NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
637016 |
6czt   |
30450 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H GLN 38 1H GLN 38 -0.642 -0.555 -0.978
2 HA GLN 38 HA GLN 38 1.503 -0.496 0.018
3 HB2 GLN 38 1HB GLN 38 1.321 -1.301 -2.284
4 HB3 GLN 38 2HB GLN 38 1.352 0.343 -2.905
5 HG2 GLN 38 1HG GLN 38 3.496 -0.641 -3.245
6 HG3 GLN 38 2HG GLN 38 3.653 0.600 -1.969
7 HE21 GLN 38 1HE2 GLN 38 5.138 -1.595 0.247
8 HE22 GLN 38 2HE2 GLN 38 4.934 0.014 -0.361
9 H ALA 39 H ALA 39 2.648 0.775 1.266
10 HA ALA 39 HA ALA 39 2.664 3.649 0.952
11 HB1 ALA 39 1HB ALA 39 4.298 3.603 2.809
12 HB2 ALA 39 2HB ALA 39 2.872 2.599 3.161
13 HB3 ALA 39 3HB ALA 39 4.399 1.833 2.666
14 HA PRO 40 HA PRO 40 5.958 4.052 -1.840
15 HB2 PRO 40 1HB PRO 40 6.747 6.631 -1.319
16 HB3 PRO 40 2HB PRO 40 5.215 6.257 -2.118
17 HG2 PRO 40 1HG PRO 40 5.739 6.854 0.825
18 HG3 PRO 40 2HG PRO 40 4.495 7.539 -0.225
19 HD2 PRO 40 1HD PRO 40 3.940 5.468 1.454
20 HD3 PRO 40 2HD PRO 40 3.164 5.591 -0.175
21 H LYS 41 H LYS 41 8.180 3.810 -1.920
22 HA LYS 41 HA LYS 41 9.530 3.012 0.475
23 HB2 LYS 41 1HB LYS 41 10.078 2.148 -1.799
24 HB3 LYS 41 2HB LYS 41 10.705 3.730 -2.242
25 HG2 LYS 41 1HG LYS 41 12.483 3.544 -0.593
26 HG3 LYS 41 2HG LYS 41 11.814 2.017 0.001
27 HD2 LYS 41 1HD LYS 41 12.222 0.954 -2.166
28 HD3 LYS 41 2HD LYS 41 12.790 2.487 -2.840
29 HE2 LYS 41 1HE LYS 41 14.690 1.075 -2.231
30 HE3 LYS 41 2HE LYS 41 14.652 2.515 -1.210
31 HZ1 LYS 41 1HZ LYS 41 15.080 0.544 0.062
32 HZ2 LYS 41 2HZ LYS 41 13.634 1.195 0.514
33 HZ3 LYS 41 3HZ LYS 41 13.672 -0.152 -0.438
34 H GLY 42 H GLY 42 10.802 4.030 1.872
35 HA2 GLY 42 1HA GLY 42 12.394 5.827 2.393
36 HA3 GLY 42 2HA GLY 42 11.526 6.874 1.287
37 H SER 43 H SER 43 8.940 5.585 2.408
38 HA SER 43 HA SER 43 8.432 7.633 4.387
39 HB2 SER 43 1HB SER 43 6.213 6.686 4.509
40 HB3 SER 43 2HB SER 43 6.711 6.746 2.825
41 HG SER 43 HG SER 43 6.988 4.643 2.789
42 H ALA 44 H ALA 44 7.510 7.165 6.539
43 HA ALA 44 HA ALA 44 8.638 4.735 7.801
44 HB1 ALA 44 1HB ALA 44 9.672 6.075 9.605
45 HB2 ALA 44 2HB ALA 44 10.401 6.429 8.020
46 HB3 ALA 44 3HB ALA 44 9.235 7.566 8.738
47 H PHE 45 H PHE 45 7.744 4.198 9.827
48 HA PHE 45 HA PHE 45 5.093 5.512 10.262
49 HB2 PHE 45 1HB PHE 45 5.831 2.566 10.475
50 HB3 PHE 45 2HB PHE 45 4.288 3.241 10.973
51 HD1 PHE 45 HD1 PHE 45 6.508 2.712 8.052
52 HD2 PHE 45 HD2 PHE 45 2.571 3.653 9.414
53 HE1 PHE 45 HE1 PHE 45 5.648 2.439 5.750
54 HE2 PHE 45 HE2 PHE 45 1.706 3.379 7.114
55 HZ PHE 45 HZ PHE 45 3.247 2.773 5.281
56 H VAL 46 H VAL 46 4.331 5.725 12.349
57 HA VAL 46 HA VAL 46 6.017 4.722 14.561
58 HB VAL 46 HB VAL 46 6.907 6.985 14.055
59 HG11 VAL 46 1HG1 VAL 46 5.504 8.963 14.382
60 HG12 VAL 46 2HG1 VAL 46 4.924 7.951 13.040
61 HG13 VAL 46 3HG1 VAL 46 4.083 7.917 14.608
62 HG21 VAL 46 1HG2 VAL 46 6.638 7.922 16.329
63 HG22 VAL 46 2HG2 VAL 46 5.254 6.838 16.609
64 HG23 VAL 46 3HG2 VAL 46 6.884 6.161 16.384
65 H ARG 47 H ARG 47 4.855 4.074 16.259
66 HA ARG 47 HA ARG 47 1.932 4.596 16.178
67 HB2 ARG 47 1HB ARG 47 2.558 2.255 16.294
68 HB3 ARG 47 2HB ARG 47 3.592 2.549 17.684
69 HG2 ARG 47 1HG ARG 47 1.730 2.939 19.113
70 HG3 ARG 47 2HG ARG 47 0.606 3.020 17.735
71 HD2 ARG 47 1HD ARG 47 2.218 0.583 18.439
72 HD3 ARG 47 2HD ARG 47 0.568 0.894 19.027
73 HE ARG 47 HE ARG 47 0.499 1.181 16.252
74 HH11 ARG 47 1HH1 ARG 47 1.196 -1.346 18.589
75 HH12 ARG 47 2HH1 ARG 47 0.657 -2.639 17.540
76 HH21 ARG 47 1HH2 ARG 47 -0.197 -0.505 14.900
77 HH22 ARG 47 2HH2 ARG 47 -0.132 -2.163 15.452
78 H ALA 48 H ALA 48 1.120 6.139 17.404
79 HA ALA 48 HA ALA 48 2.575 7.064 19.786
80 HB1 ALA 48 1HB ALA 48 0.762 8.740 19.942
81 HB2 ALA 48 2HB ALA 48 1.503 8.719 18.324
82 HB3 ALA 48 3HB ALA 48 -0.078 7.947 18.589
83 H TYR 49 H TYR 49 2.517 5.404 21.246
84 HA TYR 49 HA TYR 49 -0.090 4.193 21.912
85 HB2 TYR 49 1HB TYR 49 1.884 2.729 21.695
86 HB3 TYR 49 2HB TYR 49 2.717 3.633 22.952
87 HD1 TYR 49 HD1 TYR 49 -0.165 1.402 22.272
88 HD2 TYR 49 HD2 TYR 49 2.340 3.207 25.250
89 HE1 TYR 49 HE1 TYR 49 -1.128 -0.093 23.989
90 HE2 TYR 49 HE2 TYR 49 1.378 1.712 26.966
91 HH TYR 49 HH TYR 49 -1.131 -0.669 26.135
92 H ASN 50 H ASN 50 -1.354 4.812 23.492
93 HA ASN 50 HA ASN 50 -0.315 6.833 25.399
94 HB2 ASN 50 1HB ASN 50 -2.402 7.313 24.136
95 HB3 ASN 50 2HB ASN 50 -3.160 5.912 24.880
96 HD21 ASN 50 1HD2 ASN 50 -4.121 8.947 26.766
97 HD22 ASN 50 2HD2 ASN 50 -4.257 8.408 25.125
98 H ALA 51 H ALA 51 0.693 5.950 27.060
99 HA ALA 51 HA ALA 51 -0.362 3.452 28.223
100 HB1 ALA 51 1HB ALA 51 1.711 3.485 29.574
101 HB2 ALA 51 2HB ALA 51 2.056 3.622 27.834
102 HB3 ALA 51 3HB ALA 51 2.133 5.064 28.873
103 H GLY 52 H GLY 52 -1.174 6.567 28.522
104 HA2 GLY 52 1HA GLY 52 -1.368 6.555 31.498
105 HA3 GLY 52 2HA GLY 52 -1.546 7.961 30.467
106 H ASN 53 H ASN 53 -3.490 8.034 32.042
107 HA ASN 53 HA ASN 53 -5.752 6.439 30.909
108 HB2 ASN 53 1HB ASN 53 -5.363 7.626 33.675
109 HB3 ASN 53 2HB ASN 53 -6.880 6.940 33.108
110 HD21 ASN 53 1HD2 ASN 53 -4.190 4.570 34.743
111 HD22 ASN 53 2HD2 ASN 53 -4.275 6.291 34.916
112 H SER 54 H SER 54 -4.626 8.952 29.859
113 HA SER 54 HA SER 54 -7.226 10.316 29.638
114 HB2 SER 54 1HB SER 54 -6.370 12.510 30.169
115 HB3 SER 54 2HB SER 54 -6.076 11.445 31.534
116 HG SER 54 HG SER 54 -4.297 12.399 29.601
117 H GLU 55 H GLU 55 -7.343 11.794 27.854
118 HA GLU 55 HA GLU 55 -6.022 10.817 25.526
119 HB2 GLU 55 1HB GLU 55 -7.534 13.411 26.024
120 HB3 GLU 55 2HB GLU 55 -6.988 12.889 24.437
121 HG2 GLU 55 1HG GLU 55 -9.162 12.176 24.423
122 HG3 GLU 55 2HG GLU 55 -8.334 10.717 24.960
123 H LEU 56 H LEU 56 -4.251 11.397 24.434
124 HA LEU 56 HA LEU 56 -2.609 13.581 25.643
125 HB2 LEU 56 1HB LEU 56 -1.692 11.093 24.158
126 HB3 LEU 56 2HB LEU 56 -0.637 12.351 24.809
127 HG LEU 56 HG LEU 56 -2.403 10.490 26.440
128 HD11 LEU 56 1HD1 LEU 56 -0.264 9.525 27.158
129 HD12 LEU 56 2HD1 LEU 56 -0.501 9.365 25.402
130 HD13 LEU 56 3HD1 LEU 56 0.601 10.608 26.042
131 HD21 LEU 56 1HD2 LEU 56 -1.232 11.499 28.368
132 HD22 LEU 56 2HD2 LEU 56 -0.380 12.611 27.270
133 HD23 LEU 56 3HD2 LEU 56 -2.146 12.727 27.461
134 H ASP 57 H ASP 57 -1.668 15.094 24.359
135 HA ASP 57 HA ASP 57 -2.819 15.338 21.662
136 HB2 ASP 57 1HB ASP 57 -2.773 17.295 23.188
137 HB3 ASP 57 2HB ASP 57 -1.016 17.222 23.237
138 H VAL 58 H VAL 58 -1.868 14.272 20.072
139 HA VAL 58 HA VAL 58 1.039 13.748 20.233
140 HB VAL 58 HB VAL 58 -1.071 12.706 18.295
141 HG11 VAL 58 1HG1 VAL 58 0.621 11.057 17.659
142 HG12 VAL 58 2HG1 VAL 58 1.141 12.719 17.296
143 HG13 VAL 58 3HG1 VAL 58 1.805 11.868 18.711
144 HG21 VAL 58 1HG2 VAL 58 -0.864 10.612 19.598
145 HG22 VAL 58 2HG2 VAL 58 0.271 11.417 20.708
146 HG23 VAL 58 3HG2 VAL 58 -1.423 11.955 20.623
147 H SER 59 H SER 59 2.514 14.777 19.066
148 HA SER 59 HA SER 59 1.869 15.727 16.377
149 HB2 SER 59 1HB SER 59 1.132 17.642 17.714
150 HB3 SER 59 2HB SER 59 2.673 17.682 18.557
151 HG SER 59 HG SER 59 2.638 17.752 15.780
152 H VAL 60 H VAL 60 3.501 15.102 15.172
153 HA VAL 60 HA VAL 60 6.164 14.797 16.478
154 HB VAL 60 HB VAL 60 5.034 13.500 13.960
155 HG11 VAL 60 1HG1 VAL 60 7.057 12.124 13.991
156 HG12 VAL 60 2HG1 VAL 60 7.428 13.850 13.770
157 HG13 VAL 60 3HG1 VAL 60 7.685 13.081 15.354
158 HG21 VAL 60 1HG2 VAL 60 5.080 11.437 15.325
159 HG22 VAL 60 2HG2 VAL 60 5.642 12.379 16.726
160 HG23 VAL 60 3HG2 VAL 60 4.020 12.667 16.052
161 H GLY 61 H GLY 61 7.652 16.253 16.029
162 HA2 GLY 61 1HA GLY 61 9.026 17.644 14.759
163 HA3 GLY 61 2HA GLY 61 8.205 17.095 13.310
164 H SER 62 H SER 62 7.009 18.552 12.262
165 HA SER 62 HA SER 62 5.969 20.884 13.820
166 HB2 SER 62 1HB SER 62 6.091 22.164 11.736
167 HB3 SER 62 2HB SER 62 7.666 21.517 12.166
168 HG SER 62 HG SER 62 5.916 20.120 10.491
169 H THR 63 H THR 63 4.928 18.053 12.825
170 HA THR 63 HA THR 63 2.465 19.059 11.483
171 HB THR 63 HB THR 63 3.582 16.230 11.694
172 HG1 THR 63 HG1 THR 63 4.593 16.802 9.937
173 HG21 THR 63 1HG2 THR 63 1.780 15.642 10.121
174 HG22 THR 63 2HG2 THR 63 1.112 16.260 11.650
175 HG23 THR 63 3HG2 THR 63 1.152 17.303 10.210
176 H SER 64 H SER 64 0.649 19.236 12.568
177 HA SER 64 HA SER 64 0.383 18.077 15.242
178 HB2 SER 64 1HB SER 64 -0.563 20.266 14.827
179 HB3 SER 64 2HB SER 64 -1.507 19.661 13.475
180 HG SER 64 HG SER 64 -1.966 18.167 15.616
181 H LEU 65 H LEU 65 -0.474 16.194 15.765
182 HA LEU 65 HA LEU 65 -1.841 14.674 13.585
183 HB2 LEU 65 1HB LEU 65 -0.209 13.621 15.924
184 HB3 LEU 65 2HB LEU 65 -0.993 12.636 14.685
185 HG LEU 65 HG LEU 65 1.265 14.606 14.176
186 HD11 LEU 65 1HD1 LEU 65 2.632 12.590 13.871
187 HD12 LEU 65 2HD1 LEU 65 1.983 12.700 15.524
188 HD13 LEU 65 3HD1 LEU 65 1.249 11.579 14.352
189 HD21 LEU 65 1HD2 LEU 65 1.313 13.527 11.953
190 HD22 LEU 65 2HD2 LEU 65 -0.090 12.530 12.406
191 HD23 LEU 65 3HD2 LEU 65 -0.264 14.295 12.258
192 H ASN 66 H ASN 66 -3.080 12.708 14.657
193 HA ASN 66 HA ASN 66 -5.259 14.029 16.068
194 HB2 ASN 66 1HB ASN 66 -4.851 11.157 15.173
195 HB3 ASN 66 2HB ASN 66 -6.319 11.750 15.938
196 HD21 ASN 66 1HD2 ASN 66 -6.392 11.842 12.133
197 HD22 ASN 66 2HD2 ASN 66 -5.784 10.652 13.234
198 H ASP 67 H ASP 67 -6.095 13.610 18.076
199 HA ASP 67 HA ASP 67 -4.168 12.925 20.112
200 HB2 ASP 67 1HB ASP 67 -7.177 13.369 20.226
201 HB3 ASP 67 2HB ASP 67 -6.179 13.091 21.646
202 H VAL 68 H VAL 68 -4.314 11.237 21.671
203 HA VAL 68 HA VAL 68 -5.504 8.753 20.508
204 HB VAL 68 HB VAL 68 -3.017 9.075 22.243
205 HG11 VAL 68 1HG1 VAL 68 -2.692 6.677 21.886
206 HG12 VAL 68 2HG1 VAL 68 -4.198 7.020 22.770
207 HG13 VAL 68 3HG1 VAL 68 -4.256 6.591 21.043
208 HG21 VAL 68 1HG2 VAL 68 -1.829 8.296 20.217
209 HG22 VAL 68 2HG2 VAL 68 -3.371 8.267 19.327
210 HG23 VAL 68 3HG2 VAL 68 -2.706 9.814 19.906
211 H ALA 69 H ALA 69 -6.794 7.511 21.735
212 HA ALA 69 HA ALA 69 -7.916 8.749 24.089
213 HB1 ALA 69 1HB ALA 69 -9.383 6.758 24.150
214 HB2 ALA 69 2HB ALA 69 -9.306 7.473 22.522
215 HB3 ALA 69 3HB ALA 69 -8.385 5.996 22.889
216 HA PRO 70 HA PRO 70 -5.783 7.095 27.460
217 HB2 PRO 70 1HB PRO 70 -8.441 5.923 28.372
218 HB3 PRO 70 2HB PRO 70 -7.270 6.870 29.298
219 HG2 PRO 70 1HG PRO 70 -9.449 8.102 28.403
220 HG3 PRO 70 2HG PRO 70 -7.891 8.921 28.257
221 HD2 PRO 70 1HD PRO 70 -9.471 7.411 26.140
222 HD3 PRO 70 2HD PRO 70 -8.568 8.971 25.992
223 H LEU 71 H LEU 71 -4.590 5.283 27.718
224 HA LEU 71 HA LEU 71 -3.828 3.136 27.364
225 HB2 LEU 71 1HB LEU 71 -6.733 2.433 27.917
226 HB3 LEU 71 2HB LEU 71 -5.358 1.330 28.025
227 HG LEU 71 HG LEU 71 -5.830 3.751 29.800
228 HD11 LEU 71 1HD1 LEU 71 -6.251 2.068 31.537
229 HD12 LEU 71 2HD1 LEU 71 -7.418 1.939 30.199
230 HD13 LEU 71 3HD1 LEU 71 -6.077 0.775 30.325
231 HD21 LEU 71 1HD2 LEU 71 -3.912 2.853 31.074
232 HD22 LEU 71 2HD2 LEU 71 -3.704 1.570 29.856
233 HD23 LEU 71 3HD2 LEU 71 -3.435 3.273 29.411
234 H GLY 72 H GLY 72 -4.703 4.601 25.025
235 HA2 GLY 72 1HA GLY 72 -5.406 2.265 23.278
236 HA3 GLY 72 2HA GLY 72 -5.973 3.892 22.955
237 H SER 73 H SER 73 -4.919 3.493 20.844
238 HA SER 73 HA SER 73 -2.323 4.797 20.820
239 HB2 SER 73 1HB SER 73 -1.060 3.053 19.739
240 HB3 SER 73 2HB SER 73 -1.691 2.423 21.254
241 HG SER 73 HG SER 73 -2.820 2.081 18.697
242 H SER 74 H SER 74 -1.605 5.351 18.674
243 HA SER 74 HA SER 74 -3.507 4.789 16.479
244 HB2 SER 74 1HB SER 74 -4.329 6.876 17.482
245 HB3 SER 74 2HB SER 74 -2.730 7.592 17.348
246 HG SER 74 HG SER 74 -2.959 7.014 15.043
247 H ASP 75 H ASP 75 -2.504 4.395 14.632
248 HA ASP 75 HA ASP 75 0.421 4.723 14.556
249 HB2 ASP 75 1HB ASP 75 -1.560 3.352 12.702
250 HB3 ASP 75 2HB ASP 75 0.159 3.467 12.353
251 H PHE 76 H PHE 76 1.531 6.156 13.401
252 HA PHE 76 HA PHE 76 0.050 7.700 11.317
253 HB2 PHE 76 1HB PHE 76 2.109 8.808 13.268
254 HB3 PHE 76 2HB PHE 76 1.357 9.705 11.958
255 HD1 PHE 76 HD1 PHE 76 1.054 8.578 15.358
256 HD2 PHE 76 HD2 PHE 76 -1.138 10.095 12.020
257 HE1 PHE 76 HE1 PHE 76 -0.792 9.227 16.868
258 HE2 PHE 76 HE2 PHE 76 -2.985 10.748 13.527
259 HZ PHE 76 HZ PHE 76 -2.812 10.312 15.952
260 H LYS 77 H LYS 77 1.462 8.723 9.706
261 HA LYS 77 HA LYS 77 4.051 7.325 9.337
262 HB2 LYS 77 1HB LYS 77 3.489 6.614 7.077
263 HB3 LYS 77 2HB LYS 77 2.337 5.922 8.210
264 HG2 LYS 77 1HG LYS 77 0.702 7.690 7.601
265 HG3 LYS 77 2HG LYS 77 1.859 8.321 6.420
266 HD2 LYS 77 1HD LYS 77 1.856 6.122 5.262
267 HD3 LYS 77 2HD LYS 77 0.662 5.525 6.425
268 HE2 LYS 77 1HE LYS 77 -0.913 7.299 5.707
269 HE3 LYS 77 2HE LYS 77 0.273 7.874 4.533
270 HZ1 LYS 77 1HZ LYS 77 -1.337 6.433 3.524
271 HZ2 LYS 77 2HZ LYS 77 0.155 5.735 3.452
272 HZ3 LYS 77 3HZ LYS 77 -0.955 5.198 4.547
273 H PHE 78 H PHE 78 5.532 8.376 8.058
274 HA PHE 78 HA PHE 78 4.646 10.960 6.860
275 HB2 PHE 78 1HB PHE 78 7.147 10.495 8.533
276 HB3 PHE 78 2HB PHE 78 6.846 11.942 7.584
277 HD1 PHE 78 HD1 PHE 78 5.955 10.070 10.590
278 HD2 PHE 78 HD2 PHE 78 5.121 13.541 8.243
279 HE1 PHE 78 HE1 PHE 78 4.731 11.061 12.495
280 HE2 PHE 78 HE2 PHE 78 3.898 14.538 10.147
281 HZ PHE 78 HZ PHE 78 3.702 13.296 12.274
282 H LEU 79 H LEU 79 5.505 11.479 4.921
283 HA LEU 79 HA LEU 79 6.760 9.358 3.413
284 HB2 LEU 79 1HB LEU 79 5.219 10.924 2.352
285 HB3 LEU 79 2HB LEU 79 6.265 12.285 2.765
286 HG LEU 79 HG LEU 79 8.006 11.400 1.241
287 HD11 LEU 79 1HD1 LEU 79 7.456 9.536 -0.259
288 HD12 LEU 79 2HD1 LEU 79 7.466 9.027 1.446
289 HD13 LEU 79 3HD1 LEU 79 5.920 9.294 0.606
290 HD21 LEU 79 1HD2 LEU 79 6.783 11.881 -0.852
291 HD22 LEU 79 2HD2 LEU 79 5.236 11.671 0.004
292 HD23 LEU 79 3HD2 LEU 79 6.317 13.016 0.438
293 HA PRO 80 HA PRO 80 10.611 12.040 3.671
294 HB2 PRO 80 1HB PRO 80 10.739 14.318 5.107
295 HB3 PRO 80 2HB PRO 80 9.898 14.297 3.552
296 HG2 PRO 80 1HG PRO 80 8.726 14.088 6.361
297 HG3 PRO 80 2HG PRO 80 8.212 15.140 5.038
298 HD2 PRO 80 1HD PRO 80 7.015 12.707 5.572
299 HD3 PRO 80 2HD PRO 80 7.085 13.428 3.914
300 HA PRO 81 HA PRO 81 11.542 10.092 7.606
301 HB2 PRO 81 1HB PRO 81 13.965 9.062 6.923
302 HB3 PRO 81 2HB PRO 81 12.465 8.353 6.311
303 HG2 PRO 81 1HG PRO 81 14.345 10.324 4.942
304 HG3 PRO 81 2HG PRO 81 13.660 8.833 4.288
305 HD2 PRO 81 1HD PRO 81 12.545 11.293 3.796
306 HD3 PRO 81 2HD PRO 81 11.550 9.786 3.911
307 H GLY 82 H GLY 82 13.302 10.385 9.207
308 HA2 GLY 82 1HA GLY 82 15.577 11.747 9.296
309 HA3 GLY 82 2HA GLY 82 14.503 13.101 9.001
310 H SER 83 H SER 83 15.667 13.585 11.175
311 HA SER 83 HA SER 83 14.476 12.240 13.498
312 HB2 SER 83 1HB SER 83 16.793 12.927 13.640
313 HB3 SER 83 2HB SER 83 16.384 14.581 13.215
314 HG SER 83 HG SER 83 14.857 14.070 15.188
315 H TYR 84 H TYR 84 12.691 12.811 14.507
316 HA TYR 84 HA TYR 84 11.740 15.623 14.208
317 HB2 TYR 84 1HB TYR 84 10.023 13.111 14.060
318 HB3 TYR 84 2HB TYR 84 9.406 14.757 14.102
319 HD1 TYR 84 HD1 TYR 84 10.785 12.124 12.053
320 HD2 TYR 84 HD2 TYR 84 9.928 16.325 12.205
321 HE1 TYR 84 HE1 TYR 84 10.945 12.246 9.589
322 HE2 TYR 84 HE2 TYR 84 10.088 16.447 9.743
323 HH TYR 84 HH TYR 84 10.493 13.551 7.779
324 H THR 85 H THR 85 10.424 16.424 15.902
325 HA THR 85 HA THR 85 10.988 15.143 18.501
326 HB THR 85 HB THR 85 9.624 17.788 17.835
327 HG1 THR 85 HG1 THR 85 11.654 18.607 18.625
328 HG21 THR 85 1HG2 THR 85 9.917 18.277 20.231
329 HG22 THR 85 2HG2 THR 85 8.876 16.852 19.996
330 HG23 THR 85 3HG2 THR 85 10.572 16.643 20.489
331 H ALA 86 H ALA 86 9.715 13.436 18.869
332 HA ALA 86 HA ALA 86 6.915 13.491 17.990
333 HB1 ALA 86 1HB ALA 86 6.874 11.150 18.787
334 HB2 ALA 86 2HB ALA 86 8.235 11.446 17.680
335 HB3 ALA 86 3HB ALA 86 8.518 11.350 19.434
336 H GLN 87 H GLN 87 6.119 15.172 19.316
337 HA GLN 87 HA GLN 87 6.056 14.770 22.212
338 HB2 GLN 87 1HB GLN 87 6.065 17.045 21.210
339 HB3 GLN 87 2HB GLN 87 4.516 16.717 20.448
340 HG2 GLN 87 1HG GLN 87 3.441 16.516 22.617
341 HG3 GLN 87 2HG GLN 87 5.013 16.748 23.432
342 HE21 GLN 87 1HE2 GLN 87 3.509 20.025 23.651
343 HE22 GLN 87 2HE2 GLN 87 3.423 18.461 24.389
344 H VAL 88 H VAL 88 4.720 13.523 23.287
345 HA VAL 88 HA VAL 88 2.017 13.036 22.114
346 HB VAL 88 HB VAL 88 3.685 11.032 23.692
347 HG11 VAL 88 1HG1 VAL 88 1.917 9.445 23.105
348 HG12 VAL 88 2HG1 VAL 88 1.302 10.796 24.086
349 HG13 VAL 88 3HG1 VAL 88 0.997 10.758 22.332
350 HG21 VAL 88 1HG2 VAL 88 3.817 9.801 21.549
351 HG22 VAL 88 2HG2 VAL 88 2.960 11.130 20.735
352 HG23 VAL 88 3HG2 VAL 88 4.580 11.403 21.419
353 H GLY 89 H GLY 89 1.253 14.791 23.391
354 HA2 GLY 89 1HA GLY 89 0.059 15.553 25.233
355 HA3 GLY 89 2HA GLY 89 0.206 13.953 25.934
356 H GLN 90 H GLN 90 1.529 13.670 27.640
357 HA GLN 90 HA GLN 90 2.881 16.073 28.667
358 HB2 GLN 90 1HB GLN 90 2.467 13.322 29.905
359 HB3 GLN 90 2HB GLN 90 3.180 14.702 30.729
360 HG2 GLN 90 1HG GLN 90 0.358 14.562 29.644
361 HG3 GLN 90 2HG GLN 90 0.850 14.386 31.352
362 HE21 GLN 90 1HE2 GLN 90 -0.112 17.967 30.036
363 HE22 GLN 90 2HE2 GLN 90 -0.644 16.446 29.398
364 H GLN 91 H GLN 91 3.706 13.352 26.832
365 HA GLN 91 HA GLN 91 6.551 13.522 27.714
366 HB2 GLN 91 1HB GLN 91 5.145 11.364 26.087
367 HB3 GLN 91 2HB GLN 91 6.839 11.346 26.557
368 HG2 GLN 91 1HG GLN 91 4.507 11.340 28.484
369 HG3 GLN 91 2HG GLN 91 5.444 9.908 27.970
370 HE21 GLN 91 1HE2 GLN 91 6.619 11.926 31.157
371 HE22 GLN 91 2HE2 GLN 91 5.023 11.911 30.483
372 H SER 92 H SER 92 8.221 13.528 26.124
373 HA SER 92 HA SER 92 7.499 14.004 23.330
374 HB2 SER 92 1HB SER 92 7.187 16.246 24.255
375 HB3 SER 92 2HB SER 92 8.778 16.194 24.998
376 HG SER 92 HG SER 92 9.271 15.605 22.591
377 H LEU 93 H LEU 93 8.876 12.785 22.265
378 HA LEU 93 HA LEU 93 11.675 12.608 23.297
379 HB2 LEU 93 1HB LEU 93 9.893 10.429 22.165
380 HB3 LEU 93 2HB LEU 93 11.640 10.251 22.352
381 HG LEU 93 HG LEU 93 11.075 10.911 24.878
382 HD11 LEU 93 1HD1 LEU 93 8.922 9.946 25.557
383 HD12 LEU 93 2HD1 LEU 93 8.706 11.323 24.450
384 HD13 LEU 93 3HD1 LEU 93 8.513 9.659 23.849
385 HD21 LEU 93 1HD2 LEU 93 10.953 8.486 25.343
386 HD22 LEU 93 2HD2 LEU 93 10.572 8.177 23.632
387 HD23 LEU 93 3HD2 LEU 93 12.163 8.836 24.084
388 HA PRO 94 HA PRO 94 12.736 13.788 19.224
389 HB2 PRO 94 1HB PRO 94 15.428 13.365 19.298
390 HB3 PRO 94 2HB PRO 94 14.673 14.651 20.246
391 HG2 PRO 94 1HG PRO 94 15.494 11.853 21.136
392 HG3 PRO 94 2HG PRO 94 15.832 13.395 21.928
393 HD2 PRO 94 1HD PRO 94 13.738 11.802 22.692
394 HD3 PRO 94 2HD PRO 94 13.656 13.607 22.788
395 H VAL 95 H VAL 95 11.416 11.716 18.701
396 HA VAL 95 HA VAL 95 12.892 9.265 18.224
397 HB VAL 95 HB VAL 95 10.122 10.147 17.304
398 HG11 VAL 95 1HG1 VAL 95 9.700 7.770 16.910
399 HG12 VAL 95 2HG1 VAL 95 10.998 8.397 15.869
400 HG13 VAL 95 3HG1 VAL 95 11.398 7.405 17.291
401 HG21 VAL 95 1HG2 VAL 95 9.348 8.722 19.173
402 HG22 VAL 95 2HG2 VAL 95 11.038 8.394 19.622
403 HG23 VAL 95 3HG2 VAL 95 10.385 10.044 19.760
404 H LYS 96 H LYS 96 14.289 8.994 16.633
405 HA LYS 96 HA LYS 96 14.046 10.519 14.135
406 HB2 LYS 96 1HB LYS 96 16.270 10.049 15.167
407 HB3 LYS 96 2HB LYS 96 16.008 8.328 14.923
408 HG2 LYS 96 1HG LYS 96 15.974 8.645 12.495
409 HG3 LYS 96 2HG LYS 96 16.158 10.392 12.706
410 HD2 LYS 96 1HD LYS 96 18.334 10.026 13.831
411 HD3 LYS 96 2HD LYS 96 18.150 8.280 13.612
412 HE2 LYS 96 1HE LYS 96 18.087 8.607 11.152
413 HE3 LYS 96 2HE LYS 96 18.304 10.343 11.384
414 HZ1 LYS 96 1HZ LYS 96 20.369 9.252 10.900
415 HZ2 LYS 96 2HZ LYS 96 20.417 9.881 12.424
416 HZ3 LYS 96 3HZ LYS 96 20.214 8.259 12.207
417 H LEU 97 H LEU 97 13.100 9.897 12.334
418 HA LEU 97 HA LEU 97 12.016 7.121 12.270
419 HB2 LEU 97 1HB LEU 97 11.148 9.598 10.737
420 HB3 LEU 97 2HB LEU 97 10.375 8.011 10.658
421 HG LEU 97 HG LEU 97 10.495 9.803 13.111
422 HD11 LEU 97 1HD1 LEU 97 8.089 10.072 12.708
423 HD12 LEU 97 2HD1 LEU 97 9.056 10.683 11.346
424 HD13 LEU 97 3HD1 LEU 97 8.230 9.111 11.218
425 HD21 LEU 97 1HD2 LEU 97 8.937 8.140 14.067
426 HD22 LEU 97 2HD2 LEU 97 9.090 7.150 12.595
427 HD23 LEU 97 3HD2 LEU 97 10.498 7.391 13.655
428 H ASP 98 H ASP 98 13.717 5.993 11.395
429 HA ASP 98 HA ASP 98 15.029 6.790 8.950
430 HB2 ASP 98 1HB ASP 98 14.780 4.125 10.390
431 HB3 ASP 98 2HB ASP 98 15.689 4.315 8.897
432 HA PRO 99 HA PRO 99 12.070 5.717 5.995
433 HB2 PRO 99 1HB PRO 99 13.672 5.014 3.854
434 HB3 PRO 99 2HB PRO 99 13.472 6.685 4.400
435 HG2 PRO 99 1HG PRO 99 15.692 4.707 5.072
436 HG3 PRO 99 2HG PRO 99 15.844 6.390 4.556
437 HD2 PRO 99 1HD PRO 99 16.001 5.735 7.180
438 HD3 PRO 99 2HD PRO 99 15.171 7.255 6.654
439 H ASP 100 H ASP 100 10.944 3.945 5.212
440 HA ASP 100 HA ASP 100 10.297 1.745 5.039
441 HB2 ASP 100 1HB ASP 100 13.279 1.248 4.670
442 HB3 ASP 100 2HB ASP 100 11.999 0.101 4.298
443 H SER 101 H SER 101 10.427 2.651 7.604
444 HA SER 101 HA SER 101 11.042 0.170 9.063
445 HB2 SER 101 1HB SER 101 13.166 1.384 9.176
446 HB3 SER 101 2HB SER 101 12.344 2.822 9.760
447 HG SER 101 HG SER 101 11.684 1.643 11.555
448 H TYR 102 H TYR 102 9.847 -0.110 10.898
449 HA TYR 102 HA TYR 102 7.789 1.981 11.404
450 HB2 TYR 102 1HB TYR 102 7.870 -0.972 12.141
451 HB3 TYR 102 2HB TYR 102 6.589 0.134 12.617
452 HD1 TYR 102 HD1 TYR 102 8.368 -1.113 9.569
453 HD2 TYR 102 HD2 TYR 102 4.722 0.376 11.273
454 HE1 TYR 102 HE1 TYR 102 7.189 -1.563 7.443
455 HE2 TYR 102 HE2 TYR 102 3.545 -0.074 9.148
456 HH TYR 102 HH TYR 102 3.717 -0.832 7.073
457 H TYR 103 H TYR 103 7.292 2.695 13.470
458 HA TYR 103 HA TYR 103 9.203 1.898 15.615
459 HB2 TYR 103 1HB TYR 103 8.374 4.734 14.884
460 HB3 TYR 103 2HB TYR 103 9.196 4.304 16.377
461 HD1 TYR 103 HD1 TYR 103 9.523 4.504 12.705
462 HD2 TYR 103 HD2 TYR 103 11.537 3.812 16.429
463 HE1 TYR 103 HE1 TYR 103 11.706 4.713 11.563
464 HE2 TYR 103 HE2 TYR 103 13.720 4.022 15.288
465 HH TYR 103 HH TYR 103 14.765 4.395 13.371
466 H THR 104 H THR 104 8.400 1.748 17.654
467 HA THR 104 HA THR 104 5.559 2.600 18.025
468 HB THR 104 HB THR 104 6.961 0.210 19.301
469 HG1 THR 104 HG1 THR 104 6.150 -0.808 17.645
470 HG21 THR 104 1HG2 THR 104 4.755 -0.254 20.296
471 HG22 THR 104 2HG2 THR 104 5.379 1.322 20.839
472 HG23 THR 104 3HG2 THR 104 4.115 1.248 19.590
473 H LEU 105 H LEU 105 5.315 4.196 19.393
474 HA LEU 105 HA LEU 105 7.508 4.679 21.362
475 HB2 LEU 105 1HB LEU 105 7.256 6.441 19.664
476 HB3 LEU 105 2HB LEU 105 5.551 6.625 20.088
477 HG LEU 105 HG LEU 105 6.239 7.388 22.366
478 HD11 LEU 105 1HD1 LEU 105 8.593 7.976 22.741
479 HD12 LEU 105 2HD1 LEU 105 8.385 6.229 22.476
480 HD13 LEU 105 3HD1 LEU 105 9.022 7.257 21.171
481 HD21 LEU 105 1HD2 LEU 105 7.048 9.597 21.605
482 HD22 LEU 105 2HD2 LEU 105 7.456 8.901 20.018
483 HD23 LEU 105 3HD2 LEU 105 5.757 8.988 20.542
484 H VAL 106 H VAL 106 6.970 3.955 23.303
485 HA VAL 106 HA VAL 106 4.194 4.098 24.251
486 HB VAL 106 HB VAL 106 6.764 3.251 25.656
487 HG11 VAL 106 1HG1 VAL 106 5.293 2.269 27.346
488 HG12 VAL 106 2HG1 VAL 106 5.113 4.036 27.252
489 HG13 VAL 106 3HG1 VAL 106 3.880 2.976 26.528
490 HG21 VAL 106 1HG2 VAL 106 5.875 0.967 25.316
491 HG22 VAL 106 2HG2 VAL 106 4.486 1.640 24.432
492 HG23 VAL 106 3HG2 VAL 106 6.128 1.797 23.763
493 H SER 107 H SER 107 3.383 5.953 24.935
494 HA SER 107 HA SER 107 5.184 7.841 26.377
495 HB2 SER 107 1HB SER 107 4.072 8.824 24.459
496 HB3 SER 107 2HB SER 107 2.507 8.248 25.011
497 HG SER 107 HG SER 107 2.657 10.299 25.640
498 H GLN 108 H GLN 108 5.174 7.523 28.489
499 HA GLN 108 HA GLN 108 2.539 7.001 29.799
500 HB2 GLN 108 1HB GLN 108 4.236 5.188 30.079
501 HB3 GLN 108 2HB GLN 108 5.329 6.344 30.824
502 HG2 GLN 108 1HG GLN 108 3.762 6.690 32.662
503 HG3 GLN 108 2HG GLN 108 2.610 5.562 31.894
504 HE21 GLN 108 1HE2 GLN 108 3.924 2.992 33.827
505 HE22 GLN 108 2HE2 GLN 108 2.546 3.918 33.332
506 HA PRO 109 HA PRO 109 3.214 11.243 31.048
507 HB2 PRO 109 1HB PRO 109 0.541 10.587 32.337
508 HB3 PRO 109 2HB PRO 109 1.012 12.026 31.425
509 HG2 PRO 109 1HG PRO 109 -0.485 10.196 30.204
510 HG3 PRO 109 2HG PRO 109 0.865 10.917 29.323
511 HD2 PRO 109 1HD PRO 109 0.720 8.222 30.738
512 HD3 PRO 109 2HD PRO 109 1.422 8.622 29.119
513 H GLY 110 H GLY 110 4.598 11.498 32.698
514 HA2 GLY 110 1HA GLY 110 5.214 11.759 34.944
515 HA3 GLY 110 2HA GLY 110 3.712 10.999 35.435
516 H GLY 111 H GLY 111 5.378 9.210 33.054
517 HA2 GLY 111 1HA GLY 111 6.614 7.455 35.148
518 HA3 GLY 111 2HA GLY 111 5.670 6.793 33.826
519 H LYS 112 H LYS 112 7.093 5.730 32.576
520 HA LYS 112 HA LYS 112 9.441 7.272 31.568
521 HB2 LYS 112 1HB LYS 112 10.206 5.645 33.276
522 HB3 LYS 112 2HB LYS 112 9.429 4.340 32.390
523 HG2 LYS 112 1HG LYS 112 10.940 4.710 30.485
524 HG3 LYS 112 2HG LYS 112 11.710 6.047 31.352
525 HD2 LYS 112 1HD LYS 112 12.410 4.500 33.140
526 HD3 LYS 112 2HD LYS 112 11.611 3.160 32.306
527 HE2 LYS 112 1HE LYS 112 13.110 3.478 30.362
528 HE3 LYS 112 2HE LYS 112 13.909 4.813 31.195
529 HZ1 LYS 112 1HZ LYS 112 15.126 2.774 31.426
530 HZ2 LYS 112 2HZ LYS 112 14.581 3.268 32.904
531 HZ3 LYS 112 3HZ LYS 112 13.836 2.021 32.124
532 HA PRO 113 HA PRO 113 7.476 5.966 27.834
533 HB2 PRO 113 1HB PRO 113 8.856 7.594 26.131
534 HB3 PRO 113 2HB PRO 113 7.604 8.228 27.207
535 HG2 PRO 113 1HG PRO 113 10.628 8.205 27.599
536 HG3 PRO 113 2HG PRO 113 9.508 9.555 27.808
537 HD2 PRO 113 1HD PRO 113 10.353 8.042 29.926
538 HD3 PRO 113 2HD PRO 113 8.695 8.763 29.867
539 H GLN 114 H GLN 114 8.179 4.867 25.866
540 HA GLN 114 HA GLN 114 10.994 3.961 25.805
541 HB2 GLN 114 1HB GLN 114 9.889 2.310 27.252
542 HB3 GLN 114 2HB GLN 114 8.627 2.063 26.054
543 HG2 GLN 114 1HG GLN 114 10.138 0.238 25.908
544 HG3 GLN 114 2HG GLN 114 10.395 1.256 24.464
545 HE21 GLN 114 1HE2 GLN 114 13.792 1.555 25.021
546 HE22 GLN 114 2HE2 GLN 114 12.447 1.531 23.929
547 H LEU 115 H LEU 115 11.690 4.201 23.818
548 HA LEU 115 HA LEU 115 9.769 3.962 21.571
549 HB2 LEU 115 1HB LEU 115 11.218 5.922 21.567
550 HB3 LEU 115 2HB LEU 115 12.656 4.904 21.696
551 HG LEU 115 HG LEU 115 12.080 3.944 19.431
552 HD11 LEU 115 1HD1 LEU 115 10.491 5.203 18.048
553 HD12 LEU 115 2HD1 LEU 115 9.693 4.460 19.455
554 HD13 LEU 115 3HD1 LEU 115 10.058 6.203 19.454
555 HD21 LEU 115 1HD2 LEU 115 12.882 5.944 18.222
556 HD22 LEU 115 2HD2 LEU 115 12.483 6.957 19.631
557 HD23 LEU 115 3HD2 LEU 115 13.763 5.726 19.752
558 H VAL 116 H VAL 116 9.652 2.255 20.289
559 HA VAL 116 HA VAL 116 11.900 0.286 20.400
560 HB VAL 116 HB VAL 116 8.934 -0.242 19.924
561 HG11 VAL 116 1HG1 VAL 116 9.556 -2.608 19.972
562 HG12 VAL 116 2HG1 VAL 116 10.333 -1.741 18.626
563 HG13 VAL 116 3HG1 VAL 116 11.273 -2.153 20.081
564 HG21 VAL 116 1HG2 VAL 116 9.060 -1.423 22.095
565 HG22 VAL 116 2HG2 VAL 116 10.761 -0.926 22.264
566 HG23 VAL 116 3HG2 VAL 116 9.470 0.300 22.275
567 H ALA 117 H ALA 117 12.999 0.088 18.584
568 HA ALA 117 HA ALA 117 11.878 1.088 16.063
569 HB1 ALA 117 1HB ALA 117 14.103 0.528 15.136
570 HB2 ALA 117 2HB ALA 117 14.232 1.532 16.601
571 HB3 ALA 117 3HB ALA 117 14.554 -0.215 16.688
572 H GLU 118 H GLU 118 11.236 -0.056 14.331
573 HA GLU 118 HA GLU 118 11.415 -3.019 14.473
574 HB2 GLU 118 1HB GLU 118 8.819 -1.491 14.019
575 HB3 GLU 118 2HB GLU 118 9.014 -3.235 13.910
576 HG2 GLU 118 1HG GLU 118 9.585 -3.336 16.293
577 HG3 GLU 118 2HG GLU 118 9.432 -1.585 16.412
578 HA PRO 119 HA PRO 119 12.520 -1.224 10.355
579 HB2 PRO 119 1HB PRO 119 14.199 -3.752 10.579
580 HB3 PRO 119 2HB PRO 119 14.632 -2.192 9.869
581 HG2 PRO 119 1HG PRO 119 15.560 -2.764 12.293
582 HG3 PRO 119 2HG PRO 119 14.919 -1.146 11.991
583 HD2 PRO 119 1HD PRO 119 13.587 -3.512 13.368
584 HD3 PRO 119 2HD PRO 119 13.575 -1.764 13.837
Start of MODEL 2
1 H GLN 38 1H GLN 38 -0.488 -0.872 5.410
2 HA GLN 38 HA GLN 38 1.168 0.429 6.487
3 HB2 GLN 38 1HB GLN 38 2.106 -0.920 3.923
4 HB3 GLN 38 2HB GLN 38 3.124 -0.537 5.303
5 HG2 GLN 38 1HG GLN 38 0.754 -2.416 5.366
6 HG3 GLN 38 2HG GLN 38 2.469 -2.898 5.229
7 HE21 GLN 38 1HE2 GLN 38 0.823 -2.435 8.821
8 HE22 GLN 38 2HE2 GLN 38 -0.048 -2.632 7.336
9 H ALA 39 H ALA 39 3.336 1.536 5.837
10 HA ALA 39 HA ALA 39 2.577 4.046 4.568
11 HB1 ALA 39 1HB ALA 39 4.878 4.750 5.144
12 HB2 ALA 39 2HB ALA 39 4.040 4.031 6.539
13 HB3 ALA 39 3HB ALA 39 5.252 3.085 5.647
14 HA PRO 40 HA PRO 40 3.843 3.375 0.458
15 HB2 PRO 40 1HB PRO 40 5.135 6.110 0.722
16 HB3 PRO 40 2HB PRO 40 4.036 5.516 -0.529
17 HG2 PRO 40 1HG PRO 40 3.060 7.128 1.354
18 HG3 PRO 40 2HG PRO 40 2.116 5.718 0.862
19 HD2 PRO 40 1HD PRO 40 3.897 6.077 3.307
20 HD3 PRO 40 2HD PRO 40 2.259 5.318 3.193
21 H LYS 41 H LYS 41 5.722 2.881 -0.753
22 HA LYS 41 HA LYS 41 7.964 1.960 0.708
23 HB2 LYS 41 1HB LYS 41 7.336 1.096 -1.521
24 HB3 LYS 41 2HB LYS 41 7.753 2.640 -2.253
25 HG2 LYS 41 1HG LYS 41 9.558 1.153 -2.670
26 HG3 LYS 41 2HG LYS 41 10.117 2.300 -1.444
27 HD2 LYS 41 1HD LYS 41 9.615 0.637 0.328
28 HD3 LYS 41 2HD LYS 41 9.086 -0.511 -0.910
29 HE2 LYS 41 1HE LYS 41 11.357 -1.052 -0.314
30 HE3 LYS 41 2HE LYS 41 11.372 -0.367 -1.941
31 HZ1 LYS 41 1HZ LYS 41 13.113 0.540 -0.586
32 HZ2 LYS 41 2HZ LYS 41 12.043 1.730 -0.989
33 HZ3 LYS 41 3HZ LYS 41 12.031 1.091 0.531
34 H GLY 42 H GLY 42 9.526 2.994 1.684
35 HA2 GLY 42 1HA GLY 42 11.463 4.465 1.541
36 HA3 GLY 42 2HA GLY 42 10.561 5.516 0.464
37 H SER 43 H SER 43 8.175 4.906 2.427
38 HA SER 43 HA SER 43 8.734 7.288 4.087
39 HB2 SER 43 1HB SER 43 6.645 7.275 2.856
40 HB3 SER 43 2HB SER 43 6.203 5.712 3.526
41 HG SER 43 HG SER 43 6.283 6.704 5.589
42 H ALA 44 H ALA 44 8.795 7.339 6.271
43 HA ALA 44 HA ALA 44 9.220 4.825 7.666
44 HB1 ALA 44 1HB ALA 44 9.540 6.262 9.653
45 HB2 ALA 44 2HB ALA 44 10.498 6.832 8.267
46 HB3 ALA 44 3HB ALA 44 8.994 7.670 8.713
47 H PHE 45 H PHE 45 8.018 3.917 9.319
48 HA PHE 45 HA PHE 45 5.144 4.744 9.288
49 HB2 PHE 45 1HB PHE 45 5.605 2.529 8.230
50 HB3 PHE 45 2HB PHE 45 6.312 1.968 9.736
51 HD1 PHE 45 HD1 PHE 45 3.309 2.359 7.849
52 HD2 PHE 45 HD2 PHE 45 4.824 1.952 11.823
53 HE1 PHE 45 HE1 PHE 45 1.075 1.637 8.624
54 HE2 PHE 45 HE2 PHE 45 2.591 1.228 12.601
55 HZ PHE 45 HZ PHE 45 0.716 1.072 11.001
56 H VAL 46 H VAL 46 4.600 5.749 11.085
57 HA VAL 46 HA VAL 46 5.888 4.850 13.631
58 HB VAL 46 HB VAL 46 4.815 7.611 12.906
59 HG11 VAL 46 1HG1 VAL 46 5.804 8.319 15.029
60 HG12 VAL 46 2HG1 VAL 46 4.523 7.108 15.263
61 HG13 VAL 46 3HG1 VAL 46 6.233 6.632 15.392
62 HG21 VAL 46 1HG2 VAL 46 7.196 8.280 12.975
63 HG22 VAL 46 2HG2 VAL 46 7.661 6.588 13.270
64 HG23 VAL 46 3HG2 VAL 46 6.910 7.048 11.724
65 H ARG 47 H ARG 47 4.616 4.045 15.150
66 HA ARG 47 HA ARG 47 1.701 4.698 15.018
67 HB2 ARG 47 1HB ARG 47 2.054 2.362 14.435
68 HB3 ARG 47 2HB ARG 47 3.053 2.112 15.859
69 HG2 ARG 47 1HG ARG 47 1.191 2.301 17.325
70 HG3 ARG 47 2HG ARG 47 0.143 2.915 16.022
71 HD2 ARG 47 1HD ARG 47 1.435 0.205 15.962
72 HD3 ARG 47 2HD ARG 47 -0.172 0.517 16.658
73 HE ARG 47 HE ARG 47 -0.220 1.626 14.115
74 HH11 ARG 47 1HH1 ARG 47 0.300 -1.555 15.510
75 HH12 ARG 47 2HH1 ARG 47 -0.342 -2.406 14.123
76 HH21 ARG 47 1HH2 ARG 47 -1.052 0.511 12.321
77 HH22 ARG 47 2HH2 ARG 47 -1.108 -1.237 12.317
78 H ALA 48 H ALA 48 1.210 6.062 16.588
79 HA ALA 48 HA ALA 48 2.662 5.998 19.137
80 HB1 ALA 48 1HB ALA 48 1.206 7.908 19.733
81 HB2 ALA 48 2HB ALA 48 2.015 8.158 18.167
82 HB3 ALA 48 3HB ALA 48 0.303 7.681 18.218
83 H TYR 49 H TYR 49 1.691 5.718 21.187
84 HA TYR 49 HA TYR 49 -0.861 4.191 21.162
85 HB2 TYR 49 1HB TYR 49 0.926 2.508 21.094
86 HB3 TYR 49 2HB TYR 49 1.734 3.269 22.458
87 HD1 TYR 49 HD1 TYR 49 -1.519 1.693 21.498
88 HD2 TYR 49 HD2 TYR 49 1.301 2.546 24.617
89 HE1 TYR 49 HE1 TYR 49 -2.811 0.272 23.054
90 HE2 TYR 49 HE2 TYR 49 0.009 1.124 26.173
91 HH TYR 49 HH TYR 49 -2.972 -0.510 25.128
92 H ASN 50 H ASN 50 -2.211 4.675 22.746
93 HA ASN 50 HA ASN 50 -1.273 6.617 24.780
94 HB2 ASN 50 1HB ASN 50 -3.318 7.117 23.466
95 HB3 ASN 50 2HB ASN 50 -4.079 5.668 24.108
96 HD21 ASN 50 1HD2 ASN 50 -5.261 8.484 26.131
97 HD22 ASN 50 2HD2 ASN 50 -5.370 7.959 24.485
98 H ALA 51 H ALA 51 -0.226 5.578 26.354
99 HA ALA 51 HA ALA 51 -1.388 3.089 27.437
100 HB1 ALA 51 1HB ALA 51 0.707 2.960 28.746
101 HB2 ALA 51 2HB ALA 51 1.028 3.148 27.006
102 HB3 ALA 51 3HB ALA 51 1.201 4.541 28.097
103 H GLY 52 H GLY 52 -2.135 6.170 27.849
104 HA2 GLY 52 1HA GLY 52 -2.109 6.197 30.821
105 HA3 GLY 52 2HA GLY 52 -2.480 7.557 29.777
106 H ASN 53 H ASN 53 -4.330 7.782 31.278
107 HA ASN 53 HA ASN 53 -6.599 6.053 30.385
108 HB2 ASN 53 1HB ASN 53 -6.054 7.157 33.160
109 HB3 ASN 53 2HB ASN 53 -7.590 6.456 32.666
110 HD21 ASN 53 1HD2 ASN 53 -4.621 4.114 33.918
111 HD22 ASN 53 2HD2 ASN 53 -4.647 5.840 34.072
112 H SER 54 H SER 54 -5.702 8.497 29.194
113 HA SER 54 HA SER 54 -8.265 9.891 29.253
114 HB2 SER 54 1HB SER 54 -7.460 12.048 29.908
115 HB3 SER 54 2HB SER 54 -6.997 10.909 31.165
116 HG SER 54 HG SER 54 -5.418 11.970 29.098
117 H GLU 55 H GLU 55 -7.969 12.019 27.831
118 HA GLU 55 HA GLU 55 -7.349 11.184 25.214
119 HB2 GLU 55 1HB GLU 55 -8.778 13.141 25.768
120 HB3 GLU 55 2HB GLU 55 -7.363 14.019 26.326
121 HG2 GLU 55 1HG GLU 55 -6.406 13.917 24.057
122 HG3 GLU 55 2HG GLU 55 -7.835 13.049 23.500
123 H LEU 56 H LEU 56 -5.547 10.882 24.128
124 HA LEU 56 HA LEU 56 -2.987 11.295 25.391
125 HB2 LEU 56 1HB LEU 56 -3.525 9.451 23.780
126 HB3 LEU 56 2HB LEU 56 -3.600 10.650 22.485
127 HG LEU 56 HG LEU 56 -1.193 11.194 22.914
128 HD11 LEU 56 1HD1 LEU 56 0.116 9.651 24.304
129 HD12 LEU 56 2HD1 LEU 56 -1.109 10.519 25.259
130 HD13 LEU 56 3HD1 LEU 56 -1.382 8.822 24.793
131 HD21 LEU 56 1HD2 LEU 56 -0.341 9.110 21.895
132 HD22 LEU 56 2HD2 LEU 56 -1.845 8.272 22.351
133 HD23 LEU 56 3HD2 LEU 56 -1.888 9.595 21.161
134 H ASP 57 H ASP 57 -1.723 13.011 25.409
135 HA ASP 57 HA ASP 57 -2.187 15.107 23.330
136 HB2 ASP 57 1HB ASP 57 -2.641 15.841 25.666
137 HB3 ASP 57 2HB ASP 57 -0.999 15.408 26.119
138 H VAL 58 H VAL 58 -0.823 13.974 21.850
139 HA VAL 58 HA VAL 58 2.063 14.419 22.449
140 HB VAL 58 HB VAL 58 0.850 11.928 21.176
141 HG11 VAL 58 1HG1 VAL 58 3.150 11.112 21.006
142 HG12 VAL 58 2HG1 VAL 58 2.888 12.574 20.025
143 HG13 VAL 58 3HG1 VAL 58 3.750 12.687 21.579
144 HG21 VAL 58 1HG2 VAL 58 1.879 10.780 23.110
145 HG22 VAL 58 2HG2 VAL 58 2.433 12.347 23.745
146 HG23 VAL 58 3HG2 VAL 58 0.691 11.994 23.640
147 H SER 59 H SER 59 3.190 15.358 20.862
148 HA SER 59 HA SER 59 1.838 15.640 18.212
149 HB2 SER 59 1HB SER 59 2.226 17.762 19.406
150 HB3 SER 59 2HB SER 59 3.940 17.395 19.527
151 HG SER 59 HG SER 59 4.135 17.519 17.369
152 H VAL 60 H VAL 60 2.645 14.487 16.615
153 HA VAL 60 HA VAL 60 5.369 13.337 17.013
154 HB VAL 60 HB VAL 60 3.044 12.309 15.328
155 HG11 VAL 60 1HG1 VAL 60 4.385 10.276 15.098
156 HG12 VAL 60 2HG1 VAL 60 5.197 11.693 14.390
157 HG13 VAL 60 3HG1 VAL 60 5.724 11.062 15.969
158 HG21 VAL 60 1HG2 VAL 60 2.889 10.550 17.060
159 HG22 VAL 60 2HG2 VAL 60 4.179 11.352 17.988
160 HG23 VAL 60 3HG2 VAL 60 2.612 12.164 17.755
161 H GLY 61 H GLY 61 6.742 14.701 16.001
162 HA2 GLY 61 1HA GLY 61 7.935 15.499 14.174
163 HA3 GLY 61 2HA GLY 61 6.912 14.523 13.137
164 H SER 62 H SER 62 5.484 15.527 11.848
165 HA SER 62 HA SER 62 5.189 18.467 12.213
166 HB2 SER 62 1HB SER 62 4.632 18.534 9.848
167 HB3 SER 62 2HB SER 62 6.151 17.680 10.080
168 HG SER 62 HG SER 62 3.710 16.318 10.030
169 H THR 63 H THR 63 3.539 15.653 12.850
170 HA THR 63 HA THR 63 0.895 16.993 12.452
171 HB THR 63 HB THR 63 1.526 14.015 12.280
172 HG1 THR 63 HG1 THR 63 0.355 15.416 10.176
173 HG21 THR 63 1HG2 THR 63 -0.846 13.787 11.652
174 HG22 THR 63 2HG2 THR 63 -0.683 14.465 13.290
175 HG23 THR 63 3HG2 THR 63 -1.088 15.529 11.923
176 H SER 64 H SER 64 0.058 17.609 14.299
177 HA SER 64 HA SER 64 0.802 16.326 16.815
178 HB2 SER 64 1HB SER 64 -1.241 18.473 16.156
179 HB3 SER 64 2HB SER 64 -0.840 17.945 17.783
180 HG SER 64 HG SER 64 1.410 18.405 17.030
181 H LEU 65 H LEU 65 -0.491 15.139 18.188
182 HA LEU 65 HA LEU 65 -2.831 13.871 16.826
183 HB2 LEU 65 1HB LEU 65 -0.915 12.350 17.041
184 HB3 LEU 65 2HB LEU 65 -0.835 12.665 18.778
185 HG LEU 65 HG LEU 65 -3.097 11.622 19.027
186 HD11 LEU 65 1HD1 LEU 65 -3.991 10.324 17.146
187 HD12 LEU 65 2HD1 LEU 65 -3.920 12.061 16.771
188 HD13 LEU 65 3HD1 LEU 65 -2.700 10.953 16.096
189 HD21 LEU 65 1HD2 LEU 65 -2.284 9.313 18.684
190 HD22 LEU 65 2HD2 LEU 65 -0.967 9.928 17.656
191 HD23 LEU 65 3HD2 LEU 65 -1.012 10.341 19.387
192 H ASN 66 H ASN 66 -4.690 14.418 17.702
193 HA ASN 66 HA ASN 66 -4.842 14.552 20.678
194 HB2 ASN 66 1HB ASN 66 -6.086 16.491 18.702
195 HB3 ASN 66 2HB ASN 66 -6.505 16.413 20.407
196 HD21 ASN 66 1HD2 ASN 66 -3.392 18.575 19.220
197 HD22 ASN 66 2HD2 ASN 66 -4.613 17.933 18.173
198 H ASP 67 H ASP 67 -7.181 14.532 21.425
199 HA ASP 67 HA ASP 67 -9.110 13.289 21.623
200 HB2 ASP 67 1HB ASP 67 -9.599 14.761 19.566
201 HB3 ASP 67 2HB ASP 67 -9.245 13.344 18.590
202 H VAL 68 H VAL 68 -7.154 11.662 22.063
203 HA VAL 68 HA VAL 68 -7.861 9.229 20.475
204 HB VAL 68 HB VAL 68 -5.220 9.870 21.859
205 HG11 VAL 68 1HG1 VAL 68 -4.425 7.777 20.873
206 HG12 VAL 68 2HG1 VAL 68 -5.761 7.508 22.018
207 HG13 VAL 68 3HG1 VAL 68 -6.063 7.442 20.264
208 HG21 VAL 68 1HG2 VAL 68 -4.316 9.877 19.555
209 HG22 VAL 68 2HG2 VAL 68 -5.954 9.611 18.913
210 HG23 VAL 68 3HG2 VAL 68 -5.565 11.127 19.760
211 H ALA 69 H ALA 69 -8.830 7.665 21.562
212 HA ALA 69 HA ALA 69 -9.402 7.993 24.368
213 HB1 ALA 69 1HB ALA 69 -10.568 5.823 24.145
214 HB2 ALA 69 2HB ALA 69 -11.006 6.945 22.834
215 HB3 ALA 69 3HB ALA 69 -9.861 5.619 22.525
216 HA PRO 70 HA PRO 70 -6.207 5.943 26.470
217 HB2 PRO 70 1HB PRO 70 -8.424 4.288 27.740
218 HB3 PRO 70 2HB PRO 70 -7.080 5.129 28.523
219 HG2 PRO 70 1HG PRO 70 -9.483 6.265 28.598
220 HG3 PRO 70 2HG PRO 70 -8.079 7.275 28.248
221 HD2 PRO 70 1HD PRO 70 -10.132 6.111 26.327
222 HD3 PRO 70 2HD PRO 70 -9.395 7.763 26.344
223 H LEU 71 H LEU 71 -4.920 4.234 25.988
224 HA LEU 71 HA LEU 71 -4.218 2.205 25.154
225 HB2 LEU 71 1HB LEU 71 -7.112 1.315 25.384
226 HB3 LEU 71 2HB LEU 71 -5.685 0.279 25.267
227 HG LEU 71 HG LEU 71 -6.410 2.068 27.614
228 HD11 LEU 71 1HD1 LEU 71 -6.748 -0.067 28.779
229 HD12 LEU 71 2HD1 LEU 71 -7.843 0.103 27.386
230 HD13 LEU 71 3HD1 LEU 71 -6.409 -0.944 27.269
231 HD21 LEU 71 1HD2 LEU 71 -4.472 0.990 28.707
232 HD22 LEU 71 2HD2 LEU 71 -4.100 0.126 27.195
233 HD23 LEU 71 3HD2 LEU 71 -3.969 1.900 27.262
234 H GLY 72 H GLY 72 -5.567 4.406 23.505
235 HA2 GLY 72 1HA GLY 72 -6.309 2.862 21.086
236 HA3 GLY 72 2HA GLY 72 -6.399 4.603 21.277
237 H SER 73 H SER 73 -5.352 4.471 19.096
238 HA SER 73 HA SER 73 -2.487 4.876 19.336
239 HB2 SER 73 1HB SER 73 -1.746 3.093 17.901
240 HB3 SER 73 2HB SER 73 -2.636 2.388 19.240
241 HG SER 73 HG SER 73 -3.575 2.908 16.640
242 H SER 74 H SER 74 -1.487 5.352 17.179
243 HA SER 74 HA SER 74 -3.349 5.998 15.010
244 HB2 SER 74 1HB SER 74 -3.594 7.964 16.458
245 HB3 SER 74 2HB SER 74 -1.852 8.186 16.490
246 HG SER 74 HG SER 74 -1.950 8.389 14.213
247 H ASP 75 H ASP 75 -2.389 6.008 13.061
248 HA ASP 75 HA ASP 75 0.524 5.409 13.073
249 HB2 ASP 75 1HB ASP 75 -1.648 4.899 11.002
250 HB3 ASP 75 2HB ASP 75 0.059 4.581 10.725
251 H PHE 76 H PHE 76 1.989 6.470 11.800
252 HA PHE 76 HA PHE 76 0.975 8.897 10.384
253 HB2 PHE 76 1HB PHE 76 3.498 8.740 12.081
254 HB3 PHE 76 2HB PHE 76 2.940 10.144 11.185
255 HD1 PHE 76 HD1 PHE 76 2.365 8.018 14.119
256 HD2 PHE 76 HD2 PHE 76 1.099 11.493 11.980
257 HE1 PHE 76 HE1 PHE 76 1.063 8.754 16.089
258 HE2 PHE 76 HE2 PHE 76 -0.201 12.233 13.948
259 HZ PHE 76 HZ PHE 76 -0.220 10.862 16.003
260 H LYS 77 H LYS 77 2.177 9.609 8.603
261 HA LYS 77 HA LYS 77 4.121 7.590 7.562
262 HB2 LYS 77 1HB LYS 77 1.969 9.096 6.023
263 HB3 LYS 77 2HB LYS 77 3.228 8.122 5.277
264 HG2 LYS 77 1HG LYS 77 2.364 6.106 6.319
265 HG3 LYS 77 2HG LYS 77 1.175 7.046 7.230
266 HD2 LYS 77 1HD LYS 77 0.118 7.774 5.122
267 HD3 LYS 77 2HD LYS 77 1.319 6.861 4.198
268 HE2 LYS 77 1HE LYS 77 0.535 4.762 5.199
269 HE3 LYS 77 2HE LYS 77 -0.619 5.646 6.201
270 HZ1 LYS 77 1HZ LYS 77 -1.658 4.730 4.258
271 HZ2 LYS 77 2HZ LYS 77 -1.712 6.378 4.194
272 HZ3 LYS 77 3HZ LYS 77 -0.635 5.550 3.258
273 H PHE 78 H PHE 78 6.062 8.370 7.271
274 HA PHE 78 HA PHE 78 6.314 11.259 6.543
275 HB2 PHE 78 1HB PHE 78 8.097 9.599 8.368
276 HB3 PHE 78 2HB PHE 78 8.511 11.202 7.779
277 HD1 PHE 78 HD1 PHE 78 6.347 9.281 10.025
278 HD2 PHE 78 HD2 PHE 78 7.377 13.178 8.610
279 HE1 PHE 78 HE1 PHE 78 5.132 10.291 11.927
280 HE2 PHE 78 HE2 PHE 78 6.166 14.191 10.512
281 HZ PHE 78 HZ PHE 78 5.042 12.746 12.170
282 H LEU 79 H LEU 79 6.541 10.999 4.368
283 HA LEU 79 HA LEU 79 8.107 8.988 3.107
284 HB2 LEU 79 1HB LEU 79 6.440 10.288 1.893
285 HB3 LEU 79 2HB LEU 79 7.342 11.779 2.181
286 HG LEU 79 HG LEU 79 9.192 10.909 0.766
287 HD11 LEU 79 1HD1 LEU 79 8.807 8.895 -0.584
288 HD12 LEU 79 2HD1 LEU 79 8.829 8.526 1.155
289 HD13 LEU 79 3HD1 LEU 79 7.280 8.607 0.282
290 HD21 LEU 79 1HD2 LEU 79 7.969 11.127 -1.371
291 HD22 LEU 79 2HD2 LEU 79 6.429 10.870 -0.517
292 HD23 LEU 79 3HD2 LEU 79 7.400 12.325 -0.183
293 HA PRO 80 HA PRO 80 11.703 12.047 3.138
294 HB2 PRO 80 1HB PRO 80 11.588 14.403 4.457
295 HB3 PRO 80 2HB PRO 80 10.820 14.227 2.874
296 HG2 PRO 80 1HG PRO 80 9.549 14.056 5.642
297 HG3 PRO 80 2HG PRO 80 9.009 15.000 4.251
298 HD2 PRO 80 1HD PRO 80 7.969 12.524 4.844
299 HD3 PRO 80 2HD PRO 80 8.100 13.143 3.150
300 HA PRO 81 HA PRO 81 12.654 10.329 7.148
301 HB2 PRO 81 1HB PRO 81 15.220 9.570 6.617
302 HB3 PRO 81 2HB PRO 81 13.840 8.695 5.943
303 HG2 PRO 81 1HG PRO 81 15.558 10.851 4.638
304 HG3 PRO 81 2HG PRO 81 15.080 9.285 3.976
305 HD2 PRO 81 1HD PRO 81 13.722 11.585 3.371
306 HD3 PRO 81 2HD PRO 81 12.887 9.984 3.497
307 H GLY 82 H GLY 82 14.360 10.753 8.825
308 HA2 GLY 82 1HA GLY 82 16.390 12.467 9.035
309 HA3 GLY 82 2HA GLY 82 15.103 13.630 8.780
310 H SER 83 H SER 83 16.088 14.214 11.001
311 HA SER 83 HA SER 83 15.135 12.561 13.230
312 HB2 SER 83 1HB SER 83 17.249 13.712 13.480
313 HB3 SER 83 2HB SER 83 16.514 15.259 13.091
314 HG SER 83 HG SER 83 15.064 14.470 14.975
315 H TYR 84 H TYR 84 13.163 12.625 14.016
316 HA TYR 84 HA TYR 84 11.685 15.219 13.870
317 HB2 TYR 84 1HB TYR 84 10.613 12.383 13.608
318 HB3 TYR 84 2HB TYR 84 9.589 13.791 13.854
319 HD1 TYR 84 HD1 TYR 84 11.969 12.175 11.523
320 HD2 TYR 84 HD2 TYR 84 9.055 15.275 12.077
321 HE1 TYR 84 HE1 TYR 84 11.927 12.572 9.083
322 HE2 TYR 84 HE2 TYR 84 9.012 15.671 9.637
323 HH TYR 84 HH TYR 84 10.758 13.586 7.405
324 H THR 85 H THR 85 10.455 15.845 15.615
325 HA THR 85 HA THR 85 11.221 14.485 18.150
326 HB THR 85 HB THR 85 10.145 17.295 17.661
327 HG1 THR 85 HG1 THR 85 12.238 17.910 18.037
328 HG21 THR 85 1HG2 THR 85 10.642 17.657 20.047
329 HG22 THR 85 2HG2 THR 85 9.422 16.379 19.839
330 HG23 THR 85 3HG2 THR 85 11.107 15.948 20.214
331 H ALA 86 H ALA 86 9.812 13.284 19.189
332 HA ALA 86 HA ALA 86 6.918 13.755 18.700
333 HB1 ALA 86 1HB ALA 86 6.589 11.561 19.793
334 HB2 ALA 86 2HB ALA 86 7.690 11.445 18.400
335 HB3 ALA 86 3HB ALA 86 8.344 11.436 20.054
336 H GLN 87 H GLN 87 6.273 15.394 19.956
337 HA GLN 87 HA GLN 87 7.408 15.766 22.619
338 HB2 GLN 87 1HB GLN 87 6.824 17.680 21.117
339 HB3 GLN 87 2HB GLN 87 5.127 17.241 21.243
340 HG2 GLN 87 1HG GLN 87 5.524 19.046 22.730
341 HG3 GLN 87 2HG GLN 87 5.296 17.580 23.724
342 HE21 GLN 87 1HE2 GLN 87 8.150 18.431 25.514
343 HE22 GLN 87 2HE2 GLN 87 6.454 18.074 25.514
344 H VAL 88 H VAL 88 6.754 14.793 24.381
345 HA VAL 88 HA VAL 88 3.905 13.891 24.503
346 HB VAL 88 HB VAL 88 6.331 12.583 25.806
347 HG11 VAL 88 1HG1 VAL 88 4.777 10.771 26.344
348 HG12 VAL 88 2HG1 VAL 88 4.297 12.307 27.104
349 HG13 VAL 88 3HG1 VAL 88 3.435 11.720 25.661
350 HG21 VAL 88 1HG2 VAL 88 5.951 10.775 24.159
351 HG22 VAL 88 2HG2 VAL 88 4.650 11.731 23.411
352 HG23 VAL 88 3HG2 VAL 88 6.331 12.314 23.349
353 H GLY 89 H GLY 89 3.441 15.997 25.433
354 HA2 GLY 89 1HA GLY 89 2.892 17.270 27.301
355 HA3 GLY 89 2HA GLY 89 3.461 15.959 28.317
356 H GLN 90 H GLN 90 5.244 16.306 29.487
357 HA GLN 90 HA GLN 90 6.896 18.685 28.865
358 HB2 GLN 90 1HB GLN 90 6.874 16.849 31.294
359 HB3 GLN 90 2HB GLN 90 7.879 18.280 31.119
360 HG2 GLN 90 1HG GLN 90 4.855 18.247 31.159
361 HG3 GLN 90 2HG GLN 90 5.929 18.716 32.506
362 HE21 GLN 90 1HE2 GLN 90 4.661 21.519 30.053
363 HE22 GLN 90 2HE2 GLN 90 3.889 20.006 30.393
364 H GLN 91 H GLN 91 6.875 15.450 28.115
365 HA GLN 91 HA GLN 91 9.857 15.352 27.982
366 HB2 GLN 91 1HB GLN 91 7.849 13.066 27.829
367 HB3 GLN 91 2HB GLN 91 9.598 12.902 27.757
368 HG2 GLN 91 1HG GLN 91 8.052 13.997 30.117
369 HG3 GLN 91 2HG GLN 91 8.685 12.333 29.959
370 HE21 GLN 91 1HE2 GLN 91 10.962 15.070 31.647
371 HE22 GLN 91 2HE2 GLN 91 9.233 15.080 31.545
372 H SER 92 H SER 92 10.653 13.973 26.090
373 HA SER 92 HA SER 92 8.975 14.017 23.700
374 HB2 SER 92 1HB SER 92 10.358 15.492 22.385
375 HB3 SER 92 2HB SER 92 9.818 16.356 23.817
376 HG SER 92 HG SER 92 12.115 16.414 23.160
377 H LEU 93 H LEU 93 9.926 12.935 21.896
378 HA LEU 93 HA LEU 93 12.253 11.232 22.685
379 HB2 LEU 93 1HB LEU 93 9.882 10.553 20.909
380 HB3 LEU 93 2HB LEU 93 11.282 9.508 21.167
381 HG LEU 93 HG LEU 93 9.384 10.392 23.369
382 HD11 LEU 93 1HD1 LEU 93 8.472 8.119 23.207
383 HD12 LEU 93 2HD1 LEU 93 8.225 9.035 21.703
384 HD13 LEU 93 3HD1 LEU 93 9.507 7.804 21.794
385 HD21 LEU 93 1HD2 LEU 93 10.496 8.575 24.622
386 HD22 LEU 93 2HD2 LEU 93 11.561 8.265 23.228
387 HD23 LEU 93 3HD2 LEU 93 11.670 9.809 24.107
388 HA PRO 94 HA PRO 94 14.106 12.982 19.098
389 HB2 PRO 94 1HB PRO 94 16.488 11.673 19.181
390 HB3 PRO 94 2HB PRO 94 16.078 12.899 20.387
391 HG2 PRO 94 1HG PRO 94 15.859 9.866 20.596
392 HG3 PRO 94 2HG PRO 94 16.570 10.993 21.755
393 HD2 PRO 94 1HD PRO 94 13.995 10.064 22.001
394 HD3 PRO 94 2HD PRO 94 14.490 11.710 22.566
395 H VAL 95 H VAL 95 12.332 11.759 17.917
396 HA VAL 95 HA VAL 95 12.851 8.970 17.226
397 HB VAL 95 HB VAL 95 10.672 10.841 16.207
398 HG11 VAL 95 1HG1 VAL 95 9.451 8.773 15.738
399 HG12 VAL 95 2HG1 VAL 95 10.976 8.868 14.824
400 HG13 VAL 95 3HG1 VAL 95 10.862 7.822 16.260
401 HG21 VAL 95 1HG2 VAL 95 9.273 9.824 17.978
402 HG22 VAL 95 2HG2 VAL 95 10.684 8.913 18.567
403 HG23 VAL 95 3HG2 VAL 95 10.665 10.689 18.674
404 H LYS 96 H LYS 96 14.886 9.312 16.097
405 HA LYS 96 HA LYS 96 14.943 10.603 13.528
406 HB2 LYS 96 1HB LYS 96 16.995 10.006 14.773
407 HB3 LYS 96 2HB LYS 96 16.614 8.298 14.608
408 HG2 LYS 96 1HG LYS 96 16.876 8.434 12.183
409 HG3 LYS 96 2HG LYS 96 17.163 10.177 12.292
410 HD2 LYS 96 1HD LYS 96 19.173 9.755 13.680
411 HD3 LYS 96 2HD LYS 96 18.887 8.013 13.556
412 HE2 LYS 96 1HE LYS 96 19.251 9.791 11.126
413 HE3 LYS 96 2HE LYS 96 20.600 8.992 11.938
414 HZ1 LYS 96 1HZ LYS 96 19.789 7.703 10.104
415 HZ2 LYS 96 2HZ LYS 96 19.535 6.885 11.514
416 HZ3 LYS 96 3HZ LYS 96 18.275 7.630 10.752
417 H LEU 97 H LEU 97 13.780 10.118 11.826
418 HA LEU 97 HA LEU 97 12.633 7.391 11.637
419 HB2 LEU 97 1HB LEU 97 11.972 9.982 10.195
420 HB3 LEU 97 2HB LEU 97 11.166 8.440 9.892
421 HG LEU 97 HG LEU 97 11.098 10.045 12.471
422 HD11 LEU 97 1HD1 LEU 97 8.714 10.264 11.924
423 HD12 LEU 97 2HD1 LEU 97 9.748 10.966 10.656
424 HD13 LEU 97 3HD1 LEU 97 8.982 9.380 10.404
425 HD21 LEU 97 1HD2 LEU 97 9.534 8.294 13.246
426 HD22 LEU 97 2HD2 LEU 97 9.812 7.380 11.744
427 HD23 LEU 97 3HD2 LEU 97 11.141 7.610 12.904
428 H ASP 98 H ASP 98 13.690 5.945 10.480
429 HA ASP 98 HA ASP 98 15.121 6.842 8.031
430 HB2 ASP 98 1HB ASP 98 15.135 4.187 9.520
431 HB3 ASP 98 2HB ASP 98 15.992 4.474 8.013
432 HA PRO 99 HA PRO 99 12.093 5.580 5.236
433 HB2 PRO 99 1HB PRO 99 14.327 4.095 3.803
434 HB3 PRO 99 2HB PRO 99 13.147 5.233 3.141
435 HG2 PRO 99 1HG PRO 99 15.617 6.107 3.591
436 HG3 PRO 99 2HG PRO 99 14.255 7.133 4.053
437 HD2 PRO 99 1HD PRO 99 15.975 5.325 5.798
438 HD3 PRO 99 2HD PRO 99 15.377 6.998 6.134
439 H ASP 100 H ASP 100 10.627 3.979 5.396
440 HA ASP 100 HA ASP 100 9.700 1.876 5.488
441 HB2 ASP 100 1HB ASP 100 12.470 1.001 4.574
442 HB3 ASP 100 2HB ASP 100 11.060 -0.048 4.635
443 H SER 101 H SER 101 11.306 3.095 7.765
444 HA SER 101 HA SER 101 11.726 0.586 9.318
445 HB2 SER 101 1HB SER 101 13.576 2.186 9.384
446 HB3 SER 101 2HB SER 101 12.492 3.463 9.914
447 HG SER 101 HG SER 101 12.757 1.043 11.301
448 H TYR 102 H TYR 102 10.734 0.269 11.321
449 HA TYR 102 HA TYR 102 8.133 1.717 11.526
450 HB2 TYR 102 1HB TYR 102 8.976 -1.085 12.345
451 HB3 TYR 102 2HB TYR 102 7.472 -0.354 12.889
452 HD1 TYR 102 HD1 TYR 102 9.375 -1.295 9.826
453 HD2 TYR 102 HD2 TYR 102 5.552 -0.400 11.555
454 HE1 TYR 102 HE1 TYR 102 8.262 -2.035 7.748
455 HE2 TYR 102 HE2 TYR 102 4.438 -1.140 9.476
456 HH TYR 102 HH TYR 102 4.709 -1.950 7.433
457 H TYR 103 H TYR 103 7.443 2.630 13.377
458 HA TYR 103 HA TYR 103 9.274 2.485 15.724
459 HB2 TYR 103 1HB TYR 103 8.135 5.047 14.532
460 HB3 TYR 103 2HB TYR 103 9.048 4.937 16.030
461 HD1 TYR 103 HD1 TYR 103 9.241 4.587 12.354
462 HD2 TYR 103 HD2 TYR 103 11.425 4.770 16.042
463 HE1 TYR 103 HE1 TYR 103 11.348 4.871 11.093
464 HE2 TYR 103 HE2 TYR 103 13.532 5.054 14.782
465 HH TYR 103 HH TYR 103 14.230 5.880 12.528
466 H THR 104 H THR 104 8.342 2.534 17.695
467 HA THR 104 HA THR 104 5.393 3.020 17.762
468 HB THR 104 HB THR 104 7.008 1.101 19.496
469 HG1 THR 104 HG1 THR 104 5.474 0.839 17.181
470 HG21 THR 104 1HG2 THR 104 4.815 0.462 20.419
471 HG22 THR 104 2HG2 THR 104 5.160 2.181 20.729
472 HG23 THR 104 3HG2 THR 104 4.030 1.720 19.436
473 H LEU 105 H LEU 105 4.702 4.607 19.000
474 HA LEU 105 HA LEU 105 6.659 5.800 20.912
475 HB2 LEU 105 1HB LEU 105 4.262 7.112 19.586
476 HB3 LEU 105 2HB LEU 105 5.461 7.905 20.612
477 HG LEU 105 HG LEU 105 6.005 6.696 17.877
478 HD11 LEU 105 1HD1 LEU 105 6.238 9.037 17.172
479 HD12 LEU 105 2HD1 LEU 105 4.600 8.691 17.774
480 HD13 LEU 105 3HD1 LEU 105 5.757 9.574 18.798
481 HD21 LEU 105 1HD2 LEU 105 8.201 7.802 18.134
482 HD22 LEU 105 2HD2 LEU 105 7.748 8.323 19.774
483 HD23 LEU 105 3HD2 LEU 105 7.941 6.592 19.412
484 H VAL 106 H VAL 106 6.231 4.778 22.798
485 HA VAL 106 HA VAL 106 3.416 4.450 23.640
486 HB VAL 106 HB VAL 106 6.014 3.558 24.964
487 HG11 VAL 106 1HG1 VAL 106 4.582 2.142 26.354
488 HG12 VAL 106 2HG1 VAL 106 4.239 3.872 26.590
489 HG13 VAL 106 3HG1 VAL 106 3.141 2.871 25.610
490 HG21 VAL 106 1HG2 VAL 106 5.360 1.316 24.147
491 HG22 VAL 106 2HG2 VAL 106 3.945 2.027 23.334
492 HG23 VAL 106 3HG2 VAL 106 5.588 2.452 22.797
493 H SER 107 H SER 107 2.459 6.083 24.628
494 HA SER 107 HA SER 107 4.109 7.897 26.316
495 HB2 SER 107 1HB SER 107 2.807 9.012 24.600
496 HB3 SER 107 2HB SER 107 1.341 8.194 25.112
497 HG SER 107 HG SER 107 2.286 9.278 27.246
498 H GLN 108 H GLN 108 4.254 7.202 28.338
499 HA GLN 108 HA GLN 108 1.741 6.251 29.650
500 HB2 GLN 108 1HB GLN 108 3.375 4.459 29.577
501 HB3 GLN 108 2HB GLN 108 4.643 5.514 30.185
502 HG2 GLN 108 1HG GLN 108 3.925 4.082 31.953
503 HG3 GLN 108 2HG GLN 108 3.366 5.739 32.317
504 HE21 GLN 108 1HE2 GLN 108 0.056 4.808 32.677
505 HE22 GLN 108 2HE2 GLN 108 1.340 5.928 32.990
506 HA PRO 109 HA PRO 109 2.239 10.174 31.754
507 HB2 PRO 109 1HB PRO 109 -0.241 8.996 33.055
508 HB3 PRO 109 2HB PRO 109 0.032 10.642 32.471
509 HG2 PRO 109 1HG PRO 109 -1.436 9.001 30.977
510 HG3 PRO 109 2HG PRO 109 -0.236 10.027 30.186
511 HD2 PRO 109 1HD PRO 109 -0.043 7.082 30.935
512 HD3 PRO 109 2HD PRO 109 0.471 7.905 29.409
513 H GLY 110 H GLY 110 3.174 10.596 33.713
514 HA2 GLY 110 1HA GLY 110 3.514 10.148 36.078
515 HA3 GLY 110 2HA GLY 110 3.172 8.453 35.790
516 H GLY 111 H GLY 111 4.865 8.730 33.219
517 HA2 GLY 111 1HA GLY 111 7.579 8.951 34.429
518 HA3 GLY 111 2HA GLY 111 7.132 7.442 33.656
519 H LYS 112 H LYS 112 8.803 7.722 32.108
520 HA LYS 112 HA LYS 112 8.403 9.961 30.184
521 HB2 LYS 112 1HB LYS 112 10.750 8.069 30.600
522 HB3 LYS 112 2HB LYS 112 10.665 9.273 29.322
523 HG2 LYS 112 1HG LYS 112 10.513 11.061 31.042
524 HG3 LYS 112 2HG LYS 112 10.673 9.829 32.302
525 HD2 LYS 112 1HD LYS 112 12.869 9.164 31.380
526 HD3 LYS 112 2HD LYS 112 12.710 10.389 30.114
527 HE2 LYS 112 1HE LYS 112 12.632 12.164 31.830
528 HE3 LYS 112 2HE LYS 112 12.772 10.947 33.103
529 HZ1 LYS 112 1HZ LYS 112 14.880 11.944 32.599
530 HZ2 LYS 112 2HZ LYS 112 14.915 10.342 32.208
531 HZ3 LYS 112 3HZ LYS 112 14.785 11.478 31.020
532 HA PRO 113 HA PRO 113 6.750 7.274 27.207
533 HB2 PRO 113 1HB PRO 113 7.418 8.583 24.884
534 HB3 PRO 113 2HB PRO 113 6.197 9.204 26.003
535 HG2 PRO 113 1HG PRO 113 9.142 9.961 25.775
536 HG3 PRO 113 2HG PRO 113 7.742 11.033 25.873
537 HD2 PRO 113 1HD PRO 113 9.219 10.449 28.081
538 HD3 PRO 113 2HD PRO 113 7.425 10.660 28.183
539 H GLN 114 H GLN 114 7.334 5.701 25.614
540 HA GLN 114 HA GLN 114 10.260 5.110 25.614
541 HB2 GLN 114 1HB GLN 114 7.940 3.180 25.208
542 HB3 GLN 114 2HB GLN 114 9.642 2.757 25.339
543 HG2 GLN 114 1HG GLN 114 8.015 4.054 27.535
544 HG3 GLN 114 2HG GLN 114 8.370 2.309 27.395
545 HE21 GLN 114 1HE2 GLN 114 10.899 4.685 29.332
546 HE22 GLN 114 2HE2 GLN 114 9.246 5.055 28.970
547 H LEU 115 H LEU 115 11.330 4.571 23.769
548 HA LEU 115 HA LEU 115 9.778 4.909 21.235
549 HB2 LEU 115 1HB LEU 115 11.230 6.826 21.582
550 HB3 LEU 115 2HB LEU 115 12.614 5.774 21.899
551 HG LEU 115 HG LEU 115 12.562 4.999 19.551
552 HD11 LEU 115 1HD1 LEU 115 11.095 6.129 17.939
553 HD12 LEU 115 2HD1 LEU 115 10.163 5.237 19.163
554 HD13 LEU 115 3HD1 LEU 115 10.308 7.008 19.271
555 HD21 LEU 115 1HD2 LEU 115 13.313 7.132 18.553
556 HD22 LEU 115 2HD2 LEU 115 12.557 8.027 19.894
557 HD23 LEU 115 3HD2 LEU 115 13.936 6.947 20.210
558 H VAL 116 H VAL 116 9.545 3.001 20.306
559 HA VAL 116 HA VAL 116 11.861 1.120 20.367
560 HB VAL 116 HB VAL 116 8.920 0.567 19.784
561 HG11 VAL 116 1HG1 VAL 116 9.561 -1.793 19.867
562 HG12 VAL 116 2HG1 VAL 116 10.384 -0.924 18.549
563 HG13 VAL 116 3HG1 VAL 116 11.268 -1.322 20.043
564 HG21 VAL 116 1HG2 VAL 116 8.970 -0.604 21.963
565 HG22 VAL 116 2HG2 VAL 116 10.657 -0.089 22.199
566 HG23 VAL 116 3HG2 VAL 116 9.355 1.123 22.152
567 H ALA 117 H ALA 117 13.042 1.016 18.597
568 HA ALA 117 HA ALA 117 11.752 1.764 16.013
569 HB1 ALA 117 1HB ALA 117 14.036 2.302 15.228
570 HB2 ALA 117 2HB ALA 117 13.592 3.250 16.668
571 HB3 ALA 117 3HB ALA 117 14.681 1.853 16.823
572 H GLU 118 H GLU 118 11.776 0.430 14.307
573 HA GLU 118 HA GLU 118 13.321 -2.112 14.596
574 HB2 GLU 118 1HB GLU 118 10.909 -2.528 14.973
575 HB3 GLU 118 2HB GLU 118 10.526 -1.773 13.431
576 HG2 GLU 118 1HG GLU 118 11.747 -3.528 12.243
577 HG3 GLU 118 2HG GLU 118 12.198 -4.272 13.775
578 HA PRO 119 HA PRO 119 15.196 -0.603 10.890
579 HB2 PRO 119 1HB PRO 119 16.014 -3.535 10.848
580 HB3 PRO 119 2HB PRO 119 17.006 -2.102 10.553
581 HG2 PRO 119 1HG PRO 119 17.198 -3.290 12.922
582 HG3 PRO 119 2HG PRO 119 17.115 -1.527 12.863
583 HD2 PRO 119 1HD PRO 119 14.914 -3.532 13.498
584 HD3 PRO 119 2HD PRO 119 15.289 -1.956 14.304
Start of MODEL 3
1 H GLN 38 1H GLN 38 -1.024 -0.806 0.214
2 HA GLN 38 HA GLN 38 1.144 -0.402 1.069
3 HB2 GLN 38 1HB GLN 38 0.942 -1.699 -0.993
4 HB3 GLN 38 2HB GLN 38 0.836 -0.230 -1.954
5 HG2 GLN 38 1HG GLN 38 3.032 -1.128 -2.180
6 HG3 GLN 38 2HG GLN 38 3.144 0.365 -1.206
7 HE21 GLN 38 1HE2 GLN 38 4.850 -1.206 1.356
8 HE22 GLN 38 2HE2 GLN 38 4.509 0.220 0.434
9 H ALA 39 H ALA 39 2.226 1.183 1.968
10 HA ALA 39 HA ALA 39 2.049 3.910 1.003
11 HB1 ALA 39 1HB ALA 39 3.685 4.394 2.795
12 HB2 ALA 39 2HB ALA 39 2.322 3.419 3.392
13 HB3 ALA 39 3HB ALA 39 3.892 2.649 3.067
14 HA PRO 40 HA PRO 40 5.224 4.114 -1.951
15 HB2 PRO 40 1HB PRO 40 6.030 6.654 -0.488
16 HB3 PRO 40 2HB PRO 40 5.751 6.408 -2.216
17 HG2 PRO 40 1HG PRO 40 3.852 7.612 -0.796
18 HG3 PRO 40 2HG PRO 40 3.382 6.385 -1.976
19 HD2 PRO 40 1HD PRO 40 3.670 6.128 1.046
20 HD3 PRO 40 2HD PRO 40 2.368 5.484 -0.035
21 H LYS 41 H LYS 41 7.328 3.440 -2.104
22 HA LYS 41 HA LYS 41 8.620 2.326 0.151
23 HB2 LYS 41 1HB LYS 41 9.050 1.597 -2.171
24 HB3 LYS 41 2HB LYS 41 9.812 3.140 -2.530
25 HG2 LYS 41 1HG LYS 41 11.566 1.593 -2.179
26 HG3 LYS 41 2HG LYS 41 11.514 2.604 -0.728
27 HD2 LYS 41 1HD LYS 41 10.254 0.868 0.469
28 HD3 LYS 41 2HD LYS 41 10.222 -0.136 -0.989
29 HE2 LYS 41 1HE LYS 41 12.688 -0.269 -0.959
30 HE3 LYS 41 2HE LYS 41 12.731 0.743 0.487
31 HZ1 LYS 41 1HZ LYS 41 12.898 -1.574 1.027
32 HZ2 LYS 41 2HZ LYS 41 11.498 -0.960 1.644
33 HZ3 LYS 41 3HZ LYS 41 11.459 -1.906 0.293
34 H GLY 42 H GLY 42 9.715 3.156 1.759
35 HA2 GLY 42 1HA GLY 42 11.665 4.553 2.415
36 HA3 GLY 42 2HA GLY 42 11.058 5.803 1.345
37 H SER 43 H SER 43 8.224 5.061 2.243
38 HA SER 43 HA SER 43 7.965 7.112 4.212
39 HB2 SER 43 1HB SER 43 6.139 6.528 2.711
40 HB3 SER 43 2HB SER 43 6.066 4.900 3.368
41 HG SER 43 HG SER 43 5.722 5.996 5.434
42 H ALA 44 H ALA 44 8.080 7.122 6.349
43 HA ALA 44 HA ALA 44 8.256 4.476 7.720
44 HB1 ALA 44 1HB ALA 44 9.645 5.614 9.422
45 HB2 ALA 44 2HB ALA 44 10.373 5.716 7.801
46 HB3 ALA 44 3HB ALA 44 9.534 7.125 8.490
47 H PHE 45 H PHE 45 7.257 4.188 9.708
48 HA PHE 45 HA PHE 45 5.161 6.230 10.317
49 HB2 PHE 45 1HB PHE 45 4.863 3.202 10.222
50 HB3 PHE 45 2HB PHE 45 3.655 4.292 10.885
51 HD1 PHE 45 HD1 PHE 45 5.320 3.147 7.818
52 HD2 PHE 45 HD2 PHE 45 2.280 5.661 9.455
53 HE1 PHE 45 HE1 PHE 45 4.345 3.433 5.564
54 HE2 PHE 45 HE2 PHE 45 1.300 5.947 7.204
55 HZ PHE 45 HZ PHE 45 2.335 4.833 5.257
56 H VAL 46 H VAL 46 4.832 6.733 12.401
57 HA VAL 46 HA VAL 46 6.225 5.045 14.439
58 HB VAL 46 HB VAL 46 5.522 8.009 14.585
59 HG11 VAL 46 1HG1 VAL 46 6.827 7.998 16.655
60 HG12 VAL 46 2HG1 VAL 46 5.407 6.931 16.758
61 HG13 VAL 46 3HG1 VAL 46 7.028 6.235 16.518
62 HG21 VAL 46 1HG2 VAL 46 7.972 8.342 14.480
63 HG22 VAL 46 2HG2 VAL 46 8.199 6.589 14.272
64 HG23 VAL 46 3HG2 VAL 46 7.368 7.535 13.013
65 H ARG 47 H ARG 47 4.846 3.800 15.494
66 HA ARG 47 HA ARG 47 2.003 4.572 15.621
67 HB2 ARG 47 1HB ARG 47 2.576 2.279 14.959
68 HB3 ARG 47 2HB ARG 47 3.441 2.034 16.468
69 HG2 ARG 47 1HG ARG 47 1.472 1.966 17.736
70 HG3 ARG 47 2HG ARG 47 0.509 2.736 16.451
71 HD2 ARG 47 1HD ARG 47 1.800 0.027 16.230
72 HD3 ARG 47 2HD ARG 47 0.111 0.315 16.712
73 HE ARG 47 HE ARG 47 0.487 1.667 14.304
74 HH11 ARG 47 1HH1 ARG 47 0.634 -1.644 15.467
75 HH12 ARG 47 2HH1 ARG 47 0.162 -2.337 13.930
76 HH21 ARG 47 1HH2 ARG 47 -0.122 0.757 12.316
77 HH22 ARG 47 2HH2 ARG 47 -0.265 -0.978 12.146
78 H ALA 48 H ALA 48 1.532 5.980 17.183
79 HA ALA 48 HA ALA 48 2.863 5.845 19.784
80 HB1 ALA 48 1HB ALA 48 1.404 7.760 20.356
81 HB2 ALA 48 2HB ALA 48 2.268 8.022 18.821
82 HB3 ALA 48 3HB ALA 48 0.550 7.559 18.808
83 H TYR 49 H TYR 49 1.979 5.309 21.745
84 HA TYR 49 HA TYR 49 -0.676 3.942 21.629
85 HB2 TYR 49 1HB TYR 49 1.068 2.230 21.732
86 HB3 TYR 49 2HB TYR 49 1.834 3.036 23.093
87 HD1 TYR 49 HD1 TYR 49 -1.377 1.430 22.062
88 HD2 TYR 49 HD2 TYR 49 1.276 2.459 25.272
89 HE1 TYR 49 HE1 TYR 49 -2.754 0.101 23.625
90 HE2 TYR 49 HE2 TYR 49 -0.101 1.129 26.836
91 HH TYR 49 HH TYR 49 -3.049 -0.526 25.740
92 H ASN 50 H ASN 50 -2.127 4.576 23.047
93 HA ASN 50 HA ASN 50 -1.340 6.624 25.011
94 HB2 ASN 50 1HB ASN 50 -3.359 6.912 23.591
95 HB3 ASN 50 2HB ASN 50 -4.076 5.491 24.340
96 HD21 ASN 50 1HD2 ASN 50 -5.193 8.698 25.974
97 HD22 ASN 50 2HD2 ASN 50 -5.070 8.198 24.320
98 H ALA 51 H ALA 51 -0.259 5.702 26.656
99 HA ALA 51 HA ALA 51 -1.392 3.279 27.907
100 HB1 ALA 51 1HB ALA 51 0.702 3.268 29.225
101 HB2 ALA 51 2HB ALA 51 1.024 3.337 27.476
102 HB3 ALA 51 3HB ALA 51 1.177 4.806 28.468
103 H GLY 52 H GLY 52 -2.278 6.306 28.087
104 HA2 GLY 52 1HA GLY 52 -2.245 6.586 31.046
105 HA3 GLY 52 2HA GLY 52 -2.709 7.825 29.896
106 H ASN 53 H ASN 53 -4.526 7.954 31.528
107 HA ASN 53 HA ASN 53 -6.624 5.907 30.964
108 HB2 ASN 53 1HB ASN 53 -6.293 7.845 33.275
109 HB3 ASN 53 2HB ASN 53 -7.732 6.867 33.016
110 HD21 ASN 53 1HD2 ASN 53 -4.956 5.319 35.217
111 HD22 ASN 53 2HD2 ASN 53 -5.398 6.984 35.034
112 H SER 54 H SER 54 -5.672 8.597 29.605
113 HA SER 54 HA SER 54 -8.360 9.294 28.710
114 HB2 SER 54 1HB SER 54 -8.366 11.586 29.407
115 HB3 SER 54 2HB SER 54 -8.095 10.602 30.836
116 HG SER 54 HG SER 54 -6.291 12.145 29.363
117 H GLU 55 H GLU 55 -8.166 11.356 27.233
118 HA GLU 55 HA GLU 55 -6.321 10.794 25.146
119 HB2 GLU 55 1HB GLU 55 -8.446 12.074 24.866
120 HB3 GLU 55 2HB GLU 55 -7.744 13.417 25.757
121 HG2 GLU 55 1HG GLU 55 -6.018 13.670 24.023
122 HG3 GLU 55 2HG GLU 55 -6.715 12.320 23.131
123 H LEU 56 H LEU 56 -4.267 11.262 24.820
124 HA LEU 56 HA LEU 56 -2.967 13.081 26.800
125 HB2 LEU 56 1HB LEU 56 -1.751 10.787 25.221
126 HB3 LEU 56 2HB LEU 56 -0.919 11.782 26.419
127 HG LEU 56 HG LEU 56 -3.216 9.873 26.980
128 HD11 LEU 56 1HD1 LEU 56 -1.491 8.557 28.129
129 HD12 LEU 56 2HD1 LEU 56 -1.134 8.741 26.395
130 HD13 LEU 56 3HD1 LEU 56 -0.252 9.716 27.595
131 HD21 LEU 56 1HD2 LEU 56 -2.712 10.382 29.345
132 HD22 LEU 56 2HD2 LEU 56 -1.489 11.568 28.830
133 HD23 LEU 56 3HD2 LEU 56 -3.208 11.848 28.467
134 H ASP 57 H ASP 57 -1.407 14.543 26.140
135 HA ASP 57 HA ASP 57 -1.802 15.553 23.431
136 HB2 ASP 57 1HB ASP 57 -1.547 17.042 25.436
137 HB3 ASP 57 2HB ASP 57 0.120 16.504 25.593
138 H VAL 58 H VAL 58 -0.992 13.860 22.139
139 HA VAL 58 HA VAL 58 1.982 13.575 22.242
140 HB VAL 58 HB VAL 58 -0.105 11.617 21.188
141 HG11 VAL 58 1HG1 VAL 58 1.778 10.085 20.876
142 HG12 VAL 58 2HG1 VAL 58 1.931 11.544 19.867
143 HG13 VAL 58 3HG1 VAL 58 2.906 11.377 21.347
144 HG21 VAL 58 1HG2 VAL 58 0.644 10.209 23.079
145 HG22 VAL 58 2HG2 VAL 58 1.733 11.511 23.615
146 HG23 VAL 58 3HG2 VAL 58 -0.030 11.752 23.654
147 H SER 59 H SER 59 3.090 14.366 20.592
148 HA SER 59 HA SER 59 1.984 14.103 17.875
149 HB2 SER 59 1HB SER 59 2.321 16.412 17.272
150 HB3 SER 59 2HB SER 59 1.245 16.351 18.660
151 HG SER 59 HG SER 59 3.950 17.041 18.526
152 H VAL 60 H VAL 60 3.570 14.380 16.205
153 HA VAL 60 HA VAL 60 6.372 14.160 17.209
154 HB VAL 60 HB VAL 60 5.093 12.434 15.046
155 HG11 VAL 60 1HG1 VAL 60 7.226 11.234 15.046
156 HG12 VAL 60 2HG1 VAL 60 7.420 12.937 14.568
157 HG13 VAL 60 3HG1 VAL 60 7.888 12.412 16.204
158 HG21 VAL 60 1HG2 VAL 60 5.449 10.586 16.652
159 HG22 VAL 60 2HG2 VAL 60 6.052 11.751 17.856
160 HG23 VAL 60 3HG2 VAL 60 4.354 11.819 17.322
161 H GLY 61 H GLY 61 7.680 15.577 16.299
162 HA2 GLY 61 1HA GLY 61 8.650 16.960 14.708
163 HA3 GLY 61 2HA GLY 61 7.795 16.052 13.475
164 H SER 62 H SER 62 6.302 17.116 12.337
165 HA SER 62 HA SER 62 5.088 19.555 13.570
166 HB2 SER 62 1HB SER 62 4.821 20.413 11.295
167 HB3 SER 62 2HB SER 62 6.507 20.054 11.631
168 HG SER 62 HG SER 62 4.840 18.128 10.491
169 H THR 63 H THR 63 4.393 16.458 13.168
170 HA THR 63 HA THR 63 1.678 16.875 12.028
171 HB THR 63 HB THR 63 3.173 14.300 12.692
172 HG1 THR 63 HG1 THR 63 3.542 14.208 10.530
173 HG21 THR 63 1HG2 THR 63 1.326 13.192 11.495
174 HG22 THR 63 2HG2 THR 63 0.725 14.062 12.927
175 HG23 THR 63 3HG2 THR 63 0.504 14.758 11.304
176 H SER 64 H SER 64 0.020 17.186 13.306
177 HA SER 64 HA SER 64 0.343 16.726 16.198
178 HB2 SER 64 1HB SER 64 -1.673 18.021 16.439
179 HB3 SER 64 2HB SER 64 -0.623 18.842 15.295
180 HG SER 64 HG SER 64 -2.914 18.544 14.772
181 H LEU 65 H LEU 65 -1.620 15.892 17.404
182 HA LEU 65 HA LEU 65 -3.285 13.964 15.975
183 HB2 LEU 65 1HB LEU 65 -1.271 12.624 16.217
184 HB3 LEU 65 2HB LEU 65 -1.158 13.031 17.932
185 HG LEU 65 HG LEU 65 -3.349 11.808 18.273
186 HD11 LEU 65 1HD1 LEU 65 -4.043 10.253 16.506
187 HD12 LEU 65 2HD1 LEU 65 -4.158 11.947 15.974
188 HD13 LEU 65 3HD1 LEU 65 -2.805 10.931 15.423
189 HD21 LEU 65 1HD2 LEU 65 -2.274 9.585 18.156
190 HD22 LEU 65 2HD2 LEU 65 -1.009 10.252 17.096
191 HD23 LEU 65 3HD2 LEU 65 -1.145 10.810 18.781
192 H ASN 66 H ASN 66 -5.176 13.667 16.971
193 HA ASN 66 HA ASN 66 -5.380 14.036 19.886
194 HB2 ASN 66 1HB ASN 66 -7.161 15.709 19.727
195 HB3 ASN 66 2HB ASN 66 -5.653 16.323 19.060
196 HD21 ASN 66 1HD2 ASN 66 -7.464 17.404 16.307
197 HD22 ASN 66 2HD2 ASN 66 -6.475 17.801 17.673
198 H ASP 67 H ASP 67 -7.882 13.911 20.453
199 HA ASP 67 HA ASP 67 -9.693 12.498 20.585
200 HB2 ASP 67 1HB ASP 67 -9.971 13.473 18.198
201 HB3 ASP 67 2HB ASP 67 -9.349 11.930 17.626
202 H VAL 68 H VAL 68 -7.316 11.386 21.363
203 HA VAL 68 HA VAL 68 -7.387 8.637 20.209
204 HB VAL 68 HB VAL 68 -5.265 9.980 21.939
205 HG11 VAL 68 1HG1 VAL 68 -3.895 8.020 21.416
206 HG12 VAL 68 2HG1 VAL 68 -5.363 7.585 22.323
207 HG13 VAL 68 3HG1 VAL 68 -5.276 7.282 20.571
208 HG21 VAL 68 1HG2 VAL 68 -3.919 9.954 19.862
209 HG22 VAL 68 2HG2 VAL 68 -5.306 9.279 18.973
210 HG23 VAL 68 3HG2 VAL 68 -5.399 10.920 19.657
211 H ALA 69 H ALA 69 -8.433 7.139 21.302
212 HA ALA 69 HA ALA 69 -9.383 7.660 23.994
213 HB1 ALA 69 1HB ALA 69 -10.415 5.420 23.804
214 HB2 ALA 69 2HB ALA 69 -10.761 6.429 22.379
215 HB3 ALA 69 3HB ALA 69 -9.528 5.150 22.286
216 HA PRO 70 HA PRO 70 -6.309 5.934 26.534
217 HB2 PRO 70 1HB PRO 70 -8.587 4.345 27.774
218 HB3 PRO 70 2HB PRO 70 -7.340 5.310 28.576
219 HG2 PRO 70 1HG PRO 70 -9.772 6.357 28.331
220 HG3 PRO 70 2HG PRO 70 -8.371 7.379 28.000
221 HD2 PRO 70 1HD PRO 70 -10.208 5.950 26.038
222 HD3 PRO 70 2HD PRO 70 -9.534 7.626 25.954
223 H LEU 71 H LEU 71 -4.942 4.256 26.246
224 HA LEU 71 HA LEU 71 -4.127 2.179 25.677
225 HB2 LEU 71 1HB LEU 71 -6.992 1.200 25.907
226 HB3 LEU 71 2HB LEU 71 -5.525 0.216 25.957
227 HG LEU 71 HG LEU 71 -6.404 2.229 28.058
228 HD11 LEU 71 1HD1 LEU 71 -6.706 0.229 29.448
229 HD12 LEU 71 2HD1 LEU 71 -7.753 0.194 28.010
230 HD13 LEU 71 3HD1 LEU 71 -6.279 -0.800 28.060
231 HD21 LEU 71 1HD2 LEU 71 -4.470 1.363 29.330
232 HD22 LEU 71 2HD2 LEU 71 -4.010 0.349 27.941
233 HD23 LEU 71 3HD2 LEU 71 -3.946 2.123 27.808
234 H GLY 72 H GLY 72 -5.527 4.112 23.736
235 HA2 GLY 72 1HA GLY 72 -5.992 2.239 21.475
236 HA3 GLY 72 2HA GLY 72 -6.293 3.967 21.467
237 H SER 73 H SER 73 -5.110 3.744 19.367
238 HA SER 73 HA SER 73 -2.318 4.502 19.740
239 HB2 SER 73 1HB SER 73 -1.333 2.748 18.410
240 HB3 SER 73 2HB SER 73 -2.199 2.016 19.751
241 HG SER 73 HG SER 73 -3.101 2.326 17.103
242 H SER 74 H SER 74 -1.293 5.186 17.733
243 HA SER 74 HA SER 74 -2.917 5.379 15.325
244 HB2 SER 74 1HB SER 74 -3.909 7.193 16.650
245 HB3 SER 74 2HB SER 74 -2.318 7.886 16.929
246 HG SER 74 HG SER 74 -2.109 8.197 14.733
247 H ASP 75 H ASP 75 -1.738 5.869 13.520
248 HA ASP 75 HA ASP 75 1.187 5.738 13.971
249 HB2 ASP 75 1HB ASP 75 -0.510 5.267 11.489
250 HB3 ASP 75 2HB ASP 75 1.246 5.177 11.513
251 H PHE 76 H PHE 76 2.524 7.375 13.615
252 HA PHE 76 HA PHE 76 1.539 9.762 12.173
253 HB2 PHE 76 1HB PHE 76 4.118 9.160 13.665
254 HB3 PHE 76 2HB PHE 76 3.856 10.647 12.767
255 HD1 PHE 76 HD1 PHE 76 2.902 8.702 15.724
256 HD2 PHE 76 HD2 PHE 76 2.316 12.340 13.561
257 HE1 PHE 76 HE1 PHE 76 1.795 9.696 17.699
258 HE2 PHE 76 HE2 PHE 76 1.212 13.338 15.535
259 HZ PHE 76 HZ PHE 76 0.950 12.014 17.604
260 H LYS 77 H LYS 77 1.844 10.085 10.091
261 HA LYS 77 HA LYS 77 3.558 8.140 8.651
262 HB2 LYS 77 1HB LYS 77 1.195 8.371 7.942
263 HB3 LYS 77 2HB LYS 77 1.450 10.080 7.620
264 HG2 LYS 77 1HG LYS 77 3.061 9.525 5.849
265 HG3 LYS 77 2HG LYS 77 2.847 7.801 6.188
266 HD2 LYS 77 1HD LYS 77 0.448 7.983 5.614
267 HD3 LYS 77 2HD LYS 77 0.657 9.709 5.286
268 HE2 LYS 77 1HE LYS 77 2.304 9.151 3.506
269 HE3 LYS 77 2HE LYS 77 2.035 7.433 3.814
270 HZ1 LYS 77 1HZ LYS 77 0.731 8.215 1.976
271 HZ2 LYS 77 2HZ LYS 77 -0.264 7.744 3.204
272 HZ3 LYS 77 3HZ LYS 77 -0.013 9.349 2.915
273 H PHE 78 H PHE 78 5.549 8.683 8.184
274 HA PHE 78 HA PHE 78 6.025 11.477 7.236
275 HB2 PHE 78 1HB PHE 78 7.914 9.732 8.865
276 HB3 PHE 78 2HB PHE 78 8.331 11.287 8.166
277 HD1 PHE 78 HD1 PHE 78 6.881 9.587 10.959
278 HD2 PHE 78 HD2 PHE 78 7.022 13.340 8.923
279 HE1 PHE 78 HE1 PHE 78 6.050 10.720 12.993
280 HE2 PHE 78 HE2 PHE 78 6.194 14.477 10.956
281 HZ PHE 78 HZ PHE 78 5.706 13.165 12.992
282 H LEU 79 H LEU 79 5.830 10.991 5.079
283 HA LEU 79 HA LEU 79 7.028 8.818 3.732
284 HB2 LEU 79 1HB LEU 79 5.404 10.238 2.637
285 HB3 LEU 79 2HB LEU 79 6.447 11.653 2.812
286 HG LEU 79 HG LEU 79 8.072 10.626 1.236
287 HD11 LEU 79 1HD1 LEU 79 7.402 8.633 -0.032
288 HD12 LEU 79 2HD1 LEU 79 7.568 8.283 1.704
289 HD13 LEU 79 3HD1 LEU 79 5.952 8.474 0.985
290 HD21 LEU 79 1HD2 LEU 79 6.662 10.914 -0.775
291 HD22 LEU 79 2HD2 LEU 79 5.200 10.786 0.232
292 HD23 LEU 79 3HD2 LEU 79 6.307 12.165 0.441
293 HA PRO 80 HA PRO 80 10.968 11.382 3.277
294 HB2 PRO 80 1HB PRO 80 11.268 13.805 4.421
295 HB3 PRO 80 2HB PRO 80 10.336 13.639 2.927
296 HG2 PRO 80 1HG PRO 80 9.324 13.810 5.800
297 HG3 PRO 80 2HG PRO 80 8.777 14.727 4.393
298 HD2 PRO 80 1HD PRO 80 7.510 12.436 5.269
299 HD3 PRO 80 2HD PRO 80 7.524 12.949 3.533
300 HA PRO 81 HA PRO 81 12.126 9.805 7.282
301 HB2 PRO 81 1HB PRO 81 14.663 9.017 6.641
302 HB3 PRO 81 2HB PRO 81 13.244 8.126 6.077
303 HG2 PRO 81 1HG PRO 81 14.891 10.225 4.603
304 HG3 PRO 81 2HG PRO 81 14.368 8.641 4.022
305 HD2 PRO 81 1HD PRO 81 12.989 10.921 3.411
306 HD3 PRO 81 2HD PRO 81 12.151 9.337 3.658
307 H GLY 82 H GLY 82 13.874 10.274 8.879
308 HA2 GLY 82 1HA GLY 82 15.926 11.946 9.013
309 HA3 GLY 82 2HA GLY 82 14.680 13.134 8.677
310 H SER 83 H SER 83 15.598 13.873 10.846
311 HA SER 83 HA SER 83 14.731 12.290 13.169
312 HB2 SER 83 1HB SER 83 16.883 13.394 13.292
313 HB3 SER 83 2HB SER 83 16.167 14.948 12.895
314 HG SER 83 HG SER 83 14.819 14.504 14.821
315 H TYR 84 H TYR 84 12.883 12.510 14.208
316 HA TYR 84 HA TYR 84 11.516 15.158 14.086
317 HB2 TYR 84 1HB TYR 84 10.163 12.434 13.918
318 HB3 TYR 84 2HB TYR 84 9.331 13.978 14.040
319 HD1 TYR 84 HD1 TYR 84 11.212 11.722 11.859
320 HD2 TYR 84 HD2 TYR 84 9.284 15.543 12.162
321 HE1 TYR 84 HE1 TYR 84 11.235 11.929 9.397
322 HE2 TYR 84 HE2 TYR 84 9.307 15.749 9.699
323 HH TYR 84 HH TYR 84 10.450 13.111 7.642
324 H THR 85 H THR 85 10.389 15.802 15.903
325 HA THR 85 HA THR 85 11.389 14.468 18.358
326 HB THR 85 HB THR 85 10.153 17.227 17.958
327 HG1 THR 85 HG1 THR 85 12.343 17.869 18.373
328 HG21 THR 85 1HG2 THR 85 10.896 17.642 20.270
329 HG22 THR 85 2HG2 THR 85 9.715 16.312 20.211
330 HG23 THR 85 3HG2 THR 85 11.448 15.956 20.400
331 H ALA 86 H ALA 86 10.130 13.068 19.329
332 HA ALA 86 HA ALA 86 7.224 13.169 18.961
333 HB1 ALA 86 1HB ALA 86 7.225 11.111 20.333
334 HB2 ALA 86 2HB ALA 86 8.373 11.001 18.978
335 HB3 ALA 86 3HB ALA 86 8.968 11.316 20.625
336 H GLN 87 H GLN 87 6.473 14.995 19.940
337 HA GLN 87 HA GLN 87 7.147 15.587 22.718
338 HB2 GLN 87 1HB GLN 87 6.621 17.395 21.112
339 HB3 GLN 87 2HB GLN 87 5.002 16.746 20.893
340 HG2 GLN 87 1HG GLN 87 4.840 18.597 22.362
341 HG3 GLN 87 2HG GLN 87 4.602 17.125 23.346
342 HE21 GLN 87 1HE2 GLN 87 6.909 18.314 25.649
343 HE22 GLN 87 2HE2 GLN 87 5.326 17.694 25.315
344 H VAL 88 H VAL 88 6.323 14.655 24.430
345 HA VAL 88 HA VAL 88 3.523 13.636 24.270
346 HB VAL 88 HB VAL 88 5.888 12.211 25.564
347 HG11 VAL 88 1HG1 VAL 88 4.290 10.417 26.027
348 HG12 VAL 88 2HG1 VAL 88 3.851 11.930 26.855
349 HG13 VAL 88 3HG1 VAL 88 2.971 11.428 25.391
350 HG21 VAL 88 1HG2 VAL 88 5.460 10.486 23.841
351 HG22 VAL 88 2HG2 VAL 88 4.182 11.506 23.139
352 HG23 VAL 88 3HG2 VAL 88 5.877 12.049 23.098
353 H GLY 89 H GLY 89 2.528 15.136 25.497
354 HA2 GLY 89 1HA GLY 89 1.871 16.241 27.429
355 HA3 GLY 89 2HA GLY 89 2.852 15.111 28.344
356 H GLN 90 H GLN 90 4.396 16.040 29.516
357 HA GLN 90 HA GLN 90 5.437 18.689 28.679
358 HB2 GLN 90 1HB GLN 90 5.764 17.153 31.289
359 HB3 GLN 90 2HB GLN 90 6.407 18.758 30.974
360 HG2 GLN 90 1HG GLN 90 3.476 18.006 30.983
361 HG3 GLN 90 2HG GLN 90 4.360 18.850 32.286
362 HE21 GLN 90 1HE2 GLN 90 2.551 21.013 29.544
363 HE22 GLN 90 2HE2 GLN 90 2.145 19.402 30.038
364 H GLN 91 H GLN 91 6.193 15.523 28.179
365 HA GLN 91 HA GLN 91 9.130 16.067 28.221
366 HB2 GLN 91 1HB GLN 91 7.683 13.389 28.154
367 HB3 GLN 91 2HB GLN 91 9.425 13.616 28.210
368 HG2 GLN 91 1HG GLN 91 7.470 14.469 30.356
369 HG3 GLN 91 2HG GLN 91 8.517 13.022 30.390
370 HE21 GLN 91 1HE2 GLN 91 9.882 16.295 32.045
371 HE22 GLN 91 2HE2 GLN 91 8.229 15.800 31.879
372 H SER 92 H SER 92 10.357 14.838 26.499
373 HA SER 92 HA SER 92 8.862 14.396 24.004
374 HB2 SER 92 1HB SER 92 10.123 15.989 22.696
375 HB3 SER 92 2HB SER 92 9.329 16.837 24.014
376 HG SER 92 HG SER 92 11.476 17.441 23.765
377 H LEU 93 H LEU 93 10.067 13.320 22.384
378 HA LEU 93 HA LEU 93 12.785 12.416 23.137
379 HB2 LEU 93 1HB LEU 93 11.291 10.726 24.099
380 HB3 LEU 93 2HB LEU 93 10.468 10.539 22.548
381 HG LEU 93 HG LEU 93 12.587 9.660 21.566
382 HD11 LEU 93 1HD1 LEU 93 14.418 9.048 23.082
383 HD12 LEU 93 2HD1 LEU 93 14.149 10.807 23.053
384 HD13 LEU 93 3HD1 LEU 93 13.567 9.839 24.429
385 HD21 LEU 93 1HD2 LEU 93 12.481 7.489 22.740
386 HD22 LEU 93 2HD2 LEU 93 11.602 8.258 24.084
387 HD23 LEU 93 3HD2 LEU 93 10.851 8.153 22.474
388 HA PRO 94 HA PRO 94 12.824 13.248 18.756
389 HB2 PRO 94 1HB PRO 94 15.529 13.612 18.537
390 HB3 PRO 94 2HB PRO 94 14.470 14.857 19.213
391 HG2 PRO 94 1HG PRO 94 16.152 12.778 20.678
392 HG3 PRO 94 2HG PRO 94 16.047 14.514 20.986
393 HD2 PRO 94 1HD PRO 94 14.592 12.719 22.438
394 HD3 PRO 94 2HD PRO 94 13.941 14.356 22.030
395 H VAL 95 H VAL 95 13.254 11.917 17.012
396 HA VAL 95 HA VAL 95 15.029 9.586 17.359
397 HB VAL 95 HB VAL 95 12.841 8.791 18.208
398 HG11 VAL 95 1HG1 VAL 95 10.901 8.666 16.723
399 HG12 VAL 95 2HG1 VAL 95 11.393 10.348 17.036
400 HG13 VAL 95 3HG1 VAL 95 11.793 9.577 15.481
401 HG21 VAL 95 1HG2 VAL 95 12.598 6.858 16.683
402 HG22 VAL 95 2HG2 VAL 95 13.548 7.716 15.447
403 HG23 VAL 95 3HG2 VAL 95 14.312 7.233 16.980
404 H LYS 96 H LYS 96 16.054 9.078 15.528
405 HA LYS 96 HA LYS 96 15.271 10.420 13.030
406 HB2 LYS 96 1HB LYS 96 17.668 10.214 13.697
407 HB3 LYS 96 2HB LYS 96 17.537 8.463 13.589
408 HG2 LYS 96 1HG LYS 96 17.070 8.619 11.187
409 HG3 LYS 96 2HG LYS 96 17.132 10.385 11.279
410 HD2 LYS 96 1HD LYS 96 19.485 10.268 12.029
411 HD3 LYS 96 2HD LYS 96 19.424 8.502 11.948
412 HE2 LYS 96 1HE LYS 96 18.941 8.632 9.522
413 HE3 LYS 96 2HE LYS 96 19.015 10.395 9.604
414 HZ1 LYS 96 1HZ LYS 96 21.075 9.459 8.847
415 HZ2 LYS 96 2HZ LYS 96 21.304 10.208 10.299
416 HZ3 LYS 96 3HZ LYS 96 21.235 8.562 10.222
417 H LEU 97 H LEU 97 14.001 9.614 11.539
418 HA LEU 97 HA LEU 97 13.125 6.802 11.846
419 HB2 LEU 97 1HB LEU 97 12.012 8.963 10.025
420 HB3 LEU 97 2HB LEU 97 11.259 7.416 10.425
421 HG LEU 97 HG LEU 97 11.676 9.770 12.298
422 HD11 LEU 97 1HD1 LEU 97 9.221 9.815 12.303
423 HD12 LEU 97 2HD1 LEU 97 9.879 10.056 10.668
424 HD13 LEU 97 3HD1 LEU 97 9.193 8.479 11.130
425 HD21 LEU 97 1HD2 LEU 97 10.465 8.381 13.946
426 HD22 LEU 97 2HD2 LEU 97 10.455 7.023 12.795
427 HD23 LEU 97 3HD2 LEU 97 11.996 7.613 13.462
428 H ASP 98 H ASP 98 14.186 5.310 10.757
429 HA ASP 98 HA ASP 98 15.740 5.899 8.392
430 HB2 ASP 98 1HB ASP 98 14.890 3.302 9.718
431 HB3 ASP 98 2HB ASP 98 15.869 3.344 8.259
432 HA PRO 99 HA PRO 99 12.841 5.677 5.164
433 HB2 PRO 99 1HB PRO 99 14.923 3.890 3.846
434 HB3 PRO 99 2HB PRO 99 14.069 5.283 3.171
435 HG2 PRO 99 1HG PRO 99 16.578 5.625 3.980
436 HG3 PRO 99 2HG PRO 99 15.381 6.857 4.388
437 HD2 PRO 99 1HD PRO 99 16.505 4.624 6.125
438 HD3 PRO 99 2HD PRO 99 16.175 6.350 6.558
439 H ASP 100 H ASP 100 11.088 4.406 5.008
440 HA ASP 100 HA ASP 100 9.719 2.556 5.080
441 HB2 ASP 100 1HB ASP 100 11.227 2.056 3.053
442 HB3 ASP 100 2HB ASP 100 12.115 0.964 4.106
443 H SER 101 H SER 101 10.218 3.027 7.514
444 HA SER 101 HA SER 101 10.693 0.355 8.692
445 HB2 SER 101 1HB SER 101 12.200 1.172 10.381
446 HB3 SER 101 2HB SER 101 12.861 1.585 8.806
447 HG SER 101 HG SER 101 12.267 3.634 9.062
448 H TYR 102 H TYR 102 10.044 0.287 11.012
449 HA TYR 102 HA TYR 102 7.832 2.231 11.525
450 HB2 TYR 102 1HB TYR 102 7.870 -0.767 12.065
451 HB3 TYR 102 2HB TYR 102 6.615 0.331 12.623
452 HD1 TYR 102 HD1 TYR 102 8.146 -1.240 9.655
453 HD2 TYR 102 HD2 TYR 102 4.925 1.170 11.147
454 HE1 TYR 102 HE1 TYR 102 6.934 -1.537 7.521
455 HE2 TYR 102 HE2 TYR 102 3.714 0.873 9.014
456 HH TYR 102 HH TYR 102 5.128 -0.996 6.341
457 H TYR 103 H TYR 103 7.459 2.886 13.609
458 HA TYR 103 HA TYR 103 9.353 1.866 15.674
459 HB2 TYR 103 1HB TYR 103 8.645 4.787 15.177
460 HB3 TYR 103 2HB TYR 103 9.568 4.192 16.549
461 HD1 TYR 103 HD1 TYR 103 9.583 4.596 12.868
462 HD2 TYR 103 HD2 TYR 103 11.879 3.679 16.374
463 HE1 TYR 103 HE1 TYR 103 11.668 4.796 11.555
464 HE2 TYR 103 HE2 TYR 103 13.964 3.880 15.061
465 HH TYR 103 HH TYR 103 14.857 4.413 13.096
466 H THR 104 H THR 104 8.592 1.686 17.727
467 HA THR 104 HA THR 104 5.672 2.196 18.053
468 HB THR 104 HB THR 104 7.530 0.326 19.583
469 HG1 THR 104 HG1 THR 104 6.871 -1.082 18.158
470 HG21 THR 104 1HG2 THR 104 5.477 -0.439 20.712
471 HG22 THR 104 2HG2 THR 104 5.779 1.283 21.040
472 HG23 THR 104 3HG2 THR 104 4.539 0.807 19.859
473 H LEU 105 H LEU 105 5.063 3.869 19.197
474 HA LEU 105 HA LEU 105 7.002 4.981 21.181
475 HB2 LEU 105 1HB LEU 105 6.589 6.502 19.319
476 HB3 LEU 105 2HB LEU 105 4.843 6.358 19.543
477 HG LEU 105 HG LEU 105 5.121 7.435 21.807
478 HD11 LEU 105 1HD1 LEU 105 7.226 8.618 22.246
479 HD12 LEU 105 2HD1 LEU 105 7.467 6.858 22.159
480 HD13 LEU 105 3HD1 LEU 105 7.939 7.891 20.788
481 HD21 LEU 105 1HD2 LEU 105 5.431 9.697 20.861
482 HD22 LEU 105 2HD2 LEU 105 6.121 8.985 19.383
483 HD23 LEU 105 3HD2 LEU 105 4.414 8.694 19.799
484 H VAL 106 H VAL 106 6.478 4.769 23.228
485 HA VAL 106 HA VAL 106 3.630 4.204 23.893
486 HB VAL 106 HB VAL 106 6.165 3.711 25.513
487 HG11 VAL 106 1HG1 VAL 106 4.717 2.413 26.998
488 HG12 VAL 106 2HG1 VAL 106 4.246 4.128 26.941
489 HG13 VAL 106 3HG1 VAL 106 3.297 2.914 26.050
490 HG21 VAL 106 1HG2 VAL 106 5.723 1.330 25.005
491 HG22 VAL 106 2HG2 VAL 106 4.338 1.805 23.993
492 HG23 VAL 106 3HG2 VAL 106 5.990 2.268 23.516
493 H SER 107 H SER 107 2.506 5.898 24.547
494 HA SER 107 HA SER 107 3.876 8.124 25.930
495 HB2 SER 107 1HB SER 107 2.299 8.686 24.157
496 HB3 SER 107 2HB SER 107 1.025 7.771 24.950
497 HG SER 107 HG SER 107 1.912 9.346 26.766
498 H GLN 108 H GLN 108 4.334 7.516 27.978
499 HA GLN 108 HA GLN 108 2.037 6.542 29.625
500 HB2 GLN 108 1HB GLN 108 3.801 4.871 29.527
501 HB3 GLN 108 2HB GLN 108 5.027 6.066 29.926
502 HG2 GLN 108 1HG GLN 108 4.580 4.731 31.858
503 HG3 GLN 108 2HG GLN 108 3.945 6.376 32.147
504 HE21 GLN 108 1HE2 GLN 108 0.765 5.267 32.924
505 HE22 GLN 108 2HE2 GLN 108 2.000 6.477 33.037
506 HA PRO 109 HA PRO 109 2.411 10.653 31.338
507 HB2 PRO 109 1HB PRO 109 0.214 9.414 33.030
508 HB3 PRO 109 2HB PRO 109 0.267 11.009 32.269
509 HG2 PRO 109 1HG PRO 109 -1.204 9.110 31.120
510 HG3 PRO 109 2HG PRO 109 -0.203 10.147 30.100
511 HD2 PRO 109 1HD PRO 109 0.350 7.318 31.086
512 HD3 PRO 109 2HD PRO 109 0.605 8.020 29.438
513 H GLY 110 H GLY 110 3.419 11.375 33.194
514 HA2 GLY 110 1HA GLY 110 4.154 11.267 35.453
515 HA3 GLY 110 2HA GLY 110 3.700 9.574 35.523
516 H GLY 111 H GLY 111 5.480 10.647 32.742
517 HA2 GLY 111 1HA GLY 111 8.152 10.469 33.668
518 HA3 GLY 111 2HA GLY 111 7.665 8.847 33.213
519 H LYS 112 H LYS 112 9.510 9.300 31.657
520 HA LYS 112 HA LYS 112 8.765 10.974 29.347
521 HB2 LYS 112 1HB LYS 112 11.219 9.272 29.932
522 HB3 LYS 112 2HB LYS 112 10.997 10.204 28.458
523 HG2 LYS 112 1HG LYS 112 10.885 12.284 29.800
524 HG3 LYS 112 2HG LYS 112 11.150 11.333 31.267
525 HD2 LYS 112 1HD LYS 112 13.320 10.550 30.369
526 HD3 LYS 112 2HD LYS 112 13.054 11.501 28.901
527 HE2 LYS 112 1HE LYS 112 13.001 13.572 30.246
528 HE3 LYS 112 2HE LYS 112 13.249 12.630 31.718
529 HZ1 LYS 112 1HZ LYS 112 15.290 13.563 30.912
530 HZ2 LYS 112 2HZ LYS 112 15.363 11.917 30.834
531 HZ3 LYS 112 3HZ LYS 112 15.131 12.798 29.460
532 HA PRO 113 HA PRO 113 7.018 7.780 27.017
533 HB2 PRO 113 1HB PRO 113 7.514 8.647 24.451
534 HB3 PRO 113 2HB PRO 113 6.349 9.444 25.516
535 HG2 PRO 113 1HG PRO 113 9.255 10.185 24.970
536 HG3 PRO 113 2HG PRO 113 7.838 11.239 24.960
537 HD2 PRO 113 1HD PRO 113 9.453 11.094 27.139
538 HD3 PRO 113 2HD PRO 113 7.662 11.279 27.317
539 H GLN 114 H GLN 114 7.538 5.883 25.886
540 HA GLN 114 HA GLN 114 10.462 5.403 25.543
541 HB2 GLN 114 1HB GLN 114 8.235 3.358 25.896
542 HB3 GLN 114 2HB GLN 114 9.961 3.026 25.847
543 HG2 GLN 114 1HG GLN 114 8.570 4.683 27.962
544 HG3 GLN 114 2HG GLN 114 9.053 2.971 28.121
545 HE21 GLN 114 1HE2 GLN 114 11.613 5.845 29.116
546 HE22 GLN 114 2HE2 GLN 114 9.900 6.038 28.947
547 H LEU 115 H LEU 115 11.241 4.270 23.749
548 HA LEU 115 HA LEU 115 9.381 4.079 21.442
549 HB2 LEU 115 1HB LEU 115 10.398 6.346 21.406
550 HB3 LEU 115 2HB LEU 115 12.005 5.613 21.401
551 HG LEU 115 HG LEU 115 10.146 4.802 19.208
552 HD11 LEU 115 1HD1 LEU 115 10.671 6.831 17.929
553 HD12 LEU 115 2HD1 LEU 115 9.718 7.199 19.386
554 HD13 LEU 115 3HD1 LEU 115 11.467 7.526 19.360
555 HD21 LEU 115 1HD2 LEU 115 12.269 4.895 17.947
556 HD22 LEU 115 2HD2 LEU 115 13.091 5.565 19.377
557 HD23 LEU 115 3HD2 LEU 115 12.442 3.908 19.417
558 H VAL 116 H VAL 116 9.712 2.341 20.233
559 HA VAL 116 HA VAL 116 12.366 0.982 20.463
560 HB VAL 116 HB VAL 116 9.616 -0.305 20.177
561 HG11 VAL 116 1HG1 VAL 116 10.810 -2.432 20.368
562 HG12 VAL 116 2HG1 VAL 116 11.301 -1.521 18.922
563 HG13 VAL 116 3HG1 VAL 116 12.362 -1.562 20.350
564 HG21 VAL 116 1HG2 VAL 116 10.106 -1.227 22.420
565 HG22 VAL 116 2HG2 VAL 116 11.633 -0.314 22.461
566 HG23 VAL 116 3HG2 VAL 116 10.078 0.551 22.448
567 H ALA 117 H ALA 117 13.417 0.642 18.628
568 HA ALA 117 HA ALA 117 12.190 1.445 16.108
569 HB1 ALA 117 1HB ALA 117 14.408 0.925 15.145
570 HB2 ALA 117 2HB ALA 117 14.540 1.975 16.576
571 HB3 ALA 117 3HB ALA 117 14.917 0.242 16.707
572 H GLU 118 H GLU 118 11.479 0.234 14.465
573 HA GLU 118 HA GLU 118 11.885 -2.706 14.604
574 HB2 GLU 118 1HB GLU 118 9.168 -1.373 14.249
575 HB3 GLU 118 2HB GLU 118 9.484 -3.097 14.118
576 HG2 GLU 118 1HG GLU 118 10.180 -3.143 16.485
577 HG3 GLU 118 2HG GLU 118 9.838 -1.420 16.613
578 HA PRO 119 HA PRO 119 12.731 -0.886 10.444
579 HB2 PRO 119 1HB PRO 119 14.527 -3.338 10.606
580 HB3 PRO 119 2HB PRO 119 14.864 -1.761 9.881
581 HG2 PRO 119 1HG PRO 119 15.905 -2.290 12.268
582 HG3 PRO 119 2HG PRO 119 15.184 -0.702 11.991
583 HD2 PRO 119 1HD PRO 119 14.007 -3.121 13.417
584 HD3 PRO 119 2HD PRO 119 13.937 -1.375 13.885
Start of MODEL 4
1 H GLN 38 1H GLN 38 0.206 -0.314 4.722
2 HA GLN 38 HA GLN 38 2.538 0.067 4.629
3 HB2 GLN 38 1HB GLN 38 1.489 -1.104 2.757
4 HB3 GLN 38 2HB GLN 38 1.009 0.420 2.021
5 HG2 GLN 38 1HG GLN 38 2.903 -0.424 0.848
6 HG3 GLN 38 2HG GLN 38 3.428 1.003 1.785
7 HE21 GLN 38 1HE2 GLN 38 6.027 -0.709 3.288
8 HE22 GLN 38 2HE2 GLN 38 5.357 0.769 2.679
9 H ALA 39 H ALA 39 3.925 1.603 5.085
10 HA ALA 39 HA ALA 39 3.408 4.382 4.436
11 HB1 ALA 39 1HB ALA 39 5.646 4.775 5.415
12 HB2 ALA 39 2HB ALA 39 4.635 3.757 6.468
13 HB3 ALA 39 3HB ALA 39 5.916 3.018 5.482
14 HA PRO 40 HA PRO 40 5.116 4.825 0.460
15 HB2 PRO 40 1HB PRO 40 6.573 7.200 1.675
16 HB3 PRO 40 2HB PRO 40 5.627 7.124 0.186
17 HG2 PRO 40 1HG PRO 40 4.506 8.221 2.333
18 HG3 PRO 40 2HG PRO 40 3.544 7.120 1.340
19 HD2 PRO 40 1HD PRO 40 4.970 6.577 3.974
20 HD3 PRO 40 2HD PRO 40 3.326 6.048 3.436
21 H LYS 41 H LYS 41 7.019 4.323 -0.638
22 HA LYS 41 HA LYS 41 8.888 2.746 0.802
23 HB2 LYS 41 1HB LYS 41 8.356 2.437 -1.608
24 HB3 LYS 41 2HB LYS 41 9.164 3.954 -1.980
25 HG2 LYS 41 1HG LYS 41 10.692 2.230 -2.519
26 HG3 LYS 41 2HG LYS 41 11.281 2.951 -1.015
27 HD2 LYS 41 1HD LYS 41 10.227 1.124 0.279
28 HD3 LYS 41 2HD LYS 41 9.627 0.407 -1.224
29 HE2 LYS 41 1HE LYS 41 11.627 -0.772 -0.607
30 HE3 LYS 41 2HE LYS 41 12.012 0.223 -2.013
31 HZ1 LYS 41 1HZ LYS 41 13.704 0.371 -0.338
32 HZ2 LYS 41 2HZ LYS 41 12.981 1.842 -0.529
33 HZ3 LYS 41 3HZ LYS 41 12.624 0.909 0.785
34 H GLY 42 H GLY 42 10.431 3.333 2.123
35 HA2 GLY 42 1HA GLY 42 12.643 4.236 2.401
36 HA3 GLY 42 2HA GLY 42 12.266 5.505 1.251
37 H SER 43 H SER 43 9.578 5.222 3.153
38 HA SER 43 HA SER 43 10.487 7.501 4.847
39 HB2 SER 43 1HB SER 43 8.231 8.251 4.875
40 HB3 SER 43 2HB SER 43 8.588 7.828 3.209
41 HG SER 43 HG SER 43 7.691 5.734 3.748
42 H ALA 44 H ALA 44 8.811 7.662 6.833
43 HA ALA 44 HA ALA 44 8.609 4.974 8.087
44 HB1 ALA 44 1HB ALA 44 9.479 5.893 10.212
45 HB2 ALA 44 2HB ALA 44 10.691 5.978 8.914
46 HB3 ALA 44 3HB ALA 44 9.806 7.442 9.400
47 H PHE 45 H PHE 45 7.121 4.822 9.843
48 HA PHE 45 HA PHE 45 5.092 7.010 9.848
49 HB2 PHE 45 1HB PHE 45 4.330 5.202 8.339
50 HB3 PHE 45 2HB PHE 45 4.529 4.027 9.631
51 HD1 PHE 45 HD1 PHE 45 2.764 7.250 8.936
52 HD2 PHE 45 HD2 PHE 45 2.703 3.465 10.915
53 HE1 PHE 45 HE1 PHE 45 0.448 7.681 9.686
54 HE2 PHE 45 HE2 PHE 45 0.386 3.891 11.665
55 HZ PHE 45 HZ PHE 45 -0.741 6.003 11.052
56 H VAL 46 H VAL 46 4.292 7.558 11.775
57 HA VAL 46 HA VAL 46 5.180 5.892 14.094
58 HB VAL 46 HB VAL 46 4.931 8.928 13.943
59 HG11 VAL 46 1HG1 VAL 46 5.947 8.909 16.168
60 HG12 VAL 46 2HG1 VAL 46 4.377 8.072 16.147
61 HG13 VAL 46 3HG1 VAL 46 5.888 7.131 16.180
62 HG21 VAL 46 1HG2 VAL 46 7.396 8.893 14.154
63 HG22 VAL 46 2HG2 VAL 46 7.375 7.114 14.098
64 HG23 VAL 46 3HG2 VAL 46 6.865 8.057 12.676
65 H ARG 47 H ARG 47 3.595 5.106 15.298
66 HA ARG 47 HA ARG 47 0.980 6.519 15.332
67 HB2 ARG 47 1HB ARG 47 1.808 3.796 16.389
68 HB3 ARG 47 2HB ARG 47 0.203 4.486 16.577
69 HG2 ARG 47 1HG ARG 47 -0.039 4.549 14.110
70 HG3 ARG 47 2HG ARG 47 1.554 3.770 13.965
71 HD2 ARG 47 1HD ARG 47 0.763 1.847 15.158
72 HD3 ARG 47 2HD ARG 47 -0.808 2.632 15.442
73 HE ARG 47 HE ARG 47 -1.402 2.254 13.226
74 HH11 ARG 47 1HH1 ARG 47 1.919 1.275 13.811
75 HH12 ARG 47 2HH1 ARG 47 2.051 0.377 12.314
76 HH21 ARG 47 1HH2 ARG 47 -1.221 1.085 11.287
77 HH22 ARG 47 2HH2 ARG 47 0.274 0.270 10.886
78 H ALA 48 H ALA 48 -0.121 6.247 17.615
79 HA ALA 48 HA ALA 48 1.770 6.812 19.802
80 HB1 ALA 48 1HB ALA 48 0.669 8.953 20.375
81 HB2 ALA 48 2HB ALA 48 1.449 9.020 18.776
82 HB3 ALA 48 3HB ALA 48 -0.315 8.833 18.898
83 H TYR 49 H TYR 49 0.850 6.723 21.888
84 HA TYR 49 HA TYR 49 -2.018 6.439 22.213
85 HB2 TYR 49 1HB TYR 49 -1.487 4.145 21.469
86 HB3 TYR 49 2HB TYR 49 -0.260 4.007 22.721
87 HD1 TYR 49 HD1 TYR 49 -3.907 4.805 22.359
88 HD2 TYR 49 HD2 TYR 49 -0.814 2.978 24.705
89 HE1 TYR 49 HE1 TYR 49 -5.607 3.946 23.931
90 HE2 TYR 49 HE2 TYR 49 -2.515 2.118 26.279
91 HH TYR 49 HH TYR 49 -5.968 2.838 25.827
92 H ASN 50 H ASN 50 -2.392 7.635 23.914
93 HA ASN 50 HA ASN 50 -0.429 8.161 25.949
94 HB2 ASN 50 1HB ASN 50 -2.296 9.701 25.367
95 HB3 ASN 50 2HB ASN 50 -3.439 8.547 26.042
96 HD21 ASN 50 1HD2 ASN 50 -2.874 10.985 28.677
97 HD22 ASN 50 2HD2 ASN 50 -3.625 10.894 27.121
98 H ALA 51 H ALA 51 0.349 6.668 27.233
99 HA ALA 51 HA ALA 51 -1.611 4.833 28.540
100 HB1 ALA 51 1HB ALA 51 0.168 3.114 28.583
101 HB2 ALA 51 2HB ALA 51 -0.243 3.596 26.920
102 HB3 ALA 51 3HB ALA 51 1.240 4.211 27.684
103 H GLY 52 H GLY 52 -0.516 7.470 29.360
104 HA2 GLY 52 1HA GLY 52 1.193 6.739 31.676
105 HA3 GLY 52 2HA GLY 52 0.855 8.364 31.112
106 H ASN 53 H ASN 53 0.352 8.921 33.312
107 HA ASN 53 HA ASN 53 -2.321 7.907 34.194
108 HB2 ASN 53 1HB ASN 53 -1.661 8.437 36.478
109 HB3 ASN 53 2HB ASN 53 -0.509 7.324 35.754
110 HD21 ASN 53 1HD2 ASN 53 1.354 9.951 37.562
111 HD22 ASN 53 2HD2 ASN 53 0.165 8.762 37.969
112 H SER 54 H SER 54 -1.788 10.044 32.273
113 HA SER 54 HA SER 54 -3.565 12.019 33.445
114 HB2 SER 54 1HB SER 54 -2.101 13.930 33.339
115 HB3 SER 54 2HB SER 54 -1.362 12.721 34.377
116 HG SER 54 HG SER 54 -0.439 13.827 32.170
117 H GLU 55 H GLU 55 -4.152 13.722 31.913
118 HA GLU 55 HA GLU 55 -4.186 12.653 29.175
119 HB2 GLU 55 1HB GLU 55 -6.244 13.595 30.210
120 HB3 GLU 55 2HB GLU 55 -5.459 15.161 30.344
121 HG2 GLU 55 1HG GLU 55 -5.279 15.293 27.900
122 HG3 GLU 55 2HG GLU 55 -6.036 13.709 27.753
123 H LEU 56 H LEU 56 -3.020 13.319 27.509
124 HA LEU 56 HA LEU 56 -1.784 15.969 27.474
125 HB2 LEU 56 1HB LEU 56 0.529 15.086 27.244
126 HB3 LEU 56 2HB LEU 56 -0.152 14.839 28.853
127 HG LEU 56 HG LEU 56 -0.733 12.447 27.988
128 HD11 LEU 56 1HD1 LEU 56 0.803 11.636 26.253
129 HD12 LEU 56 2HD1 LEU 56 -0.282 12.901 25.630
130 HD13 LEU 56 3HD1 LEU 56 1.411 13.291 26.018
131 HD21 LEU 56 1HD2 LEU 56 1.521 11.687 28.658
132 HD22 LEU 56 2HD2 LEU 56 2.141 13.342 28.456
133 HD23 LEU 56 3HD2 LEU 56 0.941 12.989 29.724
134 H ASP 57 H ASP 57 -0.566 16.365 25.473
135 HA ASP 57 HA ASP 57 -1.824 14.848 23.247
136 HB2 ASP 57 1HB ASP 57 -0.428 17.552 23.334
137 HB3 ASP 57 2HB ASP 57 -1.005 16.793 21.855
138 H VAL 58 H VAL 58 -0.659 14.023 21.521
139 HA VAL 58 HA VAL 58 2.290 13.834 21.953
140 HB VAL 58 HB VAL 58 0.426 11.618 21.001
141 HG11 VAL 58 1HG1 VAL 58 2.424 10.206 21.018
142 HG12 VAL 58 2HG1 VAL 58 2.565 11.546 19.855
143 HG13 VAL 58 3HG1 VAL 58 3.421 11.624 21.412
144 HG21 VAL 58 1HG2 VAL 58 1.106 10.496 23.098
145 HG22 VAL 58 2HG2 VAL 58 2.058 11.930 23.554
146 HG23 VAL 58 3HG2 VAL 58 0.286 12.041 23.431
147 H SER 59 H SER 59 3.548 14.205 20.234
148 HA SER 59 HA SER 59 2.487 13.885 17.516
149 HB2 SER 59 1HB SER 59 2.875 16.158 16.815
150 HB3 SER 59 2HB SER 59 1.771 16.180 18.181
151 HG SER 59 HG SER 59 4.333 17.089 17.942
152 H VAL 60 H VAL 60 4.167 14.344 15.856
153 HA VAL 60 HA VAL 60 6.937 14.420 16.874
154 HB VAL 60 HB VAL 60 6.380 12.006 16.832
155 HG11 VAL 60 1HG1 VAL 60 5.863 10.887 14.719
156 HG12 VAL 60 2HG1 VAL 60 4.603 12.057 15.178
157 HG13 VAL 60 3HG1 VAL 60 5.777 12.465 13.904
158 HG21 VAL 60 1HG2 VAL 60 8.228 11.290 15.348
159 HG22 VAL 60 2HG2 VAL 60 8.212 12.884 14.559
160 HG23 VAL 60 3HG2 VAL 60 8.673 12.744 16.272
161 H GLY 61 H GLY 61 8.201 15.605 15.605
162 HA2 GLY 61 1HA GLY 61 8.922 16.847 13.782
163 HA3 GLY 61 2HA GLY 61 8.100 15.687 12.756
164 H SER 62 H SER 62 6.523 16.491 11.523
165 HA SER 62 HA SER 62 4.981 18.828 12.569
166 HB2 SER 62 1HB SER 62 4.455 19.354 10.243
167 HB3 SER 62 2HB SER 62 6.193 19.287 10.482
168 HG SER 62 HG SER 62 5.825 16.961 9.856
169 H THR 63 H THR 63 4.753 15.682 12.701
170 HA THR 63 HA THR 63 2.012 15.434 11.584
171 HB THR 63 HB THR 63 3.907 13.331 12.721
172 HG1 THR 63 HG1 THR 63 3.451 12.765 10.282
173 HG21 THR 63 1HG2 THR 63 2.263 11.704 11.874
174 HG22 THR 63 2HG2 THR 63 1.540 12.751 13.117
175 HG23 THR 63 3HG2 THR 63 1.185 13.036 11.398
176 H SER 64 H SER 64 0.348 15.869 12.825
177 HA SER 64 HA SER 64 0.532 15.717 15.743
178 HB2 SER 64 1HB SER 64 -0.839 17.451 14.751
179 HB3 SER 64 2HB SER 64 -1.767 16.268 13.842
180 HG SER 64 HG SER 64 -1.961 15.413 16.208
181 H LEU 65 H LEU 65 0.173 14.005 16.952
182 HA LEU 65 HA LEU 65 -1.078 11.632 15.645
183 HB2 LEU 65 1HB LEU 65 0.740 11.745 18.076
184 HB3 LEU 65 2HB LEU 65 0.136 10.285 17.285
185 HG LEU 65 HG LEU 65 2.024 12.303 16.017
186 HD11 LEU 65 1HD1 LEU 65 3.720 10.555 16.333
187 HD12 LEU 65 2HD1 LEU 65 3.057 11.119 17.885
188 HD13 LEU 65 3HD1 LEU 65 2.531 9.560 17.206
189 HD21 LEU 65 1HD2 LEU 65 2.261 10.552 14.289
190 HD22 LEU 65 2HD2 LEU 65 1.053 9.553 15.132
191 HD23 LEU 65 3HD2 LEU 65 0.576 11.107 14.407
192 H ASN 66 H ASN 66 -2.195 10.120 17.189
193 HA ASN 66 HA ASN 66 -3.288 11.371 19.614
194 HB2 ASN 66 1HB ASN 66 -5.620 11.029 18.998
195 HB3 ASN 66 2HB ASN 66 -4.848 12.138 17.870
196 HD21 ASN 66 1HD2 ASN 66 -6.163 10.293 15.255
197 HD22 ASN 66 2HD2 ASN 66 -6.003 11.815 16.067
198 H ASP 67 H ASP 67 -5.043 9.746 20.542
199 HA ASP 67 HA ASP 67 -3.455 7.476 21.269
200 HB2 ASP 67 1HB ASP 67 -6.378 8.157 21.761
201 HB3 ASP 67 2HB ASP 67 -5.599 6.731 22.432
202 H VAL 68 H VAL 68 -3.090 5.709 20.147
203 HA VAL 68 HA VAL 68 -5.252 4.688 18.365
204 HB VAL 68 HB VAL 68 -2.288 3.978 18.472
205 HG11 VAL 68 1HG1 VAL 68 -2.718 2.732 16.409
206 HG12 VAL 68 2HG1 VAL 68 -3.638 2.078 17.787
207 HG13 VAL 68 3HG1 VAL 68 -4.457 3.078 16.563
208 HG21 VAL 68 1HG2 VAL 68 -2.198 5.154 16.297
209 HG22 VAL 68 2HG2 VAL 68 -3.919 5.578 16.456
210 HG23 VAL 68 3HG2 VAL 68 -2.729 6.246 17.598
211 H ALA 69 H ALA 69 -6.454 3.081 19.079
212 HA ALA 69 HA ALA 69 -5.997 1.843 21.602
213 HB1 ALA 69 1HB ALA 69 -7.880 0.365 20.982
214 HB2 ALA 69 2HB ALA 69 -8.235 2.071 20.624
215 HB3 ALA 69 3HB ALA 69 -7.786 0.961 19.309
216 HA PRO 70 HA PRO 70 -3.153 -1.369 20.920
217 HB2 PRO 70 1HB PRO 70 -5.149 -3.003 22.541
218 HB3 PRO 70 2HB PRO 70 -3.396 -2.888 22.733
219 HG2 PRO 70 1HG PRO 70 -4.927 -1.505 24.406
220 HG3 PRO 70 2HG PRO 70 -3.503 -0.720 23.719
221 HD2 PRO 70 1HD PRO 70 -6.422 -0.452 22.903
222 HD3 PRO 70 2HD PRO 70 -5.155 0.831 23.050
223 H LEU 71 H LEU 71 -2.906 -2.819 19.300
224 HA LEU 71 HA LEU 71 -3.415 -4.239 17.560
225 HB2 LEU 71 1HB LEU 71 -6.028 -4.737 19.028
226 HB3 LEU 71 2HB LEU 71 -5.324 -5.743 17.761
227 HG LEU 71 HG LEU 71 -4.163 -5.314 20.535
228 HD11 LEU 71 1HD1 LEU 71 -4.794 -7.663 20.873
229 HD12 LEU 71 2HD1 LEU 71 -6.212 -6.644 20.536
230 HD13 LEU 71 3HD1 LEU 71 -5.548 -7.693 19.261
231 HD21 LEU 71 1HD2 LEU 71 -2.574 -7.081 19.854
232 HD22 LEU 71 2HD2 LEU 71 -3.296 -7.102 18.227
233 HD23 LEU 71 3HD2 LEU 71 -2.436 -5.654 18.799
234 H GLY 72 H GLY 72 -4.385 -1.362 17.752
235 HA2 GLY 72 1HA GLY 72 -6.274 -1.559 15.430
236 HA3 GLY 72 2HA GLY 72 -6.387 -0.286 16.633
237 H SER 73 H SER 73 -6.210 1.075 14.652
238 HA SER 73 HA SER 73 -3.517 2.096 14.405
239 HB2 SER 73 1HB SER 73 -3.353 0.158 12.881
240 HB3 SER 73 2HB SER 73 -4.739 0.745 11.976
241 HG SER 73 HG SER 73 -3.619 2.424 11.279
242 H SER 74 H SER 74 -3.408 4.092 13.340
243 HA SER 74 HA SER 74 -5.931 5.156 12.207
244 HB2 SER 74 1HB SER 74 -6.032 5.762 14.575
245 HB3 SER 74 2HB SER 74 -4.415 6.443 14.500
246 HG SER 74 HG SER 74 -5.165 7.927 12.997
247 H ASP 75 H ASP 75 -5.672 6.725 10.680
248 HA ASP 75 HA ASP 75 -3.105 6.687 9.365
249 HB2 ASP 75 1HB ASP 75 -5.652 8.263 8.837
250 HB3 ASP 75 2HB ASP 75 -4.229 8.353 7.805
251 H PHE 76 H PHE 76 -1.419 7.976 9.565
252 HA PHE 76 HA PHE 76 -1.898 10.757 10.535
253 HB2 PHE 76 1HB PHE 76 0.439 8.977 11.331
254 HB3 PHE 76 2HB PHE 76 0.227 10.660 11.788
255 HD1 PHE 76 HD1 PHE 76 -0.113 7.406 12.904
256 HD2 PHE 76 HD2 PHE 76 -2.204 11.130 12.889
257 HE1 PHE 76 HE1 PHE 76 -1.379 6.700 14.907
258 HE2 PHE 76 HE2 PHE 76 -3.472 10.429 14.893
259 HZ PHE 76 HZ PHE 76 -3.059 8.212 15.900
260 H LYS 77 H LYS 77 -0.172 12.274 9.956
261 HA LYS 77 HA LYS 77 0.618 12.065 7.219
262 HB2 LYS 77 1HB LYS 77 0.342 14.226 8.376
263 HB3 LYS 77 2HB LYS 77 1.699 13.854 9.431
264 HG2 LYS 77 1HG LYS 77 3.200 13.815 7.448
265 HG3 LYS 77 2HG LYS 77 1.826 14.270 6.431
266 HD2 LYS 77 1HD LYS 77 1.536 16.344 7.742
267 HD3 LYS 77 2HD LYS 77 2.904 15.889 8.767
268 HE2 LYS 77 1HE LYS 77 4.369 15.880 6.741
269 HE3 LYS 77 2HE LYS 77 2.999 16.438 5.777
270 HZ1 LYS 77 1HZ LYS 77 4.396 18.248 6.459
271 HZ2 LYS 77 2HZ LYS 77 2.908 18.402 7.155
272 HZ3 LYS 77 3HZ LYS 77 4.189 17.881 8.052
273 H PHE 78 H PHE 78 2.212 11.050 6.259
274 HA PHE 78 HA PHE 78 4.139 9.546 7.837
275 HB2 PHE 78 1HB PHE 78 3.843 9.957 4.837
276 HB3 PHE 78 2HB PHE 78 5.030 8.889 5.569
277 HD1 PHE 78 HD1 PHE 78 1.506 9.375 4.759
278 HD2 PHE 78 HD2 PHE 78 4.336 6.834 6.707
279 HE1 PHE 78 HE1 PHE 78 -0.163 7.550 4.799
280 HE2 PHE 78 HE2 PHE 78 2.671 5.006 6.746
281 HZ PHE 78 HZ PHE 78 0.421 5.367 5.793
282 H LEU 79 H LEU 79 6.348 9.787 7.953
283 HA LEU 79 HA LEU 79 7.336 12.491 7.144
284 HB2 LEU 79 1HB LEU 79 7.981 10.892 9.647
285 HB3 LEU 79 2HB LEU 79 8.786 12.390 9.176
286 HG LEU 79 HG LEU 79 5.829 12.130 9.835
287 HD11 LEU 79 1HD1 LEU 79 6.432 13.314 11.899
288 HD12 LEU 79 2HD1 LEU 79 7.251 11.740 11.781
289 HD13 LEU 79 3HD1 LEU 79 8.150 13.238 11.441
290 HD21 LEU 79 1HD2 LEU 79 5.906 14.601 9.807
291 HD22 LEU 79 2HD2 LEU 79 7.616 14.543 9.321
292 HD23 LEU 79 3HD2 LEU 79 6.357 13.929 8.222
293 HA PRO 80 HA PRO 80 10.627 10.418 5.030
294 HB2 PRO 80 1HB PRO 80 12.130 12.930 5.788
295 HB3 PRO 80 2HB PRO 80 11.932 12.184 4.195
296 HG2 PRO 80 1HG PRO 80 10.519 14.376 4.766
297 HG3 PRO 80 2HG PRO 80 9.738 13.048 3.904
298 HD2 PRO 80 1HD PRO 80 9.629 13.725 6.879
299 HD3 PRO 80 2HD PRO 80 8.268 13.307 5.760
300 HA PRO 81 HA PRO 81 13.134 8.922 8.335
301 HB2 PRO 81 1HB PRO 81 15.461 8.232 7.046
302 HB3 PRO 81 2HB PRO 81 13.957 7.327 6.830
303 HG2 PRO 81 1HG PRO 81 15.137 9.519 5.072
304 HG3 PRO 81 2HG PRO 81 14.492 7.950 4.579
305 HD2 PRO 81 1HD PRO 81 12.978 10.212 4.433
306 HD3 PRO 81 2HD PRO 81 12.245 8.611 4.862
307 H GLY 82 H GLY 82 14.850 9.514 9.730
308 HA2 GLY 82 1HA GLY 82 17.002 11.032 9.682
309 HA3 GLY 82 2HA GLY 82 15.851 12.286 9.258
310 H SER 83 H SER 83 16.461 13.396 11.202
311 HA SER 83 HA SER 83 15.569 12.092 13.727
312 HB2 SER 83 1HB SER 83 17.860 12.912 13.760
313 HB3 SER 83 2HB SER 83 17.343 14.499 13.211
314 HG SER 83 HG SER 83 15.874 14.113 15.225
315 H TYR 84 H TYR 84 13.514 12.470 14.176
316 HA TYR 84 HA TYR 84 12.535 15.277 13.861
317 HB2 TYR 84 1HB TYR 84 11.039 12.661 13.447
318 HB3 TYR 84 2HB TYR 84 10.239 14.220 13.596
319 HD1 TYR 84 HD1 TYR 84 12.746 12.350 11.570
320 HD2 TYR 84 HD2 TYR 84 9.993 15.635 11.747
321 HE1 TYR 84 HE1 TYR 84 13.050 12.737 9.149
322 HE2 TYR 84 HE2 TYR 84 10.296 16.022 9.326
323 HH TYR 84 HH TYR 84 12.555 14.050 7.419
324 H THR 85 H THR 85 12.473 16.189 15.775
325 HA THR 85 HA THR 85 12.298 14.742 18.236
326 HB THR 85 HB THR 85 11.708 17.684 17.697
327 HG1 THR 85 HG1 THR 85 13.918 17.887 18.404
328 HG21 THR 85 1HG2 THR 85 12.228 17.970 20.088
329 HG22 THR 85 2HG2 THR 85 10.829 16.892 19.867
330 HG23 THR 85 3HG2 THR 85 12.425 16.210 20.260
331 H ALA 86 H ALA 86 10.660 13.941 19.332
332 HA ALA 86 HA ALA 86 7.914 14.689 18.464
333 HB1 ALA 86 1HB ALA 86 7.202 12.626 19.631
334 HB2 ALA 86 2HB ALA 86 8.431 12.291 18.385
335 HB3 ALA 86 3HB ALA 86 8.889 12.322 20.103
336 H GLN 87 H GLN 87 6.238 14.820 20.144
337 HA GLN 87 HA GLN 87 7.326 15.873 22.716
338 HB2 GLN 87 1HB GLN 87 6.684 17.772 21.259
339 HB3 GLN 87 2HB GLN 87 5.076 17.092 21.066
340 HG2 GLN 87 1HG GLN 87 4.642 17.369 23.455
341 HG3 GLN 87 2HG GLN 87 6.288 18.027 23.676
342 HE21 GLN 87 1HE2 GLN 87 3.835 20.828 23.415
343 HE22 GLN 87 2HE2 GLN 87 4.005 19.443 24.439
344 H VAL 88 H VAL 88 6.450 15.054 24.483
345 HA VAL 88 HA VAL 88 3.689 13.931 24.268
346 HB VAL 88 HB VAL 88 6.003 12.792 25.895
347 HG11 VAL 88 1HG1 VAL 88 4.446 10.993 26.469
348 HG12 VAL 88 2HG1 VAL 88 3.887 12.575 27.065
349 HG13 VAL 88 3HG1 VAL 88 3.141 11.854 25.618
350 HG21 VAL 88 1HG2 VAL 88 5.776 10.849 24.379
351 HG22 VAL 88 2HG2 VAL 88 4.515 11.712 23.466
352 HG23 VAL 88 3HG2 VAL 88 6.186 12.326 23.475
353 H GLY 89 H GLY 89 2.512 15.466 25.253
354 HA2 GLY 89 1HA GLY 89 1.712 16.826 26.957
355 HA3 GLY 89 2HA GLY 89 2.748 15.958 28.074
356 H GLN 90 H GLN 90 4.256 17.143 29.045
357 HA GLN 90 HA GLN 90 5.137 19.668 27.744
358 HB2 GLN 90 1HB GLN 90 5.479 18.690 30.608
359 HB3 GLN 90 2HB GLN 90 6.037 20.239 29.996
360 HG2 GLN 90 1HG GLN 90 3.155 19.327 30.107
361 HG3 GLN 90 2HG GLN 90 3.955 20.457 31.235
362 HE21 GLN 90 1HE2 GLN 90 2.092 21.952 28.119
363 HE22 GLN 90 2HE2 GLN 90 1.758 20.452 28.921
364 H GLN 91 H GLN 91 6.063 16.552 27.733
365 HA GLN 91 HA GLN 91 8.971 17.186 27.935
366 HB2 GLN 91 1HB GLN 91 7.562 14.487 27.965
367 HB3 GLN 91 2HB GLN 91 9.296 14.733 28.106
368 HG2 GLN 91 1HG GLN 91 7.236 15.778 30.060
369 HG3 GLN 91 2HG GLN 91 8.213 14.297 30.265
370 HE21 GLN 91 1HE2 GLN 91 9.620 17.714 31.650
371 HE22 GLN 91 2HE2 GLN 91 7.957 17.330 31.350
372 H SER 92 H SER 92 10.346 15.789 26.430
373 HA SER 92 HA SER 92 9.079 15.441 23.776
374 HB2 SER 92 1HB SER 92 10.733 16.812 22.653
375 HB3 SER 92 2HB SER 92 9.884 17.780 23.847
376 HG SER 92 HG SER 92 12.381 17.571 23.626
377 H LEU 93 H LEU 93 10.416 14.288 22.249
378 HA LEU 93 HA LEU 93 12.798 12.936 23.292
379 HB2 LEU 93 1HB LEU 93 10.991 11.588 24.271
380 HB3 LEU 93 2HB LEU 93 10.250 11.395 22.679
381 HG LEU 93 HG LEU 93 12.308 10.151 21.943
382 HD11 LEU 93 1HD1 LEU 93 13.835 9.341 23.684
383 HD12 LEU 93 2HD1 LEU 93 13.871 11.115 23.554
384 HD13 LEU 93 3HD1 LEU 93 12.990 10.339 24.890
385 HD21 LEU 93 1HD2 LEU 93 11.713 8.098 23.183
386 HD22 LEU 93 2HD2 LEU 93 10.836 9.077 24.384
387 HD23 LEU 93 3HD2 LEU 93 10.257 9.001 22.702
388 HA PRO 94 HA PRO 94 13.532 13.500 18.930
389 HB2 PRO 94 1HB PRO 94 15.973 11.922 19.817
390 HB3 PRO 94 2HB PRO 94 15.891 13.363 18.794
391 HG2 PRO 94 1HG PRO 94 16.650 13.666 21.322
392 HG3 PRO 94 2HG PRO 94 15.509 14.825 20.634
393 HD2 PRO 94 1HD PRO 94 14.957 12.431 22.437
394 HD3 PRO 94 2HD PRO 94 14.273 14.104 22.524
395 H VAL 95 H VAL 95 12.665 12.178 17.452
396 HA VAL 95 HA VAL 95 12.799 9.232 17.919
397 HB VAL 95 HB VAL 95 10.895 10.859 16.179
398 HG11 VAL 95 1HG1 VAL 95 9.688 8.754 15.875
399 HG12 VAL 95 2HG1 VAL 95 11.337 8.678 15.211
400 HG13 VAL 95 3HG1 VAL 95 10.965 7.892 16.765
401 HG21 VAL 95 1HG2 VAL 95 9.204 10.172 17.850
402 HG22 VAL 95 2HG2 VAL 95 10.473 9.361 18.800
403 HG23 VAL 95 3HG2 VAL 95 10.501 11.131 18.603
404 H LYS 96 H LYS 96 14.349 8.251 16.822
405 HA LYS 96 HA LYS 96 15.353 9.332 14.294
406 HB2 LYS 96 1HB LYS 96 16.850 8.196 15.930
407 HB3 LYS 96 2HB LYS 96 15.961 6.697 15.694
408 HG2 LYS 96 1HG LYS 96 16.688 6.545 13.395
409 HG3 LYS 96 2HG LYS 96 17.422 8.153 13.474
410 HD2 LYS 96 1HD LYS 96 18.963 7.318 15.260
411 HD3 LYS 96 2HD LYS 96 18.271 5.702 15.060
412 HE2 LYS 96 1HE LYS 96 19.494 7.238 12.751
413 HE3 LYS 96 2HE LYS 96 20.450 6.192 13.803
414 HZ1 LYS 96 1HZ LYS 96 19.702 5.038 11.853
415 HZ2 LYS 96 2HZ LYS 96 19.015 4.368 13.195
416 HZ3 LYS 96 3HZ LYS 96 18.122 5.346 12.210
417 H LEU 97 H LEU 97 14.407 9.066 12.424
418 HA LEU 97 HA LEU 97 12.578 6.742 12.087
419 HB2 LEU 97 1HB LEU 97 12.803 9.326 10.504
420 HB3 LEU 97 2HB LEU 97 11.636 8.037 10.195
421 HG LEU 97 HG LEU 97 11.761 9.810 12.659
422 HD11 LEU 97 1HD1 LEU 97 9.603 10.626 11.822
423 HD12 LEU 97 2HD1 LEU 97 10.913 10.914 10.651
424 HD13 LEU 97 3HD1 LEU 97 9.763 9.581 10.391
425 HD21 LEU 97 1HD2 LEU 97 9.702 8.622 13.330
426 HD22 LEU 97 2HD2 LEU 97 9.861 7.546 11.919
427 HD23 LEU 97 3HD2 LEU 97 11.079 7.500 13.218
428 H ASP 98 H ASP 98 13.426 5.046 11.119
429 HA ASP 98 HA ASP 98 15.516 5.443 9.053
430 HB2 ASP 98 1HB ASP 98 14.432 2.941 10.406
431 HB3 ASP 98 2HB ASP 98 15.633 2.917 9.124
432 HA PRO 99 HA PRO 99 12.920 5.004 5.587
433 HB2 PRO 99 1HB PRO 99 15.031 3.034 4.631
434 HB3 PRO 99 2HB PRO 99 14.315 4.401 3.767
435 HG2 PRO 99 1HG PRO 99 16.752 4.702 4.784
436 HG3 PRO 99 2HG PRO 99 15.586 6.013 4.973
437 HD2 PRO 99 1HD PRO 99 16.422 3.887 6.986
438 HD3 PRO 99 2HD PRO 99 16.158 5.659 7.242
439 H ASP 100 H ASP 100 11.180 3.741 5.227
440 HA ASP 100 HA ASP 100 9.736 1.949 5.335
441 HB2 ASP 100 1HB ASP 100 12.301 0.374 4.863
442 HB3 ASP 100 2HB ASP 100 10.676 -0.276 4.705
443 H SER 101 H SER 101 9.938 2.800 7.738
444 HA SER 101 HA SER 101 9.995 0.318 9.342
445 HB2 SER 101 1HB SER 101 11.356 1.243 11.091
446 HB3 SER 101 2HB SER 101 12.248 1.375 9.583
447 HG SER 101 HG SER 101 11.742 3.490 9.457
448 H TYR 102 H TYR 102 8.958 0.574 11.451
449 HA TYR 102 HA TYR 102 7.007 2.832 11.462
450 HB2 TYR 102 1HB TYR 102 6.366 -0.090 12.034
451 HB3 TYR 102 2HB TYR 102 5.241 1.253 12.165
452 HD1 TYR 102 HD1 TYR 102 7.269 -0.741 9.790
453 HD2 TYR 102 HD2 TYR 102 4.120 2.132 10.271
454 HE1 TYR 102 HE1 TYR 102 6.642 -1.029 7.417
455 HE2 TYR 102 HE2 TYR 102 3.494 1.845 7.898
456 HH TYR 102 HH TYR 102 5.228 -0.448 5.803
457 H TYR 103 H TYR 103 6.357 3.613 13.420
458 HA TYR 103 HA TYR 103 7.697 2.435 15.809
459 HB2 TYR 103 1HB TYR 103 7.632 5.407 15.149
460 HB3 TYR 103 2HB TYR 103 8.354 4.669 16.573
461 HD1 TYR 103 HD1 TYR 103 8.682 5.201 12.948
462 HD2 TYR 103 HD2 TYR 103 10.483 3.531 16.467
463 HE1 TYR 103 HE1 TYR 103 10.829 4.981 11.747
464 HE2 TYR 103 HE2 TYR 103 12.630 3.314 15.265
465 HH TYR 103 HH TYR 103 13.729 3.699 13.378
466 H THR 104 H THR 104 6.713 2.833 17.809
467 HA THR 104 HA THR 104 4.119 4.306 17.685
468 HB THR 104 HB THR 104 4.670 1.782 19.305
469 HG1 THR 104 HG1 THR 104 3.609 0.760 17.758
470 HG21 THR 104 1HG2 THR 104 2.292 1.951 19.915
471 HG22 THR 104 2HG2 THR 104 3.191 3.385 20.467
472 HG23 THR 104 3HG2 THR 104 2.165 3.482 19.017
473 H LEU 105 H LEU 105 4.098 6.019 18.929
474 HA LEU 105 HA LEU 105 6.082 6.157 21.149
475 HB2 LEU 105 1HB LEU 105 6.297 7.906 19.454
476 HB3 LEU 105 2HB LEU 105 4.594 8.337 19.640
477 HG LEU 105 HG LEU 105 5.073 9.065 21.982
478 HD11 LEU 105 1HD1 LEU 105 7.415 9.331 22.666
479 HD12 LEU 105 2HD1 LEU 105 7.000 7.623 22.395
480 HD13 LEU 105 3HD1 LEU 105 7.943 8.513 21.177
481 HD21 LEU 105 1HD2 LEU 105 6.280 11.117 21.314
482 HD22 LEU 105 2HD2 LEU 105 6.793 10.326 19.805
483 HD23 LEU 105 3HD2 LEU 105 5.068 10.660 20.093
484 H VAL 106 H VAL 106 5.332 5.734 23.094
485 HA VAL 106 HA VAL 106 2.482 6.434 23.671
486 HB VAL 106 HB VAL 106 2.446 4.527 25.229
487 HG11 VAL 106 1HG1 VAL 106 2.544 2.708 23.596
488 HG12 VAL 106 2HG1 VAL 106 1.746 4.155 22.934
489 HG13 VAL 106 3HG1 VAL 106 3.420 3.767 22.467
490 HG21 VAL 106 1HG2 VAL 106 4.344 2.943 25.286
491 HG22 VAL 106 2HG2 VAL 106 5.273 4.017 24.212
492 HG23 VAL 106 3HG2 VAL 106 4.835 4.556 25.853
493 H SER 107 H SER 107 1.973 6.977 25.880
494 HA SER 107 HA SER 107 4.134 8.584 27.092
495 HB2 SER 107 1HB SER 107 2.402 9.633 28.372
496 HB3 SER 107 2HB SER 107 1.834 9.509 26.714
497 HG SER 107 HG SER 107 0.243 8.849 28.058
498 H GLN 108 H GLN 108 4.573 8.538 29.370
499 HA GLN 108 HA GLN 108 3.804 5.971 30.694
500 HB2 GLN 108 1HB GLN 108 6.456 7.452 30.920
501 HB3 GLN 108 2HB GLN 108 5.997 6.053 31.884
502 HG2 GLN 108 1HG GLN 108 6.163 6.021 28.865
503 HG3 GLN 108 2HG GLN 108 7.502 5.567 29.955
504 HE21 GLN 108 1HE2 GLN 108 5.107 2.720 28.802
505 HE22 GLN 108 2HE2 GLN 108 5.571 4.147 27.941
506 HA PRO 109 HA PRO 109 2.111 8.110 34.069
507 HB2 PRO 109 1HB PRO 109 4.059 6.484 35.760
508 HB3 PRO 109 2HB PRO 109 2.332 6.759 36.018
509 HG2 PRO 109 1HG PRO 109 3.079 4.435 34.977
510 HG3 PRO 109 2HG PRO 109 1.689 5.267 34.272
511 HD2 PRO 109 1HD PRO 109 4.558 5.137 33.269
512 HD3 PRO 109 2HD PRO 109 3.014 5.039 32.331
513 H GLY 110 H GLY 110 2.562 10.091 34.871
514 HA2 GLY 110 1HA GLY 110 4.020 11.711 35.958
515 HA3 GLY 110 2HA GLY 110 5.415 10.839 35.347
516 H GLY 111 H GLY 111 3.525 10.640 32.772
517 HA2 GLY 111 1HA GLY 111 3.016 11.995 30.915
518 HA3 GLY 111 2HA GLY 111 3.615 13.399 31.778
519 H LYS 112 H LYS 112 5.215 10.279 31.066
520 HA LYS 112 HA LYS 112 7.454 11.855 29.874
521 HB2 LYS 112 1HB LYS 112 7.472 9.140 31.249
522 HB3 LYS 112 2HB LYS 112 8.871 9.882 30.488
523 HG2 LYS 112 1HG LYS 112 8.755 11.758 32.083
524 HG3 LYS 112 2HG LYS 112 7.343 11.016 32.848
525 HD2 LYS 112 1HD LYS 112 8.704 9.013 33.392
526 HD3 LYS 112 2HD LYS 112 10.113 9.779 32.648
527 HE2 LYS 112 1HE LYS 112 9.979 11.623 34.287
528 HE3 LYS 112 2HE LYS 112 8.563 10.871 35.025
529 HZ1 LYS 112 1HZ LYS 112 10.563 10.356 36.219
530 HZ2 LYS 112 2HZ LYS 112 9.931 8.977 35.574
531 HZ3 LYS 112 3HZ LYS 112 11.252 9.682 34.884
532 HA PRO 113 HA PRO 113 6.692 9.853 26.101
533 HB2 PRO 113 1HB PRO 113 9.036 10.342 24.787
534 HB3 PRO 113 2HB PRO 113 7.906 11.643 25.183
535 HG2 PRO 113 1HG PRO 113 10.412 10.766 26.680
536 HG3 PRO 113 2HG PRO 113 9.928 12.402 26.220
537 HD2 PRO 113 1HD PRO 113 9.454 11.409 28.726
538 HD3 PRO 113 2HD PRO 113 8.322 12.573 27.928
539 H GLN 114 H GLN 114 7.161 7.938 24.948
540 HA GLN 114 HA GLN 114 9.560 6.390 25.646
541 HB2 GLN 114 1HB GLN 114 7.983 5.655 27.379
542 HB3 GLN 114 2HB GLN 114 6.757 5.322 26.165
543 HG2 GLN 114 1HG GLN 114 7.755 3.262 26.868
544 HG3 GLN 114 2HG GLN 114 8.243 3.593 25.181
545 HE21 GLN 114 1HE2 GLN 114 11.605 3.220 25.888
546 HE22 GLN 114 2HE2 GLN 114 10.282 3.086 24.776
547 H LEU 115 H LEU 115 10.371 6.078 23.699
548 HA LEU 115 HA LEU 115 8.536 5.634 21.423
549 HB2 LEU 115 1HB LEU 115 10.329 7.279 21.155
550 HB3 LEU 115 2HB LEU 115 11.543 6.061 21.557
551 HG LEU 115 HG LEU 115 10.868 4.802 19.484
552 HD11 LEU 115 1HD1 LEU 115 9.545 6.006 17.801
553 HD12 LEU 115 2HD1 LEU 115 8.603 5.695 19.279
554 HD13 LEU 115 3HD1 LEU 115 9.260 7.319 18.967
555 HD21 LEU 115 1HD2 LEU 115 12.024 6.367 17.962
556 HD22 LEU 115 2HD2 LEU 115 11.773 7.688 19.128
557 HD23 LEU 115 3HD2 LEU 115 12.821 6.313 19.552
558 H VAL 116 H VAL 116 7.975 3.664 20.852
559 HA VAL 116 HA VAL 116 10.007 1.492 21.165
560 HB VAL 116 HB VAL 116 6.972 1.250 21.327
561 HG11 VAL 116 1HG1 VAL 116 7.401 -1.079 21.941
562 HG12 VAL 116 2HG1 VAL 116 7.989 -0.702 20.304
563 HG13 VAL 116 3HG1 VAL 116 9.140 -0.832 21.656
564 HG21 VAL 116 1HG2 VAL 116 7.394 0.674 23.696
565 HG22 VAL 116 2HG2 VAL 116 9.130 0.980 23.459
566 HG23 VAL 116 3HG2 VAL 116 7.964 2.317 23.323
567 H ALA 117 H ALA 117 10.813 1.015 19.244
568 HA ALA 117 HA ALA 117 9.453 1.495 16.766
569 HB1 ALA 117 1HB ALA 117 11.294 0.184 15.761
570 HB2 ALA 117 2HB ALA 117 11.901 1.394 16.917
571 HB3 ALA 117 3HB ALA 117 11.813 -0.319 17.386
572 H GLU 118 H GLU 118 8.057 0.349 15.633
573 HA GLU 118 HA GLU 118 7.742 -2.541 16.235
574 HB2 GLU 118 1HB GLU 118 5.498 -0.488 16.349
575 HB3 GLU 118 2HB GLU 118 5.235 -2.225 16.280
576 HG2 GLU 118 1HG GLU 118 6.481 -2.480 18.404
577 HG3 GLU 118 2HG GLU 118 6.684 -0.732 18.477
578 HA PRO 119 HA PRO 119 7.828 -1.492 11.723
579 HB2 PRO 119 1HB PRO 119 9.133 -4.232 11.904
580 HB3 PRO 119 2HB PRO 119 9.549 -2.871 10.854
581 HG2 PRO 119 1HG PRO 119 11.065 -3.314 12.994
582 HG3 PRO 119 2HG PRO 119 10.597 -1.652 12.614
583 HD2 PRO 119 1HD PRO 119 9.408 -3.558 14.671
584 HD3 PRO 119 2HD PRO 119 9.792 -1.799 14.836
Start of MODEL 5
1 H GLN 38 1H GLN 38 -1.656 1.521 -0.061
2 HA GLN 38 HA GLN 38 -0.686 2.636 1.786
3 HB2 GLN 38 1HB GLN 38 1.181 0.728 0.319
4 HB3 GLN 38 2HB GLN 38 1.301 1.148 2.022
5 HG2 GLN 38 1HG GLN 38 -1.053 -0.239 0.719
6 HG3 GLN 38 2HG GLN 38 0.233 -1.021 1.681
7 HE21 GLN 38 1HE2 GLN 38 -3.021 0.170 3.533
8 HE22 GLN 38 2HE2 GLN 38 -2.870 -0.272 1.864
9 H ALA 39 H ALA 39 1.671 3.160 2.558
10 HA ALA 39 HA ALA 39 2.413 5.595 1.197
11 HB1 ALA 39 1HB ALA 39 4.206 5.720 2.896
12 HB2 ALA 39 2HB ALA 39 2.625 5.361 3.631
13 HB3 ALA 39 3HB ALA 39 3.822 4.061 3.413
14 HA PRO 40 HA PRO 40 5.226 4.272 -1.809
15 HB2 PRO 40 1HB PRO 40 6.918 6.600 -0.828
16 HB3 PRO 40 2HB PRO 40 6.446 6.190 -2.481
17 HG2 PRO 40 1HG PRO 40 5.145 8.157 -1.252
18 HG3 PRO 40 2HG PRO 40 4.219 6.983 -2.191
19 HD2 PRO 40 1HD PRO 40 4.632 7.131 0.820
20 HD3 PRO 40 2HD PRO 40 3.121 6.773 -0.106
21 H LYS 41 H LYS 41 6.962 2.906 -1.896
22 HA LYS 41 HA LYS 41 8.208 1.951 0.483
23 HB2 LYS 41 1HB LYS 41 8.009 0.639 -1.624
24 HB3 LYS 41 2HB LYS 41 9.164 1.713 -2.399
25 HG2 LYS 41 1HG LYS 41 10.915 1.003 -0.841
26 HG3 LYS 41 2HG LYS 41 9.758 -0.028 0.011
27 HD2 LYS 41 1HD LYS 41 9.402 -1.345 -2.051
28 HD3 LYS 41 2HD LYS 41 10.554 -0.312 -2.911
29 HE2 LYS 41 1HE LYS 41 12.342 -1.001 -1.344
30 HE3 LYS 41 2HE LYS 41 11.195 -2.033 -0.486
31 HZ1 LYS 41 1HZ LYS 41 12.497 -3.272 -2.054
32 HZ2 LYS 41 2HZ LYS 41 10.910 -3.296 -2.505
33 HZ3 LYS 41 3HZ LYS 41 11.982 -2.331 -3.306
34 H GLY 42 H GLY 42 9.937 2.523 1.604
35 HA2 GLY 42 1HA GLY 42 12.111 3.543 1.866
36 HA3 GLY 42 2HA GLY 42 11.809 4.533 0.450
37 H SER 43 H SER 43 8.966 4.495 2.156
38 HA SER 43 HA SER 43 9.518 7.097 3.424
39 HB2 SER 43 1HB SER 43 7.131 7.191 3.811
40 HB3 SER 43 2HB SER 43 7.430 6.716 2.146
41 HG SER 43 HG SER 43 6.841 4.722 2.565
42 H ALA 44 H ALA 44 8.780 7.527 5.637
43 HA ALA 44 HA ALA 44 9.579 5.268 7.392
44 HB1 ALA 44 1HB ALA 44 9.919 7.010 9.116
45 HB2 ALA 44 2HB ALA 44 10.860 7.347 7.644
46 HB3 ALA 44 3HB ALA 44 9.359 8.247 7.965
47 H PHE 45 H PHE 45 8.403 4.652 9.197
48 HA PHE 45 HA PHE 45 5.559 5.580 9.176
49 HB2 PHE 45 1HB PHE 45 6.622 2.799 9.819
50 HB3 PHE 45 2HB PHE 45 4.941 3.296 9.925
51 HD1 PHE 45 HD1 PHE 45 7.712 2.497 7.658
52 HD2 PHE 45 HD2 PHE 45 3.597 3.614 7.939
53 HE1 PHE 45 HE1 PHE 45 7.383 1.882 5.286
54 HE2 PHE 45 HE2 PHE 45 3.266 2.999 5.568
55 HZ PHE 45 HZ PHE 45 5.161 2.132 4.240
56 H VAL 46 H VAL 46 4.598 6.073 11.071
57 HA VAL 46 HA VAL 46 6.001 5.479 13.601
58 HB VAL 46 HB VAL 46 6.941 7.660 12.763
59 HG11 VAL 46 1HG1 VAL 46 5.507 9.643 12.760
60 HG12 VAL 46 2HG1 VAL 46 5.000 8.451 11.541
61 HG13 VAL 46 3HG1 VAL 46 4.087 8.615 13.060
62 HG21 VAL 46 1HG2 VAL 46 6.558 8.887 14.877
63 HG22 VAL 46 2HG2 VAL 46 5.173 7.829 15.238
64 HG23 VAL 46 3HG2 VAL 46 6.817 7.153 15.178
65 H ARG 47 H ARG 47 4.681 5.420 15.371
66 HA ARG 47 HA ARG 47 1.904 6.413 15.082
67 HB2 ARG 47 1HB ARG 47 0.939 4.330 15.879
68 HB3 ARG 47 2HB ARG 47 1.843 4.037 14.400
69 HG2 ARG 47 1HG ARG 47 3.716 3.133 15.716
70 HG3 ARG 47 2HG ARG 47 2.791 3.419 17.210
71 HD2 ARG 47 1HD ARG 47 1.073 1.906 16.468
72 HD3 ARG 47 2HD ARG 47 1.920 1.667 14.923
73 HE ARG 47 HE ARG 47 3.699 1.049 17.027
74 HH11 ARG 47 1HH1 ARG 47 0.745 -0.166 15.563
75 HH12 ARG 47 2HH1 ARG 47 1.068 -1.831 15.992
76 HH21 ARG 47 1HH2 ARG 47 4.108 -1.116 17.577
77 HH22 ARG 47 2HH2 ARG 47 2.972 -2.370 17.133
78 H ALA 48 H ALA 48 0.832 6.819 17.039
79 HA ALA 48 HA ALA 48 2.618 6.984 19.393
80 HB1 ALA 48 1HB ALA 48 0.808 8.346 20.384
81 HB2 ALA 48 2HB ALA 48 1.327 8.987 18.807
82 HB3 ALA 48 3HB ALA 48 -0.187 8.063 18.936
83 H TYR 49 H TYR 49 2.014 6.205 21.455
84 HA TYR 49 HA TYR 49 -0.216 4.235 21.474
85 HB2 TYR 49 1HB TYR 49 1.841 2.931 21.160
86 HB3 TYR 49 2HB TYR 49 2.600 3.743 22.520
87 HD1 TYR 49 HD1 TYR 49 -0.360 1.628 21.657
88 HD2 TYR 49 HD2 TYR 49 2.474 2.826 24.647
89 HE1 TYR 49 HE1 TYR 49 -1.235 -0.108 23.182
90 HE2 TYR 49 HE2 TYR 49 1.600 1.089 26.173
91 HH TYR 49 HH TYR 49 -1.077 -1.039 25.195
92 H ASN 50 H ASN 50 -1.506 4.342 23.176
93 HA ASN 50 HA ASN 50 -0.739 6.316 25.273
94 HB2 ASN 50 1HB ASN 50 -2.768 6.831 23.965
95 HB3 ASN 50 2HB ASN 50 -3.476 5.295 24.446
96 HD21 ASN 50 1HD2 ASN 50 -4.739 8.026 26.636
97 HD22 ASN 50 2HD2 ASN 50 -4.687 7.753 24.926
98 H ALA 51 H ALA 51 0.432 5.073 26.664
99 HA ALA 51 HA ALA 51 -0.709 2.609 27.741
100 HB1 ALA 51 1HB ALA 51 1.265 2.636 29.230
101 HB2 ALA 51 2HB ALA 51 1.723 2.855 27.526
102 HB3 ALA 51 3HB ALA 51 1.691 4.254 28.624
103 H GLY 52 H GLY 52 -2.764 3.757 28.290
104 HA2 GLY 52 1HA GLY 52 -3.084 3.964 31.070
105 HA3 GLY 52 2HA GLY 52 -2.805 5.605 30.515
106 H ASN 53 H ASN 53 -5.136 5.418 31.600
107 HA ASN 53 HA ASN 53 -7.140 4.539 29.587
108 HB2 ASN 53 1HB ASN 53 -7.385 5.243 32.528
109 HB3 ASN 53 2HB ASN 53 -8.757 4.881 31.491
110 HD21 ASN 53 1HD2 ASN 53 -7.317 1.880 33.371
111 HD22 ASN 53 2HD2 ASN 53 -7.541 3.522 33.874
112 H SER 54 H SER 54 -5.517 7.305 30.504
113 HA SER 54 HA SER 54 -7.799 9.070 29.777
114 HB2 SER 54 1HB SER 54 -6.583 9.710 31.782
115 HB3 SER 54 2HB SER 54 -5.051 9.660 30.922
116 HG SER 54 HG SER 54 -6.010 11.255 29.506
117 H GLU 55 H GLU 55 -7.914 10.162 27.920
118 HA GLU 55 HA GLU 55 -6.248 9.497 25.709
119 HB2 GLU 55 1HB GLU 55 -8.120 11.852 26.164
120 HB3 GLU 55 2HB GLU 55 -7.345 11.507 24.625
121 HG2 GLU 55 1HG GLU 55 -9.371 10.517 24.301
122 HG3 GLU 55 2HG GLU 55 -8.452 9.146 24.913
123 H LEU 56 H LEU 56 -4.569 10.502 24.701
124 HA LEU 56 HA LEU 56 -3.267 12.683 26.274
125 HB2 LEU 56 1HB LEU 56 -1.948 10.280 24.961
126 HB3 LEU 56 2HB LEU 56 -1.084 11.630 25.704
127 HG LEU 56 HG LEU 56 -2.938 9.732 27.189
128 HD11 LEU 56 1HD1 LEU 56 -0.864 8.799 28.113
129 HD12 LEU 56 2HD1 LEU 56 -0.949 8.592 26.348
130 HD13 LEU 56 3HD1 LEU 56 0.088 9.859 27.048
131 HD21 LEU 56 1HD2 LEU 56 -1.942 10.799 29.183
132 HD22 LEU 56 2HD2 LEU 56 -1.002 11.887 28.134
133 HD23 LEU 56 3HD2 LEU 56 -2.779 11.997 28.168
134 H ASP 57 H ASP 57 -2.227 14.281 25.162
135 HA ASP 57 HA ASP 57 -2.512 14.193 22.196
136 HB2 ASP 57 1HB ASP 57 -2.154 16.551 24.090
137 HB3 ASP 57 2HB ASP 57 -2.179 16.681 22.336
138 H VAL 58 H VAL 58 -0.760 13.529 21.186
139 HA VAL 58 HA VAL 58 1.874 14.547 22.155
140 HB VAL 58 HB VAL 58 2.893 12.376 21.620
141 HG11 VAL 58 1HG1 VAL 58 1.928 11.042 23.430
142 HG12 VAL 58 2HG1 VAL 58 2.121 12.750 23.891
143 HG13 VAL 58 3HG1 VAL 58 0.512 12.119 23.468
144 HG21 VAL 58 1HG2 VAL 58 1.460 10.434 21.072
145 HG22 VAL 58 2HG2 VAL 58 0.034 11.498 21.032
146 HG23 VAL 58 3HG2 VAL 58 1.330 11.702 19.829
147 H SER 59 H SER 59 3.604 14.315 20.471
148 HA SER 59 HA SER 59 2.608 14.305 17.692
149 HB2 SER 59 1HB SER 59 3.541 16.475 17.160
150 HB3 SER 59 2HB SER 59 2.365 16.650 18.454
151 HG SER 59 HG SER 59 4.895 17.325 18.419
152 H VAL 60 H VAL 60 4.282 14.177 16.105
153 HA VAL 60 HA VAL 60 6.983 13.566 17.230
154 HB VAL 60 HB VAL 60 5.652 12.174 14.867
155 HG11 VAL 60 1HG1 VAL 60 7.586 10.678 14.954
156 HG12 VAL 60 2HG1 VAL 60 8.059 12.361 14.621
157 HG13 VAL 60 3HG1 VAL 60 8.297 11.674 16.246
158 HG21 VAL 60 1HG2 VAL 60 5.597 10.198 16.355
159 HG22 VAL 60 2HG2 VAL 60 6.241 11.185 17.688
160 HG23 VAL 60 3HG2 VAL 60 4.629 11.532 17.022
161 H GLY 61 H GLY 61 7.654 15.694 16.792
162 HA2 GLY 61 1HA GLY 61 8.670 17.322 15.479
163 HA3 GLY 61 2HA GLY 61 8.684 16.177 14.151
164 H SER 62 H SER 62 7.439 16.618 12.443
165 HA SER 62 HA SER 62 5.538 18.852 12.602
166 HB2 SER 62 1HB SER 62 5.427 18.676 10.200
167 HB3 SER 62 2HB SER 62 7.113 18.578 10.690
168 HG SER 62 HG SER 62 5.497 16.315 10.318
169 H THR 63 H THR 63 5.433 15.495 13.013
170 HA THR 63 HA THR 63 2.730 15.149 11.915
171 HB THR 63 HB THR 63 4.510 13.248 13.503
172 HG1 THR 63 HG1 THR 63 5.420 13.172 11.585
173 HG21 THR 63 1HG2 THR 63 2.929 11.509 12.764
174 HG22 THR 63 2HG2 THR 63 2.109 12.726 13.771
175 HG23 THR 63 3HG2 THR 63 1.909 12.752 12.004
176 H SER 64 H SER 64 0.900 15.449 12.948
177 HA SER 64 HA SER 64 1.020 15.862 15.896
178 HB2 SER 64 1HB SER 64 0.117 17.744 14.665
179 HB3 SER 64 2HB SER 64 -1.010 16.707 13.807
180 HG SER 64 HG SER 64 -1.225 16.337 16.437
181 H LEU 65 H LEU 65 0.367 14.292 17.166
182 HA LEU 65 HA LEU 65 -1.762 12.458 16.148
183 HB2 LEU 65 1HB LEU 65 0.625 11.736 17.883
184 HB3 LEU 65 2HB LEU 65 -0.674 10.636 17.414
185 HG LEU 65 HG LEU 65 1.221 11.967 15.449
186 HD11 LEU 65 1HD1 LEU 65 2.319 9.774 15.341
187 HD12 LEU 65 2HD1 LEU 65 2.434 10.488 16.968
188 HD13 LEU 65 3HD1 LEU 65 1.266 9.183 16.648
189 HD21 LEU 65 1HD2 LEU 65 0.314 10.259 13.910
190 HD22 LEU 65 2HD2 LEU 65 -0.768 9.674 15.197
191 HD23 LEU 65 3HD2 LEU 65 -0.980 11.311 14.533
192 H ASN 66 H ASN 66 -3.072 14.183 17.266
193 HA ASN 66 HA ASN 66 -2.815 14.172 20.214
194 HB2 ASN 66 1HB ASN 66 -4.518 15.842 18.336
195 HB3 ASN 66 2HB ASN 66 -4.514 16.005 20.087
196 HD21 ASN 66 1HD2 ASN 66 -2.105 18.334 18.252
197 HD22 ASN 66 2HD2 ASN 66 -3.707 17.821 17.843
198 H ASP 67 H ASP 67 -4.671 13.960 21.593
199 HA ASP 67 HA ASP 67 -6.444 12.723 22.385
200 HB2 ASP 67 1HB ASP 67 -7.569 14.282 20.674
201 HB3 ASP 67 2HB ASP 67 -7.595 12.904 19.580
202 H VAL 68 H VAL 68 -4.508 11.057 22.107
203 HA VAL 68 HA VAL 68 -5.184 8.850 20.303
204 HB VAL 68 HB VAL 68 -3.174 9.006 22.592
205 HG11 VAL 68 1HG1 VAL 68 -2.148 7.045 21.549
206 HG12 VAL 68 2HG1 VAL 68 -3.808 6.716 22.098
207 HG13 VAL 68 3HG1 VAL 68 -3.478 6.978 20.368
208 HG21 VAL 68 1HG2 VAL 68 -1.517 9.318 20.780
209 HG22 VAL 68 2HG2 VAL 68 -2.833 9.326 19.581
210 HG23 VAL 68 3HG2 VAL 68 -2.720 10.631 20.786
211 H ALA 69 H ALA 69 -6.302 7.048 20.755
212 HA ALA 69 HA ALA 69 -8.208 7.244 22.859
213 HB1 ALA 69 1HB ALA 69 -8.922 4.987 22.140
214 HB2 ALA 69 2HB ALA 69 -8.672 6.073 20.753
215 HB3 ALA 69 3HB ALA 69 -7.449 4.844 21.153
216 HA PRO 70 HA PRO 70 -6.328 5.574 26.394
217 HB2 PRO 70 1HB PRO 70 -8.942 4.046 26.686
218 HB3 PRO 70 2HB PRO 70 -8.081 5.015 27.888
219 HG2 PRO 70 1HG PRO 70 -10.208 6.086 26.707
220 HG3 PRO 70 2HG PRO 70 -8.765 7.082 26.920
221 HD2 PRO 70 1HD PRO 70 -9.735 5.618 24.432
222 HD3 PRO 70 2HD PRO 70 -9.055 7.287 24.577
223 H LEU 71 H LEU 71 -4.950 3.905 26.603
224 HA LEU 71 HA LEU 71 -3.843 1.954 26.063
225 HB2 LEU 71 1HB LEU 71 -6.656 0.809 26.200
226 HB3 LEU 71 2HB LEU 71 -5.155 -0.115 26.312
227 HG LEU 71 HG LEU 71 -6.107 1.957 28.323
228 HD11 LEU 71 1HD1 LEU 71 -6.463 0.009 29.773
229 HD12 LEU 71 2HD1 LEU 71 -7.475 -0.065 28.312
230 HD13 LEU 71 3HD1 LEU 71 -6.013 -1.071 28.432
231 HD21 LEU 71 1HD2 LEU 71 -4.213 1.117 29.670
232 HD22 LEU 71 2HD2 LEU 71 -3.730 0.052 28.328
233 HD23 LEU 71 3HD2 LEU 71 -3.645 1.818 28.135
234 H GLY 72 H GLY 72 -4.672 3.592 23.837
235 HA2 GLY 72 1HA GLY 72 -4.994 1.462 21.747
236 HA3 GLY 72 2HA GLY 72 -5.781 3.023 21.622
237 H SER 73 H SER 73 -4.643 3.187 19.560
238 HA SER 73 HA SER 73 -1.992 4.435 19.904
239 HB2 SER 73 1HB SER 73 -0.913 3.070 18.227
240 HB3 SER 73 2HB SER 73 -1.533 2.026 19.496
241 HG SER 73 HG SER 73 -2.214 2.229 16.878
242 H SER 74 H SER 74 -1.213 5.420 17.841
243 HA SER 74 HA SER 74 -3.434 6.053 15.969
244 HB2 SER 74 1HB SER 74 -3.383 7.855 17.639
245 HB3 SER 74 2HB SER 74 -1.667 8.099 17.348
246 HG SER 74 HG SER 74 -2.697 8.176 15.018
247 H ASP 75 H ASP 75 -2.639 5.109 14.192
248 HA ASP 75 HA ASP 75 0.215 5.120 13.614
249 HB2 ASP 75 1HB ASP 75 -2.188 4.203 11.984
250 HB3 ASP 75 2HB ASP 75 -0.517 3.996 11.477
251 H PHE 76 H PHE 76 1.285 6.101 11.901
252 HA PHE 76 HA PHE 76 -0.260 8.016 10.246
253 HB2 PHE 76 1HB PHE 76 0.683 9.288 12.198
254 HB3 PHE 76 2HB PHE 76 2.295 8.791 11.708
255 HD1 PHE 76 HD1 PHE 76 -0.673 10.747 10.676
256 HD2 PHE 76 HD2 PHE 76 3.453 9.902 9.972
257 HE1 PHE 76 HE1 PHE 76 -0.533 12.700 9.167
258 HE2 PHE 76 HE2 PHE 76 3.601 11.855 8.464
259 HZ PHE 76 HZ PHE 76 1.603 13.254 8.060
260 H LYS 77 H LYS 77 0.268 7.900 8.180
261 HA LYS 77 HA LYS 77 2.851 6.552 7.501
262 HB2 LYS 77 1HB LYS 77 0.193 6.457 6.015
263 HB3 LYS 77 2HB LYS 77 1.691 5.735 5.446
264 HG2 LYS 77 1HG LYS 77 1.723 4.218 7.371
265 HG3 LYS 77 2HG LYS 77 0.249 4.965 8.000
266 HD2 LYS 77 1HD LYS 77 -0.955 4.293 5.930
267 HD3 LYS 77 2HD LYS 77 0.519 3.510 5.343
268 HE2 LYS 77 1HE LYS 77 0.496 1.956 7.223
269 HE3 LYS 77 2HE LYS 77 -0.883 2.789 7.942
270 HZ1 LYS 77 1HZ LYS 77 -1.553 0.828 6.763
271 HZ2 LYS 77 2HZ LYS 77 -2.186 2.161 6.027
272 HZ3 LYS 77 3HZ LYS 77 -0.897 1.382 5.355
273 H PHE 78 H PHE 78 3.352 6.974 5.048
274 HA PHE 78 HA PHE 78 3.942 8.476 3.404
275 HB2 PHE 78 1HB PHE 78 1.616 10.123 4.478
276 HB3 PHE 78 2HB PHE 78 2.438 10.390 2.950
277 HD1 PHE 78 HD1 PHE 78 -0.079 8.485 4.702
278 HD2 PHE 78 HD2 PHE 78 2.278 8.662 1.142
279 HE1 PHE 78 HE1 PHE 78 -1.639 6.921 3.593
280 HE2 PHE 78 HE2 PHE 78 0.717 7.103 0.029
281 HZ PHE 78 HZ PHE 78 -1.241 6.232 1.255
282 H LEU 79 H LEU 79 5.142 8.592 6.046
283 HA LEU 79 HA LEU 79 5.719 11.499 6.320
284 HB2 LEU 79 1HB LEU 79 5.032 10.325 8.364
285 HB3 LEU 79 2HB LEU 79 6.338 9.156 8.153
286 HG LEU 79 HG LEU 79 7.986 11.026 8.443
287 HD11 LEU 79 1HD1 LEU 79 7.167 13.148 9.365
288 HD12 LEU 79 2HD1 LEU 79 6.539 12.858 7.726
289 HD13 LEU 79 3HD1 LEU 79 5.490 12.599 9.139
290 HD21 LEU 79 1HD2 LEU 79 7.628 11.203 10.883
291 HD22 LEU 79 2HD2 LEU 79 5.956 10.626 10.679
292 HD23 LEU 79 3HD2 LEU 79 7.323 9.547 10.309
293 HA PRO 80 HA PRO 80 9.442 10.738 4.003
294 HB2 PRO 80 1HB PRO 80 9.940 13.511 5.149
295 HB3 PRO 80 2HB PRO 80 10.193 12.928 3.499
296 HG2 PRO 80 1HG PRO 80 8.039 14.407 3.988
297 HG3 PRO 80 2HG PRO 80 7.868 12.968 2.978
298 HD2 PRO 80 1HD PRO 80 7.198 13.333 5.928
299 HD3 PRO 80 2HD PRO 80 6.242 12.499 4.637
300 HA PRO 81 HA PRO 81 11.805 9.345 7.513
301 HB2 PRO 81 1HB PRO 81 13.943 9.237 5.359
302 HB3 PRO 81 2HB PRO 81 13.484 7.999 6.536
303 HG2 PRO 81 1HG PRO 81 12.649 7.728 4.021
304 HG3 PRO 81 2HG PRO 81 11.525 7.380 5.339
305 HD2 PRO 81 1HD PRO 81 11.755 9.890 3.624
306 HD3 PRO 81 2HD PRO 81 10.268 8.999 4.147
307 H GLY 82 H GLY 82 13.368 10.247 8.863
308 HA2 GLY 82 1HA GLY 82 15.429 11.979 8.432
309 HA3 GLY 82 2HA GLY 82 14.051 13.055 8.295
310 H SER 83 H SER 83 15.447 13.900 10.217
311 HA SER 83 HA SER 83 14.928 12.501 12.750
312 HB2 SER 83 1HB SER 83 17.070 13.595 12.481
313 HB3 SER 83 2HB SER 83 16.301 15.120 12.074
314 HG SER 83 HG SER 83 15.221 14.525 14.280
315 H TYR 84 H TYR 84 13.207 12.772 13.970
316 HA TYR 84 HA TYR 84 11.809 15.406 13.861
317 HB2 TYR 84 1HB TYR 84 10.499 12.657 13.942
318 HB3 TYR 84 2HB TYR 84 9.646 14.180 14.152
319 HD1 TYR 84 HD1 TYR 84 11.375 11.988 11.767
320 HD2 TYR 84 HD2 TYR 84 9.238 15.671 12.285
321 HE1 TYR 84 HE1 TYR 84 11.076 12.159 9.318
322 HE2 TYR 84 HE2 TYR 84 8.937 15.841 9.838
323 HH TYR 84 HH TYR 84 9.992 13.256 7.671
324 H THR 85 H THR 85 11.009 16.204 15.749
325 HA THR 85 HA THR 85 12.034 14.841 18.183
326 HB THR 85 HB THR 85 11.054 17.700 17.779
327 HG1 THR 85 HG1 THR 85 13.323 18.125 18.065
328 HG21 THR 85 1HG2 THR 85 11.968 18.085 20.033
329 HG22 THR 85 2HG2 THR 85 10.662 16.877 20.075
330 HG23 THR 85 3HG2 THR 85 12.362 16.355 20.174
331 H ALA 86 H ALA 86 10.660 13.500 19.103
332 HA ALA 86 HA ALA 86 7.785 13.865 18.918
333 HB1 ALA 86 1HB ALA 86 7.684 11.894 20.412
334 HB2 ALA 86 2HB ALA 86 8.771 11.621 19.029
335 HB3 ALA 86 3HB ALA 86 9.445 11.985 20.634
336 H GLN 87 H GLN 87 6.319 14.238 20.608
337 HA GLN 87 HA GLN 87 7.482 15.530 23.026
338 HB2 GLN 87 1HB GLN 87 6.923 17.328 21.418
339 HB3 GLN 87 2HB GLN 87 5.284 16.710 21.279
340 HG2 GLN 87 1HG GLN 87 5.253 18.600 22.725
341 HG3 GLN 87 2HG GLN 87 4.974 17.144 23.724
342 HE21 GLN 87 1HE2 GLN 87 7.481 18.010 25.939
343 HE22 GLN 87 2HE2 GLN 87 5.923 17.322 25.635
344 H VAL 88 H VAL 88 6.784 14.450 24.716
345 HA VAL 88 HA VAL 88 3.863 13.832 24.814
346 HB VAL 88 HB VAL 88 6.117 12.193 26.050
347 HG11 VAL 88 1HG1 VAL 88 4.347 10.619 26.662
348 HG12 VAL 88 2HG1 VAL 88 4.124 12.205 27.436
349 HG13 VAL 88 3HG1 VAL 88 3.125 11.749 26.034
350 HG21 VAL 88 1HG2 VAL 88 5.415 10.461 24.428
351 HG22 VAL 88 2HG2 VAL 88 4.232 11.594 23.733
352 HG23 VAL 88 3HG2 VAL 88 5.973 11.932 23.597
353 H GLY 89 H GLY 89 3.039 15.352 26.098
354 HA2 GLY 89 1HA GLY 89 2.616 16.545 28.045
355 HA3 GLY 89 2HA GLY 89 3.676 15.435 28.895
356 H GLN 90 H GLN 90 5.557 16.198 29.649
357 HA GLN 90 HA GLN 90 6.542 18.785 28.524
358 HB2 GLN 90 1HB GLN 90 6.810 17.700 31.357
359 HB3 GLN 90 2HB GLN 90 7.540 19.189 30.775
360 HG2 GLN 90 1HG GLN 90 4.567 18.631 30.863
361 HG3 GLN 90 2HG GLN 90 5.493 19.578 32.064
362 HE21 GLN 90 1HE2 GLN 90 3.845 21.528 29.105
363 HE22 GLN 90 2HE2 GLN 90 3.302 20.059 29.846
364 H GLN 91 H GLN 91 7.117 15.830 27.904
365 HA GLN 91 HA GLN 91 10.084 16.097 28.128
366 HB2 GLN 91 1HB GLN 91 9.342 14.354 29.684
367 HB3 GLN 91 2HB GLN 91 8.417 13.565 28.414
368 HG2 GLN 91 1HG GLN 91 10.419 12.332 28.732
369 HG3 GLN 91 2HG GLN 91 10.567 13.195 27.174
370 HE21 GLN 91 1HE2 GLN 91 13.562 14.692 28.027
371 HE22 GLN 91 2HE2 GLN 91 12.463 14.122 26.816
372 H SER 92 H SER 92 10.936 16.409 26.215
373 HA SER 92 HA SER 92 9.575 15.370 23.808
374 HB2 SER 92 1HB SER 92 11.178 16.690 22.567
375 HB3 SER 92 2HB SER 92 10.495 17.677 23.850
376 HG SER 92 HG SER 92 12.722 17.870 23.716
377 H LEU 93 H LEU 93 10.675 14.131 22.200
378 HA LEU 93 HA LEU 93 13.047 12.624 23.154
379 HB2 LEU 93 1HB LEU 93 10.436 11.372 22.234
380 HB3 LEU 93 2HB LEU 93 11.956 10.488 22.402
381 HG LEU 93 HG LEU 93 10.523 11.887 24.686
382 HD11 LEU 93 1HD1 LEU 93 9.872 9.622 25.374
383 HD12 LEU 93 2HD1 LEU 93 9.189 10.049 23.788
384 HD13 LEU 93 3HD1 LEU 93 10.596 8.964 23.889
385 HD21 LEU 93 1HD2 LEU 93 12.091 10.569 26.066
386 HD22 LEU 93 2HD2 LEU 93 12.848 9.921 24.590
387 HD23 LEU 93 3HD2 LEU 93 12.969 11.658 24.965
388 HA PRO 94 HA PRO 94 13.606 13.936 18.795
389 HB2 PRO 94 1HB PRO 94 16.422 13.536 19.857
390 HB3 PRO 94 2HB PRO 94 15.802 14.811 18.800
391 HG2 PRO 94 1HG PRO 94 16.215 15.390 21.365
392 HG3 PRO 94 2HG PRO 94 14.740 15.972 20.589
393 HD2 PRO 94 1HD PRO 94 15.127 13.551 22.400
394 HD3 PRO 94 2HD PRO 94 13.810 14.791 22.423
395 H VAL 95 H VAL 95 13.648 12.428 17.229
396 HA VAL 95 HA VAL 95 15.199 9.939 17.603
397 HB VAL 95 HB VAL 95 12.969 9.446 18.576
398 HG11 VAL 95 1HG1 VAL 95 10.970 9.462 17.165
399 HG12 VAL 95 2HG1 VAL 95 11.657 11.090 17.366
400 HG13 VAL 95 3HG1 VAL 95 11.910 10.199 15.845
401 HG21 VAL 95 1HG2 VAL 95 12.457 7.474 17.172
402 HG22 VAL 95 2HG2 VAL 95 13.446 8.155 15.859
403 HG23 VAL 95 3HG2 VAL 95 14.212 7.670 17.390
404 H LYS 96 H LYS 96 16.079 9.242 15.759
405 HA LYS 96 HA LYS 96 15.318 10.543 13.229
406 HB2 LYS 96 1HB LYS 96 17.711 10.160 13.779
407 HB3 LYS 96 2HB LYS 96 17.427 8.427 13.823
408 HG2 LYS 96 1HG LYS 96 16.839 8.447 11.434
409 HG3 LYS 96 2HG LYS 96 17.085 10.196 11.384
410 HD2 LYS 96 1HD LYS 96 19.448 9.900 12.020
411 HD3 LYS 96 2HD LYS 96 19.210 8.148 12.118
412 HE2 LYS 96 1HE LYS 96 18.607 8.105 9.712
413 HE3 LYS 96 2HE LYS 96 18.869 9.846 9.619
414 HZ1 LYS 96 1HZ LYS 96 20.775 8.626 8.868
415 HZ2 LYS 96 2HZ LYS 96 21.162 9.476 10.229
416 HZ3 LYS 96 3HZ LYS 96 20.915 7.847 10.315
417 H LEU 97 H LEU 97 13.923 9.787 11.827
418 HA LEU 97 HA LEU 97 12.914 7.020 12.233
419 HB2 LEU 97 1HB LEU 97 11.722 9.263 10.569
420 HB3 LEU 97 2HB LEU 97 10.952 7.731 10.990
421 HG LEU 97 HG LEU 97 11.610 10.015 12.881
422 HD11 LEU 97 1HD1 LEU 97 9.170 10.134 13.108
423 HD12 LEU 97 2HD1 LEU 97 9.687 10.400 11.426
424 HD13 LEU 97 3HD1 LEU 97 8.995 8.833 11.906
425 HD21 LEU 97 1HD2 LEU 97 10.508 8.616 14.593
426 HD22 LEU 97 2HD2 LEU 97 10.352 7.292 13.415
427 HD23 LEU 97 3HD2 LEU 97 11.964 7.816 13.955
428 H ASP 98 H ASP 98 14.111 5.618 11.107
429 HA ASP 98 HA ASP 98 15.292 6.288 8.546
430 HB2 ASP 98 1HB ASP 98 15.005 3.684 10.086
431 HB3 ASP 98 2HB ASP 98 15.781 3.770 8.510
432 HA PRO 99 HA PRO 99 12.079 5.192 5.843
433 HB2 PRO 99 1HB PRO 99 13.460 4.171 3.688
434 HB3 PRO 99 2HB PRO 99 13.465 5.892 4.094
435 HG2 PRO 99 1HG PRO 99 15.522 3.757 4.804
436 HG3 PRO 99 2HG PRO 99 15.802 5.362 4.121
437 HD2 PRO 99 1HD PRO 99 16.075 4.920 6.785
438 HD3 PRO 99 2HD PRO 99 15.386 6.473 6.166
439 H ASP 100 H ASP 100 10.828 3.425 5.139
440 HA ASP 100 HA ASP 100 9.985 1.288 5.283
441 HB2 ASP 100 1HB ASP 100 12.906 0.602 4.772
442 HB3 ASP 100 2HB ASP 100 11.594 -0.568 4.718
443 H SER 101 H SER 101 10.358 2.450 7.737
444 HA SER 101 HA SER 101 10.746 0.054 9.398
445 HB2 SER 101 1HB SER 101 12.998 1.032 9.327
446 HB3 SER 101 2HB SER 101 12.360 2.589 9.831
447 HG SER 101 HG SER 101 11.871 0.284 11.326
448 H TYR 102 H TYR 102 9.744 0.160 11.414
449 HA TYR 102 HA TYR 102 7.723 2.352 11.549
450 HB2 TYR 102 1HB TYR 102 7.646 -0.518 12.556
451 HB3 TYR 102 2HB TYR 102 6.421 0.681 12.945
452 HD1 TYR 102 HD1 TYR 102 8.090 -1.000 10.060
453 HD2 TYR 102 HD2 TYR 102 4.611 1.041 11.524
454 HE1 TYR 102 HE1 TYR 102 6.889 -1.547 7.971
455 HE2 TYR 102 HE2 TYR 102 3.411 0.494 9.434
456 HH TYR 102 HH TYR 102 4.992 -1.344 6.831
457 H TYR 103 H TYR 103 7.386 3.517 13.353
458 HA TYR 103 HA TYR 103 9.039 2.824 15.739
459 HB2 TYR 103 1HB TYR 103 8.651 5.595 14.536
460 HB3 TYR 103 2HB TYR 103 9.409 5.275 16.090
461 HD1 TYR 103 HD1 TYR 103 9.727 4.772 12.431
462 HD2 TYR 103 HD2 TYR 103 11.668 4.571 16.254
463 HE1 TYR 103 HE1 TYR 103 11.911 4.490 11.308
464 HE2 TYR 103 HE2 TYR 103 13.852 4.289 15.129
465 HH TYR 103 HH TYR 103 14.920 4.146 13.195
466 H THR 104 H THR 104 8.151 3.150 17.714
467 HA THR 104 HA THR 104 5.322 4.123 17.711
468 HB THR 104 HB THR 104 6.534 1.904 19.417
469 HG1 THR 104 HG1 THR 104 5.750 0.627 17.928
470 HG21 THR 104 1HG2 THR 104 4.232 1.612 20.250
471 HG22 THR 104 2HG2 THR 104 4.847 3.237 20.637
472 HG23 THR 104 3HG2 THR 104 3.704 3.015 19.292
473 H LEU 105 H LEU 105 4.923 5.821 18.920
474 HA LEU 105 HA LEU 105 6.928 6.647 20.935
475 HB2 LEU 105 1HB LEU 105 6.145 8.332 19.333
476 HB3 LEU 105 2HB LEU 105 4.473 8.058 19.833
477 HG LEU 105 HG LEU 105 5.032 8.925 22.097
478 HD11 LEU 105 1HD1 LEU 105 7.186 10.051 22.437
479 HD12 LEU 105 2HD1 LEU 105 7.394 8.312 22.123
480 HD13 LEU 105 3HD1 LEU 105 7.728 9.495 20.837
481 HD21 LEU 105 1HD2 LEU 105 5.266 11.282 21.386
482 HD22 LEU 105 2HD2 LEU 105 5.783 10.744 19.770
483 HD23 LEU 105 3HD2 LEU 105 4.129 10.407 20.334
484 H VAL 106 H VAL 106 6.663 5.450 22.740
485 HA VAL 106 HA VAL 106 4.009 4.780 23.740
486 HB VAL 106 HB VAL 106 6.762 4.470 25.008
487 HG11 VAL 106 1HG1 VAL 106 5.678 2.866 26.506
488 HG12 VAL 106 2HG1 VAL 106 5.015 4.507 26.691
489 HG13 VAL 106 3HG1 VAL 106 4.099 3.272 25.795
490 HG21 VAL 106 1HG2 VAL 106 6.528 2.110 24.300
491 HG22 VAL 106 2HG2 VAL 106 4.978 2.501 23.520
492 HG23 VAL 106 3HG2 VAL 106 6.489 3.208 22.901
493 H SER 107 H SER 107 2.795 6.396 24.502
494 HA SER 107 HA SER 107 4.067 8.375 26.328
495 HB2 SER 107 1HB SER 107 2.050 9.704 26.000
496 HB3 SER 107 2HB SER 107 2.755 9.275 24.449
497 HG SER 107 HG SER 107 1.268 7.411 24.597
498 H GLN 108 H GLN 108 2.821 9.048 28.239
499 HA GLN 108 HA GLN 108 0.918 7.099 29.323
500 HB2 GLN 108 1HB GLN 108 3.107 6.045 29.837
501 HB3 GLN 108 2HB GLN 108 3.626 7.514 30.652
502 HG2 GLN 108 1HG GLN 108 1.891 7.242 32.335
503 HG3 GLN 108 2HG GLN 108 1.283 5.792 31.488
504 HE21 GLN 108 1HE2 GLN 108 3.208 4.099 33.920
505 HE22 GLN 108 2HE2 GLN 108 1.623 4.659 33.504
506 HA PRO 109 HA PRO 109 -0.632 10.821 30.989
507 HB2 PRO 109 1HB PRO 109 -1.848 8.902 33.005
508 HB3 PRO 109 2HB PRO 109 -2.634 10.183 32.075
509 HG2 PRO 109 1HG PRO 109 -2.968 7.667 31.278
510 HG3 PRO 109 2HG PRO 109 -2.650 8.909 30.062
511 HD2 PRO 109 1HD PRO 109 -0.718 6.907 31.305
512 HD3 PRO 109 2HD PRO 109 -0.896 7.390 29.570
513 H GLY 110 H GLY 110 1.134 11.827 31.904
514 HA2 GLY 110 1HA GLY 110 2.274 12.764 33.707
515 HA3 GLY 110 2HA GLY 110 1.278 11.811 34.791
516 H GLY 111 H GLY 111 2.995 10.185 32.231
517 HA2 GLY 111 1HA GLY 111 4.903 9.084 34.267
518 HA3 GLY 111 2HA GLY 111 4.176 8.113 32.999
519 H LYS 112 H LYS 112 6.527 7.640 32.618
520 HA LYS 112 HA LYS 112 7.899 9.804 31.105
521 HB2 LYS 112 1HB LYS 112 9.181 8.689 32.914
522 HB3 LYS 112 2HB LYS 112 8.954 7.135 32.124
523 HG2 LYS 112 1HG LYS 112 10.249 7.911 30.185
524 HG3 LYS 112 2HG LYS 112 10.455 9.492 30.949
525 HD2 LYS 112 1HD LYS 112 11.646 8.435 32.837
526 HD3 LYS 112 2HD LYS 112 11.427 6.846 32.089
527 HE2 LYS 112 1HE LYS 112 12.735 7.589 30.126
528 HE3 LYS 112 2HE LYS 112 12.953 9.175 30.867
529 HZ1 LYS 112 1HZ LYS 112 14.844 7.767 31.224
530 HZ2 LYS 112 2HZ LYS 112 14.125 8.108 32.669
531 HZ3 LYS 112 3HZ LYS 112 13.922 6.624 31.974
532 HA PRO 113 HA PRO 113 6.633 7.722 27.460
533 HB2 PRO 113 1HB PRO 113 7.747 9.444 25.645
534 HB3 PRO 113 2HB PRO 113 6.315 9.877 26.587
535 HG2 PRO 113 1HG PRO 113 9.238 10.567 27.122
536 HG3 PRO 113 2HG PRO 113 7.841 11.646 27.133
537 HD2 PRO 113 1HD PRO 113 8.834 10.585 29.440
538 HD3 PRO 113 2HD PRO 113 7.062 10.872 29.218
539 H GLN 114 H GLN 114 7.649 6.614 25.637
540 HA GLN 114 HA GLN 114 10.574 6.198 25.887
541 HB2 GLN 114 1HB GLN 114 9.620 4.512 27.377
542 HB3 GLN 114 2HB GLN 114 8.488 3.997 26.134
543 HG2 GLN 114 1HG GLN 114 10.233 2.394 26.233
544 HG3 GLN 114 2HG GLN 114 10.457 3.324 24.724
545 HE21 GLN 114 1HE2 GLN 114 13.759 4.023 25.463
546 HE22 GLN 114 2HE2 GLN 114 12.526 3.664 24.301
547 H LEU 115 H LEU 115 11.502 6.201 23.975
548 HA LEU 115 HA LEU 115 9.967 5.890 21.528
549 HB2 LEU 115 1HB LEU 115 12.961 5.996 22.038
550 HB3 LEU 115 2HB LEU 115 12.215 5.995 20.436
551 HG LEU 115 HG LEU 115 11.794 8.153 22.537
552 HD11 LEU 115 1HD1 LEU 115 13.263 9.508 21.111
553 HD12 LEU 115 2HD1 LEU 115 14.110 8.084 21.761
554 HD13 LEU 115 3HD1 LEU 115 13.555 8.096 20.068
555 HD21 LEU 115 1HD2 LEU 115 10.800 9.380 20.636
556 HD22 LEU 115 2HD2 LEU 115 11.059 7.968 19.586
557 HD23 LEU 115 3HD2 LEU 115 9.920 7.867 20.950
558 H VAL 116 H VAL 116 9.626 4.143 20.320
559 HA VAL 116 HA VAL 116 11.253 1.708 20.913
560 HB VAL 116 HB VAL 116 8.270 1.815 20.292
561 HG11 VAL 116 1HG1 VAL 116 8.318 -0.611 20.620
562 HG12 VAL 116 2HG1 VAL 116 9.331 -0.104 19.248
563 HG13 VAL 116 3HG1 VAL 116 10.088 -0.550 20.796
564 HG21 VAL 116 1HG2 VAL 116 8.028 0.890 22.575
565 HG22 VAL 116 2HG2 VAL 116 9.790 1.004 22.805
566 HG23 VAL 116 3HG2 VAL 116 8.821 2.482 22.606
567 H ALA 117 H ALA 117 12.327 0.990 19.215
568 HA ALA 117 HA ALA 117 11.402 1.774 16.508
569 HB1 ALA 117 1HB ALA 117 13.620 0.974 15.761
570 HB2 ALA 117 2HB ALA 117 13.759 2.205 17.039
571 HB3 ALA 117 3HB ALA 117 13.998 0.486 17.428
572 H GLU 118 H GLU 118 10.690 0.391 15.005
573 HA GLU 118 HA GLU 118 10.634 -2.501 15.744
574 HB2 GLU 118 1HB GLU 118 8.338 -0.894 14.550
575 HB3 GLU 118 2HB GLU 118 8.333 -2.631 14.823
576 HG2 GLU 118 1HG GLU 118 8.578 -2.234 17.253
577 HG3 GLU 118 2HG GLU 118 8.530 -0.497 16.959
578 HA PRO 119 HA PRO 119 12.210 -3.431 11.807
579 HB2 PRO 119 1HB PRO 119 9.973 -5.493 11.715
580 HB3 PRO 119 2HB PRO 119 11.693 -5.704 11.360
581 HG2 PRO 119 1HG PRO 119 10.789 -6.544 13.713
582 HG3 PRO 119 2HG PRO 119 12.316 -5.662 13.661
583 HD2 PRO 119 1HD PRO 119 9.545 -4.658 14.424
584 HD3 PRO 119 2HD PRO 119 11.139 -4.315 15.210
Start of MODEL 6
1 H GLN 38 1H GLN 38 9.000 -5.020 3.563
2 HA GLN 38 HA GLN 38 9.274 -2.709 3.981
3 HB2 GLN 38 1HB GLN 38 10.565 -3.809 2.168
4 HB3 GLN 38 2HB GLN 38 9.273 -3.463 1.028
5 HG2 GLN 38 1HG GLN 38 9.626 -1.067 1.303
6 HG3 GLN 38 2HG GLN 38 10.904 -1.389 2.509
7 HE21 GLN 38 1HE2 GLN 38 13.001 -0.863 -0.302
8 HE22 GLN 38 2HE2 GLN 38 12.253 -0.094 1.057
9 H ALA 39 H ALA 39 8.263 -0.864 4.250
10 HA ALA 39 HA ALA 39 5.612 -0.506 3.078
11 HB1 ALA 39 1HB ALA 39 5.552 1.551 4.450
12 HB2 ALA 39 2HB ALA 39 6.027 0.132 5.412
13 HB3 ALA 39 3HB ALA 39 7.259 1.301 4.885
14 HA PRO 40 HA PRO 40 6.512 1.896 -0.405
15 HB2 PRO 40 1HB PRO 40 4.376 3.797 0.620
16 HB3 PRO 40 2HB PRO 40 4.535 3.063 -0.979
17 HG2 PRO 40 1HG PRO 40 2.740 2.043 0.696
18 HG3 PRO 40 2HG PRO 40 3.750 0.939 -0.245
19 HD2 PRO 40 1HD PRO 40 4.054 1.814 2.659
20 HD3 PRO 40 2HD PRO 40 4.222 0.161 1.944
21 H LYS 41 H LYS 41 8.004 3.439 -0.831
22 HA LYS 41 HA LYS 41 8.954 5.148 1.345
23 HB2 LYS 41 1HB LYS 41 9.831 4.826 -1.550
24 HB3 LYS 41 2HB LYS 41 10.606 5.921 -0.413
25 HG2 LYS 41 1HG LYS 41 11.147 3.978 1.048
26 HG3 LYS 41 2HG LYS 41 10.440 2.904 -0.167
27 HD2 LYS 41 1HD LYS 41 12.075 3.682 -1.834
28 HD3 LYS 41 2HD LYS 41 12.761 4.809 -0.655
29 HE2 LYS 41 1HE LYS 41 13.384 2.905 0.798
30 HE3 LYS 41 2HE LYS 41 12.698 1.779 -0.375
31 HZ1 LYS 41 1HZ LYS 41 15.063 1.984 -0.624
32 HZ2 LYS 41 2HZ LYS 41 14.311 2.559 -1.975
33 HZ3 LYS 41 3HZ LYS 41 14.952 3.608 -0.878
34 H GLY 42 H GLY 42 9.416 7.469 0.962
35 HA2 GLY 42 1HA GLY 42 8.684 9.521 -0.223
36 HA3 GLY 42 2HA GLY 42 7.133 8.750 -0.497
37 H SER 43 H SER 43 7.359 7.561 2.329
38 HA SER 43 HA SER 43 7.286 9.929 4.061
39 HB2 SER 43 1HB SER 43 5.022 9.977 3.193
40 HB3 SER 43 2HB SER 43 4.808 8.265 3.518
41 HG SER 43 HG SER 43 5.198 8.769 5.728
42 H ALA 44 H ALA 44 7.745 9.474 6.143
43 HA ALA 44 HA ALA 44 8.411 6.686 6.782
44 HB1 ALA 44 1HB ALA 44 9.308 7.639 8.881
45 HB2 ALA 44 2HB ALA 44 9.953 8.476 7.450
46 HB3 ALA 44 3HB ALA 44 8.671 9.233 8.420
47 H PHE 45 H PHE 45 7.659 5.570 8.642
48 HA PHE 45 HA PHE 45 4.813 6.288 9.216
49 HB2 PHE 45 1HB PHE 45 6.101 3.540 8.973
50 HB3 PHE 45 2HB PHE 45 4.439 3.827 9.458
51 HD1 PHE 45 HD1 PHE 45 6.838 4.115 6.663
52 HD2 PHE 45 HD2 PHE 45 2.743 4.306 7.863
53 HE1 PHE 45 HE1 PHE 45 6.145 4.098 4.292
54 HE2 PHE 45 HE2 PHE 45 2.045 4.287 5.492
55 HZ PHE 45 HZ PHE 45 3.747 4.185 3.706
56 H VAL 46 H VAL 46 4.050 6.198 11.263
57 HA VAL 46 HA VAL 46 5.889 5.243 13.393
58 HB VAL 46 HB VAL 46 6.295 7.684 13.122
59 HG11 VAL 46 1HG1 VAL 46 4.520 9.289 13.641
60 HG12 VAL 46 2HG1 VAL 46 4.143 8.320 12.196
61 HG13 VAL 46 3HG1 VAL 46 3.348 7.955 13.746
62 HG21 VAL 46 1HG2 VAL 46 5.868 8.306 15.478
63 HG22 VAL 46 2HG2 VAL 46 4.741 6.939 15.635
64 HG23 VAL 46 3HG2 VAL 46 6.473 6.637 15.353
65 H ARG 47 H ARG 47 4.899 4.381 15.147
66 HA ARG 47 HA ARG 47 1.913 4.375 15.086
67 HB2 ARG 47 1HB ARG 47 2.904 2.155 14.761
68 HB3 ARG 47 2HB ARG 47 3.850 2.333 16.232
69 HG2 ARG 47 1HG ARG 47 1.904 2.216 17.608
70 HG3 ARG 47 2HG ARG 47 0.825 2.356 16.198
71 HD2 ARG 47 1HD ARG 47 2.763 0.101 16.642
72 HD3 ARG 47 2HD ARG 47 1.044 0.068 17.099
73 HE ARG 47 HE ARG 47 1.065 0.784 14.432
74 HH11 ARG 47 1HH1 ARG 47 2.266 -1.921 16.326
75 HH12 ARG 47 2HH1 ARG 47 2.091 -3.073 15.023
76 HH21 ARG 47 1HH2 ARG 47 0.840 -0.722 12.748
77 HH22 ARG 47 2HH2 ARG 47 1.283 -2.397 12.996
78 H ALA 48 H ALA 48 1.071 5.724 16.511
79 HA ALA 48 HA ALA 48 2.553 6.370 18.971
80 HB1 ALA 48 1HB ALA 48 0.765 8.042 19.323
81 HB2 ALA 48 2HB ALA 48 1.506 8.198 17.712
82 HB3 ALA 48 3HB ALA 48 -0.085 7.422 17.889
83 H TYR 49 H TYR 49 2.258 5.429 20.847
84 HA TYR 49 HA TYR 49 -0.231 3.818 21.215
85 HB2 TYR 49 1HB TYR 49 1.786 2.435 21.211
86 HB3 TYR 49 2HB TYR 49 2.543 3.467 22.417
87 HD1 TYR 49 HD1 TYR 49 -0.102 0.963 21.817
88 HD2 TYR 49 HD2 TYR 49 2.004 3.290 24.744
89 HE1 TYR 49 HE1 TYR 49 -1.047 -0.444 23.613
90 HE2 TYR 49 HE2 TYR 49 1.057 1.880 26.543
91 HH TYR 49 HH TYR 49 -1.167 -0.796 25.805
92 H ASN 50 H ASN 50 -1.532 4.145 22.902
93 HA ASN 50 HA ASN 50 -0.866 6.496 24.602
94 HB2 ASN 50 1HB ASN 50 -2.958 6.561 23.244
95 HB3 ASN 50 2HB ASN 50 -3.545 5.153 24.118
96 HD21 ASN 50 1HD2 ASN 50 -4.898 8.277 25.634
97 HD22 ASN 50 2HD2 ASN 50 -4.879 7.605 24.037
98 H ALA 51 H ALA 51 0.157 5.939 26.381
99 HA ALA 51 HA ALA 51 -0.545 3.390 27.697
100 HB1 ALA 51 1HB ALA 51 1.453 3.829 29.091
101 HB2 ALA 51 2HB ALA 51 1.834 3.893 27.351
102 HB3 ALA 51 3HB ALA 51 1.659 5.400 28.281
103 H GLY 52 H GLY 52 -1.866 6.320 27.732
104 HA2 GLY 52 1HA GLY 52 -2.069 6.605 30.684
105 HA3 GLY 52 2HA GLY 52 -2.580 7.787 29.495
106 H ASN 53 H ASN 53 -4.491 7.671 31.063
107 HA ASN 53 HA ASN 53 -6.333 5.450 30.323
108 HB2 ASN 53 1HB ASN 53 -6.406 7.457 32.597
109 HB3 ASN 53 2HB ASN 53 -7.715 6.337 32.238
110 HD21 ASN 53 1HD2 ASN 53 -5.087 5.093 34.755
111 HD22 ASN 53 2HD2 ASN 53 -5.714 6.688 34.507
112 H SER 54 H SER 54 -5.530 8.389 29.196
113 HA SER 54 HA SER 54 -8.173 8.641 27.910
114 HB2 SER 54 1HB SER 54 -8.417 10.990 28.393
115 HB3 SER 54 2HB SER 54 -8.263 10.121 29.914
116 HG SER 54 HG SER 54 -6.411 11.720 28.567
117 H GLU 55 H GLU 55 -8.111 10.335 26.154
118 HA GLU 55 HA GLU 55 -6.102 9.672 24.307
119 HB2 GLU 55 1HB GLU 55 -8.311 10.683 23.733
120 HB3 GLU 55 2HB GLU 55 -7.766 12.221 24.390
121 HG2 GLU 55 1HG GLU 55 -5.977 12.310 22.696
122 HG3 GLU 55 2HG GLU 55 -6.535 10.775 22.034
123 H LEU 56 H LEU 56 -4.040 10.139 24.156
124 HA LEU 56 HA LEU 56 -3.044 12.569 25.573
125 HB2 LEU 56 1HB LEU 56 -1.550 10.083 24.666
126 HB3 LEU 56 2HB LEU 56 -0.836 11.460 25.513
127 HG LEU 56 HG LEU 56 -2.928 9.568 26.642
128 HD11 LEU 56 1HD1 LEU 56 -1.086 8.816 28.081
129 HD12 LEU 56 2HD1 LEU 56 -0.735 8.532 26.360
130 HD13 LEU 56 3HD1 LEU 56 0.032 9.893 27.212
131 HD21 LEU 56 1HD2 LEU 56 -2.498 10.778 28.754
132 HD22 LEU 56 2HD2 LEU 56 -1.398 11.886 27.895
133 HD23 LEU 56 3HD2 LEU 56 -3.135 11.875 27.506
134 H ASP 57 H ASP 57 -1.904 14.118 24.541
135 HA ASP 57 HA ASP 57 -1.656 13.818 21.584
136 HB2 ASP 57 1HB ASP 57 -1.748 16.300 23.344
137 HB3 ASP 57 2HB ASP 57 -1.432 16.332 21.613
138 H VAL 58 H VAL 58 0.243 14.212 20.525
139 HA VAL 58 HA VAL 58 2.613 14.916 22.170
140 HB VAL 58 HB VAL 58 2.595 12.459 22.078
141 HG11 VAL 58 1HG1 VAL 58 2.717 11.266 19.946
142 HG12 VAL 58 2HG1 VAL 58 1.194 12.167 20.117
143 HG13 VAL 58 3HG1 VAL 58 2.487 12.802 19.074
144 HG21 VAL 58 1HG2 VAL 58 4.794 12.124 21.000
145 HG22 VAL 58 2HG2 VAL 58 4.624 13.687 20.167
146 HG23 VAL 58 3HG2 VAL 58 4.764 13.632 21.939
147 H SER 59 H SER 59 4.058 16.194 21.169
148 HA SER 59 HA SER 59 3.447 16.925 18.347
149 HB2 SER 59 1HB SER 59 3.420 18.773 19.940
150 HB3 SER 59 2HB SER 59 5.031 18.356 20.506
151 HG SER 59 HG SER 59 5.561 18.577 18.161
152 H VAL 60 H VAL 60 4.550 15.723 16.957
153 HA VAL 60 HA VAL 60 7.346 14.966 17.649
154 HB VAL 60 HB VAL 60 5.513 13.877 15.469
155 HG11 VAL 60 1HG1 VAL 60 7.162 12.080 15.291
156 HG12 VAL 60 2HG1 VAL 60 7.864 13.667 14.903
157 HG13 VAL 60 3HG1 VAL 60 8.196 12.911 16.479
158 HG21 VAL 60 1HG2 VAL 60 5.324 11.902 16.947
159 HG22 VAL 60 2HG2 VAL 60 6.295 12.735 18.183
160 HG23 VAL 60 3HG2 VAL 60 4.691 13.363 17.743
161 H GLY 61 H GLY 61 8.544 16.736 17.081
162 HA2 GLY 61 1HA GLY 61 9.684 18.171 15.650
163 HA3 GLY 61 2HA GLY 61 9.107 17.211 14.301
164 H SER 62 H SER 62 7.639 18.089 12.966
165 HA SER 62 HA SER 62 6.397 20.660 13.813
166 HB2 SER 62 1HB SER 62 6.150 21.129 11.441
167 HB3 SER 62 2HB SER 62 7.820 20.714 11.796
168 HG SER 62 HG SER 62 5.968 18.773 11.012
169 H THR 63 H THR 63 5.667 17.421 13.545
170 HA THR 63 HA THR 63 2.808 18.015 12.906
171 HB THR 63 HB THR 63 4.384 15.479 12.282
172 HG1 THR 63 HG1 THR 63 3.373 16.419 10.110
173 HG21 THR 63 1HG2 THR 63 2.311 14.738 11.177
174 HG22 THR 63 2HG2 THR 63 2.045 15.007 12.916
175 HG23 THR 63 3HG2 THR 63 1.483 16.211 11.731
176 H SER 64 H SER 64 1.534 17.832 14.585
177 HA SER 64 HA SER 64 2.327 16.127 16.859
178 HB2 SER 64 1HB SER 64 0.460 17.139 18.016
179 HB3 SER 64 2HB SER 64 1.402 18.398 17.235
180 HG SER 64 HG SER 64 -0.955 17.202 16.267
181 H LEU 65 H LEU 65 0.953 14.531 17.772
182 HA LEU 65 HA LEU 65 -0.894 13.300 15.770
183 HB2 LEU 65 1HB LEU 65 0.771 11.837 17.846
184 HB3 LEU 65 2HB LEU 65 -0.233 11.114 16.585
185 HG LEU 65 HG LEU 65 2.302 12.724 16.113
186 HD11 LEU 65 1HD1 LEU 65 3.254 10.557 15.474
187 HD12 LEU 65 2HD1 LEU 65 2.726 10.566 17.173
188 HD13 LEU 65 3HD1 LEU 65 1.737 9.752 15.938
189 HD21 LEU 65 1HD2 LEU 65 2.028 11.950 13.784
190 HD22 LEU 65 2HD2 LEU 65 0.493 11.164 14.223
191 HD23 LEU 65 3HD2 LEU 65 0.640 12.936 14.294
192 H ASN 66 H ASN 66 -2.752 12.265 16.524
193 HA ASN 66 HA ASN 66 -3.437 12.357 19.357
194 HB2 ASN 66 1HB ASN 66 -5.340 13.892 19.115
195 HB3 ASN 66 2HB ASN 66 -3.816 14.703 18.794
196 HD21 ASN 66 1HD2 ASN 66 -5.378 16.026 15.977
197 HD22 ASN 66 2HD2 ASN 66 -4.722 16.310 17.555
198 H ASP 67 H ASP 67 -6.049 12.071 19.420
199 HA ASP 67 HA ASP 67 -7.785 10.620 19.008
200 HB2 ASP 67 1HB ASP 67 -7.522 11.721 16.676
201 HB3 ASP 67 2HB ASP 67 -6.704 10.241 16.198
202 H VAL 68 H VAL 68 -5.564 9.557 20.259
203 HA VAL 68 HA VAL 68 -5.619 6.769 19.181
204 HB VAL 68 HB VAL 68 -3.519 8.070 20.967
205 HG11 VAL 68 1HG1 VAL 68 -2.260 5.998 20.638
206 HG12 VAL 68 2HG1 VAL 68 -3.808 5.713 21.468
207 HG13 VAL 68 3HG1 VAL 68 -3.634 5.307 19.743
208 HG21 VAL 68 1HG2 VAL 68 -2.053 7.838 18.986
209 HG22 VAL 68 2HG2 VAL 68 -3.427 7.209 18.046
210 HG23 VAL 68 3HG2 VAL 68 -3.447 8.887 18.636
211 H ALA 69 H ALA 69 -6.726 5.347 20.325
212 HA ALA 69 HA ALA 69 -8.043 6.186 22.751
213 HB1 ALA 69 1HB ALA 69 -9.013 3.910 22.732
214 HB2 ALA 69 2HB ALA 69 -9.136 4.690 21.140
215 HB3 ALA 69 3HB ALA 69 -7.893 3.452 21.427
216 HA PRO 70 HA PRO 70 -5.278 5.042 25.901
217 HB2 PRO 70 1HB PRO 70 -7.765 3.846 27.183
218 HB3 PRO 70 2HB PRO 70 -6.553 4.912 27.900
219 HG2 PRO 70 1HG PRO 70 -8.871 5.977 27.159
220 HG3 PRO 70 2HG PRO 70 -7.382 6.844 26.777
221 HD2 PRO 70 1HD PRO 70 -9.099 5.092 24.973
222 HD3 PRO 70 2HD PRO 70 -8.307 6.676 24.605
223 H LEU 71 H LEU 71 -3.969 3.311 26.085
224 HA LEU 71 HA LEU 71 -3.201 1.141 26.053
225 HB2 LEU 71 1HB LEU 71 -6.118 0.337 26.308
226 HB3 LEU 71 2HB LEU 71 -4.711 -0.678 26.641
227 HG LEU 71 HG LEU 71 -5.560 1.773 28.223
228 HD11 LEU 71 1HD1 LEU 71 -6.047 0.131 29.981
229 HD12 LEU 71 2HD1 LEU 71 -7.031 -0.152 28.527
230 HD13 LEU 71 3HD1 LEU 71 -5.625 -1.188 28.866
231 HD21 LEU 71 1HD2 LEU 71 -3.739 1.096 29.753
232 HD22 LEU 71 2HD2 LEU 71 -3.285 -0.210 28.634
233 HD23 LEU 71 3HD2 LEU 71 -3.105 1.489 28.137
234 H GLY 72 H GLY 72 -4.440 2.614 23.631
235 HA2 GLY 72 1HA GLY 72 -4.218 0.217 21.843
236 HA3 GLY 72 2HA GLY 72 -5.343 1.520 21.504
237 H SER 73 H SER 73 -4.091 1.518 19.437
238 HA SER 73 HA SER 73 -2.046 3.614 19.551
239 HB2 SER 73 1HB SER 73 -0.307 2.372 18.444
240 HB3 SER 73 2HB SER 73 -0.758 1.504 19.901
241 HG SER 73 HG SER 73 -1.678 0.994 17.289
242 H SER 74 H SER 74 -1.367 4.311 17.367
243 HA SER 74 HA SER 74 -3.083 3.400 15.151
244 HB2 SER 74 1HB SER 74 -4.430 5.155 16.212
245 HB3 SER 74 2HB SER 74 -3.074 6.270 16.139
246 HG SER 74 HG SER 74 -3.166 6.258 13.965
247 H ASP 75 H ASP 75 -2.233 3.756 13.142
248 HA ASP 75 HA ASP 75 0.621 4.539 13.161
249 HB2 ASP 75 1HB ASP 75 -1.110 3.160 11.071
250 HB3 ASP 75 2HB ASP 75 0.578 3.586 10.816
251 H PHE 76 H PHE 76 1.486 6.202 12.048
252 HA PHE 76 HA PHE 76 -0.409 7.928 10.520
253 HB2 PHE 76 1HB PHE 76 1.680 8.864 12.529
254 HB3 PHE 76 2HB PHE 76 0.728 9.918 11.496
255 HD1 PHE 76 HD1 PHE 76 0.716 7.784 14.457
256 HD2 PHE 76 HD2 PHE 76 -1.666 10.232 11.892
257 HE1 PHE 76 HE1 PHE 76 -1.063 7.850 16.173
258 HE2 PHE 76 HE2 PHE 76 -3.444 10.302 13.606
259 HZ PHE 76 HZ PHE 76 -3.143 9.109 15.747
260 H LYS 77 H LYS 77 0.663 9.471 9.076
261 HA LYS 77 HA LYS 77 3.433 8.932 8.327
262 HB2 LYS 77 1HB LYS 77 2.960 8.131 6.064
263 HB3 LYS 77 2HB LYS 77 2.291 7.021 7.253
264 HG2 LYS 77 1HG LYS 77 0.046 8.083 6.911
265 HG3 LYS 77 2HG LYS 77 0.758 9.063 5.620
266 HD2 LYS 77 1HD LYS 77 1.416 6.991 4.421
267 HD3 LYS 77 2HD LYS 77 0.673 6.023 5.705
268 HE2 LYS 77 1HE LYS 77 -1.515 7.114 5.222
269 HE3 LYS 77 2HE LYS 77 -0.761 8.004 3.898
270 HZ1 LYS 77 1HZ LYS 77 -1.871 6.040 3.120
271 HZ2 LYS 77 2HZ LYS 77 -0.249 5.904 2.855
272 HZ3 LYS 77 3HZ LYS 77 -0.955 5.072 4.092
273 H PHE 78 H PHE 78 3.001 9.797 5.567
274 HA PHE 78 HA PHE 78 3.074 11.793 4.419
275 HB2 PHE 78 1HB PHE 78 1.318 12.914 6.638
276 HB3 PHE 78 2HB PHE 78 1.572 13.616 5.047
277 HD1 PHE 78 HD1 PHE 78 -0.621 11.738 6.974
278 HD2 PHE 78 HD2 PHE 78 1.037 11.902 3.041
279 HE1 PHE 78 HE1 PHE 78 -2.556 10.467 6.107
280 HE2 PHE 78 HE2 PHE 78 -0.896 10.633 2.170
281 HZ PHE 78 HZ PHE 78 -2.693 9.913 3.705
282 H LEU 79 H LEU 79 5.064 11.092 6.380
283 HA LEU 79 HA LEU 79 6.026 13.825 7.066
284 HB2 LEU 79 1HB LEU 79 5.069 12.845 9.106
285 HB3 LEU 79 2HB LEU 79 6.066 11.402 8.900
286 HG LEU 79 HG LEU 79 8.104 12.863 9.181
287 HD11 LEU 79 1HD1 LEU 79 7.772 15.092 10.155
288 HD12 LEU 79 2HD1 LEU 79 7.082 14.979 8.518
289 HD13 LEU 79 3HD1 LEU 79 6.013 14.923 9.940
290 HD21 LEU 79 1HD2 LEU 79 7.813 13.058 11.629
291 HD22 LEU 79 2HD2 LEU 79 6.055 12.861 11.434
292 HD23 LEU 79 3HD2 LEU 79 7.150 11.520 11.026
293 HA PRO 80 HA PRO 80 9.413 12.288 4.675
294 HB2 PRO 80 1HB PRO 80 10.651 14.696 6.078
295 HB3 PRO 80 2HB PRO 80 10.799 14.205 4.387
296 HG2 PRO 80 1HG PRO 80 9.113 16.170 4.970
297 HG3 PRO 80 2HG PRO 80 8.589 14.918 3.840
298 HD2 PRO 80 1HD PRO 80 7.916 15.247 6.786
299 HD3 PRO 80 2HD PRO 80 6.842 14.744 5.419
300 HA PRO 81 HA PRO 81 11.312 9.868 7.839
301 HB2 PRO 81 1HB PRO 81 13.507 9.690 5.740
302 HB3 PRO 81 2HB PRO 81 12.754 8.389 6.670
303 HG2 PRO 81 1HG PRO 81 11.995 8.732 4.143
304 HG3 PRO 81 2HG PRO 81 10.761 8.418 5.367
305 HD2 PRO 81 1HD PRO 81 11.583 11.065 4.105
306 HD3 PRO 81 2HD PRO 81 9.924 10.445 4.482
307 H GLY 82 H GLY 82 12.991 10.071 9.354
308 HA2 GLY 82 1HA GLY 82 15.352 11.356 9.436
309 HA3 GLY 82 2HA GLY 82 14.279 12.738 9.356
310 H SER 83 H SER 83 15.481 13.044 11.499
311 HA SER 83 HA SER 83 14.158 11.516 13.690
312 HB2 SER 83 1HB SER 83 16.580 11.506 13.797
313 HB3 SER 83 2HB SER 83 16.644 13.254 13.639
314 HG SER 83 HG SER 83 15.090 12.958 15.594
315 H TYR 84 H TYR 84 12.595 12.400 14.827
316 HA TYR 84 HA TYR 84 12.440 15.382 14.926
317 HB2 TYR 84 1HB TYR 84 10.094 13.458 14.633
318 HB3 TYR 84 2HB TYR 84 9.976 15.204 14.813
319 HD1 TYR 84 HD1 TYR 84 10.735 12.445 12.546
320 HD2 TYR 84 HD2 TYR 84 10.655 16.711 12.999
321 HE1 TYR 84 HE1 TYR 84 10.876 12.708 10.092
322 HE2 TYR 84 HE2 TYR 84 10.797 16.974 10.545
323 HH TYR 84 HH TYR 84 10.746 14.165 8.387
324 H THR 85 H THR 85 11.886 16.311 16.819
325 HA THR 85 HA THR 85 12.169 14.617 19.184
326 HB THR 85 HB THR 85 11.681 17.617 18.944
327 HG1 THR 85 HG1 THR 85 13.954 17.661 19.419
328 HG21 THR 85 1HG2 THR 85 12.452 17.688 21.282
329 HG22 THR 85 2HG2 THR 85 10.979 16.700 21.129
330 HG23 THR 85 3HG2 THR 85 12.566 15.912 21.303
331 H ALA 86 H ALA 86 10.573 13.581 20.111
332 HA ALA 86 HA ALA 86 7.803 14.497 19.648
333 HB1 ALA 86 1HB ALA 86 7.166 12.332 20.658
334 HB2 ALA 86 2HB ALA 86 8.298 12.119 19.303
335 HB3 ALA 86 3HB ALA 86 8.881 11.987 20.978
336 H GLN 87 H GLN 87 7.093 16.027 20.946
337 HA GLN 87 HA GLN 87 8.041 16.183 23.724
338 HB2 GLN 87 1HB GLN 87 7.742 18.243 22.370
339 HB3 GLN 87 2HB GLN 87 6.028 17.895 22.210
340 HG2 GLN 87 1HG GLN 87 6.271 19.542 23.895
341 HG3 GLN 87 2HG GLN 87 5.846 18.012 24.714
342 HE21 GLN 87 1HE2 GLN 87 8.443 18.553 26.954
343 HE22 GLN 87 2HE2 GLN 87 6.757 18.273 26.681
344 H VAL 88 H VAL 88 7.195 14.960 25.235
345 HA VAL 88 HA VAL 88 4.241 14.511 25.163
346 HB VAL 88 HB VAL 88 6.394 12.622 26.205
347 HG11 VAL 88 1HG1 VAL 88 4.556 11.049 26.565
348 HG12 VAL 88 2HG1 VAL 88 4.379 12.519 27.553
349 HG13 VAL 88 3HG1 VAL 88 3.389 12.305 26.088
350 HG21 VAL 88 1HG2 VAL 88 5.657 11.168 24.344
351 HG22 VAL 88 2HG2 VAL 88 4.530 12.434 23.802
352 HG23 VAL 88 3HG2 VAL 88 6.286 12.718 23.740
353 H GLY 89 H GLY 89 3.453 15.920 26.604
354 HA2 GLY 89 1HA GLY 89 3.047 16.927 28.656
355 HA3 GLY 89 2HA GLY 89 3.947 15.623 29.409
356 H GLN 90 H GLN 90 5.653 16.277 30.542
357 HA GLN 90 HA GLN 90 6.985 18.825 29.787
358 HB2 GLN 90 1HB GLN 90 7.217 17.128 32.307
359 HB3 GLN 90 2HB GLN 90 8.057 18.648 32.031
360 HG2 GLN 90 1HG GLN 90 5.056 18.294 32.159
361 HG3 GLN 90 2HG GLN 90 6.103 18.947 33.449
362 HE21 GLN 90 1HE2 GLN 90 4.481 21.465 30.901
363 HE22 GLN 90 2HE2 GLN 90 3.884 19.900 31.347
364 H GLN 91 H GLN 91 7.275 15.654 29.038
365 HA GLN 91 HA GLN 91 10.258 15.731 29.061
366 HB2 GLN 91 1HB GLN 91 8.389 13.341 28.790
367 HB3 GLN 91 2HB GLN 91 10.145 13.268 28.790
368 HG2 GLN 91 1HG GLN 91 8.467 14.281 31.095
369 HG3 GLN 91 2HG GLN 91 9.143 12.631 30.946
370 HE21 GLN 91 1HE2 GLN 91 11.292 15.410 32.738
371 HE22 GLN 91 2HE2 GLN 91 9.570 15.388 32.563
372 H SER 92 H SER 92 11.293 14.551 27.211
373 HA SER 92 HA SER 92 9.731 14.599 24.708
374 HB2 SER 92 1HB SER 92 11.271 16.058 23.545
375 HB3 SER 92 2HB SER 92 10.628 16.899 24.946
376 HG SER 92 HG SER 92 12.744 17.229 24.993
377 H LEU 93 H LEU 93 10.741 13.506 22.961
378 HA LEU 93 HA LEU 93 13.248 12.069 23.508
379 HB2 LEU 93 1HB LEU 93 11.567 10.643 24.595
380 HB3 LEU 93 2HB LEU 93 10.610 10.610 23.112
381 HG LEU 93 HG LEU 93 12.526 9.436 21.979
382 HD11 LEU 93 1HD1 LEU 93 14.263 8.451 23.405
383 HD12 LEU 93 2HD1 LEU 93 14.311 10.229 23.444
384 HD13 LEU 93 3HD1 LEU 93 13.609 9.328 24.809
385 HD21 LEU 93 1HD2 LEU 93 12.070 7.273 23.085
386 HD22 LEU 93 2HD2 LEU 93 11.385 8.135 24.485
387 HD23 LEU 93 3HD2 LEU 93 10.577 8.225 22.901
388 HA PRO 94 HA PRO 94 13.356 12.996 19.144
389 HB2 PRO 94 1HB PRO 94 15.915 11.413 19.527
390 HB3 PRO 94 2HB PRO 94 15.670 12.949 18.683
391 HG2 PRO 94 1HG PRO 94 16.784 13.002 21.100
392 HG3 PRO 94 2HG PRO 94 15.552 14.204 20.703
393 HD2 PRO 94 1HD PRO 94 15.263 11.616 22.291
394 HD3 PRO 94 2HD PRO 94 14.612 13.262 22.670
395 H VAL 95 H VAL 95 12.492 11.772 17.567
396 HA VAL 95 HA VAL 95 12.756 8.800 17.789
397 HB VAL 95 HB VAL 95 10.345 10.406 16.836
398 HG11 VAL 95 1HG1 VAL 95 9.234 8.236 16.603
399 HG12 VAL 95 2HG1 VAL 95 10.635 8.388 15.516
400 HG13 VAL 95 3HG1 VAL 95 10.762 7.413 16.998
401 HG21 VAL 95 1HG2 VAL 95 9.231 9.389 18.799
402 HG22 VAL 95 2HG2 VAL 95 10.762 8.610 19.260
403 HG23 VAL 95 3HG2 VAL 95 10.624 10.382 19.289
404 H LYS 96 H LYS 96 13.959 8.041 16.191
405 HA LYS 96 HA LYS 96 14.010 9.390 13.575
406 HB2 LYS 96 1HB LYS 96 16.091 8.426 14.525
407 HB3 LYS 96 2HB LYS 96 15.356 6.829 14.527
408 HG2 LYS 96 1HG LYS 96 15.226 6.835 12.091
409 HG3 LYS 96 2HG LYS 96 15.856 8.489 12.041
410 HD2 LYS 96 1HD LYS 96 17.945 7.692 13.160
411 HD3 LYS 96 2HD LYS 96 17.315 6.039 13.095
412 HE2 LYS 96 1HE LYS 96 17.658 7.776 10.629
413 HE3 LYS 96 2HE LYS 96 18.915 6.692 11.229
414 HZ1 LYS 96 1HZ LYS 96 17.589 5.654 9.538
415 HZ2 LYS 96 2HZ LYS 96 17.383 4.862 10.972
416 HZ3 LYS 96 3HZ LYS 96 16.208 5.874 10.409
417 H LEU 97 H LEU 97 12.746 8.958 11.930
418 HA LEU 97 HA LEU 97 11.215 6.392 12.000
419 HB2 LEU 97 1HB LEU 97 10.344 9.092 10.915
420 HB3 LEU 97 2HB LEU 97 9.402 7.602 10.828
421 HG LEU 97 HG LEU 97 10.203 8.997 13.406
422 HD11 LEU 97 1HD1 LEU 97 7.845 9.671 13.503
423 HD12 LEU 97 2HD1 LEU 97 8.666 10.352 12.079
424 HD13 LEU 97 3HD1 LEU 97 7.574 8.957 11.897
425 HD21 LEU 97 1HD2 LEU 97 8.561 7.440 14.403
426 HD22 LEU 97 2HD2 LEU 97 8.299 6.692 12.807
427 HD23 LEU 97 3HD2 LEU 97 9.885 6.552 13.609
428 H ASP 98 H ASP 98 11.048 5.194 10.172
429 HA ASP 98 HA ASP 98 12.735 6.134 7.891
430 HB2 ASP 98 1HB ASP 98 12.259 3.298 8.893
431 HB3 ASP 98 2HB ASP 98 13.180 3.714 7.457
432 HA PRO 99 HA PRO 99 9.277 5.631 5.343
433 HB2 PRO 99 1HB PRO 99 10.402 5.302 2.882
434 HB3 PRO 99 2HB PRO 99 10.580 6.814 3.782
435 HG2 PRO 99 1HG PRO 99 12.524 4.473 3.575
436 HG3 PRO 99 2HG PRO 99 12.861 6.195 3.373
437 HD2 PRO 99 1HD PRO 99 13.312 4.898 5.744
438 HD3 PRO 99 2HD PRO 99 12.807 6.633 5.679
439 H ASP 100 H ASP 100 11.584 3.070 5.689
440 HA ASP 100 HA ASP 100 10.049 1.204 3.981
441 HB2 ASP 100 1HB ASP 100 12.677 0.872 5.477
442 HB3 ASP 100 2HB ASP 100 11.935 -0.371 4.479
443 H SER 101 H SER 101 10.719 1.906 7.347
444 HA SER 101 HA SER 101 8.935 -0.374 8.092
445 HB2 SER 101 1HB SER 101 11.356 -0.768 8.654
446 HB3 SER 101 2HB SER 101 11.301 0.645 9.697
447 HG SER 101 HG SER 101 9.996 -1.804 9.924
448 H TYR 102 H TYR 102 8.923 0.220 10.859
449 HA TYR 102 HA TYR 102 8.082 3.031 11.116
450 HB2 TYR 102 1HB TYR 102 5.860 2.549 11.919
451 HB3 TYR 102 2HB TYR 102 6.037 1.790 10.343
452 HD1 TYR 102 HD1 TYR 102 5.572 1.253 13.919
453 HD2 TYR 102 HD2 TYR 102 6.266 -0.656 10.140
454 HE1 TYR 102 HE1 TYR 102 4.886 -0.918 14.886
455 HE2 TYR 102 HE2 TYR 102 5.582 -2.822 11.107
456 HH TYR 102 HH TYR 102 5.415 -3.894 13.288
457 H TYR 103 H TYR 103 7.721 3.695 13.314
458 HA TYR 103 HA TYR 103 8.901 1.814 15.311
459 HB2 TYR 103 1HB TYR 103 9.433 4.803 15.055
460 HB3 TYR 103 2HB TYR 103 9.968 3.801 16.398
461 HD1 TYR 103 HD1 TYR 103 10.329 4.373 12.751
462 HD2 TYR 103 HD2 TYR 103 11.907 2.453 16.249
463 HE1 TYR 103 HE1 TYR 103 12.391 3.809 11.511
464 HE2 TYR 103 HE2 TYR 103 13.970 1.890 15.010
465 HH TYR 103 HH TYR 103 14.378 2.819 11.600
466 H THR 104 H THR 104 8.051 1.795 17.336
467 HA THR 104 HA THR 104 5.396 3.130 17.522
468 HB THR 104 HB THR 104 6.496 0.710 19.014
469 HG1 THR 104 HG1 THR 104 5.059 -0.414 17.689
470 HG21 THR 104 1HG2 THR 104 4.198 0.470 19.863
471 HG22 THR 104 2HG2 THR 104 4.911 2.016 20.383
472 HG23 THR 104 3HG2 THR 104 3.735 1.983 19.048
473 H LEU 105 H LEU 105 5.213 4.853 18.738
474 HA LEU 105 HA LEU 105 7.232 5.306 20.870
475 HB2 LEU 105 1HB LEU 105 6.950 7.089 19.207
476 HB3 LEU 105 2HB LEU 105 5.225 7.182 19.570
477 HG LEU 105 HG LEU 105 5.798 7.926 21.889
478 HD11 LEU 105 1HD1 LEU 105 8.104 8.641 22.344
479 HD12 LEU 105 2HD1 LEU 105 8.005 6.891 22.039
480 HD13 LEU 105 3HD1 LEU 105 8.616 7.982 20.773
481 HD21 LEU 105 1HD2 LEU 105 6.499 10.193 21.198
482 HD22 LEU 105 2HD2 LEU 105 6.989 9.557 19.608
483 HD23 LEU 105 3HD2 LEU 105 5.275 9.534 20.087
484 H VAL 106 H VAL 106 6.704 4.614 22.816
485 HA VAL 106 HA VAL 106 3.907 4.370 23.637
486 HB VAL 106 HB VAL 106 6.489 3.978 25.209
487 HG11 VAL 106 1HG1 VAL 106 5.097 2.742 26.798
488 HG12 VAL 106 2HG1 VAL 106 4.609 4.449 26.671
489 HG13 VAL 106 3HG1 VAL 106 3.645 3.188 25.868
490 HG21 VAL 106 1HG2 VAL 106 6.052 1.573 24.828
491 HG22 VAL 106 2HG2 VAL 106 4.633 1.989 23.837
492 HG23 VAL 106 3HG2 VAL 106 6.267 2.440 23.288
493 H SER 107 H SER 107 2.914 6.299 23.890
494 HA SER 107 HA SER 107 4.329 8.527 25.175
495 HB2 SER 107 1HB SER 107 2.913 9.025 23.278
496 HB3 SER 107 2HB SER 107 1.536 8.236 24.033
497 HG SER 107 HG SER 107 2.012 9.814 25.800
498 H GLN 108 H GLN 108 4.344 8.914 27.265
499 HA GLN 108 HA GLN 108 2.391 7.539 29.002
500 HB2 GLN 108 1HB GLN 108 4.837 9.229 29.660
501 HB3 GLN 108 2HB GLN 108 3.814 8.447 30.856
502 HG2 GLN 108 1HG GLN 108 5.342 6.989 28.691
503 HG3 GLN 108 2HG GLN 108 5.890 7.209 30.374
504 HE21 GLN 108 1HE2 GLN 108 3.976 3.931 29.631
505 HE22 GLN 108 2HE2 GLN 108 5.085 4.809 28.631
506 HA PRO 109 HA PRO 109 -0.084 11.043 29.561
507 HB2 PRO 109 1HB PRO 109 -1.242 10.536 31.987
508 HB3 PRO 109 2HB PRO 109 -1.590 9.546 30.565
509 HG2 PRO 109 1HG PRO 109 0.386 9.014 32.826
510 HG3 PRO 109 2HG PRO 109 -0.818 7.916 32.148
511 HD2 PRO 109 1HD PRO 109 1.793 7.840 31.351
512 HD3 PRO 109 2HD PRO 109 0.439 7.488 30.203
513 H GLY 110 H GLY 110 2.169 12.166 29.766
514 HA2 GLY 110 1HA GLY 110 2.766 14.271 30.812
515 HA3 GLY 110 2HA GLY 110 2.139 13.676 32.338
516 H GLY 111 H GLY 111 3.642 11.043 31.196
517 HA2 GLY 111 1HA GLY 111 6.089 11.620 32.781
518 HA3 GLY 111 2HA GLY 111 5.479 10.030 32.359
519 H LYS 112 H LYS 112 7.810 9.743 31.778
520 HA LYS 112 HA LYS 112 8.647 11.032 29.262
521 HB2 LYS 112 1HB LYS 112 10.276 10.652 31.117
522 HB3 LYS 112 2HB LYS 112 10.043 8.919 30.952
523 HG2 LYS 112 1HG LYS 112 10.965 8.974 28.689
524 HG3 LYS 112 2HG LYS 112 11.129 10.734 28.780
525 HD2 LYS 112 1HD LYS 112 12.693 10.495 30.678
526 HD3 LYS 112 2HD LYS 112 12.520 8.733 30.602
527 HE2 LYS 112 1HE LYS 112 13.433 8.741 28.305
528 HE3 LYS 112 2HE LYS 112 13.602 10.497 28.372
529 HZ1 LYS 112 1HZ LYS 112 15.657 9.394 28.868
530 HZ2 LYS 112 2HZ LYS 112 15.136 10.220 30.197
531 HZ3 LYS 112 3HZ LYS 112 14.981 8.581 30.132
532 HA PRO 113 HA PRO 113 6.903 7.788 26.925
533 HB2 PRO 113 1HB PRO 113 7.716 8.616 24.439
534 HB3 PRO 113 2HB PRO 113 6.453 9.461 25.343
535 HG2 PRO 113 1HG PRO 113 9.424 10.121 25.138
536 HG3 PRO 113 2HG PRO 113 8.045 11.208 24.935
537 HD2 PRO 113 1HD PRO 113 9.388 11.052 27.300
538 HD3 PRO 113 2HD PRO 113 7.601 11.323 27.247
539 H GLN 114 H GLN 114 7.594 6.006 25.541
540 HA GLN 114 HA GLN 114 10.547 5.575 25.497
541 HB2 GLN 114 1HB GLN 114 9.657 4.248 27.342
542 HB3 GLN 114 2HB GLN 114 8.396 3.582 26.312
543 HG2 GLN 114 1HG GLN 114 10.085 1.929 26.592
544 HG3 GLN 114 2HG GLN 114 10.181 2.524 24.912
545 HE21 GLN 114 1HE2 GLN 114 13.543 3.292 25.144
546 HE22 GLN 114 2HE2 GLN 114 12.166 2.854 24.186
547 H LEU 115 H LEU 115 11.249 5.367 23.513
548 HA LEU 115 HA LEU 115 9.390 4.634 21.358
549 HB2 LEU 115 1HB LEU 115 11.045 6.459 21.070
550 HB3 LEU 115 2HB LEU 115 12.357 5.297 21.288
551 HG LEU 115 HG LEU 115 11.552 4.104 19.222
552 HD11 LEU 115 1HD1 LEU 115 10.009 5.310 17.740
553 HD12 LEU 115 2HD1 LEU 115 9.234 4.870 19.280
554 HD13 LEU 115 3HD1 LEU 115 9.766 6.544 18.998
555 HD21 LEU 115 1HD2 LEU 115 12.468 5.811 17.685
556 HD22 LEU 115 2HD2 LEU 115 12.262 7.053 18.943
557 HD23 LEU 115 3HD2 LEU 115 13.420 5.724 19.188
558 H VAL 116 H VAL 116 9.149 2.699 20.493
559 HA VAL 116 HA VAL 116 11.273 0.663 21.022
560 HB VAL 116 HB VAL 116 8.256 0.225 20.950
561 HG11 VAL 116 1HG1 VAL 116 8.777 -2.083 21.572
562 HG12 VAL 116 2HG1 VAL 116 9.456 -1.650 19.984
563 HG13 VAL 116 3HG1 VAL 116 10.515 -1.731 21.413
564 HG21 VAL 116 1HG2 VAL 116 8.545 -0.355 23.339
565 HG22 VAL 116 2HG2 VAL 116 10.273 0.056 23.228
566 HG23 VAL 116 3HG2 VAL 116 9.041 1.322 23.020
567 H ALA 117 H ALA 117 12.119 -0.236 19.277
568 HA ALA 117 HA ALA 117 11.027 0.401 16.651
569 HB1 ALA 117 1HB ALA 117 12.987 -0.846 15.802
570 HB2 ALA 117 2HB ALA 117 13.454 0.369 17.018
571 HB3 ALA 117 3HB ALA 117 13.374 -1.350 17.464
572 H GLU 118 H GLU 118 8.939 -0.658 17.090
573 HA GLU 118 HA GLU 118 8.791 -3.516 17.367
574 HB2 GLU 118 1HB GLU 118 6.944 -1.940 17.970
575 HB3 GLU 118 2HB GLU 118 6.714 -1.580 16.266
576 HG2 GLU 118 1HG GLU 118 6.077 -3.883 15.821
577 HG3 GLU 118 2HG GLU 118 6.406 -4.326 17.494
578 HA PRO 119 HA PRO 119 9.918 -4.826 13.339
579 HB2 PRO 119 1HB PRO 119 7.983 -7.054 14.098
580 HB3 PRO 119 2HB PRO 119 9.593 -7.181 13.376
581 HG2 PRO 119 1HG PRO 119 9.350 -7.663 15.978
582 HG3 PRO 119 2HG PRO 119 10.704 -6.672 15.424
583 HD2 PRO 119 1HD PRO 119 8.076 -5.795 16.675
584 HD3 PRO 119 2HD PRO 119 9.748 -5.174 16.979
Start of MODEL 7
1 H GLN 38 1H GLN 38 1.334 -2.956 3.829
2 HA GLN 38 HA GLN 38 2.943 -2.009 5.280
3 HB2 GLN 38 1HB GLN 38 3.637 -1.809 2.320
4 HB3 GLN 38 2HB GLN 38 4.803 -1.902 3.633
5 HG2 GLN 38 1HG GLN 38 2.767 -4.038 2.972
6 HG3 GLN 38 2HG GLN 38 4.486 -4.049 2.491
7 HE21 GLN 38 1HE2 GLN 38 3.441 -5.697 5.927
8 HE22 GLN 38 2HE2 GLN 38 2.403 -5.419 4.568
9 H ALA 39 H ALA 39 4.717 -0.327 5.303
10 HA ALA 39 HA ALA 39 3.496 2.286 5.379
11 HB1 ALA 39 1HB ALA 39 5.755 3.063 6.022
12 HB2 ALA 39 2HB ALA 39 5.256 1.635 6.961
13 HB3 ALA 39 3HB ALA 39 6.413 1.460 5.621
14 HA PRO 40 HA PRO 40 4.070 3.784 1.351
15 HB2 PRO 40 1HB PRO 40 4.938 6.343 2.744
16 HB3 PRO 40 2HB PRO 40 3.731 6.123 1.470
17 HG2 PRO 40 1HG PRO 40 2.877 6.474 3.964
18 HG3 PRO 40 2HG PRO 40 2.104 5.241 2.964
19 HD2 PRO 40 1HD PRO 40 4.236 4.903 5.116
20 HD3 PRO 40 2HD PRO 40 2.748 3.914 4.820
21 H LYS 41 H LYS 41 5.738 3.980 -0.110
22 HA LYS 41 HA LYS 41 8.339 3.184 0.768
23 HB2 LYS 41 1HB LYS 41 7.391 2.658 -1.477
24 HB3 LYS 41 2HB LYS 41 7.498 4.356 -1.915
25 HG2 LYS 41 1HG LYS 41 9.938 4.285 -1.718
26 HG3 LYS 41 2HG LYS 41 9.860 2.595 -1.201
27 HD2 LYS 41 1HD LYS 41 8.819 1.982 -3.362
28 HD3 LYS 41 2HD LYS 41 8.900 3.673 -3.879
29 HE2 LYS 41 1HE LYS 41 11.365 3.618 -3.678
30 HE3 LYS 41 2HE LYS 41 11.287 1.931 -3.161
31 HZ1 LYS 41 1HZ LYS 41 11.777 2.118 -5.487
32 HZ2 LYS 41 2HZ LYS 41 10.313 1.385 -5.284
33 HZ3 LYS 41 3HZ LYS 41 10.387 2.961 -5.766
34 H GLY 42 H GLY 42 9.907 4.308 1.636
35 HA2 GLY 42 1HA GLY 42 11.558 6.003 1.625
36 HA3 GLY 42 2HA GLY 42 10.570 6.962 0.538
37 H SER 43 H SER 43 8.634 5.771 3.014
38 HA SER 43 HA SER 43 8.956 8.314 4.557
39 HB2 SER 43 1HB SER 43 6.433 6.724 3.983
40 HB3 SER 43 2HB SER 43 6.521 8.133 5.030
41 HG SER 43 HG SER 43 7.202 8.022 2.300
42 H ALA 44 H ALA 44 8.302 8.236 6.808
43 HA ALA 44 HA ALA 44 9.036 5.634 8.017
44 HB1 ALA 44 1HB ALA 44 9.272 6.930 10.111
45 HB2 ALA 44 2HB ALA 44 10.255 7.617 8.795
46 HB3 ALA 44 3HB ALA 44 8.723 8.392 9.258
47 H PHE 45 H PHE 45 7.791 4.534 9.484
48 HA PHE 45 HA PHE 45 4.964 5.483 9.718
49 HB2 PHE 45 1HB PHE 45 5.016 3.423 8.461
50 HB3 PHE 45 2HB PHE 45 6.109 2.670 9.611
51 HD1 PHE 45 HD1 PHE 45 2.670 3.440 8.808
52 HD2 PHE 45 HD2 PHE 45 5.291 2.072 11.893
53 HE1 PHE 45 HE1 PHE 45 0.733 2.525 10.048
54 HE2 PHE 45 HE2 PHE 45 3.358 1.155 13.132
55 HZ PHE 45 HZ PHE 45 1.079 1.383 12.211
56 H VAL 46 H VAL 46 4.191 5.901 11.667
57 HA VAL 46 HA VAL 46 5.588 4.692 14.014
58 HB VAL 46 HB VAL 46 4.488 7.525 13.770
59 HG11 VAL 46 1HG1 VAL 46 5.277 7.836 16.064
60 HG12 VAL 46 2HG1 VAL 46 4.001 6.599 15.961
61 HG13 VAL 46 3HG1 VAL 46 5.704 6.110 16.153
62 HG21 VAL 46 1HG2 VAL 46 6.841 8.174 14.169
63 HG22 VAL 46 2HG2 VAL 46 7.309 6.454 14.191
64 HG23 VAL 46 3HG2 VAL 46 6.687 7.189 12.694
65 H ARG 47 H ARG 47 4.319 3.618 15.376
66 HA ARG 47 HA ARG 47 1.388 4.201 15.293
67 HB2 ARG 47 1HB ARG 47 1.791 1.933 14.589
68 HB3 ARG 47 2HB ARG 47 2.878 1.641 15.938
69 HG2 ARG 47 1HG ARG 47 1.031 1.766 17.514
70 HG3 ARG 47 2HG ARG 47 -0.091 2.178 16.196
71 HD2 ARG 47 1HD ARG 47 1.545 -0.337 16.223
72 HD3 ARG 47 2HD ARG 47 -0.067 -0.214 16.959
73 HE ARG 47 HE ARG 47 -0.445 0.751 14.430
74 HH11 ARG 47 1HH1 ARG 47 0.935 -2.205 15.733
75 HH12 ARG 47 2HH1 ARG 47 0.466 -3.180 14.357
76 HH21 ARG 47 1HH2 ARG 47 -1.049 -0.522 12.650
77 HH22 ARG 47 2HH2 ARG 47 -0.658 -2.228 12.613
78 H ALA 48 H ALA 48 0.973 5.586 16.892
79 HA ALA 48 HA ALA 48 2.492 5.507 19.382
80 HB1 ALA 48 1HB ALA 48 1.044 7.405 20.038
81 HB2 ALA 48 2HB ALA 48 1.773 7.653 18.433
82 HB3 ALA 48 3HB ALA 48 0.071 7.158 18.570
83 H TYR 49 H TYR 49 1.760 5.029 21.431
84 HA TYR 49 HA TYR 49 -0.945 3.818 21.646
85 HB2 TYR 49 1HB TYR 49 0.563 1.922 21.285
86 HB3 TYR 49 2HB TYR 49 1.642 2.496 22.550
87 HD1 TYR 49 HD1 TYR 49 -1.830 1.283 21.948
88 HD2 TYR 49 HD2 TYR 49 1.344 1.851 24.776
89 HE1 TYR 49 HE1 TYR 49 -3.082 -0.039 23.619
90 HE2 TYR 49 HE2 TYR 49 0.093 0.528 26.447
91 HH TYR 49 HH TYR 49 -3.111 -0.820 25.700
92 H ASN 50 H ASN 50 -2.013 4.303 23.445
93 HA ASN 50 HA ASN 50 -0.575 6.027 25.397
94 HB2 ASN 50 1HB ASN 50 -2.604 6.930 24.257
95 HB3 ASN 50 2HB ASN 50 -3.558 5.643 24.983
96 HD21 ASN 50 1HD2 ASN 50 -3.651 8.838 26.991
97 HD22 ASN 50 2HD2 ASN 50 -3.821 8.512 25.298
98 H ALA 51 H ALA 51 0.273 4.959 27.023
99 HA ALA 51 HA ALA 51 -1.103 2.507 27.964
100 HB1 ALA 51 1HB ALA 51 1.030 2.023 29.118
101 HB2 ALA 51 2HB ALA 51 1.271 2.298 27.377
102 HB3 ALA 51 3HB ALA 51 1.683 3.575 28.543
103 H GLY 52 H GLY 52 -1.960 5.307 28.587
104 HA2 GLY 52 1HA GLY 52 -1.830 5.064 31.572
105 HA3 GLY 52 2HA GLY 52 -1.767 6.614 30.758
106 H ASN 53 H ASN 53 -3.648 7.050 32.178
107 HA ASN 53 HA ASN 53 -6.168 5.954 30.996
108 HB2 ASN 53 1HB ASN 53 -5.592 6.909 33.817
109 HB3 ASN 53 2HB ASN 53 -7.206 6.567 33.209
110 HD21 ASN 53 1HD2 ASN 53 -4.967 3.627 34.661
111 HD22 ASN 53 2HD2 ASN 53 -4.647 5.317 34.865
112 H SER 54 H SER 54 -4.539 8.237 30.083
113 HA SER 54 HA SER 54 -6.750 10.199 30.057
114 HB2 SER 54 1HB SER 54 -5.346 10.937 31.921
115 HB3 SER 54 2HB SER 54 -3.916 10.881 30.904
116 HG SER 54 HG SER 54 -4.942 12.416 29.561
117 H GLU 55 H GLU 55 -7.058 11.029 28.109
118 HA GLU 55 HA GLU 55 -5.573 10.133 25.859
119 HB2 GLU 55 1HB GLU 55 -7.937 10.963 25.799
120 HB3 GLU 55 2HB GLU 55 -7.350 12.597 26.072
121 HG2 GLU 55 1HG GLU 55 -6.131 12.547 23.958
122 HG3 GLU 55 2HG GLU 55 -6.631 10.877 23.687
123 H LEU 56 H LEU 56 -3.860 10.864 24.775
124 HA LEU 56 HA LEU 56 -2.527 13.279 25.926
125 HB2 LEU 56 1HB LEU 56 -1.271 10.761 24.774
126 HB3 LEU 56 2HB LEU 56 -0.385 12.175 25.356
127 HG LEU 56 HG LEU 56 -2.133 10.382 27.076
128 HD11 LEU 56 1HD1 LEU 56 -0.001 9.579 27.986
129 HD12 LEU 56 2HD1 LEU 56 -0.152 9.221 26.249
130 HD13 LEU 56 3HD1 LEU 56 0.879 10.565 26.796
131 HD21 LEU 56 1HD2 LEU 56 -1.086 11.634 28.932
132 HD22 LEU 56 2HD2 LEU 56 -0.220 12.652 27.756
133 HD23 LEU 56 3HD2 LEU 56 -1.996 12.724 27.859
134 H ASP 57 H ASP 57 -1.427 14.673 24.568
135 HA ASP 57 HA ASP 57 -2.438 14.651 21.796
136 HB2 ASP 57 1HB ASP 57 -2.577 16.734 23.133
137 HB3 ASP 57 2HB ASP 57 -0.828 16.741 23.319
138 H VAL 58 H VAL 58 -1.343 13.626 20.286
139 HA VAL 58 HA VAL 58 1.558 13.173 20.706
140 HB VAL 58 HB VAL 58 -0.400 11.932 18.723
141 HG11 VAL 58 1HG1 VAL 58 1.382 10.319 18.268
142 HG12 VAL 58 2HG1 VAL 58 1.855 11.976 17.825
143 HG13 VAL 58 3HG1 VAL 58 2.483 11.240 19.319
144 HG21 VAL 58 1HG2 VAL 58 -0.173 9.932 20.162
145 HG22 VAL 58 2HG2 VAL 58 0.876 10.848 21.269
146 HG23 VAL 58 3HG2 VAL 58 -0.833 11.308 21.074
147 H SER 59 H SER 59 3.101 14.080 19.503
148 HA SER 59 HA SER 59 2.548 14.848 16.734
149 HB2 SER 59 1HB SER 59 3.164 17.162 16.937
150 HB3 SER 59 2HB SER 59 1.845 16.852 18.055
151 HG SER 59 HG SER 59 3.373 16.629 19.694
152 H VAL 60 H VAL 60 4.542 15.689 15.650
153 HA VAL 60 HA VAL 60 7.064 14.989 17.015
154 HB VAL 60 HB VAL 60 6.296 12.854 15.994
155 HG11 VAL 60 1HG1 VAL 60 6.154 12.639 13.561
156 HG12 VAL 60 2HG1 VAL 60 4.932 13.763 14.203
157 HG13 VAL 60 3HG1 VAL 60 6.388 14.394 13.394
158 HG21 VAL 60 1HG2 VAL 60 8.350 12.407 14.690
159 HG22 VAL 60 2HG2 VAL 60 8.648 14.158 14.564
160 HG23 VAL 60 3HG2 VAL 60 8.709 13.356 16.151
161 H GLY 61 H GLY 61 8.646 16.335 16.469
162 HA2 GLY 61 1HA GLY 61 9.836 17.966 15.323
163 HA3 GLY 61 2HA GLY 61 9.087 17.388 13.848
164 H SER 62 H SER 62 7.858 18.816 12.800
165 HA SER 62 HA SER 62 6.463 20.912 14.415
166 HB2 SER 62 1HB SER 62 6.485 22.292 12.394
167 HB3 SER 62 2HB SER 62 8.118 21.834 12.858
168 HG SER 62 HG SER 62 6.814 20.101 11.180
169 H THR 63 H THR 63 5.828 18.020 13.278
170 HA THR 63 HA THR 63 3.336 18.742 11.822
171 HB THR 63 HB THR 63 4.742 16.054 12.151
172 HG1 THR 63 HG1 THR 63 4.431 17.804 9.909
173 HG21 THR 63 1HG2 THR 63 3.105 15.245 10.496
174 HG22 THR 63 2HG2 THR 63 2.289 15.806 11.976
175 HG23 THR 63 3HG2 THR 63 2.292 16.826 10.520
176 H SER 64 H SER 64 1.545 18.934 12.937
177 HA SER 64 HA SER 64 1.220 17.688 15.555
178 HB2 SER 64 1HB SER 64 0.210 19.853 15.136
179 HB3 SER 64 2HB SER 64 -0.675 19.226 13.754
180 HG SER 64 HG SER 64 -1.301 17.629 15.628
181 H LEU 65 H LEU 65 0.493 15.738 15.988
182 HA LEU 65 HA LEU 65 -0.783 14.213 13.763
183 HB2 LEU 65 1HB LEU 65 0.622 13.202 16.261
184 HB3 LEU 65 2HB LEU 65 -0.057 12.197 14.980
185 HG LEU 65 HG LEU 65 2.267 14.129 14.648
186 HD11 LEU 65 1HD1 LEU 65 3.618 12.086 14.481
187 HD12 LEU 65 2HD1 LEU 65 2.823 12.221 16.067
188 HD13 LEU 65 3HD1 LEU 65 2.177 11.105 14.841
189 HD21 LEU 65 1HD2 LEU 65 2.492 13.032 12.445
190 HD22 LEU 65 2HD2 LEU 65 1.037 12.063 12.778
191 HD23 LEU 65 3HD2 LEU 65 0.909 13.830 12.602
192 H ASN 66 H ASN 66 -2.193 12.340 14.671
193 HA ASN 66 HA ASN 66 -4.432 13.667 15.953
194 HB2 ASN 66 1HB ASN 66 -3.993 10.782 15.119
195 HB3 ASN 66 2HB ASN 66 -5.505 11.405 15.763
196 HD21 ASN 66 1HD2 ASN 66 -5.286 11.446 11.960
197 HD22 ASN 66 2HD2 ASN 66 -4.778 10.264 13.120
198 H ASP 67 H ASP 67 -5.361 13.337 17.918
199 HA ASP 67 HA ASP 67 -3.587 12.587 20.068
200 HB2 ASP 67 1HB ASP 67 -6.575 13.164 20.020
201 HB3 ASP 67 2HB ASP 67 -5.651 12.889 21.490
202 H VAL 68 H VAL 68 -3.803 10.900 21.573
203 HA VAL 68 HA VAL 68 -5.155 8.494 20.422
204 HB VAL 68 HB VAL 68 -2.592 8.634 22.070
205 HG11 VAL 68 1HG1 VAL 68 -2.415 6.235 21.623
206 HG12 VAL 68 2HG1 VAL 68 -3.872 6.633 22.565
207 HG13 VAL 68 3HG1 VAL 68 -4.006 6.267 20.827
208 HG21 VAL 68 1HG2 VAL 68 -1.511 7.862 19.983
209 HG22 VAL 68 2HG2 VAL 68 -3.077 7.950 19.141
210 HG23 VAL 68 3HG2 VAL 68 -2.310 9.435 19.751
211 H ALA 69 H ALA 69 -6.708 7.636 21.607
212 HA ALA 69 HA ALA 69 -7.314 8.721 24.219
213 HB1 ALA 69 1HB ALA 69 -9.199 7.120 24.184
214 HB2 ALA 69 2HB ALA 69 -9.093 8.047 22.668
215 HB3 ALA 69 3HB ALA 69 -8.519 6.365 22.723
216 HA PRO 70 HA PRO 70 -5.364 6.158 27.079
217 HB2 PRO 70 1HB PRO 70 -8.140 5.403 28.082
218 HB3 PRO 70 2HB PRO 70 -6.728 5.920 29.013
219 HG2 PRO 70 1HG PRO 70 -8.643 7.703 28.548
220 HG3 PRO 70 2HG PRO 70 -6.958 8.201 28.360
221 HD2 PRO 70 1HD PRO 70 -8.982 7.432 26.225
222 HD3 PRO 70 2HD PRO 70 -7.758 8.765 26.211
223 H LEU 71 H LEU 71 -4.483 4.225 26.660
224 HA LEU 71 HA LEU 71 -4.257 1.986 26.172
225 HB2 LEU 71 1HB LEU 71 -7.246 1.818 26.693
226 HB3 LEU 71 2HB LEU 71 -6.107 0.467 26.658
227 HG LEU 71 HG LEU 71 -6.178 2.700 28.719
228 HD11 LEU 71 1HD1 LEU 71 -6.860 0.897 30.238
229 HD12 LEU 71 2HD1 LEU 71 -8.024 1.113 28.911
230 HD13 LEU 71 3HD1 LEU 71 -6.876 -0.246 28.877
231 HD21 LEU 71 1HD2 LEU 71 -4.425 1.371 29.847
232 HD22 LEU 71 2HD2 LEU 71 -4.406 0.232 28.479
233 HD23 LEU 71 3HD2 LEU 71 -3.880 1.915 28.242
234 H GLY 72 H GLY 72 -5.234 4.086 24.177
235 HA2 GLY 72 1HA GLY 72 -6.180 2.156 22.089
236 HA3 GLY 72 2HA GLY 72 -6.461 3.885 22.040
237 H SER 73 H SER 73 -5.487 3.366 19.818
238 HA SER 73 HA SER 73 -2.659 4.171 19.903
239 HB2 SER 73 1HB SER 73 -1.860 2.376 18.503
240 HB3 SER 73 2HB SER 73 -2.589 1.687 19.946
241 HG SER 73 HG SER 73 -3.558 1.805 17.332
242 H SER 74 H SER 74 -1.818 4.699 17.731
243 HA SER 74 HA SER 74 -3.869 5.139 15.657
244 HB2 SER 74 1HB SER 74 -4.053 7.142 17.069
245 HB3 SER 74 2HB SER 74 -2.324 7.418 16.936
246 HG SER 74 HG SER 74 -2.796 7.341 14.581
247 H ASP 75 H ASP 75 -3.044 4.658 13.758
248 HA ASP 75 HA ASP 75 -0.139 4.388 13.457
249 HB2 ASP 75 1HB ASP 75 -2.471 3.852 11.577
250 HB3 ASP 75 2HB ASP 75 -0.787 3.622 11.121
251 H PHE 76 H PHE 76 1.209 5.626 12.282
252 HA PHE 76 HA PHE 76 0.014 7.998 10.914
253 HB2 PHE 76 1HB PHE 76 2.539 7.969 12.617
254 HB3 PHE 76 2HB PHE 76 1.918 9.350 11.728
255 HD1 PHE 76 HD1 PHE 76 2.124 7.938 14.868
256 HD2 PHE 76 HD2 PHE 76 -0.701 9.825 12.280
257 HE1 PHE 76 HE1 PHE 76 0.765 8.586 16.829
258 HE2 PHE 76 HE2 PHE 76 -2.063 10.478 14.238
259 HZ PHE 76 HZ PHE 76 -1.329 9.856 16.513
260 H LYS 77 H LYS 77 0.480 8.030 8.845
261 HA LYS 77 HA LYS 77 2.985 6.665 7.955
262 HB2 LYS 77 1HB LYS 77 0.332 7.019 6.506
263 HB3 LYS 77 2HB LYS 77 1.786 6.364 5.762
264 HG2 LYS 77 1HG LYS 77 1.772 4.485 7.345
265 HG3 LYS 77 2HG LYS 77 0.335 5.152 8.134
266 HD2 LYS 77 1HD LYS 77 -0.919 4.956 6.004
267 HD3 LYS 77 2HD LYS 77 0.516 4.273 5.228
268 HE2 LYS 77 1HE LYS 77 0.481 2.373 6.786
269 HE3 LYS 77 2HE LYS 77 -0.912 3.062 7.624
270 HZ1 LYS 77 1HZ LYS 77 -1.565 1.383 6.060
271 HZ2 LYS 77 2HZ LYS 77 -2.167 2.847 5.590
272 HZ3 LYS 77 3HZ LYS 77 -0.866 2.200 4.808
273 H PHE 78 H PHE 78 3.859 7.483 5.860
274 HA PHE 78 HA PHE 78 4.650 9.173 4.514
275 HB2 PHE 78 1HB PHE 78 2.112 10.632 5.359
276 HB3 PHE 78 2HB PHE 78 3.160 11.093 4.028
277 HD1 PHE 78 HD1 PHE 78 0.409 9.047 5.068
278 HD2 PHE 78 HD2 PHE 78 3.441 9.472 2.089
279 HE1 PHE 78 HE1 PHE 78 -0.881 7.584 3.548
280 HE2 PHE 78 HE2 PHE 78 2.154 8.012 0.566
281 HZ PHE 78 HZ PHE 78 -0.008 7.066 1.298
282 H LEU 79 H LEU 79 5.379 9.024 7.331
283 HA LEU 79 HA LEU 79 5.662 11.825 8.181
284 HB2 LEU 79 1HB LEU 79 6.686 9.222 9.369
285 HB3 LEU 79 2HB LEU 79 6.903 10.813 10.106
286 HG LEU 79 HG LEU 79 4.234 9.447 9.611
287 HD11 LEU 79 1HD1 LEU 79 4.191 9.218 12.055
288 HD12 LEU 79 2HD1 LEU 79 5.567 8.346 11.338
289 HD13 LEU 79 3HD1 LEU 79 5.828 9.911 12.149
290 HD21 LEU 79 1HD2 LEU 79 3.341 11.312 10.963
291 HD22 LEU 79 2HD2 LEU 79 4.965 12.035 11.041
292 HD23 LEU 79 3HD2 LEU 79 4.120 11.911 9.480
293 HA PRO 80 HA PRO 80 9.354 12.470 5.899
294 HB2 PRO 80 1HB PRO 80 9.719 14.551 8.088
295 HB3 PRO 80 2HB PRO 80 9.906 14.736 6.340
296 HG2 PRO 80 1HG PRO 80 7.679 15.653 7.467
297 HG3 PRO 80 2HG PRO 80 7.556 14.759 5.950
298 HD2 PRO 80 1HD PRO 80 7.046 13.794 8.792
299 HD3 PRO 80 2HD PRO 80 6.091 13.470 7.289
300 HA PRO 81 HA PRO 81 11.946 10.002 8.632
301 HB2 PRO 81 1HB PRO 81 13.711 10.227 6.184
302 HB3 PRO 81 2HB PRO 81 13.260 8.786 7.104
303 HG2 PRO 81 1HG PRO 81 12.082 9.216 4.752
304 HG3 PRO 81 2HG PRO 81 11.107 8.652 6.111
305 HD2 PRO 81 1HD PRO 81 11.433 11.491 5.040
306 HD3 PRO 81 2HD PRO 81 9.917 10.619 5.500
307 H GLY 82 H GLY 82 13.790 10.498 9.831
308 HA2 GLY 82 1HA GLY 82 15.988 11.937 9.508
309 HA3 GLY 82 2HA GLY 82 14.842 13.264 9.488
310 H SER 83 H SER 83 16.054 14.000 11.388
311 HA SER 83 HA SER 83 15.408 12.481 13.870
312 HB2 SER 83 1HB SER 83 17.764 13.007 13.588
313 HB3 SER 83 2HB SER 83 17.397 14.704 13.319
314 HG SER 83 HG SER 83 16.238 13.913 15.559
315 H TYR 84 H TYR 84 13.564 13.045 14.779
316 HA TYR 84 HA TYR 84 12.949 15.955 14.996
317 HB2 TYR 84 1HB TYR 84 10.978 13.767 14.209
318 HB3 TYR 84 2HB TYR 84 10.543 15.429 14.581
319 HD1 TYR 84 HD1 TYR 84 11.992 13.167 12.115
320 HD2 TYR 84 HD2 TYR 84 11.182 17.269 13.075
321 HE1 TYR 84 HE1 TYR 84 12.363 13.794 9.752
322 HE2 TYR 84 HE2 TYR 84 11.555 17.896 10.713
323 HH TYR 84 HH TYR 84 12.402 15.450 8.273
324 H THR 85 H THR 85 11.577 16.548 16.737
325 HA THR 85 HA THR 85 11.936 14.767 19.060
326 HB THR 85 HB THR 85 10.847 17.611 18.877
327 HG1 THR 85 HG1 THR 85 13.070 17.625 20.172
328 HG21 THR 85 1HG2 THR 85 11.130 17.627 21.323
329 HG22 THR 85 2HG2 THR 85 9.964 16.377 20.827
330 HG23 THR 85 3HG2 THR 85 11.621 15.918 21.284
331 H ALA 86 H ALA 86 10.471 13.348 19.628
332 HA ALA 86 HA ALA 86 7.702 13.683 18.644
333 HB1 ALA 86 1HB ALA 86 7.408 11.339 19.373
334 HB2 ALA 86 2HB ALA 86 8.793 11.515 18.270
335 HB3 ALA 86 3HB ALA 86 9.064 11.338 20.021
336 H GLN 87 H GLN 87 6.292 14.711 19.842
337 HA GLN 87 HA GLN 87 6.600 14.575 22.806
338 HB2 GLN 87 1HB GLN 87 6.715 16.853 21.857
339 HB3 GLN 87 2HB GLN 87 5.157 16.625 21.076
340 HG2 GLN 87 1HG GLN 87 4.057 16.445 23.242
341 HG3 GLN 87 2HG GLN 87 5.636 16.609 24.063
342 HE21 GLN 87 1HE2 GLN 87 3.875 19.906 24.019
343 HE22 GLN 87 2HE2 GLN 87 3.483 18.318 24.590
344 H VAL 88 H VAL 88 5.141 13.575 24.003
345 HA VAL 88 HA VAL 88 2.389 13.298 22.885
346 HB VAL 88 HB VAL 88 3.872 11.198 24.524
347 HG11 VAL 88 1HG1 VAL 88 1.913 9.797 24.087
348 HG12 VAL 88 2HG1 VAL 88 1.495 11.257 25.014
349 HG13 VAL 88 3HG1 VAL 88 1.116 11.165 23.277
350 HG21 VAL 88 1HG2 VAL 88 3.777 9.854 22.449
351 HG22 VAL 88 2HG2 VAL 88 3.039 11.230 21.594
352 HG23 VAL 88 3HG2 VAL 88 4.708 11.350 22.205
353 H GLY 89 H GLY 89 1.205 14.659 24.056
354 HA2 GLY 89 1HA GLY 89 0.129 15.478 25.979
355 HA3 GLY 89 2HA GLY 89 1.106 14.414 26.973
356 H GLN 90 H GLN 90 2.838 15.223 28.040
357 HA GLN 90 HA GLN 90 3.471 18.096 27.516
358 HB2 GLN 90 1HB GLN 90 3.582 16.544 30.135
359 HB3 GLN 90 2HB GLN 90 4.069 18.220 29.932
360 HG2 GLN 90 1HG GLN 90 1.280 17.149 29.458
361 HG3 GLN 90 2HG GLN 90 1.842 18.000 30.923
362 HE21 GLN 90 1HE2 GLN 90 0.259 20.128 28.023
363 HE22 GLN 90 2HE2 GLN 90 -0.041 18.459 28.379
364 H GLN 91 H GLN 91 4.716 14.881 27.828
365 HA GLN 91 HA GLN 91 7.501 15.904 28.008
366 HB2 GLN 91 1HB GLN 91 6.420 13.064 28.215
367 HB3 GLN 91 2HB GLN 91 8.104 13.525 28.406
368 HG2 GLN 91 1HG GLN 91 5.829 14.447 30.173
369 HG3 GLN 91 2HG GLN 91 7.003 13.156 30.550
370 HE21 GLN 91 1HE2 GLN 91 7.815 16.848 31.673
371 HE22 GLN 91 2HE2 GLN 91 6.247 16.184 31.362
372 H SER 92 H SER 92 9.139 15.133 26.593
373 HA SER 92 HA SER 92 8.264 13.921 24.055
374 HB2 SER 92 1HB SER 92 9.015 15.739 22.665
375 HB3 SER 92 2HB SER 92 7.825 16.363 23.793
376 HG SER 92 HG SER 92 9.306 17.740 24.171
377 H LEU 93 H LEU 93 9.911 13.004 22.870
378 HA LEU 93 HA LEU 93 12.695 13.541 23.731
379 HB2 LEU 93 1HB LEU 93 11.386 10.806 23.641
380 HB3 LEU 93 2HB LEU 93 13.137 11.037 23.612
381 HG LEU 93 HG LEU 93 11.320 11.963 25.864
382 HD11 LEU 93 1HD1 LEU 93 12.244 10.054 27.099
383 HD12 LEU 93 2HD1 LEU 93 11.330 9.531 25.666
384 HD13 LEU 93 3HD1 LEU 93 13.109 9.525 25.635
385 HD21 LEU 93 1HD2 LEU 93 13.465 12.247 27.061
386 HD22 LEU 93 2HD2 LEU 93 14.349 11.750 25.596
387 HD23 LEU 93 3HD2 LEU 93 13.407 13.263 25.598
388 HA PRO 94 HA PRO 94 13.442 13.612 19.409
389 HB2 PRO 94 1HB PRO 94 16.123 12.472 20.261
390 HB3 PRO 94 2HB PRO 94 15.785 13.849 19.207
391 HG2 PRO 94 1HG PRO 94 16.558 14.338 21.706
392 HG3 PRO 94 2HG PRO 94 15.234 15.287 21.022
393 HD2 PRO 94 1HD PRO 94 15.103 12.884 22.896
394 HD3 PRO 94 2HD PRO 94 14.177 14.438 22.970
395 H VAL 95 H VAL 95 13.109 12.136 17.819
396 HA VAL 95 HA VAL 95 13.778 9.283 18.396
397 HB VAL 95 HB VAL 95 11.753 8.623 17.125
398 HG11 VAL 95 1HG1 VAL 95 10.095 9.227 18.818
399 HG12 VAL 95 2HG1 VAL 95 11.647 8.751 19.546
400 HG13 VAL 95 3HG1 VAL 95 11.197 10.470 19.454
401 HG21 VAL 95 1HG2 VAL 95 10.046 10.339 16.601
402 HG22 VAL 95 2HG2 VAL 95 11.154 11.611 17.165
403 HG23 VAL 95 3HG2 VAL 95 11.563 10.650 15.724
404 H LYS 96 H LYS 96 14.422 8.013 16.642
405 HA LYS 96 HA LYS 96 15.324 9.582 14.283
406 HB2 LYS 96 1HB LYS 96 17.043 8.278 15.517
407 HB3 LYS 96 2HB LYS 96 16.134 6.802 15.222
408 HG2 LYS 96 1HG LYS 96 16.475 7.058 12.799
409 HG3 LYS 96 2HG LYS 96 17.366 8.561 13.080
410 HD2 LYS 96 1HD LYS 96 19.040 7.321 14.417
411 HD3 LYS 96 2HD LYS 96 18.151 5.817 14.131
412 HE2 LYS 96 1HE LYS 96 18.503 6.075 11.693
413 HE3 LYS 96 2HE LYS 96 19.400 7.569 11.981
414 HZ1 LYS 96 1HZ LYS 96 20.860 5.705 11.700
415 HZ2 LYS 96 2HZ LYS 96 21.003 6.296 13.233
416 HZ3 LYS 96 3HZ LYS 96 20.166 4.900 12.962
417 H LEU 97 H LEU 97 14.128 9.556 12.539
418 HA LEU 97 HA LEU 97 12.324 7.219 12.115
419 HB2 LEU 97 1HB LEU 97 12.128 10.045 11.019
420 HB3 LEU 97 2HB LEU 97 10.969 8.745 10.732
421 HG LEU 97 HG LEU 97 11.554 10.030 13.424
422 HD11 LEU 97 1HD1 LEU 97 9.304 10.976 13.168
423 HD12 LEU 97 2HD1 LEU 97 10.397 11.525 11.878
424 HD13 LEU 97 3HD1 LEU 97 9.188 10.262 11.544
425 HD21 LEU 97 1HD2 LEU 97 9.614 8.697 14.176
426 HD22 LEU 97 2HD2 LEU 97 9.502 7.951 12.564
427 HD23 LEU 97 3HD2 LEU 97 10.923 7.645 13.587
428 H ASP 98 H ASP 98 13.539 5.819 10.944
429 HA ASP 98 HA ASP 98 14.887 6.771 8.502
430 HB2 ASP 98 1HB ASP 98 14.601 4.027 9.778
431 HB3 ASP 98 2HB ASP 98 15.385 4.284 8.225
432 HA PRO 99 HA PRO 99 11.510 6.011 5.872
433 HB2 PRO 99 1HB PRO 99 12.811 5.626 3.480
434 HB3 PRO 99 2HB PRO 99 12.705 7.211 4.258
435 HG2 PRO 99 1HG PRO 99 14.976 5.179 4.358
436 HG3 PRO 99 2HG PRO 99 15.073 6.913 4.036
437 HD2 PRO 99 1HD PRO 99 15.572 5.917 6.517
438 HD3 PRO 99 2HD PRO 99 14.740 7.508 6.296
439 H ASP 100 H ASP 100 10.374 4.309 4.890
440 HA ASP 100 HA ASP 100 9.766 2.120 4.529
441 HB2 ASP 100 1HB ASP 100 12.739 1.766 3.975
442 HB3 ASP 100 2HB ASP 100 11.493 0.584 3.592
443 H SER 101 H SER 101 10.099 2.845 7.181
444 HA SER 101 HA SER 101 10.680 0.187 8.327
445 HB2 SER 101 1HB SER 101 12.142 1.006 10.040
446 HB3 SER 101 2HB SER 101 12.798 1.516 8.492
447 HG SER 101 HG SER 101 11.892 3.523 8.807
448 H TYR 102 H TYR 102 9.932 -0.002 10.581
449 HA TYR 102 HA TYR 102 7.527 1.733 10.959
450 HB2 TYR 102 1HB TYR 102 7.878 -1.198 11.717
451 HB3 TYR 102 2HB TYR 102 6.430 -0.231 11.972
452 HD1 TYR 102 HD1 TYR 102 8.677 -1.563 9.316
453 HD2 TYR 102 HD2 TYR 102 4.792 -0.043 10.312
454 HE1 TYR 102 HE1 TYR 102 7.850 -2.210 7.077
455 HE2 TYR 102 HE2 TYR 102 3.963 -0.689 8.077
456 HH TYR 102 HH TYR 102 5.756 -2.702 5.962
457 H TYR 103 H TYR 103 6.990 2.463 12.964
458 HA TYR 103 HA TYR 103 8.802 1.705 15.203
459 HB2 TYR 103 1HB TYR 103 7.974 4.544 14.479
460 HB3 TYR 103 2HB TYR 103 8.836 4.083 15.939
461 HD1 TYR 103 HD1 TYR 103 9.084 4.723 12.367
462 HD2 TYR 103 HD2 TYR 103 11.162 3.248 15.818
463 HE1 TYR 103 HE1 TYR 103 11.236 4.968 11.177
464 HE2 TYR 103 HE2 TYR 103 13.314 3.492 14.629
465 HH TYR 103 HH TYR 103 14.323 4.163 12.770
466 H THR 104 H THR 104 7.899 1.611 17.217
467 HA THR 104 HA THR 104 5.031 2.438 17.405
468 HB THR 104 HB THR 104 6.479 0.244 18.951
469 HG1 THR 104 HG1 THR 104 5.771 -0.924 17.346
470 HG21 THR 104 1HG2 THR 104 4.271 -0.200 19.949
471 HG22 THR 104 2HG2 THR 104 4.832 1.441 20.348
472 HG23 THR 104 3HG2 THR 104 3.596 1.203 19.092
473 H LEU 105 H LEU 105 4.473 3.908 18.870
474 HA LEU 105 HA LEU 105 6.687 4.919 20.604
475 HB2 LEU 105 1HB LEU 105 6.054 6.416 18.715
476 HB3 LEU 105 2HB LEU 105 4.403 6.478 19.340
477 HG LEU 105 HG LEU 105 5.288 7.542 21.429
478 HD11 LEU 105 1HD1 LEU 105 7.582 8.416 21.405
479 HD12 LEU 105 2HD1 LEU 105 7.553 6.638 21.333
480 HD13 LEU 105 3HD1 LEU 105 7.883 7.582 19.861
481 HD21 LEU 105 1HD2 LEU 105 5.714 9.731 20.362
482 HD22 LEU 105 2HD2 LEU 105 5.988 8.916 18.803
483 HD23 LEU 105 3HD2 LEU 105 4.377 8.876 19.558
484 H VAL 106 H VAL 106 6.287 4.110 22.572
485 HA VAL 106 HA VAL 106 3.481 4.130 23.558
486 HB VAL 106 HB VAL 106 5.977 2.768 24.661
487 HG11 VAL 106 1HG1 VAL 106 4.441 1.599 26.164
488 HG12 VAL 106 2HG1 VAL 106 4.437 3.356 26.442
489 HG13 VAL 106 3HG1 VAL 106 3.094 2.592 25.559
490 HG21 VAL 106 1HG2 VAL 106 4.862 0.699 23.892
491 HG22 VAL 106 2HG2 VAL 106 3.533 1.669 23.213
492 HG23 VAL 106 3HG2 VAL 106 5.172 1.804 22.533
493 H SER 107 H SER 107 2.800 5.486 25.076
494 HA SER 107 HA SER 107 4.741 6.848 26.829
495 HB2 SER 107 1HB SER 107 4.697 8.249 24.805
496 HB3 SER 107 2HB SER 107 2.945 8.353 24.900
497 HG SER 107 HG SER 107 3.095 9.472 26.749
498 H GLN 108 H GLN 108 3.830 7.809 28.653
499 HA GLN 108 HA GLN 108 0.908 7.841 28.942
500 HB2 GLN 108 1HB GLN 108 0.829 6.394 30.891
501 HB3 GLN 108 2HB GLN 108 1.514 5.498 29.542
502 HG2 GLN 108 1HG GLN 108 3.777 5.882 30.441
503 HG3 GLN 108 2HG GLN 108 3.052 6.741 31.831
504 HE21 GLN 108 1HE2 GLN 108 2.332 3.869 33.640
505 HE22 GLN 108 2HE2 GLN 108 2.385 5.599 33.558
506 HA PRO 109 HA PRO 109 1.555 11.270 31.503
507 HB2 PRO 109 1HB PRO 109 -0.220 9.875 33.541
508 HB3 PRO 109 2HB PRO 109 -0.332 11.526 32.917
509 HG2 PRO 109 1HG PRO 109 -2.016 9.704 31.961
510 HG3 PRO 109 2HG PRO 109 -1.248 10.825 30.833
511 HD2 PRO 109 1HD PRO 109 -0.521 7.935 31.459
512 HD3 PRO 109 2HD PRO 109 -0.602 8.767 29.854
513 H GLY 110 H GLY 110 3.352 11.660 32.644
514 HA2 GLY 110 1HA GLY 110 4.580 11.572 34.728
515 HA3 GLY 110 2HA GLY 110 3.993 9.941 34.993
516 H GLY 111 H GLY 111 4.543 9.454 31.987
517 HA2 GLY 111 1HA GLY 111 7.459 8.871 32.338
518 HA3 GLY 111 2HA GLY 111 6.351 7.885 31.400
519 H LYS 112 H LYS 112 8.239 8.297 29.850
520 HA LYS 112 HA LYS 112 7.602 10.740 28.247
521 HB2 LYS 112 1HB LYS 112 10.320 9.426 28.645
522 HB3 LYS 112 2HB LYS 112 9.991 10.728 27.508
523 HG2 LYS 112 1HG LYS 112 9.342 12.195 29.405
524 HG3 LYS 112 2HG LYS 112 9.750 10.889 30.526
525 HD2 LYS 112 1HD LYS 112 12.075 10.884 29.667
526 HD3 LYS 112 2HD LYS 112 11.663 12.207 28.564
527 HE2 LYS 112 1HE LYS 112 11.103 13.646 30.490
528 HE3 LYS 112 2HE LYS 112 11.490 12.329 31.598
529 HZ1 LYS 112 1HZ LYS 112 13.310 13.852 31.374
530 HZ2 LYS 112 2HZ LYS 112 13.745 12.377 30.777
531 HZ3 LYS 112 3HZ LYS 112 13.384 13.610 29.744
532 HA PRO 113 HA PRO 113 6.679 8.291 24.827
533 HB2 PRO 113 1HB PRO 113 8.619 10.042 23.272
534 HB3 PRO 113 2HB PRO 113 6.947 9.616 22.879
535 HG2 PRO 113 1HG PRO 113 7.421 12.030 23.887
536 HG3 PRO 113 2HG PRO 113 6.037 11.115 24.490
537 HD2 PRO 113 1HD PRO 113 8.789 11.478 25.741
538 HD3 PRO 113 2HD PRO 113 7.161 11.534 26.532
539 H GLN 114 H GLN 114 7.455 6.290 24.563
540 HA GLN 114 HA GLN 114 10.406 5.906 24.395
541 HB2 GLN 114 1HB GLN 114 9.347 4.679 26.222
542 HB3 GLN 114 2HB GLN 114 8.166 3.981 25.125
543 HG2 GLN 114 1HG GLN 114 9.810 2.328 25.625
544 HG3 GLN 114 2HG GLN 114 10.034 2.833 23.926
545 HE21 GLN 114 1HE2 GLN 114 13.372 3.618 24.351
546 HE22 GLN 114 2HE2 GLN 114 12.058 3.165 23.315
547 H LEU 115 H LEU 115 11.167 5.798 22.414
548 HA LEU 115 HA LEU 115 9.522 4.928 20.177
549 HB2 LEU 115 1HB LEU 115 11.296 6.672 19.992
550 HB3 LEU 115 2HB LEU 115 12.515 5.438 20.317
551 HG LEU 115 HG LEU 115 11.718 4.247 18.219
552 HD11 LEU 115 1HD1 LEU 115 10.440 5.588 16.611
553 HD12 LEU 115 2HD1 LEU 115 9.506 5.274 18.091
554 HD13 LEU 115 3HD1 LEU 115 10.250 6.870 17.830
555 HD21 LEU 115 1HD2 LEU 115 12.938 5.802 16.737
556 HD22 LEU 115 2HD2 LEU 115 12.784 7.089 17.957
557 HD23 LEU 115 3HD2 LEU 115 13.758 5.642 18.309
558 H VAL 116 H VAL 116 9.244 2.945 19.426
559 HA VAL 116 HA VAL 116 11.312 0.898 20.113
560 HB VAL 116 HB VAL 116 8.366 0.489 19.436
561 HG11 VAL 116 1HG1 VAL 116 8.771 -1.852 20.021
562 HG12 VAL 116 2HG1 VAL 116 9.745 -1.336 18.622
563 HG13 VAL 116 3HG1 VAL 116 10.504 -1.500 20.223
564 HG21 VAL 116 1HG2 VAL 116 8.185 -0.224 21.799
565 HG22 VAL 116 2HG2 VAL 116 9.899 0.185 22.051
566 HG23 VAL 116 3HG2 VAL 116 8.725 1.469 21.676
567 H ALA 117 H ALA 117 12.613 0.482 18.474
568 HA ALA 117 HA ALA 117 11.874 1.191 15.754
569 HB1 ALA 117 1HB ALA 117 14.126 0.349 15.179
570 HB2 ALA 117 2HB ALA 117 14.177 1.483 16.549
571 HB3 ALA 117 3HB ALA 117 14.310 -0.268 16.837
572 H GLU 118 H GLU 118 11.129 -0.030 14.157
573 HA GLU 118 HA GLU 118 11.289 -2.983 14.436
574 HB2 GLU 118 1HB GLU 118 8.734 -1.471 13.751
575 HB3 GLU 118 2HB GLU 118 8.927 -3.217 13.729
576 HG2 GLU 118 1HG GLU 118 9.349 -3.210 16.148
577 HG3 GLU 118 2HG GLU 118 9.188 -1.457 16.177
578 HA PRO 119 HA PRO 119 12.684 -1.387 10.334
579 HB2 PRO 119 1HB PRO 119 14.270 -3.953 10.747
580 HB3 PRO 119 2HB PRO 119 14.793 -2.430 10.015
581 HG2 PRO 119 1HG PRO 119 15.546 -2.945 12.512
582 HG3 PRO 119 2HG PRO 119 14.975 -1.322 12.116
583 HD2 PRO 119 1HD PRO 119 13.488 -3.599 13.483
584 HD3 PRO 119 2HD PRO 119 13.497 -1.836 13.890
Start of MODEL 8
1 H GLN 38 1H GLN 38 1.745 -2.354 -2.059
2 HA GLN 38 HA GLN 38 3.831 -1.722 -1.141
3 HB2 GLN 38 1HB GLN 38 3.711 -2.162 -3.545
4 HB3 GLN 38 2HB GLN 38 3.140 -0.529 -3.854
5 HG2 GLN 38 1HG GLN 38 5.447 -0.653 -4.441
6 HG3 GLN 38 2HG GLN 38 5.304 0.344 -2.965
7 HE21 GLN 38 1HE2 GLN 38 7.628 -1.540 -1.236
8 HE22 GLN 38 2HE2 GLN 38 6.847 -0.023 -1.531
9 H ALA 39 H ALA 39 4.603 -0.353 0.278
10 HA ALA 39 HA ALA 39 3.637 2.374 0.465
11 HB1 ALA 39 1HB ALA 39 5.310 2.588 2.274
12 HB2 ALA 39 2HB ALA 39 4.315 1.123 2.466
13 HB3 ALA 39 3HB ALA 39 5.974 0.997 1.837
14 HA PRO 40 HA PRO 40 6.291 4.545 -2.204
15 HB2 PRO 40 1HB PRO 40 6.632 6.450 0.137
16 HB3 PRO 40 2HB PRO 40 6.206 6.814 -1.539
17 HG2 PRO 40 1HG PRO 40 4.268 6.821 0.285
18 HG3 PRO 40 2HG PRO 40 3.961 6.066 -1.282
19 HD2 PRO 40 1HD PRO 40 4.680 4.755 1.372
20 HD3 PRO 40 2HD PRO 40 3.445 4.250 0.150
21 H LYS 41 H LYS 41 8.477 4.669 -2.626
22 HA LYS 41 HA LYS 41 10.280 3.201 -0.974
23 HB2 LYS 41 1HB LYS 41 10.537 3.496 -3.438
24 HB3 LYS 41 2HB LYS 41 10.921 5.194 -3.184
25 HG2 LYS 41 1HG LYS 41 12.939 4.583 -1.939
26 HG3 LYS 41 2HG LYS 41 12.542 2.868 -2.111
27 HD2 LYS 41 1HD LYS 41 12.678 3.084 -4.575
28 HD3 LYS 41 2HD LYS 41 13.083 4.799 -4.398
29 HE2 LYS 41 1HE LYS 41 15.118 4.188 -3.130
30 HE3 LYS 41 2HE LYS 41 14.716 2.477 -3.304
31 HZ1 LYS 41 1HZ LYS 41 16.303 3.182 -4.940
32 HZ2 LYS 41 2HZ LYS 41 14.899 2.737 -5.683
33 HZ3 LYS 41 3HZ LYS 41 15.275 4.335 -5.520
34 H GLY 42 H GLY 42 11.077 3.744 0.908
35 HA2 GLY 42 1HA GLY 42 12.594 5.088 2.209
36 HA3 GLY 42 2HA GLY 42 12.152 6.496 1.261
37 H SER 43 H SER 43 9.361 4.769 1.917
38 HA SER 43 HA SER 43 8.310 6.802 3.638
39 HB2 SER 43 1HB SER 43 6.858 5.529 2.176
40 HB3 SER 43 2HB SER 43 7.319 4.020 2.950
41 HG SER 43 HG SER 43 6.539 5.108 4.926
42 H ALA 44 H ALA 44 8.340 7.056 5.763
43 HA ALA 44 HA ALA 44 9.045 4.678 7.426
44 HB1 ALA 44 1HB ALA 44 9.917 6.276 9.099
45 HB2 ALA 44 2HB ALA 44 10.767 6.422 7.543
46 HB3 ALA 44 3HB ALA 44 9.537 7.622 8.002
47 H PHE 45 H PHE 45 7.936 4.310 9.340
48 HA PHE 45 HA PHE 45 5.313 5.738 9.487
49 HB2 PHE 45 1HB PHE 45 5.803 2.752 9.832
50 HB3 PHE 45 2HB PHE 45 4.260 3.566 10.038
51 HD1 PHE 45 HD1 PHE 45 6.764 2.421 7.620
52 HD2 PHE 45 HD2 PHE 45 2.989 4.355 8.132
53 HE1 PHE 45 HE1 PHE 45 6.282 2.110 5.216
54 HE2 PHE 45 HE2 PHE 45 2.502 4.044 5.729
55 HZ PHE 45 HZ PHE 45 4.150 2.924 4.269
56 H VAL 46 H VAL 46 4.687 6.422 11.432
57 HA VAL 46 HA VAL 46 5.942 5.121 13.813
58 HB VAL 46 HB VAL 46 5.066 8.028 13.537
59 HG11 VAL 46 1HG1 VAL 46 6.033 8.313 15.766
60 HG12 VAL 46 2HG1 VAL 46 4.671 7.167 15.771
61 HG13 VAL 46 3HG1 VAL 46 6.343 6.562 15.854
62 HG21 VAL 46 1HG2 VAL 46 7.481 8.515 13.763
63 HG22 VAL 46 2HG2 VAL 46 7.829 6.770 13.782
64 HG23 VAL 46 3HG2 VAL 46 7.156 7.528 12.320
65 H ARG 47 H ARG 47 4.561 4.082 15.063
66 HA ARG 47 HA ARG 47 1.689 4.899 14.968
67 HB2 ARG 47 1HB ARG 47 1.987 2.609 14.251
68 HB3 ARG 47 2HB ARG 47 2.990 2.242 15.647
69 HG2 ARG 47 1HG ARG 47 1.161 2.250 17.118
70 HG3 ARG 47 2HG ARG 47 0.120 3.115 15.963
71 HD2 ARG 47 1HD ARG 47 1.243 0.393 15.400
72 HD3 ARG 47 2HD ARG 47 -0.289 0.645 16.267
73 HE ARG 47 HE ARG 47 -0.492 2.169 13.968
74 HH11 ARG 47 1HH1 ARG 47 0.052 -1.220 14.722
75 HH12 ARG 47 2HH1 ARG 47 -0.716 -1.797 13.261
76 HH21 ARG 47 1HH2 ARG 47 -1.486 1.405 12.073
77 HH22 ARG 47 2HH2 ARG 47 -1.586 -0.313 11.761
78 H ALA 48 H ALA 48 1.201 6.202 16.595
79 HA ALA 48 HA ALA 48 2.530 5.961 19.187
80 HB1 ALA 48 1HB ALA 48 1.034 7.815 19.851
81 HB2 ALA 48 2HB ALA 48 1.891 8.171 18.332
82 HB3 ALA 48 3HB ALA 48 0.183 7.675 18.296
83 H TYR 49 H TYR 49 1.592 5.408 21.150
84 HA TYR 49 HA TYR 49 -1.134 4.282 21.123
85 HB2 TYR 49 1HB TYR 49 0.220 2.344 20.484
86 HB3 TYR 49 2HB TYR 49 1.321 2.625 21.826
87 HD1 TYR 49 HD1 TYR 49 -2.215 1.786 21.011
88 HD2 TYR 49 HD2 TYR 49 0.919 1.704 23.940
89 HE1 TYR 49 HE1 TYR 49 -3.602 0.335 22.455
90 HE2 TYR 49 HE2 TYR 49 -0.466 0.253 25.383
91 HH TYR 49 HH TYR 49 -3.730 -0.755 24.386
92 H ASN 50 H ASN 50 -2.191 4.637 22.948
93 HA ASN 50 HA ASN 50 -0.692 5.964 25.128
94 HB2 ASN 50 1HB ASN 50 -2.766 6.994 24.203
95 HB3 ASN 50 2HB ASN 50 -3.683 5.600 24.757
96 HD21 ASN 50 1HD2 ASN 50 -3.878 8.369 27.247
97 HD22 ASN 50 2HD2 ASN 50 -4.191 8.238 25.549
98 H ALA 51 H ALA 51 0.301 4.545 26.397
99 HA ALA 51 HA ALA 51 -1.104 2.048 27.116
100 HB1 ALA 51 1HB ALA 51 1.069 1.380 28.087
101 HB2 ALA 51 2HB ALA 51 1.233 1.886 26.388
102 HB3 ALA 51 3HB ALA 51 1.729 2.986 27.696
103 H GLY 52 H GLY 52 -1.302 5.053 28.213
104 HA2 GLY 52 1HA GLY 52 -0.988 4.451 31.102
105 HA3 GLY 52 2HA GLY 52 -1.272 6.031 30.398
106 H ASN 53 H ASN 53 -2.859 5.937 32.295
107 HA ASN 53 HA ASN 53 -5.435 4.740 31.357
108 HB2 ASN 53 1HB ASN 53 -4.443 5.276 34.174
109 HB3 ASN 53 2HB ASN 53 -6.103 4.840 33.786
110 HD21 ASN 53 1HD2 ASN 53 -3.472 1.979 34.391
111 HD22 ASN 53 2HD2 ASN 53 -3.344 3.622 34.926
112 H SER 54 H SER 54 -4.210 7.345 30.656
113 HA SER 54 HA SER 54 -6.596 8.962 31.252
114 HB2 SER 54 1HB SER 54 -5.381 10.847 32.138
115 HB3 SER 54 2HB SER 54 -5.023 9.438 33.125
116 HG SER 54 HG SER 54 -3.446 10.803 31.299
117 H GLU 55 H GLU 55 -6.575 11.039 30.039
118 HA GLU 55 HA GLU 55 -5.716 10.477 27.306
119 HB2 GLU 55 1HB GLU 55 -7.163 12.853 28.544
120 HB3 GLU 55 2HB GLU 55 -6.840 12.684 26.824
121 HG2 GLU 55 1HG GLU 55 -8.198 10.647 26.748
122 HG3 GLU 55 2HG GLU 55 -8.494 10.767 28.481
123 H LEU 56 H LEU 56 -4.002 11.207 26.259
124 HA LEU 56 HA LEU 56 -2.420 13.394 27.532
125 HB2 LEU 56 1HB LEU 56 -1.353 10.795 26.371
126 HB3 LEU 56 2HB LEU 56 -0.355 12.158 26.884
127 HG LEU 56 HG LEU 56 -2.173 10.582 28.738
128 HD11 LEU 56 1HD1 LEU 56 -0.101 9.534 29.538
129 HD12 LEU 56 2HD1 LEU 56 -0.409 9.162 27.825
130 HD13 LEU 56 3HD1 LEU 56 0.815 10.377 28.267
131 HD21 LEU 56 1HD2 LEU 56 -0.858 11.732 30.486
132 HD22 LEU 56 2HD2 LEU 56 0.050 12.607 29.229
133 HD23 LEU 56 3HD2 LEU 56 -1.692 12.903 29.439
134 H ASP 57 H ASP 57 -1.259 14.730 26.164
135 HA ASP 57 HA ASP 57 -2.192 14.769 23.379
136 HB2 ASP 57 1HB ASP 57 -0.355 16.625 24.944
137 HB3 ASP 57 2HB ASP 57 -0.811 16.878 23.265
138 H VAL 58 H VAL 58 -1.144 14.049 21.663
139 HA VAL 58 HA VAL 58 1.731 13.309 22.014
140 HB VAL 58 HB VAL 58 -0.400 11.837 20.407
141 HG11 VAL 58 1HG1 VAL 58 1.350 10.182 19.979
142 HG12 VAL 58 2HG1 VAL 58 1.759 11.773 19.298
143 HG13 VAL 58 3HG1 VAL 58 2.535 11.223 20.802
144 HG21 VAL 58 1HG2 VAL 58 -0.015 10.025 22.046
145 HG22 VAL 58 2HG2 VAL 58 1.125 11.069 22.930
146 HG23 VAL 58 3HG2 VAL 58 -0.599 11.504 22.846
147 H SER 59 H SER 59 3.117 14.095 20.573
148 HA SER 59 HA SER 59 2.054 15.100 17.981
149 HB2 SER 59 1HB SER 59 2.162 17.033 19.469
150 HB3 SER 59 2HB SER 59 3.819 16.646 19.905
151 HG SER 59 HG SER 59 3.875 16.680 17.367
152 H VAL 60 H VAL 60 3.157 14.305 16.349
153 HA VAL 60 HA VAL 60 6.059 13.731 16.767
154 HB VAL 60 HB VAL 60 4.079 12.096 15.123
155 HG11 VAL 60 1HG1 VAL 60 5.954 10.563 14.774
156 HG12 VAL 60 2HG1 VAL 60 6.272 12.172 14.085
157 HG13 VAL 60 3HG1 VAL 60 7.035 11.692 15.621
158 HG21 VAL 60 1HG2 VAL 60 4.536 10.332 16.798
159 HG22 VAL 60 2HG2 VAL 60 5.569 11.462 17.704
160 HG23 VAL 60 3HG2 VAL 60 3.823 11.772 17.560
161 H GLY 61 H GLY 61 7.095 15.269 15.679
162 HA2 GLY 61 1HA GLY 61 7.904 16.403 13.811
163 HA3 GLY 61 2HA GLY 61 6.878 15.407 12.797
164 H SER 62 H SER 62 5.281 16.418 11.759
165 HA SER 62 HA SER 62 4.584 19.165 12.670
166 HB2 SER 62 1HB SER 62 3.877 19.562 10.378
167 HB3 SER 62 2HB SER 62 5.517 18.933 10.396
168 HG SER 62 HG SER 62 3.305 17.238 10.173
169 H THR 63 H THR 63 3.410 16.051 12.798
170 HA THR 63 HA THR 63 0.577 17.007 12.741
171 HB THR 63 HB THR 63 1.648 14.202 12.211
172 HG1 THR 63 HG1 THR 63 0.159 15.602 10.323
173 HG21 THR 63 1HG2 THR 63 -0.692 13.668 11.658
174 HG22 THR 63 2HG2 THR 63 -0.543 14.189 13.352
175 HG23 THR 63 3HG2 THR 63 -1.183 15.312 12.129
176 H SER 64 H SER 64 -0.725 16.654 14.446
177 HA SER 64 HA SER 64 0.358 15.122 16.743
178 HB2 SER 64 1HB SER 64 0.057 16.972 18.279
179 HB3 SER 64 2HB SER 64 1.159 17.454 16.999
180 HG SER 64 HG SER 64 -0.885 18.721 17.731
181 H LEU 65 H LEU 65 -1.200 14.663 18.390
182 HA LEU 65 HA LEU 65 -4.018 15.291 17.681
183 HB2 LEU 65 1HB LEU 65 -3.601 13.050 16.807
184 HB3 LEU 65 2HB LEU 65 -2.926 12.537 18.356
185 HG LEU 65 HG LEU 65 -5.172 12.864 19.401
186 HD11 LEU 65 1HD1 LEU 65 -7.113 13.161 17.927
187 HD12 LEU 65 2HD1 LEU 65 -6.016 14.560 17.859
188 HD13 LEU 65 3HD1 LEU 65 -6.025 13.371 16.535
189 HD21 LEU 65 1HD2 LEU 65 -6.180 10.868 18.344
190 HD22 LEU 65 2HD2 LEU 65 -5.078 11.046 16.957
191 HD23 LEU 65 3HD2 LEU 65 -4.427 10.658 18.568
192 H ASN 66 H ASN 66 -5.003 16.201 19.331
193 HA ASN 66 HA ASN 66 -3.712 16.060 21.981
194 HB2 ASN 66 1HB ASN 66 -5.991 17.760 20.915
195 HB3 ASN 66 2HB ASN 66 -5.368 17.854 22.557
196 HD21 ASN 66 1HD2 ASN 66 -3.779 20.293 20.068
197 HD22 ASN 66 2HD2 ASN 66 -5.416 19.749 20.215
198 H ASP 67 H ASP 67 -4.739 15.520 23.897
199 HA ASP 67 HA ASP 67 -6.068 14.185 25.224
200 HB2 ASP 67 1HB ASP 67 -8.210 15.089 23.254
201 HB3 ASP 67 2HB ASP 67 -8.526 14.314 24.800
202 H VAL 68 H VAL 68 -4.610 12.574 23.832
203 HA VAL 68 HA VAL 68 -6.133 10.725 22.186
204 HB VAL 68 HB VAL 68 -3.424 10.422 23.551
205 HG11 VAL 68 1HG1 VAL 68 -3.051 8.585 21.980
206 HG12 VAL 68 2HG1 VAL 68 -4.414 8.257 23.076
207 HG13 VAL 68 3HG1 VAL 68 -4.723 8.748 21.393
208 HG21 VAL 68 1HG2 VAL 68 -2.535 10.912 21.294
209 HG22 VAL 68 2HG2 VAL 68 -4.194 11.151 20.695
210 HG23 VAL 68 3HG2 VAL 68 -3.517 12.265 21.907
211 H ALA 69 H ALA 69 -7.457 9.181 22.836
212 HA ALA 69 HA ALA 69 -8.062 8.901 25.619
213 HB1 ALA 69 1HB ALA 69 -9.632 7.139 24.874
214 HB2 ALA 69 2HB ALA 69 -9.758 8.603 23.870
215 HB3 ALA 69 3HB ALA 69 -8.892 7.175 23.257
216 HA PRO 70 HA PRO 70 -5.368 5.844 27.146
217 HB2 PRO 70 1HB PRO 70 -7.926 4.598 28.234
218 HB3 PRO 70 2HB PRO 70 -6.401 4.915 29.072
219 HG2 PRO 70 1HG PRO 70 -8.425 6.587 29.482
220 HG3 PRO 70 2HG PRO 70 -6.811 7.257 29.229
221 HD2 PRO 70 1HD PRO 70 -9.119 7.017 27.259
222 HD3 PRO 70 2HD PRO 70 -7.978 8.400 27.519
223 H LEU 71 H LEU 71 -4.549 4.045 26.223
224 HA LEU 71 HA LEU 71 -4.381 2.122 24.968
225 HB2 LEU 71 1HB LEU 71 -7.380 1.832 25.343
226 HB3 LEU 71 2HB LEU 71 -6.233 0.563 24.900
227 HG LEU 71 HG LEU 71 -6.384 1.979 27.584
228 HD11 LEU 71 1HD1 LEU 71 -7.125 -0.219 28.390
229 HD12 LEU 71 2HD1 LEU 71 -8.238 0.444 27.171
230 HD13 LEU 71 3HD1 LEU 71 -7.091 -0.840 26.723
231 HD21 LEU 71 1HD2 LEU 71 -4.677 0.325 28.264
232 HD22 LEU 71 2HD2 LEU 71 -4.608 -0.291 26.595
233 HD23 LEU 71 3HD2 LEU 71 -4.073 1.368 26.955
234 H GLY 72 H GLY 72 -5.330 4.840 23.892
235 HA2 GLY 72 1HA GLY 72 -6.549 4.004 21.331
236 HA3 GLY 72 2HA GLY 72 -6.184 5.646 21.825
237 H SER 73 H SER 73 -5.369 5.608 19.509
238 HA SER 73 HA SER 73 -2.473 5.267 19.517
239 HB2 SER 73 1HB SER 73 -2.328 3.664 17.728
240 HB3 SER 73 2HB SER 73 -3.291 2.962 19.018
241 HG SER 73 HG SER 73 -3.978 3.716 16.487
242 H SER 74 H SER 74 -1.504 5.920 17.412
243 HA SER 74 HA SER 74 -3.240 7.333 15.533
244 HB2 SER 74 1HB SER 74 -3.038 9.022 17.293
245 HB3 SER 74 2HB SER 74 -1.288 8.866 17.280
246 HG SER 74 HG SER 74 -1.825 9.272 14.845
247 H ASP 75 H ASP 75 -2.458 6.894 13.610
248 HA ASP 75 HA ASP 75 0.340 5.989 13.387
249 HB2 ASP 75 1HB ASP 75 -2.034 5.940 11.495
250 HB3 ASP 75 2HB ASP 75 -0.414 5.494 10.977
251 H PHE 76 H PHE 76 1.951 7.008 12.355
252 HA PHE 76 HA PHE 76 1.238 9.476 10.822
253 HB2 PHE 76 1HB PHE 76 3.826 8.945 12.335
254 HB3 PHE 76 2HB PHE 76 3.416 10.407 11.453
255 HD1 PHE 76 HD1 PHE 76 2.847 8.463 14.497
256 HD2 PHE 76 HD2 PHE 76 1.801 11.999 12.339
257 HE1 PHE 76 HE1 PHE 76 1.842 9.415 16.546
258 HE2 PHE 76 HE2 PHE 76 0.798 12.955 14.387
259 HZ PHE 76 HZ PHE 76 0.817 11.661 16.491
260 H LYS 77 H LYS 77 1.206 8.732 8.755
261 HA LYS 77 HA LYS 77 3.145 6.584 8.079
262 HB2 LYS 77 1HB LYS 77 0.574 7.443 6.690
263 HB3 LYS 77 2HB LYS 77 1.595 6.101 6.194
264 HG2 LYS 77 1HG LYS 77 1.161 4.994 8.381
265 HG3 LYS 77 2HG LYS 77 0.072 6.323 8.807
266 HD2 LYS 77 1HD LYS 77 -1.328 5.809 6.832
267 HD3 LYS 77 2HD LYS 77 -0.239 4.480 6.407
268 HE2 LYS 77 1HE LYS 77 -0.752 3.367 8.553
269 HE3 LYS 77 2HE LYS 77 -1.830 4.697 8.990
270 HZ1 LYS 77 1HZ LYS 77 -3.033 2.846 8.088
271 HZ2 LYS 77 2HZ LYS 77 -3.183 4.148 7.088
272 HZ3 LYS 77 3HZ LYS 77 -2.179 2.906 6.679
273 H PHE 78 H PHE 78 4.344 6.578 6.161
274 HA PHE 78 HA PHE 78 5.240 7.358 4.187
275 HB2 PHE 78 1HB PHE 78 3.077 9.495 4.212
276 HB3 PHE 78 2HB PHE 78 3.984 8.913 2.825
277 HD1 PHE 78 HD1 PHE 78 0.876 8.875 4.108
278 HD2 PHE 78 HD2 PHE 78 3.861 6.089 2.851
279 HE1 PHE 78 HE1 PHE 78 -0.883 7.194 3.666
280 HE2 PHE 78 HE2 PHE 78 2.105 4.406 2.406
281 HZ PHE 78 HZ PHE 78 -0.268 4.960 2.814
282 H LEU 79 H LEU 79 6.122 8.340 6.774
283 HA LEU 79 HA LEU 79 6.858 11.143 6.319
284 HB2 LEU 79 1HB LEU 79 7.710 9.154 8.453
285 HB3 LEU 79 2HB LEU 79 8.141 10.867 8.435
286 HG LEU 79 HG LEU 79 5.318 9.764 8.682
287 HD11 LEU 79 1HD1 LEU 79 5.483 10.562 10.998
288 HD12 LEU 79 2HD1 LEU 79 6.694 9.304 10.648
289 HD13 LEU 79 3HD1 LEU 79 7.181 11.014 10.722
290 HD21 LEU 79 1HD2 LEU 79 4.743 12.117 9.172
291 HD22 LEU 79 2HD2 LEU 79 6.431 12.595 8.871
292 HD23 LEU 79 3HD2 LEU 79 5.436 11.954 7.541
293 HA PRO 80 HA PRO 80 10.599 10.182 4.212
294 HB2 PRO 80 1HB PRO 80 11.793 12.645 4.353
295 HB3 PRO 80 2HB PRO 80 10.415 12.332 3.290
296 HG2 PRO 80 1HG PRO 80 10.438 13.577 6.072
297 HG3 PRO 80 2HG PRO 80 9.619 14.161 4.619
298 HD2 PRO 80 1HD PRO 80 8.297 12.706 6.510
299 HD3 PRO 80 2HD PRO 80 7.906 12.548 4.751
300 HA PRO 81 HA PRO 81 13.401 9.097 7.410
301 HB2 PRO 81 1HB PRO 81 15.551 9.822 5.393
302 HB3 PRO 81 2HB PRO 81 15.365 8.337 6.335
303 HG2 PRO 81 1HG PRO 81 14.663 8.303 3.766
304 HG3 PRO 81 2HG PRO 81 13.620 7.506 4.947
305 HD2 PRO 81 1HD PRO 81 13.312 10.248 3.658
306 HD3 PRO 81 2HD PRO 81 12.056 8.980 3.951
307 H GLY 82 H GLY 82 14.628 10.097 8.996
308 HA2 GLY 82 1HA GLY 82 16.335 12.159 9.085
309 HA3 GLY 82 2HA GLY 82 14.854 13.047 8.782
310 H SER 83 H SER 83 15.654 13.947 10.948
311 HA SER 83 HA SER 83 14.931 12.217 13.243
312 HB2 SER 83 1HB SER 83 17.017 13.441 13.433
313 HB3 SER 83 2HB SER 83 16.216 14.959 13.059
314 HG SER 83 HG SER 83 14.957 14.648 14.929
315 H TYR 84 H TYR 84 13.183 12.472 14.484
316 HA TYR 84 HA TYR 84 11.435 14.828 13.914
317 HB2 TYR 84 1HB TYR 84 10.640 11.909 14.226
318 HB3 TYR 84 2HB TYR 84 9.489 13.232 14.350
319 HD1 TYR 84 HD1 TYR 84 11.942 11.617 12.068
320 HD2 TYR 84 HD2 TYR 84 8.558 14.229 12.437
321 HE1 TYR 84 HE1 TYR 84 11.664 11.607 9.611
322 HE2 TYR 84 HE2 TYR 84 8.280 14.219 9.981
323 HH TYR 84 HH TYR 84 10.390 12.259 7.900
324 H THR 85 H THR 85 10.205 15.640 15.604
325 HA THR 85 HA THR 85 11.144 14.844 18.300
326 HB THR 85 HB THR 85 9.455 17.216 17.397
327 HG1 THR 85 HG1 THR 85 11.529 18.240 18.201
328 HG21 THR 85 1HG2 THR 85 9.812 18.054 19.685
329 HG22 THR 85 2HG2 THR 85 8.925 16.511 19.705
330 HG23 THR 85 3HG2 THR 85 10.656 16.547 20.109
331 H ALA 86 H ALA 86 10.060 13.436 19.449
332 HA ALA 86 HA ALA 86 7.143 13.139 18.910
333 HB1 ALA 86 1HB ALA 86 7.374 10.876 19.880
334 HB2 ALA 86 2HB ALA 86 8.448 11.106 18.481
335 HB3 ALA 86 3HB ALA 86 9.110 11.170 20.130
336 H GLN 87 H GLN 87 6.235 14.611 20.242
337 HA GLN 87 HA GLN 87 7.074 14.638 23.086
338 HB2 GLN 87 1HB GLN 87 6.833 16.807 21.921
339 HB3 GLN 87 2HB GLN 87 5.155 16.438 21.552
340 HG2 GLN 87 1HG GLN 87 4.620 16.413 23.946
341 HG3 GLN 87 2HG GLN 87 6.325 16.791 24.318
342 HE21 GLN 87 1HE2 GLN 87 4.285 19.921 24.383
343 HE22 GLN 87 2HE2 GLN 87 4.201 18.392 25.193
344 H VAL 88 H VAL 88 6.009 13.609 24.627
345 HA VAL 88 HA VAL 88 3.063 13.294 24.254
346 HB VAL 88 HB VAL 88 4.971 11.368 25.648
347 HG11 VAL 88 1HG1 VAL 88 2.991 9.988 26.056
348 HG12 VAL 88 2HG1 VAL 88 2.888 11.562 26.880
349 HG13 VAL 88 3HG1 VAL 88 1.958 11.275 25.389
350 HG21 VAL 88 1HG2 VAL 88 4.207 9.787 23.903
351 HG22 VAL 88 2HG2 VAL 88 3.218 11.074 23.172
352 HG23 VAL 88 3HG2 VAL 88 4.992 11.211 23.182
353 H GLY 89 H GLY 89 1.957 14.469 25.648
354 HA2 GLY 89 1HA GLY 89 1.353 15.564 27.603
355 HA3 GLY 89 2HA GLY 89 2.487 14.542 28.467
356 H GLN 90 H GLN 90 4.312 15.430 29.250
357 HA GLN 90 HA GLN 90 4.818 18.274 28.497
358 HB2 GLN 90 1HB GLN 90 5.457 16.797 31.084
359 HB3 GLN 90 2HB GLN 90 5.855 18.478 30.752
360 HG2 GLN 90 1HG GLN 90 3.058 17.329 30.853
361 HG3 GLN 90 2HG GLN 90 3.864 18.258 32.148
362 HE21 GLN 90 1HE2 GLN 90 1.694 20.213 29.514
363 HE22 GLN 90 2HE2 GLN 90 1.523 18.553 29.979
364 H GLN 91 H GLN 91 6.026 15.176 28.129
365 HA GLN 91 HA GLN 91 8.838 16.181 27.977
366 HB2 GLN 91 1HB GLN 91 7.839 13.338 28.425
367 HB3 GLN 91 2HB GLN 91 9.526 13.812 28.285
368 HG2 GLN 91 1HG GLN 91 7.636 14.800 30.430
369 HG3 GLN 91 2HG GLN 91 8.800 13.456 30.609
370 HE21 GLN 91 1HE2 GLN 91 9.979 17.091 31.541
371 HE22 GLN 91 2HE2 GLN 91 8.355 16.487 31.550
372 H SER 92 H SER 92 10.203 15.215 26.326
373 HA SER 92 HA SER 92 8.781 14.069 24.005
374 HB2 SER 92 1HB SER 92 9.571 15.753 22.458
375 HB3 SER 92 2HB SER 92 8.629 16.531 23.720
376 HG SER 92 HG SER 92 11.433 16.316 23.597
377 H LEU 93 H LEU 93 10.089 12.960 22.572
378 HA LEU 93 HA LEU 93 13.001 12.922 23.185
379 HB2 LEU 93 1HB LEU 93 11.185 10.508 22.876
380 HB3 LEU 93 2HB LEU 93 12.949 10.426 22.831
381 HG LEU 93 HG LEU 93 11.360 11.436 25.214
382 HD11 LEU 93 1HD1 LEU 93 11.842 9.246 26.210
383 HD12 LEU 93 2HD1 LEU 93 10.833 9.098 24.754
384 HD13 LEU 93 3HD1 LEU 93 12.566 8.708 24.679
385 HD21 LEU 93 1HD2 LEU 93 13.516 11.110 26.378
386 HD22 LEU 93 2HD2 LEU 93 14.266 10.598 24.847
387 HD23 LEU 93 3HD2 LEU 93 13.681 12.268 25.037
388 HA PRO 94 HA PRO 94 13.365 13.186 18.873
389 HB2 PRO 94 1HB PRO 94 15.924 12.272 18.492
390 HB3 PRO 94 2HB PRO 94 15.586 13.812 19.292
391 HG2 PRO 94 1HG PRO 94 16.165 11.095 20.545
392 HG3 PRO 94 2HG PRO 94 16.880 12.657 20.947
393 HD2 PRO 94 1HD PRO 94 14.813 11.631 22.398
394 HD3 PRO 94 2HD PRO 94 14.969 13.410 22.105
395 H VAL 95 H VAL 95 13.118 11.955 17.009
396 HA VAL 95 HA VAL 95 13.302 8.990 17.337
397 HB VAL 95 HB VAL 95 11.209 10.572 15.785
398 HG11 VAL 95 1HG1 VAL 95 10.194 8.396 15.315
399 HG12 VAL 95 2HG1 VAL 95 11.822 8.536 14.614
400 HG13 VAL 95 3HG1 VAL 95 11.570 7.586 16.097
401 HG21 VAL 95 1HG2 VAL 95 9.637 9.583 17.421
402 HG22 VAL 95 2HG2 VAL 95 11.003 8.816 18.266
403 HG23 VAL 95 3HG2 VAL 95 10.862 10.590 18.231
404 H LYS 96 H LYS 96 14.640 8.037 15.972
405 HA LYS 96 HA LYS 96 15.418 9.482 13.492
406 HB2 LYS 96 1HB LYS 96 17.241 8.672 14.966
407 HB3 LYS 96 2HB LYS 96 16.638 7.027 14.817
408 HG2 LYS 96 1HG LYS 96 17.131 7.029 12.419
409 HG3 LYS 96 2HG LYS 96 17.666 8.713 12.515
410 HD2 LYS 96 1HD LYS 96 19.424 8.014 14.158
411 HD3 LYS 96 2HD LYS 96 18.927 6.332 13.925
412 HE2 LYS 96 1HE LYS 96 19.853 8.145 11.671
413 HE3 LYS 96 2HE LYS 96 20.919 7.047 12.550
414 HZ1 LYS 96 1HZ LYS 96 20.110 6.064 10.533
415 HZ2 LYS 96 2HZ LYS 96 19.537 5.222 11.831
416 HZ3 LYS 96 3HZ LYS 96 18.543 6.248 11.008
417 H LEU 97 H LEU 97 14.225 9.095 11.783
418 HA LEU 97 HA LEU 97 13.144 6.341 11.411
419 HB2 LEU 97 1HB LEU 97 12.311 8.989 10.177
420 HB3 LEU 97 2HB LEU 97 11.608 7.423 9.764
421 HG LEU 97 HG LEU 97 11.443 8.828 12.453
422 HD11 LEU 97 1HD1 LEU 97 9.050 8.944 11.915
423 HD12 LEU 97 2HD1 LEU 97 10.038 9.800 10.707
424 HD13 LEU 97 3HD1 LEU 97 9.369 8.195 10.333
425 HD21 LEU 97 1HD2 LEU 97 9.989 6.933 13.088
426 HD22 LEU 97 2HD2 LEU 97 10.319 6.153 11.523
427 HD23 LEU 97 3HD2 LEU 97 11.634 6.375 12.702
428 H ASP 98 H ASP 98 13.664 5.125 9.693
429 HA ASP 98 HA ASP 98 15.668 6.306 7.814
430 HB2 ASP 98 1HB ASP 98 15.378 3.445 8.813
431 HB3 ASP 98 2HB ASP 98 16.493 3.943 7.551
432 HA PRO 99 HA PRO 99 13.325 5.407 4.246
433 HB2 PRO 99 1HB PRO 99 15.627 3.598 3.409
434 HB3 PRO 99 2HB PRO 99 14.794 4.842 2.468
435 HG2 PRO 99 1HG PRO 99 17.172 5.436 3.493
436 HG3 PRO 99 2HG PRO 99 15.877 6.632 3.610
437 HD2 PRO 99 1HD PRO 99 16.898 4.698 5.729
438 HD3 PRO 99 2HD PRO 99 16.444 6.443 5.900
439 H ASP 100 H ASP 100 11.631 4.060 4.210
440 HA ASP 100 HA ASP 100 10.325 2.185 4.490
441 HB2 ASP 100 1HB ASP 100 12.882 0.733 3.696
442 HB3 ASP 100 2HB ASP 100 11.268 0.036 3.692
443 H SER 101 H SER 101 10.614 2.952 6.840
444 HA SER 101 HA SER 101 11.437 0.574 8.416
445 HB2 SER 101 1HB SER 101 12.685 1.867 9.996
446 HB3 SER 101 2HB SER 101 13.320 2.234 8.400
447 HG SER 101 HG SER 101 12.264 4.123 8.393
448 H TYR 102 H TYR 102 10.531 0.503 10.558
449 HA TYR 102 HA TYR 102 8.056 2.166 10.782
450 HB2 TYR 102 1HB TYR 102 8.502 -0.750 11.537
451 HB3 TYR 102 2HB TYR 102 7.085 0.177 12.011
452 HD1 TYR 102 HD1 TYR 102 8.972 -1.110 9.080
453 HD2 TYR 102 HD2 TYR 102 5.270 0.496 10.540
454 HE1 TYR 102 HE1 TYR 102 7.877 -1.690 6.942
455 HE2 TYR 102 HE2 TYR 102 4.175 -0.084 8.402
456 HH TYR 102 HH TYR 102 4.426 -0.970 6.387
457 H TYR 103 H TYR 103 7.215 2.397 12.995
458 HA TYR 103 HA TYR 103 9.160 2.204 15.166
459 HB2 TYR 103 1HB TYR 103 9.571 4.366 13.593
460 HB3 TYR 103 2HB TYR 103 8.316 5.024 14.633
461 HD1 TYR 103 HD1 TYR 103 11.748 3.716 14.493
462 HD2 TYR 103 HD2 TYR 103 8.703 5.424 16.986
463 HE1 TYR 103 HE1 TYR 103 13.436 4.178 16.239
464 HE2 TYR 103 HE2 TYR 103 10.390 5.886 18.732
465 HH TYR 103 HH TYR 103 13.812 5.049 18.249
466 H THR 104 H THR 104 8.310 2.637 17.199
467 HA THR 104 HA THR 104 5.371 3.168 17.238
468 HB THR 104 HB THR 104 6.875 1.087 18.882
469 HG1 THR 104 HG1 THR 104 6.168 -0.243 17.402
470 HG21 THR 104 1HG2 THR 104 4.661 0.551 19.820
471 HG22 THR 104 2HG2 THR 104 5.124 2.228 20.199
472 HG23 THR 104 3HG2 THR 104 3.943 1.900 18.910
473 H LEU 105 H LEU 105 4.665 4.614 18.662
474 HA LEU 105 HA LEU 105 6.625 5.576 20.703
475 HB2 LEU 105 1HB LEU 105 6.159 7.283 19.026
476 HB3 LEU 105 2HB LEU 105 4.419 7.077 19.249
477 HG LEU 105 HG LEU 105 4.678 7.916 21.600
478 HD11 LEU 105 1HD1 LEU 105 6.772 9.053 22.191
479 HD12 LEU 105 2HD1 LEU 105 7.023 7.314 21.914
480 HD13 LEU 105 3HD1 LEU 105 7.505 8.493 20.670
481 HD21 LEU 105 1HD2 LEU 105 4.987 10.271 20.913
482 HD22 LEU 105 2HD2 LEU 105 5.695 9.727 19.373
483 HD23 LEU 105 3HD2 LEU 105 3.987 9.385 19.735
484 H VAL 106 H VAL 106 6.137 4.884 22.658
485 HA VAL 106 HA VAL 106 3.279 4.314 23.275
486 HB VAL 106 HB VAL 106 5.830 3.364 24.648
487 HG11 VAL 106 1HG1 VAL 106 4.361 1.862 25.903
488 HG12 VAL 106 2HG1 VAL 106 3.998 3.574 26.226
489 HG13 VAL 106 3HG1 VAL 106 2.941 2.626 25.151
490 HG21 VAL 106 1HG2 VAL 106 5.221 1.170 23.680
491 HG22 VAL 106 2HG2 VAL 106 3.830 1.920 22.861
492 HG23 VAL 106 3HG2 VAL 106 5.487 2.383 22.407
493 H SER 107 H SER 107 2.195 5.596 24.589
494 HA SER 107 HA SER 107 3.620 7.745 25.999
495 HB2 SER 107 1HB SER 107 0.663 7.083 25.795
496 HB3 SER 107 2HB SER 107 1.325 8.518 26.561
497 HG SER 107 HG SER 107 1.675 7.731 23.881
498 H GLN 108 H GLN 108 4.163 7.773 28.060
499 HA GLN 108 HA GLN 108 3.234 5.525 29.766
500 HB2 GLN 108 1HB GLN 108 5.510 7.511 30.163
501 HB3 GLN 108 2HB GLN 108 5.113 6.195 31.258
502 HG2 GLN 108 1HG GLN 108 5.599 4.562 29.492
503 HG3 GLN 108 2HG GLN 108 6.009 5.902 28.383
504 HE21 GLN 108 1HE2 GLN 108 9.131 4.502 29.874
505 HE22 GLN 108 2HE2 GLN 108 7.811 3.850 28.961
506 HA PRO 109 HA PRO 109 0.531 7.874 32.249
507 HB2 PRO 109 1HB PRO 109 2.043 6.563 34.545
508 HB3 PRO 109 2HB PRO 109 0.297 6.704 34.302
509 HG2 PRO 109 1HG PRO 109 1.452 4.375 33.753
510 HG3 PRO 109 2HG PRO 109 0.251 5.011 32.627
511 HD2 PRO 109 1HD PRO 109 3.287 5.076 32.431
512 HD3 PRO 109 2HD PRO 109 2.069 4.727 31.140
513 H GLY 110 H GLY 110 0.653 9.930 32.969
514 HA2 GLY 110 1HA GLY 110 1.605 11.681 34.346
515 HA3 GLY 110 2HA GLY 110 3.163 10.883 34.268
516 H GLY 111 H GLY 111 2.252 10.475 31.234
517 HA2 GLY 111 1HA GLY 111 2.268 11.768 29.255
518 HA3 GLY 111 2HA GLY 111 2.562 13.216 30.200
519 H LYS 112 H LYS 112 4.169 10.104 29.409
520 HA LYS 112 HA LYS 112 6.566 11.659 28.606
521 HB2 LYS 112 1HB LYS 112 6.952 10.899 30.946
522 HB3 LYS 112 2HB LYS 112 6.664 9.237 30.447
523 HG2 LYS 112 1HG LYS 112 8.632 9.285 29.006
524 HG3 LYS 112 2HG LYS 112 8.897 10.992 29.386
525 HD2 LYS 112 1HD LYS 112 9.205 10.414 31.773
526 HD3 LYS 112 2HD LYS 112 8.943 8.705 31.390
527 HE2 LYS 112 1HE LYS 112 10.919 8.728 29.908
528 HE3 LYS 112 2HE LYS 112 11.177 10.437 30.267
529 HZ1 LYS 112 1HZ LYS 112 12.570 9.034 31.601
530 HZ2 LYS 112 2HZ LYS 112 11.506 9.842 32.569
531 HZ3 LYS 112 3HZ LYS 112 11.265 8.246 32.233
532 HA PRO 113 HA PRO 113 6.104 8.915 25.250
533 HB2 PRO 113 1HB PRO 113 8.264 9.724 23.766
534 HB3 PRO 113 2HB PRO 113 6.819 10.727 23.946
535 HG2 PRO 113 1HG PRO 113 9.443 10.866 25.489
536 HG3 PRO 113 2HG PRO 113 8.544 12.189 24.740
537 HD2 PRO 113 1HD PRO 113 8.312 11.636 27.402
538 HD3 PRO 113 2HD PRO 113 6.907 12.239 26.434
539 H GLN 114 H GLN 114 6.940 6.934 24.581
540 HA GLN 114 HA GLN 114 9.645 6.191 25.610
541 HB2 GLN 114 1HB GLN 114 7.919 4.985 26.891
542 HB3 GLN 114 2HB GLN 114 7.188 4.405 25.400
543 HG2 GLN 114 1HG GLN 114 9.227 3.142 24.878
544 HG3 GLN 114 2HG GLN 114 9.964 3.728 26.396
545 HE21 GLN 114 1HE2 GLN 114 8.134 0.307 26.559
546 HE22 GLN 114 2HE2 GLN 114 9.025 1.002 25.245
547 H LEU 115 H LEU 115 11.059 5.621 24.127
548 HA LEU 115 HA LEU 115 10.148 5.557 21.334
549 HB2 LEU 115 1HB LEU 115 12.933 5.423 22.545
550 HB3 LEU 115 2HB LEU 115 12.578 5.545 20.818
551 HG LEU 115 HG LEU 115 11.931 7.646 22.918
552 HD11 LEU 115 1HD1 LEU 115 13.682 8.936 21.783
553 HD12 LEU 115 2HD1 LEU 115 14.321 7.426 22.472
554 HD13 LEU 115 3HD1 LEU 115 14.019 7.549 20.723
555 HD21 LEU 115 1HD2 LEU 115 11.312 9.025 20.962
556 HD22 LEU 115 2HD2 LEU 115 11.614 7.638 19.888
557 HD23 LEU 115 3HD2 LEU 115 10.287 7.574 21.072
558 H VAL 116 H VAL 116 9.563 3.754 20.370
559 HA VAL 116 HA VAL 116 11.125 1.284 20.996
560 HB VAL 116 HB VAL 116 8.164 1.465 20.291
561 HG11 VAL 116 1HG1 VAL 116 8.136 -0.952 20.677
562 HG12 VAL 116 2HG1 VAL 116 9.204 -0.505 19.325
563 HG13 VAL 116 3HG1 VAL 116 9.900 -0.934 20.906
564 HG21 VAL 116 1HG2 VAL 116 7.826 0.604 22.585
565 HG22 VAL 116 2HG2 VAL 116 9.582 0.676 22.869
566 HG23 VAL 116 3HG2 VAL 116 8.660 2.175 22.605
567 H ALA 117 H ALA 117 12.393 0.866 19.326
568 HA ALA 117 HA ALA 117 11.576 1.652 16.614
569 HB1 ALA 117 1HB ALA 117 13.827 0.854 15.967
570 HB2 ALA 117 2HB ALA 117 13.900 2.015 17.313
571 HB3 ALA 117 3HB ALA 117 14.089 0.274 17.628
572 H GLU 118 H GLU 118 10.923 0.365 15.008
573 HA GLU 118 HA GLU 118 10.425 -2.480 15.728
574 HB2 GLU 118 1HB GLU 118 9.260 -0.782 13.483
575 HB3 GLU 118 2HB GLU 118 8.823 -2.448 13.830
576 HG2 GLU 118 1HG GLU 118 8.444 -0.150 15.760
577 HG3 GLU 118 2HG GLU 118 7.205 -0.749 14.660
578 HA PRO 119 HA PRO 119 13.416 -3.833 12.911
579 HB2 PRO 119 1HB PRO 119 12.576 -6.379 12.378
580 HB3 PRO 119 2HB PRO 119 13.147 -5.905 13.983
581 HG2 PRO 119 1HG PRO 119 10.284 -6.115 12.959
582 HG3 PRO 119 2HG PRO 119 10.958 -6.757 14.459
583 HD2 PRO 119 1HD PRO 119 9.613 -4.374 14.385
584 HD3 PRO 119 2HD PRO 119 10.990 -4.660 15.521
Start of MODEL 9
1 H GLN 38 1H GLN 38 1.942 0.911 -3.470
2 HA GLN 38 HA GLN 38 2.646 0.972 -1.214
3 HB2 GLN 38 1HB GLN 38 4.896 0.637 -3.240
4 HB3 GLN 38 2HB GLN 38 4.925 0.039 -1.588
5 HG2 GLN 38 1HG GLN 38 2.941 -0.807 -3.710
6 HG3 GLN 38 2HG GLN 38 4.398 -1.714 -3.212
7 HE21 GLN 38 1HE2 GLN 38 0.975 -2.404 -1.357
8 HE22 GLN 38 2HE2 GLN 38 1.165 -1.723 -2.939
9 H ALA 39 H ALA 39 4.534 1.537 0.184
10 HA ALA 39 HA ALA 39 4.804 4.415 0.238
11 HB1 ALA 39 1HB ALA 39 6.208 4.008 2.233
12 HB2 ALA 39 2HB ALA 39 4.679 3.099 2.306
13 HB3 ALA 39 3HB ALA 39 6.192 2.265 1.879
14 HA PRO 40 HA PRO 40 8.425 4.811 -2.120
15 HB2 PRO 40 1HB PRO 40 9.277 7.287 -1.324
16 HB3 PRO 40 2HB PRO 40 7.808 7.070 -2.285
17 HG2 PRO 40 1HG PRO 40 8.085 7.408 0.732
18 HG3 PRO 40 2HG PRO 40 6.990 8.252 -0.366
19 HD2 PRO 40 1HD PRO 40 6.169 6.087 1.081
20 HD3 PRO 40 2HD PRO 40 5.540 6.409 -0.585
21 H LYS 41 H LYS 41 10.732 4.777 -1.961
22 HA LYS 41 HA LYS 41 11.814 3.545 0.373
23 HB2 LYS 41 1HB LYS 41 12.771 3.314 -1.918
24 HB3 LYS 41 2HB LYS 41 13.276 4.997 -1.870
25 HG2 LYS 41 1HG LYS 41 14.789 4.521 -0.001
26 HG3 LYS 41 2HG LYS 41 14.246 2.837 0.025
27 HD2 LYS 41 1HD LYS 41 15.076 2.534 -2.287
28 HD3 LYS 41 2HD LYS 41 15.618 4.218 -2.314
29 HE2 LYS 41 1HE LYS 41 17.143 3.756 -0.422
30 HE3 LYS 41 2HE LYS 41 16.605 2.075 -0.394
31 HZ1 LYS 41 1HZ LYS 41 18.649 2.327 -1.598
32 HZ2 LYS 41 2HZ LYS 41 17.458 1.827 -2.623
33 HZ3 LYS 41 3HZ LYS 41 17.963 3.397 -2.648
34 H GLY 42 H GLY 42 12.492 4.309 2.232
35 HA2 GLY 42 1HA GLY 42 13.765 5.956 3.517
36 HA3 GLY 42 2HA GLY 42 13.214 7.205 2.413
37 H SER 43 H SER 43 10.605 5.237 2.829
38 HA SER 43 HA SER 43 9.198 7.180 4.419
39 HB2 SER 43 1HB SER 43 7.303 5.708 4.204
40 HB3 SER 43 2HB SER 43 8.154 5.745 2.667
41 HG SER 43 HG SER 43 9.184 3.828 3.280
42 H ALA 44 H ALA 44 8.009 6.719 6.404
43 HA ALA 44 HA ALA 44 8.935 4.523 8.081
44 HB1 ALA 44 1HB ALA 44 9.841 5.963 9.876
45 HB2 ALA 44 2HB ALA 44 10.796 6.094 8.380
46 HB3 ALA 44 3HB ALA 44 9.653 7.384 8.823
47 H PHE 45 H PHE 45 7.709 4.218 9.951
48 HA PHE 45 HA PHE 45 5.257 5.920 10.074
49 HB2 PHE 45 1HB PHE 45 5.418 2.887 10.286
50 HB3 PHE 45 2HB PHE 45 3.972 3.839 10.578
51 HD1 PHE 45 HD1 PHE 45 6.358 2.696 8.018
52 HD2 PHE 45 HD2 PHE 45 2.692 4.758 8.771
53 HE1 PHE 45 HE1 PHE 45 5.800 2.579 5.612
54 HE2 PHE 45 HE2 PHE 45 2.129 4.639 6.366
55 HZ PHE 45 HZ PHE 45 3.684 3.551 4.786
56 H VAL 46 H VAL 46 4.444 6.397 12.053
57 HA VAL 46 HA VAL 46 5.816 5.149 14.398
58 HB VAL 46 HB VAL 46 4.874 8.034 14.110
59 HG11 VAL 46 1HG1 VAL 46 5.828 8.364 16.338
60 HG12 VAL 46 2HG1 VAL 46 4.485 7.199 16.355
61 HG13 VAL 46 3HG1 VAL 46 6.166 6.621 16.451
62 HG21 VAL 46 1HG2 VAL 46 7.282 8.561 14.337
63 HG22 VAL 46 2HG2 VAL 46 7.656 6.822 14.383
64 HG23 VAL 46 3HG2 VAL 46 6.976 7.548 12.906
65 H ARG 47 H ARG 47 4.523 4.170 15.795
66 HA ARG 47 HA ARG 47 1.595 4.716 15.579
67 HB2 ARG 47 1HB ARG 47 2.143 2.434 14.971
68 HB3 ARG 47 2HB ARG 47 3.099 2.218 16.429
69 HG2 ARG 47 1HG ARG 47 1.162 2.227 17.817
70 HG3 ARG 47 2HG ARG 47 0.126 2.778 16.477
71 HD2 ARG 47 1HD ARG 47 1.643 0.184 16.458
72 HD3 ARG 47 2HD ARG 47 -0.030 0.356 17.039
73 HE ARG 47 HE ARG 47 0.011 1.500 14.512
74 HH11 ARG 47 1HH1 ARG 47 0.698 -1.653 15.902
75 HH12 ARG 47 2HH1 ARG 47 0.228 -2.529 14.462
76 HH21 ARG 47 1HH2 ARG 47 -0.596 0.351 12.649
77 HH22 ARG 47 2HH2 ARG 47 -0.505 -1.395 12.621
78 H ALA 48 H ALA 48 1.227 6.262 17.078
79 HA ALA 48 HA ALA 48 2.436 6.251 19.692
80 HB1 ALA 48 1HB ALA 48 0.756 7.989 20.220
81 HB2 ALA 48 2HB ALA 48 1.570 8.309 18.671
82 HB3 ALA 48 3HB ALA 48 -0.078 7.638 18.688
83 H TYR 49 H TYR 49 1.585 5.733 21.693
84 HA TYR 49 HA TYR 49 -1.001 4.302 21.768
85 HB2 TYR 49 1HB TYR 49 0.637 2.517 21.312
86 HB3 TYR 49 2HB TYR 49 1.623 3.044 22.669
87 HD1 TYR 49 HD1 TYR 49 -1.811 1.816 21.846
88 HD2 TYR 49 HD2 TYR 49 1.313 2.115 24.773
89 HE1 TYR 49 HE1 TYR 49 -3.072 0.312 23.346
90 HE2 TYR 49 HE2 TYR 49 0.050 0.609 26.273
91 HH TYR 49 HH TYR 49 -3.108 -0.718 25.315
92 H ASN 50 H ASN 50 -2.133 4.752 23.515
93 HA ASN 50 HA ASN 50 -0.795 6.301 25.658
94 HB2 ASN 50 1HB ASN 50 -2.874 7.185 24.620
95 HB3 ASN 50 2HB ASN 50 -3.744 5.763 25.178
96 HD21 ASN 50 1HD2 ASN 50 -4.221 8.585 27.560
97 HD22 ASN 50 2HD2 ASN 50 -4.448 8.376 25.857
98 H ALA 51 H ALA 51 0.199 5.038 27.075
99 HA ALA 51 HA ALA 51 -0.992 2.424 27.734
100 HB1 ALA 51 1HB ALA 51 1.146 2.016 28.909
101 HB2 ALA 51 2HB ALA 51 1.408 2.532 27.226
102 HB3 ALA 51 3HB ALA 51 1.649 3.687 28.557
103 H GLY 52 H GLY 52 -1.625 5.396 28.766
104 HA2 GLY 52 1HA GLY 52 -1.520 4.801 31.684
105 HA3 GLY 52 2HA GLY 52 -1.781 6.379 30.963
106 H ASN 53 H ASN 53 -3.559 6.278 32.650
107 HA ASN 53 HA ASN 53 -5.986 5.002 31.457
108 HB2 ASN 53 1HB ASN 53 -5.338 5.634 34.352
109 HB3 ASN 53 2HB ASN 53 -6.931 5.152 33.790
110 HD21 ASN 53 1HD2 ASN 53 -4.300 2.374 34.746
111 HD22 ASN 53 2HD2 ASN 53 -4.245 4.037 35.226
112 H SER 54 H SER 54 -4.655 7.667 30.961
113 HA SER 54 HA SER 54 -7.192 9.177 31.093
114 HB2 SER 54 1HB SER 54 -6.209 11.143 32.052
115 HB3 SER 54 2HB SER 54 -5.873 9.798 33.131
116 HG SER 54 HG SER 54 -4.197 11.256 31.501
117 H GLU 55 H GLU 55 -6.929 11.326 29.879
118 HA GLU 55 HA GLU 55 -6.047 10.507 27.226
119 HB2 GLU 55 1HB GLU 55 -7.347 13.053 28.267
120 HB3 GLU 55 2HB GLU 55 -6.966 12.780 26.573
121 HG2 GLU 55 1HG GLU 55 -8.458 10.833 26.536
122 HG3 GLU 55 2HG GLU 55 -8.824 11.075 28.243
123 H LEU 56 H LEU 56 -4.410 11.264 25.999
124 HA LEU 56 HA LEU 56 -2.502 13.111 27.372
125 HB2 LEU 56 1HB LEU 56 -1.946 10.870 25.396
126 HB3 LEU 56 2HB LEU 56 -0.732 11.990 26.022
127 HG LEU 56 HG LEU 56 -2.321 10.020 27.705
128 HD11 LEU 56 1HD1 LEU 56 -0.199 8.797 27.843
129 HD12 LEU 56 2HD1 LEU 56 -0.789 8.901 26.168
130 HD13 LEU 56 3HD1 LEU 56 0.543 9.951 26.711
131 HD21 LEU 56 1HD2 LEU 56 -0.694 10.655 29.455
132 HD22 LEU 56 2HD2 LEU 56 0.040 11.837 28.345
133 HD23 LEU 56 3HD2 LEU 56 -1.632 12.067 28.911
134 H ASP 57 H ASP 57 -1.527 14.741 26.214
135 HA ASP 57 HA ASP 57 -2.675 15.244 23.506
136 HB2 ASP 57 1HB ASP 57 -1.374 17.135 25.505
137 HB3 ASP 57 2HB ASP 57 -1.852 17.597 23.877
138 H VAL 58 H VAL 58 -1.445 14.603 21.892
139 HA VAL 58 HA VAL 58 1.510 14.931 22.170
140 HB VAL 58 HB VAL 58 1.838 12.799 21.008
141 HG11 VAL 58 1HG1 VAL 58 1.071 11.269 22.756
142 HG12 VAL 58 2HG1 VAL 58 1.753 12.767 23.434
143 HG13 VAL 58 3HG1 VAL 58 -0.010 12.534 23.387
144 HG21 VAL 58 1HG2 VAL 58 -0.087 11.309 20.562
145 HG22 VAL 58 2HG2 VAL 58 -1.199 12.582 21.122
146 HG23 VAL 58 3HG2 VAL 58 -0.227 12.833 19.652
147 H SER 59 H SER 59 2.658 14.889 20.067
148 HA SER 59 HA SER 59 1.020 15.360 17.674
149 HB2 SER 59 1HB SER 59 1.167 17.605 18.674
150 HB3 SER 59 2HB SER 59 2.919 17.476 18.739
151 HG SER 59 HG SER 59 2.692 17.028 16.399
152 H VAL 60 H VAL 60 1.911 14.295 16.061
153 HA VAL 60 HA VAL 60 4.848 13.761 16.209
154 HB VAL 60 HB VAL 60 2.648 11.840 15.334
155 HG11 VAL 60 1HG1 VAL 60 4.445 10.188 15.156
156 HG12 VAL 60 2HG1 VAL 60 4.675 11.547 14.031
157 HG13 VAL 60 3HG1 VAL 60 5.642 11.454 15.522
158 HG21 VAL 60 1HG2 VAL 60 3.323 10.556 17.338
159 HG22 VAL 60 2HG2 VAL 60 4.482 11.838 17.767
160 HG23 VAL 60 3HG2 VAL 60 2.733 12.176 17.781
161 H GLY 61 H GLY 61 5.964 14.333 14.481
162 HA2 GLY 61 1HA GLY 61 6.486 14.852 12.276
163 HA3 GLY 61 2HA GLY 61 5.041 13.992 11.778
164 H SER 62 H SER 62 3.537 15.181 10.801
165 HA SER 62 HA SER 62 3.458 18.108 11.404
166 HB2 SER 62 1HB SER 62 2.602 18.418 9.132
167 HB3 SER 62 2HB SER 62 4.164 17.615 9.108
168 HG SER 62 HG SER 62 1.954 15.992 9.278
169 H THR 63 H THR 63 1.964 15.468 12.347
170 HA THR 63 HA THR 63 -0.755 16.695 12.147
171 HB THR 63 HB THR 63 -0.052 13.729 12.239
172 HG1 THR 63 HG1 THR 63 -1.446 15.103 10.187
173 HG21 THR 63 1HG2 THR 63 -2.479 13.385 11.984
174 HG22 THR 63 2HG2 THR 63 -2.115 14.258 13.493
175 HG23 THR 63 3HG2 THR 63 -2.743 15.141 12.082
176 H SER 64 H SER 64 -1.327 17.535 14.009
177 HA SER 64 HA SER 64 -0.281 16.451 16.532
178 HB2 SER 64 1HB SER 64 -2.232 18.702 15.946
179 HB3 SER 64 2HB SER 64 -1.635 18.286 17.544
180 HG SER 64 HG SER 64 0.506 18.495 16.471
181 H LEU 65 H LEU 65 -1.524 15.620 18.224
182 HA LEU 65 HA LEU 65 -4.307 14.831 17.592
183 HB2 LEU 65 1HB LEU 65 -2.872 12.997 16.742
184 HB3 LEU 65 2HB LEU 65 -2.138 12.837 18.341
185 HG LEU 65 HG LEU 65 -4.387 12.211 19.257
186 HD11 LEU 65 1HD1 LEU 65 -6.154 11.605 17.663
187 HD12 LEU 65 2HD1 LEU 65 -5.756 13.337 17.577
188 HD13 LEU 65 3HD1 LEU 65 -5.159 12.223 16.324
189 HD21 LEU 65 1HD2 LEU 65 -4.367 9.948 18.262
190 HD22 LEU 65 2HD2 LEU 65 -3.345 10.542 16.930
191 HD23 LEU 65 3HD2 LEU 65 -2.713 10.516 18.593
192 H ASN 66 H ASN 66 -5.081 16.087 19.238
193 HA ASN 66 HA ASN 66 -3.968 15.673 21.953
194 HB2 ASN 66 1HB ASN 66 -6.062 17.603 20.904
195 HB3 ASN 66 2HB ASN 66 -5.528 17.521 22.577
196 HD21 ASN 66 1HD2 ASN 66 -3.663 20.065 20.418
197 HD22 ASN 66 2HD2 ASN 66 -5.339 19.626 20.452
198 H ASP 67 H ASP 67 -5.348 15.275 23.773
199 HA ASP 67 HA ASP 67 -6.966 14.083 24.892
200 HB2 ASP 67 1HB ASP 67 -8.640 14.637 22.408
201 HB3 ASP 67 2HB ASP 67 -9.259 14.056 23.948
202 H VAL 68 H VAL 68 -5.072 12.544 23.708
203 HA VAL 68 HA VAL 68 -6.217 10.436 22.091
204 HB VAL 68 HB VAL 68 -3.690 10.494 23.797
205 HG11 VAL 68 1HG1 VAL 68 -2.958 8.590 22.445
206 HG12 VAL 68 2HG1 VAL 68 -4.417 8.214 23.394
207 HG13 VAL 68 3HG1 VAL 68 -4.548 8.546 21.649
208 HG21 VAL 68 1HG2 VAL 68 -2.565 10.901 21.631
209 HG22 VAL 68 2HG2 VAL 68 -4.147 10.929 20.816
210 HG23 VAL 68 3HG2 VAL 68 -3.731 12.192 22.002
211 H ALA 69 H ALA 69 -7.531 8.874 22.706
212 HA ALA 69 HA ALA 69 -8.409 8.681 25.417
213 HB1 ALA 69 1HB ALA 69 -9.736 6.750 24.622
214 HB2 ALA 69 2HB ALA 69 -9.867 8.140 23.517
215 HB3 ALA 69 3HB ALA 69 -8.823 6.763 23.095
216 HA PRO 70 HA PRO 70 -5.605 6.014 27.395
217 HB2 PRO 70 1HB PRO 70 -8.136 4.675 28.427
218 HB3 PRO 70 2HB PRO 70 -6.707 5.193 29.330
219 HG2 PRO 70 1HG PRO 70 -8.874 6.726 29.435
220 HG3 PRO 70 2HG PRO 70 -7.300 7.498 29.225
221 HD2 PRO 70 1HD PRO 70 -9.430 6.888 27.138
222 HD3 PRO 70 2HD PRO 70 -8.418 8.375 27.335
223 H LEU 71 H LEU 71 -4.577 4.253 26.637
224 HA LEU 71 HA LEU 71 -4.176 2.227 25.619
225 HB2 LEU 71 1HB LEU 71 -7.140 1.685 25.991
226 HB3 LEU 71 2HB LEU 71 -5.875 0.491 25.688
227 HG LEU 71 HG LEU 71 -6.195 2.159 28.208
228 HD11 LEU 71 1HD1 LEU 71 -6.734 -0.003 29.238
229 HD12 LEU 71 2HD1 LEU 71 -7.888 0.419 27.951
230 HD13 LEU 71 3HD1 LEU 71 -6.619 -0.791 27.646
231 HD21 LEU 71 1HD2 LEU 71 -4.348 0.758 29.065
232 HD22 LEU 71 2HD2 LEU 71 -4.197 -0.021 27.470
233 HD23 LEU 71 3HD2 LEU 71 -3.827 1.711 27.655
234 H GLY 72 H GLY 72 -5.350 4.685 24.203
235 HA2 GLY 72 1HA GLY 72 -6.398 3.418 21.739
236 HA3 GLY 72 2HA GLY 72 -6.249 5.138 22.043
237 H SER 73 H SER 73 -5.412 4.538 19.667
238 HA SER 73 HA SER 73 -2.509 4.902 19.790
239 HB2 SER 73 1HB SER 73 -1.929 3.020 18.403
240 HB3 SER 73 2HB SER 73 -2.784 2.424 19.817
241 HG SER 73 HG SER 73 -3.490 2.445 17.177
242 H SER 74 H SER 74 -1.576 5.306 17.622
243 HA SER 74 HA SER 74 -3.406 5.889 15.435
244 HB2 SER 74 1HB SER 74 -3.835 7.844 16.847
245 HB3 SER 74 2HB SER 74 -2.114 8.177 16.954
246 HG SER 74 HG SER 74 -2.255 8.173 14.561
247 H ASP 75 H ASP 75 -2.368 5.581 13.601
248 HA ASP 75 HA ASP 75 0.574 5.407 13.648
249 HB2 ASP 75 1HB ASP 75 -1.499 4.752 11.520
250 HB3 ASP 75 2HB ASP 75 0.233 4.614 11.256
251 H PHE 76 H PHE 76 1.969 6.761 12.701
252 HA PHE 76 HA PHE 76 0.807 9.016 11.117
253 HB2 PHE 76 1HB PHE 76 3.250 9.038 12.933
254 HB3 PHE 76 2HB PHE 76 2.739 10.377 11.919
255 HD1 PHE 76 HD1 PHE 76 1.988 8.415 14.925
256 HD2 PHE 76 HD2 PHE 76 0.812 11.723 12.490
257 HE1 PHE 76 HE1 PHE 76 0.528 9.234 16.745
258 HE2 PHE 76 HE2 PHE 76 -0.647 12.547 14.309
259 HZ PHE 76 HZ PHE 76 -0.789 11.299 16.437
260 H LYS 77 H LYS 77 1.684 9.499 9.180
261 HA LYS 77 HA LYS 77 3.597 7.440 8.184
262 HB2 LYS 77 1HB LYS 77 1.346 7.470 7.130
263 HB3 LYS 77 2HB LYS 77 1.587 9.145 6.658
264 HG2 LYS 77 1HG LYS 77 3.441 8.504 5.197
265 HG3 LYS 77 2HG LYS 77 3.290 6.820 5.716
266 HD2 LYS 77 1HD LYS 77 0.971 6.766 4.822
267 HD3 LYS 77 2HD LYS 77 1.158 8.437 4.270
268 HE2 LYS 77 1HE LYS 77 3.046 7.744 2.824
269 HE3 LYS 77 2HE LYS 77 2.848 6.076 3.367
270 HZ1 LYS 77 1HZ LYS 77 1.767 6.457 1.276
271 HZ2 LYS 77 2HZ LYS 77 0.642 6.092 2.426
272 HZ3 LYS 77 3HZ LYS 77 0.828 7.650 1.917
273 H PHE 78 H PHE 78 5.593 8.020 7.781
274 HA PHE 78 HA PHE 78 6.088 10.842 6.932
275 HB2 PHE 78 1HB PHE 78 7.977 8.801 8.172
276 HB3 PHE 78 2HB PHE 78 8.471 10.380 7.582
277 HD1 PHE 78 HD1 PHE 78 6.453 8.623 10.127
278 HD2 PHE 78 HD2 PHE 78 8.091 12.357 8.853
279 HE1 PHE 78 HE1 PHE 78 5.908 9.611 12.326
280 HE2 PHE 78 HE2 PHE 78 7.550 13.348 11.052
281 HZ PHE 78 HZ PHE 78 6.456 11.974 12.789
282 H LEU 79 H LEU 79 6.895 11.270 4.984
283 HA LEU 79 HA LEU 79 7.265 8.996 3.140
284 HB2 LEU 79 1HB LEU 79 7.215 12.000 2.684
285 HB3 LEU 79 2HB LEU 79 7.400 10.794 1.406
286 HG LEU 79 HG LEU 79 4.966 11.080 3.202
287 HD11 LEU 79 1HD1 LEU 79 3.883 11.955 1.181
288 HD12 LEU 79 2HD1 LEU 79 5.243 12.980 1.694
289 HD13 LEU 79 3HD1 LEU 79 5.433 11.873 0.313
290 HD21 LEU 79 1HD2 LEU 79 3.959 9.482 1.607
291 HD22 LEU 79 2HD2 LEU 79 5.512 9.364 0.745
292 HD23 LEU 79 3HD2 LEU 79 5.376 8.772 2.417
293 HA PRO 80 HA PRO 80 11.509 10.933 2.910
294 HB2 PRO 80 1HB PRO 80 12.250 13.142 4.237
295 HB3 PRO 80 2HB PRO 80 11.117 13.279 2.886
296 HG2 PRO 80 1HG PRO 80 10.534 13.237 5.876
297 HG3 PRO 80 2HG PRO 80 9.904 14.344 4.653
298 HD2 PRO 80 1HD PRO 80 8.562 12.060 5.522
299 HD3 PRO 80 2HD PRO 80 8.300 12.835 3.908
300 HA PRO 81 HA PRO 81 13.176 8.983 6.554
301 HB2 PRO 81 1HB PRO 81 15.752 8.659 5.758
302 HB3 PRO 81 2HB PRO 81 14.446 7.730 5.011
303 HG2 PRO 81 1HG PRO 81 15.804 10.267 4.008
304 HG3 PRO 81 2HG PRO 81 15.456 8.785 3.113
305 HD2 PRO 81 1HD PRO 81 13.810 10.990 3.020
306 HD3 PRO 81 2HD PRO 81 13.188 9.300 2.841
307 H GLY 82 H GLY 82 14.803 9.450 8.228
308 HA2 GLY 82 1HA GLY 82 16.722 11.233 8.586
309 HA3 GLY 82 2HA GLY 82 15.394 12.364 8.412
310 H SER 83 H SER 83 14.560 13.048 10.272
311 HA SER 83 HA SER 83 13.747 11.209 12.347
312 HB2 SER 83 1HB SER 83 15.196 11.944 14.125
313 HB3 SER 83 2HB SER 83 16.193 11.355 12.804
314 HG SER 83 HG SER 83 15.537 14.034 13.362
315 H TYR 84 H TYR 84 12.711 12.303 14.169
316 HA TYR 84 HA TYR 84 12.310 15.184 14.019
317 HB2 TYR 84 1HB TYR 84 10.744 14.374 12.249
318 HB3 TYR 84 2HB TYR 84 9.944 13.356 13.438
319 HD1 TYR 84 HD1 TYR 84 10.625 16.855 12.446
320 HD2 TYR 84 HD2 TYR 84 8.364 14.236 14.985
321 HE1 TYR 84 HE1 TYR 84 9.132 18.729 13.051
322 HE2 TYR 84 HE2 TYR 84 6.871 16.111 15.590
323 HH TYR 84 HH TYR 84 6.401 18.256 15.299
324 H THR 85 H THR 85 11.788 16.025 15.931
325 HA THR 85 HA THR 85 11.490 14.143 18.178
326 HB THR 85 HB THR 85 11.760 17.180 18.151
327 HG1 THR 85 HG1 THR 85 13.906 16.641 18.845
328 HG21 THR 85 1HG2 THR 85 12.244 16.920 20.552
329 HG22 THR 85 2HG2 THR 85 10.607 16.337 20.167
330 HG23 THR 85 3HG2 THR 85 11.927 15.174 20.432
331 H ALA 86 H ALA 86 9.568 13.424 18.717
332 HA ALA 86 HA ALA 86 7.176 14.931 17.935
333 HB1 ALA 86 1HB ALA 86 5.954 12.945 18.761
334 HB2 ALA 86 2HB ALA 86 7.235 12.498 17.608
335 HB3 ALA 86 3HB ALA 86 7.485 12.259 19.353
336 H GLN 87 H GLN 87 5.613 15.760 19.268
337 HA GLN 87 HA GLN 87 6.530 16.432 21.990
338 HB2 GLN 87 1HB GLN 87 5.537 18.180 20.502
339 HB3 GLN 87 2HB GLN 87 4.021 17.292 20.495
340 HG2 GLN 87 1HG GLN 87 3.798 19.056 22.053
341 HG3 GLN 87 2HG GLN 87 3.955 17.549 22.999
342 HE21 GLN 87 1HE2 GLN 87 6.396 19.025 24.967
343 HE22 GLN 87 2HE2 GLN 87 4.912 18.140 24.850
344 H VAL 88 H VAL 88 6.014 15.317 23.714
345 HA VAL 88 HA VAL 88 3.506 13.695 23.634
346 HB VAL 88 HB VAL 88 6.129 12.912 24.974
347 HG11 VAL 88 1HG1 VAL 88 5.039 10.748 25.312
348 HG12 VAL 88 2HG1 VAL 88 4.172 12.066 26.135
349 HG13 VAL 88 3HG1 VAL 88 3.536 11.396 24.613
350 HG21 VAL 88 1HG2 VAL 88 6.266 11.193 23.201
351 HG22 VAL 88 2HG2 VAL 88 4.802 11.863 22.440
352 HG23 VAL 88 3HG2 VAL 88 6.293 12.832 22.510
353 H GLY 89 H GLY 89 2.468 15.487 24.682
354 HA2 GLY 89 1HA GLY 89 1.632 16.547 26.571
355 HA3 GLY 89 2HA GLY 89 2.440 15.331 27.543
356 H GLN 90 H GLN 90 3.934 16.081 28.900
357 HA GLN 90 HA GLN 90 5.232 18.684 28.330
358 HB2 GLN 90 1HB GLN 90 5.320 16.906 30.802
359 HB3 GLN 90 2HB GLN 90 6.098 18.476 30.658
360 HG2 GLN 90 1HG GLN 90 3.121 17.965 30.485
361 HG3 GLN 90 2HG GLN 90 4.006 18.618 31.892
362 HE21 GLN 90 1HE2 GLN 90 2.499 21.146 29.280
363 HE22 GLN 90 2HE2 GLN 90 1.949 19.536 29.609
364 H GLN 91 H GLN 91 5.771 15.501 27.617
365 HA GLN 91 HA GLN 91 8.734 15.824 27.779
366 HB2 GLN 91 1HB GLN 91 7.082 13.296 27.382
367 HB3 GLN 91 2HB GLN 91 8.836 13.366 27.481
368 HG2 GLN 91 1HG GLN 91 6.933 14.168 29.693
369 HG3 GLN 91 2HG GLN 91 7.811 12.616 29.571
370 HE21 GLN 91 1HE2 GLN 91 9.497 15.577 31.538
371 HE22 GLN 91 2HE2 GLN 91 7.803 15.334 31.273
372 H SER 92 H SER 92 9.832 14.455 25.949
373 HA SER 92 HA SER 92 8.378 14.643 23.390
374 HB2 SER 92 1HB SER 92 10.065 15.985 22.300
375 HB3 SER 92 2HB SER 92 9.458 16.865 23.693
376 HG SER 92 HG SER 92 11.792 15.294 23.605
377 H LEU 93 H LEU 93 9.515 13.605 21.614
378 HA LEU 93 HA LEU 93 11.575 11.660 22.529
379 HB2 LEU 93 1HB LEU 93 9.382 10.546 22.653
380 HB3 LEU 93 2HB LEU 93 9.054 10.983 20.973
381 HG LEU 93 HG LEU 93 11.004 9.561 20.281
382 HD11 LEU 93 1HD1 LEU 93 11.914 7.979 21.923
383 HD12 LEU 93 2HD1 LEU 93 12.252 9.664 22.378
384 HD13 LEU 93 3HD1 LEU 93 10.962 8.763 23.205
385 HD21 LEU 93 1HD2 LEU 93 9.813 7.429 20.662
386 HD22 LEU 93 2HD2 LEU 93 8.830 8.205 21.929
387 HD23 LEU 93 3HD2 LEU 93 8.676 8.730 20.234
388 HA PRO 94 HA PRO 94 13.177 13.218 18.669
389 HB2 PRO 94 1HB PRO 94 15.734 12.307 19.023
390 HB3 PRO 94 2HB PRO 94 15.131 13.745 19.856
391 HG2 PRO 94 1HG PRO 94 15.320 10.882 20.887
392 HG3 PRO 94 2HG PRO 94 15.859 12.365 21.679
393 HD2 PRO 94 1HD PRO 94 13.450 11.237 22.274
394 HD3 PRO 94 2HD PRO 94 13.674 13.032 22.261
395 H VAL 95 H VAL 95 11.774 11.670 17.583
396 HA VAL 95 HA VAL 95 12.496 8.863 17.464
397 HB VAL 95 HB VAL 95 10.547 10.500 15.787
398 HG11 VAL 95 1HG1 VAL 95 9.553 8.349 15.181
399 HG12 VAL 95 2HG1 VAL 95 11.233 8.489 14.615
400 HG13 VAL 95 3HG1 VAL 95 10.857 7.504 16.048
401 HG21 VAL 95 1HG2 VAL 95 8.843 9.487 17.268
402 HG22 VAL 95 2HG2 VAL 95 10.132 8.684 18.197
403 HG23 VAL 95 3HG2 VAL 95 10.009 10.460 18.198
404 H LYS 96 H LYS 96 14.166 8.103 16.358
405 HA LYS 96 HA LYS 96 15.124 9.418 13.925
406 HB2 LYS 96 1HB LYS 96 16.652 8.218 15.509
407 HB3 LYS 96 2HB LYS 96 15.857 6.704 15.095
408 HG2 LYS 96 1HG LYS 96 16.610 6.900 12.778
409 HG3 LYS 96 2HG LYS 96 17.337 8.476 13.127
410 HD2 LYS 96 1HD LYS 96 18.825 7.389 14.805
411 HD3 LYS 96 2HD LYS 96 18.127 5.819 14.379
412 HE2 LYS 96 1HE LYS 96 18.899 6.119 12.042
413 HE3 LYS 96 2HE LYS 96 19.612 7.674 12.480
414 HZ1 LYS 96 1HZ LYS 96 21.235 5.925 12.489
415 HZ2 LYS 96 2HZ LYS 96 21.048 6.517 14.016
416 HZ3 LYS 96 3HZ LYS 96 20.382 5.063 13.607
417 H LEU 97 H LEU 97 14.705 8.940 11.869
418 HA LEU 97 HA LEU 97 12.618 6.847 11.433
419 HB2 LEU 97 1HB LEU 97 13.151 9.374 9.831
420 HB3 LEU 97 2HB LEU 97 11.859 8.207 9.535
421 HG LEU 97 HG LEU 97 12.106 9.897 12.048
422 HD11 LEU 97 1HD1 LEU 97 10.266 11.205 11.083
423 HD12 LEU 97 2HD1 LEU 97 11.728 11.281 10.072
424 HD13 LEU 97 3HD1 LEU 97 10.366 10.242 9.589
425 HD21 LEU 97 1HD2 LEU 97 9.784 9.133 12.416
426 HD22 LEU 97 2HD2 LEU 97 9.876 8.141 10.940
427 HD23 LEU 97 3HD2 LEU 97 10.907 7.755 12.339
428 H ASP 98 H ASP 98 14.065 5.159 11.040
429 HA ASP 98 HA ASP 98 16.054 5.319 8.945
430 HB2 ASP 98 1HB ASP 98 14.719 2.983 10.359
431 HB3 ASP 98 2HB ASP 98 15.934 2.767 9.108
432 HA PRO 99 HA PRO 99 13.736 5.080 5.322
433 HB2 PRO 99 1HB PRO 99 15.768 2.960 4.509
434 HB3 PRO 99 2HB PRO 99 15.202 4.361 3.591
435 HG2 PRO 99 1HG PRO 99 17.569 4.522 4.787
436 HG3 PRO 99 2HG PRO 99 16.472 5.903 4.891
437 HD2 PRO 99 1HD PRO 99 17.052 3.750 6.960
438 HD3 PRO 99 2HD PRO 99 16.829 5.530 7.196
439 H ASP 100 H ASP 100 11.838 4.053 5.123
440 HA ASP 100 HA ASP 100 10.247 2.389 5.076
441 HB2 ASP 100 1HB ASP 100 12.630 0.732 4.153
442 HB3 ASP 100 2HB ASP 100 10.949 0.230 4.030
443 H SER 101 H SER 101 10.574 2.778 7.545
444 HA SER 101 HA SER 101 10.690 0.067 8.731
445 HB2 SER 101 1HB SER 101 12.099 0.769 10.568
446 HB3 SER 101 2HB SER 101 12.939 1.069 9.055
447 HG SER 101 HG SER 101 12.468 3.187 9.199
448 H TYR 102 H TYR 102 9.644 -0.098 10.793
449 HA TYR 102 HA TYR 102 7.602 2.048 11.161
450 HB2 TYR 102 1HB TYR 102 7.514 -0.914 11.864
451 HB3 TYR 102 2HB TYR 102 6.269 0.244 12.306
452 HD1 TYR 102 HD1 TYR 102 8.046 -1.212 9.369
453 HD2 TYR 102 HD2 TYR 102 4.529 0.760 10.835
454 HE1 TYR 102 HE1 TYR 102 6.933 -1.579 7.193
455 HE2 TYR 102 HE2 TYR 102 3.416 0.393 8.660
456 HH TYR 102 HH TYR 102 3.600 -0.444 6.617
457 H TYR 103 H TYR 103 7.030 2.749 13.217
458 HA TYR 103 HA TYR 103 8.790 1.855 15.445
459 HB2 TYR 103 1HB TYR 103 8.264 4.756 14.679
460 HB3 TYR 103 2HB TYR 103 9.049 4.237 16.163
461 HD1 TYR 103 HD1 TYR 103 9.415 4.747 12.574
462 HD2 TYR 103 HD2 TYR 103 11.286 3.196 16.111
463 HE1 TYR 103 HE1 TYR 103 11.600 4.745 11.418
464 HE2 TYR 103 HE2 TYR 103 13.470 3.195 14.955
465 HH TYR 103 HH TYR 103 14.555 3.627 13.073
466 H THR 104 H THR 104 7.944 2.071 17.515
467 HA THR 104 HA THR 104 5.080 2.927 17.621
468 HB THR 104 HB THR 104 6.435 0.718 19.230
469 HG1 THR 104 HG1 THR 104 5.703 -0.489 17.666
470 HG21 THR 104 1HG2 THR 104 4.192 0.344 20.176
471 HG22 THR 104 2HG2 THR 104 4.780 1.977 20.565
472 HG23 THR 104 3HG2 THR 104 3.574 1.749 19.279
473 H LEU 105 H LEU 105 4.466 4.312 19.171
474 HA LEU 105 HA LEU 105 6.626 5.267 21.001
475 HB2 LEU 105 1HB LEU 105 5.877 6.853 19.177
476 HB3 LEU 105 2HB LEU 105 4.282 6.873 19.935
477 HG LEU 105 HG LEU 105 6.782 7.689 21.437
478 HD11 LEU 105 1HD1 LEU 105 6.212 10.006 20.859
479 HD12 LEU 105 2HD1 LEU 105 6.625 9.052 19.416
480 HD13 LEU 105 3HD1 LEU 105 4.923 9.420 19.781
481 HD21 LEU 105 1HD2 LEU 105 5.118 8.884 22.821
482 HD22 LEU 105 2HD2 LEU 105 3.812 8.282 21.771
483 HD23 LEU 105 3HD2 LEU 105 4.762 7.141 22.753
484 H VAL 106 H VAL 106 6.254 4.355 22.919
485 HA VAL 106 HA VAL 106 3.442 4.250 23.898
486 HB VAL 106 HB VAL 106 5.943 2.816 24.893
487 HG11 VAL 106 1HG1 VAL 106 4.409 1.533 26.302
488 HG12 VAL 106 2HG1 VAL 106 4.398 3.266 26.709
489 HG13 VAL 106 3HG1 VAL 106 3.059 2.562 25.769
490 HG21 VAL 106 1HG2 VAL 106 4.835 0.805 23.969
491 HG22 VAL 106 2HG2 VAL 106 3.505 1.818 23.363
492 HG23 VAL 106 3HG2 VAL 106 5.145 2.012 22.698
493 H SER 107 H SER 107 2.779 5.653 25.361
494 HA SER 107 HA SER 107 4.736 6.796 27.274
495 HB2 SER 107 1HB SER 107 4.058 9.073 26.807
496 HB3 SER 107 2HB SER 107 4.657 8.335 25.330
497 HG SER 107 HG SER 107 2.212 7.748 25.263
498 H GLN 108 H GLN 108 3.689 8.030 29.015
499 HA GLN 108 HA GLN 108 0.823 7.685 29.405
500 HB2 GLN 108 1HB GLN 108 0.939 6.227 31.352
501 HB3 GLN 108 2HB GLN 108 1.652 5.410 29.969
502 HG2 GLN 108 1HG GLN 108 3.906 6.012 30.794
503 HG3 GLN 108 2HG GLN 108 3.144 6.755 32.229
504 HE21 GLN 108 1HE2 GLN 108 3.265 3.771 33.973
505 HE22 GLN 108 2HE2 GLN 108 3.438 5.494 33.941
506 HA PRO 109 HA PRO 109 1.194 11.140 31.970
507 HB2 PRO 109 1HB PRO 109 -0.421 9.604 34.038
508 HB3 PRO 109 2HB PRO 109 -0.699 11.228 33.393
509 HG2 PRO 109 1HG PRO 109 -2.206 9.233 32.480
510 HG3 PRO 109 2HG PRO 109 -1.568 10.413 31.331
511 HD2 PRO 109 1HD PRO 109 -0.545 7.618 31.977
512 HD3 PRO 109 2HD PRO 109 -0.732 8.419 30.366
513 H GLY 110 H GLY 110 2.978 11.681 33.075
514 HA2 GLY 110 1HA GLY 110 4.284 11.837 35.042
515 HA3 GLY 110 2HA GLY 110 3.568 10.350 35.636
516 H GLY 111 H GLY 111 4.356 9.747 32.483
517 HA2 GLY 111 1HA GLY 111 7.064 8.695 33.231
518 HA3 GLY 111 2HA GLY 111 5.931 7.801 32.237
519 H LYS 112 H LYS 112 7.899 7.811 30.803
520 HA LYS 112 HA LYS 112 7.838 10.249 29.074
521 HB2 LYS 112 1HB LYS 112 10.228 8.491 29.756
522 HB3 LYS 112 2HB LYS 112 10.233 9.732 28.510
523 HG2 LYS 112 1HG LYS 112 9.734 11.444 30.246
524 HG3 LYS 112 2HG LYS 112 9.817 10.178 31.479
525 HD2 LYS 112 1HD LYS 112 12.154 9.690 30.821
526 HD3 LYS 112 2HD LYS 112 12.071 10.963 29.594
527 HE2 LYS 112 1HE LYS 112 11.646 12.640 31.362
528 HE3 LYS 112 2HE LYS 112 11.726 11.373 32.588
529 HZ1 LYS 112 1HZ LYS 112 13.796 12.539 32.391
530 HZ2 LYS 112 2HZ LYS 112 13.999 10.966 31.938
531 HZ3 LYS 112 3HZ LYS 112 13.926 12.151 30.793
532 HA PRO 113 HA PRO 113 6.791 7.626 25.797
533 HB2 PRO 113 1HB PRO 113 7.949 8.921 23.651
534 HB3 PRO 113 2HB PRO 113 6.521 9.541 24.488
535 HG2 PRO 113 1HG PRO 113 9.447 10.294 24.888
536 HG3 PRO 113 2HG PRO 113 8.058 11.367 24.701
537 HD2 PRO 113 1HD PRO 113 9.035 10.785 27.163
538 HD3 PRO 113 2HD PRO 113 7.254 10.960 26.889
539 H GLN 114 H GLN 114 7.576 5.766 24.940
540 HA GLN 114 HA GLN 114 10.545 5.460 24.803
541 HB2 GLN 114 1HB GLN 114 9.567 3.973 26.469
542 HB3 GLN 114 2HB GLN 114 8.368 3.397 25.320
543 HG2 GLN 114 1HG GLN 114 10.027 1.720 25.523
544 HG3 GLN 114 2HG GLN 114 10.255 2.489 23.926
545 HE21 GLN 114 1HE2 GLN 114 13.601 3.117 24.508
546 HE22 GLN 114 2HE2 GLN 114 12.314 2.752 23.410
547 H LEU 115 H LEU 115 11.436 5.221 22.893
548 HA LEU 115 HA LEU 115 9.730 4.746 20.544
549 HB2 LEU 115 1HB LEU 115 11.516 6.458 20.490
550 HB3 LEU 115 2HB LEU 115 12.727 5.202 20.777
551 HG LEU 115 HG LEU 115 12.094 4.153 18.595
552 HD11 LEU 115 1HD1 LEU 115 10.720 5.458 17.033
553 HD12 LEU 115 2HD1 LEU 115 9.798 4.980 18.478
554 HD13 LEU 115 3HD1 LEU 115 10.394 6.650 18.315
555 HD21 LEU 115 1HD2 LEU 115 13.185 5.893 17.219
556 HD22 LEU 115 2HD2 LEU 115 12.895 7.092 18.503
557 HD23 LEU 115 3HD2 LEU 115 13.995 5.722 18.796
558 H VAL 116 H VAL 116 9.295 2.809 19.781
559 HA VAL 116 HA VAL 116 11.288 0.634 20.252
560 HB VAL 116 HB VAL 116 8.315 0.428 19.609
561 HG11 VAL 116 1HG1 VAL 116 8.595 -1.960 20.055
562 HG12 VAL 116 2HG1 VAL 116 9.575 -1.421 18.671
563 HG13 VAL 116 3HG1 VAL 116 10.348 -1.719 20.247
564 HG21 VAL 116 1HG2 VAL 116 8.128 -0.404 21.930
565 HG22 VAL 116 2HG2 VAL 116 9.865 -0.108 22.174
566 HG23 VAL 116 3HG2 VAL 116 8.760 1.258 21.893
567 H ALA 117 H ALA 117 12.492 0.111 18.575
568 HA ALA 117 HA ALA 117 11.754 0.996 15.892
569 HB1 ALA 117 1HB ALA 117 13.932 0.023 15.237
570 HB2 ALA 117 2HB ALA 117 14.090 1.114 16.635
571 HB3 ALA 117 3HB ALA 117 14.115 -0.649 16.875
572 H GLU 118 H GLU 118 10.907 -0.130 14.277
573 HA GLU 118 HA GLU 118 10.810 -3.091 14.505
574 HB2 GLU 118 1HB GLU 118 8.378 -1.352 13.924
575 HB3 GLU 118 2HB GLU 118 8.418 -3.109 13.884
576 HG2 GLU 118 1HG GLU 118 8.917 -3.164 16.287
577 HG3 GLU 118 2HG GLU 118 8.910 -1.404 16.335
578 HA PRO 119 HA PRO 119 12.199 -1.525 10.382
579 HB2 PRO 119 1HB PRO 119 13.603 -4.207 10.709
580 HB3 PRO 119 2HB PRO 119 14.213 -2.718 9.977
581 HG2 PRO 119 1HG PRO 119 15.011 -3.320 12.440
582 HG3 PRO 119 2HG PRO 119 14.547 -1.653 12.083
583 HD2 PRO 119 1HD PRO 119 12.945 -3.833 13.476
584 HD3 PRO 119 2HD PRO 119 13.095 -2.081 13.900
Start of MODEL 10
1 H GLN 38 1H GLN 38 -1.418 -0.038 -1.788
2 HA GLN 38 HA GLN 38 -0.033 -0.789 -0.024
3 HB2 GLN 38 1HB GLN 38 1.443 0.599 -2.297
4 HB3 GLN 38 2HB GLN 38 2.125 -0.642 -1.255
5 HG2 GLN 38 1HG GLN 38 -0.253 -1.022 -3.085
6 HG3 GLN 38 2HG GLN 38 1.428 -1.523 -3.428
7 HE21 GLN 38 1HE2 GLN 38 -1.003 -4.061 -1.619
8 HE22 GLN 38 2HE2 GLN 38 -1.474 -2.715 -2.601
9 H ALA 39 H ALA 39 2.072 -0.341 1.077
10 HA ALA 39 HA ALA 39 1.805 2.105 2.598
11 HB1 ALA 39 1HB ALA 39 3.836 1.316 3.769
12 HB2 ALA 39 2HB ALA 39 2.611 0.031 3.635
13 HB3 ALA 39 3HB ALA 39 4.027 0.030 2.556
14 HA PRO 40 HA PRO 40 4.315 4.734 0.214
15 HB2 PRO 40 1HB PRO 40 5.050 6.579 2.112
16 HB3 PRO 40 2HB PRO 40 3.401 6.477 1.483
17 HG2 PRO 40 1HG PRO 40 4.545 5.276 4.039
18 HG3 PRO 40 2HG PRO 40 3.062 6.210 3.843
19 HD2 PRO 40 1HD PRO 40 3.008 3.491 3.915
20 HD3 PRO 40 2HD PRO 40 1.885 4.423 2.847
21 H LYS 41 H LYS 41 5.867 2.881 0.026
22 HA LYS 41 HA LYS 41 8.074 2.521 1.772
23 HB2 LYS 41 1HB LYS 41 7.451 0.951 -0.056
24 HB3 LYS 41 2HB LYS 41 7.968 2.138 -1.247
25 HG2 LYS 41 1HG LYS 41 10.273 1.994 -0.434
26 HG3 LYS 41 2HG LYS 41 9.774 0.858 0.827
27 HD2 LYS 41 1HD LYS 41 9.026 -0.739 -0.909
28 HD3 LYS 41 2HD LYS 41 9.518 0.399 -2.171
29 HE2 LYS 41 1HE LYS 41 11.855 0.280 -1.361
30 HE3 LYS 41 2HE LYS 41 11.363 -0.856 -0.103
31 HZ1 LYS 41 1HZ LYS 41 12.275 -1.979 -2.000
32 HZ2 LYS 41 2HZ LYS 41 10.684 -2.381 -1.827
33 HZ3 LYS 41 3HZ LYS 41 11.145 -1.319 -3.004
34 H GLY 42 H GLY 42 9.891 3.577 2.155
35 HA2 GLY 42 1HA GLY 42 11.756 4.963 1.339
36 HA3 GLY 42 2HA GLY 42 10.618 5.832 0.324
37 H SER 43 H SER 43 8.627 5.675 2.671
38 HA SER 43 HA SER 43 9.666 8.074 4.076
39 HB2 SER 43 1HB SER 43 7.397 8.492 4.721
40 HB3 SER 43 2HB SER 43 7.397 8.097 3.008
41 HG SER 43 HG SER 43 6.888 5.953 3.610
42 H ALA 44 H ALA 44 9.108 8.283 6.416
43 HA ALA 44 HA ALA 44 9.894 5.791 7.797
44 HB1 ALA 44 1HB ALA 44 10.222 7.264 9.758
45 HB2 ALA 44 2HB ALA 44 11.120 7.849 8.337
46 HB3 ALA 44 3HB ALA 44 9.600 8.640 8.822
47 H PHE 45 H PHE 45 8.796 4.933 9.576
48 HA PHE 45 HA PHE 45 5.905 5.695 9.672
49 HB2 PHE 45 1HB PHE 45 7.151 2.937 10.020
50 HB3 PHE 45 2HB PHE 45 5.447 3.309 10.224
51 HD1 PHE 45 HD1 PHE 45 8.176 2.911 7.809
52 HD2 PHE 45 HD2 PHE 45 4.017 3.751 8.320
53 HE1 PHE 45 HE1 PHE 45 7.803 2.517 5.398
54 HE2 PHE 45 HE2 PHE 45 3.639 3.356 5.909
55 HZ PHE 45 HZ PHE 45 5.534 2.739 4.447
56 H VAL 46 H VAL 46 5.046 6.184 11.576
57 HA VAL 46 HA VAL 46 6.576 5.429 14.027
58 HB VAL 46 HB VAL 46 5.229 8.102 13.453
59 HG11 VAL 46 1HG1 VAL 46 6.040 8.775 15.661
60 HG12 VAL 46 2HG1 VAL 46 4.879 7.433 15.758
61 HG13 VAL 46 3HG1 VAL 46 6.621 7.119 15.952
62 HG21 VAL 46 1HG2 VAL 46 7.527 8.997 13.685
63 HG22 VAL 46 2HG2 VAL 46 8.145 7.344 13.911
64 HG23 VAL 46 3HG2 VAL 46 7.427 7.821 12.355
65 H ARG 47 H ARG 47 5.413 4.686 15.711
66 HA ARG 47 HA ARG 47 2.438 4.853 15.492
67 HB2 ARG 47 1HB ARG 47 3.037 2.599 14.891
68 HB3 ARG 47 2HB ARG 47 4.145 2.462 16.248
69 HG2 ARG 47 1HG ARG 47 2.344 2.403 17.825
70 HG3 ARG 47 2HG ARG 47 1.158 2.821 16.565
71 HD2 ARG 47 1HD ARG 47 2.869 0.363 16.430
72 HD3 ARG 47 2HD ARG 47 1.293 0.404 17.252
73 HE ARG 47 HE ARG 47 0.835 1.462 14.736
74 HH11 ARG 47 1HH1 ARG 47 2.079 -1.561 16.028
75 HH12 ARG 47 2HH1 ARG 47 1.504 -2.517 14.682
76 HH21 ARG 47 1HH2 ARG 47 0.092 0.208 12.995
77 HH22 ARG 47 2HH2 ARG 47 0.377 -1.518 12.966
78 H ALA 48 H ALA 48 2.216 6.501 16.959
79 HA ALA 48 HA ALA 48 3.479 6.408 19.566
80 HB1 ALA 48 1HB ALA 48 1.986 8.311 20.090
81 HB2 ALA 48 2HB ALA 48 2.828 8.540 18.539
82 HB3 ALA 48 3HB ALA 48 1.120 8.043 18.559
83 H TYR 49 H TYR 49 2.507 6.095 21.589
84 HA TYR 49 HA TYR 49 -0.107 4.681 21.561
85 HB2 TYR 49 1HB TYR 49 1.652 2.937 21.492
86 HB3 TYR 49 2HB TYR 49 2.410 3.635 22.917
87 HD1 TYR 49 HD1 TYR 49 -0.653 1.943 21.674
88 HD2 TYR 49 HD2 TYR 49 1.644 3.136 25.098
89 HE1 TYR 49 HE1 TYR 49 -2.076 0.534 23.121
90 HE2 TYR 49 HE2 TYR 49 0.220 1.726 26.545
91 HH TYR 49 HH TYR 49 -2.533 -0.081 25.213
92 H ASN 50 H ASN 50 -1.421 5.162 23.190
93 HA ASN 50 HA ASN 50 -0.423 7.147 25.151
94 HB2 ASN 50 1HB ASN 50 -2.489 7.633 23.859
95 HB3 ASN 50 2HB ASN 50 -3.253 6.213 24.562
96 HD21 ASN 50 1HD2 ASN 50 -4.217 9.271 26.455
97 HD22 ASN 50 2HD2 ASN 50 -4.275 8.799 24.789
98 H ALA 51 H ALA 51 0.702 6.043 26.658
99 HA ALA 51 HA ALA 51 -0.555 3.664 27.882
100 HB1 ALA 51 1HB ALA 51 1.616 3.402 29.036
101 HB2 ALA 51 2HB ALA 51 1.820 3.527 27.273
102 HB3 ALA 51 3HB ALA 51 2.177 4.926 28.312
103 H GLY 52 H GLY 52 -1.191 6.719 28.252
104 HA2 GLY 52 1HA GLY 52 -0.881 6.902 31.197
105 HA3 GLY 52 2HA GLY 52 -1.412 8.186 30.128
106 H ASN 53 H ASN 53 -3.072 8.377 31.885
107 HA ASN 53 HA ASN 53 -5.326 6.475 31.393
108 HB2 ASN 53 1HB ASN 53 -4.597 8.022 33.900
109 HB3 ASN 53 2HB ASN 53 -6.125 7.178 33.678
110 HD21 ASN 53 1HD2 ASN 53 -2.992 5.205 35.060
111 HD22 ASN 53 2HD2 ASN 53 -3.169 6.928 35.025
112 H SER 54 H SER 54 -4.535 8.968 29.955
113 HA SER 54 HA SER 54 -7.227 10.115 29.892
114 HB2 SER 54 1HB SER 54 -6.595 12.384 30.377
115 HB3 SER 54 2HB SER 54 -6.103 11.377 31.730
116 HG SER 54 HG SER 54 -4.575 12.578 29.737
117 H GLU 55 H GLU 55 -7.460 11.741 28.161
118 HA GLU 55 HA GLU 55 -6.254 10.778 25.750
119 HB2 GLU 55 1HB GLU 55 -7.845 13.305 26.342
120 HB3 GLU 55 2HB GLU 55 -7.357 12.820 24.726
121 HG2 GLU 55 1HG GLU 55 -9.496 12.013 24.814
122 HG3 GLU 55 2HG GLU 55 -8.579 10.586 25.291
123 H LEU 56 H LEU 56 -4.612 11.473 24.514
124 HA LEU 56 HA LEU 56 -2.997 13.733 25.620
125 HB2 LEU 56 1HB LEU 56 -2.036 11.139 24.360
126 HB3 LEU 56 2HB LEU 56 -0.992 12.500 24.778
127 HG LEU 56 HG LEU 56 -2.603 10.841 26.749
128 HD11 LEU 56 1HD1 LEU 56 -0.405 9.991 27.435
129 HD12 LEU 56 2HD1 LEU 56 -0.761 9.599 25.736
130 HD13 LEU 56 3HD1 LEU 56 0.363 10.923 26.127
131 HD21 LEU 56 1HD2 LEU 56 -1.315 12.104 28.441
132 HD22 LEU 56 2HD2 LEU 56 -0.560 13.064 27.147
133 HD23 LEU 56 3HD2 LEU 56 -2.309 13.195 27.447
134 H ASP 57 H ASP 57 -1.926 15.077 24.176
135 HA ASP 57 HA ASP 57 -2.873 14.888 21.361
136 HB2 ASP 57 1HB ASP 57 -1.587 17.179 22.898
137 HB3 ASP 57 2HB ASP 57 -2.001 17.243 21.193
138 H VAL 58 H VAL 58 -1.587 14.149 19.836
139 HA VAL 58 HA VAL 58 1.322 13.926 20.496
140 HB VAL 58 HB VAL 58 -0.412 12.048 18.835
141 HG11 VAL 58 1HG1 VAL 58 1.562 10.606 18.776
142 HG12 VAL 58 2HG1 VAL 58 1.855 12.170 17.980
143 HG13 VAL 58 3HG1 VAL 58 2.506 11.864 19.609
144 HG21 VAL 58 1HG2 VAL 58 -0.011 10.455 20.688
145 HG22 VAL 58 2HG2 VAL 58 0.877 11.715 21.576
146 HG23 VAL 58 3HG2 VAL 58 -0.863 11.909 21.261
147 H SER 59 H SER 59 2.717 14.852 19.164
148 HA SER 59 HA SER 59 1.893 15.304 16.337
149 HB2 SER 59 1HB SER 59 1.566 17.418 17.528
150 HB3 SER 59 2HB SER 59 3.199 17.339 18.176
151 HG SER 59 HG SER 59 2.680 17.235 15.424
152 H VAL 60 H VAL 60 3.201 13.986 15.264
153 HA VAL 60 HA VAL 60 6.080 13.931 16.053
154 HB VAL 60 HB VAL 60 4.478 11.940 14.388
155 HG11 VAL 60 1HG1 VAL 60 6.461 10.519 14.561
156 HG12 VAL 60 2HG1 VAL 60 6.802 12.037 13.699
157 HG13 VAL 60 3HG1 VAL 60 7.331 11.832 15.387
158 HG21 VAL 60 1HG2 VAL 60 4.748 10.463 16.355
159 HG22 VAL 60 2HG2 VAL 60 5.560 11.781 17.231
160 HG23 VAL 60 3HG2 VAL 60 3.846 11.936 16.776
161 H GLY 61 H GLY 61 7.340 15.184 14.873
162 HA2 GLY 61 1HA GLY 61 8.334 16.145 13.006
163 HA3 GLY 61 2HA GLY 61 7.461 15.000 12.006
164 H SER 62 H SER 62 5.926 15.780 10.699
165 HA SER 62 HA SER 62 4.992 18.568 11.163
166 HB2 SER 62 1HB SER 62 4.362 18.563 8.818
167 HB3 SER 62 2HB SER 62 6.032 18.044 8.980
168 HG SER 62 HG SER 62 3.814 16.687 8.154
169 H THR 63 H THR 63 4.025 15.471 11.818
170 HA THR 63 HA THR 63 1.205 15.806 11.038
171 HB THR 63 HB THR 63 0.898 13.530 11.906
172 HG1 THR 63 HG1 THR 63 3.655 13.421 12.549
173 HG21 THR 63 1HG2 THR 63 2.463 12.334 10.422
174 HG22 THR 63 2HG2 THR 63 1.820 13.792 9.628
175 HG23 THR 63 3HG2 THR 63 3.467 13.795 10.298
176 H SER 64 H SER 64 -0.504 15.277 12.656
177 HA SER 64 HA SER 64 0.055 15.800 15.455
178 HB2 SER 64 1HB SER 64 0.223 18.092 14.619
179 HB3 SER 64 2HB SER 64 -1.328 17.944 13.810
180 HG SER 64 HG SER 64 -1.486 17.217 16.387
181 H LEU 65 H LEU 65 -1.353 14.657 16.568
182 HA LEU 65 HA LEU 65 -4.175 14.606 15.614
183 HB2 LEU 65 1HB LEU 65 -3.183 12.474 14.955
184 HB3 LEU 65 2HB LEU 65 -2.558 12.222 16.587
185 HG LEU 65 HG LEU 65 -4.913 12.091 17.421
186 HD11 LEU 65 1HD1 LEU 65 -6.715 11.825 15.775
187 HD12 LEU 65 2HD1 LEU 65 -5.963 13.436 15.674
188 HD13 LEU 65 3HD1 LEU 65 -5.570 12.192 14.463
189 HD21 LEU 65 1HD2 LEU 65 -5.332 9.850 16.466
190 HD22 LEU 65 2HD2 LEU 65 -4.168 10.186 15.163
191 HD23 LEU 65 3HD2 LEU 65 -3.607 10.070 16.848
192 H ASN 66 H ASN 66 -5.471 15.392 17.106
193 HA ASN 66 HA ASN 66 -4.451 15.567 19.885
194 HB2 ASN 66 1HB ASN 66 -6.771 16.958 18.505
195 HB3 ASN 66 2HB ASN 66 -6.312 17.200 20.184
196 HD21 ASN 66 1HD2 ASN 66 -4.775 19.682 17.709
197 HD22 ASN 66 2HD2 ASN 66 -6.353 18.969 17.752
198 H ASP 67 H ASP 67 -5.747 15.086 21.699
199 HA ASP 67 HA ASP 67 -7.269 13.870 22.922
200 HB2 ASP 67 1HB ASP 67 -8.927 14.074 20.377
201 HB3 ASP 67 2HB ASP 67 -9.535 13.510 21.927
202 H VAL 68 H VAL 68 -5.228 12.395 21.897
203 HA VAL 68 HA VAL 68 -6.223 9.978 20.637
204 HB VAL 68 HB VAL 68 -3.655 10.516 22.189
205 HG11 VAL 68 1HG1 VAL 68 -2.798 8.495 21.108
206 HG12 VAL 68 2HG1 VAL 68 -4.182 8.147 22.170
207 HG13 VAL 68 3HG1 VAL 68 -4.404 8.191 20.405
208 HG21 VAL 68 1HG2 VAL 68 -2.646 10.676 19.935
209 HG22 VAL 68 2HG2 VAL 68 -4.253 10.443 19.203
210 HG23 VAL 68 3HG2 VAL 68 -3.914 11.905 20.163
211 H ALA 69 H ALA 69 -7.261 8.330 21.534
212 HA ALA 69 HA ALA 69 -8.208 8.638 24.216
213 HB1 ALA 69 1HB ALA 69 -9.334 6.470 23.834
214 HB2 ALA 69 2HB ALA 69 -9.554 7.576 22.458
215 HB3 ALA 69 3HB ALA 69 -8.381 6.245 22.347
216 HA PRO 70 HA PRO 70 -5.277 6.678 26.759
217 HB2 PRO 70 1HB PRO 70 -7.715 5.301 27.955
218 HB3 PRO 70 2HB PRO 70 -6.389 6.129 28.783
219 HG2 PRO 70 1HG PRO 70 -8.701 7.414 28.524
220 HG3 PRO 70 2HG PRO 70 -7.202 8.297 28.215
221 HD2 PRO 70 1HD PRO 70 -9.151 7.074 26.222
222 HD3 PRO 70 2HD PRO 70 -8.308 8.675 26.160
223 H LEU 71 H LEU 71 -4.055 4.908 26.415
224 HA LEU 71 HA LEU 71 -3.416 2.775 25.826
225 HB2 LEU 71 1HB LEU 71 -6.342 2.046 26.201
226 HB3 LEU 71 2HB LEU 71 -4.976 0.926 26.150
227 HG LEU 71 HG LEU 71 -5.522 2.987 28.316
228 HD11 LEU 71 1HD1 LEU 71 -5.929 1.010 29.709
229 HD12 LEU 71 2HD1 LEU 71 -7.065 1.094 28.340
230 HD13 LEU 71 3HD1 LEU 71 -5.694 -0.039 28.291
231 HD21 LEU 71 1HD2 LEU 71 -3.606 1.922 29.455
232 HD22 LEU 71 2HD2 LEU 71 -3.335 0.886 28.034
233 HD23 LEU 71 3HD2 LEU 71 -3.107 2.647 27.909
234 H GLY 72 H GLY 72 -4.726 4.791 23.910
235 HA2 GLY 72 1HA GLY 72 -5.357 2.915 21.684
236 HA3 GLY 72 2HA GLY 72 -5.599 4.651 21.667
237 H SER 73 H SER 73 -4.480 4.277 19.521
238 HA SER 73 HA SER 73 -1.609 4.859 19.856
239 HB2 SER 73 1HB SER 73 -0.872 3.143 18.320
240 HB3 SER 73 2HB SER 73 -1.739 2.385 19.647
241 HG SER 73 HG SER 73 -2.496 2.789 17.002
242 H SER 74 H SER 74 -0.590 5.562 17.834
243 HA SER 74 HA SER 74 -2.525 6.499 15.784
244 HB2 SER 74 1HB SER 74 -2.325 8.340 17.388
245 HB3 SER 74 2HB SER 74 -0.572 8.283 17.276
246 HG SER 74 HG SER 74 -1.294 8.441 14.854
247 H ASP 75 H ASP 75 -1.778 5.490 14.042
248 HA ASP 75 HA ASP 75 1.095 5.211 13.554
249 HB2 ASP 75 1HB ASP 75 -1.381 4.502 11.942
250 HB3 ASP 75 2HB ASP 75 0.246 4.301 11.307
251 H PHE 76 H PHE 76 2.364 6.349 12.211
252 HA PHE 76 HA PHE 76 1.077 8.650 10.795
253 HB2 PHE 76 1HB PHE 76 3.820 8.546 12.117
254 HB3 PHE 76 2HB PHE 76 3.194 9.900 11.190
255 HD1 PHE 76 HD1 PHE 76 3.263 8.253 14.391
256 HD2 PHE 76 HD2 PHE 76 1.170 11.138 12.035
257 HE1 PHE 76 HE1 PHE 76 2.238 9.180 16.441
258 HE2 PHE 76 HE2 PHE 76 0.145 12.069 14.083
259 HZ PHE 76 HZ PHE 76 0.677 11.087 16.286
260 H LYS 77 H LYS 77 0.939 7.871 8.764
261 HA LYS 77 HA LYS 77 3.395 6.752 7.526
262 HB2 LYS 77 1HB LYS 77 0.535 6.961 6.503
263 HB3 LYS 77 2HB LYS 77 1.872 6.285 5.584
264 HG2 LYS 77 1HG LYS 77 2.165 4.529 7.301
265 HG3 LYS 77 2HG LYS 77 0.803 5.205 8.207
266 HD2 LYS 77 1HD LYS 77 -0.684 4.806 6.266
267 HD3 LYS 77 2HD LYS 77 0.678 4.119 5.370
268 HE2 LYS 77 1HE LYS 77 0.912 2.333 7.037
269 HE3 LYS 77 2HE LYS 77 -0.389 3.034 8.001
270 HZ1 LYS 77 1HZ LYS 77 -1.167 1.230 6.649
271 HZ2 LYS 77 2HZ LYS 77 -1.885 2.635 6.167
272 HZ3 LYS 77 3HZ LYS 77 -0.669 1.978 5.267
273 H PHE 78 H PHE 78 3.782 7.447 5.207
274 HA PHE 78 HA PHE 78 4.587 9.124 3.851
275 HB2 PHE 78 1HB PHE 78 2.074 10.583 4.764
276 HB3 PHE 78 2HB PHE 78 3.043 10.989 3.356
277 HD1 PHE 78 HD1 PHE 78 0.558 8.717 4.745
278 HD2 PHE 78 HD2 PHE 78 3.055 9.535 1.376
279 HE1 PHE 78 HE1 PHE 78 -0.796 7.172 3.369
280 HE2 PHE 78 HE2 PHE 78 1.702 7.995 -0.005
281 HZ PHE 78 HZ PHE 78 -0.223 6.812 0.994
282 H LEU 79 H LEU 79 5.723 9.065 6.388
283 HA LEU 79 HA LEU 79 5.919 11.942 7.146
284 HB2 LEU 79 1HB LEU 79 5.236 10.402 8.945
285 HB3 LEU 79 2HB LEU 79 6.694 9.439 8.688
286 HG LEU 79 HG LEU 79 8.058 11.448 9.351
287 HD11 LEU 79 1HD1 LEU 79 6.901 13.277 10.511
288 HD12 LEU 79 2HD1 LEU 79 6.407 13.163 8.807
289 HD13 LEU 79 3HD1 LEU 79 5.331 12.551 10.087
290 HD21 LEU 79 1HD2 LEU 79 7.554 11.197 11.756
291 HD22 LEU 79 2HD2 LEU 79 5.992 10.443 11.352
292 HD23 LEU 79 3HD2 LEU 79 7.516 9.624 10.926
293 HA PRO 80 HA PRO 80 9.730 11.925 4.923
294 HB2 PRO 80 1HB PRO 80 10.030 14.424 6.642
295 HB3 PRO 80 2HB PRO 80 10.388 14.212 4.923
296 HG2 PRO 80 1HG PRO 80 8.117 15.422 5.586
297 HG3 PRO 80 2HG PRO 80 8.086 14.210 4.302
298 HD2 PRO 80 1HD PRO 80 7.252 13.944 7.214
299 HD3 PRO 80 2HD PRO 80 6.450 13.285 5.731
300 HA PRO 81 HA PRO 81 12.081 9.975 8.195
301 HB2 PRO 81 1HB PRO 81 14.130 9.995 5.960
302 HB3 PRO 81 2HB PRO 81 13.632 8.658 7.002
303 HG2 PRO 81 1HG PRO 81 12.710 8.729 4.503
304 HG3 PRO 81 2HG PRO 81 11.607 8.291 5.810
305 HD2 PRO 81 1HD PRO 81 11.939 10.976 4.403
306 HD3 PRO 81 2HD PRO 81 10.416 10.104 4.847
307 H GLY 82 H GLY 82 13.836 10.606 9.505
308 HA2 GLY 82 1HA GLY 82 15.965 12.217 9.181
309 HA3 GLY 82 2HA GLY 82 14.689 13.421 9.155
310 H SER 83 H SER 83 16.530 13.649 11.100
311 HA SER 83 HA SER 83 15.531 12.387 13.558
312 HB2 SER 83 1HB SER 83 17.917 12.770 13.354
313 HB3 SER 83 2HB SER 83 17.662 14.479 13.032
314 HG SER 83 HG SER 83 16.386 14.019 15.214
315 H TYR 84 H TYR 84 13.752 13.070 14.499
316 HA TYR 84 HA TYR 84 13.245 16.013 14.567
317 HB2 TYR 84 1HB TYR 84 11.207 13.808 14.056
318 HB3 TYR 84 2HB TYR 84 10.796 15.487 14.380
319 HD1 TYR 84 HD1 TYR 84 11.968 13.095 11.913
320 HD2 TYR 84 HD2 TYR 84 11.430 17.267 12.762
321 HE1 TYR 84 HE1 TYR 84 12.172 13.612 9.505
322 HE2 TYR 84 HE2 TYR 84 11.633 17.782 10.354
323 HH TYR 84 HH TYR 84 12.144 15.205 7.956
324 H THR 85 H THR 85 12.346 16.852 16.406
325 HA THR 85 HA THR 85 12.275 15.041 18.750
326 HB THR 85 HB THR 85 12.032 18.074 18.576
327 HG1 THR 85 HG1 THR 85 14.171 17.735 19.708
328 HG21 THR 85 1HG2 THR 85 12.325 18.003 21.021
329 HG22 THR 85 2HG2 THR 85 10.851 17.136 20.531
330 HG23 THR 85 3HG2 THR 85 12.313 16.225 20.975
331 H ALA 86 H ALA 86 10.430 13.873 18.620
332 HA ALA 86 HA ALA 86 7.921 15.140 17.848
333 HB1 ALA 86 1HB ALA 86 6.950 12.900 18.248
334 HB2 ALA 86 2HB ALA 86 8.391 12.818 17.209
335 HB3 ALA 86 3HB ALA 86 8.503 12.357 18.923
336 H GLN 87 H GLN 87 6.139 15.569 19.085
337 HA GLN 87 HA GLN 87 6.552 15.392 22.040
338 HB2 GLN 87 1HB GLN 87 6.318 17.708 21.246
339 HB3 GLN 87 2HB GLN 87 4.818 17.306 20.424
340 HG2 GLN 87 1HG GLN 87 4.289 18.437 22.452
341 HG3 GLN 87 2HG GLN 87 3.820 16.723 22.639
342 HE21 GLN 87 1HE2 GLN 87 5.459 16.627 25.695
343 HE22 GLN 87 2HE2 GLN 87 4.022 16.351 24.770
344 H VAL 88 H VAL 88 5.629 13.601 22.760
345 HA VAL 88 HA VAL 88 3.026 12.794 21.543
346 HB VAL 88 HB VAL 88 5.022 11.086 23.084
347 HG11 VAL 88 1HG1 VAL 88 3.713 9.204 22.233
348 HG12 VAL 88 2HG1 VAL 88 2.741 10.280 23.263
349 HG13 VAL 88 3HG1 VAL 88 2.561 10.340 21.492
350 HG21 VAL 88 1HG2 VAL 88 5.572 10.124 20.870
351 HG22 VAL 88 2HG2 VAL 88 4.480 11.297 20.095
352 HG23 VAL 88 3HG2 VAL 88 5.945 11.864 20.928
353 H GLY 89 H GLY 89 1.591 13.919 22.806
354 HA2 GLY 89 1HA GLY 89 0.191 14.201 24.645
355 HA3 GLY 89 2HA GLY 89 0.988 12.844 25.419
356 H GLN 90 H GLN 90 2.033 13.312 27.241
357 HA GLN 90 HA GLN 90 2.785 16.150 27.727
358 HB2 GLN 90 1HB GLN 90 2.437 13.839 29.681
359 HB3 GLN 90 2HB GLN 90 2.838 15.493 30.123
360 HG2 GLN 90 1HG GLN 90 0.285 14.604 28.765
361 HG3 GLN 90 2HG GLN 90 0.484 15.009 30.494
362 HE21 GLN 90 1HE2 GLN 90 -0.646 17.859 28.046
363 HE22 GLN 90 2HE2 GLN 90 -0.906 16.155 27.869
364 H GLN 91 H GLN 91 4.229 13.567 26.460
365 HA GLN 91 HA GLN 91 6.833 14.195 27.775
366 HB2 GLN 91 1HB GLN 91 6.081 12.021 28.617
367 HB3 GLN 91 2HB GLN 91 5.781 11.451 26.982
368 HG2 GLN 91 1HG GLN 91 7.825 10.498 27.743
369 HG3 GLN 91 2HG GLN 91 8.222 11.721 26.502
370 HE21 GLN 91 1HE2 GLN 91 10.441 13.389 28.560
371 HE22 GLN 91 2HE2 GLN 91 9.918 12.937 26.971
372 H SER 92 H SER 92 8.102 15.146 26.358
373 HA SER 92 HA SER 92 7.910 14.765 23.509
374 HB2 SER 92 1HB SER 92 8.878 16.791 24.430
375 HB3 SER 92 2HB SER 92 10.117 15.872 25.271
376 HG SER 92 HG SER 92 9.790 15.621 22.513
377 H LEU 93 H LEU 93 8.795 13.322 22.187
378 HA LEU 93 HA LEU 93 10.841 11.470 23.316
379 HB2 LEU 93 1HB LEU 93 8.407 10.676 21.677
380 HB3 LEU 93 2HB LEU 93 9.705 9.588 22.177
381 HG LEU 93 HG LEU 93 7.835 11.041 24.082
382 HD11 LEU 93 1HD1 LEU 93 6.805 8.834 24.387
383 HD12 LEU 93 2HD1 LEU 93 6.649 9.407 22.709
384 HD13 LEU 93 3HD1 LEU 93 7.858 8.167 23.117
385 HD21 LEU 93 1HD2 LEU 93 8.811 9.493 25.743
386 HD22 LEU 93 2HD2 LEU 93 9.895 8.835 24.494
387 HD23 LEU 93 3HD2 LEU 93 10.065 10.528 25.016
388 HA PRO 94 HA PRO 94 12.214 13.094 19.283
389 HB2 PRO 94 1HB PRO 94 14.857 13.402 19.997
390 HB3 PRO 94 2HB PRO 94 13.630 14.628 20.343
391 HG2 PRO 94 1HG PRO 94 14.715 12.442 22.168
392 HG3 PRO 94 2HG PRO 94 14.500 14.157 22.524
393 HD2 PRO 94 1HD PRO 94 12.647 12.328 23.301
394 HD3 PRO 94 2HD PRO 94 12.154 13.976 22.743
395 H VAL 95 H VAL 95 13.239 11.930 17.657
396 HA VAL 95 HA VAL 95 14.813 9.548 18.235
397 HB VAL 95 HB VAL 95 12.520 8.720 18.720
398 HG11 VAL 95 1HG1 VAL 95 10.855 8.579 16.930
399 HG12 VAL 95 2HG1 VAL 95 11.260 10.265 17.334
400 HG13 VAL 95 3HG1 VAL 95 11.927 9.515 15.862
401 HG21 VAL 95 1HG2 VAL 95 12.567 6.797 17.162
402 HG22 VAL 95 2HG2 VAL 95 13.694 7.681 16.107
403 HG23 VAL 95 3HG2 VAL 95 14.200 7.196 17.742
404 H LYS 96 H LYS 96 15.987 8.897 16.501
405 HA LYS 96 HA LYS 96 15.808 10.459 14.039
406 HB2 LYS 96 1HB LYS 96 17.992 9.724 14.967
407 HB3 LYS 96 2HB LYS 96 17.531 8.044 14.736
408 HG2 LYS 96 1HG LYS 96 17.526 8.301 12.338
409 HG3 LYS 96 2HG LYS 96 17.743 10.050 12.476
410 HD2 LYS 96 1HD LYS 96 19.942 9.676 13.576
411 HD3 LYS 96 2HD LYS 96 19.726 7.931 13.378
412 HE2 LYS 96 1HE LYS 96 19.624 9.831 11.021
413 HE3 LYS 96 2HE LYS 96 21.144 9.159 11.615
414 HZ1 LYS 96 1HZ LYS 96 20.227 7.844 9.849
415 HZ2 LYS 96 2HZ LYS 96 20.251 6.962 11.242
416 HZ3 LYS 96 3HZ LYS 96 18.830 7.592 10.688
417 H LEU 97 H LEU 97 14.573 10.049 12.368
418 HA LEU 97 HA LEU 97 13.200 7.408 12.308
419 HB2 LEU 97 1HB LEU 97 12.442 10.043 10.998
420 HB3 LEU 97 2HB LEU 97 11.491 8.555 10.951
421 HG LEU 97 HG LEU 97 12.125 10.134 13.469
422 HD11 LEU 97 1HD1 LEU 97 9.769 10.811 13.358
423 HD12 LEU 97 2HD1 LEU 97 10.685 11.384 11.944
424 HD13 LEU 97 3HD1 LEU 97 9.603 9.979 11.794
425 HD21 LEU 97 1HD2 LEU 97 10.414 8.655 14.468
426 HD22 LEU 97 2HD2 LEU 97 10.257 7.791 12.919
427 HD23 LEU 97 3HD2 LEU 97 11.783 7.710 13.832
428 H ASP 98 H ASP 98 14.583 6.122 11.162
429 HA ASP 98 HA ASP 98 15.562 6.936 8.537
430 HB2 ASP 98 1HB ASP 98 15.471 4.251 9.964
431 HB3 ASP 98 2HB ASP 98 16.155 4.469 8.359
432 HA PRO 99 HA PRO 99 12.103 5.887 6.147
433 HB2 PRO 99 1HB PRO 99 13.282 5.079 3.787
434 HB3 PRO 99 2HB PRO 99 13.252 6.768 4.311
435 HG2 PRO 99 1HG PRO 99 15.468 4.701 4.645
436 HG3 PRO 99 2HG PRO 99 15.601 6.359 4.055
437 HD2 PRO 99 1HD PRO 99 16.184 5.754 6.634
438 HD3 PRO 99 2HD PRO 99 15.358 7.306 6.209
439 H ASP 100 H ASP 100 10.841 4.120 5.489
440 HA ASP 100 HA ASP 100 10.114 1.937 5.506
441 HB2 ASP 100 1HB ASP 100 13.012 1.398 4.741
442 HB3 ASP 100 2HB ASP 100 11.723 0.205 4.667
443 H SER 101 H SER 101 10.662 2.963 7.999
444 HA SER 101 HA SER 101 11.190 0.453 9.439
445 HB2 SER 101 1HB SER 101 13.419 1.484 9.306
446 HB3 SER 101 2HB SER 101 12.785 2.979 9.978
447 HG SER 101 HG SER 101 12.415 0.556 11.306
448 H TYR 102 H TYR 102 10.274 0.360 11.483
449 HA TYR 102 HA TYR 102 8.198 2.461 11.869
450 HB2 TYR 102 1HB TYR 102 8.298 -0.461 12.718
451 HB3 TYR 102 2HB TYR 102 7.038 0.657 13.218
452 HD1 TYR 102 HD1 TYR 102 8.624 -0.886 10.226
453 HD2 TYR 102 HD2 TYR 102 5.185 1.096 11.851
454 HE1 TYR 102 HE1 TYR 102 7.363 -1.384 8.160
455 HE2 TYR 102 HE2 TYR 102 3.922 0.599 9.785
456 HH TYR 102 HH TYR 102 5.425 -1.169 7.090
457 H TYR 103 H TYR 103 8.076 3.654 13.639
458 HA TYR 103 HA TYR 103 9.846 2.899 15.927
459 HB2 TYR 103 1HB TYR 103 9.311 5.691 14.832
460 HB3 TYR 103 2HB TYR 103 10.209 5.339 16.302
461 HD1 TYR 103 HD1 TYR 103 10.230 5.095 12.622
462 HD2 TYR 103 HD2 TYR 103 12.469 4.535 16.239
463 HE1 TYR 103 HE1 TYR 103 12.310 4.890 11.304
464 HE2 TYR 103 HE2 TYR 103 14.548 4.330 14.922
465 HH TYR 103 HH TYR 103 15.457 4.368 12.901
466 H THR 104 H THR 104 8.544 2.192 17.458
467 HA THR 104 HA THR 104 5.895 3.395 17.851
468 HB THR 104 HB THR 104 7.358 1.230 19.422
469 HG1 THR 104 HG1 THR 104 6.796 0.179 17.658
470 HG21 THR 104 1HG2 THR 104 5.140 0.751 20.383
471 HG22 THR 104 2HG2 THR 104 5.663 2.405 20.780
472 HG23 THR 104 3HG2 THR 104 4.456 2.137 19.503
473 H LEU 105 H LEU 105 5.405 4.995 19.158
474 HA LEU 105 HA LEU 105 7.483 5.849 21.124
475 HB2 LEU 105 1HB LEU 105 5.358 7.512 19.729
476 HB3 LEU 105 2HB LEU 105 6.538 8.117 20.893
477 HG LEU 105 HG LEU 105 7.185 6.970 18.155
478 HD11 LEU 105 1HD1 LEU 105 7.765 9.294 17.609
479 HD12 LEU 105 2HD1 LEU 105 6.050 9.131 18.051
480 HD13 LEU 105 3HD1 LEU 105 7.209 9.809 19.216
481 HD21 LEU 105 1HD2 LEU 105 9.466 7.773 18.657
482 HD22 LEU 105 2HD2 LEU 105 8.936 8.269 20.282
483 HD23 LEU 105 3HD2 LEU 105 8.945 6.547 19.838
484 H VAL 106 H VAL 106 6.752 4.594 22.838
485 HA VAL 106 HA VAL 106 3.985 4.880 23.760
486 HB VAL 106 HB VAL 106 6.419 3.578 25.056
487 HG11 VAL 106 1HG1 VAL 106 4.809 2.485 26.541
488 HG12 VAL 106 2HG1 VAL 106 4.796 4.254 26.729
489 HG13 VAL 106 3HG1 VAL 106 3.496 3.446 25.821
490 HG21 VAL 106 1HG2 VAL 106 5.334 1.471 24.338
491 HG22 VAL 106 2HG2 VAL 106 4.042 2.407 23.548
492 HG23 VAL 106 3HG2 VAL 106 5.714 2.509 22.941
493 H SER 107 H SER 107 3.291 6.598 24.810
494 HA SER 107 HA SER 107 5.229 8.057 26.557
495 HB2 SER 107 1HB SER 107 4.426 9.454 24.747
496 HB3 SER 107 2HB SER 107 2.756 9.025 25.089
497 HG SER 107 HG SER 107 3.657 11.056 25.938
498 H GLN 108 H GLN 108 4.808 8.329 28.659
499 HA GLN 108 HA GLN 108 2.126 7.579 29.685
500 HB2 GLN 108 1HB GLN 108 3.573 5.517 29.686
501 HB3 GLN 108 2HB GLN 108 4.704 6.353 30.741
502 HG2 GLN 108 1HG GLN 108 3.081 6.488 32.504
503 HG3 GLN 108 2HG GLN 108 1.802 5.858 31.429
504 HE21 GLN 108 1HE2 GLN 108 2.439 2.540 32.170
505 HE22 GLN 108 2HE2 GLN 108 1.380 3.755 31.537
506 HA PRO 109 HA PRO 109 3.490 11.401 31.673
507 HB2 PRO 109 1HB PRO 109 0.530 11.280 32.338
508 HB3 PRO 109 2HB PRO 109 1.494 12.663 31.800
509 HG2 PRO 109 1HG PRO 109 -0.087 11.460 30.028
510 HG3 PRO 109 2HG PRO 109 1.543 11.928 29.537
511 HD2 PRO 109 1HD PRO 109 0.507 9.191 30.387
512 HD3 PRO 109 2HD PRO 109 1.601 9.617 29.008
513 H GLY 110 H GLY 110 4.473 11.138 33.584
514 HA2 GLY 110 1HA GLY 110 4.566 10.907 35.930
515 HA3 GLY 110 2HA GLY 110 2.941 10.246 35.930
516 H GLY 111 H GLY 111 4.713 8.727 33.520
517 HA2 GLY 111 1HA GLY 111 5.552 6.516 35.361
518 HA3 GLY 111 2HA GLY 111 4.665 6.196 33.881
519 H LYS 112 H LYS 112 6.052 5.223 32.529
520 HA LYS 112 HA LYS 112 8.605 6.629 31.925
521 HB2 LYS 112 1HB LYS 112 9.114 4.783 33.510
522 HB3 LYS 112 2HB LYS 112 8.343 3.635 32.424
523 HG2 LYS 112 1HG LYS 112 10.035 4.083 30.706
524 HG3 LYS 112 2HG LYS 112 10.793 5.293 31.752
525 HD2 LYS 112 1HD LYS 112 11.252 3.552 33.445
526 HD3 LYS 112 2HD LYS 112 10.484 2.339 32.410
527 HE2 LYS 112 1HE LYS 112 12.171 2.768 30.652
528 HE3 LYS 112 2HE LYS 112 12.938 3.979 31.682
529 HZ1 LYS 112 1HZ LYS 112 14.050 1.874 31.820
530 HZ2 LYS 112 2HZ LYS 112 13.388 2.250 33.284
531 HZ3 LYS 112 3HZ LYS 112 12.672 1.118 32.322
532 HA PRO 113 HA PRO 113 6.942 5.851 27.915
533 HB2 PRO 113 1HB PRO 113 8.716 7.366 26.498
534 HB3 PRO 113 2HB PRO 113 7.455 8.105 27.494
535 HG2 PRO 113 1HG PRO 113 10.384 7.605 28.180
536 HG3 PRO 113 2HG PRO 113 9.450 9.092 28.384
537 HD2 PRO 113 1HD PRO 113 9.834 7.335 30.447
538 HD3 PRO 113 2HD PRO 113 8.311 8.296 30.280
539 H GLN 114 H GLN 114 7.784 4.898 25.873
540 HA GLN 114 HA GLN 114 10.369 3.488 26.109
541 HB2 GLN 114 1HB GLN 114 8.777 1.944 27.172
542 HB3 GLN 114 2HB GLN 114 7.706 2.050 25.784
543 HG2 GLN 114 1HG GLN 114 8.875 0.001 25.613
544 HG3 GLN 114 2HG GLN 114 9.572 1.091 24.383
545 HE21 GLN 114 1HE2 GLN 114 12.802 0.619 25.516
546 HE22 GLN 114 2HE2 GLN 114 11.701 0.958 24.223
547 H LEU 115 H LEU 115 11.416 3.649 24.271
548 HA LEU 115 HA LEU 115 9.845 3.964 21.762
549 HB2 LEU 115 1HB LEU 115 12.662 4.658 22.584
550 HB3 LEU 115 2HB LEU 115 12.272 4.436 20.876
551 HG LEU 115 HG LEU 115 10.451 6.209 21.209
552 HD11 LEU 115 1HD1 LEU 115 10.776 7.717 23.118
553 HD12 LEU 115 2HD1 LEU 115 10.340 6.076 23.646
554 HD13 LEU 115 3HD1 LEU 115 12.026 6.632 23.764
555 HD21 LEU 115 1HD2 LEU 115 12.102 8.037 21.012
556 HD22 LEU 115 2HD2 LEU 115 13.375 6.956 21.629
557 HD23 LEU 115 3HD2 LEU 115 12.603 6.617 20.061
558 H VAL 116 H VAL 116 9.747 2.429 20.273
559 HA VAL 116 HA VAL 116 11.743 0.214 20.415
560 HB VAL 116 HB VAL 116 8.747 -0.082 19.922
561 HG11 VAL 116 1HG1 VAL 116 9.201 -2.487 19.894
562 HG12 VAL 116 2HG1 VAL 116 10.045 -1.632 18.579
563 HG13 VAL 116 3HG1 VAL 116 10.944 -2.158 20.022
564 HG21 VAL 116 1HG2 VAL 116 8.779 -1.341 22.053
565 HG22 VAL 116 2HG2 VAL 116 10.509 -0.970 22.245
566 HG23 VAL 116 3HG2 VAL 116 9.307 0.342 22.292
567 H ALA 117 H ALA 117 12.848 0.087 18.598
568 HA ALA 117 HA ALA 117 11.599 1.054 16.087
569 HB1 ALA 117 1HB ALA 117 13.889 0.916 15.158
570 HB2 ALA 117 2HB ALA 117 13.831 1.928 16.622
571 HB3 ALA 117 3HB ALA 117 14.471 0.268 16.708
572 H GLU 118 H GLU 118 11.018 -0.211 14.456
573 HA GLU 118 HA GLU 118 11.799 -3.088 14.587
574 HB2 GLU 118 1HB GLU 118 9.013 -1.977 14.057
575 HB3 GLU 118 2HB GLU 118 9.475 -3.658 13.823
576 HG2 GLU 118 1HG GLU 118 10.028 -3.824 16.231
577 HG3 GLU 118 2HG GLU 118 9.505 -2.155 16.449
578 HA PRO 119 HA PRO 119 12.939 -2.779 10.400
579 HB2 PRO 119 1HB PRO 119 11.433 -5.409 10.110
580 HB3 PRO 119 2HB PRO 119 13.062 -4.994 9.562
581 HG2 PRO 119 1HG PRO 119 12.815 -6.456 11.767
582 HG3 PRO 119 2HG PRO 119 13.988 -5.135 11.754
583 HD2 PRO 119 1HD PRO 119 11.191 -5.202 12.954
584 HD3 PRO 119 2HD PRO 119 12.713 -4.517 13.649
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