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 |
|
|
589319 |
2mv7   |
19516 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 ASP 500 H1 ASP 500 6.904 -21.061 -5.691
2 H2 ASP 500 H2 ASP 500 6.668 -20.729 -7.340
3 H3 ASP 500 H3 ASP 500 5.793 -21.976 -6.589
4 HA ASP 500 HA ASP 500 5.137 -19.245 -6.817
5 HB2 ASP 500 HB2 ASP 500 3.697 -21.325 -7.095
6 HB3 ASP 500 HB3 ASP 500 3.683 -21.447 -5.335
7 H LYS 501 H LYS 501 6.929 -20.745 -4.461
8 HA LYS 501 HA LYS 501 5.799 -19.471 -2.132
9 HB2 LYS 501 HB2 LYS 501 8.520 -20.744 -2.487
10 HB3 LYS 501 HB3 LYS 501 7.732 -20.368 -0.956
11 HG2 LYS 501 HG2 LYS 501 6.508 -22.216 -3.021
12 HG3 LYS 501 HG3 LYS 501 7.551 -22.795 -1.726
13 HD2 LYS 501 HD2 LYS 501 5.937 -21.555 -0.124
14 HD3 LYS 501 HD3 LYS 501 4.836 -21.487 -1.500
15 HE2 LYS 501 HE2 LYS 501 5.934 -23.939 -0.121
16 HE3 LYS 501 HE3 LYS 501 4.246 -23.470 -0.325
17 HZ1 LYS 501 HZ1 LYS 501 4.490 -25.001 -1.987
18 HZ2 LYS 501 HZ2 LYS 501 6.115 -24.605 -2.285
19 HZ3 LYS 501 HZ3 LYS 501 4.874 -23.583 -2.834
20 H ALA 502 H ALA 502 7.508 -18.324 -4.723
21 HA ALA 502 HA ALA 502 9.283 -16.509 -3.352
22 HB1 ALA 502 HB1 ALA 502 9.827 -15.675 -5.528
23 HB2 ALA 502 HB2 ALA 502 8.361 -16.362 -6.225
24 HB3 ALA 502 HB3 ALA 502 9.659 -17.424 -5.680
25 H TYR 503 H TYR 503 6.140 -16.304 -4.952
26 HA TYR 503 HA TYR 503 5.657 -13.609 -5.017
27 HB2 TYR 503 HB2 TYR 503 4.086 -15.455 -5.724
28 HB3 TYR 503 HB3 TYR 503 3.625 -15.619 -4.029
29 HD1 TYR 503 HD1 TYR 503 4.089 -12.940 -6.618
30 HD2 TYR 503 HD2 TYR 503 1.800 -14.358 -3.269
31 HE1 TYR 503 HE1 TYR 503 2.542 -11.025 -6.862
32 HE2 TYR 503 HE2 TYR 503 0.249 -12.442 -3.519
33 HH TYR 503 HH TYR 503 -0.381 -10.752 -4.875
34 H LEU 504 H LEU 504 4.741 -15.683 -2.241
35 HA LEU 504 HA LEU 504 3.942 -13.778 -0.455
36 HB2 LEU 504 HB2 LEU 504 5.508 -16.321 -0.030
37 HB3 LEU 504 HB3 LEU 504 5.003 -15.317 1.329
38 HG LEU 504 HG LEU 504 2.648 -15.469 0.525
39 HD11 LEU 504 HD11 LEU 504 2.829 -15.871 -1.799
40 HD12 LEU 504 HD12 LEU 504 2.265 -17.409 -1.150
41 HD13 LEU 504 HD13 LEU 504 3.965 -17.200 -1.571
42 HD21 LEU 504 HD21 LEU 504 4.057 -18.122 0.969
43 HD22 LEU 504 HD22 LEU 504 2.327 -17.844 1.171
44 HD23 LEU 504 HD23 LEU 504 3.479 -17.034 2.232
45 H ASP 505 H ASP 505 7.299 -14.875 -0.905
46 HA ASP 505 HA ASP 505 8.607 -13.299 0.923
47 HB2 ASP 505 HB2 ASP 505 9.577 -15.007 -0.740
48 HB3 ASP 505 HB3 ASP 505 9.670 -13.662 -1.876
49 H GLU 506 H GLU 506 7.769 -12.384 -2.422
50 HA GLU 506 HA GLU 506 8.801 -9.814 -2.458
51 HB2 GLU 506 HB2 GLU 506 6.196 -10.699 -3.719
52 HB3 GLU 506 HB3 GLU 506 7.191 -9.329 -4.213
53 HG2 GLU 506 HG2 GLU 506 8.123 -12.214 -4.211
54 HG3 GLU 506 HG3 GLU 506 7.555 -11.348 -5.637
55 H LEU 507 H LEU 507 6.058 -11.045 -0.752
56 HA LEU 507 HA LEU 507 4.918 -8.410 -0.224
57 HB2 LEU 507 HB2 LEU 507 4.126 -10.972 1.149
58 HB3 LEU 507 HB3 LEU 507 3.150 -9.538 0.831
59 HG LEU 507 HG LEU 507 4.162 -11.544 -1.201
60 HD11 LEU 507 HD11 LEU 507 1.685 -11.738 -1.639
61 HD12 LEU 507 HD12 LEU 507 1.419 -10.715 -0.229
62 HD13 LEU 507 HD13 LEU 507 2.178 -12.294 -0.039
63 HD21 LEU 507 HD21 LEU 507 2.849 -8.835 -1.533
64 HD22 LEU 507 HD22 LEU 507 2.792 -10.069 -2.794
65 HD23 LEU 507 HD23 LEU 507 4.343 -9.413 -2.271
66 H VAL 508 H VAL 508 6.635 -10.968 1.554
67 HA VAL 508 HA VAL 508 6.575 -9.801 4.092
68 HB VAL 508 HB VAL 508 8.784 -11.476 2.881
69 HG11 VAL 508 HG11 VAL 508 8.004 -10.810 5.735
70 HG12 VAL 508 HG12 VAL 508 9.526 -10.421 4.931
71 HG13 VAL 508 HG13 VAL 508 9.128 -12.099 5.303
72 HG21 VAL 508 HG21 VAL 508 7.507 -13.298 4.156
73 HG22 VAL 508 HG22 VAL 508 6.737 -12.698 2.688
74 HG23 VAL 508 HG23 VAL 508 6.175 -12.146 4.267
75 H GLU 509 H GLU 509 9.280 -9.678 1.760
76 HA GLU 509 HA GLU 509 10.892 -7.866 3.089
77 HB2 GLU 509 HB2 GLU 509 10.443 -8.368 0.148
78 HB3 GLU 509 HB3 GLU 509 11.606 -7.163 0.701
79 HG2 GLU 509 HG2 GLU 509 12.610 -9.435 0.293
80 HG3 GLU 509 HG3 GLU 509 12.850 -8.830 1.931
81 H LEU 510 H LEU 510 8.396 -7.095 0.641
82 HA LEU 510 HA LEU 510 8.603 -4.307 0.823
83 HB2 LEU 510 HB2 LEU 510 6.620 -6.257 -0.197
84 HB3 LEU 510 HB3 LEU 510 5.911 -4.722 0.291
85 HG LEU 510 HG LEU 510 7.612 -3.552 -1.142
86 HD11 LEU 510 HD11 LEU 510 8.981 -4.777 -2.668
87 HD12 LEU 510 HD12 LEU 510 8.155 -6.290 -2.305
88 HD13 LEU 510 HD13 LEU 510 9.211 -5.551 -1.102
89 HD21 LEU 510 HD21 LEU 510 5.255 -4.264 -1.888
90 HD22 LEU 510 HD22 LEU 510 6.050 -5.577 -2.756
91 HD23 LEU 510 HD23 LEU 510 6.412 -3.900 -3.166
92 H HIS 511 H HIS 511 6.414 -6.535 2.533
93 HA HIS 511 HA HIS 511 5.056 -4.728 4.118
94 HB2 HIS 511 HB2 HIS 511 4.469 -7.084 4.035
95 HB3 HIS 511 HB3 HIS 511 5.989 -7.522 4.810
96 HD1 HIS 511 HD1 HIS 511 3.068 -5.193 5.559
97 HD2 HIS 511 HD2 HIS 511 5.693 -7.757 7.537
98 HE1 HIS 511 HE1 HIS 511 2.429 -5.129 8.009
99 HE2 HIS 511 HE2 HIS 511 4.007 -6.699 9.226
100 H ARG 512 H ARG 512 8.001 -6.531 5.040
101 HA ARG 512 HA ARG 512 8.442 -5.333 7.502
102 HB2 ARG 512 HB2 ARG 512 9.720 -7.264 6.829
103 HB3 ARG 512 HB3 ARG 512 10.403 -6.398 5.456
104 HG2 ARG 512 HG2 ARG 512 11.960 -6.593 7.426
105 HG3 ARG 512 HG3 ARG 512 11.662 -4.935 6.916
106 HD2 ARG 512 HD2 ARG 512 10.240 -4.503 8.749
107 HD3 ARG 512 HD3 ARG 512 9.977 -6.216 9.066
108 HE ARG 512 HE ARG 512 11.961 -6.248 10.285
109 HH11 ARG 512 HH11 ARG 512 11.680 -3.363 8.394
110 HH12 ARG 512 HH12 ARG 512 13.045 -2.586 9.125
111 HH21 ARG 512 HH21 ARG 512 13.751 -5.236 11.248
112 HH22 ARG 512 HH22 ARG 512 14.218 -3.646 10.741
113 H ARG 513 H ARG 513 9.809 -4.393 4.347
114 HA ARG 513 HA ARG 513 11.211 -2.133 5.209
115 HB2 ARG 513 HB2 ARG 513 9.933 -2.780 2.549
116 HB3 ARG 513 HB3 ARG 513 10.961 -1.371 2.812
117 HG2 ARG 513 HG2 ARG 513 12.840 -2.753 3.401
118 HG3 ARG 513 HG3 ARG 513 11.833 -4.201 3.446
119 HD2 ARG 513 HD2 ARG 513 13.166 -4.016 1.344
120 HD3 ARG 513 HD3 ARG 513 11.429 -4.055 1.053
121 HE ARG 513 HE ARG 513 12.422 -1.371 1.293
122 HH11 ARG 513 HH11 ARG 513 12.112 -4.112 -0.797
123 HH12 ARG 513 HH12 ARG 513 12.150 -3.178 -2.255
124 HH21 ARG 513 HH21 ARG 513 12.473 -0.140 -0.614
125 HH22 ARG 513 HH22 ARG 513 12.355 -0.930 -2.152
126 H LEU 514 H LEU 514 7.881 -2.410 3.994
127 HA LEU 514 HA LEU 514 7.215 0.302 4.025
128 HB2 LEU 514 HB2 LEU 514 5.591 -2.212 4.352
129 HB3 LEU 514 HB3 LEU 514 4.826 -0.626 4.417
130 HG LEU 514 HG LEU 514 6.666 -1.270 2.113
131 HD11 LEU 514 HD11 LEU 514 3.756 -2.096 2.333
132 HD12 LEU 514 HD12 LEU 514 5.139 -3.184 2.209
133 HD13 LEU 514 HD13 LEU 514 4.713 -2.141 0.853
134 HD21 LEU 514 HD21 LEU 514 5.813 1.022 2.332
135 HD22 LEU 514 HD22 LEU 514 4.161 0.420 2.435
136 HD23 LEU 514 HD23 LEU 514 5.071 0.246 0.936
137 H MET 515 H MET 515 7.059 -2.118 6.591
138 HA MET 515 HA MET 515 5.691 -0.649 8.509
139 HB2 MET 515 HB2 MET 515 6.377 -3.088 8.617
140 HB3 MET 515 HB3 MET 515 7.966 -2.527 9.135
141 HG2 MET 515 HG2 MET 515 6.798 -2.932 11.158
142 HG3 MET 515 HG3 MET 515 6.704 -1.184 10.943
143 HE1 MET 515 HE1 MET 515 3.417 -4.324 10.704
144 HE2 MET 515 HE2 MET 515 4.916 -4.350 11.631
145 HE3 MET 515 HE3 MET 515 4.971 -4.507 9.877
146 H THR 516 H THR 516 9.132 -0.592 7.701
147 HA THR 516 HA THR 516 9.645 1.390 9.807
148 HB THR 516 HB THR 516 11.997 1.153 9.122
149 HG1 THR 516 HG1 THR 516 11.621 0.753 6.917
150 HG21 THR 516 HG21 THR 516 10.891 -0.463 10.720
151 HG22 THR 516 HG22 THR 516 12.305 -1.109 9.888
152 HG23 THR 516 HG23 THR 516 10.686 -1.565 9.358
153 H LEU 517 H LEU 517 9.108 1.146 6.384
154 HA LEU 517 HA LEU 517 10.383 3.406 5.427
155 HB2 LEU 517 HB2 LEU 517 9.087 1.684 4.101
156 HB3 LEU 517 HB3 LEU 517 7.623 2.543 4.570
157 HG LEU 517 HG LEU 517 8.905 4.664 3.643
158 HD11 LEU 517 HD11 LEU 517 10.314 2.361 2.248
159 HD12 LEU 517 HD12 LEU 517 11.065 3.617 3.231
160 HD13 LEU 517 HD13 LEU 517 10.341 4.028 1.679
161 HD21 LEU 517 HD21 LEU 517 8.065 4.032 1.300
162 HD22 LEU 517 HD22 LEU 517 6.884 3.958 2.606
163 HD23 LEU 517 HD23 LEU 517 7.621 2.477 2.003
164 H ARG 518 H ARG 518 10.029 5.560 5.452
165 HA ARG 518 HA ARG 518 7.628 6.566 6.878
166 HB2 ARG 518 HB2 ARG 518 9.805 6.669 8.203
167 HB3 ARG 518 HB3 ARG 518 10.366 7.834 7.007
168 HG2 ARG 518 HG2 ARG 518 9.432 9.063 8.876
169 HG3 ARG 518 HG3 ARG 518 8.346 9.239 7.500
170 HD2 ARG 518 HD2 ARG 518 7.796 6.951 9.347
171 HD3 ARG 518 HD3 ARG 518 7.455 8.567 9.956
172 HE ARG 518 HE ARG 518 6.353 8.342 7.376
173 HH11 ARG 518 HH11 ARG 518 6.008 7.077 10.578
174 HH12 ARG 518 HH12 ARG 518 4.309 6.774 10.423
175 HH21 ARG 518 HH21 ARG 518 4.126 7.947 7.166
176 HH22 ARG 518 HH22 ARG 518 3.244 7.267 8.492
177 H GLU 519 H GLU 519 9.721 6.727 4.160
178 HA GLU 519 HA GLU 519 9.483 9.289 3.213
179 HB2 GLU 519 HB2 GLU 519 10.272 6.807 2.165
180 HB3 GLU 519 HB3 GLU 519 9.002 7.334 1.068
181 HG2 GLU 519 HG2 GLU 519 11.420 8.981 1.873
182 HG3 GLU 519 HG3 GLU 519 11.231 8.127 0.343
183 H ARG 520 H ARG 520 7.588 10.326 3.677
184 HA ARG 520 HA ARG 520 4.993 9.306 3.294
185 HB2 ARG 520 HB2 ARG 520 6.068 12.124 3.420
186 HB3 ARG 520 HB3 ARG 520 4.346 11.772 3.259
187 HG2 ARG 520 HG2 ARG 520 4.351 10.515 5.334
188 HG3 ARG 520 HG3 ARG 520 6.104 10.663 5.467
189 HD2 ARG 520 HD2 ARG 520 4.271 13.066 5.366
190 HD3 ARG 520 HD3 ARG 520 4.741 12.295 6.879
191 HE ARG 520 HE ARG 520 7.026 12.914 5.271
192 HH11 ARG 520 HH11 ARG 520 4.614 14.239 7.368
193 HH12 ARG 520 HH12 ARG 520 5.605 15.556 7.903
194 HH21 ARG 520 HH21 ARG 520 8.331 14.637 5.969
195 HH22 ARG 520 HH22 ARG 520 7.709 15.780 7.110
196 H HIS 521 H HIS 521 7.297 10.604 1.061
197 HA HIS 521 HA HIS 521 5.571 11.469 -0.990
198 HB2 HIS 521 HB2 HIS 521 8.063 11.865 -0.851
199 HB3 HIS 521 HB3 HIS 521 8.282 10.199 -1.386
200 HD1 HIS 521 HD1 HIS 521 8.453 9.931 -3.849
201 HD2 HIS 521 HD2 HIS 521 6.252 13.324 -2.834
202 HE1 HIS 521 HE1 HIS 521 7.837 11.064 -6.029
203 HE2 HIS 521 HE2 HIS 521 6.496 13.134 -5.428
204 H ILE 522 H ILE 522 6.733 8.275 -0.087
205 HA ILE 522 HA ILE 522 5.615 7.037 -2.483
206 HB ILE 522 HB ILE 522 7.274 6.119 -0.151
207 HG12 ILE 522 HG12 ILE 522 8.719 5.279 -1.893
208 HG13 ILE 522 HG13 ILE 522 7.469 5.502 -3.114
209 HG21 ILE 522 HG21 ILE 522 6.971 3.741 -1.091
210 HG22 ILE 522 HG22 ILE 522 5.515 4.361 -1.870
211 HG23 ILE 522 HG23 ILE 522 5.650 4.378 -0.112
212 HD11 ILE 522 HD11 ILE 522 8.441 7.860 -1.515
213 HD12 ILE 522 HD12 ILE 522 7.707 7.831 -3.120
214 HD13 ILE 522 HD13 ILE 522 9.368 7.283 -2.900
215 H LEU 523 H LEU 523 5.024 6.893 1.045
216 HA LEU 523 HA LEU 523 2.895 5.149 1.102
217 HB2 LEU 523 HB2 LEU 523 3.030 7.703 2.718
218 HB3 LEU 523 HB3 LEU 523 2.171 6.224 3.141
219 HG LEU 523 HG LEU 523 5.171 6.423 2.776
220 HD11 LEU 523 HD11 LEU 523 4.190 7.661 4.767
221 HD12 LEU 523 HD12 LEU 523 5.347 6.393 5.168
222 HD13 LEU 523 HD13 LEU 523 3.617 6.100 5.353
223 HD21 LEU 523 HD21 LEU 523 4.961 4.173 4.073
224 HD22 LEU 523 HD22 LEU 523 4.571 4.174 2.356
225 HD23 LEU 523 HD23 LEU 523 3.276 4.200 3.550
226 H GLN 524 H GLN 524 2.945 8.429 -0.103
227 HA GLN 524 HA GLN 524 0.071 8.683 -0.179
228 HB2 GLN 524 HB2 GLN 524 1.721 10.617 -0.099
229 HB3 GLN 524 HB3 GLN 524 2.073 10.274 -1.794
230 HG2 GLN 524 HG2 GLN 524 0.373 11.964 -1.786
231 HG3 GLN 524 HG3 GLN 524 -0.422 10.454 -2.234
232 HE21 GLN 524 HE21 GLN 524 0.586 11.449 1.060
233 HE22 GLN 524 HE22 GLN 524 -0.985 11.460 1.702
234 H GLN 525 H GLN 525 2.621 7.861 -2.490
235 HA GLN 525 HA GLN 525 0.958 7.666 -4.779
236 HB2 GLN 525 HB2 GLN 525 3.558 6.230 -4.191
237 HB3 GLN 525 HB3 GLN 525 2.820 6.433 -5.779
238 HG2 GLN 525 HG2 GLN 525 3.478 8.812 -4.046
239 HG3 GLN 525 HG3 GLN 525 4.687 8.092 -5.105
240 HE21 GLN 525 HE21 GLN 525 1.466 9.654 -5.116
241 HE22 GLN 525 HE22 GLN 525 1.538 10.146 -6.740
242 H ILE 526 H ILE 526 2.309 5.131 -2.664
243 HA ILE 526 HA ILE 526 1.044 2.935 -3.824
244 HB ILE 526 HB ILE 526 1.850 3.443 -0.953
245 HG12 ILE 526 HG12 ILE 526 3.140 1.741 -3.104
246 HG13 ILE 526 HG13 ILE 526 3.593 3.416 -2.803
247 HG21 ILE 526 HG21 ILE 526 0.274 1.690 -0.774
248 HG22 ILE 526 HG22 ILE 526 1.817 0.848 -0.918
249 HG23 ILE 526 HG23 ILE 526 0.752 0.985 -2.316
250 HD11 ILE 526 HD11 ILE 526 4.001 2.748 -0.382
251 HD12 ILE 526 HD12 ILE 526 5.129 2.067 -1.555
252 HD13 ILE 526 HD13 ILE 526 3.825 1.073 -0.906
253 H VAL 527 H VAL 527 -0.005 4.687 -0.898
254 HA VAL 527 HA VAL 527 -2.387 3.494 -0.386
255 HB VAL 527 HB VAL 527 -1.691 6.435 -0.290
256 HG11 VAL 527 HG11 VAL 527 -4.158 4.977 0.675
257 HG12 VAL 527 HG12 VAL 527 -4.077 6.413 -0.346
258 HG13 VAL 527 HG13 VAL 527 -3.644 6.517 1.361
259 HG21 VAL 527 HG21 VAL 527 -1.088 6.047 1.935
260 HG22 VAL 527 HG22 VAL 527 -0.566 4.543 1.176
261 HG23 VAL 527 HG23 VAL 527 -2.084 4.598 2.068
262 H ASN 528 H ASN 528 -2.190 6.419 -2.449
263 HA ASN 528 HA ASN 528 -4.762 6.392 -3.435
264 HB2 ASN 528 HB2 ASN 528 -2.199 7.249 -4.780
265 HB3 ASN 528 HB3 ASN 528 -3.808 7.610 -5.405
266 HD21 ASN 528 HD21 ASN 528 -2.574 9.890 -4.898
267 HD22 ASN 528 HD22 ASN 528 -2.989 10.562 -3.397
268 H LEU 529 H LEU 529 -2.117 4.280 -4.255
269 HA LEU 529 HA LEU 529 -3.169 3.421 -6.774
270 HB2 LEU 529 HB2 LEU 529 -0.734 3.223 -5.779
271 HB3 LEU 529 HB3 LEU 529 -1.335 1.710 -5.114
272 HG LEU 529 HG LEU 529 -0.304 1.234 -7.248
273 HD11 LEU 529 HD11 LEU 529 -3.276 1.243 -7.781
274 HD12 LEU 529 HD12 LEU 529 -2.527 0.147 -6.619
275 HD13 LEU 529 HD13 LEU 529 -2.075 0.073 -8.321
276 HD21 LEU 529 HD21 LEU 529 -0.577 2.452 -9.190
277 HD22 LEU 529 HD22 LEU 529 -0.878 3.745 -8.037
278 HD23 LEU 529 HD23 LEU 529 -2.231 2.923 -8.812
279 H ILE 530 H ILE 530 -2.854 1.657 -3.694
280 HA ILE 530 HA ILE 530 -4.693 -0.369 -4.478
281 HB ILE 530 HB ILE 530 -4.496 -1.159 -2.170
282 HG12 ILE 530 HG12 ILE 530 -2.585 1.103 -1.558
283 HG13 ILE 530 HG13 ILE 530 -4.306 1.359 -1.309
284 HG21 ILE 530 HG21 ILE 530 -1.935 -0.222 -3.498
285 HG22 ILE 530 HG22 ILE 530 -2.757 -1.764 -3.750
286 HG23 ILE 530 HG23 ILE 530 -1.993 -1.415 -2.199
287 HD11 ILE 530 HD11 ILE 530 -3.079 -1.147 -0.209
288 HD12 ILE 530 HD12 ILE 530 -4.452 -0.209 0.383
289 HD13 ILE 530 HD13 ILE 530 -2.807 0.377 0.637
290 H GLU 531 H GLU 531 -5.107 2.751 -3.346
291 HA GLU 531 HA GLU 531 -7.597 2.370 -1.939
292 HB2 GLU 531 HB2 GLU 531 -6.128 4.345 -1.532
293 HB3 GLU 531 HB3 GLU 531 -6.505 4.914 -3.157
294 HG2 GLU 531 HG2 GLU 531 -8.701 4.286 -1.186
295 HG3 GLU 531 HG3 GLU 531 -7.903 5.857 -1.188
296 H GLU 532 H GLU 532 -6.674 3.611 -5.149
297 HA GLU 532 HA GLU 532 -9.275 4.029 -6.136
298 HB2 GLU 532 HB2 GLU 532 -6.653 3.433 -7.515
299 HB3 GLU 532 HB3 GLU 532 -8.142 3.766 -8.402
300 HG2 GLU 532 HG2 GLU 532 -7.068 5.621 -6.267
301 HG3 GLU 532 HG3 GLU 532 -6.640 5.783 -7.971
302 H THR 533 H THR 533 -7.344 1.154 -5.808
303 HA THR 533 HA THR 533 -8.838 -0.489 -7.610
304 HB THR 533 HB THR 533 -7.738 -2.384 -6.385
305 HG1 THR 533 HG1 THR 533 -6.598 -1.987 -4.636
306 HG21 THR 533 HG21 THR 533 -5.380 -1.607 -6.979
307 HG22 THR 533 HG22 THR 533 -6.102 -0.050 -7.386
308 HG23 THR 533 HG23 THR 533 -6.577 -1.499 -8.271
309 H GLY 534 H GLY 534 -8.880 -0.114 -4.066
310 HA2 GLY 534 HA2 GLY 534 -11.066 0.018 -2.955
311 HA3 GLY 534 HA3 GLY 534 -11.630 -1.246 -4.041
312 H HIS 535 H HIS 535 -8.660 -2.273 -3.522
313 HA HIS 535 HA HIS 535 -9.459 -4.244 -1.594
314 HB2 HIS 535 HB2 HIS 535 -6.696 -3.715 -2.702
315 HB3 HIS 535 HB3 HIS 535 -7.276 -5.204 -1.957
316 HD1 HIS 535 HD1 HIS 535 -6.275 -4.725 -5.029
317 HD2 HIS 535 HD2 HIS 535 -10.191 -5.255 -3.698
318 HE1 HIS 535 HE1 HIS 535 -7.601 -5.560 -7.018
319 HE2 HIS 535 HE2 HIS 535 -9.990 -5.888 -6.223
320 H PHE 536 H PHE 536 -9.832 -2.039 -0.156
321 HA PHE 536 HA PHE 536 -7.706 -2.191 1.860
322 HB2 PHE 536 HB2 PHE 536 -7.360 0.165 1.994
323 HB3 PHE 536 HB3 PHE 536 -7.192 -0.264 0.294
324 HD1 PHE 536 HD1 PHE 536 -9.402 1.291 2.814
325 HD2 PHE 536 HD2 PHE 536 -8.805 0.464 -1.355
326 HE1 PHE 536 HE1 PHE 536 -11.210 2.889 2.242
327 HE2 PHE 536 HE2 PHE 536 -10.614 2.067 -1.930
328 HZ PHE 536 HZ PHE 536 -11.815 3.277 -0.132
329 H HIS 537 H HIS 537 -8.347 -1.312 3.920
330 HA HIS 537 HA HIS 537 -11.234 -0.832 4.301
331 HB2 HIS 537 HB2 HIS 537 -9.719 -2.717 6.104
332 HB3 HIS 537 HB3 HIS 537 -11.462 -2.485 5.971
333 HD1 HIS 537 HD1 HIS 537 -8.569 -4.207 4.339
334 HD2 HIS 537 HD2 HIS 537 -12.666 -3.765 3.707
335 HE1 HIS 537 HE1 HIS 537 -9.210 -5.912 2.579
336 HE2 HIS 537 HE2 HIS 537 -11.705 -5.656 2.184
337 H ILE 538 H ILE 538 -11.001 1.269 4.935
338 HA ILE 538 HA ILE 538 -8.968 2.041 6.871
339 HB ILE 538 HB ILE 538 -11.130 3.521 5.370
340 HG12 ILE 538 HG12 ILE 538 -8.157 4.023 5.565
341 HG13 ILE 538 HG13 ILE 538 -8.850 2.934 4.369
342 HG21 ILE 538 HG21 ILE 538 -10.142 5.596 6.509
343 HG22 ILE 538 HG22 ILE 538 -9.458 4.488 7.695
344 HG23 ILE 538 HG23 ILE 538 -11.205 4.598 7.500
345 HD11 ILE 538 HD11 ILE 538 -10.342 4.888 3.654
346 HD12 ILE 538 HD12 ILE 538 -8.629 5.053 3.269
347 HD13 ILE 538 HD13 ILE 538 -9.310 5.913 4.650
348 H THR 539 H THR 539 -9.263 2.308 9.000
349 HA THR 539 HA THR 539 -11.860 1.510 10.150
350 HB THR 539 HB THR 539 -10.650 1.029 12.160
351 HG1 THR 539 HG1 THR 539 -9.021 2.907 11.210
352 HG21 THR 539 HG21 THR 539 -9.081 -0.638 11.380
353 HG22 THR 539 HG22 THR 539 -8.880 0.206 9.845
354 HG23 THR 539 HG23 THR 539 -10.417 -0.568 10.230
355 H ASN 540 H ASN 540 -11.456 2.655 12.691
356 HA ASN 540 HA ASN 540 -12.816 5.002 12.640
357 HB2 ASN 540 HB2 ASN 540 -12.162 3.768 14.702
358 HB3 ASN 540 HB3 ASN 540 -10.537 4.433 14.546
359 HD21 ASN 540 HD21 ASN 540 -12.377 6.867 13.358
360 HD22 ASN 540 HD22 ASN 540 -12.688 7.735 14.783
361 H THR 541 H THR 541 -9.276 5.017 13.131
362 HA THR 541 HA THR 541 -9.011 7.224 11.218
363 HB THR 541 HB THR 541 -9.331 8.543 13.142
364 HG1 THR 541 HG1 THR 541 -6.761 8.100 12.309
365 HG21 THR 541 HG21 THR 541 -7.729 6.405 14.555
366 HG22 THR 541 HG22 THR 541 -9.392 6.900 14.868
367 HG23 THR 541 HG23 THR 541 -8.058 7.975 15.287
368 H THR 542 H THR 542 -7.986 5.378 10.145
369 HA THR 542 HA THR 542 -5.171 5.523 10.282
370 HB THR 542 HB THR 542 -5.427 2.725 10.782
371 HG1 THR 542 HG1 THR 542 -7.480 3.588 11.761
372 HG21 THR 542 HG21 THR 542 -3.504 4.189 11.381
373 HG22 THR 542 HG22 THR 542 -4.039 3.193 12.733
374 HG23 THR 542 HG23 THR 542 -4.470 4.899 12.673
375 H PHE 543 H PHE 543 -4.178 3.958 8.696
376 HA PHE 543 HA PHE 543 -6.137 3.155 6.608
377 HB2 PHE 543 HB2 PHE 543 -4.973 5.163 5.889
378 HB3 PHE 543 HB3 PHE 543 -3.412 4.421 6.247
379 HD1 PHE 543 HD1 PHE 543 -6.421 4.191 4.093
380 HD2 PHE 543 HD2 PHE 543 -2.389 2.894 4.718
381 HE1 PHE 543 HE1 PHE 543 -6.403 3.187 1.829
382 HE2 PHE 543 HE2 PHE 543 -2.355 1.894 2.445
383 HZ PHE 543 HZ PHE 543 -4.372 2.048 1.003
384 H ASP 544 H ASP 544 -6.188 0.998 6.971
385 HA ASP 544 HA ASP 544 -3.627 -0.477 7.122
386 HB2 ASP 544 HB2 ASP 544 -5.225 -0.859 8.957
387 HB3 ASP 544 HB3 ASP 544 -6.433 -1.384 7.787
388 H PHE 545 H PHE 545 -3.121 -2.058 5.675
389 HA PHE 545 HA PHE 545 -5.039 -2.945 3.682
390 HB2 PHE 545 HB2 PHE 545 -3.763 -2.224 1.754
391 HB3 PHE 545 HB3 PHE 545 -4.171 -0.814 2.728
392 HD1 PHE 545 HD1 PHE 545 -2.444 0.230 4.205
393 HD2 PHE 545 HD2 PHE 545 -1.488 -2.917 1.444
394 HE1 PHE 545 HE1 PHE 545 -0.039 0.805 4.384
395 HE2 PHE 545 HE2 PHE 545 0.918 -2.343 1.624
396 HZ PHE 545 HZ PHE 545 1.642 -0.481 3.092
397 H ASP 546 H ASP 546 -4.344 -4.879 2.601
398 HA ASP 546 HA ASP 546 -2.034 -6.180 3.917
399 HB2 ASP 546 HB2 ASP 546 -4.488 -7.259 2.526
400 HB3 ASP 546 HB3 ASP 546 -3.112 -8.273 2.955
401 H LEU 547 H LEU 547 -0.356 -6.966 2.758
402 HA LEU 547 HA LEU 547 0.112 -5.916 0.138
403 HB2 LEU 547 HB2 LEU 547 1.600 -7.842 1.913
404 HB3 LEU 547 HB3 LEU 547 2.171 -7.454 0.301
405 HG LEU 547 HG LEU 547 3.161 -6.081 2.230
406 HD11 LEU 547 HD11 LEU 547 3.402 -4.176 0.881
407 HD12 LEU 547 HD12 LEU 547 1.766 -4.288 0.242
408 HD13 LEU 547 HD13 LEU 547 3.004 -5.420 -0.299
409 HD21 LEU 547 HD21 LEU 547 1.846 -4.313 3.178
410 HD22 LEU 547 HD22 LEU 547 0.921 -5.798 3.367
411 HD23 LEU 547 HD23 LEU 547 0.495 -4.650 2.098
412 H CYS 548 H CYS 548 -1.231 -8.842 1.385
413 HA CYS 548 HA CYS 548 -0.772 -10.445 -0.966
414 HB2 CYS 548 HB2 CYS 548 -2.399 -10.774 1.548
415 HB3 CYS 548 HB3 CYS 548 -2.567 -11.911 0.208
416 HG CYS 548 HG CYS 548 -0.643 -12.939 1.496
417 H SER 549 H SER 549 -2.873 -7.936 -0.209
418 HA SER 549 HA SER 549 -5.074 -8.875 -1.893
419 HB2 SER 549 HB2 SER 549 -6.314 -7.115 -1.020
420 HB3 SER 549 HB3 SER 549 -5.219 -7.461 0.315
421 HG SER 549 HG SER 549 -3.852 -5.838 -1.060
422 H LEU 550 H LEU 550 -2.135 -7.736 -2.576
423 HA LEU 550 HA LEU 550 -2.759 -5.636 -4.462
424 HB2 LEU 550 HB2 LEU 550 -0.232 -7.270 -4.131
425 HB3 LEU 550 HB3 LEU 550 -0.388 -5.788 -5.071
426 HG LEU 550 HG LEU 550 -0.927 -5.972 -2.092
427 HD11 LEU 550 HD11 LEU 550 1.290 -4.662 -2.010
428 HD12 LEU 550 HD12 LEU 550 1.559 -5.235 -3.655
429 HD13 LEU 550 HD13 LEU 550 1.402 -6.392 -2.330
430 HD21 LEU 550 HD21 LEU 550 -2.067 -4.067 -2.901
431 HD22 LEU 550 HD22 LEU 550 -0.830 -3.722 -4.109
432 HD23 LEU 550 HD23 LEU 550 -0.510 -3.411 -2.405
433 H ASP 551 H ASP 551 -2.652 -5.770 -6.719
434 HA ASP 551 HA ASP 551 -3.304 -8.418 -7.817
435 HB2 ASP 551 HB2 ASP 551 -3.308 -5.808 -9.331
436 HB3 ASP 551 HB3 ASP 551 -4.214 -7.280 -9.675
437 H LYS 552 H LYS 552 -2.101 -9.436 -9.363
438 HA LYS 552 HA LYS 552 0.599 -9.377 -9.358
439 HB2 LYS 552 HB2 LYS 552 -1.250 -9.992 -11.662
440 HB3 LYS 552 HB3 LYS 552 0.486 -10.281 -11.739
441 HG2 LYS 552 HG2 LYS 552 -1.069 -11.366 -9.395
442 HG3 LYS 552 HG3 LYS 552 -1.155 -12.207 -10.940
443 HD2 LYS 552 HD2 LYS 552 1.321 -12.351 -10.990
444 HD3 LYS 552 HD3 LYS 552 1.389 -11.559 -9.417
445 HE2 LYS 552 HE2 LYS 552 -0.211 -14.083 -9.857
446 HE3 LYS 552 HE3 LYS 552 1.495 -14.126 -9.417
447 HZ1 LYS 552 HZ1 LYS 552 -0.745 -13.659 -7.766
448 HZ2 LYS 552 HZ2 LYS 552 0.278 -12.302 -7.723
449 HZ3 LYS 552 HZ3 LYS 552 0.883 -13.838 -7.325
450 H THR 553 H THR 553 -1.360 -7.616 -11.770
451 HA THR 553 HA THR 553 0.851 -6.270 -12.925
452 HB THR 553 HB THR 553 -1.967 -5.269 -12.920
453 HG1 THR 553 HG1 THR 553 -1.384 -7.638 -13.520
454 HG21 THR 553 HG21 THR 553 0.182 -5.197 -15.044
455 HG22 THR 553 HG22 THR 553 -0.139 -3.874 -13.922
456 HG23 THR 553 HG23 THR 553 -1.372 -4.366 -15.083
457 H THR 554 H THR 554 -1.022 -5.719 -10.080
458 HA THR 554 HA THR 554 -0.220 -2.929 -9.819
459 HB THR 554 HB THR 554 -1.730 -4.772 -7.952
460 HG1 THR 554 HG1 THR 554 -3.096 -2.683 -8.852
461 HG21 THR 554 HG21 THR 554 -2.341 -2.478 -6.920
462 HG22 THR 554 HG22 THR 554 -0.909 -1.876 -7.755
463 HG23 THR 554 HG23 THR 554 -0.756 -3.150 -6.546
464 H VAL 555 H VAL 555 0.890 -6.061 -8.830
465 HA VAL 555 HA VAL 555 2.411 -5.205 -6.557
466 HB VAL 555 HB VAL 555 2.531 -7.673 -8.305
467 HG11 VAL 555 HG11 VAL 555 3.928 -8.568 -6.341
468 HG12 VAL 555 HG12 VAL 555 4.175 -6.881 -5.893
469 HG13 VAL 555 HG13 VAL 555 4.744 -7.471 -7.454
470 HG21 VAL 555 HG21 VAL 555 0.560 -7.186 -6.717
471 HG22 VAL 555 HG22 VAL 555 1.719 -7.411 -5.405
472 HG23 VAL 555 HG23 VAL 555 1.379 -8.736 -6.518
473 H ARG 556 H ARG 556 3.102 -5.658 -10.001
474 HA ARG 556 HA ARG 556 5.896 -5.198 -9.845
475 HB2 ARG 556 HB2 ARG 556 3.844 -4.983 -12.042
476 HB3 ARG 556 HB3 ARG 556 5.505 -4.467 -12.325
477 HG2 ARG 556 HG2 ARG 556 5.100 -7.167 -11.070
478 HG3 ARG 556 HG3 ARG 556 4.710 -7.001 -12.779
479 HD2 ARG 556 HD2 ARG 556 7.045 -7.707 -12.493
480 HD3 ARG 556 HD3 ARG 556 6.964 -6.105 -13.217
481 HE ARG 556 HE ARG 556 7.949 -5.235 -11.296
482 HH11 ARG 556 HH11 ARG 556 6.840 -8.476 -10.793
483 HH12 ARG 556 HH12 ARG 556 7.620 -8.650 -9.257
484 HH21 ARG 556 HH21 ARG 556 8.976 -5.458 -9.283
485 HH22 ARG 556 HH22 ARG 556 8.831 -6.943 -8.403
486 H LYS 557 H LYS 557 3.111 -3.114 -9.844
487 HA LYS 557 HA LYS 557 4.660 -0.690 -10.305
488 HB2 LYS 557 HB2 LYS 557 1.757 -1.100 -9.540
489 HB3 LYS 557 HB3 LYS 557 2.491 0.450 -9.952
490 HG2 LYS 557 HG2 LYS 557 3.142 -0.517 -12.176
491 HG3 LYS 557 HG3 LYS 557 2.225 -1.967 -11.761
492 HD2 LYS 557 HD2 LYS 557 0.188 -0.582 -11.477
493 HD3 LYS 557 HD3 LYS 557 1.109 0.847 -11.950
494 HE2 LYS 557 HE2 LYS 557 1.612 -0.214 -14.133
495 HE3 LYS 557 HE3 LYS 557 0.644 -1.613 -13.662
496 HZ1 LYS 557 HZ1 LYS 557 -0.357 0.423 -15.004
497 HZ2 LYS 557 HZ2 LYS 557 -0.615 1.005 -13.428
498 HZ3 LYS 557 HZ3 LYS 557 -1.280 -0.483 -13.907
499 H LEU 558 H LEU 558 3.422 -2.580 -7.669
500 HA LEU 558 HA LEU 558 3.587 -0.573 -5.649
501 HB2 LEU 558 HB2 LEU 558 2.406 -2.982 -5.733
502 HB3 LEU 558 HB3 LEU 558 3.907 -3.478 -4.970
503 HG LEU 558 HG LEU 558 2.341 -2.957 -3.221
504 HD11 LEU 558 HD11 LEU 558 4.067 -0.490 -3.374
505 HD12 LEU 558 HD12 LEU 558 4.770 -2.086 -3.111
506 HD13 LEU 558 HD13 LEU 558 3.611 -1.429 -1.955
507 HD21 LEU 558 HD21 LEU 558 2.003 -0.089 -4.023
508 HD22 LEU 558 HD22 LEU 558 0.896 -1.167 -3.178
509 HD23 LEU 558 HD23 LEU 558 1.073 -1.289 -4.923
510 H GLN 559 H GLN 559 5.686 -3.286 -6.569
511 HA GLN 559 HA GLN 559 7.747 -2.712 -4.707
512 HB2 GLN 559 HB2 GLN 559 7.888 -4.226 -7.324
513 HB3 GLN 559 HB3 GLN 559 9.079 -4.292 -6.025
514 HG2 GLN 559 HG2 GLN 559 7.579 -5.378 -4.548
515 HG3 GLN 559 HG3 GLN 559 6.172 -4.959 -5.525
516 HE21 GLN 559 HE21 GLN 559 8.213 -7.515 -4.800
517 HE22 GLN 559 HE22 GLN 559 7.985 -8.441 -6.204
518 H SER 560 H SER 560 7.015 -1.512 -7.909
519 HA SER 560 HA SER 560 9.580 -0.497 -8.564
520 HB2 SER 560 HB2 SER 560 7.620 -0.790 -10.139
521 HB3 SER 560 HB3 SER 560 6.928 0.663 -9.426
522 HG SER 560 HG SER 560 9.303 1.397 -9.928
523 H TYR 561 H TYR 561 6.740 1.067 -7.070
524 HA TYR 561 HA TYR 561 7.650 3.646 -6.813
525 HB2 TYR 561 HB2 TYR 561 5.939 1.931 -5.025
526 HB3 TYR 561 HB3 TYR 561 6.352 3.569 -4.529
527 HD1 TYR 561 HD1 TYR 561 6.122 5.360 -6.566
528 HD2 TYR 561 HD2 TYR 561 3.912 1.694 -6.168
529 HE1 TYR 561 HE1 TYR 561 4.342 6.274 -8.016
530 HE2 TYR 561 HE2 TYR 561 2.126 2.615 -7.616
531 HH TYR 561 HH TYR 561 2.514 5.699 -9.274
532 H LEU 562 H LEU 562 8.113 1.096 -4.336
533 HA LEU 562 HA LEU 562 9.782 2.600 -2.661
534 HB2 LEU 562 HB2 LEU 562 9.795 -0.394 -3.131
535 HB3 LEU 562 HB3 LEU 562 10.511 0.427 -1.745
536 HG LEU 562 HG LEU 562 7.602 0.905 -2.394
537 HD11 LEU 562 HD11 LEU 562 7.679 -1.493 -2.386
538 HD12 LEU 562 HD12 LEU 562 7.087 -0.998 -0.800
539 HD13 LEU 562 HD13 LEU 562 8.762 -1.514 -0.993
540 HD21 LEU 562 HD21 LEU 562 9.192 0.764 0.191
541 HD22 LEU 562 HD22 LEU 562 7.484 1.184 0.061
542 HD23 LEU 562 HD23 LEU 562 8.707 2.245 -0.632
543 H GLU 563 H GLU 563 10.508 0.699 -5.535
544 HA GLU 563 HA GLU 563 13.360 0.885 -5.218
545 HB2 GLU 563 HB2 GLU 563 11.613 0.049 -7.538
546 HB3 GLU 563 HB3 GLU 563 13.375 0.005 -7.576
547 HG2 GLU 563 HG2 GLU 563 11.789 -1.362 -5.398
548 HG3 GLU 563 HG3 GLU 563 12.191 -2.172 -6.912
549 H THR 564 H THR 564 12.313 3.428 -4.975
550 HA THR 564 HA THR 564 12.072 5.024 -7.215
551 HB THR 564 HB THR 564 12.816 6.874 -5.832
552 HG1 THR 564 HG1 THR 564 14.027 4.781 -4.421
553 HG21 THR 564 HG21 THR 564 11.387 4.798 -4.150
554 HG22 THR 564 HG22 THR 564 10.612 5.847 -5.337
555 HG23 THR 564 HG23 THR 564 11.355 6.544 -3.897
556 H SER 565 H SER 565 13.903 6.812 -7.652
557 HA SER 565 HA SER 565 16.595 5.827 -7.764
558 HB2 SER 565 HB2 SER 565 16.783 5.558 -10.165
559 HB3 SER 565 HB3 SER 565 15.518 4.485 -9.572
560 HG SER 565 HG SER 565 14.907 7.098 -10.425
561 H GLY 566 H GLY 566 17.300 7.301 -10.139
562 HA2 GLY 566 HA2 GLY 566 16.372 10.016 -9.849
563 HA3 GLY 566 HA3 GLY 566 17.985 9.762 -9.189
564 H THR 567 H THR 567 16.145 10.286 -12.010
565 HA THR 567 HA THR 567 18.087 9.304 -13.903
566 HB THR 567 HB THR 567 16.662 10.379 -15.580
567 HG1 THR 567 HG1 THR 567 15.979 12.219 -14.683
568 HG21 THR 567 HG21 THR 567 15.963 8.197 -14.727
569 HG22 THR 567 HG22 THR 567 14.545 9.195 -15.041
570 HG23 THR 567 HG23 THR 567 15.116 8.970 -13.388
571 H SER 568 H SER 568 19.994 10.267 -14.163
572 HA SER 568 HA SER 568 20.209 13.016 -14.881
573 HB2 SER 568 HB2 SER 568 20.008 13.577 -12.593
574 HB3 SER 568 HB3 SER 568 20.992 12.208 -12.085
575 HG SER 568 HG SER 568 21.750 14.692 -12.756
576 H1 THR 876 H1 THR 876 -0.442 -17.860 8.385
577 H2 THR 876 H2 THR 876 1.146 -17.305 8.618
578 H3 THR 876 H3 THR 876 0.531 -17.493 7.045
579 HA THR 876 HA THR 876 -1.223 -15.809 8.389
580 HB THR 876 HB THR 876 0.327 -13.972 9.005
581 HG1 THR 876 HG1 THR 876 2.274 -15.972 8.505
582 HG21 THR 876 HG21 THR 876 1.116 -14.949 11.102
583 HG22 THR 876 HG22 THR 876 0.946 -16.572 10.434
584 HG23 THR 876 HG23 THR 876 -0.485 -15.581 10.719
585 H ASN 877 H ASN 877 -1.677 -16.363 6.060
586 HA ASN 877 HA ASN 877 -0.053 -15.199 4.005
587 HB2 ASN 877 HB2 ASN 877 -2.959 -15.984 3.776
588 HB3 ASN 877 HB3 ASN 877 -1.756 -15.902 2.492
589 HD21 ASN 877 HD21 ASN 877 -0.489 -17.767 2.119
590 HD22 ASN 877 HD22 ASN 877 -0.550 -19.157 3.092
591 H LYS 878 H LYS 878 -0.653 -13.306 6.023
592 HA LYS 878 HA LYS 878 -1.881 -11.222 4.380
593 HB2 LYS 878 HB2 LYS 878 -2.869 -11.888 7.168
594 HB3 LYS 878 HB3 LYS 878 -3.347 -10.478 6.222
595 HG2 LYS 878 HG2 LYS 878 -4.064 -12.144 4.401
596 HG3 LYS 878 HG3 LYS 878 -3.913 -13.388 5.641
597 HD2 LYS 878 HD2 LYS 878 -5.693 -10.936 5.765
598 HD3 LYS 878 HD3 LYS 878 -6.225 -12.606 5.560
599 HE2 LYS 878 HE2 LYS 878 -4.989 -11.323 7.995
600 HE3 LYS 878 HE3 LYS 878 -6.521 -12.187 7.871
601 HZ1 LYS 878 HZ1 LYS 878 -5.124 -13.738 8.822
602 HZ2 LYS 878 HZ2 LYS 878 -3.780 -13.269 7.894
603 HZ3 LYS 878 HZ3 LYS 878 -5.043 -14.153 7.179
604 H LEU 879 H LEU 879 -1.062 -9.221 4.794
605 HA LEU 879 HA LEU 879 0.840 -8.884 7.038
606 HB2 LEU 879 HB2 LEU 879 1.227 -8.062 4.157
607 HB3 LEU 879 HB3 LEU 879 2.298 -7.620 5.473
608 HG LEU 879 HG LEU 879 1.737 -10.549 5.127
609 HD11 LEU 879 HD11 LEU 879 2.103 -10.144 2.836
610 HD12 LEU 879 HD12 LEU 879 3.704 -10.572 3.434
611 HD13 LEU 879 HD13 LEU 879 3.290 -8.881 3.152
612 HD21 LEU 879 HD21 LEU 879 3.265 -9.463 6.875
613 HD22 LEU 879 HD22 LEU 879 4.363 -9.098 5.543
614 HD23 LEU 879 HD23 LEU 879 3.976 -10.775 5.932
615 HA PRO 880 HA PRO 880 -2.087 -5.360 6.674
616 HB2 PRO 880 HB2 PRO 880 -2.628 -4.994 9.322
617 HB3 PRO 880 HB3 PRO 880 -3.437 -6.239 8.348
618 HG2 PRO 880 HG2 PRO 880 -1.192 -6.522 10.289
619 HG3 PRO 880 HG3 PRO 880 -2.564 -7.601 9.988
620 HD2 PRO 880 HD2 PRO 880 0.001 -7.997 8.974
621 HD3 PRO 880 HD3 PRO 880 -1.471 -8.706 8.273
622 H VAL 881 H VAL 881 -1.347 -3.277 6.523
623 HA VAL 881 HA VAL 881 0.857 -2.402 8.306
624 HB VAL 881 HB VAL 881 0.518 -1.885 5.340
625 HG11 VAL 881 HG11 VAL 881 2.706 -0.616 5.676
626 HG12 VAL 881 HG12 VAL 881 2.373 -0.675 7.406
627 HG13 VAL 881 HG13 VAL 881 1.267 0.175 6.324
628 HG21 VAL 881 HG21 VAL 881 2.606 -3.064 5.113
629 HG22 VAL 881 HG22 VAL 881 1.551 -4.072 6.104
630 HG23 VAL 881 HG23 VAL 881 2.828 -3.120 6.862
631 H SER 882 H SER 882 0.043 -0.884 9.583
632 HA SER 882 HA SER 882 -2.206 0.782 8.681
633 HB2 SER 882 HB2 SER 882 -2.209 1.538 11.068
634 HB3 SER 882 HB3 SER 882 -2.446 -0.196 10.869
635 HG SER 882 HG SER 882 -0.808 0.643 12.465
636 H ILE 883 H ILE 883 -1.963 2.887 8.048
637 HA ILE 883 HA ILE 883 0.606 4.241 8.653
638 HB ILE 883 HB ILE 883 -1.073 4.481 6.146
639 HG12 ILE 883 HG12 ILE 883 1.722 3.354 6.512
640 HG13 ILE 883 HG13 ILE 883 0.273 2.357 6.384
641 HG21 ILE 883 HG21 ILE 883 -0.050 6.601 6.639
642 HG22 ILE 883 HG22 ILE 883 0.948 5.838 5.404
643 HG23 ILE 883 HG23 ILE 883 1.472 5.831 7.087
644 HD11 ILE 883 HD11 ILE 883 1.058 4.392 4.280
645 HD12 ILE 883 HD12 ILE 883 -0.168 3.137 4.149
646 HD13 ILE 883 HD13 ILE 883 1.536 2.699 4.204
647 HA PRO 884 HA PRO 884 -2.344 6.967 10.838
648 HB2 PRO 884 HB2 PRO 884 0.031 8.784 10.477
649 HB3 PRO 884 HB3 PRO 884 -0.997 8.549 11.908
650 HG2 PRO 884 HG2 PRO 884 1.399 7.416 11.763
651 HG3 PRO 884 HG3 PRO 884 0.023 6.548 12.473
652 HD2 PRO 884 HD2 PRO 884 1.355 6.116 9.832
653 HD3 PRO 884 HD3 PRO 884 0.513 4.948 10.874
654 H LEU 885 H LEU 885 -3.940 7.966 9.750
655 HA LEU 885 HA LEU 885 -3.839 8.744 7.070
656 HB2 LEU 885 HB2 LEU 885 -5.673 9.751 9.258
657 HB3 LEU 885 HB3 LEU 885 -5.951 9.958 7.530
658 HG LEU 885 HG LEU 885 -5.505 7.191 8.657
659 HD11 LEU 885 HD11 LEU 885 -8.169 8.638 8.534
660 HD12 LEU 885 HD12 LEU 885 -7.296 8.243 10.014
661 HD13 LEU 885 HD13 LEU 885 -7.921 6.952 8.989
662 HD21 LEU 885 HD21 LEU 885 -5.531 7.412 6.225
663 HD22 LEU 885 HD22 LEU 885 -7.042 8.317 6.289
664 HD23 LEU 885 HD23 LEU 885 -7.014 6.613 6.738
665 H ALA 886 H ALA 886 -2.543 10.261 9.803
666 HA ALA 886 HA ALA 886 -2.674 12.980 8.836
667 HB1 ALA 886 HB1 ALA 886 -2.516 12.779 11.188
668 HB2 ALA 886 HB2 ALA 886 -0.899 13.279 10.688
669 HB3 ALA 886 HB3 ALA 886 -1.220 11.588 11.082
670 H SER 887 H SER 887 -0.647 10.215 8.410
671 HA SER 887 HA SER 887 1.653 11.713 7.463
672 HB2 SER 887 HB2 SER 887 1.107 8.742 7.332
673 HB3 SER 887 HB3 SER 887 2.659 9.537 7.089
674 HG SER 887 HG SER 887 1.762 8.658 9.324
675 H VAL 888 H VAL 888 -1.242 10.444 6.128
676 HA VAL 888 HA VAL 888 -0.289 11.080 3.409
677 HB VAL 888 HB VAL 888 -1.704 9.085 2.643
678 HG11 VAL 888 HG11 VAL 888 0.657 8.908 2.420
679 HG12 VAL 888 HG12 VAL 888 0.183 7.456 3.300
680 HG13 VAL 888 HG13 VAL 888 0.897 8.817 4.164
681 HG21 VAL 888 HG21 VAL 888 -1.295 8.309 5.551
682 HG22 VAL 888 HG22 VAL 888 -2.015 7.300 4.297
683 HG23 VAL 888 HG23 VAL 888 -2.842 8.761 4.835
684 H VAL 889 H VAL 889 -2.516 10.607 2.011
685 HA VAL 889 HA VAL 889 -4.759 11.982 3.340
686 HB VAL 889 HB VAL 889 -3.782 12.845 0.618
687 HG11 VAL 889 HG11 VAL 889 -5.171 14.811 1.111
688 HG12 VAL 889 HG12 VAL 889 -5.552 14.157 2.703
689 HG13 VAL 889 HG13 VAL 889 -6.129 13.337 1.252
690 HG21 VAL 889 HG21 VAL 889 -1.950 13.387 2.048
691 HG22 VAL 889 HG22 VAL 889 -3.022 13.855 3.369
692 HG23 VAL 889 HG23 VAL 889 -2.900 14.870 1.930
693 H LEU 890 H LEU 890 -6.478 10.751 3.051
694 HA LEU 890 HA LEU 890 -6.619 8.876 0.821
695 HB2 LEU 890 HB2 LEU 890 -8.112 9.234 3.393
696 HB3 LEU 890 HB3 LEU 890 -8.799 8.239 2.111
697 HG LEU 890 HG LEU 890 -7.406 6.964 3.790
698 HD11 LEU 890 HD11 LEU 890 -5.972 6.746 1.157
699 HD12 LEU 890 HD12 LEU 890 -7.704 6.430 1.190
700 HD13 LEU 890 HD13 LEU 890 -6.616 5.484 2.189
701 HD21 LEU 890 HD21 LEU 890 -5.723 8.891 3.974
702 HD22 LEU 890 HD22 LEU 890 -5.038 8.295 2.462
703 HD23 LEU 890 HD23 LEU 890 -5.047 7.265 3.893
704 HA PRO 891 HA PRO 891 -9.319 11.922 -1.162
705 HB2 PRO 891 HB2 PRO 891 -9.531 10.799 -3.601
706 HB3 PRO 891 HB3 PRO 891 -8.017 11.551 -3.055
707 HG2 PRO 891 HG2 PRO 891 -8.772 8.663 -3.118
708 HG3 PRO 891 HG3 PRO 891 -7.250 9.435 -3.596
709 HD2 PRO 891 HD2 PRO 891 -7.629 8.200 -1.153
710 HD3 PRO 891 HD3 PRO 891 -6.456 9.511 -1.419
711 H SER 892 H SER 892 -11.155 11.488 0.179
712 HA SER 892 HA SER 892 -13.300 10.126 -1.192
713 HB2 SER 892 HB2 SER 892 -12.160 8.257 0.008
714 HB3 SER 892 HB3 SER 892 -12.454 9.098 1.527
715 HG SER 892 HG SER 892 -14.521 8.510 -0.315
716 H ARG 893 H ARG 893 -13.080 12.773 -0.619
717 HA ARG 893 HA ARG 893 -14.358 13.420 1.890
718 HB2 ARG 893 HB2 ARG 893 -12.789 14.998 0.884
719 HB3 ARG 893 HB3 ARG 893 -13.798 15.113 -0.558
720 HG2 ARG 893 HG2 ARG 893 -15.568 16.168 0.641
721 HG3 ARG 893 HG3 ARG 893 -14.851 15.761 2.201
722 HD2 ARG 893 HD2 ARG 893 -12.903 17.217 1.638
723 HD3 ARG 893 HD3 ARG 893 -13.722 17.688 0.152
724 HE ARG 893 HE ARG 893 -15.053 19.104 1.415
725 HH11 ARG 893 HH11 ARG 893 -13.567 16.703 3.416
726 HH12 ARG 893 HH12 ARG 893 -14.130 17.393 4.901
727 HH21 ARG 893 HH21 ARG 893 -15.794 20.016 3.358
728 HH22 ARG 893 HH22 ARG 893 -15.391 19.270 4.869
729 H ALA 894 H ALA 894 -15.447 14.725 -1.189
730 HA ALA 894 HA ALA 894 -18.218 14.258 -0.428
731 HB1 ALA 894 HB1 ALA 894 -16.911 15.703 -2.738
732 HB2 ALA 894 HB2 ALA 894 -17.767 16.408 -1.367
733 HB3 ALA 894 HB3 ALA 894 -18.658 15.506 -2.593
734 H GLU 895 H GLU 895 -17.667 11.832 -0.587
735 HA GLU 895 HA GLU 895 -17.261 10.550 -3.044
736 HB2 GLU 895 HB2 GLU 895 -18.257 8.562 -1.948
737 HB3 GLU 895 HB3 GLU 895 -17.067 9.362 -0.924
738 HG2 GLU 895 HG2 GLU 895 -18.870 8.972 0.542
739 HG3 GLU 895 HG3 GLU 895 -19.086 10.654 0.068
740 H ARG 896 H ARG 896 -18.673 9.616 -4.539
741 HA ARG 896 HA ARG 896 -21.064 11.114 -5.051
742 HB2 ARG 896 HB2 ARG 896 -19.631 10.232 -6.865
743 HB3 ARG 896 HB3 ARG 896 -20.050 8.588 -6.379
744 HG2 ARG 896 HG2 ARG 896 -22.359 8.916 -6.933
745 HG3 ARG 896 HG3 ARG 896 -22.131 10.655 -7.125
746 HD2 ARG 896 HD2 ARG 896 -22.239 9.386 -9.301
747 HD3 ARG 896 HD3 ARG 896 -20.770 10.332 -9.090
748 HE ARG 896 HE ARG 896 -19.563 8.348 -9.042
749 HH11 ARG 896 HH11 ARG 896 -22.939 7.767 -8.552
750 HH12 ARG 896 HH12 ARG 896 -22.796 6.044 -8.641
751 HH21 ARG 896 HH21 ARG 896 -19.368 6.088 -9.159
752 HH22 ARG 896 HH22 ARG 896 -20.776 5.092 -8.984
753 H ALA 897 H ALA 897 -20.567 7.605 -4.577
754 HA ALA 897 HA ALA 897 -22.751 7.394 -2.731
755 HB1 ALA 897 HB1 ALA 897 -24.221 6.021 -4.144
756 HB2 ALA 897 HB2 ALA 897 -23.152 6.283 -5.521
757 HB3 ALA 897 HB3 ALA 897 -24.033 7.640 -4.818
758 H ARG 898 H ARG 898 -22.751 5.436 -1.667
759 HA ARG 898 HA ARG 898 -20.374 3.844 -1.919
760 HB2 ARG 898 HB2 ARG 898 -21.667 4.390 0.235
761 HB3 ARG 898 HB3 ARG 898 -22.807 3.149 -0.274
762 HG2 ARG 898 HG2 ARG 898 -21.358 1.858 1.008
763 HG3 ARG 898 HG3 ARG 898 -20.598 1.689 -0.573
764 HD2 ARG 898 HD2 ARG 898 -19.217 3.779 0.095
765 HD3 ARG 898 HD3 ARG 898 -19.772 3.455 1.732
766 HE ARG 898 HE ARG 898 -18.634 1.135 0.456
767 HH11 ARG 898 HH11 ARG 898 -17.999 4.066 2.181
768 HH12 ARG 898 HH12 ARG 898 -16.488 3.520 2.828
769 HH21 ARG 898 HH21 ARG 898 -16.655 0.411 1.302
770 HH22 ARG 898 HH22 ARG 898 -15.728 1.451 2.331
771 H SER 899 H SER 899 -23.788 2.803 -1.903
772 HA SER 899 HA SER 899 -24.851 1.083 -2.995
773 HB2 SER 899 HB2 SER 899 -22.853 1.810 -5.148
774 HB3 SER 899 HB3 SER 899 -24.280 0.806 -5.384
775 HG SER 899 HG SER 899 -24.762 3.197 -4.116
776 H THR 900 H THR 900 -23.705 -0.228 -1.261
777 HA THR 900 HA THR 900 -22.582 -2.129 -0.624
778 HB THR 900 HB THR 900 -22.762 -3.972 -2.073
779 HG1 THR 900 HG1 THR 900 -22.706 -3.767 -4.282
780 HG21 THR 900 HG21 THR 900 -24.944 -2.868 -1.560
781 HG22 THR 900 HG22 THR 900 -24.962 -3.750 -3.087
782 HG23 THR 900 HG23 THR 900 -24.820 -1.993 -3.085
Start of MODEL 2
1 H1 ASP 500 H1 ASP 500 6.767 -21.719 -5.922
2 H2 ASP 500 H2 ASP 500 5.358 -22.664 -5.842
3 H3 ASP 500 H3 ASP 500 6.064 -22.063 -4.417
4 HA ASP 500 HA ASP 500 5.361 -20.053 -6.380
5 HB2 ASP 500 HB2 ASP 500 2.965 -20.133 -5.785
6 HB3 ASP 500 HB3 ASP 500 3.463 -21.609 -6.609
7 H LYS 501 H LYS 501 6.766 -20.905 -3.691
8 HA LYS 501 HA LYS 501 5.502 -19.222 -1.726
9 HB2 LYS 501 HB2 LYS 501 8.306 -20.358 -1.691
10 HB3 LYS 501 HB3 LYS 501 7.367 -19.794 -0.309
11 HG2 LYS 501 HG2 LYS 501 5.632 -21.565 -0.950
12 HG3 LYS 501 HG3 LYS 501 6.861 -22.227 -2.027
13 HD2 LYS 501 HD2 LYS 501 8.404 -22.497 -0.133
14 HD3 LYS 501 HD3 LYS 501 7.200 -21.806 0.956
15 HE2 LYS 501 HE2 LYS 501 7.001 -24.180 1.176
16 HE3 LYS 501 HE3 LYS 501 5.629 -23.664 0.197
17 HZ1 LYS 501 HZ1 LYS 501 6.409 -24.723 -1.596
18 HZ2 LYS 501 HZ2 LYS 501 7.348 -25.606 -0.491
19 HZ3 LYS 501 HZ3 LYS 501 8.019 -24.274 -1.305
20 H ALA 502 H ALA 502 7.415 -18.619 -4.407
21 HA ALA 502 HA ALA 502 9.132 -16.570 -3.532
22 HB1 ALA 502 HB1 ALA 502 7.785 -16.752 -6.234
23 HB2 ALA 502 HB2 ALA 502 9.200 -17.698 -5.776
24 HB3 ALA 502 HB3 ALA 502 9.302 -15.939 -5.851
25 H TYR 503 H TYR 503 5.883 -16.354 -4.988
26 HA TYR 503 HA TYR 503 5.497 -13.644 -5.016
27 HB2 TYR 503 HB2 TYR 503 3.857 -15.501 -5.679
28 HB3 TYR 503 HB3 TYR 503 3.359 -15.513 -3.987
29 HD1 TYR 503 HD1 TYR 503 4.033 -13.059 -6.747
30 HD2 TYR 503 HD2 TYR 503 1.594 -14.099 -3.367
31 HE1 TYR 503 HE1 TYR 503 2.604 -11.080 -7.169
32 HE2 TYR 503 HE2 TYR 503 0.163 -12.119 -3.792
33 HH TYR 503 HH TYR 503 0.689 -9.713 -5.074
34 H LEU 504 H LEU 504 4.508 -15.704 -2.256
35 HA LEU 504 HA LEU 504 3.818 -13.776 -0.450
36 HB2 LEU 504 HB2 LEU 504 5.216 -16.419 -0.068
37 HB3 LEU 504 HB3 LEU 504 4.808 -15.400 1.312
38 HG LEU 504 HG LEU 504 2.434 -15.377 0.560
39 HD11 LEU 504 HD11 LEU 504 1.872 -17.229 -1.151
40 HD12 LEU 504 HD12 LEU 504 3.577 -17.158 -1.596
41 HD13 LEU 504 HD13 LEU 504 2.557 -15.733 -1.780
42 HD21 LEU 504 HD21 LEU 504 1.925 -17.632 1.283
43 HD22 LEU 504 HD22 LEU 504 3.342 -17.083 2.179
44 HD23 LEU 504 HD23 LEU 504 3.532 -18.192 0.821
45 H ASP 505 H ASP 505 7.103 -15.027 -0.979
46 HA ASP 505 HA ASP 505 8.497 -13.546 0.888
47 HB2 ASP 505 HB2 ASP 505 9.374 -15.316 -0.753
48 HB3 ASP 505 HB3 ASP 505 9.552 -13.992 -1.901
49 H GLU 506 H GLU 506 7.525 -12.558 -2.388
50 HA GLU 506 HA GLU 506 8.798 -10.056 -2.420
51 HB2 GLU 506 HB2 GLU 506 6.177 -10.803 -3.741
52 HB3 GLU 506 HB3 GLU 506 7.228 -9.460 -4.188
53 HG2 GLU 506 HG2 GLU 506 9.067 -11.169 -4.567
54 HG3 GLU 506 HG3 GLU 506 7.836 -12.416 -4.391
55 H LEU 507 H LEU 507 5.955 -11.158 -0.769
56 HA LEU 507 HA LEU 507 4.919 -8.488 -0.259
57 HB2 LEU 507 HB2 LEU 507 4.093 -11.038 1.129
58 HB3 LEU 507 HB3 LEU 507 3.146 -9.575 0.869
59 HG LEU 507 HG LEU 507 4.032 -11.576 -1.225
60 HD11 LEU 507 HD11 LEU 507 2.059 -12.297 -0.049
61 HD12 LEU 507 HD12 LEU 507 1.523 -11.644 -1.598
62 HD13 LEU 507 HD13 LEU 507 1.354 -10.684 -0.129
63 HD21 LEU 507 HD21 LEU 507 4.259 -9.454 -2.288
64 HD22 LEU 507 HD22 LEU 507 2.825 -8.814 -1.488
65 HD23 LEU 507 HD23 LEU 507 2.659 -10.028 -2.755
66 H VAL 508 H VAL 508 6.526 -11.078 1.592
67 HA VAL 508 HA VAL 508 6.490 -9.881 4.105
68 HB VAL 508 HB VAL 508 8.657 -11.617 2.901
69 HG11 VAL 508 HG11 VAL 508 7.985 -10.824 5.748
70 HG12 VAL 508 HG12 VAL 508 9.502 -10.546 4.890
71 HG13 VAL 508 HG13 VAL 508 9.033 -12.185 5.344
72 HG21 VAL 508 HG21 VAL 508 7.390 -13.388 4.219
73 HG22 VAL 508 HG22 VAL 508 6.537 -12.757 2.810
74 HG23 VAL 508 HG23 VAL 508 6.101 -12.200 4.425
75 H GLU 509 H GLU 509 9.145 -9.749 1.716
76 HA GLU 509 HA GLU 509 10.796 -7.957 3.062
77 HB2 GLU 509 HB2 GLU 509 10.353 -8.087 0.066
78 HB3 GLU 509 HB3 GLU 509 11.776 -7.446 0.889
79 HG2 GLU 509 HG2 GLU 509 12.333 -9.623 1.774
80 HG3 GLU 509 HG3 GLU 509 10.813 -10.302 1.191
81 H LEU 510 H LEU 510 8.286 -7.202 0.620
82 HA LEU 510 HA LEU 510 8.505 -4.418 0.747
83 HB2 LEU 510 HB2 LEU 510 6.597 -6.373 -0.293
84 HB3 LEU 510 HB3 LEU 510 5.747 -4.978 0.358
85 HG LEU 510 HG LEU 510 7.302 -3.519 -1.012
86 HD11 LEU 510 HD11 LEU 510 7.912 -6.036 -2.564
87 HD12 LEU 510 HD12 LEU 510 8.975 -5.489 -1.270
88 HD13 LEU 510 HD13 LEU 510 8.696 -4.461 -2.672
89 HD21 LEU 510 HD21 LEU 510 5.700 -5.490 -2.666
90 HD22 LEU 510 HD22 LEU 510 6.022 -3.795 -3.032
91 HD23 LEU 510 HD23 LEU 510 4.957 -4.218 -1.694
92 H HIS 511 H HIS 511 6.308 -6.568 2.535
93 HA HIS 511 HA HIS 511 5.029 -4.727 4.132
94 HB2 HIS 511 HB2 HIS 511 4.412 -7.068 4.140
95 HB3 HIS 511 HB3 HIS 511 5.971 -7.518 4.827
96 HD1 HIS 511 HD1 HIS 511 2.894 -5.477 5.687
97 HD2 HIS 511 HD2 HIS 511 6.058 -7.398 7.603
98 HE1 HIS 511 HE1 HIS 511 2.441 -5.310 8.177
99 HE2 HIS 511 HE2 HIS 511 4.353 -6.487 9.357
100 H ARG 512 H ARG 512 7.976 -6.535 4.961
101 HA ARG 512 HA ARG 512 8.582 -5.329 7.375
102 HB2 ARG 512 HB2 ARG 512 9.737 -7.304 6.269
103 HB3 ARG 512 HB3 ARG 512 10.627 -6.134 5.300
104 HG2 ARG 512 HG2 ARG 512 12.110 -6.422 7.069
105 HG3 ARG 512 HG3 ARG 512 11.176 -5.050 7.661
106 HD2 ARG 512 HD2 ARG 512 9.708 -6.641 8.911
107 HD3 ARG 512 HD3 ARG 512 10.726 -7.968 8.364
108 HE ARG 512 HE ARG 512 12.440 -6.163 9.577
109 HH11 ARG 512 HH11 ARG 512 9.620 -7.984 10.415
110 HH12 ARG 512 HH12 ARG 512 10.052 -8.146 12.085
111 HH21 ARG 512 HH21 ARG 512 13.013 -6.370 11.765
112 HH22 ARG 512 HH22 ARG 512 11.973 -7.231 12.849
113 H ARG 513 H ARG 513 9.834 -4.409 4.160
114 HA ARG 513 HA ARG 513 11.229 -2.123 4.987
115 HB2 ARG 513 HB2 ARG 513 9.940 -2.786 2.333
116 HB3 ARG 513 HB3 ARG 513 11.021 -1.415 2.590
117 HG2 ARG 513 HG2 ARG 513 12.836 -2.886 3.232
118 HG3 ARG 513 HG3 ARG 513 11.768 -4.289 3.196
119 HD2 ARG 513 HD2 ARG 513 13.117 -4.169 1.138
120 HD3 ARG 513 HD3 ARG 513 11.404 -3.962 0.781
121 HE ARG 513 HE ARG 513 12.738 -1.451 1.200
122 HH11 ARG 513 HH11 ARG 513 12.134 -4.017 -1.043
123 HH12 ARG 513 HH12 ARG 513 12.351 -3.026 -2.447
124 HH21 ARG 513 HH21 ARG 513 13.024 -0.145 -0.638
125 HH22 ARG 513 HH22 ARG 513 12.855 -0.836 -2.218
126 H LEU 514 H LEU 514 7.857 -2.554 4.023
127 HA LEU 514 HA LEU 514 7.168 0.184 3.911
128 HB2 LEU 514 HB2 LEU 514 5.639 -2.380 4.214
129 HB3 LEU 514 HB3 LEU 514 4.790 -0.852 4.448
130 HG LEU 514 HG LEU 514 6.516 -1.202 1.998
131 HD11 LEU 514 HD11 LEU 514 4.559 -2.111 0.785
132 HD12 LEU 514 HD12 LEU 514 3.680 -2.229 2.309
133 HD13 LEU 514 HD13 LEU 514 5.116 -3.217 2.040
134 HD21 LEU 514 HD21 LEU 514 3.827 0.162 2.253
135 HD22 LEU 514 HD22 LEU 514 5.115 0.475 1.089
136 HD23 LEU 514 HD23 LEU 514 5.307 0.970 2.769
137 H MET 515 H MET 515 6.925 -2.208 6.516
138 HA MET 515 HA MET 515 5.640 -0.699 8.434
139 HB2 MET 515 HB2 MET 515 6.316 -3.129 8.597
140 HB3 MET 515 HB3 MET 515 7.932 -2.570 9.035
141 HG2 MET 515 HG2 MET 515 7.054 -1.394 10.975
142 HG3 MET 515 HG3 MET 515 5.399 -1.778 10.504
143 HE1 MET 515 HE1 MET 515 4.238 -3.555 12.061
144 HE2 MET 515 HE2 MET 515 5.236 -2.372 12.904
145 HE3 MET 515 HE3 MET 515 5.281 -4.062 13.395
146 H THR 516 H THR 516 9.069 -0.680 7.579
147 HA THR 516 HA THR 516 9.656 1.314 9.640
148 HB THR 516 HB THR 516 11.967 1.063 8.925
149 HG1 THR 516 HG1 THR 516 10.730 0.114 6.695
150 HG21 THR 516 HG21 THR 516 12.285 -1.253 9.508
151 HG22 THR 516 HG22 THR 516 10.657 -1.666 8.965
152 HG23 THR 516 HG23 THR 516 10.882 -0.672 10.406
153 H LEU 517 H LEU 517 8.924 1.125 6.259
154 HA LEU 517 HA LEU 517 10.165 3.395 5.257
155 HB2 LEU 517 HB2 LEU 517 8.883 1.773 3.888
156 HB3 LEU 517 HB3 LEU 517 7.388 2.410 4.572
157 HG LEU 517 HG LEU 517 7.942 4.651 3.648
158 HD11 LEU 517 HD11 LEU 517 10.417 3.176 2.773
159 HD12 LEU 517 HD12 LEU 517 10.264 4.804 3.433
160 HD13 LEU 517 HD13 LEU 517 9.799 4.485 1.766
161 HD21 LEU 517 HD21 LEU 517 7.343 4.121 1.390
162 HD22 LEU 517 HD22 LEU 517 6.627 2.860 2.396
163 HD23 LEU 517 HD23 LEU 517 8.105 2.532 1.493
164 H ARG 518 H ARG 518 9.824 5.553 5.377
165 HA ARG 518 HA ARG 518 7.418 6.545 6.777
166 HB2 ARG 518 HB2 ARG 518 9.574 6.339 8.249
167 HB3 ARG 518 HB3 ARG 518 10.126 7.743 7.340
168 HG2 ARG 518 HG2 ARG 518 9.055 8.800 9.116
169 HG3 ARG 518 HG3 ARG 518 7.722 8.701 7.969
170 HD2 ARG 518 HD2 ARG 518 6.832 7.910 10.027
171 HD3 ARG 518 HD3 ARG 518 7.140 6.459 9.079
172 HE ARG 518 HE ARG 518 9.425 7.043 10.636
173 HH11 ARG 518 HH11 ARG 518 6.135 6.006 10.910
174 HH12 ARG 518 HH12 ARG 518 6.402 5.083 12.351
175 HH21 ARG 518 HH21 ARG 518 9.783 5.836 12.525
176 HH22 ARG 518 HH22 ARG 518 8.467 4.988 13.266
177 H GLU 519 H GLU 519 9.129 6.530 4.035
178 HA GLU 519 HA GLU 519 9.329 9.319 3.419
179 HB2 GLU 519 HB2 GLU 519 10.573 7.340 2.316
180 HB3 GLU 519 HB3 GLU 519 9.099 7.111 1.377
181 HG2 GLU 519 HG2 GLU 519 10.416 8.537 0.027
182 HG3 GLU 519 HG3 GLU 519 9.286 9.631 0.825
183 H ARG 520 H ARG 520 7.238 10.095 4.030
184 HA ARG 520 HA ARG 520 4.755 9.270 3.308
185 HB2 ARG 520 HB2 ARG 520 5.583 12.160 3.036
186 HB3 ARG 520 HB3 ARG 520 4.010 11.520 3.514
187 HG2 ARG 520 HG2 ARG 520 5.212 10.444 5.501
188 HG3 ARG 520 HG3 ARG 520 6.593 11.460 5.083
189 HD2 ARG 520 HD2 ARG 520 4.970 13.439 5.152
190 HD3 ARG 520 HD3 ARG 520 3.825 12.340 5.916
191 HE ARG 520 HE ARG 520 6.087 13.563 7.168
192 HH11 ARG 520 HH11 ARG 520 4.171 10.686 7.017
193 HH12 ARG 520 HH12 ARG 520 4.512 10.208 8.646
194 HH21 ARG 520 HH21 ARG 520 6.535 12.946 9.306
195 HH22 ARG 520 HH22 ARG 520 5.850 11.489 9.943
196 H HIS 521 H HIS 521 7.177 10.639 1.184
197 HA HIS 521 HA HIS 521 5.621 11.406 -0.986
198 HB2 HIS 521 HB2 HIS 521 8.138 11.655 -0.712
199 HB3 HIS 521 HB3 HIS 521 8.270 9.982 -1.250
200 HD1 HIS 521 HD1 HIS 521 5.845 10.226 -3.331
201 HD2 HIS 521 HD2 HIS 521 9.169 12.733 -3.129
202 HE1 HIS 521 HE1 HIS 521 6.088 11.276 -5.622
203 HE2 HIS 521 HE2 HIS 521 8.111 12.808 -5.516
204 H ILE 522 H ILE 522 6.873 8.177 -0.170
205 HA ILE 522 HA ILE 522 5.601 6.964 -2.478
206 HB ILE 522 HB ILE 522 7.248 5.963 -0.163
207 HG12 ILE 522 HG12 ILE 522 8.707 5.183 -1.936
208 HG13 ILE 522 HG13 ILE 522 7.487 5.538 -3.155
209 HG21 ILE 522 HG21 ILE 522 5.638 4.236 -0.226
210 HG22 ILE 522 HG22 ILE 522 6.932 3.641 -1.262
211 HG23 ILE 522 HG23 ILE 522 5.473 4.331 -1.978
212 HD11 ILE 522 HD11 ILE 522 7.713 7.881 -2.861
213 HD12 ILE 522 HD12 ILE 522 9.365 7.259 -2.878
214 HD13 ILE 522 HD13 ILE 522 8.597 7.678 -1.347
215 H LEU 523 H LEU 523 5.119 6.837 1.056
216 HA LEU 523 HA LEU 523 2.962 5.152 1.235
217 HB2 LEU 523 HB2 LEU 523 3.056 7.750 2.769
218 HB3 LEU 523 HB3 LEU 523 2.399 6.199 3.290
219 HG LEU 523 HG LEU 523 5.317 6.879 2.835
220 HD11 LEU 523 HD11 LEU 523 5.525 6.411 5.219
221 HD12 LEU 523 HD12 LEU 523 3.825 5.954 5.307
222 HD13 LEU 523 HD13 LEU 523 4.272 7.629 4.978
223 HD21 LEU 523 HD21 LEU 523 3.907 4.243 3.304
224 HD22 LEU 523 HD22 LEU 523 5.599 4.476 3.742
225 HD23 LEU 523 HD23 LEU 523 5.094 4.640 2.061
226 H GLN 524 H GLN 524 3.042 8.387 -0.078
227 HA GLN 524 HA GLN 524 0.160 8.689 -0.078
228 HB2 GLN 524 HB2 GLN 524 2.413 10.264 -1.334
229 HB3 GLN 524 HB3 GLN 524 0.715 10.668 -1.590
230 HG2 GLN 524 HG2 GLN 524 0.361 11.112 0.718
231 HG3 GLN 524 HG3 GLN 524 1.873 10.333 1.181
232 HE21 GLN 524 HE21 GLN 524 3.915 11.447 0.189
233 HE22 GLN 524 HE22 GLN 524 3.889 13.142 0.122
234 H GLN 525 H GLN 525 2.662 7.918 -2.467
235 HA GLN 525 HA GLN 525 0.970 7.776 -4.726
236 HB2 GLN 525 HB2 GLN 525 3.542 6.278 -4.174
237 HB3 GLN 525 HB3 GLN 525 2.793 6.499 -5.754
238 HG2 GLN 525 HG2 GLN 525 3.468 8.894 -4.051
239 HG3 GLN 525 HG3 GLN 525 4.716 8.122 -5.024
240 HE21 GLN 525 HE21 GLN 525 3.236 10.820 -5.314
241 HE22 GLN 525 HE22 GLN 525 2.683 10.805 -6.919
242 H ILE 526 H ILE 526 2.269 5.202 -2.644
243 HA ILE 526 HA ILE 526 0.961 3.040 -3.833
244 HB ILE 526 HB ILE 526 1.920 3.523 -1.012
245 HG12 ILE 526 HG12 ILE 526 2.968 1.720 -3.214
246 HG13 ILE 526 HG13 ILE 526 3.534 3.370 -2.960
247 HG21 ILE 526 HG21 ILE 526 0.507 1.142 -2.196
248 HG22 ILE 526 HG22 ILE 526 0.339 1.850 -0.592
249 HG23 ILE 526 HG23 ILE 526 1.761 0.885 -0.985
250 HD11 ILE 526 HD11 ILE 526 4.001 2.637 -0.529
251 HD12 ILE 526 HD12 ILE 526 5.086 2.034 -1.782
252 HD13 ILE 526 HD13 ILE 526 3.822 0.989 -1.133
253 H VAL 527 H VAL 527 -0.020 4.730 -0.838
254 HA VAL 527 HA VAL 527 -2.393 3.539 -0.311
255 HB VAL 527 HB VAL 527 -1.720 6.484 -0.172
256 HG11 VAL 527 HG11 VAL 527 -4.110 6.425 -0.173
257 HG12 VAL 527 HG12 VAL 527 -3.636 6.510 1.524
258 HG13 VAL 527 HG13 VAL 527 -4.144 4.971 0.827
259 HG21 VAL 527 HG21 VAL 527 -1.063 6.056 2.032
260 HG22 VAL 527 HG22 VAL 527 -0.532 4.581 1.223
261 HG23 VAL 527 HG23 VAL 527 -2.028 4.586 2.151
262 H ASN 528 H ASN 528 -2.140 6.407 -2.444
263 HA ASN 528 HA ASN 528 -4.800 6.314 -3.352
264 HB2 ASN 528 HB2 ASN 528 -3.324 8.283 -3.578
265 HB3 ASN 528 HB3 ASN 528 -2.367 7.413 -4.775
266 HD21 ASN 528 HD21 ASN 528 -5.946 7.539 -4.368
267 HD22 ASN 528 HD22 ASN 528 -6.243 8.147 -5.923
268 H LEU 529 H LEU 529 -2.031 4.424 -4.228
269 HA LEU 529 HA LEU 529 -2.867 3.688 -6.844
270 HB2 LEU 529 HB2 LEU 529 -0.538 3.438 -5.656
271 HB3 LEU 529 HB3 LEU 529 -1.186 1.900 -5.103
272 HG LEU 529 HG LEU 529 0.053 1.533 -7.154
273 HD11 LEU 529 HD11 LEU 529 -2.852 1.468 -7.964
274 HD12 LEU 529 HD12 LEU 529 -2.202 0.380 -6.735
275 HD13 LEU 529 HD13 LEU 529 -1.569 0.333 -8.380
276 HD21 LEU 529 HD21 LEU 529 -1.792 3.210 -8.822
277 HD22 LEU 529 HD22 LEU 529 -0.095 2.806 -9.071
278 HD23 LEU 529 HD23 LEU 529 -0.537 4.050 -7.906
279 H ILE 530 H ILE 530 -2.882 1.791 -3.831
280 HA ILE 530 HA ILE 530 -4.566 -0.224 -4.922
281 HB ILE 530 HB ILE 530 -4.658 -1.137 -2.671
282 HG12 ILE 530 HG12 ILE 530 -3.172 0.344 -0.977
283 HG13 ILE 530 HG13 ILE 530 -3.813 1.658 -1.947
284 HG21 ILE 530 HG21 ILE 530 -1.914 0.039 -3.173
285 HG22 ILE 530 HG22 ILE 530 -2.588 -1.284 -4.128
286 HG23 ILE 530 HG23 ILE 530 -2.299 -1.500 -2.401
287 HD11 ILE 530 HD11 ILE 530 -5.558 1.559 -0.481
288 HD12 ILE 530 HD12 ILE 530 -5.176 -0.090 0.011
289 HD13 ILE 530 HD13 ILE 530 -6.100 0.196 -1.457
290 H GLU 531 H GLU 531 -5.204 2.452 -2.674
291 HA GLU 531 HA GLU 531 -7.827 2.123 -2.050
292 HB2 GLU 531 HB2 GLU 531 -6.344 4.132 -1.513
293 HB3 GLU 531 HB3 GLU 531 -6.826 4.784 -3.079
294 HG2 GLU 531 HG2 GLU 531 -8.815 3.917 -0.961
295 HG3 GLU 531 HG3 GLU 531 -8.223 5.569 -1.113
296 H GLU 532 H GLU 532 -6.567 3.336 -5.129
297 HA GLU 532 HA GLU 532 -9.047 3.826 -6.383
298 HB2 GLU 532 HB2 GLU 532 -6.283 3.208 -7.433
299 HB3 GLU 532 HB3 GLU 532 -7.649 3.463 -8.520
300 HG2 GLU 532 HG2 GLU 532 -7.988 5.690 -7.735
301 HG3 GLU 532 HG3 GLU 532 -6.925 5.442 -6.353
302 H THR 533 H THR 533 -6.980 0.959 -6.224
303 HA THR 533 HA THR 533 -8.589 -0.655 -7.942
304 HB THR 533 HB THR 533 -7.230 -2.512 -7.162
305 HG1 THR 533 HG1 THR 533 -5.660 -1.975 -5.480
306 HG21 THR 533 HG21 THR 533 -6.209 -0.938 -8.755
307 HG22 THR 533 HG22 THR 533 -4.995 -1.593 -7.657
308 HG23 THR 533 HG23 THR 533 -5.615 0.038 -7.414
309 H GLY 534 H GLY 534 -8.174 -0.583 -4.416
310 HA2 GLY 534 HA2 GLY 534 -10.312 -0.573 -3.116
311 HA3 GLY 534 HA3 GLY 534 -10.747 -1.986 -4.078
312 H HIS 535 H HIS 535 -10.890 -3.205 -2.186
313 HA HIS 535 HA HIS 535 -10.166 -4.750 -0.660
314 HB2 HIS 535 HB2 HIS 535 -7.451 -4.482 -1.940
315 HB3 HIS 535 HB3 HIS 535 -8.125 -5.874 -1.092
316 HD1 HIS 535 HD1 HIS 535 -9.010 -3.758 -4.150
317 HD2 HIS 535 HD2 HIS 535 -9.237 -7.703 -2.824
318 HE1 HIS 535 HE1 HIS 535 -9.971 -5.103 -6.067
319 HE2 HIS 535 HE2 HIS 535 -10.112 -7.512 -5.276
320 H PHE 536 H PHE 536 -10.414 -2.488 0.582
321 HA PHE 536 HA PHE 536 -8.124 -2.396 2.415
322 HB2 PHE 536 HB2 PHE 536 -7.951 0.030 2.340
323 HB3 PHE 536 HB3 PHE 536 -7.686 -0.620 0.722
324 HD1 PHE 536 HD1 PHE 536 -10.236 0.951 2.940
325 HD2 PHE 536 HD2 PHE 536 -9.129 -0.052 -1.088
326 HE1 PHE 536 HE1 PHE 536 -12.110 2.327 2.083
327 HE2 PHE 536 HE2 PHE 536 -11.006 1.327 -1.944
328 HZ PHE 536 HZ PHE 536 -12.495 2.516 -0.359
329 H HIS 537 H HIS 537 -8.646 -1.383 4.428
330 HA HIS 537 HA HIS 537 -11.526 -0.967 4.963
331 HB2 HIS 537 HB2 HIS 537 -9.779 -2.486 6.893
332 HB3 HIS 537 HB3 HIS 537 -11.541 -2.429 6.799
333 HD1 HIS 537 HD1 HIS 537 -12.071 -3.098 3.903
334 HD2 HIS 537 HD2 HIS 537 -9.166 -5.077 6.147
335 HE1 HIS 537 HE1 HIS 537 -11.676 -5.325 2.761
336 HE2 HIS 537 HE2 HIS 537 -9.908 -6.542 4.117
337 H ILE 538 H ILE 538 -11.230 1.251 5.153
338 HA ILE 538 HA ILE 538 -9.257 2.266 7.085
339 HB ILE 538 HB ILE 538 -11.146 3.661 5.171
340 HG12 ILE 538 HG12 ILE 538 -8.119 3.600 5.233
341 HG13 ILE 538 HG13 ILE 538 -9.077 2.475 4.275
342 HG21 ILE 538 HG21 ILE 538 -10.931 5.117 7.054
343 HG22 ILE 538 HG22 ILE 538 -9.766 5.700 5.864
344 HG23 ILE 538 HG23 ILE 538 -9.217 4.739 7.236
345 HD11 ILE 538 HD11 ILE 538 -10.153 4.419 3.137
346 HD12 ILE 538 HD12 ILE 538 -8.409 4.364 2.875
347 HD13 ILE 538 HD13 ILE 538 -9.090 5.499 4.039
348 H THR 539 H THR 539 -9.796 2.841 9.102
349 HA THR 539 HA THR 539 -12.567 3.509 9.783
350 HB THR 539 HB THR 539 -12.374 1.040 10.069
351 HG1 THR 539 HG1 THR 539 -13.132 2.872 11.848
352 HG21 THR 539 HG21 THR 539 -9.895 1.179 10.655
353 HG22 THR 539 HG22 THR 539 -10.863 0.097 11.657
354 HG23 THR 539 HG23 THR 539 -10.403 1.686 12.265
355 H ASN 540 H ASN 540 -12.692 4.153 12.159
356 HA ASN 540 HA ASN 540 -12.069 5.826 13.634
357 HB2 ASN 540 HB2 ASN 540 -9.657 3.995 13.673
358 HB3 ASN 540 HB3 ASN 540 -9.986 5.241 14.877
359 HD21 ASN 540 HD21 ASN 540 -11.233 4.583 16.638
360 HD22 ASN 540 HD22 ASN 540 -12.204 3.191 16.667
361 H THR 541 H THR 541 -8.718 5.395 13.028
362 HA THR 541 HA THR 541 -8.530 7.564 11.091
363 HB THR 541 HB THR 541 -7.006 8.889 12.545
364 HG1 THR 541 HG1 THR 541 -7.024 6.769 13.995
365 HG21 THR 541 HG21 THR 541 -9.679 8.506 13.899
366 HG22 THR 541 HG22 THR 541 -9.526 9.290 12.326
367 HG23 THR 541 HG23 THR 541 -8.742 9.992 13.742
368 H THR 542 H THR 542 -7.727 5.590 10.002
369 HA THR 542 HA THR 542 -4.909 5.591 9.864
370 HB THR 542 HB THR 542 -5.283 2.848 10.613
371 HG1 THR 542 HG1 THR 542 -6.935 3.172 11.908
372 HG21 THR 542 HG21 THR 542 -3.200 4.194 10.850
373 HG22 THR 542 HG22 THR 542 -3.639 3.367 12.343
374 HG23 THR 542 HG23 THR 542 -3.953 5.091 12.167
375 H PHE 543 H PHE 543 -4.113 3.930 8.317
376 HA PHE 543 HA PHE 543 -6.242 2.983 6.478
377 HB2 PHE 543 HB2 PHE 543 -5.332 4.794 5.298
378 HB3 PHE 543 HB3 PHE 543 -3.705 4.500 5.905
379 HD1 PHE 543 HD1 PHE 543 -6.377 2.874 3.831
380 HD2 PHE 543 HD2 PHE 543 -2.173 3.349 4.553
381 HE1 PHE 543 HE1 PHE 543 -5.877 1.495 1.834
382 HE2 PHE 543 HE2 PHE 543 -1.672 1.970 2.559
383 HZ PHE 543 HZ PHE 543 -3.523 1.044 1.202
384 H ASP 544 H ASP 544 -6.243 0.830 6.884
385 HA ASP 544 HA ASP 544 -3.657 -0.600 7.020
386 HB2 ASP 544 HB2 ASP 544 -6.440 -1.475 7.825
387 HB3 ASP 544 HB3 ASP 544 -4.977 -2.444 7.984
388 H PHE 545 H PHE 545 -3.175 -2.231 5.619
389 HA PHE 545 HA PHE 545 -5.137 -3.216 3.709
390 HB2 PHE 545 HB2 PHE 545 -3.844 -2.569 1.733
391 HB3 PHE 545 HB3 PHE 545 -4.339 -1.136 2.633
392 HD1 PHE 545 HD1 PHE 545 -2.659 -0.209 4.387
393 HD2 PHE 545 HD2 PHE 545 -1.567 -2.900 1.223
394 HE1 PHE 545 HE1 PHE 545 -0.290 0.483 4.616
395 HE2 PHE 545 HE2 PHE 545 0.803 -2.209 1.453
396 HZ PHE 545 HZ PHE 545 1.442 -0.518 3.151
397 H ASP 546 H ASP 546 -4.404 -5.165 2.649
398 HA ASP 546 HA ASP 546 -2.064 -6.394 3.983
399 HB2 ASP 546 HB2 ASP 546 -3.059 -8.524 2.984
400 HB3 ASP 546 HB3 ASP 546 -3.979 -7.759 4.277
401 H LEU 547 H LEU 547 -0.387 -7.272 2.792
402 HA LEU 547 HA LEU 547 0.052 -6.111 0.191
403 HB2 LEU 547 HB2 LEU 547 1.642 -7.957 1.958
404 HB3 LEU 547 HB3 LEU 547 2.191 -7.521 0.351
405 HG LEU 547 HG LEU 547 3.111 -6.106 2.264
406 HD11 LEU 547 HD11 LEU 547 2.794 -5.412 -0.265
407 HD12 LEU 547 HD12 LEU 547 3.213 -4.193 0.928
408 HD13 LEU 547 HD13 LEU 547 1.550 -4.343 0.380
409 HD21 LEU 547 HD21 LEU 547 0.361 -4.842 2.225
410 HD22 LEU 547 HD22 LEU 547 1.705 -4.482 3.306
411 HD23 LEU 547 HD23 LEU 547 0.862 -6.020 3.438
412 H CYS 548 H CYS 548 -1.460 -8.918 1.295
413 HA CYS 548 HA CYS 548 -0.789 -10.568 -1.019
414 HB2 CYS 548 HB2 CYS 548 -1.210 -11.408 1.395
415 HB3 CYS 548 HB3 CYS 548 -2.919 -11.177 1.025
416 HG CYS 548 HG CYS 548 -2.799 -13.006 -0.755
417 H SER 549 H SER 549 -2.929 -8.099 -0.285
418 HA SER 549 HA SER 549 -5.112 -9.038 -1.978
419 HB2 SER 549 HB2 SER 549 -6.061 -7.759 -0.315
420 HB3 SER 549 HB3 SER 549 -4.628 -6.750 -0.137
421 HG SER 549 HG SER 549 -5.300 -5.487 -1.727
422 H LEU 550 H LEU 550 -2.138 -7.896 -2.624
423 HA LEU 550 HA LEU 550 -2.798 -5.946 -4.679
424 HB2 LEU 550 HB2 LEU 550 -0.114 -7.272 -4.282
425 HB3 LEU 550 HB3 LEU 550 -0.464 -5.693 -4.983
426 HG LEU 550 HG LEU 550 -0.931 -6.440 -2.082
427 HD11 LEU 550 HD11 LEU 550 1.407 -6.321 -2.253
428 HD12 LEU 550 HD12 LEU 550 0.985 -4.656 -1.856
429 HD13 LEU 550 HD13 LEU 550 1.356 -5.095 -3.522
430 HD21 LEU 550 HD21 LEU 550 -1.086 -3.862 -1.951
431 HD22 LEU 550 HD22 LEU 550 -2.462 -4.718 -2.643
432 HD23 LEU 550 HD23 LEU 550 -1.304 -3.915 -3.700
433 H ASP 551 H ASP 551 -2.239 -6.248 -6.924
434 HA ASP 551 HA ASP 551 -2.563 -9.055 -7.820
435 HB2 ASP 551 HB2 ASP 551 -4.192 -7.180 -8.548
436 HB3 ASP 551 HB3 ASP 551 -2.868 -6.610 -9.561
437 H LYS 552 H LYS 552 -1.269 -9.796 -9.582
438 HA LYS 552 HA LYS 552 1.453 -9.279 -9.304
439 HB2 LYS 552 HB2 LYS 552 -0.136 -10.531 -11.541
440 HB3 LYS 552 HB3 LYS 552 1.622 -10.398 -11.612
441 HG2 LYS 552 HG2 LYS 552 1.915 -11.766 -9.692
442 HG3 LYS 552 HG3 LYS 552 0.218 -11.622 -9.232
443 HD2 LYS 552 HD2 LYS 552 0.783 -13.831 -10.277
444 HD3 LYS 552 HD3 LYS 552 -0.474 -12.946 -11.140
445 HE2 LYS 552 HE2 LYS 552 1.020 -12.286 -12.864
446 HE3 LYS 552 HE3 LYS 552 2.439 -12.717 -11.910
447 HZ1 LYS 552 HZ1 LYS 552 0.491 -14.818 -12.492
448 HZ2 LYS 552 HZ2 LYS 552 2.180 -14.917 -12.335
449 HZ3 LYS 552 HZ3 LYS 552 1.490 -14.301 -13.760
450 H THR 553 H THR 553 -0.930 -7.779 -11.396
451 HA THR 553 HA THR 553 1.022 -6.301 -12.921
452 HB THR 553 HB THR 553 -1.901 -5.695 -12.720
453 HG1 THR 553 HG1 THR 553 -0.682 -7.929 -13.605
454 HG21 THR 553 HG21 THR 553 -0.240 -4.178 -13.942
455 HG22 THR 553 HG22 THR 553 -1.631 -4.732 -14.874
456 HG23 THR 553 HG23 THR 553 -0.057 -5.499 -15.094
457 H THR 554 H THR 554 -0.831 -5.854 -10.017
458 HA THR 554 HA THR 554 -0.285 -2.992 -9.873
459 HB THR 554 HB THR 554 -1.454 -4.692 -7.671
460 HG1 THR 554 HG1 THR 554 -2.498 -3.979 -10.143
461 HG21 THR 554 HG21 THR 554 -2.240 -1.903 -8.476
462 HG22 THR 554 HG22 THR 554 -0.798 -2.162 -7.493
463 HG23 THR 554 HG23 THR 554 -2.377 -2.679 -6.901
464 H VAL 555 H VAL 555 1.055 -5.985 -8.725
465 HA VAL 555 HA VAL 555 2.518 -4.915 -6.518
466 HB VAL 555 HB VAL 555 2.720 -7.452 -8.143
467 HG11 VAL 555 HG11 VAL 555 4.998 -7.062 -7.531
468 HG12 VAL 555 HG12 VAL 555 4.364 -8.185 -6.328
469 HG13 VAL 555 HG13 VAL 555 4.540 -6.476 -5.931
470 HG21 VAL 555 HG21 VAL 555 1.823 -8.485 -6.202
471 HG22 VAL 555 HG22 VAL 555 0.901 -6.992 -6.375
472 HG23 VAL 555 HG23 VAL 555 2.199 -7.093 -5.188
473 H ARG 556 H ARG 556 3.081 -5.189 -9.958
474 HA ARG 556 HA ARG 556 5.881 -4.633 -9.863
475 HB2 ARG 556 HB2 ARG 556 3.794 -4.574 -12.040
476 HB3 ARG 556 HB3 ARG 556 5.444 -4.033 -12.348
477 HG2 ARG 556 HG2 ARG 556 5.022 -6.703 -11.017
478 HG3 ARG 556 HG3 ARG 556 4.759 -6.570 -12.754
479 HD2 ARG 556 HD2 ARG 556 6.997 -5.928 -13.166
480 HD3 ARG 556 HD3 ARG 556 7.288 -5.528 -11.478
481 HE ARG 556 HE ARG 556 7.571 -8.105 -12.674
482 HH11 ARG 556 HH11 ARG 556 6.583 -6.437 -9.807
483 HH12 ARG 556 HH12 ARG 556 6.942 -7.759 -8.748
484 HH21 ARG 556 HH21 ARG 556 8.044 -9.842 -11.292
485 HH22 ARG 556 HH22 ARG 556 7.769 -9.688 -9.589
486 H LYS 557 H LYS 557 2.983 -2.674 -9.946
487 HA LYS 557 HA LYS 557 4.431 -0.217 -10.528
488 HB2 LYS 557 HB2 LYS 557 1.563 -0.608 -9.632
489 HB3 LYS 557 HB3 LYS 557 2.262 0.865 -10.308
490 HG2 LYS 557 HG2 LYS 557 2.874 -0.555 -12.358
491 HG3 LYS 557 HG3 LYS 557 1.788 -1.777 -11.697
492 HD2 LYS 557 HD2 LYS 557 0.027 0.090 -11.561
493 HD3 LYS 557 HD3 LYS 557 1.109 1.030 -12.591
494 HE2 LYS 557 HE2 LYS 557 -0.382 -0.059 -14.092
495 HE3 LYS 557 HE3 LYS 557 1.110 -0.994 -14.168
496 HZ1 LYS 557 HZ1 LYS 557 -0.953 -1.732 -12.213
497 HZ2 LYS 557 HZ2 LYS 557 0.212 -2.709 -12.973
498 HZ3 LYS 557 HZ3 LYS 557 -1.156 -2.184 -13.835
499 H LEU 558 H LEU 558 3.333 -2.020 -7.777
500 HA LEU 558 HA LEU 558 3.548 0.157 -5.901
501 HB2 LEU 558 HB2 LEU 558 3.151 -2.815 -5.621
502 HB3 LEU 558 HB3 LEU 558 3.323 -1.758 -4.224
503 HG LEU 558 HG LEU 558 1.306 -1.110 -6.385
504 HD11 LEU 558 HD11 LEU 558 0.781 -2.877 -3.980
505 HD12 LEU 558 HD12 LEU 558 0.911 -3.461 -5.639
506 HD13 LEU 558 HD13 LEU 558 -0.395 -2.365 -5.189
507 HD21 LEU 558 HD21 LEU 558 1.607 -0.476 -3.434
508 HD22 LEU 558 HD22 LEU 558 0.119 -0.166 -4.323
509 HD23 LEU 558 HD23 LEU 558 1.603 0.655 -4.788
510 H GLN 559 H GLN 559 5.445 -2.763 -6.614
511 HA GLN 559 HA GLN 559 7.467 -2.314 -4.709
512 HB2 GLN 559 HB2 GLN 559 7.554 -3.776 -7.356
513 HB3 GLN 559 HB3 GLN 559 8.822 -3.851 -6.134
514 HG2 GLN 559 HG2 GLN 559 7.395 -4.914 -4.560
515 HG3 GLN 559 HG3 GLN 559 5.946 -4.517 -5.481
516 HE21 GLN 559 HE21 GLN 559 6.925 -7.230 -4.657
517 HE22 GLN 559 HE22 GLN 559 7.112 -8.101 -6.103
518 H SER 560 H SER 560 6.930 -1.007 -7.903
519 HA SER 560 HA SER 560 9.541 -0.032 -8.406
520 HB2 SER 560 HB2 SER 560 7.918 -0.202 -10.197
521 HB3 SER 560 HB3 SER 560 6.849 0.938 -9.384
522 HG SER 560 HG SER 560 9.415 1.847 -9.719
523 H TYR 561 H TYR 561 6.660 1.624 -7.068
524 HA TYR 561 HA TYR 561 7.664 4.151 -6.728
525 HB2 TYR 561 HB2 TYR 561 5.775 2.506 -5.061
526 HB3 TYR 561 HB3 TYR 561 6.244 4.110 -4.507
527 HD1 TYR 561 HD1 TYR 561 6.241 5.934 -6.566
528 HD2 TYR 561 HD2 TYR 561 3.781 2.426 -6.267
529 HE1 TYR 561 HE1 TYR 561 4.592 6.955 -8.096
530 HE2 TYR 561 HE2 TYR 561 2.131 3.450 -7.788
531 HH TYR 561 HH TYR 561 1.735 5.152 -9.197
532 H LEU 562 H LEU 562 8.758 1.290 -5.199
533 HA LEU 562 HA LEU 562 9.991 2.625 -2.936
534 HB2 LEU 562 HB2 LEU 562 10.639 -0.165 -3.871
535 HB3 LEU 562 HB3 LEU 562 10.642 0.484 -2.230
536 HG LEU 562 HG LEU 562 8.205 0.000 -3.968
537 HD11 LEU 562 HD11 LEU 562 9.373 -1.966 -2.812
538 HD12 LEU 562 HD12 LEU 562 7.663 -1.737 -2.446
539 HD13 LEU 562 HD13 LEU 562 8.889 -1.218 -1.289
540 HD21 LEU 562 HD21 LEU 562 7.751 1.966 -2.690
541 HD22 LEU 562 HD22 LEU 562 8.560 1.315 -1.264
542 HD23 LEU 562 HD23 LEU 562 7.015 0.642 -1.788
543 H GLU 563 H GLU 563 11.257 0.789 -5.729
544 HA GLU 563 HA GLU 563 13.948 1.521 -5.364
545 HB2 GLU 563 HB2 GLU 563 13.200 -0.362 -6.792
546 HB3 GLU 563 HB3 GLU 563 12.546 0.799 -7.949
547 HG2 GLU 563 HG2 GLU 563 14.714 1.670 -8.445
548 HG3 GLU 563 HG3 GLU 563 15.441 0.837 -7.070
549 H THR 564 H THR 564 11.294 3.340 -6.393
550 HA THR 564 HA THR 564 11.056 5.372 -7.468
551 HB THR 564 HB THR 564 13.706 6.057 -6.200
552 HG1 THR 564 HG1 THR 564 12.831 5.273 -4.457
553 HG21 THR 564 HG21 THR 564 11.144 7.652 -6.268
554 HG22 THR 564 HG22 THR 564 12.288 7.690 -7.610
555 HG23 THR 564 HG23 THR 564 12.789 8.231 -6.009
556 H SER 565 H SER 565 12.094 3.513 -9.215
557 HA SER 565 HA SER 565 13.277 3.278 -11.175
558 HB2 SER 565 HB2 SER 565 13.234 5.145 -12.600
559 HB3 SER 565 HB3 SER 565 11.896 5.442 -11.495
560 HG SER 565 HG SER 565 13.424 7.227 -11.856
561 H GLY 566 H GLY 566 15.345 4.043 -12.364
562 HA2 GLY 566 HA2 GLY 566 17.438 5.353 -11.041
563 HA3 GLY 566 HA3 GLY 566 17.551 3.641 -10.645
564 H THR 567 H THR 567 17.253 5.856 -13.415
565 HA THR 567 HA THR 567 17.952 5.648 -15.606
566 HB THR 567 HB THR 567 20.331 4.908 -15.807
567 HG1 THR 567 HG1 THR 567 21.161 3.761 -14.273
568 HG21 THR 567 HG21 THR 567 19.817 7.220 -15.206
569 HG22 THR 567 HG22 THR 567 21.237 6.677 -14.311
570 HG23 THR 567 HG23 THR 567 19.671 6.768 -13.509
571 H SER 568 H SER 568 16.299 3.465 -14.599
572 HA SER 568 HA SER 568 16.802 1.572 -16.719
573 HB2 SER 568 HB2 SER 568 16.803 0.479 -13.908
574 HB3 SER 568 HB3 SER 568 17.154 -0.377 -15.406
575 HG SER 568 HG SER 568 18.820 0.953 -13.812
576 H1 THR 876 H1 THR 876 -0.942 -16.009 10.672
577 H2 THR 876 H2 THR 876 -2.167 -16.927 9.934
578 H3 THR 876 H3 THR 876 -2.494 -16.059 11.357
579 HA THR 876 HA THR 876 -3.418 -14.916 9.449
580 HB THR 876 HB THR 876 -0.990 -13.573 10.676
581 HG1 THR 876 HG1 THR 876 -3.155 -14.450 11.774
582 HG21 THR 876 HG21 THR 876 -2.395 -11.490 10.195
583 HG22 THR 876 HG22 THR 876 -3.354 -12.511 9.123
584 HG23 THR 876 HG23 THR 876 -1.639 -12.258 8.798
585 H ASN 877 H ASN 877 -3.097 -15.845 7.428
586 HA ASN 877 HA ASN 877 -0.523 -15.773 6.125
587 HB2 ASN 877 HB2 ASN 877 -3.173 -16.295 4.790
588 HB3 ASN 877 HB3 ASN 877 -1.578 -16.879 4.320
589 HD21 ASN 877 HD21 ASN 877 -1.191 -19.008 4.923
590 HD22 ASN 877 HD22 ASN 877 -1.916 -19.793 6.243
591 H LYS 878 H LYS 878 -1.381 -13.210 6.974
592 HA LYS 878 HA LYS 878 -1.445 -11.817 4.378
593 HB2 LYS 878 HB2 LYS 878 -3.129 -10.963 6.746
594 HB3 LYS 878 HB3 LYS 878 -3.110 -10.257 5.130
595 HG2 LYS 878 HG2 LYS 878 -3.805 -12.592 4.290
596 HG3 LYS 878 HG3 LYS 878 -4.177 -12.954 5.976
597 HD2 LYS 878 HD2 LYS 878 -5.365 -10.720 4.306
598 HD3 LYS 878 HD3 LYS 878 -6.201 -12.164 4.878
599 HE2 LYS 878 HE2 LYS 878 -5.193 -9.819 6.486
600 HE3 LYS 878 HE3 LYS 878 -6.818 -10.504 6.441
601 HZ1 LYS 878 HZ1 LYS 878 -5.473 -12.615 7.261
602 HZ2 LYS 878 HZ2 LYS 878 -6.095 -11.458 8.340
603 HZ3 LYS 878 HZ3 LYS 878 -4.457 -11.411 7.890
604 H LEU 879 H LEU 879 -1.137 -9.352 4.946
605 HA LEU 879 HA LEU 879 0.864 -8.998 7.087
606 HB2 LEU 879 HB2 LEU 879 1.153 -8.242 4.176
607 HB3 LEU 879 HB3 LEU 879 2.220 -7.662 5.445
608 HG LEU 879 HG LEU 879 1.822 -10.634 5.200
609 HD11 LEU 879 HD11 LEU 879 3.848 -10.571 3.580
610 HD12 LEU 879 HD12 LEU 879 3.341 -8.915 3.245
611 HD13 LEU 879 HD13 LEU 879 2.244 -10.255 2.919
612 HD21 LEU 879 HD21 LEU 879 4.003 -10.727 6.130
613 HD22 LEU 879 HD22 LEU 879 3.223 -9.384 6.968
614 HD23 LEU 879 HD23 LEU 879 4.363 -9.064 5.661
615 HA PRO 880 HA PRO 880 -2.128 -5.514 6.795
616 HB2 PRO 880 HB2 PRO 880 -2.610 -5.163 9.457
617 HB3 PRO 880 HB3 PRO 880 -3.428 -6.414 8.499
618 HG2 PRO 880 HG2 PRO 880 -1.138 -6.678 10.390
619 HG3 PRO 880 HG3 PRO 880 -2.501 -7.775 10.110
620 HD2 PRO 880 HD2 PRO 880 0.050 -8.126 9.043
621 HD3 PRO 880 HD3 PRO 880 -1.424 -8.857 8.371
622 H VAL 881 H VAL 881 -1.418 -3.438 6.620
623 HA VAL 881 HA VAL 881 0.754 -2.487 8.399
624 HB VAL 881 HB VAL 881 0.531 -2.102 5.399
625 HG11 VAL 881 HG11 VAL 881 2.705 -0.816 5.769
626 HG12 VAL 881 HG12 VAL 881 2.297 -0.796 7.484
627 HG13 VAL 881 HG13 VAL 881 1.241 -0.001 6.317
628 HG21 VAL 881 HG21 VAL 881 2.776 -3.271 7.068
629 HG22 VAL 881 HG22 VAL 881 2.634 -3.280 5.310
630 HG23 VAL 881 HG23 VAL 881 1.535 -4.252 6.289
631 H SER 882 H SER 882 -0.191 -0.967 9.605
632 HA SER 882 HA SER 882 -2.323 0.708 8.478
633 HB2 SER 882 HB2 SER 882 -1.288 0.735 11.310
634 HB3 SER 882 HB3 SER 882 -2.847 1.295 10.712
635 HG SER 882 HG SER 882 -2.849 -1.109 9.944
636 H ILE 883 H ILE 883 -2.025 2.811 7.904
637 HA ILE 883 HA ILE 883 0.522 4.121 8.669
638 HB ILE 883 HB ILE 883 -1.030 4.632 6.135
639 HG12 ILE 883 HG12 ILE 883 1.325 2.778 6.614
640 HG13 ILE 883 HG13 ILE 883 -0.293 2.300 6.098
641 HG21 ILE 883 HG21 ILE 883 0.596 6.345 7.080
642 HG22 ILE 883 HG22 ILE 883 0.947 5.790 5.444
643 HG23 ILE 883 HG23 ILE 883 1.872 5.157 6.806
644 HD11 ILE 883 HD11 ILE 883 0.058 3.876 4.092
645 HD12 ILE 883 HD12 ILE 883 0.988 2.376 4.094
646 HD13 ILE 883 HD13 ILE 883 1.760 3.892 4.555
647 HA PRO 884 HA PRO 884 -2.475 6.851 10.788
648 HB2 PRO 884 HB2 PRO 884 -0.059 8.631 10.544
649 HB3 PRO 884 HB3 PRO 884 -1.148 8.399 11.930
650 HG2 PRO 884 HG2 PRO 884 1.224 7.218 11.872
651 HG3 PRO 884 HG3 PRO 884 -0.197 6.366 12.504
652 HD2 PRO 884 HD2 PRO 884 1.242 5.954 9.917
653 HD3 PRO 884 HD3 PRO 884 0.333 4.783 10.900
654 H LEU 885 H LEU 885 -3.962 8.155 9.864
655 HA LEU 885 HA LEU 885 -3.829 8.892 7.138
656 HB2 LEU 885 HB2 LEU 885 -5.643 10.097 9.234
657 HB3 LEU 885 HB3 LEU 885 -5.930 10.005 7.498
658 HG LEU 885 HG LEU 885 -5.812 7.696 9.453
659 HD11 LEU 885 HD11 LEU 885 -7.913 9.027 9.382
660 HD12 LEU 885 HD12 LEU 885 -8.147 7.382 8.790
661 HD13 LEU 885 HD13 LEU 885 -8.023 8.720 7.650
662 HD21 LEU 885 HD21 LEU 885 -5.832 7.778 6.431
663 HD22 LEU 885 HD22 LEU 885 -6.519 6.406 7.301
664 HD23 LEU 885 HD23 LEU 885 -4.814 6.808 7.497
665 H ALA 886 H ALA 886 -2.463 10.322 9.887
666 HA ALA 886 HA ALA 886 -2.523 13.057 8.964
667 HB1 ALA 886 HB1 ALA 886 -1.046 11.597 11.154
668 HB2 ALA 886 HB2 ALA 886 -2.322 12.803 11.313
669 HB3 ALA 886 HB3 ALA 886 -0.713 13.288 10.779
670 H SER 887 H SER 887 -0.505 10.248 8.562
671 HA SER 887 HA SER 887 1.759 11.734 7.510
672 HB2 SER 887 HB2 SER 887 1.161 8.789 7.779
673 HB3 SER 887 HB3 SER 887 2.626 9.406 7.023
674 HG SER 887 HG SER 887 3.220 9.262 9.084
675 H VAL 888 H VAL 888 -1.181 10.574 6.266
676 HA VAL 888 HA VAL 888 -0.242 11.043 3.518
677 HB VAL 888 HB VAL 888 -1.697 9.034 2.833
678 HG11 VAL 888 HG11 VAL 888 0.200 7.416 3.446
679 HG12 VAL 888 HG12 VAL 888 0.945 8.774 4.279
680 HG13 VAL 888 HG13 VAL 888 0.658 8.858 2.543
681 HG21 VAL 888 HG21 VAL 888 -1.207 8.345 5.751
682 HG22 VAL 888 HG22 VAL 888 -1.936 7.283 4.546
683 HG23 VAL 888 HG23 VAL 888 -2.774 8.750 5.050
684 H VAL 889 H VAL 889 -2.466 10.577 2.141
685 HA VAL 889 HA VAL 889 -4.709 11.969 3.454
686 HB VAL 889 HB VAL 889 -3.723 12.802 0.724
687 HG11 VAL 889 HG11 VAL 889 -6.086 13.269 1.363
688 HG12 VAL 889 HG12 VAL 889 -5.144 14.746 1.154
689 HG13 VAL 889 HG13 VAL 889 -5.505 14.152 2.775
690 HG21 VAL 889 HG21 VAL 889 -1.909 13.379 2.169
691 HG22 VAL 889 HG22 VAL 889 -3.004 13.870 3.463
692 HG23 VAL 889 HG23 VAL 889 -2.866 14.851 2.003
693 H LEU 890 H LEU 890 -6.509 10.928 3.094
694 HA LEU 890 HA LEU 890 -6.651 8.783 1.173
695 HB2 LEU 890 HB2 LEU 890 -8.716 9.967 3.034
696 HB3 LEU 890 HB3 LEU 890 -8.936 8.488 2.100
697 HG LEU 890 HG LEU 890 -6.663 8.897 4.061
698 HD11 LEU 890 HD11 LEU 890 -8.092 7.329 5.511
699 HD12 LEU 890 HD12 LEU 890 -9.438 7.772 4.459
700 HD13 LEU 890 HD13 LEU 890 -8.613 9.011 5.405
701 HD21 LEU 890 HD21 LEU 890 -6.060 7.109 2.660
702 HD22 LEU 890 HD22 LEU 890 -7.725 6.566 2.459
703 HD23 LEU 890 HD23 LEU 890 -6.879 6.277 3.977
704 HA PRO 891 HA PRO 891 -8.512 11.258 -2.035
705 HB2 PRO 891 HB2 PRO 891 -9.771 9.373 -3.521
706 HB3 PRO 891 HB3 PRO 891 -7.999 9.475 -3.436
707 HG2 PRO 891 HG2 PRO 891 -9.854 7.669 -1.944
708 HG3 PRO 891 HG3 PRO 891 -8.330 7.282 -2.762
709 HD2 PRO 891 HD2 PRO 891 -8.487 7.668 -0.057
710 HD3 PRO 891 HD3 PRO 891 -7.030 8.062 -1.000
711 H SER 892 H SER 892 -10.007 12.524 -0.885
712 HA SER 892 HA SER 892 -12.353 11.790 0.339
713 HB2 SER 892 HB2 SER 892 -11.783 14.279 -1.281
714 HB3 SER 892 HB3 SER 892 -13.183 14.081 -0.231
715 HG SER 892 HG SER 892 -11.925 14.568 1.367
716 H ARG 893 H ARG 893 -12.822 13.575 -2.638
717 HA ARG 893 HA ARG 893 -14.413 13.330 -4.288
718 HB2 ARG 893 HB2 ARG 893 -13.174 10.588 -4.075
719 HB3 ARG 893 HB3 ARG 893 -14.409 10.948 -5.279
720 HG2 ARG 893 HG2 ARG 893 -12.078 11.249 -6.144
721 HG3 ARG 893 HG3 ARG 893 -13.043 12.722 -6.227
722 HD2 ARG 893 HD2 ARG 893 -11.941 13.689 -4.374
723 HD3 ARG 893 HD3 ARG 893 -11.287 12.141 -3.842
724 HE ARG 893 HE ARG 893 -9.526 12.445 -5.321
725 HH11 ARG 893 HH11 ARG 893 -12.173 14.537 -6.097
726 HH12 ARG 893 HH12 ARG 893 -11.303 15.416 -7.309
727 HH21 ARG 893 HH21 ARG 893 -8.379 13.594 -6.909
728 HH22 ARG 893 HH22 ARG 893 -9.155 14.882 -7.768
729 H ALA 894 H ALA 894 -15.983 13.739 -2.443
730 HA ALA 894 HA ALA 894 -18.124 11.824 -2.641
731 HB1 ALA 894 HB1 ALA 894 -18.303 11.222 -0.332
732 HB2 ALA 894 HB2 ALA 894 -17.014 12.336 0.123
733 HB3 ALA 894 HB3 ALA 894 -16.640 10.889 -0.814
734 H GLU 895 H GLU 895 -18.309 14.257 -3.571
735 HA GLU 895 HA GLU 895 -18.992 16.326 -1.770
736 HB2 GLU 895 HB2 GLU 895 -20.111 17.353 -3.746
737 HB3 GLU 895 HB3 GLU 895 -18.465 16.817 -4.089
738 HG2 GLU 895 HG2 GLU 895 -19.345 14.730 -5.067
739 HG3 GLU 895 HG3 GLU 895 -20.991 15.263 -4.727
740 H ARG 896 H ARG 896 -21.158 17.252 -1.463
741 HA ARG 896 HA ARG 896 -23.516 15.744 -1.948
742 HB2 ARG 896 HB2 ARG 896 -22.267 14.407 -0.114
743 HB3 ARG 896 HB3 ARG 896 -22.715 15.728 0.961
744 HG2 ARG 896 HG2 ARG 896 -25.125 15.371 0.072
745 HG3 ARG 896 HG3 ARG 896 -24.525 13.829 -0.537
746 HD2 ARG 896 HD2 ARG 896 -24.478 14.765 2.343
747 HD3 ARG 896 HD3 ARG 896 -25.493 13.492 1.673
748 HE ARG 896 HE ARG 896 -22.687 13.000 1.256
749 HH11 ARG 896 HH11 ARG 896 -25.324 12.815 3.488
750 HH12 ARG 896 HH12 ARG 896 -24.644 11.506 4.397
751 HH21 ARG 896 HH21 ARG 896 -21.789 11.283 2.442
752 HH22 ARG 896 HH22 ARG 896 -22.644 10.639 3.805
753 H ALA 897 H ALA 897 -24.211 16.746 1.005
754 HA ALA 897 HA ALA 897 -24.200 19.615 0.675
755 HB1 ALA 897 HB1 ALA 897 -26.057 18.948 -0.828
756 HB2 ALA 897 HB2 ALA 897 -26.619 19.894 0.550
757 HB3 ALA 897 HB3 ALA 897 -26.843 18.145 0.532
758 H ARG 898 H ARG 898 -23.327 19.762 2.710
759 HA ARG 898 HA ARG 898 -24.387 18.349 4.969
760 HB2 ARG 898 HB2 ARG 898 -22.446 20.644 4.683
761 HB3 ARG 898 HB3 ARG 898 -22.908 19.986 6.252
762 HG2 ARG 898 HG2 ARG 898 -21.960 18.090 4.108
763 HG3 ARG 898 HG3 ARG 898 -20.769 19.053 4.976
764 HD2 ARG 898 HD2 ARG 898 -22.820 17.231 6.269
765 HD3 ARG 898 HD3 ARG 898 -21.112 16.863 6.062
766 HE ARG 898 HE ARG 898 -22.268 18.641 8.035
767 HH11 ARG 898 HH11 ARG 898 -19.474 17.759 6.192
768 HH12 ARG 898 HH12 ARG 898 -18.347 18.439 7.318
769 HH21 ARG 898 HH21 ARG 898 -20.796 19.533 9.515
770 HH22 ARG 898 HH22 ARG 898 -19.094 19.443 9.199
771 H SER 899 H SER 899 -26.548 18.809 5.249
772 HA SER 899 HA SER 899 -28.442 20.032 5.738
773 HB2 SER 899 HB2 SER 899 -28.149 21.579 7.628
774 HB3 SER 899 HB3 SER 899 -27.254 20.085 7.888
775 HG SER 899 HG SER 899 -26.229 22.350 8.140
776 H THR 900 H THR 900 -28.508 20.830 3.495
777 HA THR 900 HA THR 900 -28.646 22.490 1.904
778 HB THR 900 HB THR 900 -29.705 24.521 2.659
779 HG1 THR 900 HG1 THR 900 -29.106 25.344 4.473
780 HG21 THR 900 HG21 THR 900 -31.540 23.595 3.988
781 HG22 THR 900 HG22 THR 900 -30.538 22.217 4.442
782 HG23 THR 900 HG23 THR 900 -31.038 22.430 2.764
Start of MODEL 3
1 H1 ASP 500 H1 ASP 500 6.505 -22.056 -4.266
2 H2 ASP 500 H2 ASP 500 7.230 -20.879 -5.253
3 H3 ASP 500 H3 ASP 500 6.219 -22.061 -5.937
4 HA ASP 500 HA ASP 500 5.058 -19.960 -5.791
5 HB2 ASP 500 HB2 ASP 500 4.087 -22.006 -3.772
6 HB3 ASP 500 HB3 ASP 500 3.096 -20.771 -4.545
7 H LYS 501 H LYS 501 7.134 -20.648 -3.267
8 HA LYS 501 HA LYS 501 5.991 -18.902 -1.271
9 HB2 LYS 501 HB2 LYS 501 7.477 -20.875 -0.760
10 HB3 LYS 501 HB3 LYS 501 8.823 -19.945 -1.418
11 HG2 LYS 501 HG2 LYS 501 8.516 -18.208 0.241
12 HG3 LYS 501 HG3 LYS 501 7.039 -18.973 0.830
13 HD2 LYS 501 HD2 LYS 501 8.244 -20.849 1.696
14 HD3 LYS 501 HD3 LYS 501 9.720 -20.375 0.853
15 HE2 LYS 501 HE2 LYS 501 8.397 -18.686 2.991
16 HE3 LYS 501 HE3 LYS 501 9.717 -19.810 3.311
17 HZ1 LYS 501 HZ1 LYS 501 9.794 -17.488 1.460
18 HZ2 LYS 501 HZ2 LYS 501 11.057 -18.605 1.674
19 HZ3 LYS 501 HZ3 LYS 501 10.578 -17.605 2.959
20 H ALA 502 H ALA 502 7.898 -18.522 -4.069
21 HA ALA 502 HA ALA 502 9.514 -16.333 -3.462
22 HB1 ALA 502 HB1 ALA 502 9.597 -15.908 -5.819
23 HB2 ALA 502 HB2 ALA 502 8.058 -16.727 -6.082
24 HB3 ALA 502 HB3 ALA 502 9.484 -17.655 -5.617
25 H TYR 503 H TYR 503 6.277 -16.258 -4.950
26 HA TYR 503 HA TYR 503 5.822 -13.560 -5.053
27 HB2 TYR 503 HB2 TYR 503 4.219 -15.319 -5.804
28 HB3 TYR 503 HB3 TYR 503 3.778 -15.590 -4.118
29 HD1 TYR 503 HD1 TYR 503 4.213 -12.738 -6.521
30 HD2 TYR 503 HD2 TYR 503 1.931 -14.410 -3.288
31 HE1 TYR 503 HE1 TYR 503 2.654 -10.824 -6.633
32 HE2 TYR 503 HE2 TYR 503 0.365 -12.492 -3.404
33 HH TYR 503 HH TYR 503 0.215 -10.398 -5.994
34 H LEU 504 H LEU 504 4.814 -15.571 -2.259
35 HA LEU 504 HA LEU 504 4.036 -13.606 -0.532
36 HB2 LEU 504 HB2 LEU 504 4.074 -16.132 -0.163
37 HB3 LEU 504 HB3 LEU 504 5.750 -15.931 0.339
38 HG LEU 504 HG LEU 504 4.725 -14.057 1.929
39 HD11 LEU 504 HD11 LEU 504 2.381 -15.966 1.730
40 HD12 LEU 504 HD12 LEU 504 2.411 -14.426 0.876
41 HD13 LEU 504 HD13 LEU 504 2.476 -14.458 2.635
42 HD21 LEU 504 HD21 LEU 504 4.291 -15.908 3.641
43 HD22 LEU 504 HD22 LEU 504 5.867 -15.944 2.849
44 HD23 LEU 504 HD23 LEU 504 4.597 -17.053 2.334
45 H ASP 505 H ASP 505 7.346 -14.687 -1.148
46 HA ASP 505 HA ASP 505 8.686 -13.197 0.788
47 HB2 ASP 505 HB2 ASP 505 9.609 -14.937 -0.905
48 HB3 ASP 505 HB3 ASP 505 9.824 -13.558 -1.979
49 H GLU 506 H GLU 506 7.837 -12.242 -2.549
50 HA GLU 506 HA GLU 506 8.970 -9.695 -2.532
51 HB2 GLU 506 HB2 GLU 506 6.559 -10.819 -3.949
52 HB3 GLU 506 HB3 GLU 506 7.050 -9.141 -4.166
53 HG2 GLU 506 HG2 GLU 506 8.005 -10.697 -5.889
54 HG3 GLU 506 HG3 GLU 506 9.227 -9.817 -4.976
55 H LEU 507 H LEU 507 6.143 -10.909 -0.938
56 HA LEU 507 HA LEU 507 5.027 -8.289 -0.367
57 HB2 LEU 507 HB2 LEU 507 4.271 -10.878 0.984
58 HB3 LEU 507 HB3 LEU 507 3.279 -9.449 0.716
59 HG LEU 507 HG LEU 507 4.278 -11.382 -1.386
60 HD11 LEU 507 HD11 LEU 507 1.441 -10.599 -0.703
61 HD12 LEU 507 HD12 LEU 507 2.255 -11.954 0.079
62 HD13 LEU 507 HD13 LEU 507 1.988 -11.973 -1.664
63 HD21 LEU 507 HD21 LEU 507 4.378 -9.230 -2.409
64 HD22 LEU 507 HD22 LEU 507 2.901 -8.697 -1.606
65 HD23 LEU 507 HD23 LEU 507 2.821 -9.896 -2.896
66 H VAL 508 H VAL 508 6.722 -10.858 1.448
67 HA VAL 508 HA VAL 508 6.649 -9.664 3.974
68 HB VAL 508 HB VAL 508 8.850 -11.364 2.784
69 HG11 VAL 508 HG11 VAL 508 8.155 -10.556 5.619
70 HG12 VAL 508 HG12 VAL 508 9.674 -10.275 4.767
71 HG13 VAL 508 HG13 VAL 508 9.216 -11.913 5.240
72 HG21 VAL 508 HG21 VAL 508 7.608 -13.142 4.143
73 HG22 VAL 508 HG22 VAL 508 6.794 -12.584 2.682
74 HG23 VAL 508 HG23 VAL 508 6.282 -11.986 4.261
75 H GLU 509 H GLU 509 9.406 -9.621 1.715
76 HA GLU 509 HA GLU 509 11.055 -7.832 2.963
77 HB2 GLU 509 HB2 GLU 509 11.600 -8.974 0.838
78 HB3 GLU 509 HB3 GLU 509 10.487 -7.902 -0.010
79 HG2 GLU 509 HG2 GLU 509 11.802 -5.963 0.562
80 HG3 GLU 509 HG3 GLU 509 12.829 -6.915 1.634
81 H LEU 510 H LEU 510 8.582 -6.921 0.544
82 HA LEU 510 HA LEU 510 8.842 -4.156 0.880
83 HB2 LEU 510 HB2 LEU 510 7.456 -5.629 -0.852
84 HB3 LEU 510 HB3 LEU 510 6.145 -5.339 0.284
85 HG LEU 510 HG LEU 510 6.932 -2.818 0.123
86 HD11 LEU 510 HD11 LEU 510 7.760 -2.307 -2.196
87 HD12 LEU 510 HD12 LEU 510 8.036 -4.031 -2.431
88 HD13 LEU 510 HD13 LEU 510 8.941 -3.153 -1.201
89 HD21 LEU 510 HD21 LEU 510 5.383 -4.337 -1.988
90 HD22 LEU 510 HD22 LEU 510 5.483 -2.576 -1.976
91 HD23 LEU 510 HD23 LEU 510 4.746 -3.427 -0.620
92 H HIS 511 H HIS 511 6.479 -6.385 2.360
93 HA HIS 511 HA HIS 511 5.088 -4.653 3.972
94 HB2 HIS 511 HB2 HIS 511 4.538 -7.028 3.807
95 HB3 HIS 511 HB3 HIS 511 6.022 -7.446 4.667
96 HD1 HIS 511 HD1 HIS 511 6.011 -7.237 7.208
97 HD2 HIS 511 HD2 HIS 511 2.593 -5.649 5.442
98 HE1 HIS 511 HE1 HIS 511 4.426 -6.677 9.103
99 HE2 HIS 511 HE2 HIS 511 2.333 -5.704 8.042
100 H ARG 512 H ARG 512 7.911 -6.551 5.095
101 HA ARG 512 HA ARG 512 8.228 -5.371 7.559
102 HB2 ARG 512 HB2 ARG 512 10.155 -6.615 5.612
103 HB3 ARG 512 HB3 ARG 512 10.771 -5.893 7.097
104 HG2 ARG 512 HG2 ARG 512 8.454 -7.818 7.244
105 HG3 ARG 512 HG3 ARG 512 10.088 -8.449 7.053
106 HD2 ARG 512 HD2 ARG 512 10.795 -7.612 9.123
107 HD3 ARG 512 HD3 ARG 512 9.515 -6.406 9.192
108 HE ARG 512 HE ARG 512 8.586 -9.157 9.248
109 HH11 ARG 512 HH11 ARG 512 9.656 -6.391 11.030
110 HH12 ARG 512 HH12 ARG 512 8.872 -6.860 12.501
111 HH21 ARG 512 HH21 ARG 512 7.554 -9.780 11.173
112 HH22 ARG 512 HH22 ARG 512 7.680 -8.781 12.581
113 H ARG 513 H ARG 513 9.725 -4.341 4.494
114 HA ARG 513 HA ARG 513 11.054 -2.091 5.557
115 HB2 ARG 513 HB2 ARG 513 11.661 -3.032 3.394
116 HB3 ARG 513 HB3 ARG 513 10.073 -2.624 2.743
117 HG2 ARG 513 HG2 ARG 513 10.497 -0.279 2.919
118 HG3 ARG 513 HG3 ARG 513 11.936 -0.544 3.906
119 HD2 ARG 513 HD2 ARG 513 13.092 -1.573 2.030
120 HD3 ARG 513 HD3 ARG 513 11.636 -1.484 1.040
121 HE ARG 513 HE ARG 513 12.479 1.091 2.022
122 HH11 ARG 513 HH11 ARG 513 12.928 -1.354 -0.386
123 HH12 ARG 513 HH12 ARG 513 13.539 -0.260 -1.581
124 HH21 ARG 513 HH21 ARG 513 13.281 2.532 0.459
125 HH22 ARG 513 HH22 ARG 513 13.739 1.939 -1.103
126 H LEU 514 H LEU 514 7.793 -2.510 4.246
127 HA LEU 514 HA LEU 514 7.108 0.203 4.025
128 HB2 LEU 514 HB2 LEU 514 5.843 -2.094 3.375
129 HB3 LEU 514 HB3 LEU 514 4.971 -1.725 4.857
130 HG LEU 514 HG LEU 514 5.323 0.189 2.524
131 HD11 LEU 514 HD11 LEU 514 2.968 -0.261 2.055
132 HD12 LEU 514 HD12 LEU 514 2.886 -1.378 3.418
133 HD13 LEU 514 HD13 LEU 514 3.876 -1.771 2.014
134 HD21 LEU 514 HD21 LEU 514 3.896 0.341 5.185
135 HD22 LEU 514 HD22 LEU 514 3.395 1.340 3.822
136 HD23 LEU 514 HD23 LEU 514 5.023 1.498 4.477
137 H MET 515 H MET 515 6.756 -2.054 6.729
138 HA MET 515 HA MET 515 5.350 -0.439 8.482
139 HB2 MET 515 HB2 MET 515 5.958 -2.872 8.786
140 HB3 MET 515 HB3 MET 515 7.549 -2.325 9.322
141 HG2 MET 515 HG2 MET 515 6.221 -2.607 11.302
142 HG3 MET 515 HG3 MET 515 6.347 -0.870 11.028
143 HE1 MET 515 HE1 MET 515 2.842 -1.032 12.468
144 HE2 MET 515 HE2 MET 515 4.551 -0.670 12.696
145 HE3 MET 515 HE3 MET 515 3.979 -2.327 12.862
146 H THR 516 H THR 516 8.822 -0.496 7.842
147 HA THR 516 HA THR 516 9.305 1.574 9.858
148 HB THR 516 HB THR 516 11.642 1.244 9.362
149 HG1 THR 516 HG1 THR 516 11.845 -0.591 7.640
150 HG21 THR 516 HG21 THR 516 10.522 -0.474 10.759
151 HG22 THR 516 HG22 THR 516 11.865 -1.149 9.836
152 HG23 THR 516 HG23 THR 516 10.204 -1.423 9.308
153 H LEU 517 H LEU 517 8.847 1.213 6.437
154 HA LEU 517 HA LEU 517 10.159 3.410 5.400
155 HB2 LEU 517 HB2 LEU 517 8.893 1.712 4.083
156 HB3 LEU 517 HB3 LEU 517 7.395 2.478 4.601
157 HG LEU 517 HG LEU 517 8.220 4.623 3.579
158 HD11 LEU 517 HD11 LEU 517 10.520 2.820 2.852
159 HD12 LEU 517 HD12 LEU 517 10.545 4.495 3.401
160 HD13 LEU 517 HD13 LEU 517 10.060 4.121 1.754
161 HD21 LEU 517 HD21 LEU 517 8.052 2.227 1.728
162 HD22 LEU 517 HD22 LEU 517 7.735 3.902 1.278
163 HD23 LEU 517 HD23 LEU 517 6.671 3.079 2.416
164 H ARG 518 H ARG 518 10.126 5.471 5.990
165 HA ARG 518 HA ARG 518 7.638 6.619 7.128
166 HB2 ARG 518 HB2 ARG 518 9.862 6.543 8.475
167 HB3 ARG 518 HB3 ARG 518 10.385 7.833 7.396
168 HG2 ARG 518 HG2 ARG 518 9.438 9.088 9.116
169 HG3 ARG 518 HG3 ARG 518 8.046 8.913 8.052
170 HD2 ARG 518 HD2 ARG 518 7.592 6.731 9.453
171 HD3 ARG 518 HD3 ARG 518 8.640 7.500 10.641
172 HE ARG 518 HE ARG 518 6.856 9.463 10.041
173 HH11 ARG 518 HH11 ARG 518 6.592 6.128 10.923
174 HH12 ARG 518 HH12 ARG 518 5.073 6.318 11.731
175 HH21 ARG 518 HH21 ARG 518 4.861 9.721 11.098
176 HH22 ARG 518 HH22 ARG 518 4.092 8.353 11.831
177 H GLU 519 H GLU 519 9.774 6.680 4.469
178 HA GLU 519 HA GLU 519 9.679 9.326 3.600
179 HB2 GLU 519 HB2 GLU 519 10.969 7.372 2.588
180 HB3 GLU 519 HB3 GLU 519 9.472 6.941 1.759
181 HG2 GLU 519 HG2 GLU 519 9.391 9.198 0.754
182 HG3 GLU 519 HG3 GLU 519 10.904 9.605 1.558
183 H ARG 520 H ARG 520 7.572 10.061 4.247
184 HA ARG 520 HA ARG 520 5.115 9.090 3.492
185 HB2 ARG 520 HB2 ARG 520 5.865 12.016 3.585
186 HB3 ARG 520 HB3 ARG 520 4.256 11.323 3.810
187 HG2 ARG 520 HG2 ARG 520 5.201 10.019 5.767
188 HG3 ARG 520 HG3 ARG 520 6.668 10.987 5.610
189 HD2 ARG 520 HD2 ARG 520 3.884 12.100 6.060
190 HD3 ARG 520 HD3 ARG 520 5.120 11.928 7.300
191 HE ARG 520 HE ARG 520 6.305 13.724 6.342
192 HH11 ARG 520 HH11 ARG 520 3.520 12.825 4.476
193 HH12 ARG 520 HH12 ARG 520 3.554 14.251 3.495
194 HH21 ARG 520 HH21 ARG 520 6.343 15.589 5.057
195 HH22 ARG 520 HH22 ARG 520 5.149 15.813 3.823
196 H HIS 521 H HIS 521 7.487 10.646 1.476
197 HA HIS 521 HA HIS 521 5.861 11.581 -0.602
198 HB2 HIS 521 HB2 HIS 521 8.414 11.857 -0.237
199 HB3 HIS 521 HB3 HIS 521 8.556 10.331 -1.106
200 HD1 HIS 521 HD1 HIS 521 5.932 11.156 -2.922
201 HD2 HIS 521 HD2 HIS 521 9.531 13.224 -2.528
202 HE1 HIS 521 HE1 HIS 521 6.153 12.611 -4.983
203 HE2 HIS 521 HE2 HIS 521 8.343 13.877 -4.759
204 H ILE 522 H ILE 522 6.912 8.346 0.187
205 HA ILE 522 HA ILE 522 5.982 7.231 -2.347
206 HB ILE 522 HB ILE 522 6.903 5.752 0.115
207 HG12 ILE 522 HG12 ILE 522 8.679 7.289 -0.415
208 HG13 ILE 522 HG13 ILE 522 9.143 5.724 -1.079
209 HG21 ILE 522 HG21 ILE 522 7.432 4.001 -1.488
210 HG22 ILE 522 HG22 ILE 522 6.955 5.043 -2.828
211 HG23 ILE 522 HG23 ILE 522 5.746 4.477 -1.675
212 HD11 ILE 522 HD11 ILE 522 8.113 8.156 -2.537
213 HD12 ILE 522 HD12 ILE 522 8.027 6.550 -3.267
214 HD13 ILE 522 HD13 ILE 522 9.592 7.238 -2.835
215 H LEU 523 H LEU 523 5.172 6.913 1.083
216 HA LEU 523 HA LEU 523 3.061 5.155 0.960
217 HB2 LEU 523 HB2 LEU 523 3.565 7.545 2.721
218 HB3 LEU 523 HB3 LEU 523 2.092 6.598 2.905
219 HG LEU 523 HG LEU 523 3.436 4.559 3.236
220 HD11 LEU 523 HD11 LEU 523 5.926 4.930 3.642
221 HD12 LEU 523 HD12 LEU 523 5.728 6.488 2.844
222 HD13 LEU 523 HD13 LEU 523 5.404 4.995 1.961
223 HD21 LEU 523 HD21 LEU 523 4.521 6.715 5.061
224 HD22 LEU 523 HD22 LEU 523 4.121 5.045 5.463
225 HD23 LEU 523 HD23 LEU 523 2.835 6.205 5.132
226 H GLN 524 H GLN 524 3.171 8.453 -0.137
227 HA GLN 524 HA GLN 524 0.326 8.800 -0.285
228 HB2 GLN 524 HB2 GLN 524 2.647 10.290 -1.519
229 HB3 GLN 524 HB3 GLN 524 0.966 10.750 -1.787
230 HG2 GLN 524 HG2 GLN 524 0.610 11.165 0.543
231 HG3 GLN 524 HG3 GLN 524 2.139 10.402 0.979
232 HE21 GLN 524 HE21 GLN 524 3.033 12.327 1.966
233 HE22 GLN 524 HE22 GLN 524 3.458 13.690 1.049
234 H GLN 525 H GLN 525 2.853 8.022 -2.678
235 HA GLN 525 HA GLN 525 1.116 7.866 -4.901
236 HB2 GLN 525 HB2 GLN 525 3.598 6.177 -4.662
237 HB3 GLN 525 HB3 GLN 525 2.932 6.984 -6.085
238 HG2 GLN 525 HG2 GLN 525 3.385 9.188 -4.811
239 HG3 GLN 525 HG3 GLN 525 4.394 8.210 -3.748
240 HE21 GLN 525 HE21 GLN 525 6.364 7.276 -4.648
241 HE22 GLN 525 HE22 GLN 525 6.986 7.799 -6.138
242 H ILE 526 H ILE 526 2.451 5.293 -2.818
243 HA ILE 526 HA ILE 526 1.142 3.131 -4.007
244 HB ILE 526 HB ILE 526 2.061 3.593 -1.166
245 HG12 ILE 526 HG12 ILE 526 3.224 1.866 -3.367
246 HG13 ILE 526 HG13 ILE 526 3.709 3.541 -3.109
247 HG21 ILE 526 HG21 ILE 526 0.823 1.174 -2.480
248 HG22 ILE 526 HG22 ILE 526 0.478 1.868 -0.898
249 HG23 ILE 526 HG23 ILE 526 1.981 0.987 -1.164
250 HD11 ILE 526 HD11 ILE 526 4.264 2.929 -0.728
251 HD12 ILE 526 HD12 ILE 526 5.278 2.139 -1.935
252 HD13 ILE 526 HD13 ILE 526 3.973 1.244 -1.156
253 H VAL 527 H VAL 527 0.174 4.816 -1.003
254 HA VAL 527 HA VAL 527 -2.208 3.631 -0.477
255 HB VAL 527 HB VAL 527 -1.522 6.574 -0.329
256 HG11 VAL 527 HG11 VAL 527 -3.454 6.553 1.398
257 HG12 VAL 527 HG12 VAL 527 -3.981 5.081 0.585
258 HG13 VAL 527 HG13 VAL 527 -3.892 6.598 -0.313
259 HG21 VAL 527 HG21 VAL 527 -1.867 4.733 2.027
260 HG22 VAL 527 HG22 VAL 527 -0.826 6.145 1.852
261 HG23 VAL 527 HG23 VAL 527 -0.381 4.621 1.084
262 H ASN 528 H ASN 528 -2.000 6.568 -2.514
263 HA ASN 528 HA ASN 528 -4.628 6.512 -3.450
264 HB2 ASN 528 HB2 ASN 528 -2.182 7.521 -4.919
265 HB3 ASN 528 HB3 ASN 528 -3.853 7.989 -5.225
266 HD21 ASN 528 HD21 ASN 528 -2.109 10.042 -4.578
267 HD22 ASN 528 HD22 ASN 528 -2.399 10.586 -2.997
268 H LEU 529 H LEU 529 -1.900 4.558 -4.376
269 HA LEU 529 HA LEU 529 -2.859 3.822 -6.957
270 HB2 LEU 529 HB2 LEU 529 -0.467 3.572 -5.902
271 HB3 LEU 529 HB3 LEU 529 -1.085 2.039 -5.302
272 HG LEU 529 HG LEU 529 0.040 1.660 -7.419
273 HD11 LEU 529 HD11 LEU 529 -1.644 0.435 -8.533
274 HD12 LEU 529 HD12 LEU 529 -2.906 1.573 -8.063
275 HD13 LEU 529 HD13 LEU 529 -2.186 0.504 -6.857
276 HD21 LEU 529 HD21 LEU 529 -1.913 3.317 -8.986
277 HD22 LEU 529 HD22 LEU 529 -0.236 2.912 -9.339
278 HD23 LEU 529 HD23 LEU 529 -0.603 4.165 -8.159
279 H ILE 530 H ILE 530 -2.705 1.904 -3.950
280 HA ILE 530 HA ILE 530 -4.459 -0.098 -4.948
281 HB ILE 530 HB ILE 530 -4.377 -1.067 -2.761
282 HG12 ILE 530 HG12 ILE 530 -3.063 0.432 -0.975
283 HG13 ILE 530 HG13 ILE 530 -3.721 1.753 -1.927
284 HG21 ILE 530 HG21 ILE 530 -2.284 -0.983 -4.199
285 HG22 ILE 530 HG22 ILE 530 -2.006 -1.262 -2.481
286 HG23 ILE 530 HG23 ILE 530 -1.727 0.336 -3.170
287 HD11 ILE 530 HD11 ILE 530 -5.580 1.548 -0.653
288 HD12 ILE 530 HD12 ILE 530 -5.051 0.000 -0.007
289 HD13 ILE 530 HD13 ILE 530 -5.928 0.060 -1.528
290 H GLU 531 H GLU 531 -4.930 2.660 -2.813
291 HA GLU 531 HA GLU 531 -7.521 2.378 -1.977
292 HB2 GLU 531 HB2 GLU 531 -6.041 4.368 -1.538
293 HB3 GLU 531 HB3 GLU 531 -6.473 4.966 -3.141
294 HG2 GLU 531 HG2 GLU 531 -7.965 6.007 -1.562
295 HG3 GLU 531 HG3 GLU 531 -8.899 4.803 -2.445
296 H GLU 532 H GLU 532 -6.484 3.602 -5.158
297 HA GLU 532 HA GLU 532 -9.048 4.024 -6.239
298 HB2 GLU 532 HB2 GLU 532 -6.360 3.426 -7.479
299 HB3 GLU 532 HB3 GLU 532 -7.803 3.636 -8.471
300 HG2 GLU 532 HG2 GLU 532 -8.163 5.864 -7.557
301 HG3 GLU 532 HG3 GLU 532 -6.816 5.659 -6.442
302 H THR 533 H THR 533 -7.156 1.125 -5.788
303 HA THR 533 HA THR 533 -8.615 -0.541 -7.589
304 HB THR 533 HB THR 533 -7.185 -1.527 -5.122
305 HG1 THR 533 HG1 THR 533 -6.058 0.117 -6.562
306 HG21 THR 533 HG21 THR 533 -6.621 -3.396 -6.660
307 HG22 THR 533 HG22 THR 533 -7.559 -2.609 -7.929
308 HG23 THR 533 HG23 THR 533 -8.363 -3.194 -6.472
309 H GLY 534 H GLY 534 -8.743 -0.104 -4.048
310 HA2 GLY 534 HA2 GLY 534 -10.979 0.111 -3.027
311 HA3 GLY 534 HA3 GLY 534 -11.508 -1.200 -4.074
312 H HIS 535 H HIS 535 -8.610 -2.295 -3.445
313 HA HIS 535 HA HIS 535 -9.495 -4.123 -1.424
314 HB2 HIS 535 HB2 HIS 535 -6.830 -3.683 -2.776
315 HB3 HIS 535 HB3 HIS 535 -7.103 -4.944 -1.574
316 HD1 HIS 535 HD1 HIS 535 -9.996 -5.742 -2.454
317 HD2 HIS 535 HD2 HIS 535 -6.775 -5.300 -5.065
318 HE1 HIS 535 HE1 HIS 535 -10.547 -7.113 -4.510
319 HE2 HIS 535 HE2 HIS 535 -8.594 -6.854 -6.111
320 H PHE 536 H PHE 536 -9.896 -1.951 -0.037
321 HA PHE 536 HA PHE 536 -7.739 -1.955 1.965
322 HB2 PHE 536 HB2 PHE 536 -7.563 0.424 2.062
323 HB3 PHE 536 HB3 PHE 536 -7.376 -0.024 0.370
324 HD1 PHE 536 HD1 PHE 536 -9.770 1.309 2.876
325 HD2 PHE 536 HD2 PHE 536 -8.950 0.679 -1.291
326 HE1 PHE 536 HE1 PHE 536 -11.681 2.773 2.279
327 HE2 PHE 536 HE2 PHE 536 -10.857 2.147 -1.889
328 HZ PHE 536 HZ PHE 536 -12.224 3.192 -0.103
329 H HIS 537 H HIS 537 -8.403 -1.189 4.023
330 HA HIS 537 HA HIS 537 -11.303 -0.833 4.451
331 HB2 HIS 537 HB2 HIS 537 -11.174 -2.387 6.392
332 HB3 HIS 537 HB3 HIS 537 -10.892 -3.200 4.854
333 HD1 HIS 537 HD1 HIS 537 -9.512 -3.011 8.132
334 HD2 HIS 537 HD2 HIS 537 -7.854 -3.203 4.312
335 HE1 HIS 537 HE1 HIS 537 -7.120 -3.786 8.428
336 HE2 HIS 537 HE2 HIS 537 -6.096 -3.910 6.107
337 H ILE 538 H ILE 538 -11.000 1.316 4.947
338 HA ILE 538 HA ILE 538 -9.082 2.117 7.002
339 HB ILE 538 HB ILE 538 -11.063 3.616 5.270
340 HG12 ILE 538 HG12 ILE 538 -8.067 3.943 5.504
341 HG13 ILE 538 HG13 ILE 538 -8.786 2.763 4.413
342 HG21 ILE 538 HG21 ILE 538 -11.119 4.846 7.304
343 HG22 ILE 538 HG22 ILE 538 -9.916 5.673 6.315
344 HG23 ILE 538 HG23 ILE 538 -9.401 4.585 7.602
345 HD11 ILE 538 HD11 ILE 538 -8.382 4.793 3.156
346 HD12 ILE 538 HD12 ILE 538 -9.198 5.766 4.380
347 HD13 ILE 538 HD13 ILE 538 -10.124 4.638 3.389
348 H THR 539 H THR 539 -9.610 2.631 9.089
349 HA THR 539 HA THR 539 -12.438 2.760 9.888
350 HB THR 539 HB THR 539 -12.178 1.093 11.620
351 HG1 THR 539 HG1 THR 539 -9.988 -0.121 11.184
352 HG21 THR 539 HG21 THR 539 -11.012 -0.077 9.086
353 HG22 THR 539 HG22 THR 539 -12.705 0.399 9.229
354 HG23 THR 539 HG23 THR 539 -12.057 -0.874 10.263
355 H ASN 540 H ASN 540 -12.737 3.609 12.041
356 HA ASN 540 HA ASN 540 -12.371 5.352 13.511
357 HB2 ASN 540 HB2 ASN 540 -11.310 3.531 14.714
358 HB3 ASN 540 HB3 ASN 540 -9.820 3.748 13.799
359 HD21 ASN 540 HD21 ASN 540 -12.045 5.786 15.795
360 HD22 ASN 540 HD22 ASN 540 -10.795 6.627 16.578
361 H THR 541 H THR 541 -8.947 5.171 13.100
362 HA THR 541 HA THR 541 -8.838 7.363 11.175
363 HB THR 541 HB THR 541 -7.369 8.693 12.775
364 HG1 THR 541 HG1 THR 541 -7.499 6.661 14.226
365 HG21 THR 541 HG21 THR 541 -9.759 9.249 12.195
366 HG22 THR 541 HG22 THR 541 -9.256 9.810 13.789
367 HG23 THR 541 HG23 THR 541 -10.253 8.364 13.637
368 H THR 542 H THR 542 -7.854 5.508 10.084
369 HA THR 542 HA THR 542 -5.031 5.677 10.084
370 HB THR 542 HB THR 542 -5.238 2.887 10.628
371 HG1 THR 542 HG1 THR 542 -6.524 2.699 12.271
372 HG21 THR 542 HG21 THR 542 -3.741 3.341 12.445
373 HG22 THR 542 HG22 THR 542 -4.284 5.011 12.568
374 HG23 THR 542 HG23 THR 542 -3.348 4.490 11.168
375 H PHE 543 H PHE 543 -4.099 4.093 8.505
376 HA PHE 543 HA PHE 543 -6.102 3.222 6.499
377 HB2 PHE 543 HB2 PHE 543 -5.043 5.184 5.606
378 HB3 PHE 543 HB3 PHE 543 -3.446 4.610 6.081
379 HD1 PHE 543 HD1 PHE 543 -6.369 3.781 3.906
380 HD2 PHE 543 HD2 PHE 543 -2.173 3.260 4.621
381 HE1 PHE 543 HE1 PHE 543 -6.143 2.624 1.726
382 HE2 PHE 543 HE2 PHE 543 -1.942 2.108 2.437
383 HZ PHE 543 HZ PHE 543 -3.925 1.789 0.994
384 H ASP 544 H ASP 544 -6.117 1.063 6.793
385 HA ASP 544 HA ASP 544 -3.517 -0.343 6.947
386 HB2 ASP 544 HB2 ASP 544 -6.267 -1.218 7.848
387 HB3 ASP 544 HB3 ASP 544 -4.810 -2.205 7.934
388 H PHE 545 H PHE 545 -3.072 -2.012 5.601
389 HA PHE 545 HA PHE 545 -5.056 -2.982 3.693
390 HB2 PHE 545 HB2 PHE 545 -3.579 -2.428 1.736
391 HB3 PHE 545 HB3 PHE 545 -4.326 -1.022 2.495
392 HD1 PHE 545 HD1 PHE 545 -2.967 0.223 4.302
393 HD2 PHE 545 HD2 PHE 545 -1.229 -2.551 1.522
394 HE1 PHE 545 HE1 PHE 545 -0.734 1.193 4.732
395 HE2 PHE 545 HE2 PHE 545 1.011 -1.575 1.953
396 HZ PHE 545 HZ PHE 545 1.258 0.298 3.560
397 H ASP 546 H ASP 546 -4.347 -4.947 2.624
398 HA ASP 546 HA ASP 546 -2.045 -6.222 3.969
399 HB2 ASP 546 HB2 ASP 546 -4.385 -7.408 2.455
400 HB3 ASP 546 HB3 ASP 546 -3.074 -8.336 3.182
401 H LEU 547 H LEU 547 -0.401 -7.200 2.757
402 HA LEU 547 HA LEU 547 0.009 -6.093 0.120
403 HB2 LEU 547 HB2 LEU 547 1.613 -7.969 1.855
404 HB3 LEU 547 HB3 LEU 547 2.124 -7.492 0.248
405 HG LEU 547 HG LEU 547 3.141 -6.161 2.138
406 HD11 LEU 547 HD11 LEU 547 3.154 -4.159 0.921
407 HD12 LEU 547 HD12 LEU 547 1.476 -4.324 0.418
408 HD13 LEU 547 HD13 LEU 547 2.718 -5.340 -0.311
409 HD21 LEU 547 HD21 LEU 547 1.841 -4.611 3.362
410 HD22 LEU 547 HD22 LEU 547 0.934 -6.117 3.436
411 HD23 LEU 547 HD23 LEU 547 0.432 -4.833 2.330
412 H CYS 548 H CYS 548 -1.481 -8.845 1.404
413 HA CYS 548 HA CYS 548 -0.903 -10.621 -0.818
414 HB2 CYS 548 HB2 CYS 548 -1.311 -11.339 1.615
415 HB3 CYS 548 HB3 CYS 548 -3.017 -11.026 1.293
416 HG CYS 548 HG CYS 548 -2.399 -12.746 -0.897
417 H SER 549 H SER 549 -3.130 -8.163 -0.087
418 HA SER 549 HA SER 549 -5.233 -9.155 -1.849
419 HB2 SER 549 HB2 SER 549 -5.633 -7.835 0.302
420 HB3 SER 549 HB3 SER 549 -5.063 -6.422 -0.583
421 HG SER 549 HG SER 549 -7.176 -8.145 -1.390
422 H LEU 550 H LEU 550 -2.336 -8.099 -2.544
423 HA LEU 550 HA LEU 550 -2.954 -5.978 -4.447
424 HB2 LEU 550 HB2 LEU 550 -0.361 -7.485 -4.053
425 HB3 LEU 550 HB3 LEU 550 -0.579 -5.951 -4.891
426 HG LEU 550 HG LEU 550 -1.098 -6.428 -1.942
427 HD11 LEU 550 HD11 LEU 550 1.202 -5.200 -3.477
428 HD12 LEU 550 HD12 LEU 550 1.258 -6.445 -2.228
429 HD13 LEU 550 HD13 LEU 550 0.887 -4.778 -1.794
430 HD21 LEU 550 HD21 LEU 550 -1.096 -3.813 -2.053
431 HD22 LEU 550 HD22 LEU 550 -2.546 -4.675 -2.558
432 HD23 LEU 550 HD23 LEU 550 -1.429 -4.047 -3.769
433 H ASP 551 H ASP 551 -2.776 -6.158 -6.689
434 HA ASP 551 HA ASP 551 -3.227 -8.862 -7.750
435 HB2 ASP 551 HB2 ASP 551 -3.350 -6.291 -9.321
436 HB3 ASP 551 HB3 ASP 551 -4.158 -7.821 -9.652
437 H LYS 552 H LYS 552 -1.843 -9.892 -9.079
438 HA LYS 552 HA LYS 552 0.835 -9.545 -9.047
439 HB2 LYS 552 HB2 LYS 552 -0.773 -10.502 -11.427
440 HB3 LYS 552 HB3 LYS 552 0.947 -10.793 -11.186
441 HG2 LYS 552 HG2 LYS 552 -1.001 -11.594 -9.026
442 HG3 LYS 552 HG3 LYS 552 -0.812 -12.622 -10.445
443 HD2 LYS 552 HD2 LYS 552 1.627 -12.740 -10.029
444 HD3 LYS 552 HD3 LYS 552 1.426 -11.741 -8.590
445 HE2 LYS 552 HE2 LYS 552 0.101 -13.416 -7.503
446 HE3 LYS 552 HE3 LYS 552 -0.042 -14.357 -8.987
447 HZ1 LYS 552 HZ1 LYS 552 2.101 -15.096 -8.838
448 HZ2 LYS 552 HZ2 LYS 552 1.712 -14.986 -7.189
449 HZ3 LYS 552 HZ3 LYS 552 2.631 -13.765 -7.930
450 H THR 553 H THR 553 -1.288 -8.187 -11.571
451 HA THR 553 HA THR 553 0.779 -6.777 -12.902
452 HB THR 553 HB THR 553 -2.111 -6.005 -12.904
453 HG1 THR 553 HG1 THR 553 -1.694 -8.313 -13.216
454 HG21 THR 553 HG21 THR 553 -0.095 -5.999 -15.147
455 HG22 THR 553 HG22 THR 553 -0.332 -4.614 -14.080
456 HG23 THR 553 HG23 THR 553 -1.657 -5.182 -15.097
457 H THR 554 H THR 554 -1.136 -6.104 -10.097
458 HA THR 554 HA THR 554 -0.496 -3.259 -10.084
459 HB THR 554 HB THR 554 -1.903 -4.977 -8.029
460 HG1 THR 554 HG1 THR 554 -2.658 -3.990 -10.382
461 HG21 THR 554 HG21 THR 554 -2.711 -2.667 -7.282
462 HG22 THR 554 HG22 THR 554 -1.411 -2.008 -8.275
463 HG23 THR 554 HG23 THR 554 -1.032 -3.064 -6.915
464 H VAL 555 H VAL 555 0.834 -6.205 -8.869
465 HA VAL 555 HA VAL 555 2.256 -5.025 -6.656
466 HB VAL 555 HB VAL 555 2.533 -7.674 -8.096
467 HG11 VAL 555 HG11 VAL 555 4.002 -6.558 -5.694
468 HG12 VAL 555 HG12 VAL 555 4.703 -7.193 -7.184
469 HG13 VAL 555 HG13 VAL 555 3.912 -8.283 -6.046
470 HG21 VAL 555 HG21 VAL 555 0.479 -7.109 -6.641
471 HG22 VAL 555 HG22 VAL 555 1.594 -7.124 -5.276
472 HG23 VAL 555 HG23 VAL 555 1.360 -8.582 -6.238
473 H ARG 556 H ARG 556 2.837 -5.572 -10.061
474 HA ARG 556 HA ARG 556 5.662 -5.088 -9.964
475 HB2 ARG 556 HB2 ARG 556 3.621 -5.117 -12.191
476 HB3 ARG 556 HB3 ARG 556 5.309 -4.706 -12.484
477 HG2 ARG 556 HG2 ARG 556 4.675 -7.232 -10.968
478 HG3 ARG 556 HG3 ARG 556 4.475 -7.220 -12.717
479 HD2 ARG 556 HD2 ARG 556 6.757 -6.791 -13.102
480 HD3 ARG 556 HD3 ARG 556 7.028 -6.222 -11.458
481 HE ARG 556 HE ARG 556 6.258 -8.848 -11.169
482 HH11 ARG 556 HH11 ARG 556 8.692 -7.115 -12.913
483 HH12 ARG 556 HH12 ARG 556 9.844 -8.407 -12.863
484 HH21 ARG 556 HH21 ARG 556 7.763 -10.547 -11.099
485 HH22 ARG 556 HH22 ARG 556 9.317 -10.351 -11.836
486 H LYS 557 H LYS 557 2.801 -3.119 -10.147
487 HA LYS 557 HA LYS 557 4.247 -0.715 -10.934
488 HB2 LYS 557 HB2 LYS 557 1.382 -1.137 -10.047
489 HB3 LYS 557 HB3 LYS 557 2.045 0.385 -10.641
490 HG2 LYS 557 HG2 LYS 557 2.433 -0.509 -12.813
491 HG3 LYS 557 HG3 LYS 557 2.207 -2.167 -12.255
492 HD2 LYS 557 HD2 LYS 557 0.230 -1.271 -13.509
493 HD3 LYS 557 HD3 LYS 557 -0.159 -1.769 -11.862
494 HE2 LYS 557 HE2 LYS 557 -0.254 0.468 -11.088
495 HE3 LYS 557 HE3 LYS 557 0.586 1.085 -12.511
496 HZ1 LYS 557 HZ1 LYS 557 -2.201 0.545 -12.129
497 HZ2 LYS 557 HZ2 LYS 557 -1.588 -0.184 -13.536
498 HZ3 LYS 557 HZ3 LYS 557 -1.435 1.493 -13.310
499 H LEU 558 H LEU 558 3.260 -2.348 -8.047
500 HA LEU 558 HA LEU 558 3.502 -0.029 -6.331
501 HB2 LEU 558 HB2 LEU 558 3.045 -2.966 -5.862
502 HB3 LEU 558 HB3 LEU 558 3.364 -1.873 -4.519
503 HG LEU 558 HG LEU 558 1.180 -1.399 -6.569
504 HD11 LEU 558 HD11 LEU 558 0.718 -3.495 -5.408
505 HD12 LEU 558 HD12 LEU 558 -0.374 -2.242 -4.818
506 HD13 LEU 558 HD13 LEU 558 1.017 -2.728 -3.848
507 HD21 LEU 558 HD21 LEU 558 1.466 0.658 -5.521
508 HD22 LEU 558 HD22 LEU 558 2.058 -0.056 -4.025
509 HD23 LEU 558 HD23 LEU 558 0.336 -0.084 -4.396
510 H GLN 559 H GLN 559 5.219 -3.156 -6.320
511 HA GLN 559 HA GLN 559 7.326 -2.531 -4.706
512 HB2 GLN 559 HB2 GLN 559 7.380 -4.188 -7.237
513 HB3 GLN 559 HB3 GLN 559 8.653 -4.189 -6.013
514 HG2 GLN 559 HG2 GLN 559 6.877 -4.802 -4.312
515 HG3 GLN 559 HG3 GLN 559 5.767 -5.034 -5.659
516 HE21 GLN 559 HE21 GLN 559 6.485 -6.693 -7.344
517 HE22 GLN 559 HE22 GLN 559 7.416 -8.010 -6.815
518 H SER 560 H SER 560 6.805 -1.451 -7.995
519 HA SER 560 HA SER 560 9.426 -0.556 -8.574
520 HB2 SER 560 HB2 SER 560 6.747 0.450 -9.558
521 HB3 SER 560 HB3 SER 560 8.303 0.915 -10.242
522 HG SER 560 HG SER 560 8.504 -1.016 -11.114
523 H TYR 561 H TYR 561 6.646 1.092 -7.069
524 HA TYR 561 HA TYR 561 7.719 3.658 -6.881
525 HB2 TYR 561 HB2 TYR 561 5.730 2.106 -5.258
526 HB3 TYR 561 HB3 TYR 561 6.321 3.625 -4.592
527 HD1 TYR 561 HD1 TYR 561 6.483 5.579 -6.511
528 HD2 TYR 561 HD2 TYR 561 3.747 2.266 -6.485
529 HE1 TYR 561 HE1 TYR 561 4.936 6.839 -7.976
530 HE2 TYR 561 HE2 TYR 561 2.201 3.530 -7.941
531 HH TYR 561 HH TYR 561 2.563 6.873 -8.548
532 H LEU 562 H LEU 562 8.586 0.763 -5.187
533 HA LEU 562 HA LEU 562 10.365 2.305 -3.378
534 HB2 LEU 562 HB2 LEU 562 9.056 -0.404 -3.139
535 HB3 LEU 562 HB3 LEU 562 10.465 0.011 -2.164
536 HG LEU 562 HG LEU 562 8.126 1.912 -2.256
537 HD11 LEU 562 HD11 LEU 562 7.259 0.710 -0.192
538 HD12 LEU 562 HD12 LEU 562 8.304 -0.639 -0.637
539 HD13 LEU 562 HD13 LEU 562 7.006 -0.136 -1.719
540 HD21 LEU 562 HD21 LEU 562 9.757 1.241 0.184
541 HD22 LEU 562 HD22 LEU 562 9.043 2.778 -0.302
542 HD23 LEU 562 HD23 LEU 562 10.510 2.205 -1.083
543 H GLU 563 H GLU 563 10.215 0.121 -6.028
544 HA GLU 563 HA GLU 563 11.808 -1.089 -7.169
545 HB2 GLU 563 HB2 GLU 563 12.432 1.401 -7.458
546 HB3 GLU 563 HB3 GLU 563 13.734 1.071 -6.316
547 HG2 GLU 563 HG2 GLU 563 14.416 -0.858 -7.822
548 HG3 GLU 563 HG3 GLU 563 13.268 -0.238 -9.006
549 H THR 564 H THR 564 11.453 -2.139 -4.665
550 HA THR 564 HA THR 564 13.711 -2.358 -3.025
551 HB THR 564 HB THR 564 11.632 -3.195 -2.208
552 HG1 THR 564 HG1 THR 564 13.768 -4.841 -2.523
553 HG21 THR 564 HG21 THR 564 11.669 -4.883 -4.714
554 HG22 THR 564 HG22 THR 564 10.451 -3.711 -4.210
555 HG23 THR 564 HG23 THR 564 10.610 -5.244 -3.351
556 H SER 565 H SER 565 15.364 -3.907 -2.893
557 HA SER 565 HA SER 565 17.113 -5.088 -3.818
558 HB2 SER 565 HB2 SER 565 16.465 -7.199 -4.831
559 HB3 SER 565 HB3 SER 565 15.396 -6.856 -3.474
560 HG SER 565 HG SER 565 14.550 -5.788 -5.851
561 H GLY 566 H GLY 566 16.473 -6.505 -6.524
562 HA2 GLY 566 HA2 GLY 566 16.618 -6.031 -8.794
563 HA3 GLY 566 HA3 GLY 566 16.412 -4.323 -8.419
564 H THR 567 H THR 567 18.847 -6.496 -7.063
565 HA THR 567 HA THR 567 20.980 -4.701 -7.417
566 HB THR 567 HB THR 567 22.427 -6.689 -6.970
567 HG1 THR 567 HG1 THR 567 19.918 -7.972 -7.211
568 HG21 THR 567 HG21 THR 567 19.988 -6.600 -5.179
569 HG22 THR 567 HG22 THR 567 21.244 -5.363 -5.169
570 HG23 THR 567 HG23 THR 567 21.637 -7.022 -4.721
571 H SER 568 H SER 568 22.041 -4.109 -9.189
572 HA SER 568 HA SER 568 22.796 -4.056 -11.360
573 HB2 SER 568 HB2 SER 568 24.320 -5.762 -10.727
574 HB3 SER 568 HB3 SER 568 23.053 -6.987 -10.682
575 HG SER 568 HG SER 568 23.253 -5.689 -13.086
576 H1 THR 876 H1 THR 876 -3.989 -17.168 6.811
577 H2 THR 876 H2 THR 876 -4.764 -15.716 6.388
578 H3 THR 876 H3 THR 876 -5.553 -16.844 7.384
579 HA THR 876 HA THR 876 -4.631 -14.877 8.579
580 HB THR 876 HB THR 876 -5.140 -16.898 9.812
581 HG1 THR 876 HG1 THR 876 -3.652 -15.252 10.707
582 HG21 THR 876 HG21 THR 876 -3.510 -18.744 9.969
583 HG22 THR 876 HG22 THR 876 -2.448 -17.900 8.840
584 HG23 THR 876 HG23 THR 876 -4.021 -18.489 8.299
585 H ASN 877 H ASN 877 -2.462 -16.789 6.661
586 HA ASN 877 HA ASN 877 -0.041 -15.595 7.673
587 HB2 ASN 877 HB2 ASN 877 -0.644 -17.307 5.259
588 HB3 ASN 877 HB3 ASN 877 0.970 -16.708 5.637
589 HD21 ASN 877 HD21 ASN 877 0.404 -19.515 5.625
590 HD22 ASN 877 HD22 ASN 877 0.519 -20.087 7.219
591 H LYS 878 H LYS 878 -1.965 -13.648 6.910
592 HA LYS 878 HA LYS 878 -1.152 -12.558 4.339
593 HB2 LYS 878 HB2 LYS 878 -2.912 -11.379 6.507
594 HB3 LYS 878 HB3 LYS 878 -2.726 -10.759 4.866
595 HG2 LYS 878 HG2 LYS 878 -3.479 -13.095 4.081
596 HG3 LYS 878 HG3 LYS 878 -3.999 -13.353 5.748
597 HD2 LYS 878 HD2 LYS 878 -4.897 -11.055 3.982
598 HD3 LYS 878 HD3 LYS 878 -5.849 -12.499 4.327
599 HE2 LYS 878 HE2 LYS 878 -6.651 -10.936 5.896
600 HE3 LYS 878 HE3 LYS 878 -5.487 -11.878 6.826
601 HZ1 LYS 878 HZ1 LYS 878 -5.480 -9.146 6.411
602 HZ2 LYS 878 HZ2 LYS 878 -4.189 -9.751 5.487
603 HZ3 LYS 878 HZ3 LYS 878 -4.271 -10.073 7.154
604 H LEU 879 H LEU 879 -1.175 -9.842 4.995
605 HA LEU 879 HA LEU 879 1.058 -9.395 6.848
606 HB2 LEU 879 HB2 LEU 879 1.010 -8.789 3.899
607 HB3 LEU 879 HB3 LEU 879 2.066 -7.910 4.990
608 HG LEU 879 HG LEU 879 2.103 -10.925 4.964
609 HD11 LEU 879 HD11 LEU 879 4.067 -10.638 3.327
610 HD12 LEU 879 HD12 LEU 879 3.406 -9.033 3.000
611 HD13 LEU 879 HD13 LEU 879 2.444 -10.473 2.655
612 HD21 LEU 879 HD21 LEU 879 3.326 -9.331 6.663
613 HD22 LEU 879 HD22 LEU 879 4.441 -9.052 5.331
614 HD23 LEU 879 HD23 LEU 879 4.215 -10.681 5.965
615 HA PRO 880 HA PRO 880 -2.104 -6.055 6.893
616 HB2 PRO 880 HB2 PRO 880 -2.410 -5.799 9.581
617 HB3 PRO 880 HB3 PRO 880 -3.207 -7.091 8.659
618 HG2 PRO 880 HG2 PRO 880 -0.762 -7.217 10.363
619 HG3 PRO 880 HG3 PRO 880 -2.067 -8.401 10.177
620 HD2 PRO 880 HD2 PRO 880 0.407 -8.560 8.894
621 HD3 PRO 880 HD3 PRO 880 -1.064 -9.393 8.344
622 H VAL 881 H VAL 881 -1.711 -3.917 6.947
623 HA VAL 881 HA VAL 881 0.723 -2.907 8.321
624 HB VAL 881 HB VAL 881 -0.339 -2.094 5.600
625 HG11 VAL 881 HG11 VAL 881 1.861 -1.011 7.370
626 HG12 VAL 881 HG12 VAL 881 0.557 -0.123 6.580
627 HG13 VAL 881 HG13 VAL 881 1.882 -0.778 5.622
628 HG21 VAL 881 HG21 VAL 881 2.004 -2.917 4.953
629 HG22 VAL 881 HG22 VAL 881 0.824 -4.156 5.392
630 HG23 VAL 881 HG23 VAL 881 2.062 -3.667 6.548
631 H SER 882 H SER 882 0.640 -0.574 8.731
632 HA SER 882 HA SER 882 -2.041 0.626 8.856
633 HB2 SER 882 HB2 SER 882 -0.398 0.428 11.381
634 HB3 SER 882 HB3 SER 882 -2.075 0.938 11.205
635 HG SER 882 HG SER 882 -1.028 -1.651 10.672
636 H ILE 883 H ILE 883 -1.963 2.727 8.441
637 HA ILE 883 HA ILE 883 0.505 4.261 8.992
638 HB ILE 883 HB ILE 883 -1.139 4.439 6.453
639 HG12 ILE 883 HG12 ILE 883 1.606 3.243 6.938
640 HG13 ILE 883 HG13 ILE 883 0.143 2.339 6.557
641 HG21 ILE 883 HG21 ILE 883 0.009 6.545 7.233
642 HG22 ILE 883 HG22 ILE 883 0.574 5.953 5.675
643 HG23 ILE 883 HG23 ILE 883 1.543 5.681 7.123
644 HD11 ILE 883 HD11 ILE 883 1.743 4.170 4.789
645 HD12 ILE 883 HD12 ILE 883 0.034 3.911 4.446
646 HD13 ILE 883 HD13 ILE 883 1.154 2.546 4.450
647 HA PRO 884 HA PRO 884 -2.681 6.916 10.729
648 HB2 PRO 884 HB2 PRO 884 -1.210 9.187 11.181
649 HB3 PRO 884 HB3 PRO 884 -1.102 7.743 12.208
650 HG2 PRO 884 HG2 PRO 884 0.718 8.643 10.022
651 HG3 PRO 884 HG3 PRO 884 1.116 7.931 11.595
652 HD2 PRO 884 HD2 PRO 884 1.127 6.483 9.274
653 HD3 PRO 884 HD3 PRO 884 0.755 5.759 10.852
654 H LEU 885 H LEU 885 -4.207 8.141 9.763
655 HA LEU 885 HA LEU 885 -4.038 8.895 7.057
656 HB2 LEU 885 HB2 LEU 885 -5.930 10.067 9.104
657 HB3 LEU 885 HB3 LEU 885 -6.181 9.936 7.364
658 HG LEU 885 HG LEU 885 -5.989 7.652 9.344
659 HD11 LEU 885 HD11 LEU 885 -8.316 7.265 8.764
660 HD12 LEU 885 HD12 LEU 885 -8.264 8.541 7.550
661 HD13 LEU 885 HD13 LEU 885 -8.135 8.947 9.261
662 HD21 LEU 885 HD21 LEU 885 -6.037 7.729 6.323
663 HD22 LEU 885 HD22 LEU 885 -6.678 6.338 7.198
664 HD23 LEU 885 HD23 LEU 885 -4.985 6.791 7.384
665 H ALA 886 H ALA 886 -2.781 10.378 9.830
666 HA ALA 886 HA ALA 886 -2.916 13.109 8.922
667 HB1 ALA 886 HB1 ALA 886 -1.182 13.412 10.782
668 HB2 ALA 886 HB2 ALA 886 -1.415 11.696 11.124
669 HB3 ALA 886 HB3 ALA 886 -2.768 12.817 11.271
670 H SER 887 H SER 887 -0.796 10.394 8.458
671 HA SER 887 HA SER 887 1.428 12.023 7.510
672 HB2 SER 887 HB2 SER 887 2.439 9.768 7.008
673 HB3 SER 887 HB3 SER 887 2.036 10.042 8.698
674 HG SER 887 HG SER 887 1.308 8.014 7.402
675 H VAL 888 H VAL 888 -1.419 10.731 6.212
676 HA VAL 888 HA VAL 888 -0.475 11.264 3.473
677 HB VAL 888 HB VAL 888 -1.864 9.228 2.767
678 HG11 VAL 888 HG11 VAL 888 0.504 9.097 2.554
679 HG12 VAL 888 HG12 VAL 888 0.033 7.640 3.427
680 HG13 VAL 888 HG13 VAL 888 0.733 9.001 4.299
681 HG21 VAL 888 HG21 VAL 888 -2.120 7.476 4.480
682 HG22 VAL 888 HG22 VAL 888 -3.004 8.928 4.950
683 HG23 VAL 888 HG23 VAL 888 -1.452 8.558 5.701
684 H VAL 889 H VAL 889 -2.714 10.693 2.114
685 HA VAL 889 HA VAL 889 -4.972 12.072 3.413
686 HB VAL 889 HB VAL 889 -4.063 12.841 0.641
687 HG11 VAL 889 HG11 VAL 889 -5.828 14.163 2.726
688 HG12 VAL 889 HG12 VAL 889 -6.384 13.360 1.256
689 HG13 VAL 889 HG13 VAL 889 -5.438 14.845 1.145
690 HG21 VAL 889 HG21 VAL 889 -3.112 14.897 1.774
691 HG22 VAL 889 HG22 VAL 889 -2.207 13.413 2.078
692 HG23 VAL 889 HG23 VAL 889 -3.294 14.052 3.311
693 H LEU 890 H LEU 890 -6.464 10.528 3.315
694 HA LEU 890 HA LEU 890 -6.653 8.748 1.011
695 HB2 LEU 890 HB2 LEU 890 -7.814 8.805 3.767
696 HB3 LEU 890 HB3 LEU 890 -8.647 7.872 2.529
697 HG LEU 890 HG LEU 890 -6.989 6.537 3.855
698 HD11 LEU 890 HD11 LEU 890 -5.880 6.619 1.068
699 HD12 LEU 890 HD12 LEU 890 -7.590 6.245 1.263
700 HD13 LEU 890 HD13 LEU 890 -6.375 5.243 2.041
701 HD21 LEU 890 HD21 LEU 890 -5.381 8.511 4.043
702 HD22 LEU 890 HD22 LEU 890 -4.878 8.140 2.395
703 HD23 LEU 890 HD23 LEU 890 -4.645 6.952 3.676
704 HA PRO 891 HA PRO 891 -9.524 11.685 -0.966
705 HB2 PRO 891 HB2 PRO 891 -10.297 9.060 -2.230
706 HB3 PRO 891 HB3 PRO 891 -10.111 10.658 -2.987
707 HG2 PRO 891 HG2 PRO 891 -8.198 8.846 -3.219
708 HG3 PRO 891 HG3 PRO 891 -7.794 10.552 -2.949
709 HD2 PRO 891 HD2 PRO 891 -7.620 8.258 -1.040
710 HD3 PRO 891 HD3 PRO 891 -6.650 9.747 -1.100
711 H SER 892 H SER 892 -11.938 11.786 -1.201
712 HA SER 892 HA SER 892 -13.548 9.935 0.323
713 HB2 SER 892 HB2 SER 892 -12.845 11.102 2.239
714 HB3 SER 892 HB3 SER 892 -12.833 12.652 1.405
715 HG SER 892 HG SER 892 -15.213 11.165 1.664
716 H ARG 893 H ARG 893 -13.678 13.396 -0.551
717 HA ARG 893 HA ARG 893 -16.364 13.109 -1.582
718 HB2 ARG 893 HB2 ARG 893 -14.558 15.504 -1.908
719 HB3 ARG 893 HB3 ARG 893 -16.321 15.463 -1.886
720 HG2 ARG 893 HG2 ARG 893 -14.478 14.864 0.447
721 HG3 ARG 893 HG3 ARG 893 -15.517 16.278 0.268
722 HD2 ARG 893 HD2 ARG 893 -16.315 13.413 0.742
723 HD3 ARG 893 HD3 ARG 893 -16.770 14.847 1.659
724 HE ARG 893 HE ARG 893 -17.811 15.300 -0.832
725 HH11 ARG 893 HH11 ARG 893 -17.966 12.734 1.485
726 HH12 ARG 893 HH12 ARG 893 -19.562 12.236 1.034
727 HH21 ARG 893 HH21 ARG 893 -19.907 14.655 -1.427
728 HH22 ARG 893 HH22 ARG 893 -20.661 13.324 -0.614
729 H ALA 894 H ALA 894 -13.621 12.022 -2.800
730 HA ALA 894 HA ALA 894 -12.810 11.561 -4.901
731 HB1 ALA 894 HB1 ALA 894 -14.885 10.454 -5.285
732 HB2 ALA 894 HB2 ALA 894 -14.598 11.456 -6.708
733 HB3 ALA 894 HB3 ALA 894 -15.744 11.982 -5.474
734 H GLU 895 H GLU 895 -11.395 13.052 -5.587
735 HA GLU 895 HA GLU 895 -11.930 15.781 -6.007
736 HB2 GLU 895 HB2 GLU 895 -9.756 14.003 -7.132
737 HB3 GLU 895 HB3 GLU 895 -9.777 15.759 -7.291
738 HG2 GLU 895 HG2 GLU 895 -8.416 15.234 -5.374
739 HG3 GLU 895 HG3 GLU 895 -9.936 15.896 -4.774
740 H ARG 896 H ARG 896 -12.861 13.095 -7.825
741 HA ARG 896 HA ARG 896 -12.783 14.275 -10.440
742 HB2 ARG 896 HB2 ARG 896 -12.790 11.850 -10.182
743 HB3 ARG 896 HB3 ARG 896 -14.352 11.920 -9.365
744 HG2 ARG 896 HG2 ARG 896 -15.469 12.653 -11.337
745 HG3 ARG 896 HG3 ARG 896 -13.948 13.017 -12.152
746 HD2 ARG 896 HD2 ARG 896 -14.787 10.238 -11.288
747 HD3 ARG 896 HD3 ARG 896 -15.007 10.872 -12.916
748 HE ARG 896 HE ARG 896 -12.545 9.927 -11.769
749 HH11 ARG 896 HH11 ARG 896 -13.988 12.142 -14.000
750 HH12 ARG 896 HH12 ARG 896 -12.590 12.247 -15.016
751 HH21 ARG 896 HH21 ARG 896 -10.705 10.059 -13.095
752 HH22 ARG 896 HH22 ARG 896 -10.731 11.067 -14.503
753 H ALA 897 H ALA 897 -14.184 15.647 -11.341
754 HA ALA 897 HA ALA 897 -15.975 17.070 -11.569
755 HB1 ALA 897 HB1 ALA 897 -18.196 16.054 -11.234
756 HB2 ALA 897 HB2 ALA 897 -17.443 14.695 -10.400
757 HB3 ALA 897 HB3 ALA 897 -17.117 14.969 -12.111
758 H ARG 898 H ARG 898 -14.473 17.574 -9.309
759 HA ARG 898 HA ARG 898 -16.138 17.762 -6.969
760 HB2 ARG 898 HB2 ARG 898 -14.267 18.943 -5.976
761 HB3 ARG 898 HB3 ARG 898 -13.652 17.554 -6.873
762 HG2 ARG 898 HG2 ARG 898 -13.341 19.153 -8.848
763 HG3 ARG 898 HG3 ARG 898 -13.617 20.463 -7.698
764 HD2 ARG 898 HD2 ARG 898 -11.766 19.528 -6.285
765 HD3 ARG 898 HD3 ARG 898 -11.435 18.365 -7.565
766 HE ARG 898 HE ARG 898 -10.431 20.070 -8.785
767 HH11 ARG 898 HH11 ARG 898 -12.347 21.339 -6.198
768 HH12 ARG 898 HH12 ARG 898 -11.799 22.969 -6.408
769 HH21 ARG 898 HH21 ARG 898 -9.709 22.206 -9.066
770 HH22 ARG 898 HH22 ARG 898 -10.306 23.460 -8.032
771 H SER 899 H SER 899 -16.738 19.162 -9.683
772 HA SER 899 HA SER 899 -17.759 21.101 -10.365
773 HB2 SER 899 HB2 SER 899 -18.157 21.638 -7.419
774 HB3 SER 899 HB3 SER 899 -19.116 22.261 -8.759
775 HG SER 899 HG SER 899 -20.008 20.395 -7.639
776 H THR 900 H THR 900 -16.588 22.682 -11.224
777 HA THR 900 HA THR 900 -15.035 24.362 -11.469
778 HB THR 900 HB THR 900 -15.845 25.017 -8.627
779 HG1 THR 900 HG1 THR 900 -16.947 26.253 -10.863
780 HG21 THR 900 HG21 THR 900 -15.294 27.338 -9.377
781 HG22 THR 900 HG22 THR 900 -14.682 26.666 -10.888
782 HG23 THR 900 HG23 THR 900 -13.894 26.267 -9.360
Start of MODEL 4
1 H1 ASP 500 H1 ASP 500 5.506 -22.081 -5.975
2 H2 ASP 500 H2 ASP 500 6.696 -20.874 -6.094
3 H3 ASP 500 H3 ASP 500 5.779 -21.305 -7.458
4 HA ASP 500 HA ASP 500 4.812 -19.324 -6.768
5 HB2 ASP 500 HB2 ASP 500 3.240 -21.506 -5.368
6 HB3 ASP 500 HB3 ASP 500 2.606 -19.987 -6.000
7 H LYS 501 H LYS 501 6.585 -20.866 -4.477
8 HA LYS 501 HA LYS 501 5.502 -19.627 -2.099
9 HB2 LYS 501 HB2 LYS 501 8.215 -20.910 -2.472
10 HB3 LYS 501 HB3 LYS 501 7.364 -20.630 -0.951
11 HG2 LYS 501 HG2 LYS 501 5.484 -22.094 -1.929
12 HG3 LYS 501 HG3 LYS 501 6.662 -22.580 -3.150
13 HD2 LYS 501 HD2 LYS 501 7.007 -22.862 -0.149
14 HD3 LYS 501 HD3 LYS 501 6.653 -24.174 -1.272
15 HE2 LYS 501 HE2 LYS 501 8.990 -24.309 -1.002
16 HE3 LYS 501 HE3 LYS 501 8.811 -23.408 -2.507
17 HZ1 LYS 501 HZ1 LYS 501 9.833 -21.683 -1.599
18 HZ2 LYS 501 HZ2 LYS 501 10.124 -22.606 -0.202
19 HZ3 LYS 501 HZ3 LYS 501 8.731 -21.638 -0.311
20 H ALA 502 H ALA 502 7.310 -18.526 -4.686
21 HA ALA 502 HA ALA 502 9.096 -16.759 -3.289
22 HB1 ALA 502 HB1 ALA 502 9.374 -15.734 -5.577
23 HB2 ALA 502 HB2 ALA 502 8.192 -16.901 -6.170
24 HB3 ALA 502 HB3 ALA 502 9.723 -17.461 -5.496
25 H TYR 503 H TYR 503 5.937 -16.439 -4.856
26 HA TYR 503 HA TYR 503 5.559 -13.729 -4.901
27 HB2 TYR 503 HB2 TYR 503 3.899 -15.562 -5.541
28 HB3 TYR 503 HB3 TYR 503 3.435 -15.597 -3.839
29 HD1 TYR 503 HD1 TYR 503 4.050 -13.107 -6.580
30 HD2 TYR 503 HD2 TYR 503 1.689 -14.188 -3.157
31 HE1 TYR 503 HE1 TYR 503 2.618 -11.121 -6.941
32 HE2 TYR 503 HE2 TYR 503 0.254 -12.200 -3.522
33 HH TYR 503 HH TYR 503 0.605 -9.869 -4.678
34 H LEU 504 H LEU 504 4.607 -15.760 -2.107
35 HA LEU 504 HA LEU 504 3.941 -13.823 -0.303
36 HB2 LEU 504 HB2 LEU 504 5.374 -16.448 0.072
37 HB3 LEU 504 HB3 LEU 504 4.981 -15.424 1.451
38 HG LEU 504 HG LEU 504 2.597 -15.443 0.767
39 HD11 LEU 504 HD11 LEU 504 2.660 -15.760 -1.583
40 HD12 LEU 504 HD12 LEU 504 2.009 -17.273 -0.958
41 HD13 LEU 504 HD13 LEU 504 3.701 -17.177 -1.447
42 HD21 LEU 504 HD21 LEU 504 3.991 -18.100 1.165
43 HD22 LEU 504 HD22 LEU 504 2.236 -17.937 1.192
44 HD23 LEU 504 HD23 LEU 504 3.218 -17.092 2.388
45 H ASP 505 H ASP 505 7.221 -15.077 -0.845
46 HA ASP 505 HA ASP 505 8.652 -13.575 0.962
47 HB2 ASP 505 HB2 ASP 505 9.648 -14.018 -1.848
48 HB3 ASP 505 HB3 ASP 505 10.573 -13.987 -0.348
49 H GLU 506 H GLU 506 7.605 -12.603 -2.295
50 HA GLU 506 HA GLU 506 8.865 -10.093 -2.357
51 HB2 GLU 506 HB2 GLU 506 6.235 -10.853 -3.644
52 HB3 GLU 506 HB3 GLU 506 7.290 -9.523 -4.119
53 HG2 GLU 506 HG2 GLU 506 8.140 -12.430 -4.108
54 HG3 GLU 506 HG3 GLU 506 7.559 -11.580 -5.539
55 H LEU 507 H LEU 507 6.010 -11.193 -0.717
56 HA LEU 507 HA LEU 507 4.995 -8.521 -0.187
57 HB2 LEU 507 HB2 LEU 507 4.142 -11.071 1.182
58 HB3 LEU 507 HB3 LEU 507 3.207 -9.601 0.923
59 HG LEU 507 HG LEU 507 4.104 -11.588 -1.182
60 HD11 LEU 507 HD11 LEU 507 1.426 -10.742 -0.057
61 HD12 LEU 507 HD12 LEU 507 2.138 -12.353 -0.049
62 HD13 LEU 507 HD13 LEU 507 1.584 -11.641 -1.565
63 HD21 LEU 507 HD21 LEU 507 4.319 -9.456 -2.227
64 HD22 LEU 507 HD22 LEU 507 2.884 -8.829 -1.417
65 HD23 LEU 507 HD23 LEU 507 2.719 -10.030 -2.696
66 H VAL 508 H VAL 508 6.573 -11.142 1.639
67 HA VAL 508 HA VAL 508 6.565 -9.988 4.166
68 HB VAL 508 HB VAL 508 8.740 -11.678 2.914
69 HG11 VAL 508 HG11 VAL 508 9.579 -10.644 4.923
70 HG12 VAL 508 HG12 VAL 508 9.129 -12.297 5.341
71 HG13 VAL 508 HG13 VAL 508 8.069 -10.956 5.779
72 HG21 VAL 508 HG21 VAL 508 7.509 -13.506 4.155
73 HG22 VAL 508 HG22 VAL 508 6.603 -12.814 2.808
74 HG23 VAL 508 HG23 VAL 508 6.218 -12.344 4.464
75 H GLU 509 H GLU 509 9.168 -9.783 1.733
76 HA GLU 509 HA GLU 509 10.827 -8.003 3.105
77 HB2 GLU 509 HB2 GLU 509 11.529 -9.181 1.066
78 HB3 GLU 509 HB3 GLU 509 10.394 -8.225 0.113
79 HG2 GLU 509 HG2 GLU 509 11.580 -6.193 0.585
80 HG3 GLU 509 HG3 GLU 509 12.580 -6.987 1.801
81 H LEU 510 H LEU 510 8.306 -7.263 0.669
82 HA LEU 510 HA LEU 510 8.529 -4.478 0.766
83 HB2 LEU 510 HB2 LEU 510 6.570 -6.443 -0.192
84 HB3 LEU 510 HB3 LEU 510 5.773 -4.997 0.414
85 HG LEU 510 HG LEU 510 7.352 -3.642 -1.039
86 HD11 LEU 510 HD11 LEU 510 8.980 -5.620 -1.233
87 HD12 LEU 510 HD12 LEU 510 8.652 -4.719 -2.714
88 HD13 LEU 510 HD13 LEU 510 7.866 -6.273 -2.434
89 HD21 LEU 510 HD21 LEU 510 6.030 -3.951 -3.019
90 HD22 LEU 510 HD22 LEU 510 4.974 -4.317 -1.657
91 HD23 LEU 510 HD23 LEU 510 5.681 -5.628 -2.601
92 H HIS 511 H HIS 511 6.343 -6.608 2.587
93 HA HIS 511 HA HIS 511 5.098 -4.749 4.198
94 HB2 HIS 511 HB2 HIS 511 4.416 -7.065 4.171
95 HB3 HIS 511 HB3 HIS 511 5.965 -7.578 4.838
96 HD1 HIS 511 HD1 HIS 511 3.011 -5.377 5.774
97 HD2 HIS 511 HD2 HIS 511 6.006 -7.621 7.608
98 HE1 HIS 511 HE1 HIS 511 2.564 -5.276 8.268
99 HE2 HIS 511 HE2 HIS 511 4.372 -6.650 9.399
100 H ARG 512 H ARG 512 8.005 -6.636 5.017
101 HA ARG 512 HA ARG 512 8.624 -5.488 7.451
102 HB2 ARG 512 HB2 ARG 512 9.751 -7.451 6.283
103 HB3 ARG 512 HB3 ARG 512 10.669 -6.262 5.369
104 HG2 ARG 512 HG2 ARG 512 12.130 -6.634 7.138
105 HG3 ARG 512 HG3 ARG 512 11.214 -5.266 7.764
106 HD2 ARG 512 HD2 ARG 512 10.435 -8.138 8.343
107 HD3 ARG 512 HD3 ARG 512 11.547 -7.235 9.361
108 HE ARG 512 HE ARG 512 9.416 -5.573 9.225
109 HH11 ARG 512 HH11 ARG 512 9.776 -8.953 9.870
110 HH12 ARG 512 HH12 ARG 512 8.410 -9.038 10.931
111 HH21 ARG 512 HH21 ARG 512 7.623 -5.676 10.616
112 HH22 ARG 512 HH22 ARG 512 7.192 -7.182 11.353
113 H ARG 513 H ARG 513 9.893 -4.531 4.262
114 HA ARG 513 HA ARG 513 11.333 -2.287 5.120
115 HB2 ARG 513 HB2 ARG 513 11.450 -3.425 2.858
116 HB3 ARG 513 HB3 ARG 513 9.977 -2.551 2.435
117 HG2 ARG 513 HG2 ARG 513 11.197 -0.418 3.111
118 HG3 ARG 513 HG3 ARG 513 12.671 -1.385 3.169
119 HD2 ARG 513 HD2 ARG 513 10.860 -1.092 0.756
120 HD3 ARG 513 HD3 ARG 513 12.407 -0.277 0.974
121 HE ARG 513 HE ARG 513 13.024 -2.923 1.269
122 HH11 ARG 513 HH11 ARG 513 11.351 -1.033 -1.098
123 HH12 ARG 513 HH12 ARG 513 11.798 -2.050 -2.427
124 HH21 ARG 513 HH21 ARG 513 13.614 -4.262 -0.470
125 HH22 ARG 513 HH22 ARG 513 13.079 -3.878 -2.072
126 H LEU 514 H LEU 514 7.960 -2.604 4.075
127 HA LEU 514 HA LEU 514 7.341 0.142 4.030
128 HB2 LEU 514 HB2 LEU 514 5.722 -2.372 4.319
129 HB3 LEU 514 HB3 LEU 514 4.935 -0.808 4.515
130 HG LEU 514 HG LEU 514 6.684 -1.271 2.099
131 HD11 LEU 514 HD11 LEU 514 3.811 -2.192 2.416
132 HD12 LEU 514 HD12 LEU 514 5.213 -3.217 2.107
133 HD13 LEU 514 HD13 LEU 514 4.664 -2.078 0.876
134 HD21 LEU 514 HD21 LEU 514 5.318 0.422 1.121
135 HD22 LEU 514 HD22 LEU 514 5.598 0.974 2.771
136 HD23 LEU 514 HD23 LEU 514 4.062 0.227 2.344
137 H MET 515 H MET 515 7.039 -2.276 6.604
138 HA MET 515 HA MET 515 5.764 -0.772 8.530
139 HB2 MET 515 HB2 MET 515 6.395 -3.211 8.664
140 HB3 MET 515 HB3 MET 515 8.016 -2.689 9.122
141 HG2 MET 515 HG2 MET 515 7.121 -1.499 11.062
142 HG3 MET 515 HG3 MET 515 5.475 -1.915 10.586
143 HE1 MET 515 HE1 MET 515 4.341 -3.575 12.062
144 HE2 MET 515 HE2 MET 515 5.385 -2.604 13.096
145 HE3 MET 515 HE3 MET 515 5.276 -4.343 13.352
146 H THR 516 H THR 516 9.188 -0.787 7.707
147 HA THR 516 HA THR 516 9.780 1.188 9.796
148 HB THR 516 HB THR 516 12.108 0.888 9.113
149 HG1 THR 516 HG1 THR 516 11.351 -1.098 7.305
150 HG21 THR 516 HG21 THR 516 12.359 -1.423 9.766
151 HG22 THR 516 HG22 THR 516 10.718 -1.799 9.240
152 HG23 THR 516 HG23 THR 516 10.979 -0.764 10.645
153 H LEU 517 H LEU 517 9.143 0.994 6.389
154 HA LEU 517 HA LEU 517 10.468 3.221 5.411
155 HB2 LEU 517 HB2 LEU 517 9.143 1.629 4.032
156 HB3 LEU 517 HB3 LEU 517 7.668 2.358 4.664
157 HG LEU 517 HG LEU 517 8.403 4.560 3.741
158 HD11 LEU 517 HD11 LEU 517 10.725 4.546 3.540
159 HD12 LEU 517 HD12 LEU 517 10.258 4.222 1.874
160 HD13 LEU 517 HD13 LEU 517 10.771 2.896 2.917
161 HD21 LEU 517 HD21 LEU 517 7.782 4.055 1.485
162 HD22 LEU 517 HD22 LEU 517 6.964 2.860 2.492
163 HD23 LEU 517 HD23 LEU 517 8.422 2.416 1.606
164 H ARG 518 H ARG 518 10.329 5.352 5.726
165 HA ARG 518 HA ARG 518 7.854 6.499 6.862
166 HB2 ARG 518 HB2 ARG 518 9.724 6.046 8.612
167 HB3 ARG 518 HB3 ARG 518 10.571 7.379 7.833
168 HG2 ARG 518 HG2 ARG 518 9.388 8.539 9.472
169 HG3 ARG 518 HG3 ARG 518 8.244 8.630 8.136
170 HD2 ARG 518 HD2 ARG 518 6.910 7.915 9.937
171 HD3 ARG 518 HD3 ARG 518 7.279 6.412 9.101
172 HE ARG 518 HE ARG 518 9.222 6.979 11.122
173 HH11 ARG 518 HH11 ARG 518 6.003 5.844 10.546
174 HH12 ARG 518 HH12 ARG 518 5.944 4.866 11.974
175 HH21 ARG 518 HH21 ARG 518 9.151 5.698 12.997
176 HH22 ARG 518 HH22 ARG 518 7.726 4.783 13.362
177 H GLU 519 H GLU 519 7.785 6.931 4.459
178 HA GLU 519 HA GLU 519 8.958 9.588 3.947
179 HB2 GLU 519 HB2 GLU 519 10.329 7.714 2.865
180 HB3 GLU 519 HB3 GLU 519 8.928 7.433 1.833
181 HG2 GLU 519 HG2 GLU 519 10.253 8.942 0.586
182 HG3 GLU 519 HG3 GLU 519 9.029 9.969 1.332
183 H ARG 520 H ARG 520 6.884 10.428 4.327
184 HA ARG 520 HA ARG 520 4.447 9.628 3.396
185 HB2 ARG 520 HB2 ARG 520 5.515 12.454 3.525
186 HB3 ARG 520 HB3 ARG 520 3.810 12.027 3.373
187 HG2 ARG 520 HG2 ARG 520 3.883 10.820 5.496
188 HG3 ARG 520 HG3 ARG 520 5.613 11.132 5.640
189 HD2 ARG 520 HD2 ARG 520 5.260 13.485 5.889
190 HD3 ARG 520 HD3 ARG 520 3.570 13.350 5.412
191 HE ARG 520 HE ARG 520 3.078 12.804 7.606
192 HH11 ARG 520 HH11 ARG 520 6.421 12.224 6.930
193 HH12 ARG 520 HH12 ARG 520 6.822 11.809 8.563
194 HH21 ARG 520 HH21 ARG 520 3.596 12.260 9.749
195 HH22 ARG 520 HH22 ARG 520 5.223 11.829 10.159
196 H HIS 521 H HIS 521 7.096 10.822 1.507
197 HA HIS 521 HA HIS 521 5.690 11.724 -0.767
198 HB2 HIS 521 HB2 HIS 521 8.181 12.014 -0.206
199 HB3 HIS 521 HB3 HIS 521 8.397 10.395 -0.869
200 HD1 HIS 521 HD1 HIS 521 5.975 12.961 -2.241
201 HD2 HIS 521 HD2 HIS 521 9.574 11.143 -3.305
202 HE1 HIS 521 HE1 HIS 521 6.443 13.644 -4.635
203 HE2 HIS 521 HE2 HIS 521 8.634 12.545 -5.298
204 H ILE 522 H ILE 522 6.876 8.509 0.149
205 HA ILE 522 HA ILE 522 5.928 7.324 -2.339
206 HB ILE 522 HB ILE 522 7.011 5.945 0.126
207 HG12 ILE 522 HG12 ILE 522 8.683 7.554 -0.486
208 HG13 ILE 522 HG13 ILE 522 9.209 6.011 -1.154
209 HG21 ILE 522 HG21 ILE 522 6.659 5.172 -2.770
210 HG22 ILE 522 HG22 ILE 522 6.068 4.346 -1.330
211 HG23 ILE 522 HG23 ILE 522 7.787 4.325 -1.713
212 HD11 ILE 522 HD11 ILE 522 8.000 8.369 -2.593
213 HD12 ILE 522 HD12 ILE 522 7.978 6.755 -3.308
214 HD13 ILE 522 HD13 ILE 522 9.516 7.533 -2.934
215 H LEU 523 H LEU 523 5.267 6.918 1.121
216 HA LEU 523 HA LEU 523 3.198 5.113 1.063
217 HB2 LEU 523 HB2 LEU 523 3.735 7.490 2.827
218 HB3 LEU 523 HB3 LEU 523 2.262 6.551 3.052
219 HG LEU 523 HG LEU 523 3.569 4.514 3.375
220 HD11 LEU 523 HD11 LEU 523 5.912 6.340 2.797
221 HD12 LEU 523 HD12 LEU 523 5.441 4.884 1.919
222 HD13 LEU 523 HD13 LEU 523 6.087 4.758 3.554
223 HD21 LEU 523 HD21 LEU 523 3.170 6.197 5.271
224 HD22 LEU 523 HD22 LEU 523 4.850 6.685 5.047
225 HD23 LEU 523 HD23 LEU 523 4.469 5.031 5.525
226 H GLN 524 H GLN 524 3.210 8.303 -0.230
227 HA GLN 524 HA GLN 524 0.319 8.590 -0.227
228 HB2 GLN 524 HB2 GLN 524 1.973 10.519 -0.136
229 HB3 GLN 524 HB3 GLN 524 2.305 10.201 -1.838
230 HG2 GLN 524 HG2 GLN 524 0.603 11.883 -1.796
231 HG3 GLN 524 HG3 GLN 524 -0.201 10.378 -2.235
232 HE21 GLN 524 HE21 GLN 524 -1.696 9.448 -0.706
233 HE22 GLN 524 HE22 GLN 524 -2.170 10.265 0.704
234 H GLN 525 H GLN 525 2.848 7.794 -2.580
235 HA GLN 525 HA GLN 525 1.167 7.667 -4.851
236 HB2 GLN 525 HB2 GLN 525 3.744 6.167 -4.327
237 HB3 GLN 525 HB3 GLN 525 3.001 6.442 -5.903
238 HG2 GLN 525 HG2 GLN 525 3.797 8.697 -4.049
239 HG3 GLN 525 HG3 GLN 525 4.872 8.053 -5.287
240 HE21 GLN 525 HE21 GLN 525 4.231 8.357 -7.564
241 HE22 GLN 525 HE22 GLN 525 3.083 9.534 -7.986
242 H ILE 526 H ILE 526 2.404 5.076 -2.734
243 HA ILE 526 HA ILE 526 1.105 2.929 -3.985
244 HB ILE 526 HB ILE 526 2.038 3.387 -1.148
245 HG12 ILE 526 HG12 ILE 526 3.689 1.642 -1.821
246 HG13 ILE 526 HG13 ILE 526 2.964 1.608 -3.427
247 HG21 ILE 526 HG21 ILE 526 0.301 1.857 -0.737
248 HG22 ILE 526 HG22 ILE 526 1.694 0.806 -0.983
249 HG23 ILE 526 HG23 ILE 526 0.522 1.040 -2.281
250 HD11 ILE 526 HD11 ILE 526 3.932 4.204 -2.246
251 HD12 ILE 526 HD12 ILE 526 3.696 3.781 -3.940
252 HD13 ILE 526 HD13 ILE 526 5.055 3.107 -3.044
253 H VAL 527 H VAL 527 0.074 4.642 -1.022
254 HA VAL 527 HA VAL 527 -2.333 3.483 -0.554
255 HB VAL 527 HB VAL 527 -1.621 6.416 -0.367
256 HG11 VAL 527 HG11 VAL 527 -3.532 6.398 1.347
257 HG12 VAL 527 HG12 VAL 527 -4.046 4.889 0.594
258 HG13 VAL 527 HG13 VAL 527 -4.003 6.377 -0.353
259 HG21 VAL 527 HG21 VAL 527 -0.983 5.949 1.844
260 HG22 VAL 527 HG22 VAL 527 -0.412 4.516 0.984
261 HG23 VAL 527 HG23 VAL 527 -1.914 4.451 1.905
262 H ASN 528 H ASN 528 -2.005 6.401 -2.607
263 HA ASN 528 HA ASN 528 -4.633 6.417 -3.558
264 HB2 ASN 528 HB2 ASN 528 -2.072 7.445 -4.785
265 HB3 ASN 528 HB3 ASN 528 -3.670 7.759 -5.463
266 HD21 ASN 528 HD21 ASN 528 -1.588 9.567 -4.022
267 HD22 ASN 528 HD22 ASN 528 -2.513 10.360 -2.840
268 H LEU 529 H LEU 529 -1.914 4.448 -4.470
269 HA LEU 529 HA LEU 529 -2.809 3.708 -7.061
270 HB2 LEU 529 HB2 LEU 529 -0.472 3.406 -5.878
271 HB3 LEU 529 HB3 LEU 529 -1.146 1.868 -5.359
272 HG LEU 529 HG LEU 529 0.069 1.520 -7.424
273 HD11 LEU 529 HD11 LEU 529 -2.841 1.563 -8.216
274 HD12 LEU 529 HD12 LEU 529 -2.212 0.417 -7.030
275 HD13 LEU 529 HD13 LEU 529 -1.597 0.405 -8.682
276 HD21 LEU 529 HD21 LEU 529 -1.727 3.284 -9.052
277 HD22 LEU 529 HD22 LEU 529 -0.038 2.858 -9.300
278 HD23 LEU 529 HD23 LEU 529 -0.466 4.078 -8.106
279 H ILE 530 H ILE 530 -2.859 1.832 -4.022
280 HA ILE 530 HA ILE 530 -4.597 -0.140 -5.135
281 HB ILE 530 HB ILE 530 -4.615 -1.170 -2.979
282 HG12 ILE 530 HG12 ILE 530 -3.219 0.297 -1.151
283 HG13 ILE 530 HG13 ILE 530 -4.002 1.606 -2.021
284 HG21 ILE 530 HG21 ILE 530 -1.908 0.151 -3.277
285 HG22 ILE 530 HG22 ILE 530 -2.489 -1.103 -4.373
286 HG23 ILE 530 HG23 ILE 530 -2.262 -1.464 -2.661
287 HD11 ILE 530 HD11 ILE 530 -6.157 0.052 -1.701
288 HD12 ILE 530 HD12 ILE 530 -5.624 1.146 -0.427
289 HD13 ILE 530 HD13 ILE 530 -5.208 -0.564 -0.351
290 H GLU 531 H GLU 531 -5.104 2.570 -2.931
291 HA GLU 531 HA GLU 531 -7.750 2.307 -2.251
292 HB2 GLU 531 HB2 GLU 531 -6.144 4.747 -2.990
293 HB3 GLU 531 HB3 GLU 531 -7.839 4.891 -2.534
294 HG2 GLU 531 HG2 GLU 531 -5.813 3.438 -0.826
295 HG3 GLU 531 HG3 GLU 531 -6.156 5.155 -0.639
296 H GLU 532 H GLU 532 -6.461 3.617 -5.292
297 HA GLU 532 HA GLU 532 -8.963 4.172 -6.498
298 HB2 GLU 532 HB2 GLU 532 -6.199 3.678 -7.614
299 HB3 GLU 532 HB3 GLU 532 -7.582 4.030 -8.651
300 HG2 GLU 532 HG2 GLU 532 -6.850 5.799 -6.313
301 HG3 GLU 532 HG3 GLU 532 -6.157 6.037 -7.917
302 H THR 533 H THR 533 -6.907 1.331 -6.401
303 HA THR 533 HA THR 533 -8.333 -0.196 -8.338
304 HB THR 533 HB THR 533 -6.658 -1.247 -6.051
305 HG1 THR 533 HG1 THR 533 -5.223 -1.182 -8.178
306 HG21 THR 533 HG21 THR 533 -7.904 -2.969 -7.229
307 HG22 THR 533 HG22 THR 533 -6.210 -3.067 -7.706
308 HG23 THR 533 HG23 THR 533 -7.388 -2.324 -8.786
309 H GLY 534 H GLY 534 -8.306 -0.277 -4.782
310 HA2 GLY 534 HA2 GLY 534 -10.380 -0.418 -3.525
311 HA3 GLY 534 HA3 GLY 534 -11.047 -1.415 -4.818
312 H HIS 535 H HIS 535 -9.490 -1.419 -1.835
313 HA HIS 535 HA HIS 535 -9.729 -4.039 -1.180
314 HB2 HIS 535 HB2 HIS 535 -7.419 -3.645 -3.019
315 HB3 HIS 535 HB3 HIS 535 -7.061 -4.595 -1.582
316 HD1 HIS 535 HD1 HIS 535 -9.564 -6.230 -1.198
317 HD2 HIS 535 HD2 HIS 535 -7.923 -5.535 -4.968
318 HE1 HIS 535 HE1 HIS 535 -10.412 -8.083 -2.703
319 HE2 HIS 535 HE2 HIS 535 -9.421 -7.672 -5.004
320 H PHE 536 H PHE 536 -10.028 -2.125 0.442
321 HA PHE 536 HA PHE 536 -7.809 -2.308 2.323
322 HB2 PHE 536 HB2 PHE 536 -7.665 0.139 2.631
323 HB3 PHE 536 HB3 PHE 536 -7.173 -0.347 1.009
324 HD1 PHE 536 HD1 PHE 536 -10.040 0.997 2.988
325 HD2 PHE 536 HD2 PHE 536 -8.320 0.455 -0.910
326 HE1 PHE 536 HE1 PHE 536 -11.772 2.480 2.018
327 HE2 PHE 536 HE2 PHE 536 -10.050 1.941 -1.880
328 HZ PHE 536 HZ PHE 536 -11.778 2.953 -0.417
329 H HIS 537 H HIS 537 -8.345 -1.452 4.421
330 HA HIS 537 HA HIS 537 -11.246 -1.163 4.959
331 HB2 HIS 537 HB2 HIS 537 -9.369 -2.655 6.796
332 HB3 HIS 537 HB3 HIS 537 -11.133 -2.648 6.797
333 HD1 HIS 537 HD1 HIS 537 -8.403 -4.701 5.773
334 HD2 HIS 537 HD2 HIS 537 -12.107 -3.771 4.098
335 HE1 HIS 537 HE1 HIS 537 -8.895 -6.511 4.071
336 HE2 HIS 537 HE2 HIS 537 -11.149 -5.959 3.041
337 H ILE 538 H ILE 538 -11.069 1.062 5.216
338 HA ILE 538 HA ILE 538 -9.122 2.123 7.149
339 HB ILE 538 HB ILE 538 -11.078 3.449 5.258
340 HG12 ILE 538 HG12 ILE 538 -8.063 3.648 5.395
341 HG13 ILE 538 HG13 ILE 538 -8.882 2.429 4.424
342 HG21 ILE 538 HG21 ILE 538 -11.018 4.878 7.172
343 HG22 ILE 538 HG22 ILE 538 -9.865 5.567 6.031
344 HG23 ILE 538 HG23 ILE 538 -9.289 4.618 7.400
345 HD11 ILE 538 HD11 ILE 538 -8.391 4.337 3.007
346 HD12 ILE 538 HD12 ILE 538 -9.145 5.435 4.160
347 HD13 ILE 538 HD13 ILE 538 -10.133 4.276 3.272
348 H THR 539 H THR 539 -9.656 2.675 9.172
349 HA THR 539 HA THR 539 -12.462 3.118 9.916
350 HB THR 539 HB THR 539 -12.550 1.445 11.560
351 HG1 THR 539 HG1 THR 539 -10.471 0.197 11.871
352 HG21 THR 539 HG21 THR 539 -10.918 0.211 9.326
353 HG22 THR 539 HG22 THR 539 -12.648 0.547 9.234
354 HG23 THR 539 HG23 THR 539 -12.038 -0.632 10.396
355 H ASN 540 H ASN 540 -12.627 3.899 12.196
356 HA ASN 540 HA ASN 540 -12.105 5.660 13.607
357 HB2 ASN 540 HB2 ASN 540 -9.635 3.919 13.766
358 HB3 ASN 540 HB3 ASN 540 -9.997 5.227 14.892
359 HD21 ASN 540 HD21 ASN 540 -9.868 2.254 15.414
360 HD22 ASN 540 HD22 ASN 540 -11.383 1.855 16.066
361 H THR 541 H THR 541 -8.725 5.318 13.037
362 HA THR 541 HA THR 541 -8.604 7.456 11.058
363 HB THR 541 HB THR 541 -7.110 8.844 12.491
364 HG1 THR 541 HG1 THR 541 -7.135 6.741 13.995
365 HG21 THR 541 HG21 THR 541 -8.881 9.925 13.667
366 HG22 THR 541 HG22 THR 541 -9.790 8.423 13.821
367 HG23 THR 541 HG23 THR 541 -9.629 9.198 12.245
368 H THR 542 H THR 542 -7.730 5.522 9.971
369 HA THR 542 HA THR 542 -4.908 5.592 9.883
370 HB THR 542 HB THR 542 -5.331 2.824 10.625
371 HG1 THR 542 HG1 THR 542 -6.009 3.134 12.739
372 HG21 THR 542 HG21 THR 542 -3.849 5.050 12.062
373 HG22 THR 542 HG22 THR 542 -3.184 4.069 10.756
374 HG23 THR 542 HG23 THR 542 -3.607 3.318 12.294
375 H PHE 543 H PHE 543 -4.041 3.892 8.375
376 HA PHE 543 HA PHE 543 -6.105 2.973 6.449
377 HB2 PHE 543 HB2 PHE 543 -5.081 4.847 5.393
378 HB3 PHE 543 HB3 PHE 543 -3.472 4.364 5.925
379 HD1 PHE 543 HD1 PHE 543 -6.359 3.159 3.851
380 HD2 PHE 543 HD2 PHE 543 -2.115 3.081 4.498
381 HE1 PHE 543 HE1 PHE 543 -6.061 1.842 1.770
382 HE2 PHE 543 HE2 PHE 543 -1.818 1.768 2.416
383 HZ PHE 543 HZ PHE 543 -3.793 1.150 1.051
384 H ASP 544 H ASP 544 -6.130 0.826 6.943
385 HA ASP 544 HA ASP 544 -3.556 -0.619 7.093
386 HB2 ASP 544 HB2 ASP 544 -5.290 -0.829 8.946
387 HB3 ASP 544 HB3 ASP 544 -6.292 -1.688 7.778
388 H PHE 545 H PHE 545 -3.081 -2.271 5.714
389 HA PHE 545 HA PHE 545 -5.038 -3.252 3.805
390 HB2 PHE 545 HB2 PHE 545 -3.727 -2.625 1.828
391 HB3 PHE 545 HB3 PHE 545 -4.251 -1.190 2.707
392 HD1 PHE 545 HD1 PHE 545 -2.610 -0.226 4.471
393 HD2 PHE 545 HD2 PHE 545 -1.437 -2.938 1.354
394 HE1 PHE 545 HE1 PHE 545 -0.255 0.493 4.731
395 HE2 PHE 545 HE2 PHE 545 0.921 -2.217 1.615
396 HZ PHE 545 HZ PHE 545 1.513 -0.499 3.303
397 H ASP 546 H ASP 546 -4.310 -5.184 2.718
398 HA ASP 546 HA ASP 546 -2.001 -6.453 4.064
399 HB2 ASP 546 HB2 ASP 546 -4.113 -7.783 2.356
400 HB3 ASP 546 HB3 ASP 546 -2.986 -8.547 3.476
401 H LEU 547 H LEU 547 -0.306 -7.288 2.876
402 HA LEU 547 HA LEU 547 0.116 -6.144 0.262
403 HB2 LEU 547 HB2 LEU 547 1.727 -7.970 2.037
404 HB3 LEU 547 HB3 LEU 547 2.263 -7.537 0.426
405 HG LEU 547 HG LEU 547 3.161 -6.126 2.391
406 HD11 LEU 547 HD11 LEU 547 1.724 -4.469 0.309
407 HD12 LEU 547 HD12 LEU 547 3.098 -5.486 -0.119
408 HD13 LEU 547 HD13 LEU 547 3.295 -4.184 1.047
409 HD21 LEU 547 HD21 LEU 547 0.428 -4.829 2.178
410 HD22 LEU 547 HD22 LEU 547 1.744 -4.389 3.265
411 HD23 LEU 547 HD23 LEU 547 0.899 -5.917 3.483
412 H CYS 548 H CYS 548 -1.364 -8.926 1.449
413 HA CYS 548 HA CYS 548 -0.757 -10.618 -0.853
414 HB2 CYS 548 HB2 CYS 548 -1.054 -11.438 1.572
415 HB3 CYS 548 HB3 CYS 548 -2.780 -11.194 1.308
416 HG CYS 548 HG CYS 548 -1.296 -12.953 -0.771
417 H SER 549 H SER 549 -2.947 -8.196 -0.018
418 HA SER 549 HA SER 549 -5.146 -9.184 -1.663
419 HB2 SER 549 HB2 SER 549 -5.509 -7.860 0.448
420 HB3 SER 549 HB3 SER 549 -4.818 -6.466 -0.376
421 HG SER 549 HG SER 549 -7.176 -7.911 -0.970
422 H LEU 550 H LEU 550 -2.237 -8.090 -2.442
423 HA LEU 550 HA LEU 550 -2.918 -6.028 -4.368
424 HB2 LEU 550 HB2 LEU 550 -0.325 -7.565 -4.119
425 HB3 LEU 550 HB3 LEU 550 -0.577 -6.014 -4.914
426 HG LEU 550 HG LEU 550 -0.953 -6.528 -1.950
427 HD11 LEU 550 HD11 LEU 550 1.323 -5.377 -3.577
428 HD12 LEU 550 HD12 LEU 550 1.386 -6.606 -2.313
429 HD13 LEU 550 HD13 LEU 550 1.089 -4.922 -1.890
430 HD21 LEU 550 HD21 LEU 550 -2.376 -4.728 -2.505
431 HD22 LEU 550 HD22 LEU 550 -1.269 -4.106 -3.727
432 HD23 LEU 550 HD23 LEU 550 -0.888 -3.921 -2.016
433 H ASP 551 H ASP 551 -2.163 -6.311 -6.663
434 HA ASP 551 HA ASP 551 -2.819 -9.025 -7.680
435 HB2 ASP 551 HB2 ASP 551 -3.261 -6.486 -9.243
436 HB3 ASP 551 HB3 ASP 551 -3.977 -8.076 -9.493
437 H LYS 552 H LYS 552 -1.444 -9.914 -9.117
438 HA LYS 552 HA LYS 552 1.195 -9.359 -9.220
439 HB2 LYS 552 HB2 LYS 552 -0.626 -10.591 -11.271
440 HB3 LYS 552 HB3 LYS 552 1.085 -10.382 -11.637
441 HG2 LYS 552 HG2 LYS 552 0.657 -12.612 -10.674
442 HG3 LYS 552 HG3 LYS 552 1.681 -11.652 -9.607
443 HD2 LYS 552 HD2 LYS 552 -0.149 -11.165 -8.140
444 HD3 LYS 552 HD3 LYS 552 -1.324 -11.804 -9.290
445 HE2 LYS 552 HE2 LYS 552 0.869 -13.514 -8.106
446 HE3 LYS 552 HE3 LYS 552 -0.711 -13.344 -7.342
447 HZ1 LYS 552 HZ1 LYS 552 -0.374 -14.154 -10.171
448 HZ2 LYS 552 HZ2 LYS 552 -1.774 -14.258 -9.215
449 HZ3 LYS 552 HZ3 LYS 552 -0.449 -15.275 -8.901
450 H THR 553 H THR 553 -1.211 -7.986 -11.459
451 HA THR 553 HA THR 553 0.682 -6.453 -12.931
452 HB THR 553 HB THR 553 -2.226 -5.819 -12.643
453 HG1 THR 553 HG1 THR 553 -2.205 -7.943 -13.154
454 HG21 THR 553 HG21 THR 553 -0.676 -4.263 -13.885
455 HG22 THR 553 HG22 THR 553 -1.999 -4.910 -14.855
456 HG23 THR 553 HG23 THR 553 -0.376 -5.583 -15.017
457 H THR 554 H THR 554 -1.154 -5.905 -10.011
458 HA THR 554 HA THR 554 -0.515 -3.068 -9.919
459 HB THR 554 HB THR 554 -1.700 -4.737 -7.701
460 HG1 THR 554 HG1 THR 554 -3.298 -3.304 -9.467
461 HG21 THR 554 HG21 THR 554 -2.183 -1.849 -8.452
462 HG22 THR 554 HG22 THR 554 -0.910 -2.336 -7.335
463 HG23 THR 554 HG23 THR 554 -2.599 -2.658 -6.941
464 H VAL 555 H VAL 555 0.831 -6.057 -8.804
465 HA VAL 555 HA VAL 555 2.338 -5.017 -6.616
466 HB VAL 555 HB VAL 555 2.652 -7.494 -8.324
467 HG11 VAL 555 HG11 VAL 555 4.255 -6.504 -5.958
468 HG12 VAL 555 HG12 VAL 555 4.851 -7.060 -7.522
469 HG13 VAL 555 HG13 VAL 555 4.167 -8.215 -6.378
470 HG21 VAL 555 HG21 VAL 555 0.675 -7.172 -6.703
471 HG22 VAL 555 HG22 VAL 555 1.872 -7.253 -5.412
472 HG23 VAL 555 HG23 VAL 555 1.644 -8.628 -6.491
473 H ARG 556 H ARG 556 2.795 -5.197 -10.064
474 HA ARG 556 HA ARG 556 5.596 -4.636 -10.057
475 HB2 ARG 556 HB2 ARG 556 3.426 -4.587 -12.147
476 HB3 ARG 556 HB3 ARG 556 5.042 -3.988 -12.523
477 HG2 ARG 556 HG2 ARG 556 4.807 -6.682 -11.200
478 HG3 ARG 556 HG3 ARG 556 4.387 -6.559 -12.907
479 HD2 ARG 556 HD2 ARG 556 6.893 -7.056 -12.160
480 HD3 ARG 556 HD3 ARG 556 6.553 -6.034 -13.553
481 HE ARG 556 HE ARG 556 6.633 -4.247 -11.513
482 HH11 ARG 556 HH11 ARG 556 8.702 -6.819 -12.546
483 HH12 ARG 556 HH12 ARG 556 10.156 -6.063 -11.983
484 HH21 ARG 556 HH21 ARG 556 8.533 -3.248 -10.770
485 HH22 ARG 556 HH22 ARG 556 10.060 -4.040 -10.977
486 H LYS 557 H LYS 557 2.673 -2.646 -10.257
487 HA LYS 557 HA LYS 557 4.138 -0.214 -10.770
488 HB2 LYS 557 HB2 LYS 557 1.287 -0.572 -9.812
489 HB3 LYS 557 HB3 LYS 557 1.994 0.906 -10.465
490 HG2 LYS 557 HG2 LYS 557 2.562 -0.587 -12.547
491 HG3 LYS 557 HG3 LYS 557 1.325 -1.662 -11.895
492 HD2 LYS 557 HD2 LYS 557 0.985 1.241 -12.702
493 HD3 LYS 557 HD3 LYS 557 0.253 -0.169 -13.467
494 HE2 LYS 557 HE2 LYS 557 -0.335 0.959 -10.722
495 HE3 LYS 557 HE3 LYS 557 -1.446 0.784 -12.078
496 HZ1 LYS 557 HZ1 LYS 557 -0.866 -1.698 -11.876
497 HZ2 LYS 557 HZ2 LYS 557 -1.952 -1.020 -10.759
498 HZ3 LYS 557 HZ3 LYS 557 -0.335 -1.297 -10.315
499 H LEU 558 H LEU 558 3.209 -2.047 -7.999
500 HA LEU 558 HA LEU 558 3.464 0.135 -6.116
501 HB2 LEU 558 HB2 LEU 558 3.108 -2.845 -5.839
502 HB3 LEU 558 HB3 LEU 558 3.358 -1.802 -4.442
503 HG LEU 558 HG LEU 558 1.207 -1.191 -6.483
504 HD11 LEU 558 HD11 LEU 558 0.821 -3.492 -5.700
505 HD12 LEU 558 HD12 LEU 558 -0.393 -2.395 -5.045
506 HD13 LEU 558 HD13 LEU 558 0.935 -2.949 -4.026
507 HD21 LEU 558 HD21 LEU 558 1.524 0.642 -5.004
508 HD22 LEU 558 HD22 LEU 558 1.767 -0.409 -3.611
509 HD23 LEU 558 HD23 LEU 558 0.162 -0.230 -4.310
510 H GLN 559 H GLN 559 5.262 -2.917 -6.565
511 HA GLN 559 HA GLN 559 7.407 -2.378 -4.909
512 HB2 GLN 559 HB2 GLN 559 7.395 -3.861 -7.549
513 HB3 GLN 559 HB3 GLN 559 8.703 -3.925 -6.368
514 HG2 GLN 559 HG2 GLN 559 7.286 -4.941 -4.722
515 HG3 GLN 559 HG3 GLN 559 5.839 -4.633 -5.681
516 HE21 GLN 559 HE21 GLN 559 8.116 -5.476 -7.930
517 HE22 GLN 559 HE22 GLN 559 7.845 -7.151 -7.994
518 H SER 560 H SER 560 6.679 -1.080 -8.058
519 HA SER 560 HA SER 560 9.256 -0.107 -8.732
520 HB2 SER 560 HB2 SER 560 7.571 -0.273 -10.440
521 HB3 SER 560 HB3 SER 560 6.488 0.793 -9.551
522 HG SER 560 HG SER 560 8.432 1.420 -11.277
523 H TYR 561 H TYR 561 6.444 1.574 -7.275
524 HA TYR 561 HA TYR 561 7.564 4.084 -6.968
525 HB2 TYR 561 HB2 TYR 561 5.598 2.560 -5.261
526 HB3 TYR 561 HB3 TYR 561 6.111 4.186 -4.819
527 HD1 TYR 561 HD1 TYR 561 6.133 5.891 -6.935
528 HD2 TYR 561 HD2 TYR 561 3.643 2.413 -6.535
529 HE1 TYR 561 HE1 TYR 561 4.521 6.858 -8.541
530 HE2 TYR 561 HE2 TYR 561 2.027 3.384 -8.138
531 HH TYR 561 HH TYR 561 1.499 6.016 -8.848
532 H LEU 562 H LEU 562 8.001 1.219 -4.946
533 HA LEU 562 HA LEU 562 9.423 2.476 -2.849
534 HB2 LEU 562 HB2 LEU 562 9.866 -0.369 -3.742
535 HB3 LEU 562 HB3 LEU 562 9.971 0.297 -2.112
536 HG LEU 562 HG LEU 562 7.460 -0.042 -3.777
537 HD11 LEU 562 HD11 LEU 562 8.457 -2.045 -2.573
538 HD12 LEU 562 HD12 LEU 562 6.810 -1.626 -2.098
539 HD13 LEU 562 HD13 LEU 562 8.166 -1.180 -1.063
540 HD21 LEU 562 HD21 LEU 562 6.380 0.788 -1.583
541 HD22 LEU 562 HD22 LEU 562 7.144 2.004 -2.606
542 HD23 LEU 562 HD23 LEU 562 7.980 1.407 -1.172
543 H GLU 563 H GLU 563 10.310 1.711 -6.067
544 HA GLU 563 HA GLU 563 12.950 2.810 -5.668
545 HB2 GLU 563 HB2 GLU 563 13.155 0.347 -5.107
546 HB3 GLU 563 HB3 GLU 563 12.734 0.012 -6.788
547 HG2 GLU 563 HG2 GLU 563 15.109 0.041 -6.742
548 HG3 GLU 563 HG3 GLU 563 14.644 1.599 -7.420
549 H THR 564 H THR 564 11.824 4.344 -7.084
550 HA THR 564 HA THR 564 10.969 3.629 -9.700
551 HB THR 564 HB THR 564 10.977 6.038 -10.138
552 HG1 THR 564 HG1 THR 564 12.922 6.524 -9.071
553 HG21 THR 564 HG21 THR 564 10.009 5.185 -7.403
554 HG22 THR 564 HG22 THR 564 9.081 5.250 -8.902
555 HG23 THR 564 HG23 THR 564 9.604 6.743 -8.123
556 H SER 565 H SER 565 12.000 4.298 -11.717
557 HA SER 565 HA SER 565 14.701 3.405 -11.871
558 HB2 SER 565 HB2 SER 565 14.525 4.016 -14.255
559 HB3 SER 565 HB3 SER 565 13.129 3.083 -13.722
560 HG SER 565 HG SER 565 12.167 4.752 -14.655
561 H GLY 566 H GLY 566 16.014 5.023 -13.590
562 HA2 GLY 566 HA2 GLY 566 17.143 7.035 -13.846
563 HA3 GLY 566 HA3 GLY 566 16.027 7.771 -12.699
564 H THR 567 H THR 567 17.884 4.853 -12.068
565 HA THR 567 HA THR 567 19.490 4.368 -10.503
566 HB THR 567 HB THR 567 20.302 7.255 -10.657
567 HG1 THR 567 HG1 THR 567 21.730 5.879 -12.320
568 HG21 THR 567 HG21 THR 567 22.529 6.331 -10.226
569 HG22 THR 567 HG22 THR 567 21.868 4.696 -10.257
570 HG23 THR 567 HG23 THR 567 21.404 5.809 -8.971
571 H SER 568 H SER 568 18.888 7.760 -9.634
572 HA SER 568 HA SER 568 18.842 7.381 -6.881
573 HB2 SER 568 HB2 SER 568 18.982 9.597 -7.940
574 HB3 SER 568 HB3 SER 568 17.317 9.443 -8.493
575 HG SER 568 HG SER 568 17.679 8.955 -5.813
576 H1 THR 876 H1 THR 876 -1.959 -17.492 8.071
577 H2 THR 876 H2 THR 876 -2.358 -15.922 7.557
578 H3 THR 876 H3 THR 876 -2.187 -16.259 9.214
579 HA THR 876 HA THR 876 -0.128 -15.466 8.989
580 HB THR 876 HB THR 876 1.477 -17.203 8.054
581 HG1 THR 876 HG1 THR 876 -0.826 -18.804 7.821
582 HG21 THR 876 HG21 THR 876 0.770 -17.202 10.414
583 HG22 THR 876 HG22 THR 876 0.953 -18.851 9.816
584 HG23 THR 876 HG23 THR 876 -0.655 -18.150 9.991
585 H ASN 877 H ASN 877 -1.515 -16.539 5.946
586 HA ASN 877 HA ASN 877 0.407 -15.212 4.276
587 HB2 ASN 877 HB2 ASN 877 -1.045 -17.177 3.598
588 HB3 ASN 877 HB3 ASN 877 -2.392 -16.042 3.507
589 HD21 ASN 877 HD21 ASN 877 -1.920 -17.122 1.108
590 HD22 ASN 877 HD22 ASN 877 -1.019 -16.099 0.097
591 H LYS 878 H LYS 878 -0.577 -13.477 6.280
592 HA LYS 878 HA LYS 878 -1.773 -11.372 4.595
593 HB2 LYS 878 HB2 LYS 878 -2.737 -12.318 7.298
594 HB3 LYS 878 HB3 LYS 878 -3.081 -10.693 6.713
595 HG2 LYS 878 HG2 LYS 878 -3.682 -13.033 4.912
596 HG3 LYS 878 HG3 LYS 878 -4.782 -12.683 6.243
597 HD2 LYS 878 HD2 LYS 878 -5.295 -10.522 5.409
598 HD3 LYS 878 HD3 LYS 878 -3.914 -10.525 4.313
599 HE2 LYS 878 HE2 LYS 878 -4.928 -12.141 2.880
600 HE3 LYS 878 HE3 LYS 878 -6.171 -12.521 4.073
601 HZ1 LYS 878 HZ1 LYS 878 -6.991 -10.236 3.844
602 HZ2 LYS 878 HZ2 LYS 878 -7.072 -11.093 2.380
603 HZ3 LYS 878 HZ3 LYS 878 -5.843 -9.947 2.629
604 H LEU 879 H LEU 879 -0.974 -9.370 4.969
605 HA LEU 879 HA LEU 879 0.959 -8.974 7.178
606 HB2 LEU 879 HB2 LEU 879 1.283 -8.187 4.277
607 HB3 LEU 879 HB3 LEU 879 2.371 -7.703 5.567
608 HG LEU 879 HG LEU 879 1.841 -10.645 5.246
609 HD11 LEU 879 HD11 LEU 879 2.231 -10.218 2.958
610 HD12 LEU 879 HD12 LEU 879 3.820 -10.658 3.581
611 HD13 LEU 879 HD13 LEU 879 3.419 -8.963 3.301
612 HD21 LEU 879 HD21 LEU 879 4.420 -9.128 5.726
613 HD22 LEU 879 HD22 LEU 879 4.100 -10.834 6.049
614 HD23 LEU 879 HD23 LEU 879 3.320 -9.589 7.027
615 HA PRO 880 HA PRO 880 -2.023 -5.495 6.826
616 HB2 PRO 880 HB2 PRO 880 -2.552 -5.129 9.476
617 HB3 PRO 880 HB3 PRO 880 -3.346 -6.392 8.514
618 HG2 PRO 880 HG2 PRO 880 -1.087 -6.628 10.445
619 HG3 PRO 880 HG3 PRO 880 -2.437 -7.737 10.149
620 HD2 PRO 880 HD2 PRO 880 0.137 -8.072 9.124
621 HD3 PRO 880 HD3 PRO 880 -1.322 -8.827 8.442
622 H VAL 881 H VAL 881 -1.353 -3.397 6.699
623 HA VAL 881 HA VAL 881 0.802 -2.441 8.494
624 HB VAL 881 HB VAL 881 0.631 -2.059 5.492
625 HG11 VAL 881 HG11 VAL 881 1.298 0.055 6.425
626 HG12 VAL 881 HG12 VAL 881 2.779 -0.745 5.894
627 HG13 VAL 881 HG13 VAL 881 2.349 -0.731 7.604
628 HG21 VAL 881 HG21 VAL 881 2.749 -3.210 5.446
629 HG22 VAL 881 HG22 VAL 881 1.638 -4.195 6.400
630 HG23 VAL 881 HG23 VAL 881 2.851 -3.202 7.208
631 H SER 882 H SER 882 -0.188 -0.962 9.693
632 HA SER 882 HA SER 882 -2.319 0.707 8.573
633 HB2 SER 882 HB2 SER 882 -1.222 0.594 11.387
634 HB3 SER 882 HB3 SER 882 -2.687 1.420 10.865
635 HG SER 882 HG SER 882 -3.441 -0.666 10.161
636 H ILE 883 H ILE 883 -2.094 2.837 8.052
637 HA ILE 883 HA ILE 883 0.442 4.188 8.766
638 HB ILE 883 HB ILE 883 -1.110 4.665 6.222
639 HG12 ILE 883 HG12 ILE 883 1.229 2.797 6.719
640 HG13 ILE 883 HG13 ILE 883 -0.383 2.341 6.167
641 HG21 ILE 883 HG21 ILE 883 0.855 5.835 5.533
642 HG22 ILE 883 HG22 ILE 883 1.797 5.185 6.876
643 HG23 ILE 883 HG23 ILE 883 0.530 6.373 7.182
644 HD11 ILE 883 HD11 ILE 883 0.936 2.422 4.187
645 HD12 ILE 883 HD12 ILE 883 1.718 3.921 4.679
646 HD13 ILE 883 HD13 ILE 883 0.027 3.933 4.183
647 HA PRO 884 HA PRO 884 -2.635 6.860 10.849
648 HB2 PRO 884 HB2 PRO 884 -0.267 8.701 10.591
649 HB3 PRO 884 HB3 PRO 884 -1.355 8.458 11.976
650 HG2 PRO 884 HG2 PRO 884 1.047 7.339 11.942
651 HG3 PRO 884 HG3 PRO 884 -0.354 6.456 12.578
652 HD2 PRO 884 HD2 PRO 884 1.109 6.053 10.002
653 HD3 PRO 884 HD3 PRO 884 0.224 4.870 10.993
654 H LEU 885 H LEU 885 -4.149 8.152 9.917
655 HA LEU 885 HA LEU 885 -4.003 8.842 7.172
656 HB2 LEU 885 HB2 LEU 885 -5.878 10.011 9.236
657 HB3 LEU 885 HB3 LEU 885 -6.132 9.927 7.495
658 HG LEU 885 HG LEU 885 -6.005 7.604 9.434
659 HD11 LEU 885 HD11 LEU 885 -8.316 7.251 8.747
660 HD12 LEU 885 HD12 LEU 885 -8.199 8.561 7.574
661 HD13 LEU 885 HD13 LEU 885 -8.131 8.916 9.299
662 HD21 LEU 885 HD21 LEU 885 -6.643 6.323 7.247
663 HD22 LEU 885 HD22 LEU 885 -4.951 6.738 7.505
664 HD23 LEU 885 HD23 LEU 885 -5.939 7.710 6.415
665 H ALA 886 H ALA 886 -2.724 10.346 9.925
666 HA ALA 886 HA ALA 886 -2.844 13.065 8.985
667 HB1 ALA 886 HB1 ALA 886 -2.550 12.260 11.410
668 HB2 ALA 886 HB2 ALA 886 -1.532 13.600 10.880
669 HB3 ALA 886 HB3 ALA 886 -0.863 11.971 10.981
670 H SER 887 H SER 887 -0.763 10.319 8.533
671 HA SER 887 HA SER 887 1.443 11.887 7.463
672 HB2 SER 887 HB2 SER 887 2.663 9.911 7.480
673 HB3 SER 887 HB3 SER 887 1.521 9.621 8.789
674 HG SER 887 HG SER 887 0.168 8.651 7.083
675 H VAL 888 H VAL 888 -1.468 10.666 6.249
676 HA VAL 888 HA VAL 888 -0.539 11.081 3.488
677 HB VAL 888 HB VAL 888 -1.977 9.067 2.835
678 HG11 VAL 888 HG11 VAL 888 0.599 8.738 4.397
679 HG12 VAL 888 HG12 VAL 888 0.426 8.948 2.655
680 HG13 VAL 888 HG13 VAL 888 -0.120 7.457 3.422
681 HG21 VAL 888 HG21 VAL 888 -1.576 8.464 5.784
682 HG22 VAL 888 HG22 VAL 888 -2.232 7.345 4.591
683 HG23 VAL 888 HG23 VAL 888 -3.120 8.810 5.005
684 H VAL 889 H VAL 889 -2.742 10.608 2.115
685 HA VAL 889 HA VAL 889 -4.999 12.014 3.389
686 HB VAL 889 HB VAL 889 -3.977 12.812 0.661
687 HG11 VAL 889 HG11 VAL 889 -5.838 14.109 2.676
688 HG12 VAL 889 HG12 VAL 889 -6.326 13.323 1.174
689 HG13 VAL 889 HG13 VAL 889 -5.375 14.808 1.124
690 HG21 VAL 889 HG21 VAL 889 -3.297 13.916 3.396
691 HG22 VAL 889 HG22 VAL 889 -3.136 14.876 1.925
692 HG23 VAL 889 HG23 VAL 889 -2.184 13.405 2.126
693 H LEU 890 H LEU 890 -6.719 10.835 3.106
694 HA LEU 890 HA LEU 890 -6.865 8.709 1.190
695 HB2 LEU 890 HB2 LEU 890 -8.973 9.913 2.992
696 HB3 LEU 890 HB3 LEU 890 -9.130 8.388 2.125
697 HG LEU 890 HG LEU 890 -6.930 8.976 4.127
698 HD11 LEU 890 HD11 LEU 890 -9.648 7.698 4.457
699 HD12 LEU 890 HD12 LEU 890 -8.931 9.002 5.400
700 HD13 LEU 890 HD13 LEU 890 -8.319 7.355 5.565
701 HD21 LEU 890 HD21 LEU 890 -6.170 7.194 2.797
702 HD22 LEU 890 HD22 LEU 890 -7.791 6.548 2.550
703 HD23 LEU 890 HD23 LEU 890 -6.987 6.344 4.105
704 HA PRO 891 HA PRO 891 -8.749 11.095 -2.072
705 HB2 PRO 891 HB2 PRO 891 -9.986 9.172 -3.521
706 HB3 PRO 891 HB3 PRO 891 -8.215 9.277 -3.424
707 HG2 PRO 891 HG2 PRO 891 -10.081 7.513 -1.895
708 HG3 PRO 891 HG3 PRO 891 -8.559 7.101 -2.703
709 HD2 PRO 891 HD2 PRO 891 -8.712 7.551 -0.011
710 HD3 PRO 891 HD3 PRO 891 -7.255 7.923 -0.961
711 H SER 892 H SER 892 -10.494 12.396 -1.956
712 HA SER 892 HA SER 892 -12.733 11.842 -0.308
713 HB2 SER 892 HB2 SER 892 -13.699 13.888 -1.438
714 HB3 SER 892 HB3 SER 892 -12.128 14.127 -0.679
715 HG SER 892 HG SER 892 -12.395 13.383 -3.394
716 H ARG 893 H ARG 893 -14.810 11.214 -0.799
717 HA ARG 893 HA ARG 893 -15.142 9.544 -3.102
718 HB2 ARG 893 HB2 ARG 893 -16.215 9.243 -0.791
719 HB3 ARG 893 HB3 ARG 893 -17.347 10.501 -1.279
720 HG2 ARG 893 HG2 ARG 893 -18.515 8.616 -1.982
721 HG3 ARG 893 HG3 ARG 893 -17.613 8.981 -3.450
722 HD2 ARG 893 HD2 ARG 893 -15.841 7.374 -2.694
723 HD3 ARG 893 HD3 ARG 893 -16.859 6.956 -1.321
724 HE ARG 893 HE ARG 893 -18.343 6.656 -3.713
725 HH11 ARG 893 HH11 ARG 893 -15.709 5.282 -1.938
726 HH12 ARG 893 HH12 ARG 893 -15.950 3.680 -2.551
727 HH21 ARG 893 HH21 ARG 893 -18.664 4.559 -4.523
728 HH22 ARG 893 HH22 ARG 893 -17.623 3.271 -4.015
729 H ALA 894 H ALA 894 -14.560 11.506 -4.527
730 HA ALA 894 HA ALA 894 -16.382 13.593 -4.984
731 HB1 ALA 894 HB1 ALA 894 -14.647 12.274 -7.079
732 HB2 ALA 894 HB2 ALA 894 -14.031 13.418 -5.888
733 HB3 ALA 894 HB3 ALA 894 -15.238 13.935 -7.066
734 H GLU 895 H GLU 895 -18.442 13.451 -5.578
735 HA GLU 895 HA GLU 895 -19.525 11.061 -6.767
736 HB2 GLU 895 HB2 GLU 895 -20.795 12.458 -5.150
737 HB3 GLU 895 HB3 GLU 895 -20.839 13.755 -6.345
738 HG2 GLU 895 HG2 GLU 895 -22.064 12.339 -7.903
739 HG3 GLU 895 HG3 GLU 895 -21.928 10.964 -6.807
740 H ARG 896 H ARG 896 -19.854 10.636 -8.863
741 HA ARG 896 HA ARG 896 -20.372 12.585 -10.853
742 HB2 ARG 896 HB2 ARG 896 -18.217 12.230 -12.145
743 HB3 ARG 896 HB3 ARG 896 -18.078 13.232 -10.699
744 HG2 ARG 896 HG2 ARG 896 -17.241 11.330 -9.416
745 HG3 ARG 896 HG3 ARG 896 -17.466 10.263 -10.802
746 HD2 ARG 896 HD2 ARG 896 -15.831 11.565 -12.092
747 HD3 ARG 896 HD3 ARG 896 -15.627 12.673 -10.738
748 HE ARG 896 HE ARG 896 -15.105 9.909 -10.064
749 HH11 ARG 896 HH11 ARG 896 -13.852 12.866 -11.351
750 HH12 ARG 896 HH12 ARG 896 -12.206 12.502 -10.957
751 HH21 ARG 896 HH21 ARG 896 -12.947 9.424 -9.543
752 HH22 ARG 896 HH22 ARG 896 -11.693 10.554 -9.933
753 H ALA 897 H ALA 897 -19.542 11.388 -13.129
754 HA ALA 897 HA ALA 897 -20.100 9.702 -14.586
755 HB1 ALA 897 HB1 ALA 897 -19.669 7.841 -12.246
756 HB2 ALA 897 HB2 ALA 897 -18.341 8.559 -13.157
757 HB3 ALA 897 HB3 ALA 897 -19.482 7.480 -13.962
758 H ARG 898 H ARG 898 -22.083 10.799 -12.429
759 HA ARG 898 HA ARG 898 -23.995 8.955 -11.722
760 HB2 ARG 898 HB2 ARG 898 -24.672 11.681 -12.836
761 HB3 ARG 898 HB3 ARG 898 -25.560 10.756 -11.625
762 HG2 ARG 898 HG2 ARG 898 -23.497 10.884 -10.159
763 HG3 ARG 898 HG3 ARG 898 -22.831 12.030 -11.323
764 HD2 ARG 898 HD2 ARG 898 -23.958 13.184 -9.439
765 HD3 ARG 898 HD3 ARG 898 -24.733 13.530 -10.981
766 HE ARG 898 HE ARG 898 -26.110 11.367 -9.994
767 HH11 ARG 898 HH11 ARG 898 -25.264 14.524 -8.861
768 HH12 ARG 898 HH12 ARG 898 -26.679 14.703 -7.880
769 HH21 ARG 898 HH21 ARG 898 -27.969 11.592 -8.709
770 HH22 ARG 898 HH22 ARG 898 -28.210 13.043 -7.793
771 H SER 899 H SER 899 -24.683 7.355 -13.020
772 HA SER 899 HA SER 899 -25.060 7.682 -15.848
773 HB2 SER 899 HB2 SER 899 -24.413 5.515 -14.924
774 HB3 SER 899 HB3 SER 899 -25.896 5.453 -13.976
775 HG SER 899 HG SER 899 -25.943 4.307 -16.029
776 H THR 900 H THR 900 -26.877 8.141 -16.960
777 HA THR 900 HA THR 900 -29.041 9.441 -15.778
778 HB THR 900 HB THR 900 -28.711 9.812 -18.088
779 HG1 THR 900 HG1 THR 900 -30.863 9.763 -17.786
780 HG21 THR 900 HG21 THR 900 -28.832 6.798 -18.357
781 HG22 THR 900 HG22 THR 900 -27.442 7.841 -18.658
782 HG23 THR 900 HG23 THR 900 -28.840 7.903 -19.731
Start of MODEL 5
1 H1 ASP 500 H1 ASP 500 5.597 -22.675 -4.950
2 H2 ASP 500 H2 ASP 500 4.181 -22.176 -5.745
3 H3 ASP 500 H3 ASP 500 4.384 -21.862 -4.086
4 HA ASP 500 HA ASP 500 6.489 -20.808 -5.754
5 HB2 ASP 500 HB2 ASP 500 4.409 -20.535 -7.167
6 HB3 ASP 500 HB3 ASP 500 3.734 -19.555 -5.866
7 H LYS 501 H LYS 501 6.885 -21.176 -3.268
8 HA LYS 501 HA LYS 501 5.703 -19.402 -1.400
9 HB2 LYS 501 HB2 LYS 501 8.473 -20.614 -1.285
10 HB3 LYS 501 HB3 LYS 501 7.512 -20.031 0.075
11 HG2 LYS 501 HG2 LYS 501 5.739 -21.741 -0.645
12 HG3 LYS 501 HG3 LYS 501 6.990 -22.439 -1.674
13 HD2 LYS 501 HD2 LYS 501 7.265 -22.010 1.315
14 HD3 LYS 501 HD3 LYS 501 6.855 -23.549 0.558
15 HE2 LYS 501 HE2 LYS 501 9.015 -23.252 -0.813
16 HE3 LYS 501 HE3 LYS 501 9.435 -21.993 0.347
17 HZ1 LYS 501 HZ1 LYS 501 8.850 -23.807 2.070
18 HZ2 LYS 501 HZ2 LYS 501 10.359 -23.855 1.292
19 HZ3 LYS 501 HZ3 LYS 501 9.105 -24.883 0.784
20 H ALA 502 H ALA 502 7.608 -18.733 -4.029
21 HA ALA 502 HA ALA 502 9.346 -16.728 -2.999
22 HB1 ALA 502 HB1 ALA 502 9.796 -16.178 -5.268
23 HB2 ALA 502 HB2 ALA 502 8.253 -16.837 -5.810
24 HB3 ALA 502 HB3 ALA 502 9.525 -17.920 -5.245
25 H TYR 503 H TYR 503 6.187 -16.579 -4.622
26 HA TYR 503 HA TYR 503 5.778 -13.879 -4.804
27 HB2 TYR 503 HB2 TYR 503 4.173 -15.743 -5.459
28 HB3 TYR 503 HB3 TYR 503 3.638 -15.752 -3.778
29 HD1 TYR 503 HD1 TYR 503 4.321 -13.312 -6.547
30 HD2 TYR 503 HD2 TYR 503 1.844 -14.358 -3.196
31 HE1 TYR 503 HE1 TYR 503 2.872 -11.359 -7.007
32 HE2 TYR 503 HE2 TYR 503 0.392 -12.402 -3.660
33 HH TYR 503 HH TYR 503 -0.030 -10.971 -6.123
34 H LEU 504 H LEU 504 4.760 -15.824 -1.974
35 HA LEU 504 HA LEU 504 3.942 -13.846 -0.280
36 HB2 LEU 504 HB2 LEU 504 5.449 -16.398 0.265
37 HB3 LEU 504 HB3 LEU 504 4.965 -15.331 1.583
38 HG LEU 504 HG LEU 504 2.609 -15.452 0.772
39 HD11 LEU 504 HD11 LEU 504 2.174 -17.423 -0.841
40 HD12 LEU 504 HD12 LEU 504 3.887 -17.306 -1.243
41 HD13 LEU 504 HD13 LEU 504 2.816 -15.937 -1.540
42 HD21 LEU 504 HD21 LEU 504 2.167 -17.604 1.701
43 HD22 LEU 504 HD22 LEU 504 3.651 -17.057 2.481
44 HD23 LEU 504 HD23 LEU 504 3.726 -18.236 1.171
45 H ASP 505 H ASP 505 7.300 -14.957 -0.677
46 HA ASP 505 HA ASP 505 8.585 -13.333 1.143
47 HB2 ASP 505 HB2 ASP 505 9.592 -15.087 -0.439
48 HB3 ASP 505 HB3 ASP 505 9.694 -13.788 -1.625
49 H GLU 506 H GLU 506 7.727 -12.515 -2.218
50 HA GLU 506 HA GLU 506 8.785 -9.943 -2.326
51 HB2 GLU 506 HB2 GLU 506 6.167 -10.799 -3.577
52 HB3 GLU 506 HB3 GLU 506 7.255 -9.528 -4.137
53 HG2 GLU 506 HG2 GLU 506 7.893 -12.491 -4.018
54 HG3 GLU 506 HG3 GLU 506 7.565 -11.559 -5.479
55 H LEU 507 H LEU 507 6.035 -11.152 -0.631
56 HA LEU 507 HA LEU 507 4.854 -8.526 -0.164
57 HB2 LEU 507 HB2 LEU 507 4.104 -11.059 1.286
58 HB3 LEU 507 HB3 LEU 507 3.093 -9.672 0.883
59 HG LEU 507 HG LEU 507 4.241 -11.689 -1.062
60 HD11 LEU 507 HD11 LEU 507 1.951 -12.352 -1.411
61 HD12 LEU 507 HD12 LEU 507 1.363 -11.022 -0.413
62 HD13 LEU 507 HD13 LEU 507 2.241 -12.359 0.329
63 HD21 LEU 507 HD21 LEU 507 2.795 -10.392 -2.712
64 HD22 LEU 507 HD22 LEU 507 4.256 -9.566 -2.173
65 HD23 LEU 507 HD23 LEU 507 2.691 -9.126 -1.490
66 H VAL 508 H VAL 508 6.580 -11.024 1.702
67 HA VAL 508 HA VAL 508 6.498 -9.779 4.204
68 HB VAL 508 HB VAL 508 8.696 -11.509 3.052
69 HG11 VAL 508 HG11 VAL 508 9.023 -12.046 5.513
70 HG12 VAL 508 HG12 VAL 508 7.962 -10.683 5.873
71 HG13 VAL 508 HG13 VAL 508 9.495 -10.413 5.041
72 HG21 VAL 508 HG21 VAL 508 6.624 -12.705 2.928
73 HG22 VAL 508 HG22 VAL 508 6.104 -12.101 4.502
74 HG23 VAL 508 HG23 VAL 508 7.420 -13.271 4.395
75 H GLU 509 H GLU 509 9.196 -9.704 1.858
76 HA GLU 509 HA GLU 509 10.822 -7.875 3.155
77 HB2 GLU 509 HB2 GLU 509 10.335 -8.211 0.184
78 HB3 GLU 509 HB3 GLU 509 11.653 -7.260 0.871
79 HG2 GLU 509 HG2 GLU 509 12.646 -9.178 1.878
80 HG3 GLU 509 HG3 GLU 509 11.208 -10.159 1.599
81 H LEU 510 H LEU 510 8.280 -7.166 0.748
82 HA LEU 510 HA LEU 510 8.458 -4.371 0.851
83 HB2 LEU 510 HB2 LEU 510 6.517 -6.381 -0.103
84 HB3 LEU 510 HB3 LEU 510 5.745 -4.884 0.409
85 HG LEU 510 HG LEU 510 7.354 -3.629 -1.062
86 HD11 LEU 510 HD11 LEU 510 7.970 -6.333 -2.269
87 HD12 LEU 510 HD12 LEU 510 9.028 -5.578 -1.078
88 HD13 LEU 510 HD13 LEU 510 8.733 -4.786 -2.625
89 HD21 LEU 510 HD21 LEU 510 6.140 -4.083 -3.085
90 HD22 LEU 510 HD22 LEU 510 5.022 -4.372 -1.753
91 HD23 LEU 510 HD23 LEU 510 5.786 -5.732 -2.573
92 H HIS 511 H HIS 511 6.322 -6.575 2.658
93 HA HIS 511 HA HIS 511 4.955 -4.783 4.237
94 HB2 HIS 511 HB2 HIS 511 4.632 -7.263 4.217
95 HB3 HIS 511 HB3 HIS 511 6.094 -7.417 5.194
96 HD1 HIS 511 HD1 HIS 511 5.837 -7.105 7.681
97 HD2 HIS 511 HD2 HIS 511 2.557 -5.690 5.551
98 HE1 HIS 511 HE1 HIS 511 4.106 -6.435 9.407
99 HE2 HIS 511 HE2 HIS 511 2.095 -5.561 8.122
100 H ARG 512 H ARG 512 8.000 -6.408 5.087
101 HA ARG 512 HA ARG 512 8.544 -5.105 7.475
102 HB2 ARG 512 HB2 ARG 512 9.780 -7.061 6.555
103 HB3 ARG 512 HB3 ARG 512 10.538 -5.993 5.376
104 HG2 ARG 512 HG2 ARG 512 12.049 -6.314 7.256
105 HG3 ARG 512 HG3 ARG 512 11.482 -4.646 7.248
106 HD2 ARG 512 HD2 ARG 512 9.905 -6.629 8.850
107 HD3 ARG 512 HD3 ARG 512 11.463 -6.115 9.488
108 HE ARG 512 HE ARG 512 9.074 -4.481 9.226
109 HH11 ARG 512 HH11 ARG 512 12.514 -4.614 9.577
110 HH12 ARG 512 HH12 ARG 512 12.642 -3.036 10.279
111 HH21 ARG 512 HH21 ARG 512 9.235 -2.411 10.152
112 HH22 ARG 512 HH22 ARG 512 10.786 -1.789 10.604
113 H ARG 513 H ARG 513 9.707 -4.230 4.208
114 HA ARG 513 HA ARG 513 11.074 -1.904 4.913
115 HB2 ARG 513 HB2 ARG 513 9.676 -2.695 2.357
116 HB3 ARG 513 HB3 ARG 513 10.649 -1.231 2.508
117 HG2 ARG 513 HG2 ARG 513 12.627 -2.480 2.995
118 HG3 ARG 513 HG3 ARG 513 11.710 -3.965 3.243
119 HD2 ARG 513 HD2 ARG 513 12.822 -3.958 1.036
120 HD3 ARG 513 HD3 ARG 513 11.068 -3.988 0.872
121 HE ARG 513 HE ARG 513 11.188 -1.899 -0.129
122 HH11 ARG 513 HH11 ARG 513 14.100 -2.610 1.600
123 HH12 ARG 513 HH12 ARG 513 14.946 -1.211 1.029
124 HH21 ARG 513 HH21 ARG 513 12.291 -0.061 -0.882
125 HH22 ARG 513 HH22 ARG 513 13.921 0.233 -0.377
126 H LEU 514 H LEU 514 7.687 -2.257 3.838
127 HA LEU 514 HA LEU 514 7.006 0.461 3.879
128 HB2 LEU 514 HB2 LEU 514 5.305 -1.982 4.405
129 HB3 LEU 514 HB3 LEU 514 4.658 -0.362 4.157
130 HG LEU 514 HG LEU 514 6.543 -1.552 2.119
131 HD11 LEU 514 HD11 LEU 514 3.562 -2.051 2.338
132 HD12 LEU 514 HD12 LEU 514 4.847 -3.259 2.386
133 HD13 LEU 514 HD13 LEU 514 4.523 -2.374 0.894
134 HD21 LEU 514 HD21 LEU 514 5.992 0.794 1.825
135 HD22 LEU 514 HD22 LEU 514 4.272 0.463 2.028
136 HD23 LEU 514 HD23 LEU 514 5.121 -0.125 0.601
137 H MET 515 H MET 515 6.932 -1.981 6.425
138 HA MET 515 HA MET 515 5.594 -0.553 8.399
139 HB2 MET 515 HB2 MET 515 6.312 -2.982 8.452
140 HB3 MET 515 HB3 MET 515 7.912 -2.412 8.926
141 HG2 MET 515 HG2 MET 515 6.781 -2.870 10.973
142 HG3 MET 515 HG3 MET 515 6.725 -1.117 10.797
143 HE1 MET 515 HE1 MET 515 3.413 -2.105 12.533
144 HE2 MET 515 HE2 MET 515 4.452 -0.691 12.364
145 HE3 MET 515 HE3 MET 515 5.163 -2.256 12.753
146 H THR 516 H THR 516 9.019 -0.435 7.463
147 HA THR 516 HA THR 516 9.501 1.654 9.499
148 HB THR 516 HB THR 516 11.056 -0.258 9.493
149 HG1 THR 516 HG1 THR 516 11.670 2.109 9.722
150 HG21 THR 516 HG21 THR 516 12.455 -0.727 7.582
151 HG22 THR 516 HG22 THR 516 11.809 0.662 6.708
152 HG23 THR 516 HG23 THR 516 10.779 -0.731 7.034
153 H LEU 517 H LEU 517 8.162 1.816 6.677
154 HA LEU 517 HA LEU 517 10.003 3.677 5.355
155 HB2 LEU 517 HB2 LEU 517 8.799 1.955 4.030
156 HB3 LEU 517 HB3 LEU 517 7.273 2.705 4.489
157 HG LEU 517 HG LEU 517 8.034 4.832 3.432
158 HD11 LEU 517 HD11 LEU 517 10.493 3.168 2.946
159 HD12 LEU 517 HD12 LEU 517 10.365 4.865 3.411
160 HD13 LEU 517 HD13 LEU 517 10.040 4.383 1.750
161 HD21 LEU 517 HD21 LEU 517 8.281 2.529 1.487
162 HD22 LEU 517 HD22 LEU 517 7.586 4.123 1.196
163 HD23 LEU 517 HD23 LEU 517 6.744 2.970 2.230
164 H ARG 518 H ARG 518 9.953 5.747 5.902
165 HA ARG 518 HA ARG 518 7.402 6.949 6.845
166 HB2 ARG 518 HB2 ARG 518 10.285 7.411 7.571
167 HB3 ARG 518 HB3 ARG 518 9.141 8.743 7.721
168 HG2 ARG 518 HG2 ARG 518 9.415 7.391 9.828
169 HG3 ARG 518 HG3 ARG 518 7.755 7.473 9.242
170 HD2 ARG 518 HD2 ARG 518 7.766 5.252 8.509
171 HD3 ARG 518 HD3 ARG 518 9.523 5.192 8.385
172 HE ARG 518 HE ARG 518 9.607 4.619 10.635
173 HH11 ARG 518 HH11 ARG 518 6.499 5.880 9.783
174 HH12 ARG 518 HH12 ARG 518 5.768 5.483 11.301
175 HH21 ARG 518 HH21 ARG 518 8.654 4.093 12.629
176 HH22 ARG 518 HH22 ARG 518 6.987 4.471 12.913
177 H GLU 519 H GLU 519 9.035 6.595 4.117
178 HA GLU 519 HA GLU 519 9.425 9.275 3.203
179 HB2 GLU 519 HB2 GLU 519 10.465 7.108 2.279
180 HB3 GLU 519 HB3 GLU 519 8.938 6.887 1.425
181 HG2 GLU 519 HG2 GLU 519 10.285 8.052 -0.126
182 HG3 GLU 519 HG3 GLU 519 9.277 9.310 0.586
183 H ARG 520 H ARG 520 7.592 10.504 3.467
184 HA ARG 520 HA ARG 520 4.958 9.738 2.926
185 HB2 ARG 520 HB2 ARG 520 6.308 12.435 2.905
186 HB3 ARG 520 HB3 ARG 520 4.572 12.238 2.664
187 HG2 ARG 520 HG2 ARG 520 4.303 11.228 4.829
188 HG3 ARG 520 HG3 ARG 520 6.048 11.098 5.050
189 HD2 ARG 520 HD2 ARG 520 4.805 13.061 6.215
190 HD3 ARG 520 HD3 ARG 520 6.309 13.409 5.368
191 HE ARG 520 HE ARG 520 5.090 14.683 3.861
192 HH11 ARG 520 HH11 ARG 520 3.021 12.538 5.622
193 HH12 ARG 520 HH12 ARG 520 1.557 13.202 4.980
194 HH21 ARG 520 HH21 ARG 520 3.172 15.557 3.015
195 HH22 ARG 520 HH22 ARG 520 1.642 14.911 3.503
196 H HIS 521 H HIS 521 7.522 10.605 0.758
197 HA HIS 521 HA HIS 521 5.995 11.473 -1.452
198 HB2 HIS 521 HB2 HIS 521 8.471 11.723 -1.229
199 HB3 HIS 521 HB3 HIS 521 8.630 9.995 -1.541
200 HD1 HIS 521 HD1 HIS 521 5.883 11.599 -3.382
201 HD2 HIS 521 HD2 HIS 521 9.927 10.831 -4.051
202 HE1 HIS 521 HE1 HIS 521 6.270 11.905 -5.866
203 HE2 HIS 521 HE2 HIS 521 8.729 11.439 -6.291
204 H ILE 522 H ILE 522 7.022 8.227 -0.440
205 HA ILE 522 HA ILE 522 5.761 7.013 -2.778
206 HB ILE 522 HB ILE 522 7.515 6.067 -0.536
207 HG12 ILE 522 HG12 ILE 522 8.787 5.104 -2.370
208 HG13 ILE 522 HG13 ILE 522 7.475 5.431 -3.500
209 HG21 ILE 522 HG21 ILE 522 5.604 4.327 -2.101
210 HG22 ILE 522 HG22 ILE 522 5.837 4.388 -0.354
211 HG23 ILE 522 HG23 ILE 522 7.083 3.684 -1.384
212 HD11 ILE 522 HD11 ILE 522 9.496 7.076 -3.411
213 HD12 ILE 522 HD12 ILE 522 8.723 7.689 -1.949
214 HD13 ILE 522 HD13 ILE 522 7.864 7.740 -3.491
215 H LEU 523 H LEU 523 5.306 6.935 0.766
216 HA LEU 523 HA LEU 523 3.157 5.241 0.966
217 HB2 LEU 523 HB2 LEU 523 4.065 7.633 2.501
218 HB3 LEU 523 HB3 LEU 523 2.416 7.100 2.806
219 HG LEU 523 HG LEU 523 3.298 4.797 3.246
220 HD11 LEU 523 HD11 LEU 523 5.375 4.974 1.937
221 HD12 LEU 523 HD12 LEU 523 5.723 4.543 3.612
222 HD13 LEU 523 HD13 LEU 523 5.979 6.196 3.056
223 HD21 LEU 523 HD21 LEU 523 4.033 5.286 5.463
224 HD22 LEU 523 HD22 LEU 523 2.953 6.609 5.027
225 HD23 LEU 523 HD23 LEU 523 4.700 6.844 4.977
226 H GLN 524 H GLN 524 3.181 8.515 -0.307
227 HA GLN 524 HA GLN 524 0.313 8.768 -0.332
228 HB2 GLN 524 HB2 GLN 524 2.009 10.683 -0.342
229 HB3 GLN 524 HB3 GLN 524 2.243 10.327 -2.054
230 HG2 GLN 524 HG2 GLN 524 -0.290 10.517 -2.304
231 HG3 GLN 524 HG3 GLN 524 -0.304 11.194 -0.676
232 HE21 GLN 524 HE21 GLN 524 -0.449 12.224 -3.767
233 HE22 GLN 524 HE22 GLN 524 0.402 13.686 -3.646
234 H GLN 525 H GLN 525 2.787 7.870 -2.689
235 HA GLN 525 HA GLN 525 1.059 7.671 -4.931
236 HB2 GLN 525 HB2 GLN 525 3.652 6.202 -4.402
237 HB3 GLN 525 HB3 GLN 525 2.875 6.417 -5.968
238 HG2 GLN 525 HG2 GLN 525 3.625 8.787 -4.259
239 HG3 GLN 525 HG3 GLN 525 4.789 8.044 -5.350
240 HE21 GLN 525 HE21 GLN 525 3.952 10.710 -5.810
241 HE22 GLN 525 HE22 GLN 525 2.995 10.754 -7.211
242 H ILE 526 H ILE 526 2.442 5.139 -2.833
243 HA ILE 526 HA ILE 526 1.131 2.947 -3.941
244 HB ILE 526 HB ILE 526 2.043 3.476 -1.111
245 HG12 ILE 526 HG12 ILE 526 3.204 1.705 -3.278
246 HG13 ILE 526 HG13 ILE 526 3.700 3.377 -3.037
247 HG21 ILE 526 HG21 ILE 526 0.861 1.003 -2.382
248 HG22 ILE 526 HG22 ILE 526 0.428 1.757 -0.850
249 HG23 ILE 526 HG23 ILE 526 1.957 0.895 -1.005
250 HD11 ILE 526 HD11 ILE 526 3.972 1.075 -1.094
251 HD12 ILE 526 HD12 ILE 526 4.203 2.759 -0.621
252 HD13 ILE 526 HD13 ILE 526 5.264 2.027 -1.823
253 H VAL 527 H VAL 527 0.144 4.721 -0.996
254 HA VAL 527 HA VAL 527 -2.213 3.523 -0.415
255 HB VAL 527 HB VAL 527 -1.600 6.486 -0.409
256 HG11 VAL 527 HG11 VAL 527 -3.966 4.946 0.668
257 HG12 VAL 527 HG12 VAL 527 -3.974 6.398 -0.337
258 HG13 VAL 527 HG13 VAL 527 -3.480 6.496 1.355
259 HG21 VAL 527 HG21 VAL 527 -0.340 4.650 1.043
260 HG22 VAL 527 HG22 VAL 527 -1.804 4.714 2.018
261 HG23 VAL 527 HG23 VAL 527 -0.842 6.172 1.777
262 H ASN 528 H ASN 528 -2.113 6.407 -2.548
263 HA ASN 528 HA ASN 528 -4.712 6.273 -3.472
264 HB2 ASN 528 HB2 ASN 528 -3.085 8.138 -3.845
265 HB3 ASN 528 HB3 ASN 528 -2.323 7.154 -5.094
266 HD21 ASN 528 HD21 ASN 528 -3.931 6.349 -6.863
267 HD22 ASN 528 HD22 ASN 528 -5.140 7.439 -7.338
268 H LEU 529 H LEU 529 -2.060 4.177 -4.247
269 HA LEU 529 HA LEU 529 -3.051 3.308 -6.793
270 HB2 LEU 529 HB2 LEU 529 -0.640 3.115 -5.732
271 HB3 LEU 529 HB3 LEU 529 -1.263 1.608 -5.073
272 HG LEU 529 HG LEU 529 -0.183 1.107 -7.168
273 HD11 LEU 529 HD11 LEU 529 -1.938 -0.041 -8.289
274 HD12 LEU 529 HD12 LEU 529 -3.142 1.141 -7.781
275 HD13 LEU 529 HD13 LEU 529 -2.430 0.042 -6.597
276 HD21 LEU 529 HD21 LEU 529 -2.045 2.805 -8.799
277 HD22 LEU 529 HD22 LEU 529 -0.391 2.306 -9.131
278 HD23 LEU 529 HD23 LEU 529 -0.699 3.615 -7.995
279 H ILE 530 H ILE 530 -2.768 1.538 -3.718
280 HA ILE 530 HA ILE 530 -4.569 -0.513 -4.478
281 HB ILE 530 HB ILE 530 -4.285 -1.362 -2.291
282 HG12 ILE 530 HG12 ILE 530 -3.092 0.341 -0.586
283 HG13 ILE 530 HG13 ILE 530 -3.912 1.541 -1.577
284 HG21 ILE 530 HG21 ILE 530 -1.776 0.257 -2.754
285 HG22 ILE 530 HG22 ILE 530 -2.219 -1.113 -3.773
286 HG23 ILE 530 HG23 ILE 530 -1.913 -1.357 -2.053
287 HD11 ILE 530 HD11 ILE 530 -5.008 -0.278 0.436
288 HD12 ILE 530 HD12 ILE 530 -5.917 -0.351 -1.068
289 HD13 ILE 530 HD13 ILE 530 -5.705 1.187 -0.242
290 H GLU 531 H GLU 531 -5.048 2.641 -3.420
291 HA GLU 531 HA GLU 531 -7.599 2.287 -2.128
292 HB2 GLU 531 HB2 GLU 531 -6.097 4.273 -1.751
293 HB3 GLU 531 HB3 GLU 531 -6.507 4.814 -3.377
294 HG2 GLU 531 HG2 GLU 531 -8.651 4.193 -1.343
295 HG3 GLU 531 HG3 GLU 531 -7.894 5.777 -1.427
296 H GLU 532 H GLU 532 -6.553 3.438 -5.327
297 HA GLU 532 HA GLU 532 -9.108 3.862 -6.412
298 HB2 GLU 532 HB2 GLU 532 -6.459 3.163 -7.681
299 HB3 GLU 532 HB3 GLU 532 -7.912 3.483 -8.632
300 HG2 GLU 532 HG2 GLU 532 -6.877 5.406 -6.539
301 HG3 GLU 532 HG3 GLU 532 -6.386 5.489 -8.230
302 H THR 533 H THR 533 -7.587 0.979 -5.479
303 HA THR 533 HA THR 533 -8.926 -0.743 -7.397
304 HB THR 533 HB THR 533 -7.531 -1.554 -4.842
305 HG1 THR 533 HG1 THR 533 -6.450 -1.168 -7.435
306 HG21 THR 533 HG21 THR 533 -7.888 -2.994 -7.483
307 HG22 THR 533 HG22 THR 533 -8.930 -3.234 -6.081
308 HG23 THR 533 HG23 THR 533 -7.222 -3.662 -5.994
309 H GLY 534 H GLY 534 -9.144 -0.033 -3.913
310 HA2 GLY 534 HA2 GLY 534 -11.306 0.264 -2.861
311 HA3 GLY 534 HA3 GLY 534 -11.967 -0.947 -3.953
312 H HIS 535 H HIS 535 -8.996 -2.076 -3.109
313 HA HIS 535 HA HIS 535 -10.150 -3.942 -1.178
314 HB2 HIS 535 HB2 HIS 535 -8.617 -4.567 -3.165
315 HB3 HIS 535 HB3 HIS 535 -7.297 -3.965 -2.163
316 HD1 HIS 535 HD1 HIS 535 -8.247 -4.965 0.599
317 HD2 HIS 535 HD2 HIS 535 -8.292 -7.318 -2.843
318 HE1 HIS 535 HE1 HIS 535 -8.238 -7.375 1.379
319 HE2 HIS 535 HE2 HIS 535 -8.263 -8.822 -0.707
320 H PHE 536 H PHE 536 -10.277 -1.821 0.248
321 HA PHE 536 HA PHE 536 -8.022 -1.997 2.133
322 HB2 PHE 536 HB2 PHE 536 -7.799 0.404 2.312
323 HB3 PHE 536 HB3 PHE 536 -7.578 -0.054 0.626
324 HD1 PHE 536 HD1 PHE 536 -10.063 1.285 3.061
325 HD2 PHE 536 HD2 PHE 536 -9.031 0.756 -1.075
326 HE1 PHE 536 HE1 PHE 536 -11.918 2.792 2.406
327 HE2 PHE 536 HE2 PHE 536 -10.885 2.267 -1.729
328 HZ PHE 536 HZ PHE 536 -12.330 3.283 0.012
329 H HIS 537 H HIS 537 -8.523 -1.200 4.230
330 HA HIS 537 HA HIS 537 -11.406 -0.875 4.835
331 HB2 HIS 537 HB2 HIS 537 -9.547 -2.451 6.614
332 HB3 HIS 537 HB3 HIS 537 -11.311 -2.430 6.602
333 HD1 HIS 537 HD1 HIS 537 -11.977 -2.953 3.712
334 HD2 HIS 537 HD2 HIS 537 -8.895 -4.966 5.669
335 HE1 HIS 537 HE1 HIS 537 -11.584 -5.094 2.416
336 HE2 HIS 537 HE2 HIS 537 -9.708 -6.332 3.599
337 H ILE 538 H ILE 538 -11.199 1.337 5.176
338 HA ILE 538 HA ILE 538 -9.229 2.288 7.155
339 HB ILE 538 HB ILE 538 -11.111 3.715 5.260
340 HG12 ILE 538 HG12 ILE 538 -8.105 3.888 5.541
341 HG13 ILE 538 HG13 ILE 538 -8.888 2.729 4.470
342 HG21 ILE 538 HG21 ILE 538 -11.131 5.070 7.230
343 HG22 ILE 538 HG22 ILE 538 -9.929 5.798 6.166
344 HG23 ILE 538 HG23 ILE 538 -9.413 4.795 7.521
345 HD11 ILE 538 HD11 ILE 538 -10.053 4.626 3.337
346 HD12 ILE 538 HD12 ILE 538 -8.298 4.730 3.198
347 HD13 ILE 538 HD13 ILE 538 -9.153 5.748 4.355
348 H THR 539 H THR 539 -9.803 2.892 9.184
349 HA THR 539 HA THR 539 -12.609 3.327 9.877
350 HB THR 539 HB THR 539 -12.281 0.866 10.065
351 HG1 THR 539 HG1 THR 539 -13.039 2.590 12.012
352 HG21 THR 539 HG21 THR 539 -10.716 -0.062 11.601
353 HG22 THR 539 HG22 THR 539 -10.361 1.515 12.307
354 HG23 THR 539 HG23 THR 539 -9.810 1.136 10.674
355 H ASN 540 H ASN 540 -12.867 4.118 12.089
356 HA ASN 540 HA ASN 540 -12.324 5.766 13.616
357 HB2 ASN 540 HB2 ASN 540 -11.492 3.810 14.780
358 HB3 ASN 540 HB3 ASN 540 -9.981 3.867 13.875
359 HD21 ASN 540 HD21 ASN 540 -8.617 4.254 15.725
360 HD22 ASN 540 HD22 ASN 540 -8.687 5.699 16.613
361 H THR 541 H THR 541 -8.940 5.199 13.224
362 HA THR 541 HA THR 541 -8.553 7.412 11.369
363 HB THR 541 HB THR 541 -7.268 7.565 14.079
364 HG1 THR 541 HG1 THR 541 -9.344 9.261 13.321
365 HG21 THR 541 HG21 THR 541 -6.292 8.729 12.031
366 HG22 THR 541 HG22 THR 541 -6.652 9.769 13.408
367 HG23 THR 541 HG23 THR 541 -7.747 9.724 12.025
368 H THR 542 H THR 542 -7.766 5.488 10.223
369 HA THR 542 HA THR 542 -4.942 5.328 10.286
370 HB THR 542 HB THR 542 -5.512 2.570 10.767
371 HG1 THR 542 HG1 THR 542 -6.229 3.133 13.085
372 HG21 THR 542 HG21 THR 542 -4.134 4.718 12.398
373 HG22 THR 542 HG22 THR 542 -3.392 3.503 11.359
374 HG23 THR 542 HG23 THR 542 -4.154 3.021 12.875
375 H PHE 543 H PHE 543 -4.115 3.885 8.624
376 HA PHE 543 HA PHE 543 -6.133 3.178 6.564
377 HB2 PHE 543 HB2 PHE 543 -4.943 5.102 5.770
378 HB3 PHE 543 HB3 PHE 543 -3.394 4.427 6.270
379 HD1 PHE 543 HD1 PHE 543 -6.319 3.693 4.046
380 HD2 PHE 543 HD2 PHE 543 -2.108 3.218 4.722
381 HE1 PHE 543 HE1 PHE 543 -6.088 2.607 1.829
382 HE2 PHE 543 HE2 PHE 543 -1.874 2.138 2.503
383 HZ PHE 543 HZ PHE 543 -3.862 1.830 1.059
384 H ASP 544 H ASP 544 -6.278 1.011 6.895
385 HA ASP 544 HA ASP 544 -3.790 -0.572 7.053
386 HB2 ASP 544 HB2 ASP 544 -6.595 -1.535 7.572
387 HB3 ASP 544 HB3 ASP 544 -5.078 -2.293 8.052
388 H PHE 545 H PHE 545 -3.343 -2.185 5.615
389 HA PHE 545 HA PHE 545 -5.264 -3.038 3.642
390 HB2 PHE 545 HB2 PHE 545 -3.980 -2.345 1.678
391 HB3 PHE 545 HB3 PHE 545 -4.500 -0.944 2.611
392 HD1 PHE 545 HD1 PHE 545 -2.866 0.165 4.188
393 HD2 PHE 545 HD2 PHE 545 -1.670 -2.787 1.306
394 HE1 PHE 545 HE1 PHE 545 -0.517 0.926 4.381
395 HE2 PHE 545 HE2 PHE 545 0.681 -2.022 1.496
396 HZ PHE 545 HZ PHE 545 1.259 -0.163 3.033
397 H ASP 546 H ASP 546 -4.324 -4.801 2.242
398 HA ASP 546 HA ASP 546 -2.144 -6.198 3.701
399 HB2 ASP 546 HB2 ASP 546 -4.330 -7.360 1.961
400 HB3 ASP 546 HB3 ASP 546 -3.124 -8.266 2.872
401 H LEU 547 H LEU 547 -0.539 -7.243 2.537
402 HA LEU 547 HA LEU 547 0.159 -6.014 0.008
403 HB2 LEU 547 HB2 LEU 547 1.479 -8.047 1.796
404 HB3 LEU 547 HB3 LEU 547 2.135 -7.656 0.221
405 HG LEU 547 HG LEU 547 3.096 -6.381 2.230
406 HD11 LEU 547 HD11 LEU 547 1.913 -4.509 0.171
407 HD12 LEU 547 HD12 LEU 547 3.146 -5.684 -0.284
408 HD13 LEU 547 HD13 LEU 547 3.499 -4.463 0.927
409 HD21 LEU 547 HD21 LEU 547 0.824 -5.972 3.251
410 HD22 LEU 547 HD22 LEU 547 0.520 -4.803 1.968
411 HD23 LEU 547 HD23 LEU 547 1.833 -4.538 3.111
412 H CYS 548 H CYS 548 -1.135 -9.042 1.160
413 HA CYS 548 HA CYS 548 -0.740 -10.506 -1.276
414 HB2 CYS 548 HB2 CYS 548 -1.168 -11.382 1.163
415 HB3 CYS 548 HB3 CYS 548 -2.869 -11.178 0.745
416 HG CYS 548 HG CYS 548 -1.070 -13.389 -0.285
417 H SER 549 H SER 549 -2.697 -7.954 -0.467
418 HA SER 549 HA SER 549 -4.992 -8.743 -2.100
419 HB2 SER 549 HB2 SER 549 -4.348 -6.307 -0.442
420 HB3 SER 549 HB3 SER 549 -5.765 -6.395 -1.483
421 HG SER 549 HG SER 549 -6.125 -7.086 0.715
422 H LEU 550 H LEU 550 -1.991 -7.782 -2.830
423 HA LEU 550 HA LEU 550 -2.605 -5.707 -4.786
424 HB2 LEU 550 HB2 LEU 550 -0.016 -7.207 -4.326
425 HB3 LEU 550 HB3 LEU 550 -0.220 -5.731 -5.263
426 HG LEU 550 HG LEU 550 -0.921 -5.907 -2.322
427 HD11 LEU 550 HD11 LEU 550 1.410 -6.377 -2.353
428 HD12 LEU 550 HD12 LEU 550 1.314 -4.638 -2.077
429 HD13 LEU 550 HD13 LEU 550 1.702 -5.253 -3.683
430 HD21 LEU 550 HD21 LEU 550 -1.946 -4.003 -3.348
431 HD22 LEU 550 HD22 LEU 550 -0.508 -3.650 -4.306
432 HD23 LEU 550 HD23 LEU 550 -0.493 -3.387 -2.564
433 H ASP 551 H ASP 551 -2.546 -5.957 -7.006
434 HA ASP 551 HA ASP 551 -2.979 -8.679 -7.994
435 HB2 ASP 551 HB2 ASP 551 -3.083 -6.088 -9.551
436 HB3 ASP 551 HB3 ASP 551 -3.779 -7.642 -10.004
437 H LYS 552 H LYS 552 -1.704 -9.687 -9.521
438 HA LYS 552 HA LYS 552 1.000 -9.520 -9.411
439 HB2 LYS 552 HB2 LYS 552 -0.819 -10.376 -11.652
440 HB3 LYS 552 HB3 LYS 552 0.931 -10.423 -11.863
441 HG2 LYS 552 HG2 LYS 552 0.138 -12.598 -11.067
442 HG3 LYS 552 HG3 LYS 552 1.115 -11.827 -9.817
443 HD2 LYS 552 HD2 LYS 552 -0.807 -11.206 -8.553
444 HD3 LYS 552 HD3 LYS 552 -1.896 -11.561 -9.897
445 HE2 LYS 552 HE2 LYS 552 -1.565 -13.908 -9.679
446 HE3 LYS 552 HE3 LYS 552 -0.165 -13.689 -8.628
447 HZ1 LYS 552 HZ1 LYS 552 -2.593 -14.194 -7.709
448 HZ2 LYS 552 HZ2 LYS 552 -2.660 -12.497 -7.727
449 HZ3 LYS 552 HZ3 LYS 552 -1.451 -13.292 -6.837
450 H THR 553 H THR 553 -0.957 -7.911 -11.933
451 HA THR 553 HA THR 553 1.227 -6.492 -13.051
452 HB THR 553 HB THR 553 -1.630 -5.615 -13.157
453 HG1 THR 553 HG1 THR 553 -2.000 -7.493 -13.987
454 HG21 THR 553 HG21 THR 553 -0.995 -4.781 -15.355
455 HG22 THR 553 HG22 THR 553 0.610 -5.489 -15.183
456 HG23 THR 553 HG23 THR 553 0.120 -4.149 -14.146
457 H THR 554 H THR 554 -0.744 -5.972 -10.269
458 HA THR 554 HA THR 554 -0.078 -3.141 -10.053
459 HB THR 554 HB THR 554 -1.532 -5.011 -8.166
460 HG1 THR 554 HG1 THR 554 -2.609 -2.835 -9.575
461 HG21 THR 554 HG21 THR 554 -2.256 -2.722 -7.194
462 HG22 THR 554 HG22 THR 554 -0.832 -2.083 -8.016
463 HG23 THR 554 HG23 THR 554 -0.654 -3.324 -6.777
464 H VAL 555 H VAL 555 1.101 -6.213 -8.904
465 HA VAL 555 HA VAL 555 2.559 -5.283 -6.654
466 HB VAL 555 HB VAL 555 2.918 -7.682 -8.463
467 HG11 VAL 555 HG11 VAL 555 4.370 -8.515 -6.525
468 HG12 VAL 555 HG12 VAL 555 4.439 -6.836 -5.985
469 HG13 VAL 555 HG13 VAL 555 5.097 -7.285 -7.559
470 HG21 VAL 555 HG21 VAL 555 1.850 -8.891 -6.709
471 HG22 VAL 555 HG22 VAL 555 0.893 -7.425 -6.905
472 HG23 VAL 555 HG23 VAL 555 2.038 -7.556 -5.571
473 H ARG 556 H ARG 556 3.241 -5.476 -10.090
474 HA ARG 556 HA ARG 556 6.002 -4.913 -9.998
475 HB2 ARG 556 HB2 ARG 556 3.881 -4.502 -12.106
476 HB3 ARG 556 HB3 ARG 556 5.567 -4.066 -12.384
477 HG2 ARG 556 HG2 ARG 556 4.646 -6.821 -11.505
478 HG3 ARG 556 HG3 ARG 556 4.957 -6.379 -13.182
479 HD2 ARG 556 HD2 ARG 556 7.048 -7.210 -12.677
480 HD3 ARG 556 HD3 ARG 556 7.305 -5.574 -12.083
481 HE ARG 556 HE ARG 556 7.326 -6.423 -9.919
482 HH11 ARG 556 HH11 ARG 556 6.023 -8.722 -12.155
483 HH12 ARG 556 HH12 ARG 556 5.975 -10.018 -11.007
484 HH21 ARG 556 HH21 ARG 556 7.265 -8.119 -8.409
485 HH22 ARG 556 HH22 ARG 556 6.677 -9.677 -8.887
486 H LYS 557 H LYS 557 3.167 -2.782 -10.256
487 HA LYS 557 HA LYS 557 4.723 -0.381 -10.402
488 HB2 LYS 557 HB2 LYS 557 1.809 -0.995 -9.934
489 HB3 LYS 557 HB3 LYS 557 2.423 0.651 -9.783
490 HG2 LYS 557 HG2 LYS 557 1.520 0.063 -12.075
491 HG3 LYS 557 HG3 LYS 557 3.177 0.665 -12.068
492 HD2 LYS 557 HD2 LYS 557 4.079 -1.524 -12.356
493 HD3 LYS 557 HD3 LYS 557 2.533 -2.286 -11.984
494 HE2 LYS 557 HE2 LYS 557 3.014 -0.495 -14.382
495 HE3 LYS 557 HE3 LYS 557 3.056 -2.258 -14.436
496 HZ1 LYS 557 HZ1 LYS 557 0.739 -2.002 -13.304
497 HZ2 LYS 557 HZ2 LYS 557 0.894 -1.853 -14.990
498 HZ3 LYS 557 HZ3 LYS 557 0.772 -0.464 -14.019
499 H LEU 558 H LEU 558 3.410 -2.357 -7.861
500 HA LEU 558 HA LEU 558 3.557 -0.461 -5.753
501 HB2 LEU 558 HB2 LEU 558 2.378 -2.833 -5.937
502 HB3 LEU 558 HB3 LEU 558 3.896 -3.410 -5.270
503 HG LEU 558 HG LEU 558 2.437 -3.028 -3.416
504 HD11 LEU 558 HD11 LEU 558 4.825 -2.153 -3.280
505 HD12 LEU 558 HD12 LEU 558 3.691 -1.491 -2.106
506 HD13 LEU 558 HD13 LEU 558 4.152 -0.540 -3.516
507 HD21 LEU 558 HD21 LEU 558 1.020 -1.211 -3.117
508 HD22 LEU 558 HD22 LEU 558 0.999 -1.338 -4.873
509 HD23 LEU 558 HD23 LEU 558 2.008 -0.125 -4.088
510 H GLN 559 H GLN 559 5.687 -3.168 -6.650
511 HA GLN 559 HA GLN 559 7.716 -2.575 -4.770
512 HB2 GLN 559 HB2 GLN 559 7.913 -4.091 -7.381
513 HB3 GLN 559 HB3 GLN 559 9.080 -4.149 -6.060
514 HG2 GLN 559 HG2 GLN 559 7.525 -5.203 -4.596
515 HG3 GLN 559 HG3 GLN 559 6.163 -4.838 -5.654
516 HE21 GLN 559 HE21 GLN 559 6.443 -7.493 -4.955
517 HE22 GLN 559 HE22 GLN 559 7.048 -8.393 -6.259
518 H SER 560 H SER 560 7.030 -1.348 -7.962
519 HA SER 560 HA SER 560 9.616 -0.331 -8.561
520 HB2 SER 560 HB2 SER 560 8.080 -0.545 -10.366
521 HB3 SER 560 HB3 SER 560 6.851 0.398 -9.526
522 HG SER 560 HG SER 560 9.038 1.209 -10.983
523 H TYR 561 H TYR 561 6.725 1.215 -7.138
524 HA TYR 561 HA TYR 561 7.618 3.802 -6.898
525 HB2 TYR 561 HB2 TYR 561 5.887 2.120 -5.094
526 HB3 TYR 561 HB3 TYR 561 6.267 3.786 -4.664
527 HD1 TYR 561 HD1 TYR 561 6.061 5.467 -6.815
528 HD2 TYR 561 HD2 TYR 561 3.870 1.814 -6.230
529 HE1 TYR 561 HE1 TYR 561 4.302 6.277 -8.344
530 HE2 TYR 561 HE2 TYR 561 2.102 2.635 -7.758
531 HH TYR 561 HH TYR 561 1.387 5.315 -8.475
532 H LEU 562 H LEU 562 8.964 1.040 -5.406
533 HA LEU 562 HA LEU 562 10.140 2.456 -3.164
534 HB2 LEU 562 HB2 LEU 562 10.997 -0.246 -4.196
535 HB3 LEU 562 HB3 LEU 562 11.086 0.381 -2.550
536 HG LEU 562 HG LEU 562 8.551 -0.279 -4.078
537 HD11 LEU 562 HD11 LEU 562 9.969 -2.182 -3.145
538 HD12 LEU 562 HD12 LEU 562 8.311 -2.104 -2.552
539 HD13 LEU 562 HD13 LEU 562 9.636 -1.524 -1.543
540 HD21 LEU 562 HD21 LEU 562 9.055 0.987 -1.377
541 HD22 LEU 562 HD22 LEU 562 7.540 0.164 -1.747
542 HD23 LEU 562 HD23 LEU 562 8.026 1.577 -2.682
543 H GLU 563 H GLU 563 11.538 0.750 -5.977
544 HA GLU 563 HA GLU 563 14.018 2.251 -5.699
545 HB2 GLU 563 HB2 GLU 563 13.216 0.126 -7.700
546 HB3 GLU 563 HB3 GLU 563 14.838 0.784 -7.485
547 HG2 GLU 563 HG2 GLU 563 13.318 -0.499 -5.210
548 HG3 GLU 563 HG3 GLU 563 14.338 -1.437 -6.300
549 H THR 564 H THR 564 12.000 4.004 -6.279
550 HA THR 564 HA THR 564 11.374 4.499 -8.940
551 HB THR 564 HB THR 564 11.301 6.949 -8.195
552 HG1 THR 564 HG1 THR 564 11.324 6.623 -5.651
553 HG21 THR 564 HG21 THR 564 9.847 4.726 -6.761
554 HG22 THR 564 HG22 THR 564 9.276 5.711 -8.107
555 HG23 THR 564 HG23 THR 564 9.445 6.423 -6.501
556 H SER 565 H SER 565 12.282 5.903 -10.516
557 HA SER 565 HA SER 565 15.124 5.675 -10.763
558 HB2 SER 565 HB2 SER 565 14.835 6.798 -12.884
559 HB3 SER 565 HB3 SER 565 13.525 5.637 -12.689
560 HG SER 565 HG SER 565 12.140 7.267 -12.252
561 H GLY 566 H GLY 566 15.476 8.286 -12.068
562 HA2 GLY 566 HA2 GLY 566 15.054 10.394 -10.207
563 HA3 GLY 566 HA3 GLY 566 16.674 9.729 -10.013
564 H THR 567 H THR 567 17.686 9.281 -12.357
565 HA THR 567 HA THR 567 18.445 11.692 -13.439
566 HB THR 567 HB THR 567 19.211 10.437 -15.397
567 HG1 THR 567 HG1 THR 567 17.155 9.135 -15.311
568 HG21 THR 567 HG21 THR 567 20.428 8.595 -14.152
569 HG22 THR 567 HG22 THR 567 19.471 9.024 -12.735
570 HG23 THR 567 HG23 THR 567 20.580 10.200 -13.438
571 H SER 568 H SER 568 15.676 9.686 -14.324
572 HA SER 568 HA SER 568 14.918 11.236 -16.602
573 HB2 SER 568 HB2 SER 568 13.004 9.869 -16.696
574 HB3 SER 568 HB3 SER 568 14.239 8.820 -16.007
575 HG SER 568 HG SER 568 12.229 8.798 -14.850
576 H1 THR 876 H1 THR 876 0.140 -17.164 10.022
577 H2 THR 876 H2 THR 876 1.267 -16.089 9.345
578 H3 THR 876 H3 THR 876 0.660 -17.379 8.422
579 HA THR 876 HA THR 876 -1.622 -16.333 8.793
580 HB THR 876 HB THR 876 0.100 -13.881 9.201
581 HG1 THR 876 HG1 THR 876 -0.610 -15.797 10.965
582 HG21 THR 876 HG21 THR 876 -2.261 -13.780 8.210
583 HG22 THR 876 HG22 THR 876 -1.965 -12.781 9.633
584 HG23 THR 876 HG23 THR 876 -2.830 -14.310 9.793
585 H ASN 877 H ASN 877 -2.053 -16.594 6.690
586 HA ASN 877 HA ASN 877 -0.211 -15.893 4.610
587 HB2 ASN 877 HB2 ASN 877 -3.116 -16.733 4.520
588 HB3 ASN 877 HB3 ASN 877 -2.096 -16.523 3.097
589 HD21 ASN 877 HD21 ASN 877 -0.261 -17.659 5.745
590 HD22 ASN 877 HD22 ASN 877 -0.254 -19.304 5.332
591 H LYS 878 H LYS 878 -0.809 -13.661 6.242
592 HA LYS 878 HA LYS 878 -1.761 -11.802 4.198
593 HB2 LYS 878 HB2 LYS 878 -2.946 -11.866 6.992
594 HB3 LYS 878 HB3 LYS 878 -3.306 -10.685 5.732
595 HG2 LYS 878 HG2 LYS 878 -4.035 -12.641 4.274
596 HG3 LYS 878 HG3 LYS 878 -3.937 -13.644 5.722
597 HD2 LYS 878 HD2 LYS 878 -5.586 -12.264 6.854
598 HD3 LYS 878 HD3 LYS 878 -5.607 -11.123 5.510
599 HE2 LYS 878 HE2 LYS 878 -7.482 -12.932 5.636
600 HE3 LYS 878 HE3 LYS 878 -6.709 -12.625 4.082
601 HZ1 LYS 878 HZ1 LYS 878 -6.947 -15.041 4.975
602 HZ2 LYS 878 HZ2 LYS 878 -5.562 -14.647 5.876
603 HZ3 LYS 878 HZ3 LYS 878 -5.526 -14.564 4.180
604 H LEU 879 H LEU 879 -1.276 -9.568 4.809
605 HA LEU 879 HA LEU 879 0.790 -9.198 6.867
606 HB2 LEU 879 HB2 LEU 879 1.057 -8.743 3.906
607 HB3 LEU 879 HB3 LEU 879 2.065 -7.877 5.046
608 HG LEU 879 HG LEU 879 1.898 -10.879 5.199
609 HD11 LEU 879 HD11 LEU 879 3.439 -9.224 3.196
610 HD12 LEU 879 HD12 LEU 879 2.451 -10.659 2.911
611 HD13 LEU 879 HD13 LEU 879 4.016 -10.812 3.710
612 HD21 LEU 879 HD21 LEU 879 3.082 -9.314 6.902
613 HD22 LEU 879 HD22 LEU 879 4.292 -9.086 5.643
614 HD23 LEU 879 HD23 LEU 879 3.991 -10.695 6.295
615 HA PRO 880 HA PRO 880 -2.096 -5.634 6.524
616 HB2 PRO 880 HB2 PRO 880 -2.493 -5.148 9.162
617 HB3 PRO 880 HB3 PRO 880 -3.316 -6.474 8.316
618 HG2 PRO 880 HG2 PRO 880 -0.938 -6.570 10.118
619 HG3 PRO 880 HG3 PRO 880 -2.302 -7.694 9.993
620 HD2 PRO 880 HD2 PRO 880 0.193 -8.106 8.812
621 HD3 PRO 880 HD3 PRO 880 -1.310 -8.896 8.284
622 H VAL 881 H VAL 881 -1.662 -3.444 6.588
623 HA VAL 881 HA VAL 881 0.748 -2.487 8.023
624 HB VAL 881 HB VAL 881 0.082 -1.864 5.143
625 HG11 VAL 881 HG11 VAL 881 2.335 -0.721 5.256
626 HG12 VAL 881 HG12 VAL 881 2.290 -0.946 7.004
627 HG13 VAL 881 HG13 VAL 881 1.078 0.064 6.214
628 HG21 VAL 881 HG21 VAL 881 2.340 -2.992 4.798
629 HG22 VAL 881 HG22 VAL 881 0.998 -4.052 5.234
630 HG23 VAL 881 HG23 VAL 881 2.185 -3.583 6.453
631 H SER 882 H SER 882 -0.110 -1.127 9.426
632 HA SER 882 HA SER 882 -2.349 0.629 8.650
633 HB2 SER 882 HB2 SER 882 -2.613 1.064 10.994
634 HB3 SER 882 HB3 SER 882 -2.386 -0.672 10.807
635 HG SER 882 HG SER 882 -1.075 0.231 12.471
636 H ILE 883 H ILE 883 -2.049 2.739 8.142
637 HA ILE 883 HA ILE 883 0.503 4.037 8.916
638 HB ILE 883 HB ILE 883 -1.066 4.617 6.404
639 HG12 ILE 883 HG12 ILE 883 1.345 2.819 6.816
640 HG13 ILE 883 HG13 ILE 883 -0.248 2.324 6.244
641 HG21 ILE 883 HG21 ILE 883 0.854 5.889 5.770
642 HG22 ILE 883 HG22 ILE 883 1.819 5.219 7.084
643 HG23 ILE 883 HG23 ILE 883 0.510 6.345 7.437
644 HD11 ILE 883 HD11 ILE 883 0.067 3.952 4.308
645 HD12 ILE 883 HD12 ILE 883 1.137 2.549 4.291
646 HD13 ILE 883 HD13 ILE 883 1.744 4.110 4.830
647 HA PRO 884 HA PRO 884 -2.534 6.638 11.139
648 HB2 PRO 884 HB2 PRO 884 -0.138 8.454 10.999
649 HB3 PRO 884 HB3 PRO 884 -1.230 8.138 12.365
650 HG2 PRO 884 HG2 PRO 884 1.160 6.995 12.262
651 HG3 PRO 884 HG3 PRO 884 -0.252 6.095 12.847
652 HD2 PRO 884 HD2 PRO 884 1.201 5.826 10.248
653 HD3 PRO 884 HD3 PRO 884 0.307 4.597 11.174
654 H LEU 885 H LEU 885 -4.069 7.754 10.090
655 HA LEU 885 HA LEU 885 -3.899 8.653 7.457
656 HB2 LEU 885 HB2 LEU 885 -5.758 9.748 9.578
657 HB3 LEU 885 HB3 LEU 885 -6.013 9.764 7.836
658 HG LEU 885 HG LEU 885 -5.910 7.333 9.638
659 HD11 LEU 885 HD11 LEU 885 -8.010 8.763 9.533
660 HD12 LEU 885 HD12 LEU 885 -8.224 7.074 9.073
661 HD13 LEU 885 HD13 LEU 885 -8.125 8.321 7.830
662 HD21 LEU 885 HD21 LEU 885 -4.894 6.557 7.652
663 HD22 LEU 885 HD22 LEU 885 -5.866 7.616 6.630
664 HD23 LEU 885 HD23 LEU 885 -6.599 6.198 7.380
665 H ALA 886 H ALA 886 -2.552 10.042 10.239
666 HA ALA 886 HA ALA 886 -2.676 12.791 9.376
667 HB1 ALA 886 HB1 ALA 886 -2.424 11.880 11.783
668 HB2 ALA 886 HB2 ALA 886 -1.435 13.267 11.322
669 HB3 ALA 886 HB3 ALA 886 -0.724 11.653 11.372
670 H SER 887 H SER 887 -0.682 10.031 8.787
671 HA SER 887 HA SER 887 1.609 11.577 7.866
672 HB2 SER 887 HB2 SER 887 2.001 9.456 9.011
673 HB3 SER 887 HB3 SER 887 1.037 8.605 7.807
674 HG SER 887 HG SER 887 3.494 8.798 7.612
675 H VAL 888 H VAL 888 -1.286 10.275 6.539
676 HA VAL 888 HA VAL 888 -0.355 10.954 3.818
677 HB VAL 888 HB VAL 888 -1.810 8.991 3.045
678 HG11 VAL 888 HG11 VAL 888 0.787 8.639 4.554
679 HG12 VAL 888 HG12 VAL 888 0.552 8.797 2.813
680 HG13 VAL 888 HG13 VAL 888 0.044 7.326 3.641
681 HG21 VAL 888 HG21 VAL 888 -2.911 8.694 5.283
682 HG22 VAL 888 HG22 VAL 888 -1.365 8.130 5.921
683 HG23 VAL 888 HG23 VAL 888 -2.187 7.211 4.660
684 H VAL 889 H VAL 889 -2.584 10.541 2.432
685 HA VAL 889 HA VAL 889 -4.815 11.904 3.786
686 HB VAL 889 HB VAL 889 -3.869 12.817 1.072
687 HG11 VAL 889 HG11 VAL 889 -5.230 14.763 1.584
688 HG12 VAL 889 HG12 VAL 889 -5.497 14.190 3.231
689 HG13 VAL 889 HG13 VAL 889 -6.198 13.317 1.869
690 HG21 VAL 889 HG21 VAL 889 -2.999 13.744 3.819
691 HG22 VAL 889 HG22 VAL 889 -2.900 14.792 2.402
692 HG23 VAL 889 HG23 VAL 889 -1.981 13.286 2.453
693 H LEU 890 H LEU 890 -6.353 10.414 3.580
694 HA LEU 890 HA LEU 890 -6.545 8.776 1.179
695 HB2 LEU 890 HB2 LEU 890 -7.812 8.739 3.895
696 HB3 LEU 890 HB3 LEU 890 -8.579 7.852 2.581
697 HG LEU 890 HG LEU 890 -6.963 6.494 3.976
698 HD11 LEU 890 HD11 LEU 890 -7.539 6.165 1.409
699 HD12 LEU 890 HD12 LEU 890 -6.262 5.221 2.161
700 HD13 LEU 890 HD13 LEU 890 -5.851 6.618 1.183
701 HD21 LEU 890 HD21 LEU 890 -4.629 6.900 3.874
702 HD22 LEU 890 HD22 LEU 890 -5.345 8.488 4.156
703 HD23 LEU 890 HD23 LEU 890 -4.800 8.040 2.540
704 HA PRO 891 HA PRO 891 -9.665 11.612 -0.397
705 HB2 PRO 891 HB2 PRO 891 -10.352 10.323 -2.670
706 HB3 PRO 891 HB3 PRO 891 -8.766 11.103 -2.485
707 HG2 PRO 891 HG2 PRO 891 -9.497 8.222 -2.170
708 HG3 PRO 891 HG3 PRO 891 -8.119 8.941 -3.025
709 HD2 PRO 891 HD2 PRO 891 -7.916 7.908 -0.489
710 HD3 PRO 891 HD3 PRO 891 -6.894 9.243 -1.072
711 H SER 892 H SER 892 -12.012 11.338 -1.335
712 HA SER 892 HA SER 892 -14.191 10.774 -0.883
713 HB2 SER 892 HB2 SER 892 -13.487 8.680 -2.009
714 HB3 SER 892 HB3 SER 892 -13.009 8.020 -0.449
715 HG SER 892 HG SER 892 -15.192 8.334 0.226
716 H ARG 893 H ARG 893 -15.640 9.673 0.844
717 HA ARG 893 HA ARG 893 -14.577 9.210 3.441
718 HB2 ARG 893 HB2 ARG 893 -15.715 11.336 4.424
719 HB3 ARG 893 HB3 ARG 893 -14.121 11.498 3.683
720 HG2 ARG 893 HG2 ARG 893 -15.028 12.397 1.675
721 HG3 ARG 893 HG3 ARG 893 -16.667 11.915 2.110
722 HD2 ARG 893 HD2 ARG 893 -16.079 14.389 2.435
723 HD3 ARG 893 HD3 ARG 893 -16.821 13.568 3.805
724 HE ARG 893 HE ARG 893 -14.022 13.345 4.038
725 HH11 ARG 893 HH11 ARG 893 -16.557 15.698 4.117
726 HH12 ARG 893 HH12 ARG 893 -15.728 16.757 5.208
727 HH21 ARG 893 HH21 ARG 893 -12.927 14.730 5.468
728 HH22 ARG 893 HH22 ARG 893 -13.673 16.209 5.973
729 H ALA 894 H ALA 894 -16.002 7.436 3.205
730 HA ALA 894 HA ALA 894 -17.987 6.295 3.415
731 HB1 ALA 894 HB1 ALA 894 -17.884 7.526 5.601
732 HB2 ALA 894 HB2 ALA 894 -19.522 7.146 5.067
733 HB3 ALA 894 HB3 ALA 894 -18.890 8.782 4.880
734 H GLU 895 H GLU 895 -18.708 6.183 1.311
735 HA GLU 895 HA GLU 895 -20.119 8.390 0.079
736 HB2 GLU 895 HB2 GLU 895 -20.514 6.710 -1.751
737 HB3 GLU 895 HB3 GLU 895 -18.813 6.968 -1.360
738 HG2 GLU 895 HG2 GLU 895 -18.746 4.948 -0.030
739 HG3 GLU 895 HG3 GLU 895 -20.489 4.730 -0.193
740 H ARG 896 H ARG 896 -21.005 6.526 2.525
741 HA ARG 896 HA ARG 896 -23.376 5.237 1.921
742 HB2 ARG 896 HB2 ARG 896 -22.188 5.349 4.167
743 HB3 ARG 896 HB3 ARG 896 -22.982 6.907 4.406
744 HG2 ARG 896 HG2 ARG 896 -25.180 5.868 4.164
745 HG3 ARG 896 HG3 ARG 896 -24.430 4.309 3.814
746 HD2 ARG 896 HD2 ARG 896 -25.188 4.540 6.195
747 HD3 ARG 896 HD3 ARG 896 -23.466 4.206 6.032
748 HE ARG 896 HE ARG 896 -23.863 7.005 6.118
749 HH11 ARG 896 HH11 ARG 896 -24.077 4.160 8.077
750 HH12 ARG 896 HH12 ARG 896 -23.743 4.988 9.560
751 HH21 ARG 896 HH21 ARG 896 -23.422 8.098 8.060
752 HH22 ARG 896 HH22 ARG 896 -23.372 7.218 9.551
753 H ALA 897 H ALA 897 -25.487 5.826 1.642
754 HA ALA 897 HA ALA 897 -27.207 7.162 0.896
755 HB1 ALA 897 HB1 ALA 897 -27.834 8.921 2.380
756 HB2 ALA 897 HB2 ALA 897 -26.172 9.145 2.926
757 HB3 ALA 897 HB3 ALA 897 -27.061 7.691 3.378
758 H ARG 898 H ARG 898 -26.716 7.733 -1.178
759 HA ARG 898 HA ARG 898 -24.714 9.549 -1.972
760 HB2 ARG 898 HB2 ARG 898 -27.305 8.840 -3.373
761 HB3 ARG 898 HB3 ARG 898 -25.916 9.622 -4.125
762 HG2 ARG 898 HG2 ARG 898 -25.540 6.993 -2.694
763 HG3 ARG 898 HG3 ARG 898 -26.209 7.005 -4.324
764 HD2 ARG 898 HD2 ARG 898 -23.556 8.211 -3.482
765 HD3 ARG 898 HD3 ARG 898 -23.776 6.735 -4.415
766 HE ARG 898 HE ARG 898 -25.011 9.069 -5.604
767 HH11 ARG 898 HH11 ARG 898 -22.151 7.153 -5.251
768 HH12 ARG 898 HH12 ARG 898 -21.457 7.664 -6.754
769 HH21 ARG 898 HH21 ARG 898 -24.106 9.743 -7.576
770 HH22 ARG 898 HH22 ARG 898 -22.564 9.131 -8.069
771 H SER 899 H SER 899 -28.122 10.006 -1.152
772 HA SER 899 HA SER 899 -28.457 12.648 -1.981
773 HB2 SER 899 HB2 SER 899 -29.638 11.336 0.476
774 HB3 SER 899 HB3 SER 899 -30.258 12.772 -0.333
775 HG SER 899 HG SER 899 -30.990 11.566 -1.934
776 H THR 900 H THR 900 -27.988 11.729 1.432
777 HA THR 900 HA THR 900 -25.814 13.562 1.819
778 HB THR 900 HB THR 900 -28.495 14.308 3.012
779 HG1 THR 900 HG1 THR 900 -27.142 16.075 1.410
780 HG21 THR 900 HG21 THR 900 -26.739 14.882 4.535
781 HG22 THR 900 HG22 THR 900 -27.160 16.365 3.679
782 HG23 THR 900 HG23 THR 900 -25.711 15.469 3.228
Start of MODEL 6
1 H1 ASP 500 H1 ASP 500 3.282 -20.238 -6.100
2 H2 ASP 500 H2 ASP 500 3.919 -18.663 -6.133
3 H3 ASP 500 H3 ASP 500 3.237 -19.278 -4.703
4 HA ASP 500 HA ASP 500 5.079 -21.123 -5.095
5 HB2 ASP 500 HB2 ASP 500 5.785 -19.794 -7.169
6 HB3 ASP 500 HB3 ASP 500 6.395 -18.576 -6.049
7 H LYS 501 H LYS 501 6.995 -20.799 -3.610
8 HA LYS 501 HA LYS 501 6.100 -19.461 -1.223
9 HB2 LYS 501 HB2 LYS 501 8.720 -20.858 -1.823
10 HB3 LYS 501 HB3 LYS 501 8.159 -20.365 -0.224
11 HG2 LYS 501 HG2 LYS 501 6.074 -21.785 -0.685
12 HG3 LYS 501 HG3 LYS 501 6.966 -22.459 -2.050
13 HD2 LYS 501 HD2 LYS 501 7.823 -22.518 0.860
14 HD3 LYS 501 HD3 LYS 501 7.266 -23.894 -0.094
15 HE2 LYS 501 HE2 LYS 501 9.832 -22.331 -0.376
16 HE3 LYS 501 HE3 LYS 501 9.623 -24.069 -0.171
17 HZ1 LYS 501 HZ1 LYS 501 8.326 -23.832 -2.398
18 HZ2 LYS 501 HZ2 LYS 501 10.021 -23.927 -2.403
19 HZ3 LYS 501 HZ3 LYS 501 9.250 -22.422 -2.572
20 H ALA 502 H ALA 502 7.668 -18.398 -3.954
21 HA ALA 502 HA ALA 502 9.497 -16.540 -2.672
22 HB1 ALA 502 HB1 ALA 502 10.053 -17.529 -4.858
23 HB2 ALA 502 HB2 ALA 502 9.946 -15.771 -4.961
24 HB3 ALA 502 HB3 ALA 502 8.624 -16.772 -5.563
25 H TYR 503 H TYR 503 6.416 -16.406 -4.405
26 HA TYR 503 HA TYR 503 5.958 -13.727 -4.648
27 HB2 TYR 503 HB2 TYR 503 4.389 -15.638 -5.249
28 HB3 TYR 503 HB3 TYR 503 3.849 -15.602 -3.571
29 HD1 TYR 503 HD1 TYR 503 4.502 -13.240 -6.413
30 HD2 TYR 503 HD2 TYR 503 2.024 -14.227 -3.046
31 HE1 TYR 503 HE1 TYR 503 3.019 -11.332 -6.945
32 HE2 TYR 503 HE2 TYR 503 0.535 -12.318 -3.584
33 HH TYR 503 HH TYR 503 0.560 -10.249 -4.771
34 H LEU 504 H LEU 504 5.076 -15.625 -1.736
35 HA LEU 504 HA LEU 504 4.182 -13.611 -0.105
36 HB2 LEU 504 HB2 LEU 504 5.789 -16.086 0.510
37 HB3 LEU 504 HB3 LEU 504 5.279 -14.992 1.794
38 HG LEU 504 HG LEU 504 2.919 -15.232 1.008
39 HD11 LEU 504 HD11 LEU 504 3.125 -15.812 -1.281
40 HD12 LEU 504 HD12 LEU 504 2.551 -17.290 -0.509
41 HD13 LEU 504 HD13 LEU 504 4.254 -17.122 -0.936
42 HD21 LEU 504 HD21 LEU 504 2.729 -17.699 1.696
43 HD22 LEU 504 HD22 LEU 504 3.541 -16.629 2.840
44 HD23 LEU 504 HD23 LEU 504 4.491 -17.692 1.802
45 H ASP 505 H ASP 505 7.566 -14.589 -0.588
46 HA ASP 505 HA ASP 505 8.828 -12.878 1.179
47 HB2 ASP 505 HB2 ASP 505 9.862 -14.638 -0.383
48 HB3 ASP 505 HB3 ASP 505 9.898 -13.365 -1.599
49 H GLU 506 H GLU 506 7.601 -12.174 -2.069
50 HA GLU 506 HA GLU 506 8.642 -9.545 -2.268
51 HB2 GLU 506 HB2 GLU 506 6.119 -10.627 -3.546
52 HB3 GLU 506 HB3 GLU 506 7.084 -9.255 -4.096
53 HG2 GLU 506 HG2 GLU 506 9.030 -10.823 -4.374
54 HG3 GLU 506 HG3 GLU 506 7.940 -12.160 -4.008
55 H LEU 507 H LEU 507 5.934 -10.893 -0.595
56 HA LEU 507 HA LEU 507 4.621 -8.316 -0.185
57 HB2 LEU 507 HB2 LEU 507 3.947 -10.875 1.257
58 HB3 LEU 507 HB3 LEU 507 2.893 -9.518 0.864
59 HG LEU 507 HG LEU 507 4.098 -11.499 -1.086
60 HD11 LEU 507 HD11 LEU 507 1.638 -11.902 -1.552
61 HD12 LEU 507 HD12 LEU 507 1.284 -10.912 -0.136
62 HD13 LEU 507 HD13 LEU 507 2.180 -12.419 0.045
63 HD21 LEU 507 HD21 LEU 507 2.547 -8.935 -1.507
64 HD22 LEU 507 HD22 LEU 507 2.629 -10.198 -2.734
65 HD23 LEU 507 HD23 LEU 507 4.101 -9.385 -2.204
66 H VAL 508 H VAL 508 6.373 -10.740 1.755
67 HA VAL 508 HA VAL 508 6.213 -9.432 4.224
68 HB VAL 508 HB VAL 508 8.453 -11.171 3.164
69 HG11 VAL 508 HG11 VAL 508 9.197 -9.990 5.132
70 HG12 VAL 508 HG12 VAL 508 8.758 -11.621 5.640
71 HG13 VAL 508 HG13 VAL 508 7.660 -10.275 5.949
72 HG21 VAL 508 HG21 VAL 508 5.851 -11.751 4.604
73 HG22 VAL 508 HG22 VAL 508 7.180 -12.909 4.532
74 HG23 VAL 508 HG23 VAL 508 6.386 -12.386 3.047
75 H GLU 509 H GLU 509 8.933 -9.376 1.902
76 HA GLU 509 HA GLU 509 10.572 -7.548 3.150
77 HB2 GLU 509 HB2 GLU 509 9.985 -7.822 0.191
78 HB3 GLU 509 HB3 GLU 509 11.327 -6.891 0.855
79 HG2 GLU 509 HG2 GLU 509 10.883 -9.815 1.491
80 HG3 GLU 509 HG3 GLU 509 11.898 -9.269 0.158
81 H LEU 510 H LEU 510 7.978 -6.769 0.815
82 HA LEU 510 HA LEU 510 8.174 -3.971 1.048
83 HB2 LEU 510 HB2 LEU 510 6.117 -5.906 0.077
84 HB3 LEU 510 HB3 LEU 510 5.545 -4.283 0.451
85 HG LEU 510 HG LEU 510 7.169 -3.308 -1.076
86 HD11 LEU 510 HD11 LEU 510 8.185 -6.143 -1.218
87 HD12 LEU 510 HD12 LEU 510 9.094 -4.656 -0.971
88 HD13 LEU 510 HD13 LEU 510 8.453 -5.038 -2.565
89 HD21 LEU 510 HD21 LEU 510 4.986 -4.163 -1.960
90 HD22 LEU 510 HD22 LEU 510 5.795 -5.668 -2.397
91 HD23 LEU 510 HD23 LEU 510 6.267 -4.157 -3.174
92 H HIS 511 H HIS 511 6.027 -6.275 2.736
93 HA HIS 511 HA HIS 511 4.653 -4.509 4.356
94 HB2 HIS 511 HB2 HIS 511 4.167 -6.911 4.277
95 HB3 HIS 511 HB3 HIS 511 5.695 -7.256 5.083
96 HD1 HIS 511 HD1 HIS 511 2.290 -5.825 5.683
97 HD2 HIS 511 HD2 HIS 511 5.732 -6.679 7.869
98 HE1 HIS 511 HE1 HIS 511 1.666 -5.581 8.130
99 HE2 HIS 511 HE2 HIS 511 3.756 -6.101 9.476
100 H ARG 512 H ARG 512 7.670 -6.221 5.154
101 HA ARG 512 HA ARG 512 8.187 -4.985 7.603
102 HB2 ARG 512 HB2 ARG 512 9.403 -6.937 7.042
103 HB3 ARG 512 HB3 ARG 512 9.943 -6.260 5.506
104 HG2 ARG 512 HG2 ARG 512 11.479 -4.801 6.552
105 HG3 ARG 512 HG3 ARG 512 10.721 -4.995 8.134
106 HD2 ARG 512 HD2 ARG 512 11.526 -7.236 8.342
107 HD3 ARG 512 HD3 ARG 512 12.012 -7.288 6.651
108 HE ARG 512 HE ARG 512 13.516 -6.148 8.835
109 HH11 ARG 512 HH11 ARG 512 12.852 -6.065 5.440
110 HH12 ARG 512 HH12 ARG 512 14.387 -5.385 5.016
111 HH21 ARG 512 HH21 ARG 512 15.532 -5.256 8.287
112 HH22 ARG 512 HH22 ARG 512 15.906 -4.928 6.627
113 H ARG 513 H ARG 513 9.551 -4.191 4.391
114 HA ARG 513 HA ARG 513 11.014 -1.948 5.111
115 HB2 ARG 513 HB2 ARG 513 9.564 -2.637 2.555
116 HB3 ARG 513 HB3 ARG 513 10.562 -1.191 2.712
117 HG2 ARG 513 HG2 ARG 513 12.507 -2.545 3.287
118 HG3 ARG 513 HG3 ARG 513 11.527 -4.011 3.267
119 HD2 ARG 513 HD2 ARG 513 10.969 -3.443 0.844
120 HD3 ARG 513 HD3 ARG 513 12.240 -2.227 0.932
121 HE ARG 513 HE ARG 513 13.377 -4.602 1.821
122 HH11 ARG 513 HH11 ARG 513 11.828 -3.377 -1.020
123 HH12 ARG 513 HH12 ARG 513 12.712 -4.394 -2.109
124 HH21 ARG 513 HH21 ARG 513 14.542 -5.937 0.401
125 HH22 ARG 513 HH22 ARG 513 14.250 -5.842 -1.304
126 H LEU 514 H LEU 514 7.656 -2.040 3.919
127 HA LEU 514 HA LEU 514 7.084 0.671 4.098
128 HB2 LEU 514 HB2 LEU 514 5.365 -1.786 4.386
129 HB3 LEU 514 HB3 LEU 514 4.672 -0.170 4.506
130 HG LEU 514 HG LEU 514 6.442 -0.809 2.150
131 HD11 LEU 514 HD11 LEU 514 3.574 -1.701 2.520
132 HD12 LEU 514 HD12 LEU 514 4.965 -2.688 2.069
133 HD13 LEU 514 HD13 LEU 514 4.318 -1.506 0.931
134 HD21 LEU 514 HD21 LEU 514 5.435 1.499 2.706
135 HD22 LEU 514 HD22 LEU 514 3.878 0.797 2.279
136 HD23 LEU 514 HD23 LEU 514 5.161 0.893 1.074
137 H MET 515 H MET 515 7.069 -1.812 6.587
138 HA MET 515 HA MET 515 5.737 -0.424 8.613
139 HB2 MET 515 HB2 MET 515 6.490 -2.878 8.552
140 HB3 MET 515 HB3 MET 515 8.046 -2.290 9.139
141 HG2 MET 515 HG2 MET 515 6.795 -2.874 11.089
142 HG3 MET 515 HG3 MET 515 6.749 -1.113 10.997
143 HE1 MET 515 HE1 MET 515 4.735 -1.417 12.766
144 HE2 MET 515 HE2 MET 515 4.845 -3.166 12.591
145 HE3 MET 515 HE3 MET 515 3.284 -2.370 12.433
146 H THR 516 H THR 516 9.138 -0.329 7.640
147 HA THR 516 HA THR 516 9.677 1.726 9.705
148 HB THR 516 HB THR 516 12.087 1.237 9.114
149 HG1 THR 516 HG1 THR 516 11.711 -1.190 8.165
150 HG21 THR 516 HG21 THR 516 12.142 -0.840 10.411
151 HG22 THR 516 HG22 THR 516 10.426 -1.098 10.097
152 HG23 THR 516 HG23 THR 516 10.944 0.265 11.089
153 H LEU 517 H LEU 517 8.397 1.918 6.865
154 HA LEU 517 HA LEU 517 10.322 3.704 5.559
155 HB2 LEU 517 HB2 LEU 517 9.028 1.955 4.292
156 HB3 LEU 517 HB3 LEU 517 7.568 2.882 4.633
157 HG LEU 517 HG LEU 517 8.588 4.851 3.501
158 HD11 LEU 517 HD11 LEU 517 10.600 4.063 1.924
159 HD12 LEU 517 HD12 LEU 517 10.890 2.933 3.247
160 HD13 LEU 517 HD13 LEU 517 10.908 4.671 3.549
161 HD21 LEU 517 HD21 LEU 517 8.235 4.003 1.262
162 HD22 LEU 517 HD22 LEU 517 7.136 3.147 2.344
163 HD23 LEU 517 HD23 LEU 517 8.605 2.359 1.777
164 H ARG 518 H ARG 518 10.311 5.801 5.999
165 HA ARG 518 HA ARG 518 7.872 7.058 7.104
166 HB2 ARG 518 HB2 ARG 518 10.816 7.645 7.278
167 HB3 ARG 518 HB3 ARG 518 9.674 8.975 7.473
168 HG2 ARG 518 HG2 ARG 518 10.211 8.015 9.658
169 HG3 ARG 518 HG3 ARG 518 8.522 7.698 9.265
170 HD2 ARG 518 HD2 ARG 518 8.989 5.431 8.671
171 HD3 ARG 518 HD3 ARG 518 10.727 5.716 8.676
172 HE ARG 518 HE ARG 518 9.424 6.198 11.225
173 HH11 ARG 518 HH11 ARG 518 10.981 3.939 9.120
174 HH12 ARG 518 HH12 ARG 518 11.454 2.866 10.394
175 HH21 ARG 518 HH21 ARG 518 10.042 4.798 12.903
176 HH22 ARG 518 HH22 ARG 518 10.923 3.352 12.537
177 H GLU 519 H GLU 519 10.005 7.020 4.358
178 HA GLU 519 HA GLU 519 9.602 9.495 3.197
179 HB2 GLU 519 HB2 GLU 519 11.038 7.594 2.328
180 HB3 GLU 519 HB3 GLU 519 9.565 6.899 1.650
181 HG2 GLU 519 HG2 GLU 519 10.560 8.202 -0.097
182 HG3 GLU 519 HG3 GLU 519 9.184 9.130 0.495
183 H ARG 520 H ARG 520 7.496 10.214 3.728
184 HA ARG 520 HA ARG 520 5.089 8.954 3.216
185 HB2 ARG 520 HB2 ARG 520 4.109 11.215 3.100
186 HB3 ARG 520 HB3 ARG 520 5.215 11.026 4.462
187 HG2 ARG 520 HG2 ARG 520 7.028 12.027 3.040
188 HG3 ARG 520 HG3 ARG 520 5.810 12.362 1.810
189 HD2 ARG 520 HD2 ARG 520 5.928 14.367 3.048
190 HD3 ARG 520 HD3 ARG 520 4.506 13.551 3.689
191 HE ARG 520 HE ARG 520 5.599 13.425 5.722
192 HH11 ARG 520 HH11 ARG 520 7.874 13.821 3.146
193 HH12 ARG 520 HH12 ARG 520 9.249 13.944 4.194
194 HH21 ARG 520 HH21 ARG 520 7.395 13.584 7.101
195 HH22 ARG 520 HH22 ARG 520 8.977 13.810 6.434
196 H HIS 521 H HIS 521 7.130 10.792 0.994
197 HA HIS 521 HA HIS 521 5.514 11.206 -1.161
198 HB2 HIS 521 HB2 HIS 521 8.005 11.693 -0.955
199 HB3 HIS 521 HB3 HIS 521 8.276 10.028 -1.469
200 HD1 HIS 521 HD1 HIS 521 7.269 9.371 -3.871
201 HD2 HIS 521 HD2 HIS 521 7.394 13.453 -3.034
202 HE1 HIS 521 HE1 HIS 521 6.968 10.567 -6.084
203 HE2 HIS 521 HE2 HIS 521 7.042 13.056 -5.590
204 H ILE 522 H ILE 522 6.743 8.135 -0.022
205 HA ILE 522 HA ILE 522 5.816 6.688 -2.379
206 HB ILE 522 HB ILE 522 6.815 5.526 0.218
207 HG12 ILE 522 HG12 ILE 522 8.522 7.083 -0.440
208 HG13 ILE 522 HG13 ILE 522 9.060 5.495 -0.985
209 HG21 ILE 522 HG21 ILE 522 7.326 3.610 -1.100
210 HG22 ILE 522 HG22 ILE 522 7.090 4.496 -2.606
211 HG23 ILE 522 HG23 ILE 522 5.705 4.102 -1.588
212 HD11 ILE 522 HD11 ILE 522 9.431 6.909 -2.850
213 HD12 ILE 522 HD12 ILE 522 7.891 7.742 -2.629
214 HD13 ILE 522 HD13 ILE 522 7.918 6.081 -3.226
215 H LEU 523 H LEU 523 5.121 6.591 1.107
216 HA LEU 523 HA LEU 523 3.007 4.818 1.108
217 HB2 LEU 523 HB2 LEU 523 3.561 7.251 2.801
218 HB3 LEU 523 HB3 LEU 523 2.125 6.267 3.070
219 HG LEU 523 HG LEU 523 3.551 4.264 3.349
220 HD11 LEU 523 HD11 LEU 523 5.748 6.273 2.836
221 HD12 LEU 523 HD12 LEU 523 5.461 4.739 2.015
222 HD13 LEU 523 HD13 LEU 523 6.053 4.753 3.674
223 HD21 LEU 523 HD21 LEU 523 4.759 5.102 5.472
224 HD22 LEU 523 HD22 LEU 523 3.014 5.345 5.397
225 HD23 LEU 523 HD23 LEU 523 4.107 6.690 5.069
226 H GLN 524 H GLN 524 3.101 8.099 -0.051
227 HA GLN 524 HA GLN 524 0.244 8.426 -0.187
228 HB2 GLN 524 HB2 GLN 524 1.917 10.314 -0.038
229 HB3 GLN 524 HB3 GLN 524 2.345 9.974 -1.715
230 HG2 GLN 524 HG2 GLN 524 -0.054 10.278 -2.344
231 HG3 GLN 524 HG3 GLN 524 -0.398 10.743 -0.679
232 HE21 GLN 524 HE21 GLN 524 -1.064 12.798 -2.105
233 HE22 GLN 524 HE22 GLN 524 0.151 13.973 -2.268
234 H GLN 525 H GLN 525 2.816 7.591 -2.483
235 HA GLN 525 HA GLN 525 1.169 7.473 -4.791
236 HB2 GLN 525 HB2 GLN 525 3.778 6.080 -4.144
237 HB3 GLN 525 HB3 GLN 525 3.035 6.114 -5.741
238 HG2 GLN 525 HG2 GLN 525 3.593 8.672 -4.237
239 HG3 GLN 525 HG3 GLN 525 4.849 7.895 -5.198
240 HE21 GLN 525 HE21 GLN 525 4.452 10.172 -6.347
241 HE22 GLN 525 HE22 GLN 525 3.329 10.147 -7.620
242 H ILE 526 H ILE 526 2.329 4.957 -2.570
243 HA ILE 526 HA ILE 526 1.059 2.780 -3.829
244 HB ILE 526 HB ILE 526 1.899 3.200 -0.954
245 HG12 ILE 526 HG12 ILE 526 3.162 1.565 -3.174
246 HG13 ILE 526 HG13 ILE 526 3.625 3.230 -2.824
247 HG21 ILE 526 HG21 ILE 526 1.852 0.603 -1.016
248 HG22 ILE 526 HG22 ILE 526 0.769 0.801 -2.394
249 HG23 ILE 526 HG23 ILE 526 0.319 1.451 -0.821
250 HD11 ILE 526 HD11 ILE 526 5.139 1.690 -1.679
251 HD12 ILE 526 HD12 ILE 526 3.771 0.893 -0.900
252 HD13 ILE 526 HD13 ILE 526 4.167 2.565 -0.494
253 H VAL 527 H VAL 527 0.058 4.559 -0.895
254 HA VAL 527 HA VAL 527 -2.330 3.387 -0.356
255 HB VAL 527 HB VAL 527 -1.582 6.313 -0.274
256 HG11 VAL 527 HG11 VAL 527 -3.959 6.393 -0.378
257 HG12 VAL 527 HG12 VAL 527 -3.576 6.458 1.343
258 HG13 VAL 527 HG13 VAL 527 -4.128 4.947 0.619
259 HG21 VAL 527 HG21 VAL 527 -0.581 4.357 1.240
260 HG22 VAL 527 HG22 VAL 527 -2.098 4.553 2.114
261 HG23 VAL 527 HG23 VAL 527 -0.998 5.918 1.948
262 H ASN 528 H ASN 528 -2.108 6.279 -2.443
263 HA ASN 528 HA ASN 528 -4.683 6.286 -3.419
264 HB2 ASN 528 HB2 ASN 528 -2.171 7.059 -4.911
265 HB3 ASN 528 HB3 ASN 528 -3.808 7.596 -5.285
266 HD21 ASN 528 HD21 ASN 528 -1.846 9.529 -4.671
267 HD22 ASN 528 HD22 ASN 528 -2.190 10.210 -3.155
268 H LEU 529 H LEU 529 -2.030 4.179 -4.336
269 HA LEU 529 HA LEU 529 -3.175 3.355 -6.821
270 HB2 LEU 529 HB2 LEU 529 -0.711 3.130 -5.955
271 HB3 LEU 529 HB3 LEU 529 -1.284 1.631 -5.236
272 HG LEU 529 HG LEU 529 -0.344 1.145 -7.423
273 HD11 LEU 529 HD11 LEU 529 -3.335 1.056 -7.807
274 HD12 LEU 529 HD12 LEU 529 -2.518 0.033 -6.622
275 HD13 LEU 529 HD13 LEU 529 -2.125 -0.110 -8.334
276 HD21 LEU 529 HD21 LEU 529 -1.040 3.623 -8.217
277 HD22 LEU 529 HD22 LEU 529 -2.412 2.746 -8.896
278 HD23 LEU 529 HD23 LEU 529 -0.769 2.315 -9.366
279 H ILE 530 H ILE 530 -2.770 1.559 -3.780
280 HA ILE 530 HA ILE 530 -4.602 -0.481 -4.512
281 HB ILE 530 HB ILE 530 -4.438 -1.198 -2.173
282 HG12 ILE 530 HG12 ILE 530 -2.561 1.110 -1.628
283 HG13 ILE 530 HG13 ILE 530 -4.289 1.330 -1.378
284 HG21 ILE 530 HG21 ILE 530 -2.651 -1.674 -3.872
285 HG22 ILE 530 HG22 ILE 530 -2.048 -1.641 -2.213
286 HG23 ILE 530 HG23 ILE 530 -1.774 -0.261 -3.281
287 HD11 ILE 530 HD11 ILE 530 -4.393 -0.235 0.331
288 HD12 ILE 530 HD12 ILE 530 -2.792 0.458 0.598
289 HD13 ILE 530 HD13 ILE 530 -2.952 -1.095 -0.216
290 H GLU 531 H GLU 531 -5.055 2.672 -3.479
291 HA GLU 531 HA GLU 531 -7.557 2.325 -2.093
292 HB2 GLU 531 HB2 GLU 531 -6.141 4.337 -1.761
293 HB3 GLU 531 HB3 GLU 531 -6.457 4.808 -3.430
294 HG2 GLU 531 HG2 GLU 531 -8.734 4.271 -1.524
295 HG3 GLU 531 HG3 GLU 531 -7.936 5.841 -1.554
296 H GLU 532 H GLU 532 -6.599 3.359 -5.363
297 HA GLU 532 HA GLU 532 -9.173 3.753 -6.400
298 HB2 GLU 532 HB2 GLU 532 -8.114 4.088 -8.428
299 HB3 GLU 532 HB3 GLU 532 -6.721 4.221 -7.362
300 HG2 GLU 532 HG2 GLU 532 -5.952 2.730 -8.995
301 HG3 GLU 532 HG3 GLU 532 -6.496 1.640 -7.726
302 H THR 533 H THR 533 -7.466 0.834 -5.679
303 HA THR 533 HA THR 533 -9.000 -0.867 -7.425
304 HB THR 533 HB THR 533 -7.918 -2.703 -6.294
305 HG1 THR 533 HG1 THR 533 -7.996 -2.226 -4.192
306 HG21 THR 533 HG21 THR 533 -6.031 -0.343 -6.519
307 HG22 THR 533 HG22 THR 533 -6.528 -1.388 -7.849
308 HG23 THR 533 HG23 THR 533 -5.556 -2.040 -6.529
309 H GLY 534 H GLY 534 -9.031 -0.156 -3.936
310 HA2 GLY 534 HA2 GLY 534 -11.124 0.156 -2.762
311 HA3 GLY 534 HA3 GLY 534 -11.867 -1.023 -3.836
312 H HIS 535 H HIS 535 -8.832 -2.135 -3.100
313 HA HIS 535 HA HIS 535 -9.904 -4.108 -1.240
314 HB2 HIS 535 HB2 HIS 535 -7.155 -3.856 -2.480
315 HB3 HIS 535 HB3 HIS 535 -7.751 -5.232 -1.551
316 HD1 HIS 535 HD1 HIS 535 -10.700 -4.990 -2.890
317 HD2 HIS 535 HD2 HIS 535 -7.065 -5.405 -4.890
318 HE1 HIS 535 HE1 HIS 535 -11.239 -5.967 -5.163
319 HE2 HIS 535 HE2 HIS 535 -9.035 -6.226 -6.394
320 H PHE 536 H PHE 536 -10.064 -1.906 0.184
321 HA PHE 536 HA PHE 536 -7.922 -2.199 2.169
322 HB2 PHE 536 HB2 PHE 536 -7.511 0.174 2.333
323 HB3 PHE 536 HB3 PHE 536 -7.255 -0.317 0.659
324 HD1 PHE 536 HD1 PHE 536 -9.651 1.307 2.985
325 HD2 PHE 536 HD2 PHE 536 -8.637 0.510 -1.109
326 HE1 PHE 536 HE1 PHE 536 -11.352 2.953 2.247
327 HE2 PHE 536 HE2 PHE 536 -10.335 2.160 -1.851
328 HZ PHE 536 HZ PHE 536 -11.693 3.380 -0.173
329 H HIS 537 H HIS 537 -8.478 -1.247 4.236
330 HA HIS 537 HA HIS 537 -11.359 -0.708 4.643
331 HB2 HIS 537 HB2 HIS 537 -10.829 -3.121 5.127
332 HB3 HIS 537 HB3 HIS 537 -9.734 -2.567 6.393
333 HD1 HIS 537 HD1 HIS 537 -13.334 -3.040 5.605
334 HD2 HIS 537 HD2 HIS 537 -11.064 -1.227 8.596
335 HE1 HIS 537 HE1 HIS 537 -14.920 -2.565 7.521
336 HE2 HIS 537 HE2 HIS 537 -13.553 -1.460 9.351
337 H ILE 538 H ILE 538 -11.269 1.364 5.295
338 HA ILE 538 HA ILE 538 -9.215 2.216 7.237
339 HB ILE 538 HB ILE 538 -11.218 3.731 5.542
340 HG12 ILE 538 HG12 ILE 538 -8.213 4.011 5.684
341 HG13 ILE 538 HG13 ILE 538 -8.981 2.836 4.620
342 HG21 ILE 538 HG21 ILE 538 -11.172 4.941 7.603
343 HG22 ILE 538 HG22 ILE 538 -10.034 5.772 6.541
344 HG23 ILE 538 HG23 ILE 538 -9.438 4.684 7.795
345 HD11 ILE 538 HD11 ILE 538 -8.581 4.873 3.350
346 HD12 ILE 538 HD12 ILE 538 -9.387 5.843 4.583
347 HD13 ILE 538 HD13 ILE 538 -10.317 4.706 3.609
348 H THR 539 H THR 539 -9.704 2.608 9.334
349 HA THR 539 HA THR 539 -12.504 2.884 10.180
350 HB THR 539 HB THR 539 -12.227 0.505 10.344
351 HG1 THR 539 HG1 THR 539 -11.607 0.953 12.949
352 HG21 THR 539 HG21 THR 539 -10.316 -0.440 11.678
353 HG22 THR 539 HG22 THR 539 -9.607 1.174 11.710
354 HG23 THR 539 HG23 THR 539 -9.821 0.333 10.173
355 H ASN 540 H ASN 540 -12.667 3.487 12.490
356 HA ASN 540 HA ASN 540 -12.165 5.126 14.046
357 HB2 ASN 540 HB2 ASN 540 -9.702 3.372 14.062
358 HB3 ASN 540 HB3 ASN 540 -10.021 4.613 15.272
359 HD21 ASN 540 HD21 ASN 540 -10.921 1.403 14.182
360 HD22 ASN 540 HD22 ASN 540 -12.019 1.080 15.437
361 H THR 541 H THR 541 -8.781 4.870 13.458
362 HA THR 541 HA THR 541 -8.683 7.158 11.656
363 HB THR 541 HB THR 541 -7.206 8.445 13.204
364 HG1 THR 541 HG1 THR 541 -7.901 7.551 15.508
365 HG21 THR 541 HG21 THR 541 -9.892 7.904 14.477
366 HG22 THR 541 HG22 THR 541 -9.727 8.793 12.964
367 HG23 THR 541 HG23 THR 541 -8.995 9.421 14.440
368 H THR 542 H THR 542 -7.783 5.322 10.433
369 HA THR 542 HA THR 542 -4.960 5.428 10.341
370 HB THR 542 HB THR 542 -5.225 2.620 10.793
371 HG1 THR 542 HG1 THR 542 -5.906 2.907 13.098
372 HG21 THR 542 HG21 THR 542 -4.096 4.675 12.718
373 HG22 THR 542 HG22 THR 542 -3.252 4.129 11.271
374 HG23 THR 542 HG23 THR 542 -3.627 2.984 12.557
375 H PHE 543 H PHE 543 -4.099 3.897 8.677
376 HA PHE 543 HA PHE 543 -6.173 3.170 6.679
377 HB2 PHE 543 HB2 PHE 543 -4.991 5.136 5.899
378 HB3 PHE 543 HB3 PHE 543 -3.434 4.383 6.240
379 HD1 PHE 543 HD1 PHE 543 -6.499 4.098 4.152
380 HD2 PHE 543 HD2 PHE 543 -2.415 2.905 4.674
381 HE1 PHE 543 HE1 PHE 543 -6.516 3.076 1.898
382 HE2 PHE 543 HE2 PHE 543 -2.421 1.891 2.408
383 HZ PHE 543 HZ PHE 543 -4.481 1.982 1.024
384 H ASP 544 H ASP 544 -6.268 1.007 7.031
385 HA ASP 544 HA ASP 544 -3.754 -0.543 7.098
386 HB2 ASP 544 HB2 ASP 544 -6.581 -1.439 7.695
387 HB3 ASP 544 HB3 ASP 544 -5.105 -2.363 7.963
388 H PHE 545 H PHE 545 -3.282 -2.074 5.581
389 HA PHE 545 HA PHE 545 -5.231 -2.859 3.583
390 HB2 PHE 545 HB2 PHE 545 -3.930 -2.103 1.663
391 HB3 PHE 545 HB3 PHE 545 -4.406 -0.729 2.656
392 HD1 PHE 545 HD1 PHE 545 -2.713 0.124 4.410
393 HD2 PHE 545 HD2 PHE 545 -1.654 -2.481 1.162
394 HE1 PHE 545 HE1 PHE 545 -0.337 0.788 4.651
395 HE2 PHE 545 HE2 PHE 545 0.722 -1.812 1.400
396 HZ PHE 545 HZ PHE 545 1.381 -0.178 3.145
397 H ASP 546 H ASP 546 -4.571 -4.748 2.404
398 HA ASP 546 HA ASP 546 -2.338 -6.172 3.690
399 HB2 ASP 546 HB2 ASP 546 -4.385 -7.277 1.768
400 HB3 ASP 546 HB3 ASP 546 -3.339 -8.173 2.865
401 H LEU 547 H LEU 547 -0.736 -7.205 2.470
402 HA LEU 547 HA LEU 547 -0.001 -5.820 0.016
403 HB2 LEU 547 HB2 LEU 547 1.344 -7.892 1.743
404 HB3 LEU 547 HB3 LEU 547 2.007 -7.424 0.191
405 HG LEU 547 HG LEU 547 2.897 -6.218 2.306
406 HD11 LEU 547 HD11 LEU 547 3.280 -4.191 1.090
407 HD12 LEU 547 HD12 LEU 547 1.823 -4.408 0.126
408 HD13 LEU 547 HD13 LEU 547 3.203 -5.478 -0.110
409 HD21 LEU 547 HD21 LEU 547 1.612 -4.372 3.150
410 HD22 LEU 547 HD22 LEU 547 0.594 -5.801 3.228
411 HD23 LEU 547 HD23 LEU 547 0.347 -4.618 1.950
412 H CYS 548 H CYS 548 -0.923 -9.068 1.060
413 HA CYS 548 HA CYS 548 -0.590 -10.368 -1.423
414 HB2 CYS 548 HB2 CYS 548 -0.817 -11.663 0.599
415 HB3 CYS 548 HB3 CYS 548 -2.401 -10.966 0.929
416 HG CYS 548 HG CYS 548 -1.882 -12.832 -1.535
417 H SER 549 H SER 549 -2.629 -7.863 -0.698
418 HA SER 549 HA SER 549 -4.862 -8.781 -2.372
419 HB2 SER 549 HB2 SER 549 -5.913 -6.656 -1.746
420 HB3 SER 549 HB3 SER 549 -5.389 -7.544 -0.321
421 HG SER 549 HG SER 549 -4.667 -5.104 -1.168
422 H LEU 550 H LEU 550 -1.895 -7.731 -3.058
423 HA LEU 550 HA LEU 550 -2.525 -5.651 -4.994
424 HB2 LEU 550 HB2 LEU 550 0.051 -7.167 -4.504
425 HB3 LEU 550 HB3 LEU 550 -0.122 -5.756 -5.543
426 HG LEU 550 HG LEU 550 -0.952 -5.610 -2.641
427 HD11 LEU 550 HD11 LEU 550 1.843 -5.287 -3.778
428 HD12 LEU 550 HD12 LEU 550 1.333 -6.434 -2.544
429 HD13 LEU 550 HD13 LEU 550 1.359 -4.709 -2.185
430 HD21 LEU 550 HD21 LEU 550 -1.575 -3.742 -4.111
431 HD22 LEU 550 HD22 LEU 550 0.095 -3.594 -4.656
432 HD23 LEU 550 HD23 LEU 550 -0.324 -3.223 -2.985
433 H ASP 551 H ASP 551 -2.724 -5.900 -7.169
434 HA ASP 551 HA ASP 551 -3.114 -8.593 -8.187
435 HB2 ASP 551 HB2 ASP 551 -3.228 -6.005 -9.742
436 HB3 ASP 551 HB3 ASP 551 -3.988 -7.544 -10.146
437 H LYS 552 H LYS 552 -1.910 -9.588 -9.784
438 HA LYS 552 HA LYS 552 0.791 -9.503 -9.752
439 HB2 LYS 552 HB2 LYS 552 -1.164 -10.292 -11.879
440 HB3 LYS 552 HB3 LYS 552 0.536 -10.215 -12.327
441 HG2 LYS 552 HG2 LYS 552 0.001 -12.478 -11.594
442 HG3 LYS 552 HG3 LYS 552 1.081 -11.727 -10.421
443 HD2 LYS 552 HD2 LYS 552 -0.711 -12.890 -9.244
444 HD3 LYS 552 HD3 LYS 552 -0.895 -11.156 -9.012
445 HE2 LYS 552 HE2 LYS 552 -2.782 -11.040 -10.387
446 HE3 LYS 552 HE3 LYS 552 -2.324 -12.473 -11.310
447 HZ1 LYS 552 HZ1 LYS 552 -3.879 -13.422 -10.018
448 HZ2 LYS 552 HZ2 LYS 552 -3.745 -12.261 -8.786
449 HZ3 LYS 552 HZ3 LYS 552 -2.614 -13.524 -8.893
450 H THR 553 H THR 553 -1.167 -7.722 -12.157
451 HA THR 553 HA THR 553 1.027 -6.325 -13.277
452 HB THR 553 HB THR 553 -1.818 -5.395 -13.223
453 HG1 THR 553 HG1 THR 553 -1.203 -6.702 -15.439
454 HG21 THR 553 HG21 THR 553 -0.262 -3.770 -14.120
455 HG22 THR 553 HG22 THR 553 -1.168 -4.477 -15.458
456 HG23 THR 553 HG23 THR 553 0.486 -5.000 -15.138
457 H THR 554 H THR 554 -0.909 -5.824 -10.449
458 HA THR 554 HA THR 554 -0.096 -3.054 -10.103
459 HB THR 554 HB THR 554 -1.602 -4.949 -8.287
460 HG1 THR 554 HG1 THR 554 -3.365 -3.807 -9.006
461 HG21 THR 554 HG21 THR 554 -2.225 -2.716 -7.178
462 HG22 THR 554 HG22 THR 554 -0.840 -2.039 -8.037
463 HG23 THR 554 HG23 THR 554 -0.604 -3.336 -6.867
464 H VAL 555 H VAL 555 0.989 -6.219 -9.143
465 HA VAL 555 HA VAL 555 2.502 -5.473 -6.858
466 HB VAL 555 HB VAL 555 2.768 -7.777 -8.803
467 HG11 VAL 555 HG11 VAL 555 4.960 -7.508 -7.890
468 HG12 VAL 555 HG12 VAL 555 4.194 -8.765 -6.920
469 HG13 VAL 555 HG13 VAL 555 4.324 -7.123 -6.291
470 HG21 VAL 555 HG21 VAL 555 1.910 -7.814 -5.903
471 HG22 VAL 555 HG22 VAL 555 1.646 -9.045 -7.138
472 HG23 VAL 555 HG23 VAL 555 0.757 -7.525 -7.205
473 H ARG 556 H ARG 556 3.246 -5.666 -10.309
474 HA ARG 556 HA ARG 556 6.006 -5.068 -10.109
475 HB2 ARG 556 HB2 ARG 556 3.952 -4.885 -12.305
476 HB3 ARG 556 HB3 ARG 556 5.574 -4.242 -12.562
477 HG2 ARG 556 HG2 ARG 556 5.279 -7.028 -11.451
478 HG3 ARG 556 HG3 ARG 556 5.016 -6.767 -13.172
479 HD2 ARG 556 HD2 ARG 556 7.501 -5.834 -11.713
480 HD3 ARG 556 HD3 ARG 556 7.390 -7.375 -12.555
481 HE ARG 556 HE ARG 556 6.632 -5.626 -14.471
482 HH11 ARG 556 HH11 ARG 556 9.268 -5.698 -12.229
483 HH12 ARG 556 HH12 ARG 556 10.359 -4.851 -13.275
484 HH21 ARG 556 HH21 ARG 556 8.058 -4.515 -15.846
485 HH22 ARG 556 HH22 ARG 556 9.675 -4.182 -15.322
486 H LYS 557 H LYS 557 3.118 -3.090 -10.208
487 HA LYS 557 HA LYS 557 4.561 -0.604 -10.529
488 HB2 LYS 557 HB2 LYS 557 1.681 -1.252 -9.880
489 HB3 LYS 557 HB3 LYS 557 2.296 0.395 -10.012
490 HG2 LYS 557 HG2 LYS 557 3.005 -0.016 -12.315
491 HG3 LYS 557 HG3 LYS 557 2.494 -1.700 -12.195
492 HD2 LYS 557 HD2 LYS 557 0.162 -0.861 -11.685
493 HD3 LYS 557 HD3 LYS 557 0.731 0.760 -12.082
494 HE2 LYS 557 HE2 LYS 557 1.439 -0.085 -14.327
495 HE3 LYS 557 HE3 LYS 557 0.724 -1.646 -13.925
496 HZ1 LYS 557 HZ1 LYS 557 -1.303 -0.047 -13.355
497 HZ2 LYS 557 HZ2 LYS 557 -1.063 -0.713 -14.900
498 HZ3 LYS 557 HZ3 LYS 557 -0.568 0.880 -14.571
499 H LEU 558 H LEU 558 3.492 -2.634 -7.937
500 HA LEU 558 HA LEU 558 3.585 -0.637 -5.885
501 HB2 LEU 558 HB2 LEU 558 2.429 -3.053 -5.993
502 HB3 LEU 558 HB3 LEU 558 3.939 -3.543 -5.239
503 HG LEU 558 HG LEU 558 2.374 -3.045 -3.477
504 HD11 LEU 558 HD11 LEU 558 4.090 -0.571 -3.620
505 HD12 LEU 558 HD12 LEU 558 4.797 -2.165 -3.366
506 HD13 LEU 558 HD13 LEU 558 3.641 -1.520 -2.205
507 HD21 LEU 558 HD21 LEU 558 1.099 -1.363 -5.167
508 HD22 LEU 558 HD22 LEU 558 2.013 -0.174 -4.242
509 HD23 LEU 558 HD23 LEU 558 0.912 -1.275 -3.420
510 H GLN 559 H GLN 559 5.701 -3.376 -6.727
511 HA GLN 559 HA GLN 559 7.753 -2.748 -4.894
512 HB2 GLN 559 HB2 GLN 559 7.956 -4.244 -7.518
513 HB3 GLN 559 HB3 GLN 559 9.121 -4.303 -6.195
514 HG2 GLN 559 HG2 GLN 559 7.547 -5.358 -4.732
515 HG3 GLN 559 HG3 GLN 559 6.209 -5.042 -5.834
516 HE21 GLN 559 HE21 GLN 559 6.416 -7.660 -5.176
517 HE22 GLN 559 HE22 GLN 559 7.136 -8.567 -6.417
518 H SER 560 H SER 560 6.954 -1.474 -8.024
519 HA SER 560 HA SER 560 9.501 -0.425 -8.720
520 HB2 SER 560 HB2 SER 560 7.735 -0.640 -10.382
521 HB3 SER 560 HB3 SER 560 6.718 0.486 -9.488
522 HG SER 560 HG SER 560 8.948 1.746 -9.782
523 H TYR 561 H TYR 561 6.672 1.086 -7.127
524 HA TYR 561 HA TYR 561 7.647 3.647 -6.812
525 HB2 TYR 561 HB2 TYR 561 5.890 1.972 -5.022
526 HB3 TYR 561 HB3 TYR 561 6.281 3.641 -4.626
527 HD1 TYR 561 HD1 TYR 561 6.055 5.307 -6.770
528 HD2 TYR 561 HD2 TYR 561 3.897 1.638 -6.190
529 HE1 TYR 561 HE1 TYR 561 4.294 6.095 -8.314
530 HE2 TYR 561 HE2 TYR 561 2.130 2.433 -7.725
531 HH TYR 561 HH TYR 561 1.261 4.543 -8.594
532 H LEU 562 H LEU 562 9.056 0.844 -5.605
533 HA LEU 562 HA LEU 562 10.183 2.000 -3.196
534 HB2 LEU 562 HB2 LEU 562 11.049 -0.515 -4.634
535 HB3 LEU 562 HB3 LEU 562 11.350 -0.086 -2.952
536 HG LEU 562 HG LEU 562 8.618 -0.580 -4.174
537 HD11 LEU 562 HD11 LEU 562 10.311 -2.235 -2.276
538 HD12 LEU 562 HD12 LEU 562 9.932 -2.640 -3.949
539 HD13 LEU 562 HD13 LEU 562 8.651 -2.607 -2.738
540 HD21 LEU 562 HD21 LEU 562 8.044 -0.623 -1.631
541 HD22 LEU 562 HD22 LEU 562 8.269 0.944 -2.401
542 HD23 LEU 562 HD23 LEU 562 9.565 0.249 -1.425
543 H GLU 563 H GLU 563 11.590 0.784 -6.248
544 HA GLU 563 HA GLU 563 14.097 2.084 -5.790
545 HB2 GLU 563 HB2 GLU 563 13.027 1.001 -8.402
546 HB3 GLU 563 HB3 GLU 563 14.716 1.263 -7.966
547 HG2 GLU 563 HG2 GLU 563 14.479 -0.410 -6.143
548 HG3 GLU 563 HG3 GLU 563 12.819 -0.707 -6.657
549 H THR 564 H THR 564 11.144 3.315 -6.581
550 HA THR 564 HA THR 564 10.399 5.251 -7.578
551 HB THR 564 HB THR 564 11.814 7.207 -7.228
552 HG1 THR 564 HG1 THR 564 13.834 6.759 -7.641
553 HG21 THR 564 HG21 THR 564 10.666 6.236 -5.275
554 HG22 THR 564 HG22 THR 564 12.211 6.945 -4.808
555 HG23 THR 564 HG23 THR 564 12.057 5.197 -4.974
556 H SER 565 H SER 565 10.108 4.563 -9.695
557 HA SER 565 HA SER 565 12.278 4.459 -11.581
558 HB2 SER 565 HB2 SER 565 10.299 3.027 -11.839
559 HB3 SER 565 HB3 SER 565 9.282 4.453 -12.024
560 HG SER 565 HG SER 565 10.851 3.187 -13.834
561 H GLY 566 H GLY 566 11.789 7.010 -10.135
562 HA2 GLY 566 HA2 GLY 566 11.857 9.266 -10.580
563 HA3 GLY 566 HA3 GLY 566 12.328 8.818 -12.216
564 H THR 567 H THR 567 10.600 11.002 -11.431
565 HA THR 567 HA THR 567 7.879 10.566 -11.657
566 HB THR 567 HB THR 567 8.654 12.776 -11.189
567 HG1 THR 567 HG1 THR 567 6.768 12.738 -12.415
568 HG21 THR 567 HG21 THR 567 10.073 12.566 -13.855
569 HG22 THR 567 HG22 THR 567 10.816 12.722 -12.263
570 HG23 THR 567 HG23 THR 567 9.910 14.070 -12.950
571 H SER 568 H SER 568 10.275 9.872 -13.944
572 HA SER 568 HA SER 568 8.342 8.948 -15.856
573 HB2 SER 568 HB2 SER 568 8.802 10.401 -17.664
574 HB3 SER 568 HB3 SER 568 8.557 11.467 -16.283
575 HG SER 568 HG SER 568 10.831 11.533 -16.046
576 H1 THR 876 H1 THR 876 1.539 -16.341 1.523
577 H2 THR 876 H2 THR 876 0.192 -17.328 1.214
578 H3 THR 876 H3 THR 876 0.638 -16.973 2.815
579 HA THR 876 HA THR 876 0.312 -14.514 1.679
580 HB THR 876 HB THR 876 -2.005 -14.715 0.720
581 HG1 THR 876 HG1 THR 876 -2.384 -16.810 1.628
582 HG21 THR 876 HG21 THR 876 0.191 -16.236 -0.712
583 HG22 THR 876 HG22 THR 876 -0.051 -14.490 -0.749
584 HG23 THR 876 HG23 THR 876 -1.246 -15.562 -1.479
585 H ASN 877 H ASN 877 0.678 -15.356 4.165
586 HA ASN 877 HA ASN 877 -1.780 -15.823 5.591
587 HB2 ASN 877 HB2 ASN 877 1.040 -15.204 6.470
588 HB3 ASN 877 HB3 ASN 877 -0.288 -15.411 7.610
589 HD21 ASN 877 HD21 ASN 877 -1.706 -17.544 6.455
590 HD22 ASN 877 HD22 ASN 877 -0.715 -18.921 6.407
591 H LYS 878 H LYS 878 -1.613 -13.429 3.917
592 HA LYS 878 HA LYS 878 -2.236 -11.228 3.957
593 HB2 LYS 878 HB2 LYS 878 -3.203 -11.840 6.755
594 HB3 LYS 878 HB3 LYS 878 -3.777 -10.565 5.683
595 HG2 LYS 878 HG2 LYS 878 -3.991 -13.535 5.107
596 HG3 LYS 878 HG3 LYS 878 -5.306 -12.531 5.716
597 HD2 LYS 878 HD2 LYS 878 -4.813 -11.033 3.629
598 HD3 LYS 878 HD3 LYS 878 -3.968 -12.454 3.012
599 HE2 LYS 878 HE2 LYS 878 -6.176 -12.671 2.180
600 HE3 LYS 878 HE3 LYS 878 -6.115 -13.761 3.566
601 HZ1 LYS 878 HZ1 LYS 878 -6.945 -10.971 3.968
602 HZ2 LYS 878 HZ2 LYS 878 -7.375 -12.361 4.845
603 HZ3 LYS 878 HZ3 LYS 878 -8.057 -12.073 3.315
604 H LEU 879 H LEU 879 -1.556 -9.204 4.611
605 HA LEU 879 HA LEU 879 0.384 -8.980 6.813
606 HB2 LEU 879 HB2 LEU 879 0.825 -8.393 3.896
607 HB3 LEU 879 HB3 LEU 879 1.779 -7.590 5.131
608 HG LEU 879 HG LEU 879 1.552 -10.593 5.200
609 HD11 LEU 879 HD11 LEU 879 3.197 -8.961 3.263
610 HD12 LEU 879 HD12 LEU 879 2.174 -10.357 2.929
611 HD13 LEU 879 HD13 LEU 879 3.706 -10.572 3.773
612 HD21 LEU 879 HD21 LEU 879 3.614 -10.461 6.354
613 HD22 LEU 879 HD22 LEU 879 2.711 -9.069 6.948
614 HD23 LEU 879 HD23 LEU 879 3.967 -8.850 5.728
615 HA PRO 880 HA PRO 880 -2.457 -5.369 6.452
616 HB2 PRO 880 HB2 PRO 880 -3.098 -5.081 9.080
617 HB3 PRO 880 HB3 PRO 880 -3.882 -6.290 8.042
618 HG2 PRO 880 HG2 PRO 880 -1.712 -6.649 10.057
619 HG3 PRO 880 HG3 PRO 880 -3.088 -7.703 9.682
620 HD2 PRO 880 HD2 PRO 880 -0.492 -8.107 8.746
621 HD3 PRO 880 HD3 PRO 880 -1.949 -8.781 7.981
622 H VAL 881 H VAL 881 -1.245 -3.551 6.055
623 HA VAL 881 HA VAL 881 0.793 -2.722 8.039
624 HB VAL 881 HB VAL 881 0.419 -2.016 5.120
625 HG11 VAL 881 HG11 VAL 881 2.321 -0.961 7.224
626 HG12 VAL 881 HG12 VAL 881 1.234 -0.033 6.189
627 HG13 VAL 881 HG13 VAL 881 2.650 -0.825 5.497
628 HG21 VAL 881 HG21 VAL 881 2.603 -3.502 6.608
629 HG22 VAL 881 HG22 VAL 881 2.608 -3.137 4.882
630 HG23 VAL 881 HG23 VAL 881 1.398 -4.235 5.550
631 H SER 882 H SER 882 0.239 -1.119 9.333
632 HA SER 882 HA SER 882 -2.079 0.582 8.673
633 HB2 SER 882 HB2 SER 882 -0.552 0.533 11.274
634 HB3 SER 882 HB3 SER 882 -2.196 1.093 10.981
635 HG SER 882 HG SER 882 -2.566 -1.175 10.281
636 H ILE 883 H ILE 883 -1.884 2.685 8.109
637 HA ILE 883 HA ILE 883 0.720 4.040 8.537
638 HB ILE 883 HB ILE 883 -1.106 4.185 6.132
639 HG12 ILE 883 HG12 ILE 883 1.807 3.373 6.379
640 HG13 ILE 883 HG13 ILE 883 0.469 2.226 6.314
641 HG21 ILE 883 HG21 ILE 883 -0.302 6.416 6.542
642 HG22 ILE 883 HG22 ILE 883 0.723 5.746 5.279
643 HG23 ILE 883 HG23 ILE 883 1.311 5.827 6.939
644 HD11 ILE 883 HD11 ILE 883 1.260 2.406 4.068
645 HD12 ILE 883 HD12 ILE 883 1.363 4.164 4.170
646 HD13 ILE 883 HD13 ILE 883 -0.211 3.376 4.122
647 HA PRO 884 HA PRO 884 -2.165 6.672 10.938
648 HB2 PRO 884 HB2 PRO 884 0.228 8.475 10.666
649 HB3 PRO 884 HB3 PRO 884 -0.772 8.142 12.095
650 HG2 PRO 884 HG2 PRO 884 1.615 7.012 11.810
651 HG3 PRO 884 HG3 PRO 884 0.254 6.111 12.505
652 HD2 PRO 884 HD2 PRO 884 1.507 5.837 9.805
653 HD3 PRO 884 HD3 PRO 884 0.688 4.611 10.800
654 H LEU 885 H LEU 885 -3.749 7.718 9.895
655 HA LEU 885 HA LEU 885 -3.667 8.641 7.275
656 HB2 LEU 885 HB2 LEU 885 -5.468 9.491 9.550
657 HB3 LEU 885 HB3 LEU 885 -5.752 9.894 7.859
658 HG LEU 885 HG LEU 885 -5.338 7.011 8.661
659 HD11 LEU 885 HD11 LEU 885 -7.101 7.939 10.148
660 HD12 LEU 885 HD12 LEU 885 -7.744 6.759 9.007
661 HD13 LEU 885 HD13 LEU 885 -7.988 8.483 8.725
662 HD21 LEU 885 HD21 LEU 885 -5.389 7.465 6.274
663 HD22 LEU 885 HD22 LEU 885 -6.856 8.430 6.443
664 HD23 LEU 885 HD23 LEU 885 -6.909 6.690 6.715
665 H ALA 886 H ALA 886 -2.299 10.054 10.048
666 HA ALA 886 HA ALA 886 -2.495 12.801 9.239
667 HB1 ALA 886 HB1 ALA 886 -0.401 11.661 11.083
668 HB2 ALA 886 HB2 ALA 886 -2.077 11.832 11.599
669 HB3 ALA 886 HB3 ALA 886 -1.153 13.257 11.120
670 H SER 887 H SER 887 -0.414 10.115 8.543
671 HA SER 887 HA SER 887 1.738 11.757 7.476
672 HB2 SER 887 HB2 SER 887 1.288 8.772 7.571
673 HB3 SER 887 HB3 SER 887 2.709 9.528 6.853
674 HG SER 887 HG SER 887 3.342 10.215 8.805
675 H VAL 888 H VAL 888 -1.145 10.246 6.304
676 HA VAL 888 HA VAL 888 -0.347 10.885 3.526
677 HB VAL 888 HB VAL 888 -1.817 8.935 2.868
678 HG11 VAL 888 HG11 VAL 888 0.522 8.618 2.665
679 HG12 VAL 888 HG12 VAL 888 -0.025 7.232 3.609
680 HG13 VAL 888 HG13 VAL 888 0.757 8.590 4.414
681 HG21 VAL 888 HG21 VAL 888 -2.184 7.213 4.609
682 HG22 VAL 888 HG22 VAL 888 -3.016 8.714 5.015
683 HG23 VAL 888 HG23 VAL 888 -1.504 8.299 5.821
684 H VAL 889 H VAL 889 -2.560 10.536 2.206
685 HA VAL 889 HA VAL 889 -4.776 11.926 3.560
686 HB VAL 889 HB VAL 889 -3.804 12.840 0.853
687 HG11 VAL 889 HG11 VAL 889 -6.102 13.425 1.495
688 HG12 VAL 889 HG12 VAL 889 -5.087 14.868 1.493
689 HG13 VAL 889 HG13 VAL 889 -5.520 14.096 3.018
690 HG21 VAL 889 HG21 VAL 889 -1.922 13.278 2.251
691 HG22 VAL 889 HG22 VAL 889 -2.942 13.738 3.612
692 HG23 VAL 889 HG23 VAL 889 -2.822 14.794 2.205
693 H LEU 890 H LEU 890 -6.437 10.601 3.290
694 HA LEU 890 HA LEU 890 -6.601 8.834 0.989
695 HB2 LEU 890 HB2 LEU 890 -8.079 9.104 3.580
696 HB3 LEU 890 HB3 LEU 890 -8.782 8.156 2.271
697 HG LEU 890 HG LEU 890 -7.384 6.806 3.876
698 HD11 LEU 890 HD11 LEU 890 -7.651 6.436 1.220
699 HD12 LEU 890 HD12 LEU 890 -6.640 5.398 2.207
700 HD13 LEU 890 HD13 LEU 890 -5.906 6.682 1.268
701 HD21 LEU 890 HD21 LEU 890 -5.018 7.106 3.982
702 HD22 LEU 890 HD22 LEU 890 -5.713 8.715 4.176
703 HD23 LEU 890 HD23 LEU 890 -5.028 8.233 2.625
704 HA PRO 891 HA PRO 891 -8.936 11.781 -1.510
705 HB2 PRO 891 HB2 PRO 891 -10.310 9.210 -2.271
706 HB3 PRO 891 HB3 PRO 891 -9.791 10.555 -3.310
707 HG2 PRO 891 HG2 PRO 891 -8.345 8.330 -3.134
708 HG3 PRO 891 HG3 PRO 891 -7.571 9.921 -3.252
709 HD2 PRO 891 HD2 PRO 891 -7.748 8.096 -0.905
710 HD3 PRO 891 HD3 PRO 891 -6.552 9.364 -1.259
711 H SER 892 H SER 892 -10.240 12.971 -0.180
712 HA SER 892 HA SER 892 -12.447 11.740 1.274
713 HB2 SER 892 HB2 SER 892 -11.645 14.651 1.060
714 HB3 SER 892 HB3 SER 892 -12.791 13.965 2.208
715 HG SER 892 HG SER 892 -10.805 12.515 2.642
716 H ARG 893 H ARG 893 -14.630 12.724 1.124
717 HA ARG 893 HA ARG 893 -15.828 12.430 -1.312
718 HB2 ARG 893 HB2 ARG 893 -16.693 14.420 0.799
719 HB3 ARG 893 HB3 ARG 893 -17.718 13.682 -0.434
720 HG2 ARG 893 HG2 ARG 893 -17.088 11.427 0.536
721 HG3 ARG 893 HG3 ARG 893 -16.327 12.294 1.870
722 HD2 ARG 893 HD2 ARG 893 -18.571 11.719 2.554
723 HD3 ARG 893 HD3 ARG 893 -18.522 13.456 2.271
724 HE ARG 893 HE ARG 893 -19.332 12.448 -0.131
725 HH11 ARG 893 HH11 ARG 893 -20.347 12.066 3.155
726 HH12 ARG 893 HH12 ARG 893 -22.010 11.792 2.755
727 HH21 ARG 893 HH21 ARG 893 -21.511 12.091 -0.664
728 HH22 ARG 893 HH22 ARG 893 -22.669 11.806 0.592
729 H ALA 894 H ALA 894 -14.019 15.177 -0.176
730 HA ALA 894 HA ALA 894 -14.984 17.016 -2.168
731 HB1 ALA 894 HB1 ALA 894 -12.949 18.351 -1.431
732 HB2 ALA 894 HB2 ALA 894 -12.627 17.053 -0.281
733 HB3 ALA 894 HB3 ALA 894 -14.122 17.981 -0.167
734 H GLU 895 H GLU 895 -13.768 17.849 -3.944
735 HA GLU 895 HA GLU 895 -12.735 16.027 -5.715
736 HB2 GLU 895 HB2 GLU 895 -12.134 18.970 -5.398
737 HB3 GLU 895 HB3 GLU 895 -11.533 18.016 -6.755
738 HG2 GLU 895 HG2 GLU 895 -14.461 18.088 -6.011
739 HG3 GLU 895 HG3 GLU 895 -13.748 19.246 -7.131
740 H ARG 896 H ARG 896 -10.624 15.453 -6.397
741 HA ARG 896 HA ARG 896 -8.825 14.802 -4.336
742 HB2 ARG 896 HB2 ARG 896 -7.288 14.153 -6.136
743 HB3 ARG 896 HB3 ARG 896 -8.925 13.591 -6.480
744 HG2 ARG 896 HG2 ARG 896 -9.258 15.690 -7.854
745 HG3 ARG 896 HG3 ARG 896 -7.535 16.010 -7.657
746 HD2 ARG 896 HD2 ARG 896 -8.736 13.519 -8.897
747 HD3 ARG 896 HD3 ARG 896 -7.971 14.837 -9.779
748 HE ARG 896 HE ARG 896 -6.629 12.722 -8.366
749 HH11 ARG 896 HH11 ARG 896 -6.479 16.032 -9.365
750 HH12 ARG 896 HH12 ARG 896 -4.749 16.096 -9.369
751 HH21 ARG 896 HH21 ARG 896 -4.359 12.799 -8.368
752 HH22 ARG 896 HH22 ARG 896 -3.548 14.267 -8.804
753 H ALA 897 H ALA 897 -6.326 15.429 -4.904
754 HA ALA 897 HA ALA 897 -4.733 17.044 -4.540
755 HB1 ALA 897 HB1 ALA 897 -4.965 19.100 -5.939
756 HB2 ALA 897 HB2 ALA 897 -6.581 18.562 -6.394
757 HB3 ALA 897 HB3 ALA 897 -5.173 17.606 -6.855
758 H ARG 898 H ARG 898 -6.959 19.646 -4.979
759 HA ARG 898 HA ARG 898 -6.496 20.586 -2.291
760 HB2 ARG 898 HB2 ARG 898 -8.138 21.641 -4.598
761 HB3 ARG 898 HB3 ARG 898 -8.051 22.447 -3.031
762 HG2 ARG 898 HG2 ARG 898 -5.575 22.547 -3.247
763 HG3 ARG 898 HG3 ARG 898 -5.706 21.819 -4.849
764 HD2 ARG 898 HD2 ARG 898 -5.553 24.206 -5.150
765 HD3 ARG 898 HD3 ARG 898 -7.211 23.729 -5.507
766 HE ARG 898 HE ARG 898 -7.891 25.012 -3.705
767 HH11 ARG 898 HH11 ARG 898 -4.529 24.228 -3.448
768 HH12 ARG 898 HH12 ARG 898 -4.264 25.214 -2.049
769 HH21 ARG 898 HH21 ARG 898 -7.551 26.307 -1.870
770 HH22 ARG 898 HH22 ARG 898 -5.975 26.392 -1.155
771 H SER 899 H SER 899 -8.194 21.128 -0.782
772 HA SER 899 HA SER 899 -10.842 20.071 -1.101
773 HB2 SER 899 HB2 SER 899 -9.020 18.657 0.857
774 HB3 SER 899 HB3 SER 899 -10.734 18.338 0.602
775 HG SER 899 HG SER 899 -8.587 17.982 -1.221
776 H THR 900 H THR 900 -9.082 22.417 -0.131
777 HA THR 900 HA THR 900 -9.819 22.753 2.637
778 HB THR 900 HB THR 900 -8.733 24.879 2.486
779 HG1 THR 900 HG1 THR 900 -8.212 25.754 0.454
780 HG21 THR 900 HG21 THR 900 -6.573 24.251 1.688
781 HG22 THR 900 HG22 THR 900 -7.257 23.117 0.523
782 HG23 THR 900 HG23 THR 900 -7.331 22.760 2.248
Start of MODEL 7
1 H1 ASP 500 H1 ASP 500 2.699 -19.600 -6.692
2 H2 ASP 500 H2 ASP 500 3.951 -18.667 -7.364
3 H3 ASP 500 H3 ASP 500 3.347 -18.298 -5.819
4 HA ASP 500 HA ASP 500 4.176 -20.981 -5.835
5 HB2 ASP 500 HB2 ASP 500 6.188 -18.952 -6.849
6 HB3 ASP 500 HB3 ASP 500 6.615 -20.546 -6.227
7 H LYS 501 H LYS 501 6.182 -21.018 -4.205
8 HA LYS 501 HA LYS 501 5.265 -19.728 -1.834
9 HB2 LYS 501 HB2 LYS 501 7.933 -21.076 -2.288
10 HB3 LYS 501 HB3 LYS 501 7.127 -20.805 -0.742
11 HG2 LYS 501 HG2 LYS 501 5.241 -22.240 -1.514
12 HG3 LYS 501 HG3 LYS 501 6.133 -22.571 -2.999
13 HD2 LYS 501 HD2 LYS 501 8.005 -23.486 -1.631
14 HD3 LYS 501 HD3 LYS 501 7.029 -23.246 -0.182
15 HE2 LYS 501 HE2 LYS 501 6.701 -25.528 -0.809
16 HE3 LYS 501 HE3 LYS 501 5.241 -24.677 -1.316
17 HZ1 LYS 501 HZ1 LYS 501 6.967 -24.440 -3.429
18 HZ2 LYS 501 HZ2 LYS 501 5.632 -25.485 -3.330
19 HZ3 LYS 501 HZ3 LYS 501 7.180 -26.037 -2.900
20 H ALA 502 H ALA 502 7.109 -18.624 -4.403
21 HA ALA 502 HA ALA 502 8.869 -16.874 -2.914
22 HB1 ALA 502 HB1 ALA 502 9.375 -17.848 -5.202
23 HB2 ALA 502 HB2 ALA 502 9.631 -16.111 -5.043
24 HB3 ALA 502 HB3 ALA 502 8.187 -16.718 -5.852
25 H TYR 503 H TYR 503 5.818 -16.604 -4.672
26 HA TYR 503 HA TYR 503 5.477 -13.892 -4.866
27 HB2 TYR 503 HB2 TYR 503 3.857 -16.013 -5.296
28 HB3 TYR 503 HB3 TYR 503 3.121 -15.411 -3.814
29 HD1 TYR 503 HD1 TYR 503 3.211 -12.585 -3.890
30 HD2 TYR 503 HD2 TYR 503 2.704 -15.282 -7.197
31 HE1 TYR 503 HE1 TYR 503 2.093 -10.797 -5.178
32 HE2 TYR 503 HE2 TYR 503 1.579 -13.487 -8.484
33 HH TYR 503 HH TYR 503 0.573 -10.536 -7.026
34 H LEU 504 H LEU 504 4.339 -15.802 -2.049
35 HA LEU 504 HA LEU 504 3.590 -13.788 -0.371
36 HB2 LEU 504 HB2 LEU 504 4.958 -16.413 0.187
37 HB3 LEU 504 HB3 LEU 504 4.528 -15.325 1.508
38 HG LEU 504 HG LEU 504 2.178 -15.327 0.740
39 HD11 LEU 504 HD11 LEU 504 2.338 -15.697 -1.600
40 HD12 LEU 504 HD12 LEU 504 1.607 -17.170 -0.968
41 HD13 LEU 504 HD13 LEU 504 3.320 -17.146 -1.387
42 HD21 LEU 504 HD21 LEU 504 1.736 -17.791 1.219
43 HD22 LEU 504 HD22 LEU 504 2.724 -16.956 2.418
44 HD23 LEU 504 HD23 LEU 504 3.485 -18.015 1.232
45 H ASP 505 H ASP 505 6.897 -15.062 -0.689
46 HA ASP 505 HA ASP 505 8.217 -13.488 1.146
47 HB2 ASP 505 HB2 ASP 505 9.166 -15.315 -0.385
48 HB3 ASP 505 HB3 ASP 505 9.368 -14.042 -1.587
49 H GLU 506 H GLU 506 7.532 -12.670 -2.260
50 HA GLU 506 HA GLU 506 8.728 -10.175 -2.377
51 HB2 GLU 506 HB2 GLU 506 6.091 -10.943 -3.649
52 HB3 GLU 506 HB3 GLU 506 7.171 -9.651 -4.173
53 HG2 GLU 506 HG2 GLU 506 7.998 -12.559 -4.025
54 HG3 GLU 506 HG3 GLU 506 7.394 -11.791 -5.493
55 H LEU 507 H LEU 507 5.922 -11.164 -0.634
56 HA LEU 507 HA LEU 507 4.929 -8.447 -0.241
57 HB2 LEU 507 HB2 LEU 507 3.999 -10.885 1.263
58 HB3 LEU 507 HB3 LEU 507 3.105 -9.418 0.870
59 HG LEU 507 HG LEU 507 3.994 -11.580 -1.056
60 HD11 LEU 507 HD11 LEU 507 1.500 -11.648 -1.478
61 HD12 LEU 507 HD12 LEU 507 1.305 -10.564 -0.101
62 HD13 LEU 507 HD13 LEU 507 1.980 -12.174 0.136
63 HD21 LEU 507 HD21 LEU 507 2.700 -10.121 -2.722
64 HD22 LEU 507 HD22 LEU 507 4.281 -9.514 -2.230
65 HD23 LEU 507 HD23 LEU 507 2.817 -8.830 -1.527
66 H VAL 508 H VAL 508 6.567 -10.980 1.639
67 HA VAL 508 HA VAL 508 6.537 -9.720 4.135
68 HB VAL 508 HB VAL 508 8.673 -11.523 2.980
69 HG11 VAL 508 HG11 VAL 508 7.998 -10.648 5.801
70 HG12 VAL 508 HG12 VAL 508 9.526 -10.428 4.947
71 HG13 VAL 508 HG13 VAL 508 9.016 -12.042 5.440
72 HG21 VAL 508 HG21 VAL 508 6.506 -12.603 2.901
73 HG22 VAL 508 HG22 VAL 508 6.121 -12.052 4.531
74 HG23 VAL 508 HG23 VAL 508 7.382 -13.260 4.284
75 H GLU 509 H GLU 509 9.303 -9.800 1.874
76 HA GLU 509 HA GLU 509 10.954 -7.993 3.143
77 HB2 GLU 509 HB2 GLU 509 11.496 -9.303 1.062
78 HB3 GLU 509 HB3 GLU 509 10.566 -8.119 0.143
79 HG2 GLU 509 HG2 GLU 509 12.039 -6.318 1.037
80 HG3 GLU 509 HG3 GLU 509 13.004 -7.547 1.852
81 H LEU 510 H LEU 510 8.544 -7.220 0.626
82 HA LEU 510 HA LEU 510 8.849 -4.435 0.730
83 HB2 LEU 510 HB2 LEU 510 6.645 -6.280 -0.141
84 HB3 LEU 510 HB3 LEU 510 6.336 -4.549 -0.080
85 HG LEU 510 HG LEU 510 7.135 -5.440 -2.325
86 HD11 LEU 510 HD11 LEU 510 9.167 -3.463 -1.321
87 HD12 LEU 510 HD12 LEU 510 7.464 -3.011 -1.345
88 HD13 LEU 510 HD13 LEU 510 8.271 -3.481 -2.834
89 HD21 LEU 510 HD21 LEU 510 9.873 -5.536 -1.054
90 HD22 LEU 510 HD22 LEU 510 9.364 -6.163 -2.620
91 HD23 LEU 510 HD23 LEU 510 8.861 -6.974 -1.141
92 H HIS 511 H HIS 511 6.440 -6.502 2.380
93 HA HIS 511 HA HIS 511 5.072 -4.606 3.821
94 HB2 HIS 511 HB2 HIS 511 4.418 -6.915 3.941
95 HB3 HIS 511 HB3 HIS 511 5.962 -7.378 4.650
96 HD1 HIS 511 HD1 HIS 511 2.967 -5.175 5.465
97 HD2 HIS 511 HD2 HIS 511 5.969 -7.306 7.418
98 HE1 HIS 511 HE1 HIS 511 2.480 -4.998 7.945
99 HE2 HIS 511 HE2 HIS 511 4.294 -6.299 9.149
100 H ARG 512 H ARG 512 7.947 -6.374 4.982
101 HA ARG 512 HA ARG 512 8.393 -5.008 7.333
102 HB2 ARG 512 HB2 ARG 512 9.707 -6.952 6.769
103 HB3 ARG 512 HB3 ARG 512 10.367 -6.156 5.344
104 HG2 ARG 512 HG2 ARG 512 11.934 -6.207 7.317
105 HG3 ARG 512 HG3 ARG 512 11.605 -4.588 6.705
106 HD2 ARG 512 HD2 ARG 512 10.189 -4.062 8.512
107 HD3 ARG 512 HD3 ARG 512 9.938 -5.753 8.933
108 HE ARG 512 HE ARG 512 12.168 -4.082 9.734
109 HH11 ARG 512 HH11 ARG 512 10.955 -7.279 9.214
110 HH12 ARG 512 HH12 ARG 512 12.068 -8.031 10.307
111 HH21 ARG 512 HH21 ARG 512 13.632 -5.059 11.171
112 HH22 ARG 512 HH22 ARG 512 13.585 -6.771 11.416
113 H ARG 513 H ARG 513 9.706 -4.248 4.114
114 HA ARG 513 HA ARG 513 11.146 -1.978 4.678
115 HB2 ARG 513 HB2 ARG 513 10.657 -3.261 2.418
116 HB3 ARG 513 HB3 ARG 513 9.415 -2.030 2.220
117 HG2 ARG 513 HG2 ARG 513 11.213 -0.957 1.204
118 HG3 ARG 513 HG3 ARG 513 11.406 -0.375 2.856
119 HD2 ARG 513 HD2 ARG 513 12.984 -2.294 3.271
120 HD3 ARG 513 HD3 ARG 513 12.871 -2.691 1.559
121 HE ARG 513 HE ARG 513 14.264 -0.887 1.106
122 HH11 ARG 513 HH11 ARG 513 12.956 -0.684 4.302
123 HH12 ARG 513 HH12 ARG 513 13.947 0.657 4.773
124 HH21 ARG 513 HH21 ARG 513 15.569 0.871 1.716
125 HH22 ARG 513 HH22 ARG 513 15.426 1.537 3.308
126 H LEU 514 H LEU 514 7.709 -2.054 3.697
127 HA LEU 514 HA LEU 514 7.201 0.677 3.999
128 HB2 LEU 514 HB2 LEU 514 5.293 -1.630 4.409
129 HB3 LEU 514 HB3 LEU 514 4.829 0.043 4.120
130 HG LEU 514 HG LEU 514 6.605 -1.470 2.195
131 HD11 LEU 514 HD11 LEU 514 4.600 -1.990 0.882
132 HD12 LEU 514 HD12 LEU 514 3.582 -1.252 2.119
133 HD13 LEU 514 HD13 LEU 514 4.488 -2.720 2.485
134 HD21 LEU 514 HD21 LEU 514 5.486 0.218 0.607
135 HD22 LEU 514 HD22 LEU 514 6.640 0.878 1.761
136 HD23 LEU 514 HD23 LEU 514 4.909 1.039 2.054
137 H MET 515 H MET 515 6.971 -1.953 6.343
138 HA MET 515 HA MET 515 5.703 -0.661 8.420
139 HB2 MET 515 HB2 MET 515 6.401 -3.084 8.325
140 HB3 MET 515 HB3 MET 515 8.018 -2.558 8.795
141 HG2 MET 515 HG2 MET 515 7.077 -1.506 10.829
142 HG3 MET 515 HG3 MET 515 5.471 -2.070 10.366
143 HE1 MET 515 HE1 MET 515 5.951 -4.480 13.225
144 HE2 MET 515 HE2 MET 515 4.939 -3.299 12.396
145 HE3 MET 515 HE3 MET 515 6.431 -2.779 13.176
146 H THR 516 H THR 516 9.145 -0.521 7.569
147 HA THR 516 HA THR 516 9.644 1.333 9.798
148 HB THR 516 HB THR 516 11.980 1.051 9.272
149 HG1 THR 516 HG1 THR 516 10.918 -0.077 6.923
150 HG21 THR 516 HG21 THR 516 10.906 -0.776 10.529
151 HG22 THR 516 HG22 THR 516 12.191 -1.398 9.495
152 HG23 THR 516 HG23 THR 516 10.505 -1.586 9.015
153 H LEU 517 H LEU 517 9.036 1.336 6.400
154 HA LEU 517 HA LEU 517 10.411 3.644 5.612
155 HB2 LEU 517 HB2 LEU 517 9.133 1.962 4.164
156 HB3 LEU 517 HB3 LEU 517 7.687 2.878 4.583
157 HG LEU 517 HG LEU 517 9.154 4.955 3.799
158 HD11 LEU 517 HD11 LEU 517 10.312 2.778 2.041
159 HD12 LEU 517 HD12 LEU 517 11.170 3.384 3.456
160 HD13 LEU 517 HD13 LEU 517 10.785 4.474 2.126
161 HD21 LEU 517 HD21 LEU 517 7.751 2.929 2.048
162 HD22 LEU 517 HD22 LEU 517 8.347 4.460 1.405
163 HD23 LEU 517 HD23 LEU 517 7.120 4.452 2.671
164 H ARG 518 H ARG 518 10.280 5.641 6.392
165 HA ARG 518 HA ARG 518 7.752 6.553 7.629
166 HB2 ARG 518 HB2 ARG 518 10.083 6.608 8.821
167 HB3 ARG 518 HB3 ARG 518 10.379 8.017 7.809
168 HG2 ARG 518 HG2 ARG 518 9.409 9.100 9.610
169 HG3 ARG 518 HG3 ARG 518 7.934 8.710 8.730
170 HD2 ARG 518 HD2 ARG 518 9.153 7.085 10.983
171 HD3 ARG 518 HD3 ARG 518 7.712 8.089 11.094
172 HE ARG 518 HE ARG 518 7.910 5.456 9.874
173 HH11 ARG 518 HH11 ARG 518 6.158 8.427 10.182
174 HH12 ARG 518 HH12 ARG 518 4.649 7.749 9.671
175 HH21 ARG 518 HH21 ARG 518 5.933 4.562 9.205
176 HH22 ARG 518 HH22 ARG 518 4.521 5.562 9.119
177 H GLU 519 H GLU 519 9.593 6.825 4.810
178 HA GLU 519 HA GLU 519 9.129 9.545 4.126
179 HB2 GLU 519 HB2 GLU 519 10.806 7.967 3.052
180 HB3 GLU 519 HB3 GLU 519 9.447 7.252 2.184
181 HG2 GLU 519 HG2 GLU 519 10.345 8.918 0.727
182 HG3 GLU 519 HG3 GLU 519 8.874 9.610 1.405
183 H ARG 520 H ARG 520 7.056 10.248 4.261
184 HA ARG 520 HA ARG 520 4.774 8.728 3.557
185 HB2 ARG 520 HB2 ARG 520 3.635 10.996 3.558
186 HB3 ARG 520 HB3 ARG 520 4.470 10.557 5.049
187 HG2 ARG 520 HG2 ARG 520 6.348 11.946 4.515
188 HG3 ARG 520 HG3 ARG 520 5.779 12.188 2.862
189 HD2 ARG 520 HD2 ARG 520 3.926 13.509 3.596
190 HD3 ARG 520 HD3 ARG 520 4.182 13.054 5.278
191 HE ARG 520 HE ARG 520 6.431 14.428 4.077
192 HH11 ARG 520 HH11 ARG 520 3.405 14.696 5.733
193 HH12 ARG 520 HH12 ARG 520 3.748 16.258 6.396
194 HH21 ARG 520 HH21 ARG 520 6.889 16.476 4.942
195 HH22 ARG 520 HH22 ARG 520 5.721 17.266 5.948
196 H HIS 521 H HIS 521 6.914 10.801 1.722
197 HA HIS 521 HA HIS 521 5.446 11.521 -0.471
198 HB2 HIS 521 HB2 HIS 521 7.926 11.924 -0.042
199 HB3 HIS 521 HB3 HIS 521 8.206 10.322 -0.724
200 HD1 HIS 521 HD1 HIS 521 8.594 10.322 -3.180
201 HD2 HIS 521 HD2 HIS 521 6.257 13.568 -2.009
202 HE1 HIS 521 HE1 HIS 521 8.144 11.672 -5.273
203 HE2 HIS 521 HE2 HIS 521 6.720 13.656 -4.576
204 H ILE 522 H ILE 522 6.653 8.326 0.334
205 HA ILE 522 HA ILE 522 5.771 7.168 -2.195
206 HB ILE 522 HB ILE 522 6.741 5.721 0.269
207 HG12 ILE 522 HG12 ILE 522 8.471 7.313 -0.197
208 HG13 ILE 522 HG13 ILE 522 8.994 5.799 -0.931
209 HG21 ILE 522 HG21 ILE 522 6.929 5.026 -2.668
210 HG22 ILE 522 HG22 ILE 522 5.651 4.451 -1.599
211 HG23 ILE 522 HG23 ILE 522 7.325 3.985 -1.300
212 HD11 ILE 522 HD11 ILE 522 9.388 7.435 -2.603
213 HD12 ILE 522 HD12 ILE 522 7.848 8.239 -2.293
214 HD13 ILE 522 HD13 ILE 522 7.878 6.665 -3.088
215 H LEU 523 H LEU 523 4.985 6.835 1.241
216 HA LEU 523 HA LEU 523 2.911 5.014 1.109
217 HB2 LEU 523 HB2 LEU 523 2.925 7.476 2.866
218 HB3 LEU 523 HB3 LEU 523 2.092 5.956 3.176
219 HG LEU 523 HG LEU 523 5.095 6.340 3.007
220 HD11 LEU 523 HD11 LEU 523 5.106 5.956 5.375
221 HD12 LEU 523 HD12 LEU 523 3.400 5.512 5.374
222 HD13 LEU 523 HD13 LEU 523 3.876 7.183 5.073
223 HD21 LEU 523 HD21 LEU 523 4.754 4.147 2.224
224 HD22 LEU 523 HD22 LEU 523 3.341 3.894 3.249
225 HD23 LEU 523 HD23 LEU 523 4.957 3.898 3.956
226 H GLN 524 H GLN 524 2.974 8.316 0.024
227 HA GLN 524 HA GLN 524 0.124 8.641 -0.066
228 HB2 GLN 524 HB2 GLN 524 1.699 10.562 0.005
229 HB3 GLN 524 HB3 GLN 524 2.261 10.137 -1.611
230 HG2 GLN 524 HG2 GLN 524 0.040 10.488 -2.532
231 HG3 GLN 524 HG3 GLN 524 -0.623 10.762 -0.921
232 HE21 GLN 524 HE21 GLN 524 0.221 12.738 0.258
233 HE22 GLN 524 HE22 GLN 524 0.733 14.072 -0.657
234 H GLN 525 H GLN 525 2.614 7.835 -2.483
235 HA GLN 525 HA GLN 525 0.837 7.617 -4.679
236 HB2 GLN 525 HB2 GLN 525 3.383 6.027 -4.400
237 HB3 GLN 525 HB3 GLN 525 2.646 6.674 -5.865
238 HG2 GLN 525 HG2 GLN 525 3.939 8.258 -3.633
239 HG3 GLN 525 HG3 GLN 525 4.534 8.078 -5.280
240 HE21 GLN 525 HE21 GLN 525 2.878 10.213 -3.313
241 HE22 GLN 525 HE22 GLN 525 2.015 11.062 -4.503
242 H ILE 526 H ILE 526 2.303 5.102 -2.623
243 HA ILE 526 HA ILE 526 1.036 2.883 -3.726
244 HB ILE 526 HB ILE 526 1.921 3.416 -0.883
245 HG12 ILE 526 HG12 ILE 526 3.191 1.748 -3.072
246 HG13 ILE 526 HG13 ILE 526 3.595 3.444 -2.804
247 HG21 ILE 526 HG21 ILE 526 0.397 1.619 -0.667
248 HG22 ILE 526 HG22 ILE 526 1.963 0.828 -0.848
249 HG23 ILE 526 HG23 ILE 526 0.860 0.928 -2.220
250 HD11 ILE 526 HD11 ILE 526 5.186 1.968 -1.641
251 HD12 ILE 526 HD12 ILE 526 3.855 1.223 -0.756
252 HD13 ILE 526 HD13 ILE 526 4.256 2.921 -0.486
253 H VAL 527 H VAL 527 0.034 4.605 -0.759
254 HA VAL 527 HA VAL 527 -2.295 3.358 -0.176
255 HB VAL 527 HB VAL 527 -1.703 6.323 -0.124
256 HG11 VAL 527 HG11 VAL 527 -3.631 6.350 1.572
257 HG12 VAL 527 HG12 VAL 527 -4.107 4.795 0.890
258 HG13 VAL 527 HG13 VAL 527 -4.083 6.233 -0.129
259 HG21 VAL 527 HG21 VAL 527 -0.505 4.455 1.345
260 HG22 VAL 527 HG22 VAL 527 -1.995 4.532 2.280
261 HG23 VAL 527 HG23 VAL 527 -1.009 5.981 2.075
262 H ASN 528 H ASN 528 -2.241 6.251 -2.289
263 HA ASN 528 HA ASN 528 -4.865 6.038 -3.192
264 HB2 ASN 528 HB2 ASN 528 -2.456 7.205 -4.595
265 HB3 ASN 528 HB3 ASN 528 -4.136 7.499 -5.044
266 HD21 ASN 528 HD21 ASN 528 -3.198 9.837 -4.496
267 HD22 ASN 528 HD22 ASN 528 -3.434 10.349 -2.894
268 H LEU 529 H LEU 529 -2.072 4.179 -4.096
269 HA LEU 529 HA LEU 529 -2.970 3.434 -6.689
270 HB2 LEU 529 HB2 LEU 529 -0.597 3.212 -5.601
271 HB3 LEU 529 HB3 LEU 529 -1.203 1.671 -5.004
272 HG LEU 529 HG LEU 529 -0.036 1.320 -7.115
273 HD11 LEU 529 HD11 LEU 529 -2.248 0.115 -6.547
274 HD12 LEU 529 HD12 LEU 529 -1.669 0.026 -8.209
275 HD13 LEU 529 HD13 LEU 529 -2.966 1.139 -7.793
276 HD21 LEU 529 HD21 LEU 529 -0.771 3.805 -7.864
277 HD22 LEU 529 HD22 LEU 529 -2.029 2.898 -8.709
278 HD23 LEU 529 HD23 LEU 529 -0.329 2.565 -9.034
279 H ILE 530 H ILE 530 -2.895 1.571 -3.657
280 HA ILE 530 HA ILE 530 -4.597 -0.461 -4.709
281 HB ILE 530 HB ILE 530 -4.698 -1.306 -2.398
282 HG12 ILE 530 HG12 ILE 530 -2.952 1.052 -1.632
283 HG13 ILE 530 HG13 ILE 530 -4.687 1.043 -1.348
284 HG21 ILE 530 HG21 ILE 530 -2.187 -1.526 -2.125
285 HG22 ILE 530 HG22 ILE 530 -2.016 -0.370 -3.449
286 HG23 ILE 530 HG23 ILE 530 -2.794 -1.930 -3.731
287 HD11 ILE 530 HD11 ILE 530 -4.581 -0.661 0.214
288 HD12 ILE 530 HD12 ILE 530 -3.070 0.189 0.533
289 HD13 ILE 530 HD13 ILE 530 -3.059 -1.296 -0.413
290 H GLU 531 H GLU 531 -5.118 2.372 -2.736
291 HA GLU 531 HA GLU 531 -7.714 2.103 -1.902
292 HB2 GLU 531 HB2 GLU 531 -6.229 4.146 -1.595
293 HB3 GLU 531 HB3 GLU 531 -6.738 4.650 -3.206
294 HG2 GLU 531 HG2 GLU 531 -9.046 4.758 -2.530
295 HG3 GLU 531 HG3 GLU 531 -8.684 4.004 -0.977
296 H GLU 532 H GLU 532 -6.616 3.131 -5.115
297 HA GLU 532 HA GLU 532 -9.138 3.508 -6.289
298 HB2 GLU 532 HB2 GLU 532 -7.931 3.960 -8.187
299 HB3 GLU 532 HB3 GLU 532 -6.550 3.883 -7.098
300 HG2 GLU 532 HG2 GLU 532 -6.453 1.375 -7.655
301 HG3 GLU 532 HG3 GLU 532 -7.573 1.736 -8.967
302 H THR 533 H THR 533 -7.329 0.611 -5.590
303 HA THR 533 HA THR 533 -8.732 -1.135 -7.357
304 HB THR 533 HB THR 533 -7.428 -1.966 -4.767
305 HG1 THR 533 HG1 THR 533 -6.339 -0.907 -7.091
306 HG21 THR 533 HG21 THR 533 -7.526 -3.310 -7.475
307 HG22 THR 533 HG22 THR 533 -8.705 -3.614 -6.198
308 HG23 THR 533 HG23 THR 533 -7.005 -4.019 -5.947
309 H GLY 534 H GLY 534 -9.054 -0.447 -3.869
310 HA2 GLY 534 HA2 GLY 534 -11.299 -0.174 -2.940
311 HA3 GLY 534 HA3 GLY 534 -11.844 -1.464 -4.000
312 H HIS 535 H HIS 535 -9.008 -2.666 -3.184
313 HA HIS 535 HA HIS 535 -10.137 -4.345 -1.105
314 HB2 HIS 535 HB2 HIS 535 -8.631 -5.103 -3.057
315 HB3 HIS 535 HB3 HIS 535 -7.293 -4.467 -2.100
316 HD1 HIS 535 HD1 HIS 535 -8.520 -5.305 0.711
317 HD2 HIS 535 HD2 HIS 535 -8.053 -7.827 -2.575
318 HE1 HIS 535 HE1 HIS 535 -8.444 -7.666 1.625
319 HE2 HIS 535 HE2 HIS 535 -8.162 -9.216 -0.366
320 H PHE 536 H PHE 536 -10.302 -2.397 0.378
321 HA PHE 536 HA PHE 536 -8.060 -2.473 2.232
322 HB2 PHE 536 HB2 PHE 536 -7.668 -0.087 2.271
323 HB3 PHE 536 HB3 PHE 536 -7.454 -0.656 0.617
324 HD1 PHE 536 HD1 PHE 536 -9.887 0.966 2.926
325 HD2 PHE 536 HD2 PHE 536 -8.809 0.178 -1.154
326 HE1 PHE 536 HE1 PHE 536 -11.631 2.553 2.161
327 HE2 PHE 536 HE2 PHE 536 -10.549 1.774 -1.916
328 HZ PHE 536 HZ PHE 536 -11.960 2.959 -0.261
329 H HIS 537 H HIS 537 -8.554 -1.272 4.210
330 HA HIS 537 HA HIS 537 -11.392 -0.692 4.716
331 HB2 HIS 537 HB2 HIS 537 -11.203 -2.064 6.852
332 HB3 HIS 537 HB3 HIS 537 -11.299 -2.995 5.356
333 HD1 HIS 537 HD1 HIS 537 -9.431 -2.924 8.366
334 HD2 HIS 537 HD2 HIS 537 -8.389 -3.444 4.363
335 HE1 HIS 537 HE1 HIS 537 -7.154 -4.035 8.357
336 HE2 HIS 537 HE2 HIS 537 -6.505 -4.359 5.923
337 H ILE 538 H ILE 538 -11.008 1.455 5.159
338 HA ILE 538 HA ILE 538 -8.823 2.254 6.909
339 HB ILE 538 HB ILE 538 -11.100 3.979 5.912
340 HG12 ILE 538 HG12 ILE 538 -8.538 3.109 4.550
341 HG13 ILE 538 HG13 ILE 538 -10.185 3.006 3.937
342 HG21 ILE 538 HG21 ILE 538 -8.249 4.809 6.438
343 HG22 ILE 538 HG22 ILE 538 -9.404 4.699 7.768
344 HG23 ILE 538 HG23 ILE 538 -9.706 5.800 6.425
345 HD11 ILE 538 HD11 ILE 538 -9.184 4.861 2.808
346 HD12 ILE 538 HD12 ILE 538 -8.510 5.495 4.307
347 HD13 ILE 538 HD13 ILE 538 -10.251 5.553 4.030
348 H THR 539 H THR 539 -8.970 2.229 9.058
349 HA THR 539 HA THR 539 -11.525 1.786 10.361
350 HB THR 539 HB THR 539 -9.468 0.616 11.102
351 HG1 THR 539 HG1 THR 539 -10.805 0.684 12.748
352 HG21 THR 539 HG21 THR 539 -7.674 1.788 12.152
353 HG22 THR 539 HG22 THR 539 -8.585 3.300 12.171
354 HG23 THR 539 HG23 THR 539 -7.994 2.646 10.644
355 H ASN 540 H ASN 540 -11.055 3.118 12.789
356 HA ASN 540 HA ASN 540 -12.380 5.486 12.554
357 HB2 ASN 540 HB2 ASN 540 -11.645 4.288 14.686
358 HB3 ASN 540 HB3 ASN 540 -10.119 5.154 14.522
359 HD21 ASN 540 HD21 ASN 540 -11.721 7.490 13.264
360 HD22 ASN 540 HD22 ASN 540 -12.393 8.278 14.608
361 H THR 541 H THR 541 -8.856 5.462 13.113
362 HA THR 541 HA THR 541 -8.522 7.569 11.084
363 HB THR 541 HB THR 541 -7.302 7.824 13.818
364 HG1 THR 541 HG1 THR 541 -9.546 9.225 12.829
365 HG21 THR 541 HG21 THR 541 -6.857 10.104 13.094
366 HG22 THR 541 HG22 THR 541 -7.745 9.829 11.595
367 HG23 THR 541 HG23 THR 541 -6.225 8.983 11.888
368 H THR 542 H THR 542 -7.668 5.631 10.024
369 HA THR 542 HA THR 542 -4.850 5.604 10.051
370 HB THR 542 HB THR 542 -5.367 2.838 10.707
371 HG1 THR 542 HG1 THR 542 -6.366 2.968 12.595
372 HG21 THR 542 HG21 THR 542 -3.201 3.953 10.989
373 HG22 THR 542 HG22 THR 542 -3.751 3.298 12.530
374 HG23 THR 542 HG23 THR 542 -3.892 5.025 12.206
375 H PHE 543 H PHE 543 -3.993 4.087 8.426
376 HA PHE 543 HA PHE 543 -6.062 3.224 6.472
377 HB2 PHE 543 HB2 PHE 543 -4.886 5.197 5.644
378 HB3 PHE 543 HB3 PHE 543 -3.330 4.424 5.946
379 HD1 PHE 543 HD1 PHE 543 -6.451 4.220 3.940
380 HD2 PHE 543 HD2 PHE 543 -2.419 2.830 4.417
381 HE1 PHE 543 HE1 PHE 543 -6.556 3.149 1.706
382 HE2 PHE 543 HE2 PHE 543 -2.516 1.760 2.184
383 HZ PHE 543 HZ PHE 543 -4.592 1.922 0.827
384 H ASP 544 H ASP 544 -6.120 1.047 6.780
385 HA ASP 544 HA ASP 544 -3.554 -0.420 6.941
386 HB2 ASP 544 HB2 ASP 544 -6.311 -1.458 7.603
387 HB3 ASP 544 HB3 ASP 544 -4.757 -2.183 8.009
388 H PHE 545 H PHE 545 -3.068 -1.998 5.509
389 HA PHE 545 HA PHE 545 -5.026 -2.952 3.575
390 HB2 PHE 545 HB2 PHE 545 -3.671 -2.298 1.622
391 HB3 PHE 545 HB3 PHE 545 -4.253 -0.888 2.508
392 HD1 PHE 545 HD1 PHE 545 -2.675 0.093 4.324
393 HD2 PHE 545 HD2 PHE 545 -1.367 -2.526 1.180
394 HE1 PHE 545 HE1 PHE 545 -0.347 0.884 4.633
395 HE2 PHE 545 HE2 PHE 545 0.963 -1.733 1.488
396 HZ PHE 545 HZ PHE 545 1.472 -0.028 3.215
397 H ASP 546 H ASP 546 -4.259 -4.879 2.440
398 HA ASP 546 HA ASP 546 -1.965 -6.152 3.812
399 HB2 ASP 546 HB2 ASP 546 -2.920 -8.258 3.065
400 HB3 ASP 546 HB3 ASP 546 -4.166 -7.320 3.885
401 H LEU 547 H LEU 547 -0.282 -7.085 2.597
402 HA LEU 547 HA LEU 547 0.206 -5.839 0.043
403 HB2 LEU 547 HB2 LEU 547 1.732 -7.755 1.797
404 HB3 LEU 547 HB3 LEU 547 2.311 -7.325 0.196
405 HG LEU 547 HG LEU 547 3.235 -5.962 2.158
406 HD11 LEU 547 HD11 LEU 547 3.436 -4.021 0.849
407 HD12 LEU 547 HD12 LEU 547 1.821 -4.180 0.172
408 HD13 LEU 547 HD13 LEU 547 3.108 -5.261 -0.354
409 HD21 LEU 547 HD21 LEU 547 0.976 -5.756 3.273
410 HD22 LEU 547 HD22 LEU 547 0.529 -4.606 2.013
411 HD23 LEU 547 HD23 LEU 547 1.857 -4.240 3.112
412 H CYS 548 H CYS 548 -1.366 -8.635 1.079
413 HA CYS 548 HA CYS 548 -0.710 -10.276 -1.235
414 HB2 CYS 548 HB2 CYS 548 -1.214 -11.100 1.173
415 HB3 CYS 548 HB3 CYS 548 -2.906 -10.842 0.748
416 HG CYS 548 HG CYS 548 -2.324 -12.466 -1.402
417 H SER 549 H SER 549 -2.779 -7.729 -0.605
418 HA SER 549 HA SER 549 -4.942 -8.648 -2.350
419 HB2 SER 549 HB2 SER 549 -5.786 -6.258 -1.848
420 HB3 SER 549 HB3 SER 549 -5.769 -7.424 -0.528
421 HG SER 549 HG SER 549 -4.128 -5.212 -1.018
422 H LEU 550 H LEU 550 -1.954 -7.620 -2.942
423 HA LEU 550 HA LEU 550 -2.476 -5.570 -4.934
424 HB2 LEU 550 HB2 LEU 550 0.083 -7.119 -4.499
425 HB3 LEU 550 HB3 LEU 550 -0.104 -5.555 -5.288
426 HG LEU 550 HG LEU 550 -0.749 -6.075 -2.369
427 HD11 LEU 550 HD11 LEU 550 1.378 -4.623 -2.084
428 HD12 LEU 550 HD12 LEU 550 1.748 -5.075 -3.749
429 HD13 LEU 550 HD13 LEU 550 1.601 -6.320 -2.508
430 HD21 LEU 550 HD21 LEU 550 -0.538 -3.503 -2.372
431 HD22 LEU 550 HD22 LEU 550 -1.984 -4.182 -3.116
432 HD23 LEU 550 HD23 LEU 550 -0.657 -3.612 -4.128
433 H ASP 551 H ASP 551 -2.817 -5.906 -7.059
434 HA ASP 551 HA ASP 551 -3.089 -8.605 -8.040
435 HB2 ASP 551 HB2 ASP 551 -4.500 -6.547 -8.711
436 HB3 ASP 551 HB3 ASP 551 -3.141 -6.121 -9.748
437 H LYS 552 H LYS 552 -1.951 -9.469 -9.856
438 HA LYS 552 HA LYS 552 0.784 -9.459 -9.657
439 HB2 LYS 552 HB2 LYS 552 -0.750 -11.020 -11.022
440 HB3 LYS 552 HB3 LYS 552 -0.581 -9.839 -12.318
441 HG2 LYS 552 HG2 LYS 552 1.196 -11.259 -12.817
442 HG3 LYS 552 HG3 LYS 552 2.013 -10.087 -11.787
443 HD2 LYS 552 HD2 LYS 552 1.721 -11.575 -9.844
444 HD3 LYS 552 HD3 LYS 552 0.860 -12.736 -10.853
445 HE2 LYS 552 HE2 LYS 552 3.759 -11.895 -11.089
446 HE3 LYS 552 HE3 LYS 552 3.138 -13.497 -10.689
447 HZ1 LYS 552 HZ1 LYS 552 1.925 -13.099 -13.003
448 HZ2 LYS 552 HZ2 LYS 552 3.465 -13.809 -12.885
449 HZ3 LYS 552 HZ3 LYS 552 3.313 -12.161 -13.270
450 H THR 553 H THR 553 -1.097 -7.649 -12.097
451 HA THR 553 HA THR 553 1.139 -6.256 -13.134
452 HB THR 553 HB THR 553 -1.780 -5.580 -13.208
453 HG1 THR 553 HG1 THR 553 -0.514 -7.516 -14.293
454 HG21 THR 553 HG21 THR 553 -1.031 -4.235 -15.246
455 HG22 THR 553 HG22 THR 553 0.610 -4.411 -14.624
456 HG23 THR 553 HG23 THR 553 -0.609 -3.561 -13.673
457 H THR 554 H THR 554 -0.819 -5.812 -10.336
458 HA THR 554 HA THR 554 -0.094 -3.020 -9.965
459 HB THR 554 HB THR 554 -1.582 -4.989 -8.218
460 HG1 THR 554 HG1 THR 554 -2.615 -4.234 -10.134
461 HG21 THR 554 HG21 THR 554 -0.659 -3.463 -6.677
462 HG22 THR 554 HG22 THR 554 -2.241 -2.775 -7.041
463 HG23 THR 554 HG23 THR 554 -0.795 -2.109 -7.799
464 H VAL 555 H VAL 555 1.023 -6.174 -8.946
465 HA VAL 555 HA VAL 555 2.525 -5.354 -6.681
466 HB VAL 555 HB VAL 555 2.714 -7.726 -8.547
467 HG11 VAL 555 HG11 VAL 555 4.975 -7.457 -7.822
468 HG12 VAL 555 HG12 VAL 555 4.274 -8.660 -6.739
469 HG13 VAL 555 HG13 VAL 555 4.475 -6.994 -6.195
470 HG21 VAL 555 HG21 VAL 555 1.718 -8.919 -6.751
471 HG22 VAL 555 HG22 VAL 555 0.839 -7.392 -6.801
472 HG23 VAL 555 HG23 VAL 555 2.092 -7.649 -5.588
473 H ARG 556 H ARG 556 3.269 -5.576 -10.126
474 HA ARG 556 HA ARG 556 6.035 -4.955 -9.901
475 HB2 ARG 556 HB2 ARG 556 4.035 -4.795 -12.157
476 HB3 ARG 556 HB3 ARG 556 5.706 -4.274 -12.369
477 HG2 ARG 556 HG2 ARG 556 5.180 -6.989 -11.169
478 HG3 ARG 556 HG3 ARG 556 4.993 -6.780 -12.908
479 HD2 ARG 556 HD2 ARG 556 7.258 -6.172 -13.198
480 HD3 ARG 556 HD3 ARG 556 7.484 -5.843 -11.485
481 HE ARG 556 HE ARG 556 7.686 -8.407 -12.778
482 HH11 ARG 556 HH11 ARG 556 6.905 -6.726 -9.856
483 HH12 ARG 556 HH12 ARG 556 7.275 -8.066 -8.824
484 HH21 ARG 556 HH21 ARG 556 8.171 -10.169 -11.430
485 HH22 ARG 556 HH22 ARG 556 7.991 -10.014 -9.715
486 H LYS 557 H LYS 557 3.114 -3.036 -10.075
487 HA LYS 557 HA LYS 557 4.519 -0.535 -10.485
488 HB2 LYS 557 HB2 LYS 557 1.641 -1.137 -9.755
489 HB3 LYS 557 HB3 LYS 557 2.271 0.469 -10.119
490 HG2 LYS 557 HG2 LYS 557 2.963 -0.309 -12.361
491 HG3 LYS 557 HG3 LYS 557 2.316 -1.910 -12.000
492 HD2 LYS 557 HD2 LYS 557 0.068 -0.972 -11.731
493 HD3 LYS 557 HD3 LYS 557 0.693 0.653 -12.014
494 HE2 LYS 557 HE2 LYS 557 0.923 -1.614 -14.012
495 HE3 LYS 557 HE3 LYS 557 -0.353 -0.397 -14.048
496 HZ1 LYS 557 HZ1 LYS 557 1.152 1.285 -14.511
497 HZ2 LYS 557 HZ2 LYS 557 1.734 -0.008 -15.448
498 HZ3 LYS 557 HZ3 LYS 557 2.489 0.390 -13.979
499 H LEU 558 H LEU 558 3.487 -2.500 -7.841
500 HA LEU 558 HA LEU 558 3.505 -0.449 -5.839
501 HB2 LEU 558 HB2 LEU 558 2.402 -2.879 -5.889
502 HB3 LEU 558 HB3 LEU 558 3.928 -3.342 -5.155
503 HG LEU 558 HG LEU 558 2.379 -2.856 -3.377
504 HD11 LEU 558 HD11 LEU 558 4.788 -1.972 -3.285
505 HD12 LEU 558 HD12 LEU 558 3.639 -1.285 -2.137
506 HD13 LEU 558 HD13 LEU 558 4.090 -0.379 -3.580
507 HD21 LEU 558 HD21 LEU 558 1.079 -1.179 -5.069
508 HD22 LEU 558 HD22 LEU 558 1.982 0.011 -4.133
509 HD23 LEU 558 HD23 LEU 558 0.891 -1.108 -3.322
510 H GLN 559 H GLN 559 5.719 -3.105 -6.682
511 HA GLN 559 HA GLN 559 7.734 -2.400 -4.824
512 HB2 GLN 559 HB2 GLN 559 7.995 -3.956 -7.407
513 HB3 GLN 559 HB3 GLN 559 9.147 -3.956 -6.070
514 HG2 GLN 559 HG2 GLN 559 7.569 -4.999 -4.595
515 HG3 GLN 559 HG3 GLN 559 6.246 -4.759 -5.735
516 HE21 GLN 559 HE21 GLN 559 7.501 -5.624 -8.140
517 HE22 GLN 559 HE22 GLN 559 7.855 -7.279 -8.001
518 H SER 560 H SER 560 6.947 -1.211 -7.998
519 HA SER 560 HA SER 560 9.480 -0.130 -8.686
520 HB2 SER 560 HB2 SER 560 8.298 1.141 -10.342
521 HB3 SER 560 HB3 SER 560 7.507 -0.429 -10.235
522 HG SER 560 HG SER 560 5.771 0.545 -9.576
523 H TYR 561 H TYR 561 6.633 1.344 -7.103
524 HA TYR 561 HA TYR 561 7.528 3.925 -6.782
525 HB2 TYR 561 HB2 TYR 561 5.849 2.163 -5.003
526 HB3 TYR 561 HB3 TYR 561 6.216 3.822 -4.539
527 HD1 TYR 561 HD1 TYR 561 5.922 5.577 -6.582
528 HD2 TYR 561 HD2 TYR 561 3.853 1.834 -6.171
529 HE1 TYR 561 HE1 TYR 561 4.123 6.407 -8.059
530 HE2 TYR 561 HE2 TYR 561 2.049 2.670 -7.645
531 HH TYR 561 HH TYR 561 1.374 5.600 -8.244
532 H LEU 562 H LEU 562 8.617 1.055 -5.117
533 HA LEU 562 HA LEU 562 10.189 2.625 -3.193
534 HB2 LEU 562 HB2 LEU 562 9.570 -0.310 -3.500
535 HB3 LEU 562 HB3 LEU 562 10.818 0.259 -2.394
536 HG LEU 562 HG LEU 562 8.075 1.517 -2.280
537 HD11 LEU 562 HD11 LEU 562 8.871 -1.150 -1.085
538 HD12 LEU 562 HD12 LEU 562 7.536 -0.831 -2.193
539 HD13 LEU 562 HD13 LEU 562 7.482 -0.213 -0.542
540 HD21 LEU 562 HD21 LEU 562 9.843 2.505 -0.909
541 HD22 LEU 562 HD22 LEU 562 10.245 0.928 -0.235
542 HD23 LEU 562 HD23 LEU 562 8.698 1.678 0.142
543 H GLU 563 H GLU 563 10.496 1.241 -6.262
544 HA GLU 563 HA GLU 563 13.368 1.736 -6.274
545 HB2 GLU 563 HB2 GLU 563 12.201 -0.945 -7.061
546 HB3 GLU 563 HB3 GLU 563 13.881 -0.453 -7.275
547 HG2 GLU 563 HG2 GLU 563 13.943 -0.032 -4.762
548 HG3 GLU 563 HG3 GLU 563 12.391 -0.863 -4.676
549 H THR 564 H THR 564 11.847 3.425 -7.496
550 HA THR 564 HA THR 564 10.840 2.780 -10.048
551 HB THR 564 HB THR 564 11.093 5.253 -10.480
552 HG1 THR 564 HG1 THR 564 12.127 6.450 -9.064
553 HG21 THR 564 HG21 THR 564 9.463 5.890 -8.724
554 HG22 THR 564 HG22 THR 564 9.828 4.396 -7.862
555 HG23 THR 564 HG23 THR 564 9.068 4.332 -9.452
556 H SER 565 H SER 565 11.823 2.323 -11.907
557 HA SER 565 HA SER 565 14.708 2.327 -12.068
558 HB2 SER 565 HB2 SER 565 14.408 1.220 -14.174
559 HB3 SER 565 HB3 SER 565 13.219 0.549 -13.063
560 HG SER 565 HG SER 565 11.829 2.321 -13.978
561 H GLY 566 H GLY 566 15.970 3.480 -13.574
562 HA2 GLY 566 HA2 GLY 566 14.885 5.450 -15.334
563 HA3 GLY 566 HA3 GLY 566 15.483 6.189 -13.852
564 H THR 567 H THR 567 16.351 4.475 -16.767
565 HA THR 567 HA THR 567 19.089 4.057 -16.295
566 HB THR 567 HB THR 567 19.302 3.973 -18.746
567 HG1 THR 567 HG1 THR 567 16.590 4.547 -19.020
568 HG21 THR 567 HG21 THR 567 18.432 1.988 -17.716
569 HG22 THR 567 HG22 THR 567 17.445 2.292 -19.147
570 HG23 THR 567 HG23 THR 567 16.830 2.708 -17.547
571 H SER 568 H SER 568 17.430 6.935 -16.347
572 HA SER 568 HA SER 568 18.071 9.139 -16.416
573 HB2 SER 568 HB2 SER 568 19.852 8.171 -14.870
574 HB3 SER 568 HB3 SER 568 20.914 8.131 -16.275
575 HG SER 568 HG SER 568 20.731 10.336 -16.450
576 H1 THR 876 H1 THR 876 2.194 -14.484 8.938
577 H2 THR 876 H2 THR 876 0.620 -13.888 9.165
578 H3 THR 876 H3 THR 876 1.500 -13.461 7.776
579 HA THR 876 HA THR 876 1.507 -16.181 7.708
580 HB THR 876 HB THR 876 -0.822 -16.833 8.035
581 HG1 THR 876 HG1 THR 876 -1.361 -14.405 7.670
582 HG21 THR 876 HG21 THR 876 0.589 -17.041 9.992
583 HG22 THR 876 HG22 THR 876 -0.991 -16.456 10.511
584 HG23 THR 876 HG23 THR 876 0.365 -15.335 10.385
585 H ASN 877 H ASN 877 -1.255 -16.173 6.402
586 HA ASN 877 HA ASN 877 -0.374 -15.297 3.816
587 HB2 ASN 877 HB2 ASN 877 -3.192 -16.064 4.582
588 HB3 ASN 877 HB3 ASN 877 -2.431 -16.174 2.997
589 HD21 ASN 877 HD21 ASN 877 0.120 -17.269 4.040
590 HD22 ASN 877 HD22 ASN 877 -0.210 -18.867 4.513
591 H LYS 878 H LYS 878 -0.375 -13.173 5.681
592 HA LYS 878 HA LYS 878 -1.768 -11.185 4.187
593 HB2 LYS 878 HB2 LYS 878 -3.618 -12.219 5.605
594 HB3 LYS 878 HB3 LYS 878 -2.778 -11.564 7.011
595 HG2 LYS 878 HG2 LYS 878 -2.846 -9.301 5.824
596 HG3 LYS 878 HG3 LYS 878 -3.981 -10.037 4.693
597 HD2 LYS 878 HD2 LYS 878 -5.523 -10.556 6.502
598 HD3 LYS 878 HD3 LYS 878 -4.364 -9.976 7.700
599 HE2 LYS 878 HE2 LYS 878 -4.448 -7.723 6.531
600 HE3 LYS 878 HE3 LYS 878 -5.809 -8.346 5.598
601 HZ1 LYS 878 HZ1 LYS 878 -6.818 -8.916 7.835
602 HZ2 LYS 878 HZ2 LYS 878 -6.758 -7.269 7.423
603 HZ3 LYS 878 HZ3 LYS 878 -5.633 -7.915 8.519
604 H LEU 879 H LEU 879 -1.052 -9.117 4.698
605 HA LEU 879 HA LEU 879 0.857 -8.812 6.936
606 HB2 LEU 879 HB2 LEU 879 1.259 -8.076 4.035
607 HB3 LEU 879 HB3 LEU 879 2.278 -7.474 5.334
608 HG LEU 879 HG LEU 879 1.880 -10.448 5.173
609 HD11 LEU 879 HD11 LEU 879 2.342 -10.238 2.903
610 HD12 LEU 879 HD12 LEU 879 3.961 -10.409 3.576
611 HD13 LEU 879 HD13 LEU 879 3.357 -8.811 3.125
612 HD21 LEU 879 HD21 LEU 879 4.441 -8.905 5.581
613 HD22 LEU 879 HD22 LEU 879 4.022 -10.518 6.161
614 HD23 LEU 879 HD23 LEU 879 3.275 -9.097 6.893
615 HA PRO 880 HA PRO 880 -2.071 -5.286 6.579
616 HB2 PRO 880 HB2 PRO 880 -2.619 -4.936 9.229
617 HB3 PRO 880 HB3 PRO 880 -3.432 -6.168 8.240
618 HG2 PRO 880 HG2 PRO 880 -1.198 -6.482 10.189
619 HG3 PRO 880 HG3 PRO 880 -2.574 -7.553 9.870
620 HD2 PRO 880 HD2 PRO 880 -0.006 -7.953 8.869
621 HD3 PRO 880 HD3 PRO 880 -1.479 -8.641 8.148
622 H VAL 881 H VAL 881 -1.347 -3.217 6.444
623 HA VAL 881 HA VAL 881 0.854 -2.328 8.229
624 HB VAL 881 HB VAL 881 0.505 -1.789 5.267
625 HG11 VAL 881 HG11 VAL 881 1.267 0.253 6.264
626 HG12 VAL 881 HG12 VAL 881 2.705 -0.537 5.612
627 HG13 VAL 881 HG13 VAL 881 2.368 -0.608 7.341
628 HG21 VAL 881 HG21 VAL 881 2.550 -3.000 4.993
629 HG22 VAL 881 HG22 VAL 881 1.541 -3.991 6.046
630 HG23 VAL 881 HG23 VAL 881 2.847 -3.025 6.732
631 H SER 882 H SER 882 -0.157 -0.948 9.571
632 HA SER 882 HA SER 882 -2.309 0.780 8.595
633 HB2 SER 882 HB2 SER 882 -2.652 1.344 10.908
634 HB3 SER 882 HB3 SER 882 -2.435 -0.401 10.806
635 HG SER 882 HG SER 882 -0.082 0.948 11.073
636 H ILE 883 H ILE 883 -2.014 2.864 7.996
637 HA ILE 883 HA ILE 883 0.519 4.205 8.761
638 HB ILE 883 HB ILE 883 -1.004 4.527 6.173
639 HG12 ILE 883 HG12 ILE 883 1.633 3.115 6.689
640 HG13 ILE 883 HG13 ILE 883 0.098 2.281 6.461
641 HG21 ILE 883 HG21 ILE 883 1.687 5.544 7.136
642 HG22 ILE 883 HG22 ILE 883 0.248 6.521 6.852
643 HG23 ILE 883 HG23 ILE 883 1.063 5.738 5.498
644 HD11 ILE 883 HD11 ILE 883 1.401 2.415 4.349
645 HD12 ILE 883 HD12 ILE 883 1.355 4.170 4.458
646 HD13 ILE 883 HD13 ILE 883 -0.139 3.269 4.227
647 HA PRO 884 HA PRO 884 -2.491 6.963 10.810
648 HB2 PRO 884 HB2 PRO 884 -0.099 8.767 10.505
649 HB3 PRO 884 HB3 PRO 884 -1.177 8.559 11.901
650 HG2 PRO 884 HG2 PRO 884 1.208 7.405 11.862
651 HG3 PRO 884 HG3 PRO 884 -0.200 6.555 12.526
652 HD2 PRO 884 HD2 PRO 884 1.232 6.083 9.945
653 HD3 PRO 884 HD3 PRO 884 0.335 4.934 10.965
654 H LEU 885 H LEU 885 -4.025 8.124 9.807
655 HA LEU 885 HA LEU 885 -3.887 8.850 7.085
656 HB2 LEU 885 HB2 LEU 885 -5.766 9.999 9.159
657 HB3 LEU 885 HB3 LEU 885 -6.031 9.903 7.420
658 HG LEU 885 HG LEU 885 -5.837 7.588 9.361
659 HD11 LEU 885 HD11 LEU 885 -8.153 7.209 8.794
660 HD12 LEU 885 HD12 LEU 885 -8.100 8.451 7.542
661 HD13 LEU 885 HD13 LEU 885 -7.984 8.907 9.241
662 HD21 LEU 885 HD21 LEU 885 -5.833 7.700 6.342
663 HD22 LEU 885 HD22 LEU 885 -6.510 6.303 7.180
664 HD23 LEU 885 HD23 LEU 885 -4.816 6.735 7.412
665 H ALA 886 H ALA 886 -2.604 10.356 9.831
666 HA ALA 886 HA ALA 886 -2.740 13.076 8.865
667 HB1 ALA 886 HB1 ALA 886 -1.002 13.405 10.727
668 HB2 ALA 886 HB2 ALA 886 -1.280 11.708 11.122
669 HB3 ALA 886 HB3 ALA 886 -2.607 12.865 11.221
670 H SER 887 H SER 887 -0.696 10.321 8.454
671 HA SER 887 HA SER 887 1.574 11.874 7.470
672 HB2 SER 887 HB2 SER 887 2.029 9.885 8.801
673 HB3 SER 887 HB3 SER 887 1.115 8.889 7.671
674 HG SER 887 HG SER 887 3.195 10.507 6.710
675 H VAL 888 H VAL 888 -1.285 10.526 6.212
676 HA VAL 888 HA VAL 888 -0.310 10.940 3.464
677 HB VAL 888 HB VAL 888 -1.689 8.886 2.820
678 HG11 VAL 888 HG11 VAL 888 0.683 8.736 2.664
679 HG12 VAL 888 HG12 VAL 888 0.184 7.316 3.580
680 HG13 VAL 888 HG13 VAL 888 0.873 8.705 4.417
681 HG21 VAL 888 HG21 VAL 888 -2.885 8.668 4.974
682 HG22 VAL 888 HG22 VAL 888 -1.354 8.346 5.790
683 HG23 VAL 888 HG23 VAL 888 -1.979 7.201 4.602
684 H VAL 889 H VAL 889 -2.516 10.332 2.087
685 HA VAL 889 HA VAL 889 -4.798 11.765 3.283
686 HB VAL 889 HB VAL 889 -3.797 12.438 0.513
687 HG11 VAL 889 HG11 VAL 889 -5.276 14.334 0.742
688 HG12 VAL 889 HG12 VAL 889 -5.555 13.976 2.446
689 HG13 VAL 889 HG13 VAL 889 -6.188 12.896 1.203
690 HG21 VAL 889 HG21 VAL 889 -2.972 14.575 1.673
691 HG22 VAL 889 HG22 VAL 889 -1.996 13.127 1.922
692 HG23 VAL 889 HG23 VAL 889 -3.096 13.677 3.186
693 H LEU 890 H LEU 890 -6.764 11.194 2.456
694 HA LEU 890 HA LEU 890 -6.800 8.759 0.767
695 HB2 LEU 890 HB2 LEU 890 -8.900 9.855 2.638
696 HB3 LEU 890 HB3 LEU 890 -8.917 8.282 1.840
697 HG LEU 890 HG LEU 890 -6.737 9.159 3.761
698 HD11 LEU 890 HD11 LEU 890 -8.704 9.106 5.085
699 HD12 LEU 890 HD12 LEU 890 -7.950 7.531 5.327
700 HD13 LEU 890 HD13 LEU 890 -9.329 7.691 4.242
701 HD21 LEU 890 HD21 LEU 890 -5.945 7.367 2.406
702 HD22 LEU 890 HD22 LEU 890 -7.503 6.542 2.445
703 HD23 LEU 890 HD23 LEU 890 -6.495 6.597 3.891
704 HA PRO 891 HA PRO 891 -8.468 11.906 -2.187
705 HB2 PRO 891 HB2 PRO 891 -8.492 9.451 -3.913
706 HB3 PRO 891 HB3 PRO 891 -7.886 11.078 -4.275
707 HG2 PRO 891 HG2 PRO 891 -6.213 9.084 -3.752
708 HG3 PRO 891 HG3 PRO 891 -5.893 10.725 -3.156
709 HD2 PRO 891 HD2 PRO 891 -6.908 8.336 -1.645
710 HD3 PRO 891 HD3 PRO 891 -5.797 9.622 -1.118
711 H SER 892 H SER 892 -10.389 11.804 -0.704
712 HA SER 892 HA SER 892 -12.740 11.173 -2.087
713 HB2 SER 892 HB2 SER 892 -12.463 8.866 -1.806
714 HB3 SER 892 HB3 SER 892 -11.748 9.049 -0.207
715 HG SER 892 HG SER 892 -14.406 9.017 -1.006
716 H ARG 893 H ARG 893 -11.192 12.859 0.054
717 HA ARG 893 HA ARG 893 -12.615 13.006 2.426
718 HB2 ARG 893 HB2 ARG 893 -11.370 15.237 0.802
719 HB3 ARG 893 HB3 ARG 893 -11.935 15.415 2.464
720 HG2 ARG 893 HG2 ARG 893 -10.365 13.735 3.239
721 HG3 ARG 893 HG3 ARG 893 -9.879 13.369 1.583
722 HD2 ARG 893 HD2 ARG 893 -8.221 14.837 2.615
723 HD3 ARG 893 HD3 ARG 893 -9.063 15.702 1.332
724 HE ARG 893 HE ARG 893 -10.472 16.257 3.649
725 HH11 ARG 893 HH11 ARG 893 -7.232 16.590 2.481
726 HH12 ARG 893 HH12 ARG 893 -6.893 18.009 3.418
727 HH21 ARG 893 HH21 ARG 893 -10.035 18.117 4.879
728 HH22 ARG 893 HH22 ARG 893 -8.480 18.872 4.774
729 H ALA 894 H ALA 894 -13.326 14.590 -0.676
730 HA ALA 894 HA ALA 894 -16.152 14.641 -0.058
731 HB1 ALA 894 HB1 ALA 894 -16.417 17.061 -0.225
732 HB2 ALA 894 HB2 ALA 894 -14.674 17.261 -0.406
733 HB3 ALA 894 HB3 ALA 894 -15.341 16.668 1.116
734 H GLU 895 H GLU 895 -17.143 14.152 -1.897
735 HA GLU 895 HA GLU 895 -15.771 14.264 -4.421
736 HB2 GLU 895 HB2 GLU 895 -18.638 13.584 -3.726
737 HB3 GLU 895 HB3 GLU 895 -17.919 13.393 -5.326
738 HG2 GLU 895 HG2 GLU 895 -17.780 11.254 -4.233
739 HG3 GLU 895 HG3 GLU 895 -16.152 11.933 -4.257
740 H ARG 896 H ARG 896 -19.055 15.453 -3.787
741 HA ARG 896 HA ARG 896 -18.435 18.166 -4.503
742 HB2 ARG 896 HB2 ARG 896 -18.335 17.180 -6.738
743 HB3 ARG 896 HB3 ARG 896 -19.925 16.452 -6.505
744 HG2 ARG 896 HG2 ARG 896 -20.988 18.603 -6.402
745 HG3 ARG 896 HG3 ARG 896 -19.434 19.433 -6.317
746 HD2 ARG 896 HD2 ARG 896 -20.321 19.594 -8.588
747 HD3 ARG 896 HD3 ARG 896 -18.881 18.580 -8.584
748 HE ARG 896 HE ARG 896 -21.231 16.997 -8.253
749 HH11 ARG 896 HH11 ARG 896 -19.391 18.815 -10.551
750 HH12 ARG 896 HH12 ARG 896 -19.909 17.880 -11.914
751 HH21 ARG 896 HH21 ARG 896 -21.914 15.765 -10.035
752 HH22 ARG 896 HH22 ARG 896 -21.337 16.151 -11.622
753 H ALA 897 H ALA 897 -21.146 15.850 -4.760
754 HA ALA 897 HA ALA 897 -22.580 17.161 -2.622
755 HB1 ALA 897 HB1 ALA 897 -23.690 17.302 -5.435
756 HB2 ALA 897 HB2 ALA 897 -23.063 18.672 -4.518
757 HB3 ALA 897 HB3 ALA 897 -24.512 17.831 -3.967
758 H ARG 898 H ARG 898 -22.336 14.953 -1.873
759 HA ARG 898 HA ARG 898 -23.093 12.816 -1.495
760 HB2 ARG 898 HB2 ARG 898 -25.581 13.848 -2.879
761 HB3 ARG 898 HB3 ARG 898 -25.479 12.439 -1.821
762 HG2 ARG 898 HG2 ARG 898 -24.686 13.945 0.019
763 HG3 ARG 898 HG3 ARG 898 -24.967 15.324 -1.045
764 HD2 ARG 898 HD2 ARG 898 -27.354 14.545 -1.283
765 HD3 ARG 898 HD3 ARG 898 -27.025 13.348 -0.033
766 HE ARG 898 HE ARG 898 -26.349 16.048 0.750
767 HH11 ARG 898 HH11 ARG 898 -28.822 13.642 0.489
768 HH12 ARG 898 HH12 ARG 898 -29.801 14.313 1.753
769 HH21 ARG 898 HH21 ARG 898 -27.625 16.932 2.407
770 HH22 ARG 898 HH22 ARG 898 -29.122 16.176 2.838
771 H SER 899 H SER 899 -21.400 12.411 -3.279
772 HA SER 899 HA SER 899 -20.740 11.184 -5.104
773 HB2 SER 899 HB2 SER 899 -23.514 9.995 -5.041
774 HB3 SER 899 HB3 SER 899 -22.035 9.256 -5.649
775 HG SER 899 HG SER 899 -22.391 10.094 -2.963
776 H THR 900 H THR 900 -20.443 12.225 -6.962
777 HA THR 900 HA THR 900 -22.349 13.902 -8.197
778 HB THR 900 HB THR 900 -20.082 14.347 -8.692
779 HG1 THR 900 HG1 THR 900 -20.035 13.650 -11.048
780 HG21 THR 900 HG21 THR 900 -19.928 11.414 -9.416
781 HG22 THR 900 HG22 THR 900 -19.058 12.255 -8.132
782 HG23 THR 900 HG23 THR 900 -18.658 12.570 -9.821
Start of MODEL 8
1 H1 ASP 500 H1 ASP 500 3.922 -22.486 -3.251
2 H2 ASP 500 H2 ASP 500 3.891 -22.780 -4.923
3 H3 ASP 500 H3 ASP 500 3.196 -21.363 -4.294
4 HA ASP 500 HA ASP 500 6.084 -22.053 -4.237
5 HB2 ASP 500 HB2 ASP 500 4.724 -19.807 -5.735
6 HB3 ASP 500 HB3 ASP 500 6.368 -20.413 -5.938
7 H LYS 501 H LYS 501 7.085 -21.120 -2.572
8 HA LYS 501 HA LYS 501 5.732 -19.202 -0.896
9 HB2 LYS 501 HB2 LYS 501 8.568 -20.260 -0.801
10 HB3 LYS 501 HB3 LYS 501 7.796 -19.292 0.454
11 HG2 LYS 501 HG2 LYS 501 6.127 -21.013 0.836
12 HG3 LYS 501 HG3 LYS 501 6.734 -21.955 -0.525
13 HD2 LYS 501 HD2 LYS 501 8.870 -22.291 0.606
14 HD3 LYS 501 HD3 LYS 501 8.356 -21.257 1.939
15 HE2 LYS 501 HE2 LYS 501 8.057 -23.587 2.587
16 HE3 LYS 501 HE3 LYS 501 6.472 -22.839 2.384
17 HZ1 LYS 501 HZ1 LYS 501 6.567 -23.721 0.035
18 HZ2 LYS 501 HZ2 LYS 501 6.360 -24.877 1.263
19 HZ3 LYS 501 HZ3 LYS 501 7.880 -24.671 0.535
20 H ALA 502 H ALA 502 7.515 -18.972 -3.719
21 HA ALA 502 HA ALA 502 9.163 -16.759 -3.388
22 HB1 ALA 502 HB1 ALA 502 8.787 -16.344 -5.810
23 HB2 ALA 502 HB2 ALA 502 7.473 -17.522 -5.782
24 HB3 ALA 502 HB3 ALA 502 9.128 -18.038 -5.459
25 H TYR 503 H TYR 503 5.814 -16.696 -4.630
26 HA TYR 503 HA TYR 503 5.409 -13.992 -4.751
27 HB2 TYR 503 HB2 TYR 503 3.796 -16.151 -5.067
28 HB3 TYR 503 HB3 TYR 503 3.154 -15.542 -3.546
29 HD1 TYR 503 HD1 TYR 503 3.358 -12.659 -3.752
30 HD2 TYR 503 HD2 TYR 503 2.351 -15.513 -6.802
31 HE1 TYR 503 HE1 TYR 503 2.129 -10.905 -4.986
32 HE2 TYR 503 HE2 TYR 503 1.117 -13.753 -8.035
33 HH TYR 503 HH TYR 503 1.182 -10.382 -6.983
34 H LEU 504 H LEU 504 4.539 -15.960 -1.880
35 HA LEU 504 HA LEU 504 3.879 -13.980 -0.118
36 HB2 LEU 504 HB2 LEU 504 5.353 -16.575 0.299
37 HB3 LEU 504 HB3 LEU 504 4.988 -15.512 1.659
38 HG LEU 504 HG LEU 504 2.588 -15.575 1.056
39 HD11 LEU 504 HD11 LEU 504 2.585 -15.935 -1.289
40 HD12 LEU 504 HD12 LEU 504 1.957 -17.438 -0.614
41 HD13 LEU 504 HD13 LEU 504 3.633 -17.347 -1.157
42 HD21 LEU 504 HD21 LEU 504 2.189 -17.923 1.712
43 HD22 LEU 504 HD22 LEU 504 3.508 -17.226 2.654
44 HD23 LEU 504 HD23 LEU 504 3.863 -18.319 1.316
45 H ASP 505 H ASP 505 7.175 -15.152 -0.771
46 HA ASP 505 HA ASP 505 8.602 -13.574 0.993
47 HB2 ASP 505 HB2 ASP 505 9.467 -15.361 -0.640
48 HB3 ASP 505 HB3 ASP 505 9.550 -14.062 -1.829
49 H GLU 506 H GLU 506 7.392 -12.721 -2.234
50 HA GLU 506 HA GLU 506 8.578 -10.168 -2.404
51 HB2 GLU 506 HB2 GLU 506 5.935 -11.039 -3.595
52 HB3 GLU 506 HB3 GLU 506 6.956 -9.712 -4.146
53 HG2 GLU 506 HG2 GLU 506 7.754 -12.637 -4.110
54 HG3 GLU 506 HG3 GLU 506 7.269 -11.731 -5.542
55 H LEU 507 H LEU 507 5.796 -11.343 -0.683
56 HA LEU 507 HA LEU 507 4.718 -8.688 -0.164
57 HB2 LEU 507 HB2 LEU 507 3.918 -11.233 1.245
58 HB3 LEU 507 HB3 LEU 507 2.953 -9.790 0.936
59 HG LEU 507 HG LEU 507 3.920 -11.801 -1.113
60 HD11 LEU 507 HD11 LEU 507 1.218 -11.038 0.009
61 HD12 LEU 507 HD12 LEU 507 1.978 -12.626 0.003
62 HD13 LEU 507 HD13 LEU 507 1.392 -11.924 -1.506
63 HD21 LEU 507 HD21 LEU 507 4.066 -9.675 -2.186
64 HD22 LEU 507 HD22 LEU 507 2.592 -9.099 -1.410
65 HD23 LEU 507 HD23 LEU 507 2.501 -10.329 -2.668
66 H VAL 508 H VAL 508 6.371 -11.271 1.654
67 HA VAL 508 HA VAL 508 6.372 -10.037 4.167
68 HB VAL 508 HB VAL 508 8.438 -11.891 2.964
69 HG11 VAL 508 HG11 VAL 508 8.832 -12.415 5.425
70 HG12 VAL 508 HG12 VAL 508 7.894 -10.967 5.796
71 HG13 VAL 508 HG13 VAL 508 9.402 -10.832 4.892
72 HG21 VAL 508 HG21 VAL 508 7.156 -13.613 4.229
73 HG22 VAL 508 HG22 VAL 508 6.175 -12.840 2.984
74 HG23 VAL 508 HG23 VAL 508 5.977 -12.377 4.675
75 H GLU 509 H GLU 509 9.112 -10.157 1.874
76 HA GLU 509 HA GLU 509 10.795 -8.366 3.140
77 HB2 GLU 509 HB2 GLU 509 10.353 -8.843 0.185
78 HB3 GLU 509 HB3 GLU 509 11.668 -7.854 0.823
79 HG2 GLU 509 HG2 GLU 509 12.454 -9.784 2.162
80 HG3 GLU 509 HG3 GLU 509 11.163 -10.771 1.478
81 H LEU 510 H LEU 510 8.370 -7.605 0.626
82 HA LEU 510 HA LEU 510 8.713 -4.835 0.643
83 HB2 LEU 510 HB2 LEU 510 7.329 -6.259 -0.970
84 HB3 LEU 510 HB3 LEU 510 6.055 -6.202 0.244
85 HG LEU 510 HG LEU 510 6.192 -3.691 0.175
86 HD11 LEU 510 HD11 LEU 510 7.278 -2.959 -2.172
87 HD12 LEU 510 HD12 LEU 510 8.310 -4.347 -1.842
88 HD13 LEU 510 HD13 LEU 510 8.225 -3.016 -0.689
89 HD21 LEU 510 HD21 LEU 510 5.658 -4.818 -2.578
90 HD22 LEU 510 HD22 LEU 510 4.821 -3.502 -1.762
91 HD23 LEU 510 HD23 LEU 510 4.596 -5.160 -1.217
92 H HIS 511 H HIS 511 6.423 -6.837 2.497
93 HA HIS 511 HA HIS 511 5.131 -4.839 3.922
94 HB2 HIS 511 HB2 HIS 511 4.365 -7.115 4.034
95 HB3 HIS 511 HB3 HIS 511 5.885 -7.649 4.747
96 HD1 HIS 511 HD1 HIS 511 2.850 -5.532 5.536
97 HD2 HIS 511 HD2 HIS 511 6.045 -7.329 7.521
98 HE1 HIS 511 HE1 HIS 511 2.396 -5.277 8.018
99 HE2 HIS 511 HE2 HIS 511 4.333 -6.366 9.240
100 H ARG 512 H ARG 512 8.007 -6.697 4.953
101 HA ARG 512 HA ARG 512 8.511 -5.462 7.341
102 HB2 ARG 512 HB2 ARG 512 9.777 -7.397 6.642
103 HB3 ARG 512 HB3 ARG 512 10.437 -6.528 5.259
104 HG2 ARG 512 HG2 ARG 512 12.030 -6.723 7.195
105 HG3 ARG 512 HG3 ARG 512 11.709 -5.061 6.709
106 HD2 ARG 512 HD2 ARG 512 11.620 -5.604 9.231
107 HD3 ARG 512 HD3 ARG 512 10.295 -4.668 8.546
108 HE ARG 512 HE ARG 512 9.881 -7.551 8.605
109 HH11 ARG 512 HH11 ARG 512 9.483 -4.486 10.162
110 HH12 ARG 512 HH12 ARG 512 8.150 -5.001 11.141
111 HH21 ARG 512 HH21 ARG 512 8.132 -8.233 9.883
112 HH22 ARG 512 HH22 ARG 512 7.385 -7.123 10.981
113 H ARG 513 H ARG 513 9.748 -4.524 4.135
114 HA ARG 513 HA ARG 513 11.167 -2.247 4.973
115 HB2 ARG 513 HB2 ARG 513 11.397 -3.354 2.746
116 HB3 ARG 513 HB3 ARG 513 9.840 -2.665 2.289
117 HG2 ARG 513 HG2 ARG 513 10.671 -0.420 2.521
118 HG3 ARG 513 HG3 ARG 513 12.164 -0.989 3.266
119 HD2 ARG 513 HD2 ARG 513 12.887 -2.017 1.213
120 HD3 ARG 513 HD3 ARG 513 11.320 -1.739 0.458
121 HE ARG 513 HE ARG 513 12.646 0.679 1.343
122 HH11 ARG 513 HH11 ARG 513 12.237 -1.660 -1.175
123 HH12 ARG 513 HH12 ARG 513 12.714 -0.581 -2.443
124 HH21 ARG 513 HH21 ARG 513 13.271 2.099 -0.314
125 HH22 ARG 513 HH22 ARG 513 13.300 1.547 -1.956
126 H LEU 514 H LEU 514 7.794 -2.641 3.936
127 HA LEU 514 HA LEU 514 7.139 0.099 3.862
128 HB2 LEU 514 HB2 LEU 514 5.486 -2.383 4.289
129 HB3 LEU 514 HB3 LEU 514 4.763 -0.778 4.252
130 HG LEU 514 HG LEU 514 6.576 -1.722 2.022
131 HD11 LEU 514 HD11 LEU 514 4.888 -3.414 2.093
132 HD12 LEU 514 HD12 LEU 514 4.416 -2.300 0.811
133 HD13 LEU 514 HD13 LEU 514 3.614 -2.230 2.382
134 HD21 LEU 514 HD21 LEU 514 5.000 -0.119 0.748
135 HD22 LEU 514 HD22 LEU 514 6.137 0.621 1.868
136 HD23 LEU 514 HD23 LEU 514 4.449 0.419 2.332
137 H MET 515 H MET 515 6.930 -2.300 6.451
138 HA MET 515 HA MET 515 5.628 -0.800 8.378
139 HB2 MET 515 HB2 MET 515 6.341 -3.253 8.475
140 HB3 MET 515 HB3 MET 515 7.911 -2.662 9.021
141 HG2 MET 515 HG2 MET 515 6.693 -3.090 11.018
142 HG3 MET 515 HG3 MET 515 6.613 -1.342 10.804
143 HE1 MET 515 HE1 MET 515 4.105 -0.656 11.975
144 HE2 MET 515 HE2 MET 515 5.035 -1.985 12.662
145 HE3 MET 515 HE3 MET 515 3.300 -2.167 12.423
146 H THR 516 H THR 516 9.052 -0.795 7.519
147 HA THR 516 HA THR 516 9.666 1.165 9.607
148 HB THR 516 HB THR 516 11.951 0.839 9.018
149 HG1 THR 516 HG1 THR 516 10.830 -0.179 6.647
150 HG21 THR 516 HG21 THR 516 10.688 -1.086 10.127
151 HG22 THR 516 HG22 THR 516 12.209 -1.509 9.340
152 HG23 THR 516 HG23 THR 516 10.674 -1.858 8.542
153 H LEU 517 H LEU 517 8.915 1.019 6.239
154 HA LEU 517 HA LEU 517 10.170 3.280 5.232
155 HB2 LEU 517 HB2 LEU 517 8.870 1.646 3.893
156 HB3 LEU 517 HB3 LEU 517 7.384 2.313 4.562
157 HG LEU 517 HG LEU 517 8.006 4.542 3.617
158 HD11 LEU 517 HD11 LEU 517 9.818 4.260 1.697
159 HD12 LEU 517 HD12 LEU 517 10.412 2.963 2.733
160 HD13 LEU 517 HD13 LEU 517 10.321 4.613 3.347
161 HD21 LEU 517 HD21 LEU 517 6.564 2.863 2.418
162 HD22 LEU 517 HD22 LEU 517 8.001 2.333 1.543
163 HD23 LEU 517 HD23 LEU 517 7.404 3.979 1.341
164 H ARG 518 H ARG 518 9.740 5.442 5.193
165 HA ARG 518 HA ARG 518 7.411 6.456 6.702
166 HB2 ARG 518 HB2 ARG 518 10.316 7.174 7.122
167 HB3 ARG 518 HB3 ARG 518 9.003 8.233 7.633
168 HG2 ARG 518 HG2 ARG 518 8.924 5.336 8.457
169 HG3 ARG 518 HG3 ARG 518 10.012 6.429 9.308
170 HD2 ARG 518 HD2 ARG 518 8.158 7.902 9.885
171 HD3 ARG 518 HD3 ARG 518 7.043 6.925 8.938
172 HE ARG 518 HE ARG 518 8.428 5.464 11.026
173 HH11 ARG 518 HH11 ARG 518 5.704 7.401 10.129
174 HH12 ARG 518 HH12 ARG 518 4.686 6.802 11.396
175 HH21 ARG 518 HH21 ARG 518 7.100 4.675 12.690
176 HH22 ARG 518 HH22 ARG 518 5.476 5.257 12.846
177 H GLU 519 H GLU 519 8.942 6.329 3.853
178 HA GLU 519 HA GLU 519 9.242 8.974 2.980
179 HB2 GLU 519 HB2 GLU 519 8.615 6.381 1.584
180 HB3 GLU 519 HB3 GLU 519 8.614 7.895 0.683
181 HG2 GLU 519 HG2 GLU 519 10.894 8.299 1.108
182 HG3 GLU 519 HG3 GLU 519 10.948 7.136 2.432
183 H ARG 520 H ARG 520 7.742 10.504 3.207
184 HA ARG 520 HA ARG 520 4.931 9.964 3.256
185 HB2 ARG 520 HB2 ARG 520 6.142 11.870 4.438
186 HB3 ARG 520 HB3 ARG 520 6.230 12.661 2.863
187 HG2 ARG 520 HG2 ARG 520 3.799 12.617 2.658
188 HG3 ARG 520 HG3 ARG 520 3.664 11.717 4.169
189 HD2 ARG 520 HD2 ARG 520 4.874 13.665 5.284
190 HD3 ARG 520 HD3 ARG 520 4.619 14.559 3.789
191 HE ARG 520 HE ARG 520 2.626 13.939 5.782
192 HH11 ARG 520 HH11 ARG 520 3.259 14.602 2.446
193 HH12 ARG 520 HH12 ARG 520 1.670 15.207 2.121
194 HH21 ARG 520 HH21 ARG 520 0.537 14.730 5.363
195 HH22 ARG 520 HH22 ARG 520 0.128 15.280 3.774
196 H HIS 521 H HIS 521 7.225 10.708 0.771
197 HA HIS 521 HA HIS 521 5.274 11.685 -1.115
198 HB2 HIS 521 HB2 HIS 521 7.396 11.044 -2.696
199 HB3 HIS 521 HB3 HIS 521 7.285 12.549 -1.790
200 HD1 HIS 521 HD1 HIS 521 8.202 12.124 0.887
201 HD2 HIS 521 HD2 HIS 521 9.800 9.824 -2.200
202 HE1 HIS 521 HE1 HIS 521 10.423 11.241 1.728
203 HE2 HIS 521 HE2 HIS 521 11.409 9.836 -0.142
204 H ILE 522 H ILE 522 6.560 8.561 -0.212
205 HA ILE 522 HA ILE 522 5.441 7.256 -2.584
206 HB ILE 522 HB ILE 522 7.116 6.368 -0.244
207 HG12 ILE 522 HG12 ILE 522 8.606 5.590 -1.970
208 HG13 ILE 522 HG13 ILE 522 7.367 5.786 -3.208
209 HG21 ILE 522 HG21 ILE 522 5.522 4.606 -0.248
210 HG22 ILE 522 HG22 ILE 522 6.864 4.003 -1.220
211 HG23 ILE 522 HG23 ILE 522 5.405 4.610 -2.008
212 HD11 ILE 522 HD11 ILE 522 8.294 8.144 -1.583
213 HD12 ILE 522 HD12 ILE 522 7.523 8.132 -3.168
214 HD13 ILE 522 HD13 ILE 522 9.199 7.615 -2.997
215 H LEU 523 H LEU 523 4.982 7.149 0.949
216 HA LEU 523 HA LEU 523 2.861 5.410 1.136
217 HB2 LEU 523 HB2 LEU 523 3.840 7.724 2.722
218 HB3 LEU 523 HB3 LEU 523 2.160 7.293 3.016
219 HG LEU 523 HG LEU 523 2.893 4.925 3.416
220 HD11 LEU 523 HD11 LEU 523 5.198 4.363 3.601
221 HD12 LEU 523 HD12 LEU 523 5.697 6.052 3.544
222 HD13 LEU 523 HD13 LEU 523 5.077 5.267 2.093
223 HD21 LEU 523 HD21 LEU 523 4.056 5.478 5.615
224 HD22 LEU 523 HD22 LEU 523 2.523 6.303 5.340
225 HD23 LEU 523 HD23 LEU 523 4.045 7.162 5.097
226 H GLN 524 H GLN 524 2.879 8.639 -0.174
227 HA GLN 524 HA GLN 524 0.001 8.920 -0.145
228 HB2 GLN 524 HB2 GLN 524 2.229 10.491 -1.448
229 HB3 GLN 524 HB3 GLN 524 0.524 10.889 -1.670
230 HG2 GLN 524 HG2 GLN 524 0.217 11.304 0.662
231 HG3 GLN 524 HG3 GLN 524 1.776 10.587 1.065
232 HE21 GLN 524 HE21 GLN 524 0.530 13.487 1.249
233 HE22 GLN 524 HE22 GLN 524 1.785 14.459 0.647
234 H GLN 525 H GLN 525 2.476 8.113 -2.546
235 HA GLN 525 HA GLN 525 0.745 7.942 -4.784
236 HB2 GLN 525 HB2 GLN 525 3.357 6.495 -4.278
237 HB3 GLN 525 HB3 GLN 525 2.578 6.701 -5.845
238 HG2 GLN 525 HG2 GLN 525 3.221 9.119 -4.165
239 HG3 GLN 525 HG3 GLN 525 4.487 8.361 -5.126
240 HE21 GLN 525 HE21 GLN 525 4.657 9.203 -7.203
241 HE22 GLN 525 HE22 GLN 525 3.393 9.934 -8.068
242 H ILE 526 H ILE 526 2.124 5.406 -2.707
243 HA ILE 526 HA ILE 526 0.879 3.198 -3.854
244 HB ILE 526 HB ILE 526 1.744 3.765 -1.017
245 HG12 ILE 526 HG12 ILE 526 2.916 1.966 -3.159
246 HG13 ILE 526 HG13 ILE 526 3.418 3.637 -2.911
247 HG21 ILE 526 HG21 ILE 526 0.209 2.049 -0.612
248 HG22 ILE 526 HG22 ILE 526 1.669 1.123 -0.953
249 HG23 ILE 526 HG23 ILE 526 0.440 1.324 -2.199
250 HD11 ILE 526 HD11 ILE 526 3.868 2.984 -0.477
251 HD12 ILE 526 HD12 ILE 526 4.973 2.326 -1.682
252 HD13 ILE 526 HD13 ILE 526 3.699 1.311 -1.006
253 H VAL 527 H VAL 527 -0.207 4.955 -0.946
254 HA VAL 527 HA VAL 527 -2.563 3.737 -0.414
255 HB VAL 527 HB VAL 527 -1.902 6.685 -0.374
256 HG11 VAL 527 HG11 VAL 527 -3.857 6.828 1.247
257 HG12 VAL 527 HG12 VAL 527 -4.362 5.246 0.653
258 HG13 VAL 527 HG13 VAL 527 -4.305 6.624 -0.448
259 HG21 VAL 527 HG21 VAL 527 -0.757 4.844 1.113
260 HG22 VAL 527 HG22 VAL 527 -2.284 4.852 1.993
261 HG23 VAL 527 HG23 VAL 527 -1.328 6.328 1.871
262 H ASN 528 H ASN 528 -2.347 6.542 -2.641
263 HA ASN 528 HA ASN 528 -4.975 6.344 -3.600
264 HB2 ASN 528 HB2 ASN 528 -2.564 7.441 -5.057
265 HB3 ASN 528 HB3 ASN 528 -4.254 7.835 -5.369
266 HD21 ASN 528 HD21 ASN 528 -4.775 7.770 -2.338
267 HD22 ASN 528 HD22 ASN 528 -4.165 9.254 -1.785
268 H LEU 529 H LEU 529 -2.162 4.457 -4.341
269 HA LEU 529 HA LEU 529 -2.958 3.637 -6.956
270 HB2 LEU 529 HB2 LEU 529 -0.620 3.487 -5.765
271 HB3 LEU 529 HB3 LEU 529 -1.226 1.949 -5.164
272 HG LEU 529 HG LEU 529 0.015 1.551 -7.209
273 HD11 LEU 529 HD11 LEU 529 -1.589 0.279 -8.397
274 HD12 LEU 529 HD12 LEU 529 -2.893 1.393 -7.997
275 HD13 LEU 529 HD13 LEU 529 -2.205 0.353 -6.747
276 HD21 LEU 529 HD21 LEU 529 -0.633 4.028 -8.036
277 HD22 LEU 529 HD22 LEU 529 -1.876 3.137 -8.916
278 HD23 LEU 529 HD23 LEU 529 -0.176 2.758 -9.166
279 H ILE 530 H ILE 530 -2.883 1.818 -3.903
280 HA ILE 530 HA ILE 530 -4.528 -0.258 -4.926
281 HB ILE 530 HB ILE 530 -4.651 -1.053 -2.589
282 HG12 ILE 530 HG12 ILE 530 -2.977 1.386 -1.903
283 HG13 ILE 530 HG13 ILE 530 -4.690 1.270 -1.537
284 HG21 ILE 530 HG21 ILE 530 -2.735 -1.651 -3.940
285 HG22 ILE 530 HG22 ILE 530 -2.156 -1.271 -2.318
286 HG23 ILE 530 HG23 ILE 530 -1.969 -0.093 -3.622
287 HD11 ILE 530 HD11 ILE 530 -2.778 0.487 0.195
288 HD12 ILE 530 HD12 ILE 530 -3.047 -1.037 -0.644
289 HD13 ILE 530 HD13 ILE 530 -4.392 -0.217 0.152
290 H GLU 531 H GLU 531 -5.212 2.462 -2.783
291 HA GLU 531 HA GLU 531 -7.808 2.098 -2.119
292 HB2 GLU 531 HB2 GLU 531 -6.546 4.122 -1.521
293 HB3 GLU 531 HB3 GLU 531 -6.693 4.703 -3.180
294 HG2 GLU 531 HG2 GLU 531 -8.999 5.076 -2.994
295 HG3 GLU 531 HG3 GLU 531 -9.179 3.942 -1.657
296 H GLU 532 H GLU 532 -6.638 3.200 -5.268
297 HA GLU 532 HA GLU 532 -9.156 3.628 -6.476
298 HB2 GLU 532 HB2 GLU 532 -6.403 3.039 -7.568
299 HB3 GLU 532 HB3 GLU 532 -7.796 3.266 -8.628
300 HG2 GLU 532 HG2 GLU 532 -7.078 5.277 -6.490
301 HG3 GLU 532 HG3 GLU 532 -6.385 5.353 -8.108
302 H THR 533 H THR 533 -7.163 0.754 -6.081
303 HA THR 533 HA THR 533 -8.604 -0.897 -7.904
304 HB THR 533 HB THR 533 -7.380 -2.735 -6.958
305 HG1 THR 533 HG1 THR 533 -6.112 -2.259 -5.019
306 HG21 THR 533 HG21 THR 533 -5.061 -1.812 -6.978
307 HG22 THR 533 HG22 THR 533 -5.741 -0.186 -6.932
308 HG23 THR 533 HG23 THR 533 -6.043 -1.228 -8.323
309 H GLY 534 H GLY 534 -8.691 -0.624 -4.347
310 HA2 GLY 534 HA2 GLY 534 -10.987 -0.551 -3.363
311 HA3 GLY 534 HA3 GLY 534 -11.360 -1.938 -4.375
312 H HIS 535 H HIS 535 -8.412 -2.769 -3.749
313 HA HIS 535 HA HIS 535 -9.123 -4.551 -1.613
314 HB2 HIS 535 HB2 HIS 535 -6.561 -4.056 -3.131
315 HB3 HIS 535 HB3 HIS 535 -6.688 -5.246 -1.837
316 HD1 HIS 535 HD1 HIS 535 -6.864 -7.473 -2.956
317 HD2 HIS 535 HD2 HIS 535 -9.238 -4.613 -4.845
318 HE1 HIS 535 HE1 HIS 535 -8.157 -8.693 -4.761
319 HE2 HIS 535 HE2 HIS 535 -9.610 -6.963 -5.921
320 H PHE 536 H PHE 536 -9.443 -2.040 -0.540
321 HA PHE 536 HA PHE 536 -7.286 -1.983 1.476
322 HB2 PHE 536 HB2 PHE 536 -6.983 0.352 1.334
323 HB3 PHE 536 HB3 PHE 536 -6.989 -0.191 -0.341
324 HD1 PHE 536 HD1 PHE 536 -9.297 -0.167 -1.571
325 HD2 PHE 536 HD2 PHE 536 -8.461 2.052 2.008
326 HE1 PHE 536 HE1 PHE 536 -11.202 1.346 -2.057
327 HE2 PHE 536 HE2 PHE 536 -10.371 3.556 1.515
328 HZ PHE 536 HZ PHE 536 -11.739 3.204 -0.514
329 H HIS 537 H HIS 537 -7.878 -1.109 3.473
330 HA HIS 537 HA HIS 537 -10.745 -0.609 3.969
331 HB2 HIS 537 HB2 HIS 537 -10.190 -3.020 4.468
332 HB3 HIS 537 HB3 HIS 537 -9.054 -2.440 5.686
333 HD1 HIS 537 HD1 HIS 537 -12.677 -2.928 5.029
334 HD2 HIS 537 HD2 HIS 537 -10.306 -1.082 7.919
335 HE1 HIS 537 HE1 HIS 537 -14.197 -2.438 6.995
336 HE2 HIS 537 HE2 HIS 537 -12.766 -1.312 8.765
337 H ILE 538 H ILE 538 -11.011 1.159 5.186
338 HA ILE 538 HA ILE 538 -8.689 2.212 6.711
339 HB ILE 538 HB ILE 538 -11.101 3.764 5.741
340 HG12 ILE 538 HG12 ILE 538 -8.396 3.268 4.467
341 HG13 ILE 538 HG13 ILE 538 -9.987 3.017 3.755
342 HG21 ILE 538 HG21 ILE 538 -9.845 5.695 6.360
343 HG22 ILE 538 HG22 ILE 538 -8.361 4.765 6.540
344 HG23 ILE 538 HG23 ILE 538 -9.663 4.581 7.713
345 HD11 ILE 538 HD11 ILE 538 -8.629 5.649 4.374
346 HD12 ILE 538 HD12 ILE 538 -10.348 5.540 4.011
347 HD13 ILE 538 HD13 ILE 538 -9.158 5.060 2.802
348 H THR 539 H THR 539 -8.847 2.037 8.845
349 HA THR 539 HA THR 539 -11.379 1.332 10.094
350 HB THR 539 HB THR 539 -10.036 1.015 12.114
351 HG1 THR 539 HG1 THR 539 -7.822 1.844 10.567
352 HG21 THR 539 HG21 THR 539 -8.418 -0.673 11.184
353 HG22 THR 539 HG22 THR 539 -8.808 -0.078 9.570
354 HG23 THR 539 HG23 THR 539 -10.059 -0.834 10.556
355 H ASN 540 H ASN 540 -10.966 2.482 12.626
356 HA ASN 540 HA ASN 540 -12.409 4.787 12.596
357 HB2 ASN 540 HB2 ASN 540 -11.661 3.517 14.636
358 HB3 ASN 540 HB3 ASN 540 -10.104 4.334 14.500
359 HD21 ASN 540 HD21 ASN 540 -10.352 5.604 16.444
360 HD22 ASN 540 HD22 ASN 540 -11.512 6.836 16.573
361 H THR 541 H THR 541 -8.871 4.909 13.096
362 HA THR 541 HA THR 541 -8.688 7.154 11.207
363 HB THR 541 HB THR 541 -7.332 8.441 12.889
364 HG1 THR 541 HG1 THR 541 -6.970 6.622 14.267
365 HG21 THR 541 HG21 THR 541 -9.272 9.347 14.037
366 HG22 THR 541 HG22 THR 541 -10.184 7.867 13.733
367 HG23 THR 541 HG23 THR 541 -9.737 8.919 12.391
368 H THR 542 H THR 542 -7.668 5.335 10.063
369 HA THR 542 HA THR 542 -4.854 5.528 10.122
370 HB THR 542 HB THR 542 -5.458 2.673 10.702
371 HG1 THR 542 HG1 THR 542 -5.805 2.963 12.848
372 HG21 THR 542 HG21 THR 542 -3.409 2.888 12.049
373 HG22 THR 542 HG22 THR 542 -3.420 4.634 11.805
374 HG23 THR 542 HG23 THR 542 -3.166 3.553 10.435
375 H PHE 543 H PHE 543 -3.870 4.002 8.463
376 HA PHE 543 HA PHE 543 -5.901 3.252 6.414
377 HB2 PHE 543 HB2 PHE 543 -4.587 5.192 5.697
378 HB3 PHE 543 HB3 PHE 543 -3.091 4.318 6.014
379 HD1 PHE 543 HD1 PHE 543 -6.160 4.367 3.942
380 HD2 PHE 543 HD2 PHE 543 -2.236 2.709 4.454
381 HE1 PHE 543 HE1 PHE 543 -6.290 3.366 1.676
382 HE2 PHE 543 HE2 PHE 543 -2.358 1.703 2.192
383 HZ PHE 543 HZ PHE 543 -4.393 2.040 0.802
384 H ASP 544 H ASP 544 -6.074 1.074 6.699
385 HA ASP 544 HA ASP 544 -3.589 -0.511 6.955
386 HB2 ASP 544 HB2 ASP 544 -6.463 -1.170 7.612
387 HB3 ASP 544 HB3 ASP 544 -5.129 -2.315 7.718
388 H PHE 545 H PHE 545 -3.056 -2.036 5.495
389 HA PHE 545 HA PHE 545 -4.947 -2.929 3.475
390 HB2 PHE 545 HB2 PHE 545 -3.654 -2.194 1.568
391 HB3 PHE 545 HB3 PHE 545 -4.049 -0.788 2.555
392 HD1 PHE 545 HD1 PHE 545 -2.306 0.053 4.228
393 HD2 PHE 545 HD2 PHE 545 -1.400 -2.761 1.112
394 HE1 PHE 545 HE1 PHE 545 0.106 0.579 4.451
395 HE2 PHE 545 HE2 PHE 545 1.012 -2.231 1.335
396 HZ PHE 545 HZ PHE 545 1.765 -0.561 3.006
397 H ASP 546 H ASP 546 -4.450 -4.984 2.764
398 HA ASP 546 HA ASP 546 -2.091 -6.245 3.972
399 HB2 ASP 546 HB2 ASP 546 -4.547 -7.313 2.571
400 HB3 ASP 546 HB3 ASP 546 -3.186 -8.339 3.020
401 H LEU 547 H LEU 547 -0.470 -7.212 2.823
402 HA LEU 547 HA LEU 547 0.052 -6.175 0.187
403 HB2 LEU 547 HB2 LEU 547 1.533 -8.058 2.011
404 HB3 LEU 547 HB3 LEU 547 2.107 -7.687 0.393
405 HG LEU 547 HG LEU 547 3.132 -6.254 2.184
406 HD11 LEU 547 HD11 LEU 547 1.482 -4.375 0.514
407 HD12 LEU 547 HD12 LEU 547 2.504 -5.533 -0.329
408 HD13 LEU 547 HD13 LEU 547 3.219 -4.397 0.804
409 HD21 LEU 547 HD21 LEU 547 0.907 -6.184 3.484
410 HD22 LEU 547 HD22 LEU 547 0.439 -4.899 2.374
411 HD23 LEU 547 HD23 LEU 547 1.845 -4.698 3.415
412 H CYS 548 H CYS 548 -1.374 -9.023 1.479
413 HA CYS 548 HA CYS 548 -0.905 -10.668 -0.866
414 HB2 CYS 548 HB2 CYS 548 -1.182 -11.486 1.567
415 HB3 CYS 548 HB3 CYS 548 -2.909 -11.228 1.316
416 HG CYS 548 HG CYS 548 -2.558 -12.869 -0.866
417 H SER 549 H SER 549 -2.983 -8.169 -0.065
418 HA SER 549 HA SER 549 -5.205 -9.132 -1.736
419 HB2 SER 549 HB2 SER 549 -6.475 -7.360 -0.841
420 HB3 SER 549 HB3 SER 549 -5.506 -7.927 0.516
421 HG SER 549 HG SER 549 -3.964 -6.218 -0.509
422 H LEU 550 H LEU 550 -2.352 -8.095 -2.513
423 HA LEU 550 HA LEU 550 -3.002 -5.834 -4.242
424 HB2 LEU 550 HB2 LEU 550 -0.424 -7.403 -3.980
425 HB3 LEU 550 HB3 LEU 550 -0.631 -5.867 -4.819
426 HG LEU 550 HG LEU 550 -1.064 -6.328 -1.855
427 HD11 LEU 550 HD11 LEU 550 1.214 -5.185 -3.481
428 HD12 LEU 550 HD12 LEU 550 1.277 -6.346 -2.152
429 HD13 LEU 550 HD13 LEU 550 0.943 -4.647 -1.823
430 HD21 LEU 550 HD21 LEU 550 -1.525 -3.984 -3.686
431 HD22 LEU 550 HD22 LEU 550 -1.011 -3.682 -2.027
432 HD23 LEU 550 HD23 LEU 550 -2.504 -4.561 -2.340
433 H ASP 551 H ASP 551 -2.460 -5.895 -6.538
434 HA ASP 551 HA ASP 551 -3.160 -8.497 -7.769
435 HB2 ASP 551 HB2 ASP 551 -3.199 -5.831 -9.173
436 HB3 ASP 551 HB3 ASP 551 -4.076 -7.304 -9.577
437 H LYS 552 H LYS 552 -1.844 -9.423 -9.269
438 HA LYS 552 HA LYS 552 0.846 -9.240 -9.170
439 HB2 LYS 552 HB2 LYS 552 -0.615 -9.710 -11.774
440 HB3 LYS 552 HB3 LYS 552 0.962 -10.343 -11.299
441 HG2 LYS 552 HG2 LYS 552 -0.194 -11.512 -9.372
442 HG3 LYS 552 HG3 LYS 552 -1.731 -11.042 -10.102
443 HD2 LYS 552 HD2 LYS 552 -0.955 -12.171 -12.231
444 HD3 LYS 552 HD3 LYS 552 0.411 -12.807 -11.313
445 HE2 LYS 552 HE2 LYS 552 -2.493 -13.232 -10.557
446 HE3 LYS 552 HE3 LYS 552 -1.517 -14.405 -11.441
447 HZ1 LYS 552 HZ1 LYS 552 -0.381 -13.350 -8.977
448 HZ2 LYS 552 HZ2 LYS 552 -0.315 -14.921 -9.622
449 HZ3 LYS 552 HZ3 LYS 552 -1.708 -14.392 -8.806
450 H THR 553 H THR 553 -1.090 -7.498 -11.623
451 HA THR 553 HA THR 553 1.111 -6.037 -12.650
452 HB THR 553 HB THR 553 -1.737 -5.131 -12.742
453 HG1 THR 553 HG1 THR 553 -0.441 -7.242 -14.058
454 HG21 THR 553 HG21 THR 553 -1.105 -4.107 -14.804
455 HG22 THR 553 HG22 THR 553 0.421 -4.989 -14.843
456 HG23 THR 553 HG23 THR 553 0.171 -3.715 -13.651
457 H THR 554 H THR 554 -0.947 -5.600 -9.901
458 HA THR 554 HA THR 554 -0.268 -2.801 -9.540
459 HB THR 554 HB THR 554 -1.695 -4.762 -7.727
460 HG1 THR 554 HG1 THR 554 -2.526 -3.830 -9.891
461 HG21 THR 554 HG21 THR 554 -1.068 -1.822 -7.493
462 HG22 THR 554 HG22 THR 554 -0.881 -3.092 -6.285
463 HG23 THR 554 HG23 THR 554 -2.489 -2.512 -6.711
464 H VAL 555 H VAL 555 0.871 -5.926 -8.442
465 HA VAL 555 HA VAL 555 2.366 -5.028 -6.204
466 HB VAL 555 HB VAL 555 2.662 -7.449 -7.997
467 HG11 VAL 555 HG11 VAL 555 4.036 -8.311 -6.010
468 HG12 VAL 555 HG12 VAL 555 4.154 -6.629 -5.494
469 HG13 VAL 555 HG13 VAL 555 4.828 -7.124 -7.046
470 HG21 VAL 555 HG21 VAL 555 1.713 -7.274 -5.128
471 HG22 VAL 555 HG22 VAL 555 1.514 -8.612 -6.259
472 HG23 VAL 555 HG23 VAL 555 0.607 -7.118 -6.493
473 H ARG 556 H ARG 556 3.091 -5.355 -9.638
474 HA ARG 556 HA ARG 556 5.871 -4.706 -9.391
475 HB2 ARG 556 HB2 ARG 556 4.078 -4.525 -11.826
476 HB3 ARG 556 HB3 ARG 556 5.841 -4.576 -11.824
477 HG2 ARG 556 HG2 ARG 556 3.987 -6.772 -10.852
478 HG3 ARG 556 HG3 ARG 556 4.934 -6.797 -12.337
479 HD2 ARG 556 HD2 ARG 556 5.864 -7.049 -9.492
480 HD3 ARG 556 HD3 ARG 556 6.315 -8.007 -10.898
481 HE ARG 556 HE ARG 556 7.528 -5.525 -10.041
482 HH11 ARG 556 HH11 ARG 556 6.879 -7.682 -12.665
483 HH12 ARG 556 HH12 ARG 556 8.234 -7.161 -13.611
484 HH21 ARG 556 HH21 ARG 556 9.306 -4.835 -11.272
485 HH22 ARG 556 HH22 ARG 556 9.607 -5.548 -12.823
486 H LYS 557 H LYS 557 2.948 -2.873 -9.571
487 HA LYS 557 HA LYS 557 4.251 -0.408 -10.395
488 HB2 LYS 557 HB2 LYS 557 1.451 -1.074 -9.472
489 HB3 LYS 557 HB3 LYS 557 1.973 0.569 -9.842
490 HG2 LYS 557 HG2 LYS 557 2.489 -0.027 -12.121
491 HG3 LYS 557 HG3 LYS 557 2.235 -1.740 -11.785
492 HD2 LYS 557 HD2 LYS 557 -0.112 -1.441 -11.495
493 HD3 LYS 557 HD3 LYS 557 0.049 0.313 -11.406
494 HE2 LYS 557 HE2 LYS 557 0.722 -1.334 -13.861
495 HE3 LYS 557 HE3 LYS 557 -0.805 -0.486 -13.624
496 HZ1 LYS 557 HZ1 LYS 557 1.539 1.134 -13.173
497 HZ2 LYS 557 HZ2 LYS 557 0.127 1.482 -14.052
498 HZ3 LYS 557 HZ3 LYS 557 1.378 0.584 -14.770
499 H LEU 558 H LEU 558 3.442 -2.067 -7.455
500 HA LEU 558 HA LEU 558 3.698 0.263 -5.758
501 HB2 LEU 558 HB2 LEU 558 3.487 -2.693 -5.184
502 HB3 LEU 558 HB3 LEU 558 3.647 -1.476 -3.921
503 HG LEU 558 HG LEU 558 1.481 -1.268 -6.022
504 HD11 LEU 558 HD11 LEU 558 1.464 -2.852 -3.445
505 HD12 LEU 558 HD12 LEU 558 1.090 -3.429 -5.068
506 HD13 LEU 558 HD13 LEU 558 -0.011 -2.321 -4.249
507 HD21 LEU 558 HD21 LEU 558 0.342 -0.111 -4.033
508 HD22 LEU 558 HD22 LEU 558 1.703 0.744 -4.746
509 HD23 LEU 558 HD23 LEU 558 1.915 -0.146 -3.239
510 H GLN 559 H GLN 559 5.501 -2.804 -5.846
511 HA GLN 559 HA GLN 559 7.668 -2.142 -4.334
512 HB2 GLN 559 HB2 GLN 559 7.703 -3.741 -6.905
513 HB3 GLN 559 HB3 GLN 559 8.950 -3.778 -5.657
514 HG2 GLN 559 HG2 GLN 559 7.458 -4.723 -4.053
515 HG3 GLN 559 HG3 GLN 559 6.046 -4.392 -5.057
516 HE21 GLN 559 HE21 GLN 559 8.733 -5.487 -6.900
517 HE22 GLN 559 HE22 GLN 559 8.247 -7.105 -7.062
518 H SER 560 H SER 560 6.931 -1.007 -7.550
519 HA SER 560 HA SER 560 9.520 -0.023 -8.217
520 HB2 SER 560 HB2 SER 560 6.777 0.800 -9.191
521 HB3 SER 560 HB3 SER 560 8.296 1.336 -9.905
522 HG SER 560 HG SER 560 7.578 -1.387 -9.553
523 H TYR 561 H TYR 561 6.607 1.653 -6.949
524 HA TYR 561 HA TYR 561 7.557 4.217 -6.785
525 HB2 TYR 561 HB2 TYR 561 5.704 2.628 -5.035
526 HB3 TYR 561 HB3 TYR 561 6.180 4.237 -4.504
527 HD1 TYR 561 HD1 TYR 561 6.155 6.038 -6.577
528 HD2 TYR 561 HD2 TYR 561 3.699 2.531 -6.225
529 HE1 TYR 561 HE1 TYR 561 4.485 7.049 -8.096
530 HE2 TYR 561 HE2 TYR 561 2.029 3.547 -7.734
531 HH TYR 561 HH TYR 561 1.687 6.546 -8.347
532 H LEU 562 H LEU 562 8.836 1.493 -5.175
533 HA LEU 562 HA LEU 562 10.090 3.066 -3.041
534 HB2 LEU 562 HB2 LEU 562 10.614 0.158 -3.641
535 HB3 LEU 562 HB3 LEU 562 10.767 1.015 -2.107
536 HG LEU 562 HG LEU 562 8.212 0.299 -3.566
537 HD11 LEU 562 HD11 LEU 562 7.742 -0.819 -1.364
538 HD12 LEU 562 HD12 LEU 562 9.387 -0.422 -0.868
539 HD13 LEU 562 HD13 LEU 562 9.115 -1.506 -2.232
540 HD21 LEU 562 HD21 LEU 562 8.709 2.162 -1.231
541 HD22 LEU 562 HD22 LEU 562 7.139 1.412 -1.516
542 HD23 LEU 562 HD23 LEU 562 7.827 2.500 -2.721
543 H GLU 563 H GLU 563 11.090 1.041 -5.795
544 HA GLU 563 HA GLU 563 13.058 0.928 -6.969
545 HB2 GLU 563 HB2 GLU 563 12.134 3.327 -7.386
546 HB3 GLU 563 HB3 GLU 563 13.455 3.849 -6.341
547 HG2 GLU 563 HG2 GLU 563 15.042 2.587 -7.830
548 HG3 GLU 563 HG3 GLU 563 13.690 2.265 -8.916
549 H THR 564 H THR 564 13.193 0.352 -4.137
550 HA THR 564 HA THR 564 14.694 0.183 -2.383
551 HB THR 564 HB THR 564 16.897 -0.611 -3.105
552 HG1 THR 564 HG1 THR 564 16.566 -0.527 -5.735
553 HG21 THR 564 HG21 THR 564 15.169 -2.250 -3.247
554 HG22 THR 564 HG22 THR 564 16.063 -2.364 -4.763
555 HG23 THR 564 HG23 THR 564 14.510 -1.530 -4.716
556 H SER 565 H SER 565 14.227 2.567 -1.981
557 HA SER 565 HA SER 565 16.147 4.525 -2.762
558 HB2 SER 565 HB2 SER 565 13.953 5.258 -2.106
559 HB3 SER 565 HB3 SER 565 14.097 4.465 -0.541
560 HG SER 565 HG SER 565 16.173 6.142 -1.031
561 H GLY 566 H GLY 566 17.987 2.964 -2.190
562 HA2 GLY 566 HA2 GLY 566 18.666 2.616 0.575
563 HA3 GLY 566 HA3 GLY 566 19.721 2.319 -0.803
564 H THR 567 H THR 567 20.953 3.387 1.274
565 HA THR 567 HA THR 567 20.880 6.204 1.530
566 HB THR 567 HB THR 567 21.935 4.935 3.260
567 HG1 THR 567 HG1 THR 567 22.925 6.946 2.689
568 HG21 THR 567 HG21 THR 567 24.030 3.629 2.760
569 HG22 THR 567 HG22 THR 567 23.706 3.878 1.045
570 HG23 THR 567 HG23 THR 567 22.572 2.956 2.032
571 H SER 568 H SER 568 22.020 7.820 0.533
572 HA SER 568 HA SER 568 24.192 7.419 -1.242
573 HB2 SER 568 HB2 SER 568 22.997 8.025 -3.358
574 HB3 SER 568 HB3 SER 568 22.576 6.431 -2.738
575 HG SER 568 HG SER 568 20.951 8.407 -3.282
576 H1 THR 876 H1 THR 876 0.827 -17.853 7.577
577 H2 THR 876 H2 THR 876 1.664 -17.418 8.990
578 H3 THR 876 H3 THR 876 2.280 -16.985 7.467
579 HA THR 876 HA THR 876 -0.287 -16.005 8.588
580 HB THR 876 HB THR 876 1.324 -14.937 9.913
581 HG1 THR 876 HG1 THR 876 0.291 -13.262 9.029
582 HG21 THR 876 HG21 THR 876 3.085 -14.996 7.452
583 HG22 THR 876 HG22 THR 876 3.320 -15.883 8.958
584 HG23 THR 876 HG23 THR 876 3.508 -14.131 8.929
585 H ASN 877 H ASN 877 -1.201 -16.564 6.509
586 HA ASN 877 HA ASN 877 -0.124 -15.483 4.081
587 HB2 ASN 877 HB2 ASN 877 -1.626 -17.516 4.270
588 HB3 ASN 877 HB3 ASN 877 -2.961 -16.401 4.558
589 HD21 ASN 877 HD21 ASN 877 -3.967 -15.544 2.719
590 HD22 ASN 877 HD22 ASN 877 -3.331 -15.633 1.148
591 H LYS 878 H LYS 878 -0.379 -13.496 6.086
592 HA LYS 878 HA LYS 878 -1.870 -11.517 4.604
593 HB2 LYS 878 HB2 LYS 878 -3.187 -10.798 6.615
594 HB3 LYS 878 HB3 LYS 878 -3.704 -12.328 5.910
595 HG2 LYS 878 HG2 LYS 878 -2.731 -13.605 7.635
596 HG3 LYS 878 HG3 LYS 878 -1.686 -12.282 8.155
597 HD2 LYS 878 HD2 LYS 878 -3.508 -12.532 9.751
598 HD3 LYS 878 HD3 LYS 878 -3.705 -11.016 8.873
599 HE2 LYS 878 HE2 LYS 878 -5.056 -13.550 7.940
600 HE3 LYS 878 HE3 LYS 878 -5.800 -12.504 9.151
601 HZ1 LYS 878 HZ1 LYS 878 -5.461 -12.087 6.317
602 HZ2 LYS 878 HZ2 LYS 878 -5.038 -10.744 7.267
603 HZ3 LYS 878 HZ3 LYS 878 -6.595 -11.416 7.386
604 H LEU 879 H LEU 879 -1.185 -9.442 5.044
605 HA LEU 879 HA LEU 879 0.840 -9.034 7.157
606 HB2 LEU 879 HB2 LEU 879 1.090 -8.394 4.220
607 HB3 LEU 879 HB3 LEU 879 2.153 -7.720 5.444
608 HG LEU 879 HG LEU 879 1.816 -10.710 5.337
609 HD11 LEU 879 HD11 LEU 879 3.894 -10.616 3.734
610 HD12 LEU 879 HD12 LEU 879 3.258 -9.027 3.297
611 HD13 LEU 879 HD13 LEU 879 2.271 -10.469 3.061
612 HD21 LEU 879 HD21 LEU 879 4.339 -9.101 5.747
613 HD22 LEU 879 HD22 LEU 879 3.965 -10.727 6.320
614 HD23 LEU 879 HD23 LEU 879 3.183 -9.330 7.060
615 HA PRO 880 HA PRO 880 -2.119 -5.534 6.815
616 HB2 PRO 880 HB2 PRO 880 -2.633 -5.158 9.459
617 HB3 PRO 880 HB3 PRO 880 -3.428 -6.434 8.516
618 HG2 PRO 880 HG2 PRO 880 -1.149 -6.637 10.430
619 HG3 PRO 880 HG3 PRO 880 -2.500 -7.753 10.166
620 HD2 PRO 880 HD2 PRO 880 0.066 -8.092 9.110
621 HD3 PRO 880 HD3 PRO 880 -1.400 -8.865 8.464
622 H VAL 881 H VAL 881 -1.382 -3.463 6.630
623 HA VAL 881 HA VAL 881 0.843 -2.554 8.379
624 HB VAL 881 HB VAL 881 0.437 -2.009 5.421
625 HG11 VAL 881 HG11 VAL 881 1.249 0.012 6.419
626 HG12 VAL 881 HG12 VAL 881 2.660 -0.791 5.732
627 HG13 VAL 881 HG13 VAL 881 2.358 -0.871 7.468
628 HG21 VAL 881 HG21 VAL 881 2.487 -3.224 5.111
629 HG22 VAL 881 HG22 VAL 881 1.465 -4.230 6.137
630 HG23 VAL 881 HG23 VAL 881 2.781 -3.294 6.846
631 H SER 882 H SER 882 -0.166 -1.179 9.735
632 HA SER 882 HA SER 882 -2.247 0.639 8.692
633 HB2 SER 882 HB2 SER 882 -2.985 0.875 10.901
634 HB3 SER 882 HB3 SER 882 -2.489 -0.814 10.823
635 HG SER 882 HG SER 882 -0.401 -0.021 11.610
636 H ILE 883 H ILE 883 -1.780 2.692 8.242
637 HA ILE 883 HA ILE 883 0.567 3.964 9.518
638 HB ILE 883 HB ILE 883 -0.020 5.291 7.043
639 HG12 ILE 883 HG12 ILE 883 0.389 2.339 6.545
640 HG13 ILE 883 HG13 ILE 883 -1.194 3.100 6.496
641 HG21 ILE 883 HG21 ILE 883 2.236 3.511 7.994
642 HG22 ILE 883 HG22 ILE 883 2.232 5.261 7.786
643 HG23 ILE 883 HG23 ILE 883 2.245 4.211 6.377
644 HD11 ILE 883 HD11 ILE 883 0.098 2.909 4.265
645 HD12 ILE 883 HD12 ILE 883 1.097 4.218 4.894
646 HD13 ILE 883 HD13 ILE 883 -0.635 4.464 4.656
647 HA PRO 884 HA PRO 884 -2.492 6.876 10.924
648 HB2 PRO 884 HB2 PRO 884 -0.936 9.092 11.386
649 HB3 PRO 884 HB3 PRO 884 -0.935 7.665 12.444
650 HG2 PRO 884 HG2 PRO 884 0.995 8.419 10.290
651 HG3 PRO 884 HG3 PRO 884 1.312 7.758 11.905
652 HD2 PRO 884 HD2 PRO 884 1.350 6.202 9.676
653 HD3 PRO 884 HD3 PRO 884 0.836 5.572 11.253
654 H LEU 885 H LEU 885 -3.930 8.130 9.911
655 HA LEU 885 HA LEU 885 -3.688 8.856 7.209
656 HB2 LEU 885 HB2 LEU 885 -5.598 9.928 9.290
657 HB3 LEU 885 HB3 LEU 885 -5.801 10.068 7.547
658 HG LEU 885 HG LEU 885 -5.466 7.373 8.869
659 HD11 LEU 885 HD11 LEU 885 -7.383 8.584 9.924
660 HD12 LEU 885 HD12 LEU 885 -7.887 7.168 9.003
661 HD13 LEU 885 HD13 LEU 885 -8.093 8.781 8.323
662 HD21 LEU 885 HD21 LEU 885 -5.237 7.313 6.471
663 HD22 LEU 885 HD22 LEU 885 -6.646 8.352 6.253
664 HD23 LEU 885 HD23 LEU 885 -6.849 6.706 6.844
665 H ALA 886 H ALA 886 -2.422 10.379 9.961
666 HA ALA 886 HA ALA 886 -2.580 13.094 9.046
667 HB1 ALA 886 HB1 ALA 886 -1.244 13.615 10.918
668 HB2 ALA 886 HB2 ALA 886 -0.523 12.004 10.961
669 HB3 ALA 886 HB3 ALA 886 -2.203 12.231 11.446
670 H SER 887 H SER 887 -0.529 10.369 8.438
671 HA SER 887 HA SER 887 1.667 11.951 7.369
672 HB2 SER 887 HB2 SER 887 2.116 9.839 8.549
673 HB3 SER 887 HB3 SER 887 1.187 8.963 7.336
674 HG SER 887 HG SER 887 2.680 9.714 5.778
675 H VAL 888 H VAL 888 -1.302 10.787 6.199
676 HA VAL 888 HA VAL 888 -0.456 11.326 3.426
677 HB VAL 888 HB VAL 888 -1.978 9.374 2.749
678 HG11 VAL 888 HG11 VAL 888 -0.123 7.686 3.322
679 HG12 VAL 888 HG12 VAL 888 0.686 9.021 4.136
680 HG13 VAL 888 HG13 VAL 888 0.356 9.112 2.406
681 HG21 VAL 888 HG21 VAL 888 -1.459 8.625 5.647
682 HG22 VAL 888 HG22 VAL 888 -2.246 7.607 4.440
683 HG23 VAL 888 HG23 VAL 888 -3.024 9.095 4.981
684 H VAL 889 H VAL 889 -2.655 11.053 2.082
685 HA VAL 889 HA VAL 889 -4.869 12.410 3.479
686 HB VAL 889 HB VAL 889 -3.848 13.368 0.803
687 HG11 VAL 889 HG11 VAL 889 -5.263 15.265 1.239
688 HG12 VAL 889 HG12 VAL 889 -5.542 14.747 2.902
689 HG13 VAL 889 HG13 VAL 889 -6.225 13.823 1.564
690 HG21 VAL 889 HG21 VAL 889 -2.054 13.728 2.417
691 HG22 VAL 889 HG22 VAL 889 -3.196 14.392 3.584
692 HG23 VAL 889 HG23 VAL 889 -2.849 15.269 2.095
693 H LEU 890 H LEU 890 -6.598 11.211 3.139
694 HA LEU 890 HA LEU 890 -6.758 9.359 0.932
695 HB2 LEU 890 HB2 LEU 890 -8.517 10.024 3.272
696 HB3 LEU 890 HB3 LEU 890 -9.082 8.960 1.989
697 HG LEU 890 HG LEU 890 -8.000 7.823 4.001
698 HD11 LEU 890 HD11 LEU 890 -6.478 7.193 1.470
699 HD12 LEU 890 HD12 LEU 890 -8.205 6.870 1.592
700 HD13 LEU 890 HD13 LEU 890 -7.082 6.093 2.696
701 HD21 LEU 890 HD21 LEU 890 -6.138 9.533 4.167
702 HD22 LEU 890 HD22 LEU 890 -5.419 8.782 2.741
703 HD23 LEU 890 HD23 LEU 890 -5.612 7.850 4.222
704 HA PRO 891 HA PRO 891 -8.993 12.058 -1.785
705 HB2 PRO 891 HB2 PRO 891 -10.370 10.284 -3.319
706 HB3 PRO 891 HB3 PRO 891 -8.605 10.454 -3.416
707 HG2 PRO 891 HG2 PRO 891 -10.222 8.429 -1.928
708 HG3 PRO 891 HG3 PRO 891 -8.786 8.192 -2.942
709 HD2 PRO 891 HD2 PRO 891 -8.641 8.291 -0.218
710 HD3 PRO 891 HD3 PRO 891 -7.322 8.867 -1.261
711 H SER 892 H SER 892 -10.572 13.317 -0.941
712 HA SER 892 HA SER 892 -12.789 12.309 0.543
713 HB2 SER 892 HB2 SER 892 -11.829 14.587 0.854
714 HB3 SER 892 HB3 SER 892 -12.450 15.033 -0.732
715 HG SER 892 HG SER 892 -14.548 14.303 0.147
716 H ARG 893 H ARG 893 -14.680 11.556 -0.159
717 HA ARG 893 HA ARG 893 -15.230 11.236 -2.931
718 HB2 ARG 893 HB2 ARG 893 -16.037 9.744 -1.048
719 HB3 ARG 893 HB3 ARG 893 -17.220 10.995 -0.671
720 HG2 ARG 893 HG2 ARG 893 -18.092 10.853 -2.986
721 HG3 ARG 893 HG3 ARG 893 -16.934 9.568 -3.330
722 HD2 ARG 893 HD2 ARG 893 -19.097 9.466 -1.207
723 HD3 ARG 893 HD3 ARG 893 -19.150 8.640 -2.762
724 HE ARG 893 HE ARG 893 -16.808 7.991 -1.201
725 HH11 ARG 893 HH11 ARG 893 -20.146 7.325 -1.818
726 HH12 ARG 893 HH12 ARG 893 -20.070 5.693 -1.239
727 HH21 ARG 893 HH21 ARG 893 -16.699 5.854 -0.442
728 HH22 ARG 893 HH22 ARG 893 -18.118 4.861 -0.460
729 H ALA 894 H ALA 894 -17.026 13.085 -0.454
730 HA ALA 894 HA ALA 894 -18.465 14.570 -2.463
731 HB1 ALA 894 HB1 ALA 894 -19.618 14.115 -0.414
732 HB2 ALA 894 HB2 ALA 894 -19.308 15.851 -0.454
733 HB3 ALA 894 HB3 ALA 894 -18.305 14.800 0.546
734 H GLU 895 H GLU 895 -18.388 16.874 -2.725
735 HA GLU 895 HA GLU 895 -16.150 18.362 -1.644
736 HB2 GLU 895 HB2 GLU 895 -15.213 17.037 -3.598
737 HB3 GLU 895 HB3 GLU 895 -16.281 17.979 -4.639
738 HG2 GLU 895 HG2 GLU 895 -14.210 19.146 -4.658
739 HG3 GLU 895 HG3 GLU 895 -15.244 20.058 -3.561
740 H ARG 896 H ARG 896 -18.927 18.128 -3.779
741 HA ARG 896 HA ARG 896 -19.958 20.645 -2.937
742 HB2 ARG 896 HB2 ARG 896 -18.113 21.333 -4.545
743 HB3 ARG 896 HB3 ARG 896 -19.068 20.577 -5.822
744 HG2 ARG 896 HG2 ARG 896 -20.958 22.045 -5.331
745 HG3 ARG 896 HG3 ARG 896 -20.083 22.756 -3.974
746 HD2 ARG 896 HD2 ARG 896 -19.233 22.878 -6.880
747 HD3 ARG 896 HD3 ARG 896 -19.941 24.204 -5.960
748 HE ARG 896 HE ARG 896 -17.607 23.178 -4.666
749 HH11 ARG 896 HH11 ARG 896 -18.738 25.125 -7.293
750 HH12 ARG 896 HH12 ARG 896 -17.315 26.114 -7.354
751 HH21 ARG 896 HH21 ARG 896 -15.739 24.470 -4.739
752 HH22 ARG 896 HH22 ARG 896 -15.619 25.743 -5.908
753 H ALA 897 H ALA 897 -20.018 18.882 -6.042
754 HA ALA 897 HA ALA 897 -22.566 17.680 -5.502
755 HB1 ALA 897 HB1 ALA 897 -23.764 18.899 -7.351
756 HB2 ALA 897 HB2 ALA 897 -22.433 20.057 -7.366
757 HB3 ALA 897 HB3 ALA 897 -23.434 19.882 -5.925
758 H ARG 898 H ARG 898 -23.488 17.202 -8.014
759 HA ARG 898 HA ARG 898 -21.454 16.522 -9.896
760 HB2 ARG 898 HB2 ARG 898 -21.787 14.009 -9.653
761 HB3 ARG 898 HB3 ARG 898 -20.811 14.781 -8.404
762 HG2 ARG 898 HG2 ARG 898 -22.616 14.760 -6.841
763 HG3 ARG 898 HG3 ARG 898 -23.786 14.342 -8.093
764 HD2 ARG 898 HD2 ARG 898 -22.774 12.152 -8.378
765 HD3 ARG 898 HD3 ARG 898 -21.478 12.565 -7.259
766 HE ARG 898 HE ARG 898 -24.180 11.780 -6.564
767 HH11 ARG 898 HH11 ARG 898 -21.286 13.420 -5.613
768 HH12 ARG 898 HH12 ARG 898 -21.584 13.254 -3.916
769 HH21 ARG 898 HH21 ARG 898 -24.579 11.559 -4.339
770 HH22 ARG 898 HH22 ARG 898 -23.449 12.200 -3.194
771 H SER 899 H SER 899 -22.318 15.871 -11.849
772 HA SER 899 HA SER 899 -25.041 14.962 -12.090
773 HB2 SER 899 HB2 SER 899 -25.227 17.476 -11.716
774 HB3 SER 899 HB3 SER 899 -24.425 17.671 -13.272
775 HG SER 899 HG SER 899 -26.194 16.021 -13.889
776 H THR 900 H THR 900 -22.942 16.950 -14.177
777 HA THR 900 HA THR 900 -23.308 15.208 -16.419
778 HB THR 900 HB THR 900 -21.663 16.662 -17.528
779 HG1 THR 900 HG1 THR 900 -21.135 18.524 -15.920
780 HG21 THR 900 HG21 THR 900 -23.563 18.266 -15.797
781 HG22 THR 900 HG22 THR 900 -24.049 17.377 -17.240
782 HG23 THR 900 HG23 THR 900 -22.924 18.728 -17.374
Start of MODEL 9
1 H1 ASP 500 H1 ASP 500 2.556 -21.789 -5.304
2 H2 ASP 500 H2 ASP 500 2.354 -20.153 -4.892
3 H3 ASP 500 H3 ASP 500 2.526 -21.324 -3.673
4 HA ASP 500 HA ASP 500 4.782 -21.815 -4.768
5 HB2 ASP 500 HB2 ASP 500 4.178 -19.003 -5.731
6 HB3 ASP 500 HB3 ASP 500 5.744 -19.803 -5.842
7 H LYS 501 H LYS 501 6.620 -20.030 -4.042
8 HA LYS 501 HA LYS 501 5.810 -19.049 -1.359
9 HB2 LYS 501 HB2 LYS 501 7.214 -21.180 -1.386
10 HB3 LYS 501 HB3 LYS 501 8.525 -20.188 -2.025
11 HG2 LYS 501 HG2 LYS 501 8.306 -18.680 -0.056
12 HG3 LYS 501 HG3 LYS 501 7.064 -19.749 0.596
13 HD2 LYS 501 HD2 LYS 501 8.612 -21.559 0.828
14 HD3 LYS 501 HD3 LYS 501 9.838 -20.718 -0.124
15 HE2 LYS 501 HE2 LYS 501 10.002 -18.981 1.622
16 HE3 LYS 501 HE3 LYS 501 8.780 -19.823 2.574
17 HZ1 LYS 501 HZ1 LYS 501 10.451 -20.958 3.461
18 HZ2 LYS 501 HZ2 LYS 501 11.569 -20.363 2.327
19 HZ3 LYS 501 HZ3 LYS 501 10.638 -21.738 1.966
20 H ALA 502 H ALA 502 7.437 -18.469 -4.327
21 HA ALA 502 HA ALA 502 9.177 -16.384 -3.569
22 HB1 ALA 502 HB1 ALA 502 7.781 -17.014 -6.173
23 HB2 ALA 502 HB2 ALA 502 9.458 -17.342 -5.735
24 HB3 ALA 502 HB3 ALA 502 8.923 -15.682 -6.000
25 H TYR 503 H TYR 503 5.865 -16.263 -4.879
26 HA TYR 503 HA TYR 503 5.432 -13.562 -4.982
27 HB2 TYR 503 HB2 TYR 503 3.795 -15.436 -5.532
28 HB3 TYR 503 HB3 TYR 503 3.392 -15.460 -3.815
29 HD1 TYR 503 HD1 TYR 503 3.855 -12.976 -6.595
30 HD2 TYR 503 HD2 TYR 503 1.615 -14.106 -3.106
31 HE1 TYR 503 HE1 TYR 503 2.356 -11.038 -6.930
32 HE2 TYR 503 HE2 TYR 503 0.109 -12.165 -3.448
33 HH TYR 503 HH TYR 503 -0.365 -10.642 -6.048
34 H LEU 504 H LEU 504 4.603 -15.535 -2.101
35 HA LEU 504 HA LEU 504 3.965 -13.547 -0.340
36 HB2 LEU 504 HB2 LEU 504 5.446 -16.140 0.081
37 HB3 LEU 504 HB3 LEU 504 5.080 -15.071 1.436
38 HG LEU 504 HG LEU 504 2.671 -15.133 0.790
39 HD11 LEU 504 HD11 LEU 504 2.701 -15.620 -1.529
40 HD12 LEU 504 HD12 LEU 504 2.080 -17.093 -0.785
41 HD13 LEU 504 HD13 LEU 504 3.764 -17.011 -1.310
42 HD21 LEU 504 HD21 LEU 504 3.307 -16.646 2.520
43 HD22 LEU 504 HD22 LEU 504 4.128 -17.718 1.383
44 HD23 LEU 504 HD23 LEU 504 2.367 -17.614 1.385
45 H ASP 505 H ASP 505 7.256 -14.760 -0.955
46 HA ASP 505 HA ASP 505 8.708 -13.180 0.767
47 HB2 ASP 505 HB2 ASP 505 9.548 -14.960 -0.882
48 HB3 ASP 505 HB3 ASP 505 9.611 -13.660 -2.070
49 H GLU 506 H GLU 506 7.494 -12.309 -2.456
50 HA GLU 506 HA GLU 506 8.677 -9.755 -2.606
51 HB2 GLU 506 HB2 GLU 506 6.045 -10.634 -3.812
52 HB3 GLU 506 HB3 GLU 506 7.047 -9.287 -4.341
53 HG2 GLU 506 HG2 GLU 506 7.966 -12.171 -4.300
54 HG3 GLU 506 HG3 GLU 506 7.353 -11.349 -5.732
55 H LEU 507 H LEU 507 5.857 -10.933 -0.936
56 HA LEU 507 HA LEU 507 4.786 -8.289 -0.400
57 HB2 LEU 507 HB2 LEU 507 4.032 -10.831 1.041
58 HB3 LEU 507 HB3 LEU 507 3.048 -9.400 0.741
59 HG LEU 507 HG LEU 507 3.997 -11.410 -1.314
60 HD11 LEU 507 HD11 LEU 507 1.511 -11.652 -1.645
61 HD12 LEU 507 HD12 LEU 507 1.282 -10.624 -0.230
62 HD13 LEU 507 HD13 LEU 507 2.078 -12.188 -0.063
63 HD21 LEU 507 HD21 LEU 507 2.641 -8.719 -1.594
64 HD22 LEU 507 HD22 LEU 507 2.527 -9.957 -2.846
65 HD23 LEU 507 HD23 LEU 507 4.099 -9.291 -2.406
66 H VAL 508 H VAL 508 6.464 -10.846 1.446
67 HA VAL 508 HA VAL 508 6.498 -9.587 3.933
68 HB VAL 508 HB VAL 508 8.677 -11.308 2.727
69 HG11 VAL 508 HG11 VAL 508 9.094 -11.825 5.165
70 HG12 VAL 508 HG12 VAL 508 7.979 -10.520 5.571
71 HG13 VAL 508 HG13 VAL 508 9.478 -10.164 4.708
72 HG21 VAL 508 HG21 VAL 508 6.147 -11.950 4.270
73 HG22 VAL 508 HG22 VAL 508 7.464 -13.102 4.054
74 HG23 VAL 508 HG23 VAL 508 6.581 -12.500 2.651
75 H GLU 509 H GLU 509 9.081 -9.550 1.474
76 HA GLU 509 HA GLU 509 10.849 -7.791 2.603
77 HB2 GLU 509 HB2 GLU 509 9.995 -8.005 -0.292
78 HB3 GLU 509 HB3 GLU 509 11.381 -7.056 0.249
79 HG2 GLU 509 HG2 GLU 509 12.516 -8.989 1.057
80 HG3 GLU 509 HG3 GLU 509 11.063 -9.979 0.946
81 H LEU 510 H LEU 510 8.131 -6.856 0.472
82 HA LEU 510 HA LEU 510 8.430 -4.080 0.835
83 HB2 LEU 510 HB2 LEU 510 6.317 -5.904 -0.195
84 HB3 LEU 510 HB3 LEU 510 5.738 -4.337 0.366
85 HG LEU 510 HG LEU 510 7.441 -3.233 -1.097
86 HD11 LEU 510 HD11 LEU 510 8.990 -5.221 -1.164
87 HD12 LEU 510 HD12 LEU 510 8.650 -4.528 -2.746
88 HD13 LEU 510 HD13 LEU 510 7.840 -6.011 -2.241
89 HD21 LEU 510 HD21 LEU 510 6.178 -3.479 -3.098
90 HD22 LEU 510 HD22 LEU 510 5.037 -3.812 -1.797
91 HD23 LEU 510 HD23 LEU 510 5.744 -5.144 -2.712
92 H HIS 511 H HIS 511 6.173 -6.347 2.439
93 HA HIS 511 HA HIS 511 4.925 -4.691 4.200
94 HB2 HIS 511 HB2 HIS 511 4.443 -7.081 4.042
95 HB3 HIS 511 HB3 HIS 511 6.002 -7.459 4.777
96 HD1 HIS 511 HD1 HIS 511 2.833 -5.518 5.607
97 HD2 HIS 511 HD2 HIS 511 5.924 -7.537 7.543
98 HE1 HIS 511 HE1 HIS 511 2.268 -5.505 8.075
99 HE2 HIS 511 HE2 HIS 511 4.137 -6.736 9.269
100 H ARG 512 H ARG 512 7.852 -6.535 5.094
101 HA ARG 512 HA ARG 512 8.379 -5.313 7.508
102 HB2 ARG 512 HB2 ARG 512 10.158 -6.567 5.428
103 HB3 ARG 512 HB3 ARG 512 10.856 -5.866 6.889
104 HG2 ARG 512 HG2 ARG 512 8.639 -7.938 6.900
105 HG3 ARG 512 HG3 ARG 512 10.348 -8.336 7.052
106 HD2 ARG 512 HD2 ARG 512 9.883 -8.162 9.301
107 HD3 ARG 512 HD3 ARG 512 10.144 -6.448 9.008
108 HE ARG 512 HE ARG 512 7.426 -7.166 8.505
109 HH11 ARG 512 HH11 ARG 512 9.761 -6.602 10.996
110 HH12 ARG 512 HH12 ARG 512 8.591 -6.102 12.172
111 HH21 ARG 512 HH21 ARG 512 5.885 -6.510 10.041
112 HH22 ARG 512 HH22 ARG 512 6.398 -6.049 11.631
113 H ARG 513 H ARG 513 9.612 -4.349 4.310
114 HA ARG 513 HA ARG 513 11.081 -2.116 5.174
115 HB2 ARG 513 HB2 ARG 513 9.771 -2.759 2.532
116 HB3 ARG 513 HB3 ARG 513 10.783 -1.336 2.781
117 HG2 ARG 513 HG2 ARG 513 12.686 -2.700 3.361
118 HG3 ARG 513 HG3 ARG 513 11.695 -4.160 3.389
119 HD2 ARG 513 HD2 ARG 513 12.996 -3.973 1.286
120 HD3 ARG 513 HD3 ARG 513 11.260 -3.946 0.991
121 HE ARG 513 HE ARG 513 11.952 -1.298 1.219
122 HH11 ARG 513 HH11 ARG 513 13.001 -4.003 -0.667
123 HH12 ARG 513 HH12 ARG 513 13.456 -3.046 -2.037
124 HH21 ARG 513 HH21 ARG 513 12.547 -0.037 -0.574
125 HH22 ARG 513 HH22 ARG 513 13.200 -0.802 -1.984
126 H LEU 514 H LEU 514 7.695 -2.436 4.203
127 HA LEU 514 HA LEU 514 7.065 0.316 4.197
128 HB2 LEU 514 HB2 LEU 514 5.413 -2.182 4.539
129 HB3 LEU 514 HB3 LEU 514 4.681 -0.580 4.588
130 HG LEU 514 HG LEU 514 6.499 -1.297 2.286
131 HD11 LEU 514 HD11 LEU 514 3.568 -2.047 2.525
132 HD12 LEU 514 HD12 LEU 514 4.924 -3.168 2.404
133 HD13 LEU 514 HD13 LEU 514 4.518 -2.128 1.040
134 HD21 LEU 514 HD21 LEU 514 5.725 1.019 2.448
135 HD22 LEU 514 HD22 LEU 514 4.054 0.481 2.613
136 HD23 LEU 514 HD23 LEU 514 4.912 0.238 1.094
137 H MET 515 H MET 515 6.808 -2.167 6.708
138 HA MET 515 HA MET 515 5.537 -0.711 8.686
139 HB2 MET 515 HB2 MET 515 6.032 -3.123 8.844
140 HB3 MET 515 HB3 MET 515 7.741 -2.749 9.061
141 HG2 MET 515 HG2 MET 515 5.696 -1.510 10.896
142 HG3 MET 515 HG3 MET 515 6.249 -3.160 11.177
143 HE1 MET 515 HE1 MET 515 8.368 -3.632 12.676
144 HE2 MET 515 HE2 MET 515 9.864 -3.031 11.963
145 HE3 MET 515 HE3 MET 515 8.660 -3.814 10.941
146 H THR 516 H THR 516 8.952 -0.737 7.817
147 HA THR 516 HA THR 516 9.618 1.140 9.964
148 HB THR 516 HB THR 516 11.912 0.867 9.202
149 HG1 THR 516 HG1 THR 516 10.964 -0.879 7.207
150 HG21 THR 516 HG21 THR 516 12.185 -1.454 9.709
151 HG22 THR 516 HG22 THR 516 10.577 -1.843 9.098
152 HG23 THR 516 HG23 THR 516 10.753 -0.925 10.593
153 H LEU 517 H LEU 517 8.832 1.131 6.590
154 HA LEU 517 HA LEU 517 10.117 3.430 5.698
155 HB2 LEU 517 HB2 LEU 517 8.823 1.861 4.266
156 HB3 LEU 517 HB3 LEU 517 7.335 2.517 4.941
157 HG LEU 517 HG LEU 517 7.986 4.773 4.104
158 HD11 LEU 517 HD11 LEU 517 9.841 4.573 2.212
159 HD12 LEU 517 HD12 LEU 517 10.408 3.227 3.203
160 HD13 LEU 517 HD13 LEU 517 10.308 4.850 3.888
161 HD21 LEU 517 HD21 LEU 517 6.503 3.495 2.728
162 HD22 LEU 517 HD22 LEU 517 7.813 2.467 2.151
163 HD23 LEU 517 HD23 LEU 517 7.725 4.153 1.641
164 H ARG 518 H ARG 518 9.701 5.607 5.796
165 HA ARG 518 HA ARG 518 7.344 6.516 7.335
166 HB2 ARG 518 HB2 ARG 518 10.241 7.219 7.835
167 HB3 ARG 518 HB3 ARG 518 8.913 8.223 8.411
168 HG2 ARG 518 HG2 ARG 518 8.861 5.272 9.018
169 HG3 ARG 518 HG3 ARG 518 9.925 6.313 9.960
170 HD2 ARG 518 HD2 ARG 518 8.022 7.736 10.581
171 HD3 ARG 518 HD3 ARG 518 6.942 6.745 9.605
172 HE ARG 518 HE ARG 518 8.306 5.119 11.494
173 HH11 ARG 518 HH11 ARG 518 5.848 7.538 11.194
174 HH12 ARG 518 HH12 ARG 518 4.955 7.000 12.576
175 HH21 ARG 518 HH21 ARG 518 7.139 4.407 13.308
176 HH22 ARG 518 HH22 ARG 518 5.685 5.227 13.773
177 H GLU 519 H GLU 519 8.931 6.604 4.508
178 HA GLU 519 HA GLU 519 8.872 9.448 3.971
179 HB2 GLU 519 HB2 GLU 519 10.468 7.803 2.894
180 HB3 GLU 519 HB3 GLU 519 9.095 7.197 1.969
181 HG2 GLU 519 HG2 GLU 519 10.160 8.841 0.591
182 HG3 GLU 519 HG3 GLU 519 8.694 9.593 1.217
183 H ARG 520 H ARG 520 6.891 10.357 3.982
184 HA ARG 520 HA ARG 520 4.474 9.098 3.304
185 HB2 ARG 520 HB2 ARG 520 3.506 11.313 3.298
186 HB3 ARG 520 HB3 ARG 520 4.686 11.216 4.607
187 HG2 ARG 520 HG2 ARG 520 6.383 12.181 2.949
188 HG3 ARG 520 HG3 ARG 520 5.002 12.553 1.913
189 HD2 ARG 520 HD2 ARG 520 3.980 13.784 3.859
190 HD3 ARG 520 HD3 ARG 520 5.492 13.551 4.730
191 HE ARG 520 HE ARG 520 5.003 15.493 2.697
192 HH11 ARG 520 HH11 ARG 520 7.366 13.309 3.967
193 HH12 ARG 520 HH12 ARG 520 8.723 14.243 3.427
194 HH21 ARG 520 HH21 ARG 520 6.775 16.724 1.986
195 HH22 ARG 520 HH22 ARG 520 8.388 16.176 2.306
196 H HIS 521 H HIS 521 6.771 10.932 1.341
197 HA HIS 521 HA HIS 521 5.396 11.445 -0.955
198 HB2 HIS 521 HB2 HIS 521 7.860 11.848 -0.513
199 HB3 HIS 521 HB3 HIS 521 8.135 10.172 -0.985
200 HD1 HIS 521 HD1 HIS 521 7.407 9.522 -3.476
201 HD2 HIS 521 HD2 HIS 521 7.478 13.607 -2.653
202 HE1 HIS 521 HE1 HIS 521 7.361 10.704 -5.716
203 HE2 HIS 521 HE2 HIS 521 7.403 13.197 -5.231
204 H ILE 522 H ILE 522 6.480 8.318 0.197
205 HA ILE 522 HA ILE 522 5.635 6.944 -2.238
206 HB ILE 522 HB ILE 522 6.529 5.714 0.370
207 HG12 ILE 522 HG12 ILE 522 8.276 7.259 -0.223
208 HG13 ILE 522 HG13 ILE 522 8.810 5.666 -0.754
209 HG21 ILE 522 HG21 ILE 522 7.037 3.808 -0.956
210 HG22 ILE 522 HG22 ILE 522 6.882 4.720 -2.457
211 HG23 ILE 522 HG23 ILE 522 5.449 4.344 -1.501
212 HD11 ILE 522 HD11 ILE 522 7.744 6.285 -3.031
213 HD12 ILE 522 HD12 ILE 522 9.265 7.069 -2.604
214 HD13 ILE 522 HD13 ILE 522 7.742 7.942 -2.424
215 H LEU 523 H LEU 523 4.803 6.828 1.213
216 HA LEU 523 HA LEU 523 2.654 5.093 1.115
217 HB2 LEU 523 HB2 LEU 523 2.736 7.596 2.813
218 HB3 LEU 523 HB3 LEU 523 1.854 6.110 3.153
219 HG LEU 523 HG LEU 523 4.870 6.303 2.928
220 HD11 LEU 523 HD11 LEU 523 3.862 7.505 4.904
221 HD12 LEU 523 HD12 LEU 523 4.923 6.164 5.339
222 HD13 LEU 523 HD13 LEU 523 3.172 5.964 5.413
223 HD21 LEU 523 HD21 LEU 523 4.599 4.023 4.149
224 HD22 LEU 523 HD22 LEU 523 4.264 4.071 2.421
225 HD23 LEU 523 HD23 LEU 523 2.932 4.076 3.576
226 H GLN 524 H GLN 524 2.875 8.323 -0.114
227 HA GLN 524 HA GLN 524 0.010 8.715 -0.264
228 HB2 GLN 524 HB2 GLN 524 2.396 10.214 -1.354
229 HB3 GLN 524 HB3 GLN 524 0.748 10.660 -1.791
230 HG2 GLN 524 HG2 GLN 524 1.551 10.332 1.100
231 HG3 GLN 524 HG3 GLN 524 1.832 11.848 0.248
232 HE21 GLN 524 HE21 GLN 524 -0.939 10.148 -0.900
233 HE22 GLN 524 HE22 GLN 524 -2.109 11.062 -0.078
234 H GLN 525 H GLN 525 2.613 7.842 -2.515
235 HA GLN 525 HA GLN 525 0.990 7.733 -4.842
236 HB2 GLN 525 HB2 GLN 525 3.565 6.261 -4.230
237 HB3 GLN 525 HB3 GLN 525 2.860 6.486 -5.830
238 HG2 GLN 525 HG2 GLN 525 3.500 8.841 -4.054
239 HG3 GLN 525 HG3 GLN 525 4.723 8.128 -5.103
240 HE21 GLN 525 HE21 GLN 525 1.757 10.031 -5.052
241 HE22 GLN 525 HE22 GLN 525 1.755 10.407 -6.708
242 H ILE 526 H ILE 526 2.200 5.165 -2.687
243 HA ILE 526 HA ILE 526 0.933 3.011 -3.952
244 HB ILE 526 HB ILE 526 1.712 3.413 -1.058
245 HG12 ILE 526 HG12 ILE 526 3.052 1.807 -3.248
246 HG13 ILE 526 HG13 ILE 526 3.470 3.484 -2.905
247 HG21 ILE 526 HG21 ILE 526 0.142 1.642 -0.993
248 HG22 ILE 526 HG22 ILE 526 1.697 0.824 -1.138
249 HG23 ILE 526 HG23 ILE 526 0.660 1.007 -2.553
250 HD11 ILE 526 HD11 ILE 526 3.937 2.830 -0.537
251 HD12 ILE 526 HD12 ILE 526 5.003 2.042 -1.700
252 HD13 ILE 526 HD13 ILE 526 3.659 1.148 -0.988
253 H VAL 527 H VAL 527 -0.132 4.735 -1.001
254 HA VAL 527 HA VAL 527 -2.532 3.557 -0.534
255 HB VAL 527 HB VAL 527 -1.798 6.486 -0.389
256 HG11 VAL 527 HG11 VAL 527 -3.815 6.610 1.185
257 HG12 VAL 527 HG12 VAL 527 -4.344 5.088 0.467
258 HG13 VAL 527 HG13 VAL 527 -4.183 6.528 -0.540
259 HG21 VAL 527 HG21 VAL 527 -2.326 4.611 1.916
260 HG22 VAL 527 HG22 VAL 527 -1.327 6.065 1.868
261 HG23 VAL 527 HG23 VAL 527 -0.764 4.580 1.097
262 H ASN 528 H ASN 528 -2.183 6.416 -2.659
263 HA ASN 528 HA ASN 528 -4.782 6.380 -3.684
264 HB2 ASN 528 HB2 ASN 528 -2.331 7.304 -5.184
265 HB3 ASN 528 HB3 ASN 528 -3.984 7.897 -5.345
266 HD21 ASN 528 HD21 ASN 528 -3.878 7.483 -2.140
267 HD22 ASN 528 HD22 ASN 528 -3.234 8.974 -1.642
268 H LEU 529 H LEU 529 -2.029 4.395 -4.445
269 HA LEU 529 HA LEU 529 -2.915 3.586 -7.049
270 HB2 LEU 529 HB2 LEU 529 -0.533 3.431 -5.908
271 HB3 LEU 529 HB3 LEU 529 -1.126 1.880 -5.331
272 HG LEU 529 HG LEU 529 0.035 1.483 -7.400
273 HD11 LEU 529 HD11 LEU 529 -2.899 1.495 -8.122
274 HD12 LEU 529 HD12 LEU 529 -2.203 0.347 -6.975
275 HD13 LEU 529 HD13 LEU 529 -1.654 0.368 -8.651
276 HD21 LEU 529 HD21 LEU 529 -1.795 3.227 -9.024
277 HD22 LEU 529 HD22 LEU 529 -0.127 2.756 -9.326
278 HD23 LEU 529 HD23 LEU 529 -0.481 4.010 -8.144
279 H ILE 530 H ILE 530 -2.708 1.729 -4.003
280 HA ILE 530 HA ILE 530 -4.419 -0.300 -4.986
281 HB ILE 530 HB ILE 530 -4.460 -1.132 -2.656
282 HG12 ILE 530 HG12 ILE 530 -2.710 1.261 -1.989
283 HG13 ILE 530 HG13 ILE 530 -4.415 1.188 -1.576
284 HG21 ILE 530 HG21 ILE 530 -2.611 -1.762 -4.055
285 HG22 ILE 530 HG22 ILE 530 -1.931 -1.331 -2.486
286 HG23 ILE 530 HG23 ILE 530 -1.834 -0.193 -3.834
287 HD11 ILE 530 HD11 ILE 530 -4.140 -0.495 -0.025
288 HD12 ILE 530 HD12 ILE 530 -2.630 0.394 0.170
289 HD13 ILE 530 HD13 ILE 530 -2.656 -1.095 -0.770
290 H GLU 531 H GLU 531 -4.999 2.362 -2.735
291 HA GLU 531 HA GLU 531 -7.618 1.969 -2.094
292 HB2 GLU 531 HB2 GLU 531 -6.217 3.896 -1.330
293 HB3 GLU 531 HB3 GLU 531 -6.491 4.664 -2.893
294 HG2 GLU 531 HG2 GLU 531 -8.759 5.045 -2.467
295 HG3 GLU 531 HG3 GLU 531 -8.869 3.740 -1.290
296 H GLU 532 H GLU 532 -6.330 3.325 -5.077
297 HA GLU 532 HA GLU 532 -8.795 3.936 -6.328
298 HB2 GLU 532 HB2 GLU 532 -6.968 4.996 -7.310
299 HB3 GLU 532 HB3 GLU 532 -5.954 3.564 -7.214
300 HG2 GLU 532 HG2 GLU 532 -6.854 2.614 -9.139
301 HG3 GLU 532 HG3 GLU 532 -8.368 3.511 -9.003
302 H THR 533 H THR 533 -6.742 1.066 -6.331
303 HA THR 533 HA THR 533 -8.272 -0.403 -8.243
304 HB THR 533 HB THR 533 -7.014 -2.365 -7.462
305 HG1 THR 533 HG1 THR 533 -5.754 -2.239 -5.681
306 HG21 THR 533 HG21 THR 533 -5.789 -1.113 -9.027
307 HG22 THR 533 HG22 THR 533 -4.667 -1.272 -7.677
308 HG23 THR 533 HG23 THR 533 -5.555 0.233 -7.911
309 H GLY 534 H GLY 534 -8.117 -0.554 -4.691
310 HA2 GLY 534 HA2 GLY 534 -10.224 -0.689 -3.436
311 HA3 GLY 534 HA3 GLY 534 -10.822 -1.789 -4.675
312 H HIS 535 H HIS 535 -9.229 -1.528 -1.700
313 HA HIS 535 HA HIS 535 -9.363 -4.122 -0.896
314 HB2 HIS 535 HB2 HIS 535 -7.090 -3.724 -2.773
315 HB3 HIS 535 HB3 HIS 535 -6.662 -4.558 -1.288
316 HD1 HIS 535 HD1 HIS 535 -7.380 -5.517 -4.489
317 HD2 HIS 535 HD2 HIS 535 -9.192 -6.535 -0.876
318 HE1 HIS 535 HE1 HIS 535 -8.590 -7.707 -4.886
319 HE2 HIS 535 HE2 HIS 535 -9.699 -8.341 -2.692
320 H PHE 536 H PHE 536 -9.638 -1.777 0.364
321 HA PHE 536 HA PHE 536 -7.446 -1.814 2.350
322 HB2 PHE 536 HB2 PHE 536 -7.571 0.661 2.482
323 HB3 PHE 536 HB3 PHE 536 -6.998 0.099 0.910
324 HD1 PHE 536 HD1 PHE 536 -8.538 0.070 -1.050
325 HD2 PHE 536 HD2 PHE 536 -9.673 1.805 2.707
326 HE1 PHE 536 HE1 PHE 536 -10.406 1.264 -2.163
327 HE2 PHE 536 HE2 PHE 536 -11.540 2.999 1.597
328 HZ PHE 536 HZ PHE 536 -11.908 2.727 -0.840
329 H HIS 537 H HIS 537 -8.041 -1.209 4.429
330 HA HIS 537 HA HIS 537 -10.945 -0.925 4.970
331 HB2 HIS 537 HB2 HIS 537 -9.065 -2.465 6.762
332 HB3 HIS 537 HB3 HIS 537 -10.829 -2.480 6.744
333 HD1 HIS 537 HD1 HIS 537 -8.001 -4.370 5.562
334 HD2 HIS 537 HD2 HIS 537 -11.826 -3.597 4.101
335 HE1 HIS 537 HE1 HIS 537 -8.470 -6.141 3.813
336 HE2 HIS 537 HE2 HIS 537 -10.799 -5.682 2.912
337 H ILE 538 H ILE 538 -10.802 1.282 5.315
338 HA ILE 538 HA ILE 538 -8.867 2.324 7.259
339 HB ILE 538 HB ILE 538 -10.941 3.648 5.491
340 HG12 ILE 538 HG12 ILE 538 -7.943 4.051 5.514
341 HG13 ILE 538 HG13 ILE 538 -8.680 2.746 4.588
342 HG21 ILE 538 HG21 ILE 538 -9.791 5.781 6.321
343 HG22 ILE 538 HG22 ILE 538 -9.130 4.796 7.627
344 HG23 ILE 538 HG23 ILE 538 -10.877 4.991 7.466
345 HD11 ILE 538 HD11 ILE 538 -8.398 4.714 3.154
346 HD12 ILE 538 HD12 ILE 538 -9.296 5.702 4.303
347 HD13 ILE 538 HD13 ILE 538 -10.115 4.414 3.422
348 H THR 539 H THR 539 -9.379 2.880 9.315
349 HA THR 539 HA THR 539 -12.187 3.089 10.139
350 HB THR 539 HB THR 539 -10.255 1.115 11.381
351 HG1 THR 539 HG1 THR 539 -12.572 0.881 9.782
352 HG21 THR 539 HG21 THR 539 -13.052 2.000 12.114
353 HG22 THR 539 HG22 THR 539 -11.602 2.081 13.114
354 HG23 THR 539 HG23 THR 539 -12.319 0.517 12.726
355 H ASN 540 H ASN 540 -12.463 4.117 12.177
356 HA ASN 540 HA ASN 540 -11.990 5.885 13.585
357 HB2 ASN 540 HB2 ASN 540 -11.084 4.051 14.895
358 HB3 ASN 540 HB3 ASN 540 -9.564 4.126 14.007
359 HD21 ASN 540 HD21 ASN 540 -7.964 5.390 14.970
360 HD22 ASN 540 HD22 ASN 540 -8.252 6.610 16.114
361 H THR 541 H THR 541 -8.574 5.376 13.151
362 HA THR 541 HA THR 541 -8.309 7.522 11.197
363 HB THR 541 HB THR 541 -6.929 7.807 13.848
364 HG1 THR 541 HG1 THR 541 -8.621 9.619 13.879
365 HG21 THR 541 HG21 THR 541 -7.536 9.886 11.748
366 HG22 THR 541 HG22 THR 541 -6.067 8.911 11.712
367 HG23 THR 541 HG23 THR 541 -6.377 9.988 13.074
368 H THR 542 H THR 542 -7.511 5.579 10.089
369 HA THR 542 HA THR 542 -4.684 5.499 10.056
370 HB THR 542 HB THR 542 -5.354 2.734 10.718
371 HG1 THR 542 HG1 THR 542 -6.902 3.445 12.067
372 HG21 THR 542 HG21 THR 542 -3.581 4.767 12.111
373 HG22 THR 542 HG22 THR 542 -3.080 3.719 10.785
374 HG23 THR 542 HG23 THR 542 -3.530 3.019 12.340
375 H PHE 543 H PHE 543 -3.873 3.919 8.441
376 HA PHE 543 HA PHE 543 -5.972 3.159 6.473
377 HB2 PHE 543 HB2 PHE 543 -4.727 5.072 5.638
378 HB3 PHE 543 HB3 PHE 543 -3.192 4.272 5.983
379 HD1 PHE 543 HD1 PHE 543 -6.255 4.149 3.890
380 HD2 PHE 543 HD2 PHE 543 -2.294 2.614 4.495
381 HE1 PHE 543 HE1 PHE 543 -6.340 3.060 1.664
382 HE2 PHE 543 HE2 PHE 543 -2.373 1.524 2.269
383 HZ PHE 543 HZ PHE 543 -4.400 1.749 0.854
384 H ASP 544 H ASP 544 -6.123 0.983 6.888
385 HA ASP 544 HA ASP 544 -3.633 -0.596 7.041
386 HB2 ASP 544 HB2 ASP 544 -6.472 -1.480 7.584
387 HB3 ASP 544 HB3 ASP 544 -4.991 -2.354 7.967
388 H PHE 545 H PHE 545 -3.118 -2.115 5.550
389 HA PHE 545 HA PHE 545 -5.038 -2.963 3.536
390 HB2 PHE 545 HB2 PHE 545 -3.755 -2.204 1.631
391 HB3 PHE 545 HB3 PHE 545 -4.130 -0.813 2.647
392 HD1 PHE 545 HD1 PHE 545 -2.365 -0.057 4.358
393 HD2 PHE 545 HD2 PHE 545 -1.510 -2.741 1.115
394 HE1 PHE 545 HE1 PHE 545 0.053 0.447 4.577
395 HE2 PHE 545 HE2 PHE 545 0.909 -2.236 1.335
396 HZ PHE 545 HZ PHE 545 1.690 -0.642 3.066
397 H ASP 546 H ASP 546 -4.579 -5.003 2.806
398 HA ASP 546 HA ASP 546 -2.217 -6.314 3.946
399 HB2 ASP 546 HB2 ASP 546 -4.669 -7.349 2.509
400 HB3 ASP 546 HB3 ASP 546 -3.329 -8.379 3.005
401 H LEU 547 H LEU 547 -0.487 -6.938 2.787
402 HA LEU 547 HA LEU 547 -0.102 -5.941 0.145
403 HB2 LEU 547 HB2 LEU 547 1.496 -7.825 1.874
404 HB3 LEU 547 HB3 LEU 547 2.013 -7.364 0.265
405 HG LEU 547 HG LEU 547 2.968 -6.023 2.253
406 HD11 LEU 547 HD11 LEU 547 3.103 -4.027 0.961
407 HD12 LEU 547 HD12 LEU 547 1.556 -4.331 0.178
408 HD13 LEU 547 HD13 LEU 547 2.955 -5.329 -0.216
409 HD21 LEU 547 HD21 LEU 547 0.730 -5.765 3.385
410 HD22 LEU 547 HD22 LEU 547 0.268 -4.652 2.095
411 HD23 LEU 547 HD23 LEU 547 1.608 -4.255 3.164
412 H CYS 548 H CYS 548 -1.422 -8.830 1.429
413 HA CYS 548 HA CYS 548 -0.941 -10.461 -0.916
414 HB2 CYS 548 HB2 CYS 548 -2.436 -10.824 1.670
415 HB3 CYS 548 HB3 CYS 548 -2.681 -11.956 0.338
416 HG CYS 548 HG CYS 548 -0.383 -12.103 2.168
417 H SER 549 H SER 549 -3.055 -7.989 -0.122
418 HA SER 549 HA SER 549 -5.302 -8.980 -1.716
419 HB2 SER 549 HB2 SER 549 -6.447 -6.982 -0.996
420 HB3 SER 549 HB3 SER 549 -5.653 -7.694 0.406
421 HG SER 549 HG SER 549 -3.891 -6.111 -0.708
422 H LEU 550 H LEU 550 -2.429 -7.973 -2.590
423 HA LEU 550 HA LEU 550 -3.137 -5.876 -4.492
424 HB2 LEU 550 HB2 LEU 550 -0.531 -7.390 -4.177
425 HB3 LEU 550 HB3 LEU 550 -0.779 -5.903 -5.087
426 HG LEU 550 HG LEU 550 -1.212 -6.182 -2.100
427 HD11 LEU 550 HD11 LEU 550 1.136 -6.354 -2.419
428 HD12 LEU 550 HD12 LEU 550 0.867 -4.645 -2.085
429 HD13 LEU 550 HD13 LEU 550 1.125 -5.188 -3.743
430 HD21 LEU 550 HD21 LEU 550 -1.058 -3.581 -2.387
431 HD22 LEU 550 HD22 LEU 550 -2.568 -4.393 -2.785
432 HD23 LEU 550 HD23 LEU 550 -1.464 -3.914 -4.071
433 H ASP 551 H ASP 551 -1.862 -6.383 -6.736
434 HA ASP 551 HA ASP 551 -2.749 -9.033 -7.723
435 HB2 ASP 551 HB2 ASP 551 -3.139 -6.384 -9.141
436 HB3 ASP 551 HB3 ASP 551 -3.551 -7.971 -9.784
437 H LYS 552 H LYS 552 -1.309 -10.044 -8.980
438 HA LYS 552 HA LYS 552 1.339 -9.541 -9.013
439 HB2 LYS 552 HB2 LYS 552 -0.405 -10.883 -11.066
440 HB3 LYS 552 HB3 LYS 552 1.334 -10.754 -11.328
441 HG2 LYS 552 HG2 LYS 552 0.840 -12.882 -10.244
442 HG3 LYS 552 HG3 LYS 552 1.714 -11.847 -9.117
443 HD2 LYS 552 HD2 LYS 552 -0.267 -11.320 -7.902
444 HD3 LYS 552 HD3 LYS 552 -1.305 -11.975 -9.170
445 HE2 LYS 552 HE2 LYS 552 0.685 -13.680 -7.660
446 HE3 LYS 552 HE3 LYS 552 -0.980 -13.463 -7.119
447 HZ1 LYS 552 HZ1 LYS 552 -0.955 -15.395 -8.437
448 HZ2 LYS 552 HZ2 LYS 552 -0.033 -14.658 -9.658
449 HZ3 LYS 552 HZ3 LYS 552 -1.648 -14.191 -9.412
450 H THR 553 H THR 553 -0.926 -8.343 -11.494
451 HA THR 553 HA THR 553 1.060 -6.944 -12.971
452 HB THR 553 HB THR 553 -1.852 -6.264 -12.902
453 HG1 THR 553 HG1 THR 553 -1.643 -8.496 -13.154
454 HG21 THR 553 HG21 THR 553 -0.138 -4.876 -14.194
455 HG22 THR 553 HG22 THR 553 -1.506 -5.490 -15.122
456 HG23 THR 553 HG23 THR 553 0.062 -6.290 -15.228
457 H THR 554 H THR 554 -0.897 -6.158 -10.198
458 HA THR 554 HA THR 554 -0.252 -3.318 -10.310
459 HB THR 554 HB THR 554 -1.634 -4.898 -8.130
460 HG1 THR 554 HG1 THR 554 -3.232 -3.324 -9.560
461 HG21 THR 554 HG21 THR 554 -1.459 -1.946 -8.761
462 HG22 THR 554 HG22 THR 554 -0.777 -2.760 -7.356
463 HG23 THR 554 HG23 THR 554 -2.527 -2.641 -7.545
464 H VAL 555 H VAL 555 0.974 -6.211 -8.857
465 HA VAL 555 HA VAL 555 2.377 -4.991 -6.693
466 HB VAL 555 HB VAL 555 2.663 -7.652 -8.103
467 HG11 VAL 555 HG11 VAL 555 4.230 -6.463 -5.811
468 HG12 VAL 555 HG12 VAL 555 4.840 -7.274 -7.254
469 HG13 VAL 555 HG13 VAL 555 4.044 -8.208 -5.990
470 HG21 VAL 555 HG21 VAL 555 1.765 -7.048 -5.278
471 HG22 VAL 555 HG22 VAL 555 1.519 -8.527 -6.206
472 HG23 VAL 555 HG23 VAL 555 0.635 -7.062 -6.632
473 H ARG 556 H ARG 556 3.054 -5.542 -10.070
474 HA ARG 556 HA ARG 556 5.876 -5.023 -9.898
475 HB2 ARG 556 HB2 ARG 556 3.890 -5.205 -12.165
476 HB3 ARG 556 HB3 ARG 556 5.558 -4.709 -12.452
477 HG2 ARG 556 HG2 ARG 556 5.050 -7.213 -10.855
478 HG3 ARG 556 HG3 ARG 556 4.866 -7.272 -12.605
479 HD2 ARG 556 HD2 ARG 556 7.146 -6.513 -12.933
480 HD3 ARG 556 HD3 ARG 556 7.351 -6.245 -11.205
481 HE ARG 556 HE ARG 556 7.612 -8.742 -12.572
482 HH11 ARG 556 HH11 ARG 556 6.538 -7.236 -9.648
483 HH12 ARG 556 HH12 ARG 556 6.806 -8.636 -8.664
484 HH21 ARG 556 HH21 ARG 556 7.966 -10.584 -11.287
485 HH22 ARG 556 HH22 ARG 556 7.614 -10.531 -9.592
486 H LYS 557 H LYS 557 2.990 -3.106 -10.314
487 HA LYS 557 HA LYS 557 4.434 -0.714 -11.104
488 HB2 LYS 557 HB2 LYS 557 1.556 -1.297 -10.395
489 HB3 LYS 557 HB3 LYS 557 2.131 0.342 -10.689
490 HG2 LYS 557 HG2 LYS 557 2.752 -1.803 -12.713
491 HG3 LYS 557 HG3 LYS 557 1.133 -1.106 -12.682
492 HD2 LYS 557 HD2 LYS 557 3.517 0.741 -12.679
493 HD3 LYS 557 HD3 LYS 557 3.017 -0.015 -14.190
494 HE2 LYS 557 HE2 LYS 557 1.026 1.422 -12.430
495 HE3 LYS 557 HE3 LYS 557 1.996 2.290 -13.619
496 HZ1 LYS 557 HZ1 LYS 557 0.122 1.727 -14.805
497 HZ2 LYS 557 HZ2 LYS 557 -0.045 0.214 -14.053
498 HZ3 LYS 557 HZ3 LYS 557 1.174 0.460 -15.209
499 H LEU 558 H LEU 558 3.405 -2.285 -8.205
500 HA LEU 558 HA LEU 558 3.587 0.069 -6.534
501 HB2 LEU 558 HB2 LEU 558 3.173 -2.864 -5.998
502 HB3 LEU 558 HB3 LEU 558 3.408 -1.712 -4.686
503 HG LEU 558 HG LEU 558 1.311 -1.326 -6.840
504 HD11 LEU 558 HD11 LEU 558 1.074 -2.720 -4.160
505 HD12 LEU 558 HD12 LEU 558 0.799 -3.428 -5.752
506 HD13 LEU 558 HD13 LEU 558 -0.303 -2.199 -5.129
507 HD21 LEU 558 HD21 LEU 558 1.959 -0.025 -4.195
508 HD22 LEU 558 HD22 LEU 558 0.295 -0.030 -4.768
509 HD23 LEU 558 HD23 LEU 558 1.551 0.730 -5.734
510 H GLN 559 H GLN 559 5.343 -3.034 -6.466
511 HA GLN 559 HA GLN 559 7.402 -2.388 -4.802
512 HB2 GLN 559 HB2 GLN 559 7.603 -3.995 -7.358
513 HB3 GLN 559 HB3 GLN 559 8.774 -4.027 -6.036
514 HG2 GLN 559 HG2 GLN 559 7.219 -5.005 -4.535
515 HG3 GLN 559 HG3 GLN 559 5.844 -4.622 -5.569
516 HE21 GLN 559 HE21 GLN 559 6.968 -5.522 -8.078
517 HE22 GLN 559 HE22 GLN 559 7.134 -7.209 -7.992
518 H SER 560 H SER 560 6.876 -1.214 -8.040
519 HA SER 560 HA SER 560 9.499 -0.315 -8.624
520 HB2 SER 560 HB2 SER 560 8.522 0.895 -10.396
521 HB3 SER 560 HB3 SER 560 7.464 -0.498 -10.189
522 HG SER 560 HG SER 560 6.323 1.504 -10.324
523 H TYR 561 H TYR 561 6.710 1.389 -7.147
524 HA TYR 561 HA TYR 561 7.812 3.903 -6.861
525 HB2 TYR 561 HB2 TYR 561 5.904 2.335 -5.139
526 HB3 TYR 561 HB3 TYR 561 6.458 3.916 -4.605
527 HD1 TYR 561 HD1 TYR 561 6.461 5.740 -6.670
528 HD2 TYR 561 HD2 TYR 561 3.869 2.338 -6.271
529 HE1 TYR 561 HE1 TYR 561 4.799 6.826 -8.145
530 HE2 TYR 561 HE2 TYR 561 2.206 3.428 -7.735
531 HH TYR 561 HH TYR 561 2.862 5.915 -9.727
532 H LEU 562 H LEU 562 8.971 1.017 -5.547
533 HA LEU 562 HA LEU 562 10.490 2.404 -3.412
534 HB2 LEU 562 HB2 LEU 562 10.269 -0.576 -3.858
535 HB3 LEU 562 HB3 LEU 562 10.822 0.265 -2.412
536 HG LEU 562 HG LEU 562 8.007 0.409 -3.537
537 HD11 LEU 562 HD11 LEU 562 8.524 -1.805 -2.601
538 HD12 LEU 562 HD12 LEU 562 7.410 -0.932 -1.547
539 HD13 LEU 562 HD13 LEU 562 9.118 -1.050 -1.121
540 HD21 LEU 562 HD21 LEU 562 9.383 1.630 -1.135
541 HD22 LEU 562 HD22 LEU 562 7.635 1.395 -1.168
542 HD23 LEU 562 HD23 LEU 562 8.406 2.434 -2.364
543 H GLU 563 H GLU 563 10.775 0.463 -6.333
544 HA GLU 563 HA GLU 563 12.546 0.014 -7.717
545 HB2 GLU 563 HB2 GLU 563 12.681 2.516 -7.676
546 HB3 GLU 563 HB3 GLU 563 13.855 2.383 -6.366
547 HG2 GLU 563 HG2 GLU 563 15.396 1.174 -7.768
548 HG3 GLU 563 HG3 GLU 563 14.195 1.018 -9.048
549 H THR 564 H THR 564 13.035 -1.968 -6.731
550 HA THR 564 HA THR 564 15.633 -2.013 -5.376
551 HB THR 564 HB THR 564 13.939 -1.955 -3.555
552 HG1 THR 564 HG1 THR 564 15.793 -3.088 -3.139
553 HG21 THR 564 HG21 THR 564 12.192 -3.144 -5.000
554 HG22 THR 564 HG22 THR 564 12.303 -3.668 -3.321
555 HG23 THR 564 HG23 THR 564 13.032 -4.642 -4.598
556 H SER 565 H SER 565 16.814 -3.823 -5.831
557 HA SER 565 HA SER 565 17.466 -5.701 -6.980
558 HB2 SER 565 HB2 SER 565 15.741 -6.696 -5.426
559 HB3 SER 565 HB3 SER 565 14.576 -6.556 -6.739
560 HG SER 565 HG SER 565 17.079 -7.861 -6.999
561 H GLY 566 H GLY 566 17.223 -3.691 -8.663
562 HA2 GLY 566 HA2 GLY 566 15.305 -4.010 -10.747
563 HA3 GLY 566 HA3 GLY 566 16.785 -3.059 -10.837
564 H THR 567 H THR 567 18.792 -4.188 -11.320
565 HA THR 567 HA THR 567 18.553 -5.966 -13.498
566 HB THR 567 HB THR 567 20.975 -6.122 -13.409
567 HG1 THR 567 HG1 THR 567 21.259 -4.599 -11.156
568 HG21 THR 567 HG21 THR 567 19.874 -3.976 -14.140
569 HG22 THR 567 HG22 THR 567 21.517 -3.773 -13.533
570 HG23 THR 567 HG23 THR 567 20.141 -3.353 -12.512
571 H SER 568 H SER 568 19.034 -8.170 -13.689
572 HA SER 568 HA SER 568 18.216 -9.789 -11.476
573 HB2 SER 568 HB2 SER 568 18.522 -11.658 -12.977
574 HB3 SER 568 HB3 SER 568 17.768 -10.342 -13.875
575 HG SER 568 HG SER 568 19.433 -11.001 -15.128
576 H1 THR 876 H1 THR 876 1.129 -14.605 2.456
577 H2 THR 876 H2 THR 876 1.438 -16.092 1.692
578 H3 THR 876 H3 THR 876 1.493 -15.977 3.386
579 HA THR 876 HA THR 876 -0.980 -15.352 1.904
580 HB THR 876 HB THR 876 -0.002 -18.064 2.846
581 HG1 THR 876 HG1 THR 876 0.534 -18.154 0.831
582 HG21 THR 876 HG21 THR 876 -2.289 -17.940 3.488
583 HG22 THR 876 HG22 THR 876 -2.285 -18.780 1.938
584 HG23 THR 876 HG23 THR 876 -2.733 -17.076 2.017
585 H ASN 877 H ASN 877 0.930 -15.559 4.696
586 HA ASN 877 HA ASN 877 -1.208 -15.938 6.592
587 HB2 ASN 877 HB2 ASN 877 1.109 -16.622 7.104
588 HB3 ASN 877 HB3 ASN 877 1.615 -14.936 7.016
589 HD21 ASN 877 HD21 ASN 877 -1.017 -16.795 8.666
590 HD22 ASN 877 HD22 ASN 877 -0.827 -16.004 10.155
591 H LYS 878 H LYS 878 -1.238 -13.706 4.584
592 HA LYS 878 HA LYS 878 -1.912 -11.519 4.455
593 HB2 LYS 878 HB2 LYS 878 -2.791 -12.124 7.290
594 HB3 LYS 878 HB3 LYS 878 -3.259 -10.686 6.380
595 HG2 LYS 878 HG2 LYS 878 -4.138 -12.249 4.580
596 HG3 LYS 878 HG3 LYS 878 -3.899 -13.570 5.723
597 HD2 LYS 878 HD2 LYS 878 -5.369 -12.411 7.349
598 HD3 LYS 878 HD3 LYS 878 -5.639 -11.126 6.171
599 HE2 LYS 878 HE2 LYS 878 -6.588 -12.777 4.594
600 HE3 LYS 878 HE3 LYS 878 -6.340 -14.051 5.787
601 HZ1 LYS 878 HZ1 LYS 878 -8.580 -13.309 5.948
602 HZ2 LYS 878 HZ2 LYS 878 -8.105 -11.681 6.040
603 HZ3 LYS 878 HZ3 LYS 878 -7.760 -12.743 7.319
604 H LEU 879 H LEU 879 -1.257 -9.413 4.907
605 HA LEU 879 HA LEU 879 0.827 -9.016 6.965
606 HB2 LEU 879 HB2 LEU 879 0.978 -8.274 4.044
607 HB3 LEU 879 HB3 LEU 879 2.086 -7.661 5.261
608 HG LEU 879 HG LEU 879 1.725 -10.642 5.010
609 HD11 LEU 879 HD11 LEU 879 3.730 -10.521 3.374
610 HD12 LEU 879 HD12 LEU 879 3.220 -8.854 3.090
611 HD13 LEU 879 HD13 LEU 879 2.122 -10.189 2.730
612 HD21 LEU 879 HD21 LEU 879 4.274 -9.081 5.458
613 HD22 LEU 879 HD22 LEU 879 3.884 -10.726 5.964
614 HD23 LEU 879 HD23 LEU 879 3.137 -9.354 6.781
615 HA PRO 880 HA PRO 880 -2.186 -5.553 6.781
616 HB2 PRO 880 HB2 PRO 880 -2.698 -5.300 9.439
617 HB3 PRO 880 HB3 PRO 880 -3.481 -6.544 8.444
618 HG2 PRO 880 HG2 PRO 880 -1.200 -6.806 10.347
619 HG3 PRO 880 HG3 PRO 880 -2.535 -7.927 10.025
620 HD2 PRO 880 HD2 PRO 880 0.043 -8.168 8.960
621 HD3 PRO 880 HD3 PRO 880 -1.406 -8.947 8.287
622 H VAL 881 H VAL 881 -1.405 -3.504 6.627
623 HA VAL 881 HA VAL 881 0.756 -2.633 8.468
624 HB VAL 881 HB VAL 881 0.482 -2.075 5.501
625 HG11 VAL 881 HG11 VAL 881 1.248 -0.052 6.533
626 HG12 VAL 881 HG12 VAL 881 2.687 -0.857 5.907
627 HG13 VAL 881 HG13 VAL 881 2.310 -0.938 7.629
628 HG21 VAL 881 HG21 VAL 881 1.454 -4.293 6.182
629 HG22 VAL 881 HG22 VAL 881 2.700 -3.420 7.076
630 HG23 VAL 881 HG23 VAL 881 2.597 -3.259 5.323
631 H SER 882 H SER 882 -0.284 -1.254 9.797
632 HA SER 882 HA SER 882 -2.322 0.574 8.707
633 HB2 SER 882 HB2 SER 882 -1.514 0.078 11.580
634 HB3 SER 882 HB3 SER 882 -2.911 0.994 11.021
635 HG SER 882 HG SER 882 -3.257 -1.185 9.820
636 H ILE 883 H ILE 883 -1.869 2.648 8.297
637 HA ILE 883 HA ILE 883 0.503 3.886 9.559
638 HB ILE 883 HB ILE 883 -0.069 5.212 7.077
639 HG12 ILE 883 HG12 ILE 883 0.265 2.243 6.612
640 HG13 ILE 883 HG13 ILE 883 -1.291 3.058 6.542
641 HG21 ILE 883 HG21 ILE 883 2.176 4.101 6.413
642 HG22 ILE 883 HG22 ILE 883 2.158 3.390 8.023
643 HG23 ILE 883 HG23 ILE 883 2.185 5.140 7.830
644 HD11 ILE 883 HD11 ILE 883 -0.699 4.341 4.670
645 HD12 ILE 883 HD12 ILE 883 0.040 2.778 4.328
646 HD13 ILE 883 HD13 ILE 883 1.029 4.101 4.939
647 HA PRO 884 HA PRO 884 -2.511 6.831 10.990
648 HB2 PRO 884 HB2 PRO 884 -0.929 9.065 11.335
649 HB3 PRO 884 HB3 PRO 884 -0.935 7.684 12.452
650 HG2 PRO 884 HG2 PRO 884 0.981 8.325 10.251
651 HG3 PRO 884 HG3 PRO 884 1.306 7.719 11.886
652 HD2 PRO 884 HD2 PRO 884 1.309 6.077 9.728
653 HD3 PRO 884 HD3 PRO 884 0.772 5.519 11.326
654 H LEU 885 H LEU 885 -3.991 8.011 9.921
655 HA LEU 885 HA LEU 885 -3.742 8.673 7.201
656 HB2 LEU 885 HB2 LEU 885 -5.673 9.898 9.179
657 HB3 LEU 885 HB3 LEU 885 -5.877 9.774 7.433
658 HG LEU 885 HG LEU 885 -5.738 7.465 9.389
659 HD11 LEU 885 HD11 LEU 885 -8.016 8.383 7.618
660 HD12 LEU 885 HD12 LEU 885 -7.858 8.839 9.313
661 HD13 LEU 885 HD13 LEU 885 -8.072 7.144 8.872
662 HD21 LEU 885 HD21 LEU 885 -6.481 6.219 7.204
663 HD22 LEU 885 HD22 LEU 885 -4.775 6.600 7.419
664 HD23 LEU 885 HD23 LEU 885 -5.776 7.606 6.372
665 H ALA 886 H ALA 886 -2.551 10.249 9.953
666 HA ALA 886 HA ALA 886 -2.654 12.950 8.999
667 HB1 ALA 886 HB1 ALA 886 -0.631 11.859 10.951
668 HB2 ALA 886 HB2 ALA 886 -2.310 12.127 11.415
669 HB3 ALA 886 HB3 ALA 886 -1.319 13.483 10.875
670 H SER 887 H SER 887 -0.623 10.200 8.443
671 HA SER 887 HA SER 887 1.593 11.754 7.369
672 HB2 SER 887 HB2 SER 887 1.076 8.782 7.534
673 HB3 SER 887 HB3 SER 887 2.534 9.492 6.846
674 HG SER 887 HG SER 887 3.064 10.307 8.814
675 H VAL 888 H VAL 888 -1.366 10.554 6.205
676 HA VAL 888 HA VAL 888 -0.515 11.061 3.430
677 HB VAL 888 HB VAL 888 -1.983 9.090 2.750
678 HG11 VAL 888 HG11 VAL 888 -0.142 7.417 3.358
679 HG12 VAL 888 HG12 VAL 888 0.629 8.734 4.236
680 HG13 VAL 888 HG13 VAL 888 0.377 8.863 2.497
681 HG21 VAL 888 HG21 VAL 888 -1.547 8.366 5.668
682 HG22 VAL 888 HG22 VAL 888 -2.295 7.337 4.445
683 HG23 VAL 888 HG23 VAL 888 -3.093 8.824 4.954
684 H VAL 889 H VAL 889 -2.767 10.658 2.113
685 HA VAL 889 HA VAL 889 -4.969 12.046 3.500
686 HB VAL 889 HB VAL 889 -3.938 12.926 0.795
687 HG11 VAL 889 HG11 VAL 889 -5.407 14.895 1.317
688 HG12 VAL 889 HG12 VAL 889 -5.967 14.040 2.754
689 HG13 VAL 889 HG13 VAL 889 -6.298 13.382 1.151
690 HG21 VAL 889 HG21 VAL 889 -3.414 13.991 3.580
691 HG22 VAL 889 HG22 VAL 889 -3.218 14.985 2.136
692 HG23 VAL 889 HG23 VAL 889 -2.230 13.541 2.354
693 H LEU 890 H LEU 890 -6.853 11.200 3.051
694 HA LEU 890 HA LEU 890 -7.059 9.026 1.146
695 HB2 LEU 890 HB2 LEU 890 -9.101 10.254 3.002
696 HB3 LEU 890 HB3 LEU 890 -9.306 8.748 2.108
697 HG LEU 890 HG LEU 890 -7.092 9.255 4.120
698 HD11 LEU 890 HD11 LEU 890 -9.081 9.225 5.402
699 HD12 LEU 890 HD12 LEU 890 -8.493 7.565 5.478
700 HD13 LEU 890 HD13 LEU 890 -9.818 7.982 4.391
701 HD21 LEU 890 HD21 LEU 890 -7.159 6.620 3.995
702 HD22 LEU 890 HD22 LEU 890 -6.319 7.522 2.740
703 HD23 LEU 890 HD23 LEU 890 -7.939 6.895 2.438
704 HA PRO 891 HA PRO 891 -8.881 11.643 -1.994
705 HB2 PRO 891 HB2 PRO 891 -10.052 9.814 -3.598
706 HB3 PRO 891 HB3 PRO 891 -8.284 9.916 -3.440
707 HG2 PRO 891 HG2 PRO 891 -10.187 8.055 -2.082
708 HG3 PRO 891 HG3 PRO 891 -8.644 7.692 -2.876
709 HD2 PRO 891 HD2 PRO 891 -8.867 7.980 -0.161
710 HD3 PRO 891 HD3 PRO 891 -7.385 8.400 -1.053
711 H SER 892 H SER 892 -11.112 11.901 -3.170
712 HA SER 892 HA SER 892 -13.126 12.182 -1.117
713 HB2 SER 892 HB2 SER 892 -13.396 12.702 -4.083
714 HB3 SER 892 HB3 SER 892 -14.407 13.343 -2.791
715 HG SER 892 HG SER 892 -12.805 14.659 -2.173
716 H ARG 893 H ARG 893 -15.145 11.186 -1.058
717 HA ARG 893 HA ARG 893 -16.055 9.290 -2.965
718 HB2 ARG 893 HB2 ARG 893 -14.165 7.977 -2.044
719 HB3 ARG 893 HB3 ARG 893 -14.875 8.118 -0.435
720 HG2 ARG 893 HG2 ARG 893 -16.855 6.910 -1.132
721 HG3 ARG 893 HG3 ARG 893 -16.313 6.908 -2.812
722 HD2 ARG 893 HD2 ARG 893 -14.854 5.572 -0.516
723 HD3 ARG 893 HD3 ARG 893 -15.870 4.737 -1.686
724 HE ARG 893 HE ARG 893 -13.171 5.592 -2.096
725 HH11 ARG 893 HH11 ARG 893 -16.256 5.194 -3.612
726 HH12 ARG 893 HH12 ARG 893 -15.601 4.971 -5.200
727 HH21 ARG 893 HH21 ARG 893 -12.305 5.300 -4.175
728 HH22 ARG 893 HH22 ARG 893 -13.363 5.030 -5.519
729 H ALA 894 H ALA 894 -18.156 8.663 -2.546
730 HA ALA 894 HA ALA 894 -19.335 8.979 0.074
731 HB1 ALA 894 HB1 ALA 894 -20.419 10.744 -2.120
732 HB2 ALA 894 HB2 ALA 894 -19.236 11.323 -0.947
733 HB3 ALA 894 HB3 ALA 894 -20.818 10.768 -0.402
734 H GLU 895 H GLU 895 -20.295 9.001 -3.370
735 HA GLU 895 HA GLU 895 -21.778 7.694 -4.540
736 HB2 GLU 895 HB2 GLU 895 -21.222 5.613 -2.417
737 HB3 GLU 895 HB3 GLU 895 -21.774 5.338 -4.070
738 HG2 GLU 895 HG2 GLU 895 -19.116 6.582 -3.307
739 HG3 GLU 895 HG3 GLU 895 -19.342 4.913 -3.832
740 H ARG 896 H ARG 896 -23.483 9.161 -3.854
741 HA ARG 896 HA ARG 896 -25.076 8.692 -1.554
742 HB2 ARG 896 HB2 ARG 896 -26.736 10.143 -2.703
743 HB3 ARG 896 HB3 ARG 896 -25.117 10.844 -2.687
744 HG2 ARG 896 HG2 ARG 896 -24.748 9.907 -4.982
745 HG3 ARG 896 HG3 ARG 896 -26.432 9.382 -4.993
746 HD2 ARG 896 HD2 ARG 896 -27.162 11.715 -4.668
747 HD3 ARG 896 HD3 ARG 896 -25.481 12.241 -4.657
748 HE ARG 896 HE ARG 896 -25.895 10.825 -7.037
749 HH11 ARG 896 HH11 ARG 896 -27.005 13.683 -5.431
750 HH12 ARG 896 HH12 ARG 896 -27.326 14.549 -6.897
751 HH21 ARG 896 HH21 ARG 896 -26.312 11.955 -8.963
752 HH22 ARG 896 HH22 ARG 896 -26.933 13.569 -8.895
753 H ALA 897 H ALA 897 -27.655 8.516 -2.271
754 HA ALA 897 HA ALA 897 -29.297 6.963 -2.682
755 HB1 ALA 897 HB1 ALA 897 -27.657 6.160 -5.082
756 HB2 ALA 897 HB2 ALA 897 -28.569 7.668 -5.030
757 HB3 ALA 897 HB3 ALA 897 -29.410 6.123 -4.896
758 H ARG 898 H ARG 898 -29.731 4.580 -3.019
759 HA ARG 898 HA ARG 898 -28.111 3.073 -1.222
760 HB2 ARG 898 HB2 ARG 898 -30.124 1.893 -3.133
761 HB3 ARG 898 HB3 ARG 898 -29.676 1.329 -1.523
762 HG2 ARG 898 HG2 ARG 898 -31.182 3.874 -2.191
763 HG3 ARG 898 HG3 ARG 898 -31.833 2.446 -1.388
764 HD2 ARG 898 HD2 ARG 898 -30.003 2.826 0.385
765 HD3 ARG 898 HD3 ARG 898 -29.808 4.421 -0.334
766 HE ARG 898 HE ARG 898 -31.826 5.045 0.636
767 HH11 ARG 898 HH11 ARG 898 -31.445 1.606 0.642
768 HH12 ARG 898 HH12 ARG 898 -32.836 1.315 1.631
769 HH21 ARG 898 HH21 ARG 898 -33.653 4.670 1.933
770 HH22 ARG 898 HH22 ARG 898 -34.087 3.050 2.363
771 H SER 899 H SER 899 -26.015 2.970 -2.038
772 HA SER 899 HA SER 899 -25.560 0.876 -3.973
773 HB2 SER 899 HB2 SER 899 -25.822 2.624 -5.577
774 HB3 SER 899 HB3 SER 899 -24.869 3.745 -4.610
775 HG SER 899 HG SER 899 -23.407 3.008 -6.003
776 H THR 900 H THR 900 -24.683 0.165 -1.851
777 HA THR 900 HA THR 900 -22.914 -0.291 -0.459
778 HB THR 900 HB THR 900 -21.208 0.954 -2.621
779 HG1 THR 900 HG1 THR 900 -22.735 -0.635 -3.389
780 HG21 THR 900 HG21 THR 900 -19.534 -0.628 -1.802
781 HG22 THR 900 HG22 THR 900 -20.689 -1.283 -0.642
782 HG23 THR 900 HG23 THR 900 -20.107 0.375 -0.469
Start of MODEL 10
1 H1 ASP 500 H1 ASP 500 7.724 -20.298 -5.812
2 H2 ASP 500 H2 ASP 500 7.088 -20.700 -7.335
3 H3 ASP 500 H3 ASP 500 7.212 -21.884 -6.124
4 HA ASP 500 HA ASP 500 5.151 -19.946 -6.587
5 HB2 ASP 500 HB2 ASP 500 5.293 -22.341 -4.735
6 HB3 ASP 500 HB3 ASP 500 3.837 -21.572 -5.364
7 H LYS 501 H LYS 501 6.816 -21.180 -3.674
8 HA LYS 501 HA LYS 501 5.618 -19.432 -1.840
9 HB2 LYS 501 HB2 LYS 501 8.376 -20.678 -1.735
10 HB3 LYS 501 HB3 LYS 501 7.512 -19.979 -0.365
11 HG2 LYS 501 HG2 LYS 501 5.810 -21.650 -0.462
12 HG3 LYS 501 HG3 LYS 501 6.349 -22.208 -2.044
13 HD2 LYS 501 HD2 LYS 501 8.508 -22.919 -1.018
14 HD3 LYS 501 HD3 LYS 501 7.877 -22.456 0.562
15 HE2 LYS 501 HE2 LYS 501 5.917 -24.027 0.083
16 HE3 LYS 501 HE3 LYS 501 6.870 -24.640 -1.269
17 HZ1 LYS 501 HZ1 LYS 501 8.569 -24.562 0.909
18 HZ2 LYS 501 HZ2 LYS 501 7.909 -25.941 0.167
19 HZ3 LYS 501 HZ3 LYS 501 7.117 -25.222 1.488
20 H ALA 502 H ALA 502 7.603 -18.672 -4.395
21 HA ALA 502 HA ALA 502 9.288 -16.671 -3.331
22 HB1 ALA 502 HB1 ALA 502 9.509 -17.676 -5.609
23 HB2 ALA 502 HB2 ALA 502 9.544 -15.913 -5.617
24 HB3 ALA 502 HB3 ALA 502 8.080 -16.769 -6.105
25 H TYR 503 H TYR 503 6.078 -16.472 -4.836
26 HA TYR 503 HA TYR 503 5.616 -13.777 -4.859
27 HB2 TYR 503 HB2 TYR 503 4.015 -15.647 -5.524
28 HB3 TYR 503 HB3 TYR 503 3.550 -15.723 -3.824
29 HD1 TYR 503 HD1 TYR 503 4.086 -13.171 -6.524
30 HD2 TYR 503 HD2 TYR 503 1.756 -14.385 -3.125
31 HE1 TYR 503 HE1 TYR 503 2.586 -11.233 -6.861
32 HE2 TYR 503 HE2 TYR 503 0.252 -12.442 -3.465
33 HH TYR 503 HH TYR 503 0.676 -9.984 -4.690
34 H LEU 504 H LEU 504 4.699 -15.858 -2.094
35 HA LEU 504 HA LEU 504 3.974 -13.957 -0.275
36 HB2 LEU 504 HB2 LEU 504 5.446 -16.562 0.085
37 HB3 LEU 504 HB3 LEU 504 5.013 -15.561 1.472
38 HG LEU 504 HG LEU 504 2.641 -15.605 0.740
39 HD11 LEU 504 HD11 LEU 504 2.120 -17.447 -1.002
40 HD12 LEU 504 HD12 LEU 504 3.817 -17.307 -1.462
41 HD13 LEU 504 HD13 LEU 504 2.745 -15.913 -1.605
42 HD21 LEU 504 HD21 LEU 504 3.406 -17.269 2.360
43 HD22 LEU 504 HD22 LEU 504 3.978 -18.312 1.058
44 HD23 LEU 504 HD23 LEU 504 2.250 -18.020 1.260
45 H ASP 505 H ASP 505 7.292 -15.077 -0.892
46 HA ASP 505 HA ASP 505 8.639 -13.563 1.005
47 HB2 ASP 505 HB2 ASP 505 9.575 -15.323 -0.608
48 HB3 ASP 505 HB3 ASP 505 9.713 -14.011 -1.778
49 H GLU 506 H GLU 506 7.580 -12.630 -2.252
50 HA GLU 506 HA GLU 506 8.810 -10.097 -2.326
51 HB2 GLU 506 HB2 GLU 506 6.210 -10.935 -3.634
52 HB3 GLU 506 HB3 GLU 506 7.222 -9.568 -4.099
53 HG2 GLU 506 HG2 GLU 506 9.056 -11.065 -4.676
54 HG3 GLU 506 HG3 GLU 506 8.137 -12.456 -4.107
55 H LEU 507 H LEU 507 5.982 -11.247 -0.678
56 HA LEU 507 HA LEU 507 4.922 -8.575 -0.181
57 HB2 LEU 507 HB2 LEU 507 4.041 -11.099 1.211
58 HB3 LEU 507 HB3 LEU 507 3.112 -9.639 0.868
59 HG LEU 507 HG LEU 507 4.112 -11.662 -1.156
60 HD11 LEU 507 HD11 LEU 507 1.577 -11.764 -1.591
61 HD12 LEU 507 HD12 LEU 507 1.397 -10.924 -0.052
62 HD13 LEU 507 HD13 LEU 507 2.155 -12.512 -0.104
63 HD21 LEU 507 HD21 LEU 507 2.711 -10.180 -2.727
64 HD22 LEU 507 HD22 LEU 507 4.272 -9.536 -2.221
65 HD23 LEU 507 HD23 LEU 507 2.791 -8.956 -1.460
66 H VAL 508 H VAL 508 6.556 -11.157 1.643
67 HA VAL 508 HA VAL 508 6.478 -9.975 4.175
68 HB VAL 508 HB VAL 508 8.620 -11.741 2.970
69 HG11 VAL 508 HG11 VAL 508 9.000 -12.299 5.423
70 HG12 VAL 508 HG12 VAL 508 8.010 -10.893 5.813
71 HG13 VAL 508 HG13 VAL 508 9.525 -10.689 4.932
72 HG21 VAL 508 HG21 VAL 508 6.070 -12.269 4.519
73 HG22 VAL 508 HG22 VAL 508 7.343 -13.476 4.336
74 HG23 VAL 508 HG23 VAL 508 6.497 -12.864 2.914
75 H GLU 509 H GLU 509 9.254 -9.942 1.919
76 HA GLU 509 HA GLU 509 10.863 -8.141 3.264
77 HB2 GLU 509 HB2 GLU 509 10.482 -8.327 0.261
78 HB3 GLU 509 HB3 GLU 509 11.867 -7.610 1.086
79 HG2 GLU 509 HG2 GLU 509 12.335 -9.800 2.160
80 HG3 GLU 509 HG3 GLU 509 10.989 -10.506 1.268
81 H LEU 510 H LEU 510 8.468 -7.340 0.722
82 HA LEU 510 HA LEU 510 8.709 -4.577 0.811
83 HB2 LEU 510 HB2 LEU 510 6.668 -6.516 -0.081
84 HB3 LEU 510 HB3 LEU 510 5.985 -4.960 0.372
85 HG LEU 510 HG LEU 510 7.665 -3.857 -1.137
86 HD11 LEU 510 HD11 LEU 510 9.044 -5.091 -2.590
87 HD12 LEU 510 HD12 LEU 510 8.140 -6.580 -2.338
88 HD13 LEU 510 HD13 LEU 510 9.191 -5.961 -1.067
89 HD21 LEU 510 HD21 LEU 510 5.289 -4.508 -1.804
90 HD22 LEU 510 HD22 LEU 510 5.999 -5.907 -2.610
91 HD23 LEU 510 HD23 LEU 510 6.420 -4.278 -3.136
92 H HIS 511 H HIS 511 6.613 -6.678 2.770
93 HA HIS 511 HA HIS 511 5.350 -4.674 4.260
94 HB2 HIS 511 HB2 HIS 511 4.634 -7.029 4.259
95 HB3 HIS 511 HB3 HIS 511 6.096 -7.466 5.146
96 HD1 HIS 511 HD1 HIS 511 6.189 -6.903 7.652
97 HD2 HIS 511 HD2 HIS 511 2.771 -5.479 5.760
98 HE1 HIS 511 HE1 HIS 511 4.645 -6.095 9.492
99 HE2 HIS 511 HE2 HIS 511 2.550 -5.214 8.354
100 H ARG 512 H ARG 512 8.288 -6.541 4.981
101 HA ARG 512 HA ARG 512 8.884 -5.538 7.485
102 HB2 ARG 512 HB2 ARG 512 10.023 -7.345 5.868
103 HB3 ARG 512 HB3 ARG 512 11.124 -6.011 5.546
104 HG2 ARG 512 HG2 ARG 512 12.178 -6.985 7.374
105 HG3 ARG 512 HG3 ARG 512 11.155 -5.809 8.198
106 HD2 ARG 512 HD2 ARG 512 10.896 -8.786 8.060
107 HD3 ARG 512 HD3 ARG 512 10.582 -7.700 9.409
108 HE ARG 512 HE ARG 512 8.708 -7.405 7.226
109 HH11 ARG 512 HH11 ARG 512 9.563 -9.121 10.107
110 HH12 ARG 512 HH12 ARG 512 7.945 -9.641 10.443
111 HH21 ARG 512 HH21 ARG 512 6.582 -8.088 7.660
112 HH22 ARG 512 HH22 ARG 512 6.257 -9.056 9.059
113 H ARG 513 H ARG 513 10.182 -4.330 4.371
114 HA ARG 513 HA ARG 513 11.498 -2.109 5.533
115 HB2 ARG 513 HB2 ARG 513 11.727 -1.279 3.232
116 HB3 ARG 513 HB3 ARG 513 12.135 -2.990 3.339
117 HG2 ARG 513 HG2 ARG 513 9.840 -3.557 2.581
118 HG3 ARG 513 HG3 ARG 513 9.492 -1.838 2.399
119 HD2 ARG 513 HD2 ARG 513 11.608 -3.420 0.916
120 HD3 ARG 513 HD3 ARG 513 10.128 -2.752 0.233
121 HE ARG 513 HE ARG 513 11.848 -0.777 1.472
122 HH11 ARG 513 HH11 ARG 513 11.075 -2.586 -1.376
123 HH12 ARG 513 HH12 ARG 513 11.765 -1.431 -2.465
124 HH21 ARG 513 HH21 ARG 513 12.756 0.743 0.048
125 HH22 ARG 513 HH22 ARG 513 12.717 0.455 -1.659
126 H LEU 514 H LEU 514 8.238 -2.504 4.204
127 HA LEU 514 HA LEU 514 7.548 0.213 4.044
128 HB2 LEU 514 HB2 LEU 514 6.067 -2.370 4.249
129 HB3 LEU 514 HB3 LEU 514 5.150 -0.916 4.631
130 HG LEU 514 HG LEU 514 6.804 -1.053 2.106
131 HD11 LEU 514 HD11 LEU 514 4.700 -1.795 0.945
132 HD12 LEU 514 HD12 LEU 514 3.993 -2.111 2.532
133 HD13 LEU 514 HD13 LEU 514 5.404 -3.027 1.993
134 HD21 LEU 514 HD21 LEU 514 4.982 0.510 1.336
135 HD22 LEU 514 HD22 LEU 514 5.917 1.139 2.691
136 HD23 LEU 514 HD23 LEU 514 4.312 0.460 2.965
137 H MET 515 H MET 515 7.258 -2.099 6.709
138 HA MET 515 HA MET 515 5.873 -0.535 8.519
139 HB2 MET 515 HB2 MET 515 6.440 -2.947 8.809
140 HB3 MET 515 HB3 MET 515 8.091 -2.471 9.203
141 HG2 MET 515 HG2 MET 515 5.754 -1.295 10.710
142 HG3 MET 515 HG3 MET 515 6.426 -2.860 11.161
143 HE1 MET 515 HE1 MET 515 6.519 0.212 12.952
144 HE2 MET 515 HE2 MET 515 7.749 -0.613 13.907
145 HE3 MET 515 HE3 MET 515 6.369 -1.518 13.287
146 H THR 516 H THR 516 9.336 -0.533 7.810
147 HA THR 516 HA THR 516 9.813 1.503 9.866
148 HB THR 516 HB THR 516 12.161 1.214 9.306
149 HG1 THR 516 HG1 THR 516 11.598 0.843 7.004
150 HG21 THR 516 HG21 THR 516 12.401 -1.170 9.856
151 HG22 THR 516 HG22 THR 516 10.715 -1.446 9.416
152 HG23 THR 516 HG23 THR 516 11.107 -0.439 10.809
153 H LEU 517 H LEU 517 9.309 1.200 6.453
154 HA LEU 517 HA LEU 517 10.639 3.407 5.447
155 HB2 LEU 517 HB2 LEU 517 9.413 1.719 4.088
156 HB3 LEU 517 HB3 LEU 517 7.897 2.450 4.603
157 HG LEU 517 HG LEU 517 8.582 4.592 3.575
158 HD11 LEU 517 HD11 LEU 517 11.108 3.037 3.066
159 HD12 LEU 517 HD12 LEU 517 10.912 4.716 3.568
160 HD13 LEU 517 HD13 LEU 517 10.614 4.260 1.895
161 HD21 LEU 517 HD21 LEU 517 8.710 2.132 1.812
162 HD22 LEU 517 HD22 LEU 517 8.513 3.770 1.190
163 HD23 LEU 517 HD23 LEU 517 7.274 3.064 2.225
164 H ARG 518 H ARG 518 10.504 5.524 5.763
165 HA ARG 518 HA ARG 518 8.114 6.627 7.110
166 HB2 ARG 518 HB2 ARG 518 9.701 8.609 7.523
167 HB3 ARG 518 HB3 ARG 518 9.989 7.134 8.443
168 HG2 ARG 518 HG2 ARG 518 11.380 7.474 5.792
169 HG3 ARG 518 HG3 ARG 518 11.992 8.357 7.189
170 HD2 ARG 518 HD2 ARG 518 11.406 5.462 7.606
171 HD3 ARG 518 HD3 ARG 518 12.805 5.852 6.610
172 HE ARG 518 HE ARG 518 13.143 7.448 8.783
173 HH11 ARG 518 HH11 ARG 518 12.453 4.087 8.329
174 HH12 ARG 518 HH12 ARG 518 13.261 3.585 9.776
175 HH21 ARG 518 HH21 ARG 518 14.204 6.796 10.683
176 HH22 ARG 518 HH22 ARG 518 14.251 5.118 11.110
177 H GLU 519 H GLU 519 10.046 6.695 4.254
178 HA GLU 519 HA GLU 519 9.691 9.097 3.073
179 HB2 GLU 519 HB2 GLU 519 10.440 6.608 2.204
180 HB3 GLU 519 HB3 GLU 519 8.955 6.832 1.290
181 HG2 GLU 519 HG2 GLU 519 11.414 8.600 1.297
182 HG3 GLU 519 HG3 GLU 519 10.734 7.708 -0.062
183 H ARG 520 H ARG 520 7.906 10.310 3.441
184 HA ARG 520 HA ARG 520 5.239 9.276 3.368
185 HB2 ARG 520 HB2 ARG 520 6.094 12.169 3.186
186 HB3 ARG 520 HB3 ARG 520 4.544 11.539 3.750
187 HG2 ARG 520 HG2 ARG 520 5.721 10.379 5.609
188 HG3 ARG 520 HG3 ARG 520 7.238 11.098 5.070
189 HD2 ARG 520 HD2 ARG 520 6.469 13.309 5.552
190 HD3 ARG 520 HD3 ARG 520 4.810 12.757 5.768
191 HE ARG 520 HE ARG 520 6.623 11.497 7.607
192 HH11 ARG 520 HH11 ARG 520 4.795 14.354 6.920
193 HH12 ARG 520 HH12 ARG 520 4.644 14.822 8.581
194 HH21 ARG 520 HH21 ARG 520 6.428 12.103 9.784
195 HH22 ARG 520 HH22 ARG 520 5.568 13.547 10.203
196 H HIS 521 H HIS 521 7.344 10.837 1.033
197 HA HIS 521 HA HIS 521 5.461 11.635 -0.870
198 HB2 HIS 521 HB2 HIS 521 7.975 12.088 -0.856
199 HB3 HIS 521 HB3 HIS 521 8.162 10.485 -1.571
200 HD1 HIS 521 HD1 HIS 521 5.967 10.324 -3.587
201 HD2 HIS 521 HD2 HIS 521 8.119 13.843 -2.984
202 HE1 HIS 521 HE1 HIS 521 5.706 11.694 -5.701
203 HE2 HIS 521 HE2 HIS 521 7.012 13.843 -5.349
204 H ILE 522 H ILE 522 6.916 8.454 -0.305
205 HA ILE 522 HA ILE 522 5.690 7.289 -2.647
206 HB ILE 522 HB ILE 522 6.897 5.832 -0.296
207 HG12 ILE 522 HG12 ILE 522 8.579 7.417 -0.933
208 HG13 ILE 522 HG13 ILE 522 9.017 5.905 -1.719
209 HG21 ILE 522 HG21 ILE 522 5.672 4.493 -1.948
210 HG22 ILE 522 HG22 ILE 522 7.403 4.159 -2.033
211 HG23 ILE 522 HG23 ILE 522 6.644 5.195 -3.242
212 HD11 ILE 522 HD11 ILE 522 7.751 8.355 -2.946
213 HD12 ILE 522 HD12 ILE 522 7.698 6.782 -3.748
214 HD13 ILE 522 HD13 ILE 522 9.251 7.549 -3.411
215 H LEU 523 H LEU 523 5.250 6.936 0.853
216 HA LEU 523 HA LEU 523 3.161 5.144 0.943
217 HB2 LEU 523 HB2 LEU 523 4.121 7.358 2.666
218 HB3 LEU 523 HB3 LEU 523 2.440 6.912 2.935
219 HG LEU 523 HG LEU 523 3.150 4.536 3.219
220 HD11 LEU 523 HD11 LEU 523 5.276 4.795 1.859
221 HD12 LEU 523 HD12 LEU 523 5.472 3.948 3.392
222 HD13 LEU 523 HD13 LEU 523 5.972 5.630 3.247
223 HD21 LEU 523 HD21 LEU 523 3.900 4.809 5.453
224 HD22 LEU 523 HD22 LEU 523 3.016 6.296 5.114
225 HD23 LEU 523 HD23 LEU 523 4.777 6.290 5.068
226 H GLN 524 H GLN 524 3.112 8.455 -0.161
227 HA GLN 524 HA GLN 524 0.242 8.702 -0.099
228 HB2 GLN 524 HB2 GLN 524 1.919 10.623 -0.042
229 HB3 GLN 524 HB3 GLN 524 2.149 10.346 -1.768
230 HG2 GLN 524 HG2 GLN 524 -0.396 10.524 -1.985
231 HG3 GLN 524 HG3 GLN 524 -0.389 11.155 -0.340
232 HE21 GLN 524 HE21 GLN 524 1.440 11.727 -3.409
233 HE22 GLN 524 HE22 GLN 524 1.439 13.417 -3.253
234 H GLN 525 H GLN 525 2.676 8.049 -2.601
235 HA GLN 525 HA GLN 525 0.895 7.911 -4.789
236 HB2 GLN 525 HB2 GLN 525 3.553 6.520 -4.378
237 HB3 GLN 525 HB3 GLN 525 2.719 6.694 -5.923
238 HG2 GLN 525 HG2 GLN 525 3.432 9.076 -4.208
239 HG3 GLN 525 HG3 GLN 525 4.539 8.425 -5.415
240 HE21 GLN 525 HE21 GLN 525 2.765 7.764 -7.500
241 HE22 GLN 525 HE22 GLN 525 2.014 9.178 -8.067
242 H ILE 526 H ILE 526 2.290 5.322 -2.774
243 HA ILE 526 HA ILE 526 1.033 3.151 -4.003
244 HB ILE 526 HB ILE 526 1.854 3.545 -1.118
245 HG12 ILE 526 HG12 ILE 526 3.200 2.043 -3.384
246 HG13 ILE 526 HG13 ILE 526 3.598 3.703 -2.948
247 HG21 ILE 526 HG21 ILE 526 0.369 1.730 -1.001
248 HG22 ILE 526 HG22 ILE 526 1.919 0.936 -1.272
249 HG23 ILE 526 HG23 ILE 526 0.792 1.150 -2.610
250 HD11 ILE 526 HD11 ILE 526 4.296 3.028 -0.737
251 HD12 ILE 526 HD12 ILE 526 5.106 1.981 -1.902
252 HD13 ILE 526 HD13 ILE 526 3.709 1.386 -1.003
253 H VAL 527 H VAL 527 0.018 4.771 -0.991
254 HA VAL 527 HA VAL 527 -2.328 3.524 -0.475
255 HB VAL 527 HB VAL 527 -1.721 6.482 -0.307
256 HG11 VAL 527 HG11 VAL 527 -3.613 6.411 1.433
257 HG12 VAL 527 HG12 VAL 527 -4.096 4.893 0.676
258 HG13 VAL 527 HG13 VAL 527 -4.096 6.384 -0.265
259 HG21 VAL 527 HG21 VAL 527 -0.476 4.562 1.050
260 HG22 VAL 527 HG22 VAL 527 -1.945 4.585 2.021
261 HG23 VAL 527 HG23 VAL 527 -0.973 6.047 1.860
262 H ASN 528 H ASN 528 -2.213 6.492 -2.472
263 HA ASN 528 HA ASN 528 -4.817 6.448 -3.398
264 HB2 ASN 528 HB2 ASN 528 -3.286 8.329 -3.746
265 HB3 ASN 528 HB3 ASN 528 -2.341 7.359 -4.874
266 HD21 ASN 528 HD21 ASN 528 -4.868 9.602 -4.714
267 HD22 ASN 528 HD22 ASN 528 -5.558 9.306 -6.237
268 H LEU 529 H LEU 529 -2.157 4.407 -4.321
269 HA LEU 529 HA LEU 529 -3.215 3.600 -6.860
270 HB2 LEU 529 HB2 LEU 529 -0.777 3.394 -5.875
271 HB3 LEU 529 HB3 LEU 529 -1.364 1.866 -5.235
272 HG LEU 529 HG LEU 529 -0.327 1.448 -7.379
273 HD11 LEU 529 HD11 LEU 529 -3.295 1.383 -7.909
274 HD12 LEU 529 HD12 LEU 529 -2.528 0.312 -6.735
275 HD13 LEU 529 HD13 LEU 529 -2.061 0.238 -8.434
276 HD21 LEU 529 HD21 LEU 529 -0.621 2.702 -9.290
277 HD22 LEU 529 HD22 LEU 529 -0.995 3.963 -8.121
278 HD23 LEU 529 HD23 LEU 529 -2.299 3.091 -8.923
279 H ILE 530 H ILE 530 -2.888 1.759 -3.822
280 HA ILE 530 HA ILE 530 -4.689 -0.262 -4.688
281 HB ILE 530 HB ILE 530 -4.581 -1.074 -2.365
282 HG12 ILE 530 HG12 ILE 530 -2.760 1.274 -1.768
283 HG13 ILE 530 HG13 ILE 530 -4.474 1.323 -1.387
284 HG21 ILE 530 HG21 ILE 530 -2.004 -0.149 -3.660
285 HG22 ILE 530 HG22 ILE 530 -2.796 -1.716 -3.849
286 HG23 ILE 530 HG23 ILE 530 -2.054 -1.281 -2.308
287 HD11 ILE 530 HD11 ILE 530 -4.332 -0.394 0.183
288 HD12 ILE 530 HD12 ILE 530 -2.826 0.487 0.441
289 HD13 ILE 530 HD13 ILE 530 -2.819 -1.014 -0.483
290 H GLU 531 H GLU 531 -5.015 2.632 -2.795
291 HA GLU 531 HA GLU 531 -7.607 2.321 -1.802
292 HB2 GLU 531 HB2 GLU 531 -6.065 4.253 -1.294
293 HB3 GLU 531 HB3 GLU 531 -6.478 4.916 -2.874
294 HG2 GLU 531 HG2 GLU 531 -8.599 4.188 -0.849
295 HG3 GLU 531 HG3 GLU 531 -7.835 5.776 -0.869
296 H GLU 532 H GLU 532 -6.478 3.667 -4.863
297 HA GLU 532 HA GLU 532 -9.008 4.126 -6.032
298 HB2 GLU 532 HB2 GLU 532 -7.214 5.265 -7.026
299 HB3 GLU 532 HB3 GLU 532 -6.198 3.827 -7.068
300 HG2 GLU 532 HG2 GLU 532 -7.225 2.975 -8.967
301 HG3 GLU 532 HG3 GLU 532 -8.739 3.828 -8.670
302 H THR 533 H THR 533 -6.960 1.302 -5.788
303 HA THR 533 HA THR 533 -8.215 -0.259 -7.810
304 HB THR 533 HB THR 533 -6.785 -1.331 -5.378
305 HG1 THR 533 HG1 THR 533 -5.013 -1.172 -7.117
306 HG21 THR 533 HG21 THR 533 -6.886 -2.312 -8.239
307 HG22 THR 533 HG22 THR 533 -7.959 -2.896 -6.967
308 HG23 THR 533 HG23 THR 533 -6.219 -3.160 -6.845
309 H GLY 534 H GLY 534 -8.541 -0.276 -4.253
310 HA2 GLY 534 HA2 GLY 534 -10.922 -0.362 -3.449
311 HA3 GLY 534 HA3 GLY 534 -11.131 -1.709 -4.563
312 H HIS 535 H HIS 535 -8.310 -2.611 -3.905
313 HA HIS 535 HA HIS 535 -9.033 -4.419 -1.812
314 HB2 HIS 535 HB2 HIS 535 -6.464 -3.882 -3.303
315 HB3 HIS 535 HB3 HIS 535 -6.586 -5.100 -2.036
316 HD1 HIS 535 HD1 HIS 535 -6.922 -4.768 -5.581
317 HD2 HIS 535 HD2 HIS 535 -8.959 -6.942 -2.666
318 HE1 HIS 535 HE1 HIS 535 -8.158 -6.612 -6.797
319 HE2 HIS 535 HE2 HIS 535 -9.407 -7.947 -5.034
320 H PHE 536 H PHE 536 -9.439 -2.117 -0.532
321 HA PHE 536 HA PHE 536 -7.301 -2.099 1.472
322 HB2 PHE 536 HB2 PHE 536 -6.904 0.225 1.421
323 HB3 PHE 536 HB3 PHE 536 -6.883 -0.259 -0.273
324 HD1 PHE 536 HD1 PHE 536 -9.136 -0.085 -1.568
325 HD2 PHE 536 HD2 PHE 536 -8.344 1.943 2.123
326 HE1 PHE 536 HE1 PHE 536 -10.975 1.505 -2.051
327 HE2 PHE 536 HE2 PHE 536 -10.184 3.537 1.642
328 HZ PHE 536 HZ PHE 536 -11.499 3.317 -0.446
329 H HIS 537 H HIS 537 -7.930 -1.119 3.468
330 HA HIS 537 HA HIS 537 -10.835 -0.722 3.865
331 HB2 HIS 537 HB2 HIS 537 -10.272 -3.049 4.510
332 HB3 HIS 537 HB3 HIS 537 -9.048 -2.432 5.619
333 HD1 HIS 537 HD1 HIS 537 -12.770 -1.812 4.983
334 HD2 HIS 537 HD2 HIS 537 -10.074 -2.094 8.151
335 HE1 HIS 537 HE1 HIS 537 -14.125 -1.529 7.106
336 HE2 HIS 537 HE2 HIS 537 -12.496 -1.698 9.045
337 H ILE 538 H ILE 538 -11.358 0.714 5.492
338 HA ILE 538 HA ILE 538 -9.178 2.013 7.001
339 HB ILE 538 HB ILE 538 -11.209 3.416 5.244
340 HG12 ILE 538 HG12 ILE 538 -8.186 3.614 5.396
341 HG13 ILE 538 HG13 ILE 538 -9.048 2.611 4.236
342 HG21 ILE 538 HG21 ILE 538 -9.472 4.454 7.494
343 HG22 ILE 538 HG22 ILE 538 -11.206 4.663 7.281
344 HG23 ILE 538 HG23 ILE 538 -10.081 5.511 6.223
345 HD11 ILE 538 HD11 ILE 538 -8.976 5.614 4.437
346 HD12 ILE 538 HD12 ILE 538 -10.296 4.803 3.598
347 HD13 ILE 538 HD13 ILE 538 -8.636 4.600 3.037
348 H THR 539 H THR 539 -9.728 2.415 9.062
349 HA THR 539 HA THR 539 -12.567 2.539 9.840
350 HB THR 539 HB THR 539 -12.165 0.236 10.209
351 HG1 THR 539 HG1 THR 539 -11.804 1.856 12.472
352 HG21 THR 539 HG21 THR 539 -9.802 0.096 9.856
353 HG22 THR 539 HG22 THR 539 -10.092 -0.491 11.494
354 HG23 THR 539 HG23 THR 539 -9.468 1.138 11.240
355 H ASN 540 H ASN 540 -12.830 3.279 12.094
356 HA ASN 540 HA ASN 540 -12.515 5.092 13.504
357 HB2 ASN 540 HB2 ASN 540 -10.302 4.767 14.821
358 HB3 ASN 540 HB3 ASN 540 -11.515 3.492 14.894
359 HD21 ASN 540 HD21 ASN 540 -11.099 1.503 13.667
360 HD22 ASN 540 HD22 ASN 540 -9.536 1.133 13.116
361 H THR 541 H THR 541 -9.078 4.933 13.087
362 HA THR 541 HA THR 541 -8.999 7.150 11.190
363 HB THR 541 HB THR 541 -7.614 8.542 12.732
364 HG1 THR 541 HG1 THR 541 -7.608 6.381 14.153
365 HG21 THR 541 HG21 THR 541 -10.327 7.956 13.930
366 HG22 THR 541 HG22 THR 541 -10.132 8.806 12.397
367 HG23 THR 541 HG23 THR 541 -9.476 9.499 13.879
368 H THR 542 H THR 542 -7.992 5.331 10.048
369 HA THR 542 HA THR 542 -5.173 5.532 10.072
370 HB THR 542 HB THR 542 -5.565 2.693 10.624
371 HG1 THR 542 HG1 THR 542 -6.171 2.929 12.792
372 HG21 THR 542 HG21 THR 542 -3.412 3.917 10.781
373 HG22 THR 542 HG22 THR 542 -3.813 3.099 12.290
374 HG23 THR 542 HG23 THR 542 -4.048 4.841 12.142
375 H PHE 543 H PHE 543 -4.193 3.982 8.484
376 HA PHE 543 HA PHE 543 -6.153 3.147 6.419
377 HB2 PHE 543 HB2 PHE 543 -5.026 5.193 5.710
378 HB3 PHE 543 HB3 PHE 543 -3.457 4.463 6.033
379 HD1 PHE 543 HD1 PHE 543 -6.485 4.269 3.904
380 HD2 PHE 543 HD2 PHE 543 -2.451 2.932 4.496
381 HE1 PHE 543 HE1 PHE 543 -6.478 3.283 1.629
382 HE2 PHE 543 HE2 PHE 543 -2.436 1.951 2.218
383 HZ PHE 543 HZ PHE 543 -4.456 2.126 0.789
384 H ASP 544 H ASP 544 -6.147 0.974 6.786
385 HA ASP 544 HA ASP 544 -3.546 -0.420 6.936
386 HB2 ASP 544 HB2 ASP 544 -4.930 -2.342 7.734
387 HB3 ASP 544 HB3 ASP 544 -4.992 -0.928 8.787
388 H PHE 545 H PHE 545 -3.006 -2.036 5.527
389 HA PHE 545 HA PHE 545 -4.886 -2.991 3.541
390 HB2 PHE 545 HB2 PHE 545 -3.499 -2.313 1.610
391 HB3 PHE 545 HB3 PHE 545 -4.170 -0.926 2.463
392 HD1 PHE 545 HD1 PHE 545 -2.696 0.237 4.221
393 HD2 PHE 545 HD2 PHE 545 -1.163 -2.518 1.303
394 HE1 PHE 545 HE1 PHE 545 -0.415 1.154 4.554
395 HE2 PHE 545 HE2 PHE 545 1.118 -1.603 1.638
396 HZ PHE 545 HZ PHE 545 1.491 0.234 3.261
397 H ASP 546 H ASP 546 -4.179 -4.928 2.538
398 HA ASP 546 HA ASP 546 -1.861 -6.180 3.874
399 HB2 ASP 546 HB2 ASP 546 -3.896 -7.568 2.140
400 HB3 ASP 546 HB3 ASP 546 -2.836 -8.269 3.360
401 H LEU 547 H LEU 547 -0.181 -7.150 2.688
402 HA LEU 547 HA LEU 547 0.334 -5.969 0.106
403 HB2 LEU 547 HB2 LEU 547 1.824 -7.894 1.891
404 HB3 LEU 547 HB3 LEU 547 2.419 -7.447 0.304
405 HG LEU 547 HG LEU 547 3.314 -6.139 2.361
406 HD11 LEU 547 HD11 LEU 547 3.494 -5.459 -0.101
407 HD12 LEU 547 HD12 LEU 547 3.576 -4.144 1.067
408 HD13 LEU 547 HD13 LEU 547 2.087 -4.434 0.176
409 HD21 LEU 547 HD21 LEU 547 1.038 -5.780 3.349
410 HD22 LEU 547 HD22 LEU 547 0.670 -4.683 2.021
411 HD23 LEU 547 HD23 LEU 547 1.964 -4.300 3.154
412 H CYS 548 H CYS 548 -1.219 -8.752 1.266
413 HA CYS 548 HA CYS 548 -0.628 -10.418 -1.057
414 HB2 CYS 548 HB2 CYS 548 -0.781 -11.596 1.021
415 HB3 CYS 548 HB3 CYS 548 -2.315 -10.824 1.422
416 HG CYS 548 HG CYS 548 -3.392 -12.163 -0.614
417 H SER 549 H SER 549 -2.857 -8.024 -0.176
418 HA SER 549 HA SER 549 -4.988 -9.015 -1.920
419 HB2 SER 549 HB2 SER 549 -5.331 -7.763 0.313
420 HB3 SER 549 HB3 SER 549 -4.919 -6.311 -0.593
421 HG SER 549 HG SER 549 -7.171 -6.738 -0.602
422 H LEU 550 H LEU 550 -2.130 -7.885 -2.632
423 HA LEU 550 HA LEU 550 -2.761 -5.662 -4.380
424 HB2 LEU 550 HB2 LEU 550 -0.237 -7.331 -4.245
425 HB3 LEU 550 HB3 LEU 550 -0.417 -5.764 -5.027
426 HG LEU 550 HG LEU 550 -0.783 -6.275 -2.059
427 HD11 LEU 550 HD11 LEU 550 1.544 -6.492 -2.480
428 HD12 LEU 550 HD12 LEU 550 1.348 -4.808 -2.004
429 HD13 LEU 550 HD13 LEU 550 1.528 -5.223 -3.707
430 HD21 LEU 550 HD21 LEU 550 -1.000 -3.831 -3.824
431 HD22 LEU 550 HD22 LEU 550 -0.547 -3.665 -2.128
432 HD23 LEU 550 HD23 LEU 550 -2.097 -4.382 -2.558
433 H ASP 551 H ASP 551 -2.979 -5.707 -6.586
434 HA ASP 551 HA ASP 551 -3.623 -8.286 -7.779
435 HB2 ASP 551 HB2 ASP 551 -3.635 -5.548 -9.068
436 HB3 ASP 551 HB3 ASP 551 -4.422 -7.006 -9.664
437 H LYS 552 H LYS 552 -2.533 -9.259 -9.452
438 HA LYS 552 HA LYS 552 0.170 -9.327 -9.535
439 HB2 LYS 552 HB2 LYS 552 -1.874 -9.822 -11.685
440 HB3 LYS 552 HB3 LYS 552 -0.158 -9.965 -12.063
441 HG2 LYS 552 HG2 LYS 552 -1.131 -12.143 -11.385
442 HG3 LYS 552 HG3 LYS 552 0.123 -11.611 -10.265
443 HD2 LYS 552 HD2 LYS 552 -1.500 -10.890 -8.654
444 HD3 LYS 552 HD3 LYS 552 -2.821 -11.077 -9.809
445 HE2 LYS 552 HE2 LYS 552 -2.786 -12.977 -8.260
446 HE3 LYS 552 HE3 LYS 552 -2.380 -13.519 -9.887
447 HZ1 LYS 552 HZ1 LYS 552 0.020 -12.821 -8.832
448 HZ2 LYS 552 HZ2 LYS 552 -0.585 -14.405 -8.945
449 HZ3 LYS 552 HZ3 LYS 552 -0.777 -13.519 -7.508
450 H THR 553 H THR 553 -1.795 -7.313 -11.740
451 HA THR 553 HA THR 553 0.423 -5.985 -12.897
452 HB THR 553 HB THR 553 -2.338 -4.860 -12.666
453 HG1 THR 553 HG1 THR 553 -1.341 -6.761 -14.507
454 HG21 THR 553 HG21 THR 553 -0.538 -3.441 -13.634
455 HG22 THR 553 HG22 THR 553 -1.796 -3.835 -14.806
456 HG23 THR 553 HG23 THR 553 -0.253 -4.689 -14.846
457 H THR 554 H THR 554 -1.381 -5.521 -9.972
458 HA THR 554 HA THR 554 -0.390 -2.831 -9.510
459 HB THR 554 HB THR 554 -1.905 -4.737 -7.713
460 HG1 THR 554 HG1 THR 554 -3.648 -3.497 -8.302
461 HG21 THR 554 HG21 THR 554 -1.020 -1.868 -7.392
462 HG22 THR 554 HG22 THR 554 -0.740 -3.221 -6.297
463 HG23 THR 554 HG23 THR 554 -2.360 -2.547 -6.469
464 H VAL 555 H VAL 555 0.615 -6.076 -8.862
465 HA VAL 555 HA VAL 555 2.248 -5.547 -6.583
466 HB VAL 555 HB VAL 555 2.268 -7.753 -8.654
467 HG11 VAL 555 HG11 VAL 555 4.532 -7.653 -7.891
468 HG12 VAL 555 HG12 VAL 555 3.766 -8.917 -6.931
469 HG13 VAL 555 HG13 VAL 555 4.033 -7.320 -6.232
470 HG21 VAL 555 HG21 VAL 555 1.205 -9.049 -6.966
471 HG22 VAL 555 HG22 VAL 555 0.392 -7.486 -6.908
472 HG23 VAL 555 HG23 VAL 555 1.614 -7.889 -5.704
473 H ARG 556 H ARG 556 2.855 -5.673 -10.070
474 HA ARG 556 HA ARG 556 5.639 -5.143 -9.928
475 HB2 ARG 556 HB2 ARG 556 3.552 -4.912 -12.091
476 HB3 ARG 556 HB3 ARG 556 5.199 -4.350 -12.375
477 HG2 ARG 556 HG2 ARG 556 4.771 -7.109 -11.234
478 HG3 ARG 556 HG3 ARG 556 4.522 -6.847 -12.958
479 HD2 ARG 556 HD2 ARG 556 7.058 -6.218 -11.417
480 HD3 ARG 556 HD3 ARG 556 6.830 -7.558 -12.535
481 HE ARG 556 HE ARG 556 6.243 -5.088 -13.824
482 HH11 ARG 556 HH11 ARG 556 8.829 -7.037 -12.604
483 HH12 ARG 556 HH12 ARG 556 10.001 -6.428 -13.724
484 HH21 ARG 556 HH21 ARG 556 7.775 -4.285 -15.296
485 HH22 ARG 556 HH22 ARG 556 9.404 -4.870 -15.248
486 H LYS 557 H LYS 557 2.791 -3.127 -9.880
487 HA LYS 557 HA LYS 557 4.230 -0.665 -10.347
488 HB2 LYS 557 HB2 LYS 557 1.410 -1.305 -9.473
489 HB3 LYS 557 HB3 LYS 557 2.017 0.348 -9.585
490 HG2 LYS 557 HG2 LYS 557 2.386 0.174 -11.927
491 HG3 LYS 557 HG3 LYS 557 2.248 -1.585 -11.897
492 HD2 LYS 557 HD2 LYS 557 0.206 -0.478 -12.811
493 HD3 LYS 557 HD3 LYS 557 -0.128 -1.430 -11.366
494 HE2 LYS 557 HE2 LYS 557 -1.151 0.931 -11.468
495 HE3 LYS 557 HE3 LYS 557 -0.286 0.496 -9.995
496 HZ1 LYS 557 HZ1 LYS 557 0.910 1.968 -12.281
497 HZ2 LYS 557 HZ2 LYS 557 1.651 1.640 -10.788
498 HZ3 LYS 557 HZ3 LYS 557 0.326 2.701 -10.867
499 H LEU 558 H LEU 558 3.206 -2.591 -7.620
500 HA LEU 558 HA LEU 558 3.582 -0.608 -5.617
501 HB2 LEU 558 HB2 LEU 558 2.351 -2.950 -5.551
502 HB3 LEU 558 HB3 LEU 558 3.928 -3.538 -5.045
503 HG LEU 558 HG LEU 558 2.668 -3.016 -3.057
504 HD11 LEU 558 HD11 LEU 558 4.525 -0.668 -3.470
505 HD12 LEU 558 HD12 LEU 558 5.113 -2.314 -3.238
506 HD13 LEU 558 HD13 LEU 558 4.174 -1.526 -1.970
507 HD21 LEU 558 HD21 LEU 558 2.375 -0.108 -3.754
508 HD22 LEU 558 HD22 LEU 558 1.376 -1.122 -2.721
509 HD23 LEU 558 HD23 LEU 558 1.232 -1.243 -4.471
510 H GLN 559 H GLN 559 5.532 -3.508 -6.297
511 HA GLN 559 HA GLN 559 7.752 -2.877 -4.779
512 HB2 GLN 559 HB2 GLN 559 7.732 -4.284 -7.462
513 HB3 GLN 559 HB3 GLN 559 9.004 -4.390 -6.244
514 HG2 GLN 559 HG2 GLN 559 7.597 -5.542 -4.716
515 HG3 GLN 559 HG3 GLN 559 6.138 -5.118 -5.609
516 HE21 GLN 559 HE21 GLN 559 6.814 -7.849 -4.983
517 HE22 GLN 559 HE22 GLN 559 7.141 -8.653 -6.441
518 H SER 560 H SER 560 6.745 -1.581 -7.855
519 HA SER 560 HA SER 560 9.240 -0.444 -8.633
520 HB2 SER 560 HB2 SER 560 7.679 -0.651 -10.371
521 HB3 SER 560 HB3 SER 560 6.374 0.033 -9.408
522 HG SER 560 HG SER 560 7.193 2.023 -9.689
523 H TYR 561 H TYR 561 6.319 1.069 -7.206
524 HA TYR 561 HA TYR 561 7.207 3.642 -6.899
525 HB2 TYR 561 HB2 TYR 561 5.464 1.925 -5.139
526 HB3 TYR 561 HB3 TYR 561 5.822 3.588 -4.690
527 HD1 TYR 561 HD1 TYR 561 5.614 5.303 -6.802
528 HD2 TYR 561 HD2 TYR 561 3.485 1.603 -6.331
529 HE1 TYR 561 HE1 TYR 561 3.859 6.113 -8.345
530 HE2 TYR 561 HE2 TYR 561 1.734 2.413 -7.870
531 HH TYR 561 HH TYR 561 1.286 4.004 -9.477
532 H LEU 562 H LEU 562 7.563 1.099 -4.416
533 HA LEU 562 HA LEU 562 9.086 2.503 -2.591
534 HB2 LEU 562 HB2 LEU 562 9.426 -0.414 -3.318
535 HB3 LEU 562 HB3 LEU 562 9.895 0.341 -1.798
536 HG LEU 562 HG LEU 562 7.043 0.411 -2.818
537 HD11 LEU 562 HD11 LEU 562 6.609 -1.494 -1.296
538 HD12 LEU 562 HD12 LEU 562 8.340 -1.622 -0.985
539 HD13 LEU 562 HD13 LEU 562 7.710 -1.936 -2.602
540 HD21 LEU 562 HD21 LEU 562 6.656 0.634 -0.292
541 HD22 LEU 562 HD22 LEU 562 7.397 2.019 -1.083
542 HD23 LEU 562 HD23 LEU 562 8.390 0.903 -0.149
543 H GLU 563 H GLU 563 10.272 0.552 -5.325
544 HA GLU 563 HA GLU 563 13.006 0.974 -4.936
545 HB2 GLU 563 HB2 GLU 563 11.901 -0.638 -6.555
546 HB3 GLU 563 HB3 GLU 563 11.685 0.740 -7.634
547 HG2 GLU 563 HG2 GLU 563 13.736 -0.255 -8.308
548 HG3 GLU 563 HG3 GLU 563 14.198 1.156 -7.359
549 H THR 564 H THR 564 10.947 2.611 -7.302
550 HA THR 564 HA THR 564 12.648 4.556 -8.197
551 HB THR 564 HB THR 564 10.619 5.976 -8.549
552 HG1 THR 564 HG1 THR 564 8.998 5.627 -7.291
553 HG21 THR 564 HG21 THR 564 11.294 4.070 -10.062
554 HG22 THR 564 HG22 THR 564 9.575 4.461 -10.103
555 HG23 THR 564 HG23 THR 564 10.139 3.058 -9.195
556 H SER 565 H SER 565 13.242 6.631 -7.577
557 HA SER 565 HA SER 565 14.033 8.154 -6.035
558 HB2 SER 565 HB2 SER 565 11.209 7.914 -4.978
559 HB3 SER 565 HB3 SER 565 12.295 9.286 -4.785
560 HG SER 565 HG SER 565 11.832 9.903 -6.747
561 H GLY 566 H GLY 566 14.927 5.729 -5.313
562 HA2 GLY 566 HA2 GLY 566 14.163 4.995 -2.634
563 HA3 GLY 566 HA3 GLY 566 15.526 4.354 -3.547
564 H THR 567 H THR 567 16.726 6.909 -4.121
565 HA THR 567 HA THR 567 18.390 7.199 -1.867
566 HB THR 567 HB THR 567 19.134 9.321 -3.041
567 HG1 THR 567 HG1 THR 567 17.349 9.925 -4.138
568 HG21 THR 567 HG21 THR 567 20.125 7.063 -3.446
569 HG22 THR 567 HG22 THR 567 20.184 8.106 -4.867
570 HG23 THR 567 HG23 THR 567 18.969 6.831 -4.758
571 H SER 568 H SER 568 18.627 8.995 -0.431
572 HA SER 568 HA SER 568 16.241 9.827 0.805
573 HB2 SER 568 HB2 SER 568 18.359 9.739 2.015
574 HB3 SER 568 HB3 SER 568 19.024 11.006 0.989
575 HG SER 568 HG SER 568 17.578 11.257 3.198
576 H1 THR 876 H1 THR 876 1.032 -14.324 9.575
577 H2 THR 876 H2 THR 876 1.627 -15.774 8.918
578 H3 THR 876 H3 THR 876 0.826 -15.782 10.416
579 HA THR 876 HA THR 876 -0.720 -16.602 8.860
580 HB THR 876 HB THR 876 -2.477 -14.917 8.990
581 HG1 THR 876 HG1 THR 876 -0.333 -13.157 9.580
582 HG21 THR 876 HG21 THR 876 -0.592 -14.829 11.362
583 HG22 THR 876 HG22 THR 876 -1.882 -16.001 11.091
584 HG23 THR 876 HG23 THR 876 -2.277 -14.311 11.399
585 H ASN 877 H ASN 877 -1.905 -16.283 6.834
586 HA ASN 877 HA ASN 877 -0.147 -15.541 4.694
587 HB2 ASN 877 HB2 ASN 877 -2.004 -16.195 3.233
588 HB3 ASN 877 HB3 ASN 877 -1.737 -17.409 4.484
589 HD21 ASN 877 HD21 ASN 877 -3.304 -17.474 6.297
590 HD22 ASN 877 HD22 ASN 877 -4.847 -16.791 6.114
591 H LYS 878 H LYS 878 -0.665 -13.353 6.413
592 HA LYS 878 HA LYS 878 -1.692 -11.432 4.462
593 HB2 LYS 878 HB2 LYS 878 -2.749 -11.566 7.304
594 HB3 LYS 878 HB3 LYS 878 -3.158 -10.351 6.094
595 HG2 LYS 878 HG2 LYS 878 -3.977 -12.262 4.623
596 HG3 LYS 878 HG3 LYS 878 -3.799 -13.308 6.029
597 HD2 LYS 878 HD2 LYS 878 -6.035 -12.683 6.244
598 HD3 LYS 878 HD3 LYS 878 -5.257 -11.452 7.235
599 HE2 LYS 878 HE2 LYS 878 -6.926 -10.473 5.679
600 HE3 LYS 878 HE3 LYS 878 -5.302 -9.878 5.344
601 HZ1 LYS 878 HZ1 LYS 878 -5.416 -10.710 3.310
602 HZ2 LYS 878 HZ2 LYS 878 -7.029 -11.163 3.596
603 HZ3 LYS 878 HZ3 LYS 878 -5.767 -12.259 3.905
604 H LEU 879 H LEU 879 -1.054 -9.272 4.962
605 HA LEU 879 HA LEU 879 1.008 -8.913 7.033
606 HB2 LEU 879 HB2 LEU 879 1.278 -8.415 4.069
607 HB3 LEU 879 HB3 LEU 879 2.343 -7.673 5.244
608 HG LEU 879 HG LEU 879 1.980 -10.660 5.268
609 HD11 LEU 879 HD11 LEU 879 4.104 -10.651 3.768
610 HD12 LEU 879 HD12 LEU 879 3.595 -9.022 3.311
611 HD13 LEU 879 HD13 LEU 879 2.540 -10.401 2.994
612 HD21 LEU 879 HD21 LEU 879 4.411 -8.933 5.824
613 HD22 LEU 879 HD22 LEU 879 4.194 -10.631 6.237
614 HD23 LEU 879 HD23 LEU 879 3.253 -9.396 7.068
615 HA PRO 880 HA PRO 880 -1.865 -5.344 6.626
616 HB2 PRO 880 HB2 PRO 880 -2.360 -4.893 9.259
617 HB3 PRO 880 HB3 PRO 880 -3.170 -6.187 8.349
618 HG2 PRO 880 HG2 PRO 880 -0.880 -6.364 10.253
619 HG3 PRO 880 HG3 PRO 880 -2.250 -7.466 10.035
620 HD2 PRO 880 HD2 PRO 880 0.297 -7.879 8.967
621 HD3 PRO 880 HD3 PRO 880 -1.186 -8.640 8.349
622 H VAL 881 H VAL 881 -1.364 -3.211 6.599
623 HA VAL 881 HA VAL 881 0.903 -2.201 8.222
624 HB VAL 881 HB VAL 881 0.458 -1.571 5.293
625 HG11 VAL 881 HG11 VAL 881 2.691 -0.452 5.570
626 HG12 VAL 881 HG12 VAL 881 2.569 -0.741 7.305
627 HG13 VAL 881 HG13 VAL 881 1.402 0.311 6.502
628 HG21 VAL 881 HG21 VAL 881 1.331 -3.760 5.352
629 HG22 VAL 881 HG22 VAL 881 2.384 -3.401 6.723
630 HG23 VAL 881 HG23 VAL 881 2.747 -2.733 5.130
631 H SER 882 H SER 882 -0.148 -0.840 9.550
632 HA SER 882 HA SER 882 -2.334 0.832 8.538
633 HB2 SER 882 HB2 SER 882 -2.449 1.537 10.966
634 HB3 SER 882 HB3 SER 882 -2.762 -0.170 10.662
635 HG SER 882 HG SER 882 -0.407 -0.407 11.065
636 H ILE 883 H ILE 883 -2.093 2.946 8.016
637 HA ILE 883 HA ILE 883 0.411 4.321 8.798
638 HB ILE 883 HB ILE 883 -1.148 4.633 6.225
639 HG12 ILE 883 HG12 ILE 883 1.595 3.428 6.686
640 HG13 ILE 883 HG13 ILE 883 0.128 2.477 6.450
641 HG21 ILE 883 HG21 ILE 883 -0.030 6.704 6.982
642 HG22 ILE 883 HG22 ILE 883 0.753 6.040 5.552
643 HG23 ILE 883 HG23 ILE 883 1.488 5.820 7.140
644 HD11 ILE 883 HD11 ILE 883 -0.205 3.476 4.242
645 HD12 ILE 883 HD12 ILE 883 1.411 2.781 4.332
646 HD13 ILE 883 HD13 ILE 883 1.190 4.523 4.480
647 HA PRO 884 HA PRO 884 -2.711 6.891 10.935
648 HB2 PRO 884 HB2 PRO 884 -0.388 8.792 10.729
649 HB3 PRO 884 HB3 PRO 884 -1.463 8.477 12.108
650 HG2 PRO 884 HG2 PRO 884 0.973 7.426 12.022
651 HG3 PRO 884 HG3 PRO 884 -0.398 6.496 12.653
652 HD2 PRO 884 HD2 PRO 884 1.048 6.179 10.059
653 HD3 PRO 884 HD3 PRO 884 0.194 4.959 11.031
654 H LEU 885 H LEU 885 -4.266 8.093 9.985
655 HA LEU 885 HA LEU 885 -4.173 8.866 7.282
656 HB2 LEU 885 HB2 LEU 885 -5.985 10.032 9.404
657 HB3 LEU 885 HB3 LEU 885 -6.292 9.941 7.671
658 HG LEU 885 HG LEU 885 -6.065 7.612 9.592
659 HD11 LEU 885 HD11 LEU 885 -8.434 7.246 8.915
660 HD12 LEU 885 HD12 LEU 885 -8.367 8.731 7.966
661 HD13 LEU 885 HD13 LEU 885 -8.199 8.798 9.721
662 HD21 LEU 885 HD21 LEU 885 -6.204 7.760 6.578
663 HD22 LEU 885 HD22 LEU 885 -6.859 6.364 7.434
664 HD23 LEU 885 HD23 LEU 885 -5.150 6.768 7.586
665 H ALA 886 H ALA 886 -2.828 10.327 10.023
666 HA ALA 886 HA ALA 886 -2.933 13.058 9.093
667 HB1 ALA 886 HB1 ALA 886 -1.006 11.941 11.127
668 HB2 ALA 886 HB2 ALA 886 -2.695 12.255 11.523
669 HB3 ALA 886 HB3 ALA 886 -1.649 13.581 11.012
670 H SER 887 H SER 887 -0.932 10.281 8.598
671 HA SER 887 HA SER 887 1.350 11.804 7.616
672 HB2 SER 887 HB2 SER 887 1.851 9.783 8.810
673 HB3 SER 887 HB3 SER 887 0.770 8.843 7.784
674 HG SER 887 HG SER 887 3.076 8.771 7.250
675 H VAL 888 H VAL 888 -1.567 10.583 6.337
676 HA VAL 888 HA VAL 888 -0.627 11.128 3.599
677 HB VAL 888 HB VAL 888 -2.058 9.109 2.889
678 HG11 VAL 888 HG11 VAL 888 0.584 8.872 4.342
679 HG12 VAL 888 HG12 VAL 888 0.303 8.968 2.605
680 HG13 VAL 888 HG13 VAL 888 -0.142 7.510 3.491
681 HG21 VAL 888 HG21 VAL 888 -1.544 8.370 5.788
682 HG22 VAL 888 HG22 VAL 888 -2.312 7.350 4.572
683 HG23 VAL 888 HG23 VAL 888 -3.118 8.815 5.131
684 H VAL 889 H VAL 889 -2.861 10.624 2.222
685 HA VAL 889 HA VAL 889 -5.108 12.009 3.540
686 HB VAL 889 HB VAL 889 -4.115 12.831 0.807
687 HG11 VAL 889 HG11 VAL 889 -6.000 14.080 2.829
688 HG12 VAL 889 HG12 VAL 889 -6.470 13.304 1.317
689 HG13 VAL 889 HG13 VAL 889 -5.543 14.804 1.287
690 HG21 VAL 889 HG21 VAL 889 -3.542 14.072 3.517
691 HG22 VAL 889 HG22 VAL 889 -3.190 14.840 1.969
692 HG23 VAL 889 HG23 VAL 889 -2.356 13.355 2.426
693 H LEU 890 H LEU 890 -6.965 11.128 3.087
694 HA LEU 890 HA LEU 890 -7.114 8.896 1.234
695 HB2 LEU 890 HB2 LEU 890 -9.212 10.070 3.056
696 HB3 LEU 890 HB3 LEU 890 -9.279 8.499 2.261
697 HG LEU 890 HG LEU 890 -7.138 9.323 4.245
698 HD11 LEU 890 HD11 LEU 890 -9.736 7.819 4.580
699 HD12 LEU 890 HD12 LEU 890 -9.139 9.191 5.509
700 HD13 LEU 890 HD13 LEU 890 -8.393 7.605 5.701
701 HD21 LEU 890 HD21 LEU 890 -7.782 6.777 2.752
702 HD22 LEU 890 HD22 LEU 890 -6.919 6.723 4.289
703 HD23 LEU 890 HD23 LEU 890 -6.227 7.592 2.925
704 HA PRO 891 HA PRO 891 -8.493 11.761 -2.062
705 HB2 PRO 891 HB2 PRO 891 -9.590 9.123 -3.014
706 HB3 PRO 891 HB3 PRO 891 -8.769 10.399 -3.941
707 HG2 PRO 891 HG2 PRO 891 -7.461 8.210 -3.211
708 HG3 PRO 891 HG3 PRO 891 -6.673 9.798 -3.160
709 HD2 PRO 891 HD2 PRO 891 -7.646 8.113 -0.893
710 HD3 PRO 891 HD3 PRO 891 -6.314 9.292 -0.931
711 H SER 892 H SER 892 -10.183 13.022 -1.503
712 HA SER 892 HA SER 892 -12.438 12.316 -0.058
713 HB2 SER 892 HB2 SER 892 -13.477 14.376 -1.128
714 HB3 SER 892 HB3 SER 892 -11.933 14.627 -0.320
715 HG SER 892 HG SER 892 -11.187 14.013 -2.652
716 H ARG 893 H ARG 893 -11.682 11.588 -3.311
717 HA ARG 893 HA ARG 893 -14.395 11.306 -4.251
718 HB2 ARG 893 HB2 ARG 893 -11.860 10.149 -5.430
719 HB3 ARG 893 HB3 ARG 893 -13.402 10.387 -6.252
720 HG2 ARG 893 HG2 ARG 893 -13.178 12.858 -5.760
721 HG3 ARG 893 HG3 ARG 893 -11.536 12.528 -5.202
722 HD2 ARG 893 HD2 ARG 893 -12.655 12.067 -7.976
723 HD3 ARG 893 HD3 ARG 893 -11.387 13.196 -7.513
724 HE ARG 893 HE ARG 893 -11.070 10.380 -8.013
725 HH11 ARG 893 HH11 ARG 893 -9.924 13.114 -6.228
726 HH12 ARG 893 HH12 ARG 893 -8.322 12.485 -6.027
727 HH21 ARG 893 HH21 ARG 893 -8.973 9.548 -7.754
728 HH22 ARG 893 HH22 ARG 893 -7.785 10.466 -6.890
729 H ALA 894 H ALA 894 -14.818 9.993 -2.151
730 HA ALA 894 HA ALA 894 -13.964 7.230 -2.204
731 HB1 ALA 894 HB1 ALA 894 -14.353 8.277 -0.054
732 HB2 ALA 894 HB2 ALA 894 -15.546 6.999 -0.286
733 HB3 ALA 894 HB3 ALA 894 -16.006 8.688 -0.511
734 H GLU 895 H GLU 895 -17.312 8.203 -1.727
735 HA GLU 895 HA GLU 895 -18.282 7.263 -4.240
736 HB2 GLU 895 HB2 GLU 895 -19.419 5.228 -3.423
737 HB3 GLU 895 HB3 GLU 895 -17.664 5.080 -3.315
738 HG2 GLU 895 HG2 GLU 895 -17.876 5.893 -0.906
739 HG3 GLU 895 HG3 GLU 895 -19.614 5.655 -1.076
740 H ARG 896 H ARG 896 -18.849 8.023 -0.861
741 HA ARG 896 HA ARG 896 -21.587 8.207 -0.713
742 HB2 ARG 896 HB2 ARG 896 -20.037 8.678 1.165
743 HB3 ARG 896 HB3 ARG 896 -19.625 10.219 0.413
744 HG2 ARG 896 HG2 ARG 896 -21.852 11.049 0.665
745 HG3 ARG 896 HG3 ARG 896 -22.472 9.451 1.089
746 HD2 ARG 896 HD2 ARG 896 -22.055 11.130 3.017
747 HD3 ARG 896 HD3 ARG 896 -21.455 9.485 3.213
748 HE ARG 896 HE ARG 896 -19.287 10.321 3.137
749 HH11 ARG 896 HH11 ARG 896 -21.572 12.654 1.993
750 HH12 ARG 896 HH12 ARG 896 -20.420 13.945 1.908
751 HH21 ARG 896 HH21 ARG 896 -17.769 12.007 3.027
752 HH22 ARG 896 HH22 ARG 896 -18.268 13.578 2.493
753 H ALA 897 H ALA 897 -23.149 9.539 -1.470
754 HA ALA 897 HA ALA 897 -24.145 11.003 -2.944
755 HB1 ALA 897 HB1 ALA 897 -21.918 12.792 -1.938
756 HB2 ALA 897 HB2 ALA 897 -23.468 12.540 -1.136
757 HB3 ALA 897 HB3 ALA 897 -23.408 13.330 -2.712
758 H ARG 898 H ARG 898 -23.458 12.825 -4.697
759 HA ARG 898 HA ARG 898 -22.723 13.011 -6.874
760 HB2 ARG 898 HB2 ARG 898 -20.097 12.152 -5.638
761 HB3 ARG 898 HB3 ARG 898 -20.314 13.088 -7.117
762 HG2 ARG 898 HG2 ARG 898 -21.359 14.907 -5.831
763 HG3 ARG 898 HG3 ARG 898 -21.177 13.971 -4.347
764 HD2 ARG 898 HD2 ARG 898 -18.887 14.854 -6.126
765 HD3 ARG 898 HD3 ARG 898 -19.366 15.656 -4.633
766 HE ARG 898 HE ARG 898 -17.919 13.155 -4.865
767 HH11 ARG 898 HH11 ARG 898 -19.949 15.178 -2.925
768 HH12 ARG 898 HH12 ARG 898 -19.436 14.488 -1.422
769 HH21 ARG 898 HH21 ARG 898 -17.242 12.245 -2.897
770 HH22 ARG 898 HH22 ARG 898 -17.904 12.828 -1.405
771 H SER 899 H SER 899 -24.004 11.159 -7.541
772 HA SER 899 HA SER 899 -23.006 8.516 -7.608
773 HB2 SER 899 HB2 SER 899 -25.040 9.881 -9.383
774 HB3 SER 899 HB3 SER 899 -24.751 8.144 -9.338
775 HG SER 899 HG SER 899 -25.496 8.075 -7.277
776 H THR 900 H THR 900 -20.914 8.423 -8.385
777 HA THR 900 HA THR 900 -20.018 9.702 -10.754
778 HB THR 900 HB THR 900 -18.130 8.026 -10.597
779 HG1 THR 900 HG1 THR 900 -18.515 6.338 -9.444
780 HG21 THR 900 HG21 THR 900 -17.278 8.957 -8.463
781 HG22 THR 900 HG22 THR 900 -18.898 9.549 -8.090
782 HG23 THR 900 HG23 THR 900 -18.015 10.201 -9.472
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