662 -0.445 -5.300
349 HB3 CYS 556 1HB CYS 556 -11.428 -0.994 -6.955
350 H GLY 557 H GLY 557 -9.959 1.676 -4.560
351 HA2 GLY 557 2HA GLY 557 -9.385 3.932 -5.136
352 HA3 GLY 557 1HA GLY 557 -9.538 3.494 -6.833
353 H LEU 558 H LEU 558 -12.019 2.010 -6.292
354 HA LEU 558 HA LEU 558 -13.986 3.711 -5.234
355 HB2 LEU 558 2HB LEU 558 -15.017 4.482 -7.306
356 HB3 LEU 558 1HB LEU 558 -13.386 5.102 -7.141
357 HG LEU 558 HG LEU 558 -13.958 2.657 -8.798
358 HD11 LEU 558 1HD1 LEU 558 -13.823 5.448 -9.897
359 HD12 LEU 558 2HD1 LEU 558 -15.349 4.657 -9.504
360 HD13 LEU 558 3HD1 LEU 558 -14.283 3.959 -10.724
361 HD21 LEU 558 3HD2 LEU 558 -11.659 4.403 -8.251
362 HD22 LEU 558 1HD2 LEU 558 -11.897 3.974 -9.945
363 HD23 LEU 558 2HD2 LEU 558 -11.714 2.707 -8.733
364 H ARG 559 H ARG 559 -13.177 1.325 -7.661
365 HA ARG 559 HA ARG 559 -14.252 -0.932 -6.913
366 HB2 ARG 559 2HB ARG 559 -16.600 -1.028 -7.813
367 HB3 ARG 559 1HB ARG 559 -16.422 -0.073 -6.347
368 HG2 ARG 559 2HG ARG 559 -16.066 1.795 -8.315
369 HG3 ARG 559 1HG ARG 559 -17.271 0.717 -9.020
370 HD2 ARG 559 2HD ARG 559 -18.256 0.975 -6.522
371 HD3 ARG 559 1HD ARG 559 -17.473 2.542 -6.712
372 HE ARG 559 HE ARG 559 -19.125 1.817 -8.944
373 HH11 ARG 559 1HH1 ARG 559 -19.097 3.270 -5.771
374 HH12 ARG 559 2HH1 ARG 559 -20.529 4.204 -6.049
375 HH21 ARG 559 1HH2 ARG 559 -21.008 3.045 -9.312
376 HH22 ARG 559 2HH2 ARG 559 -21.613 4.078 -8.060
377 H GLN 560 H GLN 560 -14.020 -2.424 -8.525
378 HA GLN 560 HA GLN 560 -14.298 -1.625 -11.278
379 HB2 GLN 560 2HB GLN 560 -11.948 -0.976 -10.429
380 HB3 GLN 560 1HB GLN 560 -11.618 -2.704 -10.449
381 HG2 GLN 560 2HG GLN 560 -12.238 -2.747 -12.839
382 HG3 GLN 560 1HG GLN 560 -12.420 -0.995 -12.787
383 HE21 GLN 560 1HE2 GLN 560 -10.060 -3.502 -11.926
384 HE22 GLN 560 2HE2 GLN 560 -8.676 -2.630 -12.477
Start of MODEL 7
1 H1 ALA 507 1HT ALA 507 -17.508 5.609 -0.475
2 H2 ALA 507 2HT ALA 507 -17.729 6.834 0.707
3 H3 ALA 507 3HT ALA 507 -17.248 5.256 1.183
4 HA ALA 507 HA ALA 507 -15.656 6.940 -0.614
5 HB1 ALA 507 2HB ALA 507 -15.924 8.188 1.429
6 HB2 ALA 507 3HB ALA 507 -14.298 7.506 1.373
7 HB3 ALA 507 1HB ALA 507 -15.532 6.765 2.393
8 H GLN 508 H GLN 508 -15.550 4.508 1.999
9 HA GLN 508 HA GLN 508 -13.192 3.303 0.816
10 HB2 GLN 508 2HB GLN 508 -14.777 2.542 3.276
11 HB3 GLN 508 1HB GLN 508 -13.259 1.805 2.782
12 HG2 GLN 508 2HG GLN 508 -12.065 3.425 3.712
13 HG3 GLN 508 1HG GLN 508 -13.037 4.681 2.946
14 HE21 GLN 508 1HE2 GLN 508 -15.345 4.763 3.969
15 HE22 GLN 508 2HE2 GLN 508 -15.362 4.840 5.695
16 HA PRO 509 HA PRO 509 -15.605 0.145 -1.165
17 HB2 PRO 509 2HB PRO 509 -13.625 -1.154 -2.376
18 HB3 PRO 509 1HB PRO 509 -13.995 0.520 -2.804
19 HG2 PRO 509 2HG PRO 509 -11.748 -0.568 -1.195
20 HG3 PRO 509 1HG PRO 509 -11.801 0.871 -2.227
21 HD2 PRO 509 2HD PRO 509 -12.103 0.752 0.608
22 HD3 PRO 509 1HD PRO 509 -12.277 2.175 -0.439
23 H LYS 510 H LYS 510 -14.243 -0.267 1.642
24 HA LYS 510 HA LYS 510 -13.822 -1.972 3.116
25 HB2 LYS 510 2HB LYS 510 -16.392 -2.470 1.754
26 HB3 LYS 510 1HB LYS 510 -15.748 -3.821 2.679
27 HG2 LYS 510 2HG LYS 510 -16.172 -1.052 3.781
28 HG3 LYS 510 1HG LYS 510 -17.312 -2.388 3.952
29 HD2 LYS 510 2HD LYS 510 -15.598 -3.690 5.127
30 HD3 LYS 510 1HD LYS 510 -14.467 -2.347 4.960
31 HE2 LYS 510 2HE LYS 510 -17.082 -2.301 6.462
32 HE3 LYS 510 1HE LYS 510 -15.473 -2.372 7.180
33 HZ1 LYS 510 3HZ LYS 510 -16.526 -0.141 5.524
34 HZ2 LYS 510 1HZ LYS 510 -14.987 -0.209 6.224
35 HZ3 LYS 510 2HZ LYS 510 -16.361 -0.125 7.207
36 H CYS 511 H CYS 511 -11.852 -2.383 1.593
37 HA CYS 511 HA CYS 511 -11.462 -5.172 1.471
38 HB2 CYS 511 2HB CYS 511 -11.084 -5.272 -1.053
39 HB3 CYS 511 1HB CYS 511 -12.756 -5.256 -0.504
40 H ASN 512 H ASN 512 -10.109 -2.998 2.595
41 HA ASN 512 HA ASN 512 -7.746 -2.580 0.936
42 HB2 ASN 512 2HB ASN 512 -8.173 -1.486 3.711
43 HB3 ASN 512 1HB ASN 512 -7.116 -0.869 2.446
44 HD21 ASN 512 1HD2 ASN 512 -7.843 1.060 1.912
45 HD22 ASN 512 2HD2 ASN 512 -9.485 1.460 1.549
46 HA PRO 513 HA PRO 513 -5.429 -5.692 3.030
47 HB2 PRO 513 2HB PRO 513 -2.907 -4.881 2.524
48 HB3 PRO 513 1HB PRO 513 -3.964 -5.521 1.260
49 HG2 PRO 513 2HG PRO 513 -3.299 -2.675 1.909
50 HG3 PRO 513 1HG PRO 513 -3.434 -3.460 0.329
51 HD2 PRO 513 2HD PRO 513 -5.406 -1.926 1.433
52 HD3 PRO 513 1HD PRO 513 -5.713 -3.235 0.275
53 H ASN 514 H ASN 514 -2.998 -3.260 3.590
54 HA ASN 514 HA ASN 514 -3.631 -3.243 6.467
55 HB2 ASN 514 2HB ASN 514 -1.155 -3.893 5.008
56 HB3 ASN 514 1HB ASN 514 -0.948 -2.818 6.384
57 HD21 ASN 514 1HD2 ASN 514 -1.304 -6.005 5.367
58 HD22 ASN 514 2HD2 ASN 514 -1.498 -6.746 6.914
59 H LEU 515 H LEU 515 -1.361 -1.666 4.281
60 HA LEU 515 HA LEU 515 -0.585 0.489 4.252
61 HB2 LEU 515 2HB LEU 515 -2.203 1.920 3.229
62 HB3 LEU 515 1HB LEU 515 -2.419 0.282 2.644
63 HG LEU 515 HG LEU 515 -4.170 0.422 4.770
64 HD11 LEU 515 1HD1 LEU 515 -4.491 2.597 5.192
65 HD12 LEU 515 2HD1 LEU 515 -5.427 2.584 3.698
66 HD13 LEU 515 3HD1 LEU 515 -3.741 3.102 3.677
67 HD21 LEU 515 3HD2 LEU 515 -5.835 0.820 2.759
68 HD22 LEU 515 1HD2 LEU 515 -4.957 -0.697 2.948
69 HD23 LEU 515 2HD2 LEU 515 -4.378 0.520 1.810
70 H HIS 516 H HIS 516 -0.664 -0.162 6.859
71 HA HIS 516 HA HIS 516 -2.078 1.990 8.246
72 HB2 HIS 516 2HB HIS 516 -1.489 -0.699 8.895
73 HB3 HIS 516 1HB HIS 516 -0.594 0.307 10.029
74 HD1 HIS 516 1HD HIS 516 -2.936 2.568 9.958
75 HD2 HIS 516 2HD HIS 516 -3.302 -1.462 10.896
76 HE1 HIS 516 1HE HIS 516 -5.009 2.393 11.371
77 HE2 HIS 516 2HE HIS 516 -5.162 -0.042 11.999
78 H TYR 517 H TYR 517 0.971 1.472 6.903
79 HA TYR 517 HA TYR 517 2.386 2.938 8.978
80 HB2 TYR 517 2HB TYR 517 4.373 2.332 7.940
81 HB3 TYR 517 1HB TYR 517 3.333 0.970 7.551
82 HD1 TYR 517 1HD TYR 517 4.226 4.305 6.096
83 HD2 TYR 517 2HD TYR 517 3.454 0.177 5.386
84 HE1 TYR 517 1HE TYR 517 4.695 4.634 3.718
85 HE2 TYR 517 2HE TYR 517 3.923 0.501 3.002
86 HH TYR 517 HH TYR 517 5.437 2.323 1.656
87 H TRP 518 H TRP 518 0.867 3.526 5.926
88 HA TRP 518 HA TRP 518 1.893 6.273 5.926
89 HB2 TRP 518 2HB TRP 518 2.178 4.587 3.891
90 HB3 TRP 518 1HB TRP 518 0.547 5.137 3.530
91 HD1 TRP 518 HD TRP 518 0.452 7.166 2.006
92 HE1 TRP 518 1HE TRP 518 2.024 9.115 1.411
93 HE3 TRP 518 3HE TRP 518 4.303 6.099 5.191
94 HZ2 TRP 518 2HZ TRP 518 4.561 10.074 2.193
95 HZ3 TRP 518 3HZ TRP 518 6.265 7.583 5.208
96 HH2 TRP 518 HH TRP 518 6.390 9.529 3.739
97 H THR 519 H THR 519 0.533 7.852 6.194
98 HA THR 519 HA THR 519 -1.726 8.083 7.391
99 HB THR 519 HB THR 519 -0.849 10.045 6.448
100 HG1 THR 519 1HG THR 519 -3.167 10.023 6.609
101 HG21 THR 519 3HG2 THR 519 -0.179 10.362 4.352
102 HG22 THR 519 1HG2 THR 519 -1.665 9.695 3.675
103 HG23 THR 519 2HG2 THR 519 -0.363 8.615 4.180
104 H THR 520 H THR 520 -1.875 7.363 3.887
105 HA THR 520 HA THR 520 -3.847 5.406 4.072
106 HB THR 520 HB THR 520 -5.133 7.531 4.832
107 HG1 THR 520 1HG THR 520 -6.030 5.748 2.835
108 HG21 THR 520 3HG2 THR 520 -5.197 7.953 1.850
109 HG22 THR 520 1HG2 THR 520 -4.471 9.035 3.040
110 HG23 THR 520 2HG2 THR 520 -6.214 8.771 3.038
111 H GLN 521 H GLN 521 -2.858 8.183 2.097
112 HA GLN 521 HA GLN 521 -3.546 7.436 -0.408
113 HB2 GLN 521 2HB GLN 521 -1.814 9.300 0.667
114 HB3 GLN 521 1HB GLN 521 -0.771 8.327 -0.363
115 HG2 GLN 521 2HG GLN 521 -2.507 8.676 -2.184
116 HG3 GLN 521 1HG GLN 521 -3.190 9.919 -1.137
117 HE21 GLN 521 1HE2 GLN 521 -0.908 9.223 -3.497
118 HE22 GLN 521 2HE2 GLN 521 -0.005 10.695 -3.425
119 H ASP 522 H ASP 522 -2.503 6.388 -2.153
120 HA ASP 522 HA ASP 522 -1.775 3.781 -1.729
121 HB2 ASP 522 2HB ASP 522 -0.745 3.945 -4.073
122 HB3 ASP 522 1HB ASP 522 -2.449 4.359 -3.909
123 H GLU 523 H GLU 523 -0.242 3.597 -0.093
124 HA GLU 523 HA GLU 523 2.413 4.714 -0.551
125 HB2 GLU 523 2HB GLU 523 2.912 3.982 1.694
126 HB3 GLU 523 1HB GLU 523 1.396 4.862 1.683
127 HG2 GLU 523 2HG GLU 523 1.192 1.938 1.396
128 HG3 GLU 523 1HG GLU 523 1.751 2.532 2.958
129 H GLY 524 H GLY 524 2.054 3.115 -2.505
130 HA2 GLY 524 2HA GLY 524 3.746 1.491 -3.267
131 HA3 GLY 524 1HA GLY 524 3.403 0.587 -1.796
132 H ALA 525 H ALA 525 0.571 1.896 -2.866
133 HA ALA 525 HA ALA 525 -0.549 -0.593 -3.597
134 HB1 ALA 525 1HB ALA 525 -1.898 1.092 -2.527
135 HB2 ALA 525 2HB ALA 525 -2.570 0.746 -4.120
136 HB3 ALA 525 3HB ALA 525 -1.624 2.212 -3.862
137 H ALA 526 H ALA 526 1.390 -0.684 -5.298
138 HA ALA 526 HA ALA 526 1.992 -0.912 -7.464
139 HB1 ALA 526 1HB ALA 526 -0.724 -0.481 -8.524
140 HB2 ALA 526 2HB ALA 526 -0.542 -1.786 -7.350
141 HB3 ALA 526 3HB ALA 526 0.422 -1.786 -8.828
142 H ILE 527 H ILE 527 3.116 1.046 -7.391
143 HA ILE 527 HA ILE 527 2.482 2.842 -9.448
144 HB ILE 527 HB ILE 527 0.900 3.735 -7.925
145 HG12 ILE 527 2HG1 ILE 527 3.210 5.628 -7.604
146 HG13 ILE 527 1HG1 ILE 527 2.564 5.286 -9.206
147 HG21 ILE 527 1HG2 ILE 527 2.208 2.708 -5.955
148 HG22 ILE 527 2HG2 ILE 527 1.217 4.146 -5.693
149 HG23 ILE 527 3HG2 ILE 527 2.967 4.300 -5.867
150 HD11 ILE 527 3HD1 ILE 527 1.588 7.070 -7.201
151 HD12 ILE 527 1HD1 ILE 527 0.355 5.868 -7.580
152 HD13 ILE 527 2HD1 ILE 527 1.048 6.855 -8.867
153 H GLY 528 H GLY 528 4.162 2.677 -6.316
154 HA2 GLY 528 2HA GLY 528 6.365 2.926 -5.757
155 HA3 GLY 528 1HA GLY 528 6.728 2.511 -7.419
156 H ALA 529 H ALA 529 5.028 5.018 -8.173
157 HA ALA 529 HA ALA 529 5.644 7.070 -8.983
158 HB1 ALA 529 1HB ALA 529 5.043 7.191 -6.372
159 HB2 ALA 529 2HB ALA 529 5.440 8.609 -7.343
160 HB3 ALA 529 3HB ALA 529 6.676 7.858 -6.333
161 H ALA 530 H ALA 530 7.733 5.086 -9.247
162 HA ALA 530 HA ALA 530 9.843 6.501 -10.229
163 HB1 ALA 530 1HB ALA 530 9.906 6.576 -7.364
164 HB2 ALA 530 2HB ALA 530 11.030 7.298 -8.514
165 HB3 ALA 530 3HB ALA 530 11.284 5.645 -7.949
166 H TRP 531 H TRP 531 8.631 4.304 -11.046
167 HA TRP 531 HA TRP 531 8.689 1.995 -11.302
168 HB2 TRP 531 2HB TRP 531 11.001 1.435 -12.352
169 HB3 TRP 531 1HB TRP 531 9.900 2.525 -13.190
170 HD1 TRP 531 HD TRP 531 12.541 3.206 -10.419
171 HE1 TRP 531 1HE TRP 531 14.050 5.131 -11.224
172 HE3 TRP 531 3HE TRP 531 10.477 3.982 -15.031
173 HZ2 TRP 531 2HZ TRP 531 14.328 6.761 -13.512
174 HZ3 TRP 531 3HZ TRP 531 11.422 5.743 -16.466
175 HH2 TRP 531 HH TRP 531 13.308 7.103 -15.720
176 H ILE 532 H ILE 532 8.957 2.443 -8.710
177 HA ILE 532 HA ILE 532 10.835 0.355 -7.928
178 HB ILE 532 HB ILE 532 11.746 2.618 -7.526
179 HG12 ILE 532 2HG1 ILE 532 11.097 1.053 -5.013
180 HG13 ILE 532 1HG1 ILE 532 12.421 0.706 -6.113
181 HG21 ILE 532 1HG2 ILE 532 9.799 3.045 -5.330
182 HG22 ILE 532 2HG2 ILE 532 9.264 3.348 -6.988
183 HG23 ILE 532 3HG2 ILE 532 10.661 4.216 -6.334
184 HD11 ILE 532 3HD1 ILE 532 12.133 3.306 -4.641
185 HD12 ILE 532 1HD1 ILE 532 13.533 2.715 -5.536
186 HD13 ILE 532 2HD1 ILE 532 13.050 1.927 -4.029
187 HA PRO 533 HA PRO 533 6.471 0.558 -5.805
188 HB2 PRO 533 2HB PRO 533 4.959 -0.968 -7.500
189 HB3 PRO 533 1HB PRO 533 4.980 0.795 -7.535
190 HG2 PRO 533 2HG PRO 533 6.434 -1.145 -9.272
191 HG3 PRO 533 1HG PRO 533 5.633 0.373 -9.711
192 HD2 PRO 533 2HD PRO 533 8.305 0.169 -9.434
193 HD3 PRO 533 1HD PRO 533 7.411 1.653 -9.045
194 H TYR 534 H TYR 534 8.474 -1.633 -7.457
195 HA TYR 534 HA TYR 534 7.594 -4.116 -6.563
196 HB2 TYR 534 2HB TYR 534 10.403 -3.181 -7.202
197 HB3 TYR 534 1HB TYR 534 9.883 -4.860 -7.109
198 HD1 TYR 534 1HD TYR 534 9.598 -1.718 -9.099
199 HD2 TYR 534 2HD TYR 534 8.708 -5.892 -8.902
200 HE1 TYR 534 1HE TYR 534 8.986 -1.706 -11.473
201 HE2 TYR 534 2HE TYR 534 8.096 -5.872 -11.280
202 HH TYR 534 HH TYR 534 7.449 -3.149 -12.993
203 H PHE 535 H PHE 535 10.246 -2.096 -5.277
204 HA PHE 535 HA PHE 535 9.685 -3.212 -2.617
205 HB2 PHE 535 2HB PHE 535 12.208 -3.073 -2.231
206 HB3 PHE 535 1HB PHE 535 11.614 -4.393 -3.231
207 HD1 PHE 535 1HD PHE 535 13.199 -1.052 -3.352
208 HD2 PHE 535 2HD PHE 535 12.350 -4.661 -5.441
209 HE1 PHE 535 1HE PHE 535 14.721 -0.360 -5.158
210 HE2 PHE 535 2HE PHE 535 13.872 -3.977 -7.250
211 HZ PHE 535 HZ PHE 535 15.059 -1.824 -7.109
212 H GLY 536 H GLY 536 9.435 -0.525 -4.277
213 HA2 GLY 536 2HA GLY 536 10.942 1.443 -2.976
214 HA3 GLY 536 1HA GLY 536 9.392 1.710 -3.765
215 HA PRO 537 HA PRO 537 7.939 2.446 0.413
216 HB2 PRO 537 2HB PRO 537 5.465 3.175 -0.147
217 HB3 PRO 537 1HB PRO 537 6.800 4.153 -0.787
218 HG2 PRO 537 2HG PRO 537 5.283 1.945 -2.149
219 HG3 PRO 537 1HG PRO 537 5.553 3.602 -2.733
220 HD2 PRO 537 2HD PRO 537 7.094 1.500 -3.478
221 HD3 PRO 537 1HD PRO 537 7.749 3.146 -3.317
222 H ALA 538 H ALA 538 7.973 -0.226 -0.902
223 HA ALA 538 HA ALA 538 5.739 -1.468 0.499
224 HB1 ALA 538 1HB ALA 538 5.526 -3.079 -1.244
225 HB2 ALA 538 2HB ALA 538 6.993 -2.501 -2.041
226 HB3 ALA 538 3HB ALA 538 5.543 -1.493 -2.017
227 H ALA 539 H ALA 539 9.067 -1.250 -0.278
228 HA ALA 539 HA ALA 539 9.688 -3.160 1.787
229 HB1 ALA 539 1HB ALA 539 10.768 -3.586 -0.978
230 HB2 ALA 539 2HB ALA 539 9.493 -4.541 -0.225
231 HB3 ALA 539 3HB ALA 539 11.122 -4.554 0.450
232 H GLU 540 H GLU 540 10.209 -0.194 0.783
233 HA GLU 540 HA GLU 540 13.083 -0.043 0.743
234 HB2 GLU 540 2HB GLU 540 12.756 2.378 0.980
235 HB3 GLU 540 1HB GLU 540 11.766 1.719 -0.312
236 HG2 GLU 540 2HG GLU 540 10.023 2.726 0.608
237 HG3 GLU 540 1HG GLU 540 10.162 1.604 1.960
238 H GLY 541 H GLY 541 12.844 -1.569 2.724
239 HA2 GLY 541 2HA GLY 541 13.829 -1.576 4.901
240 HA3 GLY 541 1HA GLY 541 13.232 0.067 5.133
241 H ILE 542 H ILE 542 10.726 -1.085 3.695
242 HA ILE 542 HA ILE 542 9.143 -1.441 5.998
243 HB ILE 542 HB ILE 542 8.735 -1.332 3.084
244 HG12 ILE 542 2HG1 ILE 542 6.865 -0.536 5.298
245 HG13 ILE 542 1HG1 ILE 542 8.287 0.424 4.899
246 HG21 ILE 542 1HG2 ILE 542 7.737 -3.461 3.305
247 HG22 ILE 542 2HG2 ILE 542 6.415 -2.286 3.298
248 HG23 ILE 542 3HG2 ILE 542 6.941 -3.014 4.815
249 HD11 ILE 542 3HD1 ILE 542 6.497 1.397 3.736
250 HD12 ILE 542 1HD1 ILE 542 5.913 -0.169 3.172
251 HD13 ILE 542 2HD1 ILE 542 7.419 0.489 2.536
252 H TYR 543 H TYR 543 10.225 -3.685 3.453
253 HA TYR 543 HA TYR 543 8.985 -5.992 4.178
254 HB2 TYR 543 2HB TYR 543 10.743 -7.212 3.111
255 HB3 TYR 543 1HB TYR 543 10.564 -5.688 2.247
256 HD1 TYR 543 2HD TYR 543 12.078 -3.749 3.478
257 HD2 TYR 543 1HD TYR 543 12.916 -7.906 3.333
258 HE1 TYR 543 2HE TYR 543 14.472 -3.265 3.800
259 HE2 TYR 543 1HE TYR 543 15.313 -7.447 3.658
260 HH TYR 543 HH TYR 543 16.480 -4.348 4.561
261 H ALA 544 H ALA 544 11.728 -4.486 5.747
262 HA ALA 544 HA ALA 544 12.676 -6.468 7.394
263 HB1 ALA 544 1HB ALA 544 12.177 -3.648 8.312
264 HB2 ALA 544 2HB ALA 544 13.486 -4.089 7.215
265 HB3 ALA 544 3HB ALA 544 13.443 -4.752 8.850
266 H GLU 545 H GLU 545 9.807 -4.487 7.743
267 HA GLU 545 HA GLU 545 9.023 -5.324 10.325
268 HB2 GLU 545 2HB GLU 545 7.027 -4.636 8.180
269 HB3 GLU 545 1HB GLU 545 6.989 -4.237 9.894
270 HG2 GLU 545 2HG GLU 545 9.262 -3.003 8.731
271 HG3 GLU 545 1HG GLU 545 7.860 -2.675 7.717
272 H GLY 546 H GLY 546 7.789 -6.180 7.149
273 HA2 GLY 546 2HA GLY 546 6.718 -8.025 6.359
274 HA3 GLY 546 1HA GLY 546 7.913 -8.905 7.293
275 H LEU 547 H LEU 547 5.696 -6.864 8.996
276 HA LEU 547 HA LEU 547 4.271 -9.265 9.929
277 HB2 LEU 547 2HB LEU 547 3.757 -7.616 11.919
278 HB3 LEU 547 1HB LEU 547 5.241 -8.548 11.857
279 HG LEU 547 HG LEU 547 6.400 -6.562 10.908
280 HD11 LEU 547 1HD1 LEU 547 3.844 -5.117 11.580
281 HD12 LEU 547 2HD1 LEU 547 4.397 -5.494 9.949
282 HD13 LEU 547 3HD1 LEU 547 5.334 -4.401 10.966
283 HD21 LEU 547 3HD2 LEU 547 6.901 -6.615 13.107
284 HD22 LEU 547 1HD2 LEU 547 5.211 -6.722 13.601
285 HD23 LEU 547 2HD2 LEU 547 5.901 -5.164 13.147
286 H MET 548 H MET 548 3.932 -6.451 8.167
287 HA MET 548 HA MET 548 1.344 -6.727 7.407
288 HB2 MET 548 2HB MET 548 0.260 -4.837 8.802
289 HB3 MET 548 1HB MET 548 0.385 -6.436 9.522
290 HG2 MET 548 2HG MET 548 2.077 -5.794 10.968
291 HG3 MET 548 1HG MET 548 2.504 -4.385 10.000
292 HE1 MET 548 3HE MET 548 1.713 -1.897 10.921
293 HE2 MET 548 1HE MET 548 -0.042 -1.745 10.838
294 HE3 MET 548 2HE MET 548 0.840 -2.516 9.519
295 H HIS 549 H HIS 549 3.883 -4.528 8.341
296 HA HIS 549 HA HIS 549 3.072 -2.330 6.754
297 HB2 HIS 549 2HB HIS 549 5.517 -3.114 8.240
298 HB3 HIS 549 1HB HIS 549 5.719 -1.925 6.953
299 HD1 HIS 549 1HD HIS 549 2.468 -1.803 8.609
300 HD2 HIS 549 2HD HIS 549 6.196 -0.044 9.111
301 HE1 HIS 549 1HE HIS 549 2.080 0.159 10.109
302 HE2 HIS 549 2HE HIS 549 4.370 1.136 10.514
303 H ASN 550 H ASN 550 4.580 -5.337 6.028
304 HA ASN 550 HA ASN 550 5.984 -4.610 3.692
305 HB2 ASN 550 2HB ASN 550 5.956 -7.040 3.190
306 HB3 ASN 550 1HB ASN 550 6.487 -6.683 4.831
307 HD21 ASN 550 1HD2 ASN 550 5.653 -9.180 4.217
308 HD22 ASN 550 2HD2 ASN 550 4.130 -9.506 4.965
309 H GLN 551 H GLN 551 2.709 -4.618 4.286
310 HA GLN 551 HA GLN 551 1.426 -5.708 2.136
311 HB2 GLN 551 2HB GLN 551 -0.254 -3.869 2.455
312 HB3 GLN 551 1HB GLN 551 0.186 -4.732 3.924
313 HG2 GLN 551 2HG GLN 551 0.323 -2.614 4.713
314 HG3 GLN 551 1HG GLN 551 1.966 -2.779 4.093
315 HE21 GLN 551 1HE2 GLN 551 2.089 -0.515 3.890
316 HE22 GLN 551 2HE2 GLN 551 1.320 0.310 2.581
317 H ASP 552 H ASP 552 0.160 -4.113 0.532
318 HA ASP 552 HA ASP 552 2.160 -2.487 -0.892
319 HB2 ASP 552 2HB ASP 552 1.602 -4.831 -1.877
320 HB3 ASP 552 1HB ASP 552 0.081 -4.086 -2.359
321 H GLY 553 H GLY 553 -1.323 -3.203 -0.580
322 HA2 GLY 553 2HA GLY 553 -2.760 -1.313 0.060
323 HA3 GLY 553 1HA GLY 553 -1.811 -0.323 -1.036
324 H LEU 554 H LEU 554 -3.194 -3.560 -1.533
325 HA LEU 554 HA LEU 554 -3.931 -3.378 -4.103
326 HB2 LEU 554 2HB LEU 554 -6.073 -4.751 -3.298
327 HB3 LEU 554 1HB LEU 554 -4.467 -5.441 -3.393
328 HG LEU 554 HG LEU 554 -4.761 -4.286 -0.808
329 HD11 LEU 554 1HD1 LEU 554 -6.766 -4.872 -0.012
330 HD12 LEU 554 2HD1 LEU 554 -6.786 -6.387 -0.915
331 HD13 LEU 554 3HD1 LEU 554 -7.262 -4.885 -1.706
332 HD21 LEU 554 3HD2 LEU 554 -3.289 -6.037 -0.939
333 HD22 LEU 554 1HD2 LEU 554 -4.344 -6.986 -1.987
334 HD23 LEU 554 2HD2 LEU 554 -4.703 -6.849 -0.266
335 H ILE 555 H ILE 555 -6.604 -3.008 -1.798
336 HA ILE 555 HA ILE 555 -8.435 -1.657 -1.799
337 HB ILE 555 HB ILE 555 -6.804 0.285 -3.423
338 HG12 ILE 555 2HG1 ILE 555 -5.390 -0.084 -1.608
339 HG13 ILE 555 1HG1 ILE 555 -6.363 1.280 -1.070
340 HG21 ILE 555 1HG2 ILE 555 -8.820 1.294 -3.379
341 HG22 ILE 555 2HG2 ILE 555 -8.294 1.783 -1.769
342 HG23 ILE 555 3HG2 ILE 555 -9.360 0.391 -1.964
343 HD11 ILE 555 3HD1 ILE 555 -6.628 -1.594 -0.281
344 HD12 ILE 555 1HD1 ILE 555 -7.832 -0.369 0.100
345 HD13 ILE 555 2HD1 ILE 555 -6.194 -0.224 0.740
346 H CYS 556 H CYS 556 -10.213 -2.025 -2.942
347 HA CYS 556 HA CYS 556 -10.205 -2.966 -5.580
348 HB2 CYS 556 2HB CYS 556 -12.509 -1.720 -4.064
349 HB3 CYS 556 1HB CYS 556 -12.641 -2.749 -5.486
350 H GLY 557 H GLY 557 -10.512 0.256 -4.259
351 HA2 GLY 557 2HA GLY 557 -9.792 2.138 -5.588
352 HA3 GLY 557 1HA GLY 557 -10.426 1.314 -7.006
353 H LEU 558 H LEU 558 -12.898 0.538 -5.767
354 HA LEU 558 HA LEU 558 -14.372 2.611 -4.654
355 HB2 LEU 558 2HB LEU 558 -15.374 3.733 -6.456
356 HB3 LEU 558 1HB LEU 558 -13.668 3.678 -6.860
357 HG LEU 558 HG LEU 558 -15.287 1.440 -7.874
358 HD11 LEU 558 1HD1 LEU 558 -15.968 4.228 -8.450
359 HD12 LEU 558 2HD1 LEU 558 -16.909 2.753 -8.674
360 HD13 LEU 558 3HD1 LEU 558 -15.705 3.223 -9.876
361 HD21 LEU 558 3HD2 LEU 558 -12.974 3.093 -8.748
362 HD22 LEU 558 1HD2 LEU 558 -13.899 2.193 -9.951
363 HD23 LEU 558 2HD2 LEU 558 -13.129 1.341 -8.611
364 H ARG 559 H ARG 559 -14.113 -0.432 -5.225
365 HA ARG 559 HA ARG 559 -15.532 -2.214 -5.132
366 HB2 ARG 559 2HB ARG 559 -17.849 -0.284 -5.088
367 HB3 ARG 559 1HB ARG 559 -17.793 -1.925 -4.461
368 HG2 ARG 559 2HG ARG 559 -17.435 -1.003 -2.478
369 HG3 ARG 559 1HG ARG 559 -15.805 -0.659 -3.055
370 HD2 ARG 559 2HD ARG 559 -16.917 1.328 -2.097
371 HD3 ARG 559 1HD ARG 559 -16.481 1.541 -3.791
372 HE ARG 559 HE ARG 559 -18.703 1.721 -4.310
373 HH11 ARG 559 1HH1 ARG 559 -18.396 0.388 -1.098
374 HH12 ARG 559 2HH1 ARG 559 -20.090 0.496 -0.756
375 HH21 ARG 559 1HH2 ARG 559 -20.931 1.865 -3.860
376 HH22 ARG 559 2HH2 ARG 559 -21.530 1.335 -2.324
377 H GLN 560 H GLN 560 -17.038 -3.385 -6.484
378 HA GLN 560 HA GLN 560 -18.245 -2.361 -8.790
379 HB2 GLN 560 2HB GLN 560 -16.647 -3.367 -10.486
380 HB3 GLN 560 1HB GLN 560 -16.116 -1.882 -9.709
381 HG2 GLN 560 2HG GLN 560 -14.376 -2.875 -8.702
382 HG3 GLN 560 1HG GLN 560 -15.276 -4.354 -8.370
383 HE21 GLN 560 1HE2 GLN 560 -13.805 -2.541 -11.031
384 HE22 GLN 560 2HE2 GLN 560 -13.283 -3.928 -11.920
Start of MODEL 8
1 H1 ALA 507 1HT ALA 507 -16.689 3.773 4.597
2 H2 ALA 507 2HT ALA 507 -17.902 4.850 4.035
3 H3 ALA 507 3HT ALA 507 -16.354 4.837 3.295
4 HA ALA 507 HA ALA 507 -18.037 2.448 3.364
5 HB1 ALA 507 2HB ALA 507 -18.555 3.293 0.919
6 HB2 ALA 507 3HB ALA 507 -18.330 4.873 1.669
7 HB3 ALA 507 1HB ALA 507 -19.558 3.769 2.289
8 H GLN 508 H GLN 508 -16.480 0.962 3.107
9 HA GLN 508 HA GLN 508 -14.216 1.492 1.359
10 HB2 GLN 508 2HB GLN 508 -14.898 -0.647 3.343
11 HB3 GLN 508 1HB GLN 508 -13.648 -0.940 2.143
12 HG2 GLN 508 2HG GLN 508 -12.352 -0.123 3.805
13 HG3 GLN 508 1HG GLN 508 -12.776 1.400 3.025
14 HE21 GLN 508 1HE2 GLN 508 -13.566 -0.757 5.682
15 HE22 GLN 508 2HE2 GLN 508 -14.263 0.450 6.702
16 HA PRO 509 HA PRO 509 -15.894 -1.004 -1.900
17 HB2 PRO 509 2HB PRO 509 -13.669 -1.250 -3.410
18 HB3 PRO 509 1HB PRO 509 -14.501 0.291 -3.196
19 HG2 PRO 509 2HG PRO 509 -11.911 -0.576 -2.144
20 HG3 PRO 509 1HG PRO 509 -12.579 1.057 -2.267
21 HD2 PRO 509 2HD PRO 509 -12.498 -0.719 0.035
22 HD3 PRO 509 1HD PRO 509 -12.960 0.993 -0.036
23 H LYS 510 H LYS 510 -14.556 -2.421 0.509
24 HA LYS 510 HA LYS 510 -13.904 -4.518 1.125
25 HB2 LYS 510 2HB LYS 510 -15.958 -4.850 -0.991
26 HB3 LYS 510 1HB LYS 510 -15.077 -6.291 -0.501
27 HG2 LYS 510 2HG LYS 510 -15.899 -4.867 1.831
28 HG3 LYS 510 1HG LYS 510 -17.285 -5.079 0.761
29 HD2 LYS 510 2HD LYS 510 -15.543 -7.436 1.142
30 HD3 LYS 510 1HD LYS 510 -16.494 -6.930 2.539
31 HE2 LYS 510 2HE LYS 510 -18.283 -6.809 0.427
32 HE3 LYS 510 1HE LYS 510 -17.333 -8.256 0.097
33 HZ1 LYS 510 3HZ LYS 510 -17.846 -9.062 2.311
34 HZ2 LYS 510 1HZ LYS 510 -19.272 -8.746 1.457
35 HZ3 LYS 510 2HZ LYS 510 -18.739 -7.666 2.645
36 H CYS 511 H CYS 511 -11.799 -3.504 -0.058
37 HA CYS 511 HA CYS 511 -10.460 -5.742 -1.155
38 HB2 CYS 511 2HB CYS 511 -9.869 -4.569 -3.359
39 HB3 CYS 511 1HB CYS 511 -11.460 -5.312 -3.239
40 H ASN 512 H ASN 512 -9.890 -4.264 1.017
41 HA ASN 512 HA ASN 512 -7.582 -2.624 0.203
42 HB2 ASN 512 2HB ASN 512 -8.750 -2.426 2.949
43 HB3 ASN 512 1HB ASN 512 -7.905 -1.204 2.005
44 HD21 ASN 512 1HD2 ASN 512 -10.931 -2.932 2.380
45 HD22 ASN 512 2HD2 ASN 512 -11.924 -1.743 1.615
46 HA PRO 513 HA PRO 513 -5.216 -5.762 2.247
47 HB2 PRO 513 2HB PRO 513 -2.768 -4.687 2.011
48 HB3 PRO 513 1HB PRO 513 -3.658 -5.299 0.614
49 HG2 PRO 513 2HG PRO 513 -3.249 -2.485 1.511
50 HG3 PRO 513 1HG PRO 513 -3.304 -3.146 -0.127
51 HD2 PRO 513 2HD PRO 513 -5.399 -1.854 1.167
52 HD3 PRO 513 1HD PRO 513 -5.561 -2.900 -0.256
53 H ASN 514 H ASN 514 -3.068 -3.199 3.196
54 HA ASN 514 HA ASN 514 -4.065 -3.293 5.961
55 HB2 ASN 514 2HB ASN 514 -1.427 -4.054 4.881
56 HB3 ASN 514 1HB ASN 514 -1.397 -3.045 6.320
57 HD21 ASN 514 1HD2 ASN 514 -3.173 -5.861 5.084
58 HD22 ASN 514 2HD2 ASN 514 -3.106 -6.764 6.555
59 H LEU 515 H LEU 515 -1.395 -1.828 4.197
60 HA LEU 515 HA LEU 515 -0.475 0.259 4.342
61 HB2 LEU 515 2HB LEU 515 -1.820 1.848 3.185
62 HB3 LEU 515 1HB LEU 515 -2.099 0.256 2.509
63 HG LEU 515 HG LEU 515 -4.093 0.464 4.385
64 HD11 LEU 515 1HD1 LEU 515 -4.305 2.627 4.909
65 HD12 LEU 515 2HD1 LEU 515 -4.990 2.802 3.294
66 HD13 LEU 515 3HD1 LEU 515 -3.283 3.147 3.568
67 HD21 LEU 515 3HD2 LEU 515 -4.094 1.057 1.437
68 HD22 LEU 515 1HD2 LEU 515 -5.557 0.843 2.398
69 HD23 LEU 515 2HD2 LEU 515 -4.413 -0.488 2.227
70 H HIS 516 H HIS 516 -0.943 -0.485 6.880
71 HA HIS 516 HA HIS 516 -2.327 1.739 8.185
72 HB2 HIS 516 2HB HIS 516 -1.514 -1.006 9.036
73 HB3 HIS 516 1HB HIS 516 -1.712 0.240 10.265
74 HD1 HIS 516 1HD HIS 516 -4.201 1.671 9.317
75 HD2 HIS 516 2HD HIS 516 -3.789 -2.464 9.227
76 HE1 HIS 516 1HE HIS 516 -6.544 0.762 9.307
77 HE2 HIS 516 2HE HIS 516 -6.270 -1.742 9.339
78 H TYR 517 H TYR 517 0.806 0.971 7.215
79 HA TYR 517 HA TYR 517 2.131 2.072 9.532
80 HB2 TYR 517 2HB TYR 517 4.153 1.500 8.527
81 HB3 TYR 517 1HB TYR 517 3.059 0.271 7.910
82 HD1 TYR 517 1HD TYR 517 4.226 3.699 6.946
83 HD2 TYR 517 2HD TYR 517 3.279 -0.249 5.670
84 HE1 TYR 517 1HE TYR 517 4.856 4.298 4.658
85 HE2 TYR 517 2HE TYR 517 3.905 0.341 3.374
86 HH TYR 517 HH TYR 517 4.168 2.277 1.970
87 H TRP 518 H TRP 518 0.905 3.241 6.513
88 HA TRP 518 HA TRP 518 2.142 5.854 6.997
89 HB2 TRP 518 2HB TRP 518 2.372 4.457 4.739
90 HB3 TRP 518 1HB TRP 518 0.836 5.247 4.402
91 HD1 TRP 518 HD TRP 518 1.086 7.446 3.170
92 HE1 TRP 518 1HE TRP 518 2.886 9.276 2.971
93 HE3 TRP 518 3HE TRP 518 4.539 5.535 6.413
94 HZ2 TRP 518 2HZ TRP 518 5.433 9.834 4.051
95 HZ3 TRP 518 3HZ TRP 518 6.631 6.776 6.776
96 HH2 TRP 518 HH TRP 518 7.068 8.882 5.619
97 H THR 519 H THR 519 0.919 7.453 7.549
98 HA THR 519 HA THR 519 -1.362 7.722 8.657
99 HB THR 519 HB THR 519 -0.269 9.720 8.105
100 HG1 THR 519 1HG THR 519 -2.275 10.417 8.201
101 HG21 THR 519 3HG2 THR 519 0.569 10.300 6.133
102 HG22 THR 519 1HG2 THR 519 -0.936 9.943 5.286
103 HG23 THR 519 2HG2 THR 519 0.208 8.646 5.636
104 H THR 520 H THR 520 -1.426 7.661 5.075
105 HA THR 520 HA THR 520 -3.584 5.904 4.872
106 HB THR 520 HB THR 520 -4.684 7.990 5.952
107 HG1 THR 520 1HG THR 520 -6.564 7.603 4.704
108 HG21 THR 520 3HG2 THR 520 -4.582 8.922 3.091
109 HG22 THR 520 1HG2 THR 520 -3.791 9.697 4.464
110 HG23 THR 520 2HG2 THR 520 -5.551 9.632 4.383
111 H GLN 521 H GLN 521 -2.255 8.858 3.406
112 HA GLN 521 HA GLN 521 -2.921 8.565 0.795
113 HB2 GLN 521 2HB GLN 521 -0.788 9.666 0.208
114 HB3 GLN 521 1HB GLN 521 -1.624 10.456 1.538
115 HG2 GLN 521 2HG GLN 521 -0.122 9.129 3.083
116 HG3 GLN 521 1HG GLN 521 0.815 8.714 1.648
117 HE21 GLN 521 1HE2 GLN 521 2.201 10.174 0.809
118 HE22 GLN 521 2HE2 GLN 521 2.473 11.749 1.465
119 H ASP 522 H ASP 522 -1.950 7.670 -1.056
120 HA ASP 522 HA ASP 522 -1.424 4.996 -0.995
121 HB2 ASP 522 2HB ASP 522 -0.329 5.361 -3.268
122 HB3 ASP 522 1HB ASP 522 -1.976 5.957 -3.082
123 H GLU 523 H GLU 523 0.024 4.344 0.545
124 HA GLU 523 HA GLU 523 2.790 5.282 0.347
125 HB2 GLU 523 2HB GLU 523 3.135 4.142 2.465
126 HB3 GLU 523 1HB GLU 523 1.768 5.237 2.566
127 HG2 GLU 523 2HG GLU 523 1.256 2.384 1.914
128 HG3 GLU 523 1HG GLU 523 1.660 2.814 3.575
129 H GLY 524 H GLY 524 2.314 4.013 -1.819
130 HA2 GLY 524 2HA GLY 524 3.745 2.359 -2.875
131 HA3 GLY 524 1HA GLY 524 3.492 1.332 -1.466
132 H ALA 525 H ALA 525 0.733 3.025 -2.392
133 HA ALA 525 HA ALA 525 -0.739 0.699 -2.998
134 HB1 ALA 525 1HB ALA 525 -1.981 2.412 -2.044
135 HB2 ALA 525 2HB ALA 525 -2.481 2.457 -3.735
136 HB3 ALA 525 3HB ALA 525 -1.314 3.635 -3.127
137 H ALA 526 H ALA 526 1.140 0.280 -4.751
138 HA ALA 526 HA ALA 526 1.648 -0.098 -6.921
139 HB1 ALA 526 1HB ALA 526 -0.050 -0.895 -8.187
140 HB2 ALA 526 2HB ALA 526 -1.089 0.493 -7.865
141 HB3 ALA 526 3HB ALA 526 -0.917 -0.780 -6.657
142 H ILE 527 H ILE 527 2.937 1.732 -7.064
143 HA ILE 527 HA ILE 527 2.337 3.460 -9.188
144 HB ILE 527 HB ILE 527 0.947 4.586 -7.625
145 HG12 ILE 527 2HG1 ILE 527 3.443 6.260 -7.602
146 HG13 ILE 527 1HG1 ILE 527 2.627 5.895 -9.120
147 HG21 ILE 527 1HG2 ILE 527 2.286 3.564 -5.678
148 HG22 ILE 527 2HG2 ILE 527 1.467 5.113 -5.453
149 HG23 ILE 527 3HG2 ILE 527 3.206 5.069 -5.753
150 HD11 ILE 527 3HD1 ILE 527 1.024 7.389 -8.732
151 HD12 ILE 527 1HD1 ILE 527 2.100 8.021 -7.487
152 HD13 ILE 527 2HD1 ILE 527 0.827 6.879 -7.056
153 H GLY 528 H GLY 528 4.189 3.261 -6.162
154 HA2 GLY 528 2HA GLY 528 6.435 3.335 -5.743
155 HA3 GLY 528 1HA GLY 528 6.655 2.806 -7.398
156 H ALA 529 H ALA 529 5.162 5.438 -8.184
157 HA ALA 529 HA ALA 529 5.907 7.388 -9.114
158 HB1 ALA 529 1HB ALA 529 6.051 9.006 -7.538
159 HB2 ALA 529 2HB ALA 529 7.257 8.133 -6.592
160 HB3 ALA 529 3HB ALA 529 5.555 7.684 -6.480
161 H ALA 530 H ALA 530 7.736 5.164 -9.452
162 HA ALA 530 HA ALA 530 9.882 6.289 -10.694
163 HB1 ALA 530 1HB ALA 530 10.224 6.499 -7.858
164 HB2 ALA 530 2HB ALA 530 11.311 7.024 -9.144
165 HB3 ALA 530 3HB ALA 530 11.431 5.386 -8.500
166 H TRP 531 H TRP 531 8.354 4.198 -11.249
167 HA TRP 531 HA TRP 531 8.152 1.885 -11.382
168 HB2 TRP 531 2HB TRP 531 10.301 1.047 -12.615
169 HB3 TRP 531 1HB TRP 531 9.192 2.161 -13.410
170 HD1 TRP 531 HD TRP 531 12.191 2.763 -11.019
171 HE1 TRP 531 1HE TRP 531 13.725 4.527 -12.100
172 HE3 TRP 531 3HE TRP 531 9.618 3.511 -15.368
173 HZ2 TRP 531 2HZ TRP 531 13.826 6.036 -14.486
174 HZ3 TRP 531 3HZ TRP 531 10.498 5.131 -16.997
175 HH2 TRP 531 HH TRP 531 12.558 6.366 -16.564
176 H ILE 532 H ILE 532 8.726 2.409 -8.860
177 HA ILE 532 HA ILE 532 10.479 0.188 -8.158
178 HB ILE 532 HB ILE 532 11.636 2.352 -7.947
179 HG12 ILE 532 2HG1 ILE 532 11.067 1.145 -5.230
180 HG13 ILE 532 1HG1 ILE 532 12.095 0.375 -6.428
181 HG21 ILE 532 1HG2 ILE 532 10.815 4.119 -6.785
182 HG22 ILE 532 2HG2 ILE 532 9.954 3.104 -5.626
183 HG23 ILE 532 3HG2 ILE 532 9.286 3.361 -7.244
184 HD11 ILE 532 3HD1 ILE 532 12.628 3.155 -5.459
185 HD12 ILE 532 1HD1 ILE 532 13.727 2.026 -6.251
186 HD13 ILE 532 2HD1 ILE 532 13.210 1.734 -4.587
187 HA PRO 533 HA PRO 533 6.402 0.877 -5.619
188 HB2 PRO 533 2HB PRO 533 4.567 -0.527 -7.080
189 HB3 PRO 533 1HB PRO 533 4.765 1.223 -7.188
190 HG2 PRO 533 2HG PRO 533 5.811 -0.912 -8.991
191 HG3 PRO 533 1HG PRO 533 5.128 0.670 -9.404
192 HD2 PRO 533 2HD PRO 533 7.782 0.186 -9.400
193 HD3 PRO 533 1HD PRO 533 7.092 1.769 -8.991
194 H TYR 534 H TYR 534 7.994 -1.560 -7.374
195 HA TYR 534 HA TYR 534 6.955 -3.906 -6.284
196 HB2 TYR 534 2HB TYR 534 9.763 -3.310 -7.253
197 HB3 TYR 534 1HB TYR 534 9.078 -4.916 -7.031
198 HD1 TYR 534 2HD TYR 534 8.904 -1.827 -9.114
199 HD2 TYR 534 1HD TYR 534 7.633 -5.878 -8.653
200 HE1 TYR 534 2HE TYR 534 8.049 -1.826 -11.412
201 HE2 TYR 534 1HE TYR 534 6.778 -5.870 -10.956
202 HH TYR 534 HH TYR 534 7.083 -4.684 -13.031
203 H PHE 535 H PHE 535 9.873 -2.071 -5.359
204 HA PHE 535 HA PHE 535 9.533 -3.080 -2.620
205 HB2 PHE 535 2HB PHE 535 12.120 -3.036 -2.542
206 HB3 PHE 535 1HB PHE 535 11.318 -4.398 -3.316
207 HD1 PHE 535 2HD PHE 535 11.160 -4.446 -5.822
208 HD2 PHE 535 1HD PHE 535 13.613 -1.669 -3.729
209 HE1 PHE 535 2HE PHE 535 12.445 -4.037 -7.879
210 HE2 PHE 535 1HE PHE 535 14.902 -1.253 -5.782
211 HZ PHE 535 HZ PHE 535 14.319 -2.439 -7.861
212 H GLY 536 H GLY 536 9.226 -0.436 -4.307
213 HA2 GLY 536 2HA GLY 536 10.992 1.470 -3.234
214 HA3 GLY 536 1HA GLY 536 9.397 1.815 -3.891
215 HA PRO 537 HA PRO 537 8.383 2.755 0.372
216 HB2 PRO 537 2HB PRO 537 5.895 3.578 0.028
217 HB3 PRO 537 1HB PRO 537 7.206 4.482 -0.753
218 HG2 PRO 537 2HG PRO 537 5.470 2.323 -1.919
219 HG3 PRO 537 1HG PRO 537 5.769 3.952 -2.566
220 HD2 PRO 537 2HD PRO 537 7.131 1.761 -3.397
221 HD3 PRO 537 1HD PRO 537 7.879 3.374 -3.331
222 H ALA 538 H ALA 538 8.137 0.050 -0.890
223 HA ALA 538 HA ALA 538 6.011 -1.044 0.775
224 HB1 ALA 538 1HB ALA 538 6.969 -2.307 -1.780
225 HB2 ALA 538 2HB ALA 538 5.671 -1.112 -1.769
226 HB3 ALA 538 3HB ALA 538 5.482 -2.626 -0.883
227 H ALA 539 H ALA 539 9.264 -0.963 -0.263
228 HA ALA 539 HA ALA 539 9.999 -2.835 1.791
229 HB1 ALA 539 1HB ALA 539 10.731 -3.412 -1.061
230 HB2 ALA 539 2HB ALA 539 9.578 -4.315 -0.080
231 HB3 ALA 539 3HB ALA 539 11.287 -4.307 0.352
232 H GLU 540 H GLU 540 10.557 0.057 0.549
233 HA GLU 540 HA GLU 540 13.421 0.064 0.281
234 HB2 GLU 540 2HB GLU 540 13.229 2.498 0.338
235 HB3 GLU 540 1HB GLU 540 12.066 1.808 -0.782
236 HG2 GLU 540 2HG GLU 540 10.486 2.971 0.238
237 HG3 GLU 540 1HG GLU 540 10.733 1.964 1.663
238 H GLY 541 H GLY 541 13.290 -1.312 2.376
239 HA2 GLY 541 2HA GLY 541 14.440 -1.218 4.467
240 HA3 GLY 541 1HA GLY 541 13.935 0.465 4.624
241 H ILE 542 H ILE 542 11.259 -0.587 3.503
242 HA ILE 542 HA ILE 542 9.861 -0.718 5.931
243 HB ILE 542 HB ILE 542 9.229 -0.803 3.063
244 HG12 ILE 542 2HG1 ILE 542 7.544 0.212 5.335
245 HG13 ILE 542 1HG1 ILE 542 8.975 1.080 4.793
246 HG21 ILE 542 1HG2 ILE 542 8.170 -2.861 3.456
247 HG22 ILE 542 2HG2 ILE 542 6.884 -1.650 3.541
248 HG23 ILE 542 3HG2 ILE 542 7.546 -2.341 5.023
249 HD11 ILE 542 3HD1 ILE 542 7.511 2.119 3.461
250 HD12 ILE 542 1HD1 ILE 542 6.345 0.800 3.535
251 HD13 ILE 542 2HD1 ILE 542 7.726 0.694 2.446
252 H TYR 543 H TYR 543 10.734 -3.203 3.546
253 HA TYR 543 HA TYR 543 9.439 -5.399 4.448
254 HB2 TYR 543 2HB TYR 543 11.207 -6.767 3.537
255 HB3 TYR 543 1HB TYR 543 10.961 -5.365 2.501
256 HD1 TYR 543 1HD TYR 543 12.497 -3.299 3.126
257 HD2 TYR 543 2HD TYR 543 13.366 -7.347 4.060
258 HE1 TYR 543 1HE TYR 543 14.890 -2.736 3.292
259 HE2 TYR 543 2HE TYR 543 15.762 -6.805 4.234
260 HH TYR 543 HH TYR 543 17.272 -4.769 3.101
261 H ALA 544 H ALA 544 12.052 -3.772 6.064
262 HA ALA 544 HA ALA 544 12.973 -5.731 7.803
263 HB1 ALA 544 1HB ALA 544 13.966 -3.502 7.597
264 HB2 ALA 544 2HB ALA 544 13.620 -3.910 9.278
265 HB3 ALA 544 3HB ALA 544 12.558 -2.809 8.401
266 H GLU 545 H GLU 545 9.895 -4.303 7.619
267 HA GLU 545 HA GLU 545 8.934 -4.302 10.207
268 HB2 GLU 545 2HB GLU 545 6.709 -4.873 9.040
269 HB3 GLU 545 1HB GLU 545 7.528 -3.399 8.540
270 HG2 GLU 545 2HG GLU 545 7.057 -4.224 6.494
271 HG3 GLU 545 1HG GLU 545 8.582 -5.065 6.751
272 H GLY 546 H GLY 546 9.098 -6.881 7.830
273 HA2 GLY 546 2HA GLY 546 8.882 -9.144 7.985
274 HA3 GLY 546 1HA GLY 546 9.725 -8.940 9.507
275 H LEU 547 H LEU 547 6.501 -7.618 8.971
276 HA LEU 547 HA LEU 547 5.314 -9.865 10.389
277 HB2 LEU 547 2HB LEU 547 4.511 -8.711 12.221
278 HB3 LEU 547 1HB LEU 547 6.140 -8.094 12.038
279 HG LEU 547 HG LEU 547 3.757 -6.630 10.926
280 HD11 LEU 547 1HD1 LEU 547 3.275 -5.661 12.902
281 HD12 LEU 547 2HD1 LEU 547 4.945 -5.723 13.464
282 HD13 LEU 547 3HD1 LEU 547 3.930 -7.163 13.551
283 HD21 LEU 547 3HD2 LEU 547 6.220 -5.313 11.897
284 HD22 LEU 547 1HD2 LEU 547 5.190 -4.924 10.518
285 HD23 LEU 547 2HD2 LEU 547 6.341 -6.255 10.411
286 H MET 548 H MET 548 4.734 -6.724 8.838
287 HA MET 548 HA MET 548 2.765 -7.691 7.115
288 HB2 MET 548 2HB MET 548 1.808 -7.118 9.776
289 HB3 MET 548 1HB MET 548 1.029 -6.065 8.604
290 HG2 MET 548 2HG MET 548 0.193 -7.906 7.374
291 HG3 MET 548 1HG MET 548 1.188 -9.043 8.278
292 HE1 MET 548 3HE MET 548 -0.384 -9.113 11.752
293 HE2 MET 548 1HE MET 548 0.376 -7.548 11.466
294 HE3 MET 548 2HE MET 548 1.131 -9.020 10.856
295 H HIS 549 H HIS 549 4.203 -5.003 8.799
296 HA HIS 549 HA HIS 549 3.094 -2.829 7.520
297 HB2 HIS 549 2HB HIS 549 5.475 -3.370 9.056
298 HB3 HIS 549 1HB HIS 549 5.810 -2.198 7.785
299 HD1 HIS 549 1HD HIS 549 2.401 -2.217 9.228
300 HD2 HIS 549 2HD HIS 549 5.980 -0.183 9.786
301 HE1 HIS 549 1HE HIS 549 1.823 -0.220 10.626
302 HE2 HIS 549 2HE HIS 549 4.022 0.931 11.061
303 H ASN 550 H ASN 550 4.883 -5.304 6.017
304 HA ASN 550 HA ASN 550 6.094 -3.750 3.955
305 HB2 ASN 550 2HB ASN 550 6.410 -5.974 2.840
306 HB3 ASN 550 1HB ASN 550 7.058 -5.882 4.474
307 HD21 ASN 550 1HD2 ASN 550 6.451 -8.268 3.138
308 HD22 ASN 550 2HD2 ASN 550 5.165 -9.052 3.985
309 H GLN 551 H GLN 551 2.963 -4.009 4.543
310 HA GLN 551 HA GLN 551 1.634 -4.959 2.334
311 HB2 GLN 551 2HB GLN 551 -0.090 -3.199 2.914
312 HB3 GLN 551 1HB GLN 551 0.396 -4.257 4.232
313 HG2 GLN 551 2HG GLN 551 2.110 -1.978 4.187
314 HG3 GLN 551 1HG GLN 551 0.434 -1.442 4.148
315 HE21 GLN 551 1HE2 GLN 551 1.431 -0.616 6.283
316 HE22 GLN 551 2HE2 GLN 551 1.141 -1.612 7.665
317 H ASP 552 H ASP 552 0.238 -3.191 0.990
318 HA ASP 552 HA ASP 552 2.141 -1.358 -0.306
319 HB2 ASP 552 2HB ASP 552 1.021 -3.705 -1.437
320 HB3 ASP 552 1HB ASP 552 0.235 -2.335 -2.216
321 H GLY 553 H GLY 553 -1.325 -2.237 -0.479
322 HA2 GLY 553 2HA GLY 553 -2.951 -0.655 0.464
323 HA3 GLY 553 1HA GLY 553 -1.929 0.637 -0.143
324 H LEU 554 H LEU 554 -3.013 -2.330 -1.769
325 HA LEU 554 HA LEU 554 -3.434 -1.341 -4.241
326 HB2 LEU 554 2HB LEU 554 -5.488 -3.043 -4.244
327 HB3 LEU 554 1HB LEU 554 -3.815 -3.557 -4.320
328 HG LEU 554 HG LEU 554 -4.547 -3.345 -1.573
329 HD11 LEU 554 1HD1 LEU 554 -6.554 -4.286 -1.327
330 HD12 LEU 554 2HD1 LEU 554 -6.267 -5.450 -2.622
331 HD13 LEU 554 3HD1 LEU 554 -6.826 -3.821 -3.006
332 HD21 LEU 554 3HD2 LEU 554 -2.804 -4.781 -2.621
333 HD22 LEU 554 1HD2 LEU 554 -4.096 -5.808 -3.242
334 HD23 LEU 554 2HD2 LEU 554 -3.866 -5.635 -1.501
335 H ILE 555 H ILE 555 -6.387 -1.973 -2.393
336 HA ILE 555 HA ILE 555 -8.342 -0.822 -2.203
337 HB ILE 555 HB ILE 555 -6.820 1.692 -2.836
338 HG12 ILE 555 2HG1 ILE 555 -5.463 0.825 -1.153
339 HG13 ILE 555 1HG1 ILE 555 -6.617 1.806 -0.256
340 HG21 ILE 555 1HG2 ILE 555 -8.484 2.607 -1.155
341 HG22 ILE 555 2HG2 ILE 555 -9.326 1.065 -1.310
342 HG23 ILE 555 3HG2 ILE 555 -9.131 2.109 -2.719
343 HD11 ILE 555 3HD1 ILE 555 -6.500 -1.169 -0.515
344 HD12 ILE 555 1HD1 ILE 555 -7.943 -0.332 0.051
345 HD13 ILE 555 2HD1 ILE 555 -6.431 -0.183 0.946
346 H CYS 556 H CYS 556 -9.918 -0.880 -3.656
347 HA CYS 556 HA CYS 556 -9.436 -0.728 -6.441
348 HB2 CYS 556 2HB CYS 556 -12.068 -0.598 -4.956
349 HB3 CYS 556 1HB CYS 556 -11.871 -0.928 -6.675
350 H GLY 557 H GLY 557 -10.521 1.584 -4.053
351 HA2 GLY 557 2HA GLY 557 -10.070 3.933 -4.462
352 HA3 GLY 557 1HA GLY 557 -10.473 3.657 -6.151
353 H LEU 558 H LEU 558 -12.805 2.070 -5.589
354 HA LEU 558 HA LEU 558 -14.682 3.352 -3.953
355 HB2 LEU 558 2HB LEU 558 -15.825 4.815 -5.389
356 HB3 LEU 558 1HB LEU 558 -14.129 5.189 -5.635
357 HG LEU 558 HG LEU 558 -15.207 3.151 -7.450
358 HD11 LEU 558 1HD1 LEU 558 -16.892 5.253 -7.011
359 HD12 LEU 558 2HD1 LEU 558 -16.812 4.290 -8.487
360 HD13 LEU 558 3HD1 LEU 558 -15.932 5.817 -8.380
361 HD21 LEU 558 3HD2 LEU 558 -13.992 4.689 -9.077
362 HD22 LEU 558 1HD2 LEU 558 -13.027 3.845 -7.864
363 HD23 LEU 558 2HD2 LEU 558 -13.427 5.551 -7.645
364 H ARG 559 H ARG 559 -13.814 0.774 -5.441
365 HA ARG 559 HA ARG 559 -14.737 -1.080 -6.361
366 HB2 ARG 559 2HB ARG 559 -16.795 -1.845 -5.424
367 HB3 ARG 559 1HB ARG 559 -15.901 -1.017 -4.157
368 HG2 ARG 559 2HG ARG 559 -17.837 0.620 -5.663
369 HG3 ARG 559 1HG ARG 559 -18.512 -0.651 -4.650
370 HD2 ARG 559 2HD ARG 559 -17.176 0.234 -2.748
371 HD3 ARG 559 1HD ARG 559 -16.673 1.572 -3.776
372 HE ARG 559 HE ARG 559 -18.750 2.521 -3.529
373 HH11 ARG 559 1HH1 ARG 559 -18.819 -0.752 -2.312
374 HH12 ARG 559 2HH1 ARG 559 -20.377 -0.577 -1.575
375 HH21 ARG 559 1HH2 ARG 559 -20.799 2.750 -2.561
376 HH22 ARG 559 2HH2 ARG 559 -21.500 1.410 -1.717
377 H GLN 560 H GLN 560 -16.705 -1.940 -7.631
378 HA GLN 560 HA GLN 560 -18.388 -0.233 -9.033
379 HB2 GLN 560 2HB GLN 560 -16.344 0.673 -10.020
380 HB3 GLN 560 1HB GLN 560 -15.855 -0.938 -10.524
381 HG2 GLN 560 2HG GLN 560 -17.790 -1.066 -12.002
382 HG3 GLN 560 1HG GLN 560 -18.280 0.551 -11.496
383 HE21 GLN 560 1HE2 GLN 560 -17.542 2.223 -12.613
384 HE22 GLN 560 2HE2 GLN 560 -16.262 2.175 -13.772
Start of MODEL 9
1 H1 ALA 507 1HT ALA 507 -19.522 3.668 -1.858
2 H2 ALA 507 2HT ALA 507 -21.116 3.369 -1.296
3 H3 ALA 507 3HT ALA 507 -20.373 2.280 -2.395
4 HA ALA 507 HA ALA 507 -19.201 2.853 0.221
5 HB1 ALA 507 2HB ALA 507 -21.490 1.034 -0.432
6 HB2 ALA 507 3HB ALA 507 -21.316 2.167 0.907
7 HB3 ALA 507 1HB ALA 507 -20.384 0.669 0.892
8 H GLN 508 H GLN 508 -17.372 1.730 0.499
9 HA GLN 508 HA GLN 508 -16.305 0.215 -1.681
10 HB2 GLN 508 2HB GLN 508 -14.332 -0.058 -0.235
11 HB3 GLN 508 1HB GLN 508 -14.851 1.619 -0.324
12 HG2 GLN 508 2HG GLN 508 -15.659 1.617 1.851
13 HG3 GLN 508 1HG GLN 508 -15.754 -0.142 1.917
14 HE21 GLN 508 1HE2 GLN 508 -14.371 1.977 3.572
15 HE22 GLN 508 2HE2 GLN 508 -12.743 1.414 3.704
16 HA PRO 509 HA PRO 509 -17.306 -3.813 -0.115
17 HB2 PRO 509 2HB PRO 509 -15.601 -5.295 -1.577
18 HB3 PRO 509 1HB PRO 509 -16.925 -4.392 -2.318
19 HG2 PRO 509 2HG PRO 509 -14.035 -3.874 -2.408
20 HG3 PRO 509 1HG PRO 509 -15.314 -3.289 -3.482
21 HD2 PRO 509 2HD PRO 509 -14.052 -1.929 -1.254
22 HD3 PRO 509 1HD PRO 509 -15.223 -1.288 -2.423
23 H LYS 510 H LYS 510 -15.003 -2.258 1.257
24 HA LYS 510 HA LYS 510 -13.392 -2.614 2.832
25 HB2 LYS 510 2HB LYS 510 -15.459 -4.697 3.256
26 HB3 LYS 510 1HB LYS 510 -13.950 -4.881 4.138
27 HG2 LYS 510 2HG LYS 510 -14.576 -2.235 4.536
28 HG3 LYS 510 1HG LYS 510 -16.152 -3.029 4.562
29 HD2 LYS 510 2HD LYS 510 -15.209 -4.661 6.209
30 HD3 LYS 510 1HD LYS 510 -13.752 -3.668 6.272
31 HE2 LYS 510 2HE LYS 510 -16.545 -2.775 6.979
32 HE3 LYS 510 1HE LYS 510 -15.256 -3.147 8.122
33 HZ1 LYS 510 3HZ LYS 510 -15.794 -0.713 6.881
34 HZ2 LYS 510 1HZ LYS 510 -14.316 -1.259 6.263
35 HZ3 LYS 510 2HZ LYS 510 -14.522 -1.082 7.932
36 H CYS 511 H CYS 511 -11.925 -3.019 0.905
37 HA CYS 511 HA CYS 511 -10.724 -5.683 1.215
38 HB2 CYS 511 2HB CYS 511 -10.189 -5.632 -1.237
39 HB3 CYS 511 1HB CYS 511 -11.902 -5.797 -0.857
40 H ASN 512 H ASN 512 -10.270 -2.433 1.550
41 HA ASN 512 HA ASN 512 -7.678 -2.065 0.475
42 HB2 ASN 512 2HB ASN 512 -8.745 -0.605 2.886
43 HB3 ASN 512 1HB ASN 512 -7.627 -0.016 1.660
44 HD21 ASN 512 1HD2 ASN 512 -10.050 1.220 2.547
45 HD22 ASN 512 2HD2 ASN 512 -11.094 1.335 1.175
46 HA PRO 513 HA PRO 513 -5.358 -4.120 3.636
47 HB2 PRO 513 2HB PRO 513 -2.897 -3.418 2.956
48 HB3 PRO 513 1HB PRO 513 -3.908 -4.308 1.811
49 HG2 PRO 513 2HG PRO 513 -3.276 -1.387 1.909
50 HG3 PRO 513 1HG PRO 513 -3.364 -2.467 0.507
51 HD2 PRO 513 2HD PRO 513 -5.396 -0.776 1.387
52 HD3 PRO 513 1HD PRO 513 -5.610 -2.146 0.285
53 H ASN 514 H ASN 514 -2.928 -3.169 4.653
54 HA ASN 514 HA ASN 514 -3.638 -1.863 6.982
55 HB2 ASN 514 2HB ASN 514 -1.140 -2.519 5.566
56 HB3 ASN 514 1HB ASN 514 -1.016 -1.216 6.739
57 HD21 ASN 514 1HD2 ASN 514 -1.897 -1.691 8.915
58 HD22 ASN 514 2HD2 ASN 514 -1.678 -3.285 9.545
59 H LEU 515 H LEU 515 -1.506 -0.468 4.558
60 HA LEU 515 HA LEU 515 -0.927 1.687 4.125
61 HB2 LEU 515 2HB LEU 515 -2.669 2.868 2.992
62 HB3 LEU 515 1HB LEU 515 -2.803 1.152 2.647
63 HG LEU 515 HG LEU 515 -4.485 1.432 4.784
64 HD11 LEU 515 1HD1 LEU 515 -5.304 3.483 4.985
65 HD12 LEU 515 2HD1 LEU 515 -5.647 3.562 3.257
66 HD13 LEU 515 3HD1 LEU 515 -4.063 4.044 3.864
67 HD21 LEU 515 3HD2 LEU 515 -4.778 1.218 1.854
68 HD22 LEU 515 1HD2 LEU 515 -6.225 1.624 2.777
69 HD23 LEU 515 2HD2 LEU 515 -5.335 0.143 3.135
70 H HIS 516 H HIS 516 -0.968 1.344 6.838
71 HA HIS 516 HA HIS 516 -1.906 3.976 7.741
72 HB2 HIS 516 2HB HIS 516 -2.868 1.467 8.641
73 HB3 HIS 516 1HB HIS 516 -1.906 2.151 9.947
74 HD1 HIS 516 1HD HIS 516 -3.867 4.366 7.649
75 HD2 HIS 516 2HD HIS 516 -4.150 2.781 11.479
76 HE1 HIS 516 1HE HIS 516 -5.762 5.601 8.748
77 HE2 HIS 516 2HE HIS 516 -5.856 4.686 11.094
78 H TYR 517 H TYR 517 0.711 1.907 7.353
79 HA TYR 517 HA TYR 517 2.169 2.604 9.710
80 HB2 TYR 517 2HB TYR 517 4.009 1.422 8.770
81 HB3 TYR 517 1HB TYR 517 2.567 0.533 8.306
82 HD1 TYR 517 1HD TYR 517 4.575 3.377 6.895
83 HD2 TYR 517 2HD TYR 517 2.643 -0.347 6.173
84 HE1 TYR 517 1HE TYR 517 5.259 3.485 4.550
85 HE2 TYR 517 2HE TYR 517 3.326 -0.245 3.820
86 HH TYR 517 HH TYR 517 3.971 1.454 2.164
87 H TRP 518 H TRP 518 1.629 4.103 6.660
88 HA TRP 518 HA TRP 518 3.792 6.008 7.118
89 HB2 TRP 518 2HB TRP 518 3.322 4.685 4.863
90 HB3 TRP 518 1HB TRP 518 2.199 6.016 4.608
91 HD1 TRP 518 HD TRP 518 3.210 7.989 3.381
92 HE1 TRP 518 1HE TRP 518 5.571 8.958 3.041
93 HE3 TRP 518 3HE TRP 518 5.840 4.758 6.334
94 HZ2 TRP 518 2HZ TRP 518 8.202 8.420 3.913
95 HZ3 TRP 518 3HZ TRP 518 8.275 5.051 6.531
96 HH2 TRP 518 HH TRP 518 9.431 6.846 5.343
97 H THR 519 H THR 519 3.402 8.011 7.556
98 HA THR 519 HA THR 519 1.550 9.217 8.852
99 HB THR 519 HB THR 519 3.303 10.570 8.078
100 HG1 THR 519 1HG THR 519 2.146 12.307 7.909
101 HG21 THR 519 3HG2 THR 519 3.037 9.330 5.654
102 HG22 THR 519 1HG2 THR 519 4.091 10.700 6.005
103 HG23 THR 519 2HG2 THR 519 2.492 10.974 5.315
104 H THR 520 H THR 520 1.108 9.037 5.303
105 HA THR 520 HA THR 520 -1.593 8.343 5.407
106 HB THR 520 HB THR 520 -1.602 10.756 6.373
107 HG1 THR 520 1HG THR 520 -3.529 9.857 5.897
108 HG21 THR 520 3HG2 THR 520 -1.466 11.397 3.434
109 HG22 THR 520 1HG2 THR 520 -0.268 11.844 4.650
110 HG23 THR 520 2HG2 THR 520 -1.895 12.519 4.728
111 H GLN 521 H GLN 521 0.660 10.410 3.582
112 HA GLN 521 HA GLN 521 -0.368 10.220 1.066
113 HB2 GLN 521 2HB GLN 521 1.950 10.411 0.212
114 HB3 GLN 521 1HB GLN 521 1.580 11.561 1.490
115 HG2 GLN 521 2HG GLN 521 2.702 10.028 3.097
116 HG3 GLN 521 1HG GLN 521 3.186 9.031 1.726
117 HE21 GLN 521 1HE2 GLN 521 3.609 12.086 3.343
118 HE22 GLN 521 2HE2 GLN 521 5.073 12.535 2.543
119 H ASP 522 H ASP 522 -0.019 8.899 -0.738
120 HA ASP 522 HA ASP 522 -0.414 6.201 -0.376
121 HB2 ASP 522 2HB ASP 522 0.597 7.779 -2.726
122 HB3 ASP 522 1HB ASP 522 0.408 6.031 -2.820
123 H GLU 523 H GLU 523 0.979 5.143 0.951
124 HA GLU 523 HA GLU 523 3.840 5.249 0.435
125 HB2 GLU 523 2HB GLU 523 4.016 3.828 2.444
126 HB3 GLU 523 1HB GLU 523 3.149 5.325 2.742
127 HG2 GLU 523 2HG GLU 523 1.562 2.922 2.045
128 HG3 GLU 523 1HG GLU 523 2.290 2.995 3.648
129 H GLY 524 H GLY 524 3.117 4.289 -1.742
130 HA2 GLY 524 2HA GLY 524 3.997 2.338 -2.888
131 HA3 GLY 524 1HA GLY 524 3.391 1.360 -1.556
132 H ALA 525 H ALA 525 1.263 3.827 -2.303
133 HA ALA 525 HA ALA 525 -0.735 2.042 -3.208
134 HB1 ALA 525 1HB ALA 525 -0.720 4.533 -2.073
135 HB2 ALA 525 2HB ALA 525 -2.139 3.714 -2.724
136 HB3 ALA 525 3HB ALA 525 -1.253 4.870 -3.719
137 H ALA 526 H ALA 526 1.039 1.444 -5.018
138 HA ALA 526 HA ALA 526 1.548 1.315 -7.218
139 HB1 ALA 526 1HB ALA 526 -0.727 0.617 -7.436
140 HB2 ALA 526 2HB ALA 526 -0.354 1.690 -8.784
141 HB3 ALA 526 3HB ALA 526 -1.294 2.287 -7.416
142 H ILE 527 H ILE 527 3.157 2.863 -7.189
143 HA ILE 527 HA ILE 527 2.935 4.914 -9.056
144 HB ILE 527 HB ILE 527 1.653 6.051 -7.396
145 HG12 ILE 527 2HG1 ILE 527 4.385 7.307 -7.225
146 HG13 ILE 527 1HG1 ILE 527 3.483 7.276 -8.737
147 HG21 ILE 527 1HG2 ILE 527 2.729 4.665 -5.546
148 HG22 ILE 527 2HG2 ILE 527 2.229 6.318 -5.174
149 HG23 ILE 527 3HG2 ILE 527 3.930 5.957 -5.476
150 HD11 ILE 527 3HD1 ILE 527 2.122 8.327 -6.321
151 HD12 ILE 527 1HD1 ILE 527 1.956 8.797 -8.013
152 HD13 ILE 527 2HD1 ILE 527 3.363 9.320 -7.086
153 H GLY 528 H GLY 528 4.574 4.077 -6.016
154 HA2 GLY 528 2HA GLY 528 6.788 3.770 -5.511
155 HA3 GLY 528 1HA GLY 528 7.002 3.373 -7.203
156 H ALA 529 H ALA 529 5.982 6.272 -7.769
157 HA ALA 529 HA ALA 529 7.052 8.164 -8.462
158 HB1 ALA 529 1HB ALA 529 6.631 8.279 -5.844
159 HB2 ALA 529 2HB ALA 529 7.444 9.575 -6.724
160 HB3 ALA 529 3HB ALA 529 8.392 8.388 -5.828
161 H ALA 530 H ALA 530 8.522 5.752 -9.051
162 HA ALA 530 HA ALA 530 10.844 6.622 -10.133
163 HB1 ALA 530 1HB ALA 530 12.286 5.392 -8.088
164 HB2 ALA 530 2HB ALA 530 11.145 6.445 -7.253
165 HB3 ALA 530 3HB ALA 530 12.244 7.117 -8.457
166 H TRP 531 H TRP 531 9.078 4.817 -10.897
167 HA TRP 531 HA TRP 531 8.557 2.570 -11.205
168 HB2 TRP 531 2HB TRP 531 10.604 1.517 -12.430
169 HB3 TRP 531 1HB TRP 531 9.719 2.849 -13.170
170 HD1 TRP 531 HD TRP 531 12.652 2.807 -10.624
171 HE1 TRP 531 1HE TRP 531 14.489 4.379 -11.509
172 HE3 TRP 531 3HE TRP 531 10.449 4.237 -15.007
173 HZ2 TRP 531 2HZ TRP 531 14.943 6.009 -13.769
174 HZ3 TRP 531 3HZ TRP 531 11.649 5.805 -16.475
175 HH2 TRP 531 HH TRP 531 13.850 6.672 -15.867
176 H ILE 532 H ILE 532 9.105 2.851 -8.637
177 HA ILE 532 HA ILE 532 10.484 0.354 -8.034
178 HB ILE 532 HB ILE 532 11.926 2.318 -7.643
179 HG12 ILE 532 2HG1 ILE 532 11.081 0.948 -5.077
180 HG13 ILE 532 1HG1 ILE 532 12.128 0.225 -6.288
181 HG21 ILE 532 1HG2 ILE 532 10.284 3.136 -5.317
182 HG22 ILE 532 2HG2 ILE 532 9.713 3.593 -6.928
183 HG23 ILE 532 3HG2 ILE 532 11.317 4.098 -6.378
184 HD11 ILE 532 3HD1 ILE 532 13.845 1.778 -5.860
185 HD12 ILE 532 1HD1 ILE 532 13.266 1.228 -4.285
186 HD13 ILE 532 2HD1 ILE 532 12.776 2.807 -4.905
187 HA PRO 533 HA PRO 533 6.426 1.491 -5.616
188 HB2 PRO 533 2HB PRO 533 4.513 0.373 -7.233
189 HB3 PRO 533 1HB PRO 533 4.906 2.093 -7.221
190 HG2 PRO 533 2HG PRO 533 5.783 -0.033 -9.117
191 HG3 PRO 533 1HG PRO 533 5.327 1.646 -9.446
192 HD2 PRO 533 2HD PRO 533 7.892 0.821 -9.366
193 HD3 PRO 533 1HD PRO 533 7.390 2.454 -8.881
194 H TYR 534 H TYR 534 7.773 -1.048 -7.430
195 HA TYR 534 HA TYR 534 6.433 -3.303 -6.530
196 HB2 TYR 534 2HB TYR 534 9.350 -2.962 -7.270
197 HB3 TYR 534 1HB TYR 534 8.501 -4.501 -7.170
198 HD1 TYR 534 1HD TYR 534 8.761 -1.321 -9.114
199 HD2 TYR 534 2HD TYR 534 7.096 -5.253 -8.927
200 HE1 TYR 534 1HE TYR 534 8.067 -1.146 -11.459
201 HE2 TYR 534 2HE TYR 534 6.405 -5.070 -11.276
202 HH TYR 534 HH TYR 534 6.938 -3.836 -13.264
203 H PHE 535 H PHE 535 9.516 -1.961 -5.324
204 HA PHE 535 HA PHE 535 8.812 -2.964 -2.653
205 HB2 PHE 535 2HB PHE 535 11.356 -3.364 -2.397
206 HB3 PHE 535 1HB PHE 535 10.397 -4.551 -3.275
207 HD1 PHE 535 1HD PHE 535 12.232 -1.381 -4.014
208 HD2 PHE 535 2HD PHE 535 11.327 -5.367 -5.198
209 HE1 PHE 535 1HE PHE 535 13.719 -1.138 -5.960
210 HE2 PHE 535 2HE PHE 535 12.813 -5.131 -7.144
211 HZ PHE 535 HZ PHE 535 14.013 -3.015 -7.526
212 H GLY 536 H GLY 536 9.123 -0.272 -4.288
213 HA2 GLY 536 2HA GLY 536 11.086 1.272 -3.000
214 HA3 GLY 536 1HA GLY 536 9.647 1.904 -3.790
215 HA PRO 537 HA PRO 537 8.355 2.947 0.369
216 HB2 PRO 537 2HB PRO 537 6.072 4.137 -0.199
217 HB3 PRO 537 1HB PRO 537 7.568 4.819 -0.870
218 HG2 PRO 537 2HG PRO 537 5.628 2.924 -2.168
219 HG3 PRO 537 1HG PRO 537 6.221 4.477 -2.798
220 HD2 PRO 537 2HD PRO 537 7.300 2.083 -3.482
221 HD3 PRO 537 1HD PRO 537 8.269 3.572 -3.389
222 H ALA 538 H ALA 538 7.917 0.290 -0.803
223 HA ALA 538 HA ALA 538 5.506 -0.482 0.632
224 HB1 ALA 538 1HB ALA 538 4.962 -2.090 -1.091
225 HB2 ALA 538 2HB ALA 538 6.413 -1.659 -1.999
226 HB3 ALA 538 3HB ALA 538 5.100 -0.492 -1.826
227 H ALA 539 H ALA 539 8.763 -0.966 -0.352
228 HA ALA 539 HA ALA 539 9.108 -2.975 1.712
229 HB1 ALA 539 1HB ALA 539 10.515 -3.829 -0.666
230 HB2 ALA 539 2HB ALA 539 8.767 -3.803 -0.889
231 HB3 ALA 539 3HB ALA 539 9.472 -4.739 0.427
232 H GLU 540 H GLU 540 10.101 -0.131 0.766
233 HA GLU 540 HA GLU 540 12.955 -0.500 0.571
234 HB2 GLU 540 2HB GLU 540 13.084 1.938 0.879
235 HB3 GLU 540 1HB GLU 540 11.963 1.497 -0.396
236 HG2 GLU 540 2HG GLU 540 10.142 1.703 1.387
237 HG3 GLU 540 1HG GLU 540 11.364 2.531 2.349
238 H GLY 541 H GLY 541 12.500 -2.004 2.540
239 HA2 GLY 541 2HA GLY 541 13.601 -2.226 4.661
240 HA3 GLY 541 1HA GLY 541 13.279 -0.517 4.955
241 H ILE 542 H ILE 542 10.546 -1.103 3.679
242 HA ILE 542 HA ILE 542 9.046 -1.266 6.019
243 HB ILE 542 HB ILE 542 8.525 -1.165 3.117
244 HG12 ILE 542 2HG1 ILE 542 6.692 -0.032 5.144
245 HG13 ILE 542 1HG1 ILE 542 8.347 0.554 5.180
246 HG21 ILE 542 1HG2 ILE 542 7.224 -3.105 3.413
247 HG22 ILE 542 2HG2 ILE 542 6.087 -1.754 3.477
248 HG23 ILE 542 3HG2 ILE 542 6.594 -2.548 4.967
249 HD11 ILE 542 3HD1 ILE 542 6.630 0.554 2.717
250 HD12 ILE 542 1HD1 ILE 542 8.200 1.325 2.935
251 HD13 ILE 542 2HD1 ILE 542 6.794 1.926 3.813
252 H TYR 543 H TYR 543 9.858 -3.732 3.598
253 HA TYR 543 HA TYR 543 8.297 -5.830 4.326
254 HB2 TYR 543 2HB TYR 543 10.076 -7.332 3.562
255 HB3 TYR 543 1HB TYR 543 9.887 -5.952 2.482
256 HD1 TYR 543 2HD TYR 543 11.468 -3.958 2.905
257 HD2 TYR 543 1HD TYR 543 12.176 -7.876 4.366
258 HE1 TYR 543 2HE TYR 543 13.864 -3.426 3.130
259 HE2 TYR 543 1HE TYR 543 14.574 -7.369 4.604
260 HH TYR 543 HH TYR 543 16.105 -5.013 3.143
261 H ALA 544 H ALA 544 10.924 -4.479 6.152
262 HA ALA 544 HA ALA 544 11.554 -6.556 7.889
263 HB1 ALA 544 1HB ALA 544 12.769 -4.430 7.777
264 HB2 ALA 544 2HB ALA 544 12.301 -4.835 9.430
265 HB3 ALA 544 3HB ALA 544 11.395 -3.619 8.528
266 H GLU 545 H GLU 545 8.635 -4.878 7.546
267 HA GLU 545 HA GLU 545 7.528 -4.772 10.072
268 HB2 GLU 545 2HB GLU 545 5.338 -5.179 8.774
269 HB3 GLU 545 1HB GLU 545 6.298 -3.778 8.322
270 HG2 GLU 545 2HG GLU 545 5.888 -4.582 6.253
271 HG3 GLU 545 1HG GLU 545 7.327 -5.531 6.606
272 H GLY 546 H GLY 546 7.647 -7.389 7.735
273 HA2 GLY 546 2HA GLY 546 7.254 -9.626 7.893
274 HA3 GLY 546 1HA GLY 546 7.997 -9.464 9.471
275 H LEU 547 H LEU 547 4.912 -7.949 8.655
276 HA LEU 547 HA LEU 547 3.480 -10.080 10.023
277 HB2 LEU 547 2HB LEU 547 2.587 -8.819 11.747
278 HB3 LEU 547 1HB LEU 547 4.266 -8.323 11.700
279 HG LEU 547 HG LEU 547 2.119 -6.726 10.325
280 HD11 LEU 547 1HD1 LEU 547 3.109 -5.933 13.006
281 HD12 LEU 547 2HD1 LEU 547 1.875 -7.191 12.918
282 HD13 LEU 547 3HD1 LEU 547 1.565 -5.599 12.222
283 HD21 LEU 547 3HD2 LEU 547 4.761 -6.548 10.086
284 HD22 LEU 547 1HD2 LEU 547 4.558 -5.572 11.540
285 HD23 LEU 547 2HD2 LEU 547 3.710 -5.132 10.057
286 H MET 548 H MET 548 3.238 -6.964 8.340
287 HA MET 548 HA MET 548 1.442 -7.803 6.423
288 HB2 MET 548 2HB MET 548 0.164 -7.258 8.987
289 HB3 MET 548 1HB MET 548 -0.520 -6.308 7.677
290 HG2 MET 548 2HG MET 548 -0.209 -8.956 6.737
291 HG3 MET 548 1HG MET 548 -0.964 -9.035 8.327
292 HE1 MET 548 3HE MET 548 -2.647 -7.869 4.377
293 HE2 MET 548 1HE MET 548 -0.958 -8.106 4.825
294 HE3 MET 548 2HE MET 548 -1.691 -6.509 4.966
295 H HIS 549 H HIS 549 2.882 -5.274 8.250
296 HA HIS 549 HA HIS 549 1.842 -3.000 7.030
297 HB2 HIS 549 2HB HIS 549 4.180 -3.669 8.637
298 HB3 HIS 549 1HB HIS 549 4.486 -2.352 7.511
299 HD1 HIS 549 1HD HIS 549 1.014 -2.315 8.501
300 HD2 HIS 549 2HD HIS 549 4.586 -0.925 10.107
301 HE1 HIS 549 1HE HIS 549 0.357 -0.599 10.204
302 HE2 HIS 549 2HE HIS 549 2.534 0.288 11.114
303 H ASN 550 H ASN 550 3.661 -5.462 5.558
304 HA ASN 550 HA ASN 550 5.105 -3.900 3.668
305 HB2 ASN 550 2HB ASN 550 5.651 -6.265 4.307
306 HB3 ASN 550 1HB ASN 550 4.247 -6.783 3.382
307 HD21 ASN 550 1HD2 ASN 550 6.273 -7.966 2.486
308 HD22 ASN 550 2HD2 ASN 550 6.976 -7.238 1.085
309 H GLN 551 H GLN 551 1.963 -3.812 3.989
310 HA GLN 551 HA GLN 551 0.639 -4.591 1.737
311 HB2 GLN 551 2HB GLN 551 -0.907 -2.753 2.166
312 HB3 GLN 551 1HB GLN 551 -0.416 -3.518 3.673
313 HG2 GLN 551 2HG GLN 551 0.006 -1.458 4.394
314 HG3 GLN 551 1HG GLN 551 1.447 -1.538 3.386
315 HE21 GLN 551 1HE2 GLN 551 1.594 0.536 2.747
316 HE22 GLN 551 2HE2 GLN 551 0.392 1.361 1.820
317 H ASP 552 H ASP 552 -0.368 -2.762 0.201
318 HA ASP 552 HA ASP 552 1.688 -1.010 -0.883
319 HB2 ASP 552 2HB ASP 552 0.545 -3.377 -2.343
320 HB3 ASP 552 1HB ASP 552 1.115 -1.962 -3.224
321 H GLY 553 H GLY 553 -1.137 -0.976 0.340
322 HA2 GLY 553 2HA GLY 553 -3.043 0.275 0.095
323 HA3 GLY 553 1HA GLY 553 -2.087 1.287 -0.975
324 H LEU 554 H LEU 554 -3.090 -2.099 -1.372
325 HA LEU 554 HA LEU 554 -3.617 -2.027 -4.034
326 HB2 LEU 554 2HB LEU 554 -5.491 -3.790 -3.399
327 HB3 LEU 554 1HB LEU 554 -3.781 -4.160 -3.326
328 HG LEU 554 HG LEU 554 -4.627 -3.069 -0.809
329 HD11 LEU 554 1HD1 LEU 554 -6.426 -5.063 -2.057
330 HD12 LEU 554 2HD1 LEU 554 -6.777 -3.791 -0.888
331 HD13 LEU 554 3HD1 LEU 554 -6.005 -5.286 -0.358
332 HD21 LEU 554 3HD2 LEU 554 -2.667 -4.387 -0.966
333 HD22 LEU 554 1HD2 LEU 554 -3.538 -5.713 -1.737
334 HD23 LEU 554 2HD2 LEU 554 -3.834 -5.332 -0.040
335 H ILE 555 H ILE 555 -6.414 -2.097 -1.830
336 HA ILE 555 HA ILE 555 -8.455 -1.100 -1.942
337 HB ILE 555 HB ILE 555 -6.762 1.009 -3.268
338 HG12 ILE 555 2HG1 ILE 555 -7.056 2.207 -1.228
339 HG13 ILE 555 1HG1 ILE 555 -8.320 1.114 -0.685
340 HG21 ILE 555 1HG2 ILE 555 -8.802 1.414 -4.333
341 HG22 ILE 555 2HG2 ILE 555 -8.827 2.494 -2.939
342 HG23 ILE 555 3HG2 ILE 555 -9.740 0.985 -2.902
343 HD11 ILE 555 3HD1 ILE 555 -5.423 0.393 -1.032
344 HD12 ILE 555 1HD1 ILE 555 -6.695 -0.655 -0.410
345 HD13 ILE 555 2HD1 ILE 555 -6.211 0.776 0.497
346 H CYS 556 H CYS 556 -10.103 -1.774 -3.130
347 HA CYS 556 HA CYS 556 -9.737 -2.617 -5.841
348 HB2 CYS 556 2HB CYS 556 -12.325 -2.409 -4.295
349 HB3 CYS 556 1HB CYS 556 -12.023 -3.387 -5.726
350 H GLY 557 H GLY 557 -11.167 0.156 -4.246
351 HA2 GLY 557 2HA GLY 557 -11.312 2.264 -5.378
352 HA3 GLY 557 1HA GLY 557 -11.518 1.392 -6.892
353 H LEU 558 H LEU 558 -13.420 -0.472 -5.662
354 HA LEU 558 HA LEU 558 -15.649 0.892 -4.644
355 HB2 LEU 558 2HB LEU 558 -17.076 0.957 -6.597
356 HB3 LEU 558 1HB LEU 558 -15.630 1.905 -6.879
357 HG LEU 558 HG LEU 558 -15.735 -0.927 -7.847
358 HD11 LEU 558 1HD1 LEU 558 -17.785 -0.029 -8.691
359 HD12 LEU 558 2HD1 LEU 558 -16.608 -0.068 -10.005
360 HD13 LEU 558 3HD1 LEU 558 -16.981 1.457 -9.199
361 HD21 LEU 558 3HD2 LEU 558 -13.969 1.324 -8.078
362 HD22 LEU 558 1HD2 LEU 558 -14.524 0.818 -9.674
363 HD23 LEU 558 2HD2 LEU 558 -13.736 -0.343 -8.606
364 H ARG 559 H ARG 559 -14.478 -1.729 -6.645
365 HA ARG 559 HA ARG 559 -14.821 -3.943 -5.325
366 HB2 ARG 559 2HB ARG 559 -17.140 -4.804 -5.742
367 HB3 ARG 559 1HB ARG 559 -17.061 -3.507 -4.558
368 HG2 ARG 559 2HG ARG 559 -17.482 -2.131 -6.875
369 HG3 ARG 559 1HG ARG 559 -18.390 -3.616 -7.158
370 HD2 ARG 559 2HD ARG 559 -19.136 -3.053 -4.622
371 HD3 ARG 559 1HD ARG 559 -18.877 -1.426 -5.248
372 HE ARG 559 HE ARG 559 -20.431 -2.961 -7.053
373 HH11 ARG 559 1HH1 ARG 559 -20.629 -1.267 -4.009
374 HH12 ARG 559 2HH1 ARG 559 -22.323 -0.941 -4.158
375 HH21 ARG 559 1HH2 ARG 559 -22.658 -2.534 -7.251
376 HH22 ARG 559 2HH2 ARG 559 -23.476 -1.661 -5.998
377 H GLN 560 H GLN 560 -14.401 -5.672 -6.640
378 HA GLN 560 HA GLN 560 -15.227 -5.609 -9.399
379 HB2 GLN 560 2HB GLN 560 -13.072 -4.242 -9.169
380 HB3 GLN 560 1HB GLN 560 -12.272 -5.776 -8.845
381 HG2 GLN 560 2HG GLN 560 -13.258 -6.583 -11.033
382 HG3 GLN 560 1HG GLN 560 -13.661 -4.896 -11.350
383 HE21 GLN 560 1HE2 GLN 560 -10.844 -6.581 -9.995
384 HE22 GLN 560 2HE2 GLN 560 -9.685 -5.848 -11.046
Start of MODEL 10
1 H1 ALA 507 1HT ALA 507 -15.473 5.329 5.258
2 H2 ALA 507 2HT ALA 507 -16.597 6.483 4.665
3 H3 ALA 507 3HT ALA 507 -15.097 6.251 3.864
4 HA ALA 507 HA ALA 507 -17.008 4.064 4.193
5 HB1 ALA 507 2HB ALA 507 -17.183 6.401 2.389
6 HB2 ALA 507 3HB ALA 507 -18.457 5.379 3.051
7 HB3 ALA 507 1HB ALA 507 -17.501 4.818 1.680
8 H GLN 508 H GLN 508 -16.115 2.249 3.477
9 HA GLN 508 HA GLN 508 -13.914 2.433 1.529
10 HB2 GLN 508 2HB GLN 508 -13.994 1.123 4.178
11 HB3 GLN 508 1HB GLN 508 -13.280 0.170 2.886
12 HG2 GLN 508 2HG GLN 508 -11.390 1.228 3.378
13 HG3 GLN 508 1HG GLN 508 -12.092 2.608 2.535
14 HE21 GLN 508 1HE2 GLN 508 -11.484 1.160 5.654
15 HE22 GLN 508 2HE2 GLN 508 -11.690 2.603 6.583
16 HA PRO 509 HA PRO 509 -16.054 -0.856 -0.520
17 HB2 PRO 509 2HB PRO 509 -14.101 -1.786 -2.109
18 HB3 PRO 509 1HB PRO 509 -14.730 -0.145 -2.273
19 HG2 PRO 509 2HG PRO 509 -12.137 -1.054 -1.215
20 HG3 PRO 509 1HG PRO 509 -12.595 0.527 -1.862
21 HD2 PRO 509 2HD PRO 509 -12.423 -0.312 0.900
22 HD3 PRO 509 1HD PRO 509 -12.782 1.303 0.257
23 H LYS 510 H LYS 510 -14.497 -1.581 2.062
24 HA LYS 510 HA LYS 510 -13.860 -3.433 3.237
25 HB2 LYS 510 2HB LYS 510 -16.354 -4.036 1.792
26 HB3 LYS 510 1HB LYS 510 -15.516 -5.434 2.450
27 HG2 LYS 510 2HG LYS 510 -15.803 -3.157 4.287
28 HG3 LYS 510 1HG LYS 510 -17.304 -3.958 3.817
29 HD2 LYS 510 2HD LYS 510 -16.504 -6.070 4.605
30 HD3 LYS 510 1HD LYS 510 -14.886 -5.417 4.869
31 HE2 LYS 510 2HE LYS 510 -15.454 -4.447 6.827
32 HE3 LYS 510 1HE LYS 510 -17.070 -4.022 6.268
33 HZ1 LYS 510 3HZ LYS 510 -16.136 -6.462 7.573
34 HZ2 LYS 510 1HZ LYS 510 -17.360 -6.623 6.415
35 HZ3 LYS 510 2HZ LYS 510 -17.594 -5.626 7.761
36 H CYS 511 H CYS 511 -12.165 -3.092 1.037
37 HA CYS 511 HA CYS 511 -11.263 -5.821 0.705
38 HB2 CYS 511 2HB CYS 511 -11.026 -5.598 -1.771
39 HB3 CYS 511 1HB CYS 511 -12.697 -5.671 -1.223
40 H ASN 512 H ASN 512 -10.208 -3.679 2.149
41 HA ASN 512 HA ASN 512 -7.889 -2.830 0.559
42 HB2 ASN 512 2HB ASN 512 -7.519 -1.140 2.299
43 HB3 ASN 512 1HB ASN 512 -9.148 -1.018 1.640
44 HD21 ASN 512 1HD2 ASN 512 -10.894 -1.492 2.921
45 HD22 ASN 512 2HD2 ASN 512 -10.771 -1.726 4.628
46 HA PRO 513 HA PRO 513 -5.389 -5.626 2.881
47 HB2 PRO 513 2HB PRO 513 -2.933 -4.661 2.345
48 HB3 PRO 513 1HB PRO 513 -3.925 -5.453 1.116
49 HG2 PRO 513 2HG PRO 513 -3.431 -2.543 1.563
50 HG3 PRO 513 1HG PRO 513 -3.569 -3.438 0.046
51 HD2 PRO 513 2HD PRO 513 -5.586 -1.932 1.175
52 HD3 PRO 513 1HD PRO 513 -5.840 -3.240 0.005
53 H ASN 514 H ASN 514 -3.146 -2.992 3.320
54 HA ASN 514 HA ASN 514 -3.918 -2.737 6.146
55 HB2 ASN 514 2HB ASN 514 -1.380 -3.671 4.971
56 HB3 ASN 514 1HB ASN 514 -1.217 -2.474 6.249
57 HD21 ASN 514 1HD2 ASN 514 -2.185 -5.698 5.446
58 HD22 ASN 514 2HD2 ASN 514 -2.359 -6.275 7.064
59 H LEU 515 H LEU 515 -1.362 -1.512 4.058
60 HA LEU 515 HA LEU 515 -0.444 0.585 3.924
61 HB2 LEU 515 2HB LEU 515 -1.827 1.993 2.578
62 HB3 LEU 515 1HB LEU 515 -2.080 0.319 2.122
63 HG LEU 515 HG LEU 515 -4.055 0.771 3.999
64 HD11 LEU 515 1HD1 LEU 515 -4.620 2.985 2.206
65 HD12 LEU 515 2HD1 LEU 515 -3.238 3.295 3.255
66 HD13 LEU 515 3HD1 LEU 515 -4.798 2.871 3.957
67 HD21 LEU 515 3HD2 LEU 515 -5.433 1.049 1.751
68 HD22 LEU 515 1HD2 LEU 515 -4.718 -0.491 2.231
69 HD23 LEU 515 2HD2 LEU 515 -3.899 0.532 1.050
70 H HIS 516 H HIS 516 -0.844 0.232 6.547
71 HA HIS 516 HA HIS 516 -2.214 2.644 7.502
72 HB2 HIS 516 2HB HIS 516 -2.483 0.137 8.424
73 HB3 HIS 516 1HB HIS 516 -1.143 0.665 9.436
74 HD1 HIS 516 1HD HIS 516 -4.005 2.890 8.386
75 HD2 HIS 516 2HD HIS 516 -2.561 0.966 11.774
76 HE1 HIS 516 1HE HIS 516 -5.384 3.767 10.296
77 HE2 HIS 516 2HE HIS 516 -4.547 2.529 12.324
78 H TYR 517 H TYR 517 0.889 1.607 6.719
79 HA TYR 517 HA TYR 517 2.271 2.911 8.873
80 HB2 TYR 517 2HB TYR 517 4.260 2.214 7.871
81 HB3 TYR 517 1HB TYR 517 3.126 0.965 7.381
82 HD1 TYR 517 2HD TYR 517 4.311 4.286 6.107
83 HD2 TYR 517 1HD TYR 517 3.306 0.248 5.194
84 HE1 TYR 517 2HE TYR 517 4.890 4.680 3.763
85 HE2 TYR 517 1HE TYR 517 3.889 0.637 2.847
86 HH TYR 517 HH TYR 517 4.087 2.516 1.276
87 H TRP 518 H TRP 518 0.961 3.877 5.827
88 HA TRP 518 HA TRP 518 2.287 6.478 6.041
89 HB2 TRP 518 2HB TRP 518 2.403 4.915 3.898
90 HB3 TRP 518 1HB TRP 518 0.851 5.675 3.565
91 HD1 TRP 518 HD TRP 518 1.022 7.793 2.176
92 HE1 TRP 518 1HE TRP 518 2.816 9.583 1.731
93 HE3 TRP 518 3HE TRP 518 4.659 6.087 5.327
94 HZ2 TRP 518 2HZ TRP 518 5.432 10.190 2.605
95 HZ3 TRP 518 3HZ TRP 518 6.780 7.328 5.467
96 HH2 TRP 518 HH TRP 518 7.156 9.338 4.132
97 H THR 519 H THR 519 1.144 8.239 6.202
98 HA THR 519 HA THR 519 -1.033 8.753 7.470
99 HB THR 519 HB THR 519 0.053 10.582 6.473
100 HG1 THR 519 1HG THR 519 -1.680 11.715 5.482
101 HG21 THR 519 3HG2 THR 519 0.322 9.097 4.223
102 HG22 THR 519 1HG2 THR 519 0.652 10.826 4.339
103 HG23 THR 519 2HG2 THR 519 -0.905 10.265 3.729
104 H THR 520 H THR 520 -1.356 7.988 3.988
105 HA THR 520 HA THR 520 -3.546 6.298 4.262
106 HB THR 520 HB THR 520 -4.538 8.581 5.024
107 HG1 THR 520 1HG THR 520 -6.178 7.321 4.775
108 HG21 THR 520 3HG2 THR 520 -4.717 8.926 2.038
109 HG22 THR 520 1HG2 THR 520 -3.793 9.942 3.145
110 HG23 THR 520 2HG2 THR 520 -5.553 9.896 3.253
111 H GLN 521 H GLN 521 -2.370 8.929 2.171
112 HA GLN 521 HA GLN 521 -3.247 8.141 -0.271
113 HB2 GLN 521 2HB GLN 521 -1.197 9.140 -1.235
114 HB3 GLN 521 1HB GLN 521 -1.957 10.155 -0.015
115 HG2 GLN 521 2HG GLN 521 -0.309 9.395 1.628
116 HG3 GLN 521 1HG GLN 521 0.456 8.402 0.388
117 HE21 GLN 521 1HE2 GLN 521 0.097 11.549 1.703
118 HE22 GLN 521 2HE2 GLN 521 1.218 12.354 0.665
119 H ASP 522 H ASP 522 -2.377 6.950 -2.013
120 HA ASP 522 HA ASP 522 -1.768 4.327 -1.496
121 HB2 ASP 522 2HB ASP 522 -0.885 4.300 -3.899
122 HB3 ASP 522 1HB ASP 522 -2.545 4.840 -3.662
123 H GLU 523 H GLU 523 -0.151 4.072 0.020
124 HA GLU 523 HA GLU 523 2.521 5.071 -0.579
125 HB2 GLU 523 2HB GLU 523 3.105 4.260 1.632
126 HB3 GLU 523 1HB GLU 523 1.660 5.253 1.704
127 HG2 GLU 523 2HG GLU 523 1.162 2.385 1.377
128 HG3 GLU 523 1HG GLU 523 1.934 2.838 2.894
129 H GLY 524 H GLY 524 2.210 3.569 -2.539
130 HA2 GLY 524 2HA GLY 524 3.811 1.856 -3.291
131 HA3 GLY 524 1HA GLY 524 3.352 0.930 -1.866
132 H ALA 525 H ALA 525 0.658 2.460 -2.983
133 HA ALA 525 HA ALA 525 -0.605 0.083 -3.837
134 HB1 ALA 525 1HB ALA 525 -1.799 2.679 -4.595
135 HB2 ALA 525 2HB ALA 525 -1.506 2.413 -2.878
136 HB3 ALA 525 3HB ALA 525 -2.522 1.291 -3.783
137 H ALA 526 H ALA 526 1.403 -0.095 -5.468
138 HA ALA 526 HA ALA 526 2.086 -0.284 -7.615
139 HB1 ALA 526 1HB ALA 526 -0.842 0.098 -8.209
140 HB2 ALA 526 2HB ALA 526 -0.040 -1.438 -7.879
141 HB3 ALA 526 3HB ALA 526 0.365 -0.526 -9.332
142 H ILE 527 H ILE 527 3.268 1.637 -7.429
143 HA ILE 527 HA ILE 527 2.771 3.506 -9.471
144 HB ILE 527 HB ILE 527 1.182 4.419 -7.969
145 HG12 ILE 527 2HG1 ILE 527 3.559 6.201 -7.521
146 HG13 ILE 527 1HG1 ILE 527 2.938 5.943 -9.149
147 HG21 ILE 527 1HG2 ILE 527 3.204 4.833 -5.831
148 HG22 ILE 527 2HG2 ILE 527 2.385 3.277 -5.994
149 HG23 ILE 527 3HG2 ILE 527 1.444 4.745 -5.716
150 HD11 ILE 527 3HD1 ILE 527 0.852 6.915 -8.596
151 HD12 ILE 527 1HD1 ILE 527 2.104 7.990 -7.974
152 HD13 ILE 527 2HD1 ILE 527 1.236 6.918 -6.875
153 H GLY 528 H GLY 528 4.355 3.166 -6.303
154 HA2 GLY 528 2HA GLY 528 6.551 3.308 -5.678
155 HA3 GLY 528 1HA GLY 528 6.944 2.948 -7.346
156 H ALA 529 H ALA 529 5.357 5.547 -8.035
157 HA ALA 529 HA ALA 529 6.064 7.607 -8.742
158 HB1 ALA 529 1HB ALA 529 5.929 9.099 -7.040
159 HB2 ALA 529 2HB ALA 529 7.054 8.205 -6.017
160 HB3 ALA 529 3HB ALA 529 5.381 7.667 -6.166
161 H ALA 530 H ALA 530 8.076 5.561 -9.054
162 HA ALA 530 HA ALA 530 10.264 6.934 -9.923
163 HB1 ALA 530 1HB ALA 530 10.262 6.866 -7.058
164 HB2 ALA 530 2HB ALA 530 11.445 7.592 -8.145
165 HB3 ALA 530 3HB ALA 530 11.614 5.906 -7.657
166 H TRP 531 H TRP 531 8.973 4.832 -10.869
167 HA TRP 531 HA TRP 531 8.940 2.537 -11.237
168 HB2 TRP 531 2HB TRP 531 11.244 1.932 -12.280
169 HB3 TRP 531 1HB TRP 531 10.206 3.111 -13.077
170 HD1 TRP 531 HD TRP 531 12.821 3.532 -10.232
171 HE1 TRP 531 1HE TRP 531 14.426 5.428 -10.912
172 HE3 TRP 531 3HE TRP 531 10.878 4.631 -14.830
173 HZ2 TRP 531 2HZ TRP 531 14.816 7.157 -13.109
174 HZ3 TRP 531 3HZ TRP 531 11.925 6.419 -16.158
175 HH2 TRP 531 HH TRP 531 13.853 7.655 -15.313
176 H ILE 532 H ILE 532 9.182 2.846 -8.622
177 HA ILE 532 HA ILE 532 10.959 0.645 -7.919
178 HB ILE 532 HB ILE 532 11.955 2.846 -7.393
179 HG12 ILE 532 2HG1 ILE 532 11.209 1.167 -4.983
180 HG13 ILE 532 1HG1 ILE 532 12.551 0.856 -6.073
181 HG21 ILE 532 1HG2 ILE 532 9.507 3.663 -6.859
182 HG22 ILE 532 2HG2 ILE 532 10.923 4.421 -6.115
183 HG23 ILE 532 3HG2 ILE 532 9.981 3.234 -5.211
184 HD11 ILE 532 3HD1 ILE 532 12.284 3.362 -4.442
185 HD12 ILE 532 1HD1 ILE 532 13.689 2.806 -5.353
186 HD13 ILE 532 2HD1 ILE 532 13.166 1.930 -3.910
187 HA PRO 533 HA PRO 533 6.574 0.930 -5.849
188 HB2 PRO 533 2HB PRO 533 5.031 -0.454 -7.637
189 HB3 PRO 533 1HB PRO 533 5.120 1.307 -7.583
190 HG2 PRO 533 2HG PRO 533 6.525 -0.601 -9.395
191 HG3 PRO 533 1HG PRO 533 5.791 0.967 -9.769
192 HD2 PRO 533 2HD PRO 533 8.448 0.646 -9.466
193 HD3 PRO 533 1HD PRO 533 7.605 2.141 -9.014
194 H TYR 534 H TYR 534 8.509 -1.262 -7.581
195 HA TYR 534 HA TYR 534 7.523 -3.747 -6.819
196 HB2 TYR 534 2HB TYR 534 10.379 -2.893 -7.360
197 HB3 TYR 534 1HB TYR 534 9.792 -4.553 -7.359
198 HD1 TYR 534 1HD TYR 534 9.664 -1.309 -9.198
199 HD2 TYR 534 2HD TYR 534 8.622 -5.452 -9.223
200 HE1 TYR 534 1HE TYR 534 9.100 -1.159 -11.579
201 HE2 TYR 534 2HE TYR 534 8.060 -5.295 -11.609
202 HH TYR 534 HH TYR 534 7.280 -3.203 -13.182
203 H PHE 535 H PHE 535 10.233 -1.905 -5.395
204 HA PHE 535 HA PHE 535 9.567 -3.108 -2.798
205 HB2 PHE 535 2HB PHE 535 12.091 -3.099 -2.363
206 HB3 PHE 535 1HB PHE 535 11.452 -4.354 -3.418
207 HD1 PHE 535 1HD PHE 535 13.187 -1.084 -3.398
208 HD2 PHE 535 2HD PHE 535 12.218 -4.582 -5.620
209 HE1 PHE 535 1HE PHE 535 14.770 -0.403 -5.155
210 HE2 PHE 535 2HE PHE 535 13.800 -3.908 -7.380
211 HZ PHE 535 HZ PHE 535 15.079 -1.815 -7.148
212 H GLY 536 H GLY 536 9.466 -0.346 -4.339
213 HA2 GLY 536 2HA GLY 536 11.036 1.493 -2.922
214 HA3 GLY 536 1HA GLY 536 9.520 1.867 -3.732
215 HA PRO 537 HA PRO 537 7.984 2.475 0.435
216 HB2 PRO 537 2HB PRO 537 5.557 3.321 -0.154
217 HB3 PRO 537 1HB PRO 537 6.942 4.268 -0.729
218 HG2 PRO 537 2HG PRO 537 5.373 2.167 -2.200
219 HG3 PRO 537 1HG PRO 537 5.717 3.833 -2.719
220 HD2 PRO 537 2HD PRO 537 7.197 1.701 -3.505
221 HD3 PRO 537 1HD PRO 537 7.907 3.315 -3.274
222 H ALA 538 H ALA 538 7.969 -0.146 -0.957
223 HA ALA 538 HA ALA 538 5.658 -1.356 0.341
224 HB1 ALA 538 1HB ALA 538 6.910 -2.287 -2.242
225 HB2 ALA 538 2HB ALA 538 5.457 -1.288 -2.156
226 HB3 ALA 538 3HB ALA 538 5.450 -2.914 -1.472
227 H ALA 539 H ALA 539 9.003 -1.212 -0.340
228 HA ALA 539 HA ALA 539 9.517 -3.244 1.635
229 HB1 ALA 539 1HB ALA 539 9.335 -4.561 -0.390
230 HB2 ALA 539 2HB ALA 539 10.983 -4.582 0.238
231 HB3 ALA 539 3HB ALA 539 10.581 -3.572 -1.149
232 H GLU 540 H GLU 540 10.155 -0.254 0.764
233 HA GLU 540 HA GLU 540 13.032 -0.197 0.800
234 HB2 GLU 540 2HB GLU 540 12.778 2.224 1.121
235 HB3 GLU 540 1HB GLU 540 11.810 1.644 -0.223
236 HG2 GLU 540 2HG GLU 540 9.882 1.550 1.466
237 HG3 GLU 540 1HG GLU 540 10.911 2.559 2.481
238 H GLY 541 H GLY 541 12.675 -1.785 2.719
239 HA2 GLY 541 2HA GLY 541 13.629 -1.887 4.916
240 HA3 GLY 541 1HA GLY 541 13.045 -0.246 5.197
241 H ILE 542 H ILE 542 10.555 -1.252 3.672
242 HA ILE 542 HA ILE 542 8.917 -1.708 5.915
243 HB ILE 542 HB ILE 542 8.572 -1.462 2.994
244 HG12 ILE 542 2HG1 ILE 542 6.663 -0.689 5.178
245 HG13 ILE 542 1HG1 ILE 542 8.146 0.222 4.906
246 HG21 ILE 542 1HG2 ILE 542 6.188 -2.330 3.203
247 HG22 ILE 542 2HG2 ILE 542 6.749 -3.192 4.635
248 HG23 ILE 542 3HG2 ILE 542 7.480 -3.528 3.064
249 HD11 ILE 542 3HD1 ILE 542 5.833 -0.154 3.040
250 HD12 ILE 542 1HD1 ILE 542 7.400 0.453 2.506
251 HD13 ILE 542 2HD1 ILE 542 6.474 1.346 3.712
252 H TYR 543 H TYR 543 10.020 -3.833 3.280
253 HA TYR 543 HA TYR 543 8.734 -6.158 3.856
254 HB2 TYR 543 2HB TYR 543 10.511 -7.347 2.773
255 HB3 TYR 543 1HB TYR 543 10.344 -5.788 1.973
256 HD1 TYR 543 1HD TYR 543 11.840 -3.901 3.305
257 HD2 TYR 543 2HD TYR 543 12.681 -8.051 2.999
258 HE1 TYR 543 1HE TYR 543 14.228 -3.433 3.683
259 HE2 TYR 543 2HE TYR 543 15.071 -7.606 3.376
260 HH TYR 543 HH TYR 543 16.234 -4.696 4.550
261 H ALA 544 H ALA 544 11.469 -4.776 5.549
262 HA ALA 544 HA ALA 544 12.345 -6.861 7.112
263 HB1 ALA 544 1HB ALA 544 13.222 -4.498 7.049
264 HB2 ALA 544 2HB ALA 544 13.146 -5.236 8.649
265 HB3 ALA 544 3HB ALA 544 11.914 -4.074 8.154
266 H GLU 545 H GLU 545 9.524 -4.823 7.509
267 HA GLU 545 HA GLU 545 8.687 -5.743 10.046
268 HB2 GLU 545 2HB GLU 545 6.734 -4.917 7.911
269 HB3 GLU 545 1HB GLU 545 6.688 -4.585 9.638
270 HG2 GLU 545 2HG GLU 545 9.005 -3.370 8.543
271 HG3 GLU 545 1HG GLU 545 7.620 -2.960 7.536
272 H GLY 546 H GLY 546 7.495 -6.454 6.817
273 HA2 GLY 546 2HA GLY 546 6.392 -8.242 5.943
274 HA3 GLY 546 1HA GLY 546 7.537 -9.185 6.878
275 H LEU 547 H LEU 547 5.358 -7.139 8.611
276 HA LEU 547 HA LEU 547 3.815 -9.517 9.407
277 HB2 LEU 547 2HB LEU 547 3.339 -7.980 11.475
278 HB3 LEU 547 1HB LEU 547 4.816 -8.918 11.372
279 HG LEU 547 HG LEU 547 6.048 -6.941 10.639
280 HD11 LEU 547 1HD1 LEU 547 4.778 -5.470 9.501
281 HD12 LEU 547 2HD1 LEU 547 4.556 -4.751 11.095
282 HD13 LEU 547 3HD1 LEU 547 3.331 -5.834 10.438
283 HD21 LEU 547 3HD2 LEU 547 6.345 -6.177 12.739
284 HD22 LEU 547 1HD2 LEU 547 5.247 -7.494 13.152
285 HD23 LEU 547 2HD2 LEU 547 4.628 -5.852 12.977
286 H MET 548 H MET 548 3.666 -6.352 8.100
287 HA MET 548 HA MET 548 1.028 -6.583 7.229
288 HB2 MET 548 2HB MET 548 -0.158 -5.009 8.629
289 HB3 MET 548 1HB MET 548 0.494 -6.295 9.634
290 HG2 MET 548 2HG MET 548 1.610 -4.846 10.876
291 HG3 MET 548 1HG MET 548 2.371 -4.130 9.459
292 HE1 MET 548 3HE MET 548 1.407 -1.479 11.757
293 HE2 MET 548 1HE MET 548 1.582 -3.177 12.198
294 HE3 MET 548 2HE MET 548 0.029 -2.367 12.409
295 H HIS 549 H HIS 549 3.734 -4.549 8.086
296 HA HIS 549 HA HIS 549 2.988 -2.296 6.540
297 HB2 HIS 549 2HB HIS 549 5.444 -3.222 7.928
298 HB3 HIS 549 1HB HIS 549 5.650 -2.021 6.652
299 HD1 HIS 549 1HD HIS 549 2.475 -1.784 8.436
300 HD2 HIS 549 2HD HIS 549 6.297 -0.205 8.822
301 HE1 HIS 549 1HE HIS 549 2.236 0.169 9.978
302 HE2 HIS 549 2HE HIS 549 4.541 1.178 10.126
303 H ASN 550 H ASN 550 4.396 -5.360 5.773
304 HA ASN 550 HA ASN 550 5.764 -4.738 3.417
305 HB2 ASN 550 2HB ASN 550 5.969 -6.897 4.579
306 HB3 ASN 550 1HB ASN 550 4.318 -7.297 4.117
307 HD21 ASN 550 1HD2 ASN 550 7.146 -5.957 2.435
308 HD22 ASN 550 2HD2 ASN 550 7.114 -7.085 1.128
309 H GLN 551 H GLN 551 2.464 -4.635 4.087
310 HA GLN 551 HA GLN 551 1.093 -5.427 1.880
311 HB2 GLN 551 2HB GLN 551 -0.441 -3.484 2.385
312 HB3 GLN 551 1HB GLN 551 -0.071 -4.533 3.749
313 HG2 GLN 551 2HG GLN 551 0.189 -2.471 4.705
314 HG3 GLN 551 1HG GLN 551 1.839 -2.809 4.186
315 HE21 GLN 551 1HE2 GLN 551 2.656 -0.891 3.691
316 HE22 GLN 551 2HE2 GLN 551 1.956 0.245 2.592
317 H ASP 552 H ASP 552 -0.087 -3.684 0.408
318 HA ASP 552 HA ASP 552 1.928 -1.954 -0.855
319 HB2 ASP 552 2HB ASP 552 0.464 -4.233 -2.031
320 HB3 ASP 552 1HB ASP 552 0.472 -2.768 -3.008
321 H GLY 553 H GLY 553 -1.531 -2.789 -0.665
322 HA2 GLY 553 2HA GLY 553 -3.064 -1.015 0.022
323 HA3 GLY 553 1HA GLY 553 -2.106 0.095 -0.945
324 H LEU 554 H LEU 554 -3.343 -3.132 -1.777
325 HA LEU 554 HA LEU 554 -3.997 -2.695 -4.356
326 HB2 LEU 554 2HB LEU 554 -6.044 -4.307 -3.803
327 HB3 LEU 554 1HB LEU 554 -4.387 -4.865 -3.907
328 HG LEU 554 HG LEU 554 -4.895 -4.029 -1.221
329 HD11 LEU 554 1HD1 LEU 554 -6.838 -4.956 -0.599
330 HD12 LEU 554 2HD1 LEU 554 -6.668 -6.309 -1.717
331 HD13 LEU 554 3HD1 LEU 554 -7.270 -4.757 -2.296
332 HD21 LEU 554 3HD2 LEU 554 -3.210 -5.579 -1.528
333 HD22 LEU 554 1HD2 LEU 554 -4.171 -6.555 -2.639
334 HD23 LEU 554 2HD2 LEU 554 -4.528 -6.577 -0.913
335 H ILE 555 H ILE 555 -6.753 -2.817 -2.127
336 HA ILE 555 HA ILE 555 -8.667 -1.588 -2.008
337 HB ILE 555 HB ILE 555 -7.186 0.641 -3.384
338 HG12 ILE 555 2HG1 ILE 555 -5.715 0.100 -1.639
339 HG13 ILE 555 1HG1 ILE 555 -6.716 1.385 -0.972
340 HG21 ILE 555 1HG2 ILE 555 -8.886 1.971 -2.802
341 HG22 ILE 555 2HG2 ILE 555 -9.036 1.238 -1.206
342 HG23 ILE 555 3HG2 ILE 555 -9.790 0.471 -2.602
343 HD11 ILE 555 3HD1 ILE 555 -6.854 -1.550 -0.419
344 HD12 ILE 555 1HD1 ILE 555 -8.138 -0.432 0.035
345 HD13 ILE 555 2HD1 ILE 555 -6.520 -0.237 0.709
346 H CYS 556 H CYS 556 -10.403 -1.902 -3.222
347 HA CYS 556 HA CYS 556 -10.248 -2.494 -5.983
348 HB2 CYS 556 2HB CYS 556 -12.711 -1.802 -4.367
349 HB3 CYS 556 1HB CYS 556 -12.673 -2.663 -5.901
350 H GLY 557 H GLY 557 -10.986 0.413 -4.184
351 HA2 GLY 557 2HA GLY 557 -10.528 2.555 -5.201
352 HA3 GLY 557 1HA GLY 557 -11.066 1.884 -6.734
353 H LEU 558 H LEU 558 -13.400 0.607 -5.648
354 HA LEU 558 HA LEU 558 -15.111 2.295 -4.246
355 HB2 LEU 558 2HB LEU 558 -16.291 3.501 -5.879
356 HB3 LEU 558 1HB LEU 558 -14.600 3.737 -6.279
357 HG LEU 558 HG LEU 558 -15.907 1.457 -7.601
358 HD11 LEU 558 1HD1 LEU 558 -16.670 4.303 -8.207
359 HD12 LEU 558 2HD1 LEU 558 -17.736 2.960 -7.788
360 HD13 LEU 558 3HD1 LEU 558 -16.890 2.966 -9.336
361 HD21 LEU 558 3HD2 LEU 558 -14.673 2.671 -9.549
362 HD22 LEU 558 1HD2 LEU 558 -13.762 1.778 -8.330
363 HD23 LEU 558 2HD2 LEU 558 -13.873 3.537 -8.236
364 H ARG 559 H ARG 559 -14.459 -0.579 -5.243
365 HA ARG 559 HA ARG 559 -15.616 -2.534 -5.378
366 HB2 ARG 559 2HB ARG 559 -18.141 -0.923 -4.988
367 HB3 ARG 559 1HB ARG 559 -17.914 -2.642 -4.699
368 HG2 ARG 559 2HG ARG 559 -17.654 -2.033 -2.573
369 HG3 ARG 559 1HG ARG 559 -16.025 -1.586 -3.076
370 HD2 ARG 559 2HD ARG 559 -17.049 0.229 -1.823
371 HD3 ARG 559 1HD ARG 559 -16.797 0.709 -3.499
372 HE ARG 559 HE ARG 559 -19.049 0.966 -3.710
373 HH11 ARG 559 1HH1 ARG 559 -18.432 -1.094 -0.961
374 HH12 ARG 559 2HH1 ARG 559 -20.093 -1.158 -0.476
375 HH21 ARG 559 1HH2 ARG 559 -21.236 0.884 -3.073
376 HH22 ARG 559 2HH2 ARG 559 -21.685 -0.035 -1.675
377 H GLN 560 H GLN 560 -16.559 -3.745 -6.975
378 HA GLN 560 HA GLN 560 -18.146 -2.657 -9.067
379 HB2 GLN 560 2HB GLN 560 -16.497 -2.981 -10.904
380 HB3 GLN 560 1HB GLN 560 -16.088 -1.659 -9.818
381 HG2 GLN 560 2HG GLN 560 -14.391 -2.942 -8.763
382 HG3 GLN 560 1HG GLN 560 -14.913 -4.415 -9.579
383 HE21 GLN 560 1HE2 GLN 560 -13.364 -4.981 -10.931
384 HE22 GLN 560 2HE2 GLN 560 -12.563 -3.937 -12.050
Start of MODEL 11
1 H1 ALA 507 1HT ALA 507 -16.940 5.348 -4.432
2 H2 ALA 507 2HT ALA 507 -17.584 6.804 -3.790
3 H3 ALA 507 3HT ALA 507 -18.520 5.364 -3.767
4 HA ALA 507 HA ALA 507 -16.216 6.127 -2.150
5 HB1 ALA 507 2HB ALA 507 -18.978 5.060 -1.638
6 HB2 ALA 507 3HB ALA 507 -18.285 6.601 -1.134
7 HB3 ALA 507 1HB ALA 507 -17.731 5.101 -0.393
8 H GLN 508 H GLN 508 -15.319 4.442 -0.762
9 HA GLN 508 HA GLN 508 -14.742 2.063 -2.292
10 HB2 GLN 508 2HB GLN 508 -13.104 1.579 -0.557
11 HB3 GLN 508 1HB GLN 508 -12.955 3.249 -1.088
12 HG2 GLN 508 2HG GLN 508 -14.392 3.859 0.908
13 HG3 GLN 508 1HG GLN 508 -14.129 2.209 1.471
14 HE21 GLN 508 1HE2 GLN 508 -13.316 4.084 3.121
15 HE22 GLN 508 2HE2 GLN 508 -11.597 4.263 3.107
16 HA PRO 509 HA PRO 509 -17.491 -0.508 0.077
17 HB2 PRO 509 2HB PRO 509 -16.847 -2.864 -1.020
18 HB3 PRO 509 1HB PRO 509 -17.618 -1.590 -1.969
19 HG2 PRO 509 2HG PRO 509 -14.838 -2.566 -2.050
20 HG3 PRO 509 1HG PRO 509 -15.767 -1.718 -3.294
21 HD2 PRO 509 2HD PRO 509 -13.854 -0.629 -1.423
22 HD3 PRO 509 1HD PRO 509 -14.720 0.207 -2.727
23 H LYS 510 H LYS 510 -14.667 0.053 1.152
24 HA LYS 510 HA LYS 510 -13.358 -0.624 2.878
25 HB2 LYS 510 2HB LYS 510 -15.897 -2.131 3.424
26 HB3 LYS 510 1HB LYS 510 -14.498 -2.289 4.474
27 HG2 LYS 510 2HG LYS 510 -14.624 0.347 4.456
28 HG3 LYS 510 1HG LYS 510 -16.314 0.018 4.069
29 HD2 LYS 510 2HD LYS 510 -15.450 -1.690 6.209
30 HD3 LYS 510 1HD LYS 510 -15.086 -0.009 6.599
31 HE2 LYS 510 2HE LYS 510 -17.775 -0.851 5.561
32 HE3 LYS 510 1HE LYS 510 -17.379 -0.924 7.277
33 HZ1 LYS 510 3HZ LYS 510 -18.036 1.186 7.339
34 HZ2 LYS 510 1HZ LYS 510 -18.027 1.344 5.653
35 HZ3 LYS 510 2HZ LYS 510 -16.601 1.577 6.533
36 H CYS 511 H CYS 511 -12.077 -1.606 1.071
37 HA CYS 511 HA CYS 511 -11.691 -4.454 1.629
38 HB2 CYS 511 2HB CYS 511 -11.297 -4.795 -0.866
39 HB3 CYS 511 1HB CYS 511 -12.971 -4.587 -0.357
40 H ASN 512 H ASN 512 -10.259 -2.040 2.409
41 HA ASN 512 HA ASN 512 -7.872 -1.884 0.821
42 HB2 ASN 512 2HB ASN 512 -8.135 -0.892 3.651
43 HB3 ASN 512 1HB ASN 512 -7.120 -0.262 2.360
44 HD21 ASN 512 1HD2 ASN 512 -8.861 1.282 3.932
45 HD22 ASN 512 2HD2 ASN 512 -10.088 1.927 2.901
46 HA PRO 513 HA PRO 513 -5.608 -5.162 2.693
47 HB2 PRO 513 2HB PRO 513 -3.061 -4.325 2.355
48 HB3 PRO 513 1HB PRO 513 -4.072 -4.869 1.011
49 HG2 PRO 513 2HG PRO 513 -3.422 -2.082 1.886
50 HG3 PRO 513 1HG PRO 513 -3.516 -2.748 0.251
51 HD2 PRO 513 2HD PRO 513 -5.508 -1.284 1.398
52 HD3 PRO 513 1HD PRO 513 -5.793 -2.515 0.151
53 H ASN 514 H ASN 514 -3.249 -2.718 3.535
54 HA ASN 514 HA ASN 514 -3.945 -2.958 6.383
55 HB2 ASN 514 2HB ASN 514 -1.456 -3.660 4.973
56 HB3 ASN 514 1HB ASN 514 -1.233 -2.683 6.417
57 HD21 ASN 514 1HD2 ASN 514 -3.302 -5.405 5.448
58 HD22 ASN 514 2HD2 ASN 514 -2.986 -6.365 6.850
59 H LEU 515 H LEU 515 -1.511 -1.368 4.398
60 HA LEU 515 HA LEU 515 -0.589 0.722 4.570
61 HB2 LEU 515 2HB LEU 515 -2.054 2.333 3.592
62 HB3 LEU 515 1HB LEU 515 -2.353 0.761 2.875
63 HG LEU 515 HG LEU 515 -4.190 0.869 4.929
64 HD11 LEU 515 1HD1 LEU 515 -3.530 3.586 4.058
65 HD12 LEU 515 2HD1 LEU 515 -4.379 3.029 5.500
66 HD13 LEU 515 3HD1 LEU 515 -5.246 3.188 3.974
67 HD21 LEU 515 3HD2 LEU 515 -4.865 -0.071 2.932
68 HD22 LEU 515 1HD2 LEU 515 -4.307 1.303 1.977
69 HD23 LEU 515 2HD2 LEU 515 -5.770 1.443 2.952
70 H HIS 516 H HIS 516 -0.827 -0.105 7.113
71 HA HIS 516 HA HIS 516 -2.108 2.083 8.585
72 HB2 HIS 516 2HB HIS 516 -1.463 -0.736 9.200
73 HB3 HIS 516 1HB HIS 516 -1.267 0.403 10.528
74 HD1 HIS 516 1HD HIS 516 -3.716 2.231 9.801
75 HD2 HIS 516 2HD HIS 516 -3.790 -1.916 10.060
76 HE1 HIS 516 1HE HIS 516 -6.117 1.628 10.251
77 HE2 HIS 516 2HE HIS 516 -6.121 -0.880 10.489
78 H TYR 517 H TYR 517 0.933 1.263 7.390
79 HA TYR 517 HA TYR 517 2.396 2.347 9.652
80 HB2 TYR 517 2HB TYR 517 4.345 1.589 8.644
81 HB3 TYR 517 1HB TYR 517 3.166 0.422 8.065
82 HD1 TYR 517 1HD TYR 517 4.584 3.728 7.021
83 HD2 TYR 517 2HD TYR 517 3.272 -0.142 5.831
84 HE1 TYR 517 1HE TYR 517 5.224 4.230 4.711
85 HE2 TYR 517 2HE TYR 517 3.908 0.355 3.514
86 HH TYR 517 HH TYR 517 5.786 3.106 2.670
87 H TRP 518 H TRP 518 1.151 3.405 6.598
88 HA TRP 518 HA TRP 518 2.511 5.983 6.914
89 HB2 TRP 518 2HB TRP 518 2.650 4.468 4.734
90 HB3 TRP 518 1HB TRP 518 1.129 5.281 4.379
91 HD1 TRP 518 HD TRP 518 1.420 7.409 3.028
92 HE1 TRP 518 1HE TRP 518 3.270 9.170 2.703
93 HE3 TRP 518 3HE TRP 518 4.873 5.567 6.312
94 HZ2 TRP 518 2HZ TRP 518 5.852 9.706 3.710
95 HZ3 TRP 518 3HZ TRP 518 7.007 6.763 6.575
96 HH2 TRP 518 HH TRP 518 7.485 8.790 5.300
97 H THR 519 H THR 519 1.380 7.668 7.380
98 HA THR 519 HA THR 519 -0.841 8.126 8.532
99 HB THR 519 HB THR 519 0.309 10.027 7.789
100 HG1 THR 519 1HG THR 519 -1.328 11.312 7.100
101 HG21 THR 519 3HG2 THR 519 -0.467 10.067 4.988
102 HG22 THR 519 1HG2 THR 519 0.642 8.756 5.393
103 HG23 THR 519 2HG2 THR 519 1.083 10.428 5.747
104 H THR 520 H THR 520 -1.050 7.801 4.972
105 HA THR 520 HA THR 520 -3.276 6.124 4.972
106 HB THR 520 HB THR 520 -4.261 8.309 5.960
107 HG1 THR 520 1HG THR 520 -6.087 7.492 5.343
108 HG21 THR 520 3HG2 THR 520 -5.142 9.879 4.327
109 HG22 THR 520 1HG2 THR 520 -4.250 9.059 3.045
110 HG23 THR 520 2HG2 THR 520 -3.378 9.888 4.335
111 H GLN 521 H GLN 521 -1.911 8.926 3.264
112 HA GLN 521 HA GLN 521 -2.707 8.492 0.709
113 HB2 GLN 521 2HB GLN 521 -0.579 9.483 -0.045
114 HB3 GLN 521 1HB GLN 521 -1.313 10.377 1.279
115 HG2 GLN 521 2HG GLN 521 0.229 9.209 2.838
116 HG3 GLN 521 1HG GLN 521 1.018 8.486 1.438
117 HE21 GLN 521 1HE2 GLN 521 2.083 9.881 -0.058
118 HE22 GLN 521 2HE2 GLN 521 2.696 11.410 0.458
119 H ASP 522 H ASP 522 -1.854 7.451 -1.121
120 HA ASP 522 HA ASP 522 -1.414 4.766 -0.920
121 HB2 ASP 522 2HB ASP 522 -0.710 6.740 -3.072
122 HB3 ASP 522 1HB ASP 522 -0.333 5.030 -3.259
123 H GLU 523 H GLU 523 0.096 4.188 0.619
124 HA GLU 523 HA GLU 523 2.862 5.053 0.256
125 HB2 GLU 523 2HB GLU 523 3.280 3.948 2.389
126 HB3 GLU 523 1HB GLU 523 1.954 5.090 2.514
127 HG2 GLU 523 2HG GLU 523 1.292 2.255 1.952
128 HG3 GLU 523 1HG GLU 523 1.836 2.672 3.576
129 H GLY 524 H GLY 524 2.371 3.741 -1.858
130 HA2 GLY 524 2HA GLY 524 3.769 2.046 -2.885
131 HA3 GLY 524 1HA GLY 524 3.518 1.056 -1.450
132 H ALA 525 H ALA 525 0.755 2.729 -2.363
133 HA ALA 525 HA ALA 525 -0.718 0.398 -2.923
134 HB1 ALA 525 1HB ALA 525 -2.370 2.316 -3.792
135 HB2 ALA 525 2HB ALA 525 -1.249 3.303 -2.853
136 HB3 ALA 525 3HB ALA 525 -2.110 1.970 -2.081
137 H ALA 526 H ALA 526 1.134 -0.049 -4.688
138 HA ALA 526 HA ALA 526 1.618 -0.459 -6.858
139 HB1 ALA 526 1HB ALA 526 -0.531 -1.543 -6.877
140 HB2 ALA 526 2HB ALA 526 -0.295 -0.694 -8.405
141 HB3 ALA 526 3HB ALA 526 -1.342 -0.003 -7.166
142 H ILE 527 H ILE 527 2.913 1.380 -7.006
143 HA ILE 527 HA ILE 527 2.314 3.083 -9.152
144 HB ILE 527 HB ILE 527 0.919 4.223 -7.609
145 HG12 ILE 527 2HG1 ILE 527 3.406 5.907 -7.562
146 HG13 ILE 527 1HG1 ILE 527 2.630 5.518 -9.095
147 HG21 ILE 527 1HG2 ILE 527 2.249 3.213 -5.645
148 HG22 ILE 527 2HG2 ILE 527 1.417 4.756 -5.436
149 HG23 ILE 527 3HG2 ILE 527 3.159 4.725 -5.720
150 HD11 ILE 527 3HD1 ILE 527 2.059 7.704 -7.705
151 HD12 ILE 527 1HD1 ILE 527 0.905 6.602 -6.954
152 HD13 ILE 527 2HD1 ILE 527 0.864 6.870 -8.698
153 H GLY 528 H GLY 528 4.165 2.933 -6.120
154 HA2 GLY 528 2HA GLY 528 6.413 3.009 -5.704
155 HA3 GLY 528 1HA GLY 528 6.633 2.472 -7.357
156 H ALA 529 H ALA 529 5.124 5.087 -8.157
157 HA ALA 529 HA ALA 529 5.861 7.031 -9.110
158 HB1 ALA 529 1HB ALA 529 5.966 8.666 -7.551
159 HB2 ALA 529 2HB ALA 529 7.179 7.822 -6.587
160 HB3 ALA 529 3HB ALA 529 5.483 7.349 -6.480
161 H ALA 530 H ALA 530 7.716 4.833 -9.424
162 HA ALA 530 HA ALA 530 9.863 5.974 -10.649
163 HB1 ALA 530 1HB ALA 530 10.174 6.185 -7.804
164 HB2 ALA 530 2HB ALA 530 11.253 6.746 -9.080
165 HB3 ALA 530 3HB ALA 530 11.411 5.106 -8.449
166 H TRP 531 H TRP 531 8.368 3.865 -11.215
167 HA TRP 531 HA TRP 531 8.191 1.550 -11.334
168 HB2 TRP 531 2HB TRP 531 10.361 0.724 -12.533
169 HB3 TRP 531 1HB TRP 531 9.258 1.829 -13.348
170 HD1 TRP 531 HD TRP 531 12.214 2.470 -10.909
171 HE1 TRP 531 1HE TRP 531 13.755 4.235 -11.983
172 HE3 TRP 531 3HE TRP 531 9.714 3.157 -15.314
173 HZ2 TRP 531 2HZ TRP 531 13.888 5.719 -14.380
174 HZ3 TRP 531 3HZ TRP 531 10.613 4.766 -16.944
175 HH2 TRP 531 HH TRP 531 12.657 6.020 -16.485
176 H ILE 532 H ILE 532 8.730 2.101 -8.808
177 HA ILE 532 HA ILE 532 10.488 -0.104 -8.064
178 HB ILE 532 HB ILE 532 11.624 2.075 -7.864
179 HG12 ILE 532 2HG1 ILE 532 11.042 0.824 -5.167
180 HG13 ILE 532 1HG1 ILE 532 12.145 0.139 -6.352
181 HG21 ILE 532 1HG2 ILE 532 9.270 3.074 -7.194
182 HG22 ILE 532 2HG2 ILE 532 10.787 3.837 -6.699
183 HG23 ILE 532 3HG2 ILE 532 9.903 2.815 -5.564
184 HD11 ILE 532 3HD1 ILE 532 13.163 1.484 -4.468
185 HD12 ILE 532 1HD1 ILE 532 12.486 2.909 -5.261
186 HD13 ILE 532 2HD1 ILE 532 13.662 1.906 -6.110
187 HA PRO 533 HA PRO 533 6.373 0.590 -5.586
188 HB2 PRO 533 2HB PRO 533 4.574 -0.856 -7.056
189 HB3 PRO 533 1HB PRO 533 4.750 0.896 -7.177
190 HG2 PRO 533 2HG PRO 533 5.839 -1.240 -8.951
191 HG3 PRO 533 1HG PRO 533 5.152 0.335 -9.381
192 HD2 PRO 533 2HD PRO 533 7.809 -0.138 -9.339
193 HD3 PRO 533 1HD PRO 533 7.104 1.446 -8.957
194 H TYR 534 H TYR 534 8.012 -1.851 -7.288
195 HA TYR 534 HA TYR 534 6.993 -4.199 -6.199
196 HB2 TYR 534 2HB TYR 534 9.810 -3.553 -7.106
197 HB3 TYR 534 1HB TYR 534 9.162 -5.174 -6.873
198 HD1 TYR 534 2HD TYR 534 8.949 -2.121 -9.008
199 HD2 TYR 534 1HD TYR 534 7.781 -6.201 -8.511
200 HE1 TYR 534 2HE TYR 534 8.138 -2.177 -11.322
201 HE2 TYR 534 1HE TYR 534 6.972 -6.249 -10.830
202 HH TYR 534 HH TYR 534 6.467 -3.497 -12.663
203 H PHE 535 H PHE 535 9.883 -2.346 -5.217
204 HA PHE 535 HA PHE 535 9.459 -3.308 -2.472
205 HB2 PHE 535 2HB PHE 535 12.012 -3.329 -2.286
206 HB3 PHE 535 1HB PHE 535 11.253 -4.651 -3.168
207 HD1 PHE 535 2HD PHE 535 13.003 -1.415 -3.607
208 HD2 PHE 535 1HD PHE 535 11.825 -5.095 -5.389
209 HE1 PHE 535 2HE PHE 535 14.417 -0.917 -5.558
210 HE2 PHE 535 1HE PHE 535 13.238 -4.605 -7.344
211 HZ PHE 535 HZ PHE 535 14.535 -2.513 -7.430
212 H GLY 536 H GLY 536 9.259 -0.687 -4.239
213 HA2 GLY 536 2HA GLY 536 10.993 1.225 -3.150
214 HA3 GLY 536 1HA GLY 536 9.411 1.568 -3.840
215 HA PRO 537 HA PRO 537 8.324 2.589 0.387
216 HB2 PRO 537 2HB PRO 537 5.865 3.450 -0.024
217 HB3 PRO 537 1HB PRO 537 7.205 4.313 -0.803
218 HG2 PRO 537 2HG PRO 537 5.460 2.149 -1.947
219 HG3 PRO 537 1HG PRO 537 5.784 3.760 -2.627
220 HD2 PRO 537 2HD PRO 537 7.136 1.539 -3.386
221 HD3 PRO 537 1HD PRO 537 7.903 3.143 -3.341
222 H ALA 538 H ALA 538 8.084 -0.134 -0.805
223 HA ALA 538 HA ALA 538 5.895 -1.162 0.819
224 HB1 ALA 538 1HB ALA 538 6.902 -2.397 -1.741
225 HB2 ALA 538 2HB ALA 538 5.515 -1.307 -1.673
226 HB3 ALA 538 3HB ALA 538 5.467 -2.849 -0.815
227 H ALA 539 H ALA 539 9.167 -1.193 -0.199
228 HA ALA 539 HA ALA 539 9.841 -2.996 1.943
229 HB1 ALA 539 1HB ALA 539 11.100 -4.554 0.574
230 HB2 ALA 539 2HB ALA 539 10.589 -3.698 -0.878
231 HB3 ALA 539 3HB ALA 539 9.397 -4.533 0.117
232 H GLU 540 H GLU 540 10.451 -0.153 0.732
233 HA GLU 540 HA GLU 540 13.316 -0.203 0.405
234 HB2 GLU 540 2HB GLU 540 13.165 2.246 0.521
235 HB3 GLU 540 1HB GLU 540 12.024 1.584 -0.636
236 HG2 GLU 540 2HG GLU 540 10.326 1.706 1.290
237 HG3 GLU 540 1HG GLU 540 11.495 2.783 2.051
238 H GLY 541 H GLY 541 13.142 -1.598 2.496
239 HA2 GLY 541 2HA GLY 541 14.281 -1.593 4.583
240 HA3 GLY 541 1HA GLY 541 13.915 0.125 4.738
241 H ILE 542 H ILE 542 11.160 -0.890 3.601
242 HA ILE 542 HA ILE 542 9.744 -0.784 6.024
243 HB ILE 542 HB ILE 542 9.125 -1.002 3.168
244 HG12 ILE 542 2HG1 ILE 542 7.515 0.162 5.436
245 HG13 ILE 542 1HG1 ILE 542 8.896 0.985 4.719
246 HG21 ILE 542 1HG2 ILE 542 7.368 -2.409 5.167
247 HG22 ILE 542 2HG2 ILE 542 8.014 -3.025 3.643
248 HG23 ILE 542 3HG2 ILE 542 6.761 -1.780 3.634
249 HD11 ILE 542 3HD1 ILE 542 6.268 0.307 3.466
250 HD12 ILE 542 1HD1 ILE 542 7.686 0.722 2.505
251 HD13 ILE 542 2HD1 ILE 542 7.032 1.886 3.656
252 H TYR 543 H TYR 543 10.650 -3.461 3.887
253 HA TYR 543 HA TYR 543 9.230 -5.555 4.856
254 HB2 TYR 543 2HB TYR 543 11.132 -7.015 4.281
255 HB3 TYR 543 1HB TYR 543 10.799 -5.818 3.033
256 HD1 TYR 543 1HD TYR 543 12.232 -3.737 2.979
257 HD2 TYR 543 2HD TYR 543 13.252 -7.175 5.244
258 HE1 TYR 543 1HE TYR 543 14.573 -2.971 3.062
259 HE2 TYR 543 2HE TYR 543 15.598 -6.430 5.342
260 HH TYR 543 HH TYR 543 16.829 -3.986 3.378
261 H ALA 544 H ALA 544 11.777 -3.869 6.518
262 HA ALA 544 HA ALA 544 12.552 -5.691 8.448
263 HB1 ALA 544 1HB ALA 544 13.513 -3.431 8.111
264 HB2 ALA 544 2HB ALA 544 13.178 -3.810 9.801
265 HB3 ALA 544 3HB ALA 544 12.091 -2.753 8.901
266 H GLU 545 H GLU 545 9.497 -4.260 7.985
267 HA GLU 545 HA GLU 545 8.391 -4.106 10.512
268 HB2 GLU 545 2HB GLU 545 6.229 -4.727 9.257
269 HB3 GLU 545 1HB GLU 545 7.083 -3.285 8.730
270 HG2 GLU 545 2HG GLU 545 6.690 -4.223 6.708
271 HG3 GLU 545 1HG GLU 545 8.217 -5.017 7.075
272 H GLY 546 H GLY 546 8.656 -6.819 8.294
273 HA2 GLY 546 2HA GLY 546 8.396 -9.068 8.568
274 HA3 GLY 546 1HA GLY 546 9.161 -8.783 10.118
275 H LEU 547 H LEU 547 5.893 -8.085 8.787
276 HA LEU 547 HA LEU 547 4.634 -10.008 10.423
277 HB2 LEU 547 2HB LEU 547 3.712 -8.795 12.170
278 HB3 LEU 547 1HB LEU 547 5.370 -8.234 12.098
279 HG LEU 547 HG LEU 547 3.120 -6.719 10.794
280 HD11 LEU 547 1HD1 LEU 547 2.959 -7.170 13.369
281 HD12 LEU 547 2HD1 LEU 547 2.656 -5.561 12.711
282 HD13 LEU 547 3HD1 LEU 547 4.215 -5.934 13.446
283 HD21 LEU 547 3HD2 LEU 547 5.610 -5.519 11.887
284 HD22 LEU 547 1HD2 LEU 547 4.628 -5.027 10.506
285 HD23 LEU 547 2HD2 LEU 547 5.703 -6.419 10.374
286 H MET 548 H MET 548 4.172 -6.870 8.817
287 HA MET 548 HA MET 548 2.340 -7.818 6.950
288 HB2 MET 548 2HB MET 548 1.172 -7.254 9.551
289 HB3 MET 548 1HB MET 548 0.431 -6.292 8.279
290 HG2 MET 548 2HG MET 548 0.813 -9.205 7.827
291 HG3 MET 548 1HG MET 548 -0.477 -8.671 8.904
292 HE1 MET 548 3HE MET 548 -0.556 -9.859 5.148
293 HE2 MET 548 1HE MET 548 0.973 -9.180 5.706
294 HE3 MET 548 2HE MET 548 0.033 -8.339 4.474
295 H HIS 549 H HIS 549 3.654 -5.165 8.765
296 HA HIS 549 HA HIS 549 2.586 -2.971 7.467
297 HB2 HIS 549 2HB HIS 549 4.842 -3.515 9.167
298 HB3 HIS 549 1HB HIS 549 5.292 -2.351 7.925
299 HD1 HIS 549 1HD HIS 549 1.767 -2.205 8.957
300 HD2 HIS 549 2HD HIS 549 5.359 -0.448 10.088
301 HE1 HIS 549 1HE HIS 549 1.131 -0.225 10.356
302 HE2 HIS 549 2HE HIS 549 3.319 0.758 11.128
303 H ASN 550 H ASN 550 4.565 -5.399 6.101
304 HA ASN 550 HA ASN 550 5.828 -3.799 4.101
305 HB2 ASN 550 2HB ASN 550 6.817 -5.912 4.814
306 HB3 ASN 550 1HB ASN 550 5.394 -6.788 4.262
307 HD21 ASN 550 1HD2 ASN 550 8.215 -4.988 3.277
308 HD22 ASN 550 2HD2 ASN 550 8.249 -5.557 1.647
309 H GLN 551 H GLN 551 2.698 -4.135 4.476
310 HA GLN 551 HA GLN 551 1.542 -5.238 2.237
311 HB2 GLN 551 2HB GLN 551 -0.300 -3.609 2.618
312 HB3 GLN 551 1HB GLN 551 0.217 -4.436 4.082
313 HG2 GLN 551 2HG GLN 551 0.063 -2.292 4.842
314 HG3 GLN 551 1HG GLN 551 1.757 -2.344 4.363
315 HE21 GLN 551 1HE2 GLN 551 2.471 -0.903 2.934
316 HE22 GLN 551 2HE2 GLN 551 1.478 0.182 2.029
317 H ASP 552 H ASP 552 0.180 -3.532 0.735
318 HA ASP 552 HA ASP 552 2.163 -1.771 -0.541
319 HB2 ASP 552 2HB ASP 552 1.034 -4.150 -1.620
320 HB3 ASP 552 1HB ASP 552 0.367 -2.789 -2.517
321 H GLY 553 H GLY 553 -1.319 -2.586 -0.446
322 HA2 GLY 553 2HA GLY 553 -2.830 -0.785 0.293
323 HA3 GLY 553 1HA GLY 553 -1.846 0.316 -0.657
324 H LEU 554 H LEU 554 -3.125 -2.885 -1.513
325 HA LEU 554 HA LEU 554 -3.723 -2.520 -4.091
326 HB2 LEU 554 2HB LEU 554 -5.858 -3.984 -3.569
327 HB3 LEU 554 1HB LEU 554 -4.235 -4.640 -3.496
328 HG LEU 554 HG LEU 554 -4.774 -3.641 -0.920
329 HD11 LEU 554 1HD1 LEU 554 -6.888 -4.078 -0.361
330 HD12 LEU 554 2HD1 LEU 554 -6.917 -5.578 -1.289
331 HD13 LEU 554 3HD1 LEU 554 -7.214 -4.037 -2.093
332 HD21 LEU 554 3HD2 LEU 554 -4.630 -6.394 -2.110
333 HD22 LEU 554 1HD2 LEU 554 -4.797 -6.111 -0.377
334 HD23 LEU 554 2HD2 LEU 554 -3.378 -5.513 -1.235
335 H ILE 555 H ILE 555 -6.398 -2.158 -1.759
336 HA ILE 555 HA ILE 555 -8.253 -0.840 -1.780
337 HB ILE 555 HB ILE 555 -6.552 1.089 -3.356
338 HG12 ILE 555 2HG1 ILE 555 -5.280 0.793 -1.440
339 HG13 ILE 555 1HG1 ILE 555 -6.333 2.120 -0.968
340 HG21 ILE 555 1HG2 ILE 555 -8.235 2.535 -3.246
341 HG22 ILE 555 2HG2 ILE 555 -8.453 2.245 -1.519
342 HG23 ILE 555 3HG2 ILE 555 -9.250 1.201 -2.696
343 HD11 ILE 555 3HD1 ILE 555 -7.793 0.527 0.177
344 HD12 ILE 555 1HD1 ILE 555 -6.148 0.508 0.811
345 HD13 ILE 555 2HD1 ILE 555 -6.694 -0.775 -0.268
346 H CYS 556 H CYS 556 -9.926 -1.544 -2.932
347 HA CYS 556 HA CYS 556 -9.865 -2.285 -5.623
348 HB2 CYS 556 2HB CYS 556 -12.336 -1.396 -4.133
349 HB3 CYS 556 1HB CYS 556 -12.242 -2.528 -5.478
350 H GLY 557 H GLY 557 -10.581 0.803 -4.118
351 HA2 GLY 557 2HA GLY 557 -10.238 2.851 -5.307
352 HA3 GLY 557 1HA GLY 557 -10.618 2.001 -6.800
353 H LEU 558 H LEU 558 -12.912 0.660 -5.590
354 HA LEU 558 HA LEU 558 -14.786 2.530 -4.651
355 HB2 LEU 558 2HB LEU 558 -16.135 2.801 -6.665
356 HB3 LEU 558 1HB LEU 558 -14.526 3.457 -6.891
357 HG LEU 558 HG LEU 558 -15.236 0.695 -7.854
358 HD11 LEU 558 1HD1 LEU 558 -15.398 3.207 -9.501
359 HD12 LEU 558 2HD1 LEU 558 -16.803 2.404 -8.800
360 HD13 LEU 558 3HD1 LEU 558 -15.808 1.563 -9.989
361 HD21 LEU 558 3HD2 LEU 558 -13.404 1.726 -9.555
362 HD22 LEU 558 1HD2 LEU 558 -13.010 0.758 -8.135
363 HD23 LEU 558 2HD2 LEU 558 -12.943 2.519 -8.050
364 H ARG 559 H ARG 559 -14.236 -0.331 -6.591
365 HA ARG 559 HA ARG 559 -15.120 -2.361 -5.180
366 HB2 ARG 559 2HB ARG 559 -17.545 -2.688 -5.751
367 HB3 ARG 559 1HB ARG 559 -17.244 -1.397 -4.594
368 HG2 ARG 559 2HG ARG 559 -17.188 -0.001 -6.897
369 HG3 ARG 559 1HG ARG 559 -18.311 -1.290 -7.331
370 HD2 ARG 559 2HD ARG 559 -19.423 -0.720 -5.048
371 HD3 ARG 559 1HD ARG 559 -18.557 0.807 -5.214
372 HE ARG 559 HE ARG 559 -19.861 0.422 -7.607
373 HH11 ARG 559 1HH1 ARG 559 -20.781 0.730 -4.255
374 HH12 ARG 559 2HH1 ARG 559 -22.322 1.431 -4.613
375 HH21 ARG 559 1HH2 ARG 559 -21.889 1.344 -8.080
376 HH22 ARG 559 2HH2 ARG 559 -22.952 1.780 -6.784
377 H GLN 560 H GLN 560 -15.009 -4.195 -6.412
378 HA GLN 560 HA GLN 560 -15.613 -4.061 -9.226
379 HB2 GLN 560 2HB GLN 560 -13.235 -3.216 -8.905
380 HB3 GLN 560 1HB GLN 560 -12.822 -4.853 -8.406
381 HG2 GLN 560 2HG GLN 560 -14.066 -5.383 -10.717
382 HG3 GLN 560 1HG GLN 560 -13.432 -3.778 -11.076
383 HE21 GLN 560 1HE2 GLN 560 -11.164 -3.446 -10.962
384 HE22 GLN 560 2HE2 GLN 560 -10.066 -4.766 -11.153
Start of MODEL 12
1 H1 ALA 507 1HT ALA 507 -18.641 6.369 1.378
2 H2 ALA 507 2HT ALA 507 -17.650 5.069 1.900
3 H3 ALA 507 3HT ALA 507 -18.891 4.795 0.746
4 HA ALA 507 HA ALA 507 -17.767 6.253 -0.790
5 HB1 ALA 507 2HB ALA 507 -16.498 7.253 1.355
6 HB2 ALA 507 3HB ALA 507 -15.890 7.399 -0.293
7 HB3 ALA 507 1HB ALA 507 -15.267 6.136 0.768
8 H GLN 508 H GLN 508 -15.633 4.191 1.189
9 HA GLN 508 HA GLN 508 -15.037 2.593 -1.174
10 HB2 GLN 508 2HB GLN 508 -13.258 1.610 0.164
11 HB3 GLN 508 1HB GLN 508 -13.183 3.365 0.252
12 HG2 GLN 508 2HG GLN 508 -14.814 2.377 2.381
13 HG3 GLN 508 1HG GLN 508 -13.273 1.520 2.368
14 HE21 GLN 508 1HE2 GLN 508 -11.440 2.569 2.956
15 HE22 GLN 508 2HE2 GLN 508 -11.405 4.195 3.538
16 HA PRO 509 HA PRO 509 -17.472 -0.809 0.312
17 HB2 PRO 509 2HB PRO 509 -16.563 -2.730 -1.333
18 HB3 PRO 509 1HB PRO 509 -17.462 -1.337 -1.939
19 HG2 PRO 509 2HG PRO 509 -14.605 -1.976 -2.208
20 HG3 PRO 509 1HG PRO 509 -15.608 -0.884 -3.175
21 HD2 PRO 509 2HD PRO 509 -13.810 -0.241 -0.996
22 HD3 PRO 509 1HD PRO 509 -14.706 0.866 -2.054
23 H LYS 510 H LYS 510 -14.708 -0.335 1.599
24 HA LYS 510 HA LYS 510 -13.347 -1.344 3.109
25 HB2 LYS 510 2HB LYS 510 -15.885 -2.913 3.307
26 HB3 LYS 510 1HB LYS 510 -14.476 -3.421 4.228
27 HG2 LYS 510 2HG LYS 510 -14.385 -1.136 5.216
28 HG3 LYS 510 1HG LYS 510 -15.911 -0.784 4.403
29 HD2 LYS 510 2HD LYS 510 -16.845 -1.532 6.306
30 HD3 LYS 510 1HD LYS 510 -16.493 -3.131 5.650
31 HE2 LYS 510 2HE LYS 510 -15.637 -3.186 7.828
32 HE3 LYS 510 1HE LYS 510 -14.228 -2.916 6.804
33 HZ1 LYS 510 3HZ LYS 510 -13.952 -0.820 7.578
34 HZ2 LYS 510 1HZ LYS 510 -14.709 -1.471 8.945
35 HZ3 LYS 510 2HZ LYS 510 -15.602 -0.557 7.837
36 H CYS 511 H CYS 511 -12.001 -1.878 1.178
37 HA CYS 511 HA CYS 511 -11.516 -4.757 1.134
38 HB2 CYS 511 2HB CYS 511 -11.204 -4.684 -1.354
39 HB3 CYS 511 1HB CYS 511 -12.871 -4.479 -0.827
40 H ASN 512 H ASN 512 -10.193 -2.458 2.342
41 HA ASN 512 HA ASN 512 -7.799 -2.004 0.790
42 HB2 ASN 512 2HB ASN 512 -8.197 -1.255 3.681
43 HB3 ASN 512 1HB ASN 512 -7.139 -0.499 2.495
44 HD21 ASN 512 1HD2 ASN 512 -7.863 1.506 2.299
45 HD22 ASN 512 2HD2 ASN 512 -9.496 1.958 1.962
46 HA PRO 513 HA PRO 513 -5.492 -5.370 2.439
47 HB2 PRO 513 2HB PRO 513 -2.961 -4.475 2.106
48 HB3 PRO 513 1HB PRO 513 -3.985 -4.975 0.755
49 HG2 PRO 513 2HG PRO 513 -3.345 -2.224 1.732
50 HG3 PRO 513 1HG PRO 513 -3.493 -2.819 0.075
51 HD2 PRO 513 2HD PRO 513 -5.452 -1.427 1.378
52 HD3 PRO 513 1HD PRO 513 -5.765 -2.568 0.056
53 H ASN 514 H ASN 514 -3.210 -2.876 3.373
54 HA ASN 514 HA ASN 514 -3.819 -3.327 6.215
55 HB2 ASN 514 2HB ASN 514 -1.339 -3.835 4.710
56 HB3 ASN 514 1HB ASN 514 -1.122 -2.945 6.213
57 HD21 ASN 514 1HD2 ASN 514 -2.588 -5.860 4.862
58 HD22 ASN 514 2HD2 ASN 514 -2.405 -6.828 6.281
59 H LEU 515 H LEU 515 -1.524 -1.518 4.255
60 HA LEU 515 HA LEU 515 -0.674 0.589 4.512
61 HB2 LEU 515 2HB LEU 515 -2.233 2.194 3.701
62 HB3 LEU 515 1HB LEU 515 -2.541 0.651 2.922
63 HG LEU 515 HG LEU 515 -4.239 0.605 5.092
64 HD11 LEU 515 1HD1 LEU 515 -5.064 3.145 3.955
65 HD12 LEU 515 2HD1 LEU 515 -3.540 3.263 4.836
66 HD13 LEU 515 3HD1 LEU 515 -4.977 2.635 5.641
67 HD21 LEU 515 3HD2 LEU 515 -4.572 1.188 2.182
68 HD22 LEU 515 1HD2 LEU 515 -5.966 1.213 3.262
69 HD23 LEU 515 2HD2 LEU 515 -5.008 -0.258 3.093
70 H HIS 516 H HIS 516 -0.770 -0.419 7.007
71 HA HIS 516 HA HIS 516 -2.121 1.525 8.711
72 HB2 HIS 516 2HB HIS 516 -0.700 -1.073 9.254
73 HB3 HIS 516 1HB HIS 516 -1.158 0.023 10.553
74 HD1 HIS 516 1HD HIS 516 -3.933 0.760 8.994
75 HD2 HIS 516 2HD HIS 516 -2.557 -2.984 10.158
76 HE1 HIS 516 1HE HIS 516 -5.984 -0.684 9.171
77 HE2 HIS 516 2HE HIS 516 -5.136 -2.919 9.967
78 H TYR 517 H TYR 517 0.872 1.232 7.194
79 HA TYR 517 HA TYR 517 2.290 2.585 9.366
80 HB2 TYR 517 2HB TYR 517 4.296 1.966 8.372
81 HB3 TYR 517 1HB TYR 517 3.253 0.614 7.958
82 HD1 TYR 517 2HD TYR 517 4.212 3.940 6.521
83 HD2 TYR 517 1HD TYR 517 3.417 -0.179 5.797
84 HE1 TYR 517 2HE TYR 517 4.735 4.264 4.153
85 HE2 TYR 517 1HE TYR 517 3.949 0.134 3.423
86 HH TYR 517 HH TYR 517 5.521 2.854 2.232
87 H TRP 518 H TRP 518 0.830 3.200 6.294
88 HA TRP 518 HA TRP 518 1.909 5.929 6.314
89 HB2 TRP 518 2HB TRP 518 2.284 4.332 4.292
90 HB3 TRP 518 1HB TRP 518 0.601 4.686 3.920
91 HD1 TRP 518 HD TRP 518 0.160 6.822 2.556
92 HE1 TRP 518 1HE TRP 518 1.568 8.849 1.827
93 HE3 TRP 518 3HE TRP 518 4.406 5.868 5.237
94 HZ2 TRP 518 2HZ TRP 518 4.138 9.905 2.324
95 HZ3 TRP 518 3HZ TRP 518 6.294 7.436 5.055
96 HH2 TRP 518 HH TRP 518 6.161 9.413 3.627
97 H THR 519 H THR 519 0.570 7.480 6.755
98 HA THR 519 HA THR 519 -1.741 7.679 7.849
99 HB THR 519 HB THR 519 -0.774 9.690 7.148
100 HG1 THR 519 1HG THR 519 -3.153 9.610 7.072
101 HG21 THR 519 3HG2 THR 519 -1.378 9.639 4.308
102 HG22 THR 519 1HG2 THR 519 -0.178 8.437 4.788
103 HG23 THR 519 2HG2 THR 519 0.086 10.145 5.154
104 H THR 520 H THR 520 -1.746 7.328 4.285
105 HA THR 520 HA THR 520 -3.793 5.427 4.197
106 HB THR 520 HB THR 520 -5.033 7.528 5.071
107 HG1 THR 520 1HG THR 520 -6.763 6.606 4.301
108 HG21 THR 520 3HG2 THR 520 -4.865 8.242 2.150
109 HG22 THR 520 1HG2 THR 520 -4.188 9.165 3.492
110 HG23 THR 520 2HG2 THR 520 -5.935 8.988 3.338
111 H GLN 521 H GLN 521 -2.520 8.293 2.551
112 HA GLN 521 HA GLN 521 -3.096 7.848 -0.049
113 HB2 GLN 521 2HB GLN 521 -1.307 9.456 1.307
114 HB3 GLN 521 1HB GLN 521 -0.270 8.505 0.251
115 HG2 GLN 521 2HG GLN 521 -1.788 9.168 -1.644
116 HG3 GLN 521 1HG GLN 521 -2.538 10.310 -0.529
117 HE21 GLN 521 1HE2 GLN 521 -1.763 12.286 -0.610
118 HE22 GLN 521 2HE2 GLN 521 -0.170 12.741 -1.099
119 H ASP 522 H ASP 522 -2.025 6.881 -1.829
120 HA ASP 522 HA ASP 522 -1.509 4.200 -1.620
121 HB2 ASP 522 2HB ASP 522 -0.598 6.194 -3.692
122 HB3 ASP 522 1HB ASP 522 -0.348 4.460 -3.867
123 H GLU 523 H GLU 523 -0.113 3.681 0.032
124 HA GLU 523 HA GLU 523 2.630 4.663 -0.071
125 HB2 GLU 523 2HB GLU 523 2.909 3.648 2.087
126 HB3 GLU 523 1HB GLU 523 1.423 4.578 2.079
127 HG2 GLU 523 2HG GLU 523 1.396 1.629 1.575
128 HG3 GLU 523 1HG GLU 523 1.428 2.278 3.213
129 H GLY 524 H GLY 524 2.272 3.351 -2.243
130 HA2 GLY 524 2HA GLY 524 3.863 1.760 -3.194
131 HA3 GLY 524 1HA GLY 524 3.525 0.714 -1.818
132 H ALA 525 H ALA 525 0.768 2.296 -2.856
133 HA ALA 525 HA ALA 525 -0.518 -0.079 -3.687
134 HB1 ALA 525 1HB ALA 525 -2.431 1.387 -4.155
135 HB2 ALA 525 2HB ALA 525 -1.392 2.798 -3.940
136 HB3 ALA 525 3HB ALA 525 -1.714 1.724 -2.578
137 H ALA 526 H ALA 526 1.473 -0.234 -5.355
138 HA ALA 526 HA ALA 526 2.107 -0.424 -7.516
139 HB1 ALA 526 1HB ALA 526 -0.870 -0.233 -7.807
140 HB2 ALA 526 2HB ALA 526 0.171 -1.650 -7.955
141 HB3 ALA 526 3HB ALA 526 0.185 -0.411 -9.210
142 H ILE 527 H ILE 527 3.317 1.466 -7.441
143 HA ILE 527 HA ILE 527 2.759 3.330 -9.454
144 HB ILE 527 HB ILE 527 1.210 4.255 -7.909
145 HG12 ILE 527 2HG1 ILE 527 3.613 6.039 -7.609
146 HG13 ILE 527 1HG1 ILE 527 2.882 5.769 -9.189
147 HG21 ILE 527 1HG2 ILE 527 2.476 3.157 -5.957
148 HG22 ILE 527 2HG2 ILE 527 1.560 4.640 -5.674
149 HG23 ILE 527 3HG2 ILE 527 3.315 4.707 -5.859
150 HD11 ILE 527 3HD1 ILE 527 0.705 6.422 -7.735
151 HD12 ILE 527 1HD1 ILE 527 1.676 7.575 -8.651
152 HD13 ILE 527 2HD1 ILE 527 1.948 7.371 -6.920
153 H GLY 528 H GLY 528 4.420 3.015 -6.324
154 HA2 GLY 528 2HA GLY 528 6.629 3.176 -5.749
155 HA3 GLY 528 1HA GLY 528 6.982 2.769 -7.414
156 H ALA 529 H ALA 529 5.394 5.358 -8.138
157 HA ALA 529 HA ALA 529 6.075 7.401 -8.897
158 HB1 ALA 529 1HB ALA 529 6.060 8.932 -7.217
159 HB2 ALA 529 2HB ALA 529 7.197 8.021 -6.223
160 HB3 ALA 529 3HB ALA 529 5.505 7.527 -6.306
161 H ALA 530 H ALA 530 8.052 5.334 -9.283
162 HA ALA 530 HA ALA 530 10.198 6.651 -10.299
163 HB1 ALA 530 1HB ALA 530 10.358 6.655 -7.421
164 HB2 ALA 530 2HB ALA 530 11.427 7.418 -8.597
165 HB3 ALA 530 3HB ALA 530 11.705 5.747 -8.105
166 H TRP 531 H TRP 531 8.860 4.506 -11.079
167 HA TRP 531 HA TRP 531 8.819 2.197 -11.347
168 HB2 TRP 531 2HB TRP 531 11.102 1.562 -12.453
169 HB3 TRP 531 1HB TRP 531 9.986 2.650 -13.271
170 HD1 TRP 531 HD TRP 531 12.756 3.298 -10.628
171 HE1 TRP 531 1HE TRP 531 14.248 5.208 -11.498
172 HE3 TRP 531 3HE TRP 531 10.466 4.132 -15.120
173 HZ2 TRP 531 2HZ TRP 531 14.429 6.851 -13.789
174 HZ3 TRP 531 3HZ TRP 531 11.360 5.890 -16.592
175 HH2 TRP 531 HH TRP 531 13.299 7.220 -15.940
176 H ILE 532 H ILE 532 9.172 2.621 -8.766
177 HA ILE 532 HA ILE 532 11.004 0.472 -8.040
178 HB ILE 532 HB ILE 532 12.002 2.690 -7.639
179 HG12 ILE 532 2HG1 ILE 532 11.324 1.277 -5.050
180 HG13 ILE 532 1HG1 ILE 532 12.508 0.682 -6.201
181 HG21 ILE 532 1HG2 ILE 532 10.989 4.335 -6.448
182 HG22 ILE 532 2HG2 ILE 532 10.110 3.206 -5.417
183 HG23 ILE 532 3HG2 ILE 532 9.550 3.515 -7.065
184 HD11 ILE 532 3HD1 ILE 532 13.390 1.965 -4.216
185 HD12 ILE 532 1HD1 ILE 532 12.694 3.406 -4.964
186 HD13 ILE 532 2HD1 ILE 532 13.946 2.494 -5.807
187 HA PRO 533 HA PRO 533 6.706 0.794 -5.796
188 HB2 PRO 533 2HB PRO 533 5.095 -0.663 -7.462
189 HB3 PRO 533 1HB PRO 533 5.169 1.100 -7.473
190 HG2 PRO 533 2HG PRO 533 6.501 -0.858 -9.286
191 HG3 PRO 533 1HG PRO 533 5.743 0.695 -9.673
192 HD2 PRO 533 2HD PRO 533 8.415 0.387 -9.484
193 HD3 PRO 533 1HD PRO 533 7.587 1.898 -9.051
194 H TYR 534 H TYR 534 8.575 -1.453 -7.538
195 HA TYR 534 HA TYR 534 7.652 -3.916 -6.682
196 HB2 TYR 534 2HB TYR 534 10.487 -3.016 -7.255
197 HB3 TYR 534 1HB TYR 534 9.955 -4.692 -7.168
198 HD1 TYR 534 2HD TYR 534 9.691 -1.546 -9.163
199 HD2 TYR 534 1HD TYR 534 8.838 -5.730 -8.986
200 HE1 TYR 534 2HE TYR 534 9.117 -1.537 -11.547
201 HE2 TYR 534 1HE TYR 534 8.266 -5.712 -11.374
202 HH TYR 534 HH TYR 534 8.956 -3.055 -13.415
203 H PHE 535 H PHE 535 10.343 -2.015 -5.305
204 HA PHE 535 HA PHE 535 9.665 -3.125 -2.671
205 HB2 PHE 535 2HB PHE 535 12.379 -2.965 -3.956
206 HB3 PHE 535 1HB PHE 535 12.180 -3.111 -2.214
207 HD1 PHE 535 1HD PHE 535 10.977 -4.745 -5.347
208 HD2 PHE 535 2HD PHE 535 12.238 -5.215 -1.310
209 HE1 PHE 535 1HE PHE 535 10.792 -7.188 -5.579
210 HE2 PHE 535 2HE PHE 535 12.057 -7.660 -1.534
211 HZ PHE 535 HZ PHE 535 11.334 -8.648 -3.671
212 H GLY 536 H GLY 536 9.635 -0.417 -4.356
213 HA2 GLY 536 2HA GLY 536 11.171 1.484 -3.016
214 HA3 GLY 536 1HA GLY 536 9.642 1.815 -3.821
215 HA PRO 537 HA PRO 537 8.142 2.599 0.325
216 HB2 PRO 537 2HB PRO 537 5.647 3.253 -0.251
217 HB3 PRO 537 1HB PRO 537 6.959 4.254 -0.904
218 HG2 PRO 537 2HG PRO 537 5.507 1.981 -2.233
219 HG3 PRO 537 1HG PRO 537 5.730 3.636 -2.844
220 HD2 PRO 537 2HD PRO 537 7.333 1.579 -3.561
221 HD3 PRO 537 1HD PRO 537 7.950 3.240 -3.398
222 H ALA 538 H ALA 538 8.222 -0.095 -0.967
223 HA ALA 538 HA ALA 538 6.016 -1.367 0.450
224 HB1 ALA 538 1HB ALA 538 7.353 -2.428 -2.036
225 HB2 ALA 538 2HB ALA 538 5.885 -1.449 -2.077
226 HB3 ALA 538 3HB ALA 538 5.877 -3.015 -1.266
227 H ALA 539 H ALA 539 9.357 -1.104 -0.320
228 HA ALA 539 HA ALA 539 10.010 -2.896 1.842
229 HB1 ALA 539 1HB ALA 539 11.750 -4.005 0.222
230 HB2 ALA 539 2HB ALA 539 10.551 -3.559 -0.990
231 HB3 ALA 539 3HB ALA 539 10.097 -4.607 0.353
232 H GLU 540 H GLU 540 10.477 0.020 0.718
233 HA GLU 540 HA GLU 540 13.348 0.221 0.632
234 HB2 GLU 540 2HB GLU 540 12.977 2.640 0.772
235 HB3 GLU 540 1HB GLU 540 11.970 1.913 -0.469
236 HG2 GLU 540 2HG GLU 540 10.226 2.914 0.449
237 HG3 GLU 540 1HG GLU 540 10.427 1.865 1.851
238 H GLY 541 H GLY 541 13.176 -1.230 2.674
239 HA2 GLY 541 2HA GLY 541 14.122 -1.194 4.846
240 HA3 GLY 541 1HA GLY 541 13.634 0.494 4.996
241 H ILE 542 H ILE 542 11.058 -0.728 3.628
242 HA ILE 542 HA ILE 542 9.449 -0.746 5.939
243 HB ILE 542 HB ILE 542 9.084 -0.949 3.039
244 HG12 ILE 542 2HG1 ILE 542 7.207 0.071 5.162
245 HG13 ILE 542 1HG1 ILE 542 8.601 0.989 4.605
246 HG21 ILE 542 1HG2 ILE 542 6.759 -1.889 3.278
247 HG22 ILE 542 2HG2 ILE 542 7.247 -2.477 4.867
248 HG23 ILE 542 3HG2 ILE 542 8.081 -3.050 3.419
249 HD11 ILE 542 3HD1 ILE 542 6.146 0.212 3.092
250 HD12 ILE 542 1HD1 ILE 542 7.631 0.686 2.269
251 HD13 ILE 542 2HD1 ILE 542 6.828 1.816 3.359
252 H TYR 543 H TYR 543 10.603 -3.319 3.775
253 HA TYR 543 HA TYR 543 9.265 -5.502 4.670
254 HB2 TYR 543 2HB TYR 543 11.167 -6.864 4.015
255 HB3 TYR 543 1HB TYR 543 10.925 -5.556 2.860
256 HD1 TYR 543 1HD TYR 543 12.370 -3.481 3.120
257 HD2 TYR 543 2HD TYR 543 13.233 -7.161 5.043
258 HE1 TYR 543 1HE TYR 543 14.709 -2.764 3.412
259 HE2 TYR 543 2HE TYR 543 15.577 -6.468 5.347
260 HH TYR 543 HH TYR 543 17.090 -4.364 3.764
261 H ALA 544 H ALA 544 11.701 -3.731 6.403
262 HA ALA 544 HA ALA 544 12.528 -5.566 8.310
263 HB1 ALA 544 1HB ALA 544 11.966 -2.648 8.786
264 HB2 ALA 544 2HB ALA 544 13.427 -3.278 8.023
265 HB3 ALA 544 3HB ALA 544 13.064 -3.679 9.703
266 H GLU 545 H GLU 545 9.434 -4.247 7.821
267 HA GLU 545 HA GLU 545 8.278 -4.145 10.327
268 HB2 GLU 545 2HB GLU 545 6.167 -4.838 9.031
269 HB3 GLU 545 1HB GLU 545 6.986 -3.373 8.508
270 HG2 GLU 545 2HG GLU 545 6.704 -4.318 6.482
271 HG3 GLU 545 1HG GLU 545 8.211 -5.123 6.910
272 H GLY 546 H GLY 546 8.685 -6.833 8.105
273 HA2 GLY 546 2HA GLY 546 8.512 -9.090 8.359
274 HA3 GLY 546 1HA GLY 546 9.229 -8.790 9.930
275 H LEU 547 H LEU 547 6.030 -7.573 9.088
276 HA LEU 547 HA LEU 547 4.781 -9.780 10.513
277 HB2 LEU 547 2HB LEU 547 3.815 -8.565 12.224
278 HB3 LEU 547 1HB LEU 547 5.441 -7.922 12.140
279 HG LEU 547 HG LEU 547 3.125 -6.559 10.786
280 HD11 LEU 547 1HD1 LEU 547 4.105 -5.510 13.358
281 HD12 LEU 547 2HD1 LEU 547 3.117 -6.969 13.441
282 HD13 LEU 547 3HD1 LEU 547 2.479 -5.514 12.675
283 HD21 LEU 547 3HD2 LEU 547 5.491 -5.153 11.872
284 HD22 LEU 547 1HD2 LEU 547 4.554 -4.839 10.410
285 HD23 LEU 547 2HD2 LEU 547 5.730 -6.152 10.438
286 H MET 548 H MET 548 4.242 -6.708 8.806
287 HA MET 548 HA MET 548 2.455 -7.786 6.957
288 HB2 MET 548 2HB MET 548 1.259 -7.188 9.517
289 HB3 MET 548 1HB MET 548 0.532 -6.210 8.251
290 HG2 MET 548 2HG MET 548 0.321 -8.413 6.955
291 HG3 MET 548 1HG MET 548 0.616 -9.186 8.509
292 HE1 MET 548 3HE MET 548 -2.134 -10.267 7.698
293 HE2 MET 548 1HE MET 548 -2.918 -9.852 9.222
294 HE3 MET 548 2HE MET 548 -1.224 -10.341 9.206
295 H HIS 549 H HIS 549 3.779 -5.044 8.598
296 HA HIS 549 HA HIS 549 2.632 -2.936 7.204
297 HB2 HIS 549 2HB HIS 549 4.962 -3.350 8.882
298 HB3 HIS 549 1HB HIS 549 5.266 -2.149 7.632
299 HD1 HIS 549 1HD HIS 549 1.769 -2.144 8.603
300 HD2 HIS 549 2HD HIS 549 5.274 -0.408 10.008
301 HE1 HIS 549 1HE HIS 549 1.035 -0.270 10.095
302 HE2 HIS 549 2HE HIS 549 3.169 0.820 10.875
303 H ASN 550 H ASN 550 4.594 -5.393 5.911
304 HA ASN 550 HA ASN 550 5.841 -3.825 3.860
305 HB2 ASN 550 2HB ASN 550 6.888 -5.884 4.679
306 HB3 ASN 550 1HB ASN 550 5.514 -6.822 4.099
307 HD21 ASN 550 1HD2 ASN 550 5.404 -7.384 1.990
308 HD22 ASN 550 2HD2 ASN 550 6.632 -7.025 0.828
309 H GLN 551 H GLN 551 2.733 -4.231 4.240
310 HA GLN 551 HA GLN 551 1.631 -5.472 2.037
311 HB2 GLN 551 2HB GLN 551 -0.297 -3.989 2.378
312 HB3 GLN 551 1HB GLN 551 0.316 -4.612 3.905
313 HG2 GLN 551 2HG GLN 551 0.060 -2.440 4.485
314 HG3 GLN 551 1HG GLN 551 1.702 -2.365 3.851
315 HE21 GLN 551 1HE2 GLN 551 2.115 -1.233 2.011
316 HE22 GLN 551 2HE2 GLN 551 0.937 -0.269 1.194
317 H ASP 552 H ASP 552 0.191 -3.808 0.512
318 HA ASP 552 HA ASP 552 2.175 -2.142 -0.894
319 HB2 ASP 552 2HB ASP 552 0.234 -4.165 -1.950
320 HB3 ASP 552 1HB ASP 552 0.686 -2.792 -2.957
321 H GLY 553 H GLY 553 -1.348 -2.722 -0.657
322 HA2 GLY 553 2HA GLY 553 -2.722 -0.865 0.187
323 HA3 GLY 553 1HA GLY 553 -1.695 0.211 -0.745
324 H LEU 554 H LEU 554 -3.191 -2.864 -1.703
325 HA LEU 554 HA LEU 554 -3.844 -2.314 -4.243
326 HB2 LEU 554 2HB LEU 554 -6.040 -3.709 -3.702
327 HB3 LEU 554 1HB LEU 554 -4.451 -4.438 -3.798
328 HG LEU 554 HG LEU 554 -4.819 -3.597 -1.113
329 HD11 LEU 554 1HD1 LEU 554 -7.309 -3.939 -2.185
330 HD12 LEU 554 2HD1 LEU 554 -6.895 -4.118 -0.481
331 HD13 LEU 554 3HD1 LEU 554 -6.956 -5.537 -1.527
332 HD21 LEU 554 3HD2 LEU 554 -3.420 -5.417 -1.594
333 HD22 LEU 554 1HD2 LEU 554 -4.674 -6.243 -2.519
334 HD23 LEU 554 2HD2 LEU 554 -4.811 -6.116 -0.765
335 H ILE 555 H ILE 555 -6.505 -2.087 -1.892
336 HA ILE 555 HA ILE 555 -8.297 -0.688 -1.762
337 HB ILE 555 HB ILE 555 -6.553 1.340 -3.152
338 HG12 ILE 555 2HG1 ILE 555 -5.236 0.708 -1.329
339 HG13 ILE 555 1HG1 ILE 555 -6.143 2.085 -0.714
340 HG21 ILE 555 1HG2 ILE 555 -8.131 2.860 -2.724
341 HG22 ILE 555 2HG2 ILE 555 -8.395 2.250 -1.090
342 HG23 ILE 555 3HG2 ILE 555 -9.204 1.486 -2.458
343 HD11 ILE 555 3HD1 ILE 555 -6.119 0.393 0.954
344 HD12 ILE 555 1HD1 ILE 555 -6.669 -0.819 -0.201
345 HD13 ILE 555 2HD1 ILE 555 -7.749 0.482 0.288
346 H CYS 556 H CYS 556 -9.991 -1.188 -2.980
347 HA CYS 556 HA CYS 556 -9.949 -1.650 -5.733
348 HB2 CYS 556 2HB CYS 556 -12.368 -0.834 -4.117
349 HB3 CYS 556 1HB CYS 556 -12.352 -1.767 -5.611
350 H GLY 557 H GLY 557 -10.534 1.291 -3.914
351 HA2 GLY 557 2HA GLY 557 -10.089 3.432 -4.896
352 HA3 GLY 557 1HA GLY 557 -10.538 2.762 -6.459
353 H LEU 558 H LEU 558 -12.874 1.418 -5.290
354 HA LEU 558 HA LEU 558 -14.632 3.293 -4.154
355 HB2 LEU 558 2HB LEU 558 -16.008 3.808 -6.089
356 HB3 LEU 558 1HB LEU 558 -14.366 4.372 -6.335
357 HG LEU 558 HG LEU 558 -15.241 1.722 -7.453
358 HD11 LEU 558 1HD1 LEU 558 -16.757 3.731 -8.102
359 HD12 LEU 558 2HD1 LEU 558 -16.141 2.655 -9.356
360 HD13 LEU 558 3HD1 LEU 558 -15.374 4.220 -9.081
361 HD21 LEU 558 3HD2 LEU 558 -13.507 2.984 -9.184
362 HD22 LEU 558 1HD2 LEU 558 -13.088 1.732 -8.014
363 HD23 LEU 558 2HD2 LEU 558 -12.898 3.435 -7.592
364 H ARG 559 H ARG 559 -14.251 0.572 -6.314
365 HA ARG 559 HA ARG 559 -15.218 -1.512 -5.028
366 HB2 ARG 559 2HB ARG 559 -17.654 -1.684 -5.628
367 HB3 ARG 559 1HB ARG 559 -17.301 -0.490 -4.386
368 HG2 ARG 559 2HG ARG 559 -17.154 1.041 -6.605
369 HG3 ARG 559 1HG ARG 559 -18.356 -0.150 -7.104
370 HD2 ARG 559 2HD ARG 559 -19.614 0.332 -5.014
371 HD3 ARG 559 1HD ARG 559 -18.456 1.614 -4.660
372 HE ARG 559 HE ARG 559 -19.369 2.199 -7.162
373 HH11 ARG 559 1HH1 ARG 559 -20.882 1.659 -4.064
374 HH12 ARG 559 2HH1 ARG 559 -22.217 2.712 -4.392
375 HH21 ARG 559 1HH2 ARG 559 -21.123 3.585 -7.595
376 HH22 ARG 559 2HH2 ARG 559 -22.354 3.806 -6.397
377 H GLN 560 H GLN 560 -15.181 -3.261 -6.385
378 HA GLN 560 HA GLN 560 -15.775 -2.911 -9.182
379 HB2 GLN 560 2HB GLN 560 -13.538 -3.707 -9.929
380 HB3 GLN 560 1HB GLN 560 -13.502 -2.120 -9.168
381 HG2 GLN 560 2HG GLN 560 -11.818 -2.922 -7.960
382 HG3 GLN 560 1HG GLN 560 -13.050 -3.797 -7.053
383 HE21 GLN 560 1HE2 GLN 560 -10.155 -4.250 -8.138
384 HE22 GLN 560 2HE2 GLN 560 -10.222 -5.882 -8.698
Start of MODEL 13
1 H1 ALA 507 1HT ALA 507 -19.515 4.673 -1.424
2 H2 ALA 507 2HT ALA 507 -18.949 6.287 -1.283
3 H3 ALA 507 3HT ALA 507 -18.030 4.994 -0.630
4 HA ALA 507 HA ALA 507 -18.688 5.142 -3.477
5 HB1 ALA 507 2HB ALA 507 -17.511 7.237 -2.543
6 HB2 ALA 507 3HB ALA 507 -16.817 6.436 -3.952
7 HB3 ALA 507 1HB ALA 507 -16.111 6.181 -2.356
8 H GLN 508 H GLN 508 -16.194 4.338 -1.052
9 HA GLN 508 HA GLN 508 -15.262 2.137 -2.689
10 HB2 GLN 508 2HB GLN 508 -14.363 3.313 -0.068
11 HB3 GLN 508 1HB GLN 508 -13.694 1.807 -0.679
12 HG2 GLN 508 2HG GLN 508 -13.438 3.427 -2.845
13 HG3 GLN 508 1HG GLN 508 -13.207 4.565 -1.519
14 HE21 GLN 508 1HE2 GLN 508 -11.244 4.718 -0.701
15 HE22 GLN 508 2HE2 GLN 508 -9.973 3.564 -0.888
16 HA PRO 509 HA PRO 509 -17.581 -0.861 -0.355
17 HB2 PRO 509 2HB PRO 509 -16.761 -3.045 -1.646
18 HB3 PRO 509 1HB PRO 509 -17.687 -1.793 -2.483
19 HG2 PRO 509 2HG PRO 509 -14.812 -2.459 -2.684
20 HG3 PRO 509 1HG PRO 509 -15.874 -1.692 -3.873
21 HD2 PRO 509 2HD PRO 509 -14.043 -0.433 -2.042
22 HD3 PRO 509 1HD PRO 509 -15.087 0.338 -3.253
23 H LYS 510 H LYS 510 -14.822 -0.017 0.663
24 HA LYS 510 HA LYS 510 -13.362 -0.645 2.285
25 HB2 LYS 510 2HB LYS 510 -15.566 -2.644 2.724
26 HB3 LYS 510 1HB LYS 510 -14.132 -2.599 3.737
27 HG2 LYS 510 2HG LYS 510 -15.313 0.022 3.466
28 HG3 LYS 510 1HG LYS 510 -16.471 -1.153 4.090
29 HD2 LYS 510 2HD LYS 510 -15.389 -1.361 6.054
30 HD3 LYS 510 1HD LYS 510 -13.796 -1.304 5.294
31 HE2 LYS 510 2HE LYS 510 -15.302 1.219 5.233
32 HE3 LYS 510 1HE LYS 510 -14.838 0.667 6.841
33 HZ1 LYS 510 3HZ LYS 510 -12.559 0.309 5.520
34 HZ2 LYS 510 1HZ LYS 510 -12.945 1.740 6.334
35 HZ3 LYS 510 2HZ LYS 510 -13.179 1.629 4.663
36 H CYS 511 H CYS 511 -12.279 -1.261 0.079
37 HA CYS 511 HA CYS 511 -11.469 -4.089 0.241
38 HB2 CYS 511 2HB CYS 511 -12.743 -3.488 -1.819
39 HB3 CYS 511 1HB CYS 511 -11.474 -2.337 -2.221
40 H ASN 512 H ASN 512 -10.293 -1.967 1.748
41 HA ASN 512 HA ASN 512 -7.709 -1.575 0.413
42 HB2 ASN 512 2HB ASN 512 -8.413 -0.283 3.021
43 HB3 ASN 512 1HB ASN 512 -7.341 0.290 1.749
44 HD21 ASN 512 1HD2 ASN 512 -10.707 -0.220 2.617
45 HD22 ASN 512 2HD2 ASN 512 -11.354 0.990 1.568
46 HA PRO 513 HA PRO 513 -5.874 -4.534 3.114
47 HB2 PRO 513 2HB PRO 513 -3.275 -3.949 2.811
48 HB3 PRO 513 1HB PRO 513 -4.239 -4.616 1.487
49 HG2 PRO 513 2HG PRO 513 -3.429 -1.778 1.992
50 HG3 PRO 513 1HG PRO 513 -3.447 -2.682 0.472
51 HD2 PRO 513 2HD PRO 513 -5.416 -0.936 1.247
52 HD3 PRO 513 1HD PRO 513 -5.671 -2.285 0.122
53 H ASN 514 H ASN 514 -3.304 -2.286 3.731
54 HA ASN 514 HA ASN 514 -4.361 -1.698 6.409
55 HB2 ASN 514 2HB ASN 514 -1.888 -3.124 5.636
56 HB3 ASN 514 1HB ASN 514 -1.715 -1.912 6.899
57 HD21 ASN 514 1HD2 ASN 514 -3.861 -4.583 5.981
58 HD22 ASN 514 2HD2 ASN 514 -4.066 -5.197 7.583
59 H LEU 515 H LEU 515 -1.346 -1.089 4.683
60 HA LEU 515 HA LEU 515 -0.066 0.810 4.588
61 HB2 LEU 515 2HB LEU 515 -0.968 2.349 2.996
62 HB3 LEU 515 1HB LEU 515 -1.425 0.712 2.563
63 HG LEU 515 HG LEU 515 -3.569 1.578 4.067
64 HD11 LEU 515 1HD1 LEU 515 -2.220 3.896 3.373
65 HD12 LEU 515 2HD1 LEU 515 -3.904 3.769 3.882
66 HD13 LEU 515 3HD1 LEU 515 -3.499 3.759 2.166
67 HD21 LEU 515 3HD2 LEU 515 -4.704 1.730 1.843
68 HD22 LEU 515 1HD2 LEU 515 -3.799 0.241 2.112
69 HD23 LEU 515 2HD2 LEU 515 -3.123 1.511 1.093
70 H HIS 516 H HIS 516 -0.881 0.712 7.125
71 HA HIS 516 HA HIS 516 -1.881 3.398 7.761
72 HB2 HIS 516 2HB HIS 516 -2.038 0.766 9.119
73 HB3 HIS 516 1HB HIS 516 -1.870 2.179 10.157
74 HD1 HIS 516 1HD HIS 516 -3.651 4.129 8.497
75 HD2 HIS 516 2HD HIS 516 -4.692 0.242 9.537
76 HE1 HIS 516 1HE HIS 516 -6.164 4.064 8.427
77 HE2 HIS 516 2HE HIS 516 -6.773 1.730 9.157
78 H TYR 517 H TYR 517 1.017 1.716 7.507
79 HA TYR 517 HA TYR 517 2.369 2.711 9.797
80 HB2 TYR 517 2HB TYR 517 4.336 1.814 8.884
81 HB3 TYR 517 1HB TYR 517 3.074 0.764 8.258
82 HD1 TYR 517 2HD TYR 517 4.854 3.910 7.259
83 HD2 TYR 517 1HD TYR 517 3.240 0.166 6.029
84 HE1 TYR 517 2HE TYR 517 5.643 4.327 4.979
85 HE2 TYR 517 1HE TYR 517 4.030 0.577 3.745
86 HH TYR 517 HH TYR 517 4.642 2.480 2.316
87 H TRP 518 H TRP 518 1.541 4.083 6.742
88 HA TRP 518 HA TRP 518 3.260 6.392 7.247
89 HB2 TRP 518 2HB TRP 518 3.212 5.001 4.993
90 HB3 TRP 518 1HB TRP 518 1.826 6.037 4.662
91 HD1 TRP 518 HD TRP 518 2.421 8.192 3.461
92 HE1 TRP 518 1HE TRP 518 4.513 9.675 3.228
93 HE3 TRP 518 3HE TRP 518 5.557 5.653 6.589
94 HZ2 TRP 518 2HZ TRP 518 7.148 9.754 4.242
95 HZ3 TRP 518 3HZ TRP 518 7.847 6.496 6.906
96 HH2 TRP 518 HH TRP 518 8.625 8.504 5.755
97 H THR 519 H THR 519 2.449 8.278 7.617
98 HA THR 519 HA THR 519 0.367 9.098 8.838
99 HB THR 519 HB THR 519 1.796 10.774 8.026
100 HG1 THR 519 1HG THR 519 0.348 12.297 7.186
101 HG21 THR 519 3HG2 THR 519 2.530 11.041 5.945
102 HG22 THR 519 1HG2 THR 519 0.912 10.913 5.256
103 HG23 THR 519 2HG2 THR 519 1.826 9.453 5.640
104 H THR 520 H THR 520 0.007 8.721 5.295
105 HA THR 520 HA THR 520 -2.470 7.451 5.408
106 HB THR 520 HB THR 520 -3.041 9.803 6.339
107 HG1 THR 520 1HG THR 520 -5.063 9.646 5.403
108 HG21 THR 520 3HG2 THR 520 -3.694 11.447 4.679
109 HG22 THR 520 1HG2 THR 520 -3.013 10.443 3.398
110 HG23 THR 520 2HG2 THR 520 -1.957 11.150 4.621
111 H GLN 521 H GLN 521 -0.738 9.943 3.544
112 HA GLN 521 HA GLN 521 -1.691 9.520 1.038
113 HB2 GLN 521 2HB GLN 521 0.525 10.169 0.167
114 HB3 GLN 521 1HB GLN 521 -0.036 11.219 1.461
115 HG2 GLN 521 2HG GLN 521 1.415 10.062 3.039
116 HG3 GLN 521 1HG GLN 521 1.959 8.986 1.753
117 HE21 GLN 521 1HE2 GLN 521 2.766 11.635 3.483
118 HE22 GLN 521 2HE2 GLN 521 3.853 12.396 2.376
119 H ASP 522 H ASP 522 -1.090 8.286 -0.760
120 HA ASP 522 HA ASP 522 -0.979 5.571 -0.411
121 HB2 ASP 522 2HB ASP 522 -0.203 7.312 -2.737
122 HB3 ASP 522 1HB ASP 522 -0.099 5.556 -2.833
123 H GLU 523 H GLU 523 0.576 4.901 1.042
124 HA GLU 523 HA GLU 523 3.383 5.429 0.463
125 HB2 GLU 523 2HB GLU 523 3.818 4.283 2.575
126 HB3 GLU 523 1HB GLU 523 2.640 5.569 2.778
127 HG2 GLU 523 2HG GLU 523 1.602 2.848 2.260
128 HG3 GLU 523 1HG GLU 523 2.328 3.155 3.837
129 H GLY 524 H GLY 524 2.527 4.135 -1.592
130 HA2 GLY 524 2HA GLY 524 3.710 2.293 -2.673
131 HA3 GLY 524 1HA GLY 524 3.424 1.350 -1.216
132 H ALA 525 H ALA 525 0.786 3.263 -1.897
133 HA ALA 525 HA ALA 525 -0.911 1.085 -2.448
134 HB1 ALA 525 1HB ALA 525 -2.441 3.192 -3.118
135 HB2 ALA 525 2HB ALA 525 -1.192 4.009 -2.178
136 HB3 ALA 525 3HB ALA 525 -2.132 2.704 -1.451
137 H ALA 526 H ALA 526 0.757 0.570 -4.351
138 HA ALA 526 HA ALA 526 1.062 0.224 -6.563
139 HB1 ALA 526 1HB ALA 526 -1.835 1.027 -6.744
140 HB2 ALA 526 2HB ALA 526 -1.232 -0.599 -6.423
141 HB3 ALA 526 3HB ALA 526 -0.917 0.168 -7.980
142 H ILE 527 H ILE 527 2.519 1.957 -6.660
143 HA ILE 527 HA ILE 527 1.985 3.802 -8.707
144 HB ILE 527 HB ILE 527 0.764 4.983 -7.052
145 HG12 ILE 527 2HG1 ILE 527 3.395 6.436 -7.064
146 HG13 ILE 527 1HG1 ILE 527 2.500 6.203 -8.563
147 HG21 ILE 527 1HG2 ILE 527 2.078 3.772 -5.200
148 HG22 ILE 527 2HG2 ILE 527 1.406 5.374 -4.885
149 HG23 ILE 527 3HG2 ILE 527 3.123 5.193 -5.256
150 HD11 ILE 527 3HD1 ILE 527 1.962 7.983 -6.290
151 HD12 ILE 527 1HD1 ILE 527 0.552 7.195 -6.998
152 HD13 ILE 527 2HD1 ILE 527 1.608 8.184 -8.007
153 H GLY 528 H GLY 528 3.947 3.375 -5.770
154 HA2 GLY 528 2HA GLY 528 6.212 3.251 -5.455
155 HA3 GLY 528 1HA GLY 528 6.312 2.752 -7.131
156 H ALA 529 H ALA 529 4.993 5.500 -7.795
157 HA ALA 529 HA ALA 529 5.844 7.406 -8.730
158 HB1 ALA 529 1HB ALA 529 5.588 7.675 -6.081
159 HB2 ALA 529 2HB ALA 529 6.135 8.981 -7.133
160 HB3 ALA 529 3HB ALA 529 7.312 8.018 -6.239
161 H ALA 530 H ALA 530 7.491 5.109 -9.238
162 HA ALA 530 HA ALA 530 9.669 6.088 -10.507
163 HB1 ALA 530 1HB ALA 530 10.132 6.130 -7.640
164 HB2 ALA 530 2HB ALA 530 11.102 6.815 -8.944
165 HB3 ALA 530 3HB ALA 530 11.318 5.127 -8.477
166 H TRP 531 H TRP 531 8.037 4.115 -11.070
167 HA TRP 531 HA TRP 531 7.671 1.827 -11.234
168 HB2 TRP 531 2HB TRP 531 9.807 0.854 -12.414
169 HB3 TRP 531 1HB TRP 531 8.757 2.003 -13.236
170 HD1 TRP 531 HD TRP 531 11.777 2.428 -10.851
171 HE1 TRP 531 1HE TRP 531 13.394 4.136 -11.905
172 HE3 TRP 531 3HE TRP 531 9.210 3.411 -15.153
173 HZ2 TRP 531 2HZ TRP 531 13.552 5.693 -14.258
174 HZ3 TRP 531 3HZ TRP 531 10.158 5.020 -16.754
175 HH2 TRP 531 HH TRP 531 12.284 6.138 -16.314
176 H ILE 532 H ILE 532 8.239 2.318 -8.700
177 HA ILE 532 HA ILE 532 9.853 0.005 -7.954
178 HB ILE 532 HB ILE 532 11.136 2.054 -7.684
179 HG12 ILE 532 2HG1 ILE 532 10.849 1.771 -4.873
180 HG13 ILE 532 1HG1 ILE 532 10.512 0.190 -5.570
181 HG21 ILE 532 1HG2 ILE 532 10.299 3.958 -6.866
182 HG22 ILE 532 2HG2 ILE 532 9.534 3.147 -5.499
183 HG23 ILE 532 3HG2 ILE 532 8.724 3.185 -7.068
184 HD11 ILE 532 3HD1 ILE 532 12.658 0.129 -6.607
185 HD12 ILE 532 1HD1 ILE 532 12.872 0.553 -4.906
186 HD13 ILE 532 2HD1 ILE 532 12.981 1.801 -6.151
187 HA PRO 533 HA PRO 533 5.737 0.849 -5.540
188 HB2 PRO 533 2HB PRO 533 3.838 -0.340 -7.080
189 HB3 PRO 533 1HB PRO 533 4.215 1.381 -7.185
190 HG2 PRO 533 2HG PRO 533 5.139 -0.861 -8.931
191 HG3 PRO 533 1HG PRO 533 4.576 0.756 -9.390
192 HD2 PRO 533 2HD PRO 533 7.191 0.111 -9.290
193 HD3 PRO 533 1HD PRO 533 6.588 1.737 -8.903
194 H TYR 534 H TYR 534 7.212 -1.652 -7.314
195 HA TYR 534 HA TYR 534 5.941 -3.934 -6.328
196 HB2 TYR 534 2HB TYR 534 8.812 -3.544 -7.209
197 HB3 TYR 534 1HB TYR 534 8.008 -5.100 -7.022
198 HD1 TYR 534 2HD TYR 534 8.075 -1.973 -9.048
199 HD2 TYR 534 1HD TYR 534 6.570 -5.952 -8.703
200 HE1 TYR 534 2HE TYR 534 7.276 -1.875 -11.366
201 HE2 TYR 534 1HE TYR 534 5.772 -5.851 -11.024
202 HH TYR 534 HH TYR 534 5.188 -3.338 -12.664
203 H PHE 535 H PHE 535 9.061 -2.525 -5.309
204 HA PHE 535 HA PHE 535 8.479 -3.444 -2.580
205 HB2 PHE 535 2HB PHE 535 11.229 -3.566 -3.800
206 HB3 PHE 535 1HB PHE 535 10.700 -4.251 -2.270
207 HD1 PHE 535 2HD PHE 535 9.078 -6.175 -2.303
208 HD2 PHE 535 1HD PHE 535 11.082 -4.790 -5.793
209 HE1 PHE 535 2HE PHE 535 8.595 -8.310 -3.423
210 HE2 PHE 535 1HE PHE 535 10.601 -6.923 -6.921
211 HZ PHE 535 HZ PHE 535 9.357 -8.687 -5.736
212 H GLY 536 H GLY 536 8.691 -0.791 -4.290
213 HA2 GLY 536 2HA GLY 536 10.716 0.803 -3.205
214 HA3 GLY 536 1HA GLY 536 9.185 1.407 -3.827
215 HA PRO 537 HA PRO 537 8.385 2.455 0.456
216 HB2 PRO 537 2HB PRO 537 6.008 3.573 0.169
217 HB3 PRO 537 1HB PRO 537 7.398 4.315 -0.645
218 HG2 PRO 537 2HG PRO 537 5.401 2.368 -1.763
219 HG3 PRO 537 1HG PRO 537 5.855 3.957 -2.419
220 HD2 PRO 537 2HD PRO 537 6.946 1.645 -3.294
221 HD3 PRO 537 1HD PRO 537 7.882 3.156 -3.221
222 H ALA 538 H ALA 538 7.828 -0.192 -0.773
223 HA ALA 538 HA ALA 538 5.606 -1.050 0.904
224 HB1 ALA 538 1HB ALA 538 4.953 -2.623 -0.761
225 HB2 ALA 538 2HB ALA 538 6.408 -2.316 -1.713
226 HB3 ALA 538 3HB ALA 538 5.155 -1.079 -1.590
227 H ALA 539 H ALA 539 8.818 -1.386 -0.266
228 HA ALA 539 HA ALA 539 9.427 -3.263 1.828
229 HB1 ALA 539 1HB ALA 539 10.694 -4.601 -0.150
230 HB2 ALA 539 2HB ALA 539 9.211 -4.100 -0.959
231 HB3 ALA 539 3HB ALA 539 9.126 -5.045 0.526
232 H GLU 540 H GLU 540 10.251 -0.501 0.609
233 HA GLU 540 HA GLU 540 13.063 -0.832 0.057
234 HB2 GLU 540 2HB GLU 540 13.168 1.611 0.200
235 HB3 GLU 540 1HB GLU 540 11.859 1.093 -0.850
236 HG2 GLU 540 2HG GLU 540 10.301 1.421 1.080
237 HG3 GLU 540 1HG GLU 540 11.646 2.137 1.960
238 H GLY 541 H GLY 541 12.752 -2.232 2.195
239 HA2 GLY 541 2HA GLY 541 14.104 -2.365 4.175
240 HA3 GLY 541 1HA GLY 541 13.873 -0.629 4.388
241 H ILE 542 H ILE 542 10.989 -1.224 3.458
242 HA ILE 542 HA ILE 542 9.745 -1.146 5.950
243 HB ILE 542 HB ILE 542 8.891 -1.293 3.139
244 HG12 ILE 542 2HG1 ILE 542 7.507 0.010 5.471
245 HG13 ILE 542 1HG1 ILE 542 8.978 0.685 4.777
246 HG21 ILE 542 1HG2 ILE 542 7.593 -3.160 3.647
247 HG22 ILE 542 2HG2 ILE 542 6.486 -1.806 3.905
248 HG23 ILE 542 3HG2 ILE 542 7.244 -2.598 5.285
249 HD11 ILE 542 3HD1 ILE 542 7.245 1.829 3.730
250 HD12 ILE 542 1HD1 ILE 542 6.291 0.363 3.509
251 HD13 ILE 542 2HD1 ILE 542 7.749 0.618 2.552
252 H TYR 543 H TYR 543 10.163 -3.830 3.659
253 HA TYR 543 HA TYR 543 8.723 -5.829 4.765
254 HB2 TYR 543 2HB TYR 543 10.353 -7.421 3.888
255 HB3 TYR 543 1HB TYR 543 10.069 -6.110 2.745
256 HD1 TYR 543 2HD TYR 543 11.741 -4.165 2.786
257 HD2 TYR 543 1HD TYR 543 12.518 -7.958 4.519
258 HE1 TYR 543 2HE TYR 543 14.158 -3.700 2.690
259 HE2 TYR 543 1HE TYR 543 14.939 -7.516 4.435
260 HH TYR 543 HH TYR 543 16.271 -4.652 4.151
261 H ALA 544 H ALA 544 11.608 -4.419 6.106
262 HA ALA 544 HA ALA 544 12.430 -6.361 7.905
263 HB1 ALA 544 1HB ALA 544 12.385 -3.384 8.345
264 HB2 ALA 544 2HB ALA 544 13.637 -4.271 7.476
265 HB3 ALA 544 3HB ALA 544 13.393 -4.550 9.201
266 H GLU 545 H GLU 545 9.518 -4.601 7.859
267 HA GLU 545 HA GLU 545 8.798 -4.348 10.513
268 HB2 GLU 545 2HB GLU 545 6.426 -4.706 9.578
269 HB3 GLU 545 1HB GLU 545 7.358 -3.368 8.921
270 HG2 GLU 545 2HG GLU 545 6.538 -4.262 7.000
271 HG3 GLU 545 1HG GLU 545 8.045 -5.161 7.126
272 H GLY 546 H GLY 546 8.484 -7.065 8.308
273 HA2 GLY 546 2HA GLY 546 8.032 -9.274 8.635
274 HA3 GLY 546 1HA GLY 546 9.009 -9.074 10.074
275 H LEU 547 H LEU 547 5.681 -8.056 9.155
276 HA LEU 547 HA LEU 547 4.466 -9.854 10.964
277 HB2 LEU 547 2HB LEU 547 3.892 -8.558 12.794
278 HB3 LEU 547 1HB LEU 547 5.566 -8.140 12.499
279 HG LEU 547 HG LEU 547 3.301 -6.447 11.470
280 HD11 LEU 547 1HD1 LEU 547 3.062 -5.362 13.430
281 HD12 LEU 547 2HD1 LEU 547 4.747 -5.600 13.893
282 HD13 LEU 547 3HD1 LEU 547 3.583 -6.909 14.098
283 HD21 LEU 547 3HD2 LEU 547 5.970 -5.411 12.233
284 HD22 LEU 547 1HD2 LEU 547 4.890 -4.916 10.929
285 HD23 LEU 547 2HD2 LEU 547 5.859 -6.380 10.763
286 H MET 548 H MET 548 4.098 -6.708 9.356
287 HA MET 548 HA MET 548 1.947 -7.510 7.774
288 HB2 MET 548 2HB MET 548 1.210 -6.746 10.479
289 HB3 MET 548 1HB MET 548 0.409 -5.743 9.275
290 HG2 MET 548 2HG MET 548 -0.805 -7.470 8.434
291 HG3 MET 548 1HG MET 548 0.414 -8.674 8.847
292 HE1 MET 548 3HE MET 548 -2.799 -9.110 9.324
293 HE2 MET 548 1HE MET 548 -2.651 -9.984 10.849
294 HE3 MET 548 2HE MET 548 -1.500 -10.281 9.547
295 H HIS 549 H HIS 549 3.761 -4.965 9.287
296 HA HIS 549 HA HIS 549 2.756 -2.723 7.995
297 HB2 HIS 549 2HB HIS 549 5.087 -3.395 9.535
298 HB3 HIS 549 1HB HIS 549 5.543 -2.350 8.192
299 HD1 HIS 549 1HD HIS 549 2.159 -1.914 9.640
300 HD2 HIS 549 2HD HIS 549 5.937 -0.234 10.047
301 HE1 HIS 549 1HE HIS 549 1.807 0.224 10.900
302 HE2 HIS 549 2HE HIS 549 4.119 1.175 11.231
303 H ASN 550 H ASN 550 4.283 -5.391 6.547
304 HA ASN 550 HA ASN 550 5.653 -4.075 4.442
305 HB2 ASN 550 2HB ASN 550 5.828 -6.246 3.409
306 HB3 ASN 550 1HB ASN 550 6.077 -6.431 5.141
307 HD21 ASN 550 1HD2 ASN 550 4.424 -7.373 6.400
308 HD22 ASN 550 2HD2 ASN 550 3.217 -8.376 5.681
309 H GLN 551 H GLN 551 2.501 -3.850 5.056
310 HA GLN 551 HA GLN 551 0.983 -4.563 2.920
311 HB2 GLN 551 2HB GLN 551 -0.332 -2.458 3.396
312 HB3 GLN 551 1HB GLN 551 -0.041 -3.505 4.780
313 HG2 GLN 551 2HG GLN 551 2.124 -1.794 4.789
314 HG3 GLN 551 1HG GLN 551 0.775 -0.766 4.316
315 HE21 GLN 551 1HE2 GLN 551 0.971 -3.547 6.499
316 HE22 GLN 551 2HE2 GLN 551 0.370 -2.718 7.891
317 H ASP 552 H ASP 552 -0.013 -2.909 1.309
318 HA ASP 552 HA ASP 552 2.049 -1.231 0.072
319 HB2 ASP 552 2HB ASP 552 0.387 -3.077 -1.630
320 HB3 ASP 552 1HB ASP 552 1.858 -2.210 -2.061
321 H GLY 553 H GLY 553 -1.353 -2.296 -0.100
322 HA2 GLY 553 2HA GLY 553 -3.044 -0.540 0.263
323 HA3 GLY 553 1HA GLY 553 -2.047 0.509 -0.730
324 H LEU 554 H LEU 554 -3.002 -2.861 -1.269
325 HA LEU 554 HA LEU 554 -3.367 -2.900 -3.910
326 HB2 LEU 554 2HB LEU 554 -5.437 -4.438 -3.395
327 HB3 LEU 554 1HB LEU 554 -3.801 -4.943 -3.023
328 HG LEU 554 HG LEU 554 -4.643 -3.648 -0.707
329 HD11 LEU 554 1HD1 LEU 554 -6.768 -5.502 -0.710
330 HD12 LEU 554 2HD1 LEU 554 -6.957 -4.494 -2.143
331 HD13 LEU 554 3HD1 LEU 554 -6.848 -3.748 -0.548
332 HD21 LEU 554 3HD2 LEU 554 -4.963 -6.190 -0.024
333 HD22 LEU 554 1HD2 LEU 554 -3.372 -5.496 -0.335
334 HD23 LEU 554 2HD2 LEU 554 -4.180 -6.441 -1.584
335 H ILE 555 H ILE 555 -6.210 -2.283 -1.836
336 HA ILE 555 HA ILE 555 -8.134 -1.138 -2.203
337 HB ILE 555 HB ILE 555 -6.120 0.561 -3.626
338 HG12 ILE 555 2HG1 ILE 555 -6.504 2.084 -1.821
339 HG13 ILE 555 1HG1 ILE 555 -7.935 1.205 -1.301
340 HG21 ILE 555 1HG2 ILE 555 -8.000 0.972 -4.987
341 HG22 ILE 555 2HG2 ILE 555 -7.954 2.300 -3.828
342 HG23 ILE 555 3HG2 ILE 555 -9.096 0.974 -3.606
343 HD11 ILE 555 3HD1 ILE 555 -6.457 -0.704 -0.715
344 HD12 ILE 555 1HD1 ILE 555 -6.163 0.756 0.224
345 HD13 ILE 555 2HD1 ILE 555 -5.074 0.319 -1.089
346 H CYS 556 H CYS 556 -9.794 -1.832 -3.341
347 HA CYS 556 HA CYS 556 -9.555 -3.178 -5.798
348 HB2 CYS 556 2HB CYS 556 -11.826 -2.231 -4.118
349 HB3 CYS 556 1HB CYS 556 -12.170 -2.688 -5.782
350 H GLY 557 H GLY 557 -10.269 0.161 -5.011
351 HA2 GLY 557 2HA GLY 557 -9.778 1.913 -6.567
352 HA3 GLY 557 1HA GLY 557 -10.102 0.784 -7.879
353 H LEU 558 H LEU 558 -12.504 -0.228 -6.561
354 HA LEU 558 HA LEU 558 -14.365 1.839 -6.153
355 HB2 LEU 558 2HB LEU 558 -15.595 1.684 -8.257
356 HB3 LEU 558 1HB LEU 558 -13.959 2.259 -8.516
357 HG LEU 558 HG LEU 558 -14.689 -0.636 -8.919
358 HD11 LEU 558 1HD1 LEU 558 -16.060 1.059 -10.307
359 HD12 LEU 558 2HD1 LEU 558 -15.261 -0.280 -11.132
360 HD13 LEU 558 3HD1 LEU 558 -14.544 1.331 -11.166
361 HD21 LEU 558 3HD2 LEU 558 -12.715 -0.046 -10.657
362 HD22 LEU 558 1HD2 LEU 558 -12.444 -0.666 -9.028
363 HD23 LEU 558 2HD2 LEU 558 -12.328 1.068 -9.346
364 H ARG 559 H ARG 559 -13.807 -1.379 -7.414
365 HA ARG 559 HA ARG 559 -14.849 -3.027 -5.634
366 HB2 ARG 559 2HB ARG 559 -17.228 -3.444 -6.328
367 HB3 ARG 559 1HB ARG 559 -16.985 -1.925 -5.477
368 HG2 ARG 559 2HG ARG 559 -16.655 -1.350 -8.199
369 HG3 ARG 559 1HG ARG 559 -18.062 -2.405 -8.086
370 HD2 ARG 559 2HD ARG 559 -18.537 -0.714 -6.028
371 HD3 ARG 559 1HD ARG 559 -17.676 0.355 -7.136
372 HE ARG 559 HE ARG 559 -19.809 -1.161 -8.349
373 HH11 ARG 559 1HH1 ARG 559 -18.945 1.793 -6.699
374 HH12 ARG 559 2HH1 ARG 559 -20.292 2.681 -7.324
375 HH21 ARG 559 1HH2 ARG 559 -21.580 0.008 -9.170
376 HH22 ARG 559 2HH2 ARG 559 -21.789 1.669 -8.725
377 H GLN 560 H GLN 560 -14.657 -5.084 -6.410
378 HA GLN 560 HA GLN 560 -15.040 -5.587 -9.222
379 HB2 GLN 560 2HB GLN 560 -12.664 -4.698 -8.856
380 HB3 GLN 560 1HB GLN 560 -12.344 -6.229 -8.047
381 HG2 GLN 560 2HG GLN 560 -13.234 -7.309 -10.195
382 HG3 GLN 560 1HG GLN 560 -12.998 -5.719 -10.918
383 HE21 GLN 560 1HE2 GLN 560 -11.500 -8.585 -9.778
384 HE22 GLN 560 2HE2 GLN 560 -9.877 -8.176 -10.206
Start of MODEL 14
1 H1 ALA 507 1HT ALA 507 -18.054 6.899 0.512
2 H2 ALA 507 2HT ALA 507 -16.698 6.602 -0.498
3 H3 ALA 507 3HT ALA 507 -16.715 6.014 1.115
4 HA ALA 507 HA ALA 507 -18.501 4.562 0.617
5 HB1 ALA 507 2HB ALA 507 -19.576 4.454 -1.433
6 HB2 ALA 507 3HB ALA 507 -18.271 5.288 -2.277
7 HB3 ALA 507 1HB ALA 507 -19.349 6.189 -1.209
8 H GLN 508 H GLN 508 -17.219 2.877 1.056
9 HA GLN 508 HA GLN 508 -15.379 1.985 -1.052
10 HB2 GLN 508 2HB GLN 508 -13.812 1.221 0.750
11 HB3 GLN 508 1HB GLN 508 -13.950 2.967 0.594
12 HG2 GLN 508 2HG GLN 508 -15.844 2.497 2.451
13 HG3 GLN 508 1HG GLN 508 -14.712 1.195 2.810
14 HE21 GLN 508 1HE2 GLN 508 -15.524 4.013 3.920
15 HE22 GLN 508 2HE2 GLN 508 -13.996 4.684 4.362
16 HA PRO 509 HA PRO 509 -17.381 -1.893 -0.139
17 HB2 PRO 509 2HB PRO 509 -16.293 -3.323 -2.108
18 HB3 PRO 509 1HB PRO 509 -17.360 -1.960 -2.466
19 HG2 PRO 509 2HG PRO 509 -14.424 -2.176 -2.750
20 HG3 PRO 509 1HG PRO 509 -15.565 -1.145 -3.625
21 HD2 PRO 509 2HD PRO 509 -13.915 -0.463 -1.366
22 HD3 PRO 509 1HD PRO 509 -15.042 0.581 -2.256
23 H LYS 510 H LYS 510 -14.754 -1.176 1.251
24 HA LYS 510 HA LYS 510 -13.227 -2.185 2.593
25 HB2 LYS 510 2HB LYS 510 -15.140 -4.468 2.154
26 HB3 LYS 510 1HB LYS 510 -13.739 -4.600 3.205
27 HG2 LYS 510 2HG LYS 510 -14.732 -2.449 4.308
28 HG3 LYS 510 1HG LYS 510 -16.229 -3.009 3.556
29 HD2 LYS 510 2HD LYS 510 -14.502 -4.742 5.316
30 HD3 LYS 510 1HD LYS 510 -15.855 -3.784 5.921
31 HE2 LYS 510 2HE LYS 510 -16.166 -5.757 3.677
32 HE3 LYS 510 1HE LYS 510 -16.307 -6.232 5.368
33 HZ1 LYS 510 3HZ LYS 510 -17.878 -3.934 4.488
34 HZ2 LYS 510 1HZ LYS 510 -18.263 -5.143 5.607
35 HZ3 LYS 510 2HZ LYS 510 -18.378 -5.458 3.950
36 H CYS 511 H CYS 511 -12.263 -1.834 0.168
37 HA CYS 511 HA CYS 511 -10.982 -4.384 -0.565
38 HB2 CYS 511 2HB CYS 511 -12.437 -3.339 -2.319
39 HB3 CYS 511 1HB CYS 511 -11.351 -1.954 -2.325
40 H ASN 512 H ASN 512 -10.108 -2.634 1.551
41 HA ASN 512 HA ASN 512 -7.575 -1.644 0.424
42 HB2 ASN 512 2HB ASN 512 -7.451 -0.151 2.388
43 HB3 ASN 512 1HB ASN 512 -8.899 0.143 1.430
44 HD21 ASN 512 1HD2 ASN 512 -10.847 -0.051 2.358
45 HD22 ASN 512 2HD2 ASN 512 -11.112 -0.549 3.991
46 HA PRO 513 HA PRO 513 -5.709 -4.748 2.971
47 HB2 PRO 513 2HB PRO 513 -3.156 -4.333 2.389
48 HB3 PRO 513 1HB PRO 513 -4.287 -4.815 1.120
49 HG2 PRO 513 2HG PRO 513 -3.225 -2.095 1.774
50 HG3 PRO 513 1HG PRO 513 -3.420 -2.865 0.192
51 HD2 PRO 513 2HD PRO 513 -5.212 -1.088 1.324
52 HD3 PRO 513 1HD PRO 513 -5.612 -2.243 0.042
53 H ASN 514 H ASN 514 -3.106 -4.344 4.071
54 HA ASN 514 HA ASN 514 -3.615 -3.526 6.645
55 HB2 ASN 514 2HB ASN 514 -1.201 -3.985 5.010
56 HB3 ASN 514 1HB ASN 514 -0.968 -3.015 6.458
57 HD21 ASN 514 1HD2 ASN 514 -1.175 -6.116 5.218
58 HD22 ASN 514 2HD2 ASN 514 -1.303 -6.986 6.705
59 H LEU 515 H LEU 515 -1.435 -1.730 4.538
60 HA LEU 515 HA LEU 515 -0.724 0.441 4.658
61 HB2 LEU 515 2HB LEU 515 -2.381 1.935 3.794
62 HB3 LEU 515 1HB LEU 515 -2.574 0.357 3.055
63 HG LEU 515 HG LEU 515 -4.308 0.223 5.174
64 HD11 LEU 515 1HD1 LEU 515 -3.761 2.948 4.865
65 HD12 LEU 515 2HD1 LEU 515 -5.069 2.213 5.791
66 HD13 LEU 515 3HD1 LEU 515 -5.335 2.686 4.112
67 HD21 LEU 515 3HD2 LEU 515 -4.529 0.684 2.262
68 HD22 LEU 515 1HD2 LEU 515 -5.984 0.907 3.233
69 HD23 LEU 515 2HD2 LEU 515 -5.140 -0.642 3.253
70 H HIS 516 H HIS 516 -0.717 -0.419 7.189
71 HA HIS 516 HA HIS 516 -2.126 1.616 8.765
72 HB2 HIS 516 2HB HIS 516 -0.918 -1.043 9.499
73 HB3 HIS 516 1HB HIS 516 -1.414 0.132 10.713
74 HD1 HIS 516 1HD HIS 516 -3.977 0.900 8.758
75 HD2 HIS 516 2HD HIS 516 -2.979 -2.754 10.465
76 HE1 HIS 516 1HE HIS 516 -6.124 -0.403 8.855
77 HE2 HIS 516 2HE HIS 516 -5.511 -2.583 9.962
78 H TYR 517 H TYR 517 0.933 1.083 7.443
79 HA TYR 517 HA TYR 517 2.344 2.280 9.690
80 HB2 TYR 517 2HB TYR 517 4.340 1.674 8.667
81 HB3 TYR 517 1HB TYR 517 3.253 0.396 8.143
82 HD1 TYR 517 1HD TYR 517 4.327 3.789 6.965
83 HD2 TYR 517 2HD TYR 517 3.431 -0.243 5.936
84 HE1 TYR 517 1HE TYR 517 4.892 4.267 4.634
85 HE2 TYR 517 2HE TYR 517 3.997 0.225 3.598
86 HH TYR 517 HH TYR 517 5.678 2.943 2.621
87 H TRP 518 H TRP 518 0.959 3.217 6.664
88 HA TRP 518 HA TRP 518 2.151 5.883 6.930
89 HB2 TRP 518 2HB TRP 518 2.443 4.450 4.768
90 HB3 TRP 518 1HB TRP 518 0.783 4.932 4.439
91 HD1 TRP 518 HD TRP 518 0.472 7.193 3.259
92 HE1 TRP 518 1HE TRP 518 1.988 9.201 2.721
93 HE3 TRP 518 3HE TRP 518 4.637 5.788 5.867
94 HZ2 TRP 518 2HZ TRP 518 4.604 10.075 3.321
95 HZ3 TRP 518 3HZ TRP 518 6.605 7.266 5.834
96 HH2 TRP 518 HH TRP 518 6.587 9.364 4.585
97 H THR 519 H THR 519 0.884 7.452 7.502
98 HA THR 519 HA THR 519 -1.404 7.667 8.634
99 HB THR 519 HB THR 519 -0.357 9.683 8.068
100 HG1 THR 519 1HG THR 519 -2.711 9.734 6.494
101 HG21 THR 519 3HG2 THR 519 -1.016 9.865 5.243
102 HG22 THR 519 1HG2 THR 519 0.153 8.596 5.614
103 HG23 THR 519 2HG2 THR 519 0.477 10.263 6.094
104 H THR 520 H THR 520 -1.462 7.572 5.055
105 HA THR 520 HA THR 520 -3.605 5.782 4.877
106 HB THR 520 HB THR 520 -4.728 7.883 5.880
107 HG1 THR 520 1HG THR 520 -5.726 6.713 3.499
108 HG21 THR 520 3HG2 THR 520 -5.547 9.500 4.242
109 HG22 THR 520 1HG2 THR 520 -4.506 8.779 3.013
110 HG23 THR 520 2HG2 THR 520 -3.794 9.575 4.418
111 H GLN 521 H GLN 521 -2.154 8.647 3.395
112 HA GLN 521 HA GLN 521 -2.769 8.413 0.777
113 HB2 GLN 521 2HB GLN 521 -0.876 9.806 2.199
114 HB3 GLN 521 1HB GLN 521 0.108 8.813 1.132
115 HG2 GLN 521 2HG GLN 521 -0.272 10.203 -0.536
116 HG3 GLN 521 1HG GLN 521 -2.004 9.905 -0.406
117 HE21 GLN 521 1HE2 GLN 521 -2.754 11.923 -0.751
118 HE22 GLN 521 2HE2 GLN 521 -2.414 13.278 0.266
119 H ASP 522 H ASP 522 -1.805 7.467 -1.066
120 HA ASP 522 HA ASP 522 -1.474 4.739 -0.989
121 HB2 ASP 522 2HB ASP 522 -0.612 6.798 -3.009
122 HB3 ASP 522 1HB ASP 522 -0.351 5.077 -3.278
123 H GLU 523 H GLU 523 -0.028 4.125 0.626
124 HA GLU 523 HA GLU 523 2.760 4.934 0.381
125 HB2 GLU 523 2HB GLU 523 3.085 3.787 2.486
126 HB3 GLU 523 1HB GLU 523 1.714 4.872 2.595
127 HG2 GLU 523 2HG GLU 523 1.191 2.035 1.905
128 HG3 GLU 523 1HG GLU 523 1.635 2.422 3.566
129 H GLY 524 H GLY 524 2.314 3.728 -1.807
130 HA2 GLY 524 2HA GLY 524 3.706 2.069 -2.888
131 HA3 GLY 524 1HA GLY 524 3.439 1.022 -1.498
132 H ALA 525 H ALA 525 0.708 2.763 -2.402
133 HA ALA 525 HA ALA 525 -0.801 0.474 -3.033
134 HB1 ALA 525 1HB ALA 525 -1.372 3.416 -3.275
135 HB2 ALA 525 2HB ALA 525 -1.912 2.298 -2.022
136 HB3 ALA 525 3HB ALA 525 -2.563 2.173 -3.655
137 H ALA 526 H ALA 526 1.071 0.039 -4.792
138 HA ALA 526 HA ALA 526 1.574 -0.319 -6.968
139 HB1 ALA 526 1HB ALA 526 -1.271 0.276 -7.676
140 HB2 ALA 526 2HB ALA 526 -0.846 -1.172 -6.763
141 HB3 ALA 526 3HB ALA 526 -0.177 -0.916 -8.375
142 H ILE 527 H ILE 527 2.877 1.488 -7.142
143 HA ILE 527 HA ILE 527 2.270 3.232 -9.244
144 HB ILE 527 HB ILE 527 0.887 4.349 -7.660
145 HG12 ILE 527 2HG1 ILE 527 3.400 6.007 -7.712
146 HG13 ILE 527 1HG1 ILE 527 2.496 5.675 -9.187
147 HG21 ILE 527 1HG2 ILE 527 1.454 4.906 -5.499
148 HG22 ILE 527 2HG2 ILE 527 3.186 4.821 -5.829
149 HG23 ILE 527 3HG2 ILE 527 2.232 3.338 -5.726
150 HD11 ILE 527 3HD1 ILE 527 1.344 7.509 -8.710
151 HD12 ILE 527 1HD1 ILE 527 1.959 7.563 -7.059
152 HD13 ILE 527 2HD1 ILE 527 0.561 6.560 -7.446
153 H GLY 528 H GLY 528 4.128 3.017 -6.223
154 HA2 GLY 528 2HA GLY 528 6.375 3.095 -5.805
155 HA3 GLY 528 1HA GLY 528 6.592 2.558 -7.456
156 H ALA 529 H ALA 529 5.107 5.191 -8.254
157 HA ALA 529 HA ALA 529 5.846 7.142 -9.180
158 HB1 ALA 529 1HB ALA 529 6.081 8.767 -7.606
159 HB2 ALA 529 2HB ALA 529 7.225 7.829 -6.646
160 HB3 ALA 529 3HB ALA 529 5.501 7.463 -6.569
161 H ALA 530 H ALA 530 7.656 4.896 -9.535
162 HA ALA 530 HA ALA 530 9.784 5.990 -10.830
163 HB1 ALA 530 1HB ALA 530 11.397 5.140 -8.679
164 HB2 ALA 530 2HB ALA 530 10.181 6.215 -7.990
165 HB3 ALA 530 3HB ALA 530 11.211 6.779 -9.305
166 H TRP 531 H TRP 531 8.247 3.890 -11.322
167 HA TRP 531 HA TRP 531 8.042 1.575 -11.408
168 HB2 TRP 531 2HB TRP 531 10.178 0.715 -12.651
169 HB3 TRP 531 1HB TRP 531 9.053 1.806 -13.453
170 HD1 TRP 531 HD TRP 531 12.089 2.461 -11.127
171 HE1 TRP 531 1HE TRP 531 13.598 4.212 -12.266
172 HE3 TRP 531 3HE TRP 531 9.433 3.130 -15.439
173 HZ2 TRP 531 2HZ TRP 531 13.651 5.680 -14.678
174 HZ3 TRP 531 3HZ TRP 531 10.279 4.725 -17.111
175 HH2 TRP 531 HH TRP 531 12.344 5.973 -16.737
176 H ILE 532 H ILE 532 8.643 2.146 -8.904
177 HA ILE 532 HA ILE 532 10.417 -0.052 -8.181
178 HB ILE 532 HB ILE 532 11.570 2.112 -8.018
179 HG12 ILE 532 2HG1 ILE 532 11.020 1.020 -5.253
180 HG13 ILE 532 1HG1 ILE 532 11.990 0.154 -6.435
181 HG21 ILE 532 1HG2 ILE 532 9.214 3.133 -7.325
182 HG22 ILE 532 2HG2 ILE 532 10.747 3.910 -6.908
183 HG23 ILE 532 3HG2 ILE 532 9.903 2.928 -5.710
184 HD11 ILE 532 3HD1 ILE 532 12.637 2.954 -5.593
185 HD12 ILE 532 1HD1 ILE 532 13.676 1.771 -6.388
186 HD13 ILE 532 2HD1 ILE 532 13.212 1.544 -4.700
187 HA PRO 533 HA PRO 533 6.369 0.658 -5.604
188 HB2 PRO 533 2HB PRO 533 4.513 -0.762 -7.018
189 HB3 PRO 533 1HB PRO 533 4.716 0.984 -7.160
190 HG2 PRO 533 2HG PRO 533 5.736 -1.185 -8.937
191 HG3 PRO 533 1HG PRO 533 5.046 0.388 -9.370
192 HD2 PRO 533 2HD PRO 533 7.701 -0.093 -9.391
193 HD3 PRO 533 1HD PRO 533 7.014 1.496 -9.002
194 H TYR 534 H TYR 534 7.939 -1.806 -7.343
195 HA TYR 534 HA TYR 534 6.916 -4.137 -6.218
196 HB2 TYR 534 2HB TYR 534 9.719 -3.539 -7.202
197 HB3 TYR 534 1HB TYR 534 9.050 -5.147 -6.947
198 HD1 TYR 534 1HD TYR 534 8.829 -2.096 -9.085
199 HD2 TYR 534 2HD TYR 534 7.622 -6.159 -8.550
200 HE1 TYR 534 1HE TYR 534 7.970 -2.149 -11.380
201 HE2 TYR 534 2HE TYR 534 6.764 -6.204 -10.851
202 HH TYR 534 HH TYR 534 5.884 -4.336 -12.527
203 H PHE 535 H PHE 535 9.824 -2.277 -5.317
204 HA PHE 535 HA PHE 535 9.494 -3.254 -2.566
205 HB2 PHE 535 2HB PHE 535 12.039 -3.268 -2.442
206 HB3 PHE 535 1HB PHE 535 11.282 -4.570 -3.354
207 HD1 PHE 535 1HD PHE 535 13.255 -1.490 -3.582
208 HD2 PHE 535 2HD PHE 535 11.558 -4.748 -5.731
209 HE1 PHE 535 1HE PHE 535 14.633 -0.913 -5.536
210 HE2 PHE 535 2HE PHE 535 12.934 -4.177 -7.690
211 HZ PHE 535 HZ PHE 535 14.475 -2.258 -7.593
212 H GLY 536 H GLY 536 9.197 -0.630 -4.310
213 HA2 GLY 536 2HA GLY 536 10.941 1.301 -3.262
214 HA3 GLY 536 1HA GLY 536 9.340 1.626 -3.914
215 HA PRO 537 HA PRO 537 8.346 2.622 0.342
216 HB2 PRO 537 2HB PRO 537 5.856 3.435 -0.002
217 HB3 PRO 537 1HB PRO 537 7.161 4.330 -0.804
218 HG2 PRO 537 2HG PRO 537 5.423 2.148 -1.927
219 HG3 PRO 537 1HG PRO 537 5.713 3.769 -2.600
220 HD2 PRO 537 2HD PRO 537 7.077 1.569 -3.405
221 HD3 PRO 537 1HD PRO 537 7.822 3.184 -3.369
222 H ALA 538 H ALA 538 8.104 -0.102 -0.878
223 HA ALA 538 HA ALA 538 5.984 -1.175 0.810
224 HB1 ALA 538 1HB ALA 538 5.456 -2.788 -0.825
225 HB2 ALA 538 2HB ALA 538 6.931 -2.460 -1.739
226 HB3 ALA 538 3HB ALA 538 5.620 -1.279 -1.725
227 H ALA 539 H ALA 539 9.229 -1.136 -0.282
228 HA ALA 539 HA ALA 539 9.993 -2.940 1.821
229 HB1 ALA 539 1HB ALA 539 11.199 -4.504 0.431
230 HB2 ALA 539 2HB ALA 539 10.671 -3.646 -1.015
231 HB3 ALA 539 3HB ALA 539 9.490 -4.475 -0.001
232 H GLU 540 H GLU 540 10.531 -0.095 0.611
233 HA GLU 540 HA GLU 540 13.380 -0.113 0.165
234 HB2 GLU 540 2HB GLU 540 13.206 2.334 0.302
235 HB3 GLU 540 1HB GLU 540 12.024 1.665 -0.811
236 HG2 GLU 540 2HG GLU 540 10.407 1.754 1.183
237 HG3 GLU 540 1HG GLU 540 11.594 2.841 1.904
238 H GLY 541 H GLY 541 13.293 -1.525 2.255
239 HA2 GLY 541 2HA GLY 541 14.484 -1.547 4.305
240 HA3 GLY 541 1HA GLY 541 14.171 0.180 4.469
241 H ILE 542 H ILE 542 11.362 -0.865 3.410
242 HA ILE 542 HA ILE 542 10.021 -0.683 5.884
243 HB ILE 542 HB ILE 542 9.316 -0.897 3.051
244 HG12 ILE 542 2HG1 ILE 542 7.813 0.300 5.375
245 HG13 ILE 542 1HG1 ILE 542 9.165 1.100 4.580
246 HG21 ILE 542 1HG2 ILE 542 6.946 -1.627 3.596
247 HG22 ILE 542 2HG2 ILE 542 7.601 -2.287 5.093
248 HG23 ILE 542 3HG2 ILE 542 8.177 -2.891 3.537
249 HD11 ILE 542 3HD1 ILE 542 7.514 2.038 3.384
250 HD12 ILE 542 1HD1 ILE 542 6.401 0.703 3.672
251 HD13 ILE 542 2HD1 ILE 542 7.657 0.551 2.446
252 H TYR 543 H TYR 543 10.789 -3.393 3.729
253 HA TYR 543 HA TYR 543 9.359 -5.446 4.757
254 HB2 TYR 543 2HB TYR 543 11.229 -6.953 4.151
255 HB3 TYR 543 1HB TYR 543 10.853 -5.778 2.893
256 HD1 TYR 543 2HD TYR 543 12.306 -3.743 2.688
257 HD2 TYR 543 1HD TYR 543 13.377 -7.077 5.080
258 HE1 TYR 543 2HE TYR 543 14.653 -2.994 2.657
259 HE2 TYR 543 1HE TYR 543 15.730 -6.347 5.066
260 HH TYR 543 HH TYR 543 17.197 -4.903 3.467
261 H ALA 544 H ALA 544 12.002 -3.818 6.330
262 HA ALA 544 HA ALA 544 12.803 -5.637 8.245
263 HB1 ALA 544 1HB ALA 544 12.378 -2.692 8.703
264 HB2 ALA 544 2HB ALA 544 13.782 -3.391 7.896
265 HB3 ALA 544 3HB ALA 544 13.466 -3.757 9.592
266 H GLU 545 H GLU 545 9.757 -4.125 7.891
267 HA GLU 545 HA GLU 545 8.739 -4.013 10.458
268 HB2 GLU 545 2HB GLU 545 6.518 -4.514 9.269
269 HB3 GLU 545 1HB GLU 545 7.411 -3.099 8.730
270 HG2 GLU 545 2HG GLU 545 6.889 -3.993 6.715
271 HG3 GLU 545 1HG GLU 545 8.408 -4.835 7.002
272 H GLY 546 H GLY 546 8.850 -6.668 8.156
273 HA2 GLY 546 2HA GLY 546 8.539 -8.914 8.376
274 HA3 GLY 546 1HA GLY 546 9.365 -8.695 9.905
275 H LEU 547 H LEU 547 6.069 -7.886 8.711
276 HA LEU 547 HA LEU 547 4.838 -9.824 10.362
277 HB2 LEU 547 2HB LEU 547 3.997 -8.626 12.150
278 HB3 LEU 547 1HB LEU 547 5.645 -8.049 12.015
279 HG LEU 547 HG LEU 547 3.310 -6.556 10.837
280 HD11 LEU 547 1HD1 LEU 547 2.906 -5.466 12.782
281 HD12 LEU 547 2HD1 LEU 547 4.559 -5.659 13.364
282 HD13 LEU 547 3HD1 LEU 547 3.429 -7.010 13.454
283 HD21 LEU 547 3HD2 LEU 547 5.911 -5.399 11.732
284 HD22 LEU 547 1HD2 LEU 547 4.780 -4.809 10.515
285 HD23 LEU 547 2HD2 LEU 547 5.798 -6.207 10.169
286 H MET 548 H MET 548 4.323 -6.645 8.836
287 HA MET 548 HA MET 548 2.423 -7.610 7.016
288 HB2 MET 548 2HB MET 548 0.337 -6.915 7.878
289 HB3 MET 548 1HB MET 548 1.111 -7.804 9.181
290 HG2 MET 548 2HG MET 548 1.905 -5.482 9.983
291 HG3 MET 548 1HG MET 548 0.638 -4.866 8.926
292 HE1 MET 548 3HE MET 548 -0.082 -7.612 12.563
293 HE2 MET 548 1HE MET 548 1.490 -6.950 12.115
294 HE3 MET 548 2HE MET 548 0.723 -8.168 11.096
295 H HIS 549 H HIS 549 3.770 -4.918 8.778
296 HA HIS 549 HA HIS 549 2.746 -2.758 7.398
297 HB2 HIS 549 2HB HIS 549 5.119 -3.289 9.031
298 HB3 HIS 549 1HB HIS 549 5.325 -1.970 7.882
299 HD1 HIS 549 1HD HIS 549 1.883 -2.307 9.030
300 HD2 HIS 549 2HD HIS 549 5.317 -0.349 10.308
301 HE1 HIS 549 1HE HIS 549 1.095 -0.570 10.653
302 HE2 HIS 549 2HE HIS 549 3.178 0.665 11.352
303 H ASN 550 H ASN 550 4.733 -5.225 6.122
304 HA ASN 550 HA ASN 550 6.058 -3.669 4.129
305 HB2 ASN 550 2HB ASN 550 6.555 -5.928 3.117
306 HB3 ASN 550 1HB ASN 550 7.099 -5.713 4.778
307 HD21 ASN 550 1HD2 ASN 550 7.126 -8.093 4.650
308 HD22 ASN 550 2HD2 ASN 550 5.674 -8.944 5.039
309 H GLN 551 H GLN 551 2.892 -4.136 4.450
310 HA GLN 551 HA GLN 551 1.857 -5.197 2.131
311 HB2 GLN 551 2HB GLN 551 -0.073 -3.667 2.532
312 HB3 GLN 551 1HB GLN 551 0.436 -4.558 3.961
313 HG2 GLN 551 2HG GLN 551 0.185 -2.481 4.855
314 HG3 GLN 551 1HG GLN 551 1.882 -2.415 4.393
315 HE21 GLN 551 1HE2 GLN 551 -1.135 -2.044 2.557
316 HE22 GLN 551 2HE2 GLN 551 -0.747 -0.491 1.909
317 H ASP 552 H ASP 552 0.443 -3.500 0.673
318 HA ASP 552 HA ASP 552 2.384 -1.630 -0.519
319 HB2 ASP 552 2HB ASP 552 0.520 -3.575 -1.877
320 HB3 ASP 552 1HB ASP 552 1.224 -2.200 -2.724
321 H GLY 553 H GLY 553 -1.102 -2.448 -0.489
322 HA2 GLY 553 2HA GLY 553 -2.623 -0.729 0.400
323 HA3 GLY 553 1HA GLY 553 -1.626 0.461 -0.420
324 H LEU 554 H LEU 554 -2.900 -2.638 -1.613
325 HA LEU 554 HA LEU 554 -3.455 -2.034 -4.150
326 HB2 LEU 554 2HB LEU 554 -5.632 -3.479 -3.805
327 HB3 LEU 554 1HB LEU 554 -4.031 -4.185 -3.734
328 HG LEU 554 HG LEU 554 -4.685 -3.338 -1.109
329 HD11 LEU 554 1HD1 LEU 554 -6.809 -3.873 -0.694
330 HD12 LEU 554 2HD1 LEU 554 -6.736 -5.316 -1.705
331 HD13 LEU 554 3HD1 LEU 554 -7.047 -3.742 -2.436
332 HD21 LEU 554 3HD2 LEU 554 -4.525 -6.069 -2.368
333 HD22 LEU 554 1HD2 LEU 554 -4.519 -5.746 -0.634
334 HD23 LEU 554 2HD2 LEU 554 -3.195 -5.164 -1.645
335 H ILE 555 H ILE 555 -6.209 -1.852 -1.894
336 HA ILE 555 HA ILE 555 -8.036 -0.487 -1.847
337 HB ILE 555 HB ILE 555 -6.280 1.607 -3.111
338 HG12 ILE 555 2HG1 ILE 555 -5.145 0.531 -1.180
339 HG13 ILE 555 1HG1 ILE 555 -5.519 2.231 -0.909
340 HG21 ILE 555 1HG2 ILE 555 -8.405 2.069 -1.063
341 HG22 ILE 555 2HG2 ILE 555 -8.818 1.897 -2.769
342 HG23 ILE 555 3HG2 ILE 555 -7.734 3.188 -2.249
343 HD11 ILE 555 3HD1 ILE 555 -6.523 -0.169 0.437
344 HD12 ILE 555 1HD1 ILE 555 -7.717 1.085 0.114
345 HD13 ILE 555 2HD1 ILE 555 -6.272 1.463 1.051
346 H CYS 556 H CYS 556 -9.596 -1.115 -3.217
347 HA CYS 556 HA CYS 556 -9.361 -1.361 -5.989
348 HB2 CYS 556 2HB CYS 556 -11.673 -1.227 -4.098
349 HB3 CYS 556 1HB CYS 556 -11.981 -1.152 -5.829
350 H GLY 557 H GLY 557 -10.272 1.376 -4.000
351 HA2 GLY 557 2HA GLY 557 -9.931 3.613 -4.784
352 HA3 GLY 557 1HA GLY 557 -10.227 3.041 -6.421
353 H LEU 558 H LEU 558 -12.534 1.455 -5.544
354 HA LEU 558 HA LEU 558 -14.491 3.086 -4.371
355 HB2 LEU 558 2HB LEU 558 -15.756 3.752 -6.324
356 HB3 LEU 558 1HB LEU 558 -14.132 4.407 -6.407
357 HG LEU 558 HG LEU 558 -14.773 1.849 -7.836
358 HD11 LEU 558 1HD1 LEU 558 -16.504 3.491 -8.473
359 HD12 LEU 558 2HD1 LEU 558 -15.427 3.067 -9.804
360 HD13 LEU 558 3HD1 LEU 558 -15.228 4.605 -8.963
361 HD21 LEU 558 3HD2 LEU 558 -12.557 3.685 -7.650
362 HD22 LEU 558 1HD2 LEU 558 -13.085 3.492 -9.322
363 HD23 LEU 558 2HD2 LEU 558 -12.631 2.077 -8.373
364 H ARG 559 H ARG 559 -13.768 0.625 -6.748
365 HA ARG 559 HA ARG 559 -14.668 -1.636 -5.798
366 HB2 ARG 559 2HB ARG 559 -17.071 -1.884 -6.512
367 HB3 ARG 559 1HB ARG 559 -16.831 -0.848 -5.112
368 HG2 ARG 559 2HG ARG 559 -16.718 0.940 -7.173
369 HG3 ARG 559 1HG ARG 559 -17.899 -0.231 -7.757
370 HD2 ARG 559 2HD ARG 559 -18.779 0.062 -5.245
371 HD3 ARG 559 1HD ARG 559 -18.050 1.650 -5.479
372 HE ARG 559 HE ARG 559 -19.711 0.955 -7.673
373 HH11 ARG 559 1HH1 ARG 559 -19.823 2.070 -4.368
374 HH12 ARG 559 2HH1 ARG 559 -21.344 2.875 -4.559
375 HH21 ARG 559 1HH2 ARG 559 -21.711 2.015 -7.926
376 HH22 ARG 559 2HH2 ARG 559 -22.416 2.843 -6.579
377 H GLN 560 H GLN 560 -14.533 -3.218 -7.353
378 HA GLN 560 HA GLN 560 -15.031 -2.558 -10.114
379 HB2 GLN 560 2HB GLN 560 -12.768 -3.073 -10.894
380 HB3 GLN 560 1HB GLN 560 -12.766 -1.688 -9.807
381 HG2 GLN 560 2HG GLN 560 -11.232 -2.679 -8.569
382 HG3 GLN 560 1HG GLN 560 -12.366 -3.982 -8.218
383 HE21 GLN 560 1HE2 GLN 560 -9.524 -4.185 -8.468
384 HE22 GLN 560 2HE2 GLN 560 -9.202 -5.260 -9.782
Start of MODEL 15
1 H1 ALA 507 1HT ALA 507 -13.229 6.783 2.689
2 H2 ALA 507 2HT ALA 507 -12.886 6.514 4.349
3 H3 ALA 507 3HT ALA 507 -14.261 7.434 3.892
4 HA ALA 507 HA ALA 507 -14.592 5.065 4.620
5 HB1 ALA 507 2HB ALA 507 -16.499 4.891 3.260
6 HB2 ALA 507 3HB ALA 507 -15.739 5.777 1.938
7 HB3 ALA 507 1HB ALA 507 -16.201 6.622 3.414
8 H GLN 508 H GLN 508 -14.003 3.015 4.313
9 HA GLN 508 HA GLN 508 -12.148 2.378 2.201
10 HB2 GLN 508 2HB GLN 508 -13.327 0.689 4.414
11 HB3 GLN 508 1HB GLN 508 -12.097 0.130 3.287
12 HG2 GLN 508 2HG GLN 508 -10.461 1.494 4.192
13 HG3 GLN 508 1HG GLN 508 -11.636 2.582 4.929
14 HE21 GLN 508 1HE2 GLN 508 -11.049 2.486 7.014
15 HE22 GLN 508 2HE2 GLN 508 -11.027 1.044 7.965
16 HA PRO 509 HA PRO 509 -15.171 0.408 -0.369
17 HB2 PRO 509 2HB PRO 509 -13.534 -0.596 -2.221
18 HB3 PRO 509 1HB PRO 509 -13.672 1.146 -1.978
19 HG2 PRO 509 2HG PRO 509 -11.467 -0.680 -1.247
20 HG3 PRO 509 1HG PRO 509 -11.427 1.059 -1.574
21 HD2 PRO 509 2HD PRO 509 -11.534 -0.278 0.978
22 HD3 PRO 509 1HD PRO 509 -11.455 1.467 0.653
23 H LYS 510 H LYS 510 -13.901 -1.199 1.946
24 HA LYS 510 HA LYS 510 -13.910 -3.327 2.741
25 HB2 LYS 510 2HB LYS 510 -16.146 -3.232 0.782
26 HB3 LYS 510 1HB LYS 510 -15.696 -4.796 1.445
27 HG2 LYS 510 2HG LYS 510 -15.833 -3.021 3.619
28 HG3 LYS 510 1HG LYS 510 -17.255 -2.711 2.623
29 HD2 LYS 510 2HD LYS 510 -17.986 -4.949 2.793
30 HD3 LYS 510 1HD LYS 510 -16.428 -5.490 3.421
31 HE2 LYS 510 2HE LYS 510 -18.211 -3.549 4.875
32 HE3 LYS 510 1HE LYS 510 -18.291 -5.295 5.113
33 HZ1 LYS 510 3HZ LYS 510 -16.007 -5.287 5.843
34 HZ2 LYS 510 1HZ LYS 510 -16.895 -4.184 6.769
35 HZ3 LYS 510 2HZ LYS 510 -15.870 -3.628 5.544
36 H CYS 511 H CYS 511 -12.005 -2.726 0.599
37 HA CYS 511 HA CYS 511 -11.291 -5.458 -0.015
38 HB2 CYS 511 2HB CYS 511 -10.900 -4.813 -2.476
39 HB3 CYS 511 1HB CYS 511 -12.546 -5.173 -1.973
40 H ASN 512 H ASN 512 -10.045 -3.767 1.698
41 HA ASN 512 HA ASN 512 -7.652 -2.878 0.232
42 HB2 ASN 512 2HB ASN 512 -7.186 -1.458 2.231
43 HB3 ASN 512 1HB ASN 512 -8.682 -1.034 1.405
44 HD21 ASN 512 1HD2 ASN 512 -10.501 -0.971 2.544
45 HD22 ASN 512 2HD2 ASN 512 -10.684 -1.534 4.166
46 HA PRO 513 HA PRO 513 -5.449 -6.031 2.375
47 HB2 PRO 513 2HB PRO 513 -2.907 -5.169 2.029
48 HB3 PRO 513 1HB PRO 513 -3.881 -5.855 0.728
49 HG2 PRO 513 2HG PRO 513 -3.129 -3.042 1.239
50 HG3 PRO 513 1HG PRO 513 -3.503 -3.850 -0.288
51 HD2 PRO 513 2HD PRO 513 -5.209 -2.174 1.202
52 HD3 PRO 513 1HD PRO 513 -5.658 -3.177 -0.189
53 H ASN 514 H ASN 514 -3.293 -3.334 3.093
54 HA ASN 514 HA ASN 514 -3.918 -3.605 5.958
55 HB2 ASN 514 2HB ASN 514 -1.383 -4.053 4.531
56 HB3 ASN 514 1HB ASN 514 -1.256 -3.057 5.976
57 HD21 ASN 514 1HD2 ASN 514 -1.904 -6.206 4.713
58 HD22 ASN 514 2HD2 ASN 514 -1.928 -7.042 6.224
59 H LEU 515 H LEU 515 -1.673 -1.773 3.961
60 HA LEU 515 HA LEU 515 -0.976 0.394 4.085
61 HB2 LEU 515 2HB LEU 515 -2.607 1.850 3.160
62 HB3 LEU 515 1HB LEU 515 -2.840 0.247 2.483
63 HG LEU 515 HG LEU 515 -4.537 0.249 4.644
64 HD11 LEU 515 1HD1 LEU 515 -4.104 2.997 3.787
65 HD12 LEU 515 2HD1 LEU 515 -4.913 2.373 5.224
66 HD13 LEU 515 3HD1 LEU 515 -5.795 2.503 3.702
67 HD21 LEU 515 3HD2 LEU 515 -6.278 0.713 2.766
68 HD22 LEU 515 1HD2 LEU 515 -5.295 -0.751 2.721
69 HD23 LEU 515 2HD2 LEU 515 -4.868 0.629 1.709
70 H HIS 516 H HIS 516 -1.054 -0.490 6.640
71 HA HIS 516 HA HIS 516 -2.454 1.585 8.168
72 HB2 HIS 516 2HB HIS 516 -1.707 -1.197 8.691
73 HB3 HIS 516 1HB HIS 516 -1.335 -0.111 10.026
74 HD1 HIS 516 1HD HIS 516 -3.704 1.731 10.081
75 HD2 HIS 516 2HD HIS 516 -4.054 -2.349 9.372
76 HE1 HIS 516 1HE HIS 516 -6.070 1.143 10.693
77 HE2 HIS 516 2HE HIS 516 -6.235 -1.345 10.336
78 H TYR 517 H TYR 517 0.597 0.998 6.879
79 HA TYR 517 HA TYR 517 2.014 2.249 9.097
80 HB2 TYR 517 2HB TYR 517 4.008 1.556 8.119
81 HB3 TYR 517 1HB TYR 517 2.901 0.276 7.649
82 HD1 TYR 517 1HD TYR 517 4.054 3.586 6.319
83 HD2 TYR 517 2HD TYR 517 3.071 -0.467 5.472
84 HE1 TYR 517 1HE TYR 517 4.638 3.944 3.969
85 HE2 TYR 517 2HE TYR 517 3.654 -0.118 3.115
86 HH TYR 517 HH TYR 517 3.887 1.669 1.517
87 H TRP 518 H TRP 518 0.677 3.059 6.015
88 HA TRP 518 HA TRP 518 1.921 5.710 6.146
89 HB2 TRP 518 2HB TRP 518 2.097 4.065 4.065
90 HB3 TRP 518 1HB TRP 518 0.539 4.789 3.684
91 HD1 TRP 518 HD TRP 518 0.721 6.825 2.188
92 HE1 TRP 518 1HE TRP 518 2.486 8.641 1.720
93 HE3 TRP 518 3HE TRP 518 4.285 5.364 5.539
94 HZ2 TRP 518 2HZ TRP 518 5.052 9.359 2.656
95 HZ3 TRP 518 3HZ TRP 518 6.366 6.668 5.694
96 HH2 TRP 518 HH TRP 518 6.741 8.624 4.282
97 H THR 519 H THR 519 0.715 7.364 6.537
98 HA THR 519 HA THR 519 -1.528 7.770 7.682
99 HB THR 519 HB THR 519 -0.459 9.685 6.861
100 HG1 THR 519 1HG THR 519 -2.449 10.413 6.923
101 HG21 THR 519 3HG2 THR 519 0.323 10.017 4.811
102 HG22 THR 519 1HG2 THR 519 -1.209 9.579 4.057
103 HG23 THR 519 2HG2 THR 519 -0.063 8.320 4.521
104 H THR 520 H THR 520 -1.710 7.278 4.138
105 HA THR 520 HA THR 520 -3.873 5.516 4.220
106 HB THR 520 HB THR 520 -4.936 7.718 5.083
107 HG1 THR 520 1HG THR 520 -6.021 6.196 2.958
108 HG21 THR 520 3HG2 THR 520 -5.862 9.164 3.361
109 HG22 THR 520 1HG2 THR 520 -4.937 8.303 2.128
110 HG23 THR 520 2HG2 THR 520 -4.100 9.233 3.372
111 H GLN 521 H GLN 521 -2.606 8.273 2.365
112 HA GLN 521 HA GLN 521 -3.364 7.677 -0.165
113 HB2 GLN 521 2HB GLN 521 -1.247 8.687 -0.955
114 HB3 GLN 521 1HB GLN 521 -2.040 9.634 0.298
115 HG2 GLN 521 2HG GLN 521 -0.487 8.506 1.942
116 HG3 GLN 521 1HG GLN 521 0.401 7.907 0.542
117 HE21 GLN 521 1HE2 GLN 521 0.903 9.934 2.781
118 HE22 GLN 521 2HE2 GLN 521 1.533 11.309 1.945
119 H ASP 522 H ASP 522 -2.444 6.575 -1.938
120 HA ASP 522 HA ASP 522 -1.908 3.913 -1.563
121 HB2 ASP 522 2HB ASP 522 -1.289 5.767 -3.847
122 HB3 ASP 522 1HB ASP 522 -0.869 4.058 -3.924
123 H GLU 523 H GLU 523 -0.367 3.499 -0.008
124 HA GLU 523 HA GLU 523 2.338 4.505 -0.392
125 HB2 GLU 523 2HB GLU 523 2.809 3.433 1.758
126 HB3 GLU 523 1HB GLU 523 1.439 4.522 1.856
127 HG2 GLU 523 2HG GLU 523 0.879 1.659 1.339
128 HG3 GLU 523 1HG GLU 523 1.420 2.114 2.956
129 H GLY 524 H GLY 524 2.200 3.230 -2.486
130 HA2 GLY 524 2HA GLY 524 3.747 1.589 -3.376
131 HA3 GLY 524 1HA GLY 524 3.337 0.552 -2.013
132 H ALA 525 H ALA 525 0.661 2.196 -3.173
133 HA ALA 525 HA ALA 525 -0.626 -0.163 -4.044
134 HB1 ALA 525 1HB ALA 525 -1.543 2.131 -3.088
135 HB2 ALA 525 2HB ALA 525 -2.531 1.083 -4.106
136 HB3 ALA 525 3HB ALA 525 -1.722 2.485 -4.806
137 H ALA 526 H ALA 526 1.435 -0.364 -5.627
138 HA ALA 526 HA ALA 526 2.183 -0.538 -7.756
139 HB1 ALA 526 1HB ALA 526 0.178 -0.479 -9.486
140 HB2 ALA 526 2HB ALA 526 -0.768 -0.646 -8.006
141 HB3 ALA 526 3HB ALA 526 0.451 -1.854 -8.415
142 H ILE 527 H ILE 527 3.310 1.402 -7.685
143 HA ILE 527 HA ILE 527 2.735 3.201 -9.756
144 HB ILE 527 HB ILE 527 1.113 4.092 -8.260
145 HG12 ILE 527 2HG1 ILE 527 3.434 5.979 -7.947
146 HG13 ILE 527 1HG1 ILE 527 2.756 5.644 -9.538
147 HG21 ILE 527 1HG2 ILE 527 3.174 4.645 -6.185
148 HG22 ILE 527 2HG2 ILE 527 2.360 3.081 -6.262
149 HG23 ILE 527 3HG2 ILE 527 1.418 4.556 -6.026
150 HD11 ILE 527 3HD1 ILE 527 0.543 6.231 -8.004
151 HD12 ILE 527 1HD1 ILE 527 1.356 7.315 -9.132
152 HD13 ILE 527 2HD1 ILE 527 1.773 7.352 -7.419
153 H GLY 528 H GLY 528 4.331 2.956 -6.592
154 HA2 GLY 528 2HA GLY 528 6.519 3.213 -5.964
155 HA3 GLY 528 1HA GLY 528 6.930 2.824 -7.622
156 H ALA 529 H ALA 529 5.255 5.352 -8.376
157 HA ALA 529 HA ALA 529 5.866 7.427 -9.108
158 HB1 ALA 529 1HB ALA 529 5.226 7.556 -6.557
159 HB2 ALA 529 2HB ALA 529 5.837 8.968 -7.419
160 HB3 ALA 529 3HB ALA 529 6.918 8.027 -6.392
161 H ALA 530 H ALA 530 7.913 5.445 -9.505
162 HA ALA 530 HA ALA 530 10.019 6.840 -10.486
163 HB1 ALA 530 1HB ALA 530 10.161 6.804 -7.594
164 HB2 ALA 530 2HB ALA 530 11.168 7.670 -8.753
165 HB3 ALA 530 3HB ALA 530 11.564 6.010 -8.307
166 H TRP 531 H TRP 531 8.780 4.649 -11.290
167 HA TRP 531 HA TRP 531 8.834 2.339 -11.562
168 HB2 TRP 531 2HB TRP 531 11.147 1.797 -12.646
169 HB3 TRP 531 1HB TRP 531 10.006 2.855 -13.470
170 HD1 TRP 531 HD TRP 531 12.712 3.581 -10.780
171 HE1 TRP 531 1HE TRP 531 14.155 5.542 -11.620
172 HE3 TRP 531 3HE TRP 531 10.474 4.351 -15.309
173 HZ2 TRP 531 2HZ TRP 531 14.320 7.194 -13.904
174 HZ3 TRP 531 3HZ TRP 531 11.333 6.141 -16.762
175 HH2 TRP 531 HH TRP 531 13.217 7.533 -16.073
176 H ILE 532 H ILE 532 9.145 2.774 -8.975
177 HA ILE 532 HA ILE 532 11.050 0.697 -8.231
178 HB ILE 532 HB ILE 532 11.949 2.956 -7.820
179 HG12 ILE 532 2HG1 ILE 532 11.313 1.468 -5.260
180 HG13 ILE 532 1HG1 ILE 532 12.567 0.993 -6.393
181 HG21 ILE 532 1HG2 ILE 532 9.464 3.679 -7.266
182 HG22 ILE 532 2HG2 ILE 532 10.862 4.551 -6.620
183 HG23 ILE 532 3HG2 ILE 532 10.013 3.376 -5.612
184 HD11 ILE 532 3HD1 ILE 532 13.851 2.900 -5.924
185 HD12 ILE 532 1HD1 ILE 532 13.302 2.291 -4.359
186 HD13 ILE 532 2HD1 ILE 532 12.513 3.691 -5.090
187 HA PRO 533 HA PRO 533 6.711 0.845 -6.045
188 HB2 PRO 533 2HB PRO 533 5.192 -0.684 -7.736
189 HB3 PRO 533 1HB PRO 533 5.182 1.080 -7.739
190 HG2 PRO 533 2HG PRO 533 6.626 -0.805 -9.543
191 HG3 PRO 533 1HG PRO 533 5.805 0.716 -9.932
192 HD2 PRO 533 2HD PRO 533 8.485 0.525 -9.709
193 HD3 PRO 533 1HD PRO 533 7.587 1.995 -9.279
194 H TYR 534 H TYR 534 8.688 -1.325 -7.773
195 HA TYR 534 HA TYR 534 7.867 -3.825 -6.929
196 HB2 TYR 534 2HB TYR 534 10.668 -2.796 -7.452
197 HB3 TYR 534 1HB TYR 534 10.216 -4.496 -7.368
198 HD1 TYR 534 1HD TYR 534 9.832 -1.371 -9.378
199 HD2 TYR 534 2HD TYR 534 9.187 -5.591 -9.203
200 HE1 TYR 534 1HE TYR 534 9.304 -1.395 -11.772
201 HE2 TYR 534 2HE TYR 534 8.659 -5.607 -11.602
202 HH TYR 534 HH TYR 534 9.354 -3.961 -13.653
203 H PHE 535 H PHE 535 10.449 -1.812 -5.500
204 HA PHE 535 HA PHE 535 9.772 -2.953 -2.878
205 HB2 PHE 535 2HB PHE 535 12.494 -2.689 -4.125
206 HB3 PHE 535 1HB PHE 535 12.282 -2.818 -2.383
207 HD1 PHE 535 2HD PHE 535 11.176 -4.544 -5.502
208 HD2 PHE 535 1HD PHE 535 12.423 -4.906 -1.449
209 HE1 PHE 535 2HE PHE 535 11.095 -6.995 -5.701
210 HE2 PHE 535 1HE PHE 535 12.346 -7.358 -1.641
211 HZ PHE 535 HZ PHE 535 11.680 -8.406 -3.769
212 H GLY 536 H GLY 536 9.696 -0.238 -4.579
213 HA2 GLY 536 2HA GLY 536 11.114 1.714 -3.189
214 HA3 GLY 536 1HA GLY 536 9.602 1.992 -4.043
215 HA PRO 537 HA PRO 537 7.917 2.701 0.040
216 HB2 PRO 537 2HB PRO 537 5.412 3.217 -0.618
217 HB3 PRO 537 1HB PRO 537 6.689 4.281 -1.241
218 HG2 PRO 537 2HG PRO 537 5.396 1.924 -2.589
219 HG3 PRO 537 1HG PRO 537 5.559 3.582 -3.212
220 HD2 PRO 537 2HD PRO 537 7.282 1.593 -3.850
221 HD3 PRO 537 1HD PRO 537 7.807 3.287 -3.701
222 H ALA 538 H ALA 538 8.179 0.002 -1.222
223 HA ALA 538 HA ALA 538 6.011 -1.368 0.162
224 HB1 ALA 538 1HB ALA 538 5.916 -1.463 -2.368
225 HB2 ALA 538 2HB ALA 538 5.959 -3.025 -1.546
226 HB3 ALA 538 3HB ALA 538 7.421 -2.383 -2.301
227 H ALA 539 H ALA 539 9.341 -0.918 -0.519
228 HA ALA 539 HA ALA 539 10.049 -2.680 1.643
229 HB1 ALA 539 1HB ALA 539 10.243 -4.393 0.174
230 HB2 ALA 539 2HB ALA 539 11.864 -3.708 0.049
231 HB3 ALA 539 3HB ALA 539 10.652 -3.335 -1.176
232 H GLU 540 H GLU 540 10.366 0.249 0.585
233 HA GLU 540 HA GLU 540 13.230 0.600 0.512
234 HB2 GLU 540 2HB GLU 540 12.727 3.002 0.681
235 HB3 GLU 540 1HB GLU 540 11.806 2.233 -0.602
236 HG2 GLU 540 2HG GLU 540 9.927 2.045 1.134
237 HG3 GLU 540 1HG GLU 540 10.856 3.226 2.057
238 H GLY 541 H GLY 541 13.034 -0.892 2.544
239 HA2 GLY 541 2HA GLY 541 13.954 -0.848 4.730
240 HA3 GLY 541 1HA GLY 541 13.412 0.824 4.888
241 H ILE 542 H ILE 542 10.920 -0.527 3.442
242 HA ILE 542 HA ILE 542 9.251 -0.580 5.711
243 HB ILE 542 HB ILE 542 8.965 -0.814 2.805
244 HG12 ILE 542 2HG1 ILE 542 7.001 0.156 4.869
245 HG13 ILE 542 1HG1 ILE 542 8.385 1.114 4.356
246 HG21 ILE 542 1HG2 ILE 542 8.010 -2.937 3.152
247 HG22 ILE 542 2HG2 ILE 542 6.650 -1.817 3.018
248 HG23 ILE 542 3HG2 ILE 542 7.152 -2.405 4.602
249 HD11 ILE 542 3HD1 ILE 542 7.483 0.747 1.983
250 HD12 ILE 542 1HD1 ILE 542 6.663 1.900 3.036
251 HD13 ILE 542 2HD1 ILE 542 5.983 0.292 2.791
252 H TYR 543 H TYR 543 10.486 -3.144 3.567
253 HA TYR 543 HA TYR 543 9.205 -5.349 4.472
254 HB2 TYR 543 2HB TYR 543 11.250 -6.654 3.958
255 HB3 TYR 543 1HB TYR 543 10.825 -5.502 2.697
256 HD1 TYR 543 1HD TYR 543 12.082 -3.354 2.555
257 HD2 TYR 543 2HD TYR 543 13.334 -6.552 5.042
258 HE1 TYR 543 1HE TYR 543 14.340 -2.369 2.662
259 HE2 TYR 543 2HE TYR 543 15.598 -5.588 5.166
260 HH TYR 543 HH TYR 543 16.614 -3.028 3.125
261 H ALA 544 H ALA 544 11.590 -3.516 6.226
262 HA ALA 544 HA ALA 544 12.425 -5.306 8.162
263 HB1 ALA 544 1HB ALA 544 13.275 -3.012 7.917
264 HB2 ALA 544 2HB ALA 544 12.827 -3.387 9.581
265 HB3 ALA 544 3HB ALA 544 11.762 -2.400 8.581
266 H GLU 545 H GLU 545 9.303 -4.048 7.622
267 HA GLU 545 HA GLU 545 8.107 -4.028 10.112
268 HB2 GLU 545 2HB GLU 545 6.027 -4.720 8.773
269 HB3 GLU 545 1HB GLU 545 6.827 -3.231 8.290
270 HG2 GLU 545 2HG GLU 545 6.557 -4.151 6.245
271 HG3 GLU 545 1HG GLU 545 8.095 -4.903 6.659
272 H GLY 546 H GLY 546 8.587 -6.654 7.827
273 HA2 GLY 546 2HA GLY 546 8.448 -8.922 8.030
274 HA3 GLY 546 1HA GLY 546 9.156 -8.642 9.608
275 H LEU 547 H LEU 547 5.890 -8.089 8.207
276 HA LEU 547 HA LEU 547 4.699 -10.127 9.748
277 HB2 LEU 547 2HB LEU 547 3.684 -9.035 11.516
278 HB3 LEU 547 1HB LEU 547 5.298 -8.356 11.491
279 HG LEU 547 HG LEU 547 2.944 -6.973 10.221
280 HD11 LEU 547 1HD1 LEU 547 2.326 -6.026 12.167
281 HD12 LEU 547 2HD1 LEU 547 3.969 -6.015 12.809
282 HD13 LEU 547 3HD1 LEU 547 3.014 -7.497 12.854
283 HD21 LEU 547 3HD2 LEU 547 4.319 -5.122 10.045
284 HD22 LEU 547 1HD2 LEU 547 5.424 -6.449 9.687
285 HD23 LEU 547 2HD2 LEU 547 5.431 -5.703 11.284
286 H MET 548 H MET 548 4.062 -6.941 8.283
287 HA MET 548 HA MET 548 2.320 -7.971 6.339
288 HB2 MET 548 2HB MET 548 0.153 -7.284 7.124
289 HB3 MET 548 1HB MET 548 0.867 -8.358 8.318
290 HG2 MET 548 2HG MET 548 1.662 -5.877 9.179
291 HG3 MET 548 1HG MET 548 0.044 -5.579 8.551
292 HE1 MET 548 3HE MET 548 -1.510 -5.297 9.806
293 HE2 MET 548 1HE MET 548 -1.473 -5.517 11.555
294 HE3 MET 548 2HE MET 548 -2.348 -6.664 10.541
295 H HIS 549 H HIS 549 3.418 -5.245 8.224
296 HA HIS 549 HA HIS 549 2.326 -3.111 6.870
297 HB2 HIS 549 2HB HIS 549 4.614 -3.559 8.600
298 HB3 HIS 549 1HB HIS 549 4.919 -2.281 7.427
299 HD1 HIS 549 1HD HIS 549 1.399 -2.489 8.343
300 HD2 HIS 549 2HD HIS 549 4.798 -0.623 9.836
301 HE1 HIS 549 1HE HIS 549 0.558 -0.706 9.888
302 HE2 HIS 549 2HE HIS 549 2.630 0.347 10.863
303 H ASN 550 H ASN 550 4.503 -5.426 5.590
304 HA ASN 550 HA ASN 550 5.693 -3.720 3.619
305 HB2 ASN 550 2HB ASN 550 6.527 -5.869 2.650
306 HB3 ASN 550 1HB ASN 550 6.940 -5.644 4.347
307 HD21 ASN 550 1HD2 ASN 550 7.263 -8.004 4.137
308 HD22 ASN 550 2HD2 ASN 550 5.904 -9.032 4.421
309 H GLN 551 H GLN 551 2.624 -4.379 3.885
310 HA GLN 551 HA GLN 551 1.667 -5.663 1.647
311 HB2 GLN 551 2HB GLN 551 -0.373 -4.368 1.977
312 HB3 GLN 551 1HB GLN 551 0.286 -4.876 3.527
313 HG2 GLN 551 2HG GLN 551 -0.132 -2.720 4.045
314 HG3 GLN 551 1HG GLN 551 1.472 -2.505 3.353
315 HE21 GLN 551 1HE2 GLN 551 1.665 -0.989 1.879
316 HE22 GLN 551 2HE2 GLN 551 0.391 -0.339 0.909
317 H ASP 552 H ASP 552 0.119 -4.064 0.145
318 HA ASP 552 HA ASP 552 1.998 -2.280 -1.260
319 HB2 ASP 552 2HB ASP 552 -0.043 -4.196 -2.396
320 HB3 ASP 552 1HB ASP 552 0.712 -2.923 -3.349
321 H GLY 553 H GLY 553 -1.480 -3.008 -0.867
322 HA2 GLY 553 2HA GLY 553 -2.951 -1.286 0.004
323 HA3 GLY 553 1HA GLY 553 -1.952 -0.096 -0.814
324 H LEU 554 H LEU 554 -3.319 -3.134 -2.056
325 HA LEU 554 HA LEU 554 -3.950 -2.367 -4.552
326 HB2 LEU 554 2HB LEU 554 -6.125 -3.889 -4.125
327 HB3 LEU 554 1HB LEU 554 -4.518 -4.526 -4.404
328 HG LEU 554 HG LEU 554 -4.969 -3.998 -1.588
329 HD11 LEU 554 1HD1 LEU 554 -6.496 -6.246 -1.723
330 HD12 LEU 554 2HD1 LEU 554 -7.107 -5.312 -3.089
331 HD13 LEU 554 3HD1 LEU 554 -7.117 -4.614 -1.469
332 HD21 LEU 554 3HD2 LEU 554 -4.169 -6.281 -1.377
333 HD22 LEU 554 1HD2 LEU 554 -3.161 -5.376 -2.508
334 HD23 LEU 554 2HD2 LEU 554 -4.356 -6.523 -3.114
335 H ILE 555 H ILE 555 -6.735 -2.570 -2.372
336 HA ILE 555 HA ILE 555 -8.575 -1.268 -2.126
337 HB ILE 555 HB ILE 555 -6.546 0.825 -2.859
338 HG12 ILE 555 2HG1 ILE 555 -6.686 1.436 -0.559
339 HG13 ILE 555 1HG1 ILE 555 -8.122 0.454 -0.311
340 HG21 ILE 555 1HG2 ILE 555 -9.487 1.213 -2.370
341 HG22 ILE 555 2HG2 ILE 555 -8.517 1.784 -3.728
342 HG23 ILE 555 3HG2 ILE 555 -8.304 2.500 -2.131
343 HD11 ILE 555 3HD1 ILE 555 -6.739 -1.556 -0.711
344 HD12 ILE 555 1HD1 ILE 555 -6.247 -0.620 0.694
345 HD13 ILE 555 2HD1 ILE 555 -5.321 -0.516 -0.800
346 H CYS 556 H CYS 556 -10.309 -1.279 -3.368
347 HA CYS 556 HA CYS 556 -10.209 -1.573 -6.162
348 HB2 CYS 556 2HB CYS 556 -12.554 -0.748 -4.439
349 HB3 CYS 556 1HB CYS 556 -12.654 -1.354 -6.088
350 H GLY 557 H GLY 557 -10.517 1.223 -4.102
351 HA2 GLY 557 2HA GLY 557 -9.694 3.335 -5.047
352 HA3 GLY 557 1HA GLY 557 -10.560 2.920 -6.520
353 H LEU 558 H LEU 558 -12.904 1.965 -5.175
354 HA LEU 558 HA LEU 558 -14.071 3.769 -3.408
355 HB2 LEU 558 2HB LEU 558 -15.261 5.280 -4.773
356 HB3 LEU 558 1HB LEU 558 -13.609 5.310 -5.359
357 HG LEU 558 HG LEU 558 -15.482 3.431 -6.669
358 HD11 LEU 558 1HD1 LEU 558 -16.811 5.476 -6.477
359 HD12 LEU 558 2HD1 LEU 558 -16.345 5.155 -8.149
360 HD13 LEU 558 3HD1 LEU 558 -15.500 6.394 -7.220
361 HD21 LEU 558 3HD2 LEU 558 -13.340 3.310 -7.525
362 HD22 LEU 558 1HD2 LEU 558 -13.091 5.055 -7.429
363 HD23 LEU 558 2HD2 LEU 558 -14.158 4.383 -8.662
364 H ARG 559 H ARG 559 -14.064 0.936 -4.496
365 HA ARG 559 HA ARG 559 -15.549 -0.792 -4.501
366 HB2 ARG 559 2HB ARG 559 -17.697 1.276 -4.003
367 HB3 ARG 559 1HB ARG 559 -17.849 -0.463 -3.805
368 HG2 ARG 559 2HG ARG 559 -17.413 -0.027 -1.664
369 HG3 ARG 559 1HG ARG 559 -15.738 0.038 -2.212
370 HD2 ARG 559 2HD ARG 559 -16.184 1.988 -0.871
371 HD3 ARG 559 1HD ARG 559 -15.999 2.487 -2.551
372 HE ARG 559 HE ARG 559 -18.170 3.196 -2.545
373 HH11 ARG 559 1HH1 ARG 559 -17.667 1.097 0.199
374 HH12 ARG 559 2HH1 ARG 559 -19.224 1.415 0.886
375 HH21 ARG 559 1HH2 ARG 559 -20.220 3.614 -1.641
376 HH22 ARG 559 2HH2 ARG 559 -20.674 2.843 -0.158
377 H GLN 560 H GLN 560 -16.281 -1.848 -6.197
378 HA GLN 560 HA GLN 560 -17.880 -0.555 -8.229
379 HB2 GLN 560 2HB GLN 560 -15.479 -0.054 -8.808
380 HB3 GLN 560 1HB GLN 560 -15.237 -1.785 -9.012
381 HG2 GLN 560 2HG GLN 560 -17.124 -1.705 -10.696
382 HG3 GLN 560 1HG GLN 560 -16.973 0.050 -10.626
383 HE21 GLN 560 1HE2 GLN 560 -15.319 1.040 -11.663
384 HE22 GLN 560 2HE2 GLN 560 -14.155 0.214 -12.637
Start of MODEL 16
1 H1 ALA 507 1HT ALA 507 -20.161 2.830 0.545
2 H2 ALA 507 2HT ALA 507 -19.165 4.229 0.548
3 H3 ALA 507 3HT ALA 507 -20.378 4.034 1.745
4 HA ALA 507 HA ALA 507 -18.239 3.589 2.639
5 HB1 ALA 507 2HB ALA 507 -18.741 1.074 3.197
6 HB2 ALA 507 3HB ALA 507 -20.261 1.417 2.370
7 HB3 ALA 507 1HB ALA 507 -19.795 2.359 3.787
8 H GLN 508 H GLN 508 -16.676 1.602 2.844
9 HA GLN 508 HA GLN 508 -15.301 1.434 0.327
10 HB2 GLN 508 2HB GLN 508 -14.685 0.965 3.132
11 HB3 GLN 508 1HB GLN 508 -14.011 -0.286 2.097
12 HG2 GLN 508 2HG GLN 508 -13.018 1.548 0.700
13 HG3 GLN 508 1HG GLN 508 -13.520 2.675 1.960
14 HE21 GLN 508 1HE2 GLN 508 -10.897 1.369 0.850
15 HE22 GLN 508 2HE2 GLN 508 -10.008 1.049 2.296
16 HA PRO 509 HA PRO 509 -16.780 -2.635 -0.683
17 HB2 PRO 509 2HB PRO 509 -15.270 -3.073 -2.846
18 HB3 PRO 509 1HB PRO 509 -16.469 -1.776 -2.816
19 HG2 PRO 509 2HG PRO 509 -13.524 -1.612 -2.708
20 HG3 PRO 509 1HG PRO 509 -14.698 -0.400 -3.239
21 HD2 PRO 509 2HD PRO 509 -13.390 -0.629 -0.677
22 HD3 PRO 509 1HD PRO 509 -14.518 0.626 -1.228
23 H LYS 510 H LYS 510 -14.389 -2.355 1.236
24 HA LYS 510 HA LYS 510 -12.896 -3.708 2.282
25 HB2 LYS 510 2HB LYS 510 -14.730 -5.675 0.960
26 HB3 LYS 510 1HB LYS 510 -13.330 -6.230 1.865
27 HG2 LYS 510 2HG LYS 510 -14.487 -4.454 3.598
28 HG3 LYS 510 1HG LYS 510 -15.881 -5.192 2.809
29 HD2 LYS 510 2HD LYS 510 -14.149 -7.313 3.358
30 HD3 LYS 510 1HD LYS 510 -14.091 -6.290 4.795
31 HE2 LYS 510 2HE LYS 510 -16.185 -6.821 5.394
32 HE3 LYS 510 1HE LYS 510 -16.789 -6.688 3.744
33 HZ1 LYS 510 3HZ LYS 510 -16.709 -8.979 4.983
34 HZ2 LYS 510 1HZ LYS 510 -15.114 -8.993 4.419
35 HZ3 LYS 510 2HZ LYS 510 -16.398 -8.877 3.324
36 H CYS 511 H CYS 511 -12.261 -2.664 -0.385
37 HA CYS 511 HA CYS 511 -10.542 -4.768 -1.479
38 HB2 CYS 511 2HB CYS 511 -12.047 -3.455 -3.001
39 HB3 CYS 511 1HB CYS 511 -11.092 -2.026 -2.624
40 H ASN 512 H ASN 512 -9.975 -3.380 1.051
41 HA ASN 512 HA ASN 512 -7.459 -2.046 0.309
42 HB2 ASN 512 2HB ASN 512 -7.573 -0.880 2.464
43 HB3 ASN 512 1HB ASN 512 -9.010 -0.563 1.497
44 HD21 ASN 512 1HD2 ASN 512 -10.980 -1.417 2.129
45 HD22 ASN 512 2HD2 ASN 512 -11.242 -2.058 3.712
46 HA PRO 513 HA PRO 513 -5.546 -5.437 2.395
47 HB2 PRO 513 2HB PRO 513 -2.973 -4.655 2.203
48 HB3 PRO 513 1HB PRO 513 -3.902 -5.224 0.813
49 HG2 PRO 513 2HG PRO 513 -3.097 -2.470 1.547
50 HG3 PRO 513 1HG PRO 513 -3.384 -3.175 -0.048
51 HD2 PRO 513 2HD PRO 513 -5.156 -1.551 1.434
52 HD3 PRO 513 1HD PRO 513 -5.527 -2.445 -0.049
53 H ASN 514 H ASN 514 -3.217 -2.993 3.327
54 HA ASN 514 HA ASN 514 -4.141 -3.130 6.117
55 HB2 ASN 514 2HB ASN 514 -1.554 -3.922 4.945
56 HB3 ASN 514 1HB ASN 514 -1.459 -2.950 6.408
57 HD21 ASN 514 1HD2 ASN 514 -3.189 -5.762 5.111
58 HD22 ASN 514 2HD2 ASN 514 -3.158 -6.675 6.577
59 H LEU 515 H LEU 515 -1.461 -1.667 4.355
60 HA LEU 515 HA LEU 515 -0.504 0.401 4.553
61 HB2 LEU 515 2HB LEU 515 -1.833 2.053 3.464
62 HB3 LEU 515 1HB LEU 515 -2.149 0.489 2.738
63 HG LEU 515 HG LEU 515 -4.112 0.679 4.656
64 HD11 LEU 515 1HD1 LEU 515 -3.274 3.366 3.881
65 HD12 LEU 515 2HD1 LEU 515 -4.285 2.835 5.225
66 HD13 LEU 515 3HD1 LEU 515 -4.991 3.051 3.624
67 HD21 LEU 515 3HD2 LEU 515 -4.159 -0.090 2.238
68 HD22 LEU 515 1HD2 LEU 515 -4.470 1.595 1.823
69 HD23 LEU 515 2HD2 LEU 515 -5.604 0.715 2.848
70 H HIS 516 H HIS 516 -0.950 -0.413 7.069
71 HA HIS 516 HA HIS 516 -2.329 1.751 8.469
72 HB2 HIS 516 2HB HIS 516 -1.536 -1.024 9.143
73 HB3 HIS 516 1HB HIS 516 -1.524 0.140 10.462
74 HD1 HIS 516 1HD HIS 516 -4.113 0.955 8.052
75 HD2 HIS 516 2HD HIS 516 -3.755 -1.559 11.341
76 HE1 HIS 516 1HE HIS 516 -6.468 0.378 8.717
77 HE2 HIS 516 2HE HIS 516 -6.226 -1.197 10.669
78 H TYR 517 H TYR 517 0.810 1.089 7.426
79 HA TYR 517 HA TYR 517 2.119 2.171 9.764
80 HB2 TYR 517 2HB TYR 517 4.195 1.837 8.628
81 HB3 TYR 517 1HB TYR 517 3.193 0.427 8.327
82 HD1 TYR 517 1HD TYR 517 3.715 3.763 6.695
83 HD2 TYR 517 2HD TYR 517 3.444 -0.456 6.220
84 HE1 TYR 517 1HE TYR 517 4.107 4.017 4.291
85 HE2 TYR 517 2HE TYR 517 3.832 -0.211 3.809
86 HH TYR 517 HH TYR 517 5.161 2.033 2.381
87 H TRP 518 H TRP 518 0.846 3.392 6.788
88 HA TRP 518 HA TRP 518 2.207 5.942 7.063
89 HB2 TRP 518 2HB TRP 518 1.487 4.573 4.851
90 HB3 TRP 518 1HB TRP 518 0.081 5.618 5.046
91 HD1 TRP 518 HD TRP 518 0.307 7.712 3.645
92 HE1 TRP 518 1HE TRP 518 2.215 9.287 2.931
93 HE3 TRP 518 3HE TRP 518 4.213 5.343 5.930
94 HZ2 TRP 518 2HZ TRP 518 5.004 9.493 3.288
95 HZ3 TRP 518 3HZ TRP 518 6.469 6.291 5.696
96 HH2 TRP 518 HH TRP 518 6.856 8.323 4.400
97 H THR 519 H THR 519 0.157 7.559 6.094
98 HA THR 519 HA THR 519 -1.703 7.538 8.368
99 HB THR 519 HB THR 519 -0.453 9.354 8.924
100 HG1 THR 519 1HG THR 519 -2.496 10.221 8.411
101 HG21 THR 519 3HG2 THR 519 0.063 10.071 6.056
102 HG22 THR 519 1HG2 THR 519 1.120 9.036 7.019
103 HG23 THR 519 2HG2 THR 519 0.855 10.718 7.494
104 H THR 520 H THR 520 -1.246 7.973 4.951
105 HA THR 520 HA THR 520 -3.898 7.436 4.298
106 HB THR 520 HB THR 520 -4.097 9.787 5.392
107 HG1 THR 520 1HG THR 520 -5.757 10.289 3.901
108 HG21 THR 520 3HG2 THR 520 -3.198 10.597 2.636
109 HG22 THR 520 1HG2 THR 520 -2.340 10.921 4.143
110 HG23 THR 520 2HG2 THR 520 -3.917 11.655 3.853
111 H GLN 521 H GLN 521 -1.220 9.535 3.241
112 HA GLN 521 HA GLN 521 -1.574 9.499 0.537
113 HB2 GLN 521 2HB GLN 521 0.438 10.312 2.209
114 HB3 GLN 521 1HB GLN 521 1.221 9.031 1.292
115 HG2 GLN 521 2HG GLN 521 0.383 10.187 -0.791
116 HG3 GLN 521 1HG GLN 521 -0.040 11.546 0.250
117 HE21 GLN 521 1HE2 GLN 521 1.403 13.089 0.010
118 HE22 GLN 521 2HE2 GLN 521 3.117 12.882 -0.064
119 H ASP 522 H ASP 522 -0.879 8.225 -1.186
120 HA ASP 522 HA ASP 522 -1.230 5.474 -0.908
121 HB2 ASP 522 2HB ASP 522 0.094 7.032 -3.136
122 HB3 ASP 522 1HB ASP 522 -0.367 5.335 -3.244
123 H GLU 523 H GLU 523 0.157 4.821 0.776
124 HA GLU 523 HA GLU 523 3.017 5.010 0.436
125 HB2 GLU 523 2HB GLU 523 3.159 3.895 2.561
126 HB3 GLU 523 1HB GLU 523 1.961 5.169 2.655
127 HG2 GLU 523 2HG GLU 523 1.067 2.395 2.048
128 HG3 GLU 523 1HG GLU 523 1.510 2.813 3.701
129 H GLY 524 H GLY 524 2.401 3.860 -1.731
130 HA2 GLY 524 2HA GLY 524 3.504 1.946 -2.740
131 HA3 GLY 524 1HA GLY 524 2.975 0.992 -1.357
132 H ALA 525 H ALA 525 0.634 3.182 -2.295
133 HA ALA 525 HA ALA 525 -1.201 1.191 -3.075
134 HB1 ALA 525 1HB ALA 525 -1.761 4.010 -3.775
135 HB2 ALA 525 2HB ALA 525 -1.474 3.648 -2.074
136 HB3 ALA 525 3HB ALA 525 -2.769 2.825 -2.945
137 H ALA 526 H ALA 526 0.645 0.572 -4.823
138 HA ALA 526 HA ALA 526 1.204 0.328 -7.007
139 HB1 ALA 526 1HB ALA 526 -0.721 0.332 -8.589
140 HB2 ALA 526 2HB ALA 526 -1.732 0.937 -7.276
141 HB3 ALA 526 3HB ALA 526 -0.973 -0.650 -7.146
142 H ILE 527 H ILE 527 2.619 2.038 -7.139
143 HA ILE 527 HA ILE 527 2.151 3.896 -9.165
144 HB ILE 527 HB ILE 527 0.781 5.013 -7.550
145 HG12 ILE 527 2HG1 ILE 527 3.374 6.552 -7.603
146 HG13 ILE 527 1HG1 ILE 527 2.395 6.329 -9.050
147 HG21 ILE 527 1HG2 ILE 527 3.119 5.292 -5.719
148 HG22 ILE 527 2HG2 ILE 527 2.023 3.911 -5.632
149 HG23 ILE 527 3HG2 ILE 527 1.406 5.547 -5.379
150 HD11 ILE 527 3HD1 ILE 527 1.040 7.975 -8.462
151 HD12 ILE 527 1HD1 ILE 527 2.171 8.347 -7.160
152 HD13 ILE 527 2HD1 ILE 527 0.795 7.287 -6.856
153 H GLY 528 H GLY 528 3.908 3.436 -6.114
154 HA2 GLY 528 2HA GLY 528 6.149 3.398 -5.633
155 HA3 GLY 528 1HA GLY 528 6.386 2.929 -7.302
156 H ALA 529 H ALA 529 5.048 5.664 -8.010
157 HA ALA 529 HA ALA 529 5.863 7.643 -8.784
158 HB1 ALA 529 1HB ALA 529 6.395 9.153 -7.121
159 HB2 ALA 529 2HB ALA 529 7.311 7.968 -6.191
160 HB3 ALA 529 3HB ALA 529 5.549 7.898 -6.214
161 H ALA 530 H ALA 530 7.491 5.312 -9.353
162 HA ALA 530 HA ALA 530 9.639 6.315 -10.666
163 HB1 ALA 530 1HB ALA 530 11.308 5.290 -8.664
164 HB2 ALA 530 2HB ALA 530 10.166 6.336 -7.822
165 HB3 ALA 530 3HB ALA 530 11.139 6.980 -9.145
166 H TRP 531 H TRP 531 7.948 4.337 -11.176
167 HA TRP 531 HA TRP 531 7.592 2.044 -11.344
168 HB2 TRP 531 2HB TRP 531 9.627 1.108 -12.705
169 HB3 TRP 531 1HB TRP 531 8.534 2.288 -13.422
170 HD1 TRP 531 HD TRP 531 11.699 2.668 -11.212
171 HE1 TRP 531 1HE TRP 531 13.259 4.377 -12.344
172 HE3 TRP 531 3HE TRP 531 8.897 3.692 -15.359
173 HZ2 TRP 531 2HZ TRP 531 13.292 5.952 -14.689
174 HZ3 TRP 531 3HZ TRP 531 9.762 5.311 -16.999
175 HH2 TRP 531 HH TRP 531 11.914 6.417 -16.668
176 H ILE 532 H ILE 532 8.318 2.466 -8.847
177 HA ILE 532 HA ILE 532 9.993 0.145 -8.287
178 HB ILE 532 HB ILE 532 11.275 2.226 -8.078
179 HG12 ILE 532 2HG1 ILE 532 10.770 1.130 -5.310
180 HG13 ILE 532 1HG1 ILE 532 11.568 0.168 -6.546
181 HG21 ILE 532 1HG2 ILE 532 9.003 3.353 -7.262
182 HG22 ILE 532 2HG2 ILE 532 10.594 4.030 -6.888
183 HG23 ILE 532 3HG2 ILE 532 9.743 3.058 -5.685
184 HD11 ILE 532 3HD1 ILE 532 12.588 2.886 -5.851
185 HD12 ILE 532 1HD1 ILE 532 13.444 1.513 -6.553
186 HD13 ILE 532 2HD1 ILE 532 12.986 1.488 -4.850
187 HA PRO 533 HA PRO 533 6.098 0.955 -5.512
188 HB2 PRO 533 2HB PRO 533 4.111 -0.301 -6.905
189 HB3 PRO 533 1HB PRO 533 4.397 1.438 -6.972
190 HG2 PRO 533 2HG PRO 533 5.210 -0.686 -8.900
191 HG3 PRO 533 1HG PRO 533 4.606 0.949 -9.220
192 HD2 PRO 533 2HD PRO 533 7.224 0.293 -9.382
193 HD3 PRO 533 1HD PRO 533 6.657 1.906 -8.903
194 H TYR 534 H TYR 534 7.444 -1.507 -7.433
195 HA TYR 534 HA TYR 534 6.356 -3.838 -6.403
196 HB2 TYR 534 2HB TYR 534 9.172 -3.286 -7.376
197 HB3 TYR 534 1HB TYR 534 8.471 -4.888 -7.167
198 HD1 TYR 534 1HD TYR 534 8.266 -1.753 -9.189
199 HD2 TYR 534 2HD TYR 534 7.025 -5.822 -8.792
200 HE1 TYR 534 1HE TYR 534 7.370 -1.709 -11.472
201 HE2 TYR 534 2HE TYR 534 6.131 -5.770 -11.080
202 HH TYR 534 HH TYR 534 5.600 -2.960 -12.787
203 H PHE 535 H PHE 535 9.353 -2.173 -5.415
204 HA PHE 535 HA PHE 535 8.945 -3.229 -2.706
205 HB2 PHE 535 2HB PHE 535 11.622 -3.061 -4.088
206 HB3 PHE 535 1HB PHE 535 11.317 -3.677 -2.469
207 HD1 PHE 535 2HD PHE 535 9.108 -5.447 -2.713
208 HD2 PHE 535 1HD PHE 535 12.283 -4.772 -5.466
209 HE1 PHE 535 2HE PHE 535 8.787 -7.706 -3.633
210 HE2 PHE 535 1HE PHE 535 11.966 -7.029 -6.392
211 HZ PHE 535 HZ PHE 535 10.217 -8.500 -5.474
212 H GLY 536 H GLY 536 8.890 -0.532 -4.409
213 HA2 GLY 536 2HA GLY 536 10.715 1.255 -3.284
214 HA3 GLY 536 1HA GLY 536 9.134 1.697 -3.919
215 HA PRO 537 HA PRO 537 8.162 2.610 0.356
216 HB2 PRO 537 2HB PRO 537 5.662 3.415 0.057
217 HB3 PRO 537 1HB PRO 537 6.951 4.328 -0.752
218 HG2 PRO 537 2HG PRO 537 5.214 2.147 -1.879
219 HG3 PRO 537 1HG PRO 537 5.479 3.780 -2.534
220 HD2 PRO 537 2HD PRO 537 6.851 1.611 -3.395
221 HD3 PRO 537 1HD PRO 537 7.587 3.229 -3.331
222 H ALA 538 H ALA 538 7.918 -0.094 -0.903
223 HA ALA 538 HA ALA 538 5.822 -1.213 0.784
224 HB1 ALA 538 1HB ALA 538 5.502 -1.263 -1.786
225 HB2 ALA 538 2HB ALA 538 5.254 -2.756 -0.879
226 HB3 ALA 538 3HB ALA 538 6.762 -2.498 -1.761
227 H ALA 539 H ALA 539 9.055 -1.164 -0.379
228 HA ALA 539 HA ALA 539 9.862 -2.969 1.711
229 HB1 ALA 539 1HB ALA 539 9.710 -4.740 0.339
230 HB2 ALA 539 2HB ALA 539 11.300 -4.179 -0.179
231 HB3 ALA 539 3HB ALA 539 9.869 -3.762 -1.119
232 H GLU 540 H GLU 540 10.366 -0.117 0.537
233 HA GLU 540 HA GLU 540 13.203 -0.112 0.019
234 HB2 GLU 540 2HB GLU 540 13.019 2.331 0.202
235 HB3 GLU 540 1HB GLU 540 11.812 1.674 -0.891
236 HG2 GLU 540 2HG GLU 540 10.246 1.720 1.143
237 HG3 GLU 540 1HG GLU 540 11.447 2.794 1.859
238 H GLY 541 H GLY 541 13.151 -1.563 2.093
239 HA2 GLY 541 2HA GLY 541 14.400 -1.620 4.108
240 HA3 GLY 541 1HA GLY 541 14.094 0.106 4.308
241 H ILE 542 H ILE 542 11.266 -0.985 3.289
242 HA ILE 542 HA ILE 542 9.990 -0.831 5.813
243 HB ILE 542 HB ILE 542 9.191 -0.979 2.996
244 HG12 ILE 542 2HG1 ILE 542 7.852 0.190 5.440
245 HG13 ILE 542 1HG1 ILE 542 9.077 1.012 4.478
246 HG21 ILE 542 1HG2 ILE 542 7.530 -2.385 5.077
247 HG22 ILE 542 2HG2 ILE 542 8.077 -2.996 3.512
248 HG23 ILE 542 3HG2 ILE 542 6.849 -1.728 3.588
249 HD11 ILE 542 3HD1 ILE 542 7.134 0.161 2.666
250 HD12 ILE 542 1HD1 ILE 542 7.454 1.806 3.215
251 HD13 ILE 542 2HD1 ILE 542 6.259 0.817 4.051
252 H TYR 543 H TYR 543 10.704 -3.484 3.567
253 HA TYR 543 HA TYR 543 9.303 -5.558 4.626
254 HB2 TYR 543 2HB TYR 543 11.111 -7.058 3.857
255 HB3 TYR 543 1HB TYR 543 10.675 -5.844 2.659
256 HD1 TYR 543 2HD TYR 543 12.135 -3.822 2.421
257 HD2 TYR 543 1HD TYR 543 13.312 -7.231 4.651
258 HE1 TYR 543 2HE TYR 543 14.484 -3.095 2.264
259 HE2 TYR 543 1HE TYR 543 15.668 -6.525 4.511
260 HH TYR 543 HH TYR 543 16.861 -4.520 2.407
261 H ALA 544 H ALA 544 12.024 -3.951 6.064
262 HA ALA 544 HA ALA 544 12.941 -5.823 7.886
263 HB1 ALA 544 1HB ALA 544 12.610 -2.870 8.363
264 HB2 ALA 544 2HB ALA 544 13.959 -3.617 7.508
265 HB3 ALA 544 3HB ALA 544 13.705 -3.956 9.220
266 H GLU 545 H GLU 545 9.894 -4.306 7.740
267 HA GLU 545 HA GLU 545 9.044 -4.165 10.365
268 HB2 GLU 545 2HB GLU 545 6.755 -4.707 9.323
269 HB3 GLU 545 1HB GLU 545 7.593 -3.280 8.728
270 HG2 GLU 545 2HG GLU 545 6.984 -4.179 6.744
271 HG3 GLU 545 1HG GLU 545 8.511 -5.029 6.956
272 H GLY 546 H GLY 546 9.021 -6.848 8.096
273 HA2 GLY 546 2HA GLY 546 8.733 -9.093 8.362
274 HA3 GLY 546 1HA GLY 546 9.647 -8.852 9.837
275 H LEU 547 H LEU 547 6.290 -8.061 8.825
276 HA LEU 547 HA LEU 547 5.138 -9.980 10.539
277 HB2 LEU 547 2HB LEU 547 4.399 -8.770 12.377
278 HB3 LEU 547 1HB LEU 547 6.066 -8.276 12.177
279 HG LEU 547 HG LEU 547 3.779 -6.643 11.098
280 HD11 LEU 547 1HD1 LEU 547 4.781 -6.912 13.862
281 HD12 LEU 547 2HD1 LEU 547 3.192 -6.430 13.268
282 HD13 LEU 547 3HD1 LEU 547 4.521 -5.271 13.268
283 HD21 LEU 547 3HD2 LEU 547 5.332 -4.974 10.774
284 HD22 LEU 547 1HD2 LEU 547 6.282 -6.413 10.407
285 HD23 LEU 547 2HD2 LEU 547 6.443 -5.629 11.978
286 H MET 548 H MET 548 4.608 -6.798 9.035
287 HA MET 548 HA MET 548 2.563 -7.709 7.356
288 HB2 MET 548 2HB MET 548 0.589 -6.646 8.404
289 HB3 MET 548 1HB MET 548 1.222 -7.987 9.350
290 HG2 MET 548 2HG MET 548 1.762 -6.678 11.089
291 HG3 MET 548 1HG MET 548 2.299 -5.351 10.059
292 HE1 MET 548 3HE MET 548 -1.813 -6.622 9.911
293 HE2 MET 548 1HE MET 548 -1.745 -6.414 11.661
294 HE3 MET 548 2HE MET 548 -0.599 -7.485 10.854
295 H HIS 549 H HIS 549 4.053 -5.037 9.047
296 HA HIS 549 HA HIS 549 2.987 -2.850 7.769
297 HB2 HIS 549 2HB HIS 549 5.383 -3.431 9.276
298 HB3 HIS 549 1HB HIS 549 5.703 -2.244 8.014
299 HD1 HIS 549 1HD HIS 549 2.320 -2.278 9.517
300 HD2 HIS 549 2HD HIS 549 5.908 -0.249 10.028
301 HE1 HIS 549 1HE HIS 549 1.766 -0.291 10.941
302 HE2 HIS 549 2HE HIS 549 3.973 0.860 11.339
303 H ASN 550 H ASN 550 4.768 -5.342 6.255
304 HA ASN 550 HA ASN 550 6.010 -3.819 4.208
305 HB2 ASN 550 2HB ASN 550 6.744 -6.092 4.795
306 HB3 ASN 550 1HB ASN 550 5.211 -6.736 4.212
307 HD21 ASN 550 1HD2 ASN 550 5.050 -7.279 2.144
308 HD22 ASN 550 2HD2 ASN 550 6.213 -6.915 0.919
309 H GLN 551 H GLN 551 2.843 -3.996 4.797
310 HA GLN 551 HA GLN 551 1.495 -4.774 2.541
311 HB2 GLN 551 2HB GLN 551 -0.168 -2.991 3.197
312 HB3 GLN 551 1HB GLN 551 0.285 -4.112 4.475
313 HG2 GLN 551 2HG GLN 551 2.066 -1.878 4.497
314 HG3 GLN 551 1HG GLN 551 0.401 -1.305 4.508
315 HE21 GLN 551 1HE2 GLN 551 1.494 -0.600 6.658
316 HE22 GLN 551 2HE2 GLN 551 1.187 -1.641 8.003
317 H ASP 552 H ASP 552 0.182 -2.921 1.251
318 HA ASP 552 HA ASP 552 2.132 -1.047 0.090
319 HB2 ASP 552 2HB ASP 552 0.388 -3.033 -1.354
320 HB3 ASP 552 1HB ASP 552 1.000 -1.588 -2.154
321 H GLY 553 H GLY 553 -1.320 -1.958 -0.218
322 HA2 GLY 553 2HA GLY 553 -2.984 -0.393 0.693
323 HA3 GLY 553 1HA GLY 553 -1.952 0.910 0.128
324 H LEU 554 H LEU 554 -2.984 -2.052 -1.547
325 HA LEU 554 HA LEU 554 -3.321 -1.041 -4.027
326 HB2 LEU 554 2HB LEU 554 -5.312 -2.756 -4.181
327 HB3 LEU 554 1HB LEU 554 -3.648 -3.286 -4.049
328 HG LEU 554 HG LEU 554 -4.665 -2.997 -1.414
329 HD11 LEU 554 1HD1 LEU 554 -6.803 -3.433 -3.044
330 HD12 LEU 554 2HD1 LEU 554 -6.707 -3.901 -1.347
331 HD13 LEU 554 3HD1 LEU 554 -6.332 -5.076 -2.609
332 HD21 LEU 554 3HD2 LEU 554 -2.879 -4.495 -2.021
333 HD22 LEU 554 1HD2 LEU 554 -3.958 -5.406 -3.076
334 HD23 LEU 554 2HD2 LEU 554 -4.210 -5.424 -1.331
335 H ILE 555 H ILE 555 -6.249 -1.590 -2.080
336 HA ILE 555 HA ILE 555 -8.221 -0.459 -1.956
337 HB ILE 555 HB ILE 555 -6.733 2.032 -2.741
338 HG12 ILE 555 2HG1 ILE 555 -5.358 1.171 -1.032
339 HG13 ILE 555 1HG1 ILE 555 -6.419 2.318 -0.224
340 HG21 ILE 555 1HG2 ILE 555 -8.499 2.641 -0.736
341 HG22 ILE 555 2HG2 ILE 555 -9.357 1.405 -1.655
342 HG23 ILE 555 3HG2 ILE 555 -8.783 2.863 -2.462
343 HD11 ILE 555 3HD1 ILE 555 -6.187 -0.578 0.074
344 HD12 ILE 555 1HD1 ILE 555 -7.836 0.038 0.024
345 HD13 ILE 555 2HD1 ILE 555 -6.703 0.648 1.230
346 H CYS 556 H CYS 556 -9.671 -0.911 -3.482
347 HA CYS 556 HA CYS 556 -9.226 -0.723 -6.247
348 HB2 CYS 556 2HB CYS 556 -11.682 -1.046 -4.552
349 HB3 CYS 556 1HB CYS 556 -11.831 -0.833 -6.294
350 H GLY 557 H GLY 557 -10.531 1.542 -3.924
351 HA2 GLY 557 2HA GLY 557 -10.384 3.903 -4.283
352 HA3 GLY 557 1HA GLY 557 -10.509 3.609 -6.013
353 H LEU 558 H LEU 558 -12.690 1.776 -5.808
354 HA LEU 558 HA LEU 558 -14.927 2.620 -4.458
355 HB2 LEU 558 2HB LEU 558 -16.038 4.149 -5.880
356 HB3 LEU 558 1HB LEU 558 -14.415 4.771 -5.674
357 HG LEU 558 HG LEU 558 -15.005 3.044 -8.022
358 HD11 LEU 558 1HD1 LEU 558 -15.673 5.975 -7.836
359 HD12 LEU 558 2HD1 LEU 558 -16.813 4.648 -8.063
360 HD13 LEU 558 3HD1 LEU 558 -15.640 5.028 -9.323
361 HD21 LEU 558 3HD2 LEU 558 -12.802 3.503 -8.101
362 HD22 LEU 558 1HD2 LEU 558 -12.964 5.002 -7.185
363 HD23 LEU 558 2HD2 LEU 558 -13.380 4.968 -8.900
364 H ARG 559 H ARG 559 -13.602 0.352 -5.916
365 HA ARG 559 HA ARG 559 -14.292 -1.578 -6.911
366 HB2 ARG 559 2HB ARG 559 -17.048 -0.362 -7.105
367 HB3 ARG 559 1HB ARG 559 -16.623 -2.066 -7.182
368 HG2 ARG 559 2HG ARG 559 -17.114 -2.142 -5.028
369 HG3 ARG 559 1HG ARG 559 -15.594 -1.285 -4.768
370 HD2 ARG 559 2HD ARG 559 -17.478 -0.196 -3.616
371 HD3 ARG 559 1HD ARG 559 -16.753 0.850 -4.836
372 HE ARG 559 HE ARG 559 -18.738 0.846 -5.958
373 HH11 ARG 559 1HH1 ARG 559 -18.719 -1.841 -3.728
374 HH12 ARG 559 2HH1 ARG 559 -20.372 -2.262 -4.026
375 HH21 ARG 559 1HH2 ARG 559 -20.914 0.294 -6.349
376 HH22 ARG 559 2HH2 ARG 559 -21.617 -1.051 -5.514
377 H GLN 560 H GLN 560 -14.162 -2.270 -8.944
378 HA GLN 560 HA GLN 560 -15.167 -0.726 -11.161
379 HB2 GLN 560 2HB GLN 560 -12.960 0.330 -10.576
380 HB3 GLN 560 1HB GLN 560 -12.191 -1.202 -10.975
381 HG2 GLN 560 2HG GLN 560 -13.441 -0.920 -13.237
382 HG3 GLN 560 1HG GLN 560 -13.517 0.777 -12.764
383 HE21 GLN 560 1HE2 GLN 560 -11.299 -1.919 -13.268
384 HE22 GLN 560 2HE2 GLN 560 -9.941 -0.953 -13.723
Start of MODEL 17
1 H1 ALA 507 1HT ALA 507 -14.390 7.151 -0.297
2 H2 ALA 507 2HT ALA 507 -14.560 6.116 1.062
3 H3 ALA 507 3HT ALA 507 -15.458 7.577 0.975
4 HA ALA 507 HA ALA 507 -16.961 5.965 0.445
5 HB1 ALA 507 2HB ALA 507 -16.114 6.573 -2.333
6 HB2 ALA 507 3HB ALA 507 -16.459 7.933 -1.263
7 HB3 ALA 507 1HB ALA 507 -17.699 6.718 -1.571
8 H GLN 508 H GLN 508 -15.167 4.217 1.166
9 HA GLN 508 HA GLN 508 -14.747 2.421 -1.128
10 HB2 GLN 508 2HB GLN 508 -13.367 2.198 1.540
11 HB3 GLN 508 1HB GLN 508 -12.908 1.453 0.015
12 HG2 GLN 508 2HG GLN 508 -11.382 3.143 0.142
13 HG3 GLN 508 1HG GLN 508 -12.663 3.931 -0.778
14 HE21 GLN 508 1HE2 GLN 508 -11.772 5.932 -0.058
15 HE22 GLN 508 2HE2 GLN 508 -12.134 6.531 1.522
16 HA PRO 509 HA PRO 509 -17.415 -0.465 0.940
17 HB2 PRO 509 2HB PRO 509 -16.919 -2.637 -0.562
18 HB3 PRO 509 1HB PRO 509 -17.704 -1.204 -1.231
19 HG2 PRO 509 2HG PRO 509 -14.993 -2.233 -1.697
20 HG3 PRO 509 1HG PRO 509 -15.950 -1.110 -2.673
21 HD2 PRO 509 2HD PRO 509 -13.867 -0.518 -0.745
22 HD3 PRO 509 1HD PRO 509 -14.718 0.595 -1.834
23 H LYS 510 H LYS 510 -14.528 -0.215 1.957
24 HA LYS 510 HA LYS 510 -13.190 -1.223 3.485
25 HB2 LYS 510 2HB LYS 510 -15.778 -2.687 3.892
26 HB3 LYS 510 1HB LYS 510 -14.349 -3.091 4.829
27 HG2 LYS 510 2HG LYS 510 -14.566 -0.316 4.990
28 HG3 LYS 510 1HG LYS 510 -16.211 -0.927 5.168
29 HD2 LYS 510 2HD LYS 510 -15.782 -1.848 7.178
30 HD3 LYS 510 1HD LYS 510 -14.181 -2.406 6.690
31 HE2 LYS 510 2HE LYS 510 -14.318 0.486 6.877
32 HE3 LYS 510 1HE LYS 510 -14.753 -0.297 8.396
33 HZ1 LYS 510 3HZ LYS 510 -12.470 -0.071 8.535
34 HZ2 LYS 510 1HZ LYS 510 -12.214 -0.447 6.904
35 HZ3 LYS 510 2HZ LYS 510 -12.640 -1.666 7.998
36 H CYS 511 H CYS 511 -12.117 -1.939 1.376
37 HA CYS 511 HA CYS 511 -11.726 -4.832 1.537
38 HB2 CYS 511 2HB CYS 511 -11.702 -4.990 -0.951
39 HB3 CYS 511 1HB CYS 511 -13.288 -4.607 -0.290
40 H ASN 512 H ASN 512 -10.211 -2.469 2.385
41 HA ASN 512 HA ASN 512 -7.977 -2.290 0.560
42 HB2 ASN 512 2HB ASN 512 -7.015 -0.775 2.275
43 HB3 ASN 512 1HB ASN 512 -8.631 -0.289 1.771
44 HD21 ASN 512 1HD2 ASN 512 -10.363 -0.567 3.193
45 HD22 ASN 512 2HD2 ASN 512 -10.118 -0.789 4.889
46 HA PRO 513 HA PRO 513 -5.513 -5.440 2.367
47 HB2 PRO 513 2HB PRO 513 -3.000 -4.486 2.018
48 HB3 PRO 513 1HB PRO 513 -3.997 -5.080 0.687
49 HG2 PRO 513 2HG PRO 513 -3.441 -2.270 1.531
50 HG3 PRO 513 1HG PRO 513 -3.573 -2.947 -0.097
51 HD2 PRO 513 2HD PRO 513 -5.568 -1.546 1.144
52 HD3 PRO 513 1HD PRO 513 -5.851 -2.755 -0.123
53 H ASN 514 H ASN 514 -3.300 -2.856 3.224
54 HA ASN 514 HA ASN 514 -3.922 -3.218 6.075
55 HB2 ASN 514 2HB ASN 514 -1.421 -3.734 4.611
56 HB3 ASN 514 1HB ASN 514 -1.231 -2.776 6.074
57 HD21 ASN 514 1HD2 ASN 514 -2.266 -5.846 4.773
58 HD22 ASN 514 2HD2 ASN 514 -2.212 -6.719 6.263
59 H LEU 515 H LEU 515 -1.641 -1.426 4.079
60 HA LEU 515 HA LEU 515 -0.847 0.711 4.276
61 HB2 LEU 515 2HB LEU 515 -2.431 2.242 3.373
62 HB3 LEU 515 1HB LEU 515 -2.680 0.665 2.647
63 HG LEU 515 HG LEU 515 -4.426 0.650 4.779
64 HD11 LEU 515 1HD1 LEU 515 -3.791 3.317 4.436
65 HD12 LEU 515 2HD1 LEU 515 -5.224 2.678 5.243
66 HD13 LEU 515 3HD1 LEU 515 -5.297 3.123 3.539
67 HD21 LEU 515 3HD2 LEU 515 -6.158 0.970 2.995
68 HD22 LEU 515 1HD2 LEU 515 -4.963 -0.285 2.665
69 HD23 LEU 515 2HD2 LEU 515 -4.837 1.284 1.868
70 H HIS 516 H HIS 516 -0.961 -0.202 6.804
71 HA HIS 516 HA HIS 516 -2.319 1.870 8.371
72 HB2 HIS 516 2HB HIS 516 -1.257 -0.856 9.046
73 HB3 HIS 516 1HB HIS 516 -1.587 0.323 10.311
74 HD1 HIS 516 1HD HIS 516 -4.099 1.051 8.000
75 HD2 HIS 516 2HD HIS 516 -3.478 -2.123 10.611
76 HE1 HIS 516 1HE HIS 516 -6.358 -0.006 8.324
77 HE2 HIS 516 2HE HIS 516 -5.972 -1.869 9.975
78 H TYR 517 H TYR 517 0.724 1.249 7.073
79 HA TYR 517 HA TYR 517 2.153 2.432 9.322
80 HB2 TYR 517 2HB TYR 517 4.140 1.710 8.350
81 HB3 TYR 517 1HB TYR 517 3.008 0.459 7.855
82 HD1 TYR 517 1HD TYR 517 4.257 3.757 6.582
83 HD2 TYR 517 2HD TYR 517 3.166 -0.254 5.667
84 HE1 TYR 517 1HE TYR 517 4.871 4.132 4.241
85 HE2 TYR 517 2HE TYR 517 3.779 0.112 3.319
86 HH TYR 517 HH TYR 517 5.426 2.991 2.272
87 H TRP 518 H TRP 518 0.866 3.312 6.238
88 HA TRP 518 HA TRP 518 2.167 5.933 6.417
89 HB2 TRP 518 2HB TRP 518 2.332 4.320 4.316
90 HB3 TRP 518 1HB TRP 518 0.786 5.066 3.932
91 HD1 TRP 518 HD TRP 518 0.989 7.139 2.486
92 HE1 TRP 518 1HE TRP 518 2.783 8.933 2.046
93 HE3 TRP 518 3HE TRP 518 4.546 5.547 5.788
94 HZ2 TRP 518 2HZ TRP 518 5.367 9.585 2.981
95 HZ3 TRP 518 3HZ TRP 518 6.650 6.810 5.957
96 HH2 TRP 518 HH TRP 518 7.051 8.787 4.581
97 H THR 519 H THR 519 0.995 7.606 6.830
98 HA THR 519 HA THR 519 -1.247 8.047 7.960
99 HB THR 519 HB THR 519 -0.130 9.949 7.170
100 HG1 THR 519 1HG THR 519 -2.509 10.073 7.201
101 HG21 THR 519 3HG2 THR 519 0.249 8.607 4.816
102 HG22 THR 519 1HG2 THR 519 0.668 10.293 5.128
103 HG23 THR 519 2HG2 THR 519 -0.870 9.894 4.362
104 H THR 520 H THR 520 -1.419 7.607 4.408
105 HA THR 520 HA THR 520 -3.623 5.894 4.455
106 HB THR 520 HB THR 520 -4.637 8.113 5.336
107 HG1 THR 520 1HG THR 520 -5.871 6.879 3.109
108 HG21 THR 520 3HG2 THR 520 -4.614 8.728 2.389
109 HG22 THR 520 1HG2 THR 520 -3.752 9.622 3.642
110 HG23 THR 520 2HG2 THR 520 -5.515 9.602 3.631
111 H GLN 521 H GLN 521 -2.289 8.646 2.636
112 HA GLN 521 HA GLN 521 -3.045 8.086 0.097
113 HB2 GLN 521 2HB GLN 521 -0.911 9.071 -0.673
114 HB3 GLN 521 1HB GLN 521 -1.693 10.017 0.586
115 HG2 GLN 521 2HG GLN 521 -0.166 8.902 2.232
116 HG3 GLN 521 1HG GLN 521 0.696 8.216 0.855
117 HE21 GLN 521 1HE2 GLN 521 0.683 10.682 3.013
118 HE22 GLN 521 2HE2 GLN 521 1.608 11.847 2.135
119 H ASP 522 H ASP 522 -2.134 6.988 -1.683
120 HA ASP 522 HA ASP 522 -1.643 4.313 -1.333
121 HB2 ASP 522 2HB ASP 522 -0.970 6.176 -3.597
122 HB3 ASP 522 1HB ASP 522 -0.598 4.457 -3.686
123 H GLU 523 H GLU 523 -0.116 3.858 0.223
124 HA GLU 523 HA GLU 523 2.602 4.834 -0.124
125 HB2 GLU 523 2HB GLU 523 3.047 3.707 2.004
126 HB3 GLU 523 1HB GLU 523 1.693 4.816 2.114
127 HG2 GLU 523 2HG GLU 523 1.088 1.975 1.534
128 HG3 GLU 523 1HG GLU 523 1.625 2.384 3.164
129 H GLY 524 H GLY 524 2.461 3.600 -2.247
130 HA2 GLY 524 2HA GLY 524 3.969 1.970 -3.191
131 HA3 GLY 524 1HA GLY 524 3.613 0.924 -1.820
132 H ALA 525 H ALA 525 0.916 2.579 -2.963
133 HA ALA 525 HA ALA 525 -0.428 0.222 -3.727
134 HB1 ALA 525 1HB ALA 525 -1.459 2.869 -4.591
135 HB2 ALA 525 2HB ALA 525 -1.288 2.563 -2.862
136 HB3 ALA 525 3HB ALA 525 -2.306 1.512 -3.847
137 H ALA 526 H ALA 526 1.611 -0.101 -5.317
138 HA ALA 526 HA ALA 526 2.333 -0.397 -7.439
139 HB1 ALA 526 1HB ALA 526 0.423 -1.688 -7.822
140 HB2 ALA 526 2HB ALA 526 0.466 -0.559 -9.177
141 HB3 ALA 526 3HB ALA 526 -0.636 -0.278 -7.829
142 H ILE 527 H ILE 527 3.514 1.504 -7.492
143 HA ILE 527 HA ILE 527 2.970 3.205 -9.648
144 HB ILE 527 HB ILE 527 1.370 4.208 -8.197
145 HG12 ILE 527 2HG1 ILE 527 3.757 6.042 -8.055
146 HG13 ILE 527 1HG1 ILE 527 2.977 5.661 -9.588
147 HG21 ILE 527 1HG2 ILE 527 3.452 4.852 -6.172
148 HG22 ILE 527 2HG2 ILE 527 2.615 3.298 -6.150
149 HG23 ILE 527 3HG2 ILE 527 1.697 4.799 -5.997
150 HD11 ILE 527 3HD1 ILE 527 0.820 6.418 -8.282
151 HD12 ILE 527 1HD1 ILE 527 1.894 7.585 -9.054
152 HD13 ILE 527 2HD1 ILE 527 2.005 7.299 -7.317
153 H GLY 528 H GLY 528 4.568 3.107 -6.476
154 HA2 GLY 528 2HA GLY 528 6.757 3.382 -5.854
155 HA3 GLY 528 1HA GLY 528 7.159 2.829 -7.467
156 H ALA 529 H ALA 529 5.578 5.328 -8.474
157 HA ALA 529 HA ALA 529 6.281 7.293 -9.405
158 HB1 ALA 529 1HB ALA 529 7.285 8.244 -6.800
159 HB2 ALA 529 2HB ALA 529 5.632 7.627 -6.822
160 HB3 ALA 529 3HB ALA 529 6.094 8.954 -7.890
161 H ALA 530 H ALA 530 8.293 5.277 -9.614
162 HA ALA 530 HA ALA 530 10.462 6.535 -10.601
163 HB1 ALA 530 1HB ALA 530 10.518 6.687 -7.692
164 HB2 ALA 530 2HB ALA 530 11.504 7.535 -8.882
165 HB3 ALA 530 3HB ALA 530 11.957 5.914 -8.355
166 H TRP 531 H TRP 531 9.272 4.319 -11.318
167 HA TRP 531 HA TRP 531 9.298 1.985 -11.408
168 HB2 TRP 531 2HB TRP 531 11.703 1.347 -12.219
169 HB3 TRP 531 1HB TRP 531 10.638 2.313 -13.235
170 HD1 TRP 531 HD TRP 531 13.137 3.247 -10.428
171 HE1 TRP 531 1HE TRP 531 14.640 5.153 -11.296
172 HE3 TRP 531 3HE TRP 531 11.205 3.709 -15.130
173 HZ2 TRP 531 2HZ TRP 531 14.958 6.649 -13.671
174 HZ3 TRP 531 3HZ TRP 531 12.162 5.399 -16.640
175 HH2 TRP 531 HH TRP 531 13.999 6.839 -15.925
176 H ILE 532 H ILE 532 9.354 2.622 -8.869
177 HA ILE 532 HA ILE 532 11.154 0.624 -7.757
178 HB ILE 532 HB ILE 532 12.063 2.858 -7.404
179 HG12 ILE 532 2HG1 ILE 532 11.413 2.584 -4.655
180 HG13 ILE 532 1HG1 ILE 532 11.410 0.958 -5.330
181 HG21 ILE 532 1HG2 ILE 532 10.854 4.625 -6.740
182 HG22 ILE 532 2HG2 ILE 532 9.960 3.694 -5.537
183 HG23 ILE 532 3HG2 ILE 532 9.472 3.642 -7.234
184 HD11 ILE 532 3HD1 ILE 532 13.575 1.607 -4.381
185 HD12 ILE 532 1HD1 ILE 532 13.679 2.916 -5.561
186 HD13 ILE 532 2HD1 ILE 532 13.671 1.239 -6.105
187 HA PRO 533 HA PRO 533 6.640 0.898 -6.047
188 HB2 PRO 533 2HB PRO 533 5.152 -0.515 -7.813
189 HB3 PRO 533 1HB PRO 533 5.357 1.234 -7.933
190 HG2 PRO 533 2HG PRO 533 6.778 -0.936 -9.418
191 HG3 PRO 533 1HG PRO 533 6.117 0.590 -10.030
192 HD2 PRO 533 2HD PRO 533 8.744 0.252 -9.497
193 HD3 PRO 533 1HD PRO 533 7.910 1.809 -9.305
194 H TYR 534 H TYR 534 8.516 -1.502 -7.671
195 HA TYR 534 HA TYR 534 7.331 -3.822 -6.665
196 HB2 TYR 534 2HB TYR 534 9.432 -4.925 -7.287
197 HB3 TYR 534 1HB TYR 534 8.884 -3.832 -8.550
198 HD1 TYR 534 2HD TYR 534 10.125 -1.688 -8.989
199 HD2 TYR 534 1HD TYR 534 11.466 -4.555 -6.112
200 HE1 TYR 534 2HE TYR 534 12.351 -0.647 -8.957
201 HE2 TYR 534 1HE TYR 534 13.682 -3.502 -6.090
202 HH TYR 534 HH TYR 534 14.389 -0.686 -6.892
203 H PHE 535 H PHE 535 10.179 -2.016 -5.449
204 HA PHE 535 HA PHE 535 9.603 -3.160 -2.800
205 HB2 PHE 535 2HB PHE 535 12.124 -3.266 -4.347
206 HB3 PHE 535 1HB PHE 535 12.272 -2.914 -2.631
207 HD1 PHE 535 1HD PHE 535 10.247 -5.254 -4.729
208 HD2 PHE 535 2HD PHE 535 12.783 -4.732 -1.352
209 HE1 PHE 535 1HE PHE 535 10.054 -7.651 -4.221
210 HE2 PHE 535 2HE PHE 535 12.595 -7.130 -0.837
211 HZ PHE 535 HZ PHE 535 11.230 -8.593 -2.273
212 H GLY 536 H GLY 536 9.626 -0.385 -4.462
213 HA2 GLY 536 2HA GLY 536 11.221 1.422 -3.063
214 HA3 GLY 536 1HA GLY 536 9.707 1.835 -3.858
215 HA PRO 537 HA PRO 537 8.265 2.592 0.307
216 HB2 PRO 537 2HB PRO 537 5.790 3.358 -0.241
217 HB3 PRO 537 1HB PRO 537 7.143 4.332 -0.852
218 HG2 PRO 537 2HG PRO 537 5.607 2.170 -2.268
219 HG3 PRO 537 1HG PRO 537 5.900 3.837 -2.816
220 HD2 PRO 537 2HD PRO 537 7.419 1.751 -3.613
221 HD3 PRO 537 1HD PRO 537 8.108 3.373 -3.370
222 H ALA 538 H ALA 538 8.210 -0.059 -1.086
223 HA ALA 538 HA ALA 538 5.955 -1.284 0.294
224 HB1 ALA 538 1HB ALA 538 5.658 -2.774 -1.466
225 HB2 ALA 538 2HB ALA 538 7.293 -2.520 -2.082
226 HB3 ALA 538 3HB ALA 538 6.060 -1.278 -2.313
227 H ALA 539 H ALA 539 9.315 -1.107 -0.407
228 HA ALA 539 HA ALA 539 9.891 -2.914 1.753
229 HB1 ALA 539 1HB ALA 539 10.497 -3.602 -1.076
230 HB2 ALA 539 2HB ALA 539 9.839 -4.612 0.213
231 HB3 ALA 539 3HB ALA 539 11.548 -4.173 0.219
232 H GLU 540 H GLU 540 10.489 -0.038 0.580
233 HA GLU 540 HA GLU 540 13.367 0.036 0.508
234 HB2 GLU 540 2HB GLU 540 13.108 2.463 0.560
235 HB3 GLU 540 1HB GLU 540 12.041 1.752 -0.638
236 HG2 GLU 540 2HG GLU 540 10.362 2.858 0.277
237 HG3 GLU 540 1HG GLU 540 10.547 1.855 1.716
238 H GLY 541 H GLY 541 13.082 -1.363 2.586
239 HA2 GLY 541 2HA GLY 541 14.046 -1.296 4.761
240 HA3 GLY 541 1HA GLY 541 13.574 0.399 4.879
241 H ILE 542 H ILE 542 10.972 -0.651 3.539
242 HA ILE 542 HA ILE 542 9.354 -0.670 5.818
243 HB ILE 542 HB ILE 542 9.007 -0.927 2.916
244 HG12 ILE 542 2HG1 ILE 542 7.064 0.186 4.911
245 HG13 ILE 542 1HG1 ILE 542 8.562 1.034 4.543
246 HG21 ILE 542 1HG2 ILE 542 7.917 -2.966 3.296
247 HG22 ILE 542 2HG2 ILE 542 6.625 -1.763 3.209
248 HG23 ILE 542 3HG2 ILE 542 7.148 -2.382 4.775
249 HD11 ILE 542 3HD1 ILE 542 6.847 1.949 3.187
250 HD12 ILE 542 1HD1 ILE 542 6.341 0.348 2.645
251 HD13 ILE 542 2HD1 ILE 542 7.904 0.994 2.147
252 H TYR 543 H TYR 543 10.404 -3.297 3.662
253 HA TYR 543 HA TYR 543 9.047 -5.442 4.571
254 HB2 TYR 543 2HB TYR 543 10.932 -6.846 3.958
255 HB3 TYR 543 1HB TYR 543 10.738 -5.541 2.791
256 HD1 TYR 543 2HD TYR 543 12.200 -3.457 3.145
257 HD2 TYR 543 1HD TYR 543 12.996 -7.217 4.942
258 HE1 TYR 543 2HE TYR 543 14.548 -2.788 3.474
259 HE2 TYR 543 1HE TYR 543 15.348 -6.570 5.285
260 HH TYR 543 HH TYR 543 16.766 -3.940 3.762
261 H ALA 544 H ALA 544 11.526 -3.732 6.324
262 HA ALA 544 HA ALA 544 12.257 -5.571 8.262
263 HB1 ALA 544 1HB ALA 544 13.264 -3.346 8.002
264 HB2 ALA 544 2HB ALA 544 12.788 -3.671 9.670
265 HB3 ALA 544 3HB ALA 544 11.796 -2.622 8.658
266 H GLU 545 H GLU 545 9.218 -4.139 7.720
267 HA GLU 545 HA GLU 545 8.036 -3.992 10.211
268 HB2 GLU 545 2HB GLU 545 5.915 -4.602 8.891
269 HB3 GLU 545 1HB GLU 545 6.791 -3.166 8.382
270 HG2 GLU 545 2HG GLU 545 6.465 -4.109 6.353
271 HG3 GLU 545 1HG GLU 545 7.966 -4.925 6.776
272 H GLY 546 H GLY 546 8.362 -6.697 7.991
273 HA2 GLY 546 2HA GLY 546 8.095 -8.947 8.249
274 HA3 GLY 546 1HA GLY 546 8.818 -8.668 9.820
275 H LEU 547 H LEU 547 5.586 -7.970 8.404
276 HA LEU 547 HA LEU 547 4.296 -9.897 10.022
277 HB2 LEU 547 2HB LEU 547 3.302 -8.666 11.715
278 HB3 LEU 547 1HB LEU 547 4.954 -8.085 11.688
279 HG LEU 547 HG LEU 547 2.744 -6.619 10.269
280 HD11 LEU 547 1HD1 LEU 547 2.059 -5.570 12.140
281 HD12 LEU 547 2HD1 LEU 547 3.649 -5.651 12.900
282 HD13 LEU 547 3HD1 LEU 547 2.594 -7.064 12.908
283 HD21 LEU 547 3HD2 LEU 547 5.347 -6.289 9.989
284 HD22 LEU 547 1HD2 LEU 547 5.148 -5.364 11.477
285 HD23 LEU 547 2HD2 LEU 547 4.241 -4.915 10.032
286 H MET 548 H MET 548 3.868 -6.807 8.322
287 HA MET 548 HA MET 548 2.126 -7.790 6.404
288 HB2 MET 548 2HB MET 548 0.831 -7.231 8.957
289 HB3 MET 548 1HB MET 548 0.106 -6.340 7.625
290 HG2 MET 548 2HG MET 548 -0.724 -8.195 6.651
291 HG3 MET 548 1HG MET 548 0.638 -9.199 7.146
292 HE1 MET 548 3HE MET 548 -2.654 -10.867 8.465
293 HE2 MET 548 1HE MET 548 -1.898 -10.363 6.954
294 HE3 MET 548 2HE MET 548 -3.149 -9.361 7.691
295 H HIS 549 H HIS 549 3.258 -5.099 8.293
296 HA HIS 549 HA HIS 549 2.188 -2.936 6.956
297 HB2 HIS 549 2HB HIS 549 4.518 -3.429 8.643
298 HB3 HIS 549 1HB HIS 549 4.754 -2.100 7.513
299 HD1 HIS 549 1HD HIS 549 1.267 -2.358 8.440
300 HD2 HIS 549 2HD HIS 549 4.669 -0.613 10.064
301 HE1 HIS 549 1HE HIS 549 0.428 -0.675 10.094
302 HE2 HIS 549 2HE HIS 549 2.499 0.427 11.017
303 H ASN 550 H ASN 550 4.342 -5.277 5.674
304 HA ASN 550 HA ASN 550 5.589 -3.602 3.724
305 HB2 ASN 550 2HB ASN 550 6.411 -5.695 2.750
306 HB3 ASN 550 1HB ASN 550 6.655 -5.671 4.493
307 HD21 ASN 550 1HD2 ASN 550 5.096 -7.198 1.850
308 HD22 ASN 550 2HD2 ASN 550 4.344 -8.473 2.741
309 H GLN 551 H GLN 551 2.485 -4.104 3.963
310 HA GLN 551 HA GLN 551 1.440 -5.294 1.732
311 HB2 GLN 551 2HB GLN 551 -0.437 -3.659 1.983
312 HB3 GLN 551 1HB GLN 551 0.025 -4.464 3.478
313 HG2 GLN 551 2HG GLN 551 -0.093 -2.348 4.263
314 HG3 GLN 551 1HG GLN 551 1.574 -2.323 3.700
315 HE21 GLN 551 1HE2 GLN 551 -1.553 -2.043 2.046
316 HE22 GLN 551 2HE2 GLN 551 -1.199 -0.542 1.267
317 H ASP 552 H ASP 552 0.097 -3.751 0.101
318 HA ASP 552 HA ASP 552 2.076 -2.025 -1.238
319 HB2 ASP 552 2HB ASP 552 0.492 -4.291 -2.256
320 HB3 ASP 552 1HB ASP 552 0.461 -2.858 -3.280
321 H GLY 553 H GLY 553 -1.415 -2.718 -0.944
322 HA2 GLY 553 2HA GLY 553 -2.834 -0.843 -0.223
323 HA3 GLY 553 1HA GLY 553 -1.878 0.183 -1.280
324 H LEU 554 H LEU 554 -3.298 -3.017 -1.915
325 HA LEU 554 HA LEU 554 -4.066 -2.639 -4.480
326 HB2 LEU 554 2HB LEU 554 -6.116 -4.168 -3.788
327 HB3 LEU 554 1HB LEU 554 -4.479 -4.782 -3.898
328 HG LEU 554 HG LEU 554 -4.888 -3.806 -1.247
329 HD11 LEU 554 1HD1 LEU 554 -7.322 -4.504 -2.244
330 HD12 LEU 554 2HD1 LEU 554 -6.864 -4.581 -0.543
331 HD13 LEU 554 3HD1 LEU 554 -6.765 -6.026 -1.549
332 HD21 LEU 554 3HD2 LEU 554 -3.334 -5.448 -1.328
333 HD22 LEU 554 1HD2 LEU 554 -4.161 -6.318 -2.619
334 HD23 LEU 554 2HD2 LEU 554 -4.732 -6.456 -0.957
335 H ILE 555 H ILE 555 -6.661 -2.549 -2.053
336 HA ILE 555 HA ILE 555 -8.521 -1.243 -1.861
337 HB ILE 555 HB ILE 555 -7.116 0.842 -3.511
338 HG12 ILE 555 2HG1 ILE 555 -5.526 0.195 -1.831
339 HG13 ILE 555 1HG1 ILE 555 -6.245 1.727 -1.345
340 HG21 ILE 555 1HG2 ILE 555 -8.417 2.226 -1.672
341 HG22 ILE 555 2HG2 ILE 555 -9.425 0.778 -1.656
342 HG23 ILE 555 3HG2 ILE 555 -9.200 1.681 -3.155
343 HD11 ILE 555 3HD1 ILE 555 -7.759 0.491 0.147
344 HD12 ILE 555 1HD1 ILE 555 -6.057 0.288 0.555
345 HD13 ILE 555 2HD1 ILE 555 -6.921 -0.995 -0.290
346 H CYS 556 H CYS 556 -10.359 -1.587 -2.914
347 HA CYS 556 HA CYS 556 -10.481 -2.409 -5.597
348 HB2 CYS 556 2HB CYS 556 -12.751 -1.302 -3.937
349 HB3 CYS 556 1HB CYS 556 -12.889 -2.349 -5.345
350 H GLY 557 H GLY 557 -10.763 0.737 -4.105
351 HA2 GLY 557 2HA GLY 557 -10.271 2.719 -5.366
352 HA3 GLY 557 1HA GLY 557 -10.907 1.916 -6.796
353 H LEU 558 H LEU 558 -13.196 0.884 -5.240
354 HA LEU 558 HA LEU 558 -14.721 2.987 -4.188
355 HB2 LEU 558 2HB LEU 558 -16.230 3.414 -6.037
356 HB3 LEU 558 1HB LEU 558 -14.584 3.814 -6.489
357 HG LEU 558 HG LEU 558 -15.747 1.144 -7.223
358 HD11 LEU 558 1HD1 LEU 558 -16.818 1.932 -9.082
359 HD12 LEU 558 2HD1 LEU 558 -15.856 3.409 -9.148
360 HD13 LEU 558 3HD1 LEU 558 -17.142 3.247 -7.952
361 HD21 LEU 558 3HD2 LEU 558 -14.118 2.040 -9.239
362 HD22 LEU 558 1HD2 LEU 558 -13.645 0.941 -7.941
363 HD23 LEU 558 2HD2 LEU 558 -13.331 2.672 -7.793
364 H ARG 559 H ARG 559 -14.706 0.028 -6.054
365 HA ARG 559 HA ARG 559 -15.667 -1.848 -4.503
366 HB2 ARG 559 2HB ARG 559 -18.161 -1.893 -4.771
367 HB3 ARG 559 1HB ARG 559 -17.579 -0.618 -3.709
368 HG2 ARG 559 2HG ARG 559 -17.641 0.692 -6.070
369 HG3 ARG 559 1HG ARG 559 -18.962 -0.455 -6.294
370 HD2 ARG 559 2HD ARG 559 -19.798 0.302 -4.015
371 HD3 ARG 559 1HD ARG 559 -18.644 1.628 -4.150
372 HE ARG 559 HE ARG 559 -20.183 1.580 -6.479
373 HH11 ARG 559 1HH1 ARG 559 -20.590 2.188 -3.067
374 HH12 ARG 559 2HH1 ARG 559 -21.902 3.296 -3.293
375 HH21 ARG 559 1HH2 ARG 559 -21.908 3.037 -6.778
376 HH22 ARG 559 2HH2 ARG 559 -22.651 3.778 -5.400
377 H GLN 560 H GLN 560 -15.916 -3.704 -5.681
378 HA GLN 560 HA GLN 560 -16.837 -3.550 -8.407
379 HB2 GLN 560 2HB GLN 560 -14.354 -2.991 -8.394
380 HB3 GLN 560 1HB GLN 560 -14.081 -4.660 -7.902
381 HG2 GLN 560 2HG GLN 560 -15.606 -5.127 -10.016
382 HG3 GLN 560 1HG GLN 560 -14.958 -3.562 -10.504
383 HE21 GLN 560 1HE2 GLN 560 -14.275 -5.433 -12.139
384 HE22 GLN 560 2HE2 GLN 560 -12.659 -5.996 -11.898
Start of MODEL 18
1 H1 ALA 507 1HT ALA 507 -19.751 3.172 -0.272
2 H2 ALA 507 2HT ALA 507 -20.313 4.399 0.788
3 H3 ALA 507 3HT ALA 507 -19.435 3.060 1.408
4 HA ALA 507 HA ALA 507 -18.490 5.301 -0.223
5 HB1 ALA 507 2HB ALA 507 -16.791 5.379 1.620
6 HB2 ALA 507 3HB ALA 507 -17.742 4.153 2.457
7 HB3 ALA 507 1HB ALA 507 -18.445 5.734 2.116
8 H GLN 508 H GLN 508 -17.284 2.295 1.282
9 HA GLN 508 HA GLN 508 -15.625 1.883 -1.116
10 HB2 GLN 508 2HB GLN 508 -13.890 0.903 0.344
11 HB3 GLN 508 1HB GLN 508 -14.187 2.597 0.703
12 HG2 GLN 508 2HG GLN 508 -15.866 1.517 2.460
13 HG3 GLN 508 1HG GLN 508 -14.715 0.188 2.332
14 HE21 GLN 508 1HE2 GLN 508 -13.039 0.261 3.639
15 HE22 GLN 508 2HE2 GLN 508 -12.411 1.672 4.414
16 HA PRO 509 HA PRO 509 -17.339 -2.216 -0.953
17 HB2 PRO 509 2HB PRO 509 -16.005 -3.286 -2.994
18 HB3 PRO 509 1HB PRO 509 -17.095 -1.919 -3.251
19 HG2 PRO 509 2HG PRO 509 -14.134 -1.994 -3.243
20 HG3 PRO 509 1HG PRO 509 -15.228 -0.892 -4.091
21 HD2 PRO 509 2HD PRO 509 -13.860 -0.464 -1.601
22 HD3 PRO 509 1HD PRO 509 -14.966 0.640 -2.443
23 H LYS 510 H LYS 510 -14.835 -1.602 0.731
24 HA LYS 510 HA LYS 510 -13.347 -2.733 2.020
25 HB2 LYS 510 2HB LYS 510 -15.323 -4.871 1.301
26 HB3 LYS 510 1HB LYS 510 -13.904 -5.254 2.263
27 HG2 LYS 510 2HG LYS 510 -14.585 -3.644 3.949
28 HG3 LYS 510 1HG LYS 510 -15.988 -3.202 2.974
29 HD2 LYS 510 2HD LYS 510 -16.605 -5.693 3.101
30 HD3 LYS 510 1HD LYS 510 -15.431 -5.777 4.415
31 HE2 LYS 510 2HE LYS 510 -17.505 -5.410 5.459
32 HE3 LYS 510 1HE LYS 510 -16.696 -3.844 5.469
33 HZ1 LYS 510 3HZ LYS 510 -19.195 -4.204 4.640
34 HZ2 LYS 510 1HZ LYS 510 -18.382 -4.381 3.167
35 HZ3 LYS 510 2HZ LYS 510 -18.200 -2.963 4.069
36 H CYS 511 H CYS 511 -12.261 -2.156 -0.315
37 HA CYS 511 HA CYS 511 -10.920 -4.629 -1.191
38 HB2 CYS 511 2HB CYS 511 -12.343 -3.471 -2.916
39 HB3 CYS 511 1HB CYS 511 -11.253 -2.095 -2.804
40 H ASN 512 H ASN 512 -10.163 -3.007 1.068
41 HA ASN 512 HA ASN 512 -7.637 -1.843 0.104
42 HB2 ASN 512 2HB ASN 512 -8.688 -1.327 2.856
43 HB3 ASN 512 1HB ASN 512 -7.667 -0.313 1.846
44 HD21 ASN 512 1HD2 ASN 512 -9.296 -0.512 -0.507
45 HD22 ASN 512 2HD2 ASN 512 -10.722 0.417 -0.213
46 HA PRO 513 HA PRO 513 -5.636 -5.143 2.261
47 HB2 PRO 513 2HB PRO 513 -3.084 -4.359 2.021
48 HB3 PRO 513 1HB PRO 513 -4.032 -4.882 0.626
49 HG2 PRO 513 2HG PRO 513 -3.328 -2.118 1.506
50 HG3 PRO 513 1HG PRO 513 -3.413 -2.788 -0.126
51 HD2 PRO 513 2HD PRO 513 -5.390 -1.263 1.079
52 HD3 PRO 513 1HD PRO 513 -5.637 -2.337 -0.310
53 H ASN 514 H ASN 514 -3.225 -2.803 3.169
54 HA ASN 514 HA ASN 514 -4.231 -2.749 5.932
55 HB2 ASN 514 2HB ASN 514 -1.669 -3.777 4.873
56 HB3 ASN 514 1HB ASN 514 -1.562 -2.772 6.313
57 HD21 ASN 514 1HD2 ASN 514 -2.490 -5.809 5.018
58 HD22 ASN 514 2HD2 ASN 514 -2.953 -6.555 6.505
59 H LEU 515 H LEU 515 -1.392 -1.583 4.195
60 HA LEU 515 HA LEU 515 -0.276 0.410 4.344
61 HB2 LEU 515 2HB LEU 515 -1.425 2.115 3.137
62 HB3 LEU 515 1HB LEU 515 -1.828 0.548 2.459
63 HG LEU 515 HG LEU 515 -3.855 0.965 4.272
64 HD11 LEU 515 1HD1 LEU 515 -3.876 3.150 4.753
65 HD12 LEU 515 2HD1 LEU 515 -4.502 3.352 3.117
66 HD13 LEU 515 3HD1 LEU 515 -2.779 3.546 3.431
67 HD21 LEU 515 3HD2 LEU 515 -4.025 0.028 2.012
68 HD22 LEU 515 1HD2 LEU 515 -3.840 1.649 1.340
69 HD23 LEU 515 2HD2 LEU 515 -5.254 1.256 2.319
70 H HIS 516 H HIS 516 -0.867 -0.244 6.865
71 HA HIS 516 HA HIS 516 -2.087 2.099 8.118
72 HB2 HIS 516 2HB HIS 516 -2.020 -0.681 8.745
73 HB3 HIS 516 1HB HIS 516 -1.247 0.196 10.060
74 HD1 HIS 516 1HD HIS 516 -3.165 2.752 9.719
75 HD2 HIS 516 2HD HIS 516 -4.332 -1.207 10.199
76 HE1 HIS 516 1HE HIS 516 -5.495 2.848 10.658
77 HE2 HIS 516 2HE HIS 516 -6.146 0.442 11.027
78 H TYR 517 H TYR 517 0.985 1.078 7.208
79 HA TYR 517 HA TYR 517 2.391 2.022 9.531
80 HB2 TYR 517 2HB TYR 517 4.368 1.409 8.456
81 HB3 TYR 517 1HB TYR 517 3.203 0.270 7.799
82 HD1 TYR 517 1HD TYR 517 4.552 3.674 6.992
83 HD2 TYR 517 2HD TYR 517 3.320 -0.128 5.528
84 HE1 TYR 517 1HE TYR 517 5.171 4.354 4.721
85 HE2 TYR 517 2HE TYR 517 3.935 0.548 3.252
86 HH TYR 517 HH TYR 517 5.693 2.350 2.278
87 H TRP 518 H TRP 518 1.158 3.421 6.630
88 HA TRP 518 HA TRP 518 2.577 5.919 7.163
89 HB2 TRP 518 2HB TRP 518 2.578 4.680 4.835
90 HB3 TRP 518 1HB TRP 518 1.008 5.459 4.665
91 HD1 TRP 518 HD TRP 518 1.096 7.781 3.608
92 HE1 TRP 518 1HE TRP 518 2.883 9.611 3.307
93 HE3 TRP 518 3HE TRP 518 4.892 5.617 6.224
94 HZ2 TRP 518 2HZ TRP 518 5.562 10.071 4.086
95 HZ3 TRP 518 3HZ TRP 518 7.041 6.808 6.408
96 HH2 TRP 518 HH TRP 518 7.366 8.990 5.359
97 H THR 519 H THR 519 1.492 7.747 7.429
98 HA THR 519 HA THR 519 -0.589 8.183 8.907
99 HB THR 519 HB THR 519 0.497 10.060 7.976
100 HG1 THR 519 1HG THR 519 -2.121 10.142 6.896
101 HG21 THR 519 3HG2 THR 519 0.902 10.491 5.824
102 HG22 THR 519 1HG2 THR 519 -0.708 9.984 5.309
103 HG23 THR 519 2HG2 THR 519 0.545 8.776 5.606
104 H THR 520 H THR 520 -1.093 7.647 5.408
105 HA THR 520 HA THR 520 -3.224 5.936 5.591
106 HB THR 520 HB THR 520 -4.018 8.539 6.416
107 HG1 THR 520 1HG THR 520 -6.018 7.456 6.666
108 HG21 THR 520 3HG2 THR 520 -5.248 7.730 3.789
109 HG22 THR 520 1HG2 THR 520 -4.449 9.252 4.186
110 HG23 THR 520 2HG2 THR 520 -5.998 8.850 4.929
111 H GLN 521 H GLN 521 -2.470 8.950 3.864
112 HA GLN 521 HA GLN 521 -3.120 7.648 1.353
113 HB2 GLN 521 2HB GLN 521 -3.154 9.801 0.381
114 HB3 GLN 521 1HB GLN 521 -3.942 9.943 1.947
115 HG2 GLN 521 2HG GLN 521 -1.937 10.916 2.898
116 HG3 GLN 521 1HG GLN 521 -1.089 10.710 1.366
117 HE21 GLN 521 1HE2 GLN 521 -2.391 11.703 -0.535
118 HE22 GLN 521 2HE2 GLN 521 -2.960 13.312 -0.266
119 H ASP 522 H ASP 522 -1.785 7.309 -0.298
120 HA ASP 522 HA ASP 522 0.135 6.720 -1.349
121 HB2 ASP 522 2HB ASP 522 1.051 9.355 -0.193
122 HB3 ASP 522 1HB ASP 522 1.820 8.503 -1.530
123 H GLU 523 H GLU 523 1.215 5.004 -0.642
124 HA GLU 523 HA GLU 523 3.561 5.246 0.864
125 HB2 GLU 523 2HB GLU 523 3.044 4.281 2.946
126 HB3 GLU 523 1HB GLU 523 1.852 5.539 2.684
127 HG2 GLU 523 2HG GLU 523 1.311 2.649 2.086
128 HG3 GLU 523 1HG GLU 523 1.023 3.370 3.670
129 H GLY 524 H GLY 524 2.545 4.043 -1.521
130 HA2 GLY 524 2HA GLY 524 3.686 2.148 -2.523
131 HA3 GLY 524 1HA GLY 524 3.388 1.262 -1.033
132 H ALA 525 H ALA 525 0.814 3.227 -2.082
133 HA ALA 525 HA ALA 525 -0.880 0.979 -2.456
134 HB1 ALA 525 1HB ALA 525 -2.587 2.717 -3.065
135 HB2 ALA 525 2HB ALA 525 -1.322 3.927 -2.846
136 HB3 ALA 525 3HB ALA 525 -1.830 2.925 -1.486
137 H ALA 526 H ALA 526 0.890 0.358 -4.259
138 HA ALA 526 HA ALA 526 1.289 -0.122 -6.434
139 HB1 ALA 526 1HB ALA 526 -0.720 -1.220 -6.626
140 HB2 ALA 526 2HB ALA 526 -0.870 -0.011 -7.902
141 HB3 ALA 526 3HB ALA 526 -1.667 0.243 -6.349
142 H ILE 527 H ILE 527 2.661 1.620 -6.746
143 HA ILE 527 HA ILE 527 2.024 3.294 -8.905
144 HB ILE 527 HB ILE 527 0.786 4.546 -7.303
145 HG12 ILE 527 2HG1 ILE 527 3.362 6.082 -7.543
146 HG13 ILE 527 1HG1 ILE 527 2.393 5.716 -8.968
147 HG21 ILE 527 1HG2 ILE 527 3.204 4.967 -5.616
148 HG22 ILE 527 2HG2 ILE 527 2.175 3.549 -5.398
149 HG23 ILE 527 3HG2 ILE 527 1.501 5.169 -5.203
150 HD11 ILE 527 3HD1 ILE 527 2.132 7.957 -7.539
151 HD12 ILE 527 1HD1 ILE 527 0.964 6.937 -6.699
152 HD13 ILE 527 2HD1 ILE 527 0.803 7.217 -8.434
153 H GLY 528 H GLY 528 4.036 3.094 -5.985
154 HA2 GLY 528 2HA GLY 528 6.306 3.075 -5.694
155 HA3 GLY 528 1HA GLY 528 6.403 2.475 -7.336
156 H ALA 529 H ALA 529 5.007 5.154 -8.143
157 HA ALA 529 HA ALA 529 5.795 7.027 -9.189
158 HB1 ALA 529 1HB ALA 529 6.137 8.697 -7.693
159 HB2 ALA 529 2HB ALA 529 7.318 7.776 -6.763
160 HB3 ALA 529 3HB ALA 529 5.595 7.454 -6.566
161 H ALA 530 H ALA 530 7.484 4.713 -9.572
162 HA ALA 530 HA ALA 530 9.608 5.682 -10.964
163 HB1 ALA 530 1HB ALA 530 10.128 5.925 -8.142
164 HB2 ALA 530 2HB ALA 530 11.120 6.441 -9.505
165 HB3 ALA 530 3HB ALA 530 11.272 4.801 -8.873
166 H TRP 531 H TRP 531 7.960 3.649 -11.357
167 HA TRP 531 HA TRP 531 7.644 1.346 -11.389
168 HB2 TRP 531 2HB TRP 531 9.687 0.361 -12.695
169 HB3 TRP 531 1HB TRP 531 8.586 1.493 -13.476
170 HD1 TRP 531 HD TRP 531 11.736 2.040 -11.275
171 HE1 TRP 531 1HE TRP 531 13.285 3.693 -12.504
172 HE3 TRP 531 3HE TRP 531 8.956 2.760 -15.500
173 HZ2 TRP 531 2HZ TRP 531 13.317 5.112 -14.946
174 HZ3 TRP 531 3HZ TRP 531 9.814 4.279 -17.234
175 HH2 TRP 531 HH TRP 531 11.950 5.430 -16.961
176 H ILE 532 H ILE 532 8.380 1.945 -8.923
177 HA ILE 532 HA ILE 532 10.061 -0.332 -8.222
178 HB ILE 532 HB ILE 532 11.328 1.775 -8.156
179 HG12 ILE 532 2HG1 ILE 532 10.841 0.725 -5.360
180 HG13 ILE 532 1HG1 ILE 532 11.754 -0.162 -6.571
181 HG21 ILE 532 1HG2 ILE 532 9.800 2.706 -5.794
182 HG22 ILE 532 2HG2 ILE 532 9.067 2.930 -7.387
183 HG23 ILE 532 3HG2 ILE 532 10.652 3.628 -7.034
184 HD11 ILE 532 3HD1 ILE 532 12.493 2.619 -5.746
185 HD12 ILE 532 1HD1 ILE 532 13.477 1.416 -6.578
186 HD13 ILE 532 2HD1 ILE 532 13.063 1.193 -4.875
187 HA PRO 533 HA PRO 533 6.154 0.652 -5.514
188 HB2 PRO 533 2HB PRO 533 4.190 -0.730 -6.826
189 HB3 PRO 533 1HB PRO 533 4.452 1.005 -7.012
190 HG2 PRO 533 2HG PRO 533 5.317 -1.236 -8.780
191 HG3 PRO 533 1HG PRO 533 4.682 0.358 -9.219
192 HD2 PRO 533 2HD PRO 533 7.307 -0.240 -9.328
193 HD3 PRO 533 1HD PRO 533 6.707 1.385 -8.941
194 H TYR 534 H TYR 534 7.533 -1.929 -7.251
195 HA TYR 534 HA TYR 534 6.461 -4.185 -6.038
196 HB2 TYR 534 2HB TYR 534 9.258 -3.717 -7.102
197 HB3 TYR 534 1HB TYR 534 8.541 -5.294 -6.785
198 HD1 TYR 534 1HD TYR 534 8.373 -2.296 -9.001
199 HD2 TYR 534 2HD TYR 534 7.032 -6.296 -8.320
200 HE1 TYR 534 1HE TYR 534 7.447 -2.379 -11.271
201 HE2 TYR 534 2HE TYR 534 6.107 -6.371 -10.595
202 HH TYR 534 HH TYR 534 6.802 -3.973 -12.946
203 H PHE 535 H PHE 535 9.494 -2.474 -5.253
204 HA PHE 535 HA PHE 535 9.157 -3.335 -2.464
205 HB2 PHE 535 2HB PHE 535 11.789 -3.377 -2.507
206 HB3 PHE 535 1HB PHE 535 10.856 -4.780 -3.018
207 HD1 PHE 535 1HD PHE 535 12.232 -1.641 -4.504
208 HD2 PHE 535 2HD PHE 535 11.523 -5.814 -4.947
209 HE1 PHE 535 1HE PHE 535 13.376 -1.600 -6.682
210 HE2 PHE 535 2HE PHE 535 12.666 -5.781 -7.125
211 HZ PHE 535 HZ PHE 535 13.595 -3.672 -7.995
212 H GLY 536 H GLY 536 9.022 -0.757 -4.304
213 HA2 GLY 536 2HA GLY 536 10.905 1.084 -3.347
214 HA3 GLY 536 1HA GLY 536 9.314 1.496 -3.974
215 HA PRO 537 HA PRO 537 8.468 2.654 0.270
216 HB2 PRO 537 2HB PRO 537 6.016 3.584 -0.034
217 HB3 PRO 537 1HB PRO 537 7.342 4.386 -0.896
218 HG2 PRO 537 2HG PRO 537 5.457 2.273 -1.907
219 HG3 PRO 537 1HG PRO 537 5.826 3.849 -2.640
220 HD2 PRO 537 2HD PRO 537 7.037 1.538 -3.393
221 HD3 PRO 537 1HD PRO 537 7.865 3.111 -3.451
222 H ALA 538 H ALA 538 8.053 -0.088 -0.861
223 HA ALA 538 HA ALA 538 5.964 -1.008 0.948
224 HB1 ALA 538 1HB ALA 538 5.382 -1.137 -1.521
225 HB2 ALA 538 2HB ALA 538 5.283 -2.654 -0.625
226 HB3 ALA 538 3HB ALA 538 6.673 -2.331 -1.665
227 H ALA 539 H ALA 539 9.147 -1.132 -0.275
228 HA ALA 539 HA ALA 539 9.898 -3.005 1.774
229 HB1 ALA 539 1HB ALA 539 11.056 -3.862 -0.755
230 HB2 ALA 539 2HB ALA 539 9.309 -4.078 -0.651
231 HB3 ALA 539 3HB ALA 539 10.361 -4.807 0.561
232 H GLU 540 H GLU 540 10.530 -0.165 0.507
233 HA GLU 540 HA GLU 540 13.369 -0.318 0.037
234 HB2 GLU 540 2HB GLU 540 13.309 2.132 0.122
235 HB3 GLU 540 1HB GLU 540 12.072 1.502 -0.952
236 HG2 GLU 540 2HG GLU 540 10.510 1.709 1.083
237 HG3 GLU 540 1HG GLU 540 11.763 2.760 1.742
238 H GLY 541 H GLY 541 13.286 -1.684 2.142
239 HA2 GLY 541 2HA GLY 541 14.539 -1.683 4.166
240 HA3 GLY 541 1HA GLY 541 14.208 0.042 4.328
241 H ILE 542 H ILE 542 11.377 -0.877 3.362
242 HA ILE 542 HA ILE 542 10.114 -0.771 5.865
243 HB ILE 542 HB ILE 542 9.319 -0.918 3.052
244 HG12 ILE 542 2HG1 ILE 542 7.862 0.232 5.424
245 HG13 ILE 542 1HG1 ILE 542 9.239 1.032 4.675
246 HG21 ILE 542 1HG2 ILE 542 7.660 -2.339 5.117
247 HG22 ILE 542 2HG2 ILE 542 8.179 -2.914 3.531
248 HG23 ILE 542 3HG2 ILE 542 6.960 -1.640 3.657
249 HD11 ILE 542 3HD1 ILE 542 7.646 2.050 3.482
250 HD12 ILE 542 1HD1 ILE 542 6.473 0.761 3.745
251 HD13 ILE 542 2HD1 ILE 542 7.720 0.578 2.512
252 H TYR 543 H TYR 543 10.754 -3.445 3.621
253 HA TYR 543 HA TYR 543 9.361 -5.511 4.658
254 HB2 TYR 543 2HB TYR 543 11.148 -7.017 3.921
255 HB3 TYR 543 1HB TYR 543 10.839 -5.751 2.736
256 HD1 TYR 543 2HD TYR 543 12.373 -3.720 2.771
257 HD2 TYR 543 1HD TYR 543 13.299 -7.361 4.737
258 HE1 TYR 543 2HE TYR 543 14.754 -3.086 2.793
259 HE2 TYR 543 1HE TYR 543 15.685 -6.750 4.775
260 HH TYR 543 HH TYR 543 16.780 -3.587 3.956
261 H ALA 544 H ALA 544 12.076 -3.937 6.164
262 HA ALA 544 HA ALA 544 12.917 -5.796 8.022
263 HB1 ALA 544 1HB ALA 544 13.672 -3.946 9.360
264 HB2 ALA 544 2HB ALA 544 12.565 -2.850 8.532
265 HB3 ALA 544 3HB ALA 544 13.920 -3.563 7.656
266 H GLU 545 H GLU 545 9.877 -4.257 7.798
267 HA GLU 545 HA GLU 545 8.963 -4.147 10.404
268 HB2 GLU 545 2HB GLU 545 6.692 -4.635 9.298
269 HB3 GLU 545 1HB GLU 545 7.569 -3.217 8.745
270 HG2 GLU 545 2HG GLU 545 6.947 -4.094 6.745
271 HG3 GLU 545 1HG GLU 545 8.495 -4.906 6.950
272 H GLY 546 H GLY 546 8.993 -6.796 8.101
273 HA2 GLY 546 2HA GLY 546 8.706 -9.043 8.315
274 HA3 GLY 546 1HA GLY 546 9.562 -8.828 9.826
275 H LEU 547 H LEU 547 6.231 -8.049 8.717
276 HA LEU 547 HA LEU 547 5.038 -10.048 10.305
277 HB2 LEU 547 2HB LEU 547 3.851 -7.940 11.658
278 HB3 LEU 547 1HB LEU 547 4.954 -9.128 12.317
279 HG LEU 547 HG LEU 547 6.838 -7.618 11.895
280 HD11 LEU 547 1HD1 LEU 547 6.166 -6.374 10.011
281 HD12 LEU 547 2HD1 LEU 547 6.242 -5.220 11.340
282 HD13 LEU 547 3HD1 LEU 547 4.682 -5.840 10.798
283 HD21 LEU 547 3HD2 LEU 547 6.214 -7.279 14.042
284 HD22 LEU 547 1HD2 LEU 547 4.546 -6.902 13.613
285 HD23 LEU 547 2HD2 LEU 547 5.804 -5.683 13.415
286 H MET 548 H MET 548 4.524 -6.812 8.928
287 HA MET 548 HA MET 548 2.602 -7.670 7.088
288 HB2 MET 548 2HB MET 548 0.582 -6.544 8.147
289 HB3 MET 548 1HB MET 548 1.064 -8.095 8.821
290 HG2 MET 548 2HG MET 548 2.403 -5.974 10.206
291 HG3 MET 548 1HG MET 548 0.666 -5.673 10.172
292 HE1 MET 548 3HE MET 548 0.335 -6.636 13.400
293 HE2 MET 548 1HE MET 548 1.415 -5.542 12.535
294 HE3 MET 548 2HE MET 548 2.081 -6.866 13.491
295 H HIS 549 H HIS 549 4.019 -5.099 8.958
296 HA HIS 549 HA HIS 549 2.973 -2.836 7.796
297 HB2 HIS 549 2HB HIS 549 5.231 -3.483 9.399
298 HB3 HIS 549 1HB HIS 549 5.770 -2.403 8.117
299 HD1 HIS 549 1HD HIS 549 2.311 -2.085 9.465
300 HD2 HIS 549 2HD HIS 549 6.015 -0.262 9.926
301 HE1 HIS 549 1HE HIS 549 1.858 0.037 10.718
302 HE2 HIS 549 2HE HIS 549 4.128 1.065 11.098
303 H ASN 550 H ASN 550 4.800 -5.249 6.201
304 HA ASN 550 HA ASN 550 5.984 -3.582 4.208
305 HB2 ASN 550 2HB ASN 550 6.458 -5.716 3.042
306 HB3 ASN 550 1HB ASN 550 6.977 -5.732 4.725
307 HD21 ASN 550 1HD2 ASN 550 5.905 -7.725 2.579
308 HD22 ASN 550 2HD2 ASN 550 4.823 -8.710 3.498
309 H GLN 551 H GLN 551 2.879 -3.843 4.735
310 HA GLN 551 HA GLN 551 1.563 -4.816 2.529
311 HB2 GLN 551 2HB GLN 551 -0.105 -2.916 3.051
312 HB3 GLN 551 1HB GLN 551 0.218 -4.109 4.301
313 HG2 GLN 551 2HG GLN 551 2.085 -1.956 4.532
314 HG3 GLN 551 1HG GLN 551 0.447 -1.316 4.471
315 HE21 GLN 551 1HE2 GLN 551 1.447 -0.762 6.714
316 HE22 GLN 551 2HE2 GLN 551 1.008 -1.844 7.986
317 H ASP 552 H ASP 552 0.201 -3.064 1.120
318 HA ASP 552 HA ASP 552 2.146 -1.265 -0.164
319 HB2 ASP 552 2HB ASP 552 0.164 -2.979 -1.671
320 HB3 ASP 552 1HB ASP 552 1.424 -1.954 -2.354
321 H GLY 553 H GLY 553 -1.318 -2.142 -0.446
322 HA2 GLY 553 2HA GLY 553 -2.967 -0.507 0.379
323 HA3 GLY 553 1HA GLY 553 -1.910 0.748 -0.245
324 H LEU 554 H LEU 554 -2.965 -2.281 -1.766
325 HA LEU 554 HA LEU 554 -3.265 -1.459 -4.306
326 HB2 LEU 554 2HB LEU 554 -5.319 -3.107 -4.338
327 HB3 LEU 554 1HB LEU 554 -3.676 -3.684 -4.148
328 HG LEU 554 HG LEU 554 -4.583 -3.209 -1.540
329 HD11 LEU 554 1HD1 LEU 554 -6.579 -5.094 -2.204
330 HD12 LEU 554 2HD1 LEU 554 -6.826 -3.674 -3.219
331 HD13 LEU 554 3HD1 LEU 554 -6.771 -3.503 -1.465
332 HD21 LEU 554 3HD2 LEU 554 -4.109 -5.648 -3.207
333 HD22 LEU 554 1HD2 LEU 554 -4.632 -5.775 -1.527
334 HD23 LEU 554 2HD2 LEU 554 -3.113 -4.970 -1.920
335 H ILE 555 H ILE 555 -6.171 -1.656 -2.247
336 HA ILE 555 HA ILE 555 -8.102 -0.450 -2.222
337 HB ILE 555 HB ILE 555 -6.470 1.820 -3.351
338 HG12 ILE 555 2HG1 ILE 555 -5.216 1.352 -1.473
339 HG13 ILE 555 1HG1 ILE 555 -6.421 2.439 -0.801
340 HG21 ILE 555 1HG2 ILE 555 -9.158 1.668 -2.896
341 HG22 ILE 555 2HG2 ILE 555 -8.215 3.156 -2.955
342 HG23 ILE 555 3HG2 ILE 555 -8.564 2.393 -1.403
343 HD11 ILE 555 3HD1 ILE 555 -6.442 -0.557 -0.647
344 HD12 ILE 555 1HD1 ILE 555 -7.697 0.504 -0.016
345 HD13 ILE 555 2HD1 ILE 555 -6.071 0.563 0.661
346 H CYS 556 H CYS 556 -9.607 -1.074 -3.633
347 HA CYS 556 HA CYS 556 -9.265 -1.329 -6.393
348 HB2 CYS 556 2HB CYS 556 -11.616 -1.319 -4.562
349 HB3 CYS 556 1HB CYS 556 -11.914 -1.177 -6.292
350 H GLY 557 H GLY 557 -10.337 1.390 -4.463
351 HA2 GLY 557 2HA GLY 557 -10.022 3.628 -5.283
352 HA3 GLY 557 1HA GLY 557 -10.306 3.022 -6.911
353 H LEU 558 H LEU 558 -12.575 1.391 -5.956
354 HA LEU 558 HA LEU 558 -14.560 3.051 -4.854
355 HB2 LEU 558 2HB LEU 558 -15.863 3.542 -6.833
356 HB3 LEU 558 1HB LEU 558 -14.259 4.232 -6.981
357 HG LEU 558 HG LEU 558 -14.814 1.560 -8.213
358 HD11 LEU 558 1HD1 LEU 558 -15.609 2.563 -10.229
359 HD12 LEU 558 2HD1 LEU 558 -15.415 4.184 -9.561
360 HD13 LEU 558 3HD1 LEU 558 -16.641 3.100 -8.905
361 HD21 LEU 558 3HD2 LEU 558 -12.665 3.434 -8.159
362 HD22 LEU 558 1HD2 LEU 558 -13.247 3.273 -9.816
363 HD23 LEU 558 2HD2 LEU 558 -12.736 1.844 -8.920
364 H ARG 559 H ARG 559 -13.798 0.434 -7.049
365 HA ARG 559 HA ARG 559 -14.624 -1.773 -5.941
366 HB2 ARG 559 2HB ARG 559 -17.038 -2.131 -6.555
367 HB3 ARG 559 1HB ARG 559 -16.788 -0.992 -5.241
368 HG2 ARG 559 2HG ARG 559 -16.787 0.635 -7.444
369 HG3 ARG 559 1HG ARG 559 -17.972 -0.598 -7.873
370 HD2 ARG 559 2HD ARG 559 -18.490 0.069 -5.198
371 HD3 ARG 559 1HD ARG 559 -18.205 1.598 -6.030
372 HE ARG 559 HE ARG 559 -19.928 0.121 -7.623
373 HH11 ARG 559 1HH1 ARG 559 -19.943 1.532 -4.431
374 HH12 ARG 559 2HH1 ARG 559 -21.656 1.782 -4.414
375 HH21 ARG 559 1HH2 ARG 559 -22.181 0.450 -7.602
376 HH22 ARG 559 2HH2 ARG 559 -22.927 1.169 -6.213
377 H GLN 560 H GLN 560 -14.490 -3.449 -7.391
378 HA GLN 560 HA GLN 560 -15.097 -2.997 -10.171
379 HB2 GLN 560 2HB GLN 560 -12.843 -3.495 -10.992
380 HB3 GLN 560 1HB GLN 560 -12.857 -2.033 -10.012
381 HG2 GLN 560 2HG GLN 560 -11.112 -2.926 -8.966
382 HG3 GLN 560 1HG GLN 560 -12.290 -3.961 -8.162
383 HE21 GLN 560 1HE2 GLN 560 -9.594 -4.631 -8.606
384 HE22 GLN 560 2HE2 GLN 560 -9.546 -5.990 -9.670
Start of MODEL 19
1 H1 ALA 507 1HT ALA 507 -18.108 4.776 -1.283
2 H2 ALA 507 2HT ALA 507 -19.498 4.995 -0.300
3 H3 ALA 507 3HT ALA 507 -19.542 3.900 -1.621
4 HA ALA 507 HA ALA 507 -17.912 3.663 0.816
5 HB1 ALA 507 2HB ALA 507 -19.344 1.808 1.372
6 HB2 ALA 507 3HB ALA 507 -20.237 1.997 -0.138
7 HB3 ALA 507 1HB ALA 507 -20.334 3.243 1.106
8 H GLN 508 H GLN 508 -16.434 2.014 0.851
9 HA GLN 508 HA GLN 508 -15.532 1.062 -1.715
10 HB2 GLN 508 2HB GLN 508 -13.647 0.128 -0.486
11 HB3 GLN 508 1HB GLN 508 -13.930 1.792 0.005
12 HG2 GLN 508 2HG GLN 508 -15.237 -0.329 1.601
13 HG3 GLN 508 1HG GLN 508 -13.486 -0.169 1.740
14 HE21 GLN 508 1HE2 GLN 508 -12.810 2.243 1.930
15 HE22 GLN 508 2HE2 GLN 508 -13.687 3.152 3.107
16 HA PRO 509 HA PRO 509 -17.239 -3.010 -1.308
17 HB2 PRO 509 2HB PRO 509 -15.605 -4.307 -3.081
18 HB3 PRO 509 1HB PRO 509 -16.879 -3.185 -3.557
19 HG2 PRO 509 2HG PRO 509 -14.020 -2.859 -3.779
20 HG3 PRO 509 1HG PRO 509 -15.298 -1.793 -4.375
21 HD2 PRO 509 2HD PRO 509 -13.675 -1.578 -1.929
22 HD3 PRO 509 1HD PRO 509 -14.617 -0.330 -2.772
23 H LYS 510 H LYS 510 -14.865 -2.307 0.515
24 HA LYS 510 HA LYS 510 -13.579 -3.338 2.067
25 HB2 LYS 510 2HB LYS 510 -15.535 -5.501 1.364
26 HB3 LYS 510 1HB LYS 510 -14.254 -5.786 2.530
27 HG2 LYS 510 2HG LYS 510 -15.084 -3.890 3.867
28 HG3 LYS 510 1HG LYS 510 -16.408 -3.695 2.718
29 HD2 LYS 510 2HD LYS 510 -17.448 -4.998 4.281
30 HD3 LYS 510 1HD LYS 510 -16.772 -6.262 3.251
31 HE2 LYS 510 2HE LYS 510 -15.097 -6.778 4.761
32 HE3 LYS 510 1HE LYS 510 -15.180 -5.203 5.547
33 HZ1 LYS 510 3HZ LYS 510 -16.106 -6.965 6.931
34 HZ2 LYS 510 1HZ LYS 510 -17.252 -7.322 5.738
35 HZ3 LYS 510 2HZ LYS 510 -17.287 -5.825 6.524
36 H CYS 511 H CYS 511 -12.032 -3.020 0.086
37 HA CYS 511 HA CYS 511 -10.664 -5.586 -0.279
38 HB2 CYS 511 2HB CYS 511 -10.067 -4.817 -2.627
39 HB3 CYS 511 1HB CYS 511 -11.733 -5.331 -2.381
40 H ASN 512 H ASN 512 -10.110 -3.603 1.616
41 HA ASN 512 HA ASN 512 -7.629 -2.395 0.585
42 HB2 ASN 512 2HB ASN 512 -7.815 -0.855 2.550
43 HB3 ASN 512 1HB ASN 512 -9.127 -0.695 1.387
44 HD21 ASN 512 1HD2 ASN 512 -11.148 -0.872 2.089
45 HD22 ASN 512 2HD2 ASN 512 -11.615 -1.397 3.667
46 HA PRO 513 HA PRO 513 -5.578 -5.116 3.400
47 HB2 PRO 513 2HB PRO 513 -3.050 -4.355 2.982
48 HB3 PRO 513 1HB PRO 513 -3.997 -5.153 1.724
49 HG2 PRO 513 2HG PRO 513 -3.275 -2.282 2.009
50 HG3 PRO 513 1HG PRO 513 -3.479 -3.252 0.546
51 HD2 PRO 513 2HD PRO 513 -5.371 -1.494 1.676
52 HD3 PRO 513 1HD PRO 513 -5.664 -2.675 0.387
53 H ASN 514 H ASN 514 -3.190 -2.634 3.814
54 HA ASN 514 HA ASN 514 -4.201 -2.016 6.505
55 HB2 ASN 514 2HB ASN 514 -1.639 -3.238 5.680
56 HB3 ASN 514 1HB ASN 514 -1.535 -1.968 6.893
57 HD21 ASN 514 1HD2 ASN 514 -3.117 -5.024 6.133
58 HD22 ASN 514 2HD2 ASN 514 -3.334 -5.530 7.770
59 H LEU 515 H LEU 515 -1.377 -1.227 4.545
60 HA LEU 515 HA LEU 515 -0.254 0.747 4.281
61 HB2 LEU 515 2HB LEU 515 -1.417 2.177 2.775
62 HB3 LEU 515 1HB LEU 515 -1.866 0.512 2.443
63 HG LEU 515 HG LEU 515 -3.819 1.339 4.198
64 HD11 LEU 515 1HD1 LEU 515 -2.736 3.665 2.815
65 HD12 LEU 515 2HD1 LEU 515 -3.824 3.572 4.199
66 HD13 LEU 515 3HD1 LEU 515 -4.467 3.441 2.562
67 HD21 LEU 515 3HD2 LEU 515 -5.290 1.238 2.274
68 HD22 LEU 515 1HD2 LEU 515 -4.089 -0.051 2.197
69 HD23 LEU 515 2HD2 LEU 515 -3.908 1.384 1.187
70 H HIS 516 H HIS 516 -0.814 0.592 6.893
71 HA HIS 516 HA HIS 516 -1.917 3.205 7.645
72 HB2 HIS 516 2HB HIS 516 -1.750 0.566 9.014
73 HB3 HIS 516 1HB HIS 516 -1.701 2.015 10.012
74 HD1 HIS 516 1HD HIS 516 -3.768 2.651 7.130
75 HD2 HIS 516 2HD HIS 516 -4.300 0.819 10.821
76 HE1 HIS 516 1HE HIS 516 -6.256 2.572 7.489
77 HE2 HIS 516 2HE HIS 516 -6.557 1.382 9.689
78 H TYR 517 H TYR 517 1.080 1.742 7.137
79 HA TYR 517 HA TYR 517 2.460 2.809 9.386
80 HB2 TYR 517 2HB TYR 517 4.442 2.037 8.421
81 HB3 TYR 517 1HB TYR 517 3.232 0.912 7.827
82 HD1 TYR 517 1HD TYR 517 4.762 4.164 6.769
83 HD2 TYR 517 2HD TYR 517 3.420 0.292 5.620
84 HE1 TYR 517 1HE TYR 517 5.490 4.598 4.473
85 HE2 TYR 517 2HE TYR 517 4.142 0.724 3.320
86 HH TYR 517 HH TYR 517 5.100 3.848 2.240
87 H TRP 518 H TRP 518 1.197 4.242 6.585
88 HA TRP 518 HA TRP 518 2.975 6.549 6.738
89 HB2 TRP 518 2HB TRP 518 2.002 5.299 4.567
90 HB3 TRP 518 1HB TRP 518 0.752 6.520 4.802
91 HD1 TRP 518 HD TRP 518 1.256 8.408 3.186
92 HE1 TRP 518 1HE TRP 518 3.327 9.781 2.508
93 HE3 TRP 518 3HE TRP 518 4.769 5.922 5.907
94 HZ2 TRP 518 2HZ TRP 518 6.095 9.801 3.072
95 HZ3 TRP 518 3HZ TRP 518 7.108 6.677 5.795
96 HH2 TRP 518 HH TRP 518 7.757 8.578 4.405
97 H THR 519 H THR 519 1.104 8.435 5.821
98 HA THR 519 HA THR 519 -0.638 8.670 8.173
99 HB THR 519 HB THR 519 0.863 10.301 8.664
100 HG1 THR 519 1HG THR 519 -1.132 11.380 8.144
101 HG21 THR 519 3HG2 THR 519 2.293 9.779 6.691
102 HG22 THR 519 1HG2 THR 519 2.279 11.477 7.178
103 HG23 THR 519 2HG2 THR 519 1.345 10.956 5.777
104 H THR 520 H THR 520 -0.418 8.700 4.768
105 HA THR 520 HA THR 520 -3.181 8.791 4.379
106 HB THR 520 HB THR 520 -2.589 11.256 5.038
107 HG1 THR 520 1HG THR 520 -4.560 11.314 4.369
108 HG21 THR 520 3HG2 THR 520 -2.154 12.706 3.128
109 HG22 THR 520 1HG2 THR 520 -1.882 11.289 2.109
110 HG23 THR 520 2HG2 THR 520 -0.790 11.636 3.453
111 H GLN 521 H GLN 521 -0.146 9.848 2.872
112 HA GLN 521 HA GLN 521 -0.716 9.506 0.229
113 HB2 GLN 521 2HB GLN 521 1.568 9.949 1.691
114 HB3 GLN 521 1HB GLN 521 1.902 8.400 0.927
115 HG2 GLN 521 2HG GLN 521 1.604 9.315 -1.246
116 HG3 GLN 521 1HG GLN 521 0.975 10.824 -0.587
117 HE21 GLN 521 1HE2 GLN 521 3.810 8.896 -1.145
118 HE22 GLN 521 2HE2 GLN 521 4.968 10.140 -0.833
119 H ASP 522 H ASP 522 -0.247 7.834 -1.285
120 HA ASP 522 HA ASP 522 -1.510 5.433 -0.778
121 HB2 ASP 522 2HB ASP 522 0.338 6.392 -2.915
122 HB3 ASP 522 1HB ASP 522 -0.073 4.683 -2.867
123 H GLU 523 H GLU 523 1.704 6.365 -0.068
124 HA GLU 523 HA GLU 523 3.567 5.252 0.648
125 HB2 GLU 523 2HB GLU 523 3.144 3.859 2.625
126 HB3 GLU 523 1HB GLU 523 2.295 5.388 2.671
127 HG2 GLU 523 2HG GLU 523 0.812 3.766 3.510
128 HG3 GLU 523 1HG GLU 523 0.252 4.157 1.885
129 H GLY 524 H GLY 524 2.429 4.078 -1.731
130 HA2 GLY 524 2HA GLY 524 3.708 2.260 -2.799
131 HA3 GLY 524 1HA GLY 524 3.376 1.307 -1.359
132 H ALA 525 H ALA 525 0.729 3.174 -2.169
133 HA ALA 525 HA ALA 525 -0.852 0.927 -2.847
134 HB1 ALA 525 1HB ALA 525 -2.569 2.281 -2.385
135 HB2 ALA 525 2HB ALA 525 -2.017 3.512 -3.519
136 HB3 ALA 525 3HB ALA 525 -1.348 3.454 -1.890
137 H ALA 526 H ALA 526 0.947 0.595 -4.686
138 HA ALA 526 HA ALA 526 1.381 0.382 -6.895
139 HB1 ALA 526 1HB ALA 526 -0.558 -0.678 -7.399
140 HB2 ALA 526 2HB ALA 526 -0.808 0.783 -8.354
141 HB3 ALA 526 3HB ALA 526 -1.564 0.627 -6.768
142 H ILE 527 H ILE 527 2.732 2.202 -6.823
143 HA ILE 527 HA ILE 527 2.191 4.125 -8.799
144 HB ILE 527 HB ILE 527 0.815 5.139 -7.155
145 HG12 ILE 527 2HG1 ILE 527 3.333 6.753 -6.911
146 HG13 ILE 527 1HG1 ILE 527 2.582 6.532 -8.488
147 HG21 ILE 527 1HG2 ILE 527 1.313 5.437 -4.936
148 HG22 ILE 527 2HG2 ILE 527 3.055 5.383 -5.216
149 HG23 ILE 527 3HG2 ILE 527 2.098 3.899 -5.300
150 HD11 ILE 527 3HD1 ILE 527 0.660 7.343 -6.490
151 HD12 ILE 527 1HD1 ILE 527 1.040 8.063 -8.054
152 HD13 ILE 527 2HD1 ILE 527 1.994 8.488 -6.633
153 H GLY 528 H GLY 528 4.024 3.649 -5.785
154 HA2 GLY 528 2HA GLY 528 6.273 3.623 -5.363
155 HA3 GLY 528 1HA GLY 528 6.488 3.257 -7.063
156 H ALA 529 H ALA 529 5.023 5.963 -7.588
157 HA ALA 529 HA ALA 529 5.780 7.990 -8.323
158 HB1 ALA 529 1HB ALA 529 5.941 9.445 -6.597
159 HB2 ALA 529 2HB ALA 529 7.138 8.472 -5.743
160 HB3 ALA 529 3HB ALA 529 5.431 8.031 -5.673
161 H ALA 530 H ALA 530 7.581 5.812 -8.906
162 HA ALA 530 HA ALA 530 9.738 7.034 -10.028
163 HB1 ALA 530 1HB ALA 530 11.149 7.617 -8.397
164 HB2 ALA 530 2HB ALA 530 11.306 5.911 -7.972
165 HB3 ALA 530 3HB ALA 530 10.090 6.909 -7.177
166 H TRP 531 H TRP 531 8.189 5.026 -10.793
167 HA TRP 531 HA TRP 531 7.963 2.742 -11.158
168 HB2 TRP 531 2HB TRP 531 10.103 2.008 -12.468
169 HB3 TRP 531 1HB TRP 531 9.008 3.209 -13.147
170 HD1 TRP 531 HD TRP 531 12.012 3.528 -10.707
171 HE1 TRP 531 1HE TRP 531 13.567 5.377 -11.603
172 HE3 TRP 531 3HE TRP 531 9.447 4.753 -14.953
173 HZ2 TRP 531 2HZ TRP 531 13.685 7.123 -13.820
174 HZ3 TRP 531 3HZ TRP 531 10.345 6.521 -16.408
175 HH2 TRP 531 HH TRP 531 12.421 7.682 -15.851
176 H ILE 532 H ILE 532 8.541 3.012 -8.597
177 HA ILE 532 HA ILE 532 10.259 0.705 -8.114
178 HB ILE 532 HB ILE 532 11.441 2.829 -7.693
179 HG12 ILE 532 2HG1 ILE 532 10.865 1.332 -5.126
180 HG13 ILE 532 1HG1 ILE 532 11.908 0.716 -6.397
181 HG21 ILE 532 1HG2 ILE 532 9.757 3.349 -5.307
182 HG22 ILE 532 2HG2 ILE 532 9.110 3.792 -6.892
183 HG23 ILE 532 3HG2 ILE 532 10.647 4.471 -6.339
184 HD11 ILE 532 3HD1 ILE 532 13.015 1.849 -4.416
185 HD12 ILE 532 1HD1 ILE 532 12.399 3.362 -5.084
186 HD13 ILE 532 2HD1 ILE 532 13.513 2.373 -6.029
187 HA PRO 533 HA PRO 533 6.174 1.215 -5.532
188 HB2 PRO 533 2HB PRO 533 4.341 -0.037 -7.133
189 HB3 PRO 533 1HB PRO 533 4.545 1.714 -7.068
190 HG2 PRO 533 2HG PRO 533 5.592 -0.237 -9.067
191 HG3 PRO 533 1HG PRO 533 4.921 1.382 -9.323
192 HD2 PRO 533 2HD PRO 533 7.570 0.885 -9.356
193 HD3 PRO 533 1HD PRO 533 6.889 2.423 -8.787
194 H TYR 534 H TYR 534 7.726 -1.070 -7.525
195 HA TYR 534 HA TYR 534 6.690 -3.502 -6.713
196 HB2 TYR 534 2HB TYR 534 9.535 -2.777 -7.459
197 HB3 TYR 534 1HB TYR 534 8.889 -4.415 -7.407
198 HD1 TYR 534 2HD TYR 534 8.715 -1.161 -9.232
199 HD2 TYR 534 1HD TYR 534 7.563 -5.276 -9.176
200 HE1 TYR 534 2HE TYR 534 7.969 -0.991 -11.560
201 HE2 TYR 534 1HE TYR 534 6.818 -5.096 -11.509
202 HH TYR 534 HH TYR 534 7.550 -2.388 -13.474
203 H PHE 535 H PHE 535 9.614 -1.878 -5.459
204 HA PHE 535 HA PHE 535 9.045 -3.067 -2.833
205 HB2 PHE 535 2HB PHE 535 11.739 -2.931 -4.184
206 HB3 PHE 535 1HB PHE 535 11.483 -3.417 -2.513
207 HD1 PHE 535 2HD PHE 535 10.680 -4.313 -6.017
208 HD2 PHE 535 1HD PHE 535 10.936 -5.624 -1.977
209 HE1 PHE 535 2HE PHE 535 10.328 -6.634 -6.753
210 HE2 PHE 535 1HE PHE 535 10.584 -7.948 -2.705
211 HZ PHE 535 HZ PHE 535 10.279 -8.455 -5.096
212 H GLY 536 H GLY 536 9.081 -0.283 -4.374
213 HA2 GLY 536 2HA GLY 536 10.862 1.433 -3.085
214 HA3 GLY 536 1HA GLY 536 9.298 1.913 -3.736
215 HA PRO 537 HA PRO 537 8.226 2.556 0.565
216 HB2 PRO 537 2HB PRO 537 5.759 3.447 0.249
217 HB3 PRO 537 1HB PRO 537 7.095 4.380 -0.453
218 HG2 PRO 537 2HG PRO 537 5.352 2.324 -1.784
219 HG3 PRO 537 1HG PRO 537 5.663 3.993 -2.314
220 HD2 PRO 537 2HD PRO 537 7.021 1.867 -3.288
221 HD3 PRO 537 1HD PRO 537 7.789 3.459 -3.080
222 H ALA 538 H ALA 538 7.972 -0.042 -0.883
223 HA ALA 538 HA ALA 538 5.784 -1.225 0.637
224 HB1 ALA 538 1HB ALA 538 5.423 -2.780 -1.156
225 HB2 ALA 538 2HB ALA 538 6.836 -2.177 -2.027
226 HB3 ALA 538 3HB ALA 538 5.410 -1.155 -1.842
227 H ALA 539 H ALA 539 9.071 -1.134 -0.321
228 HA ALA 539 HA ALA 539 9.745 -3.094 1.666
229 HB1 ALA 539 1HB ALA 539 11.226 -4.284 -0.134
230 HB2 ALA 539 2HB ALA 539 9.985 -3.674 -1.227
231 HB3 ALA 539 3HB ALA 539 9.539 -4.734 0.111
232 H GLU 540 H GLU 540 10.360 -0.184 0.630
233 HA GLU 540 HA GLU 540 13.224 -0.218 0.296
234 HB2 GLU 540 2HB GLU 540 13.073 2.215 0.528
235 HB3 GLU 540 1HB GLU 540 11.903 1.618 -0.636
236 HG2 GLU 540 2HG GLU 540 10.255 1.637 1.339
237 HG3 GLU 540 1HG GLU 540 11.442 2.685 2.116
238 H GLY 541 H GLY 541 12.972 -1.732 2.327
239 HA2 GLY 541 2HA GLY 541 14.153 -1.829 4.404
240 HA3 GLY 541 1HA GLY 541 13.753 -0.130 4.662
241 H ILE 542 H ILE 542 11.014 -0.970 3.491
242 HA ILE 542 HA ILE 542 9.590 -1.099 5.889
243 HB ILE 542 HB ILE 542 8.980 -1.176 3.012
244 HG12 ILE 542 2HG1 ILE 542 7.276 -0.074 5.219
245 HG13 ILE 542 1HG1 ILE 542 8.789 0.712 4.779
246 HG21 ILE 542 1HG2 ILE 542 7.780 -3.132 3.315
247 HG22 ILE 542 2HG2 ILE 542 6.561 -1.876 3.575
248 HG23 ILE 542 3HG2 ILE 542 7.286 -2.699 4.955
249 HD11 ILE 542 3HD1 ILE 542 7.199 1.844 3.541
250 HD12 ILE 542 1HD1 ILE 542 6.307 0.372 3.157
251 HD13 ILE 542 2HD1 ILE 542 7.864 0.685 2.391
252 H TYR 543 H TYR 543 10.379 -3.615 3.502
253 HA TYR 543 HA TYR 543 9.027 -5.771 4.424
254 HB2 TYR 543 2HB TYR 543 10.790 -7.192 3.534
255 HB3 TYR 543 1HB TYR 543 10.505 -5.823 2.464
256 HD1 TYR 543 2HD TYR 543 12.054 -3.783 2.790
257 HD2 TYR 543 1HD TYR 543 12.945 -7.677 4.219
258 HE1 TYR 543 2HE TYR 543 14.443 -3.188 2.883
259 HE2 TYR 543 1HE TYR 543 15.340 -7.105 4.322
260 HH TYR 543 HH TYR 543 16.633 -4.357 2.843
261 H ALA 544 H ALA 544 11.719 -4.225 5.992
262 HA ALA 544 HA ALA 544 12.585 -6.205 7.739
263 HB1 ALA 544 1HB ALA 544 13.333 -4.393 9.181
264 HB2 ALA 544 2HB ALA 544 12.317 -3.258 8.293
265 HB3 ALA 544 3HB ALA 544 13.681 -4.035 7.490
266 H GLU 545 H GLU 545 9.573 -4.659 7.580
267 HA GLU 545 HA GLU 545 8.649 -4.555 10.179
268 HB2 GLU 545 2HB GLU 545 6.389 -5.062 9.055
269 HB3 GLU 545 1HB GLU 545 7.263 -3.642 8.497
270 HG2 GLU 545 2HG GLU 545 6.744 -4.506 6.483
271 HG3 GLU 545 1HG GLU 545 8.222 -5.422 6.758
272 H GLY 546 H GLY 546 8.669 -7.196 7.866
273 HA2 GLY 546 2HA GLY 546 8.357 -9.443 8.080
274 HA3 GLY 546 1HA GLY 546 9.229 -9.240 9.586
275 H LEU 547 H LEU 547 6.078 -7.755 9.094
276 HA LEU 547 HA LEU 547 4.800 -9.918 10.570
277 HB2 LEU 547 2HB LEU 547 4.090 -8.687 12.387
278 HB3 LEU 547 1HB LEU 547 5.738 -8.142 12.158
279 HG LEU 547 HG LEU 547 3.392 -6.610 11.059
280 HD11 LEU 547 1HD1 LEU 547 3.061 -5.498 13.014
281 HD12 LEU 547 2HD1 LEU 547 4.710 -5.772 13.579
282 HD13 LEU 547 3HD1 LEU 547 3.520 -7.072 13.664
283 HD21 LEU 547 3HD2 LEU 547 5.918 -5.354 11.936
284 HD22 LEU 547 1HD2 LEU 547 4.886 -4.987 10.554
285 HD23 LEU 547 2HD2 LEU 547 5.991 -6.360 10.490
286 H MET 548 H MET 548 4.344 -6.790 8.941
287 HA MET 548 HA MET 548 2.313 -7.712 7.269
288 HB2 MET 548 2HB MET 548 1.410 -6.950 9.937
289 HB3 MET 548 1HB MET 548 0.582 -6.066 8.662
290 HG2 MET 548 2HG MET 548 0.501 -8.602 7.694
291 HG3 MET 548 1HG MET 548 0.401 -8.884 9.431
292 HE1 MET 548 3HE MET 548 -3.147 -9.149 9.583
293 HE2 MET 548 1HE MET 548 -2.210 -8.299 10.813
294 HE3 MET 548 2HE MET 548 -1.509 -9.679 9.966
295 H HIS 549 H HIS 549 3.964 -5.077 8.796
296 HA HIS 549 HA HIS 549 2.841 -2.888 7.522
297 HB2 HIS 549 2HB HIS 549 5.312 -3.470 8.936
298 HB3 HIS 549 1HB HIS 549 5.533 -2.254 7.682
299 HD1 HIS 549 1HD HIS 549 2.445 -1.234 8.217
300 HD2 HIS 549 2HD HIS 549 5.613 -1.451 10.896
301 HE1 HIS 549 1HE HIS 549 1.888 0.389 10.043
302 HE2 HIS 549 2HE HIS 549 3.868 0.325 11.600
303 H ASN 550 H ASN 550 4.482 -5.464 6.037
304 HA ASN 550 HA ASN 550 5.771 -4.103 3.922
305 HB2 ASN 550 2HB ASN 550 5.514 -6.763 4.771
306 HB3 ASN 550 1HB ASN 550 4.844 -6.731 3.145
307 HD21 ASN 550 1HD2 ASN 550 7.181 -8.092 3.890
308 HD22 ASN 550 2HD2 ASN 550 8.511 -7.373 3.053
309 H GLN 551 H GLN 551 2.579 -4.062 4.584
310 HA GLN 551 HA GLN 551 1.107 -4.748 2.409
311 HB2 GLN 551 2HB GLN 551 -0.380 -2.841 2.993
312 HB3 GLN 551 1HB GLN 551 0.087 -3.816 4.380
313 HG2 GLN 551 2HG GLN 551 2.034 -1.834 4.206
314 HG3 GLN 551 1HG GLN 551 0.512 -1.013 3.871
315 HE21 GLN 551 1HE2 GLN 551 1.111 -3.787 5.972
316 HE22 GLN 551 2HE2 GLN 551 0.608 -3.014 7.432
317 H ASP 552 H ASP 552 0.021 -3.128 0.869
318 HA ASP 552 HA ASP 552 2.044 -1.382 -0.375
319 HB2 ASP 552 2HB ASP 552 1.196 -3.752 -1.468
320 HB3 ASP 552 1HB ASP 552 0.095 -2.598 -2.215
321 H GLY 553 H GLY 553 -1.423 -2.152 -0.142
322 HA2 GLY 553 2HA GLY 553 -2.877 -0.320 0.597
323 HA3 GLY 553 1HA GLY 553 -1.946 0.739 -0.447
324 H LEU 554 H LEU 554 -3.283 -2.480 -1.144
325 HA LEU 554 HA LEU 554 -4.324 -1.620 -3.649
326 HB2 LEU 554 2HB LEU 554 -5.426 -3.863 -3.683
327 HB3 LEU 554 1HB LEU 554 -3.691 -3.910 -3.440
328 HG LEU 554 HG LEU 554 -4.521 -3.940 -0.868
329 HD11 LEU 554 1HD1 LEU 554 -6.672 -4.405 -0.655
330 HD12 LEU 554 2HD1 LEU 554 -6.396 -5.938 -1.481
331 HD13 LEU 554 3HD1 LEU 554 -6.863 -4.509 -2.405
332 HD21 LEU 554 3HD2 LEU 554 -4.089 -6.330 -0.910
333 HD22 LEU 554 1HD2 LEU 554 -2.934 -5.475 -1.932
334 HD23 LEU 554 2HD2 LEU 554 -4.280 -6.349 -2.663
335 H ILE 555 H ILE 555 -5.935 -0.206 -3.737
336 HA ILE 555 HA ILE 555 -8.352 -0.753 -2.178
337 HB ILE 555 HB ILE 555 -7.326 2.031 -2.670
338 HG12 ILE 555 2HG1 ILE 555 -5.714 1.024 -1.213
339 HG13 ILE 555 1HG1 ILE 555 -6.754 2.048 -0.230
340 HG21 ILE 555 1HG2 ILE 555 -9.152 2.786 -1.581
341 HG22 ILE 555 2HG2 ILE 555 -9.185 1.417 -0.471
342 HG23 ILE 555 3HG2 ILE 555 -9.828 1.243 -2.105
343 HD11 ILE 555 3HD1 ILE 555 -7.168 0.332 1.086
344 HD12 ILE 555 1HD1 ILE 555 -6.173 -0.705 0.066
345 HD13 ILE 555 2HD1 ILE 555 -7.893 -0.528 -0.272
346 H CYS 556 H CYS 556 -9.829 -1.220 -3.597
347 HA CYS 556 HA CYS 556 -9.787 -0.695 -6.330
348 HB2 CYS 556 2HB CYS 556 -12.349 -1.053 -4.790
349 HB3 CYS 556 1HB CYS 556 -11.974 -1.583 -6.426
350 H GLY 557 H GLY 557 -11.089 1.195 -3.671
351 HA2 GLY 557 2HA GLY 557 -11.308 3.561 -3.814
352 HA3 GLY 557 1HA GLY 557 -11.508 3.403 -5.554
353 H LEU 558 H LEU 558 -13.398 1.213 -5.311
354 HA LEU 558 HA LEU 558 -15.626 1.918 -3.775
355 HB2 LEU 558 2HB LEU 558 -17.053 2.949 -5.412
356 HB3 LEU 558 1HB LEU 558 -15.578 3.885 -5.275
357 HG LEU 558 HG LEU 558 -15.744 1.826 -7.435
358 HD11 LEU 558 1HD1 LEU 558 -17.801 2.826 -7.864
359 HD12 LEU 558 2HD1 LEU 558 -16.674 3.719 -8.887
360 HD13 LEU 558 3HD1 LEU 558 -17.236 4.423 -7.370
361 HD21 LEU 558 3HD2 LEU 558 -14.039 4.012 -6.680
362 HD22 LEU 558 1HD2 LEU 558 -14.660 4.254 -8.313
363 HD23 LEU 558 2HD2 LEU 558 -13.795 2.770 -7.910
364 H ARG 559 H ARG 559 -14.476 0.608 -6.803
365 HA ARG 559 HA ARG 559 -15.083 -2.015 -6.535
366 HB2 ARG 559 2HB ARG 559 -17.482 -0.429 -7.304
367 HB3 ARG 559 1HB ARG 559 -17.194 -1.928 -8.174
368 HG2 ARG 559 2HG ARG 559 -17.881 -3.174 -6.468
369 HG3 ARG 559 1HG ARG 559 -16.939 -2.242 -5.303
370 HD2 ARG 559 2HD ARG 559 -19.152 -1.885 -4.644
371 HD3 ARG 559 1HD ARG 559 -18.745 -0.443 -5.576
372 HE ARG 559 HE ARG 559 -20.273 -1.066 -7.170
373 HH11 ARG 559 1HH1 ARG 559 -19.734 -3.738 -4.989
374 HH12 ARG 559 2HH1 ARG 559 -21.047 -4.677 -5.616
375 HH21 ARG 559 1HH2 ARG 559 -21.999 -2.302 -7.995
376 HH22 ARG 559 2HH2 ARG 559 -22.332 -3.863 -7.323
377 H GLN 560 H GLN 560 -13.467 -2.456 -7.918
378 HA GLN 560 HA GLN 560 -13.746 -1.417 -10.652
379 HB2 GLN 560 2HB GLN 560 -11.261 -1.358 -10.792
380 HB3 GLN 560 1HB GLN 560 -11.930 -0.223 -9.626
381 HG2 GLN 560 2HG GLN 560 -10.487 -1.040 -8.163
382 HG3 GLN 560 1HG GLN 560 -11.466 -2.505 -8.137
383 HE21 GLN 560 1HE2 GLN 560 -8.899 -2.784 -7.518
384 HE22 GLN 560 2HE2 GLN 560 -8.016 -3.534 -8.800
Start of MODEL 20
1 H1 ALA 507 1HT ALA 507 -20.573 2.139 -4.433
2 H2 ALA 507 2HT ALA 507 -19.662 0.708 -4.695
3 H3 ALA 507 3HT ALA 507 -18.914 2.245 -4.850
4 HA ALA 507 HA ALA 507 -18.851 2.616 -2.646
5 HB1 ALA 507 2HB ALA 507 -20.389 1.929 -1.106
6 HB2 ALA 507 3HB ALA 507 -20.653 0.376 -1.896
7 HB3 ALA 507 1HB ALA 507 -21.377 1.838 -2.564
8 H GLN 508 H GLN 508 -17.214 1.804 -1.444
9 HA GLN 508 HA GLN 508 -15.695 -0.335 -2.396
10 HB2 GLN 508 2HB GLN 508 -14.401 -0.114 -0.311
11 HB3 GLN 508 1HB GLN 508 -14.716 1.445 -1.061
12 HG2 GLN 508 2HG GLN 508 -16.425 1.942 0.532
13 HG3 GLN 508 1HG GLN 508 -16.338 0.315 1.205
14 HE21 GLN 508 1HE2 GLN 508 -13.872 2.714 0.339
15 HE22 GLN 508 2HE2 GLN 508 -13.118 2.752 1.894
16 HA PRO 509 HA PRO 509 -17.830 -3.688 -0.369
17 HB2 PRO 509 2HB PRO 509 -16.241 -5.649 -1.520
18 HB3 PRO 509 1HB PRO 509 -17.654 -4.913 -2.276
19 HG2 PRO 509 2HG PRO 509 -14.927 -4.672 -3.072
20 HG3 PRO 509 1HG PRO 509 -16.337 -3.868 -3.778
21 HD2 PRO 509 2HD PRO 509 -14.349 -2.832 -1.839
22 HD3 PRO 509 1HD PRO 509 -15.350 -1.957 -3.015
23 H LYS 510 H LYS 510 -15.290 -2.376 0.807
24 HA LYS 510 HA LYS 510 -13.900 -2.720 2.569
25 HB2 LYS 510 2HB LYS 510 -15.920 -4.901 2.979
26 HB3 LYS 510 1HB LYS 510 -14.580 -4.664 4.088
27 HG2 LYS 510 2HG LYS 510 -15.449 -2.757 4.957
28 HG3 LYS 510 1HG LYS 510 -16.227 -2.294 3.441
29 HD2 LYS 510 2HD LYS 510 -18.057 -2.852 4.718
30 HD3 LYS 510 1HD LYS 510 -17.722 -4.393 3.928
31 HE2 LYS 510 2HE LYS 510 -16.387 -3.832 6.522
32 HE3 LYS 510 1HE LYS 510 -18.110 -4.208 6.544
33 HZ1 LYS 510 3HZ LYS 510 -17.749 -6.333 5.893
34 HZ2 LYS 510 1HZ LYS 510 -16.261 -6.072 6.657
35 HZ3 LYS 510 2HZ LYS 510 -16.380 -5.958 4.973
36 H CYS 511 H CYS 511 -12.217 -3.233 0.986
37 HA CYS 511 HA CYS 511 -11.116 -5.857 1.526
38 HB2 CYS 511 2HB CYS 511 -10.597 -5.802 -1.141
39 HB3 CYS 511 1HB CYS 511 -11.913 -6.703 -0.399
40 H ASN 512 H ASN 512 -10.469 -3.064 2.149
41 HA ASN 512 HA ASN 512 -8.178 -2.313 0.604
42 HB2 ASN 512 2HB ASN 512 -9.085 -1.413 3.350
43 HB3 ASN 512 1HB ASN 512 -7.807 -0.652 2.408
44 HD21 ASN 512 1HD2 ASN 512 -10.334 0.432 3.402
45 HD22 ASN 512 2HD2 ASN 512 -11.173 1.026 2.013
46 HA PRO 513 HA PRO 513 -5.188 -4.730 2.755
47 HB2 PRO 513 2HB PRO 513 -2.917 -3.418 2.321
48 HB3 PRO 513 1HB PRO 513 -3.862 -4.057 0.973
49 HG2 PRO 513 2HG PRO 513 -3.744 -1.257 2.031
50 HG3 PRO 513 1HG PRO 513 -3.713 -1.816 0.350
51 HD2 PRO 513 2HD PRO 513 -5.964 -0.905 1.652
52 HD3 PRO 513 1HD PRO 513 -5.987 -1.982 0.240
53 H ASN 514 H ASN 514 -3.085 -2.196 3.581
54 HA ASN 514 HA ASN 514 -4.092 -2.059 6.341
55 HB2 ASN 514 2HB ASN 514 -1.516 -3.072 5.323
56 HB3 ASN 514 1HB ASN 514 -1.399 -1.964 6.684
57 HD21 ASN 514 1HD2 ASN 514 -3.013 -4.910 5.593
58 HD22 ASN 514 2HD2 ASN 514 -3.142 -5.635 7.155
59 H LEU 515 H LEU 515 -1.329 -0.891 4.507
60 HA LEU 515 HA LEU 515 -0.262 1.128 4.535
61 HB2 LEU 515 2HB LEU 515 -1.471 2.730 3.248
62 HB3 LEU 515 1HB LEU 515 -1.846 1.115 2.670
63 HG LEU 515 HG LEU 515 -3.850 1.597 4.497
64 HD11 LEU 515 1HD1 LEU 515 -4.191 3.985 2.898
65 HD12 LEU 515 2HD1 LEU 515 -2.788 4.098 3.963
66 HD13 LEU 515 3HD1 LEU 515 -4.380 3.752 4.636
67 HD21 LEU 515 3HD2 LEU 515 -4.469 0.521 2.571
68 HD22 LEU 515 1HD2 LEU 515 -3.622 1.666 1.531
69 HD23 LEU 515 2HD2 LEU 515 -5.149 2.123 2.285
70 H HIS 516 H HIS 516 -0.826 0.603 7.109
71 HA HIS 516 HA HIS 516 -1.961 3.081 8.197
72 HB2 HIS 516 2HB HIS 516 -1.973 0.291 9.064
73 HB3 HIS 516 1HB HIS 516 -1.513 1.404 10.349
74 HD1 HIS 516 1HD HIS 516 -3.425 3.749 9.408
75 HD2 HIS 516 2HD HIS 516 -4.521 -0.217 9.993
76 HE1 HIS 516 1HE HIS 516 -5.902 3.793 9.842
77 HE2 HIS 516 2HE HIS 516 -6.526 1.391 10.281
78 H TYR 517 H TYR 517 1.022 1.704 7.476
79 HA TYR 517 HA TYR 517 2.438 2.629 9.794
80 HB2 TYR 517 2HB TYR 517 4.389 1.789 8.804
81 HB3 TYR 517 1HB TYR 517 3.134 0.715 8.206
82 HD1 TYR 517 2HD TYR 517 4.723 3.948 7.175
83 HD2 TYR 517 1HD TYR 517 3.325 0.111 5.981
84 HE1 TYR 517 2HE TYR 517 5.428 4.416 4.878
85 HE2 TYR 517 1HE TYR 517 4.032 0.569 3.679
86 HH TYR 517 HH TYR 517 6.032 3.211 2.858
87 H TRP 518 H TRP 518 1.431 4.003 6.796
88 HA TRP 518 HA TRP 518 3.073 6.383 7.278
89 HB2 TRP 518 2HB TRP 518 2.988 4.951 5.009
90 HB3 TRP 518 1HB TRP 518 1.663 6.070 4.702
91 HD1 TRP 518 HD TRP 518 2.483 8.010 3.316
92 HE1 TRP 518 1HE TRP 518 4.606 9.462 3.195
93 HE3 TRP 518 3HE TRP 518 5.222 5.719 6.956
94 HZ2 TRP 518 2HZ TRP 518 7.114 9.612 4.485
95 HZ3 TRP 518 3HZ TRP 518 7.474 6.574 7.458
96 HH2 TRP 518 HH TRP 518 8.398 8.481 6.247
97 H THR 519 H THR 519 2.139 8.133 7.896
98 HA THR 519 HA THR 519 -0.029 8.787 9.041
99 HB THR 519 HB THR 519 1.359 10.580 8.455
100 HG1 THR 519 1HG THR 519 -0.315 11.821 8.460
101 HG21 THR 519 3HG2 THR 519 0.665 10.927 5.657
102 HG22 THR 519 1HG2 THR 519 1.574 9.448 5.970
103 HG23 THR 519 2HG2 THR 519 2.233 11.010 6.461
104 H THR 520 H THR 520 -0.217 8.752 5.463
105 HA THR 520 HA THR 520 -2.667 7.398 5.359
106 HB THR 520 HB THR 520 -3.328 9.660 6.428
107 HG1 THR 520 1HG THR 520 -5.277 9.635 5.218
108 HG21 THR 520 3HG2 THR 520 -3.905 11.427 4.859
109 HG22 THR 520 1HG2 THR 520 -3.115 10.538 3.555
110 HG23 THR 520 2HG2 THR 520 -2.162 11.156 4.905
111 H GLN 521 H GLN 521 -0.842 10.018 3.798
112 HA GLN 521 HA GLN 521 -1.629 9.833 1.213
113 HB2 GLN 521 2HB GLN 521 0.673 10.467 0.554
114 HB3 GLN 521 1HB GLN 521 0.043 11.431 1.884
115 HG2 GLN 521 2HG GLN 521 1.272 9.660 3.358
116 HG3 GLN 521 1HG GLN 521 2.192 9.372 1.883
117 HE21 GLN 521 1HE2 GLN 521 2.996 10.505 4.477
118 HE22 GLN 521 2HE2 GLN 521 3.681 12.050 4.118
119 H ASP 522 H ASP 522 -0.938 8.722 -0.643
120 HA ASP 522 HA ASP 522 -0.898 5.978 -0.476
121 HB2 ASP 522 2HB ASP 522 0.168 7.749 -2.680
122 HB3 ASP 522 1HB ASP 522 -0.090 6.014 -2.842
123 H GLU 523 H GLU 523 0.575 5.188 0.993
124 HA GLU 523 HA GLU 523 3.411 5.711 0.585
125 HB2 GLU 523 2HB GLU 523 3.731 4.428 2.637
126 HB3 GLU 523 1HB GLU 523 2.564 5.719 2.861
127 HG2 GLU 523 2HG GLU 523 1.538 3.024 2.161
128 HG3 GLU 523 1HG GLU 523 2.158 3.280 3.792
129 H GLY 524 H GLY 524 2.851 4.620 -1.592
130 HA2 GLY 524 2HA GLY 524 4.011 2.826 -2.724
131 HA3 GLY 524 1HA GLY 524 3.617 1.783 -1.360
132 H ALA 525 H ALA 525 1.125 3.879 -2.201
133 HA ALA 525 HA ALA 525 -0.648 1.807 -2.902
134 HB1 ALA 525 1HB ALA 525 -1.287 4.620 -3.610
135 HB2 ALA 525 2HB ALA 525 -1.026 4.227 -1.912
136 HB3 ALA 525 3HB ALA 525 -2.286 3.396 -2.825
137 H ALA 526 H ALA 526 1.162 1.209 -4.677
138 HA ALA 526 HA ALA 526 1.627 0.866 -6.865
139 HB1 ALA 526 1HB ALA 526 -0.435 1.268 -8.416
140 HB2 ALA 526 2HB ALA 526 -1.292 1.466 -6.887
141 HB3 ALA 526 3HB ALA 526 -0.450 -0.044 -7.238
142 H ILE 527 H ILE 527 3.142 2.519 -6.954
143 HA ILE 527 HA ILE 527 2.767 4.392 -9.000
144 HB ILE 527 HB ILE 527 1.499 5.607 -7.399
145 HG12 ILE 527 2HG1 ILE 527 4.170 6.984 -7.314
146 HG13 ILE 527 1HG1 ILE 527 3.320 6.774 -8.841
147 HG21 ILE 527 1HG2 ILE 527 3.791 5.754 -5.509
148 HG22 ILE 527 2HG2 ILE 527 2.690 4.374 -5.485
149 HG23 ILE 527 3HG2 ILE 527 2.070 6.004 -5.208
150 HD11 ILE 527 3HD1 ILE 527 2.951 8.761 -6.846
151 HD12 ILE 527 1HD1 ILE 527 1.466 7.823 -6.995
152 HD13 ILE 527 2HD1 ILE 527 2.162 8.604 -8.414
153 H GLY 528 H GLY 528 4.553 3.866 -5.972
154 HA2 GLY 528 2HA GLY 528 6.791 3.669 -5.539
155 HA3 GLY 528 1HA GLY 528 6.965 3.181 -7.212
156 H ALA 529 H ALA 529 5.787 5.994 -7.903
157 HA ALA 529 HA ALA 529 6.751 7.886 -8.749
158 HB1 ALA 529 1HB ALA 529 6.395 8.143 -6.131
159 HB2 ALA 529 2HB ALA 529 7.125 9.417 -7.110
160 HB3 ALA 529 3HB ALA 529 8.148 8.329 -6.171
161 H ALA 530 H ALA 530 8.306 5.506 -9.223
162 HA ALA 530 HA ALA 530 10.571 6.421 -10.409
163 HB1 ALA 530 1HB ALA 530 12.052 5.285 -8.310
164 HB2 ALA 530 2HB ALA 530 10.931 6.410 -7.547
165 HB3 ALA 530 3HB ALA 530 12.026 6.978 -8.806
166 H TRP 531 H TRP 531 8.816 4.534 -11.039
167 HA TRP 531 HA TRP 531 8.361 2.262 -11.252
168 HB2 TRP 531 2HB TRP 531 10.404 1.238 -12.524
169 HB3 TRP 531 1HB TRP 531 9.423 2.493 -13.275
170 HD1 TRP 531 HD TRP 531 12.471 2.687 -10.876
171 HE1 TRP 531 1HE TRP 531 14.185 4.310 -11.908
172 HE3 TRP 531 3HE TRP 531 9.990 3.848 -15.190
173 HZ2 TRP 531 2HZ TRP 531 14.449 5.873 -14.246
174 HZ3 TRP 531 3HZ TRP 531 11.040 5.414 -16.772
175 HH2 TRP 531 HH TRP 531 13.223 6.405 -16.307
176 H ILE 532 H ILE 532 8.984 2.627 -8.718
177 HA ILE 532 HA ILE 532 10.491 0.209 -8.100
178 HB ILE 532 HB ILE 532 11.873 2.229 -7.823
179 HG12 ILE 532 2HG1 ILE 532 11.181 0.974 -5.156
180 HG13 ILE 532 1HG1 ILE 532 12.144 0.172 -6.386
181 HG21 ILE 532 1HG2 ILE 532 11.245 4.033 -6.601
182 HG22 ILE 532 2HG2 ILE 532 10.294 3.075 -5.464
183 HG23 ILE 532 3HG2 ILE 532 9.641 3.452 -7.064
184 HD11 ILE 532 3HD1 ILE 532 13.916 1.655 -6.128
185 HD12 ILE 532 1HD1 ILE 532 13.361 1.348 -4.480
186 HD13 ILE 532 2HD1 ILE 532 12.917 2.848 -5.299
187 HA PRO 533 HA PRO 533 6.517 1.256 -5.514
188 HB2 PRO 533 2HB PRO 533 4.544 0.084 -7.006
189 HB3 PRO 533 1HB PRO 533 4.914 1.808 -7.059
190 HG2 PRO 533 2HG PRO 533 5.739 -0.360 -8.934
191 HG3 PRO 533 1HG PRO 533 5.214 1.293 -9.293
192 HD2 PRO 533 2HD PRO 533 7.805 0.556 -9.325
193 HD3 PRO 533 1HD PRO 533 7.277 2.183 -8.849
194 H TYR 534 H TYR 534 7.824 -1.283 -7.366
195 HA TYR 534 HA TYR 534 6.573 -3.544 -6.340
196 HB2 TYR 534 2HB TYR 534 9.429 -3.188 -7.287
197 HB3 TYR 534 1HB TYR 534 8.597 -4.730 -7.110
198 HD1 TYR 534 1HD TYR 534 8.722 -1.582 -9.109
199 HD2 TYR 534 2HD TYR 534 7.068 -5.506 -8.756
200 HE1 TYR 534 1HE TYR 534 7.879 -1.438 -11.406
201 HE2 TYR 534 2HE TYR 534 6.225 -5.354 -11.059
202 HH TYR 534 HH TYR 534 7.183 -2.866 -13.211
203 H PHE 535 H PHE 535 9.669 -2.061 -5.361
204 HA PHE 535 HA PHE 535 9.205 -3.093 -2.649
205 HB2 PHE 535 2HB PHE 535 11.777 -3.350 -2.564
206 HB3 PHE 535 1HB PHE 535 10.830 -4.589 -3.379
207 HD1 PHE 535 1HD PHE 535 12.678 -1.433 -4.087
208 HD2 PHE 535 2HD PHE 535 11.430 -5.246 -5.505
209 HE1 PHE 535 1HE PHE 535 14.019 -1.110 -6.124
210 HE2 PHE 535 2HE PHE 535 12.770 -4.931 -7.545
211 HZ PHE 535 HZ PHE 535 14.067 -2.861 -7.856
212 H GLY 536 H GLY 536 9.188 -0.388 -4.250
213 HA2 GLY 536 2HA GLY 536 11.164 1.268 -3.107
214 HA3 GLY 536 1HA GLY 536 9.638 1.816 -3.790
215 HA PRO 537 HA PRO 537 8.594 2.756 0.465
216 HB2 PRO 537 2HB PRO 537 6.209 3.818 0.078
217 HB3 PRO 537 1HB PRO 537 7.617 4.600 -0.667
218 HG2 PRO 537 2HG PRO 537 5.710 2.624 -1.890
219 HG3 PRO 537 1HG PRO 537 6.169 4.224 -2.514
220 HD2 PRO 537 2HD PRO 537 7.340 1.924 -3.340
221 HD3 PRO 537 1HD PRO 537 8.232 3.459 -3.247
222 H ALA 538 H ALA 538 8.137 0.100 -0.830
223 HA ALA 538 HA ALA 538 5.885 -0.809 0.780
224 HB1 ALA 538 1HB ALA 538 5.223 -2.314 -0.913
225 HB2 ALA 538 2HB ALA 538 6.726 -2.084 -1.812
226 HB3 ALA 538 3HB ALA 538 5.525 -0.792 -1.752
227 H ALA 539 H ALA 539 9.134 -1.047 -0.256
228 HA ALA 539 HA ALA 539 9.678 -3.009 1.774
229 HB1 ALA 539 1HB ALA 539 9.092 -4.439 -0.081
230 HB2 ALA 539 2HB ALA 539 10.810 -4.586 0.298
231 HB3 ALA 539 3HB ALA 539 10.292 -3.639 -1.095
232 H GLU 540 H GLU 540 10.497 -0.172 0.735
233 HA GLU 540 HA GLU 540 13.345 -0.440 0.341
234 HB2 GLU 540 2HB GLU 540 13.398 2.007 0.591
235 HB3 GLU 540 1HB GLU 540 12.203 1.500 -0.591
236 HG2 GLU 540 2HG GLU 540 10.523 1.660 1.341
237 HG3 GLU 540 1HG GLU 540 11.777 2.585 2.164
238 H GLY 541 H GLY 541 13.019 -1.925 2.367
239 HA2 GLY 541 2HA GLY 541 14.194 -2.131 4.431
240 HA3 GLY 541 1HA GLY 541 13.971 -0.400 4.688
241 H ILE 542 H ILE 542 11.145 -1.192 3.492
242 HA ILE 542 HA ILE 542 9.750 -1.112 5.948
243 HB ILE 542 HB ILE 542 9.084 -1.082 3.086
244 HG12 ILE 542 2HG1 ILE 542 7.672 0.119 5.467
245 HG13 ILE 542 1HG1 ILE 542 9.093 0.840 4.715
246 HG21 ILE 542 1HG2 ILE 542 7.764 -2.987 3.459
247 HG22 ILE 542 2HG2 ILE 542 6.650 -1.622 3.598
248 HG23 ILE 542 3HG2 ILE 542 7.245 -2.424 5.051
249 HD11 ILE 542 3HD1 ILE 542 7.752 0.772 2.551
250 HD12 ILE 542 1HD1 ILE 542 7.298 1.964 3.768
251 HD13 ILE 542 2HD1 ILE 542 6.352 0.488 3.585
252 H TYR 543 H TYR 543 10.375 -3.676 3.577
253 HA TYR 543 HA TYR 543 8.800 -5.710 4.420
254 HB2 TYR 543 2HB TYR 543 10.564 -7.282 3.692
255 HB3 TYR 543 1HB TYR 543 10.300 -5.973 2.542
256 HD1 TYR 543 2HD TYR 543 11.887 -4.005 2.613
257 HD2 TYR 543 1HD TYR 543 12.693 -7.685 4.561
258 HE1 TYR 543 2HE TYR 543 14.283 -3.431 2.675
259 HE2 TYR 543 1HE TYR 543 15.092 -7.134 4.638
260 HH TYR 543 HH TYR 543 16.468 -4.673 2.824
261 H ALA 544 H ALA 544 11.530 -4.391 6.127
262 HA ALA 544 HA ALA 544 12.177 -6.411 7.902
263 HB1 ALA 544 1HB ALA 544 12.001 -3.470 8.521
264 HB2 ALA 544 2HB ALA 544 13.363 -4.266 7.734
265 HB3 ALA 544 3HB ALA 544 12.947 -4.669 9.400
266 H GLU 545 H GLU 545 9.259 -4.677 7.623
267 HA GLU 545 HA GLU 545 8.210 -4.624 10.176
268 HB2 GLU 545 2HB GLU 545 5.983 -4.940 8.927
269 HB3 GLU 545 1HB GLU 545 6.965 -3.551 8.482
270 HG2 GLU 545 2HG GLU 545 6.479 -4.288 6.405
271 HG3 GLU 545 1HG GLU 545 7.899 -5.287 6.693
272 H GLY 546 H GLY 546 8.186 -7.161 7.747
273 HA2 GLY 546 2HA GLY 546 7.733 -9.393 7.847
274 HA3 GLY 546 1HA GLY 546 8.547 -9.306 9.395
275 H LEU 547 H LEU 547 5.496 -7.643 8.807
276 HA LEU 547 HA LEU 547 4.042 -9.782 10.143
277 HB2 LEU 547 2HB LEU 547 3.307 -8.582 11.974
278 HB3 LEU 547 1HB LEU 547 4.995 -8.132 11.850
279 HG LEU 547 HG LEU 547 2.809 -6.413 10.697
280 HD11 LEU 547 1HD1 LEU 547 4.038 -5.832 13.345
281 HD12 LEU 547 2HD1 LEU 547 2.691 -6.967 13.253
282 HD13 LEU 547 3HD1 LEU 547 2.490 -5.311 12.679
283 HD21 LEU 547 3HD2 LEU 547 5.433 -6.298 10.263
284 HD22 LEU 547 1HD2 LEU 547 5.367 -5.376 11.763
285 HD23 LEU 547 2HD2 LEU 547 4.424 -4.855 10.368
286 H MET 548 H MET 548 3.843 -6.578 8.629
287 HA MET 548 HA MET 548 1.852 -7.298 6.824
288 HB2 MET 548 2HB MET 548 0.852 -6.663 9.476
289 HB3 MET 548 1HB MET 548 0.175 -5.594 8.254
290 HG2 MET 548 2HG MET 548 -0.930 -7.279 7.187
291 HG3 MET 548 1HG MET 548 0.215 -8.511 7.710
292 HE1 MET 548 3HE MET 548 -0.093 -10.054 9.343
293 HE2 MET 548 1HE MET 548 -1.691 -10.367 8.667
294 HE3 MET 548 2HE MET 548 -1.484 -10.235 10.413
295 H HIS 549 H HIS 549 3.529 -4.828 8.596
296 HA HIS 549 HA HIS 549 2.623 -2.524 7.358
297 HB2 HIS 549 2HB HIS 549 4.952 -3.308 8.906
298 HB3 HIS 549 1HB HIS 549 5.333 -2.061 7.722
299 HD1 HIS 549 1HD HIS 549 1.908 -1.993 9.074
300 HD2 HIS 549 2HD HIS 549 5.586 -0.270 9.950
301 HE1 HIS 549 1HE HIS 549 1.403 -0.098 10.633
302 HE2 HIS 549 2HE HIS 549 3.653 0.854 11.252
303 H ASN 550 H ASN 550 4.228 -5.116 5.856
304 HA ASN 550 HA ASN 550 5.637 -3.641 3.859
305 HB2 ASN 550 2HB ASN 550 5.759 -5.870 2.701
306 HB3 ASN 550 1HB ASN 550 6.396 -5.857 4.342
307 HD21 ASN 550 1HD2 ASN 550 6.008 -8.234 3.809
308 HD22 ASN 550 2HD2 ASN 550 4.486 -8.881 4.308
309 H GLN 551 H GLN 551 2.535 -3.493 4.365
310 HA GLN 551 HA GLN 551 1.067 -4.306 2.208
311 HB2 GLN 551 2HB GLN 551 -0.363 -2.296 2.699
312 HB3 GLN 551 1HB GLN 551 0.009 -3.301 4.096
313 HG2 GLN 551 2HG GLN 551 2.024 -1.296 3.815
314 HG3 GLN 551 1HG GLN 551 0.434 -0.538 3.778
315 HE21 GLN 551 1HE2 GLN 551 1.256 0.409 5.800
316 HE22 GLN 551 2HE2 GLN 551 1.024 -0.470 7.270
317 H ASP 552 H ASP 552 -0.050 -2.422 0.785
318 HA ASP 552 HA ASP 552 2.011 -0.817 -0.536
319 HB2 ASP 552 2HB ASP 552 0.626 -3.149 -1.672
320 HB3 ASP 552 1HB ASP 552 0.549 -1.708 -2.683
321 H GLY 553 H GLY 553 -1.443 -1.654 -0.369
322 HA2 GLY 553 2HA GLY 553 -2.966 0.163 0.271
323 HA3 GLY 553 1HA GLY 553 -2.034 1.210 -0.786
324 H LEU 554 H LEU 554 -3.223 -2.073 -1.418
325 HA LEU 554 HA LEU 554 -4.000 -1.671 -4.005
326 HB2 LEU 554 2HB LEU 554 -5.811 -3.498 -3.412
327 HB3 LEU 554 1HB LEU 554 -4.105 -3.880 -3.516
328 HG LEU 554 HG LEU 554 -4.741 -3.078 -0.827
329 HD11 LEU 554 1HD1 LEU 554 -6.167 -5.592 -1.388
330 HD12 LEU 554 2HD1 LEU 554 -6.977 -4.114 -1.904
331 HD13 LEU 554 3HD1 LEU 554 -6.514 -4.321 -0.214
332 HD21 LEU 554 3HD2 LEU 554 -4.069 -5.632 -0.597
333 HD22 LEU 554 1HD2 LEU 554 -2.879 -4.383 -0.967
334 HD23 LEU 554 2HD2 LEU 554 -3.540 -5.383 -2.261
335 H ILE 555 H ILE 555 -6.545 -2.055 -1.561
336 HA ILE 555 HA ILE 555 -8.527 -0.980 -1.243
337 HB ILE 555 HB ILE 555 -7.450 1.258 -2.943
338 HG12 ILE 555 2HG1 ILE 555 -5.839 0.703 -1.177
339 HG13 ILE 555 1HG1 ILE 555 -6.606 2.259 -0.882
340 HG21 ILE 555 1HG2 ILE 555 -9.183 1.772 -0.624
341 HG22 ILE 555 2HG2 ILE 555 -9.941 0.935 -1.979
342 HG23 ILE 555 3HG2 ILE 555 -9.182 2.507 -2.228
343 HD11 ILE 555 3HD1 ILE 555 -8.079 1.248 0.740
344 HD12 ILE 555 1HD1 ILE 555 -6.394 0.928 1.150
345 HD13 ILE 555 2HD1 ILE 555 -7.379 -0.336 0.412
346 H CYS 556 H CYS 556 -10.260 -1.777 -2.211
347 HA CYS 556 HA CYS 556 -10.372 -2.506 -4.921
348 HB2 CYS 556 2HB CYS 556 -12.427 -2.225 -2.747
349 HB3 CYS 556 1HB CYS 556 -12.909 -2.649 -4.384
350 H GLY 557 H GLY 557 -11.387 0.397 -3.234
351 HA2 GLY 557 2HA GLY 557 -11.642 2.518 -4.176
352 HA3 GLY 557 1HA GLY 557 -11.640 1.782 -5.774
353 H LEU 558 H LEU 558 -13.629 -0.181 -5.145
354 HA LEU 558 HA LEU 558 -15.959 0.605 -4.064
355 HB2 LEU 558 2HB LEU 558 -17.265 1.626 -5.789
356 HB3 LEU 558 1HB LEU 558 -15.808 2.567 -5.572
357 HG LEU 558 HG LEU 558 -15.919 0.498 -7.728
358 HD11 LEU 558 1HD1 LEU 558 -17.201 3.207 -7.742
359 HD12 LEU 558 2HD1 LEU 558 -17.860 1.662 -8.283
360 HD13 LEU 558 3HD1 LEU 558 -16.602 2.463 -9.225
361 HD21 LEU 558 3HD2 LEU 558 -13.771 1.471 -7.278
362 HD22 LEU 558 1HD2 LEU 558 -14.447 3.099 -7.349
363 HD23 LEU 558 2HD2 LEU 558 -14.372 2.110 -8.808
364 H ARG 559 H ARG 559 -14.491 -0.778 -6.935
365 HA ARG 559 HA ARG 559 -14.881 -2.658 -8.144
366 HB2 ARG 559 2HB ARG 559 -15.250 -3.397 -5.318
367 HB3 ARG 559 1HB ARG 559 -15.920 -4.533 -6.483
368 HG2 ARG 559 2HG ARG 559 -13.558 -4.977 -5.732
369 HG3 ARG 559 1HG ARG 559 -13.815 -4.912 -7.476
370 HD2 ARG 559 2HD ARG 559 -13.174 -2.313 -6.332
371 HD3 ARG 559 1HD ARG 559 -11.910 -3.510 -6.048
372 HE ARG 559 HE ARG 559 -12.669 -2.343 -8.572
373 HH11 ARG 559 1HH1 ARG 559 -11.090 -5.034 -7.004
374 HH12 ARG 559 2HH1 ARG 559 -10.127 -5.433 -8.386
375 HH21 ARG 559 1HH2 ARG 559 -11.402 -2.868 -10.388
376 HH22 ARG 559 2HH2 ARG 559 -10.302 -4.204 -10.307
377 H GLN 560 H GLN 560 -16.390 -2.692 -9.647
378 HA GLN 560 HA GLN 560 -19.183 -3.025 -8.798
379 HB2 GLN 560 2HB GLN 560 -19.845 -1.663 -10.790
380 HB3 GLN 560 1HB GLN 560 -18.994 -0.757 -9.548
381 HG2 GLN 560 2HG GLN 560 -17.373 -0.185 -10.948
382 HG3 GLN 560 1HG GLN 560 -17.166 -1.845 -11.502
383 HE21 GLN 560 1HE2 GLN 560 -17.763 1.141 -12.554
384 HE22 GLN 560 2HE2 GLN 560 -18.721 0.804 -13.951
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