Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
26096 | 2kes RC | 16156 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 GLY 510 HT1 GLY 510 -33.785 8.564 10.914
2 H2 GLY 510 HT2 GLY 510 -33.280 7.145 11.695
3 H3 GLY 510 HT3 GLY 510 -34.928 7.534 11.617
4 HA2 GLY 510 HA1 GLY 510 -34.287 5.776 10.032
5 HA3 GLY 510 HA2 GLY 510 -35.000 7.195 9.278
6 H SER 511 HN SER 511 -33.783 5.980 7.471
7 HA SER 511 HA SER 511 -32.305 6.292 5.789
8 HB2 SER 511 HB2 SER 511 -32.354 8.695 6.389
9 HB3 SER 511 HB1 SER 511 -31.020 8.427 7.509
10 HG SER 511 HG SER 511 -30.965 7.970 4.699
11 H VAL 512 HN VAL 512 -31.090 5.816 9.011
12 HA VAL 512 HA VAL 512 -28.419 5.268 8.490
13 HB VAL 512 HB VAL 512 -29.144 5.548 10.753
14 HG11 VAL 512 HG11 VAL 512 -30.734 3.008 10.416
15 HG12 VAL 512 HG12 VAL 512 -31.387 4.637 10.591
16 HG13 VAL 512 HG13 VAL 512 -30.512 3.891 11.928
17 HG21 VAL 512 HG21 VAL 512 -27.968 3.774 11.834
18 HG22 VAL 512 HG22 VAL 512 -27.186 4.066 10.277
19 HG23 VAL 512 HG23 VAL 512 -28.263 2.684 10.481
20 H GLU 513 HN GLU 513 -31.202 3.055 8.389
21 HA GLU 513 HA GLU 513 -29.664 0.717 8.043
22 HB2 GLU 513 HB2 GLU 513 -31.703 -0.410 7.501
23 HB3 GLU 513 HB1 GLU 513 -32.001 0.714 8.810
24 HG2 GLU 513 HG2 GLU 513 -32.768 1.074 5.919
25 HG3 GLU 513 HG1 GLU 513 -33.853 0.723 7.262
26 H THR 514 HN THR 514 -31.047 3.009 5.772
27 HA THR 514 HA THR 514 -30.414 1.505 3.440
28 HB THR 514 HB THR 514 -30.984 4.461 3.730
29 HG1 THR 514 HG1 THR 514 -32.673 3.125 4.577
30 HG21 THR 514 HG21 THR 514 -29.983 3.765 1.593
31 HG22 THR 514 HG22 THR 514 -31.623 4.386 1.414
32 HG23 THR 514 HG23 THR 514 -31.324 2.647 1.348
33 H CYS 515 HN CYS 515 -28.970 4.298 5.082
34 HA CYS 515 HA CYS 515 -26.901 4.656 3.176
35 HB2 CYS 515 HB2 CYS 515 -27.707 6.462 4.647
36 HB3 CYS 515 HB1 CYS 515 -27.030 5.619 6.042
37 HG CYS 515 HG CYS 515 -24.988 7.197 5.894
38 H MET 516 HN MET 516 -27.143 2.815 6.176
39 HA MET 516 HA MET 516 -24.418 2.271 6.534
40 HB2 MET 516 HB2 MET 516 -26.056 1.765 8.256
41 HB3 MET 516 HB1 MET 516 -26.820 0.567 7.222
42 HG2 MET 516 HG2 MET 516 -24.825 -0.815 7.312
43 HG3 MET 516 HG1 MET 516 -24.007 0.407 8.285
44 HE1 MET 516 HE1 MET 516 -26.301 1.381 10.228
45 HE2 MET 516 HE2 MET 516 -24.673 1.002 10.792
46 HE3 MET 516 HE3 MET 516 -26.072 0.312 11.614
47 H SER 517 HN SER 517 -26.810 0.796 4.429
48 HA SER 517 HA SER 517 -25.220 -1.427 3.669
49 HB2 SER 517 HB2 SER 517 -27.454 -0.098 2.117
50 HB3 SER 517 HB1 SER 517 -26.866 -1.750 1.916
51 HG SER 517 HG SER 517 -27.445 -1.764 4.368
52 H LEU 518 HN LEU 518 -25.864 1.709 2.085
53 HA LEU 518 HA LEU 518 -24.111 1.191 -0.060
54 HB2 LEU 518 HB2 LEU 518 -24.239 3.687 -0.442
55 HB3 LEU 518 HB1 LEU 518 -25.728 2.780 -0.546
56 HG LEU 518 HG LEU 518 -25.959 3.589 1.980
57 HD11 LEU 518 HD11 LEU 518 -24.023 5.500 0.735
58 HD12 LEU 518 HD12 LEU 518 -24.013 4.786 2.354
59 HD13 LEU 518 HD13 LEU 518 -25.183 6.041 1.948
60 HD21 LEU 518 HD21 LEU 518 -27.289 5.464 1.157
61 HD22 LEU 518 HD22 LEU 518 -27.552 4.012 0.191
62 HD23 LEU 518 HD23 LEU 518 -26.528 5.308 -0.427
63 H ALA 519 HN ALA 519 -23.705 2.872 2.991
64 HA ALA 519 HA ALA 519 -21.121 3.880 2.517
65 HB1 ALA 519 HB1 ALA 519 -20.987 4.101 4.985
66 HB2 ALA 519 HB2 ALA 519 -22.501 3.203 5.106
67 HB3 ALA 519 HB3 ALA 519 -22.470 4.768 4.299
68 H SER 520 HN SER 520 -22.216 0.785 3.903
69 HA SER 520 HA SER 520 -19.625 -0.039 4.690
70 HB2 SER 520 HB2 SER 520 -20.613 -2.340 4.750
71 HB3 SER 520 HB1 SER 520 -21.506 -1.144 5.685
72 HG SER 520 HG SER 520 -23.135 -1.242 4.313
73 H GLN 521 HN GLN 521 -21.464 -0.452 1.676
74 HA GLN 521 HA GLN 521 -19.582 -2.094 0.372
75 HB2 GLN 521 HB2 GLN 521 -21.459 -0.036 -0.790
76 HB3 GLN 521 HB1 GLN 521 -20.533 -1.194 -1.736
77 HG2 GLN 521 HG2 GLN 521 -21.672 -3.021 -0.567
78 HG3 GLN 521 HG1 GLN 521 -22.638 -1.842 0.313
79 HE21 GLN 521 HE21 GLN 521 -21.735 -1.437 -3.030
80 HE22 GLN 521 HE22 GLN 521 -23.314 -1.679 -3.689
81 H VAL 522 HN VAL 522 -19.866 1.447 0.508
82 HA VAL 522 HA VAL 522 -17.551 2.081 -0.938
83 HB VAL 522 HB VAL 522 -18.736 3.569 1.418
84 HG11 VAL 522 HG11 VAL 522 -16.839 4.520 -0.730
85 HG12 VAL 522 HG12 VAL 522 -16.451 4.285 0.974
86 HG13 VAL 522 HG13 VAL 522 -17.596 5.538 0.497
87 HG21 VAL 522 HG21 VAL 522 -20.351 3.256 -0.373
88 HG22 VAL 522 HG22 VAL 522 -19.194 3.884 -1.548
89 HG23 VAL 522 HG23 VAL 522 -19.840 4.944 -0.295
90 H VAL 523 HN VAL 523 -18.029 1.239 2.450
91 HA VAL 523 HA VAL 523 -15.441 1.696 3.384
92 HB VAL 523 HB VAL 523 -17.754 0.038 4.292
93 HG11 VAL 523 HG11 VAL 523 -14.990 -0.114 5.474
94 HG12 VAL 523 HG12 VAL 523 -15.946 -1.427 4.783
95 HG13 VAL 523 HG13 VAL 523 -16.459 -0.663 6.287
96 HG21 VAL 523 HG21 VAL 523 -16.136 2.247 5.555
97 HG22 VAL 523 HG22 VAL 523 -17.542 1.468 6.284
98 HG23 VAL 523 HG23 VAL 523 -17.724 2.408 4.802
99 H LYS 524 HN LYS 524 -16.889 -1.184 1.873
100 HA LYS 524 HA LYS 524 -14.674 -2.887 2.144
101 HB2 LYS 524 HB2 LYS 524 -17.018 -2.760 0.337
102 HB3 LYS 524 HB1 LYS 524 -15.658 -3.729 -0.212
103 HG2 LYS 524 HG2 LYS 524 -17.077 -5.216 0.898
104 HG3 LYS 524 HG1 LYS 524 -15.781 -4.886 2.048
105 HD2 LYS 524 HD2 LYS 524 -17.240 -3.176 3.102
106 HD3 LYS 524 HD1 LYS 524 -18.541 -3.678 2.025
107 HE2 LYS 524 HE2 LYS 524 -17.147 -5.398 4.073
108 HE3 LYS 524 HE1 LYS 524 -18.781 -4.743 4.191
109 HZ1 LYS 524 HZ1 LYS 524 -19.355 -6.038 2.190
110 HZ2 LYS 524 HZ2 LYS 524 -18.890 -7.015 3.497
111 HZ3 LYS 524 HZ3 LYS 524 -17.810 -6.742 2.217
112 H LEU 525 HN LEU 525 -15.496 -0.553 -0.408
113 HA LEU 525 HA LEU 525 -13.252 -1.127 -2.032
114 HB2 LEU 525 HB2 LEU 525 -15.138 1.187 -1.861
115 HB3 LEU 525 HB1 LEU 525 -13.692 1.319 -2.842
116 HG LEU 525 HG LEU 525 -14.459 -0.772 -4.050
117 HD11 LEU 525 HD11 LEU 525 -17.105 -0.126 -2.780
118 HD12 LEU 525 HD12 LEU 525 -16.063 -1.450 -2.267
119 HD13 LEU 525 HD13 LEU 525 -16.734 -1.440 -3.899
120 HD21 LEU 525 HD21 LEU 525 -16.180 1.696 -4.202
121 HD22 LEU 525 HD22 LEU 525 -16.049 0.456 -5.449
122 HD23 LEU 525 HD23 LEU 525 -14.645 1.438 -5.032
123 H THR 526 HN THR 526 -13.796 1.394 0.421
124 HA THR 526 HA THR 526 -11.258 2.595 0.054
125 HB THR 526 HB THR 526 -13.209 3.731 1.154
126 HG1 THR 526 HG1 THR 526 -11.370 4.841 1.464
127 HG21 THR 526 HG21 THR 526 -12.385 2.076 3.543
128 HG22 THR 526 HG22 THR 526 -13.914 1.957 2.669
129 HG23 THR 526 HG23 THR 526 -13.523 3.424 3.565
130 H LYS 527 HN LYS 527 -12.386 -0.042 2.081
131 HA LYS 527 HA LYS 527 -10.098 -0.318 3.693
132 HB2 LYS 527 HB2 LYS 527 -12.166 -1.474 4.224
133 HB3 LYS 527 HB1 LYS 527 -12.079 -2.394 2.733
134 HG2 LYS 527 HG2 LYS 527 -11.431 -3.758 4.617
135 HG3 LYS 527 HG1 LYS 527 -10.054 -3.505 3.542
136 HD2 LYS 527 HD2 LYS 527 -9.363 -3.278 5.855
137 HD3 LYS 527 HD1 LYS 527 -9.245 -1.722 5.038
138 HE2 LYS 527 HE2 LYS 527 -11.438 -1.098 6.008
139 HE3 LYS 527 HE1 LYS 527 -11.446 -2.625 6.894
140 HZ1 LYS 527 HZ1 LYS 527 -9.372 -1.927 7.978
141 HZ2 LYS 527 HZ2 LYS 527 -10.651 -0.857 8.299
142 HZ3 LYS 527 HZ3 LYS 527 -9.455 -0.436 7.172
143 H GLN 528 HN GLN 528 -10.982 -1.846 0.605
144 HA GLN 528 HA GLN 528 -8.603 -3.342 0.340
145 HB2 GLN 528 HB2 GLN 528 -10.503 -2.364 -1.797
146 HB3 GLN 528 HB1 GLN 528 -9.241 -3.562 -2.043
147 HG2 GLN 528 HG2 GLN 528 -10.345 -4.990 -0.338
148 HG3 GLN 528 HG1 GLN 528 -11.659 -3.817 -0.271
149 HE21 GLN 528 HE21 GLN 528 -9.957 -4.599 -3.206
150 HE22 GLN 528 HE22 GLN 528 -11.251 -5.459 -3.973
151 H LEU 529 HN LEU 529 -9.500 -0.092 -0.714
152 HA LEU 529 HA LEU 529 -7.209 0.491 -2.227
153 HB2 LEU 529 HB2 LEU 529 -8.938 2.273 -0.521
154 HB3 LEU 529 HB1 LEU 529 -7.703 2.869 -1.606
155 HG LEU 529 HG LEU 529 -10.102 1.269 -2.483
156 HD11 LEU 529 HD11 LEU 529 -9.633 4.229 -2.740
157 HD12 LEU 529 HD12 LEU 529 -10.613 3.490 -1.475
158 HD13 LEU 529 HD13 LEU 529 -11.088 3.324 -3.168
159 HD21 LEU 529 HD21 LEU 529 -8.193 1.084 -3.987
160 HD22 LEU 529 HD22 LEU 529 -8.045 2.841 -4.032
161 HD23 LEU 529 HD23 LEU 529 -9.471 2.058 -4.714
162 H LYS 530 HN LYS 530 -7.902 0.946 1.213
163 HA LYS 530 HA LYS 530 -5.389 2.034 1.885
164 HB2 LYS 530 HB2 LYS 530 -7.434 0.574 3.553
165 HB3 LYS 530 HB1 LYS 530 -5.976 1.284 4.231
166 HG2 LYS 530 HG2 LYS 530 -8.138 2.782 2.757
167 HG3 LYS 530 HG1 LYS 530 -7.907 2.750 4.506
168 HD2 LYS 530 HD2 LYS 530 -5.749 3.820 4.278
169 HD3 LYS 530 HD1 LYS 530 -5.871 3.758 2.520
170 HE2 LYS 530 HE2 LYS 530 -6.396 5.986 3.308
171 HE3 LYS 530 HE1 LYS 530 -7.835 5.234 2.625
172 HZ1 LYS 530 HZ1 LYS 530 -8.170 6.457 4.760
173 HZ2 LYS 530 HZ2 LYS 530 -7.255 5.258 5.538
174 HZ3 LYS 530 HZ3 LYS 530 -8.712 4.850 4.771
175 H GLU 531 HN GLU 531 -6.574 -1.314 1.859
176 HA GLU 531 HA GLU 531 -4.283 -2.471 3.005
177 HB2 GLU 531 HB2 GLU 531 -6.277 -3.653 1.068
178 HB3 GLU 531 HB1 GLU 531 -5.048 -4.581 1.916
179 HG2 GLU 531 HG2 GLU 531 -6.045 -3.812 4.060
180 HG3 GLU 531 HG1 GLU 531 -7.346 -3.070 3.129
181 H GLN 532 HN GLN 532 -5.131 -1.924 -0.419
182 HA GLN 532 HA GLN 532 -2.783 -3.027 -1.502
183 HB2 GLN 532 HB2 GLN 532 -4.715 -2.461 -2.897
184 HB3 GLN 532 HB1 GLN 532 -4.467 -0.750 -2.575
185 HG2 GLN 532 HG2 GLN 532 -2.242 -0.927 -3.661
186 HG3 GLN 532 HG1 GLN 532 -2.626 -2.591 -4.089
187 HE21 GLN 532 HE21 GLN 532 -4.988 -0.015 -4.104
188 HE22 GLN 532 HE22 GLN 532 -5.195 0.044 -5.824
189 H THR 533 HN THR 533 -3.506 0.173 -0.240
190 HA THR 533 HA THR 533 -1.081 1.368 -1.110
191 HB THR 533 HB THR 533 -2.867 2.280 1.153
192 HG1 THR 533 HG1 THR 533 -4.172 2.216 -0.634
193 HG21 THR 533 HG21 THR 533 -0.583 3.309 0.938
194 HG22 THR 533 HG22 THR 533 -1.925 4.444 0.783
195 HG23 THR 533 HG23 THR 533 -1.069 3.888 -0.655
196 H VAL 534 HN VAL 534 -2.133 0.001 2.032
197 HA VAL 534 HA VAL 534 0.191 0.758 3.415
198 HB VAL 534 HB VAL 534 -0.416 -0.885 5.139
199 HG11 VAL 534 HG11 VAL 534 -2.520 0.134 5.781
200 HG12 VAL 534 HG12 VAL 534 -2.769 0.704 4.131
201 HG13 VAL 534 HG13 VAL 534 -1.436 1.345 5.094
202 HG21 VAL 534 HG21 VAL 534 -2.395 -2.250 4.952
203 HG22 VAL 534 HG22 VAL 534 -1.283 -2.641 3.641
204 HG23 VAL 534 HG23 VAL 534 -2.700 -1.643 3.326
205 H GLU 535 HN GLU 535 -0.542 -2.236 1.629
206 HA GLU 535 HA GLU 535 1.916 -3.469 2.369
207 HB2 GLU 535 HB2 GLU 535 1.417 -5.095 0.602
208 HB3 GLU 535 HB1 GLU 535 0.025 -4.823 1.635
209 HG2 GLU 535 HG2 GLU 535 -1.054 -3.514 -0.022
210 HG3 GLU 535 HG1 GLU 535 0.406 -3.456 -1.007
211 H ARG 536 HN ARG 536 0.874 -1.452 -0.316
212 HA ARG 536 HA ARG 536 3.228 -1.756 -1.859
213 HB2 ARG 536 HB2 ARG 536 1.196 -1.019 -2.908
214 HB3 ARG 536 HB1 ARG 536 1.110 0.390 -1.861
215 HG2 ARG 536 HG2 ARG 536 3.596 0.226 -3.375
216 HG3 ARG 536 HG1 ARG 536 2.152 0.329 -4.388
217 HD2 ARG 536 HD2 ARG 536 2.712 2.168 -2.076
218 HD3 ARG 536 HD1 ARG 536 3.167 2.535 -3.743
219 HE ARG 536 HE ARG 536 0.478 1.917 -3.816
220 HH11 ARG 536 HH11 ARG 536 2.503 4.321 -2.283
221 HH12 ARG 536 HH12 ARG 536 1.248 5.521 -2.206
222 HH21 ARG 536 HH21 ARG 536 -1.181 3.490 -3.727
223 HH22 ARG 536 HH22 ARG 536 -0.849 5.046 -3.019
224 H VAL 537 HN VAL 537 2.222 0.715 0.498
225 HA VAL 537 HA VAL 537 4.566 2.281 0.198
226 HB VAL 537 HB VAL 537 3.992 3.365 2.306
227 HG11 VAL 537 HG11 VAL 537 1.741 4.151 1.706
228 HG12 VAL 537 HG12 VAL 537 1.601 2.810 0.568
229 HG13 VAL 537 HG13 VAL 537 2.817 4.061 0.310
230 HG21 VAL 537 HG21 VAL 537 2.202 2.660 3.718
231 HG22 VAL 537 HG22 VAL 537 3.261 1.265 3.478
232 HG23 VAL 537 HG23 VAL 537 1.739 1.385 2.592
233 H THR 538 HN THR 538 3.705 -0.380 2.316
234 HA THR 538 HA THR 538 6.076 -0.419 3.834
235 HB THR 538 HB THR 538 4.127 -2.621 3.156
236 HG1 THR 538 HG1 THR 538 3.028 -1.308 4.445
237 HG21 THR 538 HG21 THR 538 6.255 -3.590 3.802
238 HG22 THR 538 HG22 THR 538 5.061 -3.830 5.077
239 HG23 THR 538 HG23 THR 538 6.301 -2.586 5.248
240 H LEU 539 HN LEU 539 5.195 -1.930 0.750
241 HA LEU 539 HA LEU 539 7.555 -3.445 0.423
242 HB2 LEU 539 HB2 LEU 539 5.539 -3.890 -0.870
243 HB3 LEU 539 HB1 LEU 539 5.602 -2.292 -1.580
244 HG LEU 539 HG LEU 539 6.322 -4.315 -2.999
245 HD11 LEU 539 HD11 LEU 539 8.415 -2.754 -3.712
246 HD12 LEU 539 HD12 LEU 539 7.435 -1.628 -2.758
247 HD13 LEU 539 HD13 LEU 539 6.732 -2.447 -4.153
248 HD21 LEU 539 HD21 LEU 539 7.830 -5.307 -1.333
249 HD22 LEU 539 HD22 LEU 539 8.859 -3.878 -1.431
250 HD23 LEU 539 HD23 LEU 539 8.666 -4.923 -2.838
251 H GLN 540 HN GLN 540 6.601 -0.209 -0.701
252 HA GLN 540 HA GLN 540 9.071 0.476 -1.862
253 HB2 GLN 540 HB2 GLN 540 6.977 2.254 -0.613
254 HB3 GLN 540 HB1 GLN 540 8.319 2.818 -1.597
255 HG2 GLN 540 HG2 GLN 540 6.183 0.930 -2.518
256 HG3 GLN 540 HG1 GLN 540 6.213 2.661 -2.852
257 HE21 GLN 540 HE21 GLN 540 6.230 0.399 -4.690
258 HE22 GLN 540 HE22 GLN 540 7.659 0.564 -5.649
259 H ASN 541 HN ASN 541 7.913 0.583 1.436
260 HA ASN 541 HA ASN 541 10.067 2.005 2.585
261 HB2 ASN 541 HB2 ASN 541 7.961 1.530 3.791
262 HB3 ASN 541 HB1 ASN 541 8.365 -0.182 3.810
263 HD21 ASN 541 HD21 ASN 541 9.055 2.937 5.141
264 HD22 ASN 541 HD22 ASN 541 10.030 2.384 6.461
265 H GLN 542 HN GLN 542 9.542 -1.452 1.993
266 HA GLN 542 HA GLN 542 12.015 -2.362 2.988
267 HB2 GLN 542 HB2 GLN 542 10.294 -3.503 0.774
268 HB3 GLN 542 HB1 GLN 542 11.622 -4.350 1.556
269 HG2 GLN 542 HG2 GLN 542 10.436 -4.289 3.671
270 HG3 GLN 542 HG1 GLN 542 9.121 -3.385 2.918
271 HE21 GLN 542 HE21 GLN 542 10.710 -6.461 3.168
272 HE22 GLN 542 HE22 GLN 542 9.459 -7.399 2.425
273 H LEU 543 HN LEU 543 10.992 -1.187 -0.173
274 HA LEU 543 HA LEU 543 13.473 -1.602 -1.478
275 HB2 LEU 543 HB2 LEU 543 11.245 -1.201 -2.579
276 HB3 LEU 543 HB1 LEU 543 11.398 0.489 -2.141
277 HG LEU 543 HG LEU 543 13.608 -0.758 -3.707
278 HD11 LEU 543 HD11 LEU 543 10.969 0.107 -4.889
279 HD12 LEU 543 HD12 LEU 543 11.605 -1.538 -4.852
280 HD13 LEU 543 HD13 LEU 543 12.424 -0.298 -5.799
281 HD21 LEU 543 HD21 LEU 543 13.645 1.494 -4.723
282 HD22 LEU 543 HD22 LEU 543 13.846 1.534 -2.972
283 HD23 LEU 543 HD23 LEU 543 12.292 1.959 -3.690
284 H GLN 544 HN GLN 544 12.170 1.012 0.475
285 HA GLN 544 HA GLN 544 14.218 2.882 0.074
286 HB2 GLN 544 HB2 GLN 544 12.163 3.503 1.194
287 HB3 GLN 544 HB1 GLN 544 12.466 2.342 2.479
288 HG2 GLN 544 HG2 GLN 544 14.492 3.623 3.067
289 HG3 GLN 544 HG1 GLN 544 14.013 4.845 1.894
290 HE21 GLN 544 HE21 GLN 544 11.163 4.426 2.512
291 HE22 GLN 544 HE22 GLN 544 10.894 5.216 4.026
292 H GLN 545 HN GLN 545 13.828 0.295 2.478
293 HA GLN 545 HA GLN 545 16.318 0.570 3.744
294 HB2 GLN 545 HB2 GLN 545 14.784 -1.992 3.255
295 HB3 GLN 545 HB1 GLN 545 16.013 -1.736 4.482
296 HG2 GLN 545 HG2 GLN 545 14.584 -0.134 5.610
297 HG3 GLN 545 HG1 GLN 545 13.358 -0.325 4.356
298 HE21 GLN 545 HE21 GLN 545 11.791 -1.051 5.772
299 HE22 GLN 545 HE22 GLN 545 11.865 -2.614 6.527
300 H PHE 546 HN PHE 546 15.333 -1.052 0.804
301 HA PHE 546 HA PHE 546 17.743 -2.450 0.324
302 HB2 PHE 546 HB2 PHE 546 16.063 -3.361 -0.912
303 HB3 PHE 546 HB1 PHE 546 15.258 -1.814 -1.154
304 HD1 PHE 546 HD1 PHE 546 18.146 -3.855 -2.312
305 HD2 PHE 546 HD2 PHE 546 15.429 -0.696 -3.163
306 HE1 PHE 546 HE1 PHE 546 18.962 -3.783 -4.634
307 HE2 PHE 546 HE2 PHE 546 16.234 -0.613 -5.480
308 HZ PHE 546 HZ PHE 546 18.004 -2.158 -6.222
309 H LEU 547 HN LEU 547 16.487 0.623 -1.015
310 HA LEU 547 HA LEU 547 18.811 1.190 -2.492
311 HB2 LEU 547 HB2 LEU 547 17.914 3.375 -2.834
312 HB3 LEU 547 HB1 LEU 547 16.602 2.226 -2.887
313 HG LEU 547 HG LEU 547 16.281 2.937 -0.369
314 HD11 LEU 547 HD11 LEU 547 17.595 5.371 -1.574
315 HD12 LEU 547 HD12 LEU 547 18.258 4.376 -0.278
316 HD13 LEU 547 HD13 LEU 547 16.776 5.296 -0.013
317 HD21 LEU 547 HD21 LEU 547 14.640 3.189 -2.169
318 HD22 LEU 547 HD22 LEU 547 15.448 4.667 -2.696
319 HD23 LEU 547 HD23 LEU 547 14.669 4.602 -1.115
320 H GLU 548 HN GLU 548 17.827 1.972 0.786
321 HA GLU 548 HA GLU 548 20.010 3.540 1.521
322 HB2 GLU 548 HB2 GLU 548 18.070 1.837 2.985
323 HB3 GLU 548 HB1 GLU 548 19.542 2.288 3.837
324 HG2 GLU 548 HG2 GLU 548 17.632 4.215 2.544
325 HG3 GLU 548 HG1 GLU 548 17.684 3.829 4.266
326 H ALA 549 HN ALA 549 19.628 0.005 1.640
327 HA ALA 549 HA ALA 549 22.158 -0.585 2.695
328 HB1 ALA 549 HB1 ALA 549 21.838 -2.825 1.757
329 HB2 ALA 549 HB2 ALA 549 20.494 -2.228 0.784
330 HB3 ALA 549 HB3 ALA 549 20.373 -2.242 2.544
331 H GLN 550 HN GLN 550 21.101 0.049 -0.597
332 HA GLN 550 HA GLN 550 23.552 -0.605 -1.867
333 HB2 GLN 550 HB2 GLN 550 21.409 1.333 -2.762
334 HB3 GLN 550 HB1 GLN 550 22.670 0.654 -3.780
335 HG2 GLN 550 HG2 GLN 550 20.417 -0.839 -2.461
336 HG3 GLN 550 HG1 GLN 550 20.584 -0.476 -4.177
337 HE21 GLN 550 HE21 GLN 550 23.444 -1.029 -4.211
338 HE22 GLN 550 HE22 GLN 550 23.599 -2.756 -4.133
339 H LYS 551 HN LYS 551 22.169 2.450 -0.712
340 HA LYS 551 HA LYS 551 24.396 4.021 -1.510
341 HB2 LYS 551 HB2 LYS 551 23.067 5.771 -1.006
342 HB3 LYS 551 HB1 LYS 551 21.816 4.541 -0.937
343 HG2 LYS 551 HG2 LYS 551 21.412 5.525 1.046
344 HG3 LYS 551 HG1 LYS 551 22.672 4.398 1.560
345 HD2 LYS 551 HD2 LYS 551 24.332 6.177 1.094
346 HD3 LYS 551 HD1 LYS 551 22.986 7.303 0.873
347 HE2 LYS 551 HE2 LYS 551 23.482 5.656 3.323
348 HE3 LYS 551 HE1 LYS 551 23.965 7.343 3.156
349 HZ1 LYS 551 HZ1 LYS 551 21.165 6.319 3.036
350 HZ2 LYS 551 HZ2 LYS 551 21.631 7.941 2.874
351 HZ3 LYS 551 HZ3 LYS 551 21.868 7.138 4.348
352 H SER 552 HN SER 552 23.655 2.103 1.226
353 HA SER 552 HA SER 552 25.567 3.200 3.005
354 HB2 SER 552 HB2 SER 552 24.441 0.399 2.805
355 HB3 SER 552 HB1 SER 552 25.438 0.980 4.142
356 HG SER 552 HG SER 552 22.970 2.143 3.328
357 H GLU 553 HN GLU 553 25.779 1.011 0.304
358 HA GLU 553 HA GLU 553 28.536 0.327 0.803
359 HB2 GLU 553 HB2 GLU 553 26.793 -0.049 -1.636
360 HB3 GLU 553 HB1 GLU 553 28.418 -0.696 -1.455
361 HG2 GLU 553 HG2 GLU 553 26.145 -1.348 0.392
362 HG3 GLU 553 HG1 GLU 553 26.583 -2.322 -1.012
363 H GLY 554 HN GLY 554 26.708 2.588 -1.150
364 HA2 GLY 554 HA2 GLY 554 28.893 3.590 -2.663
365 HA3 GLY 554 HA1 GLY 554 27.337 4.375 -2.447
366 H LYS 555 HN LYS 555 27.540 4.441 0.459
367 HA LYS 555 HA LYS 555 29.108 6.834 0.738
368 HB2 LYS 555 HB2 LYS 555 28.184 7.000 2.917
369 HB3 LYS 555 HB1 LYS 555 26.913 6.375 1.882
370 HG2 LYS 555 HG2 LYS 555 27.425 4.094 2.706
371 HG3 LYS 555 HG1 LYS 555 28.580 4.809 3.832
372 HD2 LYS 555 HD2 LYS 555 26.759 6.138 4.822
373 HD3 LYS 555 HD1 LYS 555 25.616 5.365 3.723
374 HE2 LYS 555 HE2 LYS 555 26.247 3.170 4.687
375 HE3 LYS 555 HE1 LYS 555 27.271 4.012 5.849
376 HZ1 LYS 555 HZ1 LYS 555 24.323 4.287 5.585
377 HZ2 LYS 555 HZ2 LYS 555 25.285 5.170 6.665
378 HZ3 LYS 555 HZ3 LYS 555 25.149 3.490 6.831
379 H SER 556 HN SER 556 29.840 3.616 0.844
380 HA SER 556 HA SER 556 32.001 3.925 2.790
381 HB2 SER 556 HB2 SER 556 30.486 1.923 2.929
382 HB3 SER 556 HB1 SER 556 31.103 1.410 1.359
383 HG SER 556 HG SER 556 32.498 0.405 2.608
384 H LEU 557 HN LEU 557 34.129 3.069 2.187
385 HA LEU 557 HA LEU 557 34.719 3.535 -0.658
386 HB2 LEU 557 HB2 LEU 557 36.479 4.049 1.747
387 HB3 LEU 557 HB1 LEU 557 36.979 4.240 0.079
388 HG LEU 557 HG LEU 557 34.833 5.852 1.466
389 HD11 LEU 557 HD11 LEU 557 37.050 6.410 2.266
390 HD12 LEU 557 HD12 LEU 557 36.438 7.701 1.233
391 HD13 LEU 557 HD13 LEU 557 37.634 6.565 0.610
392 HD21 LEU 557 HD21 LEU 557 35.990 6.090 -1.310
393 HD22 LEU 557 HD22 LEU 557 34.860 7.220 -0.564
394 HD23 LEU 557 HD23 LEU 557 34.354 5.566 -0.907
Start of MODEL 2
1 H1 GLY 510 HT1 GLY 510 -35.298 9.846 -6.736
2 H2 GLY 510 HT2 GLY 510 -34.289 11.167 -7.071
3 H3 GLY 510 HT3 GLY 510 -35.585 11.343 -5.992
4 HA2 GLY 510 HA1 GLY 510 -33.466 11.179 -4.822
5 HA3 GLY 510 HA2 GLY 510 -34.553 9.853 -4.429
6 H SER 511 HN SER 511 -32.104 9.285 -3.822
7 HA SER 511 HA SER 511 -31.426 7.213 -5.721
8 HB2 SER 511 HB2 SER 511 -29.407 9.365 -5.014
9 HB3 SER 511 HB1 SER 511 -29.024 7.855 -5.845
10 HG SER 511 HG SER 511 -31.082 9.032 -7.080
11 H VAL 512 HN VAL 512 -32.107 5.901 -3.995
12 HA VAL 512 HA VAL 512 -30.357 5.904 -1.616
13 HB VAL 512 HB VAL 512 -33.007 4.492 -1.949
14 HG11 VAL 512 HG11 VAL 512 -31.712 5.150 0.656
15 HG12 VAL 512 HG12 VAL 512 -31.145 3.768 -0.272
16 HG13 VAL 512 HG13 VAL 512 -32.830 3.843 0.254
17 HG21 VAL 512 HG21 VAL 512 -33.327 6.914 -2.034
18 HG22 VAL 512 HG22 VAL 512 -32.401 7.095 -0.543
19 HG23 VAL 512 HG23 VAL 512 -33.949 6.249 -0.522
20 H GLU 513 HN GLU 513 -32.025 3.708 -3.835
21 HA GLU 513 HA GLU 513 -30.548 1.412 -3.124
22 HB2 GLU 513 HB2 GLU 513 -31.524 0.385 -5.112
23 HB3 GLU 513 HB1 GLU 513 -32.731 1.246 -4.175
24 HG2 GLU 513 HG2 GLU 513 -31.401 2.365 -6.633
25 HG3 GLU 513 HG1 GLU 513 -32.926 1.485 -6.655
26 H THR 514 HN THR 514 -30.180 3.844 -5.653
27 HA THR 514 HA THR 514 -27.990 2.590 -6.949
28 HB THR 514 HB THR 514 -27.610 5.128 -7.644
29 HG1 THR 514 HG1 THR 514 -30.291 5.493 -7.463
30 HG21 THR 514 HG21 THR 514 -29.960 3.492 -8.564
31 HG22 THR 514 HG22 THR 514 -28.304 3.314 -9.137
32 HG23 THR 514 HG23 THR 514 -29.195 4.801 -9.462
33 H CYS 515 HN CYS 515 -28.218 5.167 -4.518
34 HA CYS 515 HA CYS 515 -25.464 5.668 -4.325
35 HB2 CYS 515 HB2 CYS 515 -27.076 7.242 -3.429
36 HB3 CYS 515 HB1 CYS 515 -27.642 6.047 -2.262
37 HG CYS 515 HG CYS 515 -25.410 8.311 -1.811
38 H MET 516 HN MET 516 -27.560 3.383 -2.604
39 HA MET 516 HA MET 516 -25.617 2.493 -0.775
40 HB2 MET 516 HB2 MET 516 -28.019 1.981 -0.558
41 HB3 MET 516 HB1 MET 516 -27.913 0.926 -1.960
42 HG2 MET 516 HG2 MET 516 -26.417 -0.555 -0.787
43 HG3 MET 516 HG1 MET 516 -26.382 0.537 0.598
44 HE1 MET 516 HE1 MET 516 -29.461 1.474 0.586
45 HE2 MET 516 HE2 MET 516 -28.568 1.105 2.062
46 HE3 MET 516 HE3 MET 516 -30.143 0.362 1.774
47 H SER 517 HN SER 517 -26.415 1.434 -4.051
48 HA SER 517 HA SER 517 -24.667 -0.784 -4.075
49 HB2 SER 517 HB2 SER 517 -26.501 -0.585 -5.676
50 HB3 SER 517 HB1 SER 517 -25.766 0.861 -6.368
51 HG SER 517 HG SER 517 -24.438 -0.337 -7.470
52 H LEU 518 HN LEU 518 -24.257 2.564 -5.288
53 HA LEU 518 HA LEU 518 -21.626 2.093 -6.180
54 HB2 LEU 518 HB2 LEU 518 -21.410 4.612 -6.159
55 HB3 LEU 518 HB1 LEU 518 -22.619 3.916 -7.210
56 HG LEU 518 HG LEU 518 -24.227 4.471 -5.199
57 HD11 LEU 518 HD11 LEU 518 -21.803 6.131 -4.656
58 HD12 LEU 518 HD12 LEU 518 -22.865 5.284 -3.524
59 HD13 LEU 518 HD13 LEU 518 -23.409 6.769 -4.309
60 HD21 LEU 518 HD21 LEU 518 -23.150 6.600 -7.040
61 HD22 LEU 518 HD22 LEU 518 -24.727 6.593 -6.249
62 HD23 LEU 518 HD23 LEU 518 -24.350 5.382 -7.476
63 H ALA 519 HN ALA 519 -22.893 3.341 -3.145
64 HA ALA 519 HA ALA 519 -20.442 4.105 -1.998
65 HB1 ALA 519 HB1 ALA 519 -21.638 3.916 0.173
66 HB2 ALA 519 HB2 ALA 519 -23.003 3.207 -0.692
67 HB3 ALA 519 HB3 ALA 519 -22.505 4.861 -1.036
68 H SER 520 HN SER 520 -22.170 1.003 -1.948
69 HA SER 520 HA SER 520 -20.379 -0.327 -0.227
70 HB2 SER 520 HB2 SER 520 -22.094 -1.488 -2.442
71 HB3 SER 520 HB1 SER 520 -21.344 -2.401 -1.131
72 HG SER 520 HG SER 520 -23.516 -0.623 -1.066
73 H GLN 521 HN GLN 521 -20.418 0.072 -3.751
74 HA GLN 521 HA GLN 521 -18.116 -1.488 -4.242
75 HB2 GLN 521 HB2 GLN 521 -19.336 0.777 -5.810
76 HB3 GLN 521 HB1 GLN 521 -17.973 -0.181 -6.365
77 HG2 GLN 521 HG2 GLN 521 -20.605 -1.391 -5.613
78 HG3 GLN 521 HG1 GLN 521 -20.224 -0.855 -7.247
79 HE21 GLN 521 HE21 GLN 521 -20.481 -2.984 -7.993
80 HE22 GLN 521 HE22 GLN 521 -19.257 -4.189 -7.732
81 H VAL 522 HN VAL 522 -18.561 1.939 -3.507
82 HA VAL 522 HA VAL 522 -15.861 2.707 -3.633
83 HB VAL 522 HB VAL 522 -18.056 3.765 -1.834
84 HG11 VAL 522 HG11 VAL 522 -15.364 4.967 -2.479
85 HG12 VAL 522 HG12 VAL 522 -15.876 4.333 -0.914
86 HG13 VAL 522 HG13 VAL 522 -16.657 5.765 -1.585
87 HG21 VAL 522 HG21 VAL 522 -18.203 5.575 -3.481
88 HG22 VAL 522 HG22 VAL 522 -18.535 4.005 -4.213
89 HG23 VAL 522 HG23 VAL 522 -16.970 4.777 -4.461
90 H VAL 523 HN VAL 523 -17.782 1.261 -1.053
91 HA VAL 523 HA VAL 523 -15.832 1.252 0.957
92 HB VAL 523 HB VAL 523 -18.360 -0.232 0.431
93 HG11 VAL 523 HG11 VAL 523 -16.325 -1.056 2.483
94 HG12 VAL 523 HG12 VAL 523 -17.110 -2.041 1.246
95 HG13 VAL 523 HG13 VAL 523 -18.044 -1.443 2.616
96 HG21 VAL 523 HG21 VAL 523 -17.353 1.403 2.755
97 HG22 VAL 523 HG22 VAL 523 -18.979 0.742 2.587
98 HG23 VAL 523 HG23 VAL 523 -18.408 1.971 1.460
99 H LYS 524 HN LYS 524 -16.596 -1.134 -1.574
100 HA LYS 524 HA LYS 524 -14.628 -3.022 -0.817
101 HB2 LYS 524 HB2 LYS 524 -16.252 -2.501 -3.241
102 HB3 LYS 524 HB1 LYS 524 -14.802 -3.470 -3.467
103 HG2 LYS 524 HG2 LYS 524 -16.649 -4.932 -3.123
104 HG3 LYS 524 HG1 LYS 524 -15.649 -4.981 -1.669
105 HD2 LYS 524 HD2 LYS 524 -17.166 -3.320 -0.643
106 HD3 LYS 524 HD1 LYS 524 -18.199 -3.432 -2.064
107 HE2 LYS 524 HE2 LYS 524 -17.477 -5.771 -0.306
108 HE3 LYS 524 HE1 LYS 524 -18.962 -4.833 -0.151
109 HZ1 LYS 524 HZ1 LYS 524 -19.296 -6.847 -1.450
110 HZ2 LYS 524 HZ2 LYS 524 -18.127 -6.343 -2.570
111 HZ3 LYS 524 HZ3 LYS 524 -19.565 -5.462 -2.392
112 H LEU 525 HN LEU 525 -14.576 -0.260 -3.022
113 HA LEU 525 HA LEU 525 -11.944 -0.612 -3.945
114 HB2 LEU 525 HB2 LEU 525 -13.910 1.594 -3.923
115 HB3 LEU 525 HB1 LEU 525 -12.230 2.065 -4.099
116 HG LEU 525 HG LEU 525 -12.000 0.826 -6.125
117 HD11 LEU 525 HD11 LEU 525 -14.202 -0.322 -6.977
118 HD12 LEU 525 HD12 LEU 525 -14.526 -0.458 -5.242
119 HD13 LEU 525 HD13 LEU 525 -13.072 -1.179 -5.931
120 HD21 LEU 525 HD21 LEU 525 -14.646 2.268 -6.098
121 HD22 LEU 525 HD22 LEU 525 -13.725 1.854 -7.543
122 HD23 LEU 525 HD23 LEU 525 -13.059 2.992 -6.371
123 H THR 526 HN THR 526 -13.234 1.352 -1.268
124 HA THR 526 HA THR 526 -10.717 2.395 -0.520
125 HB THR 526 HB THR 526 -12.934 3.356 0.211
126 HG1 THR 526 HG1 THR 526 -10.806 2.858 2.022
127 HG21 THR 526 HG21 THR 526 -12.810 1.083 2.199
128 HG22 THR 526 HG22 THR 526 -14.066 1.373 0.988
129 HG23 THR 526 HG23 THR 526 -13.868 2.488 2.340
130 H LYS 527 HN LYS 527 -12.423 -0.551 0.361
131 HA LYS 527 HA LYS 527 -10.701 -1.389 2.424
132 HB2 LYS 527 HB2 LYS 527 -12.768 -2.500 2.201
133 HB3 LYS 527 HB1 LYS 527 -12.510 -2.825 0.499
134 HG2 LYS 527 HG2 LYS 527 -12.342 -4.825 1.902
135 HG3 LYS 527 HG1 LYS 527 -10.849 -4.487 1.025
136 HD2 LYS 527 HD2 LYS 527 -10.469 -5.158 3.372
137 HD3 LYS 527 HD1 LYS 527 -9.848 -3.553 3.002
138 HE2 LYS 527 HE2 LYS 527 -11.754 -2.523 4.059
139 HE3 LYS 527 HE1 LYS 527 -12.498 -4.104 4.326
140 HZ1 LYS 527 HZ1 LYS 527 -11.154 -2.948 6.217
141 HZ2 LYS 527 HZ2 LYS 527 -9.812 -3.609 5.407
142 HZ3 LYS 527 HZ3 LYS 527 -11.038 -4.626 5.984
143 H GLN 528 HN GLN 528 -10.704 -2.073 -1.052
144 HA GLN 528 HA GLN 528 -8.386 -3.699 -0.959
145 HB2 GLN 528 HB2 GLN 528 -10.149 -3.772 -2.735
146 HB3 GLN 528 HB1 GLN 528 -9.533 -2.241 -3.345
147 HG2 GLN 528 HG2 GLN 528 -7.376 -3.282 -3.793
148 HG3 GLN 528 HG1 GLN 528 -7.983 -4.814 -3.170
149 HE21 GLN 528 HE21 GLN 528 -10.633 -4.367 -4.358
150 HE22 GLN 528 HE22 GLN 528 -10.450 -4.667 -6.053
151 H LEU 529 HN LEU 529 -8.940 -0.314 -1.888
152 HA LEU 529 HA LEU 529 -6.283 0.152 -2.764
153 HB2 LEU 529 HB2 LEU 529 -8.461 2.043 -1.902
154 HB3 LEU 529 HB1 LEU 529 -6.949 2.557 -2.615
155 HG LEU 529 HG LEU 529 -8.908 0.732 -4.004
156 HD11 LEU 529 HD11 LEU 529 -8.520 3.677 -4.469
157 HD12 LEU 529 HD12 LEU 529 -9.786 3.017 -3.435
158 HD13 LEU 529 HD13 LEU 529 -9.756 2.619 -5.157
159 HD21 LEU 529 HD21 LEU 529 -6.581 0.595 -4.782
160 HD22 LEU 529 HD22 LEU 529 -6.574 2.340 -5.038
161 HD23 LEU 529 HD23 LEU 529 -7.642 1.314 -5.995
162 H LYS 530 HN LYS 530 -7.968 0.967 0.270
163 HA LYS 530 HA LYS 530 -5.844 2.386 1.428
164 HB2 LYS 530 HB2 LYS 530 -8.158 2.424 2.313
165 HB3 LYS 530 HB1 LYS 530 -7.953 0.770 2.871
166 HG2 LYS 530 HG2 LYS 530 -7.661 2.230 4.733
167 HG3 LYS 530 HG1 LYS 530 -6.084 1.555 4.315
168 HD2 LYS 530 HD2 LYS 530 -5.658 3.647 2.989
169 HD3 LYS 530 HD1 LYS 530 -7.137 4.306 3.693
170 HE2 LYS 530 HE2 LYS 530 -6.175 3.928 5.941
171 HE3 LYS 530 HE1 LYS 530 -4.676 3.397 5.178
172 HZ1 LYS 530 HZ1 LYS 530 -4.297 5.626 5.626
173 HZ2 LYS 530 HZ2 LYS 530 -5.876 6.092 5.221
174 HZ3 LYS 530 HZ3 LYS 530 -4.785 5.660 4.000
175 H GLU 531 HN GLU 531 -6.749 -1.050 1.758
176 HA GLU 531 HA GLU 531 -4.519 -1.608 3.432
177 HB2 GLU 531 HB2 GLU 531 -6.426 -3.416 1.958
178 HB3 GLU 531 HB1 GLU 531 -5.129 -4.017 2.988
179 HG2 GLU 531 HG2 GLU 531 -6.116 -2.498 4.795
180 HG3 GLU 531 HG1 GLU 531 -7.538 -2.409 3.759
181 H GLN 532 HN GLN 532 -5.076 -1.854 -0.053
182 HA GLN 532 HA GLN 532 -2.635 -3.077 -0.726
183 HB2 GLN 532 HB2 GLN 532 -4.399 -2.720 -2.378
184 HB3 GLN 532 HB1 GLN 532 -4.198 -0.980 -2.243
185 HG2 GLN 532 HG2 GLN 532 -1.829 -1.313 -3.041
186 HG3 GLN 532 HG1 GLN 532 -2.281 -2.976 -3.406
187 HE21 GLN 532 HE21 GLN 532 -3.677 -3.390 -5.097
188 HE22 GLN 532 HE22 GLN 532 -4.060 -2.205 -6.295
189 H THR 533 HN THR 533 -3.463 0.272 0.015
190 HA THR 533 HA THR 533 -0.991 1.400 -0.752
191 HB THR 533 HB THR 533 -2.899 2.471 1.341
192 HG1 THR 533 HG1 THR 533 -3.806 2.065 -0.826
193 HG21 THR 533 HG21 THR 533 -0.580 3.457 1.228
194 HG22 THR 533 HG22 THR 533 -1.890 4.601 0.931
195 HG23 THR 533 HG23 THR 533 -0.950 3.961 -0.419
196 H VAL 534 HN VAL 534 -2.171 0.196 2.397
197 HA VAL 534 HA VAL 534 0.118 1.069 3.814
198 HB VAL 534 HB VAL 534 -0.611 -0.380 5.661
199 HG11 VAL 534 HG11 VAL 534 -2.766 0.728 6.059
200 HG12 VAL 534 HG12 VAL 534 -2.822 1.213 4.366
201 HG13 VAL 534 HG13 VAL 534 -1.560 1.844 5.422
202 HG21 VAL 534 HG21 VAL 534 -2.628 -1.693 5.514
203 HG22 VAL 534 HG22 VAL 534 -1.466 -2.252 4.309
204 HG23 VAL 534 HG23 VAL 534 -2.831 -1.249 3.821
205 H GLU 535 HN GLU 535 -0.643 -2.055 2.270
206 HA GLU 535 HA GLU 535 1.791 -3.262 3.143
207 HB2 GLU 535 HB2 GLU 535 1.304 -4.989 1.460
208 HB3 GLU 535 HB1 GLU 535 -0.083 -4.659 2.486
209 HG2 GLU 535 HG2 GLU 535 -1.111 -3.351 0.750
210 HG3 GLU 535 HG1 GLU 535 0.319 -3.530 -0.266
211 H ARG 536 HN ARG 536 0.826 -1.329 0.396
212 HA ARG 536 HA ARG 536 3.170 -1.780 -1.147
213 HB2 ARG 536 HB2 ARG 536 1.112 -1.070 -2.205
214 HB3 ARG 536 HB1 ARG 536 1.121 0.423 -1.281
215 HG2 ARG 536 HG2 ARG 536 3.576 0.081 -2.767
216 HG3 ARG 536 HG1 ARG 536 2.153 0.031 -3.814
217 HD2 ARG 536 HD2 ARG 536 2.676 2.149 -1.753
218 HD3 ARG 536 HD1 ARG 536 3.084 2.318 -3.464
219 HE ARG 536 HE ARG 536 0.319 1.653 -2.894
220 HH11 ARG 536 HH11 ARG 536 2.638 4.205 -3.537
221 HH12 ARG 536 HH12 ARG 536 1.414 5.357 -4.001
222 HH21 ARG 536 HH21 ARG 536 -1.268 3.147 -3.527
223 HH22 ARG 536 HH22 ARG 536 -0.799 4.748 -4.027
224 H VAL 537 HN VAL 537 2.243 0.803 1.138
225 HA VAL 537 HA VAL 537 4.634 2.288 0.786
226 HB VAL 537 HB VAL 537 4.166 3.382 2.915
227 HG11 VAL 537 HG11 VAL 537 1.954 4.283 2.384
228 HG12 VAL 537 HG12 VAL 537 1.686 2.939 1.271
229 HG13 VAL 537 HG13 VAL 537 2.956 4.120 0.941
230 HG21 VAL 537 HG21 VAL 537 2.429 2.745 4.397
231 HG22 VAL 537 HG22 VAL 537 3.368 1.281 4.078
232 HG23 VAL 537 HG23 VAL 537 1.819 1.533 3.273
233 H THR 538 HN THR 538 3.729 -0.326 2.948
234 HA THR 538 HA THR 538 6.134 -0.542 4.374
235 HB THR 538 HB THR 538 4.105 -2.646 3.623
236 HG1 THR 538 HG1 THR 538 3.043 -1.366 4.983
237 HG21 THR 538 HG21 THR 538 6.215 -3.693 4.211
238 HG22 THR 538 HG22 THR 538 5.024 -3.960 5.481
239 HG23 THR 538 HG23 THR 538 6.292 -2.751 5.697
240 H LEU 539 HN LEU 539 5.096 -1.890 1.271
241 HA LEU 539 HA LEU 539 7.430 -3.366 0.709
242 HB2 LEU 539 HB2 LEU 539 5.381 -3.781 -0.468
243 HB3 LEU 539 HB1 LEU 539 5.282 -2.122 -1.008
244 HG LEU 539 HG LEU 539 5.910 -3.904 -2.718
245 HD11 LEU 539 HD11 LEU 539 7.966 -1.761 -2.649
246 HD12 LEU 539 HD12 LEU 539 6.260 -1.326 -2.730
247 HD13 LEU 539 HD13 LEU 539 6.976 -2.336 -3.995
248 HD21 LEU 539 HD21 LEU 539 7.561 -5.081 -1.339
249 HD22 LEU 539 HD22 LEU 539 8.585 -3.645 -1.360
250 HD23 LEU 539 HD23 LEU 539 8.255 -4.513 -2.858
251 H GLN 540 HN GLN 540 6.452 -0.032 -0.015
252 HA GLN 540 HA GLN 540 8.788 0.758 -1.356
253 HB2 GLN 540 HB2 GLN 540 6.909 2.380 0.355
254 HB3 GLN 540 HB1 GLN 540 8.184 3.061 -0.646
255 HG2 GLN 540 HG2 GLN 540 5.912 1.396 -1.672
256 HG3 GLN 540 HG1 GLN 540 5.953 3.159 -1.686
257 HE21 GLN 540 HE21 GLN 540 7.116 0.255 -3.153
258 HE22 GLN 540 HE22 GLN 540 7.928 1.003 -4.486
259 H ASN 541 HN ASN 541 8.023 0.552 2.058
260 HA ASN 541 HA ASN 541 10.365 1.748 3.075
261 HB2 ASN 541 HB2 ASN 541 8.418 1.216 4.487
262 HB3 ASN 541 HB1 ASN 541 8.716 -0.502 4.250
263 HD21 ASN 541 HD21 ASN 541 9.008 -0.922 6.411
264 HD22 ASN 541 HD22 ASN 541 10.404 -0.397 7.283
265 H GLN 542 HN GLN 542 9.616 -1.589 2.193
266 HA GLN 542 HA GLN 542 12.137 -2.704 2.772
267 HB2 GLN 542 HB2 GLN 542 10.080 -3.525 0.708
268 HB3 GLN 542 HB1 GLN 542 11.432 -4.519 1.231
269 HG2 GLN 542 HG2 GLN 542 10.537 -4.617 3.473
270 HG3 GLN 542 HG1 GLN 542 9.224 -3.529 3.021
271 HE21 GLN 542 HE21 GLN 542 7.495 -4.310 1.888
272 HE22 GLN 542 HE22 GLN 542 7.222 -5.998 1.625
273 H LEU 543 HN LEU 543 10.794 -1.169 -0.099
274 HA LEU 543 HA LEU 543 13.049 -1.531 -1.770
275 HB2 LEU 543 HB2 LEU 543 10.727 -0.947 -2.520
276 HB3 LEU 543 HB1 LEU 543 10.991 0.674 -1.909
277 HG LEU 543 HG LEU 543 12.936 -0.396 -3.900
278 HD11 LEU 543 HD11 LEU 543 10.184 0.624 -4.601
279 HD12 LEU 543 HD12 LEU 543 10.774 -1.022 -4.839
280 HD13 LEU 543 HD13 LEU 543 11.490 0.312 -5.744
281 HD21 LEU 543 HD21 LEU 543 12.868 1.958 -4.656
282 HD22 LEU 543 HD22 LEU 543 13.330 1.795 -2.962
283 HD23 LEU 543 HD23 LEU 543 11.694 2.308 -3.385
284 H GLN 544 HN GLN 544 12.168 0.871 0.612
285 HA GLN 544 HA GLN 544 14.091 2.812 0.051
286 HB2 GLN 544 HB2 GLN 544 12.243 3.210 1.577
287 HB3 GLN 544 HB1 GLN 544 12.853 1.983 2.676
288 HG2 GLN 544 HG2 GLN 544 14.840 3.318 3.059
289 HG3 GLN 544 HG1 GLN 544 14.219 4.565 1.980
290 HE21 GLN 544 HE21 GLN 544 12.246 2.701 4.193
291 HE22 GLN 544 HE22 GLN 544 11.844 4.017 5.236
292 H GLN 545 HN GLN 545 14.218 0.003 2.228
293 HA GLN 545 HA GLN 545 16.882 0.228 3.027
294 HB2 GLN 545 HB2 GLN 545 15.041 -1.344 3.862
295 HB3 GLN 545 HB1 GLN 545 15.440 -2.363 2.489
296 HG2 GLN 545 HG2 GLN 545 17.731 -2.566 3.307
297 HG3 GLN 545 HG1 GLN 545 17.303 -1.561 4.689
298 HE21 GLN 545 HE21 GLN 545 15.947 -2.393 6.294
299 HE22 GLN 545 HE22 GLN 545 15.664 -4.095 6.448
300 H PHE 546 HN PHE 546 15.391 -1.154 0.178
301 HA PHE 546 HA PHE 546 17.692 -2.379 -0.908
302 HB2 PHE 546 HB2 PHE 546 15.799 -3.284 -1.790
303 HB3 PHE 546 HB1 PHE 546 14.921 -1.757 -1.756
304 HD1 PHE 546 HD1 PHE 546 17.399 -3.742 -3.663
305 HD2 PHE 546 HD2 PHE 546 14.722 -0.439 -3.653
306 HE1 PHE 546 HE1 PHE 546 17.644 -3.535 -6.107
307 HE2 PHE 546 HE2 PHE 546 14.968 -0.216 -6.075
308 HZ PHE 546 HZ PHE 546 16.426 -1.769 -7.317
309 H LEU 547 HN LEU 547 16.146 0.780 -1.617
310 HA LEU 547 HA LEU 547 18.088 1.603 -3.472
311 HB2 LEU 547 HB2 LEU 547 17.138 3.766 -3.351
312 HB3 LEU 547 HB1 LEU 547 15.837 2.614 -3.175
313 HG LEU 547 HG LEU 547 16.191 3.068 -0.605
314 HD11 LEU 547 HD11 LEU 547 17.205 5.618 -1.860
315 HD12 LEU 547 HD12 LEU 547 18.149 4.502 -0.874
316 HD13 LEU 547 HD13 LEU 547 16.803 5.388 -0.158
317 HD21 LEU 547 HD21 LEU 547 14.473 4.790 -0.735
318 HD22 LEU 547 HD22 LEU 547 14.143 3.479 -1.868
319 HD23 LEU 547 HD23 LEU 547 14.804 5.006 -2.453
320 H GLU 548 HN GLU 548 17.923 1.885 0.019
321 HA GLU 548 HA GLU 548 20.177 3.472 0.431
322 HB2 GLU 548 HB2 GLU 548 18.791 1.388 2.064
323 HB3 GLU 548 HB1 GLU 548 20.327 2.038 2.619
324 HG2 GLU 548 HG2 GLU 548 17.949 3.746 1.933
325 HG3 GLU 548 HG1 GLU 548 18.305 3.156 3.558
326 H ALA 549 HN ALA 549 19.902 0.000 -0.134
327 HA ALA 549 HA ALA 549 22.629 -0.616 0.230
328 HB1 ALA 549 HB1 ALA 549 22.156 -2.659 -1.008
329 HB2 ALA 549 HB2 ALA 549 20.620 -1.986 -1.556
330 HB3 ALA 549 HB3 ALA 549 20.875 -2.323 0.155
331 H GLN 550 HN GLN 550 20.779 0.533 -2.554
332 HA GLN 550 HA GLN 550 22.795 0.375 -4.509
333 HB2 GLN 550 HB2 GLN 550 20.726 2.564 -4.277
334 HB3 GLN 550 HB1 GLN 550 21.586 2.082 -5.727
335 HG2 GLN 550 HG2 GLN 550 20.433 -0.056 -5.716
336 HG3 GLN 550 HG1 GLN 550 19.589 0.400 -4.233
337 HE21 GLN 550 HE21 GLN 550 17.562 0.336 -5.112
338 HE22 GLN 550 HE22 GLN 550 16.997 1.477 -6.284
339 H LYS 551 HN LYS 551 22.106 2.788 -2.046
340 HA LYS 551 HA LYS 551 23.943 4.744 -2.973
341 HB2 LYS 551 HB2 LYS 551 23.030 4.327 -0.130
342 HB3 LYS 551 HB1 LYS 551 23.636 5.813 -0.837
343 HG2 LYS 551 HG2 LYS 551 21.065 4.451 -1.600
344 HG3 LYS 551 HG1 LYS 551 21.209 5.834 -0.517
345 HD2 LYS 551 HD2 LYS 551 22.213 7.129 -2.367
346 HD3 LYS 551 HD1 LYS 551 21.971 5.744 -3.434
347 HE2 LYS 551 HE2 LYS 551 19.559 5.867 -3.055
348 HE3 LYS 551 HE1 LYS 551 19.797 7.242 -1.975
349 HZ1 LYS 551 HZ1 LYS 551 19.133 7.985 -4.158
350 HZ2 LYS 551 HZ2 LYS 551 20.426 7.166 -4.879
351 HZ3 LYS 551 HZ3 LYS 551 20.725 8.483 -3.850
352 H SER 552 HN SER 552 24.158 2.128 -0.636
353 HA SER 552 HA SER 552 26.785 2.802 0.227
354 HB2 SER 552 HB2 SER 552 25.318 0.172 0.534
355 HB3 SER 552 HB1 SER 552 26.692 0.728 1.489
356 HG SER 552 HG SER 552 24.138 1.985 1.374
357 H GLU 553 HN GLU 553 25.498 0.309 -1.986
358 HA GLU 553 HA GLU 553 28.109 -0.712 -2.566
359 HB2 GLU 553 HB2 GLU 553 25.450 -1.106 -3.933
360 HB3 GLU 553 HB1 GLU 553 26.927 -1.947 -4.395
361 HG2 GLU 553 HG2 GLU 553 25.633 -2.068 -1.689
362 HG3 GLU 553 HG1 GLU 553 25.468 -3.291 -2.950
363 H GLY 554 HN GLY 554 25.941 1.606 -4.041
364 HA2 GLY 554 HA2 GLY 554 27.351 1.945 -6.466
365 HA3 GLY 554 HA1 GLY 554 26.226 3.096 -5.759
366 H LYS 555 HN LYS 555 27.541 3.660 -3.356
367 HA LYS 555 HA LYS 555 29.511 5.510 -4.233
368 HB2 LYS 555 HB2 LYS 555 29.681 6.201 -1.975
369 HB3 LYS 555 HB1 LYS 555 28.001 5.738 -2.201
370 HG2 LYS 555 HG2 LYS 555 28.533 3.538 -1.180
371 HG3 LYS 555 HG1 LYS 555 30.146 4.156 -0.813
372 HD2 LYS 555 HD2 LYS 555 29.103 5.994 0.474
373 HD3 LYS 555 HD1 LYS 555 27.520 5.275 0.163
374 HE2 LYS 555 HE2 LYS 555 28.336 4.659 2.376
375 HE3 LYS 555 HE1 LYS 555 28.204 3.245 1.331
376 HZ1 LYS 555 HZ1 LYS 555 30.270 3.342 2.681
377 HZ2 LYS 555 HZ2 LYS 555 30.746 4.712 1.800
378 HZ3 LYS 555 HZ3 LYS 555 30.542 3.219 1.013
379 H SER 556 HN SER 556 29.663 2.219 -3.311
380 HA SER 556 HA SER 556 32.352 2.180 -2.371
381 HB2 SER 556 HB2 SER 556 30.706 0.434 -1.772
382 HB3 SER 556 HB1 SER 556 30.659 -0.087 -3.455
383 HG SER 556 HG SER 556 32.285 -1.303 -2.957
384 H LEU 557 HN LEU 557 34.199 2.056 -3.469
385 HA LEU 557 HA LEU 557 34.338 1.004 -6.145
386 HB2 LEU 557 HB2 LEU 557 33.606 3.311 -6.579
387 HB3 LEU 557 HB1 LEU 557 34.948 3.922 -5.632
388 HG LEU 557 HG LEU 557 36.515 2.908 -7.288
389 HD11 LEU 557 HD11 LEU 557 33.998 2.415 -8.873
390 HD12 LEU 557 HD12 LEU 557 35.022 1.177 -8.148
391 HD13 LEU 557 HD13 LEU 557 35.649 2.189 -9.447
392 HD21 LEU 557 HD21 LEU 557 34.514 4.874 -8.403
393 HD22 LEU 557 HD22 LEU 557 36.148 4.600 -9.008
394 HD23 LEU 557 HD23 LEU 557 35.907 5.269 -7.394
Start of MODEL 3
1 H1 GLY 510 HT1 GLY 510 -31.771 -5.797 -12.105
2 H2 GLY 510 HT2 GLY 510 -31.571 -5.672 -10.424
3 H3 GLY 510 HT3 GLY 510 -31.069 -4.408 -11.436
4 HA2 GLY 510 HA1 GLY 510 -33.329 -3.946 -12.070
5 HA3 GLY 510 HA2 GLY 510 -33.872 -5.292 -11.079
6 H SER 511 HN SER 511 -34.118 -5.018 -8.905
7 HA SER 511 HA SER 511 -34.053 -2.250 -8.002
8 HB2 SER 511 HB2 SER 511 -35.191 -4.687 -6.623
9 HB3 SER 511 HB1 SER 511 -35.497 -2.999 -6.209
10 HG SER 511 HG SER 511 -36.141 -3.093 -8.684
11 H VAL 512 HN VAL 512 -33.208 -5.396 -6.516
12 HA VAL 512 HA VAL 512 -31.507 -3.908 -4.646
13 HB VAL 512 HB VAL 512 -32.567 -6.730 -4.464
14 HG11 VAL 512 HG11 VAL 512 -31.814 -6.633 -2.128
15 HG12 VAL 512 HG12 VAL 512 -31.068 -5.065 -2.448
16 HG13 VAL 512 HG13 VAL 512 -30.473 -6.507 -3.269
17 HG21 VAL 512 HG21 VAL 512 -34.321 -5.026 -4.293
18 HG22 VAL 512 HG22 VAL 512 -33.417 -4.230 -3.004
19 HG23 VAL 512 HG23 VAL 512 -34.063 -5.853 -2.758
20 H GLU 513 HN GLU 513 -31.387 -6.904 -6.598
21 HA GLU 513 HA GLU 513 -28.924 -7.749 -5.641
22 HB2 GLU 513 HB2 GLU 513 -28.844 -9.301 -7.499
23 HB3 GLU 513 HB1 GLU 513 -30.448 -9.234 -6.799
24 HG2 GLU 513 HG2 GLU 513 -29.584 -7.904 -9.359
25 HG3 GLU 513 HG1 GLU 513 -30.520 -9.391 -9.229
26 H THR 514 HN THR 514 -29.569 -5.849 -8.599
27 HA THR 514 HA THR 514 -26.883 -5.895 -9.481
28 HB THR 514 HB THR 514 -27.621 -3.837 -10.836
29 HG1 THR 514 HG1 THR 514 -29.679 -3.210 -10.669
30 HG21 THR 514 HG21 THR 514 -27.546 -6.132 -11.728
31 HG22 THR 514 HG22 THR 514 -28.901 -5.215 -12.385
32 HG23 THR 514 HG23 THR 514 -29.178 -6.410 -11.120
33 H CYS 515 HN CYS 515 -28.744 -3.448 -7.715
34 HA CYS 515 HA CYS 515 -26.665 -1.553 -7.532
35 HB2 CYS 515 HB2 CYS 515 -28.908 -1.895 -5.542
36 HB3 CYS 515 HB1 CYS 515 -28.039 -0.413 -5.945
37 HG CYS 515 HG CYS 515 -30.829 -1.486 -7.189
38 H MET 516 HN MET 516 -27.646 -4.236 -5.468
39 HA MET 516 HA MET 516 -25.882 -3.701 -3.337
40 HB2 MET 516 HB2 MET 516 -27.738 -5.274 -3.115
41 HB3 MET 516 HB1 MET 516 -26.997 -6.344 -4.296
42 HG2 MET 516 HG2 MET 516 -25.132 -6.744 -2.809
43 HG3 MET 516 HG1 MET 516 -25.797 -5.609 -1.636
44 HE1 MET 516 HE1 MET 516 -26.226 -9.086 -3.402
45 HE2 MET 516 HE2 MET 516 -27.707 -8.241 -3.849
46 HE3 MET 516 HE3 MET 516 -27.777 -9.626 -2.760
47 H SER 517 HN SER 517 -25.490 -5.581 -6.319
48 HA SER 517 HA SER 517 -22.958 -6.641 -5.657
49 HB2 SER 517 HB2 SER 517 -24.203 -6.193 -8.377
50 HB3 SER 517 HB1 SER 517 -22.789 -7.199 -8.054
51 HG SER 517 HG SER 517 -24.147 -8.456 -6.650
52 H LEU 518 HN LEU 518 -23.871 -3.787 -7.612
53 HA LEU 518 HA LEU 518 -21.208 -3.136 -8.245
54 HB2 LEU 518 HB2 LEU 518 -22.143 -0.827 -8.735
55 HB3 LEU 518 HB1 LEU 518 -22.741 -2.168 -9.684
56 HG LEU 518 HG LEU 518 -24.713 -2.132 -7.952
57 HD11 LEU 518 HD11 LEU 518 -23.410 0.532 -7.567
58 HD12 LEU 518 HD12 LEU 518 -24.109 -0.565 -6.367
59 HD13 LEU 518 HD13 LEU 518 -25.161 0.359 -7.439
60 HD21 LEU 518 HD21 LEU 518 -24.888 -1.703 -10.351
61 HD22 LEU 518 HD22 LEU 518 -24.413 -0.026 -10.085
62 HD23 LEU 518 HD23 LEU 518 -25.931 -0.629 -9.418
63 H ALA 519 HN ALA 519 -23.285 -2.140 -5.595
64 HA ALA 519 HA ALA 519 -21.508 -0.257 -4.454
65 HB1 ALA 519 HB1 ALA 519 -22.833 -0.601 -2.386
66 HB2 ALA 519 HB2 ALA 519 -23.661 -1.947 -3.175
67 HB3 ALA 519 HB3 ALA 519 -23.835 -0.311 -3.808
68 H SER 520 HN SER 520 -21.965 -3.742 -3.930
69 HA SER 520 HA SER 520 -20.008 -4.039 -1.920
70 HB2 SER 520 HB2 SER 520 -20.945 -6.066 -3.968
71 HB3 SER 520 HB1 SER 520 -20.067 -6.431 -2.483
72 HG SER 520 HG SER 520 -22.683 -5.384 -2.770
73 H GLN 521 HN GLN 521 -19.853 -4.149 -5.440
74 HA GLN 521 HA GLN 521 -17.173 -4.919 -5.696
75 HB2 GLN 521 HB2 GLN 521 -18.784 -4.840 -7.563
76 HB3 GLN 521 HB1 GLN 521 -18.759 -3.085 -7.506
77 HG2 GLN 521 HG2 GLN 521 -17.362 -3.863 -9.299
78 HG3 GLN 521 HG1 GLN 521 -16.359 -3.138 -8.043
79 HE21 GLN 521 HE21 GLN 521 -15.010 -4.461 -6.806
80 HE22 GLN 521 HE22 GLN 521 -14.625 -6.077 -7.287
81 H VAL 522 HN VAL 522 -18.665 -1.701 -5.510
82 HA VAL 522 HA VAL 522 -16.340 -0.143 -5.538
83 HB VAL 522 HB VAL 522 -18.956 0.354 -4.087
84 HG11 VAL 522 HG11 VAL 522 -18.343 2.678 -3.966
85 HG12 VAL 522 HG12 VAL 522 -16.832 2.358 -4.811
86 HG13 VAL 522 HG13 VAL 522 -17.083 1.716 -3.189
87 HG21 VAL 522 HG21 VAL 522 -17.950 1.309 -6.763
88 HG22 VAL 522 HG22 VAL 522 -19.473 1.781 -6.010
89 HG23 VAL 522 HG23 VAL 522 -19.210 0.105 -6.496
90 H VAL 523 HN VAL 523 -18.016 -1.749 -2.884
91 HA VAL 523 HA VAL 523 -16.416 -0.790 -0.787
92 HB VAL 523 HB VAL 523 -18.303 -3.075 -1.151
93 HG11 VAL 523 HG11 VAL 523 -16.470 -2.750 1.213
94 HG12 VAL 523 HG12 VAL 523 -16.619 -4.136 0.132
95 HG13 VAL 523 HG13 VAL 523 -17.940 -3.728 1.223
96 HG21 VAL 523 HG21 VAL 523 -19.457 -1.952 0.716
97 HG22 VAL 523 HG22 VAL 523 -19.196 -0.884 -0.663
98 HG23 VAL 523 HG23 VAL 523 -18.167 -0.749 0.764
99 H LYS 524 HN LYS 524 -16.139 -3.673 -2.856
100 HA LYS 524 HA LYS 524 -13.837 -4.721 -1.599
101 HB2 LYS 524 HB2 LYS 524 -15.248 -5.157 -4.143
102 HB3 LYS 524 HB1 LYS 524 -13.537 -5.566 -4.166
103 HG2 LYS 524 HG2 LYS 524 -14.710 -7.541 -3.621
104 HG3 LYS 524 HG1 LYS 524 -13.978 -6.970 -2.121
105 HD2 LYS 524 HD2 LYS 524 -16.139 -5.898 -1.547
106 HD3 LYS 524 HD1 LYS 524 -16.844 -6.632 -2.983
107 HE2 LYS 524 HE2 LYS 524 -17.374 -7.979 -1.050
108 HE3 LYS 524 HE1 LYS 524 -16.272 -8.861 -2.104
109 HZ1 LYS 524 HZ1 LYS 524 -14.437 -8.108 -0.626
110 HZ2 LYS 524 HZ2 LYS 524 -15.549 -9.143 0.123
111 HZ3 LYS 524 HZ3 LYS 524 -15.600 -7.475 0.434
112 H LEU 525 HN LEU 525 -14.247 -2.366 -4.211
113 HA LEU 525 HA LEU 525 -11.522 -2.108 -4.882
114 HB2 LEU 525 HB2 LEU 525 -13.958 -0.475 -5.289
115 HB3 LEU 525 HB1 LEU 525 -12.434 0.382 -5.388
116 HG LEU 525 HG LEU 525 -11.695 -1.227 -7.140
117 HD11 LEU 525 HD11 LEU 525 -14.533 -2.086 -7.431
118 HD12 LEU 525 HD12 LEU 525 -13.469 -2.933 -6.312
119 HD13 LEU 525 HD13 LEU 525 -13.056 -2.851 -8.029
120 HD21 LEU 525 HD21 LEU 525 -12.614 0.950 -7.728
121 HD22 LEU 525 HD22 LEU 525 -14.244 0.275 -7.713
122 HD23 LEU 525 HD23 LEU 525 -13.074 -0.271 -8.914
123 H THR 526 HN THR 526 -13.549 -0.262 -2.623
124 HA THR 526 HA THR 526 -11.460 1.482 -1.833
125 HB THR 526 HB THR 526 -13.929 1.943 -1.550
126 HG1 THR 526 HG1 THR 526 -13.281 2.593 0.905
127 HG21 THR 526 HG21 THR 526 -13.604 0.180 0.883
128 HG22 THR 526 HG22 THR 526 -14.614 -0.164 -0.523
129 HG23 THR 526 HG23 THR 526 -14.998 1.201 0.526
130 H LYS 527 HN LYS 527 -12.587 -1.620 -0.618
131 HA LYS 527 HA LYS 527 -11.032 -1.710 1.728
132 HB2 LYS 527 HB2 LYS 527 -12.830 -3.285 1.381
133 HB3 LYS 527 HB1 LYS 527 -12.062 -3.913 -0.068
134 HG2 LYS 527 HG2 LYS 527 -11.776 -5.451 1.763
135 HG3 LYS 527 HG1 LYS 527 -10.215 -4.771 1.302
136 HD2 LYS 527 HD2 LYS 527 -10.415 -4.840 3.720
137 HD3 LYS 527 HD1 LYS 527 -10.386 -3.168 3.160
138 HE2 LYS 527 HE2 LYS 527 -12.791 -3.017 3.385
139 HE3 LYS 527 HE1 LYS 527 -12.880 -4.719 3.842
140 HZ1 LYS 527 HZ1 LYS 527 -11.589 -2.531 5.375
141 HZ2 LYS 527 HZ2 LYS 527 -11.479 -4.170 5.785
142 HZ3 LYS 527 HZ3 LYS 527 -12.985 -3.393 5.807
143 H GLN 528 HN GLN 528 -10.429 -2.878 -1.563
144 HA GLN 528 HA GLN 528 -7.863 -3.908 -1.073
145 HB2 GLN 528 HB2 GLN 528 -9.136 -4.531 -3.051
146 HB3 GLN 528 HB1 GLN 528 -9.076 -2.878 -3.643
147 HG2 GLN 528 HG2 GLN 528 -7.487 -4.309 -4.809
148 HG3 GLN 528 HG1 GLN 528 -6.672 -3.031 -3.911
149 HE21 GLN 528 HE21 GLN 528 -8.010 -5.913 -2.438
150 HE22 GLN 528 HE22 GLN 528 -6.493 -6.612 -1.983
151 H LEU 529 HN LEU 529 -8.953 -0.670 -1.996
152 HA LEU 529 HA LEU 529 -6.444 0.408 -2.655
153 HB2 LEU 529 HB2 LEU 529 -8.885 1.719 -1.466
154 HB3 LEU 529 HB1 LEU 529 -7.492 2.604 -2.051
155 HG LEU 529 HG LEU 529 -9.197 0.808 -3.774
156 HD11 LEU 529 HD11 LEU 529 -9.193 3.812 -3.659
157 HD12 LEU 529 HD12 LEU 529 -10.353 2.803 -2.796
158 HD13 LEU 529 HD13 LEU 529 -10.289 2.761 -4.561
159 HD21 LEU 529 HD21 LEU 529 -8.058 1.958 -5.614
160 HD22 LEU 529 HD22 LEU 529 -6.912 1.099 -4.584
161 HD23 LEU 529 HD23 LEU 529 -7.078 2.850 -4.451
162 H LYS 530 HN LYS 530 -8.189 0.367 0.449
163 HA LYS 530 HA LYS 530 -6.243 1.747 1.936
164 HB2 LYS 530 HB2 LYS 530 -8.523 -0.038 2.604
165 HB3 LYS 530 HB1 LYS 530 -7.314 0.216 3.856
166 HG2 LYS 530 HG2 LYS 530 -9.089 1.789 4.160
167 HG3 LYS 530 HG1 LYS 530 -7.653 2.660 3.621
168 HD2 LYS 530 HD2 LYS 530 -8.546 2.759 1.361
169 HD3 LYS 530 HD1 LYS 530 -9.955 1.821 1.858
170 HE2 LYS 530 HE2 LYS 530 -9.183 4.566 2.846
171 HE3 LYS 530 HE1 LYS 530 -10.511 4.178 1.750
172 HZ1 LYS 530 HZ1 LYS 530 -11.358 4.485 3.960
173 HZ2 LYS 530 HZ2 LYS 530 -10.266 3.355 4.596
174 HZ3 LYS 530 HZ3 LYS 530 -11.499 2.842 3.554
175 H GLU 531 HN GLU 531 -6.722 -1.749 1.494
176 HA GLU 531 HA GLU 531 -4.531 -2.476 3.141
177 HB2 GLU 531 HB2 GLU 531 -5.941 -4.060 0.987
178 HB3 GLU 531 HB1 GLU 531 -4.813 -4.728 2.162
179 HG2 GLU 531 HG2 GLU 531 -6.356 -3.890 3.959
180 HG3 GLU 531 HG1 GLU 531 -7.518 -3.526 2.684
181 H GLN 532 HN GLN 532 -4.873 -1.890 -0.314
182 HA GLN 532 HA GLN 532 -2.294 -2.714 -1.087
183 HB2 GLN 532 HB2 GLN 532 -4.081 -2.250 -2.698
184 HB3 GLN 532 HB1 GLN 532 -4.028 -0.543 -2.279
185 HG2 GLN 532 HG2 GLN 532 -1.669 -0.495 -3.065
186 HG3 GLN 532 HG1 GLN 532 -1.877 -2.153 -3.630
187 HE21 GLN 532 HE21 GLN 532 -3.239 -2.565 -5.374
188 HE22 GLN 532 HE22 GLN 532 -3.722 -1.305 -6.465
189 H THR 533 HN THR 533 -3.517 0.343 0.182
190 HA THR 533 HA THR 533 -1.184 1.862 -0.312
191 HB THR 533 HB THR 533 -3.216 2.325 1.881
192 HG1 THR 533 HG1 THR 533 -4.092 2.166 -0.316
193 HG21 THR 533 HG21 THR 533 -1.047 3.606 1.974
194 HG22 THR 533 HG22 THR 533 -2.497 4.601 1.836
195 HG23 THR 533 HG23 THR 533 -1.484 4.318 0.421
196 H VAL 534 HN VAL 534 -2.264 0.052 2.578
197 HA VAL 534 HA VAL 534 -0.095 0.888 4.182
198 HB VAL 534 HB VAL 534 -0.689 -0.933 5.725
199 HG11 VAL 534 HG11 VAL 534 -2.921 -0.143 6.273
200 HG12 VAL 534 HG12 VAL 534 -3.092 0.544 4.658
201 HG13 VAL 534 HG13 VAL 534 -1.897 1.204 5.774
202 HG21 VAL 534 HG21 VAL 534 -2.532 -2.430 5.275
203 HG22 VAL 534 HG22 VAL 534 -1.293 -2.626 4.035
204 HG23 VAL 534 HG23 VAL 534 -2.758 -1.717 3.677
205 H GLU 535 HN GLU 535 -0.528 -1.979 2.107
206 HA GLU 535 HA GLU 535 2.014 -3.065 2.807
207 HB2 GLU 535 HB2 GLU 535 1.704 -4.581 0.934
208 HB3 GLU 535 HB1 GLU 535 0.230 -4.478 1.880
209 HG2 GLU 535 HG2 GLU 535 -0.830 -3.144 0.244
210 HG3 GLU 535 HG1 GLU 535 0.681 -2.892 -0.628
211 H ARG 536 HN ARG 536 0.871 -0.798 0.402
212 HA ARG 536 HA ARG 536 3.193 -0.788 -1.206
213 HB2 ARG 536 HB2 ARG 536 1.114 0.053 -2.075
214 HB3 ARG 536 HB1 ARG 536 1.028 1.276 -0.819
215 HG2 ARG 536 HG2 ARG 536 3.453 1.400 -2.453
216 HG3 ARG 536 HG1 ARG 536 1.954 1.680 -3.342
217 HD2 ARG 536 HD2 ARG 536 2.623 3.077 -0.770
218 HD3 ARG 536 HD1 ARG 536 3.080 3.725 -2.347
219 HE ARG 536 HE ARG 536 0.279 3.096 -2.137
220 HH11 ARG 536 HH11 ARG 536 2.732 5.543 -1.601
221 HH12 ARG 536 HH12 ARG 536 1.588 6.858 -1.544
222 HH21 ARG 536 HH21 ARG 536 -1.228 4.837 -2.095
223 HH22 ARG 536 HH22 ARG 536 -0.645 6.451 -1.821
224 H VAL 537 HN VAL 537 2.195 1.335 1.492
225 HA VAL 537 HA VAL 537 4.536 2.936 1.395
226 HB VAL 537 HB VAL 537 3.964 3.717 3.633
227 HG11 VAL 537 HG11 VAL 537 1.707 4.558 3.171
228 HG12 VAL 537 HG12 VAL 537 1.550 3.371 1.875
229 HG13 VAL 537 HG13 VAL 537 2.755 4.652 1.751
230 HG21 VAL 537 HG21 VAL 537 2.201 2.810 4.958
231 HG22 VAL 537 HG22 VAL 537 3.266 1.469 4.521
232 HG23 VAL 537 HG23 VAL 537 1.733 1.693 3.676
233 H THR 538 HN THR 538 3.704 0.010 3.153
234 HA THR 538 HA THR 538 6.104 -0.225 4.616
235 HB THR 538 HB THR 538 4.154 -2.336 3.685
236 HG1 THR 538 HG1 THR 538 3.069 -1.088 5.096
237 HG21 THR 538 HG21 THR 538 6.345 -3.288 4.242
238 HG22 THR 538 HG22 THR 538 5.098 -3.779 5.385
239 HG23 THR 538 HG23 THR 538 6.265 -2.533 5.831
240 H LEU 539 HN LEU 539 5.122 -1.328 1.404
241 HA LEU 539 HA LEU 539 7.423 -2.816 0.782
242 HB2 LEU 539 HB2 LEU 539 5.387 -3.074 -0.467
243 HB3 LEU 539 HB1 LEU 539 5.366 -1.381 -0.896
244 HG LEU 539 HG LEU 539 5.978 -3.077 -2.699
245 HD11 LEU 539 HD11 LEU 539 8.091 -1.003 -2.446
246 HD12 LEU 539 HD12 LEU 539 6.400 -0.512 -2.520
247 HD13 LEU 539 HD13 LEU 539 7.104 -1.452 -3.843
248 HD21 LEU 539 HD21 LEU 539 7.559 -4.393 -1.367
249 HD22 LEU 539 HD22 LEU 539 8.616 -2.985 -1.241
250 HD23 LEU 539 HD23 LEU 539 8.321 -3.730 -2.813
251 H GLN 540 HN GLN 540 6.563 0.589 0.256
252 HA GLN 540 HA GLN 540 8.887 1.397 -1.059
253 HB2 GLN 540 HB2 GLN 540 7.127 2.935 0.855
254 HB3 GLN 540 HB1 GLN 540 8.389 3.658 -0.131
255 HG2 GLN 540 HG2 GLN 540 6.051 2.135 -1.224
256 HG3 GLN 540 HG1 GLN 540 6.108 3.890 -1.067
257 HE21 GLN 540 HE21 GLN 540 8.947 4.017 -1.756
258 HE22 GLN 540 HE22 GLN 540 9.031 3.755 -3.463
259 H ASN 541 HN ASN 541 8.233 1.008 2.373
260 HA ASN 541 HA ASN 541 10.680 2.026 3.365
261 HB2 ASN 541 HB2 ASN 541 8.708 1.559 4.794
262 HB3 ASN 541 HB1 ASN 541 8.908 -0.161 4.502
263 HD21 ASN 541 HD21 ASN 541 9.110 -0.549 6.708
264 HD22 ASN 541 HD22 ASN 541 10.560 -0.173 7.569
265 H GLN 542 HN GLN 542 9.673 -1.255 2.474
266 HA GLN 542 HA GLN 542 12.156 -2.507 2.945
267 HB2 GLN 542 HB2 GLN 542 10.016 -3.263 0.945
268 HB3 GLN 542 HB1 GLN 542 11.298 -4.313 1.527
269 HG2 GLN 542 HG2 GLN 542 10.373 -4.232 3.772
270 HG3 GLN 542 HG1 GLN 542 9.109 -3.132 3.220
271 HE21 GLN 542 HE21 GLN 542 8.851 -4.552 0.660
272 HE22 GLN 542 HE22 GLN 542 7.957 -5.987 1.015
273 H LEU 543 HN LEU 543 10.751 -0.958 0.103
274 HA LEU 543 HA LEU 543 12.822 -1.615 -1.703
275 HB2 LEU 543 HB2 LEU 543 10.466 -0.855 -2.246
276 HB3 LEU 543 HB1 LEU 543 10.987 0.774 -1.867
277 HG LEU 543 HG LEU 543 12.509 -0.778 -3.920
278 HD11 LEU 543 HD11 LEU 543 9.912 0.680 -4.429
279 HD12 LEU 543 HD12 LEU 543 10.133 -1.068 -4.502
280 HD13 LEU 543 HD13 LEU 543 10.968 -0.026 -5.654
281 HD21 LEU 543 HD21 LEU 543 12.709 1.489 -4.905
282 HD22 LEU 543 HD22 LEU 543 13.373 1.376 -3.277
283 HD23 LEU 543 HD23 LEU 543 11.799 2.130 -3.538
284 H GLN 544 HN GLN 544 12.331 1.050 0.522
285 HA GLN 544 HA GLN 544 14.428 2.713 -0.284
286 HB2 GLN 544 HB2 GLN 544 12.853 3.520 1.310
287 HB3 GLN 544 HB1 GLN 544 13.158 2.173 2.399
288 HG2 GLN 544 HG2 GLN 544 15.363 3.013 2.858
289 HG3 GLN 544 HG1 GLN 544 15.123 4.348 1.731
290 HE21 GLN 544 HE21 GLN 544 15.408 5.912 3.311
291 HE22 GLN 544 HE22 GLN 544 14.232 6.209 4.551
292 H GLN 545 HN GLN 545 14.349 0.016 2.010
293 HA GLN 545 HA GLN 545 17.148 -0.028 2.517
294 HB2 GLN 545 HB2 GLN 545 15.077 -2.222 2.748
295 HB3 GLN 545 HB1 GLN 545 16.702 -2.294 3.413
296 HG2 GLN 545 HG2 GLN 545 16.244 -0.608 4.984
297 HG3 GLN 545 HG1 GLN 545 14.756 -0.140 4.164
298 HE21 GLN 545 HE21 GLN 545 12.920 -1.371 4.424
299 HE22 GLN 545 HE22 GLN 545 12.760 -2.569 5.668
300 H PHE 546 HN PHE 546 15.064 -1.529 0.137
301 HA PHE 546 HA PHE 546 16.863 -3.372 -0.958
302 HB2 PHE 546 HB2 PHE 546 14.717 -3.807 -1.613
303 HB3 PHE 546 HB1 PHE 546 14.298 -2.098 -1.751
304 HD1 PHE 546 HD2 PHE 546 15.929 -4.936 -3.432
305 HD2 PHE 546 HD1 PHE 546 14.412 -0.984 -3.848
306 HE1 PHE 546 HE2 PHE 546 16.128 -5.127 -5.873
307 HE2 PHE 546 HE1 PHE 546 14.612 -1.160 -6.295
308 HZ PHE 546 HZ PHE 546 15.379 -3.179 -7.323
309 H LEU 547 HN LEU 547 16.077 -0.044 -2.005
310 HA LEU 547 HA LEU 547 17.904 -0.034 -4.142
311 HB2 LEU 547 HB2 LEU 547 17.514 2.314 -4.304
312 HB3 LEU 547 HB1 LEU 547 16.006 1.529 -3.897
313 HG LEU 547 HG LEU 547 16.741 2.217 -1.435
314 HD11 LEU 547 HD11 LEU 547 17.981 4.343 -3.172
315 HD12 LEU 547 HD12 LEU 547 18.859 3.216 -2.138
316 HD13 LEU 547 HD13 LEU 547 17.780 4.414 -1.421
317 HD21 LEU 547 HD21 LEU 547 14.647 2.808 -2.514
318 HD22 LEU 547 HD22 LEU 547 15.467 4.056 -3.452
319 HD23 LEU 547 HD23 LEU 547 15.341 4.211 -1.699
320 H GLU 548 HN GLU 548 18.210 0.972 -0.775
321 HA GLU 548 HA GLU 548 20.839 1.933 -0.893
322 HB2 GLU 548 HB2 GLU 548 19.279 0.654 1.343
323 HB3 GLU 548 HB1 GLU 548 20.907 1.284 1.566
324 HG2 GLU 548 HG2 GLU 548 18.582 2.907 0.563
325 HG3 GLU 548 HG1 GLU 548 19.100 2.843 2.246
326 H ALA 549 HN ALA 549 19.578 -1.330 -0.471
327 HA ALA 549 HA ALA 549 22.035 -2.638 -0.090
328 HB1 ALA 549 HB1 ALA 549 20.879 -4.669 -0.791
329 HB2 ALA 549 HB2 ALA 549 19.543 -3.705 -1.421
330 HB3 ALA 549 HB3 ALA 549 19.876 -3.725 0.310
331 H GLN 550 HN GLN 550 20.231 -1.837 -3.037
332 HA GLN 550 HA GLN 550 21.912 -3.099 -4.889
333 HB2 GLN 550 HB2 GLN 550 20.305 -0.566 -5.271
334 HB3 GLN 550 HB1 GLN 550 20.941 -1.590 -6.555
335 HG2 GLN 550 HG2 GLN 550 18.910 -2.399 -4.497
336 HG3 GLN 550 HG1 GLN 550 18.571 -1.985 -6.177
337 HE21 GLN 550 HE21 GLN 550 18.161 -4.475 -4.636
338 HE22 GLN 550 HE22 GLN 550 18.943 -5.716 -5.554
339 H LYS 551 HN LYS 551 22.123 0.043 -3.353
340 HA LYS 551 HA LYS 551 24.289 1.071 -4.835
341 HB2 LYS 551 HB2 LYS 551 23.662 1.531 -1.918
342 HB3 LYS 551 HB1 LYS 551 24.699 2.534 -2.916
343 HG2 LYS 551 HG2 LYS 551 21.769 2.109 -3.437
344 HG3 LYS 551 HG1 LYS 551 22.429 3.463 -2.521
345 HD2 LYS 551 HD2 LYS 551 23.760 4.100 -4.512
346 HD3 LYS 551 HD1 LYS 551 22.974 2.801 -5.412
347 HE2 LYS 551 HE2 LYS 551 20.813 3.826 -5.100
348 HE3 LYS 551 HE1 LYS 551 21.512 5.072 -4.068
349 HZ1 LYS 551 HZ1 LYS 551 22.812 5.835 -5.998
350 HZ2 LYS 551 HZ2 LYS 551 21.141 5.942 -6.253
351 HZ3 LYS 551 HZ3 LYS 551 22.026 4.689 -6.974
352 H SER 552 HN SER 552 24.265 -0.681 -1.751
353 HA SER 552 HA SER 552 27.073 -0.826 -1.508
354 HB2 SER 552 HB2 SER 552 24.941 -2.576 -0.260
355 HB3 SER 552 HB1 SER 552 26.621 -2.462 0.273
356 HG SER 552 HG SER 552 24.527 -0.810 0.797
357 H GLU 553 HN GLU 553 24.702 -2.995 -2.959
358 HA GLU 553 HA GLU 553 26.534 -5.126 -3.428
359 HB2 GLU 553 HB2 GLU 553 23.892 -4.475 -4.745
360 HB3 GLU 553 HB1 GLU 553 24.782 -5.974 -4.968
361 HG2 GLU 553 HG2 GLU 553 23.792 -4.992 -2.311
362 HG3 GLU 553 HG1 GLU 553 22.900 -6.105 -3.346
363 H GLY 554 HN GLY 554 25.485 -2.313 -5.255
364 HA2 GLY 554 HA2 GLY 554 26.741 -3.163 -7.703
365 HA3 GLY 554 HA1 GLY 554 25.985 -1.608 -7.399
366 H LYS 555 HN LYS 555 27.521 -0.880 -5.111
367 HA LYS 555 HA LYS 555 29.829 0.186 -6.374
368 HB2 LYS 555 HB2 LYS 555 30.389 1.133 -4.226
369 HB3 LYS 555 HB1 LYS 555 28.653 1.266 -4.457
370 HG2 LYS 555 HG2 LYS 555 28.318 -0.690 -3.030
371 HG3 LYS 555 HG1 LYS 555 30.061 -0.804 -2.788
372 HD2 LYS 555 HD2 LYS 555 28.334 1.542 -1.997
373 HD3 LYS 555 HD1 LYS 555 28.925 0.293 -0.900
374 HE2 LYS 555 HE2 LYS 555 31.255 0.940 -1.609
375 HE3 LYS 555 HE1 LYS 555 30.536 2.320 -2.434
376 HZ1 LYS 555 HZ1 LYS 555 31.308 2.935 -0.242
377 HZ2 LYS 555 HZ2 LYS 555 30.342 1.737 0.469
378 HZ3 LYS 555 HZ3 LYS 555 29.614 3.052 -0.315
379 H SER 556 HN SER 556 29.250 -2.751 -4.631
380 HA SER 556 HA SER 556 32.113 -3.221 -4.262
381 HB2 SER 556 HB2 SER 556 30.443 -3.601 -2.394
382 HB3 SER 556 HB1 SER 556 29.810 -4.950 -3.335
383 HG SER 556 HG SER 556 32.333 -4.652 -2.097
384 H LEU 557 HN LEU 557 32.367 -5.881 -4.446
385 HA LEU 557 HA LEU 557 32.036 -6.369 -7.290
386 HB2 LEU 557 HB2 LEU 557 33.472 -7.917 -5.131
387 HB3 LEU 557 HB1 LEU 557 33.397 -8.421 -6.805
388 HG LEU 557 HG LEU 557 35.513 -7.439 -6.529
389 HD11 LEU 557 HD11 LEU 557 34.390 -6.754 -8.563
390 HD12 LEU 557 HD12 LEU 557 35.466 -5.486 -7.975
391 HD13 LEU 557 HD13 LEU 557 33.724 -5.346 -7.737
392 HD21 LEU 557 HD21 LEU 557 35.131 -6.316 -4.404
393 HD22 LEU 557 HD22 LEU 557 34.167 -5.083 -5.216
394 HD23 LEU 557 HD23 LEU 557 35.889 -5.227 -5.567
Start of MODEL 4
1 H1 GLY 510 HT1 GLY 510 -36.410 0.079 4.425
2 H2 GLY 510 HT2 GLY 510 -35.409 -1.217 3.987
3 H3 GLY 510 HT3 GLY 510 -37.003 -1.505 4.503
4 HA2 GLY 510 HA1 GLY 510 -36.836 -1.728 2.111
5 HA3 GLY 510 HA2 GLY 510 -37.879 -0.386 2.563
6 H SER 511 HN SER 511 -35.893 1.481 3.270
7 HA SER 511 HA SER 511 -34.693 1.989 0.627
8 HB2 SER 511 HB2 SER 511 -34.891 4.426 1.325
9 HB3 SER 511 HB1 SER 511 -36.415 3.591 1.024
10 HG SER 511 HG SER 511 -36.182 4.910 3.042
11 H VAL 512 HN VAL 512 -33.761 0.829 3.420
12 HA VAL 512 HA VAL 512 -31.468 2.629 3.804
13 HB VAL 512 HB VAL 512 -32.621 0.548 5.669
14 HG11 VAL 512 HG11 VAL 512 -30.982 1.494 7.309
15 HG12 VAL 512 HG12 VAL 512 -30.206 2.327 5.959
16 HG13 VAL 512 HG13 VAL 512 -30.260 0.567 5.996
17 HG21 VAL 512 HG21 VAL 512 -33.137 2.495 7.090
18 HG22 VAL 512 HG22 VAL 512 -33.983 2.546 5.543
19 HG23 VAL 512 HG23 VAL 512 -32.564 3.560 5.808
20 H GLU 513 HN GLU 513 -32.264 -0.841 3.781
21 HA GLU 513 HA GLU 513 -29.612 -1.732 3.942
22 HB2 GLU 513 HB2 GLU 513 -30.541 -3.911 3.101
23 HB3 GLU 513 HB1 GLU 513 -31.320 -3.252 4.530
24 HG2 GLU 513 HG2 GLU 513 -32.467 -2.701 1.831
25 HG3 GLU 513 HG1 GLU 513 -32.742 -4.258 2.603
26 H THR 514 HN THR 514 -31.580 -0.874 1.171
27 HA THR 514 HA THR 514 -29.973 -2.113 -0.797
28 HB THR 514 HB THR 514 -31.130 -0.406 -2.335
29 HG1 THR 514 HG1 THR 514 -33.103 0.409 -1.171
30 HG21 THR 514 HG21 THR 514 -32.788 -2.266 -0.644
31 HG22 THR 514 HG22 THR 514 -31.868 -2.720 -2.073
32 HG23 THR 514 HG23 THR 514 -33.249 -1.634 -2.222
33 H CYS 515 HN CYS 515 -30.171 1.288 0.251
34 HA CYS 515 HA CYS 515 -27.933 2.111 -1.303
35 HB2 CYS 515 HB2 CYS 515 -28.989 3.501 1.164
36 HB3 CYS 515 HB1 CYS 515 -28.127 4.219 -0.198
37 HG CYS 515 HG CYS 515 -30.315 3.512 -1.989
38 H MET 516 HN MET 516 -28.359 0.948 1.978
39 HA MET 516 HA MET 516 -25.781 1.466 2.950
40 HB2 MET 516 HB2 MET 516 -27.648 0.775 4.376
41 HB3 MET 516 HB1 MET 516 -27.665 -0.805 3.615
42 HG2 MET 516 HG2 MET 516 -25.432 -1.246 4.499
43 HG3 MET 516 HG1 MET 516 -25.424 0.342 5.267
44 HE1 MET 516 HE1 MET 516 -24.853 -2.362 6.828
45 HE2 MET 516 HE2 MET 516 -25.788 -2.113 8.302
46 HE3 MET 516 HE3 MET 516 -24.859 -0.781 7.610
47 H SER 517 HN SER 517 -27.045 -1.070 0.891
48 HA SER 517 HA SER 517 -24.824 -2.817 1.085
49 HB2 SER 517 HB2 SER 517 -27.025 -3.567 0.270
50 HB3 SER 517 HB1 SER 517 -26.855 -2.528 -1.145
51 HG SER 517 HG SER 517 -25.826 -4.107 -2.045
52 H LEU 518 HN LEU 518 -25.692 -0.301 -1.308
53 HA LEU 518 HA LEU 518 -23.397 -0.744 -2.879
54 HB2 LEU 518 HB2 LEU 518 -23.888 1.549 -3.833
55 HB3 LEU 518 HB1 LEU 518 -25.109 0.313 -4.036
56 HG LEU 518 HG LEU 518 -26.162 1.439 -1.901
57 HD11 LEU 518 HD11 LEU 518 -24.286 3.531 -2.945
58 HD12 LEU 518 HD12 LEU 518 -24.602 3.043 -1.274
59 HD13 LEU 518 HD13 LEU 518 -25.807 3.969 -2.168
60 HD21 LEU 518 HD21 LEU 518 -27.476 2.876 -3.374
61 HD22 LEU 518 HD22 LEU 518 -27.218 1.283 -4.085
62 HD23 LEU 518 HD23 LEU 518 -26.278 2.665 -4.651
63 H ALA 519 HN ALA 519 -24.067 1.508 -0.265
64 HA ALA 519 HA ALA 519 -21.620 2.888 -0.326
65 HB1 ALA 519 HB1 ALA 519 -22.133 3.456 2.040
66 HB2 ALA 519 HB2 ALA 519 -23.490 2.332 1.973
67 HB3 ALA 519 HB3 ALA 519 -23.472 3.755 0.934
68 H SER 520 HN SER 520 -22.588 -0.096 1.310
69 HA SER 520 HA SER 520 -20.216 -0.509 2.771
70 HB2 SER 520 HB2 SER 520 -22.445 -1.692 3.053
71 HB3 SER 520 HB1 SER 520 -22.002 -2.681 1.665
72 HG SER 520 HG SER 520 -21.331 -3.032 4.199
73 H GLN 521 HN GLN 521 -21.207 -1.447 -0.485
74 HA GLN 521 HA GLN 521 -18.924 -2.963 -1.142
75 HB2 GLN 521 HB2 GLN 521 -20.809 -1.411 -2.910
76 HB3 GLN 521 HB1 GLN 521 -19.563 -2.498 -3.497
77 HG2 GLN 521 HG2 GLN 521 -20.610 -4.376 -2.497
78 HG3 GLN 521 HG1 GLN 521 -21.759 -3.355 -1.640
79 HE21 GLN 521 HE21 GLN 521 -23.449 -2.425 -2.765
80 HE22 GLN 521 HE22 GLN 521 -23.938 -2.979 -4.329
81 H VAL 522 HN VAL 522 -19.676 0.481 -1.661
82 HA VAL 522 HA VAL 522 -17.246 1.205 -2.851
83 HB VAL 522 HB VAL 522 -19.001 2.867 -1.028
84 HG11 VAL 522 HG11 VAL 522 -16.832 3.707 -2.949
85 HG12 VAL 522 HG12 VAL 522 -16.796 3.851 -1.192
86 HG13 VAL 522 HG13 VAL 522 -17.943 4.806 -2.132
87 HG21 VAL 522 HG21 VAL 522 -19.948 3.755 -3.097
88 HG22 VAL 522 HG22 VAL 522 -20.175 2.009 -2.994
89 HG23 VAL 522 HG23 VAL 522 -18.919 2.674 -4.039
90 H VAL 523 HN VAL 523 -18.188 0.949 0.532
91 HA VAL 523 HA VAL 523 -15.820 1.863 1.701
92 HB VAL 523 HB VAL 523 -18.123 0.189 2.585
93 HG11 VAL 523 HG11 VAL 523 -15.533 0.387 4.094
94 HG12 VAL 523 HG12 VAL 523 -16.399 -1.066 3.588
95 HG13 VAL 523 HG13 VAL 523 -17.075 -0.030 4.843
96 HG21 VAL 523 HG21 VAL 523 -18.312 1.938 4.280
97 HG22 VAL 523 HG22 VAL 523 -18.248 2.621 2.656
98 HG23 VAL 523 HG23 VAL 523 -16.822 2.674 3.689
99 H LYS 524 HN LYS 524 -16.804 -1.355 0.596
100 HA LYS 524 HA LYS 524 -14.541 -2.784 1.450
101 HB2 LYS 524 HB2 LYS 524 -16.817 -3.226 -0.257
102 HB3 LYS 524 HB1 LYS 524 -15.377 -3.947 -0.964
103 HG2 LYS 524 HG2 LYS 524 -16.513 -5.568 0.386
104 HG3 LYS 524 HG1 LYS 524 -14.993 -5.128 1.173
105 HD2 LYS 524 HD2 LYS 524 -16.258 -3.524 2.576
106 HD3 LYS 524 HD1 LYS 524 -17.749 -4.128 1.861
107 HE2 LYS 524 HE2 LYS 524 -15.761 -5.837 3.351
108 HE3 LYS 524 HE1 LYS 524 -17.228 -5.159 4.058
109 HZ1 LYS 524 HZ1 LYS 524 -17.448 -7.497 3.275
110 HZ2 LYS 524 HZ2 LYS 524 -17.225 -6.945 1.687
111 HZ3 LYS 524 HZ3 LYS 524 -18.565 -6.424 2.580
112 H LEU 525 HN LEU 525 -15.211 -1.119 -1.620
113 HA LEU 525 HA LEU 525 -12.757 -1.765 -2.857
114 HB2 LEU 525 HB2 LEU 525 -14.829 0.338 -3.323
115 HB3 LEU 525 HB1 LEU 525 -13.278 0.491 -4.124
116 HG LEU 525 HG LEU 525 -13.637 -1.808 -5.081
117 HD11 LEU 525 HD11 LEU 525 -16.512 -1.420 -4.305
118 HD12 LEU 525 HD12 LEU 525 -15.401 -2.405 -3.361
119 HD13 LEU 525 HD13 LEU 525 -15.752 -2.835 -5.036
120 HD21 LEU 525 HD21 LEU 525 -15.186 -1.020 -6.809
121 HD22 LEU 525 HD22 LEU 525 -13.983 0.199 -6.393
122 HD23 LEU 525 HD23 LEU 525 -15.631 0.342 -5.781
123 H THR 526 HN THR 526 -13.736 0.915 -0.791
124 HA THR 526 HA THR 526 -11.345 2.391 -1.065
125 HB THR 526 HB THR 526 -13.782 2.454 0.628
126 HG1 THR 526 HG1 THR 526 -13.159 3.642 -1.473
127 HG21 THR 526 HG21 THR 526 -12.114 2.667 2.311
128 HG22 THR 526 HG22 THR 526 -12.848 4.251 2.040
129 HG23 THR 526 HG23 THR 526 -11.246 3.894 1.386
130 H LYS 527 HN LYS 527 -12.537 -0.004 1.260
131 HA LYS 527 HA LYS 527 -10.339 0.042 3.020
132 HB2 LYS 527 HB2 LYS 527 -12.515 -1.064 3.501
133 HB3 LYS 527 HB1 LYS 527 -12.119 -2.306 2.321
134 HG2 LYS 527 HG2 LYS 527 -11.678 -3.154 4.512
135 HG3 LYS 527 HG1 LYS 527 -10.137 -2.896 3.691
136 HD2 LYS 527 HD2 LYS 527 -10.007 -2.113 5.985
137 HD3 LYS 527 HD1 LYS 527 -9.895 -0.749 4.868
138 HE2 LYS 527 HE2 LYS 527 -12.279 -0.277 5.227
139 HE3 LYS 527 HE1 LYS 527 -12.366 -1.622 6.369
140 HZ1 LYS 527 HZ1 LYS 527 -12.115 0.397 7.586
141 HZ2 LYS 527 HZ2 LYS 527 -10.783 0.873 6.652
142 HZ3 LYS 527 HZ3 LYS 527 -10.647 -0.450 7.705
143 H GLN 528 HN GLN 528 -11.026 -1.828 0.112
144 HA GLN 528 HA GLN 528 -8.760 -3.469 0.100
145 HB2 GLN 528 HB2 GLN 528 -10.718 -3.811 -1.341
146 HB3 GLN 528 HB1 GLN 528 -10.329 -2.344 -2.227
147 HG2 GLN 528 HG2 GLN 528 -8.172 -3.410 -2.889
148 HG3 GLN 528 HG1 GLN 528 -8.756 -4.903 -2.149
149 HE21 GLN 528 HE21 GLN 528 -10.480 -5.996 -3.090
150 HE22 GLN 528 HE22 GLN 528 -10.986 -5.691 -4.721
151 H LEU 529 HN LEU 529 -9.316 -0.293 -1.401
152 HA LEU 529 HA LEU 529 -6.791 0.018 -2.582
153 HB2 LEU 529 HB2 LEU 529 -8.688 2.080 -1.460
154 HB3 LEU 529 HB1 LEU 529 -7.290 2.462 -2.445
155 HG LEU 529 HG LEU 529 -9.621 0.783 -3.367
156 HD11 LEU 529 HD11 LEU 529 -8.973 3.638 -4.069
157 HD12 LEU 529 HD12 LEU 529 -10.153 3.163 -2.847
158 HD13 LEU 529 HD13 LEU 529 -10.400 2.708 -4.535
159 HD21 LEU 529 HD21 LEU 529 -8.652 1.083 -5.581
160 HD22 LEU 529 HD22 LEU 529 -7.498 0.299 -4.503
161 HD23 LEU 529 HD23 LEU 529 -7.319 2.010 -4.891
162 H LYS 530 HN LYS 530 -8.002 1.010 0.595
163 HA LYS 530 HA LYS 530 -5.668 2.218 1.547
164 HB2 LYS 530 HB2 LYS 530 -7.880 2.384 2.642
165 HB3 LYS 530 HB1 LYS 530 -7.740 0.706 3.152
166 HG2 LYS 530 HG2 LYS 530 -7.206 2.308 4.945
167 HG3 LYS 530 HG1 LYS 530 -5.854 1.243 4.553
168 HD2 LYS 530 HD2 LYS 530 -4.854 3.011 3.187
169 HD3 LYS 530 HD1 LYS 530 -6.206 4.078 3.569
170 HE2 LYS 530 HE2 LYS 530 -4.370 2.877 5.631
171 HE3 LYS 530 HE1 LYS 530 -4.139 4.474 4.922
172 HZ1 LYS 530 HZ1 LYS 530 -5.273 4.639 7.022
173 HZ2 LYS 530 HZ2 LYS 530 -6.490 3.583 6.503
174 HZ3 LYS 530 HZ3 LYS 530 -6.324 5.108 5.774
175 H GLU 531 HN GLU 531 -6.725 -1.176 1.796
176 HA GLU 531 HA GLU 531 -4.457 -2.055 3.243
177 HB2 GLU 531 HB2 GLU 531 -6.331 -3.584 1.435
178 HB3 GLU 531 HB1 GLU 531 -5.118 -4.327 2.470
179 HG2 GLU 531 HG2 GLU 531 -6.230 -3.238 4.419
180 HG3 GLU 531 HG1 GLU 531 -7.514 -2.728 3.323
181 H GLN 532 HN GLN 532 -5.153 -1.860 -0.209
182 HA GLN 532 HA GLN 532 -2.801 -3.053 -1.163
183 HB2 GLN 532 HB2 GLN 532 -4.979 -2.148 -2.341
184 HB3 GLN 532 HB1 GLN 532 -3.980 -0.734 -2.616
185 HG2 GLN 532 HG2 GLN 532 -3.507 -3.549 -3.564
186 HG3 GLN 532 HG1 GLN 532 -3.881 -2.139 -4.544
187 HE21 GLN 532 HE21 GLN 532 -1.441 -3.910 -2.889
188 HE22 GLN 532 HE22 GLN 532 -0.089 -2.985 -3.435
189 H THR 533 HN THR 533 -3.532 0.135 0.052
190 HA THR 533 HA THR 533 -1.115 1.376 -0.821
191 HB THR 533 HB THR 533 -2.923 2.269 1.431
192 HG1 THR 533 HG1 THR 533 -3.903 1.896 -0.754
193 HG21 THR 533 HG21 THR 533 -0.688 3.364 1.243
194 HG22 THR 533 HG22 THR 533 -2.041 4.467 0.995
195 HG23 THR 533 HG23 THR 533 -1.123 3.874 -0.389
196 H VAL 534 HN VAL 534 -2.180 0.023 2.314
197 HA VAL 534 HA VAL 534 0.128 0.805 3.711
198 HB VAL 534 HB VAL 534 -0.497 -0.834 5.444
199 HG11 VAL 534 HG11 VAL 534 -2.661 0.166 6.008
200 HG12 VAL 534 HG12 VAL 534 -2.787 0.807 4.370
201 HG13 VAL 534 HG13 VAL 534 -1.506 1.374 5.443
202 HG21 VAL 534 HG21 VAL 534 -2.482 -2.189 5.231
203 HG22 VAL 534 HG22 VAL 534 -1.348 -2.601 3.945
204 HG23 VAL 534 HG23 VAL 534 -2.751 -1.596 3.593
205 H GLU 535 HN GLU 535 -0.583 -2.194 1.938
206 HA GLU 535 HA GLU 535 1.891 -3.420 2.650
207 HB2 GLU 535 HB2 GLU 535 1.365 -5.028 0.867
208 HB3 GLU 535 HB1 GLU 535 0.000 -4.775 1.943
209 HG2 GLU 535 HG2 GLU 535 -1.025 -3.295 0.319
210 HG3 GLU 535 HG1 GLU 535 0.360 -3.498 -0.752
211 H ARG 536 HN ARG 536 0.817 -1.346 0.031
212 HA ARG 536 HA ARG 536 3.114 -1.639 -1.591
213 HB2 ARG 536 HB2 ARG 536 1.059 -0.810 -2.534
214 HB3 ARG 536 HB1 ARG 536 1.061 0.561 -1.438
215 HG2 ARG 536 HG2 ARG 536 3.466 0.355 -3.079
216 HG3 ARG 536 HG1 ARG 536 1.977 0.584 -3.999
217 HD2 ARG 536 HD2 ARG 536 2.725 2.274 -1.630
218 HD3 ARG 536 HD1 ARG 536 3.181 2.694 -3.283
219 HE ARG 536 HE ARG 536 0.505 2.315 -3.465
220 HH11 ARG 536 HH11 ARG 536 2.493 4.267 -1.324
221 HH12 ARG 536 HH12 ARG 536 1.266 5.480 -1.097
222 HH21 ARG 536 HH21 ARG 536 -1.074 3.934 -3.208
223 HH22 ARG 536 HH22 ARG 536 -0.746 5.309 -2.190
224 H VAL 537 HN VAL 537 2.231 0.804 0.862
225 HA VAL 537 HA VAL 537 4.614 2.303 0.608
226 HB VAL 537 HB VAL 537 4.139 3.274 2.784
227 HG11 VAL 537 HG11 VAL 537 1.875 4.120 2.343
228 HG12 VAL 537 HG12 VAL 537 1.667 2.858 1.126
229 HG13 VAL 537 HG13 VAL 537 2.890 4.110 0.898
230 HG21 VAL 537 HG21 VAL 537 2.447 2.519 4.253
231 HG22 VAL 537 HG22 VAL 537 3.404 1.094 3.836
232 HG23 VAL 537 HG23 VAL 537 1.836 1.362 3.073
233 H THR 538 HN THR 538 3.748 -0.474 2.565
234 HA THR 538 HA THR 538 6.111 -0.669 4.068
235 HB THR 538 HB THR 538 4.171 -2.795 3.167
236 HG1 THR 538 HG1 THR 538 3.047 -1.608 4.546
237 HG21 THR 538 HG21 THR 538 6.297 -3.814 3.757
238 HG22 THR 538 HG22 THR 538 5.082 -4.169 4.985
239 HG23 THR 538 HG23 THR 538 6.312 -2.942 5.289
240 H LEU 539 HN LEU 539 5.232 -1.971 0.881
241 HA LEU 539 HA LEU 539 7.602 -3.446 0.458
242 HB2 LEU 539 HB2 LEU 539 5.615 -3.894 -0.825
243 HB3 LEU 539 HB1 LEU 539 5.549 -2.246 -1.403
244 HG LEU 539 HG LEU 539 6.282 -4.055 -3.044
245 HD11 LEU 539 HD11 LEU 539 8.353 -1.928 -2.881
246 HD12 LEU 539 HD12 LEU 539 6.660 -1.471 -3.052
247 HD13 LEU 539 HD13 LEU 539 7.423 -2.501 -4.272
248 HD21 LEU 539 HD21 LEU 539 7.817 -5.232 -1.547
249 HD22 LEU 539 HD22 LEU 539 8.850 -3.802 -1.485
250 HD23 LEU 539 HD23 LEU 539 8.637 -4.671 -3.006
251 H GLN 540 HN GLN 540 6.612 -0.156 -0.434
252 HA GLN 540 HA GLN 540 9.039 0.587 -1.663
253 HB2 GLN 540 HB2 GLN 540 6.955 2.274 -0.276
254 HB3 GLN 540 HB1 GLN 540 8.288 2.915 -1.229
255 HG2 GLN 540 HG2 GLN 540 6.222 1.025 -2.288
256 HG3 GLN 540 HG1 GLN 540 6.126 2.781 -2.443
257 HE21 GLN 540 HE21 GLN 540 6.297 0.721 -4.515
258 HE22 GLN 540 HE22 GLN 540 7.706 1.109 -5.452
259 H ASN 541 HN ASN 541 8.067 0.379 1.656
260 HA ASN 541 HA ASN 541 10.241 1.868 2.757
261 HB2 ASN 541 HB2 ASN 541 8.101 1.251 3.974
262 HB3 ASN 541 HB1 ASN 541 8.744 -0.382 4.110
263 HD21 ASN 541 HD21 ASN 541 10.415 -0.798 5.523
264 HD22 ASN 541 HD22 ASN 541 10.935 0.346 6.707
265 H GLN 542 HN GLN 542 9.695 -1.544 2.009
266 HA GLN 542 HA GLN 542 12.238 -2.444 2.898
267 HB2 GLN 542 HB2 GLN 542 10.419 -3.637 0.796
268 HB3 GLN 542 HB1 GLN 542 11.760 -4.458 1.585
269 HG2 GLN 542 HG2 GLN 542 10.601 -4.233 3.742
270 HG3 GLN 542 HG1 GLN 542 9.246 -3.463 2.914
271 HE21 GLN 542 HE21 GLN 542 9.313 -5.916 4.478
272 HE22 GLN 542 HE22 GLN 542 8.738 -7.165 3.425
273 H LEU 543 HN LEU 543 10.983 -1.228 -0.161
274 HA LEU 543 HA LEU 543 13.369 -1.559 -1.656
275 HB2 LEU 543 HB2 LEU 543 11.088 -1.134 -2.609
276 HB3 LEU 543 HB1 LEU 543 11.217 0.522 -2.052
277 HG LEU 543 HG LEU 543 13.356 -0.527 -3.848
278 HD11 LEU 543 HD11 LEU 543 10.611 0.329 -4.766
279 HD12 LEU 543 HD12 LEU 543 11.319 -1.277 -4.934
280 HD13 LEU 543 HD13 LEU 543 12.010 0.087 -5.813
281 HD21 LEU 543 HD21 LEU 543 13.267 1.799 -4.683
282 HD22 LEU 543 HD22 LEU 543 13.587 1.708 -2.952
283 HD23 LEU 543 HD23 LEU 543 11.977 2.140 -3.528
284 H GLN 544 HN GLN 544 12.172 0.931 0.498
285 HA GLN 544 HA GLN 544 14.140 2.872 0.056
286 HB2 GLN 544 HB2 GLN 544 12.130 3.338 1.335
287 HB3 GLN 544 HB1 GLN 544 12.587 2.154 2.551
288 HG2 GLN 544 HG2 GLN 544 14.531 3.521 3.111
289 HG3 GLN 544 HG1 GLN 544 14.009 4.731 1.941
290 HE21 GLN 544 HE21 GLN 544 13.396 3.257 5.017
291 HE22 GLN 544 HE22 GLN 544 12.242 4.423 5.577
292 H GLN 545 HN GLN 545 13.982 0.169 2.344
293 HA GLN 545 HA GLN 545 16.529 0.416 3.457
294 HB2 GLN 545 HB2 GLN 545 14.572 -1.119 4.108
295 HB3 GLN 545 HB1 GLN 545 15.176 -2.207 2.868
296 HG2 GLN 545 HG2 GLN 545 17.337 -2.291 4.031
297 HG3 GLN 545 HG1 GLN 545 16.658 -1.260 5.288
298 HE21 GLN 545 HE21 GLN 545 17.718 -3.969 5.482
299 HE22 GLN 545 HE22 GLN 545 16.432 -4.939 6.129
300 H PHE 546 HN PHE 546 15.387 -1.092 0.500
301 HA PHE 546 HA PHE 546 17.788 -2.360 -0.252
302 HB2 PHE 546 HB2 PHE 546 16.035 -3.222 -1.430
303 HB3 PHE 546 HB1 PHE 546 15.190 -1.673 -1.505
304 HD1 PHE 546 HD1 PHE 546 17.983 -3.605 -3.010
305 HD2 PHE 546 HD2 PHE 546 15.229 -0.391 -3.422
306 HE1 PHE 546 HE1 PHE 546 18.627 -3.358 -5.373
307 HE2 PHE 546 HE2 PHE 546 15.863 -0.132 -5.772
308 HZ PHE 546 HZ PHE 546 17.569 -1.617 -6.761
309 H LEU 547 HN LEU 547 16.394 0.784 -1.233
310 HA LEU 547 HA LEU 547 18.573 1.516 -2.846
311 HB2 LEU 547 HB2 LEU 547 17.626 3.684 -2.962
312 HB3 LEU 547 HB1 LEU 547 16.316 2.529 -2.945
313 HG LEU 547 HG LEU 547 16.248 3.095 -0.376
314 HD11 LEU 547 HD11 LEU 547 17.449 5.591 -1.561
315 HD12 LEU 547 HD12 LEU 547 18.218 4.533 -0.377
316 HD13 LEU 547 HD13 LEU 547 16.768 5.438 0.057
317 HD21 LEU 547 HD21 LEU 547 14.429 3.429 -1.936
318 HD22 LEU 547 HD22 LEU 547 15.190 4.900 -2.539
319 HD23 LEU 547 HD23 LEU 547 14.598 4.832 -0.880
320 H GLU 548 HN GLU 548 17.920 1.978 0.566
321 HA GLU 548 HA GLU 548 20.150 3.577 1.165
322 HB2 GLU 548 HB2 GLU 548 18.618 1.598 2.834
323 HB3 GLU 548 HB1 GLU 548 19.954 2.541 3.478
324 HG2 GLU 548 HG2 GLU 548 18.728 4.606 2.847
325 HG3 GLU 548 HG1 GLU 548 17.369 3.592 2.364
326 H ALA 549 HN ALA 549 19.768 0.060 1.009
327 HA ALA 549 HA ALA 549 22.357 -0.658 1.799
328 HB1 ALA 549 HB1 ALA 549 21.964 -2.754 0.600
329 HB2 ALA 549 HB2 ALA 549 20.569 -2.035 -0.205
330 HB3 ALA 549 HB3 ALA 549 20.549 -2.281 1.541
331 H GLN 550 HN GLN 550 21.047 0.232 -1.369
332 HA GLN 550 HA GLN 550 23.367 -0.120 -2.903
333 HB2 GLN 550 HB2 GLN 550 21.228 1.986 -3.245
334 HB3 GLN 550 HB1 GLN 550 22.381 1.486 -4.472
335 HG2 GLN 550 HG2 GLN 550 20.333 -0.320 -3.228
336 HG3 GLN 550 HG1 GLN 550 20.108 0.543 -4.747
337 HE21 GLN 550 HE21 GLN 550 19.900 -1.289 -5.962
338 HE22 GLN 550 HE22 GLN 550 21.218 -2.363 -6.297
339 H LYS 551 HN LYS 551 22.276 2.557 -0.901
340 HA LYS 551 HA LYS 551 24.313 4.394 -1.597
341 HB2 LYS 551 HB2 LYS 551 22.794 4.168 1.003
342 HB3 LYS 551 HB1 LYS 551 23.725 5.561 0.482
343 HG2 LYS 551 HG2 LYS 551 21.282 4.483 -0.903
344 HG3 LYS 551 HG1 LYS 551 21.316 5.872 0.182
345 HD2 LYS 551 HD2 LYS 551 22.793 7.050 -1.346
346 HD3 LYS 551 HD1 LYS 551 22.856 5.634 -2.397
347 HE2 LYS 551 HE2 LYS 551 20.400 7.260 -1.755
348 HE3 LYS 551 HE1 LYS 551 21.302 7.298 -3.271
349 HZ1 LYS 551 HZ1 LYS 551 20.755 4.970 -3.609
350 HZ2 LYS 551 HZ2 LYS 551 19.341 5.898 -3.446
351 HZ3 LYS 551 HZ3 LYS 551 19.881 4.941 -2.159
352 H SER 552 HN SER 552 23.981 2.245 1.221
353 HA SER 552 HA SER 552 26.425 2.868 2.402
354 HB2 SER 552 HB2 SER 552 24.926 0.248 2.558
355 HB3 SER 552 HB1 SER 552 26.108 0.848 3.720
356 HG SER 552 HG SER 552 23.633 1.195 3.969
357 H GLU 553 HN GLU 553 25.717 0.677 -0.219
358 HA GLU 553 HA GLU 553 28.361 -0.509 -0.126
359 HB2 GLU 553 HB2 GLU 553 26.068 -0.821 -2.064
360 HB3 GLU 553 HB1 GLU 553 27.597 -1.680 -2.209
361 HG2 GLU 553 HG2 GLU 553 25.769 -1.843 0.171
362 HG3 GLU 553 HG1 GLU 553 25.785 -3.005 -1.156
363 H GLY 554 HN GLY 554 26.544 1.708 -2.194
364 HA2 GLY 554 HA2 GLY 554 28.626 1.973 -4.134
365 HA3 GLY 554 HA1 GLY 554 27.178 2.955 -4.021
366 H LYS 555 HN LYS 555 27.916 3.602 -1.152
367 HA LYS 555 HA LYS 555 29.433 5.957 -1.714
368 HB2 LYS 555 HB2 LYS 555 29.164 6.490 0.608
369 HB3 LYS 555 HB1 LYS 555 27.661 5.787 0.037
370 HG2 LYS 555 HG2 LYS 555 28.317 3.633 1.048
371 HG3 LYS 555 HG1 LYS 555 29.770 4.407 1.684
372 HD2 LYS 555 HD2 LYS 555 26.936 5.251 2.301
373 HD3 LYS 555 HD1 LYS 555 27.951 4.266 3.355
374 HE2 LYS 555 HE2 LYS 555 28.706 7.026 2.417
375 HE3 LYS 555 HE1 LYS 555 27.844 6.715 3.920
376 HZ1 LYS 555 HZ1 LYS 555 29.677 5.503 4.767
377 HZ2 LYS 555 HZ2 LYS 555 30.303 6.950 4.140
378 HZ3 LYS 555 HZ3 LYS 555 30.477 5.505 3.272
379 H SER 556 HN SER 556 30.271 2.767 -0.985
380 HA SER 556 HA SER 556 32.857 3.464 0.151
381 HB2 SER 556 HB2 SER 556 31.546 1.536 1.045
382 HB3 SER 556 HB1 SER 556 31.732 0.732 -0.513
383 HG SER 556 HG SER 556 33.294 0.168 1.187
384 H LEU 557 HN LEU 557 34.279 4.195 -1.306
385 HA LEU 557 HA LEU 557 34.442 2.833 -3.897
386 HB2 LEU 557 HB2 LEU 557 35.661 4.791 -4.717
387 HB3 LEU 557 HB1 LEU 557 34.067 5.208 -4.130
388 HG LEU 557 HG LEU 557 36.503 5.601 -2.405
389 HD11 LEU 557 HD11 LEU 557 36.869 6.746 -4.563
390 HD12 LEU 557 HD12 LEU 557 36.658 7.875 -3.227
391 HD13 LEU 557 HD13 LEU 557 35.332 7.587 -4.354
392 HD21 LEU 557 HD21 LEU 557 33.812 6.967 -2.501
393 HD22 LEU 557 HD22 LEU 557 35.102 7.285 -1.340
394 HD23 LEU 557 HD23 LEU 557 34.284 5.721 -1.345
Start of MODEL 5
1 H1 GLY 510 HT1 GLY 510 -35.313 2.999 3.071
2 H2 GLY 510 HT2 GLY 510 -36.440 3.874 2.157
3 H3 GLY 510 HT3 GLY 510 -36.814 3.405 3.741
4 HA2 GLY 510 HA1 GLY 510 -34.673 5.316 2.975
5 HA3 GLY 510 HA2 GLY 510 -36.248 5.765 3.616
6 H SER 511 HN SER 511 -35.147 2.880 4.957
7 HA SER 511 HA SER 511 -34.496 4.272 7.448
8 HB2 SER 511 HB2 SER 511 -35.033 1.334 6.948
9 HB3 SER 511 HB1 SER 511 -34.873 2.112 8.523
10 HG SER 511 HG SER 511 -37.049 1.917 8.052
11 H VAL 512 HN VAL 512 -32.645 4.097 5.175
12 HA VAL 512 HA VAL 512 -30.448 3.784 4.745
13 HB VAL 512 HB VAL 512 -30.056 3.004 7.629
14 HG11 VAL 512 HG11 VAL 512 -28.254 4.669 5.916
15 HG12 VAL 512 HG12 VAL 512 -28.233 2.912 5.818
16 HG13 VAL 512 HG13 VAL 512 -27.853 3.713 7.346
17 HG21 VAL 512 HG21 VAL 512 -31.415 5.033 7.623
18 HG22 VAL 512 HG22 VAL 512 -30.282 5.803 6.511
19 HG23 VAL 512 HG23 VAL 512 -29.769 5.389 8.147
20 H GLU 513 HN GLU 513 -32.475 1.541 4.844
21 HA GLU 513 HA GLU 513 -31.168 -0.830 5.650
22 HB2 GLU 513 HB2 GLU 513 -32.958 -2.021 4.526
23 HB3 GLU 513 HB1 GLU 513 -33.596 -0.686 5.466
24 HG2 GLU 513 HG2 GLU 513 -33.140 -0.583 2.492
25 HG3 GLU 513 HG1 GLU 513 -34.672 -1.023 3.243
26 H THR 514 HN THR 514 -31.529 0.779 2.534
27 HA THR 514 HA THR 514 -29.845 -1.195 1.220
28 HB THR 514 HB THR 514 -30.212 0.303 -0.785
29 HG1 THR 514 HG1 THR 514 -31.947 1.857 -0.490
30 HG21 THR 514 HG21 THR 514 -31.600 -1.674 -0.414
31 HG22 THR 514 HG22 THR 514 -32.566 -0.360 -1.084
32 HG23 THR 514 HG23 THR 514 -32.671 -0.743 0.635
33 H CYS 515 HN CYS 515 -29.761 2.134 2.296
34 HA CYS 515 HA CYS 515 -27.373 2.898 1.052
35 HB2 CYS 515 HB2 CYS 515 -28.958 4.519 1.951
36 HB3 CYS 515 HB1 CYS 515 -28.614 3.966 3.594
37 HG CYS 515 HG CYS 515 -26.739 5.918 1.540
38 H MET 516 HN MET 516 -27.986 1.375 4.193
39 HA MET 516 HA MET 516 -25.357 1.572 5.167
40 HB2 MET 516 HB2 MET 516 -27.230 0.910 6.600
41 HB3 MET 516 HB1 MET 516 -27.407 -0.589 5.697
42 HG2 MET 516 HG2 MET 516 -25.238 -1.343 6.445
43 HG3 MET 516 HG1 MET 516 -24.962 0.191 7.269
44 HE1 MET 516 HE1 MET 516 -28.350 -1.811 7.101
45 HE2 MET 516 HE2 MET 516 -28.216 -2.837 8.531
46 HE3 MET 516 HE3 MET 516 -27.131 -3.083 7.163
47 H SER 517 HN SER 517 -26.892 -0.734 3.007
48 HA SER 517 HA SER 517 -24.739 -2.578 2.960
49 HB2 SER 517 HB2 SER 517 -26.914 -2.129 0.905
50 HB3 SER 517 HB1 SER 517 -25.893 -3.562 1.046
51 HG SER 517 HG SER 517 -28.072 -3.610 2.065
52 H LEU 518 HN LEU 518 -25.698 0.054 0.727
53 HA LEU 518 HA LEU 518 -23.491 -0.370 -0.977
54 HB2 LEU 518 HB2 LEU 518 -24.003 1.945 -1.836
55 HB3 LEU 518 HB1 LEU 518 -25.256 0.737 -1.994
56 HG LEU 518 HG LEU 518 -26.135 1.844 0.244
57 HD11 LEU 518 HD11 LEU 518 -24.306 3.896 -0.924
58 HD12 LEU 518 HD12 LEU 518 -24.564 3.451 0.768
59 HD13 LEU 518 HD13 LEU 518 -25.787 4.381 -0.099
60 HD21 LEU 518 HD21 LEU 518 -26.465 3.088 -2.482
61 HD22 LEU 518 HD22 LEU 518 -27.557 3.292 -1.112
62 HD23 LEU 518 HD23 LEU 518 -27.362 1.705 -1.857
63 H ALA 519 HN ALA 519 -23.986 1.837 1.732
64 HA ALA 519 HA ALA 519 -21.613 3.304 1.446
65 HB1 ALA 519 HB1 ALA 519 -21.936 3.927 3.809
66 HB2 ALA 519 HB2 ALA 519 -23.202 2.703 3.934
67 HB3 ALA 519 HB3 ALA 519 -23.411 4.082 2.856
68 H SER 520 HN SER 520 -22.294 0.345 3.300
69 HA SER 520 HA SER 520 -19.705 0.147 4.438
70 HB2 SER 520 HB2 SER 520 -20.332 -2.237 4.873
71 HB3 SER 520 HB1 SER 520 -21.516 -1.072 5.460
72 HG SER 520 HG SER 520 -22.929 -1.757 4.039
73 H GLN 521 HN GLN 521 -21.134 -1.035 1.447
74 HA GLN 521 HA GLN 521 -18.971 -2.621 0.601
75 HB2 GLN 521 HB2 GLN 521 -21.137 -2.745 -0.486
76 HB3 GLN 521 HB1 GLN 521 -20.995 -1.081 -1.029
77 HG2 GLN 521 HG2 GLN 521 -19.178 -1.650 -2.484
78 HG3 GLN 521 HG1 GLN 521 -19.148 -3.296 -1.858
79 HE21 GLN 521 HE21 GLN 521 -20.886 -1.000 -3.823
80 HE22 GLN 521 HE22 GLN 521 -21.885 -2.162 -4.644
81 H VAL 522 HN VAL 522 -19.759 0.792 -0.035
82 HA VAL 522 HA VAL 522 -17.449 1.469 -1.454
83 HB VAL 522 HB VAL 522 -19.036 3.205 0.456
84 HG11 VAL 522 HG11 VAL 522 -17.129 3.999 -1.745
85 HG12 VAL 522 HG12 VAL 522 -16.843 4.165 -0.014
86 HG13 VAL 522 HG13 VAL 522 -18.118 5.103 -0.789
87 HG21 VAL 522 HG21 VAL 522 -20.404 2.256 -1.326
88 HG22 VAL 522 HG22 VAL 522 -19.271 2.862 -2.531
89 HG23 VAL 522 HG23 VAL 522 -20.198 3.992 -1.545
90 H VAL 523 HN VAL 523 -18.069 1.350 2.020
91 HA VAL 523 HA VAL 523 -15.601 2.339 2.903
92 HB VAL 523 HB VAL 523 -17.771 0.671 4.113
93 HG11 VAL 523 HG11 VAL 523 -15.100 1.192 5.399
94 HG12 VAL 523 HG12 VAL 523 -15.833 -0.367 5.017
95 HG13 VAL 523 HG13 VAL 523 -16.547 0.658 6.260
96 HG21 VAL 523 HG21 VAL 523 -17.870 2.567 5.675
97 HG22 VAL 523 HG22 VAL 523 -18.068 3.066 3.995
98 HG23 VAL 523 HG23 VAL 523 -16.529 3.326 4.815
99 H LYS 524 HN LYS 524 -16.680 -0.948 2.105
100 HA LYS 524 HA LYS 524 -14.283 -2.248 2.833
101 HB2 LYS 524 HB2 LYS 524 -16.706 -2.947 1.352
102 HB3 LYS 524 HB1 LYS 524 -15.274 -3.805 0.799
103 HG2 LYS 524 HG2 LYS 524 -16.324 -5.149 2.446
104 HG3 LYS 524 HG1 LYS 524 -14.874 -4.465 3.183
105 HD2 LYS 524 HD2 LYS 524 -16.333 -2.666 4.138
106 HD3 LYS 524 HD1 LYS 524 -17.726 -3.581 3.570
107 HE2 LYS 524 HE2 LYS 524 -15.638 -4.575 5.510
108 HE3 LYS 524 HE1 LYS 524 -17.260 -4.029 5.934
109 HZ1 LYS 524 HZ1 LYS 524 -18.117 -5.836 4.472
110 HZ2 LYS 524 HZ2 LYS 524 -17.288 -6.385 5.845
111 HZ3 LYS 524 HZ3 LYS 524 -16.527 -6.418 4.331
112 H LEU 525 HN LEU 525 -15.355 -0.804 -0.235
113 HA LEU 525 HA LEU 525 -13.078 -1.464 -1.751
114 HB2 LEU 525 HB2 LEU 525 -15.172 0.647 -1.937
115 HB3 LEU 525 HB1 LEU 525 -13.710 0.871 -2.876
116 HG LEU 525 HG LEU 525 -14.119 -1.349 -3.942
117 HD11 LEU 525 HD11 LEU 525 -16.883 -1.195 -2.792
118 HD12 LEU 525 HD12 LEU 525 -15.599 -2.111 -2.008
119 HD13 LEU 525 HD13 LEU 525 -16.109 -2.534 -3.644
120 HD21 LEU 525 HD21 LEU 525 -16.304 0.708 -4.205
121 HD22 LEU 525 HD22 LEU 525 -15.943 -0.559 -5.376
122 HD23 LEU 525 HD23 LEU 525 -14.758 0.706 -5.053
123 H THR 526 HN THR 526 -13.746 1.232 0.421
124 HA THR 526 HA THR 526 -11.351 2.641 -0.087
125 HB THR 526 HB THR 526 -13.607 2.772 1.815
126 HG1 THR 526 HG1 THR 526 -13.261 4.062 -0.169
127 HG21 THR 526 HG21 THR 526 -11.811 2.759 3.398
128 HG22 THR 526 HG22 THR 526 -12.502 4.378 3.297
129 HG23 THR 526 HG23 THR 526 -10.959 4.026 2.513
130 H LYS 527 HN LYS 527 -12.326 0.168 2.228
131 HA LYS 527 HA LYS 527 -9.949 0.121 3.752
132 HB2 LYS 527 HB2 LYS 527 -12.043 -0.937 4.486
133 HB3 LYS 527 HB1 LYS 527 -11.922 -2.099 3.173
134 HG2 LYS 527 HG2 LYS 527 -11.229 -3.125 5.229
135 HG3 LYS 527 HG1 LYS 527 -9.837 -2.950 4.159
136 HD2 LYS 527 HD2 LYS 527 -9.244 -2.346 6.438
137 HD3 LYS 527 HD1 LYS 527 -9.155 -0.939 5.378
138 HE2 LYS 527 HE2 LYS 527 -10.202 -0.384 7.516
139 HE3 LYS 527 HE1 LYS 527 -11.335 -0.188 6.182
140 HZ1 LYS 527 HZ1 LYS 527 -11.237 -2.662 7.814
141 HZ2 LYS 527 HZ2 LYS 527 -12.480 -2.125 6.788
142 HZ3 LYS 527 HZ3 LYS 527 -12.186 -1.326 8.248
143 H GLN 528 HN GLN 528 -11.014 -1.705 0.915
144 HA GLN 528 HA GLN 528 -8.780 -3.372 0.647
145 HB2 GLN 528 HB2 GLN 528 -10.898 -3.738 -0.530
146 HB3 GLN 528 HB1 GLN 528 -10.641 -2.280 -1.474
147 HG2 GLN 528 HG2 GLN 528 -8.630 -3.305 -2.458
148 HG3 GLN 528 HG1 GLN 528 -8.982 -4.788 -1.570
149 HE21 GLN 528 HE21 GLN 528 -8.822 -4.296 -4.437
150 HE22 GLN 528 HE22 GLN 528 -10.355 -4.758 -5.102
151 H LEU 529 HN LEU 529 -9.478 -0.180 -0.749
152 HA LEU 529 HA LEU 529 -7.132 0.119 -2.257
153 HB2 LEU 529 HB2 LEU 529 -8.830 2.171 -0.842
154 HB3 LEU 529 HB1 LEU 529 -7.553 2.570 -1.970
155 HG LEU 529 HG LEU 529 -9.993 0.948 -2.682
156 HD11 LEU 529 HD11 LEU 529 -9.408 3.829 -3.321
157 HD12 LEU 529 HD12 LEU 529 -10.440 3.303 -1.993
158 HD13 LEU 529 HD13 LEU 529 -10.889 2.927 -3.660
159 HD21 LEU 529 HD21 LEU 529 -7.856 2.234 -4.381
160 HD22 LEU 529 HD22 LEU 529 -9.293 1.408 -4.986
161 HD23 LEU 529 HD23 LEU 529 -8.059 0.504 -4.105
162 H LYS 530 HN LYS 530 -7.878 1.018 1.075
163 HA LYS 530 HA LYS 530 -5.396 2.183 1.687
164 HB2 LYS 530 HB2 LYS 530 -7.442 2.469 3.048
165 HB3 LYS 530 HB1 LYS 530 -7.313 0.795 3.568
166 HG2 LYS 530 HG2 LYS 530 -5.231 1.261 4.694
167 HG3 LYS 530 HG1 LYS 530 -5.248 2.921 4.094
168 HD2 LYS 530 HD2 LYS 530 -7.328 1.701 5.909
169 HD3 LYS 530 HD1 LYS 530 -6.018 2.759 6.433
170 HE2 LYS 530 HE2 LYS 530 -8.126 3.528 4.421
171 HE3 LYS 530 HE1 LYS 530 -8.214 3.907 6.141
172 HZ1 LYS 530 HZ1 LYS 530 -5.976 4.763 4.384
173 HZ2 LYS 530 HZ2 LYS 530 -6.299 5.272 5.971
174 HZ3 LYS 530 HZ3 LYS 530 -7.337 5.720 4.711
175 H GLU 531 HN GLU 531 -6.577 -1.148 2.229
176 HA GLU 531 HA GLU 531 -4.218 -2.104 3.444
177 HB2 GLU 531 HB2 GLU 531 -6.309 -3.619 1.871
178 HB3 GLU 531 HB1 GLU 531 -5.075 -4.361 2.880
179 HG2 GLU 531 HG2 GLU 531 -6.016 -3.154 4.830
180 HG3 GLU 531 HG1 GLU 531 -7.309 -2.562 3.789
181 H GLN 532 HN GLN 532 -5.234 -1.931 0.087
182 HA GLN 532 HA GLN 532 -3.030 -3.297 -1.022
183 HB2 GLN 532 HB2 GLN 532 -5.007 -2.911 -2.343
184 HB3 GLN 532 HB1 GLN 532 -4.841 -1.170 -2.166
185 HG2 GLN 532 HG2 GLN 532 -2.866 -1.159 -3.522
186 HG3 GLN 532 HG1 GLN 532 -2.849 -2.921 -3.581
187 HE21 GLN 532 HE21 GLN 532 -4.306 -3.998 -4.870
188 HE22 GLN 532 HE22 GLN 532 -5.208 -3.196 -6.118
189 H THR 533 HN THR 533 -3.563 0.092 -0.183
190 HA THR 533 HA THR 533 -1.109 0.979 -1.341
191 HB THR 533 HB THR 533 -2.842 2.380 0.701
192 HG1 THR 533 HG1 THR 533 -4.019 1.982 -1.189
193 HG21 THR 533 HG21 THR 533 -0.498 3.206 0.443
194 HG22 THR 533 HG22 THR 533 -1.736 4.388 0.009
195 HG23 THR 533 HG23 THR 533 -0.853 3.528 -1.255
196 H VAL 534 HN VAL 534 -2.080 0.040 1.957
197 HA VAL 534 HA VAL 534 0.312 0.908 3.164
198 HB VAL 534 HB VAL 534 -0.213 -0.571 5.057
199 HG11 VAL 534 HG11 VAL 534 -2.302 0.512 5.705
200 HG12 VAL 534 HG12 VAL 534 -2.565 1.004 4.032
201 HG13 VAL 534 HG13 VAL 534 -1.193 1.648 4.936
202 HG21 VAL 534 HG21 VAL 534 -2.214 -1.913 5.100
203 HG22 VAL 534 HG22 VAL 534 -1.179 -2.433 3.769
204 HG23 VAL 534 HG23 VAL 534 -2.600 -1.443 3.445
205 H GLU 535 HN GLU 535 -0.551 -2.231 1.702
206 HA GLU 535 HA GLU 535 1.969 -3.395 2.341
207 HB2 GLU 535 HB2 GLU 535 1.361 -5.173 0.817
208 HB3 GLU 535 HB1 GLU 535 -0.015 -4.756 1.818
209 HG2 GLU 535 HG2 GLU 535 -1.176 -4.734 -0.073
210 HG3 GLU 535 HG1 GLU 535 -0.393 -3.189 -0.399
211 H ARG 536 HN ARG 536 0.762 -1.438 -0.261
212 HA ARG 536 HA ARG 536 2.938 -1.785 -2.043
213 HB2 ARG 536 HB2 ARG 536 0.773 -1.040 -2.819
214 HB3 ARG 536 HB1 ARG 536 0.859 0.387 -1.800
215 HG2 ARG 536 HG2 ARG 536 3.093 0.150 -3.660
216 HG3 ARG 536 HG1 ARG 536 1.514 0.270 -4.443
217 HD2 ARG 536 HD2 ARG 536 2.642 2.149 -2.383
218 HD3 ARG 536 HD1 ARG 536 2.459 2.484 -4.106
219 HE ARG 536 HE ARG 536 0.401 2.535 -2.077
220 HH11 ARG 536 HH11 ARG 536 1.079 2.374 -5.511
221 HH12 ARG 536 HH12 ARG 536 -0.511 2.905 -5.978
222 HH21 ARG 536 HH21 ARG 536 -1.716 3.212 -2.702
223 HH22 ARG 536 HH22 ARG 536 -2.090 3.374 -4.393
224 H VAL 537 HN VAL 537 2.197 0.739 0.371
225 HA VAL 537 HA VAL 537 4.584 2.202 -0.075
226 HB VAL 537 HB VAL 537 4.186 3.312 2.055
227 HG11 VAL 537 HG11 VAL 537 1.933 4.182 1.606
228 HG12 VAL 537 HG12 VAL 537 1.667 2.846 0.484
229 HG13 VAL 537 HG13 VAL 537 2.909 4.052 0.141
230 HG21 VAL 537 HG21 VAL 537 2.530 2.680 3.616
231 HG22 VAL 537 HG22 VAL 537 3.431 1.204 3.244
232 HG23 VAL 537 HG23 VAL 537 1.848 1.481 2.517
233 H THR 538 HN THR 538 3.728 -0.413 2.110
234 HA THR 538 HA THR 538 6.119 -0.608 3.529
235 HB THR 538 HB THR 538 4.142 -2.733 2.720
236 HG1 THR 538 HG1 THR 538 3.149 -1.455 4.152
237 HG21 THR 538 HG21 THR 538 6.301 -3.770 3.195
238 HG22 THR 538 HG22 THR 538 5.120 -4.150 4.448
239 HG23 THR 538 HG23 THR 538 6.369 -2.940 4.750
240 H LEU 539 HN LEU 539 5.237 -1.860 0.328
241 HA LEU 539 HA LEU 539 7.587 -3.371 -0.090
242 HB2 LEU 539 HB2 LEU 539 5.603 -3.739 -1.398
243 HB3 LEU 539 HB1 LEU 539 5.590 -2.082 -1.947
244 HG LEU 539 HG LEU 539 6.301 -3.906 -3.590
245 HD11 LEU 539 HD11 LEU 539 8.372 -1.780 -3.415
246 HD12 LEU 539 HD12 LEU 539 6.679 -1.324 -3.595
247 HD13 LEU 539 HD13 LEU 539 7.449 -2.354 -4.808
248 HD21 LEU 539 HD21 LEU 539 7.840 -5.082 -2.093
249 HD22 LEU 539 HD22 LEU 539 8.870 -3.648 -2.034
250 HD23 LEU 539 HD23 LEU 539 8.655 -4.519 -3.553
251 H GLN 540 HN GLN 540 6.675 -0.036 -0.898
252 HA GLN 540 HA GLN 540 9.173 0.738 -1.982
253 HB2 GLN 540 HB2 GLN 540 7.077 2.419 -0.590
254 HB3 GLN 540 HB1 GLN 540 8.417 3.045 -1.540
255 HG2 GLN 540 HG2 GLN 540 6.332 1.200 -2.646
256 HG3 GLN 540 HG1 GLN 540 6.206 2.958 -2.717
257 HE21 GLN 540 HE21 GLN 540 7.847 0.142 -3.914
258 HE22 GLN 540 HE22 GLN 540 8.652 0.914 -5.238
259 H ASN 541 HN ASN 541 7.970 0.494 1.288
260 HA ASN 541 HA ASN 541 10.139 1.801 2.573
261 HB2 ASN 541 HB2 ASN 541 7.921 1.297 3.627
262 HB3 ASN 541 HB1 ASN 541 8.370 -0.400 3.671
263 HD21 ASN 541 HD21 ASN 541 7.754 1.637 5.767
264 HD22 ASN 541 HD22 ASN 541 9.081 1.540 6.875
265 H GLN 542 HN GLN 542 9.509 -1.567 1.655
266 HA GLN 542 HA GLN 542 11.902 -2.689 2.627
267 HB2 GLN 542 HB2 GLN 542 10.354 -3.459 0.137
268 HB3 GLN 542 HB1 GLN 542 11.568 -4.450 0.931
269 HG2 GLN 542 HG2 GLN 542 8.932 -3.600 2.110
270 HG3 GLN 542 HG1 GLN 542 9.313 -5.193 1.458
271 HE21 GLN 542 HE21 GLN 542 9.749 -2.997 4.093
272 HE22 GLN 542 HE22 GLN 542 10.473 -4.125 5.185
273 H LEU 543 HN LEU 543 11.093 -1.059 -0.386
274 HA LEU 543 HA LEU 543 13.638 -1.314 -1.598
275 HB2 LEU 543 HB2 LEU 543 11.503 -0.804 -2.777
276 HB3 LEU 543 HB1 LEU 543 11.535 0.800 -2.074
277 HG LEU 543 HG LEU 543 13.886 -0.092 -3.678
278 HD11 LEU 543 HD11 LEU 543 11.273 0.863 -4.848
279 HD12 LEU 543 HD12 LEU 543 11.972 -0.746 -5.039
280 HD13 LEU 543 HD13 LEU 543 12.784 0.656 -5.735
281 HD21 LEU 543 HD21 LEU 543 13.864 2.300 -4.322
282 HD22 LEU 543 HD22 LEU 543 14.001 2.052 -2.583
283 HD23 LEU 543 HD23 LEU 543 12.458 2.540 -3.283
284 H GLN 544 HN GLN 544 12.186 1.099 0.517
285 HA GLN 544 HA GLN 544 14.220 3.008 0.502
286 HB2 GLN 544 HB2 GLN 544 12.077 3.445 1.544
287 HB3 GLN 544 HB1 GLN 544 12.321 2.135 2.689
288 HG2 GLN 544 HG2 GLN 544 14.256 3.374 3.596
289 HG3 GLN 544 HG1 GLN 544 13.827 4.728 2.552
290 HE21 GLN 544 HE21 GLN 544 11.931 5.888 2.978
291 HE22 GLN 544 HE22 GLN 544 11.142 5.803 4.513
292 H GLN 545 HN GLN 545 13.716 0.165 2.547
293 HA GLN 545 HA GLN 545 16.134 0.343 3.983
294 HB2 GLN 545 HB2 GLN 545 14.495 -2.103 3.301
295 HB3 GLN 545 HB1 GLN 545 15.745 -2.021 4.535
296 HG2 GLN 545 HG2 GLN 545 14.457 -0.410 5.781
297 HG3 GLN 545 HG1 GLN 545 13.225 -0.385 4.524
298 HE21 GLN 545 HE21 GLN 545 11.609 -1.022 5.904
299 HE22 GLN 545 HE22 GLN 545 11.513 -2.626 6.564
300 H PHE 546 HN PHE 546 15.295 -1.020 0.875
301 HA PHE 546 HA PHE 546 17.682 -2.439 0.389
302 HB2 PHE 546 HB2 PHE 546 16.106 -3.098 -1.111
303 HB3 PHE 546 HB1 PHE 546 15.341 -1.512 -1.165
304 HD1 PHE 546 HD1 PHE 546 18.310 -3.396 -2.405
305 HD2 PHE 546 HD2 PHE 546 15.631 -0.142 -2.985
306 HE1 PHE 546 HE1 PHE 546 19.287 -2.988 -4.627
307 HE2 PHE 546 HE2 PHE 546 16.598 0.277 -5.199
308 HZ PHE 546 HZ PHE 546 18.432 -1.149 -6.029
309 H LEU 547 HN LEU 547 16.680 0.852 -0.606
310 HA LEU 547 HA LEU 547 19.142 1.459 -1.824
311 HB2 LEU 547 HB2 LEU 547 18.396 3.720 -1.946
312 HB3 LEU 547 HB1 LEU 547 17.039 2.666 -2.257
313 HG LEU 547 HG LEU 547 16.553 3.072 0.309
314 HD11 LEU 547 HD11 LEU 547 18.029 5.579 -0.493
315 HD12 LEU 547 HD12 LEU 547 18.567 4.401 0.704
316 HD13 LEU 547 HD13 LEU 547 17.103 5.342 0.990
317 HD21 LEU 547 HD21 LEU 547 15.071 4.914 -0.358
318 HD22 LEU 547 HD22 LEU 547 15.030 3.581 -1.511
319 HD23 LEU 547 HD23 LEU 547 15.935 5.046 -1.890
320 H GLU 548 HN GLU 548 17.952 1.941 1.450
321 HA GLU 548 HA GLU 548 20.255 3.246 2.402
322 HB2 GLU 548 HB2 GLU 548 18.124 1.681 3.831
323 HB3 GLU 548 HB1 GLU 548 19.484 2.404 4.683
324 HG2 GLU 548 HG2 GLU 548 18.759 4.579 3.470
325 HG3 GLU 548 HG1 GLU 548 17.226 3.736 3.256
326 H ALA 549 HN ALA 549 19.452 -0.165 2.063
327 HA ALA 549 HA ALA 549 21.715 -1.218 3.360
328 HB1 ALA 549 HB1 ALA 549 21.339 -3.233 2.050
329 HB2 ALA 549 HB2 ALA 549 20.253 -2.350 0.977
330 HB3 ALA 549 HB3 ALA 549 19.812 -2.600 2.666
331 H GLN 550 HN GLN 550 21.215 0.013 0.101
332 HA GLN 550 HA GLN 550 23.801 -0.565 -0.897
333 HB2 GLN 550 HB2 GLN 550 21.965 1.718 -1.659
334 HB3 GLN 550 HB1 GLN 550 23.323 1.122 -2.603
335 HG2 GLN 550 HG2 GLN 550 22.197 -0.999 -2.929
336 HG3 GLN 550 HG1 GLN 550 20.856 -0.458 -1.921
337 HE21 GLN 550 HE21 GLN 550 22.437 -0.147 -5.006
338 HE22 GLN 550 HE22 GLN 550 21.154 0.711 -5.789
339 H LYS 551 HN LYS 551 22.415 2.252 0.748
340 HA LYS 551 HA LYS 551 24.699 3.888 0.760
341 HB2 LYS 551 HB2 LYS 551 22.612 3.719 2.931
342 HB3 LYS 551 HB1 LYS 551 23.665 5.080 2.593
343 HG2 LYS 551 HG2 LYS 551 21.537 4.042 0.740
344 HG3 LYS 551 HG1 LYS 551 21.364 5.424 1.818
345 HD2 LYS 551 HD2 LYS 551 23.210 6.547 0.649
346 HD3 LYS 551 HD1 LYS 551 23.340 5.166 -0.444
347 HE2 LYS 551 HE2 LYS 551 21.026 5.546 -1.172
348 HE3 LYS 551 HE1 LYS 551 20.930 6.946 -0.110
349 HZ1 LYS 551 HZ1 LYS 551 22.625 8.040 -1.388
350 HZ2 LYS 551 HZ2 LYS 551 21.393 7.522 -2.436
351 HZ3 LYS 551 HZ3 LYS 551 22.852 6.664 -2.359
352 H SER 552 HN SER 552 23.608 1.383 2.989
353 HA SER 552 HA SER 552 25.512 1.645 4.994
354 HB2 SER 552 HB2 SER 552 24.336 -0.944 3.945
355 HB3 SER 552 HB1 SER 552 25.045 -0.690 5.540
356 HG SER 552 HG SER 552 22.814 0.785 4.581
357 H GLU 553 HN GLU 553 25.743 0.055 1.858
358 HA GLU 553 HA GLU 553 28.367 -1.000 2.377
359 HB2 GLU 553 HB2 GLU 553 26.870 -0.712 -0.230
360 HB3 GLU 553 HB1 GLU 553 28.341 -1.648 0.013
361 HG2 GLU 553 HG2 GLU 553 25.723 -2.161 1.388
362 HG3 GLU 553 HG1 GLU 553 26.301 -3.030 -0.033
363 H GLY 554 HN GLY 554 26.990 1.651 0.487
364 HA2 GLY 554 HA2 GLY 554 29.418 2.542 -0.654
365 HA3 GLY 554 HA1 GLY 554 27.929 3.465 -0.550
366 H LYS 555 HN LYS 555 27.932 3.229 2.438
367 HA LYS 555 HA LYS 555 29.513 5.563 2.946
368 HB2 LYS 555 HB2 LYS 555 28.562 5.569 5.112
369 HB3 LYS 555 HB1 LYS 555 27.298 5.017 4.027
370 HG2 LYS 555 HG2 LYS 555 27.775 2.693 4.701
371 HG3 LYS 555 HG1 LYS 555 28.965 3.303 5.854
372 HD2 LYS 555 HD2 LYS 555 26.001 3.865 5.840
373 HD3 LYS 555 HD1 LYS 555 26.884 2.871 7.001
374 HE2 LYS 555 HE2 LYS 555 28.155 4.859 7.699
375 HE3 LYS 555 HE1 LYS 555 27.217 5.840 6.574
376 HZ1 LYS 555 HZ1 LYS 555 26.277 6.079 8.725
377 HZ2 LYS 555 HZ2 LYS 555 26.224 4.406 8.973
378 HZ3 LYS 555 HZ3 LYS 555 25.202 5.124 7.823
379 H SER 556 HN SER 556 30.150 2.262 2.962
380 HA SER 556 HA SER 556 32.412 2.525 4.796
381 HB2 SER 556 HB2 SER 556 30.885 0.533 4.954
382 HB3 SER 556 HB1 SER 556 31.433 0.049 3.348
383 HG SER 556 HG SER 556 33.418 -0.396 4.137
384 H LEU 557 HN LEU 557 31.627 1.739 1.442
385 HA LEU 557 HA LEU 557 34.181 2.768 0.568
386 HB2 LEU 557 HB2 LEU 557 34.417 0.254 1.150
387 HB3 LEU 557 HB1 LEU 557 33.447 -0.029 -0.280
388 HG LEU 557 HG LEU 557 36.074 1.464 -0.332
389 HD11 LEU 557 HD11 LEU 557 35.518 -1.448 -0.869
390 HD12 LEU 557 HD12 LEU 557 36.456 -0.790 0.471
391 HD13 LEU 557 HD13 LEU 557 37.045 -0.622 -1.184
392 HD21 LEU 557 HD21 LEU 557 34.492 0.148 -2.542
393 HD22 LEU 557 HD22 LEU 557 36.019 1.015 -2.717
394 HD23 LEU 557 HD23 LEU 557 34.563 1.884 -2.232
Start of MODEL 6
1 H1 GLY 510 HT1 GLY 510 -37.499 5.750 -0.661
2 H2 GLY 510 HT2 GLY 510 -37.581 7.444 -0.571
3 H3 GLY 510 HT3 GLY 510 -38.561 6.493 0.438
4 HA2 GLY 510 HA1 GLY 510 -36.756 7.353 1.720
5 HA3 GLY 510 HA2 GLY 510 -36.580 5.613 1.535
6 H SER 511 HN SER 511 -34.579 7.698 2.063
7 HA SER 511 HA SER 511 -32.923 7.370 -0.346
8 HB2 SER 511 HB2 SER 511 -31.612 9.330 0.792
9 HB3 SER 511 HB1 SER 511 -33.104 9.668 -0.086
10 HG SER 511 HG SER 511 -32.756 9.414 2.729
11 H VAL 512 HN VAL 512 -33.280 6.448 2.896
12 HA VAL 512 HA VAL 512 -30.620 6.126 3.733
13 HB VAL 512 HB VAL 512 -32.899 4.271 4.430
14 HG11 VAL 512 HG11 VAL 512 -30.641 5.048 6.225
15 HG12 VAL 512 HG12 VAL 512 -30.401 3.816 4.996
16 HG13 VAL 512 HG13 VAL 512 -31.633 3.588 6.240
17 HG21 VAL 512 HG21 VAL 512 -32.097 6.863 5.752
18 HG22 VAL 512 HG22 VAL 512 -33.334 5.746 6.326
19 HG23 VAL 512 HG23 VAL 512 -33.556 6.601 4.801
20 H GLU 513 HN GLU 513 -32.744 3.994 1.877
21 HA GLU 513 HA GLU 513 -31.089 1.770 1.673
22 HB2 GLU 513 HB2 GLU 513 -32.301 1.306 -0.460
23 HB3 GLU 513 HB1 GLU 513 -33.348 1.644 0.909
24 HG2 GLU 513 HG2 GLU 513 -33.843 3.816 0.105
25 HG3 GLU 513 HG1 GLU 513 -32.578 3.725 -1.117
26 H THR 514 HN THR 514 -31.168 4.707 -0.290
27 HA THR 514 HA THR 514 -29.256 3.905 -2.193
28 HB THR 514 HB THR 514 -29.699 6.769 -1.387
29 HG1 THR 514 HG1 THR 514 -31.455 5.084 -2.903
30 HG21 THR 514 HG21 THR 514 -29.258 5.386 -4.021
31 HG22 THR 514 HG22 THR 514 -28.072 6.346 -3.141
32 HG23 THR 514 HG23 THR 514 -29.506 7.119 -3.822
33 H CYS 515 HN CYS 515 -28.990 5.974 0.705
34 HA CYS 515 HA CYS 515 -26.235 6.483 0.465
35 HB2 CYS 515 HB2 CYS 515 -27.887 6.451 2.991
36 HB3 CYS 515 HB1 CYS 515 -26.343 7.268 2.762
37 HG CYS 515 HG CYS 515 -27.222 9.418 1.611
38 H MET 516 HN MET 516 -27.995 3.899 2.109
39 HA MET 516 HA MET 516 -25.795 2.769 3.455
40 HB2 MET 516 HB2 MET 516 -28.161 2.192 3.907
41 HB3 MET 516 HB1 MET 516 -28.231 1.356 2.363
42 HG2 MET 516 HG2 MET 516 -26.184 0.595 4.401
43 HG3 MET 516 HG1 MET 516 -27.839 0.015 4.538
44 HE1 MET 516 HE1 MET 516 -29.006 -1.597 2.771
45 HE2 MET 516 HE2 MET 516 -28.260 -2.059 1.241
46 HE3 MET 516 HE3 MET 516 -28.713 -0.378 1.534
47 H SER 517 HN SER 517 -27.102 2.282 0.219
48 HA SER 517 HA SER 517 -25.430 0.109 -0.465
49 HB2 SER 517 HB2 SER 517 -26.813 2.086 -2.294
50 HB3 SER 517 HB1 SER 517 -26.195 0.498 -2.752
51 HG SER 517 HG SER 517 -28.372 1.130 -1.048
52 H LEU 518 HN LEU 518 -25.200 3.604 -1.154
53 HA LEU 518 HA LEU 518 -22.820 3.358 -2.635
54 HB2 LEU 518 HB2 LEU 518 -22.592 5.844 -2.236
55 HB3 LEU 518 HB1 LEU 518 -24.004 5.296 -3.104
56 HG LEU 518 HG LEU 518 -25.141 5.453 -0.736
57 HD11 LEU 518 HD11 LEU 518 -22.671 7.118 -0.431
58 HD12 LEU 518 HD12 LEU 518 -23.417 5.993 0.716
59 HD13 LEU 518 HD13 LEU 518 -24.170 7.554 0.389
60 HD21 LEU 518 HD21 LEU 518 -24.475 7.846 -2.440
61 HD22 LEU 518 HD22 LEU 518 -25.784 7.761 -1.263
62 HD23 LEU 518 HD23 LEU 518 -25.810 6.721 -2.685
63 H ALA 519 HN ALA 519 -23.399 4.081 0.772
64 HA ALA 519 HA ALA 519 -20.742 4.654 1.475
65 HB1 ALA 519 HB1 ALA 519 -21.436 4.106 3.782
66 HB2 ALA 519 HB2 ALA 519 -22.959 3.486 3.142
67 HB3 ALA 519 HB3 ALA 519 -22.558 5.193 2.962
68 H SER 520 HN SER 520 -22.519 1.580 1.455
69 HA SER 520 HA SER 520 -20.416 -0.026 2.439
70 HB2 SER 520 HB2 SER 520 -22.611 -0.846 0.513
71 HB3 SER 520 HB1 SER 520 -21.669 -1.913 1.556
72 HG SER 520 HG SER 520 -23.744 -0.137 2.203
73 H GLN 521 HN GLN 521 -21.341 0.964 -0.816
74 HA GLN 521 HA GLN 521 -19.461 -0.540 -2.254
75 HB2 GLN 521 HB2 GLN 521 -21.336 0.593 -3.308
76 HB3 GLN 521 HB1 GLN 521 -20.683 2.155 -2.853
77 HG2 GLN 521 HG2 GLN 521 -18.717 1.690 -4.292
78 HG3 GLN 521 HG1 GLN 521 -19.519 0.211 -4.822
79 HE21 GLN 521 HE21 GLN 521 -19.508 3.677 -4.963
80 HE22 GLN 521 HE22 GLN 521 -20.675 3.836 -6.232
81 H VAL 522 HN VAL 522 -19.314 2.786 -1.018
82 HA VAL 522 HA VAL 522 -16.682 3.358 -1.803
83 HB VAL 522 HB VAL 522 -18.258 4.446 0.544
84 HG11 VAL 522 HG11 VAL 522 -15.755 5.538 -0.751
85 HG12 VAL 522 HG12 VAL 522 -15.857 4.815 0.855
86 HG13 VAL 522 HG13 VAL 522 -16.694 6.329 0.515
87 HG21 VAL 522 HG21 VAL 522 -18.715 6.335 -0.935
88 HG22 VAL 522 HG22 VAL 522 -19.307 4.827 -1.632
89 HG23 VAL 522 HG23 VAL 522 -17.814 5.549 -2.230
90 H VAL 523 HN VAL 523 -17.979 1.867 1.124
91 HA VAL 523 HA VAL 523 -15.608 1.766 2.602
92 HB VAL 523 HB VAL 523 -18.225 0.343 2.674
93 HG11 VAL 523 HG11 VAL 523 -15.791 -0.614 4.166
94 HG12 VAL 523 HG12 VAL 523 -16.803 -1.519 3.040
95 HG13 VAL 523 HG13 VAL 523 -17.450 -1.026 4.605
96 HG21 VAL 523 HG21 VAL 523 -18.231 1.216 4.965
97 HG22 VAL 523 HG22 VAL 523 -17.937 2.486 3.778
98 HG23 VAL 523 HG23 VAL 523 -16.598 1.840 4.727
99 H LYS 524 HN LYS 524 -16.983 -0.505 0.243
100 HA LYS 524 HA LYS 524 -14.939 -2.447 0.530
101 HB2 LYS 524 HB2 LYS 524 -17.165 -1.979 -1.342
102 HB3 LYS 524 HB1 LYS 524 -15.812 -2.892 -1.999
103 HG2 LYS 524 HG2 LYS 524 -17.467 -4.397 -1.096
104 HG3 LYS 524 HG1 LYS 524 -16.001 -4.466 -0.114
105 HD2 LYS 524 HD2 LYS 524 -17.154 -2.720 1.365
106 HD3 LYS 524 HD1 LYS 524 -18.633 -3.175 0.520
107 HE2 LYS 524 HE2 LYS 524 -16.831 -5.045 2.057
108 HE3 LYS 524 HE1 LYS 524 -18.378 -4.413 2.618
109 HZ1 LYS 524 HZ1 LYS 524 -18.614 -6.642 1.748
110 HZ2 LYS 524 HZ2 LYS 524 -17.967 -6.169 0.255
111 HZ3 LYS 524 HZ3 LYS 524 -19.461 -5.546 0.767
112 H LEU 525 HN LEU 525 -15.347 0.273 -1.744
113 HA LEU 525 HA LEU 525 -12.966 -0.189 -3.187
114 HB2 LEU 525 HB2 LEU 525 -14.716 2.185 -2.759
115 HB3 LEU 525 HB1 LEU 525 -13.118 2.450 -3.427
116 HG LEU 525 HG LEU 525 -13.750 0.727 -5.207
117 HD11 LEU 525 HD11 LEU 525 -16.552 1.407 -4.387
118 HD12 LEU 525 HD12 LEU 525 -15.738 -0.058 -3.853
119 HD13 LEU 525 HD13 LEU 525 -16.009 0.221 -5.575
120 HD21 LEU 525 HD21 LEU 525 -14.934 2.401 -6.542
121 HD22 LEU 525 HD22 LEU 525 -13.579 3.107 -5.660
122 HD23 LEU 525 HD23 LEU 525 -15.229 3.349 -5.085
123 H THR 526 HN THR 526 -13.644 1.616 -0.245
124 HA THR 526 HA THR 526 -11.110 2.813 0.005
125 HB THR 526 HB THR 526 -13.551 2.460 1.676
126 HG1 THR 526 HG1 THR 526 -13.475 4.229 0.329
127 HG21 THR 526 HG21 THR 526 -11.821 1.985 3.235
128 HG22 THR 526 HG22 THR 526 -12.483 3.584 3.573
129 HG23 THR 526 HG23 THR 526 -10.919 3.424 2.767
130 H LYS 527 HN LYS 527 -12.592 -0.137 1.264
131 HA LYS 527 HA LYS 527 -10.534 -0.957 2.976
132 HB2 LYS 527 HB2 LYS 527 -12.810 -1.976 2.842
133 HB3 LYS 527 HB1 LYS 527 -12.346 -2.723 1.319
134 HG2 LYS 527 HG2 LYS 527 -12.165 -4.340 3.079
135 HG3 LYS 527 HG1 LYS 527 -10.548 -3.932 2.503
136 HD2 LYS 527 HD2 LYS 527 -10.628 -4.065 4.951
137 HD3 LYS 527 HD1 LYS 527 -10.236 -2.433 4.406
138 HE2 LYS 527 HE2 LYS 527 -11.843 -2.355 6.223
139 HE3 LYS 527 HE1 LYS 527 -12.573 -1.774 4.728
140 HZ1 LYS 527 HZ1 LYS 527 -12.938 -4.470 5.927
141 HZ2 LYS 527 HZ2 LYS 527 -13.595 -3.971 4.444
142 HZ3 LYS 527 HZ3 LYS 527 -14.088 -3.223 5.884
143 H GLN 528 HN GLN 528 -11.098 -1.628 -0.462
144 HA GLN 528 HA GLN 528 -8.854 -3.253 -0.889
145 HB2 GLN 528 HB2 GLN 528 -10.668 -3.105 -2.505
146 HB3 GLN 528 HB1 GLN 528 -10.306 -1.408 -2.792
147 HG2 GLN 528 HG2 GLN 528 -8.097 -2.064 -3.671
148 HG3 GLN 528 HG1 GLN 528 -8.542 -3.754 -3.454
149 HE21 GLN 528 HE21 GLN 528 -11.323 -3.268 -4.256
150 HE22 GLN 528 HE22 GLN 528 -11.282 -3.085 -5.978
151 H LEU 529 HN LEU 529 -9.290 0.246 -1.305
152 HA LEU 529 HA LEU 529 -6.717 0.837 -2.250
153 HB2 LEU 529 HB2 LEU 529 -8.614 2.511 -0.610
154 HB3 LEU 529 HB1 LEU 529 -7.178 3.130 -1.393
155 HG LEU 529 HG LEU 529 -9.503 1.885 -2.854
156 HD11 LEU 529 HD11 LEU 529 -8.793 4.800 -2.599
157 HD12 LEU 529 HD12 LEU 529 -10.025 3.991 -1.628
158 HD13 LEU 529 HD13 LEU 529 -10.214 4.100 -3.382
159 HD21 LEU 529 HD21 LEU 529 -7.374 1.726 -4.049
160 HD22 LEU 529 HD22 LEU 529 -7.121 3.458 -3.839
161 HD23 LEU 529 HD23 LEU 529 -8.457 2.875 -4.833
162 H LYS 530 HN LYS 530 -8.049 0.798 1.004
163 HA LYS 530 HA LYS 530 -5.881 1.806 2.418
164 HB2 LYS 530 HB2 LYS 530 -8.224 1.342 3.264
165 HB3 LYS 530 HB1 LYS 530 -7.762 -0.348 3.391
166 HG2 LYS 530 HG2 LYS 530 -7.551 0.559 5.551
167 HG3 LYS 530 HG1 LYS 530 -5.906 0.398 4.930
168 HD2 LYS 530 HD2 LYS 530 -5.818 2.743 4.409
169 HD3 LYS 530 HD1 LYS 530 -7.517 2.945 4.840
170 HE2 LYS 530 HE2 LYS 530 -6.105 3.754 6.631
171 HE3 LYS 530 HE1 LYS 530 -6.977 2.316 7.161
172 HZ1 LYS 530 HZ1 LYS 530 -5.012 0.996 6.802
173 HZ2 LYS 530 HZ2 LYS 530 -4.624 2.303 7.814
174 HZ3 LYS 530 HZ3 LYS 530 -4.175 2.336 6.180
175 H GLU 531 HN GLU 531 -6.659 -1.583 1.635
176 HA GLU 531 HA GLU 531 -4.434 -2.624 3.086
177 HB2 GLU 531 HB2 GLU 531 -6.092 -3.970 0.950
178 HB3 GLU 531 HB1 GLU 531 -5.046 -4.773 2.113
179 HG2 GLU 531 HG2 GLU 531 -6.472 -3.879 3.929
180 HG3 GLU 531 HG1 GLU 531 -7.558 -3.233 2.701
181 H GLN 532 HN GLN 532 -5.067 -2.079 -0.366
182 HA GLN 532 HA GLN 532 -2.652 -3.211 -1.273
183 HB2 GLN 532 HB2 GLN 532 -4.308 -1.047 -2.580
184 HB3 GLN 532 HB1 GLN 532 -3.064 -2.006 -3.367
185 HG2 GLN 532 HG2 GLN 532 -5.664 -3.020 -2.245
186 HG3 GLN 532 HG1 GLN 532 -5.248 -2.840 -3.946
187 HE21 GLN 532 HE21 GLN 532 -3.889 -4.319 -4.914
188 HE22 GLN 532 HE22 GLN 532 -3.491 -5.836 -4.175
189 H THR 533 HN THR 533 -3.462 -0.008 -0.093
190 HA THR 533 HA THR 533 -0.988 1.163 -0.930
191 HB THR 533 HB THR 533 -2.914 2.197 1.157
192 HG1 THR 533 HG1 THR 533 -4.065 2.113 -0.711
193 HG21 THR 533 HG21 THR 533 -0.583 3.156 1.114
194 HG22 THR 533 HG22 THR 533 -1.871 4.324 0.822
195 HG23 THR 533 HG23 THR 533 -0.913 3.711 -0.526
196 H VAL 534 HN VAL 534 -2.198 -0.127 2.197
197 HA VAL 534 HA VAL 534 0.007 0.756 3.700
198 HB VAL 534 HB VAL 534 -0.597 -0.921 5.404
199 HG11 VAL 534 HG11 VAL 534 -2.797 -0.029 5.925
200 HG12 VAL 534 HG12 VAL 534 -2.969 0.548 4.267
201 HG13 VAL 534 HG13 VAL 534 -1.734 1.243 5.319
202 HG21 VAL 534 HG21 VAL 534 -2.475 -2.401 5.112
203 HG22 VAL 534 HG22 VAL 534 -1.281 -2.715 3.852
204 HG23 VAL 534 HG23 VAL 534 -2.738 -1.799 3.476
205 H GLU 535 HN GLU 535 -0.493 -2.298 1.939
206 HA GLU 535 HA GLU 535 2.032 -3.345 2.755
207 HB2 GLU 535 HB2 GLU 535 1.681 -5.022 0.983
208 HB3 GLU 535 HB1 GLU 535 0.306 -4.879 2.065
209 HG2 GLU 535 HG2 GLU 535 -0.953 -3.696 0.447
210 HG3 GLU 535 HG1 GLU 535 0.460 -3.499 -0.593
211 H ARG 536 HN ARG 536 0.901 -1.456 0.006
212 HA ARG 536 HA ARG 536 3.240 -1.698 -1.550
213 HB2 ARG 536 HB2 ARG 536 1.118 -0.974 -2.492
214 HB3 ARG 536 HB1 ARG 536 1.158 0.483 -1.513
215 HG2 ARG 536 HG2 ARG 536 3.533 0.146 -3.165
216 HG3 ARG 536 HG1 ARG 536 2.034 0.258 -4.093
217 HD2 ARG 536 HD2 ARG 536 2.753 2.185 -1.905
218 HD3 ARG 536 HD1 ARG 536 3.215 2.442 -3.588
219 HE ARG 536 HE ARG 536 0.435 1.941 -3.408
220 HH11 ARG 536 HH11 ARG 536 2.805 4.397 -2.664
221 HH12 ARG 536 HH12 ARG 536 1.710 5.724 -2.886
222 HH21 ARG 536 HH21 ARG 536 -1.044 3.680 -3.684
223 HH22 ARG 536 HH22 ARG 536 -0.497 5.315 -3.451
224 H VAL 537 HN VAL 537 2.237 0.793 0.793
225 HA VAL 537 HA VAL 537 4.559 2.384 0.492
226 HB VAL 537 HB VAL 537 3.974 3.457 2.599
227 HG11 VAL 537 HG11 VAL 537 1.705 4.193 2.027
228 HG12 VAL 537 HG12 VAL 537 1.563 2.834 0.911
229 HG13 VAL 537 HG13 VAL 537 2.749 4.105 0.607
230 HG21 VAL 537 HG21 VAL 537 2.232 2.708 4.039
231 HG22 VAL 537 HG22 VAL 537 3.310 1.330 3.771
232 HG23 VAL 537 HG23 VAL 537 1.772 1.430 2.914
233 H THR 538 HN THR 538 3.754 -0.294 2.636
234 HA THR 538 HA THR 538 6.138 -0.323 4.124
235 HB THR 538 HB THR 538 4.241 -2.550 3.391
236 HG1 THR 538 HG1 THR 538 3.074 -1.453 4.771
237 HG21 THR 538 HG21 THR 538 6.418 -3.458 4.026
238 HG22 THR 538 HG22 THR 538 5.199 -3.801 5.253
239 HG23 THR 538 HG23 THR 538 6.382 -2.518 5.516
240 H LEU 539 HN LEU 539 5.262 -1.804 1.033
241 HA LEU 539 HA LEU 539 7.634 -3.270 0.641
242 HB2 LEU 539 HB2 LEU 539 5.631 -3.776 -0.580
243 HB3 LEU 539 HB1 LEU 539 5.540 -2.156 -1.225
244 HG LEU 539 HG LEU 539 6.241 -4.020 -2.803
245 HD11 LEU 539 HD11 LEU 539 8.286 -1.860 -2.756
246 HD12 LEU 539 HD12 LEU 539 6.583 -1.454 -2.952
247 HD13 LEU 539 HD13 LEU 539 7.375 -2.524 -4.117
248 HD21 LEU 539 HD21 LEU 539 7.834 -5.118 -1.282
249 HD22 LEU 539 HD22 LEU 539 8.872 -3.694 -1.365
250 HD23 LEU 539 HD23 LEU 539 8.577 -4.658 -2.812
251 H GLN 540 HN GLN 540 6.629 -0.005 -0.340
252 HA GLN 540 HA GLN 540 9.054 0.701 -1.605
253 HB2 GLN 540 HB2 GLN 540 6.961 2.428 -0.284
254 HB3 GLN 540 HB1 GLN 540 8.297 3.044 -1.251
255 HG2 GLN 540 HG2 GLN 540 6.194 1.146 -2.229
256 HG3 GLN 540 HG1 GLN 540 6.196 2.888 -2.512
257 HE21 GLN 540 HE21 GLN 540 6.283 0.685 -4.437
258 HE22 GLN 540 HE22 GLN 540 7.729 0.916 -5.361
259 H ASN 541 HN ASN 541 7.996 0.793 1.727
260 HA ASN 541 HA ASN 541 10.196 2.174 2.829
261 HB2 ASN 541 HB2 ASN 541 8.126 1.663 4.091
262 HB3 ASN 541 HB1 ASN 541 8.541 -0.044 4.062
263 HD21 ASN 541 HD21 ASN 541 8.569 -0.184 6.282
264 HD22 ASN 541 HD22 ASN 541 9.848 0.482 7.234
265 H GLN 542 HN GLN 542 9.628 -1.250 2.166
266 HA GLN 542 HA GLN 542 12.150 -2.195 3.028
267 HB2 GLN 542 HB2 GLN 542 10.217 -3.311 0.986
268 HB3 GLN 542 HB1 GLN 542 11.623 -4.174 1.593
269 HG2 GLN 542 HG2 GLN 542 9.266 -3.244 3.211
270 HG3 GLN 542 HG1 GLN 542 9.607 -4.905 2.715
271 HE21 GLN 542 HE21 GLN 542 11.338 -6.008 3.663
272 HE22 GLN 542 HE22 GLN 542 12.061 -5.491 5.150
273 H LEU 543 HN LEU 543 10.930 -1.065 -0.077
274 HA LEU 543 HA LEU 543 13.273 -1.624 -1.559
275 HB2 LEU 543 HB2 LEU 543 10.959 -1.149 -2.472
276 HB3 LEU 543 HB1 LEU 543 11.264 0.547 -2.150
277 HG LEU 543 HG LEU 543 13.226 -0.945 -3.832
278 HD11 LEU 543 HD11 LEU 543 10.552 0.062 -4.811
279 HD12 LEU 543 HD12 LEU 543 11.079 -1.621 -4.754
280 HD13 LEU 543 HD13 LEU 543 11.881 -0.484 -5.836
281 HD21 LEU 543 HD21 LEU 543 13.321 1.247 -4.984
282 HD22 LEU 543 HD22 LEU 543 13.727 1.341 -3.272
283 HD23 LEU 543 HD23 LEU 543 12.140 1.871 -3.830
284 H GLN 544 HN GLN 544 12.230 1.126 0.359
285 HA GLN 544 HA GLN 544 14.342 2.866 -0.270
286 HB2 GLN 544 HB2 GLN 544 12.417 3.696 0.896
287 HB3 GLN 544 HB1 GLN 544 12.648 2.550 2.207
288 HG2 GLN 544 HG2 GLN 544 14.679 3.672 2.857
289 HG3 GLN 544 HG1 GLN 544 14.498 4.815 1.525
290 HE21 GLN 544 HE21 GLN 544 13.276 3.778 4.611
291 HE22 GLN 544 HE22 GLN 544 12.336 5.204 4.942
292 H GLN 545 HN GLN 545 13.964 0.422 2.287
293 HA GLN 545 HA GLN 545 16.524 0.546 3.371
294 HB2 GLN 545 HB2 GLN 545 14.595 -0.699 4.317
295 HB3 GLN 545 HB1 GLN 545 14.740 -1.864 3.009
296 HG2 GLN 545 HG2 GLN 545 17.030 -2.371 3.791
297 HG3 GLN 545 HG1 GLN 545 16.728 -1.302 5.157
298 HE21 GLN 545 HE21 GLN 545 17.277 -4.205 5.031
299 HE22 GLN 545 HE22 GLN 545 15.958 -4.957 5.862
300 H PHE 546 HN PHE 546 15.230 -1.131 0.575
301 HA PHE 546 HA PHE 546 17.480 -2.740 0.030
302 HB2 PHE 546 HB2 PHE 546 15.637 -3.609 -0.985
303 HB3 PHE 546 HB1 PHE 546 14.931 -2.022 -1.299
304 HD1 PHE 546 HD1 PHE 546 17.514 -4.416 -2.493
305 HD2 PHE 546 HD2 PHE 546 15.066 -1.051 -3.387
306 HE1 PHE 546 HE1 PHE 546 18.146 -4.584 -4.864
307 HE2 PHE 546 HE2 PHE 546 15.693 -1.209 -5.751
308 HZ PHE 546 HZ PHE 546 17.235 -2.982 -6.496
309 H LEU 547 HN LEU 547 16.393 0.345 -1.416
310 HA LEU 547 HA LEU 547 18.588 0.594 -3.146
311 HB2 LEU 547 HB2 LEU 547 17.906 2.877 -3.469
312 HB3 LEU 547 HB1 LEU 547 16.505 1.835 -3.409
313 HG LEU 547 HG LEU 547 16.412 2.614 -0.892
314 HD11 LEU 547 HD11 LEU 547 17.806 4.917 -2.243
315 HD12 LEU 547 HD12 LEU 547 18.502 3.883 -0.996
316 HD13 LEU 547 HD13 LEU 547 17.123 4.916 -0.616
317 HD21 LEU 547 HD21 LEU 547 14.898 4.407 -1.579
318 HD22 LEU 547 HD22 LEU 547 14.660 2.957 -2.551
319 HD23 LEU 547 HD23 LEU 547 15.544 4.329 -3.217
320 H GLU 548 HN GLU 548 18.078 1.585 0.162
321 HA GLU 548 HA GLU 548 20.584 2.856 0.457
322 HB2 GLU 548 HB2 GLU 548 18.567 1.811 2.398
323 HB3 GLU 548 HB1 GLU 548 20.150 2.333 2.966
324 HG2 GLU 548 HG2 GLU 548 18.076 3.973 1.537
325 HG3 GLU 548 HG1 GLU 548 18.673 4.176 3.186
326 H ALA 549 HN ALA 549 19.512 -0.469 0.891
327 HA ALA 549 HA ALA 549 21.911 -1.521 1.909
328 HB1 ALA 549 HB1 ALA 549 21.132 -3.675 1.070
329 HB2 ALA 549 HB2 ALA 549 19.918 -2.865 0.084
330 HB3 ALA 549 HB3 ALA 549 19.812 -2.792 1.843
331 H GLN 550 HN GLN 550 20.849 -0.793 -1.376
332 HA GLN 550 HA GLN 550 23.095 -1.802 -2.738
333 HB2 GLN 550 HB2 GLN 550 21.399 0.594 -3.463
334 HB3 GLN 550 HB1 GLN 550 22.494 -0.255 -4.546
335 HG2 GLN 550 HG2 GLN 550 21.106 -2.311 -4.179
336 HG3 GLN 550 HG1 GLN 550 19.955 -1.283 -3.324
337 HE21 GLN 550 HE21 GLN 550 21.379 -2.055 -6.399
338 HE22 GLN 550 HE22 GLN 550 20.215 -1.225 -7.375
339 H LYS 551 HN LYS 551 22.428 1.346 -1.261
340 HA LYS 551 HA LYS 551 24.841 2.638 -1.833
341 HB2 LYS 551 HB2 LYS 551 23.347 2.791 0.782
342 HB3 LYS 551 HB1 LYS 551 24.499 3.963 0.179
343 HG2 LYS 551 HG2 LYS 551 21.786 3.369 -0.966
344 HG3 LYS 551 HG1 LYS 551 22.247 4.780 -0.028
345 HD2 LYS 551 HD2 LYS 551 23.988 5.158 -1.894
346 HD3 LYS 551 HD1 LYS 551 22.988 4.036 -2.826
347 HE2 LYS 551 HE2 LYS 551 22.149 6.636 -1.581
348 HE3 LYS 551 HE1 LYS 551 22.251 6.267 -3.301
349 HZ1 LYS 551 HZ1 LYS 551 20.451 4.665 -3.012
350 HZ2 LYS 551 HZ2 LYS 551 19.973 6.213 -2.509
351 HZ3 LYS 551 HZ3 LYS 551 20.367 5.038 -1.356
352 H SER 552 HN SER 552 23.971 0.567 0.918
353 HA SER 552 HA SER 552 26.388 0.662 2.274
354 HB2 SER 552 HB2 SER 552 24.446 -1.654 2.151
355 HB3 SER 552 HB1 SER 552 25.644 -1.367 3.415
356 HG SER 552 HG SER 552 23.707 -0.545 4.142
357 H GLU 553 HN GLU 553 25.385 -1.492 -0.348
358 HA GLU 553 HA GLU 553 27.690 -3.132 -0.277
359 HB2 GLU 553 HB2 GLU 553 25.778 -2.545 -2.537
360 HB3 GLU 553 HB1 GLU 553 27.013 -3.798 -2.575
361 HG2 GLU 553 HG2 GLU 553 24.776 -3.651 -0.576
362 HG3 GLU 553 HG1 GLU 553 24.765 -4.651 -2.029
363 H GLY 554 HN GLY 554 26.903 -0.148 -1.984
364 HA2 GLY 554 HA2 GLY 554 29.324 -0.192 -3.552
365 HA3 GLY 554 HA1 GLY 554 28.148 1.109 -3.482
366 H LYS 555 HN LYS 555 28.191 1.497 -0.667
367 HA LYS 555 HA LYS 555 30.493 3.201 -0.518
368 HB2 LYS 555 HB2 LYS 555 29.528 4.086 1.446
369 HB3 LYS 555 HB1 LYS 555 28.184 3.702 0.387
370 HG2 LYS 555 HG2 LYS 555 27.929 1.559 1.665
371 HG3 LYS 555 HG1 LYS 555 29.083 2.214 2.827
372 HD2 LYS 555 HD2 LYS 555 27.627 4.145 3.194
373 HD3 LYS 555 HD1 LYS 555 26.470 3.500 2.028
374 HE2 LYS 555 HE2 LYS 555 26.224 1.494 3.464
375 HE3 LYS 555 HE1 LYS 555 27.279 2.258 4.651
376 HZ1 LYS 555 HZ1 LYS 555 25.668 4.095 4.795
377 HZ2 LYS 555 HZ2 LYS 555 24.994 2.605 5.257
378 HZ3 LYS 555 HZ3 LYS 555 24.632 3.261 3.738
379 H SER 556 HN SER 556 29.961 -0.014 0.236
380 HA SER 556 HA SER 556 31.638 -0.407 2.451
381 HB2 SER 556 HB2 SER 556 30.124 -2.141 1.470
382 HB3 SER 556 HB1 SER 556 31.219 -2.276 0.096
383 HG SER 556 HG SER 556 32.612 -3.368 1.280
384 H LEU 557 HN LEU 557 32.428 -1.027 -0.966
385 HA LEU 557 HA LEU 557 34.612 0.667 -1.171
386 HB2 LEU 557 HB2 LEU 557 35.565 -0.975 0.515
387 HB3 LEU 557 HB1 LEU 557 35.502 -2.184 -0.751
388 HG LEU 557 HG LEU 557 37.043 -0.832 -2.118
389 HD11 LEU 557 HD11 LEU 557 37.163 0.967 0.299
390 HD12 LEU 557 HD12 LEU 557 36.478 1.380 -1.273
391 HD13 LEU 557 HD13 LEU 557 38.208 1.072 -1.117
392 HD21 LEU 557 HD21 LEU 557 37.934 -2.569 -0.673
393 HD22 LEU 557 HD22 LEU 557 38.031 -1.424 0.666
394 HD23 LEU 557 HD23 LEU 557 39.045 -1.201 -0.759
Start of MODEL 7
1 H1 GLY 510 HT1 GLY 510 -33.698 -8.799 -4.210
2 H2 GLY 510 HT2 GLY 510 -35.158 -9.444 -3.639
3 H3 GLY 510 HT3 GLY 510 -34.179 -8.523 -2.606
4 HA2 GLY 510 HA1 GLY 510 -35.643 -7.544 -4.990
5 HA3 GLY 510 HA2 GLY 510 -36.032 -7.199 -3.310
6 H SER 511 HN SER 511 -35.632 -5.108 -3.004
7 HA SER 511 HA SER 511 -33.570 -3.750 -4.502
8 HB2 SER 511 HB2 SER 511 -35.484 -2.695 -2.403
9 HB3 SER 511 HB1 SER 511 -34.465 -1.710 -3.452
10 HG SER 511 HG SER 511 -36.369 -3.569 -4.452
11 H VAL 512 HN VAL 512 -34.199 -4.480 -1.062
12 HA VAL 512 HA VAL 512 -31.858 -3.152 -0.132
13 HB VAL 512 HB VAL 512 -33.847 -3.764 1.298
14 HG11 VAL 512 HG11 VAL 512 -32.535 -6.473 1.285
15 HG12 VAL 512 HG12 VAL 512 -34.137 -6.077 0.661
16 HG13 VAL 512 HG13 VAL 512 -33.810 -5.965 2.392
17 HG21 VAL 512 HG21 VAL 512 -32.039 -2.876 2.433
18 HG22 VAL 512 HG22 VAL 512 -31.013 -4.261 2.074
19 HG23 VAL 512 HG23 VAL 512 -32.307 -4.411 3.265
20 H GLU 513 HN GLU 513 -32.514 -6.278 -1.435
21 HA GLU 513 HA GLU 513 -30.174 -7.655 -0.825
22 HB2 GLU 513 HB2 GLU 513 -31.954 -8.812 -1.849
23 HB3 GLU 513 HB1 GLU 513 -32.048 -7.667 -3.176
24 HG2 GLU 513 HG2 GLU 513 -29.945 -8.497 -4.052
25 HG3 GLU 513 HG1 GLU 513 -29.822 -9.630 -2.703
26 H THR 514 HN THR 514 -30.906 -5.421 -3.485
27 HA THR 514 HA THR 514 -28.394 -5.438 -4.715
28 HB THR 514 HB THR 514 -30.211 -3.038 -4.595
29 HG1 THR 514 HG1 THR 514 -30.482 -5.465 -6.068
30 HG21 THR 514 HG21 THR 514 -28.412 -4.169 -6.720
31 HG22 THR 514 HG22 THR 514 -28.089 -2.736 -5.750
32 HG23 THR 514 HG23 THR 514 -29.423 -2.737 -6.907
33 H CYS 515 HN CYS 515 -29.761 -3.341 -2.195
34 HA CYS 515 HA CYS 515 -27.632 -1.550 -1.978
35 HB2 CYS 515 HB2 CYS 515 -29.427 -2.439 0.280
36 HB3 CYS 515 HB1 CYS 515 -28.549 -0.915 0.156
37 HG CYS 515 HG CYS 515 -30.374 -1.065 -2.507
38 H MET 516 HN MET 516 -28.263 -4.540 -0.151
39 HA MET 516 HA MET 516 -25.940 -4.410 1.434
40 HB2 MET 516 HB2 MET 516 -27.828 -5.893 1.948
41 HB3 MET 516 HB1 MET 516 -27.476 -6.846 0.514
42 HG2 MET 516 HG2 MET 516 -25.353 -7.524 1.431
43 HG3 MET 516 HG1 MET 516 -25.597 -6.486 2.834
44 HE1 MET 516 HE1 MET 516 -28.254 -8.767 0.993
45 HE2 MET 516 HE2 MET 516 -28.102 -10.259 1.920
46 HE3 MET 516 HE3 MET 516 -26.759 -9.701 0.922
47 H SER 517 HN SER 517 -26.545 -5.696 -1.782
48 HA SER 517 HA SER 517 -24.074 -7.043 -2.076
49 HB2 SER 517 HB2 SER 517 -26.029 -7.535 -3.483
50 HB3 SER 517 HB1 SER 517 -25.937 -5.921 -4.187
51 HG SER 517 HG SER 517 -24.113 -8.076 -4.466
52 H LEU 518 HN LEU 518 -25.166 -3.807 -3.140
53 HA LEU 518 HA LEU 518 -22.676 -3.158 -4.294
54 HB2 LEU 518 HB2 LEU 518 -23.516 -0.773 -4.201
55 HB3 LEU 518 HB1 LEU 518 -24.415 -1.912 -5.174
56 HG LEU 518 HG LEU 518 -25.943 -2.075 -3.047
57 HD11 LEU 518 HD11 LEU 518 -24.349 0.396 -2.548
58 HD12 LEU 518 HD12 LEU 518 -24.950 -0.817 -1.403
59 HD13 LEU 518 HD13 LEU 518 -26.057 0.357 -2.116
60 HD21 LEU 518 HD21 LEU 518 -27.316 -0.260 -3.932
61 HD22 LEU 518 HD22 LEU 518 -26.656 -1.270 -5.219
62 HD23 LEU 518 HD23 LEU 518 -25.945 0.309 -4.884
63 H ALA 519 HN ALA 519 -24.042 -2.506 -1.111
64 HA ALA 519 HA ALA 519 -22.063 -0.723 -0.229
65 HB1 ALA 519 HB1 ALA 519 -22.845 -1.268 2.037
66 HB2 ALA 519 HB2 ALA 519 -23.769 -2.617 1.372
67 HB3 ALA 519 HB3 ALA 519 -24.177 -0.963 0.922
68 H SER 520 HN SER 520 -22.259 -4.267 0.091
69 HA SER 520 HA SER 520 -19.845 -4.505 1.567
70 HB2 SER 520 HB2 SER 520 -19.983 -6.925 0.837
71 HB3 SER 520 HB1 SER 520 -21.397 -6.312 1.691
72 HG SER 520 HG SER 520 -22.563 -6.410 -0.098
73 H GLN 521 HN GLN 521 -20.623 -4.552 -1.866
74 HA GLN 521 HA GLN 521 -18.085 -5.258 -2.847
75 HB2 GLN 521 HB2 GLN 521 -20.095 -5.216 -4.240
76 HB3 GLN 521 HB1 GLN 521 -20.197 -3.473 -4.076
77 HG2 GLN 521 HG2 GLN 521 -19.287 -3.936 -6.211
78 HG3 GLN 521 HG1 GLN 521 -17.982 -3.317 -5.205
79 HE21 GLN 521 HE21 GLN 521 -17.917 -4.960 -7.623
80 HE22 GLN 521 HE22 GLN 521 -17.035 -6.394 -7.198
81 H VAL 522 HN VAL 522 -19.547 -2.072 -2.242
82 HA VAL 522 HA VAL 522 -17.319 -0.508 -2.913
83 HB VAL 522 HB VAL 522 -19.559 0.043 -0.946
84 HG11 VAL 522 HG11 VAL 522 -17.488 1.949 -2.056
85 HG12 VAL 522 HG12 VAL 522 -17.643 1.438 -0.375
86 HG13 VAL 522 HG13 VAL 522 -18.907 2.415 -1.120
87 HG21 VAL 522 HG21 VAL 522 -19.093 0.931 -3.795
88 HG22 VAL 522 HG22 VAL 522 -20.427 1.451 -2.766
89 HG23 VAL 522 HG23 VAL 522 -20.291 -0.241 -3.246
90 H VAL 523 HN VAL 523 -18.269 -2.002 0.145
91 HA VAL 523 HA VAL 523 -16.235 -0.930 1.743
92 HB VAL 523 HB VAL 523 -18.059 -3.291 1.926
93 HG11 VAL 523 HG11 VAL 523 -15.673 -2.856 3.707
94 HG12 VAL 523 HG12 VAL 523 -16.062 -4.275 2.734
95 HG13 VAL 523 HG13 VAL 523 -17.054 -3.871 4.133
96 HG21 VAL 523 HG21 VAL 523 -17.489 -0.931 3.718
97 HG22 VAL 523 HG22 VAL 523 -18.719 -2.162 4.008
98 HG23 VAL 523 HG23 VAL 523 -18.849 -1.100 2.606
99 H LYS 524 HN LYS 524 -16.367 -3.851 -0.264
100 HA LYS 524 HA LYS 524 -13.804 -4.808 0.464
101 HB2 LYS 524 HB2 LYS 524 -15.861 -5.506 -1.470
102 HB3 LYS 524 HB1 LYS 524 -14.237 -5.749 -2.107
103 HG2 LYS 524 HG2 LYS 524 -14.960 -7.784 -1.104
104 HG3 LYS 524 HG1 LYS 524 -13.723 -7.078 -0.065
105 HD2 LYS 524 HD2 LYS 524 -15.616 -6.062 1.266
106 HD3 LYS 524 HD1 LYS 524 -16.697 -7.108 0.348
107 HE2 LYS 524 HE2 LYS 524 -14.406 -7.995 2.097
108 HE3 LYS 524 HE1 LYS 524 -16.124 -8.144 2.466
109 HZ1 LYS 524 HZ1 LYS 524 -15.328 -10.234 1.678
110 HZ2 LYS 524 HZ2 LYS 524 -14.641 -9.530 0.298
111 HZ3 LYS 524 HZ3 LYS 524 -16.326 -9.578 0.473
112 H LEU 525 HN LEU 525 -14.914 -2.681 -2.152
113 HA LEU 525 HA LEU 525 -12.403 -2.475 -3.439
114 HB2 LEU 525 HB2 LEU 525 -14.925 -0.904 -3.508
115 HB3 LEU 525 HB1 LEU 525 -13.472 -0.114 -4.088
116 HG LEU 525 HG LEU 525 -13.147 -2.060 -5.653
117 HD11 LEU 525 HD11 LEU 525 -16.030 -2.696 -5.234
118 HD12 LEU 525 HD12 LEU 525 -14.808 -3.464 -4.229
119 HD13 LEU 525 HD13 LEU 525 -14.760 -3.670 -5.982
120 HD21 LEU 525 HD21 LEU 525 -14.819 -1.254 -7.250
121 HD22 LEU 525 HD22 LEU 525 -14.035 0.077 -6.400
122 HD23 LEU 525 HD23 LEU 525 -15.662 -0.426 -5.943
123 H THR 526 HN THR 526 -13.955 -0.435 -0.973
124 HA THR 526 HA THR 526 -11.855 1.468 -0.902
125 HB THR 526 HB THR 526 -14.255 1.763 -0.017
126 HG1 THR 526 HG1 THR 526 -13.000 3.476 0.376
127 HG21 THR 526 HG21 THR 526 -14.218 -0.205 1.510
128 HG22 THR 526 HG22 THR 526 -14.655 1.301 2.315
129 HG23 THR 526 HG23 THR 526 -13.032 0.636 2.505
130 H LYS 527 HN LYS 527 -12.463 -1.491 0.942
131 HA LYS 527 HA LYS 527 -10.280 -1.123 2.728
132 HB2 LYS 527 HB2 LYS 527 -12.238 -2.690 3.065
133 HB3 LYS 527 HB1 LYS 527 -11.486 -3.761 1.890
134 HG2 LYS 527 HG2 LYS 527 -10.977 -4.475 4.141
135 HG3 LYS 527 HG1 LYS 527 -9.510 -3.929 3.325
136 HD2 LYS 527 HD2 LYS 527 -9.583 -3.099 5.608
137 HD3 LYS 527 HD1 LYS 527 -9.693 -1.763 4.461
138 HE2 LYS 527 HE2 LYS 527 -11.276 -1.387 6.223
139 HE3 LYS 527 HE1 LYS 527 -12.158 -1.790 4.749
140 HZ1 LYS 527 HZ1 LYS 527 -12.392 -4.070 5.584
141 HZ2 LYS 527 HZ2 LYS 527 -13.093 -2.941 6.634
142 HZ3 LYS 527 HZ3 LYS 527 -11.595 -3.633 7.017
143 H GLN 528 HN GLN 528 -10.688 -2.684 -0.392
144 HA GLN 528 HA GLN 528 -8.176 -3.916 -0.618
145 HB2 GLN 528 HB2 GLN 528 -10.077 -4.343 -2.123
146 HB3 GLN 528 HB1 GLN 528 -9.929 -2.718 -2.769
147 HG2 GLN 528 HG2 GLN 528 -7.663 -3.305 -3.587
148 HG3 GLN 528 HG1 GLN 528 -7.946 -4.960 -3.044
149 HE21 GLN 528 HE21 GLN 528 -8.752 -2.538 -5.397
150 HE22 GLN 528 HE22 GLN 528 -9.646 -3.576 -6.463
151 H LEU 529 HN LEU 529 -9.302 -0.705 -1.570
152 HA LEU 529 HA LEU 529 -6.941 0.243 -2.738
153 HB2 LEU 529 HB2 LEU 529 -9.122 1.697 -1.239
154 HB3 LEU 529 HB1 LEU 529 -7.870 2.498 -2.171
155 HG LEU 529 HG LEU 529 -9.879 0.569 -3.327
156 HD11 LEU 529 HD11 LEU 529 -9.836 3.569 -3.543
157 HD12 LEU 529 HD12 LEU 529 -10.831 2.681 -2.388
158 HD13 LEU 529 HD13 LEU 529 -11.081 2.458 -4.122
159 HD21 LEU 529 HD21 LEU 529 -9.123 1.463 -5.470
160 HD22 LEU 529 HD22 LEU 529 -7.791 0.713 -4.590
161 HD23 LEU 529 HD23 LEU 529 -7.937 2.471 -4.638
162 H LYS 530 HN LYS 530 -8.120 0.457 0.580
163 HA LYS 530 HA LYS 530 -5.897 1.908 1.562
164 HB2 LYS 530 HB2 LYS 530 -8.040 0.314 2.956
165 HB3 LYS 530 HB1 LYS 530 -6.815 1.248 3.814
166 HG2 LYS 530 HG2 LYS 530 -7.588 3.289 2.851
167 HG3 LYS 530 HG1 LYS 530 -8.668 2.424 1.758
168 HD2 LYS 530 HD2 LYS 530 -9.996 1.660 3.647
169 HD3 LYS 530 HD1 LYS 530 -8.897 2.472 4.765
170 HE2 LYS 530 HE2 LYS 530 -10.944 3.777 4.333
171 HE3 LYS 530 HE1 LYS 530 -9.479 4.628 3.844
172 HZ1 LYS 530 HZ1 LYS 530 -11.349 3.176 2.041
173 HZ2 LYS 530 HZ2 LYS 530 -9.910 3.924 1.546
174 HZ3 LYS 530 HZ3 LYS 530 -11.181 4.858 2.166
175 H GLU 531 HN GLU 531 -6.714 -1.572 1.727
176 HA GLU 531 HA GLU 531 -4.412 -2.326 3.164
177 HB2 GLU 531 HB2 GLU 531 -6.203 -3.863 1.290
178 HB3 GLU 531 HB1 GLU 531 -4.818 -4.609 2.076
179 HG2 GLU 531 HG2 GLU 531 -5.806 -3.916 4.272
180 HG3 GLU 531 HG1 GLU 531 -7.253 -3.431 3.387
181 H GLN 532 HN GLN 532 -4.999 -1.932 -0.292
182 HA GLN 532 HA GLN 532 -2.523 -2.876 -1.222
183 HB2 GLN 532 HB2 GLN 532 -4.420 -2.381 -2.705
184 HB3 GLN 532 HB1 GLN 532 -4.248 -0.667 -2.356
185 HG2 GLN 532 HG2 GLN 532 -1.946 -0.789 -3.325
186 HG3 GLN 532 HG1 GLN 532 -2.316 -2.436 -3.833
187 HE21 GLN 532 HE21 GLN 532 -4.664 0.150 -3.817
188 HE22 GLN 532 HE22 GLN 532 -4.831 0.280 -5.536
189 H THR 533 HN THR 533 -3.545 0.312 -0.087
190 HA THR 533 HA THR 533 -1.150 1.654 -0.765
191 HB THR 533 HB THR 533 -3.103 2.430 1.411
192 HG1 THR 533 HG1 THR 533 -4.140 2.137 -0.651
193 HG21 THR 533 HG21 THR 533 -0.888 3.610 1.331
194 HG22 THR 533 HG22 THR 533 -2.288 4.658 1.099
195 HG23 THR 533 HG23 THR 533 -1.316 4.168 -0.288
196 H VAL 534 HN VAL 534 -2.275 0.179 2.290
197 HA VAL 534 HA VAL 534 -0.087 1.084 3.808
198 HB VAL 534 HB VAL 534 -0.716 -0.588 5.500
199 HG11 VAL 534 HG11 VAL 534 -2.944 0.297 5.962
200 HG12 VAL 534 HG12 VAL 534 -3.052 0.898 4.307
201 HG13 VAL 534 HG13 VAL 534 -1.852 1.568 5.413
202 HG21 VAL 534 HG21 VAL 534 -2.610 -2.055 5.178
203 HG22 VAL 534 HG22 VAL 534 -1.379 -2.397 3.962
204 HG23 VAL 534 HG23 VAL 534 -2.815 -1.474 3.526
205 H GLU 535 HN GLU 535 -0.549 -1.959 2.000
206 HA GLU 535 HA GLU 535 1.971 -2.999 2.848
207 HB2 GLU 535 HB2 GLU 535 1.674 -4.687 1.119
208 HB3 GLU 535 HB1 GLU 535 0.219 -4.510 2.083
209 HG2 GLU 535 HG2 GLU 535 -0.898 -3.364 0.347
210 HG3 GLU 535 HG1 GLU 535 0.595 -3.169 -0.573
211 H ARG 536 HN ARG 536 0.878 -1.010 0.166
212 HA ARG 536 HA ARG 536 3.252 -1.201 -1.364
213 HB2 ARG 536 HB2 ARG 536 1.195 -0.480 -2.402
214 HB3 ARG 536 HB1 ARG 536 1.094 0.907 -1.332
215 HG2 ARG 536 HG2 ARG 536 3.571 0.763 -2.884
216 HG3 ARG 536 HG1 ARG 536 2.106 0.954 -3.849
217 HD2 ARG 536 HD2 ARG 536 2.669 2.663 -1.451
218 HD3 ARG 536 HD1 ARG 536 3.279 3.081 -3.053
219 HE ARG 536 HE ARG 536 0.620 2.667 -3.455
220 HH11 ARG 536 HH11 ARG 536 2.450 4.691 -1.266
221 HH12 ARG 536 HH12 ARG 536 1.240 5.936 -1.196
222 HH21 ARG 536 HH21 ARG 536 -0.958 4.288 -3.395
223 HH22 ARG 536 HH22 ARG 536 -0.696 5.718 -2.441
224 H VAL 537 HN VAL 537 2.183 1.170 1.081
225 HA VAL 537 HA VAL 537 4.508 2.782 0.873
226 HB VAL 537 HB VAL 537 3.921 3.744 3.030
227 HG11 VAL 537 HG11 VAL 537 1.661 4.523 2.477
228 HG12 VAL 537 HG12 VAL 537 1.521 3.224 1.291
229 HG13 VAL 537 HG13 VAL 537 2.719 4.500 1.064
230 HG21 VAL 537 HG21 VAL 537 2.187 2.938 4.434
231 HG22 VAL 537 HG22 VAL 537 3.227 1.551 4.079
232 HG23 VAL 537 HG23 VAL 537 1.685 1.740 3.242
233 H THR 538 HN THR 538 3.686 0.003 2.858
234 HA THR 538 HA THR 538 6.076 -0.116 4.339
235 HB THR 538 HB THR 538 4.170 -2.310 3.515
236 HG1 THR 538 HG1 THR 538 3.014 -1.119 4.876
237 HG21 THR 538 HG21 THR 538 6.334 -3.236 4.121
238 HG22 THR 538 HG22 THR 538 5.126 -3.612 5.348
239 HG23 THR 538 HG23 THR 538 6.310 -2.337 5.637
240 H LEU 539 HN LEU 539 5.126 -1.427 1.190
241 HA LEU 539 HA LEU 539 7.460 -2.877 0.634
242 HB2 LEU 539 HB2 LEU 539 5.490 -3.227 -0.659
243 HB3 LEU 539 HB1 LEU 539 5.368 -1.535 -1.074
244 HG LEU 539 HG LEU 539 6.059 -3.151 -2.903
245 HD11 LEU 539 HD11 LEU 539 8.106 -1.017 -2.592
246 HD12 LEU 539 HD12 LEU 539 6.401 -0.588 -2.715
247 HD13 LEU 539 HD13 LEU 539 7.179 -1.494 -4.019
248 HD21 LEU 539 HD21 LEU 539 7.671 -4.450 -1.598
249 HD22 LEU 539 HD22 LEU 539 8.695 -3.021 -1.455
250 HD23 LEU 539 HD23 LEU 539 8.408 -3.746 -3.037
251 H GLN 540 HN GLN 540 6.586 0.505 0.116
252 HA GLN 540 HA GLN 540 8.893 1.368 -1.189
253 HB2 GLN 540 HB2 GLN 540 7.167 2.842 0.801
254 HB3 GLN 540 HB1 GLN 540 8.392 3.591 -0.212
255 HG2 GLN 540 HG2 GLN 540 6.007 2.098 -1.244
256 HG3 GLN 540 HG1 GLN 540 6.100 3.853 -1.079
257 HE21 GLN 540 HE21 GLN 540 7.558 4.992 -2.382
258 HE22 GLN 540 HE22 GLN 540 8.150 4.334 -3.868
259 H ASN 541 HN ASN 541 8.253 0.906 2.251
260 HA ASN 541 HA ASN 541 10.759 1.896 3.167
261 HB2 ASN 541 HB2 ASN 541 8.760 1.543 4.628
262 HB3 ASN 541 HB1 ASN 541 8.984 -0.192 4.463
263 HD21 ASN 541 HD21 ASN 541 11.600 2.134 4.780
264 HD22 ASN 541 HD22 ASN 541 12.119 1.604 6.341
265 H GLN 542 HN GLN 542 9.617 -1.306 2.200
266 HA GLN 542 HA GLN 542 12.023 -2.702 2.719
267 HB2 GLN 542 HB2 GLN 542 9.972 -3.322 0.582
268 HB3 GLN 542 HB1 GLN 542 11.131 -4.443 1.280
269 HG2 GLN 542 HG2 GLN 542 8.897 -3.113 2.791
270 HG3 GLN 542 HG1 GLN 542 8.837 -4.744 2.128
271 HE21 GLN 542 HE21 GLN 542 9.982 -6.373 3.121
272 HE22 GLN 542 HE22 GLN 542 10.686 -6.207 4.698
273 H LEU 543 HN LEU 543 10.780 -0.969 -0.086
274 HA LEU 543 HA LEU 543 12.960 -1.507 -1.815
275 HB2 LEU 543 HB2 LEU 543 10.694 -0.706 -2.516
276 HB3 LEU 543 HB1 LEU 543 11.088 0.868 -1.853
277 HG LEU 543 HG LEU 543 12.883 -0.311 -3.938
278 HD11 LEU 543 HD11 LEU 543 10.293 1.124 -4.523
279 HD12 LEU 543 HD12 LEU 543 10.591 -0.593 -4.787
280 HD13 LEU 543 HD13 LEU 543 11.500 0.609 -5.704
281 HD21 LEU 543 HD21 LEU 543 13.120 2.058 -4.564
282 HD22 LEU 543 HD22 LEU 543 13.565 1.759 -2.885
283 HD23 LEU 543 HD23 LEU 543 12.010 2.499 -3.263
284 H GLN 544 HN GLN 544 12.311 0.960 0.593
285 HA GLN 544 HA GLN 544 14.465 2.654 0.071
286 HB2 GLN 544 HB2 GLN 544 12.578 3.139 1.618
287 HB3 GLN 544 HB1 GLN 544 13.240 1.963 2.749
288 HG2 GLN 544 HG2 GLN 544 15.328 3.320 2.752
289 HG3 GLN 544 HG1 GLN 544 14.448 4.567 1.875
290 HE21 GLN 544 HE21 GLN 544 14.951 2.988 4.888
291 HE22 GLN 544 HE22 GLN 544 13.948 4.031 5.848
292 H GLN 545 HN GLN 545 14.179 -0.159 2.213
293 HA GLN 545 HA GLN 545 16.884 -0.274 2.987
294 HB2 GLN 545 HB2 GLN 545 14.772 -2.417 2.776
295 HB3 GLN 545 HB1 GLN 545 16.363 -2.694 3.466
296 HG2 GLN 545 HG2 GLN 545 15.943 -1.084 5.199
297 HG3 GLN 545 HG1 GLN 545 14.395 -0.660 4.474
298 HE21 GLN 545 HE21 GLN 545 15.528 -3.938 4.557
299 HE22 GLN 545 HE22 GLN 545 14.391 -4.519 5.730
300 H PHE 546 HN PHE 546 15.159 -1.472 0.188
301 HA PHE 546 HA PHE 546 17.194 -3.084 -0.891
302 HB2 PHE 546 HB2 PHE 546 15.217 -3.521 -1.932
303 HB3 PHE 546 HB1 PHE 546 14.670 -1.845 -1.834
304 HD1 PHE 546 HD1 PHE 546 16.952 -4.108 -3.709
305 HD2 PHE 546 HD2 PHE 546 14.727 -0.483 -3.677
306 HE1 PHE 546 HE1 PHE 546 17.391 -3.817 -6.114
307 HE2 PHE 546 HE2 PHE 546 15.158 -0.181 -6.065
308 HZ PHE 546 HZ PHE 546 16.495 -1.853 -7.299
309 H LEU 547 HN LEU 547 16.358 0.342 -1.577
310 HA LEU 547 HA LEU 547 18.604 0.799 -3.209
311 HB2 LEU 547 HB2 LEU 547 18.109 3.127 -3.059
312 HB3 LEU 547 HB1 LEU 547 16.609 2.239 -3.166
313 HG LEU 547 HG LEU 547 16.616 2.503 -0.550
314 HD11 LEU 547 HD11 LEU 547 18.266 4.870 -1.434
315 HD12 LEU 547 HD12 LEU 547 18.821 3.545 -0.411
316 HD13 LEU 547 HD13 LEU 547 17.558 4.633 0.165
317 HD21 LEU 547 HD21 LEU 547 14.906 3.349 -2.055
318 HD22 LEU 547 HD22 LEU 547 15.919 4.735 -2.456
319 HD23 LEU 547 HD23 LEU 547 15.294 4.544 -0.817
320 H GLU 548 HN GLU 548 18.104 1.128 0.258
321 HA GLU 548 HA GLU 548 20.585 2.188 0.968
322 HB2 GLU 548 HB2 GLU 548 18.728 0.324 2.435
323 HB3 GLU 548 HB1 GLU 548 20.227 0.892 3.153
324 HG2 GLU 548 HG2 GLU 548 19.471 3.188 2.980
325 HG3 GLU 548 HG1 GLU 548 17.989 2.655 2.186
326 H ALA 549 HN ALA 549 19.634 -1.121 0.268
327 HA ALA 549 HA ALA 549 22.111 -2.334 0.900
328 HB1 ALA 549 HB1 ALA 549 21.293 -4.237 -0.381
329 HB2 ALA 549 HB2 ALA 549 19.997 -3.243 -1.048
330 HB3 ALA 549 HB3 ALA 549 20.032 -3.604 0.677
331 H GLN 550 HN GLN 550 20.824 -0.856 -2.041
332 HA GLN 550 HA GLN 550 22.976 -1.545 -3.744
333 HB2 GLN 550 HB2 GLN 550 21.202 0.903 -3.877
334 HB3 GLN 550 HB1 GLN 550 22.213 0.292 -5.178
335 HG2 GLN 550 HG2 GLN 550 20.886 -1.810 -5.120
336 HG3 GLN 550 HG1 GLN 550 19.811 -1.026 -3.965
337 HE21 GLN 550 HE21 GLN 550 20.096 1.591 -5.288
338 HE22 GLN 550 HE22 GLN 550 19.132 1.483 -6.720
339 H LYS 551 HN LYS 551 22.438 1.062 -1.476
340 HA LYS 551 HA LYS 551 24.776 2.548 -1.992
341 HB2 LYS 551 HB2 LYS 551 23.319 2.128 0.620
342 HB3 LYS 551 HB1 LYS 551 24.528 3.367 0.327
343 HG2 LYS 551 HG2 LYS 551 21.896 3.133 -1.109
344 HG3 LYS 551 HG1 LYS 551 22.252 4.244 0.215
345 HD2 LYS 551 HD2 LYS 551 24.006 5.283 -1.138
346 HD3 LYS 551 HD1 LYS 551 23.644 4.170 -2.457
347 HE2 LYS 551 HE2 LYS 551 21.390 5.089 -2.622
348 HE3 LYS 551 HE1 LYS 551 21.737 6.192 -1.288
349 HZ1 LYS 551 HZ1 LYS 551 23.458 7.223 -2.626
350 HZ2 LYS 551 HZ2 LYS 551 21.968 7.284 -3.435
351 HZ3 LYS 551 HZ3 LYS 551 23.147 6.153 -3.906
352 H SER 552 HN SER 552 24.154 -0.122 0.261
353 HA SER 552 HA SER 552 26.723 -0.416 1.276
354 HB2 SER 552 HB2 SER 552 24.714 -2.595 0.676
355 HB3 SER 552 HB1 SER 552 26.072 -2.719 1.793
356 HG SER 552 HG SER 552 23.993 -2.203 2.765
357 H GLU 553 HN GLU 553 25.286 -1.771 -1.673
358 HA GLU 553 HA GLU 553 27.516 -3.278 -2.478
359 HB2 GLU 553 HB2 GLU 553 25.407 -1.964 -4.194
360 HB3 GLU 553 HB1 GLU 553 26.505 -3.235 -4.718
361 HG2 GLU 553 HG2 GLU 553 24.501 -3.512 -2.504
362 HG3 GLU 553 HG1 GLU 553 24.234 -4.042 -4.165
363 H GLY 554 HN GLY 554 26.510 0.023 -3.263
364 HA2 GLY 554 HA2 GLY 554 28.640 0.565 -5.055
365 HA3 GLY 554 HA1 GLY 554 27.593 1.756 -4.303
366 H LYS 555 HN LYS 555 28.238 1.171 -1.585
367 HA LYS 555 HA LYS 555 30.654 2.674 -1.362
368 HB2 LYS 555 HB2 LYS 555 30.318 2.578 1.013
369 HB3 LYS 555 HB1 LYS 555 28.763 2.833 0.243
370 HG2 LYS 555 HG2 LYS 555 28.261 0.442 0.503
371 HG3 LYS 555 HG1 LYS 555 29.794 0.234 1.348
372 HD2 LYS 555 HD2 LYS 555 27.667 2.163 2.250
373 HD3 LYS 555 HD1 LYS 555 27.755 0.496 2.816
374 HE2 LYS 555 HE2 LYS 555 30.027 2.456 3.049
375 HE3 LYS 555 HE1 LYS 555 28.821 2.211 4.310
376 HZ1 LYS 555 HZ1 LYS 555 30.925 0.912 4.576
377 HZ2 LYS 555 HZ2 LYS 555 30.484 0.008 3.211
378 HZ3 LYS 555 HZ3 LYS 555 29.509 -0.021 4.598
379 H SER 556 HN SER 556 29.965 -0.685 -1.485
380 HA SER 556 HA SER 556 32.243 -1.590 -0.031
381 HB2 SER 556 HB2 SER 556 30.136 -2.921 -0.441
382 HB3 SER 556 HB1 SER 556 30.673 -3.132 -2.105
383 HG SER 556 HG SER 556 32.420 -4.306 -1.404
384 H LEU 557 HN LEU 557 31.514 -1.161 -3.478
385 HA LEU 557 HA LEU 557 34.400 -1.161 -3.963
386 HB2 LEU 557 HB2 LEU 557 33.974 -2.204 -6.199
387 HB3 LEU 557 HB1 LEU 557 33.742 -3.263 -4.825
388 HG LEU 557 HG LEU 557 31.364 -1.888 -6.021
389 HD11 LEU 557 HD11 LEU 557 31.082 -3.752 -7.575
390 HD12 LEU 557 HD12 LEU 557 32.645 -4.407 -7.082
391 HD13 LEU 557 HD13 LEU 557 32.562 -2.857 -7.919
392 HD21 LEU 557 HD21 LEU 557 30.235 -3.915 -5.261
393 HD22 LEU 557 HD22 LEU 557 31.117 -3.157 -3.934
394 HD23 LEU 557 HD23 LEU 557 31.776 -4.587 -4.730
Start of MODEL 8
1 H1 GLY 510 HT1 GLY 510 -38.394 -2.116 1.389
2 H2 GLY 510 HT2 GLY 510 -37.917 -0.739 2.255
3 H3 GLY 510 HT3 GLY 510 -36.765 -1.896 1.805
4 HA2 GLY 510 HA1 GLY 510 -37.144 -1.405 -0.530
5 HA3 GLY 510 HA2 GLY 510 -38.323 -0.194 -0.056
6 H SER 511 HN SER 511 -35.809 0.010 -1.561
7 HA SER 511 HA SER 511 -34.251 1.599 -1.925
8 HB2 SER 511 HB2 SER 511 -35.406 2.933 0.528
9 HB3 SER 511 HB1 SER 511 -34.271 3.678 -0.599
10 HG SER 511 HG SER 511 -36.725 3.944 -0.847
11 H VAL 512 HN VAL 512 -34.373 1.150 1.624
12 HA VAL 512 HA VAL 512 -31.648 1.530 2.106
13 HB VAL 512 HB VAL 512 -33.625 -0.177 3.628
14 HG11 VAL 512 HG11 VAL 512 -32.027 0.338 5.559
15 HG12 VAL 512 HG12 VAL 512 -30.841 0.717 4.305
16 HG13 VAL 512 HG13 VAL 512 -31.543 -0.896 4.399
17 HG21 VAL 512 HG21 VAL 512 -33.811 1.778 5.102
18 HG22 VAL 512 HG22 VAL 512 -34.325 2.137 3.455
19 HG23 VAL 512 HG23 VAL 512 -32.747 2.681 4.024
20 H GLU 513 HN GLU 513 -33.424 -1.294 1.107
21 HA GLU 513 HA GLU 513 -31.585 -3.319 1.494
22 HB2 GLU 513 HB2 GLU 513 -32.702 -4.383 -0.506
23 HB3 GLU 513 HB1 GLU 513 -33.778 -3.867 0.785
24 HG2 GLU 513 HG2 GLU 513 -34.343 -1.859 -0.474
25 HG3 GLU 513 HG1 GLU 513 -33.234 -2.338 -1.754
26 H THR 514 HN THR 514 -31.829 -1.027 -1.199
27 HA THR 514 HA THR 514 -29.641 -2.214 -2.641
28 HB THR 514 HB THR 514 -30.465 0.536 -3.323
29 HG1 THR 514 HG1 THR 514 -32.303 -1.593 -3.781
30 HG21 THR 514 HG21 THR 514 -30.301 -2.038 -4.878
31 HG22 THR 514 HG22 THR 514 -29.045 -0.809 -4.784
32 HG23 THR 514 HG23 THR 514 -30.580 -0.443 -5.571
33 H CYS 515 HN CYS 515 -30.173 0.589 -0.568
34 HA CYS 515 HA CYS 515 -27.710 1.869 -1.130
35 HB2 CYS 515 HB2 CYS 515 -29.396 2.186 1.355
36 HB3 CYS 515 HB1 CYS 515 -28.237 3.340 0.695
37 HG CYS 515 HG CYS 515 -31.215 2.458 -0.753
38 H MET 516 HN MET 516 -28.707 -0.447 1.342
39 HA MET 516 HA MET 516 -26.365 -0.332 2.898
40 HB2 MET 516 HB2 MET 516 -28.432 -1.430 3.646
41 HB3 MET 516 HB1 MET 516 -28.214 -2.677 2.428
42 HG2 MET 516 HG2 MET 516 -26.088 -2.172 4.466
43 HG3 MET 516 HG1 MET 516 -27.510 -3.119 4.878
44 HE1 MET 516 HE1 MET 516 -24.485 -4.184 5.082
45 HE2 MET 516 HE2 MET 516 -24.688 -5.819 4.453
46 HE3 MET 516 HE3 MET 516 -25.897 -5.136 5.540
47 H SER 517 HN SER 517 -27.190 -2.059 -0.037
48 HA SER 517 HA SER 517 -24.894 -3.722 -0.097
49 HB2 SER 517 HB2 SER 517 -26.904 -4.316 -1.339
50 HB3 SER 517 HB1 SER 517 -26.766 -2.856 -2.313
51 HG SER 517 HG SER 517 -24.511 -4.430 -2.320
52 H LEU 518 HN LEU 518 -25.674 -0.631 -1.721
53 HA LEU 518 HA LEU 518 -23.206 -0.513 -3.075
54 HB2 LEU 518 HB2 LEU 518 -23.749 1.942 -3.352
55 HB3 LEU 518 HB1 LEU 518 -24.844 0.787 -4.069
56 HG LEU 518 HG LEU 518 -26.217 1.176 -1.863
57 HD11 LEU 518 HD11 LEU 518 -24.426 3.581 -1.979
58 HD12 LEU 518 HD12 LEU 518 -24.790 2.541 -0.597
59 HD13 LEU 518 HD13 LEU 518 -26.024 3.627 -1.236
60 HD21 LEU 518 HD21 LEU 518 -27.443 2.964 -2.991
61 HD22 LEU 518 HD22 LEU 518 -26.991 1.682 -4.114
62 HD23 LEU 518 HD23 LEU 518 -26.087 3.195 -4.093
63 H ALA 519 HN ALA 519 -24.271 0.792 0.012
64 HA ALA 519 HA ALA 519 -21.960 2.296 0.576
65 HB1 ALA 519 HB1 ALA 519 -22.698 2.152 2.938
66 HB2 ALA 519 HB2 ALA 519 -23.939 1.002 2.441
67 HB3 ALA 519 HB3 ALA 519 -23.973 2.653 1.830
68 H SER 520 HN SER 520 -22.776 -1.094 1.340
69 HA SER 520 HA SER 520 -20.347 -1.606 2.730
70 HB2 SER 520 HB2 SER 520 -20.941 -4.025 2.333
71 HB3 SER 520 HB1 SER 520 -22.178 -3.072 3.151
72 HG SER 520 HG SER 520 -23.450 -3.207 1.442
73 H GLN 521 HN GLN 521 -21.320 -1.839 -0.637
74 HA GLN 521 HA GLN 521 -19.016 -3.080 -1.650
75 HB2 GLN 521 HB2 GLN 521 -20.999 -2.812 -3.005
76 HB3 GLN 521 HB1 GLN 521 -20.876 -1.063 -2.910
77 HG2 GLN 521 HG2 GLN 521 -18.851 -1.090 -4.210
78 HG3 GLN 521 HG1 GLN 521 -18.858 -2.851 -4.227
79 HE21 GLN 521 HE21 GLN 521 -18.915 -0.929 -6.433
80 HE22 GLN 521 HE22 GLN 521 -20.328 -1.322 -7.354
81 H VAL 522 HN VAL 522 -19.787 0.367 -1.203
82 HA VAL 522 HA VAL 522 -17.324 1.427 -1.995
83 HB VAL 522 HB VAL 522 -19.225 2.434 0.133
84 HG11 VAL 522 HG11 VAL 522 -16.984 3.376 0.447
85 HG12 VAL 522 HG12 VAL 522 -18.128 4.599 -0.106
86 HG13 VAL 522 HG13 VAL 522 -16.970 3.900 -1.237
87 HG21 VAL 522 HG21 VAL 522 -20.235 2.296 -2.071
88 HG22 VAL 522 HG22 VAL 522 -18.883 3.190 -2.766
89 HG23 VAL 522 HG23 VAL 522 -19.968 3.982 -1.624
90 H VAL 523 HN VAL 523 -18.390 0.119 1.102
91 HA VAL 523 HA VAL 523 -16.120 0.737 2.617
92 HB VAL 523 HB VAL 523 -18.355 -1.231 2.840
93 HG11 VAL 523 HG11 VAL 523 -15.868 -1.291 4.529
94 HG12 VAL 523 HG12 VAL 523 -16.597 -2.599 3.593
95 HG13 VAL 523 HG13 VAL 523 -17.411 -1.987 5.031
96 HG21 VAL 523 HG21 VAL 523 -17.311 0.969 4.614
97 HG22 VAL 523 HG22 VAL 523 -18.727 -0.026 4.953
98 HG23 VAL 523 HG23 VAL 523 -18.718 1.046 3.553
99 H LYS 524 HN LYS 524 -16.915 -2.144 0.670
100 HA LYS 524 HA LYS 524 -14.518 -3.545 1.190
101 HB2 LYS 524 HB2 LYS 524 -16.694 -3.730 -0.790
102 HB3 LYS 524 HB1 LYS 524 -15.152 -4.396 -1.313
103 HG2 LYS 524 HG2 LYS 524 -16.365 -6.177 -0.377
104 HG3 LYS 524 HG1 LYS 524 -15.159 -5.728 0.832
105 HD2 LYS 524 HD2 LYS 524 -16.878 -4.377 1.978
106 HD3 LYS 524 HD1 LYS 524 -18.069 -4.943 0.811
107 HE2 LYS 524 HE2 LYS 524 -16.482 -6.696 2.681
108 HE3 LYS 524 HE1 LYS 524 -18.163 -6.221 2.904
109 HZ1 LYS 524 HZ1 LYS 524 -18.649 -7.318 0.749
110 HZ2 LYS 524 HZ2 LYS 524 -18.119 -8.389 1.952
111 HZ3 LYS 524 HZ3 LYS 524 -17.056 -7.907 0.723
112 H LEU 525 HN LEU 525 -15.396 -1.210 -1.319
113 HA LEU 525 HA LEU 525 -13.018 -1.327 -2.805
114 HB2 LEU 525 HB2 LEU 525 -15.230 0.614 -2.486
115 HB3 LEU 525 HB1 LEU 525 -13.733 1.244 -3.143
116 HG LEU 525 HG LEU 525 -13.848 -0.173 -5.041
117 HD11 LEU 525 HD11 LEU 525 -15.928 -1.742 -5.183
118 HD12 LEU 525 HD12 LEU 525 -15.833 -1.684 -3.419
119 HD13 LEU 525 HD13 LEU 525 -14.463 -2.271 -4.358
120 HD21 LEU 525 HD21 LEU 525 -16.611 0.851 -4.408
121 HD22 LEU 525 HD22 LEU 525 -16.019 0.415 -6.012
122 HD23 LEU 525 HD23 LEU 525 -15.295 1.768 -5.142
123 H THR 526 HN THR 526 -13.970 0.765 -0.108
124 HA THR 526 HA THR 526 -11.627 2.288 0.007
125 HB THR 526 HB THR 526 -14.027 1.918 1.594
126 HG1 THR 526 HG1 THR 526 -13.934 4.081 1.597
127 HG21 THR 526 HG21 THR 526 -12.510 1.109 3.309
128 HG22 THR 526 HG22 THR 526 -13.152 2.698 3.740
129 HG23 THR 526 HG23 THR 526 -11.504 2.549 3.125
130 H LYS 527 HN LYS 527 -12.511 -0.782 1.508
131 HA LYS 527 HA LYS 527 -10.260 -1.030 3.182
132 HB2 LYS 527 HB2 LYS 527 -12.232 -2.408 3.514
133 HB3 LYS 527 HB1 LYS 527 -12.022 -3.148 1.934
134 HG2 LYS 527 HG2 LYS 527 -11.268 -4.667 3.626
135 HG3 LYS 527 HG1 LYS 527 -9.876 -4.090 2.705
136 HD2 LYS 527 HD2 LYS 527 -9.288 -4.077 5.023
137 HD3 LYS 527 HD1 LYS 527 -9.481 -2.402 4.505
138 HE2 LYS 527 HE2 LYS 527 -10.516 -2.815 6.691
139 HE3 LYS 527 HE1 LYS 527 -11.697 -2.330 5.471
140 HZ1 LYS 527 HZ1 LYS 527 -12.265 -4.289 6.993
141 HZ2 LYS 527 HZ2 LYS 527 -11.190 -5.186 6.038
142 HZ3 LYS 527 HZ3 LYS 527 -12.554 -4.463 5.335
143 H GLN 528 HN GLN 528 -10.912 -2.247 -0.093
144 HA GLN 528 HA GLN 528 -8.462 -3.578 -0.440
145 HB2 GLN 528 HB2 GLN 528 -10.344 -2.378 -2.473
146 HB3 GLN 528 HB1 GLN 528 -8.983 -3.413 -2.880
147 HG2 GLN 528 HG2 GLN 528 -9.957 -5.254 -1.681
148 HG3 GLN 528 HG1 GLN 528 -11.269 -4.228 -1.102
149 HE21 GLN 528 HE21 GLN 528 -12.887 -3.610 -2.518
150 HE22 GLN 528 HE22 GLN 528 -13.141 -4.400 -4.038
151 H LEU 529 HN LEU 529 -9.443 -0.255 -1.107
152 HA LEU 529 HA LEU 529 -7.079 0.584 -2.388
153 HB2 LEU 529 HB2 LEU 529 -9.041 2.123 -0.690
154 HB3 LEU 529 HB1 LEU 529 -7.782 2.861 -1.656
155 HG LEU 529 HG LEU 529 -10.026 1.190 -2.788
156 HD11 LEU 529 HD11 LEU 529 -9.714 4.182 -2.839
157 HD12 LEU 529 HD12 LEU 529 -10.727 3.318 -1.683
158 HD13 LEU 529 HD13 LEU 529 -11.085 3.229 -3.410
159 HD21 LEU 529 HD21 LEU 529 -8.006 1.212 -4.163
160 HD22 LEU 529 HD22 LEU 529 -7.975 2.974 -4.104
161 HD23 LEU 529 HD23 LEU 529 -9.296 2.144 -4.925
162 H LYS 530 HN LYS 530 -8.095 0.704 1.007
163 HA LYS 530 HA LYS 530 -5.778 1.893 2.043
164 HB2 LYS 530 HB2 LYS 530 -7.859 0.090 3.252
165 HB3 LYS 530 HB1 LYS 530 -6.476 0.633 4.190
166 HG2 LYS 530 HG2 LYS 530 -8.529 2.397 2.877
167 HG3 LYS 530 HG1 LYS 530 -8.405 2.035 4.600
168 HD2 LYS 530 HD2 LYS 530 -6.041 2.986 4.456
169 HD3 LYS 530 HD1 LYS 530 -6.521 3.622 2.882
170 HE2 LYS 530 HE2 LYS 530 -6.846 5.342 4.508
171 HE3 LYS 530 HE1 LYS 530 -8.431 4.761 3.997
172 HZ1 LYS 530 HZ1 LYS 530 -8.500 3.378 6.006
173 HZ2 LYS 530 HZ2 LYS 530 -8.362 5.029 6.374
174 HZ3 LYS 530 HZ3 LYS 530 -7.008 4.016 6.496
175 H GLU 531 HN GLU 531 -6.619 -1.558 1.744
176 HA GLU 531 HA GLU 531 -4.240 -2.460 2.972
177 HB2 GLU 531 HB2 GLU 531 -6.194 -3.887 1.170
178 HB3 GLU 531 HB1 GLU 531 -4.839 -4.682 1.963
179 HG2 GLU 531 HG2 GLU 531 -5.793 -3.779 4.139
180 HG3 GLU 531 HG1 GLU 531 -7.247 -3.408 3.214
181 H GLN 532 HN GLN 532 -5.085 -1.882 -0.411
182 HA GLN 532 HA GLN 532 -2.712 -2.872 -1.548
183 HB2 GLN 532 HB2 GLN 532 -4.612 -2.293 -2.942
184 HB3 GLN 532 HB1 GLN 532 -4.499 -0.608 -2.452
185 HG2 GLN 532 HG2 GLN 532 -2.234 -0.535 -3.495
186 HG3 GLN 532 HG1 GLN 532 -2.534 -2.157 -4.114
187 HE21 GLN 532 HE21 GLN 532 -5.031 0.269 -3.846
188 HE22 GLN 532 HE22 GLN 532 -5.245 0.507 -5.545
189 H THR 533 HN THR 533 -3.525 0.256 -0.149
190 HA THR 533 HA THR 533 -1.099 1.509 -0.954
191 HB THR 533 HB THR 533 -2.980 2.387 1.243
192 HG1 THR 533 HG1 THR 533 -4.238 2.304 -0.561
193 HG21 THR 533 HG21 THR 533 -0.722 3.472 1.105
194 HG22 THR 533 HG22 THR 533 -2.082 4.575 0.889
195 HG23 THR 533 HG23 THR 533 -1.157 4.030 -0.511
196 H VAL 534 HN VAL 534 -2.233 0.081 2.116
197 HA VAL 534 HA VAL 534 0.005 0.864 3.625
198 HB VAL 534 HB VAL 534 -0.652 -0.846 5.269
199 HG11 VAL 534 HG11 VAL 534 -2.852 0.084 5.786
200 HG12 VAL 534 HG12 VAL 534 -2.949 0.758 4.159
201 HG13 VAL 534 HG13 VAL 534 -1.718 1.336 5.281
202 HG21 VAL 534 HG21 VAL 534 -2.597 -2.242 4.923
203 HG22 VAL 534 HG22 VAL 534 -1.383 -2.584 3.689
204 HG23 VAL 534 HG23 VAL 534 -2.793 -1.605 3.290
205 H GLU 535 HN GLU 535 -0.575 -2.094 1.727
206 HA GLU 535 HA GLU 535 1.905 -3.274 2.510
207 HB2 GLU 535 HB2 GLU 535 1.528 -4.860 0.695
208 HB3 GLU 535 HB1 GLU 535 0.074 -4.657 1.654
209 HG2 GLU 535 HG2 GLU 535 -0.968 -3.371 -0.026
210 HG3 GLU 535 HG1 GLU 535 0.544 -3.179 -0.910
211 H ARG 536 HN ARG 536 0.874 -1.136 -0.074
212 HA ARG 536 HA ARG 536 3.228 -1.348 -1.633
213 HB2 ARG 536 HB2 ARG 536 1.101 -0.564 -2.540
214 HB3 ARG 536 HB1 ARG 536 1.194 0.862 -1.517
215 HG2 ARG 536 HG2 ARG 536 3.597 0.651 -3.035
216 HG3 ARG 536 HG1 ARG 536 2.203 0.516 -4.114
217 HD2 ARG 536 HD2 ARG 536 2.562 2.651 -2.037
218 HD3 ARG 536 HD1 ARG 536 2.977 2.857 -3.743
219 HE ARG 536 HE ARG 536 0.354 1.998 -3.718
220 HH11 ARG 536 HH11 ARG 536 2.127 4.732 -2.418
221 HH12 ARG 536 HH12 ARG 536 0.763 5.809 -2.503
222 HH21 ARG 536 HH21 ARG 536 -1.439 3.408 -3.812
223 HH22 ARG 536 HH22 ARG 536 -1.259 5.061 -3.301
224 H VAL 537 HN VAL 537 2.210 1.000 0.839
225 HA VAL 537 HA VAL 537 4.566 2.565 0.658
226 HB VAL 537 HB VAL 537 3.966 3.533 2.811
227 HG11 VAL 537 HG11 VAL 537 1.734 4.361 2.233
228 HG12 VAL 537 HG12 VAL 537 1.577 3.066 1.045
229 HG13 VAL 537 HG13 VAL 537 2.804 4.317 0.829
230 HG21 VAL 537 HG21 VAL 537 2.164 2.756 4.170
231 HG22 VAL 537 HG22 VAL 537 3.224 1.372 3.864
232 HG23 VAL 537 HG23 VAL 537 1.713 1.545 2.972
233 H THR 538 HN THR 538 3.680 -0.212 2.613
234 HA THR 538 HA THR 538 6.034 -0.341 4.160
235 HB THR 538 HB THR 538 4.081 -2.492 3.349
236 HG1 THR 538 HG1 THR 538 2.936 -1.326 4.713
237 HG21 THR 538 HG21 THR 538 6.234 -3.457 3.991
238 HG22 THR 538 HG22 THR 538 4.986 -3.815 5.183
239 HG23 THR 538 HG23 THR 538 6.185 -2.561 5.506
240 H LEU 539 HN LEU 539 5.147 -1.730 1.025
241 HA LEU 539 HA LEU 539 7.465 -3.249 0.585
242 HB2 LEU 539 HB2 LEU 539 5.442 -3.521 -0.740
243 HB3 LEU 539 HB1 LEU 539 5.561 -1.874 -1.320
244 HG LEU 539 HG LEU 539 6.206 -3.793 -2.899
245 HD11 LEU 539 HD11 LEU 539 8.364 -2.258 -3.476
246 HD12 LEU 539 HD12 LEU 539 7.418 -1.177 -2.437
247 HD13 LEU 539 HD13 LEU 539 6.698 -1.857 -3.899
248 HD21 LEU 539 HD21 LEU 539 7.673 -5.000 -1.363
249 HD22 LEU 539 HD22 LEU 539 8.743 -3.599 -1.282
250 HD23 LEU 539 HD23 LEU 539 8.549 -4.473 -2.801
251 H GLN 540 HN GLN 540 6.620 0.090 -0.246
252 HA GLN 540 HA GLN 540 9.066 0.776 -1.448
253 HB2 GLN 540 HB2 GLN 540 7.041 2.507 -0.041
254 HB3 GLN 540 HB1 GLN 540 8.378 3.114 -1.013
255 HG2 GLN 540 HG2 GLN 540 6.219 1.292 -2.013
256 HG3 GLN 540 HG1 GLN 540 6.232 3.045 -2.231
257 HE21 GLN 540 HE21 GLN 540 6.260 0.919 -4.232
258 HE22 GLN 540 HE22 GLN 540 7.683 1.170 -5.186
259 H ASN 541 HN ASN 541 8.071 0.623 1.883
260 HA ASN 541 HA ASN 541 10.303 1.987 3.002
261 HB2 ASN 541 HB2 ASN 541 8.280 1.548 4.319
262 HB3 ASN 541 HB1 ASN 541 8.546 -0.185 4.184
263 HD21 ASN 541 HD21 ASN 541 9.741 2.793 5.578
264 HD22 ASN 541 HD22 ASN 541 10.675 2.046 6.838
265 H GLN 542 HN GLN 542 9.657 -1.441 2.347
266 HA GLN 542 HA GLN 542 12.168 -2.427 3.189
267 HB2 GLN 542 HB2 GLN 542 10.407 -3.542 1.001
268 HB3 GLN 542 HB1 GLN 542 11.615 -4.420 1.928
269 HG2 GLN 542 HG2 GLN 542 10.295 -4.223 3.924
270 HG3 GLN 542 HG1 GLN 542 9.124 -3.201 3.090
271 HE21 GLN 542 HE21 GLN 542 9.348 -4.834 0.638
272 HE22 GLN 542 HE22 GLN 542 8.432 -6.271 0.955
273 H LEU 543 HN LEU 543 10.931 -1.334 0.077
274 HA LEU 543 HA LEU 543 13.255 -1.804 -1.432
275 HB2 LEU 543 HB2 LEU 543 10.921 -1.358 -2.288
276 HB3 LEU 543 HB1 LEU 543 11.189 0.337 -1.936
277 HG LEU 543 HG LEU 543 13.119 -1.092 -3.713
278 HD11 LEU 543 HD11 LEU 543 10.440 -0.008 -4.583
279 HD12 LEU 543 HD12 LEU 543 10.916 -1.705 -4.576
280 HD13 LEU 543 HD13 LEU 543 11.724 -0.565 -5.654
281 HD21 LEU 543 HD21 LEU 543 13.205 1.137 -4.788
282 HD22 LEU 543 HD22 LEU 543 13.657 1.174 -3.086
283 HD23 LEU 543 HD23 LEU 543 12.060 1.734 -3.584
284 H GLN 544 HN GLN 544 12.230 0.895 0.569
285 HA GLN 544 HA GLN 544 14.184 2.755 -0.134
286 HB2 GLN 544 HB2 GLN 544 12.294 3.347 1.263
287 HB3 GLN 544 HB1 GLN 544 12.822 2.234 2.516
288 HG2 GLN 544 HG2 GLN 544 14.837 3.575 2.817
289 HG3 GLN 544 HG1 GLN 544 14.241 4.730 1.631
290 HE21 GLN 544 HE21 GLN 544 12.248 3.065 3.971
291 HE22 GLN 544 HE22 GLN 544 11.861 4.457 4.926
292 H GLN 545 HN GLN 545 14.220 0.234 2.380
293 HA GLN 545 HA GLN 545 16.874 0.589 3.200
294 HB2 GLN 545 HB2 GLN 545 15.093 -0.725 4.382
295 HB3 GLN 545 HB1 GLN 545 15.272 -1.974 3.157
296 HG2 GLN 545 HG2 GLN 545 17.542 -2.367 3.819
297 HG3 GLN 545 HG1 GLN 545 17.464 -1.013 4.942
298 HE21 GLN 545 HE21 GLN 545 16.399 -4.273 4.316
299 HE22 GLN 545 HE22 GLN 545 15.898 -4.626 5.934
300 H PHE 546 HN PHE 546 15.400 -1.191 0.568
301 HA PHE 546 HA PHE 546 17.681 -2.695 -0.181
302 HB2 PHE 546 HB2 PHE 546 15.790 -3.660 -1.009
303 HB3 PHE 546 HB1 PHE 546 14.989 -2.115 -1.291
304 HD1 PHE 546 HD1 PHE 546 17.466 -4.501 -2.661
305 HD2 PHE 546 HD2 PHE 546 15.020 -1.100 -3.386
306 HE1 PHE 546 HE1 PHE 546 17.915 -4.695 -5.074
307 HE2 PHE 546 HE2 PHE 546 15.464 -1.278 -5.786
308 HZ PHE 546 HZ PHE 546 16.915 -3.079 -6.642
309 H LEU 547 HN LEU 547 16.317 0.353 -1.468
310 HA LEU 547 HA LEU 547 18.269 0.684 -3.456
311 HB2 LEU 547 HB2 LEU 547 17.441 2.895 -3.734
312 HB3 LEU 547 HB1 LEU 547 16.085 1.853 -3.366
313 HG LEU 547 HG LEU 547 16.525 2.741 -0.902
314 HD11 LEU 547 HD11 LEU 547 17.509 4.984 -2.656
315 HD12 LEU 547 HD12 LEU 547 18.481 4.069 -1.505
316 HD13 LEU 547 HD13 LEU 547 17.165 5.094 -0.931
317 HD21 LEU 547 HD21 LEU 547 14.442 2.935 -2.164
318 HD22 LEU 547 HD22 LEU 547 15.104 4.316 -3.039
319 HD23 LEU 547 HD23 LEU 547 14.820 4.427 -1.304
320 H GLU 548 HN GLU 548 18.153 1.768 -0.106
321 HA GLU 548 HA GLU 548 20.582 3.193 -0.182
322 HB2 GLU 548 HB2 GLU 548 19.156 1.896 2.134
323 HB3 GLU 548 HB1 GLU 548 20.565 2.935 2.305
324 HG2 GLU 548 HG2 GLU 548 19.210 4.691 1.047
325 HG3 GLU 548 HG1 GLU 548 17.816 3.657 1.356
326 H ALA 549 HN ALA 549 19.821 -0.187 0.432
327 HA ALA 549 HA ALA 549 22.390 -1.074 1.114
328 HB1 ALA 549 HB1 ALA 549 21.661 -3.277 0.381
329 HB2 ALA 549 HB2 ALA 549 20.289 -2.560 -0.464
330 HB3 ALA 549 HB3 ALA 549 20.382 -2.479 1.295
331 H GLN 550 HN GLN 550 20.851 -0.537 -2.035
332 HA GLN 550 HA GLN 550 22.997 -1.385 -3.642
333 HB2 GLN 550 HB2 GLN 550 20.972 0.785 -4.217
334 HB3 GLN 550 HB1 GLN 550 22.026 0.037 -5.407
335 HG2 GLN 550 HG2 GLN 550 20.945 -2.148 -4.844
336 HG3 GLN 550 HG1 GLN 550 19.785 -1.234 -3.879
337 HE21 GLN 550 HE21 GLN 550 18.302 0.104 -4.918
338 HE22 GLN 550 HE22 GLN 550 17.967 -0.035 -6.612
339 H LYS 551 HN LYS 551 22.181 1.795 -2.302
340 HA LYS 551 HA LYS 551 24.338 3.262 -3.289
341 HB2 LYS 551 HB2 LYS 551 23.076 3.509 -0.559
342 HB3 LYS 551 HB1 LYS 551 24.047 4.733 -1.354
343 HG2 LYS 551 HG2 LYS 551 21.376 3.731 -2.317
344 HG3 LYS 551 HG1 LYS 551 21.660 5.234 -1.440
345 HD2 LYS 551 HD2 LYS 551 23.248 5.854 -3.322
346 HD3 LYS 551 HD1 LYS 551 22.561 4.491 -4.210
347 HE2 LYS 551 HE2 LYS 551 21.354 6.416 -4.894
348 HE3 LYS 551 HE1 LYS 551 20.297 5.523 -3.802
349 HZ1 LYS 551 HZ1 LYS 551 21.860 7.968 -3.197
350 HZ2 LYS 551 HZ2 LYS 551 21.105 7.040 -2.000
351 HZ3 LYS 551 HZ3 LYS 551 20.174 7.798 -3.202
352 H SER 552 HN SER 552 24.091 1.294 -0.367
353 HA SER 552 HA SER 552 26.646 1.829 0.661
354 HB2 SER 552 HB2 SER 552 24.944 -0.651 1.015
355 HB3 SER 552 HB1 SER 552 26.280 -0.157 2.057
356 HG SER 552 HG SER 552 23.764 1.087 1.689
357 H GLU 553 HN GLU 553 25.538 -0.539 -1.705
358 HA GLU 553 HA GLU 553 28.086 -1.866 -1.819
359 HB2 GLU 553 HB2 GLU 553 25.674 -2.015 -3.623
360 HB3 GLU 553 HB1 GLU 553 27.112 -3.010 -3.811
361 HG2 GLU 553 HG2 GLU 553 25.309 -2.951 -1.417
362 HG3 GLU 553 HG1 GLU 553 25.352 -4.213 -2.649
363 H GLY 554 HN GLY 554 26.372 0.561 -3.696
364 HA2 GLY 554 HA2 GLY 554 28.225 0.740 -5.826
365 HA3 GLY 554 HA1 GLY 554 27.040 1.956 -5.385
366 H LYS 555 HN LYS 555 27.943 2.520 -2.766
367 HA LYS 555 HA LYS 555 30.038 4.344 -3.343
368 HB2 LYS 555 HB2 LYS 555 29.900 5.010 -1.061
369 HB3 LYS 555 HB1 LYS 555 28.267 4.642 -1.590
370 HG2 LYS 555 HG2 LYS 555 28.432 2.443 -0.495
371 HG3 LYS 555 HG1 LYS 555 30.038 2.883 0.093
372 HD2 LYS 555 HD2 LYS 555 29.038 4.813 1.273
373 HD3 LYS 555 HD1 LYS 555 27.441 4.289 0.735
374 HE2 LYS 555 HE2 LYS 555 27.754 2.165 1.930
375 HE3 LYS 555 HE1 LYS 555 29.331 2.718 2.485
376 HZ1 LYS 555 HZ1 LYS 555 28.173 4.599 3.582
377 HZ2 LYS 555 HZ2 LYS 555 27.765 3.078 4.217
378 HZ3 LYS 555 HZ3 LYS 555 26.692 3.877 3.179
379 H SER 556 HN SER 556 30.059 1.060 -2.550
380 HA SER 556 HA SER 556 32.663 1.021 -1.313
381 HB2 SER 556 HB2 SER 556 30.896 -0.685 -0.796
382 HB3 SER 556 HB1 SER 556 31.059 -1.296 -2.442
383 HG SER 556 HG SER 556 33.287 -1.083 -0.702
384 H LEU 557 HN LEU 557 33.654 2.270 -3.039
385 HA LEU 557 HA LEU 557 34.831 0.504 -5.031
386 HB2 LEU 557 HB2 LEU 557 32.766 1.850 -5.933
387 HB3 LEU 557 HB1 LEU 557 33.867 3.210 -5.907
388 HG LEU 557 HG LEU 557 34.407 0.672 -7.447
389 HD11 LEU 557 HD11 LEU 557 33.250 3.282 -8.419
390 HD12 LEU 557 HD12 LEU 557 32.381 1.753 -8.281
391 HD13 LEU 557 HD13 LEU 557 33.709 1.911 -9.430
392 HD21 LEU 557 HD21 LEU 557 36.047 2.037 -8.626
393 HD22 LEU 557 HD22 LEU 557 36.388 2.009 -6.896
394 HD23 LEU 557 HD23 LEU 557 35.629 3.425 -7.622
Start of MODEL 9
1 H1 GLY 510 HT1 GLY 510 -29.727 12.009 -3.403
2 H2 GLY 510 HT2 GLY 510 -31.341 11.533 -3.576
3 H3 GLY 510 HT3 GLY 510 -30.129 10.360 -3.385
4 HA2 GLY 510 HA1 GLY 510 -29.657 11.242 -1.154
5 HA3 GLY 510 HA2 GLY 510 -31.013 12.342 -1.363
6 H SER 511 HN SER 511 -30.649 8.897 -2.203
7 HA SER 511 HA SER 511 -32.910 8.331 -0.391
8 HB2 SER 511 HB2 SER 511 -32.022 6.758 -2.826
9 HB3 SER 511 HB1 SER 511 -33.435 6.427 -1.823
10 HG SER 511 HG SER 511 -33.781 8.873 -2.497
11 H VAL 512 HN VAL 512 -32.598 6.882 1.194
12 HA VAL 512 HA VAL 512 -29.919 6.263 1.927
13 HB VAL 512 HB VAL 512 -32.339 4.969 3.155
14 HG11 VAL 512 HG11 VAL 512 -29.860 5.986 4.497
15 HG12 VAL 512 HG12 VAL 512 -29.926 4.393 3.750
16 HG13 VAL 512 HG13 VAL 512 -31.022 4.790 5.078
17 HG21 VAL 512 HG21 VAL 512 -32.531 6.919 4.635
18 HG22 VAL 512 HG22 VAL 512 -32.861 7.339 2.954
19 HG23 VAL 512 HG23 VAL 512 -31.308 7.757 3.680
20 H GLU 513 HN GLU 513 -32.491 4.436 0.395
21 HA GLU 513 HA GLU 513 -31.524 1.843 0.738
22 HB2 GLU 513 HB2 GLU 513 -33.027 3.048 -1.576
23 HB3 GLU 513 HB1 GLU 513 -32.808 1.342 -1.285
24 HG2 GLU 513 HG2 GLU 513 -34.991 2.004 -0.643
25 HG3 GLU 513 HG1 GLU 513 -34.087 1.510 0.783
26 H THR 514 HN THR 514 -31.128 4.087 -1.944
27 HA THR 514 HA THR 514 -29.216 2.485 -3.316
28 HB THR 514 HB THR 514 -28.830 4.690 -4.601
29 HG1 THR 514 HG1 THR 514 -30.724 6.118 -4.269
30 HG21 THR 514 HG21 THR 514 -30.217 2.848 -5.435
31 HG22 THR 514 HG22 THR 514 -30.935 4.409 -5.835
32 HG23 THR 514 HG23 THR 514 -31.587 3.453 -4.504
33 H CYS 515 HN CYS 515 -28.983 5.359 -1.247
34 HA CYS 515 HA CYS 515 -26.271 5.887 -1.528
35 HB2 CYS 515 HB2 CYS 515 -27.742 7.437 -0.403
36 HB3 CYS 515 HB1 CYS 515 -28.046 6.275 0.887
37 HG CYS 515 HG CYS 515 -26.346 7.476 2.385
38 H MET 516 HN MET 516 -27.851 3.808 0.923
39 HA MET 516 HA MET 516 -25.429 3.054 2.149
40 HB2 MET 516 HB2 MET 516 -28.170 1.830 2.122
41 HB3 MET 516 HB1 MET 516 -26.826 1.014 2.910
42 HG2 MET 516 HG2 MET 516 -26.455 3.078 4.255
43 HG3 MET 516 HG1 MET 516 -27.934 3.731 3.556
44 HE1 MET 516 HE1 MET 516 -28.878 2.814 7.293
45 HE2 MET 516 HE2 MET 516 -28.828 4.112 6.099
46 HE3 MET 516 HE3 MET 516 -27.327 3.408 6.702
47 H SER 517 HN SER 517 -27.128 1.804 -0.650
48 HA SER 517 HA SER 517 -25.629 -0.594 -0.874
49 HB2 SER 517 HB2 SER 517 -27.122 0.955 -3.007
50 HB3 SER 517 HB1 SER 517 -26.545 -0.705 -3.160
51 HG SER 517 HG SER 517 -28.636 0.329 -1.575
52 H LEU 518 HN LEU 518 -25.329 2.577 -2.520
53 HA LEU 518 HA LEU 518 -23.003 1.812 -3.913
54 HB2 LEU 518 HB2 LEU 518 -22.669 4.307 -4.230
55 HB3 LEU 518 HB1 LEU 518 -24.098 3.578 -4.921
56 HG LEU 518 HG LEU 518 -25.247 4.450 -2.717
57 HD11 LEU 518 HD11 LEU 518 -22.650 5.884 -2.761
58 HD12 LEU 518 HD12 LEU 518 -23.668 5.407 -1.393
59 HD13 LEU 518 HD13 LEU 518 -24.098 6.810 -2.369
60 HD21 LEU 518 HD21 LEU 518 -25.840 5.153 -4.953
61 HD22 LEU 518 HD22 LEU 518 -24.453 6.240 -5.006
62 HD23 LEU 518 HD23 LEU 518 -25.771 6.546 -3.875
63 H ALA 519 HN ALA 519 -23.492 3.486 -0.861
64 HA ALA 519 HA ALA 519 -20.821 4.195 -0.390
65 HB1 ALA 519 HB1 ALA 519 -21.494 4.355 1.987
66 HB2 ALA 519 HB2 ALA 519 -23.039 3.617 1.561
67 HB3 ALA 519 HB3 ALA 519 -22.595 5.185 0.888
68 H SER 520 HN SER 520 -22.618 1.247 0.494
69 HA SER 520 HA SER 520 -20.490 0.103 1.970
70 HB2 SER 520 HB2 SER 520 -21.764 -2.051 1.636
71 HB3 SER 520 HB1 SER 520 -22.684 -0.737 2.366
72 HG SER 520 HG SER 520 -23.871 -0.541 0.591
73 H GLN 521 HN GLN 521 -21.445 -0.136 -1.444
74 HA GLN 521 HA GLN 521 -19.515 -2.047 -2.174
75 HB2 GLN 521 HB2 GLN 521 -21.326 -1.477 -3.681
76 HB3 GLN 521 HB1 GLN 521 -20.731 0.172 -3.822
77 HG2 GLN 521 HG2 GLN 521 -18.772 -0.564 -4.969
78 HG3 GLN 521 HG1 GLN 521 -19.176 -2.251 -4.670
79 HE21 GLN 521 HE21 GLN 521 -20.794 -3.229 -5.854
80 HE22 GLN 521 HE22 GLN 521 -21.399 -2.542 -7.326
81 H VAL 522 HN VAL 522 -19.419 1.501 -2.228
82 HA VAL 522 HA VAL 522 -16.777 1.819 -3.078
83 HB VAL 522 HB VAL 522 -18.421 3.583 -1.250
84 HG11 VAL 522 HG11 VAL 522 -15.863 4.248 -2.711
85 HG12 VAL 522 HG12 VAL 522 -16.033 4.048 -0.967
86 HG13 VAL 522 HG13 VAL 522 -16.855 5.375 -1.787
87 HG21 VAL 522 HG21 VAL 522 -17.858 3.762 -4.212
88 HG22 VAL 522 HG22 VAL 522 -18.789 4.922 -3.264
89 HG23 VAL 522 HG23 VAL 522 -19.383 3.275 -3.472
90 H VAL 523 HN VAL 523 -18.113 1.272 0.140
91 HA VAL 523 HA VAL 523 -15.785 1.680 1.631
92 HB VAL 523 HB VAL 523 -18.367 0.274 2.076
93 HG11 VAL 523 HG11 VAL 523 -15.938 -0.154 3.793
94 HG12 VAL 523 HG12 VAL 523 -16.956 -1.366 3.010
95 HG13 VAL 523 HG13 VAL 523 -17.591 -0.416 4.353
96 HG21 VAL 523 HG21 VAL 523 -16.814 2.355 3.605
97 HG22 VAL 523 HG22 VAL 523 -18.432 1.781 4.011
98 HG23 VAL 523 HG23 VAL 523 -18.157 2.648 2.500
99 H LYS 524 HN LYS 524 -17.006 -1.249 0.013
100 HA LYS 524 HA LYS 524 -14.883 -2.903 0.915
101 HB2 LYS 524 HB2 LYS 524 -16.968 -3.115 -1.194
102 HB3 LYS 524 HB1 LYS 524 -15.571 -4.178 -1.322
103 HG2 LYS 524 HG2 LYS 524 -17.262 -5.365 -0.160
104 HG3 LYS 524 HG1 LYS 524 -16.036 -4.911 1.025
105 HD2 LYS 524 HD2 LYS 524 -17.486 -2.892 1.527
106 HD3 LYS 524 HD1 LYS 524 -18.741 -3.685 0.577
107 HE2 LYS 524 HE2 LYS 524 -17.420 -4.753 3.067
108 HE3 LYS 524 HE1 LYS 524 -19.073 -4.159 2.926
109 HZ1 LYS 524 HZ1 LYS 524 -19.424 -5.986 1.265
110 HZ2 LYS 524 HZ2 LYS 524 -19.162 -6.502 2.859
111 HZ3 LYS 524 HZ3 LYS 524 -17.913 -6.608 1.719
112 H LEU 525 HN LEU 525 -15.304 -0.844 -1.925
113 HA LEU 525 HA LEU 525 -12.913 -1.597 -3.231
114 HB2 LEU 525 HB2 LEU 525 -14.746 0.743 -3.402
115 HB3 LEU 525 HB1 LEU 525 -13.158 0.882 -4.131
116 HG LEU 525 HG LEU 525 -13.658 -1.134 -5.504
117 HD11 LEU 525 HD11 LEU 525 -16.511 -0.812 -4.657
118 HD12 LEU 525 HD12 LEU 525 -15.428 -1.951 -3.863
119 HD13 LEU 525 HD13 LEU 525 -15.770 -2.116 -5.588
120 HD21 LEU 525 HD21 LEU 525 -15.193 -0.004 -7.030
121 HD22 LEU 525 HD22 LEU 525 -13.968 1.100 -6.408
122 HD23 LEU 525 HD23 LEU 525 -15.608 1.148 -5.760
123 H THR 526 HN THR 526 -13.650 1.071 -1.006
124 HA THR 526 HA THR 526 -11.035 2.142 -1.046
125 HB THR 526 HB THR 526 -13.079 3.409 -0.304
126 HG1 THR 526 HG1 THR 526 -11.170 4.384 0.169
127 HG21 THR 526 HG21 THR 526 -12.683 1.810 2.230
128 HG22 THR 526 HG22 THR 526 -14.107 1.809 1.186
129 HG23 THR 526 HG23 THR 526 -13.682 3.257 2.099
130 H LYS 527 HN LYS 527 -12.567 -0.338 0.903
131 HA LYS 527 HA LYS 527 -10.617 -0.634 2.891
132 HB2 LYS 527 HB2 LYS 527 -12.803 -1.746 2.976
133 HB3 LYS 527 HB1 LYS 527 -12.363 -2.739 1.593
134 HG2 LYS 527 HG2 LYS 527 -12.149 -4.029 3.605
135 HG3 LYS 527 HG1 LYS 527 -10.544 -3.731 2.931
136 HD2 LYS 527 HD2 LYS 527 -10.490 -3.424 5.326
137 HD3 LYS 527 HD1 LYS 527 -10.258 -1.870 4.527
138 HE2 LYS 527 HE2 LYS 527 -12.618 -1.335 4.903
139 HE3 LYS 527 HE1 LYS 527 -12.839 -2.891 5.703
140 HZ1 LYS 527 HZ1 LYS 527 -12.533 -1.157 7.334
141 HZ2 LYS 527 HZ2 LYS 527 -11.072 -0.686 6.615
142 HZ3 LYS 527 HZ3 LYS 527 -11.196 -2.200 7.368
143 H GLN 528 HN GLN 528 -10.934 -2.161 -0.293
144 HA GLN 528 HA GLN 528 -8.561 -3.692 -0.137
145 HB2 GLN 528 HB2 GLN 528 -10.653 -3.632 -1.852
146 HB3 GLN 528 HB1 GLN 528 -9.461 -2.760 -2.805
147 HG2 GLN 528 HG2 GLN 528 -9.001 -5.478 -1.602
148 HG3 GLN 528 HG1 GLN 528 -9.575 -5.208 -3.244
149 HE21 GLN 528 HE21 GLN 528 -7.135 -6.491 -2.228
150 HE22 GLN 528 HE22 GLN 528 -5.812 -5.655 -2.967
151 H LEU 529 HN LEU 529 -9.285 -0.475 -1.424
152 HA LEU 529 HA LEU 529 -6.783 0.101 -2.554
153 HB2 LEU 529 HB2 LEU 529 -8.814 1.940 -1.299
154 HB3 LEU 529 HB1 LEU 529 -7.444 2.482 -2.247
155 HG LEU 529 HG LEU 529 -9.664 0.726 -3.290
156 HD11 LEU 529 HD11 LEU 529 -9.179 3.656 -3.772
157 HD12 LEU 529 HD12 LEU 529 -10.346 3.013 -2.617
158 HD13 LEU 529 HD13 LEU 529 -10.537 2.682 -4.342
159 HD21 LEU 529 HD21 LEU 529 -7.504 0.464 -4.449
160 HD22 LEU 529 HD22 LEU 529 -7.465 2.203 -4.740
161 HD23 LEU 529 HD23 LEU 529 -8.728 1.213 -5.473
162 H LYS 530 HN LYS 530 -8.051 0.782 0.689
163 HA LYS 530 HA LYS 530 -5.745 2.030 1.691
164 HB2 LYS 530 HB2 LYS 530 -8.017 0.591 3.025
165 HB3 LYS 530 HB1 LYS 530 -6.677 1.242 3.961
166 HG2 LYS 530 HG2 LYS 530 -7.136 3.468 3.090
167 HG3 LYS 530 HG1 LYS 530 -8.465 2.823 2.125
168 HD2 LYS 530 HD2 LYS 530 -9.681 2.214 4.100
169 HD3 LYS 530 HD1 LYS 530 -8.311 2.639 5.128
170 HE2 LYS 530 HE2 LYS 530 -10.065 4.365 5.136
171 HE3 LYS 530 HE1 LYS 530 -8.530 4.970 4.515
172 HZ1 LYS 530 HZ1 LYS 530 -9.347 4.844 2.297
173 HZ2 LYS 530 HZ2 LYS 530 -10.502 5.675 3.217
174 HZ3 LYS 530 HZ3 LYS 530 -10.763 4.056 2.784
175 H GLU 531 HN GLU 531 -6.698 -1.408 1.748
176 HA GLU 531 HA GLU 531 -4.376 -2.290 3.103
177 HB2 GLU 531 HB2 GLU 531 -6.266 -3.707 1.231
178 HB3 GLU 531 HB1 GLU 531 -4.891 -4.516 1.972
179 HG2 GLU 531 HG2 GLU 531 -5.848 -3.744 4.199
180 HG3 GLU 531 HG1 GLU 531 -7.318 -3.363 3.299
181 H GLN 532 HN GLN 532 -5.102 -1.773 -0.301
182 HA GLN 532 HA GLN 532 -2.689 -2.709 -1.387
183 HB2 GLN 532 HB2 GLN 532 -4.608 -2.200 -2.783
184 HB3 GLN 532 HB1 GLN 532 -4.544 -0.508 -2.317
185 HG2 GLN 532 HG2 GLN 532 -2.373 -0.298 -3.440
186 HG3 GLN 532 HG1 GLN 532 -2.485 -1.987 -3.938
187 HE21 GLN 532 HE21 GLN 532 -3.966 -2.574 -5.517
188 HE22 GLN 532 HE22 GLN 532 -4.726 -1.411 -6.548
189 H THR 533 HN THR 533 -3.592 0.373 0.036
190 HA THR 533 HA THR 533 -1.216 1.770 -0.649
191 HB THR 533 HB THR 533 -3.061 2.345 1.679
192 HG1 THR 533 HG1 THR 533 -4.075 2.169 -0.507
193 HG21 THR 533 HG21 THR 533 -0.889 3.562 1.615
194 HG22 THR 533 HG22 THR 533 -2.291 4.621 1.468
195 HG23 THR 533 HG23 THR 533 -1.341 4.211 0.039
196 H VAL 534 HN VAL 534 -2.245 0.082 2.341
197 HA VAL 534 HA VAL 534 0.054 0.811 3.806
198 HB VAL 534 HB VAL 534 -0.564 -0.954 5.421
199 HG11 VAL 534 HG11 VAL 534 -2.703 0.029 6.080
200 HG12 VAL 534 HG12 VAL 534 -2.863 0.756 4.481
201 HG13 VAL 534 HG13 VAL 534 -1.562 1.268 5.556
202 HG21 VAL 534 HG21 VAL 534 -2.591 -2.260 5.108
203 HG22 VAL 534 HG22 VAL 534 -1.426 -2.614 3.831
204 HG23 VAL 534 HG23 VAL 534 -2.807 -1.569 3.501
205 H GLU 535 HN GLU 535 -0.642 -2.062 1.836
206 HA GLU 535 HA GLU 535 1.817 -3.338 2.506
207 HB2 GLU 535 HB2 GLU 535 1.344 -4.824 0.619
208 HB3 GLU 535 HB1 GLU 535 -0.066 -4.637 1.646
209 HG2 GLU 535 HG2 GLU 535 -1.066 -3.119 0.072
210 HG3 GLU 535 HG1 GLU 535 0.391 -3.144 -0.919
211 H ARG 536 HN ARG 536 0.804 -1.050 0.056
212 HA ARG 536 HA ARG 536 3.118 -1.219 -1.557
213 HB2 ARG 536 HB2 ARG 536 1.129 -0.273 -2.482
214 HB3 ARG 536 HB1 ARG 536 1.052 0.944 -1.219
215 HG2 ARG 536 HG2 ARG 536 3.534 1.014 -2.752
216 HG3 ARG 536 HG1 ARG 536 2.084 1.311 -3.715
217 HD2 ARG 536 HD2 ARG 536 2.683 2.708 -1.127
218 HD3 ARG 536 HD1 ARG 536 3.128 3.359 -2.706
219 HE ARG 536 HE ARG 536 0.389 2.712 -2.705
220 HH11 ARG 536 HH11 ARG 536 2.585 5.047 -1.273
221 HH12 ARG 536 HH12 ARG 536 1.382 6.298 -1.177
222 HH21 ARG 536 HH21 ARG 536 -1.180 4.340 -2.543
223 HH22 ARG 536 HH22 ARG 536 -0.766 5.892 -1.871
224 H VAL 537 HN VAL 537 2.229 1.008 1.084
225 HA VAL 537 HA VAL 537 4.629 2.495 0.960
226 HB VAL 537 HB VAL 537 4.126 3.329 3.187
227 HG11 VAL 537 HG11 VAL 537 1.881 4.220 2.766
228 HG12 VAL 537 HG12 VAL 537 1.662 3.017 1.492
229 HG13 VAL 537 HG13 VAL 537 2.896 4.266 1.324
230 HG21 VAL 537 HG21 VAL 537 2.391 2.497 4.580
231 HG22 VAL 537 HG22 VAL 537 3.371 1.102 4.112
232 HG23 VAL 537 HG23 VAL 537 1.820 1.397 3.326
233 H THR 538 HN THR 538 3.714 -0.393 2.729
234 HA THR 538 HA THR 538 6.065 -0.678 4.241
235 HB THR 538 HB THR 538 4.097 -2.761 3.281
236 HG1 THR 538 HG1 THR 538 3.028 -1.389 4.618
237 HG21 THR 538 HG21 THR 538 6.168 -3.828 3.914
238 HG22 THR 538 HG22 THR 538 4.946 -4.139 5.144
239 HG23 THR 538 HG23 THR 538 6.206 -2.937 5.434
240 H LEU 539 HN LEU 539 5.167 -1.783 0.994
241 HA LEU 539 HA LEU 539 7.498 -3.337 0.550
242 HB2 LEU 539 HB2 LEU 539 5.493 -3.715 -0.723
243 HB3 LEU 539 HB1 LEU 539 5.469 -2.061 -1.287
244 HG LEU 539 HG LEU 539 6.157 -3.886 -2.936
245 HD11 LEU 539 HD11 LEU 539 8.246 -1.785 -2.774
246 HD12 LEU 539 HD12 LEU 539 6.557 -1.313 -2.946
247 HD13 LEU 539 HD13 LEU 539 7.314 -2.351 -4.163
248 HD21 LEU 539 HD21 LEU 539 7.700 -5.101 -1.496
249 HD22 LEU 539 HD22 LEU 539 8.728 -3.671 -1.384
250 HD23 LEU 539 HD23 LEU 539 8.523 -4.490 -2.933
251 H GLN 540 HN GLN 540 6.577 -0.009 -0.251
252 HA GLN 540 HA GLN 540 8.965 0.732 -1.523
253 HB2 GLN 540 HB2 GLN 540 7.039 2.403 0.085
254 HB3 GLN 540 HB1 GLN 540 8.334 3.052 -0.910
255 HG2 GLN 540 HG2 GLN 540 6.116 1.325 -1.951
256 HG3 GLN 540 HG1 GLN 540 6.089 3.088 -1.972
257 HE21 GLN 540 HE21 GLN 540 7.508 0.225 -3.328
258 HE22 GLN 540 HE22 GLN 540 8.273 0.997 -4.673
259 H ASN 541 HN ASN 541 8.072 0.570 1.858
260 HA ASN 541 HA ASN 541 10.323 1.859 2.974
261 HB2 ASN 541 HB2 ASN 541 8.186 1.171 4.170
262 HB3 ASN 541 HB1 ASN 541 8.797 -0.476 4.168
263 HD21 ASN 541 HD21 ASN 541 8.121 1.309 6.373
264 HD22 ASN 541 HD22 ASN 541 9.550 1.412 7.349
265 H GLN 542 HN GLN 542 9.687 -1.548 2.186
266 HA GLN 542 HA GLN 542 12.215 -2.553 2.937
267 HB2 GLN 542 HB2 GLN 542 10.358 -3.603 0.791
268 HB3 GLN 542 HB1 GLN 542 11.647 -4.506 1.575
269 HG2 GLN 542 HG2 GLN 542 9.159 -3.440 2.887
270 HG3 GLN 542 HG1 GLN 542 9.485 -5.121 2.470
271 HE21 GLN 542 HE21 GLN 542 10.936 -6.299 3.695
272 HE22 GLN 542 HE22 GLN 542 11.491 -5.766 5.252
273 H LEU 543 HN LEU 543 10.966 -1.249 -0.089
274 HA LEU 543 HA LEU 543 13.294 -1.722 -1.637
275 HB2 LEU 543 HB2 LEU 543 11.003 -1.277 -2.537
276 HB3 LEU 543 HB1 LEU 543 11.183 0.395 -2.049
277 HG LEU 543 HG LEU 543 13.219 -0.789 -3.884
278 HD11 LEU 543 HD11 LEU 543 10.512 0.242 -4.734
279 HD12 LEU 543 HD12 LEU 543 11.032 -1.439 -4.796
280 HD13 LEU 543 HD13 LEU 543 11.830 -0.235 -5.805
281 HD21 LEU 543 HD21 LEU 543 13.170 1.521 -4.787
282 HD22 LEU 543 HD22 LEU 543 13.611 1.446 -3.083
283 HD23 LEU 543 HD23 LEU 543 11.984 1.944 -3.552
284 H GLN 544 HN GLN 544 12.226 0.944 0.382
285 HA GLN 544 HA GLN 544 14.167 2.822 -0.335
286 HB2 GLN 544 HB2 GLN 544 12.081 3.254 0.959
287 HB3 GLN 544 HB1 GLN 544 12.803 2.436 2.336
288 HG2 GLN 544 HG2 GLN 544 14.518 4.091 2.458
289 HG3 GLN 544 HG1 GLN 544 13.897 4.907 1.025
290 HE21 GLN 544 HE21 GLN 544 11.890 5.984 1.168
291 HE22 GLN 544 HE22 GLN 544 11.244 6.485 2.690
292 H GLN 545 HN GLN 545 14.070 0.332 2.165
293 HA GLN 545 HA GLN 545 16.709 0.766 3.106
294 HB2 GLN 545 HB2 GLN 545 14.912 -1.653 3.247
295 HB3 GLN 545 HB1 GLN 545 16.469 -1.547 4.056
296 HG2 GLN 545 HG2 GLN 545 15.698 0.307 5.381
297 HG3 GLN 545 HG1 GLN 545 14.163 0.327 4.516
298 HE21 GLN 545 HE21 GLN 545 12.641 -1.237 4.944
299 HE22 GLN 545 HE22 GLN 545 12.732 -2.273 6.326
300 H PHE 546 HN PHE 546 15.331 -1.098 0.494
301 HA PHE 546 HA PHE 546 17.579 -2.668 -0.143
302 HB2 PHE 546 HB2 PHE 546 15.764 -3.494 -1.227
303 HB3 PHE 546 HB1 PHE 546 15.024 -1.901 -1.416
304 HD1 PHE 546 HD1 PHE 546 17.636 -4.148 -2.832
305 HD2 PHE 546 HD2 PHE 546 15.082 -0.796 -3.439
306 HE1 PHE 546 HE1 PHE 546 18.211 -4.143 -5.229
307 HE2 PHE 546 HE2 PHE 546 15.646 -0.781 -5.823
308 HZ PHE 546 HZ PHE 546 17.217 -2.459 -6.731
309 H LEU 547 HN LEU 547 16.527 0.498 -1.444
310 HA LEU 547 HA LEU 547 18.751 0.818 -3.134
311 HB2 LEU 547 HB2 LEU 547 18.078 3.076 -3.404
312 HB3 LEU 547 HB1 LEU 547 16.631 2.105 -3.266
313 HG LEU 547 HG LEU 547 16.783 2.859 -0.731
314 HD11 LEU 547 HD11 LEU 547 18.138 5.110 -2.205
315 HD12 LEU 547 HD12 LEU 547 18.871 4.083 -0.974
316 HD13 LEU 547 HD13 LEU 547 17.550 5.170 -0.543
317 HD21 LEU 547 HD21 LEU 547 15.731 4.549 -2.993
318 HD22 LEU 547 HD22 LEU 547 15.270 4.718 -1.300
319 HD23 LEU 547 HD23 LEU 547 14.883 3.236 -2.175
320 H GLU 548 HN GLU 548 18.217 1.634 0.238
321 HA GLU 548 HA GLU 548 20.693 2.906 0.682
322 HB2 GLU 548 HB2 GLU 548 18.921 1.366 2.581
323 HB3 GLU 548 HB1 GLU 548 20.323 2.301 3.082
324 HG2 GLU 548 HG2 GLU 548 19.265 4.327 2.160
325 HG3 GLU 548 HG1 GLU 548 17.838 3.371 1.759
326 H ALA 549 HN ALA 549 19.697 -0.472 0.758
327 HA ALA 549 HA ALA 549 22.084 -1.577 1.751
328 HB1 ALA 549 HB1 ALA 549 21.310 -3.680 0.763
329 HB2 ALA 549 HB2 ALA 549 20.088 -2.800 -0.155
330 HB3 ALA 549 HB3 ALA 549 20.001 -2.849 1.606
331 H GLN 550 HN GLN 550 21.028 -0.779 -1.530
332 HA GLN 550 HA GLN 550 23.244 -1.744 -2.936
333 HB2 GLN 550 HB2 GLN 550 21.638 0.746 -3.556
334 HB3 GLN 550 HB1 GLN 550 22.646 -0.146 -4.687
335 HG2 GLN 550 HG2 GLN 550 21.184 -2.096 -4.427
336 HG3 GLN 550 HG1 GLN 550 20.158 -1.155 -3.342
337 HE21 GLN 550 HE21 GLN 550 21.159 -1.663 -6.631
338 HE22 GLN 550 HE22 GLN 550 19.929 -0.691 -7.361
339 H LYS 551 HN LYS 551 22.755 1.240 -1.164
340 HA LYS 551 HA LYS 551 25.205 2.493 -1.871
341 HB2 LYS 551 HB2 LYS 551 23.613 2.849 0.667
342 HB3 LYS 551 HB1 LYS 551 24.799 3.965 0.012
343 HG2 LYS 551 HG2 LYS 551 22.217 3.228 -1.332
344 HG3 LYS 551 HG1 LYS 551 22.472 4.677 -0.361
345 HD2 LYS 551 HD2 LYS 551 24.184 5.432 -1.917
346 HD3 LYS 551 HD1 LYS 551 23.994 3.952 -2.863
347 HE2 LYS 551 HE2 LYS 551 21.834 6.003 -2.384
348 HE3 LYS 551 HE1 LYS 551 22.807 5.876 -3.850
349 HZ1 LYS 551 HZ1 LYS 551 21.069 3.703 -2.816
350 HZ2 LYS 551 HZ2 LYS 551 21.886 3.732 -4.299
351 HZ3 LYS 551 HZ3 LYS 551 20.604 4.801 -4.020
352 H SER 552 HN SER 552 24.214 0.416 0.804
353 HA SER 552 HA SER 552 26.666 0.445 2.189
354 HB2 SER 552 HB2 SER 552 24.396 -0.393 3.027
355 HB3 SER 552 HB1 SER 552 24.737 -1.880 2.142
356 HG SER 552 HG SER 552 26.278 -2.395 3.538
357 H GLU 553 HN GLU 553 25.534 -1.321 -0.587
358 HA GLU 553 HA GLU 553 27.777 -3.106 -0.694
359 HB2 GLU 553 HB2 GLU 553 25.717 -2.331 -2.764
360 HB3 GLU 553 HB1 GLU 553 26.954 -3.558 -3.014
361 HG2 GLU 553 HG2 GLU 553 24.845 -3.633 -0.876
362 HG3 GLU 553 HG1 GLU 553 24.776 -4.511 -2.404
363 H GLY 554 HN GLY 554 26.850 -0.066 -2.224
364 HA2 GLY 554 HA2 GLY 554 29.050 0.056 -4.025
365 HA3 GLY 554 HA1 GLY 554 27.972 1.378 -3.612
366 H LYS 555 HN LYS 555 28.546 1.289 -0.762
367 HA LYS 555 HA LYS 555 30.830 2.942 -0.649
368 HB2 LYS 555 HB2 LYS 555 30.588 2.844 1.764
369 HB3 LYS 555 HB1 LYS 555 29.004 2.998 1.020
370 HG2 LYS 555 HG2 LYS 555 28.687 0.563 1.284
371 HG3 LYS 555 HG1 LYS 555 30.227 0.489 2.137
372 HD2 LYS 555 HD2 LYS 555 27.894 2.187 3.001
373 HD3 LYS 555 HD1 LYS 555 28.218 0.567 3.618
374 HE2 LYS 555 HE2 LYS 555 30.460 1.383 4.351
375 HE3 LYS 555 HE1 LYS 555 29.959 3.010 3.889
376 HZ1 LYS 555 HZ1 LYS 555 29.645 2.544 6.270
377 HZ2 LYS 555 HZ2 LYS 555 28.548 1.310 5.878
378 HZ3 LYS 555 HZ3 LYS 555 28.185 2.921 5.491
379 H SER 556 HN SER 556 30.456 -0.450 -0.638
380 HA SER 556 HA SER 556 33.142 -0.906 0.422
381 HB2 SER 556 HB2 SER 556 31.169 -2.277 1.214
382 HB3 SER 556 HB1 SER 556 31.078 -2.960 -0.407
383 HG SER 556 HG SER 556 32.447 -4.358 0.352
384 H LEU 557 HN LEU 557 32.017 0.066 -2.366
385 HA LEU 557 HA LEU 557 33.644 -1.735 -4.022
386 HB2 LEU 557 HB2 LEU 557 31.284 -1.462 -4.696
387 HB3 LEU 557 HB1 LEU 557 31.536 0.266 -4.846
388 HG LEU 557 HG LEU 557 33.159 -0.145 -6.669
389 HD11 LEU 557 HD11 LEU 557 33.896 -2.370 -6.014
390 HD12 LEU 557 HD12 LEU 557 33.285 -2.377 -7.668
391 HD13 LEU 557 HD13 LEU 557 32.291 -3.016 -6.359
392 HD21 LEU 557 HD21 LEU 557 31.507 -0.820 -8.350
393 HD22 LEU 557 HD22 LEU 557 30.830 0.329 -7.194
394 HD23 LEU 557 HD23 LEU 557 30.437 -1.385 -7.065
Start of MODEL 10
1 H1 GLY 510 HT1 GLY 510 -32.353 10.574 -2.505
2 H2 GLY 510 HT2 GLY 510 -32.467 10.934 -0.848
3 H3 GLY 510 HT3 GLY 510 -33.823 10.366 -1.686
4 HA2 GLY 510 HA1 GLY 510 -32.766 8.236 -2.053
5 HA3 GLY 510 HA2 GLY 510 -31.333 8.818 -1.216
6 H SER 511 HN SER 511 -33.607 6.715 -0.756
7 HA SER 511 HA SER 511 -34.551 7.588 1.861
8 HB2 SER 511 HB2 SER 511 -35.808 5.391 1.768
9 HB3 SER 511 HB1 SER 511 -36.208 6.545 0.496
10 HG SER 511 HG SER 511 -35.309 4.053 0.245
11 H VAL 512 HN VAL 512 -31.716 7.055 1.473
12 HA VAL 512 HA VAL 512 -29.999 6.229 2.688
13 HB VAL 512 HB VAL 512 -32.169 5.056 4.428
14 HG11 VAL 512 HG11 VAL 512 -30.250 4.805 6.088
15 HG12 VAL 512 HG12 VAL 512 -29.174 4.954 4.693
16 HG13 VAL 512 HG13 VAL 512 -30.334 3.631 4.777
17 HG21 VAL 512 HG21 VAL 512 -31.505 6.829 5.984
18 HG22 VAL 512 HG22 VAL 512 -32.034 7.495 4.438
19 HG23 VAL 512 HG23 VAL 512 -30.315 7.406 4.818
20 H GLU 513 HN GLU 513 -32.500 3.726 2.367
21 HA GLU 513 HA GLU 513 -30.848 1.503 2.479
22 HB2 GLU 513 HB2 GLU 513 -32.694 0.338 1.275
23 HB3 GLU 513 HB1 GLU 513 -33.214 1.284 2.661
24 HG2 GLU 513 HG2 GLU 513 -33.974 3.063 1.204
25 HG3 GLU 513 HG1 GLU 513 -33.372 2.191 -0.204
26 H THR 514 HN THR 514 -31.762 3.428 -0.352
27 HA THR 514 HA THR 514 -30.451 1.666 -2.202
28 HB THR 514 HB THR 514 -31.136 4.487 -2.911
29 HG1 THR 514 HG1 THR 514 -33.094 2.440 -2.486
30 HG21 THR 514 HG21 THR 514 -31.599 1.834 -4.254
31 HG22 THR 514 HG22 THR 514 -30.303 2.965 -4.626
32 HG23 THR 514 HG23 THR 514 -31.980 3.408 -4.946
33 H CYS 515 HN CYS 515 -29.429 4.184 -0.143
34 HA CYS 515 HA CYS 515 -27.031 4.729 -1.724
35 HB2 CYS 515 HB2 CYS 515 -28.281 6.548 -0.432
36 HB3 CYS 515 HB1 CYS 515 -27.679 5.775 1.038
37 HG CYS 515 HG CYS 515 -25.944 7.779 0.886
38 H MET 516 HN MET 516 -28.138 3.146 1.178
39 HA MET 516 HA MET 516 -25.750 2.380 2.360
40 HB2 MET 516 HB2 MET 516 -27.807 2.031 3.507
41 HB3 MET 516 HB1 MET 516 -28.451 1.038 2.213
42 HG2 MET 516 HG2 MET 516 -26.833 -0.706 2.739
43 HG3 MET 516 HG1 MET 516 -26.159 0.299 4.021
44 HE1 MET 516 HE1 MET 516 -29.982 -0.069 3.066
45 HE2 MET 516 HE2 MET 516 -30.445 -1.427 4.094
46 HE3 MET 516 HE3 MET 516 -29.311 -1.674 2.768
47 H SER 517 HN SER 517 -27.424 1.037 -0.412
48 HA SER 517 HA SER 517 -25.887 -1.334 -0.612
49 HB2 SER 517 HB2 SER 517 -26.852 -1.430 -2.915
50 HB3 SER 517 HB1 SER 517 -28.069 -1.158 -1.666
51 HG SER 517 HG SER 517 -28.588 0.368 -3.047
52 H LEU 518 HN LEU 518 -25.678 1.783 -2.365
53 HA LEU 518 HA LEU 518 -23.346 1.047 -3.766
54 HB2 LEU 518 HB2 LEU 518 -23.118 3.523 -4.208
55 HB3 LEU 518 HB1 LEU 518 -24.555 2.729 -4.807
56 HG LEU 518 HG LEU 518 -25.634 3.664 -2.603
57 HD11 LEU 518 HD11 LEU 518 -23.125 5.270 -2.876
58 HD12 LEU 518 HD12 LEU 518 -23.884 4.609 -1.422
59 HD13 LEU 518 HD13 LEU 518 -24.597 6.001 -2.238
60 HD21 LEU 518 HD21 LEU 518 -26.317 4.274 -4.849
61 HD22 LEU 518 HD22 LEU 518 -24.958 5.394 -4.979
62 HD23 LEU 518 HD23 LEU 518 -26.250 5.705 -3.819
63 H ALA 519 HN ALA 519 -23.861 2.773 -0.769
64 HA ALA 519 HA ALA 519 -21.249 3.666 -0.332
65 HB1 ALA 519 HB1 ALA 519 -21.917 3.775 2.061
66 HB2 ALA 519 HB2 ALA 519 -23.412 2.940 1.634
67 HB3 ALA 519 HB3 ALA 519 -23.068 4.534 0.961
68 H SER 520 HN SER 520 -22.801 0.608 0.606
69 HA SER 520 HA SER 520 -20.566 -0.398 2.023
70 HB2 SER 520 HB2 SER 520 -21.705 -2.640 1.615
71 HB3 SER 520 HB1 SER 520 -22.638 -1.425 2.486
72 HG SER 520 HG SER 520 -23.933 -1.160 0.797
73 H GLN 521 HN GLN 521 -21.555 -0.617 -1.374
74 HA GLN 521 HA GLN 521 -19.494 -2.343 -2.210
75 HB2 GLN 521 HB2 GLN 521 -20.849 -0.114 -3.725
76 HB3 GLN 521 HB1 GLN 521 -19.788 -1.316 -4.444
77 HG2 GLN 521 HG2 GLN 521 -21.311 -3.081 -3.772
78 HG3 GLN 521 HG1 GLN 521 -22.380 -1.889 -3.035
79 HE21 GLN 521 HE21 GLN 521 -20.674 -1.309 -6.015
80 HE22 GLN 521 HE22 GLN 521 -22.060 -1.337 -7.051
81 H VAL 522 HN VAL 522 -19.594 1.206 -2.025
82 HA VAL 522 HA VAL 522 -16.967 1.714 -2.850
83 HB VAL 522 HB VAL 522 -18.620 3.263 -0.842
84 HG11 VAL 522 HG11 VAL 522 -16.260 3.850 -0.679
85 HG12 VAL 522 HG12 VAL 522 -17.178 5.167 -1.408
86 HG13 VAL 522 HG13 VAL 522 -16.191 4.114 -2.422
87 HG21 VAL 522 HG21 VAL 522 -18.285 3.625 -3.815
88 HG22 VAL 522 HG22 VAL 522 -19.181 4.700 -2.742
89 HG23 VAL 522 HG23 VAL 522 -19.732 3.043 -2.991
90 H VAL 523 HN VAL 523 -18.293 0.862 0.290
91 HA VAL 523 HA VAL 523 -16.037 1.310 1.865
92 HB VAL 523 HB VAL 523 -18.521 -0.328 2.125
93 HG11 VAL 523 HG11 VAL 523 -16.123 -0.640 3.908
94 HG12 VAL 523 HG12 VAL 523 -17.024 -1.884 3.041
95 HG13 VAL 523 HG13 VAL 523 -17.765 -1.054 4.405
96 HG21 VAL 523 HG21 VAL 523 -18.557 2.027 2.683
97 HG22 VAL 523 HG22 VAL 523 -17.235 1.799 3.828
98 HG23 VAL 523 HG23 VAL 523 -18.804 1.050 4.130
99 H LYS 524 HN LYS 524 -17.029 -1.566 0.013
100 HA LYS 524 HA LYS 524 -14.854 -3.178 0.846
101 HB2 LYS 524 HB2 LYS 524 -16.854 -3.294 -1.336
102 HB3 LYS 524 HB1 LYS 524 -15.371 -4.207 -1.586
103 HG2 LYS 524 HG2 LYS 524 -16.966 -5.670 -0.615
104 HG3 LYS 524 HG1 LYS 524 -15.769 -5.296 0.625
105 HD2 LYS 524 HD2 LYS 524 -17.383 -3.467 1.379
106 HD3 LYS 524 HD1 LYS 524 -18.580 -4.270 0.364
107 HE2 LYS 524 HE2 LYS 524 -17.085 -5.475 2.686
108 HE3 LYS 524 HE1 LYS 524 -18.792 -5.039 2.643
109 HZ1 LYS 524 HZ1 LYS 524 -17.494 -7.126 0.972
110 HZ2 LYS 524 HZ2 LYS 524 -19.135 -6.707 0.920
111 HZ3 LYS 524 HZ3 LYS 524 -18.479 -7.406 2.324
112 H LEU 525 HN LEU 525 -15.264 -0.950 -1.885
113 HA LEU 525 HA LEU 525 -12.770 -1.491 -3.093
114 HB2 LEU 525 HB2 LEU 525 -14.688 0.801 -3.246
115 HB3 LEU 525 HB1 LEU 525 -13.091 0.970 -3.947
116 HG LEU 525 HG LEU 525 -13.565 -1.065 -5.339
117 HD11 LEU 525 HD11 LEU 525 -16.423 -0.638 -4.518
118 HD12 LEU 525 HD12 LEU 525 -15.394 -1.896 -3.838
119 HD13 LEU 525 HD13 LEU 525 -15.768 -1.899 -5.566
120 HD21 LEU 525 HD21 LEU 525 -14.998 0.130 -6.928
121 HD22 LEU 525 HD22 LEU 525 -13.739 1.171 -6.262
122 HD23 LEU 525 HD23 LEU 525 -15.398 1.305 -5.675
123 H THR 526 HN THR 526 -13.750 1.022 -0.774
124 HA THR 526 HA THR 526 -11.258 2.342 -0.751
125 HB THR 526 HB THR 526 -13.405 3.351 0.060
126 HG1 THR 526 HG1 THR 526 -10.951 3.709 0.948
127 HG21 THR 526 HG21 THR 526 -12.862 1.745 2.555
128 HG22 THR 526 HG22 THR 526 -14.188 1.463 1.429
129 HG23 THR 526 HG23 THR 526 -14.120 2.965 2.350
130 H LYS 527 HN LYS 527 -12.500 -0.383 1.111
131 HA LYS 527 HA LYS 527 -10.373 -0.429 2.988
132 HB2 LYS 527 HB2 LYS 527 -12.510 -1.595 3.378
133 HB3 LYS 527 HB1 LYS 527 -12.131 -2.713 2.073
134 HG2 LYS 527 HG2 LYS 527 -11.687 -3.672 4.280
135 HG3 LYS 527 HG1 LYS 527 -10.221 -3.545 3.305
136 HD2 LYS 527 HD2 LYS 527 -9.793 -2.843 5.589
137 HD3 LYS 527 HD1 LYS 527 -9.625 -1.480 4.484
138 HE2 LYS 527 HE2 LYS 527 -10.819 -0.665 6.351
139 HE3 LYS 527 HE1 LYS 527 -12.010 -0.884 5.071
140 HZ1 LYS 527 HZ1 LYS 527 -11.616 -2.449 7.527
141 HZ2 LYS 527 HZ2 LYS 527 -12.314 -3.195 6.177
142 HZ3 LYS 527 HZ3 LYS 527 -13.052 -1.836 6.867
143 H GLN 528 HN GLN 528 -10.946 -2.171 -0.047
144 HA GLN 528 HA GLN 528 -8.576 -3.675 -0.009
145 HB2 GLN 528 HB2 GLN 528 -10.526 -4.086 -1.517
146 HB3 GLN 528 HB1 GLN 528 -10.040 -2.679 -2.456
147 HG2 GLN 528 HG2 GLN 528 -7.857 -3.775 -2.868
148 HG3 GLN 528 HG1 GLN 528 -8.469 -5.207 -2.042
149 HE21 GLN 528 HE21 GLN 528 -8.287 -6.508 -3.821
150 HE22 GLN 528 HE22 GLN 528 -9.327 -6.363 -5.202
151 H LEU 529 HN LEU 529 -9.322 -0.498 -1.380
152 HA LEU 529 HA LEU 529 -6.837 0.033 -2.570
153 HB2 LEU 529 HB2 LEU 529 -8.812 1.917 -1.288
154 HB3 LEU 529 HB1 LEU 529 -7.472 2.423 -2.292
155 HG LEU 529 HG LEU 529 -9.743 0.676 -3.239
156 HD11 LEU 529 HD11 LEU 529 -9.269 3.600 -3.777
157 HD12 LEU 529 HD12 LEU 529 -10.398 2.980 -2.573
158 HD13 LEU 529 HD13 LEU 529 -10.650 2.620 -4.281
159 HD21 LEU 529 HD21 LEU 529 -7.659 0.362 -4.476
160 HD22 LEU 529 HD22 LEU 529 -7.545 2.103 -4.738
161 HD23 LEU 529 HD23 LEU 529 -8.868 1.186 -5.463
162 H LYS 530 HN LYS 530 -8.067 0.745 0.667
163 HA LYS 530 HA LYS 530 -5.781 1.971 1.699
164 HB2 LYS 530 HB2 LYS 530 -8.019 1.903 2.804
165 HB3 LYS 530 HB1 LYS 530 -7.718 0.221 3.219
166 HG2 LYS 530 HG2 LYS 530 -7.282 1.722 5.100
167 HG3 LYS 530 HG1 LYS 530 -5.823 0.872 4.589
168 HD2 LYS 530 HD2 LYS 530 -5.065 2.828 3.381
169 HD3 LYS 530 HD1 LYS 530 -6.560 3.679 3.770
170 HE2 LYS 530 HE2 LYS 530 -4.515 2.714 5.767
171 HE3 LYS 530 HE1 LYS 530 -4.694 4.375 5.201
172 HZ1 LYS 530 HZ1 LYS 530 -6.701 2.808 6.733
173 HZ2 LYS 530 HZ2 LYS 530 -6.973 4.353 6.097
174 HZ3 LYS 530 HZ3 LYS 530 -5.799 4.128 7.298
175 H GLU 531 HN GLU 531 -6.707 -1.461 1.656
176 HA GLU 531 HA GLU 531 -4.446 -2.417 3.019
177 HB2 GLU 531 HB2 GLU 531 -6.211 -3.759 0.974
178 HB3 GLU 531 HB1 GLU 531 -4.957 -4.598 1.878
179 HG2 GLU 531 HG2 GLU 531 -6.142 -3.750 3.967
180 HG3 GLU 531 HG1 GLU 531 -7.488 -3.365 2.897
181 H GLN 532 HN GLN 532 -5.029 -1.940 -0.450
182 HA GLN 532 HA GLN 532 -2.536 -2.877 -1.344
183 HB2 GLN 532 HB2 GLN 532 -4.365 -0.784 -2.512
184 HB3 GLN 532 HB1 GLN 532 -2.935 -1.402 -3.325
185 HG2 GLN 532 HG2 GLN 532 -3.919 -3.673 -3.216
186 HG3 GLN 532 HG1 GLN 532 -5.388 -2.957 -2.551
187 HE21 GLN 532 HE21 GLN 532 -6.629 -3.622 -4.307
188 HE22 GLN 532 HE22 GLN 532 -6.504 -2.878 -5.866
189 H THR 533 HN THR 533 -3.529 0.206 -0.023
190 HA THR 533 HA THR 533 -1.167 1.623 -0.742
191 HB THR 533 HB THR 533 -3.083 2.258 1.513
192 HG1 THR 533 HG1 THR 533 -4.061 2.041 -0.636
193 HG21 THR 533 HG21 THR 533 -0.875 3.454 1.480
194 HG22 THR 533 HG22 THR 533 -2.281 4.507 1.332
195 HG23 THR 533 HG23 THR 533 -1.322 4.112 -0.094
196 H VAL 534 HN VAL 534 -2.224 0.023 2.273
197 HA VAL 534 HA VAL 534 0.023 0.845 3.765
198 HB VAL 534 HB VAL 534 -0.610 -0.881 5.418
199 HG11 VAL 534 HG11 VAL 534 -2.746 0.098 6.008
200 HG12 VAL 534 HG12 VAL 534 -2.957 0.694 4.364
201 HG13 VAL 534 HG13 VAL 534 -1.670 1.348 5.380
202 HG21 VAL 534 HG21 VAL 534 -2.602 -2.236 5.073
203 HG22 VAL 534 HG22 VAL 534 -1.379 -2.614 3.860
204 HG23 VAL 534 HG23 VAL 534 -2.764 -1.609 3.433
205 H GLU 535 HN GLU 535 -0.552 -2.129 1.893
206 HA GLU 535 HA GLU 535 1.959 -3.251 2.651
207 HB2 GLU 535 HB2 GLU 535 1.554 -4.869 0.839
208 HB3 GLU 535 HB1 GLU 535 0.196 -4.727 1.943
209 HG2 GLU 535 HG2 GLU 535 -0.977 -3.330 0.344
210 HG3 GLU 535 HG1 GLU 535 0.401 -3.427 -0.755
211 H ARG 536 HN ARG 536 0.866 -1.156 0.071
212 HA ARG 536 HA ARG 536 3.198 -1.354 -1.527
213 HB2 ARG 536 HB2 ARG 536 1.226 -0.556 -2.565
214 HB3 ARG 536 HB1 ARG 536 1.004 0.697 -1.357
215 HG2 ARG 536 HG2 ARG 536 3.504 0.824 -2.919
216 HG3 ARG 536 HG1 ARG 536 2.010 1.140 -3.804
217 HD2 ARG 536 HD2 ARG 536 2.722 2.502 -1.218
218 HD3 ARG 536 HD1 ARG 536 3.145 3.164 -2.799
219 HE ARG 536 HE ARG 536 0.401 2.617 -2.805
220 HH11 ARG 536 HH11 ARG 536 2.667 4.734 -1.159
221 HH12 ARG 536 HH12 ARG 536 1.499 5.997 -0.900
222 HH21 ARG 536 HH21 ARG 536 -1.131 4.300 -2.492
223 HH22 ARG 536 HH22 ARG 536 -0.655 5.759 -1.670
224 H VAL 537 HN VAL 537 2.214 1.001 0.973
225 HA VAL 537 HA VAL 537 4.568 2.556 0.810
226 HB VAL 537 HB VAL 537 4.045 3.414 3.034
227 HG11 VAL 537 HG11 VAL 537 1.781 4.255 2.581
228 HG12 VAL 537 HG12 VAL 537 1.608 3.040 1.312
229 HG13 VAL 537 HG13 VAL 537 2.817 4.314 1.153
230 HG21 VAL 537 HG21 VAL 537 2.330 2.567 4.428
231 HG22 VAL 537 HG22 VAL 537 3.323 1.176 3.968
232 HG23 VAL 537 HG23 VAL 537 1.767 1.456 3.180
233 H THR 538 HN THR 538 3.744 -0.288 2.700
234 HA THR 538 HA THR 538 6.143 -0.526 4.140
235 HB THR 538 HB THR 538 4.240 -2.678 3.206
236 HG1 THR 538 HG1 THR 538 3.046 -1.439 4.507
237 HG21 THR 538 HG21 THR 538 6.344 -3.640 3.897
238 HG22 THR 538 HG22 THR 538 5.120 -3.965 5.121
239 HG23 THR 538 HG23 THR 538 6.321 -2.702 5.389
240 H LEU 539 HN LEU 539 5.192 -1.634 0.920
241 HA LEU 539 HA LEU 539 7.510 -3.130 0.356
242 HB2 LEU 539 HB2 LEU 539 5.505 -3.435 -0.922
243 HB3 LEU 539 HB1 LEU 539 5.460 -1.747 -1.372
244 HG LEU 539 HG LEU 539 6.126 -3.446 -3.152
245 HD11 LEU 539 HD11 LEU 539 8.229 -1.360 -2.889
246 HD12 LEU 539 HD12 LEU 539 6.538 -0.874 -3.005
247 HD13 LEU 539 HD13 LEU 539 7.270 -1.836 -4.297
248 HD21 LEU 539 HD21 LEU 539 7.687 -4.740 -1.781
249 HD22 LEU 539 HD22 LEU 539 8.740 -3.333 -1.656
250 HD23 LEU 539 HD23 LEU 539 8.467 -4.093 -3.224
251 H GLN 540 HN GLN 540 6.603 0.242 -0.265
252 HA GLN 540 HA GLN 540 9.027 1.029 -1.471
253 HB2 GLN 540 HB2 GLN 540 7.058 2.669 0.132
254 HB3 GLN 540 HB1 GLN 540 8.347 3.327 -0.864
255 HG2 GLN 540 HG2 GLN 540 6.226 1.535 -1.985
256 HG3 GLN 540 HG1 GLN 540 6.009 3.277 -1.852
257 HE21 GLN 540 HE21 GLN 540 9.120 1.834 -2.592
258 HE22 GLN 540 HE22 GLN 540 9.192 2.382 -4.231
259 H ASN 541 HN ASN 541 8.017 0.772 1.871
260 HA ASN 541 HA ASN 541 10.264 1.962 3.097
261 HB2 ASN 541 HB2 ASN 541 8.182 1.402 4.307
262 HB3 ASN 541 HB1 ASN 541 8.520 -0.310 4.091
263 HD21 ASN 541 HD21 ASN 541 9.327 2.571 5.823
264 HD22 ASN 541 HD22 ASN 541 10.332 1.810 7.014
265 H GLN 542 HN GLN 542 9.586 -1.390 2.150
266 HA GLN 542 HA GLN 542 12.096 -2.428 2.954
267 HB2 GLN 542 HB2 GLN 542 10.172 -3.442 0.853
268 HB3 GLN 542 HB1 GLN 542 11.519 -4.356 1.520
269 HG2 GLN 542 HG2 GLN 542 10.473 -4.159 3.757
270 HG3 GLN 542 HG1 GLN 542 9.086 -3.379 2.994
271 HE21 GLN 542 HE21 GLN 542 7.662 -4.597 1.790
272 HE22 GLN 542 HE22 GLN 542 7.675 -6.327 1.802
273 H LEU 543 HN LEU 543 10.884 -1.058 -0.050
274 HA LEU 543 HA LEU 543 13.196 -1.571 -1.603
275 HB2 LEU 543 HB2 LEU 543 10.912 -0.977 -2.475
276 HB3 LEU 543 HB1 LEU 543 11.216 0.675 -1.978
277 HG LEU 543 HG LEU 543 13.163 -0.637 -3.822
278 HD11 LEU 543 HD11 LEU 543 10.517 0.543 -4.679
279 HD12 LEU 543 HD12 LEU 543 10.965 -1.159 -4.775
280 HD13 LEU 543 HD13 LEU 543 11.822 0.033 -5.752
281 HD21 LEU 543 HD21 LEU 543 13.285 1.673 -4.714
282 HD22 LEU 543 HD22 LEU 543 13.695 1.569 -3.003
283 HD23 LEU 543 HD23 LEU 543 12.114 2.176 -3.494
284 H GLN 544 HN GLN 544 12.265 1.047 0.545
285 HA GLN 544 HA GLN 544 14.361 2.821 0.001
286 HB2 GLN 544 HB2 GLN 544 12.542 3.565 1.353
287 HB3 GLN 544 HB1 GLN 544 12.770 2.256 2.503
288 HG2 GLN 544 HG2 GLN 544 14.856 3.221 3.225
289 HG3 GLN 544 HG1 GLN 544 14.696 4.519 2.044
290 HE21 GLN 544 HE21 GLN 544 14.727 6.097 3.627
291 HE22 GLN 544 HE22 GLN 544 13.396 6.367 4.706
292 H GLN 545 HN GLN 545 14.105 0.135 2.291
293 HA GLN 545 HA GLN 545 16.750 0.242 3.258
294 HB2 GLN 545 HB2 GLN 545 14.792 -2.047 3.022
295 HB3 GLN 545 HB1 GLN 545 16.339 -2.173 3.848
296 HG2 GLN 545 HG2 GLN 545 15.692 -0.661 5.521
297 HG3 GLN 545 HG1 GLN 545 14.297 -0.111 4.595
298 HE21 GLN 545 HE21 GLN 545 12.438 -1.310 4.593
299 HE22 GLN 545 HE22 GLN 545 12.168 -2.629 5.677
300 H PHE 546 HN PHE 546 15.277 -1.339 0.483
301 HA PHE 546 HA PHE 546 17.497 -2.845 -0.348
302 HB2 PHE 546 HB2 PHE 546 15.619 -3.570 -1.419
303 HB3 PHE 546 HB1 PHE 546 14.918 -1.953 -1.512
304 HD1 PHE 546 HD1 PHE 546 17.466 -4.179 -3.068
305 HD2 PHE 546 HD2 PHE 546 14.982 -0.745 -3.487
306 HE1 PHE 546 HE1 PHE 546 18.030 -4.061 -5.460
307 HE2 PHE 546 HE2 PHE 546 15.545 -0.621 -5.872
308 HZ PHE 546 HZ PHE 546 17.072 -2.278 -6.865
309 H LEU 547 HN LEU 547 16.375 0.382 -1.419
310 HA LEU 547 HA LEU 547 18.483 0.729 -3.249
311 HB2 LEU 547 HB2 LEU 547 17.744 2.972 -3.502
312 HB3 LEU 547 HB1 LEU 547 16.330 1.966 -3.287
313 HG LEU 547 HG LEU 547 16.596 2.759 -0.760
314 HD11 LEU 547 HD11 LEU 547 17.771 5.038 -2.351
315 HD12 LEU 547 HD12 LEU 547 18.635 4.047 -1.175
316 HD13 LEU 547 HD13 LEU 547 17.309 5.086 -0.647
317 HD21 LEU 547 HD21 LEU 547 15.375 4.405 -2.976
318 HD22 LEU 547 HD22 LEU 547 14.981 4.536 -1.261
319 HD23 LEU 547 HD23 LEU 547 14.612 3.051 -2.137
320 H GLU 548 HN GLU 548 18.104 1.708 0.120
321 HA GLU 548 HA GLU 548 20.519 3.118 0.327
322 HB2 GLU 548 HB2 GLU 548 18.804 1.718 2.355
323 HB3 GLU 548 HB1 GLU 548 20.324 2.475 2.815
324 HG2 GLU 548 HG2 GLU 548 19.495 4.612 1.896
325 HG3 GLU 548 HG1 GLU 548 17.949 3.835 1.558
326 H ALA 549 HN ALA 549 19.777 -0.317 0.731
327 HA ALA 549 HA ALA 549 22.329 -1.171 1.538
328 HB1 ALA 549 HB1 ALA 549 21.684 -3.368 0.660
329 HB2 ALA 549 HB2 ALA 549 20.308 -2.635 -0.167
330 HB3 ALA 549 HB3 ALA 549 20.379 -2.641 1.596
331 H GLN 550 HN GLN 550 20.925 -0.735 -1.694
332 HA GLN 550 HA GLN 550 23.179 -1.516 -3.176
333 HB2 GLN 550 HB2 GLN 550 21.121 0.559 -3.958
334 HB3 GLN 550 HB1 GLN 550 22.190 -0.311 -5.048
335 HG2 GLN 550 HG2 GLN 550 19.923 -1.442 -3.432
336 HG3 GLN 550 HG1 GLN 550 20.010 -1.266 -5.183
337 HE21 GLN 550 HE21 GLN 550 22.797 -2.133 -5.299
338 HE22 GLN 550 HE22 GLN 550 22.788 -3.841 -5.043
339 H LYS 551 HN LYS 551 22.208 1.601 -1.849
340 HA LYS 551 HA LYS 551 24.268 3.172 -2.912
341 HB2 LYS 551 HB2 LYS 551 22.864 3.423 -0.250
342 HB3 LYS 551 HB1 LYS 551 23.889 4.659 -0.956
343 HG2 LYS 551 HG2 LYS 551 21.313 3.631 -2.123
344 HG3 LYS 551 HG1 LYS 551 21.528 5.157 -1.263
345 HD2 LYS 551 HD2 LYS 551 23.203 5.806 -3.009
346 HD3 LYS 551 HD1 LYS 551 22.752 4.351 -3.901
347 HE2 LYS 551 HE2 LYS 551 21.531 6.196 -4.815
348 HE3 LYS 551 HE1 LYS 551 20.401 5.177 -3.924
349 HZ1 LYS 551 HZ1 LYS 551 20.586 6.722 -2.054
350 HZ2 LYS 551 HZ2 LYS 551 20.009 7.496 -3.443
351 HZ3 LYS 551 HZ3 LYS 551 21.621 7.711 -2.960
352 H SER 552 HN SER 552 24.099 1.569 0.260
353 HA SER 552 HA SER 552 26.630 2.353 1.125
354 HB2 SER 552 HB2 SER 552 25.169 -0.177 1.901
355 HB3 SER 552 HB1 SER 552 26.378 0.686 2.855
356 HG SER 552 HG SER 552 23.786 1.031 2.905
357 H GLU 553 HN GLU 553 25.632 -0.634 -0.539
358 HA GLU 553 HA GLU 553 28.244 -1.778 -0.420
359 HB2 GLU 553 HB2 GLU 553 25.846 -2.484 -2.113
360 HB3 GLU 553 HB1 GLU 553 27.314 -3.448 -2.014
361 HG2 GLU 553 HG2 GLU 553 25.544 -2.777 0.317
362 HG3 GLU 553 HG1 GLU 553 25.489 -4.290 -0.585
363 H GLY 554 HN GLY 554 26.439 0.050 -2.834
364 HA2 GLY 554 HA2 GLY 554 28.363 -0.298 -4.915
365 HA3 GLY 554 HA1 GLY 554 27.049 0.869 -4.897
366 H LYS 555 HN LYS 555 27.833 2.154 -2.437
367 HA LYS 555 HA LYS 555 29.826 3.930 -3.515
368 HB2 LYS 555 HB2 LYS 555 29.284 5.383 -1.772
369 HB3 LYS 555 HB1 LYS 555 27.781 4.530 -2.070
370 HG2 LYS 555 HG2 LYS 555 28.199 3.077 -0.160
371 HG3 LYS 555 HG1 LYS 555 29.717 3.927 0.149
372 HD2 LYS 555 HD2 LYS 555 28.453 6.022 0.449
373 HD3 LYS 555 HD1 LYS 555 26.949 5.136 0.195
374 HE2 LYS 555 HE2 LYS 555 27.422 5.522 2.580
375 HE3 LYS 555 HE1 LYS 555 27.356 3.808 2.175
376 HZ1 LYS 555 HZ1 LYS 555 29.674 3.623 2.314
377 HZ2 LYS 555 HZ2 LYS 555 29.235 4.545 3.666
378 HZ3 LYS 555 HZ3 LYS 555 29.911 5.302 2.304
379 H SER 556 HN SER 556 29.961 1.073 -1.794
380 HA SER 556 HA SER 556 32.292 1.660 -0.215
381 HB2 SER 556 HB2 SER 556 30.612 -0.084 0.422
382 HB3 SER 556 HB1 SER 556 31.140 -1.038 -0.963
383 HG SER 556 HG SER 556 32.958 -1.535 0.037
384 H LEU 557 HN LEU 557 33.647 2.533 -1.831
385 HA LEU 557 HA LEU 557 35.386 0.611 -3.015
386 HB2 LEU 557 HB2 LEU 557 33.388 0.867 -4.637
387 HB3 LEU 557 HB1 LEU 557 34.028 2.463 -4.967
388 HG LEU 557 HG LEU 557 34.651 0.701 -6.635
389 HD11 LEU 557 HD11 LEU 557 36.957 1.991 -5.184
390 HD12 LEU 557 HD12 LEU 557 35.964 2.746 -6.432
391 HD13 LEU 557 HD13 LEU 557 36.985 1.365 -6.834
392 HD21 LEU 557 HD21 LEU 557 36.336 -0.344 -4.366
393 HD22 LEU 557 HD22 LEU 557 36.402 -0.891 -6.043
394 HD23 LEU 557 HD23 LEU 557 34.943 -1.153 -5.085
Start of MODEL 11
1 H1 GLY 510 HT1 GLY 510 -37.518 2.184 9.642
2 H2 GLY 510 HT2 GLY 510 -37.455 1.001 10.856
3 H3 GLY 510 HT3 GLY 510 -36.601 0.772 9.412
4 HA2 GLY 510 HA1 GLY 510 -36.053 2.891 11.423
5 HA3 GLY 510 HA2 GLY 510 -35.113 1.422 11.214
6 H SER 511 HN SER 511 -33.401 3.172 10.973
7 HA SER 511 HA SER 511 -33.329 4.092 8.174
8 HB2 SER 511 HB2 SER 511 -32.052 5.432 10.568
9 HB3 SER 511 HB1 SER 511 -32.072 6.038 8.912
10 HG SER 511 HG SER 511 -33.928 6.910 9.354
11 H VAL 512 HN VAL 512 -31.232 3.242 10.939
12 HA VAL 512 HA VAL 512 -28.848 3.039 9.407
13 HB VAL 512 HB VAL 512 -29.335 1.633 12.025
14 HG11 VAL 512 HG11 VAL 512 -26.808 2.960 11.124
15 HG12 VAL 512 HG12 VAL 512 -27.221 1.341 10.573
16 HG13 VAL 512 HG13 VAL 512 -27.028 1.659 12.298
17 HG21 VAL 512 HG21 VAL 512 -30.098 3.936 12.251
18 HG22 VAL 512 HG22 VAL 512 -28.569 4.517 11.591
19 HG23 VAL 512 HG23 VAL 512 -28.599 3.678 13.142
20 H GLU 513 HN GLU 513 -31.442 0.839 9.985
21 HA GLU 513 HA GLU 513 -30.259 -1.606 9.373
22 HB2 GLU 513 HB2 GLU 513 -32.556 -2.230 8.531
23 HB3 GLU 513 HB1 GLU 513 -32.486 -1.594 10.168
24 HG2 GLU 513 HG2 GLU 513 -33.127 0.642 9.228
25 HG3 GLU 513 HG1 GLU 513 -33.408 -0.168 7.687
26 H THR 514 HN THR 514 -31.118 1.062 7.323
27 HA THR 514 HA THR 514 -30.053 -0.413 4.998
28 HB THR 514 HB THR 514 -31.266 1.296 3.615
29 HG1 THR 514 HG1 THR 514 -31.618 2.457 5.959
30 HG21 THR 514 HG21 THR 514 -33.469 0.266 3.898
31 HG22 THR 514 HG22 THR 514 -32.962 -0.397 5.449
32 HG23 THR 514 HG23 THR 514 -32.185 -0.936 3.960
33 H CYS 515 HN CYS 515 -29.069 1.226 3.360
34 HA CYS 515 HA CYS 515 -27.597 2.845 2.788
35 HB2 CYS 515 HB2 CYS 515 -28.104 4.094 5.490
36 HB3 CYS 515 HB1 CYS 515 -27.343 4.864 4.099
37 HG CYS 515 HG CYS 515 -29.584 6.024 3.582
38 H MET 516 HN MET 516 -27.211 1.636 6.101
39 HA MET 516 HA MET 516 -24.420 1.904 6.252
40 HB2 MET 516 HB2 MET 516 -25.750 1.339 8.214
41 HB3 MET 516 HB1 MET 516 -26.237 -0.182 7.478
42 HG2 MET 516 HG2 MET 516 -23.923 -0.951 7.533
43 HG3 MET 516 HG1 MET 516 -23.433 0.572 8.269
44 HE1 MET 516 HE1 MET 516 -23.066 -2.101 11.139
45 HE2 MET 516 HE2 MET 516 -22.227 -0.892 10.166
46 HE3 MET 516 HE3 MET 516 -22.818 -2.376 9.414
47 H SER 517 HN SER 517 -26.500 -0.454 4.733
48 HA SER 517 HA SER 517 -24.578 -2.416 4.153
49 HB2 SER 517 HB2 SER 517 -27.159 -2.522 4.005
50 HB3 SER 517 HB1 SER 517 -26.960 -1.794 2.412
51 HG SER 517 HG SER 517 -25.730 -4.216 3.261
52 H LEU 518 HN LEU 518 -25.816 0.282 2.131
53 HA LEU 518 HA LEU 518 -24.023 -0.237 0.016
54 HB2 LEU 518 HB2 LEU 518 -24.569 2.123 -0.709
55 HB3 LEU 518 HB1 LEU 518 -25.886 0.976 -0.651
56 HG LEU 518 HG LEU 518 -26.306 2.068 1.714
57 HD11 LEU 518 HD11 LEU 518 -24.597 4.077 0.294
58 HD12 LEU 518 HD12 LEU 518 -24.532 3.545 1.981
59 HD13 LEU 518 HD13 LEU 518 -25.848 4.580 1.428
60 HD21 LEU 518 HD21 LEU 518 -27.838 3.647 0.650
61 HD22 LEU 518 HD22 LEU 518 -27.874 2.072 -0.144
62 HD23 LEU 518 HD23 LEU 518 -27.008 3.415 -0.888
63 H ALA 519 HN ALA 519 -23.868 1.839 2.816
64 HA ALA 519 HA ALA 519 -21.438 3.120 2.244
65 HB1 ALA 519 HB1 ALA 519 -21.284 3.360 4.752
66 HB2 ALA 519 HB2 ALA 519 -22.778 2.425 4.839
67 HB3 ALA 519 HB3 ALA 519 -22.758 3.976 4.005
68 H SER 520 HN SER 520 -22.157 -0.005 3.734
69 HA SER 520 HA SER 520 -19.543 -0.677 4.520
70 HB2 SER 520 HB2 SER 520 -21.674 -1.862 5.180
71 HB3 SER 520 HB1 SER 520 -21.673 -2.615 3.592
72 HG SER 520 HG SER 520 -19.971 -3.818 4.124
73 H GLN 521 HN GLN 521 -21.285 -1.029 1.489
74 HA GLN 521 HA GLN 521 -19.377 -2.533 0.073
75 HB2 GLN 521 HB2 GLN 521 -21.214 -0.391 -1.007
76 HB3 GLN 521 HB1 GLN 521 -20.400 -1.625 -1.952
77 HG2 GLN 521 HG2 GLN 521 -21.684 -3.351 -0.878
78 HG3 GLN 521 HG1 GLN 521 -22.439 -2.171 0.189
79 HE21 GLN 521 HE21 GLN 521 -21.792 -1.597 -3.197
80 HE22 GLN 521 HE22 GLN 521 -23.449 -1.546 -3.700
81 H VAL 522 HN VAL 522 -19.791 0.971 0.407
82 HA VAL 522 HA VAL 522 -17.530 1.744 -1.099
83 HB VAL 522 HB VAL 522 -18.797 3.227 1.218
84 HG11 VAL 522 HG11 VAL 522 -17.132 4.234 -1.092
85 HG12 VAL 522 HG12 VAL 522 -16.597 4.096 0.582
86 HG13 VAL 522 HG13 VAL 522 -17.879 5.230 0.158
87 HG21 VAL 522 HG21 VAL 522 -20.462 2.671 -0.455
88 HG22 VAL 522 HG22 VAL 522 -19.429 3.317 -1.729
89 HG23 VAL 522 HG23 VAL 522 -20.102 4.397 -0.508
90 H VAL 523 HN VAL 523 -17.996 1.011 2.323
91 HA VAL 523 HA VAL 523 -15.447 1.696 3.243
92 HB VAL 523 HB VAL 523 -17.646 -0.078 4.243
93 HG11 VAL 523 HG11 VAL 523 -14.913 0.133 5.494
94 HG12 VAL 523 HG12 VAL 523 -15.680 -1.311 4.832
95 HG13 VAL 523 HG13 VAL 523 -16.341 -0.550 6.277
96 HG21 VAL 523 HG21 VAL 523 -17.626 1.509 6.103
97 HG22 VAL 523 HG22 VAL 523 -17.810 2.330 4.554
98 HG23 VAL 523 HG23 VAL 523 -16.251 2.342 5.378
99 H LYS 524 HN LYS 524 -16.706 -1.357 1.920
100 HA LYS 524 HA LYS 524 -14.300 -2.813 2.255
101 HB2 LYS 524 HB2 LYS 524 -16.823 -3.178 0.807
102 HB3 LYS 524 HB1 LYS 524 -15.442 -3.965 0.051
103 HG2 LYS 524 HG2 LYS 524 -16.491 -5.528 1.505
104 HG3 LYS 524 HG1 LYS 524 -14.965 -5.043 2.247
105 HD2 LYS 524 HD2 LYS 524 -16.304 -3.341 3.554
106 HD3 LYS 524 HD1 LYS 524 -17.749 -4.175 2.982
107 HE2 LYS 524 HE2 LYS 524 -15.514 -5.353 4.628
108 HE3 LYS 524 HE1 LYS 524 -17.148 -4.988 5.179
109 HZ1 LYS 524 HZ1 LYS 524 -16.869 -7.339 4.701
110 HZ2 LYS 524 HZ2 LYS 524 -16.433 -6.991 3.102
111 HZ3 LYS 524 HZ3 LYS 524 -18.002 -6.650 3.646
112 H LEU 525 HN LEU 525 -15.466 -0.680 -0.290
113 HA LEU 525 HA LEU 525 -13.398 -1.219 -2.143
114 HB2 LEU 525 HB2 LEU 525 -15.433 0.894 -1.785
115 HB3 LEU 525 HB1 LEU 525 -14.021 1.343 -2.720
116 HG LEU 525 HG LEU 525 -14.459 -0.333 -4.359
117 HD11 LEU 525 HD11 LEU 525 -16.673 -1.690 -3.990
118 HD12 LEU 525 HD12 LEU 525 -16.285 -1.418 -2.285
119 HD13 LEU 525 HD13 LEU 525 -15.138 -2.251 -3.333
120 HD21 LEU 525 HD21 LEU 525 -17.040 1.016 -3.576
121 HD22 LEU 525 HD22 LEU 525 -16.686 0.311 -5.153
122 HD23 LEU 525 HD23 LEU 525 -15.766 1.703 -4.584
123 H THR 526 HN THR 526 -13.766 1.327 0.315
124 HA THR 526 HA THR 526 -11.222 2.477 -0.155
125 HB THR 526 HB THR 526 -13.083 3.665 1.030
126 HG1 THR 526 HG1 THR 526 -11.378 4.830 1.501
127 HG21 THR 526 HG21 THR 526 -12.276 1.918 3.352
128 HG22 THR 526 HG22 THR 526 -13.839 1.925 2.533
129 HG23 THR 526 HG23 THR 526 -13.322 3.335 3.458
130 H LYS 527 HN LYS 527 -12.344 -0.146 1.895
131 HA LYS 527 HA LYS 527 -10.011 -0.481 3.437
132 HB2 LYS 527 HB2 LYS 527 -12.122 -1.568 4.015
133 HB3 LYS 527 HB1 LYS 527 -12.048 -2.535 2.550
134 HG2 LYS 527 HG2 LYS 527 -11.392 -3.886 4.412
135 HG3 LYS 527 HG1 LYS 527 -9.976 -3.587 3.403
136 HD2 LYS 527 HD2 LYS 527 -9.358 -3.343 5.718
137 HD3 LYS 527 HD1 LYS 527 -9.321 -1.759 4.945
138 HE2 LYS 527 HE2 LYS 527 -11.516 -1.247 5.876
139 HE3 LYS 527 HE1 LYS 527 -11.574 -2.839 6.632
140 HZ1 LYS 527 HZ1 LYS 527 -9.685 -0.633 7.253
141 HZ2 LYS 527 HZ2 LYS 527 -9.545 -2.200 7.883
142 HZ3 LYS 527 HZ3 LYS 527 -10.902 -1.258 8.257
143 H GLN 528 HN GLN 528 -11.032 -1.977 0.379
144 HA GLN 528 HA GLN 528 -8.794 -3.627 0.035
145 HB2 GLN 528 HB2 GLN 528 -10.876 -3.876 -1.243
146 HB3 GLN 528 HB1 GLN 528 -10.576 -2.348 -2.052
147 HG2 GLN 528 HG2 GLN 528 -8.565 -4.541 -2.256
148 HG3 GLN 528 HG1 GLN 528 -10.033 -4.602 -3.231
149 HE21 GLN 528 HE21 GLN 528 -7.208 -4.284 -4.002
150 HE22 GLN 528 HE22 GLN 528 -7.151 -2.827 -4.938
151 H LEU 529 HN LEU 529 -9.441 -0.324 -1.069
152 HA LEU 529 HA LEU 529 -6.988 0.105 -2.385
153 HB2 LEU 529 HB2 LEU 529 -8.825 2.043 -0.986
154 HB3 LEU 529 HB1 LEU 529 -7.505 2.513 -2.033
155 HG LEU 529 HG LEU 529 -9.876 0.876 -2.920
156 HD11 LEU 529 HD11 LEU 529 -9.314 3.787 -3.439
157 HD12 LEU 529 HD12 LEU 529 -10.404 3.200 -2.181
158 HD13 LEU 529 HD13 LEU 529 -10.759 2.869 -3.878
159 HD21 LEU 529 HD21 LEU 529 -9.077 1.454 -5.174
160 HD22 LEU 529 HD22 LEU 529 -7.896 0.499 -4.279
161 HD23 LEU 529 HD23 LEU 529 -7.665 2.237 -4.460
162 H LYS 530 HN LYS 530 -8.040 0.797 0.919
163 HA LYS 530 HA LYS 530 -5.734 2.011 1.897
164 HB2 LYS 530 HB2 LYS 530 -8.089 0.679 3.025
165 HB3 LYS 530 HB1 LYS 530 -6.670 0.582 4.053
166 HG2 LYS 530 HG2 LYS 530 -7.660 3.178 2.921
167 HG3 LYS 530 HG1 LYS 530 -8.236 2.520 4.454
168 HD2 LYS 530 HD2 LYS 530 -5.817 2.392 5.165
169 HD3 LYS 530 HD1 LYS 530 -5.431 3.335 3.723
170 HE2 LYS 530 HE2 LYS 530 -6.792 5.161 4.486
171 HE3 LYS 530 HE1 LYS 530 -7.377 4.210 5.852
172 HZ1 LYS 530 HZ1 LYS 530 -5.013 4.103 6.608
173 HZ2 LYS 530 HZ2 LYS 530 -5.712 5.647 6.662
174 HZ3 LYS 530 HZ3 LYS 530 -4.633 5.250 5.412
175 H GLU 531 HN GLU 531 -6.616 -1.441 1.967
176 HA GLU 531 HA GLU 531 -4.259 -2.213 3.325
177 HB2 GLU 531 HB2 GLU 531 -6.124 -3.894 1.649
178 HB3 GLU 531 HB1 GLU 531 -4.903 -4.512 2.756
179 HG2 GLU 531 HG2 GLU 531 -6.137 -3.092 4.529
180 HG3 GLU 531 HG1 GLU 531 -7.465 -3.103 3.369
181 H GLN 532 HN GLN 532 -5.104 -2.015 -0.084
182 HA GLN 532 HA GLN 532 -2.709 -3.203 -1.022
183 HB2 GLN 532 HB2 GLN 532 -4.728 -2.943 -2.416
184 HB3 GLN 532 HB1 GLN 532 -4.469 -1.201 -2.436
185 HG2 GLN 532 HG2 GLN 532 -2.383 -1.479 -3.600
186 HG3 GLN 532 HG1 GLN 532 -2.514 -3.233 -3.482
187 HE21 GLN 532 HE21 GLN 532 -3.969 -4.321 -4.779
188 HE22 GLN 532 HE22 GLN 532 -4.676 -3.587 -6.180
189 H THR 533 HN THR 533 -3.582 0.049 -0.054
190 HA THR 533 HA THR 533 -1.203 1.287 -1.054
191 HB THR 533 HB THR 533 -3.032 2.297 1.138
192 HG1 THR 533 HG1 THR 533 -4.226 1.960 -0.774
193 HG21 THR 533 HG21 THR 533 -0.779 3.378 0.898
194 HG22 THR 533 HG22 THR 533 -2.143 4.464 0.633
195 HG23 THR 533 HG23 THR 533 -1.239 3.834 -0.743
196 H VAL 534 HN VAL 534 -2.191 0.065 2.162
197 HA VAL 534 HA VAL 534 0.116 0.966 3.496
198 HB VAL 534 HB VAL 534 -0.417 -0.638 5.287
199 HG11 VAL 534 HG11 VAL 534 -2.616 0.301 5.865
200 HG12 VAL 534 HG12 VAL 534 -2.773 0.904 4.215
201 HG13 VAL 534 HG13 VAL 534 -1.499 1.526 5.264
202 HG21 VAL 534 HG21 VAL 534 -2.358 -2.070 5.166
203 HG22 VAL 534 HG22 VAL 534 -1.239 -2.475 3.863
204 HG23 VAL 534 HG23 VAL 534 -2.687 -1.532 3.520
205 H GLU 535 HN GLU 535 -0.539 -2.107 1.824
206 HA GLU 535 HA GLU 535 2.000 -3.218 2.485
207 HB2 GLU 535 HB2 GLU 535 1.529 -4.851 0.710
208 HB3 GLU 535 HB1 GLU 535 0.169 -4.665 1.805
209 HG2 GLU 535 HG2 GLU 535 -1.007 -3.328 0.206
210 HG3 GLU 535 HG1 GLU 535 0.394 -3.297 -0.858
211 H ARG 536 HN ARG 536 0.787 -1.218 -0.136
212 HA ARG 536 HA ARG 536 3.043 -1.468 -1.821
213 HB2 ARG 536 HB2 ARG 536 0.880 -0.711 -2.655
214 HB3 ARG 536 HB1 ARG 536 0.980 0.736 -1.665
215 HG2 ARG 536 HG2 ARG 536 3.266 0.352 -3.447
216 HG3 ARG 536 HG1 ARG 536 1.722 0.554 -4.279
217 HD2 ARG 536 HD2 ARG 536 2.594 2.391 -2.076
218 HD3 ARG 536 HD1 ARG 536 3.073 2.660 -3.754
219 HE ARG 536 HE ARG 536 0.437 2.449 -4.015
220 HH11 ARG 536 HH11 ARG 536 2.305 4.190 -1.633
221 HH12 ARG 536 HH12 ARG 536 1.135 5.462 -1.442
222 HH21 ARG 536 HH21 ARG 536 -1.093 4.141 -3.816
223 HH22 ARG 536 HH22 ARG 536 -0.769 5.456 -2.725
224 H VAL 537 HN VAL 537 2.170 0.969 0.630
225 HA VAL 537 HA VAL 537 4.517 2.517 0.290
226 HB VAL 537 HB VAL 537 4.066 3.503 2.473
227 HG11 VAL 537 HG11 VAL 537 1.810 4.354 2.034
228 HG12 VAL 537 HG12 VAL 537 1.568 3.055 0.864
229 HG13 VAL 537 HG13 VAL 537 2.791 4.292 0.566
230 HG21 VAL 537 HG21 VAL 537 2.352 2.757 3.950
231 HG22 VAL 537 HG22 VAL 537 3.359 1.350 3.578
232 HG23 VAL 537 HG23 VAL 537 1.794 1.553 2.790
233 H THR 538 HN THR 538 3.738 -0.236 2.323
234 HA THR 538 HA THR 538 6.155 -0.359 3.747
235 HB THR 538 HB THR 538 4.194 -2.530 3.019
236 HG1 THR 538 HG1 THR 538 3.136 -1.276 4.404
237 HG21 THR 538 HG21 THR 538 6.368 -3.506 3.568
238 HG22 THR 538 HG22 THR 538 5.188 -3.834 4.837
239 HG23 THR 538 HG23 THR 538 6.409 -2.581 5.070
240 H LEU 539 HN LEU 539 5.197 -1.718 0.607
241 HA LEU 539 HA LEU 539 7.538 -3.200 0.120
242 HB2 LEU 539 HB2 LEU 539 5.549 -3.569 -1.167
243 HB3 LEU 539 HB1 LEU 539 5.494 -1.900 -1.681
244 HG LEU 539 HG LEU 539 6.189 -3.651 -3.394
245 HD11 LEU 539 HD11 LEU 539 8.283 -1.553 -3.172
246 HD12 LEU 539 HD12 LEU 539 6.592 -1.070 -3.311
247 HD13 LEU 539 HD13 LEU 539 7.333 -2.063 -4.576
248 HD21 LEU 539 HD21 LEU 539 7.745 -4.898 -1.971
249 HD22 LEU 539 HD22 LEU 539 8.785 -3.477 -1.868
250 HD23 LEU 539 HD23 LEU 539 8.542 -4.281 -3.419
251 H GLN 540 HN GLN 540 6.630 0.140 -0.647
252 HA GLN 540 HA GLN 540 9.087 0.909 -1.797
253 HB2 GLN 540 HB2 GLN 540 7.013 2.551 -0.338
254 HB3 GLN 540 HB1 GLN 540 8.356 3.221 -1.253
255 HG2 GLN 540 HG2 GLN 540 6.275 1.414 -2.435
256 HG3 GLN 540 HG1 GLN 540 6.171 3.174 -2.461
257 HE21 GLN 540 HE21 GLN 540 6.329 1.319 -4.708
258 HE22 GLN 540 HE22 GLN 540 7.745 1.767 -5.601
259 H ASN 541 HN ASN 541 7.973 0.703 1.502
260 HA ASN 541 HA ASN 541 10.177 1.984 2.746
261 HB2 ASN 541 HB2 ASN 541 8.072 1.553 3.935
262 HB3 ASN 541 HB1 ASN 541 8.334 -0.180 3.798
263 HD21 ASN 541 HD21 ASN 541 9.761 -1.192 5.172
264 HD22 ASN 541 HD22 ASN 541 10.487 -0.395 6.530
265 H GLN 542 HN GLN 542 9.529 -1.377 1.839
266 HA GLN 542 HA GLN 542 11.986 -2.432 2.769
267 HB2 GLN 542 HB2 GLN 542 10.244 -3.390 0.493
268 HB3 GLN 542 HB1 GLN 542 11.541 -4.312 1.238
269 HG2 GLN 542 HG2 GLN 542 10.291 -4.199 3.386
270 HG3 GLN 542 HG1 GLN 542 8.961 -3.443 2.510
271 HE21 GLN 542 HE21 GLN 542 9.502 -5.078 0.118
272 HE22 GLN 542 HE22 GLN 542 8.891 -6.657 0.476
273 H LEU 543 HN LEU 543 10.967 -0.930 -0.245
274 HA LEU 543 HA LEU 543 13.386 -1.323 -1.654
275 HB2 LEU 543 HB2 LEU 543 11.211 -0.658 -2.676
276 HB3 LEU 543 HB1 LEU 543 11.410 0.935 -1.981
277 HG LEU 543 HG LEU 543 13.565 -0.108 -3.765
278 HD11 LEU 543 HD11 LEU 543 10.938 1.037 -4.713
279 HD12 LEU 543 HD12 LEU 543 11.523 -0.602 -4.995
280 HD13 LEU 543 HD13 LEU 543 12.362 0.770 -5.720
281 HD21 LEU 543 HD21 LEU 543 13.666 2.282 -4.389
282 HD22 LEU 543 HD22 LEU 543 13.912 2.013 -2.665
283 HD23 LEU 543 HD23 LEU 543 12.359 2.610 -3.252
284 H GLN 544 HN GLN 544 12.300 1.151 0.597
285 HA GLN 544 HA GLN 544 14.508 2.867 0.443
286 HB2 GLN 544 HB2 GLN 544 12.574 3.564 1.667
287 HB3 GLN 544 HB1 GLN 544 12.641 2.149 2.707
288 HG2 GLN 544 HG2 GLN 544 13.375 4.068 3.928
289 HG3 GLN 544 HG1 GLN 544 14.736 2.984 3.660
290 HE21 GLN 544 HE21 GLN 544 13.415 5.095 1.200
291 HE22 GLN 544 HE22 GLN 544 14.775 6.161 1.110
292 H GLN 545 HN GLN 545 13.895 0.009 2.449
293 HA GLN 545 HA GLN 545 16.399 -0.118 3.706
294 HB2 GLN 545 HB2 GLN 545 14.583 -2.407 2.915
295 HB3 GLN 545 HB1 GLN 545 15.872 -2.483 4.107
296 HG2 GLN 545 HG2 GLN 545 14.697 -0.940 5.534
297 HG3 GLN 545 HG1 GLN 545 13.440 -0.724 4.316
298 HE21 GLN 545 HE21 GLN 545 14.793 -2.853 6.700
299 HE22 GLN 545 HE22 GLN 545 13.455 -3.949 6.773
300 H PHE 546 HN PHE 546 15.263 -1.250 0.598
301 HA PHE 546 HA PHE 546 17.483 -2.812 -0.133
302 HB2 PHE 546 HB2 PHE 546 15.737 -3.286 -1.503
303 HB3 PHE 546 HB1 PHE 546 15.108 -1.640 -1.445
304 HD1 PHE 546 HD1 PHE 546 17.770 -3.729 -3.006
305 HD2 PHE 546 HD2 PHE 546 15.370 -0.222 -3.235
306 HE1 PHE 546 HE1 PHE 546 18.575 -3.330 -5.295
307 HE2 PHE 546 HE2 PHE 546 16.167 0.187 -5.520
308 HZ PHE 546 HZ PHE 546 17.775 -1.369 -6.558
309 H LEU 547 HN LEU 547 16.714 0.596 -0.943
310 HA LEU 547 HA LEU 547 19.120 1.024 -2.339
311 HB2 LEU 547 HB2 LEU 547 18.600 3.357 -2.282
312 HB3 LEU 547 HB1 LEU 547 17.131 2.449 -2.553
313 HG LEU 547 HG LEU 547 16.845 2.749 0.055
314 HD11 LEU 547 HD11 LEU 547 18.520 5.135 -0.721
315 HD12 LEU 547 HD12 LEU 547 19.007 3.849 0.383
316 HD13 LEU 547 HD13 LEU 547 17.667 4.916 0.806
317 HD21 LEU 547 HD21 LEU 547 16.327 4.945 -1.946
318 HD22 LEU 547 HD22 LEU 547 15.498 4.725 -0.403
319 HD23 LEU 547 HD23 LEU 547 15.310 3.528 -1.686
320 H GLU 548 HN GLU 548 18.254 1.436 1.039
321 HA GLU 548 HA GLU 548 20.715 2.508 1.877
322 HB2 GLU 548 HB2 GLU 548 18.650 0.922 3.394
323 HB3 GLU 548 HB1 GLU 548 20.072 1.627 4.153
324 HG2 GLU 548 HG2 GLU 548 19.256 3.838 3.117
325 HG3 GLU 548 HG1 GLU 548 17.719 2.999 2.919
326 H ALA 549 HN ALA 549 19.636 -0.816 1.419
327 HA ALA 549 HA ALA 549 21.896 -2.102 2.490
328 HB1 ALA 549 HB1 ALA 549 21.241 -4.022 1.132
329 HB2 ALA 549 HB2 ALA 549 20.131 -3.004 0.213
330 HB3 ALA 549 HB3 ALA 549 19.843 -3.299 1.929
331 H GLN 550 HN GLN 550 21.264 -0.708 -0.685
332 HA GLN 550 HA GLN 550 23.661 -1.517 -1.937
333 HB2 GLN 550 HB2 GLN 550 22.005 0.971 -2.402
334 HB3 GLN 550 HB1 GLN 550 23.235 0.355 -3.493
335 HG2 GLN 550 HG2 GLN 550 21.907 -1.715 -3.756
336 HG3 GLN 550 HG1 GLN 550 20.656 -0.991 -2.744
337 HE21 GLN 550 HE21 GLN 550 19.388 0.647 -3.564
338 HE22 GLN 550 HE22 GLN 550 19.356 1.062 -5.246
339 H LYS 551 HN LYS 551 22.796 1.362 -0.073
340 HA LYS 551 HA LYS 551 25.293 2.656 -0.087
341 HB2 LYS 551 HB2 LYS 551 23.184 2.580 2.072
342 HB3 LYS 551 HB1 LYS 551 24.521 3.719 2.016
343 HG2 LYS 551 HG2 LYS 551 22.460 3.488 -0.156
344 HG3 LYS 551 HG1 LYS 551 22.309 4.583 1.217
345 HD2 LYS 551 HD2 LYS 551 24.406 5.665 0.581
346 HD3 LYS 551 HD1 LYS 551 24.567 4.555 -0.780
347 HE2 LYS 551 HE2 LYS 551 22.548 5.434 -1.778
348 HE3 LYS 551 HE1 LYS 551 22.286 6.481 -0.384
349 HZ1 LYS 551 HZ1 LYS 551 24.642 6.631 -2.184
350 HZ2 LYS 551 HZ2 LYS 551 24.277 7.685 -0.907
351 HZ3 LYS 551 HZ3 LYS 551 23.285 7.646 -2.283
352 H SER 552 HN SER 552 23.970 0.142 1.964
353 HA SER 552 HA SER 552 26.073 -0.032 3.810
354 HB2 SER 552 HB2 SER 552 24.277 -2.273 2.852
355 HB3 SER 552 HB1 SER 552 25.185 -2.231 4.363
356 HG SER 552 HG SER 552 23.194 -0.330 3.649
357 H GLU 553 HN GLU 553 25.633 -1.502 0.631
358 HA GLU 553 HA GLU 553 27.997 -3.084 0.707
359 HB2 GLU 553 HB2 GLU 553 26.374 -2.017 -1.606
360 HB3 GLU 553 HB1 GLU 553 27.722 -3.132 -1.788
361 HG2 GLU 553 HG2 GLU 553 25.257 -3.696 -0.166
362 HG3 GLU 553 HG1 GLU 553 25.496 -4.214 -1.834
363 H GLY 554 HN GLY 554 27.243 0.174 -0.400
364 HA2 GLY 554 HA2 GLY 554 29.770 0.726 -1.567
365 HA3 GLY 554 HA1 GLY 554 28.581 1.918 -1.077
366 H LYS 555 HN LYS 555 28.424 1.490 1.628
367 HA LYS 555 HA LYS 555 30.771 2.836 2.538
368 HB2 LYS 555 HB2 LYS 555 29.689 2.961 4.652
369 HB3 LYS 555 HB1 LYS 555 28.428 3.120 3.440
370 HG2 LYS 555 HG2 LYS 555 27.852 0.756 3.739
371 HG3 LYS 555 HG1 LYS 555 29.093 0.623 4.983
372 HD2 LYS 555 HD2 LYS 555 26.638 2.374 5.070
373 HD3 LYS 555 HD1 LYS 555 26.914 0.902 6.003
374 HE2 LYS 555 HE2 LYS 555 28.872 1.998 7.061
375 HE3 LYS 555 HE1 LYS 555 28.458 3.485 6.207
376 HZ1 LYS 555 HZ1 LYS 555 26.849 2.085 8.269
377 HZ2 LYS 555 HZ2 LYS 555 26.251 3.361 7.323
378 HZ3 LYS 555 HZ3 LYS 555 27.554 3.624 8.379
379 H SER 556 HN SER 556 29.986 -0.459 2.215
380 HA SER 556 HA SER 556 31.400 -1.500 4.451
381 HB2 SER 556 HB2 SER 556 29.560 -2.661 3.159
382 HB3 SER 556 HB1 SER 556 30.739 -2.947 1.882
383 HG SER 556 HG SER 556 31.569 -4.511 3.015
384 H LEU 557 HN LEU 557 33.356 -2.742 4.389
385 HA LEU 557 HA LEU 557 35.269 -1.691 2.424
386 HB2 LEU 557 HB2 LEU 557 35.684 -2.825 5.193
387 HB3 LEU 557 HB1 LEU 557 36.994 -2.418 4.106
388 HG LEU 557 HG LEU 557 36.109 -0.035 4.133
389 HD11 LEU 557 HD11 LEU 557 33.870 -0.516 5.001
390 HD12 LEU 557 HD12 LEU 557 34.740 0.619 6.034
391 HD13 LEU 557 HD13 LEU 557 34.581 -1.070 6.518
392 HD21 LEU 557 HD21 LEU 557 37.184 0.461 6.272
393 HD22 LEU 557 HD22 LEU 557 38.100 -0.727 5.346
394 HD23 LEU 557 HD23 LEU 557 37.106 -1.246 6.706
Start of MODEL 12
1 H1 GLY 510 HT1 GLY 510 -35.717 -2.719 1.122
2 H2 GLY 510 HT2 GLY 510 -35.188 -3.871 -0.003
3 H3 GLY 510 HT3 GLY 510 -36.826 -3.796 0.425
4 HA2 GLY 510 HA1 GLY 510 -36.448 -2.815 -1.748
5 HA3 GLY 510 HA2 GLY 510 -37.048 -1.639 -0.587
6 H SER 511 HN SER 511 -36.156 0.244 -1.036
7 HA SER 511 HA SER 511 -33.818 0.625 -2.519
8 HB2 SER 511 HB2 SER 511 -34.064 3.025 -1.666
9 HB3 SER 511 HB1 SER 511 -35.435 2.346 -2.543
10 HG SER 511 HG SER 511 -35.640 3.465 -0.296
11 H VAL 512 HN VAL 512 -34.345 1.028 0.990
12 HA VAL 512 HA VAL 512 -31.748 1.936 1.581
13 HB VAL 512 HB VAL 512 -33.421 0.368 3.527
14 HG11 VAL 512 HG11 VAL 512 -31.756 2.811 4.029
15 HG12 VAL 512 HG12 VAL 512 -31.046 1.201 3.989
16 HG13 VAL 512 HG13 VAL 512 -32.295 1.583 5.179
17 HG21 VAL 512 HG21 VAL 512 -33.771 3.260 2.738
18 HG22 VAL 512 HG22 VAL 512 -34.563 2.467 4.100
19 HG23 VAL 512 HG23 VAL 512 -34.919 1.954 2.451
20 H GLU 513 HN GLU 513 -33.093 -1.293 1.320
21 HA GLU 513 HA GLU 513 -31.015 -2.752 2.480
22 HB2 GLU 513 HB2 GLU 513 -33.167 -3.719 1.958
23 HB3 GLU 513 HB1 GLU 513 -32.899 -3.479 0.237
24 HG2 GLU 513 HG2 GLU 513 -32.484 -5.749 0.653
25 HG3 GLU 513 HG1 GLU 513 -30.908 -4.985 0.463
26 H THR 514 HN THR 514 -31.540 -1.780 -0.910
27 HA THR 514 HA THR 514 -29.120 -2.985 -1.808
28 HB THR 514 HB THR 514 -29.577 -1.473 -3.869
29 HG1 THR 514 HG1 THR 514 -31.226 -0.181 -3.676
30 HG21 THR 514 HG21 THR 514 -29.987 -3.879 -3.817
31 HG22 THR 514 HG22 THR 514 -31.288 -3.049 -4.670
32 HG23 THR 514 HG23 THR 514 -31.536 -3.612 -3.017
33 H CYS 515 HN CYS 515 -30.032 0.262 -0.758
34 HA CYS 515 HA CYS 515 -27.620 1.532 -1.519
35 HB2 CYS 515 HB2 CYS 515 -29.440 2.246 0.789
36 HB3 CYS 515 HB1 CYS 515 -28.225 3.297 0.060
37 HG CYS 515 HG CYS 515 -31.028 2.135 -1.534
38 H MET 516 HN MET 516 -28.583 -0.235 1.386
39 HA MET 516 HA MET 516 -26.256 0.250 2.900
40 HB2 MET 516 HB2 MET 516 -28.340 -0.706 3.832
41 HB3 MET 516 HB1 MET 516 -28.055 -2.182 2.923
42 HG2 MET 516 HG2 MET 516 -26.034 -2.607 4.185
43 HG3 MET 516 HG1 MET 516 -26.241 -1.090 5.059
44 HE1 MET 516 HE1 MET 516 -25.799 -3.915 6.478
45 HE2 MET 516 HE2 MET 516 -26.980 -3.827 7.786
46 HE3 MET 516 HE3 MET 516 -26.010 -2.412 7.375
47 H SER 517 HN SER 517 -27.055 -2.213 0.487
48 HA SER 517 HA SER 517 -24.606 -3.638 0.688
49 HB2 SER 517 HB2 SER 517 -26.622 -4.619 -0.338
50 HB3 SER 517 HB1 SER 517 -26.539 -3.432 -1.638
51 HG SER 517 HG SER 517 -25.522 -5.132 -2.489
52 H LEU 518 HN LEU 518 -25.690 -0.870 -1.163
53 HA LEU 518 HA LEU 518 -23.466 -0.600 -2.851
54 HB2 LEU 518 HB2 LEU 518 -25.437 0.498 -3.474
55 HB3 LEU 518 HB1 LEU 518 -25.694 1.155 -1.880
56 HG LEU 518 HG LEU 518 -25.142 2.784 -3.730
57 HD11 LEU 518 HD11 LEU 518 -23.129 3.088 -1.566
58 HD12 LEU 518 HD12 LEU 518 -24.835 2.975 -1.121
59 HD13 LEU 518 HD13 LEU 518 -24.284 4.257 -2.216
60 HD21 LEU 518 HD21 LEU 518 -23.376 1.551 -4.830
61 HD22 LEU 518 HD22 LEU 518 -22.392 1.605 -3.369
62 HD23 LEU 518 HD23 LEU 518 -22.753 3.094 -4.243
63 H ALA 519 HN ALA 519 -24.265 0.762 0.320
64 HA ALA 519 HA ALA 519 -21.939 2.351 0.560
65 HB1 ALA 519 HB1 ALA 519 -22.768 1.682 3.145
66 HB2 ALA 519 HB2 ALA 519 -24.226 1.701 2.154
67 HB3 ALA 519 HB3 ALA 519 -23.187 3.123 2.216
68 H SER 520 HN SER 520 -22.714 -0.929 1.709
69 HA SER 520 HA SER 520 -20.239 -1.351 3.002
70 HB2 SER 520 HB2 SER 520 -20.820 -3.786 2.808
71 HB3 SER 520 HB1 SER 520 -22.089 -2.800 3.530
72 HG SER 520 HG SER 520 -23.352 -3.220 1.895
73 H GLN 521 HN GLN 521 -21.341 -1.807 -0.305
74 HA GLN 521 HA GLN 521 -19.083 -3.103 -1.335
75 HB2 GLN 521 HB2 GLN 521 -21.166 -2.838 -2.590
76 HB3 GLN 521 HB1 GLN 521 -20.905 -1.103 -2.683
77 HG2 GLN 521 HG2 GLN 521 -18.860 -1.509 -3.992
78 HG3 GLN 521 HG1 GLN 521 -19.205 -3.237 -3.938
79 HE21 GLN 521 HE21 GLN 521 -20.976 -4.044 -5.069
80 HE22 GLN 521 HE22 GLN 521 -21.722 -3.159 -6.354
81 H VAL 522 HN VAL 522 -19.842 0.363 -1.084
82 HA VAL 522 HA VAL 522 -17.414 1.363 -2.059
83 HB VAL 522 HB VAL 522 -19.236 2.538 0.060
84 HG11 VAL 522 HG11 VAL 522 -17.034 3.555 0.205
85 HG12 VAL 522 HG12 VAL 522 -18.185 4.695 -0.491
86 HG13 VAL 522 HG13 VAL 522 -17.035 3.858 -1.532
87 HG21 VAL 522 HG21 VAL 522 -20.356 2.186 -2.065
88 HG22 VAL 522 HG22 VAL 522 -19.060 3.031 -2.912
89 HG23 VAL 522 HG23 VAL 522 -20.098 3.909 -1.788
90 H VAL 523 HN VAL 523 -18.355 0.316 1.179
91 HA VAL 523 HA VAL 523 -15.997 0.982 2.526
92 HB VAL 523 HB VAL 523 -18.250 -0.920 2.993
93 HG11 VAL 523 HG11 VAL 523 -15.675 -0.943 4.551
94 HG12 VAL 523 HG12 VAL 523 -16.462 -2.284 3.713
95 HG13 VAL 523 HG13 VAL 523 -17.203 -1.592 5.154
96 HG21 VAL 523 HG21 VAL 523 -18.467 0.407 5.053
97 HG22 VAL 523 HG22 VAL 523 -18.506 1.406 3.601
98 HG23 VAL 523 HG23 VAL 523 -17.044 1.338 4.585
99 H LYS 524 HN LYS 524 -16.914 -1.950 0.721
100 HA LYS 524 HA LYS 524 -14.541 -3.410 1.147
101 HB2 LYS 524 HB2 LYS 524 -16.743 -3.468 -0.824
102 HB3 LYS 524 HB1 LYS 524 -15.243 -4.229 -1.333
103 HG2 LYS 524 HG2 LYS 524 -16.551 -5.936 -0.419
104 HG3 LYS 524 HG1 LYS 524 -15.374 -5.540 0.837
105 HD2 LYS 524 HD2 LYS 524 -17.025 -4.159 1.956
106 HD3 LYS 524 HD1 LYS 524 -18.198 -4.502 0.690
107 HE2 LYS 524 HE2 LYS 524 -16.929 -6.625 2.401
108 HE3 LYS 524 HE1 LYS 524 -18.472 -5.860 2.777
109 HZ1 LYS 524 HZ1 LYS 524 -18.704 -7.986 1.583
110 HZ2 LYS 524 HZ2 LYS 524 -17.881 -7.326 0.259
111 HZ3 LYS 524 HZ3 LYS 524 -19.381 -6.685 0.729
112 H LEU 525 HN LEU 525 -15.446 -1.111 -1.405
113 HA LEU 525 HA LEU 525 -13.097 -1.309 -2.925
114 HB2 LEU 525 HB2 LEU 525 -15.245 0.733 -2.630
115 HB3 LEU 525 HB1 LEU 525 -13.766 1.221 -3.432
116 HG LEU 525 HG LEU 525 -14.081 -0.584 -5.090
117 HD11 LEU 525 HD11 LEU 525 -16.834 -0.993 -3.985
118 HD12 LEU 525 HD12 LEU 525 -15.476 -1.970 -3.442
119 HD13 LEU 525 HD13 LEU 525 -15.943 -1.982 -5.145
120 HD21 LEU 525 HD21 LEU 525 -14.914 1.652 -5.564
121 HD22 LEU 525 HD22 LEU 525 -16.442 1.266 -4.770
122 HD23 LEU 525 HD23 LEU 525 -15.984 0.430 -6.253
123 H THR 526 HN THR 526 -13.941 0.759 -0.192
124 HA THR 526 HA THR 526 -11.531 2.248 -0.230
125 HB THR 526 HB THR 526 -13.935 2.013 1.471
126 HG1 THR 526 HG1 THR 526 -13.353 3.631 -0.252
127 HG21 THR 526 HG21 THR 526 -12.277 1.729 3.155
128 HG22 THR 526 HG22 THR 526 -12.943 3.360 3.278
129 HG23 THR 526 HG23 THR 526 -11.349 3.107 2.558
130 H LYS 527 HN LYS 527 -12.648 -0.660 1.417
131 HA LYS 527 HA LYS 527 -10.516 -0.995 3.208
132 HB2 LYS 527 HB2 LYS 527 -12.671 -2.310 3.146
133 HB3 LYS 527 HB1 LYS 527 -12.014 -3.202 1.783
134 HG2 LYS 527 HG2 LYS 527 -11.681 -4.526 3.717
135 HG3 LYS 527 HG1 LYS 527 -10.107 -3.877 3.252
136 HD2 LYS 527 HD2 LYS 527 -10.413 -3.729 5.665
137 HD3 LYS 527 HD1 LYS 527 -10.340 -2.119 4.948
138 HE2 LYS 527 HE2 LYS 527 -12.755 -1.939 5.035
139 HE3 LYS 527 HE1 LYS 527 -12.878 -3.581 5.669
140 HZ1 LYS 527 HZ1 LYS 527 -11.645 -1.243 7.021
141 HZ2 LYS 527 HZ2 LYS 527 -11.591 -2.825 7.619
142 HZ3 LYS 527 HZ3 LYS 527 -13.080 -2.027 7.461
143 H GLN 528 HN GLN 528 -11.000 -2.109 -0.115
144 HA GLN 528 HA GLN 528 -8.585 -3.488 -0.440
145 HB2 GLN 528 HB2 GLN 528 -10.492 -3.657 -1.993
146 HB3 GLN 528 HB1 GLN 528 -10.214 -2.002 -2.515
147 HG2 GLN 528 HG2 GLN 528 -7.913 -2.749 -3.226
148 HG3 GLN 528 HG1 GLN 528 -8.470 -4.398 -2.956
149 HE21 GLN 528 HE21 GLN 528 -10.524 -1.847 -4.152
150 HE22 GLN 528 HE22 GLN 528 -10.706 -2.474 -5.755
151 H LEU 529 HN LEU 529 -9.436 -0.099 -0.980
152 HA LEU 529 HA LEU 529 -7.047 0.743 -2.172
153 HB2 LEU 529 HB2 LEU 529 -8.953 2.251 -0.387
154 HB3 LEU 529 HB1 LEU 529 -7.701 2.996 -1.352
155 HG LEU 529 HG LEU 529 -10.021 1.430 -2.471
156 HD11 LEU 529 HD11 LEU 529 -9.594 4.408 -2.443
157 HD12 LEU 529 HD12 LEU 529 -10.631 3.539 -1.312
158 HD13 LEU 529 HD13 LEU 529 -11.005 3.529 -3.038
159 HD21 LEU 529 HD21 LEU 529 -7.938 3.151 -3.809
160 HD22 LEU 529 HD22 LEU 529 -9.325 2.407 -4.605
161 HD23 LEU 529 HD23 LEU 529 -8.062 1.394 -3.908
162 H LYS 530 HN LYS 530 -8.048 0.730 1.231
163 HA LYS 530 HA LYS 530 -5.689 1.815 2.286
164 HB2 LYS 530 HB2 LYS 530 -7.668 -0.092 3.539
165 HB3 LYS 530 HB1 LYS 530 -6.379 0.711 4.422
166 HG2 LYS 530 HG2 LYS 530 -7.362 2.892 3.740
167 HG3 LYS 530 HG1 LYS 530 -8.717 2.002 3.041
168 HD2 LYS 530 HD2 LYS 530 -9.242 1.052 5.215
169 HD3 LYS 530 HD1 LYS 530 -7.849 1.868 5.927
170 HE2 LYS 530 HE2 LYS 530 -10.286 3.166 4.721
171 HE3 LYS 530 HE1 LYS 530 -9.861 3.105 6.430
172 HZ1 LYS 530 HZ1 LYS 530 -9.248 5.227 5.636
173 HZ2 LYS 530 HZ2 LYS 530 -8.475 4.585 4.269
174 HZ3 LYS 530 HZ3 LYS 530 -7.798 4.359 5.806
175 H GLU 531 HN GLU 531 -6.651 -1.587 1.855
176 HA GLU 531 HA GLU 531 -4.320 -2.648 3.041
177 HB2 GLU 531 HB2 GLU 531 -6.160 -3.950 1.030
178 HB3 GLU 531 HB1 GLU 531 -5.002 -4.784 2.057
179 HG2 GLU 531 HG2 GLU 531 -6.259 -3.809 4.027
180 HG3 GLU 531 HG1 GLU 531 -7.506 -3.348 2.870
181 H GLN 532 HN GLN 532 -5.149 -1.899 -0.304
182 HA GLN 532 HA GLN 532 -2.793 -2.890 -1.488
183 HB2 GLN 532 HB2 GLN 532 -4.739 -2.314 -2.827
184 HB3 GLN 532 HB1 GLN 532 -4.604 -0.627 -2.353
185 HG2 GLN 532 HG2 GLN 532 -3.753 -0.820 -4.556
186 HG3 GLN 532 HG1 GLN 532 -2.381 -0.566 -3.481
187 HE21 GLN 532 HE21 GLN 532 -2.401 -1.699 -6.132
188 HE22 GLN 532 HE22 GLN 532 -1.766 -3.302 -5.998
189 H THR 533 HN THR 533 -3.591 0.244 -0.058
190 HA THR 533 HA THR 533 -1.178 1.515 -0.871
191 HB THR 533 HB THR 533 -3.016 2.304 1.398
192 HG1 THR 533 HG1 THR 533 -4.196 2.286 -0.515
193 HG21 THR 533 HG21 THR 533 -0.706 3.327 1.322
194 HG22 THR 533 HG22 THR 533 -2.048 4.471 1.238
195 HG23 THR 533 HG23 THR 533 -1.163 4.037 -0.226
196 H VAL 534 HN VAL 534 -2.212 -0.052 2.167
197 HA VAL 534 HA VAL 534 0.046 0.756 3.640
198 HB VAL 534 HB VAL 534 -0.545 -0.980 5.280
199 HG11 VAL 534 HG11 VAL 534 -2.711 -0.077 5.882
200 HG12 VAL 534 HG12 VAL 534 -2.935 0.535 4.244
201 HG13 VAL 534 HG13 VAL 534 -1.667 1.207 5.270
202 HG21 VAL 534 HG21 VAL 534 -2.454 -2.420 4.962
203 HG22 VAL 534 HG22 VAL 534 -1.279 -2.710 3.679
204 HG23 VAL 534 HG23 VAL 534 -2.725 -1.756 3.351
205 H GLU 535 HN GLU 535 -0.537 -2.210 1.726
206 HA GLU 535 HA GLU 535 1.986 -3.332 2.452
207 HB2 GLU 535 HB2 GLU 535 1.600 -4.934 0.643
208 HB3 GLU 535 HB1 GLU 535 0.185 -4.780 1.669
209 HG2 GLU 535 HG2 GLU 535 -1.039 -3.700 0.041
210 HG3 GLU 535 HG1 GLU 535 0.397 -3.179 -0.840
211 H ARG 536 HN ARG 536 0.840 -1.277 -0.152
212 HA ARG 536 HA ARG 536 3.137 -1.469 -1.780
213 HB2 ARG 536 HB2 ARG 536 1.072 -0.733 -2.735
214 HB3 ARG 536 HB1 ARG 536 0.966 0.610 -1.606
215 HG2 ARG 536 HG2 ARG 536 3.392 0.613 -3.238
216 HG3 ARG 536 HG1 ARG 536 1.891 0.767 -4.158
217 HD2 ARG 536 HD2 ARG 536 2.619 2.442 -1.765
218 HD3 ARG 536 HD1 ARG 536 2.855 2.948 -3.441
219 HE ARG 536 HE ARG 536 0.181 2.189 -3.135
220 HH11 ARG 536 HH11 ARG 536 2.351 4.703 -1.995
221 HH12 ARG 536 HH12 ARG 536 1.074 5.869 -1.772
222 HH21 ARG 536 HH21 ARG 536 -1.469 3.692 -2.854
223 HH22 ARG 536 HH22 ARG 536 -1.109 5.292 -2.276
224 H VAL 537 HN VAL 537 2.206 0.902 0.708
225 HA VAL 537 HA VAL 537 4.548 2.480 0.395
226 HB VAL 537 HB VAL 537 4.015 3.487 2.557
227 HG11 VAL 537 HG11 VAL 537 1.780 4.321 2.013
228 HG12 VAL 537 HG12 VAL 537 1.583 3.001 0.859
229 HG13 VAL 537 HG13 VAL 537 2.810 4.238 0.582
230 HG21 VAL 537 HG21 VAL 537 2.210 2.744 3.946
231 HG22 VAL 537 HG22 VAL 537 3.290 1.371 3.680
232 HG23 VAL 537 HG23 VAL 537 1.770 1.487 2.790
233 H THR 538 HN THR 538 3.732 -0.243 2.483
234 HA THR 538 HA THR 538 6.158 -0.317 3.909
235 HB THR 538 HB THR 538 4.175 -2.491 3.258
236 HG1 THR 538 HG1 THR 538 4.213 -0.489 5.015
237 HG21 THR 538 HG21 THR 538 6.373 -3.491 3.642
238 HG22 THR 538 HG22 THR 538 5.265 -3.856 4.962
239 HG23 THR 538 HG23 THR 538 6.511 -2.623 5.168
240 H LEU 539 HN LEU 539 5.205 -1.720 0.792
241 HA LEU 539 HA LEU 539 7.533 -3.229 0.347
242 HB2 LEU 539 HB2 LEU 539 5.543 -3.609 -0.936
243 HB3 LEU 539 HB1 LEU 539 5.509 -1.952 -1.489
244 HG LEU 539 HG LEU 539 6.185 -3.751 -3.157
245 HD11 LEU 539 HD11 LEU 539 8.303 -1.673 -2.996
246 HD12 LEU 539 HD12 LEU 539 6.618 -1.175 -3.141
247 HD13 LEU 539 HD13 LEU 539 7.344 -2.210 -4.380
248 HD21 LEU 539 HD21 LEU 539 7.715 -4.984 -1.699
249 HD22 LEU 539 HD22 LEU 539 8.781 -3.577 -1.635
250 HD23 LEU 539 HD23 LEU 539 8.523 -4.421 -3.163
251 H GLN 540 HN GLN 540 6.661 0.102 -0.496
252 HA GLN 540 HA GLN 540 9.117 0.805 -1.706
253 HB2 GLN 540 HB2 GLN 540 7.084 2.516 -0.263
254 HB3 GLN 540 HB1 GLN 540 8.405 3.137 -1.237
255 HG2 GLN 540 HG2 GLN 540 6.300 1.293 -2.308
256 HG3 GLN 540 HG1 GLN 540 6.158 3.050 -2.348
257 HE21 GLN 540 HE21 GLN 540 6.123 3.134 -4.558
258 HE22 GLN 540 HE22 GLN 540 7.523 2.839 -5.538
259 H ASN 541 HN ASN 541 8.011 0.835 1.634
260 HA ASN 541 HA ASN 541 10.257 2.088 2.800
261 HB2 ASN 541 HB2 ASN 541 8.054 1.615 3.924
262 HB3 ASN 541 HB1 ASN 541 8.518 -0.077 4.016
263 HD21 ASN 541 HD21 ASN 541 7.933 1.996 6.059
264 HD22 ASN 541 HD22 ASN 541 9.293 1.962 7.128
265 H GLN 542 HN GLN 542 9.507 -1.318 2.165
266 HA GLN 542 HA GLN 542 11.917 -2.449 3.047
267 HB2 GLN 542 HB2 GLN 542 10.086 -3.312 0.793
268 HB3 GLN 542 HB1 GLN 542 11.377 -4.301 1.461
269 HG2 GLN 542 HG2 GLN 542 9.062 -3.260 3.072
270 HG3 GLN 542 HG1 GLN 542 9.085 -4.836 2.283
271 HE21 GLN 542 HE21 GLN 542 10.432 -6.443 3.055
272 HE22 GLN 542 HE22 GLN 542 11.159 -6.363 4.631
273 H LEU 543 HN LEU 543 10.951 -1.153 -0.085
274 HA LEU 543 HA LEU 543 13.371 -1.745 -1.430
275 HB2 LEU 543 HB2 LEU 543 11.105 -1.253 -2.448
276 HB3 LEU 543 HB1 LEU 543 11.419 0.444 -2.131
277 HG LEU 543 HG LEU 543 13.439 -1.099 -3.692
278 HD11 LEU 543 HD11 LEU 543 10.885 -0.002 -4.878
279 HD12 LEU 543 HD12 LEU 543 11.242 -1.712 -4.653
280 HD13 LEU 543 HD13 LEU 543 12.223 -0.744 -5.756
281 HD21 LEU 543 HD21 LEU 543 13.611 1.085 -4.867
282 HD22 LEU 543 HD22 LEU 543 13.947 1.180 -3.140
283 HD23 LEU 543 HD23 LEU 543 12.394 1.732 -3.764
284 H GLN 544 HN GLN 544 12.272 1.034 0.437
285 HA GLN 544 HA GLN 544 14.330 2.816 -0.176
286 HB2 GLN 544 HB2 GLN 544 12.459 3.621 1.052
287 HB3 GLN 544 HB1 GLN 544 12.665 2.407 2.305
288 HG2 GLN 544 HG2 GLN 544 14.769 3.492 2.962
289 HG3 GLN 544 HG1 GLN 544 14.472 4.750 1.765
290 HE21 GLN 544 HE21 GLN 544 14.414 6.352 3.317
291 HE22 GLN 544 HE22 GLN 544 13.084 6.539 4.407
292 H GLN 545 HN GLN 545 14.084 0.378 2.380
293 HA GLN 545 HA GLN 545 16.691 0.736 3.403
294 HB2 GLN 545 HB2 GLN 545 14.825 -1.637 3.482
295 HB3 GLN 545 HB1 GLN 545 16.332 -1.551 4.383
296 HG2 GLN 545 HG2 GLN 545 15.521 0.318 5.651
297 HG3 GLN 545 HG1 GLN 545 14.068 0.409 4.664
298 HE21 GLN 545 HE21 GLN 545 12.412 -1.013 5.011
299 HE22 GLN 545 HE22 GLN 545 12.335 -2.067 6.386
300 H PHE 546 HN PHE 546 15.377 -1.149 0.780
301 HA PHE 546 HA PHE 546 17.637 -2.773 0.307
302 HB2 PHE 546 HB2 PHE 546 15.771 -3.664 -0.658
303 HB3 PHE 546 HB1 PHE 546 15.097 -2.084 -1.065
304 HD1 PHE 546 HD1 PHE 546 17.614 -4.610 -2.124
305 HD2 PHE 546 HD2 PHE 546 15.271 -1.221 -3.196
306 HE1 PHE 546 HE1 PHE 546 18.231 -4.928 -4.488
307 HE2 PHE 546 HE2 PHE 546 15.885 -1.527 -5.545
308 HZ PHE 546 HZ PHE 546 17.368 -3.388 -6.202
309 H LEU 547 HN LEU 547 16.531 0.250 -1.267
310 HA LEU 547 HA LEU 547 18.744 0.455 -2.989
311 HB2 LEU 547 HB2 LEU 547 17.997 2.647 -3.502
312 HB3 LEU 547 HB1 LEU 547 16.584 1.646 -3.256
313 HG LEU 547 HG LEU 547 16.676 2.681 -0.825
314 HD11 LEU 547 HD11 LEU 547 18.001 4.801 -2.519
315 HD12 LEU 547 HD12 LEU 547 18.742 3.935 -1.173
316 HD13 LEU 547 HD13 LEU 547 17.382 5.020 -0.882
317 HD21 LEU 547 HD21 LEU 547 15.657 4.185 -3.230
318 HD22 LEU 547 HD22 LEU 547 15.088 4.359 -1.569
319 HD23 LEU 547 HD23 LEU 547 14.834 2.844 -2.437
320 H GLU 548 HN GLU 548 18.200 1.604 0.278
321 HA GLU 548 HA GLU 548 20.631 3.040 0.446
322 HB2 GLU 548 HB2 GLU 548 18.818 1.985 2.606
323 HB3 GLU 548 HB1 GLU 548 20.251 2.957 2.925
324 HG2 GLU 548 HG2 GLU 548 19.229 4.655 1.314
325 HG3 GLU 548 HG1 GLU 548 17.734 3.743 1.511
326 H ALA 549 HN ALA 549 19.736 -0.289 1.157
327 HA ALA 549 HA ALA 549 22.176 -1.152 2.237
328 HB1 ALA 549 HB1 ALA 549 21.544 -3.386 1.462
329 HB2 ALA 549 HB2 ALA 549 20.287 -2.682 0.445
330 HB3 ALA 549 HB3 ALA 549 20.173 -2.557 2.201
331 H GLN 550 HN GLN 550 21.173 -0.550 -1.083
332 HA GLN 550 HA GLN 550 23.456 -1.570 -2.392
333 HB2 GLN 550 HB2 GLN 550 21.765 0.789 -3.246
334 HB3 GLN 550 HB1 GLN 550 22.814 -0.170 -4.275
335 HG2 GLN 550 HG2 GLN 550 21.364 -2.133 -3.826
336 HG3 GLN 550 HG1 GLN 550 20.270 -1.063 -2.949
337 HE21 GLN 550 HE21 GLN 550 22.061 -0.183 -5.816
338 HE22 GLN 550 HE22 GLN 550 20.694 -0.023 -6.862
339 H LYS 551 HN LYS 551 22.713 1.570 -0.954
340 HA LYS 551 HA LYS 551 25.024 2.986 -1.673
341 HB2 LYS 551 HB2 LYS 551 23.512 3.167 0.938
342 HB3 LYS 551 HB1 LYS 551 24.593 4.387 0.288
343 HG2 LYS 551 HG2 LYS 551 22.089 3.507 -1.113
344 HG3 LYS 551 HG1 LYS 551 22.128 4.829 0.053
345 HD2 LYS 551 HD2 LYS 551 23.842 5.948 -1.347
346 HD3 LYS 551 HD1 LYS 551 23.666 4.655 -2.536
347 HE2 LYS 551 HE2 LYS 551 21.320 5.231 -2.837
348 HE3 LYS 551 HE1 LYS 551 21.456 6.489 -1.610
349 HZ1 LYS 551 HZ1 LYS 551 22.930 6.427 -4.189
350 HZ2 LYS 551 HZ2 LYS 551 23.044 7.645 -3.012
351 HZ3 LYS 551 HZ3 LYS 551 21.585 7.401 -3.842
352 H SER 552 HN SER 552 24.348 0.949 1.137
353 HA SER 552 HA SER 552 26.822 1.171 2.391
354 HB2 SER 552 HB2 SER 552 24.986 -1.235 2.394
355 HB3 SER 552 HB1 SER 552 26.175 -0.810 3.629
356 HG SER 552 HG SER 552 23.849 -0.197 3.971
357 H GLU 553 HN GLU 553 25.771 -0.909 -0.247
358 HA GLU 553 HA GLU 553 28.121 -2.512 -0.334
359 HB2 GLU 553 HB2 GLU 553 26.033 -1.890 -2.421
360 HB3 GLU 553 HB1 GLU 553 27.344 -3.037 -2.666
361 HG2 GLU 553 HG2 GLU 553 25.241 -3.224 -0.533
362 HG3 GLU 553 HG1 GLU 553 25.243 -4.125 -2.048
363 H GLY 554 HN GLY 554 27.039 0.350 -2.123
364 HA2 GLY 554 HA2 GLY 554 29.305 0.555 -3.799
365 HA3 GLY 554 HA1 GLY 554 28.155 1.840 -3.462
366 H LYS 555 HN LYS 555 28.528 2.042 -0.683
367 HA LYS 555 HA LYS 555 30.921 3.623 -0.624
368 HB2 LYS 555 HB2 LYS 555 30.233 4.305 1.551
369 HB3 LYS 555 HB1 LYS 555 28.771 4.158 0.584
370 HG2 LYS 555 HG2 LYS 555 28.317 1.988 1.579
371 HG3 LYS 555 HG1 LYS 555 29.780 2.120 2.555
372 HD2 LYS 555 HD2 LYS 555 27.476 4.066 2.664
373 HD3 LYS 555 HD1 LYS 555 27.694 2.713 3.776
374 HE2 LYS 555 HE2 LYS 555 29.711 4.920 3.365
375 HE3 LYS 555 HE1 LYS 555 28.513 4.895 4.660
376 HZ1 LYS 555 HZ1 LYS 555 29.480 2.873 5.514
377 HZ2 LYS 555 HZ2 LYS 555 30.687 4.057 5.380
378 HZ3 LYS 555 HZ3 LYS 555 30.592 2.810 4.237
379 H SER 556 HN SER 556 30.265 0.360 -0.016
380 HA SER 556 HA SER 556 32.122 -0.078 2.103
381 HB2 SER 556 HB2 SER 556 30.189 -1.589 1.604
382 HB3 SER 556 HB1 SER 556 31.034 -2.118 0.153
383 HG SER 556 HG SER 556 32.821 -2.495 1.898
384 H LEU 557 HN LEU 557 33.969 1.000 1.315
385 HA LEU 557 HA LEU 557 35.475 -0.498 -0.716
386 HB2 LEU 557 HB2 LEU 557 36.069 2.233 0.442
387 HB3 LEU 557 HB1 LEU 557 36.918 1.457 -0.881
388 HG LEU 557 HG LEU 557 34.055 2.422 -0.934
389 HD11 LEU 557 HD11 LEU 557 36.520 3.444 -2.339
390 HD12 LEU 557 HD12 LEU 557 35.705 4.223 -0.984
391 HD13 LEU 557 HD13 LEU 557 34.881 4.063 -2.535
392 HD21 LEU 557 HD21 LEU 557 34.105 1.827 -3.304
393 HD22 LEU 557 HD22 LEU 557 34.351 0.408 -2.286
394 HD23 LEU 557 HD23 LEU 557 35.722 1.155 -3.106
Start of MODEL 13
1 H1 GLY 510 HT1 GLY 510 -37.209 -5.798 -8.871
2 H2 GLY 510 HT2 GLY 510 -36.095 -4.577 -8.494
3 H3 GLY 510 HT3 GLY 510 -35.760 -6.185 -8.078
4 HA2 GLY 510 HA1 GLY 510 -35.685 -6.795 -10.421
5 HA3 GLY 510 HA2 GLY 510 -35.994 -5.116 -10.834
6 H SER 511 HN SER 511 -34.376 -3.593 -9.503
7 HA SER 511 HA SER 511 -31.728 -4.641 -10.235
8 HB2 SER 511 HB2 SER 511 -32.574 -1.746 -10.070
9 HB3 SER 511 HB1 SER 511 -31.097 -2.388 -10.788
10 HG SER 511 HG SER 511 -32.934 -3.646 -12.065
11 H VAL 512 HN VAL 512 -33.091 -4.874 -7.550
12 HA VAL 512 HA VAL 512 -31.760 -3.120 -5.755
13 HB VAL 512 HB VAL 512 -32.973 -5.847 -5.292
14 HG11 VAL 512 HG11 VAL 512 -32.859 -5.068 -2.835
15 HG12 VAL 512 HG12 VAL 512 -31.583 -3.984 -3.396
16 HG13 VAL 512 HG13 VAL 512 -31.402 -5.727 -3.576
17 HG21 VAL 512 HG21 VAL 512 -33.901 -3.073 -4.552
18 HG22 VAL 512 HG22 VAL 512 -34.745 -4.578 -4.186
19 HG23 VAL 512 HG23 VAL 512 -34.545 -4.062 -5.861
20 H GLU 513 HN GLU 513 -31.103 -6.498 -6.681
21 HA GLU 513 HA GLU 513 -28.684 -6.746 -5.312
22 HB2 GLU 513 HB2 GLU 513 -28.215 -8.624 -6.821
23 HB3 GLU 513 HB1 GLU 513 -29.843 -8.670 -6.166
24 HG2 GLU 513 HG2 GLU 513 -30.614 -7.626 -8.328
25 HG3 GLU 513 HG1 GLU 513 -28.990 -7.927 -8.949
26 H THR 514 HN THR 514 -29.436 -5.258 -8.363
27 HA THR 514 HA THR 514 -26.869 -5.091 -9.452
28 HB THR 514 HB THR 514 -29.107 -3.090 -9.779
29 HG1 THR 514 HG1 THR 514 -28.677 -5.523 -11.228
30 HG21 THR 514 HG21 THR 514 -26.884 -2.551 -10.726
31 HG22 THR 514 HG22 THR 514 -28.148 -2.700 -11.945
32 HG23 THR 514 HG23 THR 514 -26.981 -4.005 -11.712
33 H CYS 515 HN CYS 515 -28.744 -2.628 -7.636
34 HA CYS 515 HA CYS 515 -26.561 -0.840 -7.378
35 HB2 CYS 515 HB2 CYS 515 -29.006 -0.997 -5.607
36 HB3 CYS 515 HB1 CYS 515 -27.949 0.398 -5.838
37 HG CYS 515 HG CYS 515 -29.358 1.434 -7.708
38 H MET 516 HN MET 516 -27.826 -3.419 -5.341
39 HA MET 516 HA MET 516 -26.202 -2.990 -3.093
40 HB2 MET 516 HB2 MET 516 -28.098 -4.534 -3.112
41 HB3 MET 516 HB1 MET 516 -27.244 -5.593 -4.218
42 HG2 MET 516 HG2 MET 516 -26.117 -4.897 -1.537
43 HG3 MET 516 HG1 MET 516 -27.298 -6.181 -1.733
44 HE1 MET 516 HE1 MET 516 -26.446 -7.300 -4.617
45 HE2 MET 516 HE2 MET 516 -26.833 -8.377 -3.277
46 HE3 MET 516 HE3 MET 516 -25.335 -8.596 -4.185
47 H SER 517 HN SER 517 -25.628 -4.725 -6.110
48 HA SER 517 HA SER 517 -23.133 -5.816 -5.371
49 HB2 SER 517 HB2 SER 517 -24.539 -6.663 -7.248
50 HB3 SER 517 HB1 SER 517 -24.139 -5.206 -8.158
51 HG SER 517 HG SER 517 -22.123 -6.893 -7.103
52 H LEU 518 HN LEU 518 -23.982 -2.867 -7.228
53 HA LEU 518 HA LEU 518 -21.301 -2.209 -7.749
54 HB2 LEU 518 HB2 LEU 518 -22.189 0.132 -8.146
55 HB3 LEU 518 HB1 LEU 518 -22.784 -1.148 -9.176
56 HG LEU 518 HG LEU 518 -24.779 -1.167 -7.455
57 HD11 LEU 518 HD11 LEU 518 -23.499 1.505 -7.026
58 HD12 LEU 518 HD12 LEU 518 -24.151 0.369 -5.834
59 HD13 LEU 518 HD13 LEU 518 -25.241 1.288 -6.873
60 HD21 LEU 518 HD21 LEU 518 -24.422 0.943 -9.571
61 HD22 LEU 518 HD22 LEU 518 -25.962 0.405 -8.898
62 HD23 LEU 518 HD23 LEU 518 -24.966 -0.713 -9.829
63 H ALA 519 HN ALA 519 -23.435 -1.319 -5.106
64 HA ALA 519 HA ALA 519 -21.687 0.518 -3.859
65 HB1 ALA 519 HB1 ALA 519 -23.084 0.161 -1.854
66 HB2 ALA 519 HB2 ALA 519 -23.889 -1.170 -2.688
67 HB3 ALA 519 HB3 ALA 519 -24.034 0.473 -3.305
68 H SER 520 HN SER 520 -22.167 -2.982 -3.410
69 HA SER 520 HA SER 520 -20.250 -3.197 -1.320
70 HB2 SER 520 HB2 SER 520 -20.372 -5.660 -1.826
71 HB3 SER 520 HB1 SER 520 -21.917 -4.897 -1.465
72 HG SER 520 HG SER 520 -22.554 -5.148 -3.487
73 H GLN 521 HN GLN 521 -20.070 -3.530 -4.844
74 HA GLN 521 HA GLN 521 -17.404 -4.421 -4.944
75 HB2 GLN 521 HB2 GLN 521 -18.939 -2.762 -6.939
76 HB3 GLN 521 HB1 GLN 521 -17.343 -3.441 -7.225
77 HG2 GLN 521 HG2 GLN 521 -19.885 -4.948 -6.730
78 HG3 GLN 521 HG1 GLN 521 -18.975 -4.861 -8.236
79 HE21 GLN 521 HE21 GLN 521 -19.157 -6.227 -5.068
80 HE22 GLN 521 HE22 GLN 521 -17.925 -7.427 -5.269
81 H VAL 522 HN VAL 522 -18.763 -1.137 -4.946
82 HA VAL 522 HA VAL 522 -16.344 0.263 -5.013
83 HB VAL 522 HB VAL 522 -18.961 0.984 -3.668
84 HG11 VAL 522 HG11 VAL 522 -17.162 2.230 -2.589
85 HG12 VAL 522 HG12 VAL 522 -18.135 3.295 -3.604
86 HG13 VAL 522 HG13 VAL 522 -16.557 2.744 -4.165
87 HG21 VAL 522 HG21 VAL 522 -17.709 1.872 -6.265
88 HG22 VAL 522 HG22 VAL 522 -19.241 2.451 -5.611
89 HG23 VAL 522 HG23 VAL 522 -19.069 0.763 -6.091
90 H VAL 523 HN VAL 523 -18.118 -1.144 -2.306
91 HA VAL 523 HA VAL 523 -16.442 -0.274 -0.236
92 HB VAL 523 HB VAL 523 -18.443 -2.456 -0.588
93 HG11 VAL 523 HG11 VAL 523 -16.502 -2.341 1.704
94 HG12 VAL 523 HG12 VAL 523 -16.818 -3.683 0.601
95 HG13 VAL 523 HG13 VAL 523 -18.048 -3.191 1.764
96 HG21 VAL 523 HG21 VAL 523 -19.477 -1.350 1.335
97 HG22 VAL 523 HG22 VAL 523 -19.162 -0.220 0.018
98 HG23 VAL 523 HG23 VAL 523 -18.105 -0.245 1.429
99 H LYS 524 HN LYS 524 -16.306 -3.151 -2.314
100 HA LYS 524 HA LYS 524 -14.014 -4.296 -1.118
101 HB2 LYS 524 HB2 LYS 524 -15.503 -4.658 -3.634
102 HB3 LYS 524 HB1 LYS 524 -13.807 -5.121 -3.701
103 HG2 LYS 524 HG2 LYS 524 -15.070 -7.051 -3.155
104 HG3 LYS 524 HG1 LYS 524 -14.217 -6.551 -1.693
105 HD2 LYS 524 HD2 LYS 524 -16.301 -5.344 -1.009
106 HD3 LYS 524 HD1 LYS 524 -17.114 -6.107 -2.373
107 HE2 LYS 524 HE2 LYS 524 -17.508 -7.338 -0.296
108 HE3 LYS 524 HE1 LYS 524 -16.619 -8.308 -1.470
109 HZ1 LYS 524 HZ1 LYS 524 -14.611 -7.973 -0.288
110 HZ2 LYS 524 HZ2 LYS 524 -15.775 -8.414 0.866
111 HZ3 LYS 524 HZ3 LYS 524 -15.300 -6.792 0.717
112 H LEU 525 HN LEU 525 -14.404 -2.061 -3.848
113 HA LEU 525 HA LEU 525 -11.694 -1.912 -4.563
114 HB2 LEU 525 HB2 LEU 525 -14.089 -0.214 -5.031
115 HB3 LEU 525 HB1 LEU 525 -12.523 0.527 -5.291
116 HG LEU 525 HG LEU 525 -11.977 -1.278 -6.908
117 HD11 LEU 525 HD11 LEU 525 -14.866 -2.023 -6.930
118 HD12 LEU 525 HD12 LEU 525 -13.755 -2.817 -5.821
119 HD13 LEU 525 HD13 LEU 525 -13.473 -2.906 -7.563
120 HD21 LEU 525 HD21 LEU 525 -12.839 0.868 -7.665
121 HD22 LEU 525 HD22 LEU 525 -14.492 0.281 -7.482
122 HD23 LEU 525 HD23 LEU 525 -13.427 -0.443 -8.689
123 H THR 526 HN THR 526 -13.616 0.147 -2.398
124 HA THR 526 HA THR 526 -11.514 1.946 -1.840
125 HB THR 526 HB THR 526 -13.992 2.349 -1.445
126 HG1 THR 526 HG1 THR 526 -12.705 3.912 -0.649
127 HG21 THR 526 HG21 THR 526 -13.422 0.847 1.112
128 HG22 THR 526 HG22 THR 526 -14.522 0.340 -0.170
129 HG23 THR 526 HG23 THR 526 -14.877 1.786 0.774
130 H LYS 527 HN LYS 527 -12.540 -1.060 -0.318
131 HA LYS 527 HA LYS 527 -10.783 -0.898 1.901
132 HB2 LYS 527 HB2 LYS 527 -12.660 -2.411 1.978
133 HB3 LYS 527 HB1 LYS 527 -12.085 -3.272 0.558
134 HG2 LYS 527 HG2 LYS 527 -11.653 -4.548 2.560
135 HG3 LYS 527 HG1 LYS 527 -10.135 -4.035 1.825
136 HD2 LYS 527 HD2 LYS 527 -9.995 -3.734 4.209
137 HD3 LYS 527 HD1 LYS 527 -10.040 -2.151 3.434
138 HE2 LYS 527 HE2 LYS 527 -12.429 -1.979 3.944
139 HE3 LYS 527 HE1 LYS 527 -12.378 -3.562 4.721
140 HZ1 LYS 527 HZ1 LYS 527 -12.218 -1.955 6.418
141 HZ2 LYS 527 HZ2 LYS 527 -11.035 -1.071 5.596
142 HZ3 LYS 527 HZ3 LYS 527 -10.659 -2.598 6.242
143 H GLN 528 HN GLN 528 -10.538 -2.514 -1.261
144 HA GLN 528 HA GLN 528 -7.997 -3.624 -0.842
145 HB2 GLN 528 HB2 GLN 528 -9.427 -2.854 -3.380
146 HB3 GLN 528 HB1 GLN 528 -7.863 -3.658 -3.374
147 HG2 GLN 528 HG2 GLN 528 -8.866 -5.521 -2.102
148 HG3 GLN 528 HG1 GLN 528 -10.436 -4.727 -2.234
149 HE21 GLN 528 HE21 GLN 528 -11.317 -6.449 -3.379
150 HE22 GLN 528 HE22 GLN 528 -10.908 -6.769 -5.026
151 H LEU 529 HN LEU 529 -8.980 -0.455 -2.061
152 HA LEU 529 HA LEU 529 -6.468 0.463 -2.906
153 HB2 LEU 529 HB2 LEU 529 -8.798 1.954 -1.703
154 HB3 LEU 529 HB1 LEU 529 -7.402 2.744 -2.404
155 HG LEU 529 HG LEU 529 -9.246 0.910 -3.930
156 HD11 LEU 529 HD11 LEU 529 -9.132 3.915 -3.997
157 HD12 LEU 529 HD12 LEU 529 -10.304 2.995 -3.055
158 HD13 LEU 529 HD13 LEU 529 -10.284 2.857 -4.817
159 HD21 LEU 529 HD21 LEU 529 -8.151 1.847 -5.886
160 HD22 LEU 529 HD22 LEU 529 -6.963 1.089 -4.824
161 HD23 LEU 529 HD23 LEU 529 -7.126 2.846 -4.855
162 H LYS 530 HN LYS 530 -8.067 0.705 0.252
163 HA LYS 530 HA LYS 530 -5.968 2.129 1.510
164 HB2 LYS 530 HB2 LYS 530 -8.130 0.395 2.709
165 HB3 LYS 530 HB1 LYS 530 -7.062 1.442 3.636
166 HG2 LYS 530 HG2 LYS 530 -7.934 3.375 2.341
167 HG3 LYS 530 HG1 LYS 530 -9.094 2.281 1.581
168 HD2 LYS 530 HD2 LYS 530 -10.001 1.722 3.785
169 HD3 LYS 530 HD1 LYS 530 -8.849 2.821 4.542
170 HE2 LYS 530 HE2 LYS 530 -10.993 3.902 4.368
171 HE3 LYS 530 HE1 LYS 530 -9.856 4.687 3.272
172 HZ1 LYS 530 HZ1 LYS 530 -10.829 3.586 1.424
173 HZ2 LYS 530 HZ2 LYS 530 -12.104 4.246 2.325
174 HZ3 LYS 530 HZ3 LYS 530 -11.771 2.589 2.419
175 H GLU 531 HN GLU 531 -6.787 -1.335 1.493
176 HA GLU 531 HA GLU 531 -4.654 -2.073 3.208
177 HB2 GLU 531 HB2 GLU 531 -6.081 -3.841 1.214
178 HB3 GLU 531 HB1 GLU 531 -5.176 -4.362 2.633
179 HG2 GLU 531 HG2 GLU 531 -6.982 -2.653 3.731
180 HG3 GLU 531 HG1 GLU 531 -7.911 -3.349 2.405
181 H GLN 532 HN GLN 532 -4.964 -1.851 -0.291
182 HA GLN 532 HA GLN 532 -2.477 -2.955 -0.984
183 HB2 GLN 532 HB2 GLN 532 -4.084 -2.525 -2.709
184 HB3 GLN 532 HB1 GLN 532 -4.152 -0.817 -2.308
185 HG2 GLN 532 HG2 GLN 532 -2.923 -1.117 -4.347
186 HG3 GLN 532 HG1 GLN 532 -1.828 -0.567 -3.081
187 HE21 GLN 532 HE21 GLN 532 -1.306 -1.991 -5.583
188 HE22 GLN 532 HE22 GLN 532 -0.446 -3.428 -5.134
189 H THR 533 HN THR 533 -3.401 0.285 0.049
190 HA THR 533 HA THR 533 -0.898 1.484 -0.480
191 HB THR 533 HB THR 533 -3.002 2.377 1.498
192 HG1 THR 533 HG1 THR 533 -3.930 2.293 -0.534
193 HG21 THR 533 HG21 THR 533 -0.688 3.389 1.681
194 HG22 THR 533 HG22 THR 533 -2.000 4.530 1.379
195 HG23 THR 533 HG23 THR 533 -0.938 4.037 0.059
196 H VAL 534 HN VAL 534 -2.259 0.007 2.483
197 HA VAL 534 HA VAL 534 -0.120 0.862 4.126
198 HB VAL 534 HB VAL 534 -0.882 -0.797 5.781
199 HG11 VAL 534 HG11 VAL 534 -3.124 0.157 6.124
200 HG12 VAL 534 HG12 VAL 534 -3.074 0.828 4.494
201 HG13 VAL 534 HG13 VAL 534 -1.927 1.384 5.713
202 HG21 VAL 534 HG21 VAL 534 -2.825 -2.181 5.366
203 HG22 VAL 534 HG22 VAL 534 -1.542 -2.573 4.220
204 HG23 VAL 534 HG23 VAL 534 -2.915 -1.595 3.704
205 H GLU 535 HN GLU 535 -0.627 -2.191 2.338
206 HA GLU 535 HA GLU 535 1.855 -3.287 3.226
207 HB2 GLU 535 HB2 GLU 535 1.538 -4.954 1.458
208 HB3 GLU 535 HB1 GLU 535 0.085 -4.755 2.421
209 HG2 GLU 535 HG2 GLU 535 -1.018 -3.595 0.703
210 HG3 GLU 535 HG1 GLU 535 0.481 -3.347 -0.192
211 H ARG 536 HN ARG 536 0.856 -1.252 0.564
212 HA ARG 536 HA ARG 536 3.237 -1.508 -0.949
213 HB2 ARG 536 HB2 ARG 536 1.237 -0.797 -2.042
214 HB3 ARG 536 HB1 ARG 536 1.063 0.570 -0.954
215 HG2 ARG 536 HG2 ARG 536 3.569 0.525 -2.474
216 HG3 ARG 536 HG1 ARG 536 2.101 0.696 -3.444
217 HD2 ARG 536 HD2 ARG 536 2.864 2.396 -1.078
218 HD3 ARG 536 HD1 ARG 536 2.988 2.877 -2.773
219 HE ARG 536 HE ARG 536 0.370 2.086 -1.749
220 HH11 ARG 536 HH11 ARG 536 2.507 4.608 -2.888
221 HH12 ARG 536 HH12 ARG 536 1.233 5.793 -3.033
222 HH21 ARG 536 HH21 ARG 536 -1.301 3.635 -1.919
223 HH22 ARG 536 HH22 ARG 536 -0.929 5.246 -2.457
224 H VAL 537 HN VAL 537 2.198 0.905 1.467
225 HA VAL 537 HA VAL 537 4.544 2.473 1.241
226 HB VAL 537 HB VAL 537 3.989 3.433 3.417
227 HG11 VAL 537 HG11 VAL 537 1.764 4.293 2.868
228 HG12 VAL 537 HG12 VAL 537 1.571 3.004 1.678
229 HG13 VAL 537 HG13 VAL 537 2.811 4.237 1.448
230 HG21 VAL 537 HG21 VAL 537 2.247 2.657 4.819
231 HG22 VAL 537 HG22 VAL 537 3.225 1.237 4.427
232 HG23 VAL 537 HG23 VAL 537 1.687 1.505 3.607
233 H THR 538 HN THR 538 3.675 -0.265 3.266
234 HA THR 538 HA THR 538 6.065 -0.493 4.713
235 HB THR 538 HB THR 538 4.144 -2.626 3.776
236 HG1 THR 538 HG1 THR 538 2.986 -1.352 5.094
237 HG21 THR 538 HG21 THR 538 6.265 -3.598 4.454
238 HG22 THR 538 HG22 THR 538 5.007 -3.975 5.630
239 HG23 THR 538 HG23 THR 538 6.202 -2.723 5.981
240 H LEU 539 HN LEU 539 5.111 -1.677 1.528
241 HA LEU 539 HA LEU 539 7.448 -3.156 0.966
242 HB2 LEU 539 HB2 LEU 539 5.368 -3.507 -0.242
243 HB3 LEU 539 HB1 LEU 539 5.390 -1.856 -0.820
244 HG LEU 539 HG LEU 539 6.021 -3.756 -2.433
245 HD11 LEU 539 HD11 LEU 539 8.055 -2.130 -3.163
246 HD12 LEU 539 HD12 LEU 539 7.146 -1.088 -2.057
247 HD13 LEU 539 HD13 LEU 539 6.346 -1.801 -3.460
248 HD21 LEU 539 HD21 LEU 539 7.634 -4.868 -0.954
249 HD22 LEU 539 HD22 LEU 539 8.654 -3.429 -1.000
250 HD23 LEU 539 HD23 LEU 539 8.373 -4.361 -2.472
251 H GLN 540 HN GLN 540 6.450 0.175 0.207
252 HA GLN 540 HA GLN 540 8.743 0.975 -1.155
253 HB2 GLN 540 HB2 GLN 540 6.972 2.622 0.648
254 HB3 GLN 540 HB1 GLN 540 8.185 3.275 -0.444
255 HG2 GLN 540 HG2 GLN 540 5.812 1.646 -1.267
256 HG3 GLN 540 HG1 GLN 540 5.923 3.403 -1.365
257 HE21 GLN 540 HE21 GLN 540 7.333 4.322 -2.892
258 HE22 GLN 540 HE22 GLN 540 7.921 3.421 -4.244
259 H ASN 541 HN ASN 541 8.123 0.728 2.287
260 HA ASN 541 HA ASN 541 10.492 1.943 3.218
261 HB2 ASN 541 HB2 ASN 541 8.536 1.305 4.656
262 HB3 ASN 541 HB1 ASN 541 9.013 -0.378 4.484
263 HD21 ASN 541 HD21 ASN 541 9.713 2.652 5.974
264 HD22 ASN 541 HD22 ASN 541 10.932 2.077 7.057
265 H GLN 542 HN GLN 542 9.740 -1.408 2.357
266 HA GLN 542 HA GLN 542 12.326 -2.454 2.856
267 HB2 GLN 542 HB2 GLN 542 10.271 -3.468 0.876
268 HB3 GLN 542 HB1 GLN 542 11.600 -4.383 1.573
269 HG2 GLN 542 HG2 GLN 542 10.584 -4.237 3.769
270 HG3 GLN 542 HG1 GLN 542 9.276 -3.251 3.115
271 HE21 GLN 542 HE21 GLN 542 10.733 -6.019 1.523
272 HE22 GLN 542 HE22 GLN 542 9.322 -7.019 1.576
273 H LEU 543 HN LEU 543 10.789 -0.987 0.055
274 HA LEU 543 HA LEU 543 12.877 -1.484 -1.790
275 HB2 LEU 543 HB2 LEU 543 10.506 -0.848 -2.345
276 HB3 LEU 543 HB1 LEU 543 10.887 0.785 -1.841
277 HG LEU 543 HG LEU 543 12.572 -0.470 -3.964
278 HD11 LEU 543 HD11 LEU 543 9.834 0.712 -4.427
279 HD12 LEU 543 HD12 LEU 543 10.286 -0.977 -4.657
280 HD13 LEU 543 HD13 LEU 543 10.996 0.271 -5.680
281 HD21 LEU 543 HD21 LEU 543 12.567 1.863 -4.801
282 HD22 LEU 543 HD22 LEU 543 13.209 1.713 -3.165
283 HD23 LEU 543 HD23 LEU 543 11.574 2.325 -3.419
284 H GLN 544 HN GLN 544 12.250 1.082 0.527
285 HA GLN 544 HA GLN 544 14.304 2.837 -0.188
286 HB2 GLN 544 HB2 GLN 544 12.774 3.639 1.411
287 HB3 GLN 544 HB1 GLN 544 12.932 2.204 2.416
288 HG2 GLN 544 HG2 GLN 544 15.124 2.884 3.118
289 HG3 GLN 544 HG1 GLN 544 15.090 4.259 2.017
290 HE21 GLN 544 HE21 GLN 544 12.353 4.945 2.520
291 HE22 GLN 544 HE22 GLN 544 12.299 5.645 4.103
292 H GLN 545 HN GLN 545 14.299 0.039 1.988
293 HA GLN 545 HA GLN 545 17.041 0.122 2.629
294 HB2 GLN 545 HB2 GLN 545 15.293 -2.336 2.475
295 HB3 GLN 545 HB1 GLN 545 16.762 -2.143 3.409
296 HG2 GLN 545 HG2 GLN 545 14.216 -0.676 3.840
297 HG3 GLN 545 HG1 GLN 545 14.809 -2.005 4.821
298 HE21 GLN 545 HE21 GLN 545 14.132 0.722 5.574
299 HE22 GLN 545 HE22 GLN 545 15.561 1.405 6.268
300 H PHE 546 HN PHE 546 15.236 -1.201 -0.029
301 HA PHE 546 HA PHE 546 17.261 -2.808 -1.170
302 HB2 PHE 546 HB2 PHE 546 15.218 -3.428 -1.959
303 HB3 PHE 546 HB1 PHE 546 14.588 -1.780 -1.932
304 HD1 PHE 546 HD2 PHE 546 16.699 -4.137 -3.825
305 HD2 PHE 546 HD1 PHE 546 14.495 -0.500 -3.903
306 HE1 PHE 546 HE2 PHE 546 16.982 -4.029 -6.256
307 HE2 PHE 546 HE1 PHE 546 14.784 -0.381 -6.344
308 HZ PHE 546 HZ PHE 546 15.872 -2.145 -7.538
309 H LEU 547 HN LEU 547 16.161 0.507 -1.965
310 HA LEU 547 HA LEU 547 18.059 0.899 -4.005
311 HB2 LEU 547 HB2 LEU 547 17.470 3.226 -3.929
312 HB3 LEU 547 HB1 LEU 547 16.031 2.246 -3.751
313 HG LEU 547 HG LEU 547 16.459 2.695 -1.175
314 HD11 LEU 547 HD11 LEU 547 17.646 5.132 -2.498
315 HD12 LEU 547 HD12 LEU 547 18.541 3.941 -1.555
316 HD13 LEU 547 HD13 LEU 547 17.304 4.931 -0.780
317 HD21 LEU 547 HD21 LEU 547 15.221 4.676 -3.082
318 HD22 LEU 547 HD22 LEU 547 14.914 4.585 -1.347
319 HD23 LEU 547 HD23 LEU 547 14.437 3.251 -2.398
320 H GLU 548 HN GLU 548 18.164 1.589 -0.549
321 HA GLU 548 HA GLU 548 20.730 2.748 -0.529
322 HB2 GLU 548 HB2 GLU 548 19.211 1.258 1.611
323 HB3 GLU 548 HB1 GLU 548 20.781 1.998 1.892
324 HG2 GLU 548 HG2 GLU 548 19.829 4.178 1.220
325 HG3 GLU 548 HG1 GLU 548 18.252 3.405 1.078
326 H ALA 549 HN ALA 549 19.651 -0.608 -0.406
327 HA ALA 549 HA ALA 549 22.134 -1.827 0.041
328 HB1 ALA 549 HB1 ALA 549 21.171 -3.827 -0.947
329 HB2 ALA 549 HB2 ALA 549 19.859 -2.875 -1.643
330 HB3 ALA 549 HB3 ALA 549 19.995 -3.041 0.107
331 H GLN 550 HN GLN 550 20.608 -0.692 -2.940
332 HA GLN 550 HA GLN 550 22.457 -1.650 -4.801
333 HB2 GLN 550 HB2 GLN 550 20.952 0.974 -4.846
334 HB3 GLN 550 HB1 GLN 550 21.734 0.235 -6.232
335 HG2 GLN 550 HG2 GLN 550 20.218 -1.663 -6.083
336 HG3 GLN 550 HG1 GLN 550 19.451 -0.924 -4.674
337 HE21 GLN 550 HE21 GLN 550 18.434 -1.646 -7.373
338 HE22 GLN 550 HE22 GLN 550 17.690 -0.192 -7.964
339 H LYS 551 HN LYS 551 22.587 1.060 -2.644
340 HA LYS 551 HA LYS 551 24.889 2.295 -3.783
341 HB2 LYS 551 HB2 LYS 551 23.644 2.475 -1.046
342 HB3 LYS 551 HB1 LYS 551 24.992 3.473 -1.569
343 HG2 LYS 551 HG2 LYS 551 22.398 3.407 -3.072
344 HG3 LYS 551 HG1 LYS 551 22.645 4.476 -1.690
345 HD2 LYS 551 HD2 LYS 551 24.668 5.375 -2.857
346 HD3 LYS 551 HD1 LYS 551 24.228 4.403 -4.260
347 HE2 LYS 551 HE2 LYS 551 22.429 6.480 -3.022
348 HE3 LYS 551 HE1 LYS 551 23.524 6.808 -4.363
349 HZ1 LYS 551 HZ1 LYS 551 22.353 5.144 -5.673
350 HZ2 LYS 551 HZ2 LYS 551 21.295 6.359 -5.144
351 HZ3 LYS 551 HZ3 LYS 551 21.291 4.849 -4.385
352 H SER 552 HN SER 552 24.481 0.339 -0.826
353 HA SER 552 HA SER 552 27.239 0.208 -0.273
354 HB2 SER 552 HB2 SER 552 25.090 -1.721 0.629
355 HB3 SER 552 HB1 SER 552 26.643 -1.420 1.414
356 HG SER 552 HG SER 552 24.757 -0.303 2.315
357 H GLU 553 HN GLU 553 25.129 -1.872 -2.185
358 HA GLU 553 HA GLU 553 27.204 -3.887 -2.439
359 HB2 GLU 553 HB2 GLU 553 24.469 -3.729 -3.700
360 HB3 GLU 553 HB1 GLU 553 25.556 -5.109 -3.793
361 HG2 GLU 553 HG2 GLU 553 24.428 -3.973 -1.255
362 HG3 GLU 553 HG1 GLU 553 23.776 -5.374 -2.104
363 H GLY 554 HN GLY 554 25.976 -1.175 -4.179
364 HA2 GLY 554 HA2 GLY 554 27.095 -1.976 -6.721
365 HA3 GLY 554 HA1 GLY 554 26.325 -0.439 -6.354
366 H LYS 555 HN LYS 555 27.968 0.178 -4.073
367 HA LYS 555 HA LYS 555 30.137 1.456 -5.324
368 HB2 LYS 555 HB2 LYS 555 30.835 2.123 -3.118
369 HB3 LYS 555 HB1 LYS 555 29.082 2.187 -3.204
370 HG2 LYS 555 HG2 LYS 555 28.989 -0.009 -2.067
371 HG3 LYS 555 HG1 LYS 555 30.742 0.063 -1.877
372 HD2 LYS 555 HD2 LYS 555 28.784 2.093 -0.802
373 HD3 LYS 555 HD1 LYS 555 29.541 0.808 0.140
374 HE2 LYS 555 HE2 LYS 555 31.104 2.907 -1.349
375 HE3 LYS 555 HE1 LYS 555 30.609 3.085 0.334
376 HZ1 LYS 555 HZ1 LYS 555 32.891 2.220 0.058
377 HZ2 LYS 555 HZ2 LYS 555 32.257 0.835 -0.691
378 HZ3 LYS 555 HZ3 LYS 555 31.879 1.170 0.928
379 H SER 556 HN SER 556 29.796 -1.743 -4.227
380 HA SER 556 HA SER 556 32.687 -2.195 -4.229
381 HB2 SER 556 HB2 SER 556 31.305 -3.170 -2.380
382 HB3 SER 556 HB1 SER 556 30.469 -4.154 -3.582
383 HG SER 556 HG SER 556 32.039 -5.511 -3.381
384 H LEU 557 HN LEU 557 33.230 -2.100 -6.345
385 HA LEU 557 HA LEU 557 31.703 -3.570 -8.317
386 HB2 LEU 557 HB2 LEU 557 33.445 -2.633 -9.902
387 HB3 LEU 557 HB1 LEU 557 32.393 -1.478 -9.113
388 HG LEU 557 HG LEU 557 34.361 -1.241 -7.412
389 HD11 LEU 557 HD11 LEU 557 36.565 -1.543 -8.422
390 HD12 LEU 557 HD12 LEU 557 35.817 -2.303 -9.827
391 HD13 LEU 557 HD13 LEU 557 35.715 -3.078 -8.245
392 HD21 LEU 557 HD21 LEU 557 35.322 0.541 -8.781
393 HD22 LEU 557 HD22 LEU 557 33.559 0.537 -8.857
394 HD23 LEU 557 HD23 LEU 557 34.502 -0.110 -10.200
Start of MODEL 14
1 H1 GLY 510 HT1 GLY 510 -32.703 13.842 0.752
2 H2 GLY 510 HT2 GLY 510 -31.504 13.040 1.641
3 H3 GLY 510 HT3 GLY 510 -32.807 13.767 2.442
4 HA2 GLY 510 HA1 GLY 510 -34.343 12.213 1.378
5 HA3 GLY 510 HA2 GLY 510 -32.962 11.438 0.611
6 H SER 511 HN SER 511 -33.916 9.546 1.755
7 HA SER 511 HA SER 511 -33.526 9.453 4.623
8 HB2 SER 511 HB2 SER 511 -35.392 8.260 3.374
9 HB3 SER 511 HB1 SER 511 -34.163 7.150 2.766
10 HG SER 511 HG SER 511 -35.114 7.505 5.388
11 H VAL 512 HN VAL 512 -32.140 7.896 5.640
12 HA VAL 512 HA VAL 512 -29.492 8.146 4.660
13 HB VAL 512 HB VAL 512 -30.576 6.601 7.020
14 HG11 VAL 512 HG11 VAL 512 -28.144 6.937 7.823
15 HG12 VAL 512 HG12 VAL 512 -27.787 7.131 6.104
16 HG13 VAL 512 HG13 VAL 512 -28.498 5.632 6.690
17 HG21 VAL 512 HG21 VAL 512 -31.020 8.972 7.188
18 HG22 VAL 512 HG22 VAL 512 -29.333 9.342 6.825
19 HG23 VAL 512 HG23 VAL 512 -29.753 8.518 8.328
20 H GLU 513 HN GLU 513 -31.861 5.661 4.381
21 HA GLU 513 HA GLU 513 -30.329 3.366 4.299
22 HB2 GLU 513 HB2 GLU 513 -32.822 3.955 2.724
23 HB3 GLU 513 HB1 GLU 513 -32.178 2.377 3.118
24 HG2 GLU 513 HG2 GLU 513 -32.461 2.963 5.535
25 HG3 GLU 513 HG1 GLU 513 -33.342 4.393 4.999
26 H THR 514 HN THR 514 -30.905 5.728 1.730
27 HA THR 514 HA THR 514 -29.748 4.085 -0.311
28 HB THR 514 HB THR 514 -29.723 6.236 -1.633
29 HG1 THR 514 HG1 THR 514 -30.450 8.051 -0.722
30 HG21 THR 514 HG21 THR 514 -32.136 6.284 -1.906
31 HG22 THR 514 HG22 THR 514 -32.346 5.449 -0.369
32 HG23 THR 514 HG23 THR 514 -31.574 4.625 -1.724
33 H CYS 515 HN CYS 515 -28.661 6.938 1.499
34 HA CYS 515 HA CYS 515 -26.098 7.118 0.392
35 HB2 CYS 515 HB2 CYS 515 -27.040 8.944 1.671
36 HB3 CYS 515 HB1 CYS 515 -27.096 7.945 3.126
37 HG CYS 515 HG CYS 515 -24.868 8.871 3.994
38 H MET 516 HN MET 516 -27.324 5.260 3.127
39 HA MET 516 HA MET 516 -24.850 4.373 4.108
40 HB2 MET 516 HB2 MET 516 -26.993 4.152 5.321
41 HB3 MET 516 HB1 MET 516 -27.502 2.925 4.171
42 HG2 MET 516 HG2 MET 516 -25.655 1.492 4.880
43 HG3 MET 516 HG1 MET 516 -25.143 2.725 6.032
44 HE1 MET 516 HE1 MET 516 -26.570 3.449 8.162
45 HE2 MET 516 HE2 MET 516 -28.173 2.807 8.518
46 HE3 MET 516 HE3 MET 516 -27.923 3.816 7.093
47 H SER 517 HN SER 517 -26.864 3.206 1.468
48 HA SER 517 HA SER 517 -25.469 0.751 1.102
49 HB2 SER 517 HB2 SER 517 -27.809 1.294 0.272
50 HB3 SER 517 HB1 SER 517 -27.049 2.250 -0.998
51 HG SER 517 HG SER 517 -26.871 -0.543 -0.541
52 H LEU 518 HN LEU 518 -25.306 3.918 -0.562
53 HA LEU 518 HA LEU 518 -23.188 3.124 -2.242
54 HB2 LEU 518 HB2 LEU 518 -22.845 5.610 -2.587
55 HB3 LEU 518 HB1 LEU 518 -24.380 4.928 -3.072
56 HG LEU 518 HG LEU 518 -25.130 5.799 -0.683
57 HD11 LEU 518 HD11 LEU 518 -22.638 7.331 -1.289
58 HD12 LEU 518 HD12 LEU 518 -23.219 6.685 0.253
59 HD13 LEU 518 HD13 LEU 518 -23.982 8.108 -0.455
60 HD21 LEU 518 HD21 LEU 518 -26.099 6.463 -2.813
61 HD22 LEU 518 HD22 LEU 518 -24.758 7.577 -3.088
62 HD23 LEU 518 HD23 LEU 518 -25.880 7.860 -1.756
63 H ALA 519 HN ALA 519 -23.238 4.778 0.863
64 HA ALA 519 HA ALA 519 -20.493 5.385 0.975
65 HB1 ALA 519 HB1 ALA 519 -20.852 5.647 3.403
66 HB2 ALA 519 HB2 ALA 519 -22.461 4.947 3.212
67 HB3 ALA 519 HB3 ALA 519 -22.067 6.477 2.431
68 H SER 520 HN SER 520 -22.289 2.515 2.072
69 HA SER 520 HA SER 520 -20.041 1.278 3.289
70 HB2 SER 520 HB2 SER 520 -21.398 -0.812 3.148
71 HB3 SER 520 HB1 SER 520 -22.267 0.533 3.880
72 HG SER 520 HG SER 520 -23.552 0.668 2.173
73 H GLN 521 HN GLN 521 -21.382 1.219 0.028
74 HA GLN 521 HA GLN 521 -19.662 -0.707 -1.073
75 HB2 GLN 521 HB2 GLN 521 -21.657 0.180 -2.208
76 HB3 GLN 521 HB1 GLN 521 -20.853 1.727 -2.403
77 HG2 GLN 521 HG2 GLN 521 -19.160 0.668 -3.812
78 HG3 GLN 521 HG1 GLN 521 -19.985 -0.878 -3.618
79 HE21 GLN 521 HE21 GLN 521 -21.984 -1.202 -4.619
80 HE22 GLN 521 HE22 GLN 521 -22.518 -0.191 -5.919
81 H VAL 522 HN VAL 522 -19.352 2.807 -0.760
82 HA VAL 522 HA VAL 522 -16.772 3.083 -1.832
83 HB VAL 522 HB VAL 522 -18.113 4.700 0.345
84 HG11 VAL 522 HG11 VAL 522 -16.520 6.469 -0.222
85 HG12 VAL 522 HG12 VAL 522 -15.716 5.382 -1.350
86 HG13 VAL 522 HG13 VAL 522 -15.697 5.028 0.377
87 HG21 VAL 522 HG21 VAL 522 -18.621 6.279 -1.468
88 HG22 VAL 522 HG22 VAL 522 -19.375 4.707 -1.725
89 HG23 VAL 522 HG23 VAL 522 -17.928 5.148 -2.631
90 H VAL 523 HN VAL 523 -17.899 2.309 1.427
91 HA VAL 523 HA VAL 523 -15.434 2.404 2.739
92 HB VAL 523 HB VAL 523 -18.079 1.136 3.301
93 HG11 VAL 523 HG11 VAL 523 -15.568 0.591 4.867
94 HG12 VAL 523 HG12 VAL 523 -16.621 -0.576 4.064
95 HG13 VAL 523 HG13 VAL 523 -17.203 0.309 5.474
96 HG21 VAL 523 HG21 VAL 523 -17.945 2.577 5.282
97 HG22 VAL 523 HG22 VAL 523 -17.752 3.483 3.781
98 HG23 VAL 523 HG23 VAL 523 -16.343 3.107 4.772
99 H LYS 524 HN LYS 524 -17.095 -0.305 1.119
100 HA LYS 524 HA LYS 524 -15.152 -2.263 1.673
101 HB2 LYS 524 HB2 LYS 524 -17.313 -1.957 -0.333
102 HB3 LYS 524 HB1 LYS 524 -16.043 -3.111 -0.719
103 HG2 LYS 524 HG2 LYS 524 -17.720 -4.354 0.335
104 HG3 LYS 524 HG1 LYS 524 -16.481 -4.119 1.570
105 HD2 LYS 524 HD2 LYS 524 -17.795 -2.179 2.409
106 HD3 LYS 524 HD1 LYS 524 -19.069 -2.609 1.271
107 HE2 LYS 524 HE2 LYS 524 -19.185 -4.851 2.334
108 HE3 LYS 524 HE1 LYS 524 -18.027 -4.296 3.541
109 HZ1 LYS 524 HZ1 LYS 524 -19.614 -2.556 4.172
110 HZ2 LYS 524 HZ2 LYS 524 -20.257 -4.111 4.383
111 HZ3 LYS 524 HZ3 LYS 524 -20.730 -3.169 3.049
112 H LEU 525 HN LEU 525 -15.457 0.022 -1.014
113 HA LEU 525 HA LEU 525 -13.195 -0.863 -2.449
114 HB2 LEU 525 HB2 LEU 525 -14.909 1.558 -2.463
115 HB3 LEU 525 HB1 LEU 525 -13.330 1.699 -3.211
116 HG LEU 525 HG LEU 525 -13.844 0.065 -4.845
117 HD11 LEU 525 HD11 LEU 525 -16.217 -1.006 -4.722
118 HD12 LEU 525 HD12 LEU 525 -16.052 -0.680 -2.992
119 HD13 LEU 525 HD13 LEU 525 -14.876 -1.702 -3.815
120 HD21 LEU 525 HD21 LEU 525 -16.291 1.765 -4.393
121 HD22 LEU 525 HD22 LEU 525 -15.864 0.955 -5.901
122 HD23 LEU 525 HD23 LEU 525 -14.833 2.238 -5.268
123 H THR 526 HN THR 526 -13.620 1.691 -0.032
124 HA THR 526 HA THR 526 -10.996 2.674 -0.095
125 HB THR 526 HB THR 526 -13.395 2.969 1.576
126 HG1 THR 526 HG1 THR 526 -12.872 5.134 1.338
127 HG21 THR 526 HG21 THR 526 -11.920 2.310 3.333
128 HG22 THR 526 HG22 THR 526 -12.213 4.048 3.446
129 HG23 THR 526 HG23 THR 526 -10.683 3.448 2.797
130 H LYS 527 HN LYS 527 -12.549 0.053 1.640
131 HA LYS 527 HA LYS 527 -10.537 -0.574 3.476
132 HB2 LYS 527 HB2 LYS 527 -12.830 -1.563 3.433
133 HB3 LYS 527 HB1 LYS 527 -12.370 -2.495 2.018
134 HG2 LYS 527 HG2 LYS 527 -12.260 -3.900 3.948
135 HG3 LYS 527 HG1 LYS 527 -10.616 -3.599 3.377
136 HD2 LYS 527 HD2 LYS 527 -10.748 -3.436 5.808
137 HD3 LYS 527 HD1 LYS 527 -10.337 -1.877 5.093
138 HE2 LYS 527 HE2 LYS 527 -12.722 -1.229 5.259
139 HE3 LYS 527 HE1 LYS 527 -13.049 -2.753 6.082
140 HZ1 LYS 527 HZ1 LYS 527 -12.775 -1.020 7.688
141 HZ2 LYS 527 HZ2 LYS 527 -11.274 -0.573 7.033
142 HZ3 LYS 527 HZ3 LYS 527 -11.449 -2.072 7.803
143 H GLN 528 HN GLN 528 -11.084 -1.746 0.171
144 HA GLN 528 HA GLN 528 -8.775 -3.392 0.078
145 HB2 GLN 528 HB2 GLN 528 -10.377 -2.176 -2.175
146 HB3 GLN 528 HB1 GLN 528 -9.185 -3.455 -2.355
147 HG2 GLN 528 HG2 GLN 528 -10.543 -4.927 -0.967
148 HG3 GLN 528 HG1 GLN 528 -11.734 -3.644 -0.764
149 HE21 GLN 528 HE21 GLN 528 -10.379 -5.987 -2.928
150 HE22 GLN 528 HE22 GLN 528 -11.596 -5.856 -4.152
151 H LEU 529 HN LEU 529 -9.448 -0.085 -0.978
152 HA LEU 529 HA LEU 529 -7.043 0.413 -2.320
153 HB2 LEU 529 HB2 LEU 529 -8.839 2.292 -0.792
154 HB3 LEU 529 HB1 LEU 529 -7.540 2.812 -1.842
155 HG LEU 529 HG LEU 529 -9.918 1.207 -2.769
156 HD11 LEU 529 HD11 LEU 529 -9.405 4.147 -3.151
157 HD12 LEU 529 HD12 LEU 529 -10.446 3.490 -1.888
158 HD13 LEU 529 HD13 LEU 529 -10.849 3.231 -3.589
159 HD21 LEU 529 HD21 LEU 529 -7.895 0.957 -4.133
160 HD22 LEU 529 HD22 LEU 529 -7.795 2.712 -4.294
161 HD23 LEU 529 HD23 LEU 529 -9.160 1.839 -4.990
162 H LYS 530 HN LYS 530 -7.954 0.997 1.055
163 HA LYS 530 HA LYS 530 -5.517 2.098 1.891
164 HB2 LYS 530 HB2 LYS 530 -7.607 2.166 3.220
165 HB3 LYS 530 HB1 LYS 530 -7.440 0.444 3.537
166 HG2 LYS 530 HG2 LYS 530 -5.343 0.856 4.715
167 HG3 LYS 530 HG1 LYS 530 -5.493 2.583 4.382
168 HD2 LYS 530 HD2 LYS 530 -7.611 2.613 5.643
169 HD3 LYS 530 HD1 LYS 530 -7.387 0.903 6.021
170 HE2 LYS 530 HE2 LYS 530 -6.670 2.287 7.885
171 HE3 LYS 530 HE1 LYS 530 -5.291 1.448 7.180
172 HZ1 LYS 530 HZ1 LYS 530 -4.659 3.456 6.033
173 HZ2 LYS 530 HZ2 LYS 530 -4.826 3.793 7.687
174 HZ3 LYS 530 HZ3 LYS 530 -6.036 4.267 6.598
175 H GLU 531 HN GLU 531 -6.624 -1.275 1.835
176 HA GLU 531 HA GLU 531 -4.319 -2.353 3.059
177 HB2 GLU 531 HB2 GLU 531 -6.355 -3.623 1.228
178 HB3 GLU 531 HB1 GLU 531 -5.106 -4.518 2.083
179 HG2 GLU 531 HG2 GLU 531 -6.015 -3.757 4.218
180 HG3 GLU 531 HG1 GLU 531 -7.269 -2.861 3.362
181 H GLN 532 HN GLN 532 -5.154 -1.764 -0.326
182 HA GLN 532 HA GLN 532 -2.848 -2.944 -1.451
183 HB2 GLN 532 HB2 GLN 532 -4.823 -2.345 -2.778
184 HB3 GLN 532 HB1 GLN 532 -4.511 -0.641 -2.485
185 HG2 GLN 532 HG2 GLN 532 -2.383 -0.835 -3.680
186 HG3 GLN 532 HG1 GLN 532 -2.729 -2.536 -3.994
187 HE21 GLN 532 HE21 GLN 532 -4.363 -3.082 -5.438
188 HE22 GLN 532 HE22 GLN 532 -4.954 -1.946 -6.605
189 H THR 533 HN THR 533 -3.519 0.239 -0.145
190 HA THR 533 HA THR 533 -1.077 1.441 -0.984
191 HB THR 533 HB THR 533 -2.848 2.295 1.316
192 HG1 THR 533 HG1 THR 533 -4.089 2.187 -0.578
193 HG21 THR 533 HG21 THR 533 -0.580 3.331 1.151
194 HG22 THR 533 HG22 THR 533 -1.909 4.478 0.979
195 HG23 THR 533 HG23 THR 533 -1.026 3.931 -0.447
196 H VAL 534 HN VAL 534 -2.125 -0.028 2.110
197 HA VAL 534 HA VAL 534 0.233 0.644 3.489
198 HB VAL 534 HB VAL 534 -0.396 -1.066 5.157
199 HG11 VAL 534 HG11 VAL 534 -2.465 0.004 5.864
200 HG12 VAL 534 HG12 VAL 534 -2.667 0.700 4.257
201 HG13 VAL 534 HG13 VAL 534 -1.307 1.193 5.268
202 HG21 VAL 534 HG21 VAL 534 -2.469 -2.305 4.940
203 HG22 VAL 534 HG22 VAL 534 -1.363 -2.725 3.627
204 HG23 VAL 534 HG23 VAL 534 -2.720 -1.640 3.326
205 H GLU 535 HN GLU 535 -0.603 -2.270 1.623
206 HA GLU 535 HA GLU 535 1.824 -3.614 2.250
207 HB2 GLU 535 HB2 GLU 535 1.258 -5.102 0.383
208 HB3 GLU 535 HB1 GLU 535 -0.120 -4.856 1.444
209 HG2 GLU 535 HG2 GLU 535 -1.040 -3.235 -0.125
210 HG3 GLU 535 HG1 GLU 535 0.352 -3.466 -1.177
211 H ARG 536 HN ARG 536 0.852 -1.341 -0.234
212 HA ARG 536 HA ARG 536 3.201 -1.645 -1.809
213 HB2 ARG 536 HB2 ARG 536 1.218 -0.793 -2.842
214 HB3 ARG 536 HB1 ARG 536 1.104 0.519 -1.680
215 HG2 ARG 536 HG2 ARG 536 3.588 0.424 -3.260
216 HG3 ARG 536 HG1 ARG 536 2.111 0.782 -4.158
217 HD2 ARG 536 HD2 ARG 536 2.896 2.214 -1.633
218 HD3 ARG 536 HD1 ARG 536 3.354 2.783 -3.243
219 HE ARG 536 HE ARG 536 0.564 2.332 -3.117
220 HH11 ARG 536 HH11 ARG 536 3.047 4.559 -2.024
221 HH12 ARG 536 HH12 ARG 536 1.963 5.918 -1.929
222 HH21 ARG 536 HH21 ARG 536 -0.871 4.092 -2.957
223 HH22 ARG 536 HH22 ARG 536 -0.281 5.640 -2.436
224 H VAL 537 HN VAL 537 2.234 0.725 0.674
225 HA VAL 537 HA VAL 537 4.608 2.258 0.479
226 HB VAL 537 HB VAL 537 4.058 3.228 2.645
227 HG11 VAL 537 HG11 VAL 537 1.843 4.118 2.101
228 HG12 VAL 537 HG12 VAL 537 1.631 2.831 0.915
229 HG13 VAL 537 HG13 VAL 537 2.886 4.048 0.677
230 HG21 VAL 537 HG21 VAL 537 2.296 2.477 4.045
231 HG22 VAL 537 HG22 VAL 537 3.274 1.052 3.670
232 HG23 VAL 537 HG23 VAL 537 1.740 1.320 2.839
233 H THR 538 HN THR 538 3.689 -0.500 2.441
234 HA THR 538 HA THR 538 5.995 -0.705 4.012
235 HB THR 538 HB THR 538 4.098 -2.818 2.993
236 HG1 THR 538 HG1 THR 538 2.950 -1.748 4.436
237 HG21 THR 538 HG21 THR 538 6.243 -3.831 3.550
238 HG22 THR 538 HG22 THR 538 5.003 -4.299 4.710
239 HG23 THR 538 HG23 THR 538 6.204 -3.077 5.140
240 H LEU 539 HN LEU 539 5.263 -2.006 0.782
241 HA LEU 539 HA LEU 539 7.679 -3.426 0.476
242 HB2 LEU 539 HB2 LEU 539 5.730 -3.945 -0.846
243 HB3 LEU 539 HB1 LEU 539 5.681 -2.324 -1.498
244 HG LEU 539 HG LEU 539 6.516 -4.215 -3.005
245 HD11 LEU 539 HD11 LEU 539 8.515 -2.028 -2.887
246 HD12 LEU 539 HD12 LEU 539 6.819 -1.615 -3.123
247 HD13 LEU 539 HD13 LEU 539 7.636 -2.686 -4.271
248 HD21 LEU 539 HD21 LEU 539 8.054 -5.228 -1.365
249 HD22 LEU 539 HD22 LEU 539 9.034 -3.762 -1.411
250 HD23 LEU 539 HD23 LEU 539 8.874 -4.762 -2.856
251 H GLN 540 HN GLN 540 6.628 -0.185 -0.513
252 HA GLN 540 HA GLN 540 9.040 0.640 -1.686
253 HB2 GLN 540 HB2 GLN 540 6.959 2.279 -0.239
254 HB3 GLN 540 HB1 GLN 540 8.252 2.941 -1.225
255 HG2 GLN 540 HG2 GLN 540 6.159 1.056 -2.245
256 HG3 GLN 540 HG1 GLN 540 6.046 2.811 -2.355
257 HE21 GLN 540 HE21 GLN 540 7.584 -0.043 -3.563
258 HE22 GLN 540 HE22 GLN 540 8.365 0.699 -4.912
259 H ASN 541 HN ASN 541 7.965 0.562 1.645
260 HA ASN 541 HA ASN 541 10.086 2.040 2.799
261 HB2 ASN 541 HB2 ASN 541 7.889 1.341 3.904
262 HB3 ASN 541 HB1 ASN 541 8.603 -0.252 4.105
263 HD21 ASN 541 HD21 ASN 541 8.455 -0.101 6.333
264 HD22 ASN 541 HD22 ASN 541 9.533 0.897 7.259
265 H GLN 542 HN GLN 542 9.633 -1.414 2.159
266 HA GLN 542 HA GLN 542 12.155 -2.225 3.168
267 HB2 GLN 542 HB2 GLN 542 10.411 -3.551 1.080
268 HB3 GLN 542 HB1 GLN 542 11.777 -4.301 1.891
269 HG2 GLN 542 HG2 GLN 542 9.151 -3.467 3.083
270 HG3 GLN 542 HG1 GLN 542 9.815 -5.097 2.945
271 HE21 GLN 542 HE21 GLN 542 9.802 -2.156 4.731
272 HE22 GLN 542 HE22 GLN 542 10.811 -2.678 6.032
273 H LEU 543 HN LEU 543 10.994 -1.208 0.013
274 HA LEU 543 HA LEU 543 13.398 -1.685 -1.399
275 HB2 LEU 543 HB2 LEU 543 11.105 -1.324 -2.386
276 HB3 LEU 543 HB1 LEU 543 11.303 0.384 -2.048
277 HG LEU 543 HG LEU 543 13.393 -0.986 -3.675
278 HD11 LEU 543 HD11 LEU 543 10.718 -0.085 -4.747
279 HD12 LEU 543 HD12 LEU 543 11.282 -1.752 -4.648
280 HD13 LEU 543 HD13 LEU 543 12.098 -0.608 -5.712
281 HD21 LEU 543 HD21 LEU 543 13.400 1.216 -4.813
282 HD22 LEU 543 HD22 LEU 543 13.758 1.322 -3.089
283 HD23 LEU 543 HD23 LEU 543 12.159 1.769 -3.688
284 H GLN 544 HN GLN 544 12.210 1.029 0.484
285 HA GLN 544 HA GLN 544 14.195 2.890 -0.186
286 HB2 GLN 544 HB2 GLN 544 12.251 3.617 1.019
287 HB3 GLN 544 HB1 GLN 544 12.572 2.493 2.333
288 HG2 GLN 544 HG2 GLN 544 14.568 3.717 2.912
289 HG3 GLN 544 HG1 GLN 544 14.289 4.844 1.587
290 HE21 GLN 544 HE21 GLN 544 12.583 6.320 1.746
291 HE22 GLN 544 HE22 GLN 544 11.864 6.709 3.275
292 H GLN 545 HN GLN 545 14.025 0.493 2.428
293 HA GLN 545 HA GLN 545 16.616 0.908 3.432
294 HB2 GLN 545 HB2 GLN 545 14.575 -0.487 4.334
295 HB3 GLN 545 HB1 GLN 545 15.320 -1.798 3.434
296 HG2 GLN 545 HG2 GLN 545 16.862 -0.191 5.423
297 HG3 GLN 545 HG1 GLN 545 15.870 -1.561 5.910
298 HE21 GLN 545 HE21 GLN 545 16.401 -3.124 3.546
299 HE22 GLN 545 HE22 GLN 545 18.036 -3.674 3.673
300 H PHE 546 HN PHE 546 15.346 -1.005 0.789
301 HA PHE 546 HA PHE 546 17.652 -2.516 0.222
302 HB2 PHE 546 HB2 PHE 546 15.796 -3.417 -0.758
303 HB3 PHE 546 HB1 PHE 546 15.084 -1.842 -1.107
304 HD1 PHE 546 HD1 PHE 546 17.567 -4.330 -2.276
305 HD2 PHE 546 HD2 PHE 546 15.298 -0.852 -3.208
306 HE1 PHE 546 HE1 PHE 546 18.169 -4.576 -4.651
307 HE2 PHE 546 HE2 PHE 546 15.894 -1.084 -5.571
308 HZ PHE 546 HZ PHE 546 17.333 -2.950 -6.302
309 H LEU 547 HN LEU 547 16.454 0.529 -1.232
310 HA LEU 547 HA LEU 547 18.639 0.841 -2.970
311 HB2 LEU 547 HB2 LEU 547 17.833 3.029 -3.409
312 HB3 LEU 547 HB1 LEU 547 16.447 1.990 -3.178
313 HG LEU 547 HG LEU 547 16.566 2.954 -0.711
314 HD11 LEU 547 HD11 LEU 547 17.764 5.166 -2.373
315 HD12 LEU 547 HD12 LEU 547 18.589 4.274 -1.095
316 HD13 LEU 547 HD13 LEU 547 17.211 5.303 -0.703
317 HD21 LEU 547 HD21 LEU 547 14.935 4.644 -1.391
318 HD22 LEU 547 HD22 LEU 547 14.656 3.107 -2.210
319 HD23 LEU 547 HD23 LEU 547 15.425 4.438 -3.073
320 H GLU 548 HN GLU 548 18.080 1.943 0.325
321 HA GLU 548 HA GLU 548 20.455 3.434 0.572
322 HB2 GLU 548 HB2 GLU 548 18.724 2.080 2.632
323 HB3 GLU 548 HB1 GLU 548 20.149 3.016 3.062
324 HG2 GLU 548 HG2 GLU 548 19.127 4.961 1.870
325 HG3 GLU 548 HG1 GLU 548 17.664 3.997 1.684
326 H ALA 549 HN ALA 549 19.728 0.024 1.063
327 HA ALA 549 HA ALA 549 22.210 -0.743 2.144
328 HB1 ALA 549 HB1 ALA 549 21.636 -3.005 1.433
329 HB2 ALA 549 HB2 ALA 549 20.343 -2.368 0.417
330 HB3 ALA 549 HB3 ALA 549 20.248 -2.204 2.171
331 H GLN 550 HN GLN 550 21.073 -0.477 -1.202
332 HA GLN 550 HA GLN 550 23.356 -1.362 -2.539
333 HB2 GLN 550 HB2 GLN 550 21.469 0.869 -3.311
334 HB3 GLN 550 HB1 GLN 550 22.633 0.120 -4.393
335 HG2 GLN 550 HG2 GLN 550 21.460 -2.048 -4.018
336 HG3 GLN 550 HG1 GLN 550 20.235 -1.146 -3.119
337 HE21 GLN 550 HE21 GLN 550 20.094 -2.675 -5.655
338 HE22 GLN 550 HE22 GLN 550 19.461 -1.567 -6.825
339 H LYS 551 HN LYS 551 22.547 1.778 -1.204
340 HA LYS 551 HA LYS 551 24.822 3.195 -2.076
341 HB2 LYS 551 HB2 LYS 551 23.140 3.598 0.396
342 HB3 LYS 551 HB1 LYS 551 24.296 4.760 -0.231
343 HG2 LYS 551 HG2 LYS 551 21.851 3.791 -1.693
344 HG3 LYS 551 HG1 LYS 551 21.970 5.309 -0.800
345 HD2 LYS 551 HD2 LYS 551 23.830 5.984 -2.283
346 HD3 LYS 551 HD1 LYS 551 23.598 4.499 -3.208
347 HE2 LYS 551 HE2 LYS 551 21.320 5.189 -3.751
348 HE3 LYS 551 HE1 LYS 551 21.538 6.668 -2.813
349 HZ1 LYS 551 HZ1 LYS 551 23.373 7.250 -4.338
350 HZ2 LYS 551 HZ2 LYS 551 21.868 7.159 -5.107
351 HZ3 LYS 551 HZ3 LYS 551 22.990 5.896 -5.288
352 H SER 552 HN SER 552 24.145 1.489 0.962
353 HA SER 552 HA SER 552 26.594 1.957 2.208
354 HB2 SER 552 HB2 SER 552 24.823 -0.483 2.484
355 HB3 SER 552 HB1 SER 552 26.013 0.082 3.656
356 HG SER 552 HG SER 552 24.632 1.511 4.359
357 H GLU 553 HN GLU 553 25.570 -0.795 0.201
358 HA GLU 553 HA GLU 553 27.984 -2.212 0.306
359 HB2 GLU 553 HB2 GLU 553 25.924 -2.129 -1.900
360 HB3 GLU 553 HB1 GLU 553 27.184 -3.344 -1.739
361 HG2 GLU 553 HG2 GLU 553 25.086 -2.833 0.344
362 HG3 GLU 553 HG1 GLU 553 24.926 -4.037 -0.932
363 H GLY 554 HN GLY 554 26.877 0.343 -1.856
364 HA2 GLY 554 HA2 GLY 554 29.121 0.144 -3.631
365 HA3 GLY 554 HA1 GLY 554 27.918 1.423 -3.608
366 H LYS 555 HN LYS 555 28.269 2.278 -0.931
367 HA LYS 555 HA LYS 555 30.558 3.957 -1.268
368 HB2 LYS 555 HB2 LYS 555 29.890 5.031 0.747
369 HB3 LYS 555 HB1 LYS 555 28.412 4.609 -0.100
370 HG2 LYS 555 HG2 LYS 555 28.250 2.585 1.344
371 HG3 LYS 555 HG1 LYS 555 29.616 3.208 2.270
372 HD2 LYS 555 HD2 LYS 555 28.311 5.257 2.734
373 HD3 LYS 555 HD1 LYS 555 26.935 4.541 1.893
374 HE2 LYS 555 HE2 LYS 555 27.021 2.644 3.499
375 HE3 LYS 555 HE1 LYS 555 28.278 3.505 4.387
376 HZ1 LYS 555 HZ1 LYS 555 26.121 3.864 5.377
377 HZ2 LYS 555 HZ2 LYS 555 25.506 4.463 3.917
378 HZ3 LYS 555 HZ3 LYS 555 26.714 5.323 4.744
379 H SER 556 HN SER 556 30.027 0.894 0.180
380 HA SER 556 HA SER 556 32.200 0.985 2.034
381 HB2 SER 556 HB2 SER 556 30.255 -0.573 2.271
382 HB3 SER 556 HB1 SER 556 30.843 -1.462 0.866
383 HG SER 556 HG SER 556 31.495 -1.944 3.301
384 H LEU 557 HN LEU 557 33.844 1.812 0.717
385 HA LEU 557 HA LEU 557 35.603 -0.190 -0.233
386 HB2 LEU 557 HB2 LEU 557 34.120 0.053 -2.237
387 HB3 LEU 557 HB1 LEU 557 34.561 1.749 -2.313
388 HG LEU 557 HG LEU 557 36.907 1.121 -2.719
389 HD11 LEU 557 HD11 LEU 557 35.849 -1.699 -2.780
390 HD12 LEU 557 HD12 LEU 557 36.908 -1.020 -1.545
391 HD13 LEU 557 HD13 LEU 557 37.486 -1.192 -3.203
392 HD21 LEU 557 HD21 LEU 557 35.443 1.532 -4.611
393 HD22 LEU 557 HD22 LEU 557 34.918 -0.151 -4.595
394 HD23 LEU 557 HD23 LEU 557 36.589 0.246 -4.989
Start of MODEL 15
1 H1 GLY 510 HT1 GLY 510 -39.269 2.859 -4.695
2 H2 GLY 510 HT2 GLY 510 -38.597 3.914 -3.549
3 H3 GLY 510 HT3 GLY 510 -39.806 2.816 -3.087
4 HA2 GLY 510 HA1 GLY 510 -37.620 2.077 -2.361
5 HA3 GLY 510 HA2 GLY 510 -38.356 0.960 -3.503
6 H SER 511 HN SER 511 -36.562 0.096 -4.396
7 HA SER 511 HA SER 511 -34.723 -0.117 -5.694
8 HB2 SER 511 HB2 SER 511 -35.566 2.582 -6.782
9 HB3 SER 511 HB1 SER 511 -34.430 1.472 -7.549
10 HG SER 511 HG SER 511 -37.211 1.131 -7.121
11 H VAL 512 HN VAL 512 -34.327 0.827 -3.123
12 HA VAL 512 HA VAL 512 -32.178 2.810 -3.345
13 HB VAL 512 HB VAL 512 -33.561 1.630 -0.924
14 HG11 VAL 512 HG11 VAL 512 -32.235 3.483 0.275
15 HG12 VAL 512 HG12 VAL 512 -31.172 3.430 -1.136
16 HG13 VAL 512 HG13 VAL 512 -31.395 1.992 -0.146
17 HG21 VAL 512 HG21 VAL 512 -34.903 3.259 -2.129
18 HG22 VAL 512 HG22 VAL 512 -33.573 4.414 -2.080
19 HG23 VAL 512 HG23 VAL 512 -34.367 3.923 -0.585
20 H GLU 513 HN GLU 513 -32.862 -0.528 -2.647
21 HA GLU 513 HA GLU 513 -30.471 -1.314 -1.465
22 HB2 GLU 513 HB2 GLU 513 -32.445 -2.693 -1.472
23 HB3 GLU 513 HB1 GLU 513 -32.396 -2.830 -3.223
24 HG2 GLU 513 HG2 GLU 513 -30.304 -4.050 -3.064
25 HG3 GLU 513 HG1 GLU 513 -30.353 -3.926 -1.306
26 H THR 514 HN THR 514 -31.296 -0.761 -4.821
27 HA THR 514 HA THR 514 -29.112 -2.098 -5.998
28 HB THR 514 HB THR 514 -29.609 -0.510 -7.945
29 HG1 THR 514 HG1 THR 514 -31.194 0.924 -7.703
30 HG21 THR 514 HG21 THR 514 -31.853 -2.180 -6.835
31 HG22 THR 514 HG22 THR 514 -30.510 -2.782 -7.802
32 HG23 THR 514 HG23 THR 514 -31.681 -1.670 -8.511
33 H CYS 515 HN CYS 515 -29.586 1.349 -5.176
34 HA CYS 515 HA CYS 515 -26.908 2.014 -5.958
35 HB2 CYS 515 HB2 CYS 515 -27.497 4.238 -4.842
36 HB3 CYS 515 HB1 CYS 515 -28.444 3.758 -6.250
37 HG CYS 515 HG CYS 515 -29.416 4.280 -3.090
38 H MET 516 HN MET 516 -28.510 1.158 -2.974
39 HA MET 516 HA MET 516 -26.420 1.851 -1.215
40 HB2 MET 516 HB2 MET 516 -28.670 1.259 -0.449
41 HB3 MET 516 HB1 MET 516 -28.434 -0.390 -0.993
42 HG2 MET 516 HG2 MET 516 -26.569 0.816 0.999
43 HG3 MET 516 HG1 MET 516 -28.136 0.200 1.503
44 HE1 MET 516 HE1 MET 516 -25.611 -2.553 2.709
45 HE2 MET 516 HE2 MET 516 -26.885 -1.434 3.196
46 HE3 MET 516 HE3 MET 516 -25.328 -0.812 2.650
47 H SER 517 HN SER 517 -27.010 -0.976 -3.218
48 HA SER 517 HA SER 517 -24.967 -2.610 -2.158
49 HB2 SER 517 HB2 SER 517 -26.914 -3.408 -3.505
50 HB3 SER 517 HB1 SER 517 -26.161 -2.707 -4.936
51 HG SER 517 HG SER 517 -25.802 -5.097 -4.074
52 H LEU 518 HN LEU 518 -25.019 -0.447 -5.003
53 HA LEU 518 HA LEU 518 -22.389 -1.087 -5.782
54 HB2 LEU 518 HB2 LEU 518 -22.507 1.062 -7.094
55 HB3 LEU 518 HB1 LEU 518 -23.684 -0.171 -7.483
56 HG LEU 518 HG LEU 518 -25.214 1.236 -5.862
57 HD11 LEU 518 HD11 LEU 518 -23.104 3.210 -6.699
58 HD12 LEU 518 HD12 LEU 518 -23.663 2.838 -5.064
59 HD13 LEU 518 HD13 LEU 518 -24.725 3.677 -6.194
60 HD21 LEU 518 HD21 LEU 518 -26.025 2.486 -7.792
61 HD22 LEU 518 HD22 LEU 518 -25.643 0.820 -8.227
62 HD23 LEU 518 HD23 LEU 518 -24.534 2.121 -8.661
63 H ALA 519 HN ALA 519 -23.694 1.401 -3.692
64 HA ALA 519 HA ALA 519 -21.321 2.868 -3.335
65 HB1 ALA 519 HB1 ALA 519 -22.427 3.722 -1.280
66 HB2 ALA 519 HB2 ALA 519 -23.720 2.555 -1.552
67 HB3 ALA 519 HB3 ALA 519 -23.423 3.828 -2.732
68 H SER 520 HN SER 520 -22.682 0.148 -1.464
69 HA SER 520 HA SER 520 -20.602 0.099 0.464
70 HB2 SER 520 HB2 SER 520 -21.419 -2.234 0.907
71 HB3 SER 520 HB1 SER 520 -22.677 -1.001 0.973
72 HG SER 520 HG SER 520 -23.542 -2.565 -0.260
73 H GLN 521 HN GLN 521 -21.012 -1.423 -2.695
74 HA GLN 521 HA GLN 521 -18.742 -3.073 -2.636
75 HB2 GLN 521 HB2 GLN 521 -20.457 -3.200 -4.392
76 HB3 GLN 521 HB1 GLN 521 -19.936 -1.643 -5.017
77 HG2 GLN 521 HG2 GLN 521 -17.649 -2.706 -5.317
78 HG3 GLN 521 HG1 GLN 521 -18.458 -4.246 -5.036
79 HE21 GLN 521 HE21 GLN 521 -18.037 -5.000 -7.107
80 HE22 GLN 521 HE22 GLN 521 -18.859 -4.372 -8.499
81 H VAL 522 HN VAL 522 -19.145 0.291 -3.720
82 HA VAL 522 HA VAL 522 -16.486 0.817 -4.412
83 HB VAL 522 HB VAL 522 -18.547 2.717 -3.261
84 HG11 VAL 522 HG11 VAL 522 -16.296 3.632 -3.010
85 HG12 VAL 522 HG12 VAL 522 -17.193 4.507 -4.249
86 HG13 VAL 522 HG13 VAL 522 -15.969 3.327 -4.715
87 HG21 VAL 522 HG21 VAL 522 -19.270 1.670 -5.328
88 HG22 VAL 522 HG22 VAL 522 -17.750 2.110 -6.108
89 HG23 VAL 522 HG23 VAL 522 -18.883 3.368 -5.611
90 H VAL 523 HN VAL 523 -18.140 0.974 -1.309
91 HA VAL 523 HA VAL 523 -16.047 1.990 0.243
92 HB VAL 523 HB VAL 523 -18.527 0.412 0.765
93 HG11 VAL 523 HG11 VAL 523 -16.302 0.747 2.751
94 HG12 VAL 523 HG12 VAL 523 -17.134 -0.730 2.256
95 HG13 VAL 523 HG13 VAL 523 -17.982 0.475 3.221
96 HG21 VAL 523 HG21 VAL 523 -19.033 2.324 2.203
97 HG22 VAL 523 HG22 VAL 523 -18.628 2.833 0.563
98 HG23 VAL 523 HG23 VAL 523 -17.442 3.005 1.858
99 H LYS 524 HN LYS 524 -16.849 -1.322 -0.731
100 HA LYS 524 HA LYS 524 -14.760 -2.596 0.692
101 HB2 LYS 524 HB2 LYS 524 -16.635 -3.336 -1.454
102 HB3 LYS 524 HB1 LYS 524 -15.137 -4.257 -1.417
103 HG2 LYS 524 HG2 LYS 524 -16.756 -5.443 -0.154
104 HG3 LYS 524 HG1 LYS 524 -15.608 -4.740 0.988
105 HD2 LYS 524 HD2 LYS 524 -17.197 -2.846 1.294
106 HD3 LYS 524 HD1 LYS 524 -18.358 -3.726 0.304
107 HE2 LYS 524 HE2 LYS 524 -17.156 -4.708 2.889
108 HE3 LYS 524 HE1 LYS 524 -18.784 -4.061 2.686
109 HZ1 LYS 524 HZ1 LYS 524 -17.717 -6.520 1.395
110 HZ2 LYS 524 HZ2 LYS 524 -19.272 -5.883 1.162
111 HZ3 LYS 524 HZ3 LYS 524 -18.817 -6.465 2.688
112 H LEU 525 HN LEU 525 -14.954 -1.328 -2.626
113 HA LEU 525 HA LEU 525 -12.360 -2.074 -3.421
114 HB2 LEU 525 HB2 LEU 525 -14.308 -0.010 -4.338
115 HB3 LEU 525 HB1 LEU 525 -12.647 0.133 -4.877
116 HG LEU 525 HG LEU 525 -12.798 -2.176 -5.802
117 HD11 LEU 525 HD11 LEU 525 -15.756 -1.927 -5.371
118 HD12 LEU 525 HD12 LEU 525 -14.702 -2.819 -4.279
119 HD13 LEU 525 HD13 LEU 525 -14.850 -3.320 -5.967
120 HD21 LEU 525 HD21 LEU 525 -14.774 -0.143 -6.815
121 HD22 LEU 525 HD22 LEU 525 -14.207 -1.541 -7.727
122 HD23 LEU 525 HD23 LEU 525 -13.072 -0.277 -7.256
123 H THR 526 HN THR 526 -13.571 0.701 -1.648
124 HA THR 526 HA THR 526 -11.166 2.164 -1.583
125 HB THR 526 HB THR 526 -13.805 2.246 -0.301
126 HG1 THR 526 HG1 THR 526 -13.738 3.960 -1.503
127 HG21 THR 526 HG21 THR 526 -12.510 2.144 1.717
128 HG22 THR 526 HG22 THR 526 -13.135 3.781 1.494
129 HG23 THR 526 HG23 THR 526 -11.439 3.427 1.148
130 H LYS 527 HN LYS 527 -12.521 -0.380 0.442
131 HA LYS 527 HA LYS 527 -10.546 -0.352 2.460
132 HB2 LYS 527 HB2 LYS 527 -12.720 -1.536 2.655
133 HB3 LYS 527 HB1 LYS 527 -12.180 -2.692 1.446
134 HG2 LYS 527 HG2 LYS 527 -11.919 -3.678 3.601
135 HG3 LYS 527 HG1 LYS 527 -10.313 -3.313 2.964
136 HD2 LYS 527 HD2 LYS 527 -10.423 -2.682 5.294
137 HD3 LYS 527 HD1 LYS 527 -10.291 -1.232 4.297
138 HE2 LYS 527 HE2 LYS 527 -12.737 -0.944 4.460
139 HE3 LYS 527 HE1 LYS 527 -12.813 -2.346 5.528
140 HZ1 LYS 527 HZ1 LYS 527 -11.313 -1.138 7.061
141 HZ2 LYS 527 HZ2 LYS 527 -12.810 -0.371 6.840
142 HZ3 LYS 527 HZ3 LYS 527 -11.433 0.228 6.056
143 H GLN 528 HN GLN 528 -10.841 -2.119 -0.597
144 HA GLN 528 HA GLN 528 -8.474 -3.619 -0.382
145 HB2 GLN 528 HB2 GLN 528 -9.891 -2.618 -2.859
146 HB3 GLN 528 HB1 GLN 528 -8.622 -3.833 -2.851
147 HG2 GLN 528 HG2 GLN 528 -11.331 -4.072 -1.560
148 HG3 GLN 528 HG1 GLN 528 -10.796 -4.871 -3.037
149 HE21 GLN 528 HE21 GLN 528 -11.791 -6.055 -0.596
150 HE22 GLN 528 HE22 GLN 528 -10.541 -7.089 0.003
151 H LEU 529 HN LEU 529 -9.107 -0.413 -1.748
152 HA LEU 529 HA LEU 529 -6.522 0.148 -2.690
153 HB2 LEU 529 HB2 LEU 529 -8.621 1.992 -1.550
154 HB3 LEU 529 HB1 LEU 529 -7.188 2.532 -2.396
155 HG LEU 529 HG LEU 529 -9.342 0.812 -3.626
156 HD11 LEU 529 HD11 LEU 529 -8.826 3.749 -4.037
157 HD12 LEU 529 HD12 LEU 529 -10.048 3.108 -2.940
158 HD13 LEU 529 HD13 LEU 529 -10.164 2.787 -4.672
159 HD21 LEU 529 HD21 LEU 529 -7.139 0.546 -4.657
160 HD22 LEU 529 HD22 LEU 529 -7.007 2.296 -4.836
161 HD23 LEU 529 HD23 LEU 529 -8.242 1.409 -5.732
162 H LYS 530 HN LYS 530 -8.041 0.752 0.442
163 HA LYS 530 HA LYS 530 -5.905 1.963 1.756
164 HB2 LYS 530 HB2 LYS 530 -8.181 1.807 2.683
165 HB3 LYS 530 HB1 LYS 530 -7.974 0.077 2.908
166 HG2 LYS 530 HG2 LYS 530 -6.080 0.579 4.448
167 HG3 LYS 530 HG1 LYS 530 -6.500 2.288 4.316
168 HD2 LYS 530 HD2 LYS 530 -8.760 1.768 5.151
169 HD3 LYS 530 HD1 LYS 530 -8.281 0.080 5.342
170 HE2 LYS 530 HE2 LYS 530 -8.128 1.179 7.473
171 HE3 LYS 530 HE1 LYS 530 -6.499 0.816 6.903
172 HZ1 LYS 530 HZ1 LYS 530 -6.697 3.052 7.842
173 HZ2 LYS 530 HZ2 LYS 530 -7.840 3.458 6.658
174 HZ3 LYS 530 HZ3 LYS 530 -6.245 3.099 6.208
175 H GLU 531 HN GLU 531 -6.737 -1.497 1.549
176 HA GLU 531 HA GLU 531 -4.542 -2.408 3.065
177 HB2 GLU 531 HB2 GLU 531 -6.197 -3.814 0.967
178 HB3 GLU 531 HB1 GLU 531 -5.017 -4.618 1.993
179 HG2 GLU 531 HG2 GLU 531 -6.305 -3.846 3.971
180 HG3 GLU 531 HG1 GLU 531 -7.534 -3.225 2.869
181 H GLN 532 HN GLN 532 -4.980 -1.920 -0.405
182 HA GLN 532 HA GLN 532 -2.522 -2.971 -1.264
183 HB2 GLN 532 HB2 GLN 532 -4.360 -2.419 -2.795
184 HB3 GLN 532 HB1 GLN 532 -4.137 -0.708 -2.458
185 HG2 GLN 532 HG2 GLN 532 -1.771 -1.005 -3.328
186 HG3 GLN 532 HG1 GLN 532 -2.307 -2.573 -3.931
187 HE21 GLN 532 HE21 GLN 532 -2.024 -2.023 -6.072
188 HE22 GLN 532 HE22 GLN 532 -3.058 -0.900 -6.890
189 H THR 533 HN THR 533 -3.438 0.218 -0.091
190 HA THR 533 HA THR 533 -0.974 1.485 -0.707
191 HB THR 533 HB THR 533 -3.031 2.320 1.346
192 HG1 THR 533 HG1 THR 533 -4.009 2.175 -0.682
193 HG21 THR 533 HG21 THR 533 -0.760 3.415 1.442
194 HG22 THR 533 HG22 THR 533 -2.110 4.513 1.159
195 HG23 THR 533 HG23 THR 533 -1.070 4.030 -0.181
196 H VAL 534 HN VAL 534 -2.252 0.017 2.301
197 HA VAL 534 HA VAL 534 -0.095 0.871 3.906
198 HB VAL 534 HB VAL 534 -0.795 -0.827 5.552
199 HG11 VAL 534 HG11 VAL 534 -3.010 0.100 5.980
200 HG12 VAL 534 HG12 VAL 534 -3.074 0.727 4.334
201 HG13 VAL 534 HG13 VAL 534 -1.883 1.359 5.472
202 HG21 VAL 534 HG21 VAL 534 -2.714 -2.245 5.155
203 HG22 VAL 534 HG22 VAL 534 -1.458 -2.589 3.962
204 HG23 VAL 534 HG23 VAL 534 -2.864 -1.625 3.511
205 H GLU 535 HN GLU 535 -0.580 -2.151 2.080
206 HA GLU 535 HA GLU 535 1.915 -3.243 2.934
207 HB2 GLU 535 HB2 GLU 535 1.600 -4.859 1.095
208 HB3 GLU 535 HB1 GLU 535 0.199 -4.741 2.149
209 HG2 GLU 535 HG2 GLU 535 -1.028 -3.543 0.545
210 HG3 GLU 535 HG1 GLU 535 0.407 -3.237 -0.435
211 H ARG 536 HN ARG 536 0.887 -1.176 0.296
212 HA ARG 536 HA ARG 536 3.255 -1.391 -1.235
213 HB2 ARG 536 HB2 ARG 536 1.209 -0.575 -2.237
214 HB3 ARG 536 HB1 ARG 536 1.189 0.804 -1.146
215 HG2 ARG 536 HG2 ARG 536 3.663 0.599 -2.666
216 HG3 ARG 536 HG1 ARG 536 2.230 0.763 -3.685
217 HD2 ARG 536 HD2 ARG 536 2.804 2.538 -1.334
218 HD3 ARG 536 HD1 ARG 536 3.324 2.919 -2.976
219 HE ARG 536 HE ARG 536 0.655 2.435 -3.233
220 HH11 ARG 536 HH11 ARG 536 2.549 4.602 -1.214
221 HH12 ARG 536 HH12 ARG 536 1.292 5.805 -1.120
222 HH21 ARG 536 HH21 ARG 536 -0.964 4.022 -3.149
223 HH22 ARG 536 HH22 ARG 536 -0.700 5.492 -2.261
224 H VAL 537 HN VAL 537 2.230 1.003 1.220
225 HA VAL 537 HA VAL 537 4.593 2.544 1.080
226 HB VAL 537 HB VAL 537 4.036 3.440 3.284
227 HG11 VAL 537 HG11 VAL 537 1.810 4.315 2.760
228 HG12 VAL 537 HG12 VAL 537 1.616 3.053 1.541
229 HG13 VAL 537 HG13 VAL 537 2.853 4.295 1.338
230 HG21 VAL 537 HG21 VAL 537 2.289 2.625 4.658
231 HG22 VAL 537 HG22 VAL 537 3.273 1.218 4.230
232 HG23 VAL 537 HG23 VAL 537 1.736 1.509 3.412
233 H THR 538 HN THR 538 3.720 -0.274 2.999
234 HA THR 538 HA THR 538 6.098 -0.492 4.479
235 HB THR 538 HB THR 538 4.190 -2.634 3.540
236 HG1 THR 538 HG1 THR 538 2.966 -1.490 4.856
237 HG21 THR 538 HG21 THR 538 6.277 -3.630 4.238
238 HG22 THR 538 HG22 THR 538 5.043 -3.937 5.459
239 HG23 THR 538 HG23 THR 538 6.266 -2.693 5.731
240 H LEU 539 HN LEU 539 5.167 -1.678 1.287
241 HA LEU 539 HA LEU 539 7.509 -3.153 0.748
242 HB2 LEU 539 HB2 LEU 539 5.501 -3.579 -0.475
243 HB3 LEU 539 HB1 LEU 539 5.363 -1.909 -0.967
244 HG LEU 539 HG LEU 539 6.037 -3.608 -2.728
245 HD11 LEU 539 HD11 LEU 539 8.041 -1.412 -2.535
246 HD12 LEU 539 HD12 LEU 539 6.326 -1.048 -2.698
247 HD13 LEU 539 HD13 LEU 539 7.148 -2.000 -3.940
248 HD21 LEU 539 HD21 LEU 539 7.683 -4.841 -1.407
249 HD22 LEU 539 HD22 LEU 539 8.694 -3.396 -1.317
250 HD23 LEU 539 HD23 LEU 539 8.402 -4.174 -2.874
251 H GLN 540 HN GLN 540 6.528 0.191 0.054
252 HA GLN 540 HA GLN 540 8.860 0.996 -1.283
253 HB2 GLN 540 HB2 GLN 540 7.011 2.628 0.457
254 HB3 GLN 540 HB1 GLN 540 8.232 3.290 -0.621
255 HG2 GLN 540 HG2 GLN 540 5.942 1.569 -1.508
256 HG3 GLN 540 HG1 GLN 540 5.931 3.331 -1.540
257 HE21 GLN 540 HE21 GLN 540 8.772 3.445 -2.298
258 HE22 GLN 540 HE22 GLN 540 8.822 3.013 -3.971
259 H ASN 541 HN ASN 541 8.094 0.781 2.131
260 HA ASN 541 HA ASN 541 10.426 1.992 3.155
261 HB2 ASN 541 HB2 ASN 541 8.280 1.345 4.394
262 HB3 ASN 541 HB1 ASN 541 8.923 -0.290 4.447
263 HD21 ASN 541 HD21 ASN 541 8.267 1.618 6.574
264 HD22 ASN 541 HD22 ASN 541 9.712 1.793 7.515
265 H GLN 542 HN GLN 542 9.654 -1.363 2.299
266 HA GLN 542 HA GLN 542 12.199 -2.437 2.918
267 HB2 GLN 542 HB2 GLN 542 10.149 -3.395 0.912
268 HB3 GLN 542 HB1 GLN 542 11.522 -4.330 1.484
269 HG2 GLN 542 HG2 GLN 542 10.600 -4.224 3.770
270 HG3 GLN 542 HG1 GLN 542 9.198 -3.363 3.132
271 HE21 GLN 542 HE21 GLN 542 9.162 -4.929 0.677
272 HE22 GLN 542 HE22 GLN 542 8.510 -6.475 1.102
273 H LEU 543 HN LEU 543 10.807 -1.010 0.018
274 HA LEU 543 HA LEU 543 12.997 -1.517 -1.702
275 HB2 LEU 543 HB2 LEU 543 10.640 -0.891 -2.365
276 HB3 LEU 543 HB1 LEU 543 11.022 0.756 -1.908
277 HG LEU 543 HG LEU 543 12.763 -0.610 -3.913
278 HD11 LEU 543 HD11 LEU 543 10.054 0.586 -4.489
279 HD12 LEU 543 HD12 LEU 543 10.530 -1.099 -4.710
280 HD13 LEU 543 HD13 LEU 543 11.257 0.160 -5.707
281 HD21 LEU 543 HD21 LEU 543 12.863 1.692 -4.822
282 HD22 LEU 543 HD22 LEU 543 13.427 1.581 -3.155
283 HD23 LEU 543 HD23 LEU 543 11.822 2.228 -3.502
284 H GLN 544 HN GLN 544 12.239 1.056 0.560
285 HA GLN 544 HA GLN 544 14.302 2.832 -0.090
286 HB2 GLN 544 HB2 GLN 544 12.558 3.529 1.400
287 HB3 GLN 544 HB1 GLN 544 12.907 2.217 2.518
288 HG2 GLN 544 HG2 GLN 544 15.001 3.222 3.109
289 HG3 GLN 544 HG1 GLN 544 14.777 4.493 1.908
290 HE21 GLN 544 HE21 GLN 544 13.795 3.261 4.999
291 HE22 GLN 544 HE22 GLN 544 12.957 4.676 5.524
292 H GLN 545 HN GLN 545 14.192 0.077 2.138
293 HA GLN 545 HA GLN 545 16.914 0.158 2.897
294 HB2 GLN 545 HB2 GLN 545 15.001 -2.179 2.752
295 HB3 GLN 545 HB1 GLN 545 16.571 -2.222 3.533
296 HG2 GLN 545 HG2 GLN 545 15.870 -0.625 5.165
297 HG3 GLN 545 HG1 GLN 545 14.342 -0.369 4.324
298 HE21 GLN 545 HE21 GLN 545 12.725 -1.894 4.491
299 HE22 GLN 545 HE22 GLN 545 12.761 -3.187 5.643
300 H PHE 546 HN PHE 546 15.209 -1.230 0.194
301 HA PHE 546 HA PHE 546 17.283 -2.835 -0.836
302 HB2 PHE 546 HB2 PHE 546 15.254 -3.451 -1.694
303 HB3 PHE 546 HB1 PHE 546 14.663 -1.791 -1.775
304 HD1 PHE 546 HD1 PHE 546 16.914 -4.221 -3.460
305 HD2 PHE 546 HD2 PHE 546 14.649 -0.636 -3.758
306 HE1 PHE 546 HE1 PHE 546 17.274 -4.198 -5.894
307 HE2 PHE 546 HE2 PHE 546 15.004 -0.598 -6.181
308 HZ PHE 546 HZ PHE 546 16.317 -2.386 -7.260
309 H LEU 547 HN LEU 547 16.206 0.457 -1.762
310 HA LEU 547 HA LEU 547 18.250 0.850 -3.645
311 HB2 LEU 547 HB2 LEU 547 17.623 3.147 -3.677
312 HB3 LEU 547 HB1 LEU 547 16.174 2.184 -3.505
313 HG LEU 547 HG LEU 547 16.550 2.732 -0.929
314 HD11 LEU 547 HD11 LEU 547 17.769 5.099 -2.347
315 HD12 LEU 547 HD12 LEU 547 18.626 3.972 -1.296
316 HD13 LEU 547 HD13 LEU 547 17.364 5.008 -0.632
317 HD21 LEU 547 HD21 LEU 547 15.321 4.589 -2.963
318 HD22 LEU 547 HD22 LEU 547 15.015 4.636 -1.227
319 HD23 LEU 547 HD23 LEU 547 14.535 3.224 -2.169
320 H GLU 548 HN GLU 548 18.075 1.566 -0.197
321 HA GLU 548 HA GLU 548 20.575 2.794 0.076
322 HB2 GLU 548 HB2 GLU 548 18.877 1.226 1.997
323 HB3 GLU 548 HB1 GLU 548 20.432 1.894 2.476
324 HG2 GLU 548 HG2 GLU 548 18.115 3.485 1.400
325 HG3 GLU 548 HG1 GLU 548 18.557 3.340 3.101
326 H ALA 549 HN ALA 549 19.656 -0.605 0.059
327 HA ALA 549 HA ALA 549 22.176 -1.683 0.664
328 HB1 ALA 549 HB1 ALA 549 21.385 -3.730 -0.368
329 HB2 ALA 549 HB2 ALA 549 20.068 -2.855 -1.145
330 HB3 ALA 549 HB3 ALA 549 20.103 -3.015 0.609
331 H GLN 550 HN GLN 550 20.673 -0.859 -2.459
332 HA GLN 550 HA GLN 550 22.788 -1.575 -4.141
333 HB2 GLN 550 HB2 GLN 550 20.898 0.755 -4.513
334 HB3 GLN 550 HB1 GLN 550 21.843 -0.024 -5.773
335 HG2 GLN 550 HG2 GLN 550 20.583 -2.106 -5.382
336 HG3 GLN 550 HG1 GLN 550 19.602 -1.250 -4.191
337 HE21 GLN 550 HE21 GLN 550 18.191 0.358 -4.880
338 HE22 GLN 550 HE22 GLN 550 17.658 0.476 -6.524
339 H LYS 551 HN LYS 551 22.156 1.444 -2.402
340 HA LYS 551 HA LYS 551 24.351 2.946 -3.244
341 HB2 LYS 551 HB2 LYS 551 23.220 2.798 -0.445
342 HB3 LYS 551 HB1 LYS 551 24.225 4.091 -1.075
343 HG2 LYS 551 HG2 LYS 551 21.504 3.384 -2.149
344 HG3 LYS 551 HG1 LYS 551 21.805 4.627 -0.934
345 HD2 LYS 551 HD2 LYS 551 23.293 5.780 -2.545
346 HD3 LYS 551 HD1 LYS 551 22.864 4.569 -3.756
347 HE2 LYS 551 HE2 LYS 551 20.524 5.220 -3.601
348 HE3 LYS 551 HE1 LYS 551 20.922 6.405 -2.359
349 HZ1 LYS 551 HZ1 LYS 551 21.936 6.442 -5.151
350 HZ2 LYS 551 HZ2 LYS 551 22.244 7.610 -3.962
351 HZ3 LYS 551 HZ3 LYS 551 20.671 7.402 -4.557
352 H SER 552 HN SER 552 24.130 0.981 -0.312
353 HA SER 552 HA SER 552 26.741 1.028 0.487
354 HB2 SER 552 HB2 SER 552 24.871 -1.337 0.705
355 HB3 SER 552 HB1 SER 552 26.259 -0.994 1.741
356 HG SER 552 HG SER 552 23.800 0.397 1.547
357 H GLU 553 HN GLU 553 25.300 -1.088 -1.949
358 HA GLU 553 HA GLU 553 27.484 -2.815 -2.297
359 HB2 GLU 553 HB2 GLU 553 25.396 -1.958 -4.298
360 HB3 GLU 553 HB1 GLU 553 26.479 -3.328 -4.493
361 HG2 GLU 553 HG2 GLU 553 24.467 -3.024 -2.287
362 HG3 GLU 553 HG1 GLU 553 24.220 -3.969 -3.754
363 H GLY 554 HN GLY 554 26.472 -0.182 -4.478
364 HA2 GLY 554 HA2 GLY 554 28.877 -0.198 -5.974
365 HA3 GLY 554 HA1 GLY 554 27.650 1.058 -6.010
366 H LYS 555 HN LYS 555 27.858 1.588 -3.152
367 HA LYS 555 HA LYS 555 29.905 3.531 -3.140
368 HB2 LYS 555 HB2 LYS 555 27.951 3.841 -1.813
369 HB3 LYS 555 HB1 LYS 555 28.186 2.312 -0.986
370 HG2 LYS 555 HG2 LYS 555 30.163 3.215 0.118
371 HG3 LYS 555 HG1 LYS 555 29.909 4.761 -0.700
372 HD2 LYS 555 HD2 LYS 555 27.896 3.432 1.116
373 HD3 LYS 555 HD1 LYS 555 29.013 4.703 1.626
374 HE2 LYS 555 HE2 LYS 555 26.928 4.956 -0.543
375 HE3 LYS 555 HE1 LYS 555 26.775 5.579 1.099
376 HZ1 LYS 555 HZ1 LYS 555 27.445 7.336 -0.349
377 HZ2 LYS 555 HZ2 LYS 555 28.753 6.430 -0.948
378 HZ3 LYS 555 HZ3 LYS 555 28.753 6.960 0.664
379 H SER 556 HN SER 556 29.768 0.218 -1.961
380 HA SER 556 HA SER 556 32.208 0.466 -0.455
381 HB2 SER 556 HB2 SER 556 30.262 -1.056 0.131
382 HB3 SER 556 HB1 SER 556 30.773 -2.081 -1.209
383 HG SER 556 HG SER 556 32.474 -1.307 0.929
384 H LEU 557 HN LEU 557 31.196 -1.190 -3.445
385 HA LEU 557 HA LEU 557 34.024 -1.205 -4.226
386 HB2 LEU 557 HB2 LEU 557 33.557 -3.333 -5.492
387 HB3 LEU 557 HB1 LEU 557 33.633 -3.473 -3.750
388 HG LEU 557 HG LEU 557 30.968 -3.193 -5.098
389 HD11 LEU 557 HD11 LEU 557 32.123 -4.977 -6.302
390 HD12 LEU 557 HD12 LEU 557 30.844 -5.629 -5.280
391 HD13 LEU 557 HD13 LEU 557 32.527 -5.756 -4.773
392 HD21 LEU 557 HD21 LEU 557 31.076 -3.053 -2.661
393 HD22 LEU 557 HD22 LEU 557 31.912 -4.605 -2.601
394 HD23 LEU 557 HD23 LEU 557 30.244 -4.523 -3.171