Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
637386 | 6d8h RC | 30459 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 ALA 1 H1 ALA 1 19.619 14.210 19.958
2 H2 ALA 1 H2 ALA 1 19.631 13.150 21.204
3 H3 ALA 1 H3 ALA 1 21.066 13.728 20.611
4 HA ALA 1 HA ALA 1 18.985 15.309 21.930
5 HB1 ALA 1 HB1 ALA 1 20.160 13.861 23.557
6 HB2 ALA 1 HB2 ALA 1 21.722 14.496 22.997
7 HB3 ALA 1 HB3 ALA 1 20.564 15.566 23.804
8 H PHE 2 H PHE 2 19.284 17.495 21.992
9 HA PHE 2 HA PHE 2 21.184 18.636 20.028
10 HB2 PHE 2 HB2 PHE 2 19.007 20.072 21.564
11 HB3 PHE 2 HB3 PHE 2 19.792 20.562 20.067
12 HD1 PHE 2 HD1 PHE 2 17.110 18.621 21.566
13 HD2 PHE 2 HD2 PHE 2 19.341 19.225 17.924
14 HE1 PHE 2 HE1 PHE 2 15.395 17.366 20.315
15 HE2 PHE 2 HE2 PHE 2 17.583 18.007 16.654
16 HZ PHE 2 HZ PHE 2 15.596 17.095 17.841
17 H CYS 3 H CYS 3 22.493 20.515 20.514
18 HA CYS 3 HA CYS 3 23.701 20.463 23.186
19 HB2 CYS 3 HB2 CYS 3 25.299 22.045 22.197
20 HB3 CYS 3 HB3 CYS 3 25.074 20.619 21.188
21 H ASN 4 H ASN 4 23.921 22.244 24.583
22 HA ASN 4 HA ASN 4 21.610 24.098 24.686
23 HB2 ASN 4 HB2 ASN 4 23.838 23.619 26.687
24 HB3 ASN 4 HB3 ASN 4 22.366 24.537 26.966
25 HD21 ASN 4 HD21 ASN 4 22.380 20.683 27.842
26 HD22 ASN 4 HD22 ASN 4 23.800 21.679 27.595
27 H LEU 5 H LEU 5 22.580 25.072 22.619
28 HA LEU 5 HA LEU 5 25.080 26.403 22.692
29 HB2 LEU 5 HB2 LEU 5 24.020 25.678 20.631
30 HB3 LEU 5 HB3 LEU 5 22.685 26.811 20.874
31 HG LEU 5 HG LEU 5 24.202 28.721 20.576
32 HD11 LEU 5 HD11 LEU 5 26.342 27.839 21.416
33 HD12 LEU 5 HD12 LEU 5 26.387 26.649 20.092
34 HD13 LEU 5 HD13 LEU 5 26.521 28.380 19.749
35 HD21 LEU 5 HD21 LEU 5 24.519 26.642 18.376
36 HD22 LEU 5 HD22 LEU 5 23.107 27.703 18.610
37 HD23 LEU 5 HD23 LEU 5 24.680 28.404 18.199
38 H ARG 6 H ARG 6 21.809 27.786 23.324
39 HA ARG 6 HA ARG 6 22.673 30.508 23.574
40 HB2 ARG 6 HB2 ARG 6 20.337 29.795 23.250
41 HB3 ARG 6 HB3 ARG 6 20.302 29.160 24.908
42 HG2 ARG 6 HG2 ARG 6 20.656 31.412 25.819
43 HG3 ARG 6 HG3 ARG 6 20.917 32.057 24.189
44 HD2 ARG 6 HD2 ARG 6 18.717 32.641 24.953
45 HD3 ARG 6 HD3 ARG 6 18.595 31.512 23.587
46 HE ARG 6 HE ARG 6 18.489 29.927 25.898
47 HH11 ARG 6 HH11 ARG 6 16.442 32.405 24.461
48 HH12 ARG 6 HH12 ARG 6 14.997 31.708 25.172
49 HH21 ARG 6 HH21 ARG 6 16.771 29.069 26.580
50 HH22 ARG 6 HH22 ARG 6 15.160 29.728 26.347
51 H ARG 7 H ARG 7 22.585 27.931 25.996
52 HA ARG 7 HA ARG 7 23.600 29.516 28.223
53 HB2 ARG 7 HB2 ARG 7 23.613 26.533 27.577
54 HB3 ARG 7 HB3 ARG 7 24.265 27.170 29.061
55 HG2 ARG 7 HG2 ARG 7 21.401 27.873 28.320
56 HG3 ARG 7 HG3 ARG 7 21.799 26.255 28.881
57 HD2 ARG 7 HD2 ARG 7 21.175 27.281 30.831
58 HD3 ARG 7 HD3 ARG 7 22.935 27.338 30.902
59 HE ARG 7 HE ARG 7 21.541 29.730 29.827
60 HH11 ARG 7 HH11 ARG 7 22.802 28.255 32.770
61 HH12 ARG 7 HH12 ARG 7 22.960 29.781 33.592
62 HH21 ARG 7 HH21 ARG 7 21.753 31.671 30.964
63 HH22 ARG 7 HH22 ARG 7 22.269 31.632 32.633
64 H CYS 8 H CYS 8 25.197 27.605 25.677
65 HA CYS 8 HA CYS 8 27.876 27.876 26.685
66 HB2 CYS 8 HB2 CYS 8 26.902 26.115 25.140
67 HB3 CYS 8 HB3 CYS 8 26.853 27.330 23.872
68 H GLU 9 H GLU 9 26.191 29.786 24.123
69 HA GLU 9 HA GLU 9 28.470 31.453 23.577
70 HB2 GLU 9 HB2 GLU 9 27.001 32.790 22.284
71 HB3 GLU 9 HB3 GLU 9 26.619 31.085 22.012
72 HG2 GLU 9 HG2 GLU 9 24.574 31.230 23.030
73 HG3 GLU 9 HG3 GLU 9 25.008 32.552 24.098
74 H LEU 10 H LEU 10 26.457 31.490 26.290
75 HA LEU 10 HA LEU 10 27.164 34.256 27.064
76 HB2 LEU 10 HB2 LEU 10 24.903 33.868 27.473
77 HB3 LEU 10 HB3 LEU 10 25.150 32.158 27.850
78 HG LEU 10 HG LEU 10 26.195 32.727 29.942
79 HD11 LEU 10 HD11 LEU 10 25.912 35.022 30.917
80 HD12 LEU 10 HD12 LEU 10 26.973 35.076 29.503
81 HD13 LEU 10 HD13 LEU 10 25.280 35.591 29.365
82 HD21 LEU 10 HD21 LEU 10 23.811 32.201 29.816
83 HD22 LEU 10 HD22 LEU 10 24.129 33.361 31.122
84 HD23 LEU 10 HD23 LEU 10 23.432 33.926 29.588
85 H SER 11 H SER 11 27.589 30.832 28.102
86 HA SER 11 HA SER 11 29.106 31.588 30.428
87 HB2 SER 11 HB2 SER 11 27.878 29.445 30.303
88 HB3 SER 11 HB3 SER 11 29.018 28.865 29.069
89 HG SER 11 HG SER 11 29.580 29.667 31.746
90 H CYS 12 H CYS 12 30.126 30.392 27.207
91 HA CYS 12 HA CYS 12 32.953 30.622 27.749
92 HB2 CYS 12 HB2 CYS 12 31.374 30.728 25.151
93 HB3 CYS 12 HB3 CYS 12 33.118 30.521 25.265
94 H ARG 13 H ARG 13 30.438 32.920 26.744
95 HA ARG 13 HA ARG 13 32.305 35.010 25.870
96 HB2 ARG 13 HB2 ARG 13 30.110 35.155 25.024
97 HB3 ARG 13 HB3 ARG 13 29.368 35.047 26.628
98 HG2 ARG 13 HG2 ARG 13 30.139 37.247 27.238
99 HG3 ARG 13 HG3 ARG 13 31.152 37.358 25.798
100 HD2 ARG 13 HD2 ARG 13 29.140 38.709 25.563
101 HD3 ARG 13 HD3 ARG 13 29.205 37.437 24.350
102 HE ARG 13 HE ARG 13 27.247 36.570 25.182
103 HH11 ARG 13 HH11 ARG 13 28.439 38.695 27.769
104 HH12 ARG 13 HH12 ARG 13 26.843 38.676 28.507
105 HH21 ARG 13 HH21 ARG 13 25.354 36.625 26.286
106 HH22 ARG 13 HH22 ARG 13 25.267 37.606 27.767
107 H SER 14 H SER 14 30.818 34.202 29.001
108 HA SER 14 HA SER 14 31.960 36.408 30.418
109 HB2 SER 14 HB2 SER 14 31.187 33.676 31.481
110 HB3 SER 14 HB3 SER 14 31.433 35.131 32.448
111 HG SER 14 HG SER 14 29.668 36.084 31.287
112 H LEU 15 H LEU 15 33.596 33.793 29.008
113 HA LEU 15 HA LEU 15 36.047 34.232 30.640
114 HB2 LEU 15 HB2 LEU 15 35.482 31.990 28.679
115 HB3 LEU 15 HB3 LEU 15 36.847 32.112 29.799
116 HG LEU 15 HG LEU 15 33.946 31.692 30.577
117 HD11 LEU 15 HD11 LEU 15 34.665 29.433 31.197
118 HD12 LEU 15 HD12 LEU 15 34.939 29.738 29.471
119 HD13 LEU 15 HD13 LEU 15 36.304 29.790 30.613
120 HD21 LEU 15 HD21 LEU 15 34.839 31.219 32.842
121 HD22 LEU 15 HD22 LEU 15 36.461 31.683 32.289
122 HD23 LEU 15 HD23 LEU 15 35.159 32.895 32.365
123 H GLY 16 H GLY 16 34.646 35.406 27.856
124 HA2 GLY 16 HA2 GLY 16 35.531 36.635 26.120
125 HA3 GLY 16 HA3 GLY 16 37.169 36.284 26.682
126 H LEU 17 H LEU 17 34.777 33.791 25.896
127 HA LEU 17 HA LEU 17 36.265 33.063 23.393
128 HB2 LEU 17 HB2 LEU 17 35.216 31.310 25.643
129 HB3 LEU 17 HB3 LEU 17 35.716 30.673 24.082
130 HG LEU 17 HG LEU 17 37.546 32.310 25.826
131 HD11 LEU 17 HD11 LEU 17 37.499 29.287 25.788
132 HD12 LEU 17 HD12 LEU 17 38.570 30.342 26.715
133 HD13 LEU 17 HD13 LEU 17 36.850 30.305 27.105
134 HD21 LEU 17 HD21 LEU 17 38.246 32.042 23.454
135 HD22 LEU 17 HD22 LEU 17 39.348 31.249 24.587
136 HD23 LEU 17 HD23 LEU 17 38.192 30.276 23.663
137 H LEU 18 H LEU 18 35.146 32.069 21.775
138 HA LEU 18 HA LEU 18 32.327 32.684 21.407
139 HB2 LEU 18 HB2 LEU 18 33.867 32.760 19.524
140 HB3 LEU 18 HB3 LEU 18 34.398 31.109 19.834
141 HG LEU 18 HG LEU 18 32.155 30.248 19.233
142 HD11 LEU 18 HD11 LEU 18 30.747 32.206 19.778
143 HD12 LEU 18 HD12 LEU 18 31.549 33.141 18.494
144 HD13 LEU 18 HD13 LEU 18 30.546 31.735 18.087
145 HD21 LEU 18 HD21 LEU 18 33.300 32.073 17.094
146 HD22 LEU 18 HD22 LEU 18 33.979 30.492 17.543
147 HD23 LEU 18 HD23 LEU 18 32.351 30.587 16.856
148 H GLY 19 H GLY 19 30.707 31.441 22.163
149 HA2 GLY 19 HA2 GLY 19 31.062 28.692 23.108
150 HA3 GLY 19 HA3 GLY 19 29.539 29.574 22.973
151 H LYS 20 H LYS 20 31.243 27.011 21.797
152 HA LYS 20 HA LYS 20 30.038 26.921 19.092
153 HB2 LYS 20 HB2 LYS 20 32.397 27.081 18.959
154 HB3 LYS 20 HB3 LYS 20 32.641 26.060 20.384
155 HG2 LYS 20 HG2 LYS 20 33.344 24.872 18.426
156 HG3 LYS 20 HG3 LYS 20 31.953 24.066 19.130
157 HD2 LYS 20 HD2 LYS 20 30.511 25.312 17.422
158 HD3 LYS 20 HD3 LYS 20 32.032 25.854 16.661
159 HE2 LYS 20 HE2 LYS 20 32.736 23.440 16.511
160 HE3 LYS 20 HE3 LYS 20 31.178 22.973 17.201
161 HZ1 LYS 20 HZ1 LYS 20 31.104 22.796 14.774
162 HZ2 LYS 20 HZ2 LYS 20 30.130 24.070 15.218
163 HZ3 LYS 20 HZ3 LYS 20 31.639 24.316 14.612
164 H CYS 21 H CYS 21 28.449 25.507 18.817
165 HA CYS 21 HA CYS 21 27.935 23.248 20.632
166 HB2 CYS 21 HB2 CYS 21 26.105 24.478 19.543
167 HB3 CYS 21 HB3 CYS 21 26.791 24.146 17.960
168 H ILE 22 H ILE 22 29.278 21.473 20.522
169 HA ILE 22 HA ILE 22 30.698 20.723 18.054
170 HB ILE 22 HB ILE 22 30.359 19.304 20.722
171 HG12 ILE 22 HG12 ILE 22 31.620 21.389 20.955
172 HG13 ILE 22 HG13 ILE 22 32.633 19.983 21.210
173 HG21 ILE 22 HG21 ILE 22 30.864 17.605 19.082
174 HG22 ILE 22 HG22 ILE 22 32.136 18.597 18.351
175 HG23 ILE 22 HG23 ILE 22 32.337 17.932 19.987
176 HD11 ILE 22 HD11 ILE 22 33.623 20.253 18.938
177 HD12 ILE 22 HD12 ILE 22 32.600 21.684 18.673
178 HD13 ILE 22 HD13 ILE 22 33.841 21.692 19.930
179 H GLY 23 H GLY 23 27.800 19.660 19.757
180 HA2 GLY 23 HA2 GLY 23 26.277 18.984 17.527
181 HA3 GLY 23 HA3 GLY 23 27.092 17.485 17.998
182 H GLU 24 H GLU 24 27.123 17.476 20.658
183 HA GLU 24 HA GLU 24 24.498 18.322 21.767
184 HB2 GLU 24 HB2 GLU 24 24.133 16.323 22.917
185 HB3 GLU 24 HB3 GLU 24 24.417 15.909 21.243
186 HG2 GLU 24 HG2 GLU 24 26.813 15.329 21.883
187 HG3 GLU 24 HG3 GLU 24 26.329 15.512 23.574
188 H GLU 25 H GLU 25 27.941 18.116 22.126
189 HA GLU 25 HA GLU 25 27.843 19.299 24.848
190 HB2 GLU 25 HB2 GLU 25 30.167 18.259 23.204
191 HB3 GLU 25 HB3 GLU 25 30.276 18.867 24.855
192 HG2 GLU 25 HG2 GLU 25 28.773 16.367 23.949
193 HG3 GLU 25 HG3 GLU 25 30.318 16.419 24.773
194 H CYS 26 H CYS 26 29.237 21.067 25.366
195 HA CYS 26 HA CYS 26 29.297 23.235 23.329
196 HB2 CYS 26 HB2 CYS 26 27.983 23.740 25.266
197 HB3 CYS 26 HB3 CYS 26 29.205 23.095 26.339
198 H LYS 27 H LYS 27 31.138 24.428 22.953
199 HA LYS 27 HA LYS 27 33.681 23.821 24.386
200 HB2 LYS 27 HB2 LYS 27 33.129 23.031 21.724
201 HB3 LYS 27 HB3 LYS 27 33.997 24.529 21.536
202 HG2 LYS 27 HG2 LYS 27 35.611 22.874 21.423
203 HG3 LYS 27 HG3 LYS 27 35.840 23.558 23.021
204 HD2 LYS 27 HD2 LYS 27 34.055 21.122 22.712
205 HD3 LYS 27 HD3 LYS 27 35.800 20.927 22.515
206 HE2 LYS 27 HE2 LYS 27 36.163 21.931 24.753
207 HE3 LYS 27 HE3 LYS 27 34.413 22.017 24.999
208 HZ1 LYS 27 HZ1 LYS 27 35.820 19.483 24.370
209 HZ2 LYS 27 HZ2 LYS 27 35.558 19.956 25.910
210 HZ3 LYS 27 HZ3 LYS 27 34.299 19.615 24.911
211 H CYS 28 H CYS 28 35.071 25.533 24.620
212 HA CYS 28 HA CYS 28 34.104 28.288 23.880
213 HB2 CYS 28 HB2 CYS 28 35.825 27.446 26.212
214 HB3 CYS 28 HB3 CYS 28 35.245 29.057 25.829
215 H VAL 29 H VAL 29 35.248 29.150 22.268
216 HA VAL 29 HA VAL 29 38.108 28.396 21.793
217 HB VAL 29 HB VAL 29 37.560 27.932 19.425
218 HG11 VAL 29 HG11 VAL 29 35.972 26.126 21.267
219 HG12 VAL 29 HG12 VAL 29 36.678 25.723 19.694
220 HG13 VAL 29 HG13 VAL 29 37.738 26.081 21.068
221 HG21 VAL 29 HG21 VAL 29 35.465 29.178 19.164
222 HG22 VAL 29 HG22 VAL 29 35.268 27.484 18.707
223 HG23 VAL 29 HG23 VAL 29 34.639 28.049 20.262
224 HA PRO 30 HA PRO 30 38.688 32.583 20.270
225 HB2 PRO 30 HB2 PRO 30 39.732 31.401 17.698
226 HB3 PRO 30 HB3 PRO 30 40.440 32.711 18.706
227 HG2 PRO 30 HG2 PRO 30 41.446 30.194 18.820
228 HG3 PRO 30 HG3 PRO 30 41.202 31.137 20.324
229 HD2 PRO 30 HD2 PRO 30 39.440 28.975 19.155
230 HD3 PRO 30 HD3 PRO 30 39.946 29.205 20.845
231 H TYR 31 H TYR 31 37.613 34.159 19.021
232 HA TYR 31 HA TYR 31 35.199 33.333 17.600
233 HB2 TYR 31 HB2 TYR 31 36.492 36.035 18.102
234 HB3 TYR 31 HB3 TYR 31 35.051 35.817 17.140
235 HD1 TYR 31 HD1 TYR 31 36.379 35.734 20.596
236 HD2 TYR 31 HD2 TYR 31 32.899 35.282 18.081
237 HE1 TYR 31 HE1 TYR 31 34.904 35.947 22.597
238 HE2 TYR 31 HE2 TYR 31 31.432 35.451 20.090
239 HH TYR 31 HH TYR 31 32.720 36.368 23.260
240 H ASN 32 H ASN 32 34.844 33.188 15.463
241 HA ASN 32 HA ASN 32 37.131 33.167 13.642
242 HB2 ASN 32 HB2 ASN 32 34.225 32.538 12.997
243 HB3 ASN 32 HB3 ASN 32 35.651 32.014 12.117
244 HD21 ASN 32 HD21 ASN 32 36.524 29.662 14.839
245 HD22 ASN 32 HD22 ASN 32 37.311 30.838 13.792
Start of MODEL 2
1 H1 ALA 1 H1 ALA 1 17.157 16.991 24.965
2 H2 ALA 1 H2 ALA 1 16.586 16.393 23.541
3 H3 ALA 1 H3 ALA 1 15.542 16.981 24.682
4 HA ALA 1 HA ALA 1 15.802 18.514 22.869
5 HB1 ALA 1 HB1 ALA 1 17.021 19.513 25.486
6 HB2 ALA 1 HB2 ALA 1 16.276 20.517 24.225
7 HB3 ALA 1 HB3 ALA 1 15.283 19.374 25.145
8 H PHE 2 H PHE 2 17.216 20.110 21.779
9 HA PHE 2 HA PHE 2 19.802 19.148 21.040
10 HB2 PHE 2 HB2 PHE 2 18.848 22.022 20.929
11 HB3 PHE 2 HB3 PHE 2 20.048 21.257 19.904
12 HD1 PHE 2 HD1 PHE 2 19.240 19.364 18.314
13 HD2 PHE 2 HD2 PHE 2 16.590 22.140 20.275
14 HE1 PHE 2 HE1 PHE 2 17.469 18.854 16.644
15 HE2 PHE 2 HE2 PHE 2 14.822 21.628 18.617
16 HZ PHE 2 HZ PHE 2 15.256 19.983 16.796
17 H CYS 3 H CYS 3 21.888 20.265 21.371
18 HA CYS 3 HA CYS 3 22.693 20.711 24.017
19 HB2 CYS 3 HB2 CYS 3 24.673 21.824 22.939
20 HB3 CYS 3 HB3 CYS 3 24.265 20.218 22.342
21 H ASN 4 H ASN 4 23.171 22.560 25.265
22 HA ASN 4 HA ASN 4 21.139 24.627 25.039
23 HB2 ASN 4 HB2 ASN 4 21.768 25.231 27.272
24 HB3 ASN 4 HB3 ASN 4 21.553 23.495 27.149
25 HD21 ASN 4 HD21 ASN 4 24.490 23.951 29.243
26 HD22 ASN 4 HD22 ASN 4 22.724 24.121 29.320
27 H LEU 5 H LEU 5 22.407 25.186 22.876
28 HA LEU 5 HA LEU 5 24.864 26.434 22.900
29 HB2 LEU 5 HB2 LEU 5 23.703 25.600 20.900
30 HB3 LEU 5 HB3 LEU 5 22.547 26.930 21.003
31 HG LEU 5 HG LEU 5 24.375 28.567 20.583
32 HD11 LEU 5 HD11 LEU 5 26.327 27.383 21.482
33 HD12 LEU 5 HD12 LEU 5 26.132 26.098 20.266
34 HD13 LEU 5 HD13 LEU 5 26.581 27.750 19.776
35 HD21 LEU 5 HD21 LEU 5 23.092 27.648 18.704
36 HD22 LEU 5 HD22 LEU 5 24.760 27.984 18.228
37 HD23 LEU 5 HD23 LEU 5 24.247 26.308 18.547
38 H ARG 6 H ARG 6 21.728 28.129 23.430
39 HA ARG 6 HA ARG 6 22.851 30.784 23.511
40 HB2 ARG 6 HB2 ARG 6 20.416 29.576 24.876
41 HB3 ARG 6 HB3 ARG 6 20.874 31.272 25.061
42 HG2 ARG 6 HG2 ARG 6 20.806 31.579 22.607
43 HG3 ARG 6 HG3 ARG 6 20.216 29.920 22.411
44 HD2 ARG 6 HD2 ARG 6 18.817 32.063 24.085
45 HD3 ARG 6 HD3 ARG 6 18.494 31.750 22.379
46 HE ARG 6 HE ARG 6 18.260 29.412 24.173
47 HH11 ARG 6 HH11 ARG 6 16.473 31.966 22.531
48 HH12 ARG 6 HH12 ARG 6 15.038 30.996 22.366
49 HH21 ARG 6 HH21 ARG 6 16.336 28.272 24.039
50 HH22 ARG 6 HH22 ARG 6 15.016 28.929 23.102
51 H ARG 7 H ARG 7 22.470 28.434 26.181
52 HA ARG 7 HA ARG 7 23.774 30.122 28.145
53 HB2 ARG 7 HB2 ARG 7 22.261 28.307 28.772
54 HB3 ARG 7 HB3 ARG 7 23.395 27.107 28.141
55 HG2 ARG 7 HG2 ARG 7 25.064 27.681 29.787
56 HG3 ARG 7 HG3 ARG 7 24.172 29.117 30.300
57 HD2 ARG 7 HD2 ARG 7 23.040 26.306 30.583
58 HD3 ARG 7 HD3 ARG 7 24.099 27.020 31.800
59 HE ARG 7 HE ARG 7 21.298 27.765 31.250
60 HH11 ARG 7 HH11 ARG 7 24.230 28.935 32.840
61 HH12 ARG 7 HH12 ARG 7 23.291 29.823 34.008
62 HH21 ARG 7 HH21 ARG 7 20.254 28.863 32.710
63 HH22 ARG 7 HH22 ARG 7 21.093 29.694 34.035
64 H CYS 8 H CYS 8 25.027 27.585 25.961
65 HA CYS 8 HA CYS 8 27.773 27.766 26.868
66 HB2 CYS 8 HB2 CYS 8 26.780 25.927 25.454
67 HB3 CYS 8 HB3 CYS 8 26.619 27.078 24.125
68 H GLU 9 H GLU 9 26.120 29.594 24.246
69 HA GLU 9 HA GLU 9 28.349 31.177 23.555
70 HB2 GLU 9 HB2 GLU 9 25.367 31.701 23.468
71 HB3 GLU 9 HB3 GLU 9 26.552 32.916 22.965
72 HG2 GLU 9 HG2 GLU 9 27.542 31.313 21.359
73 HG3 GLU 9 HG3 GLU 9 26.305 30.129 21.758
74 H LEU 10 H LEU 10 26.043 31.723 26.293
75 HA LEU 10 HA LEU 10 27.432 34.233 26.923
76 HB2 LEU 10 HB2 LEU 10 25.825 34.694 28.513
77 HB3 LEU 10 HB3 LEU 10 25.007 33.993 27.150
78 HG LEU 10 HG LEU 10 25.152 31.760 28.579
79 HD11 LEU 10 HD11 LEU 10 26.461 32.660 30.480
80 HD12 LEU 10 HD12 LEU 10 25.242 33.926 30.722
81 HD13 LEU 10 HD13 LEU 10 24.842 32.214 30.999
82 HD21 LEU 10 HD21 LEU 10 23.070 32.847 27.875
83 HD22 LEU 10 HD22 LEU 10 22.949 32.285 29.543
84 HD23 LEU 10 HD23 LEU 10 23.210 34.013 29.208
85 H SER 11 H SER 11 27.580 30.912 28.053
86 HA SER 11 HA SER 11 29.115 31.412 30.462
87 HB2 SER 11 HB2 SER 11 27.789 29.381 30.190
88 HB3 SER 11 HB3 SER 11 28.730 28.923 28.760
89 HG SER 11 HG SER 11 29.868 27.900 30.155
90 H CYS 12 H CYS 12 29.997 30.427 27.107
91 HA CYS 12 HA CYS 12 32.873 30.550 27.621
92 HB2 CYS 12 HB2 CYS 12 31.295 30.684 25.030
93 HB3 CYS 12 HB3 CYS 12 33.030 30.490 25.144
94 H ARG 13 H ARG 13 30.389 32.872 26.516
95 HA ARG 13 HA ARG 13 32.257 35.007 25.813
96 HB2 ARG 13 HB2 ARG 13 29.992 34.965 25.021
97 HB3 ARG 13 HB3 ARG 13 29.348 35.087 26.664
98 HG2 ARG 13 HG2 ARG 13 30.088 37.370 26.856
99 HG3 ARG 13 HG3 ARG 13 30.988 37.268 25.335
100 HD2 ARG 13 HD2 ARG 13 27.964 36.893 25.588
101 HD3 ARG 13 HD3 ARG 13 28.744 38.413 25.139
102 HE ARG 13 HE ARG 13 29.801 37.059 23.228
103 HH11 ARG 13 HH11 ARG 13 26.492 36.296 24.282
104 HH12 ARG 13 HH12 ARG 13 26.119 35.611 22.723
105 HH21 ARG 13 HH21 ARG 13 29.154 36.211 21.284
106 HH22 ARG 13 HH22 ARG 13 27.573 35.513 21.140
107 H SER 14 H SER 14 30.847 33.996 28.874
108 HA SER 14 HA SER 14 31.791 36.203 30.414
109 HB2 SER 14 HB2 SER 14 31.172 33.383 31.343
110 HB3 SER 14 HB3 SER 14 31.372 34.809 32.377
111 HG SER 14 HG SER 14 29.379 34.347 30.390
112 H LEU 15 H LEU 15 33.604 33.748 28.910
113 HA LEU 15 HA LEU 15 36.003 34.249 30.636
114 HB2 LEU 15 HB2 LEU 15 35.513 32.114 28.515
115 HB3 LEU 15 HB3 LEU 15 36.939 32.252 29.523
116 HG LEU 15 HG LEU 15 34.138 31.665 30.544
117 HD11 LEU 15 HD11 LEU 15 34.965 29.388 30.879
118 HD12 LEU 15 HD12 LEU 15 35.076 29.839 29.175
119 HD13 LEU 15 HD13 LEU 15 36.540 29.829 30.187
120 HD21 LEU 15 HD21 LEU 15 35.513 32.790 32.260
121 HD22 LEU 15 HD22 LEU 15 35.358 31.089 32.659
122 HD23 LEU 15 HD23 LEU 15 36.864 31.677 31.941
123 H GLY 16 H GLY 16 34.607 35.485 27.849
124 HA2 GLY 16 HA2 GLY 16 35.475 36.780 26.129
125 HA3 GLY 16 HA3 GLY 16 37.111 36.524 26.766
126 H LEU 17 H LEU 17 34.920 33.848 25.930
127 HA LEU 17 HA LEU 17 36.475 33.245 23.453
128 HB2 LEU 17 HB2 LEU 17 35.168 31.288 25.387
129 HB3 LEU 17 HB3 LEU 17 36.021 30.857 23.903
130 HG LEU 17 HG LEU 17 37.219 32.136 26.346
131 HD11 LEU 17 HD11 LEU 17 38.408 30.058 26.720
132 HD12 LEU 17 HD12 LEU 17 36.670 29.864 26.838
133 HD13 LEU 17 HD13 LEU 17 37.538 29.303 25.372
134 HD21 LEU 17 HD21 LEU 17 38.641 31.044 23.880
135 HD22 LEU 17 HD22 LEU 17 38.494 32.767 24.290
136 HD23 LEU 17 HD23 LEU 17 39.427 31.695 25.336
137 H LEU 18 H LEU 18 35.260 32.034 21.826
138 HA LEU 18 HA LEU 18 32.417 32.855 21.555
139 HB2 LEU 18 HB2 LEU 18 34.197 31.134 19.796
140 HB3 LEU 18 HB3 LEU 18 32.557 31.645 19.398
141 HG LEU 18 HG LEU 18 34.896 33.553 19.791
142 HD11 LEU 18 HD11 LEU 18 35.283 32.073 17.868
143 HD12 LEU 18 HD12 LEU 18 33.649 32.424 17.249
144 HD13 LEU 18 HD13 LEU 18 34.871 33.701 17.308
145 HD21 LEU 18 HD21 LEU 18 32.698 34.640 20.113
146 HD22 LEU 18 HD22 LEU 18 33.442 35.167 18.593
147 HD23 LEU 18 HD23 LEU 18 32.139 33.972 18.565
148 H GLY 19 H GLY 19 30.731 31.458 21.783
149 HA2 GLY 19 HA2 GLY 19 31.254 28.728 22.902
150 HA3 GLY 19 HA3 GLY 19 29.749 29.621 23.039
151 H LYS 20 H LYS 20 31.025 27.004 21.688
152 HA LYS 20 HA LYS 20 29.200 26.981 19.302
153 HB2 LYS 20 HB2 LYS 20 31.898 25.587 19.522
154 HB3 LYS 20 HB3 LYS 20 30.847 25.629 18.112
155 HG2 LYS 20 HG2 LYS 20 32.368 28.004 19.274
156 HG3 LYS 20 HG3 LYS 20 32.829 27.048 17.871
157 HD2 LYS 20 HD2 LYS 20 30.761 27.761 16.685
158 HD3 LYS 20 HD3 LYS 20 30.351 28.802 18.068
159 HE2 LYS 20 HE2 LYS 20 32.599 29.928 17.810
160 HE3 LYS 20 HE3 LYS 20 32.874 28.962 16.357
161 HZ1 LYS 20 HZ1 LYS 20 30.858 30.008 15.402
162 HZ2 LYS 20 HZ2 LYS 20 30.726 30.982 16.733
163 HZ3 LYS 20 HZ3 LYS 20 32.000 31.110 15.744
164 H CYS 21 H CYS 21 28.391 24.873 18.743
165 HA CYS 21 HA CYS 21 28.565 22.800 20.903
166 HB2 CYS 21 HB2 CYS 21 26.383 23.609 21.111
167 HB3 CYS 21 HB3 CYS 21 26.160 23.755 19.361
168 H ILE 22 H ILE 22 29.699 21.126 20.202
169 HA ILE 22 HA ILE 22 30.338 20.818 17.385
170 HB ILE 22 HB ILE 22 31.940 20.539 19.232
171 HG12 ILE 22 HG12 ILE 22 31.734 17.985 17.573
172 HG13 ILE 22 HG13 ILE 22 32.235 19.546 16.916
173 HG21 ILE 22 HG21 ILE 22 32.024 18.520 20.593
174 HG22 ILE 22 HG22 ILE 22 30.459 19.282 20.828
175 HG23 ILE 22 HG23 ILE 22 30.597 17.850 19.786
176 HD11 ILE 22 HD11 ILE 22 34.202 18.245 17.427
177 HD12 ILE 22 HD12 ILE 22 34.125 19.624 18.545
178 HD13 ILE 22 HD13 ILE 22 33.673 17.992 19.095
179 H GLY 23 H GLY 23 28.057 19.271 19.481
180 HA2 GLY 23 HA2 GLY 23 26.548 18.133 17.343
181 HA3 GLY 23 HA3 GLY 23 27.469 16.846 18.136
182 H GLU 24 H GLU 24 27.367 17.163 20.726
183 HA GLU 24 HA GLU 24 24.683 18.154 21.637
184 HB2 GLU 24 HB2 GLU 24 26.102 15.600 22.438
185 HB3 GLU 24 HB3 GLU 24 24.764 16.287 23.342
186 HG2 GLU 24 HG2 GLU 24 24.460 15.558 20.402
187 HG3 GLU 24 HG3 GLU 24 24.281 14.375 21.684
188 H GLU 25 H GLU 25 28.102 18.170 22.042
189 HA GLU 25 HA GLU 25 28.017 19.193 24.800
190 HB2 GLU 25 HB2 GLU 25 30.409 18.377 23.107
191 HB3 GLU 25 HB3 GLU 25 30.357 18.690 24.830
192 HG2 GLU 25 HG2 GLU 25 30.370 16.392 24.770
193 HG3 GLU 25 HG3 GLU 25 28.659 16.746 24.999
194 H CYS 26 H CYS 26 28.843 21.107 25.475
195 HA CYS 26 HA CYS 26 29.082 23.334 23.581
196 HB2 CYS 26 HB2 CYS 26 27.918 23.677 25.672
197 HB3 CYS 26 HB3 CYS 26 29.285 23.048 26.592
198 H LYS 27 H LYS 27 30.939 24.249 22.849
199 HA LYS 27 HA LYS 27 33.569 23.657 24.138
200 HB2 LYS 27 HB2 LYS 27 32.915 23.936 21.170
201 HB3 LYS 27 HB3 LYS 27 34.543 23.794 21.834
202 HG2 LYS 27 HG2 LYS 27 32.399 21.646 22.039
203 HG3 LYS 27 HG3 LYS 27 33.663 21.710 20.819
204 HD2 LYS 27 HD2 LYS 27 35.164 20.753 22.173
205 HD3 LYS 27 HD3 LYS 27 34.913 21.998 23.412
206 HE2 LYS 27 HE2 LYS 27 33.020 20.849 24.299
207 HE3 LYS 27 HE3 LYS 27 33.081 19.611 23.027
208 HZ1 LYS 27 HZ1 LYS 27 34.113 18.784 25.071
209 HZ2 LYS 27 HZ2 LYS 27 35.268 18.938 23.926
210 HZ3 LYS 27 HZ3 LYS 27 35.141 20.066 25.118
211 H CYS 28 H CYS 28 34.760 25.328 24.639
212 HA CYS 28 HA CYS 28 34.057 28.119 23.752
213 HB2 CYS 28 HB2 CYS 28 35.739 27.299 26.093
214 HB3 CYS 28 HB3 CYS 28 35.175 28.904 25.623
215 H VAL 29 H VAL 29 35.396 29.204 22.412
216 HA VAL 29 HA VAL 29 38.192 28.282 21.992
217 HB VAL 29 HB VAL 29 37.757 28.303 19.488
218 HG11 VAL 29 HG11 VAL 29 36.389 26.050 20.995
219 HG12 VAL 29 HG12 VAL 29 37.162 25.995 19.388
220 HG13 VAL 29 HG13 VAL 29 38.147 26.239 20.828
221 HG21 VAL 29 HG21 VAL 29 34.851 27.902 20.298
222 HG22 VAL 29 HG22 VAL 29 35.522 29.355 19.516
223 HG23 VAL 29 HG23 VAL 29 35.542 27.813 18.658
224 HA PRO 30 HA PRO 30 39.018 32.568 21.252
225 HB2 PRO 30 HB2 PRO 30 41.366 32.524 19.877
226 HB3 PRO 30 HB3 PRO 30 41.238 31.918 21.553
227 HG2 PRO 30 HG2 PRO 30 41.114 30.305 18.982
228 HG3 PRO 30 HG3 PRO 30 42.146 30.010 20.419
229 HD2 PRO 30 HD2 PRO 30 39.779 28.731 20.048
230 HD3 PRO 30 HD3 PRO 30 40.319 29.205 21.677
231 H TYR 31 H TYR 31 39.666 34.161 19.419
232 HA TYR 31 HA TYR 31 37.713 33.968 17.273
233 HB2 TYR 31 HB2 TYR 31 39.864 36.047 17.795
234 HB3 TYR 31 HB3 TYR 31 38.453 36.230 16.761
235 HD1 TYR 31 HD1 TYR 31 36.192 35.321 18.334
236 HD2 TYR 31 HD2 TYR 31 39.632 37.642 19.503
237 HE1 TYR 31 HE1 TYR 31 34.857 36.395 20.139
238 HE2 TYR 31 HE2 TYR 31 38.273 38.742 21.289
239 HH TYR 31 HH TYR 31 36.221 38.633 22.503
240 H ASN 32 H ASN 32 38.338 34.713 15.037
241 HA ASN 32 HA ASN 32 40.744 33.297 13.955
242 HB2 ASN 32 HB2 ASN 32 38.336 34.564 12.556
243 HB3 ASN 32 HB3 ASN 32 39.685 33.771 11.760
244 HD21 ASN 32 HD21 ASN 32 38.412 30.487 13.078
245 HD22 ASN 32 HD22 ASN 32 39.863 31.387 13.490
Start of MODEL 3
1 H1 ALA 1 H1 ALA 1 21.017 13.814 22.552
2 H2 ALA 1 H2 ALA 1 19.627 14.075 21.724
3 H3 ALA 1 H3 ALA 1 19.595 13.179 23.118
4 HA ALA 1 HA ALA 1 18.707 15.395 23.437
5 HB1 ALA 1 HB1 ALA 1 19.759 14.205 25.345
6 HB2 ALA 1 HB2 ALA 1 21.331 14.912 24.920
7 HB3 ALA 1 HB3 ALA 1 19.986 15.952 25.442
8 H PHE 2 H PHE 2 18.779 17.511 22.816
9 HA PHE 2 HA PHE 2 20.850 18.329 20.938
10 HB2 PHE 2 HB2 PHE 2 18.698 20.093 22.110
11 HB3 PHE 2 HB3 PHE 2 19.491 20.234 20.539
12 HD1 PHE 2 HD1 PHE 2 16.585 19.137 22.243
13 HD2 PHE 2 HD2 PHE 2 19.109 18.117 18.912
14 HE1 PHE 2 HE1 PHE 2 14.761 17.772 21.287
15 HE2 PHE 2 HE2 PHE 2 17.247 16.780 17.929
16 HZ PHE 2 HZ PHE 2 15.086 16.587 19.121
17 H CYS 3 H CYS 3 22.266 20.180 21.118
18 HA CYS 3 HA CYS 3 23.407 20.440 23.785
19 HB2 CYS 3 HB2 CYS 3 25.119 21.784 22.667
20 HB3 CYS 3 HB3 CYS 3 24.834 20.250 21.870
21 H ASN 4 H ASN 4 23.655 22.249 25.063
22 HA ASN 4 HA ASN 4 21.550 24.320 24.833
23 HB2 ASN 4 HB2 ASN 4 22.304 24.958 27.136
24 HB3 ASN 4 HB3 ASN 4 21.589 23.376 26.952
25 HD21 ASN 4 HD21 ASN 4 25.592 23.585 27.882
26 HD22 ASN 4 HD22 ASN 4 24.882 24.807 26.836
27 H LEU 5 H LEU 5 22.733 24.931 22.786
28 HA LEU 5 HA LEU 5 25.249 26.257 22.863
29 HB2 LEU 5 HB2 LEU 5 24.322 25.257 20.850
30 HB3 LEU 5 HB3 LEU 5 22.969 26.390 20.870
31 HG LEU 5 HG LEU 5 24.486 28.270 20.417
32 HD11 LEU 5 HD11 LEU 5 26.847 27.845 19.749
33 HD12 LEU 5 HD12 LEU 5 26.574 27.568 21.466
34 HD13 LEU 5 HD13 LEU 5 26.700 26.189 20.353
35 HD21 LEU 5 HD21 LEU 5 23.512 26.969 18.537
36 HD22 LEU 5 HD22 LEU 5 25.083 27.665 18.123
37 HD23 LEU 5 HD23 LEU 5 24.955 25.939 18.514
38 H ARG 6 H ARG 6 21.926 27.618 23.185
39 HA ARG 6 HA ARG 6 22.739 30.415 23.088
40 HB2 ARG 6 HB2 ARG 6 20.334 28.897 24.149
41 HB3 ARG 6 HB3 ARG 6 20.554 30.570 24.595
42 HG2 ARG 6 HG2 ARG 6 19.058 30.367 22.703
43 HG3 ARG 6 HG3 ARG 6 20.478 31.323 22.302
44 HD2 ARG 6 HD2 ARG 6 20.283 28.372 21.581
45 HD3 ARG 6 HD3 ARG 6 19.552 29.639 20.587
46 HE ARG 6 HE ARG 6 22.386 30.082 21.229
47 HH11 ARG 6 HH11 ARG 6 20.248 28.530 18.800
48 HH12 ARG 6 HH12 ARG 6 21.451 28.841 17.559
49 HH21 ARG 6 HH21 ARG 6 23.616 30.575 19.475
50 HH22 ARG 6 HH22 ARG 6 23.247 29.848 17.909
51 H ARG 7 H ARG 7 22.658 28.135 25.753
52 HA ARG 7 HA ARG 7 23.637 30.064 27.737
53 HB2 ARG 7 HB2 ARG 7 22.309 28.009 28.298
54 HB3 ARG 7 HB3 ARG 7 23.732 27.027 27.881
55 HG2 ARG 7 HG2 ARG 7 25.027 28.258 29.682
56 HG3 ARG 7 HG3 ARG 7 23.562 29.178 30.040
57 HD2 ARG 7 HD2 ARG 7 23.558 27.469 31.649
58 HD3 ARG 7 HD3 ARG 7 22.404 26.939 30.414
59 HE ARG 7 HE ARG 7 25.198 25.968 30.163
60 HH11 ARG 7 HH11 ARG 7 21.999 25.161 31.416
61 HH12 ARG 7 HH12 ARG 7 22.426 23.470 31.595
62 HH21 ARG 7 HH21 ARG 7 25.611 23.815 30.344
63 HH22 ARG 7 HH22 ARG 7 24.458 22.739 31.089
64 H CYS 8 H CYS 8 25.178 27.636 25.650
65 HA CYS 8 HA CYS 8 27.861 27.881 26.642
66 HB2 CYS 8 HB2 CYS 8 26.848 26.142 25.044
67 HB3 CYS 8 HB3 CYS 8 26.914 27.375 23.793
68 H GLU 9 H GLU 9 26.149 29.775 24.129
69 HA GLU 9 HA GLU 9 28.294 31.468 23.433
70 HB2 GLU 9 HB2 GLU 9 25.292 31.855 23.425
71 HB3 GLU 9 HB3 GLU 9 26.413 33.069 22.779
72 HG2 GLU 9 HG2 GLU 9 27.358 31.520 21.204
73 HG3 GLU 9 HG3 GLU 9 26.485 30.145 21.880
74 H LEU 10 H LEU 10 26.102 31.823 26.267
75 HA LEU 10 HA LEU 10 27.488 34.331 26.982
76 HB2 LEU 10 HB2 LEU 10 25.927 34.644 28.720
77 HB3 LEU 10 HB3 LEU 10 25.109 34.268 27.217
78 HG LEU 10 HG LEU 10 24.921 31.851 28.208
79 HD11 LEU 10 HD11 LEU 10 26.325 32.159 30.260
80 HD12 LEU 10 HD12 LEU 10 25.251 33.472 30.767
81 HD13 LEU 10 HD13 LEU 10 24.651 31.809 30.671
82 HD21 LEU 10 HD21 LEU 10 23.021 33.295 27.790
83 HD22 LEU 10 HD22 LEU 10 22.819 32.465 29.338
84 HD23 LEU 10 HD23 LEU 10 23.321 34.167 29.311
85 H SER 11 H SER 11 27.527 30.949 27.968
86 HA SER 11 HA SER 11 29.021 31.431 30.411
87 HB2 SER 11 HB2 SER 11 27.462 29.499 29.958
88 HB3 SER 11 HB3 SER 11 28.736 28.779 28.969
89 HG SER 11 HG SER 11 28.451 28.552 31.519
90 H CYS 12 H CYS 12 29.969 30.465 27.070
91 HA CYS 12 HA CYS 12 32.825 30.517 27.725
92 HB2 CYS 12 HB2 CYS 12 31.336 30.604 25.084
93 HB3 CYS 12 HB3 CYS 12 33.083 30.485 25.246
94 H ARG 13 H ARG 13 30.419 32.932 26.652
95 HA ARG 13 HA ARG 13 32.418 34.983 25.996
96 HB2 ARG 13 HB2 ARG 13 30.183 35.195 25.152
97 HB3 ARG 13 HB3 ARG 13 29.495 35.254 26.784
98 HG2 ARG 13 HG2 ARG 13 30.452 37.431 27.193
99 HG3 ARG 13 HG3 ARG 13 31.486 37.305 25.756
100 HD2 ARG 13 HD2 ARG 13 29.608 38.800 25.342
101 HD3 ARG 13 HD3 ARG 13 29.557 37.396 24.281
102 HE ARG 13 HE ARG 13 27.880 37.613 26.777
103 HH11 ARG 13 HH11 ARG 13 27.913 36.748 23.320
104 HH12 ARG 13 HH12 ARG 13 26.153 36.656 23.359
105 HH21 ARG 13 HH21 ARG 13 25.801 37.170 26.660
106 HH22 ARG 13 HH22 ARG 13 25.039 36.834 25.089
107 H SER 14 H SER 14 30.946 33.923 28.995
108 HA SER 14 HA SER 14 32.047 35.913 30.706
109 HB2 SER 14 HB2 SER 14 31.482 33.019 31.421
110 HB3 SER 14 HB3 SER 14 31.582 34.401 32.519
111 HG SER 14 HG SER 14 29.602 33.909 30.519
112 H LEU 15 H LEU 15 33.721 33.542 28.908
113 HA LEU 15 HA LEU 15 36.221 33.883 30.521
114 HB2 LEU 15 HB2 LEU 15 35.629 31.833 28.354
115 HB3 LEU 15 HB3 LEU 15 37.034 31.892 29.403
116 HG LEU 15 HG LEU 15 34.182 31.294 30.299
117 HD11 LEU 15 HD11 LEU 15 35.186 29.503 28.934
118 HD12 LEU 15 HD12 LEU 15 36.601 29.468 30.008
119 HD13 LEU 15 HD13 LEU 15 34.998 29.008 30.621
120 HD21 LEU 15 HD21 LEU 15 36.809 31.187 31.855
121 HD22 LEU 15 HD22 LEU 15 35.478 32.333 32.131
122 HD23 LEU 15 HD23 LEU 15 35.233 30.613 32.439
123 H GLY 16 H GLY 16 34.681 35.338 27.979
124 HA2 GLY 16 HA2 GLY 16 35.411 36.744 26.317
125 HA3 GLY 16 HA3 GLY 16 37.092 36.379 26.717
126 H LEU 17 H LEU 17 34.734 33.849 25.885
127 HA LEU 17 HA LEU 17 36.112 33.379 23.274
128 HB2 LEU 17 HB2 LEU 17 35.273 31.390 25.409
129 HB3 LEU 17 HB3 LEU 17 35.860 30.937 23.815
130 HG LEU 17 HG LEU 17 37.435 32.485 25.872
131 HD11 LEU 17 HD11 LEU 17 37.709 29.572 25.121
132 HD12 LEU 17 HD12 LEU 17 38.768 30.479 26.213
133 HD13 LEU 17 HD13 LEU 17 37.085 30.226 26.663
134 HD21 LEU 17 HD21 LEU 17 39.414 32.006 24.479
135 HD22 LEU 17 HD22 LEU 17 38.393 31.178 23.297
136 HD23 LEU 17 HD23 LEU 17 38.233 32.929 23.547
137 H LEU 18 H LEU 18 35.025 32.214 21.701
138 HA LEU 18 HA LEU 18 32.195 32.742 21.346
139 HB2 LEU 18 HB2 LEU 18 33.733 32.719 19.439
140 HB3 LEU 18 HB3 LEU 18 34.255 31.088 19.845
141 HG LEU 18 HG LEU 18 31.980 30.224 19.324
142 HD11 LEU 18 HD11 LEU 18 30.397 31.618 18.088
143 HD12 LEU 18 HD12 LEU 18 30.646 32.291 19.704
144 HD13 LEU 18 HD13 LEU 18 31.447 33.035 18.300
145 HD21 LEU 18 HD21 LEU 18 33.767 30.198 17.637
146 HD22 LEU 18 HD22 LEU 18 32.172 30.432 16.895
147 HD23 LEU 18 HD23 LEU 18 33.275 31.813 17.094
148 H GLY 19 H GLY 19 30.549 31.480 21.979
149 HA2 GLY 19 HA2 GLY 19 30.972 28.785 23.124
150 HA3 GLY 19 HA3 GLY 19 29.434 29.635 22.962
151 H LYS 20 H LYS 20 31.308 27.150 21.783
152 HA LYS 20 HA LYS 20 29.961 26.941 19.140
153 HB2 LYS 20 HB2 LYS 20 32.461 27.265 19.206
154 HB3 LYS 20 HB3 LYS 20 32.603 25.854 20.250
155 HG2 LYS 20 HG2 LYS 20 33.187 25.090 18.098
156 HG3 LYS 20 HG3 LYS 20 31.564 24.475 18.375
157 HD2 LYS 20 HD2 LYS 20 30.914 26.828 17.160
158 HD3 LYS 20 HD3 LYS 20 32.554 26.618 16.506
159 HE2 LYS 20 HE2 LYS 20 31.774 24.162 16.027
160 HE3 LYS 20 HE3 LYS 20 30.142 24.778 16.310
161 HZ1 LYS 20 HZ1 LYS 20 30.611 24.887 13.984
162 HZ2 LYS 20 HZ2 LYS 20 30.613 26.439 14.535
163 HZ3 LYS 20 HZ3 LYS 20 32.036 25.693 14.195
164 H CYS 21 H CYS 21 28.667 25.191 18.775
165 HA CYS 21 HA CYS 21 28.677 22.933 20.747
166 HB2 CYS 21 HB2 CYS 21 26.535 23.882 20.708
167 HB3 CYS 21 HB3 CYS 21 26.524 24.039 18.943
168 H ILE 22 H ILE 22 29.404 21.015 20.144
169 HA ILE 22 HA ILE 22 29.962 20.405 17.290
170 HB ILE 22 HB ILE 22 30.392 18.800 19.823
171 HG12 ILE 22 HG12 ILE 22 32.293 20.180 17.865
172 HG13 ILE 22 HG13 ILE 22 31.908 20.726 19.498
173 HG21 ILE 22 HG21 ILE 22 31.121 18.056 16.948
174 HG22 ILE 22 HG22 ILE 22 31.521 17.133 18.415
175 HG23 ILE 22 HG23 ILE 22 29.853 17.269 17.913
176 HD11 ILE 22 HD11 ILE 22 34.062 19.669 19.534
177 HD12 ILE 22 HD12 ILE 22 32.927 18.623 20.413
178 HD13 ILE 22 HD13 ILE 22 33.454 18.214 18.758
179 H GLY 23 H GLY 23 28.054 18.716 19.812
180 HA2 GLY 23 HA2 GLY 23 25.628 18.695 18.186
181 HA3 GLY 23 HA3 GLY 23 26.396 17.102 18.321
182 H GLU 24 H GLU 24 27.306 17.124 20.912
183 HA GLU 24 HA GLU 24 24.989 17.720 22.746
184 HB2 GLU 24 HB2 GLU 24 27.211 15.646 22.988
185 HB3 GLU 24 HB3 GLU 24 26.059 16.030 24.260
186 HG2 GLU 24 HG2 GLU 24 24.210 15.158 23.006
187 HG3 GLU 24 HG3 GLU 24 25.196 14.990 21.545
188 H GLU 25 H GLU 25 28.485 17.955 22.148
189 HA GLU 25 HA GLU 25 29.059 19.124 24.742
190 HB2 GLU 25 HB2 GLU 25 30.467 17.411 23.581
191 HB3 GLU 25 HB3 GLU 25 30.805 18.589 22.321
192 HG2 GLU 25 HG2 GLU 25 32.700 18.600 23.675
193 HG3 GLU 25 HG3 GLU 25 31.852 20.074 24.113
194 H CYS 26 H CYS 26 29.299 21.143 25.282
195 HA CYS 26 HA CYS 26 29.388 23.388 23.346
196 HB2 CYS 26 HB2 CYS 26 27.877 23.762 25.176
197 HB3 CYS 26 HB3 CYS 26 29.024 23.094 26.339
198 H LYS 27 H LYS 27 31.384 24.050 22.704
199 HA LYS 27 HA LYS 27 33.660 23.937 24.626
200 HB2 LYS 27 HB2 LYS 27 33.841 24.075 21.608
201 HB3 LYS 27 HB3 LYS 27 35.125 23.757 22.788
202 HG2 LYS 27 HG2 LYS 27 33.497 21.727 23.479
203 HG3 LYS 27 HG3 LYS 27 32.893 21.949 21.827
204 HD2 LYS 27 HD2 LYS 27 35.688 21.346 22.781
205 HD3 LYS 27 HD3 LYS 27 34.590 20.274 21.887
206 HE2 LYS 27 HE2 LYS 27 34.720 21.775 19.918
207 HE3 LYS 27 HE3 LYS 27 35.781 22.879 20.804
208 HZ1 LYS 27 HZ1 LYS 27 37.530 21.580 20.426
209 HZ2 LYS 27 HZ2 LYS 27 36.731 20.147 20.718
210 HZ3 LYS 27 HZ3 LYS 27 36.638 20.882 19.256
211 H CYS 28 H CYS 28 35.117 25.550 24.717
212 HA CYS 28 HA CYS 28 34.178 28.301 23.936
213 HB2 CYS 28 HB2 CYS 28 35.934 27.531 26.261
214 HB3 CYS 28 HB3 CYS 28 35.333 29.126 25.832
215 H VAL 29 H VAL 29 35.283 29.189 22.374
216 HA VAL 29 HA VAL 29 38.115 28.462 21.816
217 HB VAL 29 HB VAL 29 37.555 28.016 19.450
218 HG11 VAL 29 HG11 VAL 29 36.047 26.120 21.280
219 HG12 VAL 29 HG12 VAL 29 36.754 25.766 19.694
220 HG13 VAL 29 HG13 VAL 29 37.812 26.140 21.067
221 HG21 VAL 29 HG21 VAL 29 35.407 29.182 19.241
222 HG22 VAL 29 HG22 VAL 29 35.263 27.493 18.756
223 HG23 VAL 29 HG23 VAL 29 34.640 28.011 20.337
224 HA PRO 30 HA PRO 30 38.483 32.688 20.495
225 HB2 PRO 30 HB2 PRO 30 39.786 31.679 17.967
226 HB3 PRO 30 HB3 PRO 30 40.335 32.978 19.075
227 HG2 PRO 30 HG2 PRO 30 41.489 30.530 19.182
228 HG3 PRO 30 HG3 PRO 30 41.054 31.377 20.705
229 HD2 PRO 30 HD2 PRO 30 39.523 29.188 19.272
230 HD3 PRO 30 HD3 PRO 30 39.903 29.353 21.011
231 H TYR 31 H TYR 31 37.359 34.222 19.267
232 HA TYR 31 HA TYR 31 35.212 33.371 17.480
233 HB2 TYR 31 HB2 TYR 31 36.340 36.130 18.060
234 HB3 TYR 31 HB3 TYR 31 34.907 35.815 17.106
235 HD1 TYR 31 HD1 TYR 31 32.767 35.166 18.163
236 HD2 TYR 31 HD2 TYR 31 36.308 35.866 20.498
237 HE1 TYR 31 HE1 TYR 31 31.377 35.386 20.223
238 HE2 TYR 31 HE2 TYR 31 34.935 36.089 22.549
239 HH TYR 31 HH TYR 31 32.813 36.477 23.296
240 H ASN 32 H ASN 32 35.004 33.751 15.279
241 HA ASN 32 HA ASN 32 37.505 33.504 13.698
242 HB2 ASN 32 HB2 ASN 32 34.576 32.944 13.054
243 HB3 ASN 32 HB3 ASN 32 35.886 32.779 11.894
244 HD21 ASN 32 HD21 ASN 32 35.363 29.393 12.982
245 HD22 ASN 32 HD22 ASN 32 34.604 30.614 11.968
Start of MODEL 4
1 H1 ALA 1 H1 ALA 1 19.370 14.134 23.645
2 H2 ALA 1 H2 ALA 1 20.262 15.313 24.374
3 H3 ALA 1 H3 ALA 1 20.855 14.511 23.054
4 HA ALA 1 HA ALA 1 19.181 15.376 21.660
5 HB1 ALA 1 HB1 ALA 1 18.263 16.869 24.154
6 HB2 ALA 1 HB2 ALA 1 17.630 17.123 22.511
7 HB3 ALA 1 HB3 ALA 1 17.393 15.570 23.307
8 H PHE 2 H PHE 2 19.126 17.698 20.812
9 HA PHE 2 HA PHE 2 21.585 18.674 20.217
10 HB2 PHE 2 HB2 PHE 2 19.059 20.331 20.538
11 HB3 PHE 2 HB3 PHE 2 20.493 20.843 19.669
12 HD1 PHE 2 HD1 PHE 2 17.455 18.794 19.510
13 HD2 PHE 2 HD2 PHE 2 21.162 19.772 17.527
14 HE1 PHE 2 HE1 PHE 2 16.641 17.701 17.439
15 HE2 PHE 2 HE2 PHE 2 20.325 18.704 15.441
16 HZ PHE 2 HZ PHE 2 18.069 17.660 15.402
17 H CYS 3 H CYS 3 23.106 20.082 20.864
18 HA CYS 3 HA CYS 3 23.622 20.599 23.515
19 HB2 CYS 3 HB2 CYS 3 25.361 22.107 22.679
20 HB3 CYS 3 HB3 CYS 3 25.295 20.624 21.727
21 H ASN 4 H ASN 4 23.478 22.327 24.984
22 HA ASN 4 HA ASN 4 21.525 24.414 24.552
23 HB2 ASN 4 HB2 ASN 4 21.975 23.040 26.659
24 HB3 ASN 4 HB3 ASN 4 23.451 23.994 26.871
25 HD21 ASN 4 HD21 ASN 4 20.703 25.550 28.801
26 HD22 ASN 4 HD22 ASN 4 21.431 23.936 28.787
27 H LEU 5 H LEU 5 22.918 25.013 22.536
28 HA LEU 5 HA LEU 5 25.359 26.432 22.709
29 HB2 LEU 5 HB2 LEU 5 24.136 25.574 20.682
30 HB3 LEU 5 HB3 LEU 5 23.061 26.952 20.773
31 HG LEU 5 HG LEU 5 26.094 27.218 20.555
32 HD11 LEU 5 HD11 LEU 5 25.260 25.866 18.657
33 HD12 LEU 5 HD12 LEU 5 24.078 27.136 18.263
34 HD13 LEU 5 HD13 LEU 5 25.826 27.446 18.136
35 HD21 LEU 5 HD21 LEU 5 23.790 29.117 19.861
36 HD22 LEU 5 HD22 LEU 5 25.043 29.364 21.096
37 HD23 LEU 5 HD23 LEU 5 25.483 29.389 19.412
38 H ARG 6 H ARG 6 22.001 27.536 23.146
39 HA ARG 6 HA ARG 6 22.457 30.316 23.437
40 HB2 ARG 6 HB2 ARG 6 20.284 29.194 23.092
41 HB3 ARG 6 HB3 ARG 6 20.372 28.459 24.689
42 HG2 ARG 6 HG2 ARG 6 20.175 30.697 25.745
43 HG3 ARG 6 HG3 ARG 6 20.234 31.459 24.149
44 HD2 ARG 6 HD2 ARG 6 17.933 31.376 24.834
45 HD3 ARG 6 HD3 ARG 6 18.181 30.240 23.507
46 HE ARG 6 HE ARG 6 18.370 29.057 26.206
47 HH11 ARG 6 HH11 ARG 6 16.265 29.599 23.429
48 HH12 ARG 6 HH12 ARG 6 15.146 28.359 23.922
49 HH21 ARG 6 HH21 ARG 6 16.659 27.762 26.955
50 HH22 ARG 6 HH22 ARG 6 15.299 27.456 25.902
51 H ARG 7 H ARG 7 22.808 27.789 25.974
52 HA ARG 7 HA ARG 7 23.576 29.835 27.973
53 HB2 ARG 7 HB2 ARG 7 22.500 27.598 28.542
54 HB3 ARG 7 HB3 ARG 7 24.038 26.826 28.116
55 HG2 ARG 7 HG2 ARG 7 25.127 28.409 29.836
56 HG3 ARG 7 HG3 ARG 7 23.496 28.873 30.325
57 HD2 ARG 7 HD2 ARG 7 24.679 26.062 30.394
58 HD3 ARG 7 HD3 ARG 7 24.532 27.166 31.773
59 HE ARG 7 HE ARG 7 21.938 26.791 30.635
60 HH11 ARG 7 HH11 ARG 7 24.270 25.068 32.643
61 HH12 ARG 7 HH12 ARG 7 22.988 24.164 33.431
62 HH21 ARG 7 HH21 ARG 7 20.453 25.511 31.567
63 HH22 ARG 7 HH22 ARG 7 20.903 24.386 32.840
64 H CYS 8 H CYS 8 25.223 27.571 25.807
65 HA CYS 8 HA CYS 8 27.887 27.898 26.792
66 HB2 CYS 8 HB2 CYS 8 26.879 26.092 25.281
67 HB3 CYS 8 HB3 CYS 8 26.889 27.277 23.986
68 H GLU 9 H GLU 9 26.228 29.774 24.181
69 HA GLU 9 HA GLU 9 28.538 31.226 23.465
70 HB2 GLU 9 HB2 GLU 9 27.078 32.846 22.486
71 HB3 GLU 9 HB3 GLU 9 26.428 31.224 22.183
72 HG2 GLU 9 HG2 GLU 9 24.722 31.569 23.894
73 HG3 GLU 9 HG3 GLU 9 25.382 33.157 24.291
74 H LEU 10 H LEU 10 26.358 31.748 26.232
75 HA LEU 10 HA LEU 10 27.720 34.277 26.911
76 HB2 LEU 10 HB2 LEU 10 25.977 34.853 28.207
77 HB3 LEU 10 HB3 LEU 10 25.208 33.875 26.992
78 HG LEU 10 HG LEU 10 25.493 31.946 28.849
79 HD11 LEU 10 HD11 LEU 10 25.128 32.843 31.113
80 HD12 LEU 10 HD12 LEU 10 26.693 33.377 30.510
81 HD13 LEU 10 HD13 LEU 10 25.323 34.501 30.510
82 HD21 LEU 10 HD21 LEU 10 23.366 32.696 27.906
83 HD22 LEU 10 HD22 LEU 10 23.241 32.491 29.655
84 HD23 LEU 10 HD23 LEU 10 23.384 34.126 28.964
85 H SER 11 H SER 11 27.549 30.969 28.077
86 HA SER 11 HA SER 11 29.046 31.235 30.517
87 HB2 SER 11 HB2 SER 11 27.658 29.303 30.068
88 HB3 SER 11 HB3 SER 11 28.535 28.960 28.571
89 HG SER 11 HG SER 11 29.536 28.760 31.229
90 H CYS 12 H CYS 12 30.019 30.637 27.126
91 HA CYS 12 HA CYS 12 32.877 30.726 27.737
92 HB2 CYS 12 HB2 CYS 12 31.313 30.841 25.127
93 HB3 CYS 12 HB3 CYS 12 33.061 30.666 25.262
94 H ARG 13 H ARG 13 30.389 33.089 26.841
95 HA ARG 13 HA ARG 13 32.239 35.231 26.112
96 HB2 ARG 13 HB2 ARG 13 29.869 35.402 25.551
97 HB3 ARG 13 HB3 ARG 13 29.440 35.406 27.268
98 HG2 ARG 13 HG2 ARG 13 30.639 37.559 27.562
99 HG3 ARG 13 HG3 ARG 13 31.095 37.508 25.849
100 HD2 ARG 13 HD2 ARG 13 29.243 38.999 26.154
101 HD3 ARG 13 HD3 ARG 13 28.675 37.574 25.258
102 HE ARG 13 HE ARG 13 28.276 37.297 28.131
103 HH11 ARG 13 HH11 ARG 13 26.853 38.980 25.377
104 HH12 ARG 13 HH12 ARG 13 25.244 38.873 26.097
105 HH21 ARG 13 HH21 ARG 13 26.218 37.451 29.014
106 HH22 ARG 13 HH22 ARG 13 24.912 37.994 27.959
107 H SER 14 H SER 14 30.998 34.112 29.260
108 HA SER 14 HA SER 14 32.092 36.101 30.881
109 HB2 SER 14 HB2 SER 14 31.891 33.124 31.461
110 HB3 SER 14 HB3 SER 14 32.130 34.390 32.675
111 HG SER 14 HG SER 14 29.886 33.626 32.245
112 H LEU 15 H LEU 15 33.774 33.602 29.114
113 HA LEU 15 HA LEU 15 36.394 34.138 30.413
114 HB2 LEU 15 HB2 LEU 15 35.692 32.055 28.319
115 HB3 LEU 15 HB3 LEU 15 37.153 32.149 29.291
116 HG LEU 15 HG LEU 15 34.358 31.485 30.311
117 HD11 LEU 15 HD11 LEU 15 35.294 29.248 30.668
118 HD12 LEU 15 HD12 LEU 15 35.424 29.708 28.965
119 HD13 LEU 15 HD13 LEU 15 36.860 29.770 30.014
120 HD21 LEU 15 HD21 LEU 15 35.507 30.909 32.443
121 HD22 LEU 15 HD22 LEU 15 37.032 31.557 31.797
122 HD23 LEU 15 HD23 LEU 15 35.645 32.632 32.084
123 H GLY 16 H GLY 16 34.662 35.535 27.934
124 HA2 GLY 16 HA2 GLY 16 35.313 36.975 26.258
125 HA3 GLY 16 HA3 GLY 16 37.009 36.613 26.584
126 H LEU 17 H LEU 17 34.727 34.009 25.858
127 HA LEU 17 HA LEU 17 36.043 33.554 23.207
128 HB2 LEU 17 HB2 LEU 17 35.206 31.537 25.320
129 HB3 LEU 17 HB3 LEU 17 35.852 31.130 23.738
130 HG LEU 17 HG LEU 17 37.290 32.502 26.001
131 HD11 LEU 17 HD11 LEU 17 37.695 29.777 24.753
132 HD12 LEU 17 HD12 LEU 17 38.762 30.513 25.957
133 HD13 LEU 17 HD13 LEU 17 37.098 30.147 26.397
134 HD21 LEU 17 HD21 LEU 17 39.356 32.345 24.613
135 HD22 LEU 17 HD22 LEU 17 38.382 31.754 23.251
136 HD23 LEU 17 HD23 LEU 17 38.173 33.408 23.863
137 H LEU 18 H LEU 18 34.916 32.237 21.698
138 HA LEU 18 HA LEU 18 32.004 32.685 21.541
139 HB2 LEU 18 HB2 LEU 18 33.992 31.250 19.732
140 HB3 LEU 18 HB3 LEU 18 32.266 31.392 19.395
141 HG LEU 18 HG LEU 18 34.184 33.747 19.629
142 HD11 LEU 18 HD11 LEU 18 32.870 32.559 17.154
143 HD12 LEU 18 HD12 LEU 18 34.004 33.918 17.222
144 HD13 LEU 18 HD13 LEU 18 34.572 32.295 17.629
145 HD21 LEU 18 HD21 LEU 18 31.242 33.543 18.835
146 HD22 LEU 18 HD22 LEU 18 31.925 34.461 20.196
147 HD23 LEU 18 HD23 LEU 18 32.242 34.968 18.532
148 H GLY 19 H GLY 19 30.471 31.107 21.691
149 HA2 GLY 19 HA2 GLY 19 31.205 28.474 22.912
150 HA3 GLY 19 HA3 GLY 19 29.597 29.195 22.860
151 H LYS 20 H LYS 20 31.623 26.974 21.459
152 HA LYS 20 HA LYS 20 29.990 26.714 18.925
153 HB2 LYS 20 HB2 LYS 20 32.931 26.352 19.440
154 HB3 LYS 20 HB3 LYS 20 32.167 25.191 18.390
155 HG2 LYS 20 HG2 LYS 20 33.128 26.919 17.062
156 HG3 LYS 20 HG3 LYS 20 31.367 26.928 16.880
157 HD2 LYS 20 HD2 LYS 20 31.164 28.921 18.254
158 HD3 LYS 20 HD3 LYS 20 32.850 28.802 18.764
159 HE2 LYS 20 HE2 LYS 20 32.827 30.491 17.112
160 HE3 LYS 20 HE3 LYS 20 33.532 29.074 16.327
161 HZ1 LYS 20 HZ1 LYS 20 31.884 30.170 14.939
162 HZ2 LYS 20 HZ2 LYS 20 31.326 28.671 15.300
163 HZ3 LYS 20 HZ3 LYS 20 30.734 30.022 16.084
164 H CYS 21 H CYS 21 28.807 24.935 18.681
165 HA CYS 21 HA CYS 21 28.902 22.843 20.711
166 HB2 CYS 21 HB2 CYS 21 27.239 23.070 18.216
167 HB3 CYS 21 HB3 CYS 21 27.188 21.716 19.342
168 H ILE 22 H ILE 22 29.630 20.862 20.623
169 HA ILE 22 HA ILE 22 31.581 20.049 18.529
170 HB ILE 22 HB ILE 22 31.007 18.991 21.320
171 HG12 ILE 22 HG12 ILE 22 31.939 21.204 21.563
172 HG13 ILE 22 HG13 ILE 22 33.131 20.008 22.029
173 HG21 ILE 22 HG21 ILE 22 31.984 17.185 20.108
174 HG22 ILE 22 HG22 ILE 22 33.214 18.246 19.381
175 HG23 ILE 22 HG23 ILE 22 33.253 17.864 21.116
176 HD11 ILE 22 HD11 ILE 22 33.083 21.544 19.393
177 HD12 ILE 22 HD12 ILE 22 34.188 21.798 20.752
178 HD13 ILE 22 HD13 ILE 22 34.284 20.298 19.822
179 H GLY 23 H GLY 23 28.365 19.636 19.360
180 HA2 GLY 23 HA2 GLY 23 26.748 18.232 18.303
181 HA3 GLY 23 HA3 GLY 23 28.004 17.060 17.899
182 H GLU 24 H GLU 24 25.446 17.573 19.904
183 HA GLU 24 HA GLU 24 24.651 16.891 21.855
184 HB2 GLU 24 HB2 GLU 24 26.540 14.673 22.308
185 HB3 GLU 24 HB3 GLU 24 24.798 14.715 22.349
186 HG2 GLU 24 HG2 GLU 24 26.624 14.344 19.956
187 HG3 GLU 24 HG3 GLU 24 25.512 13.208 20.654
188 H GLU 25 H GLU 25 27.232 18.599 21.815
189 HA GLU 25 HA GLU 25 27.692 19.074 24.656
190 HB2 GLU 25 HB2 GLU 25 29.043 17.065 24.278
191 HB3 GLU 25 HB3 GLU 25 29.743 17.750 22.826
192 HG2 GLU 25 HG2 GLU 25 31.338 17.702 24.659
193 HG3 GLU 25 HG3 GLU 25 31.031 19.354 24.138
194 H CYS 26 H CYS 26 29.254 21.028 24.886
195 HA CYS 26 HA CYS 26 29.873 22.541 22.461
196 HB2 CYS 26 HB2 CYS 26 27.500 23.112 22.924
197 HB3 CYS 26 HB3 CYS 26 27.962 23.688 24.525
198 H LYS 27 H LYS 27 31.476 24.053 22.657
199 HA LYS 27 HA LYS 27 32.902 24.286 25.281
200 HB2 LYS 27 HB2 LYS 27 33.662 22.796 22.838
201 HB3 LYS 27 HB3 LYS 27 34.874 23.967 23.298
202 HG2 LYS 27 HG2 LYS 27 35.352 21.783 24.188
203 HG3 LYS 27 HG3 LYS 27 35.173 22.961 25.472
204 HD2 LYS 27 HD2 LYS 27 32.742 21.320 24.766
205 HD3 LYS 27 HD3 LYS 27 34.103 20.493 25.496
206 HE2 LYS 27 HE2 LYS 27 34.117 22.138 27.375
207 HE3 LYS 27 HE3 LYS 27 32.661 22.891 26.708
208 HZ1 LYS 27 HZ1 LYS 27 32.124 21.204 28.445
209 HZ2 LYS 27 HZ2 LYS 27 31.495 20.781 26.999
210 HZ3 LYS 27 HZ3 LYS 27 32.859 20.052 27.528
211 H CYS 28 H CYS 28 34.626 25.785 25.344
212 HA CYS 28 HA CYS 28 33.950 28.367 24.044
213 HB2 CYS 28 HB2 CYS 28 35.789 27.762 26.356
214 HB3 CYS 28 HB3 CYS 28 35.153 29.326 25.830
215 H VAL 29 H VAL 29 35.144 29.262 22.493
216 HA VAL 29 HA VAL 29 37.963 28.438 22.033
217 HB VAL 29 HB VAL 29 37.361 28.117 19.570
218 HG11 VAL 29 HG11 VAL 29 37.979 26.250 21.082
219 HG12 VAL 29 HG12 VAL 29 36.260 26.016 21.473
220 HG13 VAL 29 HG13 VAL 29 36.842 25.779 19.813
221 HG21 VAL 29 HG21 VAL 29 35.060 29.049 19.682
222 HG22 VAL 29 HG22 VAL 29 35.132 27.422 18.991
223 HG23 VAL 29 HG23 VAL 29 34.558 27.651 20.662
224 HA PRO 30 HA PRO 30 38.463 32.643 20.839
225 HB2 PRO 30 HB2 PRO 30 40.633 32.565 19.141
226 HB3 PRO 30 HB3 PRO 30 40.714 32.267 20.898
227 HG2 PRO 30 HG2 PRO 30 40.615 30.257 18.644
228 HG3 PRO 30 HG3 PRO 30 41.653 30.268 20.105
229 HD2 PRO 30 HD2 PRO 30 39.370 28.782 19.898
230 HD3 PRO 30 HD3 PRO 30 39.954 29.433 21.451
231 H TYR 31 H TYR 31 39.034 34.033 18.711
232 HA TYR 31 HA TYR 31 36.693 33.631 16.943
233 HB2 TYR 31 HB2 TYR 31 38.446 36.038 17.526
234 HB3 TYR 31 HB3 TYR 31 37.115 36.019 16.376
235 HD1 TYR 31 HD1 TYR 31 34.953 36.603 17.070
236 HD2 TYR 31 HD2 TYR 31 37.836 35.407 20.044
237 HE1 TYR 31 HE1 TYR 31 33.317 37.127 18.867
238 HE2 TYR 31 HE2 TYR 31 36.160 35.847 21.827
239 HH TYR 31 HH TYR 31 32.809 36.783 21.145
240 H ASN 32 H ASN 32 38.039 31.775 16.014
241 HA ASN 32 HA ASN 32 40.295 32.131 14.341
242 HB2 ASN 32 HB2 ASN 32 38.094 30.032 14.119
243 HB3 ASN 32 HB3 ASN 32 39.699 29.931 13.417
244 HD21 ASN 32 HD21 ASN 32 41.004 28.428 16.310
245 HD22 ASN 32 HD22 ASN 32 41.084 28.639 14.558
Start of MODEL 5
1 H1 ALA 1 H1 ALA 1 15.924 15.981 24.687
2 H2 ALA 1 H2 ALA 1 17.566 15.813 24.680
3 H3 ALA 1 H3 ALA 1 16.714 15.675 23.282
4 HA ALA 1 HA ALA 1 16.107 17.962 23.324
5 HB1 ALA 1 HB1 ALA 1 17.801 18.127 25.852
6 HB2 ALA 1 HB2 ALA 1 16.886 19.442 25.081
7 HB3 ALA 1 HB3 ALA 1 16.024 18.092 25.840
8 H PHE 2 H PHE 2 17.436 19.550 22.293
9 HA PHE 2 HA PHE 2 19.967 18.721 21.201
10 HB2 PHE 2 HB2 PHE 2 18.842 21.532 21.477
11 HB3 PHE 2 HB3 PHE 2 20.100 21.021 20.364
12 HD1 PHE 2 HD1 PHE 2 16.599 21.555 20.741
13 HD2 PHE 2 HD2 PHE 2 19.471 19.106 18.672
14 HE1 PHE 2 HE1 PHE 2 14.859 20.884 19.127
15 HE2 PHE 2 HE2 PHE 2 17.726 18.459 17.017
16 HZ PHE 2 HZ PHE 2 15.419 19.360 17.240
17 H CYS 3 H CYS 3 22.018 20.023 21.413
18 HA CYS 3 HA CYS 3 22.992 20.171 24.115
19 HB2 CYS 3 HB2 CYS 3 24.999 21.134 23.063
20 HB3 CYS 3 HB3 CYS 3 24.441 19.667 22.260
21 H ASN 4 H ASN 4 23.720 21.995 25.298
22 HA ASN 4 HA ASN 4 21.752 24.112 25.367
23 HB2 ASN 4 HB2 ASN 4 24.212 23.585 27.042
24 HB3 ASN 4 HB3 ASN 4 22.967 24.765 27.442
25 HD21 ASN 4 HD21 ASN 4 22.393 21.471 29.226
26 HD22 ASN 4 HD22 ASN 4 23.884 22.386 28.937
27 H LEU 5 H LEU 5 22.753 24.705 22.970
28 HA LEU 5 HA LEU 5 25.099 26.263 22.796
29 HB2 LEU 5 HB2 LEU 5 24.003 25.343 20.839
30 HB3 LEU 5 HB3 LEU 5 22.560 26.318 21.144
31 HG LEU 5 HG LEU 5 23.787 28.390 20.657
32 HD11 LEU 5 HD11 LEU 5 26.044 28.279 19.639
33 HD12 LEU 5 HD12 LEU 5 26.086 27.767 21.329
34 HD13 LEU 5 HD13 LEU 5 26.130 26.548 20.027
35 HD21 LEU 5 HD21 LEU 5 24.231 26.323 18.485
36 HD22 LEU 5 HD22 LEU 5 22.672 27.081 18.834
37 HD23 LEU 5 HD23 LEU 5 24.034 28.073 18.272
38 H ARG 6 H ARG 6 21.749 27.396 23.452
39 HA ARG 6 HA ARG 6 22.436 30.200 23.371
40 HB2 ARG 6 HB2 ARG 6 20.049 28.578 24.043
41 HB3 ARG 6 HB3 ARG 6 20.200 29.994 25.065
42 HG2 ARG 6 HG2 ARG 6 18.855 30.420 23.042
43 HG3 ARG 6 HG3 ARG 6 20.233 31.502 23.210
44 HD2 ARG 6 HD2 ARG 6 19.929 30.812 20.885
45 HD3 ARG 6 HD3 ARG 6 21.484 30.241 21.498
46 HE ARG 6 HE ARG 6 19.720 28.151 21.990
47 HH11 ARG 6 HH11 ARG 6 21.064 29.684 19.114
48 HH12 ARG 6 HH12 ARG 6 20.460 28.399 18.072
49 HH21 ARG 6 HH21 ARG 6 18.802 26.749 20.556
50 HH22 ARG 6 HH22 ARG 6 19.322 26.740 18.870
51 H ARG 7 H ARG 7 22.588 27.933 25.996
52 HA ARG 7 HA ARG 7 23.498 30.048 27.869
53 HB2 ARG 7 HB2 ARG 7 22.238 28.037 28.594
54 HB3 ARG 7 HB3 ARG 7 23.680 27.048 28.267
55 HG2 ARG 7 HG2 ARG 7 24.953 28.346 29.961
56 HG3 ARG 7 HG3 ARG 7 23.591 29.457 30.149
57 HD2 ARG 7 HD2 ARG 7 23.566 27.933 32.006
58 HD3 ARG 7 HD3 ARG 7 22.174 27.595 30.965
59 HE ARG 7 HE ARG 7 24.510 25.965 30.334
60 HH11 ARG 7 HH11 ARG 7 21.690 26.093 32.497
61 HH12 ARG 7 HH12 ARG 7 21.803 24.356 32.775
62 HH21 ARG 7 HH21 ARG 7 24.466 23.758 30.835
63 HH22 ARG 7 HH22 ARG 7 23.270 23.180 32.011
64 H CYS 8 H CYS 8 25.129 27.536 25.942
65 HA CYS 8 HA CYS 8 27.806 27.955 26.825
66 HB2 CYS 8 HB2 CYS 8 26.986 26.057 25.457
67 HB3 CYS 8 HB3 CYS 8 26.577 27.169 24.151
68 H GLU 9 H GLU 9 26.098 29.621 24.120
69 HA GLU 9 HA GLU 9 28.346 31.191 23.379
70 HB2 GLU 9 HB2 GLU 9 26.878 32.414 22.011
71 HB3 GLU 9 HB3 GLU 9 26.330 30.738 21.986
72 HG2 GLU 9 HG2 GLU 9 24.581 31.363 23.665
73 HG3 GLU 9 HG3 GLU 9 25.090 33.055 23.566
74 H LEU 10 H LEU 10 26.203 31.678 26.094
75 HA LEU 10 HA LEU 10 27.329 34.409 26.524
76 HB2 LEU 10 HB2 LEU 10 25.563 34.788 28.111
77 HB3 LEU 10 HB3 LEU 10 24.984 34.365 26.522
78 HG LEU 10 HG LEU 10 24.520 32.015 27.436
79 HD11 LEU 10 HD11 LEU 10 23.953 31.974 29.891
80 HD12 LEU 10 HD12 LEU 10 25.679 32.033 29.613
81 HD13 LEU 10 HD13 LEU 10 24.816 33.508 30.086
82 HD21 LEU 10 HD21 LEU 10 22.796 33.718 26.952
83 HD22 LEU 10 HD22 LEU 10 22.362 32.737 28.349
84 HD23 LEU 10 HD23 LEU 10 22.994 34.385 28.581
85 H SER 11 H SER 11 27.368 31.178 27.936
86 HA SER 11 HA SER 11 28.571 31.936 30.450
87 HB2 SER 11 HB2 SER 11 27.330 29.839 30.176
88 HB3 SER 11 HB3 SER 11 28.506 29.270 28.973
89 HG SER 11 HG SER 11 29.606 28.530 30.589
90 H CYS 12 H CYS 12 29.930 30.543 27.424
91 HA CYS 12 HA CYS 12 32.674 30.868 28.302
92 HB2 CYS 12 HB2 CYS 12 31.339 30.209 25.664
93 HB3 CYS 12 HB3 CYS 12 33.079 30.402 25.824
94 H ARG 13 H ARG 13 30.370 33.039 26.791
95 HA ARG 13 HA ARG 13 32.273 34.981 25.789
96 HB2 ARG 13 HB2 ARG 13 29.816 34.961 25.307
97 HB3 ARG 13 HB3 ARG 13 29.508 35.531 26.949
98 HG2 ARG 13 HG2 ARG 13 30.934 37.568 26.391
99 HG3 ARG 13 HG3 ARG 13 31.015 36.986 24.724
100 HD2 ARG 13 HD2 ARG 13 28.541 37.779 26.289
101 HD3 ARG 13 HD3 ARG 13 29.281 38.673 24.962
102 HE ARG 13 HE ARG 13 28.735 36.487 23.592
103 HH11 ARG 13 HH11 ARG 13 26.578 38.012 25.946
104 HH12 ARG 13 HH12 ARG 13 25.222 37.055 25.395
105 HH21 ARG 13 HH21 ARG 13 26.884 35.619 22.764
106 HH22 ARG 13 HH22 ARG 13 25.367 35.818 23.641
107 H SER 14 H SER 14 30.831 34.465 28.966
108 HA SER 14 HA SER 14 32.078 36.687 30.241
109 HB2 SER 14 HB2 SER 14 30.059 35.376 30.957
110 HB3 SER 14 HB3 SER 14 31.143 34.105 31.514
111 HG SER 14 HG SER 14 30.384 35.685 33.035
112 H LEU 15 H LEU 15 33.376 33.621 29.280
113 HA LEU 15 HA LEU 15 35.881 33.920 30.839
114 HB2 LEU 15 HB2 LEU 15 35.085 31.782 28.830
115 HB3 LEU 15 HB3 LEU 15 36.464 31.738 29.919
116 HG LEU 15 HG LEU 15 33.554 31.703 30.813
117 HD11 LEU 15 HD11 LEU 15 35.560 29.433 30.665
118 HD12 LEU 15 HD12 LEU 15 33.891 29.341 31.274
119 HD13 LEU 15 HD13 LEU 15 34.189 29.668 29.560
120 HD21 LEU 15 HD21 LEU 15 35.069 32.624 32.544
121 HD22 LEU 15 HD22 LEU 15 34.494 31.019 32.999
122 HD23 LEU 15 HD23 LEU 15 36.144 31.213 32.359
123 H GLY 16 H GLY 16 34.725 35.353 28.077
124 HA2 GLY 16 HA2 GLY 16 35.794 36.523 26.401
125 HA3 GLY 16 HA3 GLY 16 37.356 36.048 27.068
126 H LEU 17 H LEU 17 35.179 33.433 26.279
127 HA LEU 17 HA LEU 17 36.738 32.802 23.799
128 HB2 LEU 17 HB2 LEU 17 35.098 30.901 25.487
129 HB3 LEU 17 HB3 LEU 17 36.157 30.486 24.151
130 HG LEU 17 HG LEU 17 36.903 31.491 26.873
131 HD11 LEU 17 HD11 LEU 17 37.425 28.809 25.623
132 HD12 LEU 17 HD12 LEU 17 37.976 29.342 27.213
133 HD13 LEU 17 HD13 LEU 17 36.247 29.184 26.918
134 HD21 LEU 17 HD21 LEU 17 38.560 32.337 25.175
135 HD22 LEU 17 HD22 LEU 17 39.272 31.175 26.294
136 HD23 LEU 17 HD23 LEU 17 38.824 30.648 24.667
137 H LEU 18 H LEU 18 35.574 32.018 21.972
138 HA LEU 18 HA LEU 18 32.755 32.918 21.749
139 HB2 LEU 18 HB2 LEU 18 34.563 31.433 19.799
140 HB3 LEU 18 HB3 LEU 18 32.910 31.920 19.489
141 HG LEU 18 HG LEU 18 34.244 33.435 18.360
142 HD11 LEU 18 HD11 LEU 18 33.490 34.952 20.870
143 HD12 LEU 18 HD12 LEU 18 33.663 35.579 19.222
144 HD13 LEU 18 HD13 LEU 18 32.346 34.459 19.600
145 HD21 LEU 18 HD21 LEU 18 36.073 34.697 19.171
146 HD22 LEU 18 HD22 LEU 18 35.808 34.192 20.845
147 HD23 LEU 18 HD23 LEU 18 36.377 33.016 19.633
148 H GLY 19 H GLY 19 31.032 31.586 21.813
149 HA2 GLY 19 HA2 GLY 19 31.473 28.748 22.728
150 HA3 GLY 19 HA3 GLY 19 30.156 29.772 23.280
151 H LYS 20 H LYS 20 30.850 27.262 21.358
152 HA LYS 20 HA LYS 20 28.353 27.415 19.796
153 HB2 LYS 20 HB2 LYS 20 31.088 26.880 18.567
154 HB3 LYS 20 HB3 LYS 20 29.576 26.460 17.781
155 HG2 LYS 20 HG2 LYS 20 30.471 29.284 18.462
156 HG3 LYS 20 HG3 LYS 20 30.507 28.512 16.882
157 HD2 LYS 20 HD2 LYS 20 27.998 28.284 16.957
158 HD3 LYS 20 HD3 LYS 20 28.009 29.199 18.476
159 HE2 LYS 20 HE2 LYS 20 29.242 31.046 17.235
160 HE3 LYS 20 HE3 LYS 20 28.927 30.159 15.737
161 HZ1 LYS 20 HZ1 LYS 20 27.224 31.850 16.132
162 HZ2 LYS 20 HZ2 LYS 20 26.511 30.385 16.259
163 HZ3 LYS 20 HZ3 LYS 20 26.878 31.226 17.609
164 H CYS 21 H CYS 21 27.945 25.178 18.768
165 HA CYS 21 HA CYS 21 28.709 23.050 20.742
166 HB2 CYS 21 HB2 CYS 21 26.416 23.655 21.034
167 HB3 CYS 21 HB3 CYS 21 26.110 23.606 19.298
168 H ILE 22 H ILE 22 29.370 21.064 19.990
169 HA ILE 22 HA ILE 22 29.951 20.836 17.077
170 HB ILE 22 HB ILE 22 30.759 19.117 19.431
171 HG12 ILE 22 HG12 ILE 22 32.291 20.893 17.482
172 HG13 ILE 22 HG13 ILE 22 31.935 21.277 19.167
173 HG21 ILE 22 HG21 ILE 22 32.052 17.750 17.843
174 HG22 ILE 22 HG22 ILE 22 30.364 17.654 17.424
175 HG23 ILE 22 HG23 ILE 22 31.437 18.706 16.476
176 HD11 ILE 22 HD11 ILE 22 33.336 19.318 19.873
177 HD12 ILE 22 HD12 ILE 22 33.800 19.088 18.167
178 HD13 ILE 22 HD13 ILE 22 34.227 20.581 18.991
179 H GLY 23 H GLY 23 27.937 19.179 19.519
180 HA2 GLY 23 HA2 GLY 23 25.719 18.871 17.816
181 HA3 GLY 23 HA3 GLY 23 26.631 17.352 17.729
182 H GLU 24 H GLU 24 27.506 17.288 20.491
183 HA GLU 24 HA GLU 24 24.943 17.142 22.043
184 HB2 GLU 24 HB2 GLU 24 27.509 15.511 22.321
185 HB3 GLU 24 HB3 GLU 24 26.109 15.451 23.397
186 HG2 GLU 24 HG2 GLU 24 25.778 13.625 22.023
187 HG3 GLU 24 HG3 GLU 24 24.695 14.824 21.361
188 H GLU 25 H GLU 25 28.315 18.255 22.061
189 HA GLU 25 HA GLU 25 27.967 19.456 24.777
190 HB2 GLU 25 HB2 GLU 25 30.481 18.534 23.360
191 HB3 GLU 25 HB3 GLU 25 30.381 19.124 25.009
192 HG2 GLU 25 HG2 GLU 25 29.147 16.536 23.950
193 HG3 GLU 25 HG3 GLU 25 30.626 16.675 24.868
194 H CYS 26 H CYS 26 29.033 21.370 25.275
195 HA CYS 26 HA CYS 26 29.185 23.457 23.197
196 HB2 CYS 26 HB2 CYS 26 28.129 23.926 25.342
197 HB3 CYS 26 HB3 CYS 26 29.525 23.310 26.210
198 H LYS 27 H LYS 27 31.100 24.329 22.387
199 HA LYS 27 HA LYS 27 33.699 23.570 23.646
200 HB2 LYS 27 HB2 LYS 27 32.779 22.801 20.980
201 HB3 LYS 27 HB3 LYS 27 34.192 23.831 20.874
202 HG2 LYS 27 HG2 LYS 27 34.917 21.575 20.904
203 HG3 LYS 27 HG3 LYS 27 35.448 22.333 22.385
204 HD2 LYS 27 HD2 LYS 27 32.829 20.894 22.610
205 HD3 LYS 27 HD3 LYS 27 34.197 19.869 22.166
206 HE2 LYS 27 HE2 LYS 27 35.502 20.635 24.069
207 HE3 LYS 27 HE3 LYS 27 34.231 21.772 24.528
208 HZ1 LYS 27 HZ1 LYS 27 34.289 19.636 25.794
209 HZ2 LYS 27 HZ2 LYS 27 32.847 20.022 25.218
210 HZ3 LYS 27 HZ3 LYS 27 33.733 18.832 24.475
211 H CYS 28 H CYS 28 35.112 25.088 23.925
212 HA CYS 28 HA CYS 28 34.502 27.901 23.051
213 HB2 CYS 28 HB2 CYS 28 35.054 26.933 25.835
214 HB3 CYS 28 HB3 CYS 28 34.828 28.603 25.288
215 H VAL 29 H VAL 29 36.040 29.037 22.299
216 HA VAL 29 HA VAL 29 38.894 28.544 22.853
217 HB VAL 29 HB VAL 29 39.398 28.559 20.396
218 HG11 VAL 29 HG11 VAL 29 37.812 26.131 21.279
219 HG12 VAL 29 HG12 VAL 29 39.087 26.200 20.049
220 HG13 VAL 29 HG13 VAL 29 39.489 26.489 21.752
221 HG21 VAL 29 HG21 VAL 29 37.220 29.382 19.529
222 HG22 VAL 29 HG22 VAL 29 37.745 27.875 18.769
223 HG23 VAL 29 HG23 VAL 29 36.478 27.837 20.002
224 HA PRO 30 HA PRO 30 38.900 32.937 22.545
225 HB2 PRO 30 HB2 PRO 30 41.508 33.567 22.037
226 HB3 PRO 30 HB3 PRO 30 40.982 32.765 23.559
227 HG2 PRO 30 HG2 PRO 30 42.114 31.460 21.080
228 HG3 PRO 30 HG3 PRO 30 42.657 31.234 22.785
229 HD2 PRO 30 HD2 PRO 30 40.926 29.520 21.548
230 HD3 PRO 30 HD3 PRO 30 40.756 29.927 23.270
231 H TYR 31 H TYR 31 39.365 34.845 21.174
232 HA TYR 31 HA TYR 31 38.725 34.589 18.384
233 HB2 TYR 31 HB2 TYR 31 39.952 36.857 20.004
234 HB3 TYR 31 HB3 TYR 31 39.502 36.977 18.319
235 HD1 TYR 31 HD1 TYR 31 38.154 36.712 21.765
236 HD2 TYR 31 HD2 TYR 31 37.243 37.248 17.577
237 HE1 TYR 31 HE1 TYR 31 35.876 37.481 22.354
238 HE2 TYR 31 HE2 TYR 31 34.971 38.051 18.174
239 HH TYR 31 HH TYR 31 33.821 38.116 21.561
240 H ASN 32 H ASN 32 40.006 34.599 16.581
241 HA ASN 32 HA ASN 32 42.734 33.651 16.773
242 HB2 ASN 32 HB2 ASN 32 40.931 34.297 14.401
243 HB3 ASN 32 HB3 ASN 32 42.524 33.580 14.263
244 HD21 ASN 32 HD21 ASN 32 41.347 30.334 14.857
245 HD22 ASN 32 HD22 ASN 32 42.646 31.377 14.302
Start of MODEL 6
1 H1 ALA 1 H1 ALA 1 18.845 15.336 25.930
2 H2 ALA 1 H2 ALA 1 17.846 15.361 24.615
3 H3 ALA 1 H3 ALA 1 17.256 15.667 26.126
4 HA ALA 1 HA ALA 1 17.458 17.710 24.880
5 HB1 ALA 1 HB1 ALA 1 18.848 18.983 26.488
6 HB2 ALA 1 HB2 ALA 1 17.720 17.888 27.292
7 HB3 ALA 1 HB3 ALA 1 19.443 17.456 27.173
8 H PHE 2 H PHE 2 18.762 19.212 23.730
9 HA PHE 2 HA PHE 2 21.077 18.041 22.304
10 HB2 PHE 2 HB2 PHE 2 19.780 20.756 21.946
11 HB3 PHE 2 HB3 PHE 2 20.831 19.914 20.813
12 HD1 PHE 2 HD1 PHE 2 17.424 20.415 21.913
13 HD2 PHE 2 HD2 PHE 2 20.009 17.649 19.848
14 HE1 PHE 2 HE1 PHE 2 15.443 19.202 21.069
15 HE2 PHE 2 HE2 PHE 2 18.022 16.445 18.973
16 HZ PHE 2 HZ PHE 2 15.734 17.213 19.592
17 H CYS 3 H CYS 3 22.915 19.807 21.809
18 HA CYS 3 HA CYS 3 24.124 20.580 24.325
19 HB2 CYS 3 HB2 CYS 3 25.829 21.643 22.981
20 HB3 CYS 3 HB3 CYS 3 25.495 20.008 22.425
21 H ASN 4 H ASN 4 24.070 22.481 25.408
22 HA ASN 4 HA ASN 4 21.780 24.236 24.839
23 HB2 ASN 4 HB2 ASN 4 23.701 24.146 27.202
24 HB3 ASN 4 HB3 ASN 4 22.233 25.118 27.105
25 HD21 ASN 4 HD21 ASN 4 20.052 22.360 27.726
26 HD22 ASN 4 HD22 ASN 4 20.121 23.873 26.816
27 H LEU 5 H LEU 5 23.048 24.911 22.805
28 HA LEU 5 HA LEU 5 25.390 26.387 22.778
29 HB2 LEU 5 HB2 LEU 5 24.283 25.509 20.792
30 HB3 LEU 5 HB3 LEU 5 22.939 26.628 21.013
31 HG LEU 5 HG LEU 5 24.434 28.561 20.575
32 HD11 LEU 5 HD11 LEU 5 26.550 26.421 20.058
33 HD12 LEU 5 HD12 LEU 5 26.694 28.131 19.605
34 HD13 LEU 5 HD13 LEU 5 26.607 27.692 21.307
35 HD21 LEU 5 HD21 LEU 5 23.194 27.515 18.741
36 HD22 LEU 5 HD22 LEU 5 24.763 28.114 18.185
37 HD23 LEU 5 HD23 LEU 5 24.529 26.378 18.471
38 H ARG 6 H ARG 6 22.094 27.768 23.338
39 HA ARG 6 HA ARG 6 22.979 30.492 23.279
40 HB2 ARG 6 HB2 ARG 6 20.811 31.068 23.874
41 HB3 ARG 6 HB3 ARG 6 20.648 29.547 23.009
42 HG2 ARG 6 HG2 ARG 6 19.199 29.163 24.743
43 HG3 ARG 6 HG3 ARG 6 20.671 28.461 25.409
44 HD2 ARG 6 HD2 ARG 6 20.949 31.040 26.299
45 HD3 ARG 6 HD3 ARG 6 19.195 30.986 26.136
46 HE ARG 6 HE ARG 6 19.956 28.638 27.526
47 HH11 ARG 6 HH11 ARG 6 20.042 32.132 28.173
48 HH12 ARG 6 HH12 ARG 6 19.940 31.809 29.898
49 HH21 ARG 6 HH21 ARG 6 19.857 28.439 29.735
50 HH22 ARG 6 HH22 ARG 6 19.787 29.897 30.706
51 H ARG 7 H ARG 7 22.857 28.204 25.943
52 HA ARG 7 HA ARG 7 23.700 30.150 27.993
53 HB2 ARG 7 HB2 ARG 7 22.265 28.160 28.498
54 HB3 ARG 7 HB3 ARG 7 23.616 27.101 28.079
55 HG2 ARG 7 HG2 ARG 7 24.963 28.097 29.935
56 HG3 ARG 7 HG3 ARG 7 23.635 29.216 30.289
57 HD2 ARG 7 HD2 ARG 7 23.539 27.396 31.870
58 HD3 ARG 7 HD3 ARG 7 22.162 27.279 30.769
59 HE ARG 7 HE ARG 7 24.637 25.665 30.256
60 HH11 ARG 7 HH11 ARG 7 21.179 25.561 31.025
61 HH12 ARG 7 HH12 ARG 7 21.164 23.822 30.882
62 HH21 ARG 7 HH21 ARG 7 24.518 23.636 29.995
63 HH22 ARG 7 HH22 ARG 7 23.067 22.696 30.304
64 H CYS 8 H CYS 8 25.220 27.618 26.023
65 HA CYS 8 HA CYS 8 27.911 27.899 27.012
66 HB2 CYS 8 HB2 CYS 8 27.018 26.040 25.624
67 HB3 CYS 8 HB3 CYS 8 26.686 27.172 24.327
68 H GLU 9 H GLU 9 26.260 29.683 24.312
69 HA GLU 9 HA GLU 9 28.474 31.332 23.741
70 HB2 GLU 9 HB2 GLU 9 25.480 31.809 23.536
71 HB3 GLU 9 HB3 GLU 9 26.655 33.069 23.139
72 HG2 GLU 9 HG2 GLU 9 27.782 31.468 21.552
73 HG3 GLU 9 HG3 GLU 9 26.451 30.350 21.798
74 H LEU 10 H LEU 10 26.035 31.820 26.374
75 HA LEU 10 HA LEU 10 27.312 34.346 27.116
76 HB2 LEU 10 HB2 LEU 10 25.552 34.786 28.494
77 HB3 LEU 10 HB3 LEU 10 24.845 33.871 27.189
78 HG LEU 10 HG LEU 10 25.166 31.827 28.897
79 HD11 LEU 10 HD11 LEU 10 24.701 32.522 31.217
80 HD12 LEU 10 HD12 LEU 10 26.270 33.136 30.706
81 HD13 LEU 10 HD13 LEU 10 24.871 34.226 30.755
82 HD21 LEU 10 HD21 LEU 10 23.024 32.604 27.958
83 HD22 LEU 10 HD22 LEU 10 22.879 32.190 29.675
84 HD23 LEU 10 HD23 LEU 10 22.967 33.893 29.178
85 H SER 11 H SER 11 27.499 31.028 28.247
86 HA SER 11 HA SER 11 29.044 31.550 30.648
87 HB2 SER 11 HB2 SER 11 27.814 29.449 30.340
88 HB3 SER 11 HB3 SER 11 28.786 29.066 28.909
89 HG SER 11 HG SER 11 30.027 28.118 30.281
90 H CYS 12 H CYS 12 29.927 30.550 27.282
91 HA CYS 12 HA CYS 12 32.764 30.811 27.703
92 HB2 CYS 12 HB2 CYS 12 31.163 30.981 25.134
93 HB3 CYS 12 HB3 CYS 12 32.898 30.724 25.256
94 H ARG 13 H ARG 13 30.213 33.134 26.912
95 HA ARG 13 HA ARG 13 31.921 35.361 26.168
96 HB2 ARG 13 HB2 ARG 13 29.484 35.353 25.789
97 HB3 ARG 13 HB3 ARG 13 29.203 35.406 27.533
98 HG2 ARG 13 HG2 ARG 13 30.374 37.645 27.571
99 HG3 ARG 13 HG3 ARG 13 30.467 37.543 25.804
100 HD2 ARG 13 HD2 ARG 13 27.921 37.558 27.490
101 HD3 ARG 13 HD3 ARG 13 28.563 38.936 26.584
102 HE ARG 13 HE ARG 13 28.330 37.403 24.527
103 HH11 ARG 13 HH11 ARG 13 25.824 37.509 27.000
104 HH12 ARG 13 HH12 ARG 13 24.794 36.456 26.075
105 HH21 ARG 13 HH21 ARG 13 27.018 36.209 23.449
106 HH22 ARG 13 HH22 ARG 13 25.427 35.749 24.044
107 H SER 14 H SER 14 30.951 34.059 29.355
108 HA SER 14 HA SER 14 32.069 36.185 30.870
109 HB2 SER 14 HB2 SER 14 31.875 34.851 32.771
110 HB3 SER 14 HB3 SER 14 30.562 34.298 31.727
111 HG SER 14 HG SER 14 31.827 32.511 31.145
112 H LEU 15 H LEU 15 33.590 33.604 29.155
113 HA LEU 15 HA LEU 15 36.295 34.015 30.295
114 HB2 LEU 15 HB2 LEU 15 35.307 32.023 28.219
115 HB3 LEU 15 HB3 LEU 15 36.821 31.963 29.096
116 HG LEU 15 HG LEU 15 34.080 31.608 30.383
117 HD11 LEU 15 HD11 LEU 15 34.545 29.822 28.794
118 HD12 LEU 15 HD12 LEU 15 36.139 29.556 29.521
119 HD13 LEU 15 HD13 LEU 15 34.659 29.229 30.451
120 HD21 LEU 15 HD21 LEU 15 36.903 31.148 31.440
121 HD22 LEU 15 HD22 LEU 15 35.762 32.392 31.993
122 HD23 LEU 15 HD23 LEU 15 35.409 30.681 32.271
123 H GLY 16 H GLY 16 34.521 35.513 27.915
124 HA2 GLY 16 HA2 GLY 16 35.021 36.768 26.068
125 HA3 GLY 16 HA3 GLY 16 36.741 36.538 26.395
126 H LEU 17 H LEU 17 34.879 33.613 25.968
127 HA LEU 17 HA LEU 17 36.202 33.154 23.328
128 HB2 LEU 17 HB2 LEU 17 35.141 31.154 25.354
129 HB3 LEU 17 HB3 LEU 17 35.910 30.763 23.823
130 HG LEU 17 HG LEU 17 37.145 31.959 26.283
131 HD11 LEU 17 HD11 LEU 17 36.988 29.546 26.319
132 HD12 LEU 17 HD12 LEU 17 37.785 29.437 24.724
133 HD13 LEU 17 HD13 LEU 17 38.667 30.026 26.144
134 HD21 LEU 17 HD21 LEU 17 39.332 31.992 25.055
135 HD22 LEU 17 HD22 LEU 17 38.462 31.630 23.551
136 HD23 LEU 17 HD23 LEU 17 38.192 33.168 24.408
137 H LEU 18 H LEU 18 35.130 31.893 21.747
138 HA LEU 18 HA LEU 18 32.313 32.576 21.318
139 HB2 LEU 18 HB2 LEU 18 33.893 32.559 19.446
140 HB3 LEU 18 HB3 LEU 18 34.357 30.907 19.807
141 HG LEU 18 HG LEU 18 32.102 30.102 19.201
142 HD11 LEU 18 HD11 LEU 18 30.529 31.573 18.016
143 HD12 LEU 18 HD12 LEU 18 30.731 32.103 19.686
144 HD13 LEU 18 HD13 LEU 18 31.547 32.980 18.375
145 HD21 LEU 18 HD21 LEU 18 32.300 30.482 16.783
146 HD22 LEU 18 HD22 LEU 18 33.404 31.844 17.074
147 HD23 LEU 18 HD23 LEU 18 33.887 30.189 17.513
148 H GLY 19 H GLY 19 30.627 31.338 21.916
149 HA2 GLY 19 HA2 GLY 19 30.957 28.556 22.881
150 HA3 GLY 19 HA3 GLY 19 29.455 29.487 22.822
151 H LYS 20 H LYS 20 31.029 26.939 21.459
152 HA LYS 20 HA LYS 20 29.462 26.966 18.944
153 HB2 LYS 20 HB2 LYS 20 31.888 27.882 18.709
154 HB3 LYS 20 HB3 LYS 20 32.443 26.281 19.163
155 HG2 LYS 20 HG2 LYS 20 32.506 26.365 16.779
156 HG3 LYS 20 HG3 LYS 20 31.104 25.378 17.187
157 HD2 LYS 20 HD2 LYS 20 29.918 27.858 17.094
158 HD3 LYS 20 HD3 LYS 20 31.269 28.128 15.986
159 HE2 LYS 20 HE2 LYS 20 30.591 26.095 14.707
160 HE3 LYS 20 HE3 LYS 20 29.265 25.838 15.854
161 HZ1 LYS 20 HZ1 LYS 20 28.540 27.024 13.815
162 HZ2 LYS 20 HZ2 LYS 20 28.288 27.921 15.159
163 HZ3 LYS 20 HZ3 LYS 20 29.558 28.261 14.160
164 H CYS 21 H CYS 21 28.694 24.995 18.300
165 HA CYS 21 HA CYS 21 29.410 22.623 19.977
166 HB2 CYS 21 HB2 CYS 21 27.211 23.594 20.409
167 HB3 CYS 21 HB3 CYS 21 26.769 23.382 18.718
168 H ILE 22 H ILE 22 30.350 20.969 19.018
169 HA ILE 22 HA ILE 22 30.269 20.569 16.086
170 HB ILE 22 HB ILE 22 31.671 19.142 18.355
171 HG12 ILE 22 HG12 ILE 22 32.576 21.363 17.645
172 HG13 ILE 22 HG13 ILE 22 33.697 20.022 17.496
173 HG21 ILE 22 HG21 ILE 22 31.684 18.354 15.422
174 HG22 ILE 22 HG22 ILE 22 32.911 17.837 16.603
175 HG23 ILE 22 HG23 ILE 22 31.229 17.361 16.818
176 HD11 ILE 22 HD11 ILE 22 33.419 19.967 15.072
177 HD12 ILE 22 HD12 ILE 22 32.164 21.224 15.150
178 HD13 ILE 22 HD13 ILE 22 33.836 21.602 15.596
179 H GLY 23 H GLY 23 29.087 18.775 18.966
180 HA2 GLY 23 HA2 GLY 23 26.969 17.498 17.327
181 HA3 GLY 23 HA3 GLY 23 28.191 16.441 18.033
182 H GLU 24 H GLU 24 28.006 15.871 20.187
183 HA GLU 24 HA GLU 24 25.443 16.508 21.454
184 HB2 GLU 24 HB2 GLU 24 25.846 14.684 22.877
185 HB3 GLU 24 HB3 GLU 24 26.395 14.213 21.272
186 HG2 GLU 24 HG2 GLU 24 28.750 14.635 21.962
187 HG3 GLU 24 HG3 GLU 24 28.186 15.126 23.554
188 H GLU 25 H GLU 25 28.345 18.137 21.617
189 HA GLU 25 HA GLU 25 27.581 19.385 24.183
190 HB2 GLU 25 HB2 GLU 25 29.277 17.527 24.634
191 HB3 GLU 25 HB3 GLU 25 30.435 18.422 23.662
192 HG2 GLU 25 HG2 GLU 25 30.706 18.803 26.109
193 HG3 GLU 25 HG3 GLU 25 30.395 20.293 25.222
194 H CYS 26 H CYS 26 28.160 21.500 24.476
195 HA CYS 26 HA CYS 26 29.344 22.910 22.133
196 HB2 CYS 26 HB2 CYS 26 27.066 23.556 22.751
197 HB3 CYS 26 HB3 CYS 26 27.615 23.984 24.372
198 H LYS 27 H LYS 27 31.270 23.809 22.299
199 HA LYS 27 HA LYS 27 32.686 23.879 24.929
200 HB2 LYS 27 HB2 LYS 27 33.644 23.317 22.092
201 HB3 LYS 27 HB3 LYS 27 34.727 23.553 23.463
202 HG2 LYS 27 HG2 LYS 27 32.613 21.383 23.410
203 HG3 LYS 27 HG3 LYS 27 34.245 21.161 22.798
204 HD2 LYS 27 HD2 LYS 27 35.169 20.973 24.843
205 HD3 LYS 27 HD3 LYS 27 34.245 22.345 25.495
206 HE2 LYS 27 HE2 LYS 27 32.341 21.086 25.892
207 HE3 LYS 27 HE3 LYS 27 32.940 19.697 24.959
208 HZ1 LYS 27 HZ1 LYS 27 34.081 20.607 27.572
209 HZ2 LYS 27 HZ2 LYS 27 33.176 19.270 27.360
210 HZ3 LYS 27 HZ3 LYS 27 34.658 19.367 26.687
211 H CYS 28 H CYS 28 34.422 25.383 25.098
212 HA CYS 28 HA CYS 28 33.776 28.093 23.996
213 HB2 CYS 28 HB2 CYS 28 35.360 27.352 26.464
214 HB3 CYS 28 HB3 CYS 28 34.934 28.967 25.902
215 H VAL 29 H VAL 29 35.117 28.890 22.509
216 HA VAL 29 HA VAL 29 37.921 27.902 22.353
217 HB VAL 29 HB VAL 29 37.635 27.606 19.889
218 HG11 VAL 29 HG11 VAL 29 35.994 25.682 21.570
219 HG12 VAL 29 HG12 VAL 29 36.795 25.344 20.025
220 HG13 VAL 29 HG13 VAL 29 37.768 25.699 21.467
221 HG21 VAL 29 HG21 VAL 29 35.466 28.790 19.581
222 HG22 VAL 29 HG22 VAL 29 35.420 27.128 18.967
223 HG23 VAL 29 HG23 VAL 29 34.652 27.514 20.519
224 HA PRO 30 HA PRO 30 38.804 32.073 21.206
225 HB2 PRO 30 HB2 PRO 30 41.214 31.831 19.910
226 HB3 PRO 30 HB3 PRO 30 41.009 31.649 21.677
227 HG2 PRO 30 HG2 PRO 30 41.257 29.500 19.582
228 HG3 PRO 30 HG3 PRO 30 41.980 29.557 21.214
229 HD2 PRO 30 HD2 PRO 30 39.678 28.160 20.559
230 HD3 PRO 30 HD3 PRO 30 40.017 28.762 22.198
231 H TYR 31 H TYR 31 38.369 33.453 19.546
232 HA TYR 31 HA TYR 31 36.691 32.459 17.499
233 HB2 TYR 31 HB2 TYR 31 37.895 35.174 18.084
234 HB3 TYR 31 HB3 TYR 31 36.906 34.907 16.666
235 HD1 TYR 31 HD1 TYR 31 34.557 34.585 16.749
236 HD2 TYR 31 HD2 TYR 31 36.809 35.001 20.389
237 HE1 TYR 31 HE1 TYR 31 32.467 35.126 17.971
238 HE2 TYR 31 HE2 TYR 31 34.705 35.492 21.635
239 HH TYR 31 HH TYR 31 31.520 35.614 19.963
240 H ASN 32 H ASN 32 36.885 31.946 15.451
241 HA ASN 32 HA ASN 32 39.471 32.035 14.000
242 HB2 ASN 32 HB2 ASN 32 36.752 31.185 12.916
243 HB3 ASN 32 HB3 ASN 32 38.338 30.798 12.270
244 HD21 ASN 32 HD21 ASN 32 38.247 28.547 15.504
245 HD22 ASN 32 HD22 ASN 32 39.087 30.093 15.295
Start of MODEL 7
1 H1 ALA 1 H1 ALA 1 20.358 14.045 19.242
2 H2 ALA 1 H2 ALA 1 21.716 14.953 19.446
3 H3 ALA 1 H3 ALA 1 20.535 15.471 18.437
4 HA ALA 1 HA ALA 1 18.998 15.694 20.258
5 HB1 ALA 1 HB1 ALA 1 21.412 15.087 22.015
6 HB2 ALA 1 HB2 ALA 1 19.789 15.519 22.566
7 HB3 ALA 1 HB3 ALA 1 20.052 13.976 21.728
8 H PHE 2 H PHE 2 18.773 17.784 21.306
9 HA PHE 2 HA PHE 2 20.219 19.711 19.790
10 HB2 PHE 2 HB2 PHE 2 18.285 20.196 22.063
11 HB3 PHE 2 HB3 PHE 2 18.798 21.369 20.859
12 HD1 PHE 2 HD1 PHE 2 16.469 18.712 21.622
13 HD2 PHE 2 HD2 PHE 2 18.279 20.897 18.374
14 HE1 PHE 2 HE1 PHE 2 14.720 17.879 20.089
15 HE2 PHE 2 HE2 PHE 2 16.528 20.053 16.832
16 HZ PHE 2 HZ PHE 2 14.740 18.543 17.681
17 H CYS 3 H CYS 3 21.903 20.965 20.151
18 HA CYS 3 HA CYS 3 23.658 20.717 22.406
19 HB2 CYS 3 HB2 CYS 3 23.354 22.853 20.256
20 HB3 CYS 3 HB3 CYS 3 24.733 22.721 21.339
21 H ASN 4 H ASN 4 23.875 21.997 24.284
22 HA ASN 4 HA ASN 4 21.830 23.902 25.048
23 HB2 ASN 4 HB2 ASN 4 22.931 24.013 27.101
24 HB3 ASN 4 HB3 ASN 4 23.116 22.345 26.599
25 HD21 ASN 4 HD21 ASN 4 26.323 24.115 27.895
26 HD22 ASN 4 HD22 ASN 4 24.679 23.955 28.512
27 H LEU 5 H LEU 5 22.834 24.754 22.667
28 HA LEU 5 HA LEU 5 25.107 26.378 22.805
29 HB2 LEU 5 HB2 LEU 5 24.039 25.093 20.891
30 HB3 LEU 5 HB3 LEU 5 22.943 26.454 20.681
31 HG LEU 5 HG LEU 5 24.823 27.900 20.125
32 HD11 LEU 5 HD11 LEU 5 27.118 26.863 19.767
33 HD12 LEU 5 HD12 LEU 5 26.670 27.107 21.454
34 HD13 LEU 5 HD13 LEU 5 26.563 25.483 20.737
35 HD21 LEU 5 HD21 LEU 5 23.776 26.531 18.369
36 HD22 LEU 5 HD22 LEU 5 25.492 26.814 18.028
37 HD23 LEU 5 HD23 LEU 5 24.966 25.241 18.660
38 H ARG 6 H ARG 6 21.901 27.286 23.732
39 HA ARG 6 HA ARG 6 22.331 30.197 23.406
40 HB2 ARG 6 HB2 ARG 6 20.181 28.627 24.903
41 HB3 ARG 6 HB3 ARG 6 20.293 30.369 24.871
42 HG2 ARG 6 HG2 ARG 6 18.633 29.766 23.303
43 HG3 ARG 6 HG3 ARG 6 20.015 30.389 22.411
44 HD2 ARG 6 HD2 ARG 6 18.957 28.460 21.301
45 HD3 ARG 6 HD3 ARG 6 20.642 28.147 21.710
46 HE ARG 6 HE ARG 6 18.644 27.261 23.704
47 HH11 ARG 6 HH11 ARG 6 20.369 26.157 20.838
48 HH12 ARG 6 HH12 ARG 6 20.477 24.526 21.468
49 HH21 ARG 6 HH21 ARG 6 18.557 25.090 24.223
50 HH22 ARG 6 HH22 ARG 6 19.553 23.956 23.336
51 H ARG 7 H ARG 7 22.527 27.827 26.091
52 HA ARG 7 HA ARG 7 23.464 29.807 28.043
53 HB2 ARG 7 HB2 ARG 7 23.597 26.757 27.985
54 HB3 ARG 7 HB3 ARG 7 24.097 27.751 29.363
55 HG2 ARG 7 HG2 ARG 7 21.826 28.618 29.653
56 HG3 ARG 7 HG3 ARG 7 21.297 27.842 28.169
57 HD2 ARG 7 HD2 ARG 7 20.466 26.411 29.764
58 HD3 ARG 7 HD3 ARG 7 21.955 25.597 29.276
59 HE ARG 7 HE ARG 7 22.615 27.246 31.481
60 HH11 ARG 7 HH11 ARG 7 20.580 24.399 30.993
61 HH12 ARG 7 HH12 ARG 7 20.458 24.121 32.721
62 HH21 ARG 7 HH21 ARG 7 22.599 26.685 33.559
63 HH22 ARG 7 HH22 ARG 7 21.859 25.207 34.102
64 H CYS 8 H CYS 8 25.074 27.476 25.911
65 HA CYS 8 HA CYS 8 27.760 27.904 26.755
66 HB2 CYS 8 HB2 CYS 8 26.864 26.040 25.334
67 HB3 CYS 8 HB3 CYS 8 26.587 27.188 24.035
68 H GLU 9 H GLU 9 25.963 29.684 24.162
69 HA GLU 9 HA GLU 9 28.261 31.176 23.406
70 HB2 GLU 9 HB2 GLU 9 26.880 32.629 22.207
71 HB3 GLU 9 HB3 GLU 9 26.249 30.997 22.028
72 HG2 GLU 9 HG2 GLU 9 24.356 31.464 23.356
73 HG3 GLU 9 HG3 GLU 9 25.067 32.912 24.076
74 H LEU 10 H LEU 10 26.268 31.605 26.234
75 HA LEU 10 HA LEU 10 27.624 34.211 26.748
76 HB2 LEU 10 HB2 LEU 10 25.969 34.745 28.366
77 HB3 LEU 10 HB3 LEU 10 25.300 34.411 26.787
78 HG LEU 10 HG LEU 10 24.631 32.091 27.691
79 HD11 LEU 10 HD11 LEU 10 24.182 32.054 30.152
80 HD12 LEU 10 HD12 LEU 10 25.900 32.033 29.812
81 HD13 LEU 10 HD13 LEU 10 25.136 33.546 30.338
82 HD21 LEU 10 HD21 LEU 10 23.063 33.905 27.230
83 HD22 LEU 10 HD22 LEU 10 22.585 33.048 28.693
84 HD23 LEU 10 HD23 LEU 10 23.397 34.642 28.803
85 H SER 11 H SER 11 27.539 30.889 28.008
86 HA SER 11 HA SER 11 29.069 31.639 30.371
87 HB2 SER 11 HB2 SER 11 29.169 29.387 30.937
88 HB3 SER 11 HB3 SER 11 27.557 29.664 30.272
89 HG SER 11 HG SER 11 28.331 27.793 29.476
90 H CYS 12 H CYS 12 29.964 30.450 27.093
91 HA CYS 12 HA CYS 12 32.825 30.549 27.699
92 HB2 CYS 12 HB2 CYS 12 31.298 30.652 25.073
93 HB3 CYS 12 HB3 CYS 12 33.051 30.568 25.204
94 H ARG 13 H ARG 13 30.400 32.941 26.788
95 HA ARG 13 HA ARG 13 32.239 35.050 25.989
96 HB2 ARG 13 HB2 ARG 13 29.810 34.962 25.494
97 HB3 ARG 13 HB3 ARG 13 29.465 35.338 27.192
98 HG2 ARG 13 HG2 ARG 13 30.589 37.522 26.908
99 HG3 ARG 13 HG3 ARG 13 30.908 37.136 25.207
100 HD2 ARG 13 HD2 ARG 13 28.156 37.312 26.515
101 HD3 ARG 13 HD3 ARG 13 28.890 38.588 25.545
102 HE ARG 13 HE ARG 13 28.917 36.840 23.639
103 HH11 ARG 13 HH11 ARG 13 26.227 36.940 25.972
104 HH12 ARG 13 HH12 ARG 13 25.180 36.156 24.814
105 HH21 ARG 13 HH21 ARG 13 27.557 35.933 22.349
106 HH22 ARG 13 HH22 ARG 13 25.908 35.530 22.824
107 H SER 14 H SER 14 31.126 33.900 29.094
108 HA SER 14 HA SER 14 32.257 35.947 30.734
109 HB2 SER 14 HB2 SER 14 30.483 34.330 31.406
110 HB3 SER 14 HB3 SER 14 31.682 33.043 31.388
111 HG SER 14 HG SER 14 31.306 35.140 33.180
112 H LEU 15 H LEU 15 33.861 33.448 28.959
113 HA LEU 15 HA LEU 15 36.412 33.814 30.478
114 HB2 LEU 15 HB2 LEU 15 35.741 31.949 28.163
115 HB3 LEU 15 HB3 LEU 15 37.257 31.996 29.049
116 HG LEU 15 HG LEU 15 34.569 31.134 30.178
117 HD11 LEU 15 HD11 LEU 15 35.641 28.899 30.209
118 HD12 LEU 15 HD12 LEU 15 35.547 29.548 28.567
119 HD13 LEU 15 HD13 LEU 15 37.092 29.579 29.450
120 HD21 LEU 15 HD21 LEU 15 37.360 31.154 31.431
121 HD22 LEU 15 HD22 LEU 15 35.963 32.122 31.953
122 HD23 LEU 15 HD23 LEU 15 35.929 30.369 32.135
123 H GLY 16 H GLY 16 34.750 35.321 27.997
124 HA2 GLY 16 HA2 GLY 16 35.408 36.774 26.330
125 HA3 GLY 16 HA3 GLY 16 37.109 36.503 26.735
126 H LEU 17 H LEU 17 34.793 33.899 25.863
127 HA LEU 17 HA LEU 17 36.256 33.455 23.285
128 HB2 LEU 17 HB2 LEU 17 35.320 31.402 25.325
129 HB3 LEU 17 HB3 LEU 17 35.986 31.009 23.743
130 HG LEU 17 HG LEU 17 37.447 32.402 25.983
131 HD11 LEU 17 HD11 LEU 17 37.749 29.567 24.976
132 HD12 LEU 17 HD12 LEU 17 38.798 30.364 26.159
133 HD13 LEU 17 HD13 LEU 17 37.108 30.097 26.563
134 HD21 LEU 17 HD21 LEU 17 39.504 32.067 24.660
135 HD22 LEU 17 HD22 LEU 17 38.562 31.326 23.356
136 HD23 LEU 17 HD23 LEU 17 38.366 33.048 23.739
137 H LEU 18 H LEU 18 35.121 32.158 21.714
138 HA LEU 18 HA LEU 18 32.237 32.757 21.489
139 HB2 LEU 18 HB2 LEU 18 34.226 31.252 19.750
140 HB3 LEU 18 HB3 LEU 18 32.511 31.371 19.373
141 HG LEU 18 HG LEU 18 34.345 33.790 19.654
142 HD11 LEU 18 HD11 LEU 18 33.329 32.399 17.144
143 HD12 LEU 18 HD12 LEU 18 34.323 33.862 17.210
144 HD13 LEU 18 HD13 LEU 18 34.996 32.317 17.760
145 HD21 LEU 18 HD21 LEU 18 32.006 34.404 19.989
146 HD22 LEU 18 HD22 LEU 18 32.446 34.869 18.344
147 HD23 LEU 18 HD23 LEU 18 31.496 33.400 18.613
148 H GLY 19 H GLY 19 30.626 31.347 21.851
149 HA2 GLY 19 HA2 GLY 19 31.240 28.657 23.000
150 HA3 GLY 19 HA3 GLY 19 29.695 29.490 23.064
151 H LYS 20 H LYS 20 31.467 27.088 21.558
152 HA LYS 20 HA LYS 20 29.569 26.816 19.238
153 HB2 LYS 20 HB2 LYS 20 32.525 26.189 19.498
154 HB3 LYS 20 HB3 LYS 20 31.520 25.173 18.478
155 HG2 LYS 20 HG2 LYS 20 32.533 26.789 17.075
156 HG3 LYS 20 HG3 LYS 20 30.803 27.135 17.146
157 HD2 LYS 20 HD2 LYS 20 31.216 28.935 18.754
158 HD3 LYS 20 HD3 LYS 20 32.927 28.532 18.812
159 HE2 LYS 20 HE2 LYS 20 32.872 30.387 17.404
160 HE3 LYS 20 HE3 LYS 20 33.001 29.032 16.283
161 HZ1 LYS 20 HZ1 LYS 20 30.414 30.307 17.012
162 HZ2 LYS 20 HZ2 LYS 20 31.293 30.782 15.735
163 HZ3 LYS 20 HZ3 LYS 20 30.686 29.256 15.762
164 H CYS 21 H CYS 21 28.902 24.743 18.699
165 HA CYS 21 HA CYS 21 28.855 22.779 20.953
166 HB2 CYS 21 HB2 CYS 21 26.728 23.442 19.691
167 HB3 CYS 21 HB3 CYS 21 27.377 22.480 18.347
168 H ILE 22 H ILE 22 30.192 21.078 20.974
169 HA ILE 22 HA ILE 22 31.012 19.782 18.468
170 HB ILE 22 HB ILE 22 33.022 20.464 20.604
171 HG12 ILE 22 HG12 ILE 22 32.717 21.705 17.829
172 HG13 ILE 22 HG13 ILE 22 32.542 22.534 19.380
173 HG21 ILE 22 HG21 ILE 22 33.355 19.148 17.884
174 HG22 ILE 22 HG22 ILE 22 34.653 19.441 19.068
175 HG23 ILE 22 HG23 ILE 22 33.373 18.308 19.450
176 HD11 ILE 22 HD11 ILE 22 34.642 23.173 18.520
177 HD12 ILE 22 HD12 ILE 22 34.979 22.033 19.838
178 HD13 ILE 22 HD13 ILE 22 35.105 21.507 18.143
179 H GLY 23 H GLY 23 30.032 18.016 18.801
180 HA2 GLY 23 HA2 GLY 23 29.963 15.741 19.535
181 HA3 GLY 23 HA3 GLY 23 30.737 16.193 21.056
182 H GLU 24 H GLU 24 27.932 17.848 19.674
183 HA GLU 24 HA GLU 24 25.960 18.457 20.537
184 HB2 GLU 24 HB2 GLU 24 25.756 15.697 21.757
185 HB3 GLU 24 HB3 GLU 24 24.451 16.863 21.486
186 HG2 GLU 24 HG2 GLU 24 25.178 16.828 19.003
187 HG3 GLU 24 HG3 GLU 24 26.054 15.346 19.412
188 H GLU 25 H GLU 25 28.382 18.992 22.117
189 HA GLU 25 HA GLU 25 26.994 20.172 24.392
190 HB2 GLU 25 HB2 GLU 25 28.363 19.290 26.114
191 HB3 GLU 25 HB3 GLU 25 27.632 17.961 25.246
192 HG2 GLU 25 HG2 GLU 25 29.841 17.668 24.019
193 HG3 GLU 25 HG3 GLU 25 30.511 18.916 25.074
194 H CYS 26 H CYS 26 28.497 21.665 25.629
195 HA CYS 26 HA CYS 26 29.349 23.558 23.650
196 HB2 CYS 26 HB2 CYS 26 28.097 24.106 25.694
197 HB3 CYS 26 HB3 CYS 26 29.455 23.572 26.672
198 H LYS 27 H LYS 27 31.226 24.302 23.013
199 HA LYS 27 HA LYS 27 33.701 23.911 24.582
200 HB2 LYS 27 HB2 LYS 27 33.250 22.715 22.078
201 HB3 LYS 27 HB3 LYS 27 34.062 24.202 21.654
202 HG2 LYS 27 HG2 LYS 27 35.818 22.711 21.901
203 HG3 LYS 27 HG3 LYS 27 35.854 23.553 23.449
204 HD2 LYS 27 HD2 LYS 27 34.293 20.977 23.051
205 HD3 LYS 27 HD3 LYS 27 36.038 20.934 23.356
206 HE2 LYS 27 HE2 LYS 27 35.707 22.118 25.509
207 HE3 LYS 27 HE3 LYS 27 33.970 22.178 25.203
208 HZ1 LYS 27 HZ1 LYS 27 35.557 19.727 25.624
209 HZ2 LYS 27 HZ2 LYS 27 34.381 20.341 26.599
210 HZ3 LYS 27 HZ3 LYS 27 33.982 19.733 25.135
211 H CYS 28 H CYS 28 34.871 25.613 24.951
212 HA CYS 28 HA CYS 28 34.146 28.293 23.849
213 HB2 CYS 28 HB2 CYS 28 35.950 27.607 26.154
214 HB3 CYS 28 HB3 CYS 28 35.313 29.178 25.672
215 H VAL 29 H VAL 29 35.374 29.238 22.365
216 HA VAL 29 HA VAL 29 38.168 28.369 21.851
217 HB VAL 29 HB VAL 29 37.591 28.163 19.401
218 HG11 VAL 29 HG11 VAL 29 36.312 26.051 21.171
219 HG12 VAL 29 HG12 VAL 29 36.886 25.856 19.505
220 HG13 VAL 29 HG13 VAL 29 38.046 26.181 20.795
221 HG21 VAL 29 HG21 VAL 29 35.338 29.209 19.459
222 HG22 VAL 29 HG22 VAL 29 35.324 27.594 18.740
223 HG23 VAL 29 HG23 VAL 29 34.735 27.824 20.403
224 HA PRO 30 HA PRO 30 38.707 32.638 20.982
225 HB2 PRO 30 HB2 PRO 30 40.944 32.702 19.411
226 HB3 PRO 30 HB3 PRO 30 40.960 32.211 21.128
227 HG2 PRO 30 HG2 PRO 30 40.879 30.453 18.669
228 HG3 PRO 30 HG3 PRO 30 41.927 30.283 20.110
229 HD2 PRO 30 HD2 PRO 30 39.627 28.857 19.771
230 HD3 PRO 30 HD3 PRO 30 40.181 29.372 21.386
231 H TYR 31 H TYR 31 38.944 34.316 19.268
232 HA TYR 31 HA TYR 31 36.813 33.942 17.303
233 HB2 TYR 31 HB2 TYR 31 38.542 36.324 18.063
234 HB3 TYR 31 HB3 TYR 31 37.235 36.377 16.890
235 HD1 TYR 31 HD1 TYR 31 38.012 35.957 20.521
236 HD2 TYR 31 HD2 TYR 31 34.922 36.439 17.553
237 HE1 TYR 31 HE1 TYR 31 36.350 36.356 22.322
238 HE2 TYR 31 HE2 TYR 31 33.266 36.859 19.372
239 HH TYR 31 HH TYR 31 34.146 37.186 22.748
240 H ASN 32 H ASN 32 37.391 32.704 15.595
241 HA ASN 32 HA ASN 32 39.839 33.374 13.984
242 HB2 ASN 32 HB2 ASN 32 38.482 30.703 14.498
243 HB3 ASN 32 HB3 ASN 32 39.726 30.943 13.315
244 HD21 ASN 32 HD21 ASN 32 41.012 29.774 16.736
245 HD22 ASN 32 HD22 ASN 32 39.354 29.588 16.191
Start of MODEL 8
1 H1 ALA 1 H1 ALA 1 22.887 15.530 18.506
2 H2 ALA 1 H2 ALA 1 23.048 15.989 16.957
3 H3 ALA 1 H3 ALA 1 21.786 15.008 17.389
4 HA ALA 1 HA ALA 1 21.050 17.276 17.031
5 HB1 ALA 1 HB1 ALA 1 20.904 16.384 19.936
6 HB2 ALA 1 HB2 ALA 1 19.823 17.542 19.124
7 HB3 ALA 1 HB3 ALA 1 19.836 15.846 18.628
8 H PHE 2 H PHE 2 20.937 19.499 17.988
9 HA PHE 2 HA PHE 2 23.628 20.525 18.348
10 HB2 PHE 2 HB2 PHE 2 20.995 22.003 18.579
11 HB3 PHE 2 HB3 PHE 2 22.590 22.693 18.282
12 HD1 PHE 2 HD1 PHE 2 23.829 21.882 16.102
13 HD2 PHE 2 HD2 PHE 2 19.601 21.365 16.766
14 HE1 PHE 2 HE1 PHE 2 23.503 21.425 13.686
15 HE2 PHE 2 HE2 PHE 2 19.288 20.891 14.357
16 HZ PHE 2 HZ PHE 2 21.238 20.904 12.805
17 H CYS 3 H CYS 3 24.580 21.443 20.156
18 HA CYS 3 HA CYS 3 23.785 20.456 22.768
19 HB2 CYS 3 HB2 CYS 3 25.806 21.343 23.492
20 HB3 CYS 3 HB3 CYS 3 26.138 20.785 21.865
21 H ASN 4 H ASN 4 24.013 22.279 24.701
22 HA ASN 4 HA ASN 4 21.904 24.201 24.374
23 HB2 ASN 4 HB2 ASN 4 22.516 22.790 26.421
24 HB3 ASN 4 HB3 ASN 4 23.844 23.924 26.695
25 HD21 ASN 4 HD21 ASN 4 20.817 24.930 28.587
26 HD22 ASN 4 HD22 ASN 4 22.080 23.700 28.677
27 H LEU 5 H LEU 5 23.207 25.046 22.425
28 HA LEU 5 HA LEU 5 25.502 26.664 22.634
29 HB2 LEU 5 HB2 LEU 5 24.373 25.696 20.594
30 HB3 LEU 5 HB3 LEU 5 23.154 26.950 20.722
31 HG LEU 5 HG LEU 5 24.827 27.332 18.978
32 HD11 LEU 5 HD11 LEU 5 23.701 29.290 20.132
33 HD12 LEU 5 HD12 LEU 5 25.227 29.538 21.012
34 HD13 LEU 5 HD13 LEU 5 25.203 29.631 19.256
35 HD21 LEU 5 HD21 LEU 5 26.790 26.331 20.111
36 HD22 LEU 5 HD22 LEU 5 27.112 27.934 19.430
37 HD23 LEU 5 HD23 LEU 5 26.882 27.757 21.177
38 H ARG 6 H ARG 6 22.061 27.507 23.095
39 HA ARG 6 HA ARG 6 22.407 30.361 23.337
40 HB2 ARG 6 HB2 ARG 6 20.276 28.558 24.557
41 HB3 ARG 6 HB3 ARG 6 20.165 30.307 24.368
42 HG2 ARG 6 HG2 ARG 6 20.313 30.053 21.886
43 HG3 ARG 6 HG3 ARG 6 20.322 28.308 22.065
44 HD2 ARG 6 HD2 ARG 6 18.102 30.204 22.890
45 HD3 ARG 6 HD3 ARG 6 18.083 29.061 21.531
46 HE ARG 6 HE ARG 6 18.585 27.554 23.879
47 HH11 ARG 6 HH11 ARG 6 15.896 29.364 22.509
48 HH12 ARG 6 HH12 ARG 6 14.738 28.471 23.496
49 HH21 ARG 6 HH21 ARG 6 17.109 26.515 25.008
50 HH22 ARG 6 HH22 ARG 6 15.389 26.865 24.802
51 H ARG 7 H ARG 7 22.974 27.842 25.707
52 HA ARG 7 HA ARG 7 23.475 29.855 27.857
53 HB2 ARG 7 HB2 ARG 7 22.325 27.603 28.250
54 HB3 ARG 7 HB3 ARG 7 23.899 26.843 27.974
55 HG2 ARG 7 HG2 ARG 7 24.837 28.260 29.838
56 HG3 ARG 7 HG3 ARG 7 23.223 28.918 30.120
57 HD2 ARG 7 HD2 ARG 7 24.025 25.982 30.363
58 HD3 ARG 7 HD3 ARG 7 23.841 27.129 31.701
59 HE ARG 7 HE ARG 7 21.394 27.057 30.211
60 HH11 ARG 7 HH11 ARG 7 23.147 25.184 32.669
61 HH12 ARG 7 HH12 ARG 7 21.660 24.367 33.132
62 HH21 ARG 7 HH21 ARG 7 19.659 25.839 30.832
63 HH22 ARG 7 HH22 ARG 7 19.743 25.023 32.394
64 H CYS 8 H CYS 8 25.214 27.687 25.680
65 HA CYS 8 HA CYS 8 27.858 28.018 26.680
66 HB2 CYS 8 HB2 CYS 8 26.807 26.378 24.945
67 HB3 CYS 8 HB3 CYS 8 27.041 27.667 23.773
68 H GLU 9 H GLU 9 26.128 30.026 24.218
69 HA GLU 9 HA GLU 9 28.368 31.657 23.632
70 HB2 GLU 9 HB2 GLU 9 26.841 33.117 22.539
71 HB3 GLU 9 HB3 GLU 9 26.349 31.453 22.243
72 HG2 GLU 9 HG2 GLU 9 24.513 31.670 23.841
73 HG3 GLU 9 HG3 GLU 9 25.045 33.284 24.289
74 H LEU 10 H LEU 10 26.393 31.738 26.467
75 HA LEU 10 HA LEU 10 27.615 34.335 27.304
76 HB2 LEU 10 HB2 LEU 10 25.874 34.552 28.967
77 HB3 LEU 10 HB3 LEU 10 25.271 34.466 27.318
78 HG LEU 10 HG LEU 10 24.676 32.010 27.793
79 HD11 LEU 10 HD11 LEU 10 25.921 31.627 29.910
80 HD12 LEU 10 HD12 LEU 10 25.036 32.966 30.673
81 HD13 LEU 10 HD13 LEU 10 24.191 31.485 30.176
82 HD21 LEU 10 HD21 LEU 10 23.282 34.220 29.332
83 HD22 LEU 10 HD22 LEU 10 23.023 33.789 27.624
84 HD23 LEU 10 HD23 LEU 10 22.577 32.642 28.904
85 H SER 11 H SER 11 27.631 30.911 28.040
86 HA SER 11 HA SER 11 29.100 31.183 30.545
87 HB2 SER 11 HB2 SER 11 27.731 29.211 29.978
88 HB3 SER 11 HB3 SER 11 28.811 28.840 28.642
89 HG SER 11 HG SER 11 29.389 27.617 30.338
90 H CYS 12 H CYS 12 30.102 30.395 27.150
91 HA CYS 12 HA CYS 12 32.927 30.545 27.717
92 HB2 CYS 12 HB2 CYS 12 31.389 30.844 25.114
93 HB3 CYS 12 HB3 CYS 12 33.131 30.612 25.253
94 H ARG 13 H ARG 13 30.514 32.988 27.265
95 HA ARG 13 HA ARG 13 32.251 35.211 26.583
96 HB2 ARG 13 HB2 ARG 13 29.764 35.246 26.387
97 HB3 ARG 13 HB3 ARG 13 29.653 35.275 28.151
98 HG2 ARG 13 HG2 ARG 13 30.872 37.443 28.172
99 HG3 ARG 13 HG3 ARG 13 30.995 37.380 26.417
100 HD2 ARG 13 HD2 ARG 13 29.176 38.863 27.050
101 HD3 ARG 13 HD3 ARG 13 28.499 37.421 26.266
102 HE ARG 13 HE ARG 13 28.656 37.181 29.183
103 HH11 ARG 13 HH11 ARG 13 26.553 38.680 26.767
104 HH12 ARG 13 HH12 ARG 13 25.151 38.361 27.780
105 HH21 ARG 13 HH21 ARG 13 26.898 36.921 30.316
106 HH22 ARG 13 HH22 ARG 13 25.323 37.469 29.709
107 H SER 14 H SER 14 31.702 33.480 29.596
108 HA SER 14 HA SER 14 32.901 35.335 31.387
109 HB2 SER 14 HB2 SER 14 31.814 33.275 32.174
110 HB3 SER 14 HB3 SER 14 33.073 32.302 31.411
111 HG SER 14 HG SER 14 33.644 32.613 33.566
112 H LEU 15 H LEU 15 34.310 32.917 29.190
113 HA LEU 15 HA LEU 15 37.088 33.502 29.942
114 HB2 LEU 15 HB2 LEU 15 36.061 31.824 27.630
115 HB3 LEU 15 HB3 LEU 15 37.635 31.739 28.401
116 HG LEU 15 HG LEU 15 34.968 30.839 29.590
117 HD11 LEU 15 HD11 LEU 15 35.936 29.454 27.764
118 HD12 LEU 15 HD12 LEU 15 37.430 29.258 28.705
119 HD13 LEU 15 HD13 LEU 15 35.887 28.607 29.305
120 HD21 LEU 15 HD21 LEU 15 36.313 29.870 31.423
121 HD22 LEU 15 HD22 LEU 15 37.783 30.615 30.758
122 HD23 LEU 15 HD23 LEU 15 36.469 31.630 31.397
123 H GLY 16 H GLY 16 34.905 35.101 27.902
124 HA2 GLY 16 HA2 GLY 16 35.146 36.566 26.141
125 HA3 GLY 16 HA3 GLY 16 36.883 36.556 26.399
126 H LEU 17 H LEU 17 35.049 33.612 25.725
127 HA LEU 17 HA LEU 17 36.284 33.345 23.004
128 HB2 LEU 17 HB2 LEU 17 35.470 31.199 24.997
129 HB3 LEU 17 HB3 LEU 17 36.083 30.900 23.382
130 HG LEU 17 HG LEU 17 37.558 31.982 25.759
131 HD11 LEU 17 HD11 LEU 17 38.037 29.540 24.026
132 HD12 LEU 17 HD12 LEU 17 39.036 30.051 25.399
133 HD13 LEU 17 HD13 LEU 17 37.370 29.559 25.679
134 HD21 LEU 17 HD21 LEU 17 39.606 32.085 24.324
135 HD22 LEU 17 HD22 LEU 17 38.600 31.748 22.901
136 HD23 LEU 17 HD23 LEU 17 38.399 33.263 23.810
137 H LEU 18 H LEU 18 35.039 32.148 21.417
138 HA LEU 18 HA LEU 18 32.164 32.741 21.402
139 HB2 LEU 18 HB2 LEU 18 34.029 31.140 19.608
140 HB3 LEU 18 HB3 LEU 18 32.295 31.166 19.351
141 HG LEU 18 HG LEU 18 34.021 33.672 19.336
142 HD11 LEU 18 HD11 LEU 18 32.941 32.020 17.019
143 HD12 LEU 18 HD12 LEU 18 33.817 33.560 16.886
144 HD13 LEU 18 HD13 LEU 18 34.648 32.124 17.510
145 HD21 LEU 18 HD21 LEU 18 31.637 34.146 19.778
146 HD22 LEU 18 HD22 LEU 18 32.031 34.614 18.123
147 HD23 LEU 18 HD23 LEU 18 31.152 33.102 18.426
148 H GLY 19 H GLY 19 30.533 31.399 21.877
149 HA2 GLY 19 HA2 GLY 19 31.060 28.726 23.078
150 HA3 GLY 19 HA3 GLY 19 29.523 29.599 23.090
151 H LYS 20 H LYS 20 30.781 26.929 21.915
152 HA LYS 20 HA LYS 20 29.283 26.779 19.355
153 HB2 LYS 20 HB2 LYS 20 31.396 27.879 18.895
154 HB3 LYS 20 HB3 LYS 20 32.295 26.632 19.747
155 HG2 LYS 20 HG2 LYS 20 30.528 25.804 17.450
156 HG3 LYS 20 HG3 LYS 20 32.008 26.705 17.084
157 HD2 LYS 20 HD2 LYS 20 33.418 25.104 18.107
158 HD3 LYS 20 HD3 LYS 20 32.056 24.281 18.904
159 HE2 LYS 20 HE2 LYS 20 31.176 23.491 16.879
160 HE3 LYS 20 HE3 LYS 20 32.226 24.531 15.899
161 HZ1 LYS 20 HZ1 LYS 20 32.864 22.044 16.219
162 HZ2 LYS 20 HZ2 LYS 20 34.047 23.196 16.279
163 HZ3 LYS 20 HZ3 LYS 20 33.454 22.545 17.665
164 H CYS 21 H CYS 21 28.864 24.581 18.707
165 HA CYS 21 HA CYS 21 29.060 22.659 20.957
166 HB2 CYS 21 HB2 CYS 21 27.591 22.411 18.319
167 HB3 CYS 21 HB3 CYS 21 27.461 21.331 19.700
168 H ILE 22 H ILE 22 30.676 21.207 21.052
169 HA ILE 22 HA ILE 22 32.380 20.536 18.754
170 HB ILE 22 HB ILE 22 33.139 20.617 21.127
171 HG12 ILE 22 HG12 ILE 22 33.653 17.879 19.921
172 HG13 ILE 22 HG13 ILE 22 34.310 19.372 19.236
173 HG21 ILE 22 HG21 ILE 22 31.208 19.472 22.218
174 HG22 ILE 22 HG22 ILE 22 31.720 17.946 21.480
175 HG23 ILE 22 HG23 ILE 22 32.749 18.754 22.667
176 HD11 ILE 22 HD11 ILE 22 34.885 18.299 22.032
177 HD12 ILE 22 HD12 ILE 22 35.979 18.323 20.646
178 HD13 ILE 22 HD13 ILE 22 35.472 19.848 21.382
179 H GLY 23 H GLY 23 29.433 19.378 19.969
180 HA2 GLY 23 HA2 GLY 23 28.236 17.756 18.289
181 HA3 GLY 23 HA3 GLY 23 29.571 16.683 18.731
182 H GLU 24 H GLU 24 26.508 17.677 19.564
183 HA GLU 24 HA GLU 24 25.046 17.421 21.238
184 HB2 GLU 24 HB2 GLU 24 26.824 15.354 22.509
185 HB3 GLU 24 HB3 GLU 24 25.077 15.461 22.534
186 HG2 GLU 24 HG2 GLU 24 26.864 14.636 20.234
187 HG3 GLU 24 HG3 GLU 24 25.691 13.651 21.104
188 H GLU 25 H GLU 25 28.169 18.444 22.192
189 HA GLU 25 HA GLU 25 27.152 19.524 24.786
190 HB2 GLU 25 HB2 GLU 25 29.877 18.326 24.186
191 HB3 GLU 25 HB3 GLU 25 29.399 19.039 25.713
192 HG2 GLU 25 HG2 GLU 25 28.137 16.527 24.513
193 HG3 GLU 25 HG3 GLU 25 29.476 16.534 25.641
194 H CYS 26 H CYS 26 28.157 21.420 25.543
195 HA CYS 26 HA CYS 26 28.943 23.403 23.559
196 HB2 CYS 26 HB2 CYS 26 27.546 24.095 25.364
197 HB3 CYS 26 HB3 CYS 26 28.571 23.308 26.561
198 H LYS 27 H LYS 27 30.872 24.385 23.249
199 HA LYS 27 HA LYS 27 33.225 23.898 24.950
200 HB2 LYS 27 HB2 LYS 27 32.848 22.576 22.426
201 HB3 LYS 27 HB3 LYS 27 33.937 23.895 22.106
202 HG2 LYS 27 HG2 LYS 27 35.254 22.003 22.547
203 HG3 LYS 27 HG3 LYS 27 35.454 23.053 23.943
204 HD2 LYS 27 HD2 LYS 27 33.379 20.822 23.992
205 HD3 LYS 27 HD3 LYS 27 35.093 20.440 24.196
206 HE2 LYS 27 HE2 LYS 27 35.220 22.061 26.094
207 HE3 LYS 27 HE3 LYS 27 33.486 22.338 25.949
208 HZ1 LYS 27 HZ1 LYS 27 33.910 20.724 27.622
209 HZ2 LYS 27 HZ2 LYS 27 33.162 19.933 26.374
210 HZ3 LYS 27 HZ3 LYS 27 34.771 19.764 26.633
211 H CYS 28 H CYS 28 34.753 25.480 24.880
212 HA CYS 28 HA CYS 28 33.919 28.131 23.770
213 HB2 CYS 28 HB2 CYS 28 35.784 27.481 26.046
214 HB3 CYS 28 HB3 CYS 28 35.195 29.065 25.536
215 H VAL 29 H VAL 29 35.081 29.044 22.193
216 HA VAL 29 HA VAL 29 37.826 28.078 21.586
217 HB VAL 29 HB VAL 29 37.132 27.853 19.162
218 HG11 VAL 29 HG11 VAL 29 35.888 25.836 21.064
219 HG12 VAL 29 HG12 VAL 29 36.392 25.566 19.382
220 HG13 VAL 29 HG13 VAL 29 37.609 25.909 20.623
221 HG21 VAL 29 HG21 VAL 29 34.807 27.333 18.647
222 HG22 VAL 29 HG22 VAL 29 34.328 27.650 20.331
223 HG23 VAL 29 HG23 VAL 29 34.920 28.975 19.301
224 HA PRO 30 HA PRO 30 38.870 32.177 20.672
225 HB2 PRO 30 HB2 PRO 30 40.209 31.214 18.142
226 HB3 PRO 30 HB3 PRO 30 40.846 32.298 19.413
227 HG2 PRO 30 HG2 PRO 30 41.580 29.700 19.371
228 HG3 PRO 30 HG3 PRO 30 41.131 30.462 20.932
229 HD2 PRO 30 HD2 PRO 30 39.430 28.700 19.137
230 HD3 PRO 30 HD3 PRO 30 39.660 28.644 20.912
231 H TYR 31 H TYR 31 38.268 34.008 19.674
232 HA TYR 31 HA TYR 31 36.194 34.062 17.629
233 HB2 TYR 31 HB2 TYR 31 37.867 36.154 19.056
234 HB3 TYR 31 HB3 TYR 31 36.925 36.579 17.646
235 HD1 TYR 31 HD1 TYR 31 36.666 35.321 21.152
236 HD2 TYR 31 HD2 TYR 31 34.575 36.838 17.696
237 HE1 TYR 31 HE1 TYR 31 34.589 35.594 22.506
238 HE2 TYR 31 HE2 TYR 31 32.515 37.109 19.046
239 HH TYR 31 HH TYR 31 31.523 36.748 21.034
240 H ASN 32 H ASN 32 36.369 34.760 15.524
241 HA ASN 32 HA ASN 32 39.079 34.713 14.254
242 HB2 ASN 32 HB2 ASN 32 36.414 33.888 13.013
243 HB3 ASN 32 HB3 ASN 32 38.003 33.805 12.262
244 HD21 ASN 32 HD21 ASN 32 38.829 30.980 14.613
245 HD22 ASN 32 HD22 ASN 32 39.332 32.653 14.721
Start of MODEL 9
1 H1 ALA 1 H1 ALA 1 21.413 18.808 15.340
2 H2 ALA 1 H2 ALA 1 21.433 20.301 16.057
3 H3 ALA 1 H3 ALA 1 20.047 19.388 16.034
4 HA ALA 1 HA ALA 1 21.018 17.718 17.383
5 HB1 ALA 1 HB1 ALA 1 23.157 18.141 18.510
6 HB2 ALA 1 HB2 ALA 1 23.366 18.060 16.761
7 HB3 ALA 1 HB3 ALA 1 23.377 19.638 17.586
8 H PHE 2 H PHE 2 20.380 17.725 19.520
9 HA PHE 2 HA PHE 2 18.755 19.999 20.243
10 HB2 PHE 2 HB2 PHE 2 19.095 17.390 21.741
11 HB3 PHE 2 HB3 PHE 2 17.737 18.502 21.817
12 HD1 PHE 2 HD1 PHE 2 16.285 18.830 19.706
13 HD2 PHE 2 HD2 PHE 2 19.131 15.620 20.144
14 HE1 PHE 2 HE1 PHE 2 15.203 17.602 17.835
15 HE2 PHE 2 HE2 PHE 2 18.096 14.433 18.240
16 HZ PHE 2 HZ PHE 2 16.115 15.421 17.081
17 H CYS 3 H CYS 3 21.601 20.551 20.656
18 HA CYS 3 HA CYS 3 22.195 20.371 23.488
19 HB2 CYS 3 HB2 CYS 3 24.317 21.508 22.795
20 HB3 CYS 3 HB3 CYS 3 23.962 19.992 21.983
21 H ASN 4 H ASN 4 22.868 22.061 24.861
22 HA ASN 4 HA ASN 4 21.110 24.393 24.932
23 HB2 ASN 4 HB2 ASN 4 23.393 23.522 26.742
24 HB3 ASN 4 HB3 ASN 4 22.232 24.792 27.109
25 HD21 ASN 4 HD21 ASN 4 19.637 22.496 27.966
26 HD22 ASN 4 HD22 ASN 4 20.000 24.168 27.594
27 H LEU 5 H LEU 5 22.110 25.128 22.716
28 HA LEU 5 HA LEU 5 24.804 26.127 22.768
29 HB2 LEU 5 HB2 LEU 5 23.775 25.400 20.710
30 HB3 LEU 5 HB3 LEU 5 22.528 26.641 20.828
31 HG LEU 5 HG LEU 5 24.206 28.424 20.541
32 HD11 LEU 5 HD11 LEU 5 26.211 26.149 20.263
33 HD12 LEU 5 HD12 LEU 5 26.529 27.859 19.912
34 HD13 LEU 5 HD13 LEU 5 26.204 27.362 21.559
35 HD21 LEU 5 HD21 LEU 5 23.150 27.441 18.554
36 HD22 LEU 5 HD22 LEU 5 24.817 27.935 18.217
37 HD23 LEU 5 HD23 LEU 5 24.437 26.217 18.457
38 H ARG 6 H ARG 6 21.678 27.853 23.182
39 HA ARG 6 HA ARG 6 22.722 30.503 23.222
40 HB2 ARG 6 HB2 ARG 6 20.332 29.858 23.023
41 HB3 ARG 6 HB3 ARG 6 20.324 29.345 24.714
42 HG2 ARG 6 HG2 ARG 6 20.785 31.674 25.432
43 HG3 ARG 6 HG3 ARG 6 20.913 32.176 23.736
44 HD2 ARG 6 HD2 ARG 6 18.728 32.791 24.613
45 HD3 ARG 6 HD3 ARG 6 18.559 31.557 23.358
46 HE ARG 6 HE ARG 6 18.680 30.551 26.134
47 HH11 ARG 6 HH11 ARG 6 16.425 31.834 23.778
48 HH12 ARG 6 HH12 ARG 6 15.121 30.802 24.373
49 HH21 ARG 6 HH21 ARG 6 16.862 29.381 26.870
50 HH22 ARG 6 HH22 ARG 6 15.329 29.636 26.040
51 H ARG 7 H ARG 7 22.401 28.168 25.903
52 HA ARG 7 HA ARG 7 23.539 29.870 27.928
53 HB2 ARG 7 HB2 ARG 7 22.156 27.816 28.275
54 HB3 ARG 7 HB3 ARG 7 23.557 26.835 27.818
55 HG2 ARG 7 HG2 ARG 7 24.829 27.701 29.737
56 HG3 ARG 7 HG3 ARG 7 23.566 28.897 30.078
57 HD2 ARG 7 HD2 ARG 7 23.338 27.076 31.647
58 HD3 ARG 7 HD3 ARG 7 21.955 27.081 30.547
59 HE ARG 7 HE ARG 7 24.089 25.340 29.601
60 HH11 ARG 7 HH11 ARG 7 21.439 25.343 31.958
61 HH12 ARG 7 HH12 ARG 7 21.195 23.609 31.711
62 HH21 ARG 7 HH21 ARG 7 23.787 23.220 29.545
63 HH22 ARG 7 HH22 ARG 7 22.450 22.469 30.462
64 H CYS 8 H CYS 8 25.082 27.564 25.666
65 HA CYS 8 HA CYS 8 27.772 27.846 26.718
66 HB2 CYS 8 HB2 CYS 8 26.948 25.993 25.276
67 HB3 CYS 8 HB3 CYS 8 26.722 27.120 23.950
68 H GLU 9 H GLU 9 26.101 29.638 24.089
69 HA GLU 9 HA GLU 9 28.333 31.279 23.441
70 HB2 GLU 9 HB2 GLU 9 25.342 31.705 23.182
71 HB3 GLU 9 HB3 GLU 9 26.537 32.878 22.588
72 HG2 GLU 9 HG2 GLU 9 27.619 31.113 21.241
73 HG3 GLU 9 HG3 GLU 9 26.403 29.945 21.753
74 H LEU 10 H LEU 10 26.051 31.669 26.152
75 HA LEU 10 HA LEU 10 27.324 34.243 26.874
76 HB2 LEU 10 HB2 LEU 10 25.698 34.466 28.617
77 HB3 LEU 10 HB3 LEU 10 24.962 34.155 27.066
78 HG LEU 10 HG LEU 10 24.656 31.726 27.837
79 HD11 LEU 10 HD11 LEU 10 24.366 31.467 30.323
80 HD12 LEU 10 HD12 LEU 10 26.054 31.633 29.870
81 HD13 LEU 10 HD13 LEU 10 25.184 33.024 30.555
82 HD21 LEU 10 HD21 LEU 10 22.825 33.360 27.668
83 HD22 LEU 10 HD22 LEU 10 22.593 32.295 29.056
84 HD23 LEU 10 HD23 LEU 10 23.189 33.953 29.301
85 H SER 11 H SER 11 27.578 30.883 27.785
86 HA SER 11 HA SER 11 28.987 31.323 30.288
87 HB2 SER 11 HB2 SER 11 27.667 29.296 29.803
88 HB3 SER 11 HB3 SER 11 28.814 28.839 28.536
89 HG SER 11 HG SER 11 30.366 28.454 30.058
90 H CYS 12 H CYS 12 30.013 30.398 26.961
91 HA CYS 12 HA CYS 12 32.858 30.488 27.602
92 HB2 CYS 12 HB2 CYS 12 31.378 30.660 24.958
93 HB3 CYS 12 HB3 CYS 12 33.118 30.498 25.118
94 H ARG 13 H ARG 13 30.449 32.889 26.540
95 HA ARG 13 HA ARG 13 32.392 34.963 25.895
96 HB2 ARG 13 HB2 ARG 13 30.073 35.133 25.166
97 HB3 ARG 13 HB3 ARG 13 29.521 35.270 26.847
98 HG2 ARG 13 HG2 ARG 13 30.775 37.420 27.056
99 HG3 ARG 13 HG3 ARG 13 31.422 37.210 25.433
100 HD2 ARG 13 HD2 ARG 13 29.585 38.806 25.398
101 HD3 ARG 13 HD3 ARG 13 29.170 37.351 24.479
102 HE ARG 13 HE ARG 13 28.296 37.569 27.325
103 HH11 ARG 13 HH11 ARG 13 27.259 37.971 23.984
104 HH12 ARG 13 HH12 ARG 13 25.591 37.701 24.420
105 HH21 ARG 13 HH21 ARG 13 26.047 37.205 27.709
106 HH22 ARG 13 HH22 ARG 13 24.991 37.112 26.319
107 H SER 14 H SER 14 30.908 33.929 28.968
108 HA SER 14 HA SER 14 32.130 35.981 30.523
109 HB2 SER 14 HB2 SER 14 30.210 34.568 31.261
110 HB3 SER 14 HB3 SER 14 31.342 33.228 31.493
111 HG SER 14 HG SER 14 32.532 34.695 32.893
112 H LEU 15 H LEU 15 33.671 33.350 28.950
113 HA LEU 15 HA LEU 15 36.100 33.537 30.676
114 HB2 LEU 15 HB2 LEU 15 35.578 31.773 28.254
115 HB3 LEU 15 HB3 LEU 15 36.953 31.693 29.341
116 HG LEU 15 HG LEU 15 34.069 31.022 30.070
117 HD11 LEU 15 HD11 LEU 15 36.526 29.256 29.730
118 HD12 LEU 15 HD12 LEU 15 34.896 28.727 30.198
119 HD13 LEU 15 HD13 LEU 15 35.177 29.388 28.580
120 HD21 LEU 15 HD21 LEU 15 35.235 31.883 32.055
121 HD22 LEU 15 HD22 LEU 15 35.074 30.128 32.175
122 HD23 LEU 15 HD23 LEU 15 36.633 30.837 31.713
123 H GLY 16 H GLY 16 34.729 35.066 27.964
124 HA2 GLY 16 HA2 GLY 16 35.650 36.706 26.576
125 HA3 GLY 16 HA3 GLY 16 37.282 36.223 27.033
126 H LEU 17 H LEU 17 34.845 33.885 25.921
127 HA LEU 17 HA LEU 17 36.324 33.439 23.365
128 HB2 LEU 17 HB2 LEU 17 35.259 31.369 25.329
129 HB3 LEU 17 HB3 LEU 17 36.007 31.003 23.785
130 HG LEU 17 HG LEU 17 37.334 32.238 26.185
131 HD11 LEU 17 HD11 LEU 17 37.665 29.481 25.001
132 HD12 LEU 17 HD12 LEU 17 38.661 30.168 26.294
133 HD13 LEU 17 HD13 LEU 17 36.947 29.913 26.582
134 HD21 LEU 17 HD21 LEU 17 38.636 31.333 23.582
135 HD22 LEU 17 HD22 LEU 17 38.424 33.027 24.071
136 HD23 LEU 17 HD23 LEU 17 39.484 31.974 25.000
137 H LEU 18 H LEU 18 35.218 32.392 21.715
138 HA LEU 18 HA LEU 18 32.353 32.895 21.410
139 HB2 LEU 18 HB2 LEU 18 33.778 33.137 19.490
140 HB3 LEU 18 HB3 LEU 18 34.519 31.571 19.753
141 HG LEU 18 HG LEU 18 32.408 30.433 19.143
142 HD11 LEU 18 HD11 LEU 18 31.400 33.253 18.553
143 HD12 LEU 18 HD12 LEU 18 30.600 31.747 18.062
144 HD13 LEU 18 HD13 LEU 18 30.747 32.133 19.774
145 HD21 LEU 18 HD21 LEU 18 33.330 32.495 17.101
146 HD22 LEU 18 HD22 LEU 18 34.121 30.939 17.432
147 HD23 LEU 18 HD23 LEU 18 32.486 30.970 16.755
148 H GLY 19 H GLY 19 30.796 31.528 22.054
149 HA2 GLY 19 HA2 GLY 19 31.391 28.751 22.901
150 HA3 GLY 19 HA3 GLY 19 29.877 29.609 23.125
151 H LYS 20 H LYS 20 31.001 26.996 21.683
152 HA LYS 20 HA LYS 20 29.163 27.102 19.348
153 HB2 LYS 20 HB2 LYS 20 31.424 27.887 18.743
154 HB3 LYS 20 HB3 LYS 20 32.132 26.383 19.324
155 HG2 LYS 20 HG2 LYS 20 29.917 26.275 17.269
156 HG3 LYS 20 HG3 LYS 20 31.506 26.832 16.750
157 HD2 LYS 20 HD2 LYS 20 32.576 24.814 17.252
158 HD3 LYS 20 HD3 LYS 20 31.263 24.242 18.303
159 HE2 LYS 20 HE2 LYS 20 29.952 23.562 16.619
160 HE3 LYS 20 HE3 LYS 20 30.388 24.911 15.574
161 HZ1 LYS 20 HZ1 LYS 20 31.179 22.695 14.783
162 HZ2 LYS 20 HZ2 LYS 20 32.371 23.816 14.917
163 HZ3 LYS 20 HZ3 LYS 20 32.238 22.653 16.051
164 H CYS 21 H CYS 21 27.956 25.296 19.164
165 HA CYS 21 HA CYS 21 28.454 23.060 21.070
166 HB2 CYS 21 HB2 CYS 21 26.208 23.780 21.028
167 HB3 CYS 21 HB3 CYS 21 26.152 23.806 19.260
168 H ILE 22 H ILE 22 29.725 21.391 20.476
169 HA ILE 22 HA ILE 22 30.378 20.927 17.654
170 HB ILE 22 HB ILE 22 32.079 20.735 19.334
171 HG12 ILE 22 HG12 ILE 22 31.595 18.004 18.086
172 HG13 ILE 22 HG13 ILE 22 32.104 19.425 17.172
173 HG21 ILE 22 HG21 ILE 22 30.609 18.303 20.420
174 HG22 ILE 22 HG22 ILE 22 32.227 18.826 20.901
175 HG23 ILE 22 HG23 ILE 22 30.849 19.849 21.260
176 HD11 ILE 22 HD11 ILE 22 33.681 18.046 19.375
177 HD12 ILE 22 HD12 ILE 22 34.052 18.103 17.649
178 HD13 ILE 22 HD13 ILE 22 34.153 19.586 18.619
179 H GLY 23 H GLY 23 28.200 19.506 19.967
180 HA2 GLY 23 HA2 GLY 23 26.360 18.556 18.100
181 HA3 GLY 23 HA3 GLY 23 27.405 17.165 18.447
182 H GLU 24 H GLU 24 27.862 17.016 20.987
183 HA GLU 24 HA GLU 24 25.309 17.469 22.502
184 HB2 GLU 24 HB2 GLU 24 27.139 15.054 22.751
185 HB3 GLU 24 HB3 GLU 24 25.640 15.394 23.621
186 HG2 GLU 24 HG2 GLU 24 24.521 15.478 21.277
187 HG3 GLU 24 HG3 GLU 24 25.972 14.663 20.703
188 H GLU 25 H GLU 25 28.132 18.877 22.378
189 HA GLU 25 HA GLU 25 28.181 19.484 25.243
190 HB2 GLU 25 HB2 GLU 25 29.694 17.539 24.966
191 HB3 GLU 25 HB3 GLU 25 30.630 18.432 23.775
192 HG2 GLU 25 HG2 GLU 25 31.768 18.331 25.923
193 HG3 GLU 25 HG3 GLU 25 31.395 19.992 25.500
194 H CYS 26 H CYS 26 29.266 21.406 25.766
195 HA CYS 26 HA CYS 26 29.294 23.471 23.657
196 HB2 CYS 26 HB2 CYS 26 28.188 23.965 25.742
197 HB3 CYS 26 HB3 CYS 26 29.590 23.453 26.671
198 H LYS 27 H LYS 27 31.120 24.153 22.631
199 HA LYS 27 HA LYS 27 33.827 23.742 23.841
200 HB2 LYS 27 HB2 LYS 27 33.003 24.410 20.981
201 HB3 LYS 27 HB3 LYS 27 34.643 24.165 21.541
202 HG2 LYS 27 HG2 LYS 27 32.476 22.003 21.488
203 HG3 LYS 27 HG3 LYS 27 33.719 22.273 20.269
204 HD2 LYS 27 HD2 LYS 27 34.937 20.784 21.384
205 HD3 LYS 27 HD3 LYS 27 35.293 22.109 22.492
206 HE2 LYS 27 HE2 LYS 27 33.333 21.356 23.905
207 HE3 LYS 27 HE3 LYS 27 33.150 19.967 22.809
208 HZ1 LYS 27 HZ1 LYS 27 35.488 20.609 24.501
209 HZ2 LYS 27 HZ2 LYS 27 34.561 19.264 24.641
210 HZ3 LYS 27 HZ3 LYS 27 35.551 19.463 23.344
211 H CYS 28 H CYS 28 35.004 25.486 24.407
212 HA CYS 28 HA CYS 28 34.145 28.256 23.623
213 HB2 CYS 28 HB2 CYS 28 35.904 27.465 25.922
214 HB3 CYS 28 HB3 CYS 28 35.263 29.053 25.499
215 H VAL 29 H VAL 29 35.426 29.326 22.263
216 HA VAL 29 HA VAL 29 38.241 28.512 21.758
217 HB VAL 29 HB VAL 29 37.757 28.537 19.284
218 HG11 VAL 29 HG11 VAL 29 37.081 26.232 19.145
219 HG12 VAL 29 HG12 VAL 29 38.133 26.435 20.552
220 HG13 VAL 29 HG13 VAL 29 36.375 26.277 20.769
221 HG21 VAL 29 HG21 VAL 29 35.506 28.023 18.481
222 HG22 VAL 29 HG22 VAL 29 34.850 28.157 20.123
223 HG23 VAL 29 HG23 VAL 29 35.518 29.587 19.302
224 HA PRO 30 HA PRO 30 38.757 32.780 21.586
225 HB2 PRO 30 HB2 PRO 30 40.851 33.267 19.872
226 HB3 PRO 30 HB3 PRO 30 41.024 32.471 21.480
227 HG2 PRO 30 HG2 PRO 30 40.778 31.153 18.751
228 HG3 PRO 30 HG3 PRO 30 41.963 30.801 20.045
229 HD2 PRO 30 HD2 PRO 30 39.731 29.309 19.701
230 HD3 PRO 30 HD3 PRO 30 40.334 29.655 21.338
231 H TYR 31 H TYR 31 38.149 34.707 20.626
232 HA TYR 31 HA TYR 31 36.478 34.636 18.225
233 HB2 TYR 31 HB2 TYR 31 37.722 37.001 19.698
234 HB3 TYR 31 HB3 TYR 31 36.464 37.095 18.494
235 HD1 TYR 31 HD1 TYR 31 36.951 37.483 21.840
236 HD2 TYR 31 HD2 TYR 31 34.366 35.358 19.120
237 HE1 TYR 31 HE1 TYR 31 35.120 37.551 23.514
238 HE2 TYR 31 HE2 TYR 31 32.567 35.370 20.838
239 HH TYR 31 HH TYR 31 32.449 37.501 23.282
240 H ASN 32 H ASN 32 36.940 35.453 16.159
241 HA ASN 32 HA ASN 32 39.803 35.829 15.376
242 HB2 ASN 32 HB2 ASN 32 37.216 35.518 13.781
243 HB3 ASN 32 HB3 ASN 32 38.725 36.053 13.049
244 HD21 ASN 32 HD21 ASN 32 39.749 32.428 14.243
245 HD22 ASN 32 HD22 ASN 32 39.662 33.773 15.351
Start of MODEL 10
1 H1 ALA 1 H1 ALA 1 18.222 16.111 19.272
2 H2 ALA 1 H2 ALA 1 17.910 14.948 20.404
3 H3 ALA 1 H3 ALA 1 19.399 15.659 20.309
4 HA ALA 1 HA ALA 1 16.907 17.033 21.056
5 HB1 ALA 1 HB1 ALA 1 17.726 15.530 22.864
6 HB2 ALA 1 HB2 ALA 1 19.321 16.300 22.772
7 HB3 ALA 1 HB3 ALA 1 17.909 17.233 23.304
8 H PHE 2 H PHE 2 17.077 19.288 21.289
9 HA PHE 2 HA PHE 2 19.120 20.514 19.680
10 HB2 PHE 2 HB2 PHE 2 17.219 21.840 21.641
11 HB3 PHE 2 HB3 PHE 2 18.134 22.644 20.364
12 HD1 PHE 2 HD1 PHE 2 15.129 20.759 21.161
13 HD2 PHE 2 HD2 PHE 2 17.659 22.057 17.920
14 HE1 PHE 2 HE1 PHE 2 13.366 20.141 19.540
15 HE2 PHE 2 HE2 PHE 2 15.865 21.485 16.300
16 HZ PHE 2 HZ PHE 2 13.721 20.502 17.105
17 H CYS 3 H CYS 3 21.115 21.222 20.135
18 HA CYS 3 HA CYS 3 22.270 20.787 22.740
19 HB2 CYS 3 HB2 CYS 3 24.311 21.411 21.802
20 HB3 CYS 3 HB3 CYS 3 23.455 20.609 20.495
21 H ASN 4 H ASN 4 23.035 22.304 24.249
22 HA ASN 4 HA ASN 4 21.286 24.594 24.552
23 HB2 ASN 4 HB2 ASN 4 23.530 23.684 26.366
24 HB3 ASN 4 HB3 ASN 4 22.189 24.735 26.796
25 HD21 ASN 4 HD21 ASN 4 21.646 21.132 27.882
26 HD22 ASN 4 HD22 ASN 4 23.021 22.217 28.033
27 H LEU 5 H LEU 5 22.828 25.106 22.315
28 HA LEU 5 HA LEU 5 25.194 26.551 22.523
29 HB2 LEU 5 HB2 LEU 5 24.162 25.709 20.475
30 HB3 LEU 5 HB3 LEU 5 22.870 26.884 20.580
31 HG LEU 5 HG LEU 5 24.617 27.288 18.864
32 HD11 LEU 5 HD11 LEU 5 24.757 29.638 19.045
33 HD12 LEU 5 HD12 LEU 5 23.198 29.159 19.730
34 HD13 LEU 5 HD13 LEU 5 24.550 29.628 20.793
35 HD21 LEU 5 HD21 LEU 5 26.583 26.576 20.181
36 HD22 LEU 5 HD22 LEU 5 26.786 28.167 19.425
37 HD23 LEU 5 HD23 LEU 5 26.452 28.061 21.162
38 H ARG 6 H ARG 6 21.861 27.850 22.895
39 HA ARG 6 HA ARG 6 22.517 30.611 23.165
40 HB2 ARG 6 HB2 ARG 6 20.387 28.984 24.639
41 HB3 ARG 6 HB3 ARG 6 20.412 30.745 24.555
42 HG2 ARG 6 HG2 ARG 6 20.051 30.715 22.145
43 HG3 ARG 6 HG3 ARG 6 20.123 28.956 22.100
44 HD2 ARG 6 HD2 ARG 6 18.051 30.628 23.563
45 HD3 ARG 6 HD3 ARG 6 17.797 29.749 22.046
46 HE ARG 6 HE ARG 6 18.679 27.884 24.024
47 HH11 ARG 6 HH11 ARG 6 15.756 29.835 23.494
48 HH12 ARG 6 HH12 ARG 6 14.790 28.622 24.328
49 HH21 ARG 6 HH21 ARG 6 17.441 26.706 25.258
50 HH22 ARG 6 HH22 ARG 6 15.776 27.164 25.594
51 H ARG 7 H ARG 7 22.832 28.054 25.532
52 HA ARG 7 HA ARG 7 23.536 29.837 27.785
53 HB2 ARG 7 HB2 ARG 7 23.865 26.819 27.689
54 HB3 ARG 7 HB3 ARG 7 23.686 27.855 29.091
55 HG2 ARG 7 HG2 ARG 7 21.547 27.088 27.067
56 HG3 ARG 7 HG3 ARG 7 21.678 26.545 28.730
57 HD2 ARG 7 HD2 ARG 7 21.114 29.404 27.846
58 HD3 ARG 7 HD3 ARG 7 19.897 28.238 28.378
59 HE ARG 7 HE ARG 7 21.578 28.252 30.515
60 HH11 ARG 7 HH11 ARG 7 19.747 30.774 28.892
61 HH12 ARG 7 HH12 ARG 7 19.838 31.838 30.286
62 HH21 ARG 7 HH21 ARG 7 21.573 29.690 32.276
63 HH22 ARG 7 HH22 ARG 7 20.825 31.277 32.035
64 H CYS 8 H CYS 8 25.140 27.644 25.511
65 HA CYS 8 HA CYS 8 27.804 27.841 26.581
66 HB2 CYS 8 HB2 CYS 8 26.876 26.116 24.983
67 HB3 CYS 8 HB3 CYS 8 26.823 27.355 23.740
68 H GLU 9 H GLU 9 26.192 29.871 24.041
69 HA GLU 9 HA GLU 9 28.535 31.433 23.629
70 HB2 GLU 9 HB2 GLU 9 27.333 32.895 22.370
71 HB3 GLU 9 HB3 GLU 9 26.573 31.327 22.076
72 HG2 GLU 9 HG2 GLU 9 24.653 31.914 23.350
73 HG3 GLU 9 HG3 GLU 9 25.419 33.344 24.037
74 H LEU 10 H LEU 10 26.288 31.633 26.276
75 HA LEU 10 HA LEU 10 27.544 34.176 27.203
76 HB2 LEU 10 HB2 LEU 10 25.741 34.401 28.776
77 HB3 LEU 10 HB3 LEU 10 25.193 34.274 27.118
78 HG LEU 10 HG LEU 10 24.653 31.807 27.633
79 HD11 LEU 10 HD11 LEU 10 24.046 31.362 30.018
80 HD12 LEU 10 HD12 LEU 10 25.783 31.513 29.812
81 HD13 LEU 10 HD13 LEU 10 24.855 32.868 30.490
82 HD21 LEU 10 HD21 LEU 10 22.474 32.419 28.587
83 HD22 LEU 10 HD22 LEU 10 23.119 34.012 29.041
84 HD23 LEU 10 HD23 LEU 10 22.965 33.560 27.330
85 H SER 11 H SER 11 27.670 30.772 27.861
86 HA SER 11 HA SER 11 28.996 31.108 30.463
87 HB2 SER 11 HB2 SER 11 27.622 29.173 30.123
88 HB3 SER 11 HB3 SER 11 28.517 28.728 28.660
89 HG SER 11 HG SER 11 29.618 28.888 31.295
90 H CYS 12 H CYS 12 30.083 30.186 27.115
91 HA CYS 12 HA CYS 12 32.892 30.214 27.770
92 HB2 CYS 12 HB2 CYS 12 31.421 30.745 25.161
93 HB3 CYS 12 HB3 CYS 12 33.165 30.576 25.304
94 H ARG 13 H ARG 13 30.558 32.752 27.325
95 HA ARG 13 HA ARG 13 32.348 34.965 26.777
96 HB2 ARG 13 HB2 ARG 13 29.783 34.850 26.573
97 HB3 ARG 13 HB3 ARG 13 29.742 35.129 28.312
98 HG2 ARG 13 HG2 ARG 13 31.025 37.285 27.896
99 HG3 ARG 13 HG3 ARG 13 30.903 36.954 26.157
100 HD2 ARG 13 HD2 ARG 13 29.123 38.486 26.766
101 HD3 ARG 13 HD3 ARG 13 28.394 36.912 26.394
102 HE ARG 13 HE ARG 13 29.082 37.459 29.226
103 HH11 ARG 13 HH11 ARG 13 26.309 37.348 26.967
104 HH12 ARG 13 HH12 ARG 13 25.238 37.206 28.357
105 HH21 ARG 13 HH21 ARG 13 27.548 37.476 30.752
106 HH22 ARG 13 HH22 ARG 13 25.871 37.194 30.277
107 H SER 14 H SER 14 31.594 33.228 29.768
108 HA SER 14 HA SER 14 32.699 35.178 31.545
109 HB2 SER 14 HB2 SER 14 31.283 33.256 32.281
110 HB3 SER 14 HB3 SER 14 32.649 32.165 31.939
111 HG SER 14 HG SER 14 32.450 34.280 33.826
112 H LEU 15 H LEU 15 34.177 32.745 29.485
113 HA LEU 15 HA LEU 15 36.928 33.251 30.472
114 HB2 LEU 15 HB2 LEU 15 35.923 31.501 28.194
115 HB3 LEU 15 HB3 LEU 15 37.553 31.538 28.833
116 HG LEU 15 HG LEU 15 35.082 30.551 30.324
117 HD11 LEU 15 HD11 LEU 15 36.161 28.351 30.087
118 HD12 LEU 15 HD12 LEU 15 35.829 29.065 28.507
119 HD13 LEU 15 HD13 LEU 15 37.487 29.081 29.154
120 HD21 LEU 15 HD21 LEU 15 38.024 30.580 31.147
121 HD22 LEU 15 HD22 LEU 15 36.700 31.487 31.925
122 HD23 LEU 15 HD23 LEU 15 36.718 29.725 32.004
123 H GLY 16 H GLY 16 34.816 34.827 28.401
124 HA2 GLY 16 HA2 GLY 16 35.090 36.465 26.820
125 HA3 GLY 16 HA3 GLY 16 36.843 36.339 26.966
126 H LEU 17 H LEU 17 34.898 33.466 26.157
127 HA LEU 17 HA LEU 17 36.109 33.488 23.410
128 HB2 LEU 17 HB2 LEU 17 35.413 31.173 25.231
129 HB3 LEU 17 HB3 LEU 17 36.002 31.013 23.579
130 HG LEU 17 HG LEU 17 37.481 32.071 25.973
131 HD11 LEU 17 HD11 LEU 17 37.399 29.654 25.893
132 HD12 LEU 17 HD12 LEU 17 38.007 29.667 24.211
133 HD13 LEU 17 HD13 LEU 17 39.031 30.210 25.549
134 HD21 LEU 17 HD21 LEU 17 38.437 31.945 23.076
135 HD22 LEU 17 HD22 LEU 17 38.245 33.416 24.058
136 HD23 LEU 17 HD23 LEU 17 39.493 32.244 24.472
137 H LEU 18 H LEU 18 35.044 32.424 21.742
138 HA LEU 18 HA LEU 18 32.181 32.880 21.509
139 HB2 LEU 18 HB2 LEU 18 33.655 33.198 19.618
140 HB3 LEU 18 HB3 LEU 18 34.277 31.565 19.758
141 HG LEU 18 HG LEU 18 32.115 30.613 19.100
142 HD11 LEU 18 HD11 LEU 18 31.230 33.521 18.858
143 HD12 LEU 18 HD12 LEU 18 30.350 32.132 18.174
144 HD13 LEU 18 HD13 LEU 18 30.524 32.293 19.922
145 HD21 LEU 18 HD21 LEU 18 33.831 31.292 17.395
146 HD22 LEU 18 HD22 LEU 18 32.172 31.276 16.795
147 HD23 LEU 18 HD23 LEU 18 32.937 32.827 17.186
148 H GLY 19 H GLY 19 30.630 31.481 22.074
149 HA2 GLY 19 HA2 GLY 19 31.189 28.659 22.735
150 HA3 GLY 19 HA3 GLY 19 29.662 29.502 22.928
151 H LYS 20 H LYS 20 30.979 27.043 21.384
152 HA LYS 20 HA LYS 20 28.910 26.929 19.242
153 HB2 LYS 20 HB2 LYS 20 31.807 27.002 18.926
154 HB3 LYS 20 HB3 LYS 20 31.273 25.370 18.586
155 HG2 LYS 20 HG2 LYS 20 31.324 26.597 16.565
156 HG3 LYS 20 HG3 LYS 20 29.643 26.231 16.934
157 HD2 LYS 20 HD2 LYS 20 29.205 28.531 17.614
158 HD3 LYS 20 HD3 LYS 20 30.949 28.938 17.546
159 HE2 LYS 20 HE2 LYS 20 31.031 28.438 15.191
160 HE3 LYS 20 HE3 LYS 20 29.384 27.809 15.222
161 HZ1 LYS 20 HZ1 LYS 20 29.361 29.954 14.261
162 HZ2 LYS 20 HZ2 LYS 20 28.618 30.115 15.697
163 HZ3 LYS 20 HZ3 LYS 20 30.164 30.674 15.474
164 H CYS 21 H CYS 21 27.988 24.778 18.965
165 HA CYS 21 HA CYS 21 28.810 22.845 21.087
166 HB2 CYS 21 HB2 CYS 21 26.718 21.937 21.143
167 HB3 CYS 21 HB3 CYS 21 26.477 23.669 21.165
168 H ILE 22 H ILE 22 29.870 21.053 20.534
169 HA ILE 22 HA ILE 22 30.434 20.534 17.677
170 HB ILE 22 HB ILE 22 32.196 20.571 19.383
171 HG12 ILE 22 HG12 ILE 22 32.011 17.842 18.045
172 HG13 ILE 22 HG13 ILE 22 32.386 19.346 17.196
173 HG21 ILE 22 HG21 ILE 22 32.542 18.708 20.942
174 HG22 ILE 22 HG22 ILE 22 31.002 19.480 21.258
175 HG23 ILE 22 HG23 ILE 22 31.051 17.927 20.395
176 HD11 ILE 22 HD11 ILE 22 34.045 18.047 19.393
177 HD12 ILE 22 HD12 ILE 22 34.439 18.224 17.681
178 HD13 ILE 22 HD13 ILE 22 34.364 19.664 18.715
179 H GLY 23 H GLY 23 28.322 19.398 20.029
180 HA2 GLY 23 HA2 GLY 23 26.762 17.683 18.343
181 HA3 GLY 23 HA3 GLY 23 27.701 16.723 19.510
182 H GLU 24 H GLU 24 26.800 16.489 21.481
183 HA GLU 24 HA GLU 24 24.670 18.287 22.508
184 HB2 GLU 24 HB2 GLU 24 26.146 15.933 23.781
185 HB3 GLU 24 HB3 GLU 24 24.824 16.837 24.520
186 HG2 GLU 24 HG2 GLU 24 23.270 16.082 22.780
187 HG3 GLU 24 HG3 GLU 24 24.561 15.224 21.954
188 H GLU 25 H GLU 25 28.116 17.735 22.792
189 HA GLU 25 HA GLU 25 28.635 19.235 25.185
190 HB2 GLU 25 HB2 GLU 25 29.911 17.296 24.434
191 HB3 GLU 25 HB3 GLU 25 30.319 18.098 22.943
192 HG2 GLU 25 HG2 GLU 25 32.279 18.256 24.074
193 HG3 GLU 25 HG3 GLU 25 31.601 19.833 24.410
194 H CYS 26 H CYS 26 29.324 21.271 25.558
195 HA CYS 26 HA CYS 26 29.412 23.287 23.405
196 HB2 CYS 26 HB2 CYS 26 28.140 23.843 25.339
197 HB3 CYS 26 HB3 CYS 26 29.421 23.322 26.421
198 H LYS 27 H LYS 27 31.202 24.082 22.527
199 HA LYS 27 HA LYS 27 33.888 23.822 23.787
200 HB2 LYS 27 HB2 LYS 27 33.099 24.417 20.909
201 HB3 LYS 27 HB3 LYS 27 34.730 24.127 21.488
202 HG2 LYS 27 HG2 LYS 27 32.513 22.007 21.534
203 HG3 LYS 27 HG3 LYS 27 33.613 22.282 20.197
204 HD2 LYS 27 HD2 LYS 27 34.447 20.465 21.382
205 HD3 LYS 27 HD3 LYS 27 35.545 21.824 21.653
206 HE2 LYS 27 HE2 LYS 27 34.676 22.102 23.935
207 HE3 LYS 27 HE3 LYS 27 33.457 20.845 23.651
208 HZ1 LYS 27 HZ1 LYS 27 36.404 20.438 23.592
209 HZ2 LYS 27 HZ2 LYS 27 35.442 19.956 24.813
210 HZ3 LYS 27 HZ3 LYS 27 35.305 19.270 23.318
211 H CYS 28 H CYS 28 35.160 25.526 24.010
212 HA CYS 28 HA CYS 28 34.132 28.290 23.458
213 HB2 CYS 28 HB2 CYS 28 35.991 27.483 25.680
214 HB3 CYS 28 HB3 CYS 28 35.326 29.068 25.338
215 H VAL 29 H VAL 29 35.277 29.395 22.015
216 HA VAL 29 HA VAL 29 38.082 28.649 21.328
217 HB VAL 29 HB VAL 29 37.441 28.485 18.923
218 HG11 VAL 29 HG11 VAL 29 36.016 26.413 20.623
219 HG12 VAL 29 HG12 VAL 29 36.623 26.237 18.977
220 HG13 VAL 29 HG13 VAL 29 37.771 26.469 20.297
221 HG21 VAL 29 HG21 VAL 29 35.291 29.678 18.927
222 HG22 VAL 29 HG22 VAL 29 35.134 28.057 18.253
223 HG23 VAL 29 HG23 VAL 29 34.556 28.380 19.896
224 HA PRO 30 HA PRO 30 38.568 32.947 20.153
225 HB2 PRO 30 HB2 PRO 30 39.765 31.933 17.570
226 HB3 PRO 30 HB3 PRO 30 40.387 33.197 18.681
227 HG2 PRO 30 HG2 PRO 30 41.471 30.722 18.725
228 HG3 PRO 30 HG3 PRO 30 41.085 31.545 20.276
229 HD2 PRO 30 HD2 PRO 30 39.453 29.455 18.804
230 HD3 PRO 30 HD3 PRO 30 39.894 29.527 20.536
231 H TYR 31 H TYR 31 37.414 34.493 19.018
232 HA TYR 31 HA TYR 31 34.976 33.667 17.792
233 HB2 TYR 31 HB2 TYR 31 36.320 36.364 18.048
234 HB3 TYR 31 HB3 TYR 31 34.821 36.169 17.168
235 HD1 TYR 31 HD1 TYR 31 32.716 35.640 18.253
236 HD2 TYR 31 HD2 TYR 31 36.333 36.099 20.547
237 HE1 TYR 31 HE1 TYR 31 31.378 35.732 20.340
238 HE2 TYR 31 HE2 TYR 31 34.980 36.203 22.642
239 HH TYR 31 HH TYR 31 31.419 36.140 22.595
240 H ASN 32 H ASN 32 34.431 33.143 15.837
241 HA ASN 32 HA ASN 32 35.780 34.213 13.416
242 HB2 ASN 32 HB2 ASN 32 35.440 31.299 14.215
243 HB3 ASN 32 HB3 ASN 32 35.320 31.756 12.523
244 HD21 ASN 32 HD21 ASN 32 39.041 32.781 13.514
245 HD22 ASN 32 HD22 ASN 32 37.674 33.656 14.224
Start of MODEL 11
1 H1 ALA 1 H1 ALA 1 21.169 14.682 24.134
2 H2 ALA 1 H2 ALA 1 21.052 14.345 22.540
3 H3 ALA 1 H3 ALA 1 19.929 13.734 23.589
4 HA ALA 1 HA ALA 1 18.996 15.526 22.344
5 HB1 ALA 1 HB1 ALA 1 18.228 15.192 24.660
6 HB2 ALA 1 HB2 ALA 1 19.498 16.289 25.254
7 HB3 ALA 1 HB3 ALA 1 18.192 16.904 24.212
8 H PHE 2 H PHE 2 19.030 17.711 21.635
9 HA PHE 2 HA PHE 2 21.390 18.620 20.604
10 HB2 PHE 2 HB2 PHE 2 18.993 20.346 21.315
11 HB3 PHE 2 HB3 PHE 2 20.216 20.737 20.136
12 HD1 PHE 2 HD1 PHE 2 17.180 18.786 20.790
13 HD2 PHE 2 HD2 PHE 2 20.322 19.597 17.949
14 HE1 PHE 2 HE1 PHE 2 15.811 17.767 18.984
15 HE2 PHE 2 HE2 PHE 2 18.921 18.617 16.137
16 HZ PHE 2 HZ PHE 2 16.680 17.688 16.660
17 H CYS 3 H CYS 3 22.718 20.410 20.827
18 HA CYS 3 HA CYS 3 24.038 20.804 23.236
19 HB2 CYS 3 HB2 CYS 3 23.814 22.440 20.693
20 HB3 CYS 3 HB3 CYS 3 24.851 22.965 22.011
21 H ASN 4 H ASN 4 24.113 22.267 24.850
22 HA ASN 4 HA ASN 4 21.915 24.130 25.367
23 HB2 ASN 4 HB2 ASN 4 24.532 23.682 26.855
24 HB3 ASN 4 HB3 ASN 4 23.147 24.597 27.447
25 HD21 ASN 4 HD21 ASN 4 23.209 21.063 28.814
26 HD22 ASN 4 HD22 ASN 4 24.542 22.185 28.575
27 H LEU 5 H LEU 5 22.936 24.864 22.933
28 HA LEU 5 HA LEU 5 25.310 26.375 22.885
29 HB2 LEU 5 HB2 LEU 5 24.243 25.363 20.924
30 HB3 LEU 5 HB3 LEU 5 22.888 26.487 21.055
31 HG LEU 5 HG LEU 5 24.384 28.387 20.531
32 HD11 LEU 5 HD11 LEU 5 26.539 27.592 21.419
33 HD12 LEU 5 HD12 LEU 5 26.561 26.271 20.226
34 HD13 LEU 5 HD13 LEU 5 26.689 27.960 19.702
35 HD21 LEU 5 HD21 LEU 5 23.254 27.165 18.710
36 HD22 LEU 5 HD22 LEU 5 24.829 27.773 18.180
37 HD23 LEU 5 HD23 LEU 5 24.642 26.061 18.581
38 H ARG 6 H ARG 6 21.961 27.560 23.400
39 HA ARG 6 HA ARG 6 22.666 30.372 23.436
40 HB2 ARG 6 HB2 ARG 6 20.271 28.737 24.317
41 HB3 ARG 6 HB3 ARG 6 20.435 30.379 24.917
42 HG2 ARG 6 HG2 ARG 6 19.047 30.407 22.968
43 HG3 ARG 6 HG3 ARG 6 20.541 31.286 22.670
44 HD2 ARG 6 HD2 ARG 6 19.985 30.059 20.685
45 HD3 ARG 6 HD3 ARG 6 21.419 29.337 21.385
46 HE ARG 6 HE ARG 6 20.156 27.409 22.065
47 HH11 ARG 6 HH11 ARG 6 17.955 29.670 20.484
48 HH12 ARG 6 HH12 ARG 6 16.912 28.374 19.961
49 HH21 ARG 6 HH21 ARG 6 18.657 25.895 21.567
50 HH22 ARG 6 HH22 ARG 6 17.131 26.406 20.883
51 H ARG 7 H ARG 7 22.763 27.947 25.964
52 HA ARG 7 HA ARG 7 23.529 29.840 28.084
53 HB2 ARG 7 HB2 ARG 7 22.452 27.702 28.639
54 HB3 ARG 7 HB3 ARG 7 23.736 26.802 27.861
55 HG2 ARG 7 HG2 ARG 7 23.957 26.751 30.297
56 HG3 ARG 7 HG3 ARG 7 25.362 27.475 29.520
57 HD2 ARG 7 HD2 ARG 7 24.793 28.717 31.518
58 HD3 ARG 7 HD3 ARG 7 24.536 29.746 30.117
59 HE ARG 7 HE ARG 7 22.050 28.511 30.621
60 HH11 ARG 7 HH11 ARG 7 24.157 30.663 32.499
61 HH12 ARG 7 HH12 ARG 7 22.743 31.293 33.349
62 HH21 ARG 7 HH21 ARG 7 20.454 29.330 31.848
63 HH22 ARG 7 HH22 ARG 7 20.848 30.466 33.144
64 H CYS 8 H CYS 8 25.257 27.569 25.984
65 HA CYS 8 HA CYS 8 27.900 27.965 26.981
66 HB2 CYS 8 HB2 CYS 8 27.043 26.077 25.596
67 HB3 CYS 8 HB3 CYS 8 26.777 27.186 24.264
68 H GLU 9 H GLU 9 26.296 29.673 24.219
69 HA GLU 9 HA GLU 9 28.542 31.318 23.648
70 HB2 GLU 9 HB2 GLU 9 25.551 31.760 23.305
71 HB3 GLU 9 HB3 GLU 9 26.767 32.925 22.749
72 HG2 GLU 9 HG2 GLU 9 27.864 31.127 21.416
73 HG3 GLU 9 HG3 GLU 9 26.558 30.023 21.849
74 H LEU 10 H LEU 10 26.154 31.615 26.270
75 HA LEU 10 HA LEU 10 26.980 34.307 27.061
76 HB2 LEU 10 HB2 LEU 10 24.819 34.110 27.641
77 HB3 LEU 10 HB3 LEU 10 24.845 32.367 27.585
78 HG LEU 10 HG LEU 10 25.803 32.313 29.885
79 HD11 LEU 10 HD11 LEU 10 26.631 34.695 30.038
80 HD12 LEU 10 HD12 LEU 10 24.953 35.245 29.909
81 HD13 LEU 10 HD13 LEU 10 25.476 34.305 31.317
82 HD21 LEU 10 HD21 LEU 10 23.613 32.814 30.944
83 HD22 LEU 10 HD22 LEU 10 23.102 33.654 29.471
84 HD23 LEU 10 HD23 LEU 10 23.430 31.909 29.432
85 H SER 11 H SER 11 27.551 30.974 28.148
86 HA SER 11 HA SER 11 29.028 31.671 30.531
87 HB2 SER 11 HB2 SER 11 27.833 29.551 30.332
88 HB3 SER 11 HB3 SER 11 28.863 29.065 28.971
89 HG SER 11 HG SER 11 29.577 28.180 30.960
90 H CYS 12 H CYS 12 30.055 30.535 27.267
91 HA CYS 12 HA CYS 12 32.880 30.691 27.816
92 HB2 CYS 12 HB2 CYS 12 31.331 30.849 25.202
93 HB3 CYS 12 HB3 CYS 12 33.073 30.612 25.340
94 H ARG 13 H ARG 13 30.441 33.069 26.806
95 HA ARG 13 HA ARG 13 32.396 35.064 25.897
96 HB2 ARG 13 HB2 ARG 13 30.141 35.159 25.114
97 HB3 ARG 13 HB3 ARG 13 29.494 35.376 26.738
98 HG2 ARG 13 HG2 ARG 13 30.737 37.593 26.844
99 HG3 ARG 13 HG3 ARG 13 31.265 37.322 25.176
100 HD2 ARG 13 HD2 ARG 13 28.465 37.759 26.226
101 HD3 ARG 13 HD3 ARG 13 29.383 38.820 25.170
102 HE ARG 13 HE ARG 13 29.245 37.046 23.420
103 HH11 ARG 13 HH11 ARG 13 26.701 36.934 25.920
104 HH12 ARG 13 HH12 ARG 13 25.775 35.816 24.920
105 HH21 ARG 13 HH21 ARG 13 27.797 35.917 22.195
106 HH22 ARG 13 HH22 ARG 13 26.257 35.456 22.884
107 H SER 14 H SER 14 31.025 34.320 29.092
108 HA SER 14 HA SER 14 32.074 36.615 30.398
109 HB2 SER 14 HB2 SER 14 30.465 34.981 31.433
110 HB3 SER 14 HB3 SER 14 31.813 33.850 31.627
111 HG SER 14 HG SER 14 31.864 34.941 33.494
112 H LEU 15 H LEU 15 33.636 33.589 29.446
113 HA LEU 15 HA LEU 15 36.182 34.171 30.794
114 HB2 LEU 15 HB2 LEU 15 35.542 32.078 28.676
115 HB3 LEU 15 HB3 LEU 15 36.902 32.087 29.791
116 HG LEU 15 HG LEU 15 33.987 31.670 30.543
117 HD11 LEU 15 HD11 LEU 15 36.345 29.760 30.515
118 HD12 LEU 15 HD12 LEU 15 34.689 29.383 31.044
119 HD13 LEU 15 HD13 LEU 15 35.006 29.777 29.345
120 HD21 LEU 15 HD21 LEU 15 36.468 31.556 32.292
121 HD22 LEU 15 HD22 LEU 15 35.178 32.778 32.395
122 HD23 LEU 15 HD23 LEU 15 34.826 31.087 32.782
123 H GLY 16 H GLY 16 34.758 35.232 27.882
124 HA2 GLY 16 HA2 GLY 16 35.741 36.788 26.389
125 HA3 GLY 16 HA3 GLY 16 37.347 36.176 26.782
126 H LEU 17 H LEU 17 35.174 33.616 26.147
127 HA LEU 17 HA LEU 17 36.306 33.171 23.433
128 HB2 LEU 17 HB2 LEU 17 35.394 31.278 25.644
129 HB3 LEU 17 HB3 LEU 17 35.765 30.770 23.998
130 HG LEU 17 HG LEU 17 38.015 32.065 24.413
131 HD11 LEU 17 HD11 LEU 17 37.300 31.152 27.240
132 HD12 LEU 17 HD12 LEU 17 38.899 31.696 26.701
133 HD13 LEU 17 HD13 LEU 17 37.565 32.833 26.719
134 HD21 LEU 17 HD21 LEU 17 37.525 29.288 25.555
135 HD22 LEU 17 HD22 LEU 17 37.912 29.698 23.863
136 HD23 LEU 17 HD23 LEU 17 39.100 29.974 25.122
137 H LEU 18 H LEU 18 35.039 31.902 21.934
138 HA LEU 18 HA LEU 18 32.172 32.648 21.880
139 HB2 LEU 18 HB2 LEU 18 34.044 31.518 19.816
140 HB3 LEU 18 HB3 LEU 18 32.302 31.642 19.567
141 HG LEU 18 HG LEU 18 34.046 34.047 20.290
142 HD11 LEU 18 HD11 LEU 18 34.729 33.028 18.141
143 HD12 LEU 18 HD12 LEU 18 33.044 33.084 17.589
144 HD13 LEU 18 HD13 LEU 18 33.936 34.591 17.884
145 HD21 LEU 18 HD21 LEU 18 31.649 34.413 20.765
146 HD22 LEU 18 HD22 LEU 18 32.127 35.331 19.343
147 HD23 LEU 18 HD23 LEU 18 31.213 33.825 19.147
148 H GLY 19 H GLY 19 30.566 31.273 22.176
149 HA2 GLY 19 HA2 GLY 19 31.027 28.462 22.907
150 HA3 GLY 19 HA3 GLY 19 29.477 29.281 22.806
151 H LYS 20 H LYS 20 31.146 26.847 21.485
152 HA LYS 20 HA LYS 20 29.598 26.912 18.922
153 HB2 LYS 20 HB2 LYS 20 32.562 26.263 19.089
154 HB3 LYS 20 HB3 LYS 20 31.558 26.053 17.660
155 HG2 LYS 20 HG2 LYS 20 32.107 28.746 18.955
156 HG3 LYS 20 HG3 LYS 20 33.036 28.057 17.620
157 HD2 LYS 20 HD2 LYS 20 31.152 28.105 16.117
158 HD3 LYS 20 HD3 LYS 20 30.041 28.503 17.431
159 HE2 LYS 20 HE2 LYS 20 30.378 30.519 16.319
160 HE3 LYS 20 HE3 LYS 20 31.304 30.620 17.822
161 HZ1 LYS 20 HZ1 LYS 20 32.504 31.462 15.798
162 HZ2 LYS 20 HZ2 LYS 20 33.337 30.262 16.556
163 HZ3 LYS 20 HZ3 LYS 20 32.482 29.968 15.175
164 H CYS 21 H CYS 21 28.605 25.116 18.409
165 HA CYS 21 HA CYS 21 28.654 22.844 20.305
166 HB2 CYS 21 HB2 CYS 21 26.535 23.882 19.792
167 HB3 CYS 21 HB3 CYS 21 26.827 23.719 18.068
168 H ILE 22 H ILE 22 29.260 20.769 19.869
169 HA ILE 22 HA ILE 22 30.504 20.135 17.226
170 HB ILE 22 HB ILE 22 30.532 18.673 19.887
171 HG12 ILE 22 HG12 ILE 22 32.740 20.193 18.419
172 HG13 ILE 22 HG13 ILE 22 31.844 20.817 19.803
173 HG21 ILE 22 HG21 ILE 22 32.051 18.027 17.314
174 HG22 ILE 22 HG22 ILE 22 32.201 17.171 18.871
175 HG23 ILE 22 HG23 ILE 22 30.704 17.073 17.972
176 HD11 ILE 22 HD11 ILE 22 33.989 20.017 20.541
177 HD12 ILE 22 HD12 ILE 22 32.719 18.974 21.219
178 HD13 ILE 22 HD13 ILE 22 33.718 18.424 19.846
179 H GLY 23 H GLY 23 27.842 19.010 19.303
180 HA2 GLY 23 HA2 GLY 23 26.181 18.189 17.136
181 HA3 GLY 23 HA3 GLY 23 27.024 16.763 17.766
182 H GLU 24 H GLU 24 27.067 16.975 20.409
183 HA GLU 24 HA GLU 24 24.382 17.862 21.400
184 HB2 GLU 24 HB2 GLU 24 24.197 15.964 22.845
185 HB3 GLU 24 HB3 GLU 24 24.337 15.418 21.180
186 HG2 GLU 24 HG2 GLU 24 26.656 14.745 21.535
187 HG3 GLU 24 HG3 GLU 24 26.661 15.480 23.145
188 H GLU 25 H GLU 25 27.801 18.031 21.808
189 HA GLU 25 HA GLU 25 27.421 19.531 24.365
190 HB2 GLU 25 HB2 GLU 25 29.851 18.004 23.358
191 HB3 GLU 25 HB3 GLU 25 29.846 19.048 24.777
192 HG2 GLU 25 HG2 GLU 25 28.206 16.497 24.441
193 HG3 GLU 25 HG3 GLU 25 29.681 16.683 25.382
194 H CYS 26 H CYS 26 28.625 21.439 24.684
195 HA CYS 26 HA CYS 26 29.583 22.784 22.187
196 HB2 CYS 26 HB2 CYS 26 27.318 23.448 22.761
197 HB3 CYS 26 HB3 CYS 26 27.822 23.900 24.391
198 H LYS 27 H LYS 27 31.416 23.804 22.226
199 HA LYS 27 HA LYS 27 33.071 23.858 24.731
200 HB2 LYS 27 HB2 LYS 27 33.880 23.905 21.783
201 HB3 LYS 27 HB3 LYS 27 34.967 23.819 23.144
202 HG2 LYS 27 HG2 LYS 27 33.035 21.640 22.287
203 HG3 LYS 27 HG3 LYS 27 34.756 21.705 22.003
204 HD2 LYS 27 HD2 LYS 27 34.760 20.288 23.753
205 HD3 LYS 27 HD3 LYS 27 34.952 21.830 24.635
206 HE2 LYS 27 HE2 LYS 27 32.579 21.810 25.234
207 HE3 LYS 27 HE3 LYS 27 32.268 20.448 24.159
208 HZ1 LYS 27 HZ1 LYS 27 32.468 19.719 26.456
209 HZ2 LYS 27 HZ2 LYS 27 33.714 19.081 25.569
210 HZ3 LYS 27 HZ3 LYS 27 33.977 20.358 26.572
211 H CYS 28 H CYS 28 34.684 25.517 24.876
212 HA CYS 28 HA CYS 28 33.868 28.245 23.928
213 HB2 CYS 28 HB2 CYS 28 35.672 27.421 26.215
214 HB3 CYS 28 HB3 CYS 28 35.188 29.047 25.782
215 H VAL 29 H VAL 29 34.983 28.949 22.222
216 HA VAL 29 HA VAL 29 37.831 28.145 21.882
217 HB VAL 29 HB VAL 29 37.339 27.950 19.406
218 HG11 VAL 29 HG11 VAL 29 35.979 25.911 21.223
219 HG12 VAL 29 HG12 VAL 29 36.577 25.648 19.574
220 HG13 VAL 29 HG13 VAL 29 37.720 25.997 20.876
221 HG21 VAL 29 HG21 VAL 29 35.087 29.063 19.446
222 HG22 VAL 29 HG22 VAL 29 35.097 27.468 18.680
223 HG23 VAL 29 HG23 VAL 29 34.440 27.656 20.319
224 HA PRO 30 HA PRO 30 38.930 32.297 20.897
225 HB2 PRO 30 HB2 PRO 30 40.330 31.165 18.473
226 HB3 PRO 30 HB3 PRO 30 40.954 32.325 19.679
227 HG2 PRO 30 HG2 PRO 30 41.684 29.742 19.837
228 HG3 PRO 30 HG3 PRO 30 41.143 30.581 21.331
229 HD2 PRO 30 HD2 PRO 30 39.533 28.763 19.516
230 HD3 PRO 30 HD3 PRO 30 39.691 28.740 21.305
231 H TYR 31 H TYR 31 38.940 34.069 19.261
232 HA TYR 31 HA TYR 31 36.644 34.018 17.436
233 HB2 TYR 31 HB2 TYR 31 38.811 36.104 17.455
234 HB3 TYR 31 HB3 TYR 31 37.150 36.273 16.957
235 HD1 TYR 31 HD1 TYR 31 38.999 37.934 18.891
236 HD2 TYR 31 HD2 TYR 31 35.850 35.084 19.542
237 HE1 TYR 31 HE1 TYR 31 38.492 39.008 21.061
238 HE2 TYR 31 HE2 TYR 31 35.336 36.162 21.739
239 HH TYR 31 HH TYR 31 35.734 38.068 23.091
240 H ASN 32 H ASN 32 36.708 33.955 15.175
241 HA ASN 32 HA ASN 32 39.286 33.144 13.870
242 HB2 ASN 32 HB2 ASN 32 37.933 31.466 12.577
243 HB3 ASN 32 HB3 ASN 32 38.141 31.109 14.274
244 HD21 ASN 32 HD21 ASN 32 34.357 32.381 13.336
245 HD22 ASN 32 HD22 ASN 32 35.719 33.249 12.649
Start of MODEL 12
1 H1 ALA 1 H1 ALA 1 18.357 14.665 24.514
2 H2 ALA 1 H2 ALA 1 19.773 15.490 24.619
3 H3 ALA 1 H3 ALA 1 19.391 14.690 23.231
4 HA ALA 1 HA ALA 1 17.655 16.185 22.715
5 HB1 ALA 1 HB1 ALA 1 18.294 17.486 25.404
6 HB2 ALA 1 HB2 ALA 1 17.083 18.044 24.231
7 HB3 ALA 1 HB3 ALA 1 16.865 16.490 25.048
8 H PHE 2 H PHE 2 17.984 18.512 21.964
9 HA PHE 2 HA PHE 2 20.538 18.829 20.848
10 HB2 PHE 2 HB2 PHE 2 18.618 21.114 21.332
11 HB3 PHE 2 HB3 PHE 2 19.791 20.942 20.032
12 HD1 PHE 2 HD1 PHE 2 16.637 21.440 20.097
13 HD2 PHE 2 HD2 PHE 2 19.158 18.050 19.199
14 HE1 PHE 2 HE1 PHE 2 14.853 20.474 18.699
15 HE2 PHE 2 HE2 PHE 2 17.355 17.073 17.829
16 HZ PHE 2 HZ PHE 2 15.192 18.279 17.550
17 H CYS 3 H CYS 3 22.262 20.131 21.139
18 HA CYS 3 HA CYS 3 23.161 20.664 23.770
19 HB2 CYS 3 HB2 CYS 3 25.033 21.820 22.597
20 HB3 CYS 3 HB3 CYS 3 24.696 20.183 22.042
21 H ASN 4 H ASN 4 23.516 22.478 24.956
22 HA ASN 4 HA ASN 4 21.560 24.629 24.706
23 HB2 ASN 4 HB2 ASN 4 23.751 23.999 26.741
24 HB3 ASN 4 HB3 ASN 4 22.622 25.332 26.889
25 HD21 ASN 4 HD21 ASN 4 21.323 22.614 28.960
26 HD22 ASN 4 HD22 ASN 4 22.945 23.240 28.797
27 H LEU 5 H LEU 5 22.676 25.195 22.489
28 HA LEU 5 HA LEU 5 25.286 26.342 22.515
29 HB2 LEU 5 HB2 LEU 5 24.226 25.293 20.586
30 HB3 LEU 5 HB3 LEU 5 23.061 26.592 20.472
31 HG LEU 5 HG LEU 5 24.945 26.567 18.815
32 HD11 LEU 5 HD11 LEU 5 25.239 28.943 18.688
33 HD12 LEU 5 HD12 LEU 5 23.581 28.592 19.204
34 HD13 LEU 5 HD13 LEU 5 24.785 29.163 20.378
35 HD21 LEU 5 HD21 LEU 5 26.776 26.002 20.391
36 HD22 LEU 5 HD22 LEU 5 27.118 27.421 19.387
37 HD23 LEU 5 HD23 LEU 5 26.662 27.643 21.081
38 H ARG 6 H ARG 6 22.079 28.019 22.616
39 HA ARG 6 HA ARG 6 23.144 30.695 22.619
40 HB2 ARG 6 HB2 ARG 6 20.609 29.618 23.928
41 HB3 ARG 6 HB3 ARG 6 20.980 31.323 23.713
42 HG2 ARG 6 HG2 ARG 6 20.986 31.047 21.254
43 HG3 ARG 6 HG3 ARG 6 20.582 29.340 21.430
44 HD2 ARG 6 HD2 ARG 6 18.891 31.696 22.362
45 HD3 ARG 6 HD3 ARG 6 18.565 30.691 20.954
46 HE ARG 6 HE ARG 6 18.099 30.050 23.790
47 HH11 ARG 6 HH11 ARG 6 18.249 28.608 20.557
48 HH12 ARG 6 HH12 ARG 6 17.443 27.157 21.144
49 HH21 ARG 6 HH21 ARG 6 16.941 28.227 24.316
50 HH22 ARG 6 HH22 ARG 6 16.508 27.081 23.073
51 H ARG 7 H ARG 7 22.400 28.558 25.369
52 HA ARG 7 HA ARG 7 23.459 30.378 27.395
53 HB2 ARG 7 HB2 ARG 7 22.778 27.435 27.343
54 HB3 ARG 7 HB3 ARG 7 23.717 28.087 28.681
55 HG2 ARG 7 HG2 ARG 7 21.406 28.044 29.308
56 HG3 ARG 7 HG3 ARG 7 21.959 29.716 29.198
57 HD2 ARG 7 HD2 ARG 7 20.850 29.958 26.997
58 HD3 ARG 7 HD3 ARG 7 20.341 28.266 27.057
59 HE ARG 7 HE ARG 7 19.149 30.543 28.408
60 HH11 ARG 7 HH11 ARG 7 19.145 27.022 28.213
61 HH12 ARG 7 HH12 ARG 7 17.794 26.933 29.336
62 HH21 ARG 7 HH21 ARG 7 17.487 30.223 29.942
63 HH22 ARG 7 HH22 ARG 7 16.898 28.571 30.143
64 H CYS 8 H CYS 8 25.035 27.730 25.576
65 HA CYS 8 HA CYS 8 27.597 27.933 26.826
66 HB2 CYS 8 HB2 CYS 8 26.837 26.070 25.436
67 HB3 CYS 8 HB3 CYS 8 26.692 27.128 24.042
68 H GLU 9 H GLU 9 26.271 29.722 24.033
69 HA GLU 9 HA GLU 9 28.533 31.373 23.495
70 HB2 GLU 9 HB2 GLU 9 25.542 31.707 23.150
71 HB3 GLU 9 HB3 GLU 9 26.643 32.983 22.670
72 HG2 GLU 9 HG2 GLU 9 27.059 30.156 21.640
73 HG3 GLU 9 HG3 GLU 9 25.828 31.219 20.946
74 H LEU 10 H LEU 10 26.429 31.488 26.260
75 HA LEU 10 HA LEU 10 27.395 34.157 27.110
76 HB2 LEU 10 HB2 LEU 10 25.131 34.171 27.387
77 HB3 LEU 10 HB3 LEU 10 25.004 32.433 27.477
78 HG LEU 10 HG LEU 10 25.857 32.505 29.818
79 HD11 LEU 10 HD11 LEU 10 25.645 34.628 31.061
80 HD12 LEU 10 HD12 LEU 10 26.823 34.832 29.757
81 HD13 LEU 10 HD13 LEU 10 25.190 35.484 29.567
82 HD21 LEU 10 HD21 LEU 10 23.257 33.959 29.195
83 HD22 LEU 10 HD22 LEU 10 23.493 32.199 29.291
84 HD23 LEU 10 HD23 LEU 10 23.674 33.190 30.747
85 H SER 11 H SER 11 27.437 30.713 28.056
86 HA SER 11 HA SER 11 28.888 31.081 30.508
87 HB2 SER 11 HB2 SER 11 27.429 29.132 29.954
88 HB3 SER 11 HB3 SER 11 28.656 28.575 28.804
89 HG SER 11 HG SER 11 28.888 28.912 31.626
90 H CYS 12 H CYS 12 29.991 30.215 27.180
91 HA CYS 12 HA CYS 12 32.823 30.279 27.860
92 HB2 CYS 12 HB2 CYS 12 31.312 30.572 25.239
93 HB3 CYS 12 HB3 CYS 12 33.064 30.514 25.361
94 H ARG 13 H ARG 13 30.399 32.772 27.176
95 HA ARG 13 HA ARG 13 32.321 34.795 26.414
96 HB2 ARG 13 HB2 ARG 13 29.897 34.956 25.904
97 HB3 ARG 13 HB3 ARG 13 29.553 35.222 27.606
98 HG2 ARG 13 HG2 ARG 13 29.523 37.324 26.402
99 HG3 ARG 13 HG3 ARG 13 30.846 37.323 27.551
100 HD2 ARG 13 HD2 ARG 13 31.671 38.298 25.538
101 HD3 ARG 13 HD3 ARG 13 32.417 36.732 25.648
102 HE ARG 13 HE ARG 13 30.814 35.876 23.972
103 HH11 ARG 13 HH11 ARG 13 30.713 39.408 24.194
104 HH12 ARG 13 HH12 ARG 13 30.525 39.519 22.435
105 HH21 ARG 13 HH21 ARG 13 30.147 36.223 21.908
106 HH22 ARG 13 HH22 ARG 13 30.238 37.869 21.243
107 H SER 14 H SER 14 31.343 33.524 29.525
108 HA SER 14 HA SER 14 32.418 35.506 31.217
109 HB2 SER 14 HB2 SER 14 31.164 33.426 31.916
110 HB3 SER 14 HB3 SER 14 32.645 32.505 31.600
111 HG SER 14 HG SER 14 32.862 32.979 33.656
112 H LEU 15 H LEU 15 34.040 32.995 29.318
113 HA LEU 15 HA LEU 15 36.742 33.593 30.286
114 HB2 LEU 15 HB2 LEU 15 35.895 31.818 27.975
115 HB3 LEU 15 HB3 LEU 15 37.406 31.769 28.865
116 HG LEU 15 HG LEU 15 34.685 30.961 29.969
117 HD11 LEU 15 HD11 LEU 15 35.592 28.675 29.851
118 HD12 LEU 15 HD12 LEU 15 35.545 29.435 28.249
119 HD13 LEU 15 HD13 LEU 15 37.086 29.306 29.112
120 HD21 LEU 15 HD21 LEU 15 36.156 31.759 31.776
121 HD22 LEU 15 HD22 LEU 15 36.004 30.001 31.845
122 HD23 LEU 15 HD23 LEU 15 37.478 30.725 31.166
123 H GLY 16 H GLY 16 34.801 35.342 28.269
124 HA2 GLY 16 HA2 GLY 16 35.178 36.819 26.539
125 HA3 GLY 16 HA3 GLY 16 36.918 36.613 26.790
126 H LEU 17 H LEU 17 34.599 34.030 25.970
127 HA LEU 17 HA LEU 17 35.756 33.722 23.227
128 HB2 LEU 17 HB2 LEU 17 35.138 31.537 25.258
129 HB3 LEU 17 HB3 LEU 17 35.639 31.261 23.605
130 HG LEU 17 HG LEU 17 37.274 32.578 25.754
131 HD11 LEU 17 HD11 LEU 17 37.058 30.239 26.241
132 HD12 LEU 17 HD12 LEU 17 37.597 29.819 24.588
133 HD13 LEU 17 HD13 LEU 17 38.699 30.606 25.730
134 HD21 LEU 17 HD21 LEU 17 37.943 33.359 23.462
135 HD22 LEU 17 HD22 LEU 17 39.203 32.410 24.247
136 HD23 LEU 17 HD23 LEU 17 38.189 31.660 22.999
137 H LEU 18 H LEU 18 34.425 32.477 21.785
138 HA LEU 18 HA LEU 18 31.503 32.883 22.094
139 HB2 LEU 18 HB2 LEU 18 33.115 31.678 19.804
140 HB3 LEU 18 HB3 LEU 18 31.387 32.031 19.790
141 HG LEU 18 HG LEU 18 33.656 34.048 19.950
142 HD11 LEU 18 HD11 LEU 18 31.585 33.513 17.791
143 HD12 LEU 18 HD12 LEU 18 32.821 34.782 17.759
144 HD13 LEU 18 HD13 LEU 18 33.309 33.079 17.726
145 HD21 LEU 18 HD21 LEU 18 31.805 35.750 19.708
146 HD22 LEU 18 HD22 LEU 18 30.633 34.444 19.982
147 HD23 LEU 18 HD23 LEU 18 31.785 34.905 21.257
148 H GLY 19 H GLY 19 30.052 31.183 21.882
149 HA2 GLY 19 HA2 GLY 19 30.945 28.602 23.072
150 HA3 GLY 19 HA3 GLY 19 29.285 29.174 22.945
151 H LYS 20 H LYS 20 30.981 26.761 21.944
152 HA LYS 20 HA LYS 20 29.565 26.543 19.329
153 HB2 LYS 20 HB2 LYS 20 32.377 26.623 19.660
154 HB3 LYS 20 HB3 LYS 20 32.007 24.905 19.535
155 HG2 LYS 20 HG2 LYS 20 32.356 25.543 17.323
156 HG3 LYS 20 HG3 LYS 20 30.588 25.560 17.461
157 HD2 LYS 20 HD2 LYS 20 30.927 28.111 18.054
158 HD3 LYS 20 HD3 LYS 20 32.543 27.899 17.381
159 HE2 LYS 20 HE2 LYS 20 29.896 27.357 16.009
160 HE3 LYS 20 HE3 LYS 20 30.931 28.775 15.741
161 HZ1 LYS 20 HZ1 LYS 20 32.656 27.235 14.855
162 HZ2 LYS 20 HZ2 LYS 20 31.647 25.962 15.084
163 HZ3 LYS 20 HZ3 LYS 20 31.280 27.096 13.989
164 H CYS 21 H CYS 21 28.712 24.571 18.771
165 HA CYS 21 HA CYS 21 28.447 22.528 20.927
166 HB2 CYS 21 HB2 CYS 21 26.433 23.509 19.895
167 HB3 CYS 21 HB3 CYS 21 26.963 22.932 18.319
168 H ILE 22 H ILE 22 29.207 20.466 20.669
169 HA ILE 22 HA ILE 22 30.291 19.626 18.027
170 HB ILE 22 HB ILE 22 32.035 20.673 19.669
171 HG12 ILE 22 HG12 ILE 22 32.695 17.985 18.422
172 HG13 ILE 22 HG13 ILE 22 32.420 19.451 17.481
173 HG21 ILE 22 HG21 ILE 22 31.397 19.327 21.667
174 HG22 ILE 22 HG22 ILE 22 31.924 17.843 20.836
175 HG23 ILE 22 HG23 ILE 22 33.091 19.087 21.225
176 HD11 ILE 22 HD11 ILE 22 34.600 19.103 19.567
177 HD12 ILE 22 HD12 ILE 22 34.799 19.122 17.807
178 HD13 ILE 22 HD13 ILE 22 34.268 20.589 18.651
179 H GLY 23 H GLY 23 28.657 18.724 20.907
180 HA2 GLY 23 HA2 GLY 23 27.334 16.556 20.608
181 HA3 GLY 23 HA3 GLY 23 28.896 15.792 20.316
182 H GLU 24 H GLU 24 26.710 16.988 22.630
183 HA GLU 24 HA GLU 24 26.458 16.916 24.827
184 HB2 GLU 24 HB2 GLU 24 28.378 14.649 25.092
185 HB3 GLU 24 HB3 GLU 24 26.851 14.937 25.907
186 HG2 GLU 24 HG2 GLU 24 27.372 13.857 23.136
187 HG3 GLU 24 HG3 GLU 24 26.583 13.066 24.480
188 H GLU 25 H GLU 25 28.837 18.605 23.925
189 HA GLU 25 HA GLU 25 29.504 19.492 26.611
190 HB2 GLU 25 HB2 GLU 25 31.202 17.739 26.403
191 HB3 GLU 25 HB3 GLU 25 31.694 18.366 24.837
192 HG2 GLU 25 HG2 GLU 25 33.367 19.007 26.335
193 HG3 GLU 25 HG3 GLU 25 32.479 20.479 25.990
194 H CYS 26 H CYS 26 29.673 21.651 26.668
195 HA CYS 26 HA CYS 26 29.636 23.260 24.266
196 HB2 CYS 26 HB2 CYS 26 28.423 23.953 26.225
197 HB3 CYS 26 HB3 CYS 26 29.856 23.796 27.230
198 H LYS 27 H LYS 27 31.308 23.724 23.020
199 HA LYS 27 HA LYS 27 34.092 23.924 24.113
200 HB2 LYS 27 HB2 LYS 27 32.849 23.565 21.414
201 HB3 LYS 27 HB3 LYS 27 34.301 24.550 21.470
202 HG2 LYS 27 HG2 LYS 27 34.722 22.218 20.931
203 HG3 LYS 27 HG3 LYS 27 35.635 22.774 22.324
204 HD2 LYS 27 HD2 LYS 27 33.026 21.287 22.724
205 HD3 LYS 27 HD3 LYS 27 34.466 20.404 22.238
206 HE2 LYS 27 HE2 LYS 27 34.310 22.091 24.758
207 HE3 LYS 27 HE3 LYS 27 34.067 20.347 24.658
208 HZ1 LYS 27 HZ1 LYS 27 36.572 21.817 24.394
209 HZ2 LYS 27 HZ2 LYS 27 36.275 20.385 25.131
210 HZ3 LYS 27 HZ3 LYS 27 36.412 20.475 23.487
211 H CYS 28 H CYS 28 35.326 25.698 24.063
212 HA CYS 28 HA CYS 28 34.018 28.377 23.663
213 HB2 CYS 28 HB2 CYS 28 36.063 27.657 25.743
214 HB3 CYS 28 HB3 CYS 28 35.280 29.213 25.463
215 H VAL 29 H VAL 29 34.910 29.606 22.148
216 HA VAL 29 HA VAL 29 37.695 29.090 21.243
217 HB VAL 29 HB VAL 29 36.906 29.017 18.893
218 HG11 VAL 29 HG11 VAL 29 35.740 26.779 20.600
219 HG12 VAL 29 HG12 VAL 29 36.228 26.690 18.905
220 HG13 VAL 29 HG13 VAL 29 37.454 26.945 20.156
221 HG21 VAL 29 HG21 VAL 29 34.128 28.620 20.086
222 HG22 VAL 29 HG22 VAL 29 34.666 30.039 19.152
223 HG23 VAL 29 HG23 VAL 29 34.592 28.453 18.379
224 HA PRO 30 HA PRO 30 38.070 33.403 20.901
225 HB2 PRO 30 HB2 PRO 30 39.553 33.033 18.305
226 HB3 PRO 30 HB3 PRO 30 40.035 33.965 19.755
227 HG2 PRO 30 HG2 PRO 30 41.108 31.525 19.281
228 HG3 PRO 30 HG3 PRO 30 40.582 31.960 20.941
229 HD2 PRO 30 HD2 PRO 30 39.094 30.299 18.882
230 HD3 PRO 30 HD3 PRO 30 39.376 29.993 20.617
231 H TYR 31 H TYR 31 37.486 35.365 19.894
232 HA TYR 31 HA TYR 31 35.279 35.431 18.054
233 HB2 TYR 31 HB2 TYR 31 37.250 37.682 18.595
234 HB3 TYR 31 HB3 TYR 31 35.598 37.830 18.023
235 HD1 TYR 31 HD1 TYR 31 34.059 36.171 19.871
236 HD2 TYR 31 HD2 TYR 31 37.316 38.863 20.646
237 HE1 TYR 31 HE1 TYR 31 33.317 36.375 22.248
238 HE2 TYR 31 HE2 TYR 31 36.544 39.110 23.007
239 HH TYR 31 HH TYR 31 34.871 38.624 24.514
240 H ASN 32 H ASN 32 35.207 36.214 15.898
241 HA ASN 32 HA ASN 32 35.707 36.208 13.709
242 HB2 ASN 32 HB2 ASN 32 38.356 37.399 14.590
243 HB3 ASN 32 HB3 ASN 32 37.534 37.678 13.067
244 HD21 ASN 32 HD21 ASN 32 36.911 40.339 15.817
245 HD22 ASN 32 HD22 ASN 32 38.342 39.335 15.618
Start of MODEL 13
1 H1 ALA 1 H1 ALA 1 22.020 14.120 24.741
2 H2 ALA 1 H2 ALA 1 21.648 13.953 23.153
3 H3 ALA 1 H3 ALA 1 20.658 13.284 24.304
4 HA ALA 1 HA ALA 1 19.580 15.190 23.538
5 HB1 ALA 1 HB1 ALA 1 20.935 15.757 26.218
6 HB2 ALA 1 HB2 ALA 1 19.489 16.568 25.606
7 HB3 ALA 1 HB3 ALA 1 19.434 14.836 25.975
8 H PHE 2 H PHE 2 19.771 17.015 22.315
9 HA PHE 2 HA PHE 2 22.212 17.902 21.372
10 HB2 PHE 2 HB2 PHE 2 19.721 19.612 21.552
11 HB3 PHE 2 HB3 PHE 2 21.017 19.749 20.364
12 HD1 PHE 2 HD1 PHE 2 21.394 16.884 19.532
13 HD2 PHE 2 HD2 PHE 2 17.796 19.133 20.306
14 HE1 PHE 2 HE1 PHE 2 20.122 15.362 18.079
15 HE2 PHE 2 HE2 PHE 2 16.535 17.622 18.813
16 HZ PHE 2 HZ PHE 2 17.690 15.739 17.673
17 H CYS 3 H CYS 3 23.405 19.754 21.476
18 HA CYS 3 HA CYS 3 24.346 20.494 23.975
19 HB2 CYS 3 HB2 CYS 3 25.663 22.140 22.704
20 HB3 CYS 3 HB3 CYS 3 25.597 20.578 21.899
21 H ASN 4 H ASN 4 24.356 22.311 25.204
22 HA ASN 4 HA ASN 4 21.965 24.062 25.223
23 HB2 ASN 4 HB2 ASN 4 24.308 23.715 27.149
24 HB3 ASN 4 HB3 ASN 4 22.951 24.804 27.405
25 HD21 ASN 4 HD21 ASN 4 22.387 21.542 29.180
26 HD22 ASN 4 HD22 ASN 4 23.677 22.733 29.215
27 H LEU 5 H LEU 5 23.112 24.673 22.945
28 HA LEU 5 HA LEU 5 25.443 26.269 22.910
29 HB2 LEU 5 HB2 LEU 5 24.466 25.245 20.920
30 HB3 LEU 5 HB3 LEU 5 23.049 26.280 21.052
31 HG LEU 5 HG LEU 5 24.371 28.276 20.554
32 HD11 LEU 5 HD11 LEU 5 26.748 26.372 20.390
33 HD12 LEU 5 HD12 LEU 5 26.738 28.028 19.769
34 HD13 LEU 5 HD13 LEU 5 26.561 27.746 21.498
35 HD21 LEU 5 HD21 LEU 5 23.430 26.932 18.715
36 HD22 LEU 5 HD22 LEU 5 24.920 27.750 18.228
37 HD23 LEU 5 HD23 LEU 5 24.941 26.012 18.599
38 H ARG 6 H ARG 6 22.039 27.284 23.452
39 HA ARG 6 HA ARG 6 22.587 30.089 23.235
40 HB2 ARG 6 HB2 ARG 6 20.353 28.917 23.020
41 HB3 ARG 6 HB3 ARG 6 20.323 28.725 24.776
42 HG2 ARG 6 HG2 ARG 6 20.301 31.185 25.057
43 HG3 ARG 6 HG3 ARG 6 20.527 31.394 23.315
44 HD2 ARG 6 HD2 ARG 6 18.219 31.793 23.797
45 HD3 ARG 6 HD3 ARG 6 18.331 30.268 22.906
46 HE ARG 6 HE ARG 6 18.391 29.713 25.723
47 HH11 ARG 6 HH11 ARG 6 15.990 30.835 23.378
48 HH12 ARG 6 HH12 ARG 6 14.689 30.220 24.413
49 HH21 ARG 6 HH21 ARG 6 16.715 28.999 26.820
50 HH22 ARG 6 HH22 ARG 6 15.058 29.301 26.243
51 H ARG 7 H ARG 7 22.485 27.998 26.141
52 HA ARG 7 HA ARG 7 23.414 30.026 28.004
53 HB2 ARG 7 HB2 ARG 7 22.310 28.068 28.850
54 HB3 ARG 7 HB3 ARG 7 23.399 26.992 27.989
55 HG2 ARG 7 HG2 ARG 7 23.926 26.906 30.333
56 HG3 ARG 7 HG3 ARG 7 25.268 27.600 29.457
57 HD2 ARG 7 HD2 ARG 7 25.129 28.909 31.369
58 HD3 ARG 7 HD3 ARG 7 24.334 29.921 30.158
59 HE ARG 7 HE ARG 7 22.292 28.391 31.352
60 HH11 ARG 7 HH11 ARG 7 24.623 30.748 32.666
61 HH12 ARG 7 HH12 ARG 7 23.505 31.100 33.978
62 HH21 ARG 7 HH21 ARG 7 21.139 28.864 33.095
63 HH22 ARG 7 HH22 ARG 7 21.689 30.110 34.230
64 H CYS 8 H CYS 8 25.129 27.557 26.070
65 HA CYS 8 HA CYS 8 27.756 28.023 27.107
66 HB2 CYS 8 HB2 CYS 8 26.999 26.038 25.822
67 HB3 CYS 8 HB3 CYS 8 26.719 27.057 24.425
68 H GLU 9 H GLU 9 26.211 29.532 24.218
69 HA GLU 9 HA GLU 9 28.563 31.056 23.627
70 HB2 GLU 9 HB2 GLU 9 27.350 32.105 21.978
71 HB3 GLU 9 HB3 GLU 9 26.721 30.449 22.045
72 HG2 GLU 9 HG2 GLU 9 24.740 31.245 23.246
73 HG3 GLU 9 HG3 GLU 9 25.370 32.887 23.252
74 H LEU 10 H LEU 10 26.208 31.628 26.074
75 HA LEU 10 HA LEU 10 27.379 34.339 26.543
76 HB2 LEU 10 HB2 LEU 10 25.630 34.853 28.023
77 HB3 LEU 10 HB3 LEU 10 24.979 34.281 26.504
78 HG LEU 10 HG LEU 10 24.603 32.022 27.722
79 HD11 LEU 10 HD11 LEU 10 24.921 33.885 30.127
80 HD12 LEU 10 HD12 LEU 10 24.123 32.307 30.180
81 HD13 LEU 10 HD13 LEU 10 25.844 32.398 29.832
82 HD21 LEU 10 HD21 LEU 10 22.809 33.489 27.038
83 HD22 LEU 10 HD22 LEU 10 22.458 32.809 28.623
84 HD23 LEU 10 HD23 LEU 10 23.024 34.491 28.496
85 H SER 11 H SER 11 27.410 31.070 27.857
86 HA SER 11 HA SER 11 28.682 31.719 30.359
87 HB2 SER 11 HB2 SER 11 27.512 29.601 30.045
88 HB3 SER 11 HB3 SER 11 28.633 29.144 28.745
89 HG SER 11 HG SER 11 29.287 28.176 30.677
90 H CYS 12 H CYS 12 30.014 30.489 27.241
91 HA CYS 12 HA CYS 12 32.772 30.704 27.974
92 HB2 CYS 12 HB2 CYS 12 31.398 30.821 25.262
93 HB3 CYS 12 HB3 CYS 12 33.118 30.563 25.513
94 H ARG 13 H ARG 13 30.433 33.061 26.895
95 HA ARG 13 HA ARG 13 32.264 35.133 25.998
96 HB2 ARG 13 HB2 ARG 13 29.795 35.085 25.540
97 HB3 ARG 13 HB3 ARG 13 29.510 35.504 27.235
98 HG2 ARG 13 HG2 ARG 13 30.775 37.643 26.890
99 HG3 ARG 13 HG3 ARG 13 31.026 37.196 25.202
100 HD2 ARG 13 HD2 ARG 13 29.179 38.757 25.351
101 HD3 ARG 13 HD3 ARG 13 28.558 37.172 24.864
102 HE ARG 13 HE ARG 13 28.501 37.854 27.776
103 HH11 ARG 13 HH11 ARG 13 26.461 37.675 24.854
104 HH12 ARG 13 HH12 ARG 13 25.071 37.337 25.886
105 HH21 ARG 13 HH21 ARG 13 26.670 37.636 28.840
106 HH22 ARG 13 HH22 ARG 13 25.141 37.439 27.975
107 H SER 14 H SER 14 31.283 34.081 29.219
108 HA SER 14 HA SER 14 32.135 36.284 30.725
109 HB2 SER 14 HB2 SER 14 30.928 34.250 31.585
110 HB3 SER 14 HB3 SER 14 32.465 33.360 31.479
111 HG SER 14 HG SER 14 31.859 35.651 33.041
112 H LEU 15 H LEU 15 34.042 33.547 29.473
113 HA LEU 15 HA LEU 15 36.613 34.620 30.444
114 HB2 LEU 15 HB2 LEU 15 35.999 32.192 28.708
115 HB3 LEU 15 HB3 LEU 15 37.527 32.555 29.500
116 HG LEU 15 HG LEU 15 34.916 31.877 30.906
117 HD11 LEU 15 HD11 LEU 15 35.983 29.965 29.766
118 HD12 LEU 15 HD12 LEU 15 37.509 30.312 30.615
119 HD13 LEU 15 HD13 LEU 15 36.072 29.806 31.530
120 HD21 LEU 15 HD21 LEU 15 36.303 31.747 32.966
121 HD22 LEU 15 HD22 LEU 15 37.688 32.396 32.065
122 HD23 LEU 15 HD23 LEU 15 36.236 33.391 32.329
123 H GLY 16 H GLY 16 34.737 35.547 27.925
124 HA2 GLY 16 HA2 GLY 16 35.164 36.868 26.092
125 HA3 GLY 16 HA3 GLY 16 36.894 36.702 26.358
126 H LEU 17 H LEU 17 35.312 33.675 26.173
127 HA LEU 17 HA LEU 17 36.432 33.139 23.461
128 HB2 LEU 17 HB2 LEU 17 35.341 31.287 25.615
129 HB3 LEU 17 HB3 LEU 17 36.007 30.769 24.077
130 HG LEU 17 HG LEU 17 37.502 32.193 26.276
131 HD11 LEU 17 HD11 LEU 17 37.668 29.298 25.404
132 HD12 LEU 17 HD12 LEU 17 38.725 30.089 26.584
133 HD13 LEU 17 HD13 LEU 17 37.013 29.933 26.941
134 HD21 LEU 17 HD21 LEU 17 38.516 32.717 24.069
135 HD22 LEU 17 HD22 LEU 17 39.566 31.651 24.997
136 HD23 LEU 17 HD23 LEU 17 38.576 30.980 23.687
137 H LEU 18 H LEU 18 35.172 31.995 21.902
138 HA LEU 18 HA LEU 18 32.311 32.702 21.848
139 HB2 LEU 18 HB2 LEU 18 33.976 31.090 19.874
140 HB3 LEU 18 HB3 LEU 18 32.295 31.593 19.675
141 HG LEU 18 HG LEU 18 33.547 32.967 18.304
142 HD11 LEU 18 HD11 LEU 18 33.027 34.666 20.774
143 HD12 LEU 18 HD12 LEU 18 33.143 35.218 19.098
144 HD13 LEU 18 HD13 LEU 18 31.802 34.167 19.582
145 HD21 LEU 18 HD21 LEU 18 35.360 33.879 20.563
146 HD22 LEU 18 HD22 LEU 18 35.776 32.595 19.399
147 HD23 LEU 18 HD23 LEU 18 35.475 34.246 18.843
148 H GLY 19 H GLY 19 30.675 31.268 22.101
149 HA2 GLY 19 HA2 GLY 19 31.309 28.513 23.127
150 HA3 GLY 19 HA3 GLY 19 29.755 29.318 23.251
151 H LYS 20 H LYS 20 31.549 27.050 21.529
152 HA LYS 20 HA LYS 20 29.717 27.116 19.144
153 HB2 LYS 20 HB2 LYS 20 32.674 26.672 19.388
154 HB3 LYS 20 HB3 LYS 20 31.805 25.599 18.295
155 HG2 LYS 20 HG2 LYS 20 32.562 27.396 16.991
156 HG3 LYS 20 HG3 LYS 20 30.813 27.519 17.131
157 HD2 LYS 20 HD2 LYS 20 30.998 29.367 18.712
158 HD3 LYS 20 HD3 LYS 20 32.761 29.144 18.805
159 HE2 LYS 20 HE2 LYS 20 32.322 31.025 17.342
160 HE3 LYS 20 HE3 LYS 20 32.932 29.676 16.371
161 HZ1 LYS 20 HZ1 LYS 20 30.119 30.574 16.603
162 HZ2 LYS 20 HZ2 LYS 20 31.081 30.624 15.255
163 HZ3 LYS 20 HZ3 LYS 20 30.556 29.184 15.828
164 H CYS 21 H CYS 21 28.414 25.518 18.821
165 HA CYS 21 HA CYS 21 28.505 23.098 20.497
166 HB2 CYS 21 HB2 CYS 21 26.396 24.185 20.164
167 HB3 CYS 21 HB3 CYS 21 26.561 24.104 18.408
168 H ILE 22 H ILE 22 29.156 21.152 19.930
169 HA ILE 22 HA ILE 22 30.190 20.583 17.191
170 HB ILE 22 HB ILE 22 30.333 19.055 19.813
171 HG12 ILE 22 HG12 ILE 22 32.548 20.457 18.242
172 HG13 ILE 22 HG13 ILE 22 31.716 21.182 19.616
173 HG21 ILE 22 HG21 ILE 22 31.911 17.524 18.641
174 HG22 ILE 22 HG22 ILE 22 30.315 17.457 17.919
175 HG23 ILE 22 HG23 ILE 22 31.603 18.378 17.116
176 HD11 ILE 22 HD11 ILE 22 32.482 19.297 21.071
177 HD12 ILE 22 HD12 ILE 22 33.486 18.724 19.712
178 HD13 ILE 22 HD13 ILE 22 33.780 20.318 20.418
179 H GLY 23 H GLY 23 27.662 19.530 19.462
180 HA2 GLY 23 HA2 GLY 23 25.620 19.245 17.650
181 HA3 GLY 23 HA3 GLY 23 26.370 17.642 17.648
182 H GLU 24 H GLU 24 26.953 16.971 20.084
183 HA GLU 24 HA GLU 24 24.449 17.100 21.721
184 HB2 GLU 24 HB2 GLU 24 26.936 15.378 22.012
185 HB3 GLU 24 HB3 GLU 24 25.480 15.260 22.990
186 HG2 GLU 24 HG2 GLU 24 25.557 14.750 19.972
187 HG3 GLU 24 HG3 GLU 24 25.736 13.515 21.200
188 H GLU 25 H GLU 25 27.843 18.116 21.692
189 HA GLU 25 HA GLU 25 27.486 19.455 24.354
190 HB2 GLU 25 HB2 GLU 25 29.926 18.046 23.222
191 HB3 GLU 25 HB3 GLU 25 29.897 18.969 24.736
192 HG2 GLU 25 HG2 GLU 25 28.213 17.441 25.678
193 HG3 GLU 25 HG3 GLU 25 28.176 16.504 24.184
194 H CYS 26 H CYS 26 28.930 21.312 24.768
195 HA CYS 26 HA CYS 26 29.702 22.812 22.314
196 HB2 CYS 26 HB2 CYS 26 27.426 23.412 22.943
197 HB3 CYS 26 HB3 CYS 26 27.947 23.822 24.571
198 H LYS 27 H LYS 27 31.521 23.939 22.398
199 HA LYS 27 HA LYS 27 33.077 23.988 24.952
200 HB2 LYS 27 HB2 LYS 27 33.912 23.558 22.047
201 HB3 LYS 27 HB3 LYS 27 35.064 23.838 23.349
202 HG2 LYS 27 HG2 LYS 27 33.132 21.482 23.223
203 HG3 LYS 27 HG3 LYS 27 34.829 21.452 22.784
204 HD2 LYS 27 HD2 LYS 27 35.340 20.955 24.915
205 HD3 LYS 27 HD3 LYS 27 34.855 22.609 25.338
206 HE2 LYS 27 HE2 LYS 27 32.458 21.692 25.482
207 HE3 LYS 27 HE3 LYS 27 33.177 20.079 25.429
208 HZ1 LYS 27 HZ1 LYS 27 33.636 22.181 27.471
209 HZ2 LYS 27 HZ2 LYS 27 32.896 20.755 27.725
210 HZ3 LYS 27 HZ3 LYS 27 34.506 20.786 27.443
211 H CYS 28 H CYS 28 34.477 25.614 25.389
212 HA CYS 28 HA CYS 28 33.940 28.298 24.239
213 HB2 CYS 28 HB2 CYS 28 35.653 27.493 26.593
214 HB3 CYS 28 HB3 CYS 28 35.130 29.107 26.116
215 H VAL 29 H VAL 29 35.198 29.096 22.693
216 HA VAL 29 HA VAL 29 37.958 28.073 22.270
217 HB VAL 29 HB VAL 29 37.405 27.721 19.851
218 HG11 VAL 29 HG11 VAL 29 36.507 25.489 20.121
219 HG12 VAL 29 HG12 VAL 29 37.618 25.827 21.455
220 HG13 VAL 29 HG13 VAL 29 35.862 25.879 21.721
221 HG21 VAL 29 HG21 VAL 29 35.249 28.977 19.766
222 HG22 VAL 29 HG22 VAL 29 35.105 27.321 19.161
223 HG23 VAL 29 HG23 VAL 29 34.501 27.721 20.782
224 HA PRO 30 HA PRO 30 38.690 32.260 21.041
225 HB2 PRO 30 HB2 PRO 30 41.063 32.100 19.730
226 HB3 PRO 30 HB3 PRO 30 40.909 31.665 21.453
227 HG2 PRO 30 HG2 PRO 30 40.852 29.806 19.053
228 HG3 PRO 30 HG3 PRO 30 41.858 29.663 20.539
229 HD2 PRO 30 HD2 PRO 30 39.493 28.333 20.213
230 HD3 PRO 30 HD3 PRO 30 40.019 28.932 21.811
231 H TYR 31 H TYR 31 39.214 33.701 19.120
232 HA TYR 31 HA TYR 31 37.557 33.124 16.800
233 HB2 TYR 31 HB2 TYR 31 39.619 35.279 17.374
234 HB3 TYR 31 HB3 TYR 31 38.749 35.169 15.860
235 HD1 TYR 31 HD1 TYR 31 36.209 35.319 15.828
236 HD2 TYR 31 HD2 TYR 31 38.612 36.410 19.251
237 HE1 TYR 31 HE1 TYR 31 34.331 36.701 16.712
238 HE2 TYR 31 HE2 TYR 31 36.730 37.791 20.124
239 HH TYR 31 HH TYR 31 33.529 37.846 18.574
240 H ASN 32 H ASN 32 38.180 32.777 14.705
241 HA ASN 32 HA ASN 32 41.004 32.341 14.011
242 HB2 ASN 32 HB2 ASN 32 40.333 30.311 12.597
243 HB3 ASN 32 HB3 ASN 32 40.567 30.091 14.326
244 HD21 ASN 32 HD21 ASN 32 36.702 29.881 13.007
245 HD22 ASN 32 HD22 ASN 32 37.808 31.101 12.328
Start of MODEL 14
1 H1 ALA 1 H1 ALA 1 20.479 14.263 21.510
2 H2 ALA 1 H2 ALA 1 19.801 13.434 22.768
3 H3 ALA 1 H3 ALA 1 21.375 13.885 22.830
4 HA ALA 1 HA ALA 1 19.056 15.671 22.858
5 HB1 ALA 1 HB1 ALA 1 21.196 15.308 24.995
6 HB2 ALA 1 HB2 ALA 1 19.734 16.301 25.093
7 HB3 ALA 1 HB3 ALA 1 19.596 14.533 25.044
8 H PHE 2 H PHE 2 19.545 17.957 23.003
9 HA PHE 2 HA PHE 2 21.872 18.726 21.363
10 HB2 PHE 2 HB2 PHE 2 19.726 20.488 22.577
11 HB3 PHE 2 HB3 PHE 2 20.817 20.880 21.252
12 HD1 PHE 2 HD1 PHE 2 17.656 19.362 22.195
13 HD2 PHE 2 HD2 PHE 2 20.590 19.583 19.036
14 HE1 PHE 2 HE1 PHE 2 16.051 18.325 20.638
15 HE2 PHE 2 HE2 PHE 2 18.951 18.582 17.453
16 HZ PHE 2 HZ PHE 2 16.683 17.938 18.251
17 H CYS 3 H CYS 3 23.343 20.441 22.026
18 HA CYS 3 HA CYS 3 24.231 20.339 24.816
19 HB2 CYS 3 HB2 CYS 3 25.891 21.901 24.104
20 HB3 CYS 3 HB3 CYS 3 25.712 20.729 22.799
21 H ASN 4 H ASN 4 24.465 22.568 26.013
22 HA ASN 4 HA ASN 4 21.860 24.037 25.979
23 HB2 ASN 4 HB2 ASN 4 24.170 24.028 27.951
24 HB3 ASN 4 HB3 ASN 4 22.741 25.040 28.083
25 HD21 ASN 4 HD21 ASN 4 22.076 22.228 30.294
26 HD22 ASN 4 HD22 ASN 4 23.181 23.587 30.223
27 H LEU 5 H LEU 5 22.781 24.670 23.675
28 HA LEU 5 HA LEU 5 25.006 26.275 23.310
29 HB2 LEU 5 HB2 LEU 5 23.746 25.228 21.473
30 HB3 LEU 5 HB3 LEU 5 22.379 26.295 21.765
31 HG LEU 5 HG LEU 5 23.704 28.233 21.029
32 HD11 LEU 5 HD11 LEU 5 25.990 27.561 21.689
33 HD12 LEU 5 HD12 LEU 5 25.942 26.247 20.490
34 HD13 LEU 5 HD13 LEU 5 25.915 27.942 19.964
35 HD21 LEU 5 HD21 LEU 5 23.883 25.892 19.105
36 HD22 LEU 5 HD22 LEU 5 22.449 26.903 19.369
37 HD23 LEU 5 HD23 LEU 5 23.917 27.610 18.659
38 H ARG 6 H ARG 6 21.665 27.520 23.900
39 HA ARG 6 HA ARG 6 22.382 30.260 23.546
40 HB2 ARG 6 HB2 ARG 6 20.069 29.335 23.419
41 HB3 ARG 6 HB3 ARG 6 20.081 29.118 25.177
42 HG2 ARG 6 HG2 ARG 6 20.331 31.555 25.502
43 HG3 ARG 6 HG3 ARG 6 20.488 31.783 23.751
44 HD2 ARG 6 HD2 ARG 6 18.276 32.393 24.501
45 HD3 ARG 6 HD3 ARG 6 18.208 31.002 23.403
46 HE ARG 6 HE ARG 6 18.175 29.682 25.733
47 HH11 ARG 6 HH11 ARG 6 16.222 32.469 24.840
48 HH12 ARG 6 HH12 ARG 6 14.961 31.954 25.974
49 HH21 ARG 6 HH21 ARG 6 16.593 29.179 27.007
50 HH22 ARG 6 HH22 ARG 6 15.129 30.198 27.102
51 H ARG 7 H ARG 7 22.328 28.304 26.536
52 HA ARG 7 HA ARG 7 23.330 30.502 28.207
53 HB2 ARG 7 HB2 ARG 7 23.280 27.479 28.579
54 HB3 ARG 7 HB3 ARG 7 23.946 28.581 29.774
55 HG2 ARG 7 HG2 ARG 7 21.055 28.575 28.807
56 HG3 ARG 7 HG3 ARG 7 21.637 27.869 30.311
57 HD2 ARG 7 HD2 ARG 7 21.669 30.832 29.595
58 HD3 ARG 7 HD3 ARG 7 20.554 30.027 30.696
59 HE ARG 7 HE ARG 7 23.056 29.425 31.742
60 HH11 ARG 7 HH11 ARG 7 21.193 32.358 31.230
61 HH12 ARG 7 HH12 ARG 7 22.086 33.248 32.428
62 HH21 ARG 7 HH21 ARG 7 24.222 30.669 33.189
63 HH22 ARG 7 HH22 ARG 7 23.540 32.184 33.757
64 H CYS 8 H CYS 8 24.941 27.836 26.425
65 HA CYS 8 HA CYS 8 27.546 28.336 27.468
66 HB2 CYS 8 HB2 CYS 8 26.800 26.258 26.276
67 HB3 CYS 8 HB3 CYS 8 26.777 27.170 24.767
68 H GLU 9 H GLU 9 26.037 29.645 24.460
69 HA GLU 9 HA GLU 9 28.364 31.005 23.613
70 HB2 GLU 9 HB2 GLU 9 27.032 32.185 22.078
71 HB3 GLU 9 HB3 GLU 9 26.399 30.537 22.207
72 HG2 GLU 9 HG2 GLU 9 24.601 31.408 23.715
73 HG3 GLU 9 HG3 GLU 9 25.201 33.047 23.452
74 H LEU 10 H LEU 10 26.050 32.031 26.089
75 HA LEU 10 HA LEU 10 27.457 34.639 26.319
76 HB2 LEU 10 HB2 LEU 10 25.767 35.291 27.917
77 HB3 LEU 10 HB3 LEU 10 25.138 34.825 26.357
78 HG LEU 10 HG LEU 10 24.537 32.552 27.472
79 HD11 LEU 10 HD11 LEU 10 25.719 32.973 29.692
80 HD12 LEU 10 HD12 LEU 10 24.584 34.309 29.968
81 HD13 LEU 10 HD13 LEU 10 23.998 32.645 29.840
82 HD21 LEU 10 HD21 LEU 10 22.393 33.484 28.247
83 HD22 LEU 10 HD22 LEU 10 23.097 35.119 28.266
84 HD23 LEU 10 HD23 LEU 10 22.904 34.244 26.739
85 H SER 11 H SER 11 27.209 31.581 28.028
86 HA SER 11 HA SER 11 28.473 32.436 30.464
87 HB2 SER 11 HB2 SER 11 26.889 30.559 30.250
88 HB3 SER 11 HB3 SER 11 28.087 29.642 29.321
89 HG SER 11 HG SER 11 29.174 29.235 31.100
90 H CYS 12 H CYS 12 29.727 30.815 27.519
91 HA CYS 12 HA CYS 12 32.499 30.955 28.482
92 HB2 CYS 12 HB2 CYS 12 31.151 30.029 25.949
93 HB3 CYS 12 HB3 CYS 12 32.876 30.323 25.987
94 H ARG 13 H ARG 13 30.338 33.135 26.707
95 HA ARG 13 HA ARG 13 32.442 34.852 25.617
96 HB2 ARG 13 HB2 ARG 13 30.106 35.015 24.887
97 HB3 ARG 13 HB3 ARG 13 29.616 35.549 26.498
98 HG2 ARG 13 HG2 ARG 13 31.221 37.562 26.086
99 HG3 ARG 13 HG3 ARG 13 31.233 37.037 24.399
100 HD2 ARG 13 HD2 ARG 13 28.853 37.802 26.113
101 HD3 ARG 13 HD3 ARG 13 29.535 38.768 24.796
102 HE ARG 13 HE ARG 13 28.837 36.573 23.409
103 HH11 ARG 13 HH11 ARG 13 26.842 38.332 25.734
104 HH12 ARG 13 HH12 ARG 13 25.396 37.535 25.133
105 HH21 ARG 13 HH21 ARG 13 27.017 35.858 22.631
106 HH22 ARG 13 HH22 ARG 13 25.471 36.188 23.447
107 H SER 14 H SER 14 30.862 34.634 28.786
108 HA SER 14 HA SER 14 32.111 36.889 29.974
109 HB2 SER 14 HB2 SER 14 30.164 35.548 30.880
110 HB3 SER 14 HB3 SER 14 31.342 34.312 31.384
111 HG SER 14 HG SER 14 31.130 35.600 33.108
112 H LEU 15 H LEU 15 33.421 33.709 29.269
113 HA LEU 15 HA LEU 15 35.919 34.146 30.784
114 HB2 LEU 15 HB2 LEU 15 35.253 31.914 28.834
115 HB3 LEU 15 HB3 LEU 15 36.534 31.938 30.040
116 HG LEU 15 HG LEU 15 33.548 31.790 30.601
117 HD11 LEU 15 HD11 LEU 15 34.470 29.730 29.631
118 HD12 LEU 15 HD12 LEU 15 35.743 29.705 30.868
119 HD13 LEU 15 HD13 LEU 15 34.041 29.495 31.333
120 HD21 LEU 15 HD21 LEU 15 34.716 32.941 32.454
121 HD22 LEU 15 HD22 LEU 15 34.207 31.318 32.941
122 HD23 LEU 15 HD23 LEU 15 35.909 31.624 32.523
123 H GLY 16 H GLY 16 34.731 35.363 27.930
124 HA2 GLY 16 HA2 GLY 16 35.677 36.308 26.071
125 HA3 GLY 16 HA3 GLY 16 37.280 36.037 26.759
126 H LEU 17 H LEU 17 34.734 33.632 25.929
127 HA LEU 17 HA LEU 17 36.413 32.572 23.702
128 HB2 LEU 17 HB2 LEU 17 34.867 30.967 25.759
129 HB3 LEU 17 HB3 LEU 17 35.762 30.296 24.408
130 HG LEU 17 HG LEU 17 36.938 31.799 26.732
131 HD11 LEU 17 HD11 LEU 17 37.000 28.815 26.266
132 HD12 LEU 17 HD12 LEU 17 37.724 29.702 27.617
133 HD13 LEU 17 HD13 LEU 17 35.968 29.661 27.449
134 HD21 LEU 17 HD21 LEU 17 39.122 30.999 26.045
135 HD22 LEU 17 HD22 LEU 17 38.408 30.064 24.727
136 HD23 LEU 17 HD23 LEU 17 38.387 31.846 24.677
137 H LEU 18 H LEU 18 35.352 31.743 21.932
138 HA LEU 18 HA LEU 18 32.541 32.428 21.478
139 HB2 LEU 18 HB2 LEU 18 34.509 30.844 19.776
140 HB3 LEU 18 HB3 LEU 18 32.840 31.177 19.359
141 HG LEU 18 HG LEU 18 33.510 33.718 19.747
142 HD11 LEU 18 HD11 LEU 18 36.157 32.326 19.138
143 HD12 LEU 18 HD12 LEU 18 35.851 34.051 18.876
144 HD13 LEU 18 HD13 LEU 18 35.780 33.386 20.517
145 HD21 LEU 18 HD21 LEU 18 32.702 32.791 17.632
146 HD22 LEU 18 HD22 LEU 18 34.080 33.860 17.342
147 HD23 LEU 18 HD23 LEU 18 34.302 32.095 17.302
148 H GLY 19 H GLY 19 31.003 31.304 22.366
149 HA2 GLY 19 HA2 GLY 19 31.241 28.410 22.970
150 HA3 GLY 19 HA3 GLY 19 29.888 29.445 23.396
151 H LYS 20 H LYS 20 30.936 27.037 21.346
152 HA LYS 20 HA LYS 20 28.545 27.130 19.582
153 HB2 LYS 20 HB2 LYS 20 31.448 26.896 18.663
154 HB3 LYS 20 HB3 LYS 20 30.090 26.420 17.660
155 HG2 LYS 20 HG2 LYS 20 30.509 29.259 18.701
156 HG3 LYS 20 HG3 LYS 20 31.034 28.665 17.130
157 HD2 LYS 20 HD2 LYS 20 28.709 28.101 16.524
158 HD3 LYS 20 HD3 LYS 20 28.139 28.732 18.088
159 HE2 LYS 20 HE2 LYS 20 28.822 30.966 17.543
160 HE3 LYS 20 HE3 LYS 20 29.769 30.414 16.149
161 HZ1 LYS 20 HZ1 LYS 20 26.800 30.284 16.321
162 HZ2 LYS 20 HZ2 LYS 20 27.655 31.383 15.473
163 HZ3 LYS 20 HZ3 LYS 20 27.722 29.794 15.042
164 H CYS 21 H CYS 21 28.030 25.008 18.682
165 HA CYS 21 HA CYS 21 29.124 22.824 20.418
166 HB2 CYS 21 HB2 CYS 21 26.323 23.164 19.353
167 HB3 CYS 21 HB3 CYS 21 26.937 21.757 20.232
168 H ILE 22 H ILE 22 30.100 21.218 19.604
169 HA ILE 22 HA ILE 22 30.415 20.786 16.725
170 HB ILE 22 HB ILE 22 31.275 19.078 19.093
171 HG12 ILE 22 HG12 ILE 22 32.271 21.257 19.399
172 HG13 ILE 22 HG13 ILE 22 33.493 20.105 18.904
173 HG21 ILE 22 HG21 ILE 22 32.247 19.099 16.205
174 HG22 ILE 22 HG22 ILE 22 33.019 18.213 17.535
175 HG23 ILE 22 HG23 ILE 22 31.384 17.789 17.042
176 HD11 ILE 22 HD11 ILE 22 32.220 22.209 17.095
177 HD12 ILE 22 HD12 ILE 22 33.831 22.274 17.825
178 HD13 ILE 22 HD13 ILE 22 33.475 21.044 16.604
179 H GLY 23 H GLY 23 28.449 19.509 19.294
180 HA2 GLY 23 HA2 GLY 23 26.379 18.479 17.666
181 HA3 GLY 23 HA3 GLY 23 27.397 17.128 18.198
182 H GLU 24 H GLU 24 26.706 16.233 20.026
183 HA GLU 24 HA GLU 24 24.881 17.411 21.898
184 HB2 GLU 24 HB2 GLU 24 24.982 15.407 23.072
185 HB3 GLU 24 HB3 GLU 24 24.873 15.075 21.358
186 HG2 GLU 24 HG2 GLU 24 27.421 14.925 23.032
187 HG3 GLU 24 HG3 GLU 24 26.355 13.591 22.614
188 H GLU 25 H GLU 25 28.041 18.310 21.603
189 HA GLU 25 HA GLU 25 28.226 19.136 24.465
190 HB2 GLU 25 HB2 GLU 25 30.463 18.066 22.722
191 HB3 GLU 25 HB3 GLU 25 30.760 18.974 24.186
192 HG2 GLU 25 HG2 GLU 25 29.192 16.365 24.100
193 HG3 GLU 25 HG3 GLU 25 30.921 16.477 24.391
194 H CYS 26 H CYS 26 28.961 21.172 24.872
195 HA CYS 26 HA CYS 26 29.375 23.004 22.595
196 HB2 CYS 26 HB2 CYS 26 27.907 23.553 24.621
197 HB3 CYS 26 HB3 CYS 26 29.417 23.743 25.520
198 H LYS 27 H LYS 27 31.178 24.143 22.197
199 HA LYS 27 HA LYS 27 33.770 23.510 23.523
200 HB2 LYS 27 HB2 LYS 27 32.938 23.405 20.680
201 HB3 LYS 27 HB3 LYS 27 34.289 24.474 20.939
202 HG2 LYS 27 HG2 LYS 27 35.089 22.336 20.313
203 HG3 LYS 27 HG3 LYS 27 35.621 22.698 21.956
204 HD2 LYS 27 HD2 LYS 27 33.095 21.065 21.701
205 HD3 LYS 27 HD3 LYS 27 34.570 20.336 21.106
206 HE2 LYS 27 HE2 LYS 27 35.497 21.272 23.484
207 HE3 LYS 27 HE3 LYS 27 33.797 21.022 23.908
208 HZ1 LYS 27 HZ1 LYS 27 35.074 19.029 24.323
209 HZ2 LYS 27 HZ2 LYS 27 34.066 18.691 23.045
210 HZ3 LYS 27 HZ3 LYS 27 35.638 18.983 22.767
211 H CYS 28 H CYS 28 35.170 25.203 23.796
212 HA CYS 28 HA CYS 28 34.259 28.027 23.395
213 HB2 CYS 28 HB2 CYS 28 35.069 26.822 26.034
214 HB3 CYS 28 HB3 CYS 28 34.739 28.519 25.692
215 H VAL 29 H VAL 29 35.801 29.093 22.373
216 HA VAL 29 HA VAL 29 38.652 28.530 22.871
217 HB VAL 29 HB VAL 29 39.195 28.389 20.519
218 HG11 VAL 29 HG11 VAL 29 37.072 26.317 21.131
219 HG12 VAL 29 HG12 VAL 29 38.460 26.161 20.035
220 HG13 VAL 29 HG13 VAL 29 38.727 26.293 21.788
221 HG21 VAL 29 HG21 VAL 29 36.215 28.379 19.980
222 HG22 VAL 29 HG22 VAL 29 37.347 29.664 19.509
223 HG23 VAL 29 HG23 VAL 29 37.489 28.057 18.787
224 HA PRO 30 HA PRO 30 39.089 32.932 22.463
225 HB2 PRO 30 HB2 PRO 30 41.729 32.420 21.110
226 HB3 PRO 30 HB3 PRO 30 41.354 33.460 22.516
227 HG2 PRO 30 HG2 PRO 30 42.518 31.054 22.908
228 HG3 PRO 30 HG3 PRO 30 41.170 31.574 23.968
229 HD2 PRO 30 HD2 PRO 30 41.036 29.755 21.533
230 HD3 PRO 30 HD3 PRO 30 40.380 29.514 23.183
231 H TYR 31 H TYR 31 39.724 34.776 20.927
232 HA TYR 31 HA TYR 31 37.987 34.448 18.618
233 HB2 TYR 31 HB2 TYR 31 39.392 36.904 19.714
234 HB3 TYR 31 HB3 TYR 31 38.161 36.898 18.476
235 HD1 TYR 31 HD1 TYR 31 35.793 36.407 18.999
236 HD2 TYR 31 HD2 TYR 31 38.819 36.590 22.083
237 HE1 TYR 31 HE1 TYR 31 34.019 36.399 20.739
238 HE2 TYR 31 HE2 TYR 31 37.027 36.644 23.820
239 HH TYR 31 HH TYR 31 33.578 36.168 22.971
240 H ASN 32 H ASN 32 38.403 34.506 16.544
241 HA ASN 32 HA ASN 32 41.123 35.094 15.442
242 HB2 ASN 32 HB2 ASN 32 39.276 32.744 14.797
243 HB3 ASN 32 HB3 ASN 32 40.644 33.210 13.800
244 HD21 ASN 32 HD21 ASN 32 42.439 32.110 17.181
245 HD22 ASN 32 HD22 ASN 32 41.714 33.692 16.923
Start of MODEL 15
1 H1 ALA 1 H1 ALA 1 20.564 13.095 22.570
2 H2 ALA 1 H2 ALA 1 21.961 13.846 22.111
3 H3 ALA 1 H3 ALA 1 20.521 14.288 21.441
4 HA ALA 1 HA ALA 1 19.737 15.127 23.504
5 HB1 ALA 1 HB1 ALA 1 20.957 13.615 25.012
6 HB2 ALA 1 HB2 ALA 1 22.502 14.358 24.534
7 HB3 ALA 1 HB3 ALA 1 21.302 15.310 25.418
8 H PHE 2 H PHE 2 19.658 17.287 23.305
9 HA PHE 2 HA PHE 2 21.406 18.578 21.431
10 HB2 PHE 2 HB2 PHE 2 19.364 19.842 23.282
11 HB3 PHE 2 HB3 PHE 2 20.010 20.530 21.794
12 HD1 PHE 2 HD1 PHE 2 17.393 18.496 23.218
13 HD2 PHE 2 HD2 PHE 2 19.596 19.200 19.588
14 HE1 PHE 2 HE1 PHE 2 15.622 17.362 21.919
15 HE2 PHE 2 HE2 PHE 2 17.809 18.079 18.280
16 HZ PHE 2 HZ PHE 2 15.805 17.164 19.448
17 H CYS 3 H CYS 3 22.895 20.227 21.628
18 HA CYS 3 HA CYS 3 24.288 20.598 24.179
19 HB2 CYS 3 HB2 CYS 3 25.810 21.984 22.890
20 HB3 CYS 3 HB3 CYS 3 25.533 20.432 22.113
21 H ASN 4 H ASN 4 24.511 22.562 25.302
22 HA ASN 4 HA ASN 4 22.076 24.200 25.402
23 HB2 ASN 4 HB2 ASN 4 22.816 24.910 27.516
24 HB3 ASN 4 HB3 ASN 4 23.203 23.198 27.436
25 HD21 ASN 4 HD21 ASN 4 26.100 25.375 28.736
26 HD22 ASN 4 HD22 ASN 4 24.385 25.346 29.173
27 H LEU 5 H LEU 5 23.316 24.722 23.023
28 HA LEU 5 HA LEU 5 25.445 26.424 22.763
29 HB2 LEU 5 HB2 LEU 5 23.804 25.181 21.094
30 HB3 LEU 5 HB3 LEU 5 23.033 26.750 20.966
31 HG LEU 5 HG LEU 5 25.967 26.112 20.375
32 HD11 LEU 5 HD11 LEU 5 23.629 26.707 18.518
33 HD12 LEU 5 HD12 LEU 5 25.303 26.364 18.027
34 HD13 LEU 5 HD13 LEU 5 24.331 25.099 18.795
35 HD21 LEU 5 HD21 LEU 5 25.845 28.469 20.948
36 HD22 LEU 5 HD22 LEU 5 25.958 28.325 19.201
37 HD23 LEU 5 HD23 LEU 5 24.386 28.688 19.942
38 H ARG 6 H ARG 6 22.044 27.575 23.211
39 HA ARG 6 HA ARG 6 22.714 30.389 23.019
40 HB2 ARG 6 HB2 ARG 6 20.331 28.822 23.977
41 HB3 ARG 6 HB3 ARG 6 20.450 30.508 24.427
42 HG2 ARG 6 HG2 ARG 6 19.116 30.285 22.412
43 HG3 ARG 6 HG3 ARG 6 20.563 31.246 22.130
44 HD2 ARG 6 HD2 ARG 6 20.113 29.814 20.233
45 HD3 ARG 6 HD3 ARG 6 21.643 29.347 20.986
46 HE ARG 6 HE ARG 6 19.607 27.756 22.159
47 HH11 ARG 6 HH11 ARG 6 20.960 28.084 18.906
48 HH12 ARG 6 HH12 ARG 6 20.602 26.426 18.511
49 HH21 ARG 6 HH21 ARG 6 19.307 25.711 21.638
50 HH22 ARG 6 HH22 ARG 6 19.580 25.119 20.001
51 H ARG 7 H ARG 7 22.573 28.233 25.847
52 HA ARG 7 HA ARG 7 23.272 30.413 27.723
53 HB2 ARG 7 HB2 ARG 7 23.092 27.391 28.041
54 HB3 ARG 7 HB3 ARG 7 23.527 28.504 29.355
55 HG2 ARG 7 HG2 ARG 7 21.392 29.677 29.169
56 HG3 ARG 7 HG3 ARG 7 20.944 28.732 27.749
57 HD2 ARG 7 HD2 ARG 7 21.061 26.651 29.190
58 HD3 ARG 7 HD3 ARG 7 21.218 27.730 30.598
59 HE ARG 7 HE ARG 7 19.017 28.761 29.399
60 HH11 ARG 7 HH11 ARG 7 19.623 25.554 30.682
61 HH12 ARG 7 HH12 ARG 7 17.914 25.131 30.513
62 HH21 ARG 7 HH21 ARG 7 16.923 27.991 29.091
63 HH22 ARG 7 HH22 ARG 7 16.530 26.411 29.745
64 H CYS 8 H CYS 8 25.038 27.982 25.892
65 HA CYS 8 HA CYS 8 27.603 28.363 27.091
66 HB2 CYS 8 HB2 CYS 8 26.861 26.481 25.661
67 HB3 CYS 8 HB3 CYS 8 26.790 27.564 24.277
68 H GLU 9 H GLU 9 26.155 30.041 24.213
69 HA GLU 9 HA GLU 9 28.451 31.659 23.725
70 HB2 GLU 9 HB2 GLU 9 27.142 32.861 22.185
71 HB3 GLU 9 HB3 GLU 9 26.719 31.150 22.066
72 HG2 GLU 9 HG2 GLU 9 24.624 31.500 23.147
73 HG3 GLU 9 HG3 GLU 9 25.038 33.141 23.649
74 H LEU 10 H LEU 10 26.404 31.935 26.293
75 HA LEU 10 HA LEU 10 27.323 34.715 26.883
76 HB2 LEU 10 HB2 LEU 10 25.438 35.073 28.319
77 HB3 LEU 10 HB3 LEU 10 24.970 34.675 26.681
78 HG LEU 10 HG LEU 10 24.564 32.270 27.557
79 HD11 LEU 10 HD11 LEU 10 24.341 33.830 30.178
80 HD12 LEU 10 HD12 LEU 10 23.787 32.167 29.908
81 HD13 LEU 10 HD13 LEU 10 25.504 32.530 29.867
82 HD21 LEU 10 HD21 LEU 10 22.772 34.578 28.376
83 HD22 LEU 10 HD22 LEU 10 22.813 33.772 26.791
84 HD23 LEU 10 HD23 LEU 10 22.273 32.877 28.210
85 H SER 11 H SER 11 27.241 31.402 28.142
86 HA SER 11 HA SER 11 28.465 32.096 30.673
87 HB2 SER 11 HB2 SER 11 27.135 30.081 30.431
88 HB3 SER 11 HB3 SER 11 28.255 29.437 29.211
89 HG SER 11 HG SER 11 28.437 28.974 31.707
90 H CYS 12 H CYS 12 29.832 30.681 27.630
91 HA CYS 12 HA CYS 12 32.570 30.948 28.552
92 HB2 CYS 12 HB2 CYS 12 31.261 30.271 25.920
93 HB3 CYS 12 HB3 CYS 12 32.986 30.578 26.016
94 H ARG 13 H ARG 13 30.328 33.216 27.127
95 HA ARG 13 HA ARG 13 32.250 35.157 26.147
96 HB2 ARG 13 HB2 ARG 13 29.891 35.325 25.560
97 HB3 ARG 13 HB3 ARG 13 29.435 35.433 27.249
98 HG2 ARG 13 HG2 ARG 13 29.224 37.604 26.281
99 HG3 ARG 13 HG3 ARG 13 30.525 37.631 27.457
100 HD2 ARG 13 HD2 ARG 13 31.211 38.932 25.605
101 HD3 ARG 13 HD3 ARG 13 32.181 37.454 25.554
102 HE ARG 13 HE ARG 13 30.210 36.734 23.886
103 HH11 ARG 13 HH11 ARG 13 32.014 39.798 23.819
104 HH12 ARG 13 HH12 ARG 13 31.648 39.967 22.108
105 HH21 ARG 13 HH21 ARG 13 29.724 37.210 21.845
106 HH22 ARG 13 HH22 ARG 13 30.464 38.628 21.069
107 H SER 14 H SER 14 31.004 34.418 29.403
108 HA SER 14 HA SER 14 32.372 36.607 30.648
109 HB2 SER 14 HB2 SER 14 30.405 35.364 31.587
110 HB3 SER 14 HB3 SER 14 31.499 34.006 31.944
111 HG SER 14 HG SER 14 31.182 35.462 33.713
112 H LEU 15 H LEU 15 33.520 33.489 29.566
113 HA LEU 15 HA LEU 15 36.039 33.585 31.116
114 HB2 LEU 15 HB2 LEU 15 35.150 31.694 28.906
115 HB3 LEU 15 HB3 LEU 15 36.566 31.512 29.937
116 HG LEU 15 HG LEU 15 33.671 31.345 30.854
117 HD11 LEU 15 HD11 LEU 15 34.412 29.434 29.481
118 HD12 LEU 15 HD12 LEU 15 35.837 29.228 30.534
119 HD13 LEU 15 HD13 LEU 15 34.202 28.959 31.176
120 HD21 LEU 15 HD21 LEU 15 35.091 32.192 32.687
121 HD22 LEU 15 HD22 LEU 15 34.652 30.507 32.993
122 HD23 LEU 15 HD23 LEU 15 36.273 30.899 32.388
123 H GLY 16 H GLY 16 34.894 34.676 28.006
124 HA2 GLY 16 HA2 GLY 16 36.166 36.087 26.553
125 HA3 GLY 16 HA3 GLY 16 37.667 35.401 27.153
126 H LEU 17 H LEU 17 35.034 33.224 26.268
127 HA LEU 17 HA LEU 17 36.346 32.573 23.663
128 HB2 LEU 17 HB2 LEU 17 35.143 30.656 25.714
129 HB3 LEU 17 HB3 LEU 17 35.666 30.244 24.079
130 HG LEU 17 HG LEU 17 37.906 31.386 24.887
131 HD11 LEU 17 HD11 LEU 17 38.480 30.733 27.218
132 HD12 LEU 17 HD12 LEU 17 37.151 31.884 27.220
133 HD13 LEU 17 HD13 LEU 17 36.821 30.156 27.468
134 HD21 LEU 17 HD21 LEU 17 37.838 29.145 24.027
135 HD22 LEU 17 HD22 LEU 17 38.811 29.162 25.490
136 HD23 LEU 17 HD23 LEU 17 37.157 28.526 25.557
137 H LEU 18 H LEU 18 35.066 31.937 21.971
138 HA LEU 18 HA LEU 18 32.264 32.812 21.902
139 HB2 LEU 18 HB2 LEU 18 34.201 31.595 19.910
140 HB3 LEU 18 HB3 LEU 18 32.500 31.743 19.552
141 HG LEU 18 HG LEU 18 34.284 34.106 20.254
142 HD11 LEU 18 HD11 LEU 18 34.907 33.023 18.119
143 HD12 LEU 18 HD12 LEU 18 33.219 33.100 17.579
144 HD13 LEU 18 HD13 LEU 18 34.142 34.594 17.827
145 HD21 LEU 18 HD21 LEU 18 31.928 34.623 20.719
146 HD22 LEU 18 HD22 LEU 18 32.364 35.390 19.195
147 HD23 LEU 18 HD23 LEU 18 31.414 33.892 19.180
148 H GLY 19 H GLY 19 30.495 31.558 21.939
149 HA2 GLY 19 HA2 GLY 19 30.644 28.705 22.616
150 HA3 GLY 19 HA3 GLY 19 29.182 29.668 22.389
151 H LYS 20 H LYS 20 30.613 27.082 21.268
152 HA LYS 20 HA LYS 20 29.556 27.253 18.477
153 HB2 LYS 20 HB2 LYS 20 32.221 27.610 18.968
154 HB3 LYS 20 HB3 LYS 20 32.180 25.853 18.957
155 HG2 LYS 20 HG2 LYS 20 32.610 26.306 16.712
156 HG3 LYS 20 HG3 LYS 20 30.845 26.200 16.675
157 HD2 LYS 20 HD2 LYS 20 31.347 28.190 15.483
158 HD3 LYS 20 HD3 LYS 20 30.895 28.751 17.112
159 HE2 LYS 20 HE2 LYS 20 33.339 28.808 17.714
160 HE3 LYS 20 HE3 LYS 20 33.738 28.326 16.058
161 HZ1 LYS 20 HZ1 LYS 20 32.766 30.383 15.276
162 HZ2 LYS 20 HZ2 LYS 20 32.293 30.814 16.784
163 HZ3 LYS 20 HZ3 LYS 20 33.908 30.719 16.410
164 H CYS 21 H CYS 21 28.765 25.242 17.638
165 HA CYS 21 HA CYS 21 29.172 22.829 19.326
166 HB2 CYS 21 HB2 CYS 21 27.261 23.907 20.334
167 HB3 CYS 21 HB3 CYS 21 26.478 24.079 18.762
168 H ILE 22 H ILE 22 29.117 20.961 18.364
169 HA ILE 22 HA ILE 22 27.907 20.682 15.646
170 HB ILE 22 HB ILE 22 30.361 20.923 15.482
171 HG12 ILE 22 HG12 ILE 22 29.414 18.152 14.649
172 HG13 ILE 22 HG13 ILE 22 28.938 19.655 13.840
173 HG21 ILE 22 HG21 ILE 22 31.889 19.171 16.209
174 HG22 ILE 22 HG22 ILE 22 31.035 19.808 17.602
175 HG23 ILE 22 HG23 ILE 22 30.559 18.234 16.911
176 HD11 ILE 22 HD11 ILE 22 31.357 20.141 13.387
177 HD12 ILE 22 HD12 ILE 22 31.767 18.537 14.041
178 HD13 ILE 22 HD13 ILE 22 30.753 18.674 12.599
179 H GLY 23 H GLY 23 28.620 19.216 18.758
180 HA2 GLY 23 HA2 GLY 23 26.833 16.881 18.122
181 HA3 GLY 23 HA3 GLY 23 28.360 16.723 18.977
182 H GLU 24 H GLU 24 27.489 15.875 20.819
183 HA GLU 24 HA GLU 24 25.079 16.822 22.055
184 HB2 GLU 24 HB2 GLU 24 27.178 14.976 23.205
185 HB3 GLU 24 HB3 GLU 24 25.465 15.029 23.641
186 HG2 GLU 24 HG2 GLU 24 26.491 14.159 20.876
187 HG3 GLU 24 HG3 GLU 24 26.305 13.079 22.221
188 H GLU 25 H GLU 25 28.025 18.321 22.220
189 HA GLU 25 HA GLU 25 27.546 19.633 24.835
190 HB2 GLU 25 HB2 GLU 25 28.825 17.653 25.449
191 HB3 GLU 25 HB3 GLU 25 30.000 17.968 24.187
192 HG2 GLU 25 HG2 GLU 25 30.612 20.119 25.405
193 HG3 GLU 25 HG3 GLU 25 29.542 19.591 26.720
194 H CYS 26 H CYS 26 27.941 21.744 24.590
195 HA CYS 26 HA CYS 26 28.964 22.935 22.223
196 HB2 CYS 26 HB2 CYS 26 27.329 23.944 23.814
197 HB3 CYS 26 HB3 CYS 26 28.625 24.135 24.991
198 H LYS 27 H LYS 27 30.925 23.560 21.558
199 HA LYS 27 HA LYS 27 33.357 23.338 23.291
200 HB2 LYS 27 HB2 LYS 27 32.811 23.438 20.323
201 HB3 LYS 27 HB3 LYS 27 34.304 24.149 20.902
202 HG2 LYS 27 HG2 LYS 27 34.707 21.917 20.186
203 HG3 LYS 27 HG3 LYS 27 35.035 22.056 21.903
204 HD2 LYS 27 HD2 LYS 27 32.370 20.959 20.929
205 HD3 LYS 27 HD3 LYS 27 33.826 19.959 20.911
206 HE2 LYS 27 HE2 LYS 27 34.165 20.429 23.350
207 HE3 LYS 27 HE3 LYS 27 32.601 21.257 23.377
208 HZ1 LYS 27 HZ1 LYS 27 33.027 18.421 22.608
209 HZ2 LYS 27 HZ2 LYS 27 32.439 18.904 24.046
210 HZ3 LYS 27 HZ3 LYS 27 31.571 19.182 22.654
211 H CYS 28 H CYS 28 34.825 25.034 23.468
212 HA CYS 28 HA CYS 28 33.867 27.816 22.960
213 HB2 CYS 28 HB2 CYS 28 34.874 26.767 25.593
214 HB3 CYS 28 HB3 CYS 28 34.732 28.472 25.158
215 H VAL 29 H VAL 29 35.143 28.951 21.855
216 HA VAL 29 HA VAL 29 38.051 28.311 21.593
217 HB VAL 29 HB VAL 29 37.695 28.470 19.085
218 HG11 VAL 29 HG11 VAL 29 38.100 26.321 20.249
219 HG12 VAL 29 HG12 VAL 29 36.346 26.096 20.427
220 HG13 VAL 29 HG13 VAL 29 37.080 26.146 18.814
221 HG21 VAL 29 HG21 VAL 29 35.391 29.455 19.136
222 HG22 VAL 29 HG22 VAL 29 35.544 28.007 18.126
223 HG23 VAL 29 HG23 VAL 29 34.770 27.896 19.717
224 HA PRO 30 HA PRO 30 38.587 32.685 21.294
225 HB2 PRO 30 HB2 PRO 30 40.761 33.026 19.652
226 HB3 PRO 30 HB3 PRO 30 40.851 32.314 21.289
227 HG2 PRO 30 HG2 PRO 30 40.663 30.852 18.638
228 HG3 PRO 30 HG3 PRO 30 41.828 30.568 19.968
229 HD2 PRO 30 HD2 PRO 30 39.605 29.068 19.690
230 HD3 PRO 30 HD3 PRO 30 40.155 29.547 21.310
231 H TYR 31 H TYR 31 38.446 34.598 20.048
232 HA TYR 31 HA TYR 31 36.514 34.589 17.921
233 HB2 TYR 31 HB2 TYR 31 38.283 36.803 19.016
234 HB3 TYR 31 HB3 TYR 31 36.913 37.045 17.947
235 HD1 TYR 31 HD1 TYR 31 34.624 36.965 18.758
236 HD2 TYR 31 HD2 TYR 31 37.937 36.183 21.409
237 HE1 TYR 31 HE1 TYR 31 33.101 37.126 20.725
238 HE2 TYR 31 HE2 TYR 31 36.405 36.304 23.361
239 HH TYR 31 HH TYR 31 34.235 37.137 24.008
240 H ASN 32 H ASN 32 36.686 35.321 15.760
241 HA ASN 32 HA ASN 32 39.169 34.881 14.341
242 HB2 ASN 32 HB2 ASN 32 37.908 35.842 12.375
243 HB3 ASN 32 HB3 ASN 32 37.229 34.412 13.100
244 HD21 ASN 32 HD21 ASN 32 35.081 37.768 14.043
245 HD22 ASN 32 HD22 ASN 32 36.834 37.716 14.328
Start of MODEL 16
1 H1 ALA 1 H1 ALA 1 19.213 13.968 24.821
2 H2 ALA 1 H2 ALA 1 20.632 14.793 24.961
3 H3 ALA 1 H3 ALA 1 20.052 14.443 23.473
4 HA ALA 1 HA ALA 1 18.078 15.800 23.952
5 HB1 ALA 1 HB1 ALA 1 19.757 16.670 26.353
6 HB2 ALA 1 HB2 ALA 1 18.204 17.374 25.851
7 HB3 ALA 1 HB3 ALA 1 18.268 15.702 26.424
8 H PHE 2 H PHE 2 18.177 18.283 23.594
9 HA PHE 2 HA PHE 2 20.047 18.801 21.535
10 HB2 PHE 2 HB2 PHE 2 18.504 20.911 23.063
11 HB3 PHE 2 HB3 PHE 2 19.104 21.001 21.420
12 HD1 PHE 2 HD1 PHE 2 16.364 19.972 23.568
13 HD2 PHE 2 HD2 PHE 2 18.068 19.489 19.631
14 HE1 PHE 2 HE1 PHE 2 14.218 19.040 22.746
15 HE2 PHE 2 HE2 PHE 2 15.895 18.610 18.806
16 HZ PHE 2 HZ PHE 2 13.966 18.396 20.365
17 H CYS 3 H CYS 3 21.840 20.224 21.354
18 HA CYS 3 HA CYS 3 23.487 20.556 23.712
19 HB2 CYS 3 HB2 CYS 3 25.028 21.737 22.266
20 HB3 CYS 3 HB3 CYS 3 24.524 20.199 21.585
21 H ASN 4 H ASN 4 23.895 22.302 24.948
22 HA ASN 4 HA ASN 4 21.802 24.295 25.195
23 HB2 ASN 4 HB2 ASN 4 22.914 24.800 27.305
24 HB3 ASN 4 HB3 ASN 4 22.565 23.088 27.138
25 HD21 ASN 4 HD21 ASN 4 25.879 23.151 28.591
26 HD22 ASN 4 HD22 ASN 4 24.245 23.684 29.042
27 H LEU 5 H LEU 5 22.879 24.913 22.823
28 HA LEU 5 HA LEU 5 25.303 26.344 22.837
29 HB2 LEU 5 HB2 LEU 5 24.229 25.281 20.896
30 HB3 LEU 5 HB3 LEU 5 22.990 26.528 20.869
31 HG LEU 5 HG LEU 5 24.872 26.634 19.171
32 HD11 LEU 5 HD11 LEU 5 24.514 29.184 20.785
33 HD12 LEU 5 HD12 LEU 5 25.013 29.028 19.096
34 HD13 LEU 5 HD13 LEU 5 23.381 28.548 19.575
35 HD21 LEU 5 HD21 LEU 5 26.755 26.190 20.751
36 HD22 LEU 5 HD22 LEU 5 26.983 27.630 19.740
37 HD23 LEU 5 HD23 LEU 5 26.526 27.812 21.438
38 H ARG 6 H ARG 6 21.979 27.690 23.134
39 HA ARG 6 HA ARG 6 22.766 30.431 23.076
40 HB2 ARG 6 HB2 ARG 6 20.452 29.462 22.761
41 HB3 ARG 6 HB3 ARG 6 20.370 29.229 24.512
42 HG2 ARG 6 HG2 ARG 6 20.627 31.707 24.830
43 HG3 ARG 6 HG3 ARG 6 20.718 31.886 23.070
44 HD2 ARG 6 HD2 ARG 6 18.467 32.385 23.678
45 HD3 ARG 6 HD3 ARG 6 18.454 30.827 22.883
46 HE ARG 6 HE ARG 6 18.031 29.716 24.928
47 HH11 ARG 6 HH11 ARG 6 17.990 33.238 25.423
48 HH12 ARG 6 HH12 ARG 6 17.044 33.040 26.886
49 HH21 ARG 6 HH21 ARG 6 17.117 29.643 26.943
50 HH22 ARG 6 HH22 ARG 6 16.602 31.133 27.706
51 H ARG 7 H ARG 7 22.469 28.221 25.841
52 HA ARG 7 HA ARG 7 23.424 30.143 27.838
53 HB2 ARG 7 HB2 ARG 7 23.230 27.110 27.766
54 HB3 ARG 7 HB3 ARG 7 23.855 28.006 29.158
55 HG2 ARG 7 HG2 ARG 7 21.756 29.167 29.472
56 HG3 ARG 7 HG3 ARG 7 21.075 28.474 27.989
57 HD2 ARG 7 HD2 ARG 7 21.202 26.232 28.900
58 HD3 ARG 7 HD3 ARG 7 22.018 26.816 30.366
59 HE ARG 7 HE ARG 7 19.712 28.267 30.417
60 HH11 ARG 7 HH11 ARG 7 20.211 24.793 30.103
61 HH12 ARG 7 HH12 ARG 7 18.605 24.481 30.765
62 HH21 ARG 7 HH21 ARG 7 17.756 27.657 31.404
63 HH22 ARG 7 HH22 ARG 7 17.357 25.946 31.419
64 H CYS 8 H CYS 8 25.086 27.657 25.876
65 HA CYS 8 HA CYS 8 27.653 27.954 27.101
66 HB2 CYS 8 HB2 CYS 8 26.938 26.048 25.661
67 HB3 CYS 8 HB3 CYS 8 26.896 27.125 24.269
68 H GLU 9 H GLU 9 26.283 29.693 24.272
69 HA GLU 9 HA GLU 9 28.619 31.221 23.740
70 HB2 GLU 9 HB2 GLU 9 25.673 31.912 23.398
71 HB3 GLU 9 HB3 GLU 9 26.978 33.013 22.951
72 HG2 GLU 9 HG2 GLU 9 27.974 31.112 21.570
73 HG3 GLU 9 HG3 GLU 9 26.435 30.263 21.780
74 H LEU 10 H LEU 10 26.115 31.844 26.278
75 HA LEU 10 HA LEU 10 27.449 34.388 26.960
76 HB2 LEU 10 HB2 LEU 10 25.669 34.914 28.364
77 HB3 LEU 10 HB3 LEU 10 25.019 34.261 26.878
78 HG LEU 10 HG LEU 10 24.767 32.033 28.254
79 HD11 LEU 10 HD11 LEU 10 24.216 32.443 30.648
80 HD12 LEU 10 HD12 LEU 10 25.925 32.702 30.343
81 HD13 LEU 10 HD13 LEU 10 24.836 34.097 30.502
82 HD21 LEU 10 HD21 LEU 10 23.016 34.451 28.744
83 HD22 LEU 10 HD22 LEU 10 22.911 33.302 27.381
84 HD23 LEU 10 HD23 LEU 10 22.546 32.760 29.022
85 H SER 11 H SER 11 27.358 31.135 28.148
86 HA SER 11 HA SER 11 28.644 31.518 30.706
87 HB2 SER 11 HB2 SER 11 27.409 29.510 30.375
88 HB3 SER 11 HB3 SER 11 28.208 29.187 28.833
89 HG SER 11 HG SER 11 29.475 29.095 31.389
90 H CYS 12 H CYS 12 29.886 30.455 27.479
91 HA CYS 12 HA CYS 12 32.657 30.586 28.342
92 HB2 CYS 12 HB2 CYS 12 31.363 30.433 25.597
93 HB3 CYS 12 HB3 CYS 12 33.103 30.346 25.901
94 H ARG 13 H ARG 13 30.395 32.933 26.950
95 HA ARG 13 HA ARG 13 32.450 34.903 26.321
96 HB2 ARG 13 HB2 ARG 13 30.327 35.036 25.227
97 HB3 ARG 13 HB3 ARG 13 29.482 35.252 26.777
98 HG2 ARG 13 HG2 ARG 13 30.360 37.436 27.061
99 HG3 ARG 13 HG3 ARG 13 31.607 37.197 25.833
100 HD2 ARG 13 HD2 ARG 13 29.731 38.704 25.120
101 HD3 ARG 13 HD3 ARG 13 30.088 37.359 24.053
102 HE ARG 13 HE ARG 13 27.950 36.713 24.212
103 HH11 ARG 13 HH11 ARG 13 28.464 38.508 27.213
104 HH12 ARG 13 HH12 ARG 13 26.876 38.013 27.805
105 HH21 ARG 13 HH21 ARG 13 25.846 36.467 25.013
106 HH22 ARG 13 HH22 ARG 13 25.537 36.988 26.651
107 H SER 14 H SER 14 31.138 33.881 29.383
108 HA SER 14 HA SER 14 31.864 36.251 30.837
109 HB2 SER 14 HB2 SER 14 30.436 34.524 31.818
110 HB3 SER 14 HB3 SER 14 31.786 33.365 31.749
111 HG SER 14 HG SER 14 31.604 35.748 33.288
112 H LEU 15 H LEU 15 33.787 33.734 29.386
113 HA LEU 15 HA LEU 15 36.317 34.822 30.489
114 HB2 LEU 15 HB2 LEU 15 35.819 32.357 28.796
115 HB3 LEU 15 HB3 LEU 15 37.344 32.811 29.569
116 HG LEU 15 HG LEU 15 34.814 32.013 31.063
117 HD11 LEU 15 HD11 LEU 15 35.784 30.141 29.781
118 HD12 LEU 15 HD12 LEU 15 37.364 30.444 30.538
119 HD13 LEU 15 HD13 LEU 15 35.983 29.917 31.526
120 HD21 LEU 15 HD21 LEU 15 36.303 33.497 32.366
121 HD22 LEU 15 HD22 LEU 15 36.298 31.848 33.016
122 HD23 LEU 15 HD23 LEU 15 37.667 32.419 32.033
123 H GLY 16 H GLY 16 34.292 35.641 28.098
124 HA2 GLY 16 HA2 GLY 16 34.512 36.849 26.138
125 HA3 GLY 16 HA3 GLY 16 36.258 36.591 26.159
126 H LEU 17 H LEU 17 35.886 33.570 26.355
127 HA LEU 17 HA LEU 17 36.344 32.934 23.710
128 HB2 LEU 17 HB2 LEU 17 35.491 31.305 26.127
129 HB3 LEU 17 HB3 LEU 17 35.745 30.554 24.563
130 HG LEU 17 HG LEU 17 38.040 31.299 24.473
131 HD11 LEU 17 HD11 LEU 17 37.678 32.413 27.262
132 HD12 LEU 17 HD12 LEU 17 39.230 32.148 26.455
133 HD13 LEU 17 HD13 LEU 17 38.111 33.330 25.795
134 HD21 LEU 17 HD21 LEU 17 37.452 29.116 25.509
135 HD22 LEU 17 HD22 LEU 17 38.919 29.800 26.218
136 HD23 LEU 17 HD23 LEU 17 37.377 29.897 27.099
137 H LEU 18 H LEU 18 35.294 32.098 22.009
138 HA LEU 18 HA LEU 18 32.474 32.716 21.716
139 HB2 LEU 18 HB2 LEU 18 34.279 33.183 20.018
140 HB3 LEU 18 HB3 LEU 18 34.423 31.442 19.773
141 HG LEU 18 HG LEU 18 31.971 31.414 19.085
142 HD11 LEU 18 HD11 LEU 18 32.377 34.439 19.126
143 HD12 LEU 18 HD12 LEU 18 31.012 33.601 18.364
144 HD13 LEU 18 HD13 LEU 18 31.214 33.523 20.114
145 HD21 LEU 18 HD21 LEU 18 33.777 31.404 17.412
146 HD22 LEU 18 HD22 LEU 18 32.395 32.357 16.846
147 HD23 LEU 18 HD23 LEU 18 33.842 33.178 17.453
148 H GLY 19 H GLY 19 30.818 31.326 22.066
149 HA2 GLY 19 HA2 GLY 19 31.303 28.482 22.578
150 HA3 GLY 19 HA3 GLY 19 29.760 29.315 22.688
151 H LYS 20 H LYS 20 30.969 26.775 21.311
152 HA LYS 20 HA LYS 20 29.202 26.908 18.925
153 HB2 LYS 20 HB2 LYS 20 32.094 25.962 18.816
154 HB3 LYS 20 HB3 LYS 20 30.911 25.667 17.558
155 HG2 LYS 20 HG2 LYS 20 31.836 28.442 18.411
156 HG3 LYS 20 HG3 LYS 20 32.469 27.532 17.043
157 HD2 LYS 20 HD2 LYS 20 30.286 27.557 15.926
158 HD3 LYS 20 HD3 LYS 20 29.557 28.357 17.321
159 HE2 LYS 20 HE2 LYS 20 31.256 30.253 16.971
160 HE3 LYS 20 HE3 LYS 20 31.649 29.495 15.417
161 HZ1 LYS 20 HZ1 LYS 20 29.936 31.183 15.124
162 HZ2 LYS 20 HZ2 LYS 20 29.270 29.723 14.835
163 HZ3 LYS 20 HZ3 LYS 20 28.994 30.504 16.275
164 H CYS 21 H CYS 21 28.011 25.221 18.629
165 HA CYS 21 HA CYS 21 28.255 22.842 20.377
166 HB2 CYS 21 HB2 CYS 21 26.124 23.757 20.402
167 HB3 CYS 21 HB3 CYS 21 26.081 24.046 18.668
168 H ILE 22 H ILE 22 28.650 20.847 19.722
169 HA ILE 22 HA ILE 22 29.138 20.170 16.846
170 HB ILE 22 HB ILE 22 30.974 19.599 19.208
171 HG12 ILE 22 HG12 ILE 22 31.457 21.243 16.685
172 HG13 ILE 22 HG13 ILE 22 31.194 21.904 18.301
173 HG21 ILE 22 HG21 ILE 22 31.248 18.686 16.309
174 HG22 ILE 22 HG22 ILE 22 32.445 18.432 17.598
175 HG23 ILE 22 HG23 ILE 22 30.897 17.639 17.704
176 HD11 ILE 22 HD11 ILE 22 33.274 20.699 19.069
177 HD12 ILE 22 HD12 ILE 22 33.608 20.345 17.356
178 HD13 ILE 22 HD13 ILE 22 33.518 22.020 17.907
179 H GLY 23 H GLY 23 28.348 19.046 20.142
180 HA2 GLY 23 HA2 GLY 23 26.833 16.745 19.269
181 HA3 GLY 23 HA3 GLY 23 28.449 16.283 19.835
182 H GLU 24 H GLU 24 28.279 15.516 21.899
183 HA GLU 24 HA GLU 24 26.086 16.441 23.620
184 HB2 GLU 24 HB2 GLU 24 26.656 14.726 25.129
185 HB3 GLU 24 HB3 GLU 24 26.412 14.128 23.498
186 HG2 GLU 24 HG2 GLU 24 29.203 14.673 24.556
187 HG3 GLU 24 HG3 GLU 24 28.310 13.216 24.950
188 H GLU 25 H GLU 25 29.305 17.511 23.273
189 HA GLU 25 HA GLU 25 29.093 19.113 25.788
190 HB2 GLU 25 HB2 GLU 25 30.722 17.274 26.105
191 HB3 GLU 25 HB3 GLU 25 31.575 17.792 24.634
192 HG2 GLU 25 HG2 GLU 25 32.053 19.986 25.720
193 HG3 GLU 25 HG3 GLU 25 31.286 19.404 27.190
194 H CYS 26 H CYS 26 29.307 21.294 25.461
195 HA CYS 26 HA CYS 26 29.718 22.337 22.783
196 HB2 CYS 26 HB2 CYS 26 28.115 23.246 24.483
197 HB3 CYS 26 HB3 CYS 26 29.495 23.794 25.428
198 H LYS 27 H LYS 27 31.475 23.454 21.919
199 HA LYS 27 HA LYS 27 34.052 23.383 23.481
200 HB2 LYS 27 HB2 LYS 27 33.414 23.052 20.553
201 HB3 LYS 27 HB3 LYS 27 34.912 23.852 20.994
202 HG2 LYS 27 HG2 LYS 27 35.346 21.549 20.593
203 HG3 LYS 27 HG3 LYS 27 35.676 21.921 22.276
204 HD2 LYS 27 HD2 LYS 27 32.964 20.806 21.560
205 HD3 LYS 27 HD3 LYS 27 34.335 19.721 21.449
206 HE2 LYS 27 HE2 LYS 27 33.640 21.275 23.977
207 HE3 LYS 27 HE3 LYS 27 33.076 19.643 23.610
208 HZ1 LYS 27 HZ1 LYS 27 35.553 19.127 23.338
209 HZ2 LYS 27 HZ2 LYS 27 35.845 20.485 24.200
210 HZ3 LYS 27 HZ3 LYS 27 34.944 19.274 24.858
211 H CYS 28 H CYS 28 35.274 25.142 23.757
212 HA CYS 28 HA CYS 28 34.313 27.750 22.691
213 HB2 CYS 28 HB2 CYS 28 34.719 27.042 25.607
214 HB3 CYS 28 HB3 CYS 28 34.571 28.696 24.997
215 H VAL 29 H VAL 29 35.831 29.062 21.990
216 HA VAL 29 HA VAL 29 38.610 28.977 22.973
217 HB VAL 29 HB VAL 29 39.542 28.773 20.696
218 HG11 VAL 29 HG11 VAL 29 37.916 26.309 21.369
219 HG12 VAL 29 HG12 VAL 29 39.422 26.404 20.441
220 HG13 VAL 29 HG13 VAL 29 39.434 26.779 22.175
221 HG21 VAL 29 HG21 VAL 29 36.764 27.924 19.826
222 HG22 VAL 29 HG22 VAL 29 37.584 29.439 19.380
223 HG23 VAL 29 HG23 VAL 29 38.241 27.884 18.844
224 HA PRO 30 HA PRO 30 38.139 33.250 22.285
225 HB2 PRO 30 HB2 PRO 30 40.672 34.242 22.158
226 HB3 PRO 30 HB3 PRO 30 39.989 33.468 23.617
227 HG2 PRO 30 HG2 PRO 30 41.758 32.214 21.496
228 HG3 PRO 30 HG3 PRO 30 41.949 32.143 23.279
229 HD2 PRO 30 HD2 PRO 30 40.757 30.142 21.862
230 HD3 PRO 30 HD3 PRO 30 40.191 30.596 23.497
231 H TYR 31 H TYR 31 37.478 34.515 20.734
232 HA TYR 31 HA TYR 31 38.880 34.765 18.101
233 HB2 TYR 31 HB2 TYR 31 35.943 34.489 18.764
234 HB3 TYR 31 HB3 TYR 31 36.419 35.409 17.367
235 HD1 TYR 31 HD1 TYR 31 37.278 34.430 15.361
236 HD2 TYR 31 HD2 TYR 31 36.512 32.008 18.852
237 HE1 TYR 31 HE1 TYR 31 37.472 32.390 13.983
238 HE2 TYR 31 HE2 TYR 31 36.685 29.960 17.450
239 HH TYR 31 HH TYR 31 37.333 30.129 13.914
240 H ASN 32 H ASN 32 37.958 36.857 16.970
241 HA ASN 32 HA ASN 32 38.951 39.066 18.581
242 HB2 ASN 32 HB2 ASN 32 39.115 40.232 16.528
243 HB3 ASN 32 HB3 ASN 32 39.613 38.584 16.181
244 HD21 ASN 32 HD21 ASN 32 36.797 40.188 13.933
245 HD22 ASN 32 HD22 ASN 32 37.849 41.109 15.013
Start of MODEL 17
1 H1 ALA 1 H1 ALA 1 22.311 13.891 21.353
2 H2 ALA 1 H2 ALA 1 20.912 13.986 20.478
3 H3 ALA 1 H3 ALA 1 21.009 12.970 21.776
4 HA ALA 1 HA ALA 1 19.722 14.883 22.309
5 HB1 ALA 1 HB1 ALA 1 20.946 15.593 24.336
6 HB2 ALA 1 HB2 ALA 1 21.046 13.836 24.114
7 HB3 ALA 1 HB3 ALA 1 22.437 14.873 23.699
8 H PHE 2 H PHE 2 19.464 17.116 22.437
9 HA PHE 2 HA PHE 2 21.069 18.819 20.683
10 HB2 PHE 2 HB2 PHE 2 18.958 19.571 22.739
11 HB3 PHE 2 HB3 PHE 2 19.543 20.576 21.408
12 HD1 PHE 2 HD1 PHE 2 19.195 19.630 18.974
13 HD2 PHE 2 HD2 PHE 2 17.086 18.182 22.437
14 HE1 PHE 2 HE1 PHE 2 17.502 18.566 17.511
15 HE2 PHE 2 HE2 PHE 2 15.443 17.090 20.977
16 HZ PHE 2 HZ PHE 2 15.615 17.284 18.495
17 H CYS 3 H CYS 3 22.149 20.800 21.387
18 HA CYS 3 HA CYS 3 23.568 20.488 24.009
19 HB2 CYS 3 HB2 CYS 3 25.341 21.801 22.996
20 HB3 CYS 3 HB3 CYS 3 24.976 20.361 22.055
21 H ASN 4 H ASN 4 24.184 22.518 25.092
22 HA ASN 4 HA ASN 4 21.887 24.398 25.266
23 HB2 ASN 4 HB2 ASN 4 24.249 23.841 27.119
24 HB3 ASN 4 HB3 ASN 4 22.994 25.037 27.416
25 HD21 ASN 4 HD21 ASN 4 20.553 22.754 28.466
26 HD22 ASN 4 HD22 ASN 4 20.758 24.309 27.652
27 H LEU 5 H LEU 5 23.022 25.021 22.940
28 HA LEU 5 HA LEU 5 25.451 26.453 22.912
29 HB2 LEU 5 HB2 LEU 5 24.366 25.537 20.908
30 HB3 LEU 5 HB3 LEU 5 23.046 26.699 21.078
31 HG LEU 5 HG LEU 5 24.569 28.574 20.644
32 HD11 LEU 5 HD11 LEU 5 26.704 27.734 21.470
33 HD12 LEU 5 HD12 LEU 5 26.704 26.439 20.250
34 HD13 LEU 5 HD13 LEU 5 26.853 28.139 19.763
35 HD21 LEU 5 HD21 LEU 5 24.780 26.376 18.554
36 HD22 LEU 5 HD22 LEU 5 23.396 27.472 18.782
37 HD23 LEU 5 HD23 LEU 5 24.964 28.126 18.279
38 H ARG 6 H ARG 6 22.140 27.764 23.513
39 HA ARG 6 HA ARG 6 22.951 30.519 23.409
40 HB2 ARG 6 HB2 ARG 6 20.808 31.045 24.263
41 HB3 ARG 6 HB3 ARG 6 20.656 29.691 23.154
42 HG2 ARG 6 HG2 ARG 6 20.655 28.171 25.282
43 HG3 ARG 6 HG3 ARG 6 20.456 29.674 26.187
44 HD2 ARG 6 HD2 ARG 6 18.270 28.797 25.815
45 HD3 ARG 6 HD3 ARG 6 18.475 30.214 24.765
46 HE ARG 6 HE ARG 6 19.179 27.889 23.271
47 HH11 ARG 6 HH11 ARG 6 16.304 29.284 24.695
48 HH12 ARG 6 HH12 ARG 6 15.230 28.446 23.604
49 HH21 ARG 6 HH21 ARG 6 17.846 27.224 21.664
50 HH22 ARG 6 HH22 ARG 6 16.115 27.446 21.771
51 H ARG 7 H ARG 7 22.885 28.283 26.098
52 HA ARG 7 HA ARG 7 23.681 30.218 28.150
53 HB2 ARG 7 HB2 ARG 7 22.284 28.134 28.511
54 HB3 ARG 7 HB3 ARG 7 23.736 27.171 28.206
55 HG2 ARG 7 HG2 ARG 7 24.860 28.349 30.129
56 HG3 ARG 7 HG3 ARG 7 23.346 29.197 30.463
57 HD2 ARG 7 HD2 ARG 7 23.724 26.175 30.436
58 HD3 ARG 7 HD3 ARG 7 23.701 27.171 31.895
59 HE ARG 7 HE ARG 7 21.344 27.885 31.058
60 HH11 ARG 7 HH11 ARG 7 22.533 24.574 30.647
61 HH12 ARG 7 HH12 ARG 7 20.908 23.931 30.586
62 HH21 ARG 7 HH21 ARG 7 19.381 26.976 31.154
63 HH22 ARG 7 HH22 ARG 7 19.176 25.262 31.028
64 H CYS 8 H CYS 8 25.306 27.735 26.195
65 HA CYS 8 HA CYS 8 27.971 28.023 27.175
66 HB2 CYS 8 HB2 CYS 8 27.087 26.224 25.751
67 HB3 CYS 8 HB3 CYS 8 26.808 27.372 24.453
68 H GLU 9 H GLU 9 26.332 29.730 24.462
69 HA GLU 9 HA GLU 9 28.474 31.440 23.770
70 HB2 GLU 9 HB2 GLU 9 25.479 31.374 23.307
71 HB3 GLU 9 HB3 GLU 9 26.325 32.826 22.857
72 HG2 GLU 9 HG2 GLU 9 27.323 30.159 21.863
73 HG3 GLU 9 HG3 GLU 9 25.996 31.030 21.091
74 H LEU 10 H LEU 10 26.323 31.745 26.460
75 HA LEU 10 HA LEU 10 27.233 34.569 26.867
76 HB2 LEU 10 HB2 LEU 10 25.506 34.995 28.336
77 HB3 LEU 10 HB3 LEU 10 24.820 34.148 26.976
78 HG LEU 10 HG LEU 10 25.021 32.035 28.570
79 HD11 LEU 10 HD11 LEU 10 24.791 34.327 30.575
80 HD12 LEU 10 HD12 LEU 10 24.573 32.604 30.931
81 HD13 LEU 10 HD13 LEU 10 26.161 33.211 30.473
82 HD21 LEU 10 HD21 LEU 10 22.922 32.937 27.682
83 HD22 LEU 10 HD22 LEU 10 22.742 32.476 29.379
84 HD23 LEU 10 HD23 LEU 10 22.919 34.189 28.943
85 H SER 11 H SER 11 27.443 31.346 28.362
86 HA SER 11 HA SER 11 28.775 32.353 30.741
87 HB2 SER 11 HB2 SER 11 27.482 30.277 30.840
88 HB3 SER 11 HB3 SER 11 28.602 29.504 29.697
89 HG SER 11 HG SER 11 29.246 29.029 31.822
90 H CYS 12 H CYS 12 30.000 30.493 27.861
91 HA CYS 12 HA CYS 12 32.765 30.722 28.647
92 HB2 CYS 12 HB2 CYS 12 31.351 30.192 26.005
93 HB3 CYS 12 HB3 CYS 12 33.091 30.205 26.166
94 H ARG 13 H ARG 13 30.560 32.913 27.000
95 HA ARG 13 HA ARG 13 32.568 34.709 25.961
96 HB2 ARG 13 HB2 ARG 13 30.303 34.392 25.106
97 HB3 ARG 13 HB3 ARG 13 29.618 35.176 26.539
98 HG2 ARG 13 HG2 ARG 13 30.700 37.284 25.956
99 HG3 ARG 13 HG3 ARG 13 31.587 36.517 24.628
100 HD2 ARG 13 HD2 ARG 13 28.559 36.802 24.814
101 HD3 ARG 13 HD3 ARG 13 29.620 37.817 23.836
102 HE ARG 13 HE ARG 13 28.916 34.960 23.364
103 HH11 ARG 13 HH11 ARG 13 30.903 37.683 22.150
104 HH12 ARG 13 HH12 ARG 13 30.974 36.896 20.579
105 HH21 ARG 13 HH21 ARG 13 29.364 34.079 21.312
106 HH22 ARG 13 HH22 ARG 13 30.197 35.108 20.147
107 H SER 14 H SER 14 31.105 34.401 29.156
108 HA SER 14 HA SER 14 32.011 36.943 30.130
109 HB2 SER 14 HB2 SER 14 31.640 36.119 32.337
110 HB3 SER 14 HB3 SER 14 30.338 35.514 31.301
111 HG SER 14 HG SER 14 31.537 33.513 31.163
112 H LEU 15 H LEU 15 33.709 33.909 29.585
113 HA LEU 15 HA LEU 15 36.243 34.862 30.785
114 HB2 LEU 15 HB2 LEU 15 35.723 32.413 29.080
115 HB3 LEU 15 HB3 LEU 15 37.114 32.728 30.108
116 HG LEU 15 HG LEU 15 34.259 32.130 31.010
117 HD11 LEU 15 HD11 LEU 15 36.856 30.567 31.306
118 HD12 LEU 15 HD12 LEU 15 35.261 30.083 31.918
119 HD13 LEU 15 HD13 LEU 15 35.539 30.191 30.173
120 HD21 LEU 15 HD21 LEU 15 35.254 33.687 32.623
121 HD22 LEU 15 HD22 LEU 15 35.205 32.061 33.308
122 HD23 LEU 15 HD23 LEU 15 36.737 32.711 32.687
123 H GLY 16 H GLY 16 34.594 34.943 27.752
124 HA2 GLY 16 HA2 GLY 16 35.197 36.362 25.955
125 HA3 GLY 16 HA3 GLY 16 36.910 36.203 26.345
126 H LEU 17 H LEU 17 35.095 33.225 26.373
127 HA LEU 17 HA LEU 17 36.189 32.420 23.738
128 HB2 LEU 17 HB2 LEU 17 35.066 30.851 26.099
129 HB3 LEU 17 HB3 LEU 17 35.437 30.163 24.513
130 HG LEU 17 HG LEU 17 37.775 31.177 24.861
131 HD11 LEU 17 HD11 LEU 17 37.381 32.440 26.980
132 HD12 LEU 17 HD12 LEU 17 36.893 30.920 27.778
133 HD13 LEU 17 HD13 LEU 17 38.561 31.170 27.232
134 HD21 LEU 17 HD21 LEU 17 36.837 28.762 26.451
135 HD22 LEU 17 HD22 LEU 17 37.429 28.801 24.769
136 HD23 LEU 17 HD23 LEU 17 38.536 29.136 26.088
137 H LEU 18 H LEU 18 34.978 31.909 22.080
138 HA LEU 18 HA LEU 18 32.173 32.631 21.796
139 HB2 LEU 18 HB2 LEU 18 33.848 32.769 19.959
140 HB3 LEU 18 HB3 LEU 18 34.195 31.054 20.132
141 HG LEU 18 HG LEU 18 31.835 30.536 19.404
142 HD11 LEU 18 HD11 LEU 18 31.818 33.512 18.726
143 HD12 LEU 18 HD12 LEU 18 30.614 32.322 18.191
144 HD13 LEU 18 HD13 LEU 18 30.767 32.697 19.908
145 HD21 LEU 18 HD21 LEU 18 33.754 30.452 17.860
146 HD22 LEU 18 HD22 LEU 18 32.270 30.980 17.052
147 HD23 LEU 18 HD23 LEU 18 33.519 32.174 17.474
148 H GLY 19 H GLY 19 30.404 31.308 22.053
149 HA2 GLY 19 HA2 GLY 19 30.759 28.504 22.971
150 HA3 GLY 19 HA3 GLY 19 29.241 29.371 22.759
151 H LYS 20 H LYS 20 31.056 26.954 21.546
152 HA LYS 20 HA LYS 20 30.023 27.137 18.742
153 HB2 LYS 20 HB2 LYS 20 32.519 27.761 19.258
154 HB3 LYS 20 HB3 LYS 20 32.754 26.043 19.539
155 HG2 LYS 20 HG2 LYS 20 33.311 26.321 17.267
156 HG3 LYS 20 HG3 LYS 20 31.659 25.711 17.209
157 HD2 LYS 20 HD2 LYS 20 31.093 28.382 17.251
158 HD3 LYS 20 HD3 LYS 20 32.740 28.451 16.581
159 HE2 LYS 20 HE2 LYS 20 32.031 26.723 14.890
160 HE3 LYS 20 HE3 LYS 20 30.397 26.817 15.558
161 HZ1 LYS 20 HZ1 LYS 20 30.675 28.237 13.588
162 HZ2 LYS 20 HZ2 LYS 20 30.344 29.168 14.907
163 HZ3 LYS 20 HZ3 LYS 20 31.858 29.106 14.333
164 H CYS 21 H CYS 21 28.461 25.662 18.696
165 HA CYS 21 HA CYS 21 29.002 22.879 19.690
166 HB2 CYS 21 HB2 CYS 21 27.156 23.923 20.898
167 HB3 CYS 21 HB3 CYS 21 26.360 24.326 19.382
168 H ILE 22 H ILE 22 29.142 21.329 18.270
169 HA ILE 22 HA ILE 22 27.599 21.456 15.723
170 HB ILE 22 HB ILE 22 29.937 22.055 15.298
171 HG12 ILE 22 HG12 ILE 22 29.219 19.343 14.103
172 HG13 ILE 22 HG13 ILE 22 28.508 20.886 13.613
173 HG21 ILE 22 HG21 ILE 22 31.043 20.727 17.092
174 HG22 ILE 22 HG22 ILE 22 30.692 19.236 16.189
175 HG23 ILE 22 HG23 ILE 22 31.774 20.472 15.523
176 HD11 ILE 22 HD11 ILE 22 30.791 21.700 12.971
177 HD12 ILE 22 HD12 ILE 22 31.423 20.068 13.327
178 HD13 ILE 22 HD13 ILE 22 30.234 20.287 12.042
179 H GLY 23 H GLY 23 28.822 19.548 18.373
180 HA2 GLY 23 HA2 GLY 23 27.427 17.070 17.430
181 HA3 GLY 23 HA3 GLY 23 28.712 17.182 18.617
182 H GLU 24 H GLU 24 27.667 16.100 20.201
183 HA GLU 24 HA GLU 24 24.974 16.571 21.149
184 HB2 GLU 24 HB2 GLU 24 27.396 15.272 22.476
185 HB3 GLU 24 HB3 GLU 24 25.739 15.126 23.045
186 HG2 GLU 24 HG2 GLU 24 26.708 14.112 20.331
187 HG3 GLU 24 HG3 GLU 24 26.628 13.144 21.796
188 H GLU 25 H GLU 25 27.983 18.206 21.841
189 HA GLU 25 HA GLU 25 26.752 19.745 24.052
190 HB2 GLU 25 HB2 GLU 25 27.843 17.819 25.115
191 HB3 GLU 25 HB3 GLU 25 29.364 18.202 24.302
192 HG2 GLU 25 HG2 GLU 25 29.531 20.325 25.523
193 HG3 GLU 25 HG3 GLU 25 27.936 20.067 26.248
194 H CYS 26 H CYS 26 27.453 21.809 24.227
195 HA CYS 26 HA CYS 26 28.895 22.964 21.991
196 HB2 CYS 26 HB2 CYS 26 26.952 23.988 23.164
197 HB3 CYS 26 HB3 CYS 26 27.937 24.178 24.602
198 H LYS 27 H LYS 27 31.012 23.335 21.768
199 HA LYS 27 HA LYS 27 32.858 23.219 24.110
200 HB2 LYS 27 HB2 LYS 27 33.386 23.112 21.108
201 HB3 LYS 27 HB3 LYS 27 34.626 23.061 22.353
202 HG2 LYS 27 HG2 LYS 27 32.488 20.940 21.873
203 HG3 LYS 27 HG3 LYS 27 34.194 20.853 21.473
204 HD2 LYS 27 HD2 LYS 27 34.388 19.749 23.407
205 HD3 LYS 27 HD3 LYS 27 34.433 21.342 24.142
206 HE2 LYS 27 HE2 LYS 27 32.015 21.209 24.645
207 HE3 LYS 27 HE3 LYS 27 31.894 19.705 23.710
208 HZ1 LYS 27 HZ1 LYS 27 33.321 20.035 26.290
209 HZ2 LYS 27 HZ2 LYS 27 32.022 19.098 25.994
210 HZ3 LYS 27 HZ3 LYS 27 33.479 18.719 25.338
211 H CYS 28 H CYS 28 34.625 24.764 24.155
212 HA CYS 28 HA CYS 28 33.851 27.490 23.172
213 HB2 CYS 28 HB2 CYS 28 34.730 26.655 25.935
214 HB3 CYS 28 HB3 CYS 28 34.541 28.324 25.371
215 H VAL 29 H VAL 29 35.224 28.731 22.293
216 HA VAL 29 HA VAL 29 38.151 28.209 22.244
217 HB VAL 29 HB VAL 29 38.054 28.268 19.728
218 HG11 VAL 29 HG11 VAL 29 36.640 25.861 20.920
219 HG12 VAL 29 HG12 VAL 29 37.598 25.935 19.438
220 HG13 VAL 29 HG13 VAL 29 38.392 26.168 21.001
221 HG21 VAL 29 HG21 VAL 29 35.751 29.170 19.438
222 HG22 VAL 29 HG22 VAL 29 36.014 27.662 18.553
223 HG23 VAL 29 HG23 VAL 29 35.090 27.643 20.063
224 HA PRO 30 HA PRO 30 38.350 32.647 21.634
225 HB2 PRO 30 HB2 PRO 30 40.356 32.179 19.448
226 HB3 PRO 30 HB3 PRO 30 40.469 33.268 20.861
227 HG2 PRO 30 HG2 PRO 30 41.801 30.909 20.819
228 HG3 PRO 30 HG3 PRO 30 40.967 31.446 22.316
229 HD2 PRO 30 HD2 PRO 30 40.007 29.451 20.245
230 HD3 PRO 30 HD3 PRO 30 39.966 29.346 22.030
231 H TYR 31 H TYR 31 38.122 34.406 19.985
232 HA TYR 31 HA TYR 31 35.979 33.869 18.124
233 HB2 TYR 31 HB2 TYR 31 37.536 36.441 18.522
234 HB3 TYR 31 HB3 TYR 31 35.947 36.263 17.803
235 HD1 TYR 31 HD1 TYR 31 34.184 34.962 19.452
236 HD2 TYR 31 HD2 TYR 31 37.536 37.396 20.656
237 HE1 TYR 31 HE1 TYR 31 33.103 35.373 21.668
238 HE2 TYR 31 HE2 TYR 31 36.443 37.815 22.855
239 HH TYR 31 HH TYR 31 34.525 37.582 24.092
240 H ASN 32 H ASN 32 38.048 32.349 17.178
241 HA ASN 32 HA ASN 32 39.940 33.499 15.445
242 HB2 ASN 32 HB2 ASN 32 38.730 30.703 15.432
243 HB3 ASN 32 HB3 ASN 32 40.191 31.163 14.582
244 HD21 ASN 32 HD21 ASN 32 40.900 29.687 18.037
245 HD22 ASN 32 HD22 ASN 32 39.511 29.322 17.028
Start of MODEL 18
1 H1 ALA 1 H1 ALA 1 22.694 13.402 22.663
2 H2 ALA 1 H2 ALA 1 21.056 13.548 22.530
3 H3 ALA 1 H3 ALA 1 21.697 12.702 23.781
4 HA ALA 1 HA ALA 1 21.013 14.732 24.660
5 HB1 ALA 1 HB1 ALA 1 24.028 14.753 24.258
6 HB2 ALA 1 HB2 ALA 1 23.132 15.662 25.482
7 HB3 ALA 1 HB3 ALA 1 23.152 13.889 25.540
8 H PHE 2 H PHE 2 20.233 16.801 24.147
9 HA PHE 2 HA PHE 2 21.250 18.231 21.812
10 HB2 PHE 2 HB2 PHE 2 19.720 19.389 24.163
11 HB3 PHE 2 HB3 PHE 2 19.863 20.056 22.539
12 HD1 PHE 2 HD1 PHE 2 18.020 17.856 24.733
13 HD2 PHE 2 HD2 PHE 2 18.716 18.828 20.591
14 HE1 PHE 2 HE1 PHE 2 15.919 16.758 24.129
15 HE2 PHE 2 HE2 PHE 2 16.580 17.727 19.983
16 HZ PHE 2 HZ PHE 2 15.137 16.720 21.744
17 H CYS 3 H CYS 3 22.713 19.970 21.727
18 HA CYS 3 HA CYS 3 24.442 20.473 24.055
19 HB2 CYS 3 HB2 CYS 3 25.772 21.783 22.582
20 HB3 CYS 3 HB3 CYS 3 25.346 20.283 21.766
21 H ASN 4 H ASN 4 24.583 22.494 25.176
22 HA ASN 4 HA ASN 4 22.093 24.132 25.103
23 HB2 ASN 4 HB2 ASN 4 24.365 24.043 27.115
24 HB3 ASN 4 HB3 ASN 4 22.887 24.991 27.272
25 HD21 ASN 4 HD21 ASN 4 22.806 21.384 28.773
26 HD22 ASN 4 HD22 ASN 4 24.149 22.519 28.692
27 H LEU 5 H LEU 5 23.132 24.741 22.838
28 HA LEU 5 HA LEU 5 25.438 26.257 22.616
29 HB2 LEU 5 HB2 LEU 5 24.251 25.219 20.778
30 HB3 LEU 5 HB3 LEU 5 22.924 26.343 20.914
31 HG LEU 5 HG LEU 5 24.516 26.649 19.002
32 HD11 LEU 5 HD11 LEU 5 24.450 29.030 18.950
33 HD12 LEU 5 HD12 LEU 5 22.974 28.453 19.740
34 HD13 LEU 5 HD13 LEU 5 24.296 29.150 20.704
35 HD21 LEU 5 HD21 LEU 5 26.412 27.875 21.034
36 HD22 LEU 5 HD22 LEU 5 26.646 26.304 20.250
37 HD23 LEU 5 HD23 LEU 5 26.617 27.788 19.281
38 H ARG 6 H ARG 6 22.147 27.741 23.094
39 HA ARG 6 HA ARG 6 23.262 30.405 23.063
40 HB2 ARG 6 HB2 ARG 6 20.927 29.729 22.450
41 HB3 ARG 6 HB3 ARG 6 20.593 29.507 24.170
42 HG2 ARG 6 HG2 ARG 6 21.045 31.886 24.586
43 HG3 ARG 6 HG3 ARG 6 21.523 32.119 22.897
44 HD2 ARG 6 HD2 ARG 6 19.290 32.970 23.216
45 HD3 ARG 6 HD3 ARG 6 19.210 31.536 22.185
46 HE ARG 6 HE ARG 6 18.612 30.255 24.325
47 HH11 ARG 6 HH11 ARG 6 17.575 33.688 24.122
48 HH12 ARG 6 HH12 ARG 6 16.497 33.392 25.470
49 HH21 ARG 6 HH21 ARG 6 17.134 30.136 25.875
50 HH22 ARG 6 HH22 ARG 6 16.252 31.585 26.372
51 H ARG 7 H ARG 7 22.638 28.212 25.819
52 HA ARG 7 HA ARG 7 23.468 30.195 27.828
53 HB2 ARG 7 HB2 ARG 7 23.340 27.150 27.960
54 HB3 ARG 7 HB3 ARG 7 23.874 28.178 29.290
55 HG2 ARG 7 HG2 ARG 7 21.656 29.419 29.114
56 HG3 ARG 7 HG3 ARG 7 21.113 28.118 28.034
57 HD2 ARG 7 HD2 ARG 7 21.558 26.461 29.841
58 HD3 ARG 7 HD3 ARG 7 22.129 27.773 30.895
59 HE ARG 7 HE ARG 7 19.452 28.248 29.843
60 HH11 ARG 7 HH11 ARG 7 21.108 26.834 32.646
61 HH12 ARG 7 HH12 ARG 7 19.591 26.911 33.542
62 HH21 ARG 7 HH21 ARG 7 17.691 28.159 31.073
63 HH22 ARG 7 HH22 ARG 7 17.796 27.539 32.725
64 H CYS 8 H CYS 8 25.187 27.756 25.953
65 HA CYS 8 HA CYS 8 27.808 28.119 27.102
66 HB2 CYS 8 HB2 CYS 8 27.046 26.154 25.833
67 HB3 CYS 8 HB3 CYS 8 26.714 27.155 24.438
68 H GLU 9 H GLU 9 26.251 29.680 24.237
69 HA GLU 9 HA GLU 9 28.381 31.335 23.495
70 HB2 GLU 9 HB2 GLU 9 25.386 31.781 23.483
71 HB3 GLU 9 HB3 GLU 9 26.473 33.024 22.892
72 HG2 GLU 9 HG2 GLU 9 26.714 30.218 21.778
73 HG3 GLU 9 HG3 GLU 9 25.393 31.266 21.260
74 H LEU 10 H LEU 10 26.104 31.924 26.255
75 HA LEU 10 HA LEU 10 27.555 34.411 26.874
76 HB2 LEU 10 HB2 LEU 10 25.954 34.899 28.536
77 HB3 LEU 10 HB3 LEU 10 25.202 34.510 27.002
78 HG LEU 10 HG LEU 10 24.593 32.239 27.960
79 HD11 LEU 10 HD11 LEU 10 25.422 33.596 30.575
80 HD12 LEU 10 HD12 LEU 10 24.375 32.170 30.474
81 HD13 LEU 10 HD13 LEU 10 26.044 32.058 29.949
82 HD21 LEU 10 HD21 LEU 10 23.514 34.682 29.434
83 HD22 LEU 10 HD22 LEU 10 23.032 34.199 27.804
84 HD23 LEU 10 HD23 LEU 10 22.669 33.143 29.174
85 H SER 11 H SER 11 27.583 31.105 28.032
86 HA SER 11 HA SER 11 29.011 31.731 30.497
87 HB2 SER 11 HB2 SER 11 28.666 29.057 29.095
88 HB3 SER 11 HB3 SER 11 29.294 29.317 30.736
89 HG SER 11 HG SER 11 26.703 29.757 29.708
90 H CYS 12 H CYS 12 29.987 30.651 27.221
91 HA CYS 12 HA CYS 12 32.838 30.656 27.809
92 HB2 CYS 12 HB2 CYS 12 31.344 31.011 25.185
93 HB3 CYS 12 HB3 CYS 12 33.071 30.720 25.352
94 H ARG 13 H ARG 13 30.460 33.113 26.768
95 HA ARG 13 HA ARG 13 32.364 35.193 26.145
96 HB2 ARG 13 HB2 ARG 13 29.990 35.252 25.438
97 HB3 ARG 13 HB3 ARG 13 29.496 35.452 27.122
98 HG2 ARG 13 HG2 ARG 13 30.839 37.664 27.082
99 HG3 ARG 13 HG3 ARG 13 31.018 37.401 25.342
100 HD2 ARG 13 HD2 ARG 13 29.153 38.886 25.711
101 HD3 ARG 13 HD3 ARG 13 28.496 37.326 25.181
102 HE ARG 13 HE ARG 13 28.658 37.467 28.077
103 HH11 ARG 13 HH11 ARG 13 26.566 38.652 25.484
104 HH12 ARG 13 HH12 ARG 13 25.153 38.472 26.504
105 HH21 ARG 13 HH21 ARG 13 26.949 37.531 29.294
106 HH22 ARG 13 HH22 ARG 13 25.384 38.057 28.667
107 H SER 14 H SER 14 31.075 34.078 29.251
108 HA SER 14 HA SER 14 31.883 36.268 30.808
109 HB2 SER 14 HB2 SER 14 31.756 34.911 32.707
110 HB3 SER 14 HB3 SER 14 30.567 34.231 31.590
111 HG SER 14 HG SER 14 31.912 32.500 31.212
112 H LEU 15 H LEU 15 33.849 33.608 29.541
113 HA LEU 15 HA LEU 15 36.371 34.646 30.688
114 HB2 LEU 15 HB2 LEU 15 35.852 32.345 28.765
115 HB3 LEU 15 HB3 LEU 15 37.339 32.656 29.648
116 HG LEU 15 HG LEU 15 34.669 31.809 30.864
117 HD11 LEU 15 HD11 LEU 15 37.296 30.302 30.496
118 HD12 LEU 15 HD12 LEU 15 35.843 29.695 31.318
119 HD13 LEU 15 HD13 LEU 15 35.792 30.034 29.585
120 HD21 LEU 15 HD21 LEU 15 37.393 32.152 32.207
121 HD22 LEU 15 HD22 LEU 15 35.969 33.189 32.468
122 HD23 LEU 15 HD23 LEU 15 35.923 31.494 32.958
123 H GLY 16 H GLY 16 34.493 35.272 27.955
124 HA2 GLY 16 HA2 GLY 16 34.903 36.874 26.279
125 HA3 GLY 16 HA3 GLY 16 36.635 36.626 26.432
126 H LEU 17 H LEU 17 35.671 33.551 26.334
127 HA LEU 17 HA LEU 17 36.346 33.129 23.562
128 HB2 LEU 17 HB2 LEU 17 35.456 31.346 25.869
129 HB3 LEU 17 HB3 LEU 17 35.682 30.742 24.228
130 HG LEU 17 HG LEU 17 38.019 31.642 24.267
131 HD11 LEU 17 HD11 LEU 17 39.127 31.853 26.495
132 HD12 LEU 17 HD12 LEU 17 38.021 33.175 26.179
133 HD13 LEU 17 HD13 LEU 17 37.534 31.843 27.267
134 HD21 LEU 17 HD21 LEU 17 37.570 29.262 24.553
135 HD22 LEU 17 HD22 LEU 17 38.926 29.743 25.561
136 HD23 LEU 17 HD23 LEU 17 37.336 29.490 26.309
137 H LEU 18 H LEU 18 35.061 32.052 21.999
138 HA LEU 18 HA LEU 18 32.203 32.811 21.956
139 HB2 LEU 18 HB2 LEU 18 34.009 31.542 19.851
140 HB3 LEU 18 HB3 LEU 18 32.289 31.878 19.663
141 HG LEU 18 HG LEU 18 32.865 34.352 20.182
142 HD11 LEU 18 HD11 LEU 18 35.196 34.174 20.910
143 HD12 LEU 18 HD12 LEU 18 35.632 33.315 19.414
144 HD13 LEU 18 HD13 LEU 18 35.138 35.027 19.375
145 HD21 LEU 18 HD21 LEU 18 33.853 33.048 17.616
146 HD22 LEU 18 HD22 LEU 18 32.171 33.507 17.977
147 HD23 LEU 18 HD23 LEU 18 33.412 34.759 17.822
148 H GLY 19 H GLY 19 30.538 31.317 21.898
149 HA2 GLY 19 HA2 GLY 19 31.125 28.586 22.939
150 HA3 GLY 19 HA3 GLY 19 29.543 29.361 22.867
151 H LYS 20 H LYS 20 31.064 26.819 21.667
152 HA LYS 20 HA LYS 20 29.659 26.894 19.020
153 HB2 LYS 20 HB2 LYS 20 32.525 25.990 19.527
154 HB3 LYS 20 HB3 LYS 20 31.635 25.656 18.045
155 HG2 LYS 20 HG2 LYS 20 32.354 28.433 19.081
156 HG3 LYS 20 HG3 LYS 20 33.157 27.553 17.777
157 HD2 LYS 20 HD2 LYS 20 31.068 27.554 16.447
158 HD3 LYS 20 HD3 LYS 20 30.254 28.460 17.734
159 HE2 LYS 20 HE2 LYS 20 32.097 30.225 17.477
160 HE3 LYS 20 HE3 LYS 20 32.538 29.379 15.981
161 HZ1 LYS 20 HZ1 LYS 20 30.125 29.672 15.349
162 HZ2 LYS 20 HZ2 LYS 20 29.947 30.658 16.640
163 HZ3 LYS 20 HZ3 LYS 20 30.980 31.068 15.426
164 H CYS 21 H CYS 21 28.422 25.283 18.599
165 HA CYS 21 HA CYS 21 28.328 22.939 20.423
166 HB2 CYS 21 HB2 CYS 21 26.248 24.099 20.041
167 HB3 CYS 21 HB3 CYS 21 26.433 23.968 18.292
168 H ILE 22 H ILE 22 29.115 21.007 19.870
169 HA ILE 22 HA ILE 22 30.063 20.578 17.059
170 HB ILE 22 HB ILE 22 30.884 19.329 19.692
171 HG12 ILE 22 HG12 ILE 22 32.210 21.284 17.758
172 HG13 ILE 22 HG13 ILE 22 31.658 21.628 19.397
173 HG21 ILE 22 HG21 ILE 22 31.024 17.642 17.857
174 HG22 ILE 22 HG22 ILE 22 31.990 18.789 16.902
175 HG23 ILE 22 HG23 ILE 22 32.609 18.115 18.425
176 HD11 ILE 22 HD11 ILE 22 34.018 21.455 19.479
177 HD12 ILE 22 HD12 ILE 22 33.377 19.989 20.250
178 HD13 ILE 22 HD13 ILE 22 34.020 19.930 18.591
179 H GLY 23 H GLY 23 27.770 19.379 19.386
180 HA2 GLY 23 HA2 GLY 23 25.873 18.554 17.628
181 HA3 GLY 23 HA3 GLY 23 26.863 17.101 17.788
182 H GLU 24 H GLU 24 27.422 16.555 20.154
183 HA GLU 24 HA GLU 24 24.926 16.358 21.715
184 HB2 GLU 24 HB2 GLU 24 27.745 15.333 22.249
185 HB3 GLU 24 HB3 GLU 24 26.316 14.953 23.202
186 HG2 GLU 24 HG2 GLU 24 26.772 14.176 20.293
187 HG3 GLU 24 HG3 GLU 24 26.942 13.116 21.683
188 H GLU 25 H GLU 25 27.895 18.215 21.783
189 HA GLU 25 HA GLU 25 27.073 19.602 24.271
190 HB2 GLU 25 HB2 GLU 25 29.025 17.536 24.071
191 HB3 GLU 25 HB3 GLU 25 29.945 19.021 24.213
192 HG2 GLU 25 HG2 GLU 25 27.611 18.448 26.091
193 HG3 GLU 25 HG3 GLU 25 29.166 17.687 26.345
194 H CYS 26 H CYS 26 28.610 21.459 24.801
195 HA CYS 26 HA CYS 26 29.398 22.871 22.304
196 HB2 CYS 26 HB2 CYS 26 27.182 23.579 23.009
197 HB3 CYS 26 HB3 CYS 26 27.791 24.001 24.606
198 H LYS 27 H LYS 27 31.354 23.601 22.272
199 HA LYS 27 HA LYS 27 33.032 23.680 24.750
200 HB2 LYS 27 HB2 LYS 27 33.876 23.753 21.830
201 HB3 LYS 27 HB3 LYS 27 34.931 23.560 23.221
202 HG2 LYS 27 HG2 LYS 27 32.903 21.514 22.211
203 HG3 LYS 27 HG3 LYS 27 34.640 21.504 21.966
204 HD2 LYS 27 HD2 LYS 27 34.372 19.952 23.619
205 HD3 LYS 27 HD3 LYS 27 34.877 21.377 24.533
206 HE2 LYS 27 HE2 LYS 27 32.570 21.770 25.263
207 HE3 LYS 27 HE3 LYS 27 31.972 20.525 24.150
208 HZ1 LYS 27 HZ1 LYS 27 33.758 20.000 26.462
209 HZ2 LYS 27 HZ2 LYS 27 32.131 19.706 26.403
210 HZ3 LYS 27 HZ3 LYS 27 33.164 18.865 25.437
211 H CYS 28 H CYS 28 34.713 25.351 24.785
212 HA CYS 28 HA CYS 28 33.804 28.013 23.759
213 HB2 CYS 28 HB2 CYS 28 35.585 27.420 26.132
214 HB3 CYS 28 HB3 CYS 28 35.056 29.000 25.566
215 H VAL 29 H VAL 29 35.109 29.059 22.382
216 HA VAL 29 HA VAL 29 37.941 28.180 22.028
217 HB VAL 29 HB VAL 29 37.509 28.485 19.512
218 HG11 VAL 29 HG11 VAL 29 36.350 26.046 20.914
219 HG12 VAL 29 HG12 VAL 29 36.880 26.137 19.224
220 HG13 VAL 29 HG13 VAL 29 38.064 26.326 20.521
221 HG21 VAL 29 HG21 VAL 29 35.172 29.387 19.732
222 HG22 VAL 29 HG22 VAL 29 35.302 27.969 18.675
223 HG23 VAL 29 HG23 VAL 29 34.651 27.788 20.320
224 HA PRO 30 HA PRO 30 38.796 32.502 21.827
225 HB2 PRO 30 HB2 PRO 30 41.192 32.594 20.528
226 HB3 PRO 30 HB3 PRO 30 40.994 31.790 22.116
227 HG2 PRO 30 HG2 PRO 30 40.934 30.530 19.371
228 HG3 PRO 30 HG3 PRO 30 41.936 30.027 20.777
229 HD2 PRO 30 HD2 PRO 30 39.564 28.840 20.160
230 HD3 PRO 30 HD3 PRO 30 40.049 29.081 21.851
231 H TYR 31 H TYR 31 39.631 34.238 20.135
232 HA TYR 31 HA TYR 31 37.582 34.725 18.282
233 HB2 TYR 31 HB2 TYR 31 40.397 35.817 18.121
234 HB3 TYR 31 HB3 TYR 31 38.940 36.561 17.482
235 HD1 TYR 31 HD1 TYR 31 37.259 35.985 20.199
236 HD2 TYR 31 HD2 TYR 31 41.063 37.799 19.261
237 HE1 TYR 31 HE1 TYR 31 37.118 37.370 22.258
238 HE2 TYR 31 HE2 TYR 31 40.915 39.178 21.306
239 HH TYR 31 HH TYR 31 39.702 39.717 23.130
240 H ASN 32 H ASN 32 37.453 34.785 16.002
241 HA ASN 32 HA ASN 32 38.349 32.256 14.875
242 HB2 ASN 32 HB2 ASN 32 36.578 34.501 13.846
243 HB3 ASN 32 HB3 ASN 32 36.967 33.090 12.884
244 HD21 ASN 32 HD21 ASN 32 33.824 32.781 15.152
245 HD22 ASN 32 HD22 ASN 32 34.585 34.306 14.729
Start of MODEL 19
1 H1 ALA 1 H1 ALA 1 18.875 14.840 21.865
2 H2 ALA 1 H2 ALA 1 19.208 13.830 23.098
3 H3 ALA 1 H3 ALA 1 20.356 14.156 21.930
4 HA ALA 1 HA ALA 1 19.228 16.064 23.851
5 HB1 ALA 1 HB1 ALA 1 20.745 14.470 24.958
6 HB2 ALA 1 HB2 ALA 1 22.017 14.870 23.782
7 HB3 ALA 1 HB3 ALA 1 21.441 16.104 24.915
8 H PHE 2 H PHE 2 19.007 17.993 22.949
9 HA PHE 2 HA PHE 2 20.499 18.857 20.607
10 HB2 PHE 2 HB2 PHE 2 18.854 20.587 22.458
11 HB3 PHE 2 HB3 PHE 2 19.179 20.831 20.760
12 HD1 PHE 2 HD1 PHE 2 18.218 19.009 19.098
13 HD2 PHE 2 HD2 PHE 2 16.871 19.528 23.164
14 HE1 PHE 2 HE1 PHE 2 16.103 17.821 18.553
15 HE2 PHE 2 HE2 PHE 2 14.756 18.356 22.620
16 HZ PHE 2 HZ PHE 2 14.363 17.510 20.309
17 H CYS 3 H CYS 3 21.870 20.781 20.499
18 HA CYS 3 HA CYS 3 23.865 21.006 22.579
19 HB2 CYS 3 HB2 CYS 3 23.115 22.783 20.244
20 HB3 CYS 3 HB3 CYS 3 24.578 22.955 21.207
21 H ASN 4 H ASN 4 23.987 22.360 24.340
22 HA ASN 4 HA ASN 4 21.805 24.218 25.004
23 HB2 ASN 4 HB2 ASN 4 24.411 23.582 26.428
24 HB3 ASN 4 HB3 ASN 4 23.137 24.610 27.063
25 HD21 ASN 4 HD21 ASN 4 22.945 21.004 28.327
26 HD22 ASN 4 HD22 ASN 4 24.383 21.898 27.874
27 H LEU 5 H LEU 5 22.732 25.131 22.611
28 HA LEU 5 HA LEU 5 25.131 26.615 22.686
29 HB2 LEU 5 HB2 LEU 5 24.046 25.704 20.651
30 HB3 LEU 5 HB3 LEU 5 22.789 26.933 20.791
31 HG LEU 5 HG LEU 5 24.539 28.713 20.501
32 HD11 LEU 5 HD11 LEU 5 26.558 27.529 21.247
33 HD12 LEU 5 HD12 LEU 5 26.373 26.342 19.932
34 HD13 LEU 5 HD13 LEU 5 26.746 28.042 19.571
35 HD21 LEU 5 HD21 LEU 5 23.229 27.888 18.591
36 HD22 LEU 5 HD22 LEU 5 24.865 28.338 18.099
37 HD23 LEU 5 HD23 LEU 5 24.440 26.622 18.294
38 H ARG 6 H ARG 6 21.795 27.832 23.226
39 HA ARG 6 HA ARG 6 22.494 30.604 23.464
40 HB2 ARG 6 HB2 ARG 6 20.191 29.789 23.144
41 HB3 ARG 6 HB3 ARG 6 20.189 29.086 24.765
42 HG2 ARG 6 HG2 ARG 6 20.390 31.290 25.797
43 HG3 ARG 6 HG3 ARG 6 20.643 32.043 24.221
44 HD2 ARG 6 HD2 ARG 6 18.436 32.515 24.892
45 HD3 ARG 6 HD3 ARG 6 18.334 31.366 23.554
46 HE ARG 6 HE ARG 6 18.243 29.722 25.767
47 HH11 ARG 6 HH11 ARG 6 16.289 32.603 25.037
48 HH12 ARG 6 HH12 ARG 6 14.908 31.902 25.849
49 HH21 ARG 6 HH21 ARG 6 16.574 29.061 26.833
50 HH22 ARG 6 HH22 ARG 6 15.088 30.009 26.967
51 H ARG 7 H ARG 7 22.656 27.974 25.837
52 HA ARG 7 HA ARG 7 23.529 29.746 28.028
53 HB2 ARG 7 HB2 ARG 7 22.465 27.377 28.229
54 HB3 ARG 7 HB3 ARG 7 24.082 26.763 27.848
55 HG2 ARG 7 HG2 ARG 7 24.990 28.168 29.778
56 HG3 ARG 7 HG3 ARG 7 23.310 28.556 30.187
57 HD2 ARG 7 HD2 ARG 7 24.577 25.798 30.120
58 HD3 ARG 7 HD3 ARG 7 24.184 26.727 31.574
59 HE ARG 7 HE ARG 7 21.740 26.512 30.239
60 HH11 ARG 7 HH11 ARG 7 24.021 24.180 31.531
61 HH12 ARG 7 HH12 ARG 7 22.829 22.898 31.533
62 HH21 ARG 7 HH21 ARG 7 20.275 24.986 30.505
63 HH22 ARG 7 HH22 ARG 7 20.694 23.393 31.142
64 H CYS 8 H CYS 8 25.140 27.712 25.628
65 HA CYS 8 HA CYS 8 27.788 28.011 26.570
66 HB2 CYS 8 HB2 CYS 8 26.750 26.319 24.941
67 HB3 CYS 8 HB3 CYS 8 26.885 27.569 23.704
68 H GLU 9 H GLU 9 26.059 30.053 24.118
69 HA GLU 9 HA GLU 9 28.319 31.663 23.544
70 HB2 GLU 9 HB2 GLU 9 26.854 33.292 22.623
71 HB3 GLU 9 HB3 GLU 9 26.266 31.683 22.193
72 HG2 GLU 9 HG2 GLU 9 24.475 31.838 23.802
73 HG3 GLU 9 HG3 GLU 9 25.112 33.341 24.469
74 H LEU 10 H LEU 10 26.159 31.857 26.382
75 HA LEU 10 HA LEU 10 27.483 34.377 27.203
76 HB2 LEU 10 HB2 LEU 10 25.804 34.781 28.647
77 HB3 LEU 10 HB3 LEU 10 24.989 33.917 27.375
78 HG LEU 10 HG LEU 10 25.394 31.818 29.019
79 HD11 LEU 10 HD11 LEU 10 25.297 34.213 30.906
80 HD12 LEU 10 HD12 LEU 10 25.109 32.509 31.378
81 HD13 LEU 10 HD13 LEU 10 26.651 33.083 30.752
82 HD21 LEU 10 HD21 LEU 10 23.208 32.614 28.253
83 HD22 LEU 10 HD22 LEU 10 23.169 32.248 29.983
84 HD23 LEU 10 HD23 LEU 10 23.256 33.939 29.436
85 H SER 11 H SER 11 27.557 30.959 28.073
86 HA SER 11 HA SER 11 29.138 31.396 30.480
87 HB2 SER 11 HB2 SER 11 27.522 29.523 30.157
88 HB3 SER 11 HB3 SER 11 28.649 28.792 29.010
89 HG SER 11 HG SER 11 29.838 28.151 30.609
90 H CYS 12 H CYS 12 29.969 30.447 27.089
91 HA CYS 12 HA CYS 12 32.825 30.317 27.657
92 HB2 CYS 12 HB2 CYS 12 31.277 30.795 25.077
93 HB3 CYS 12 HB3 CYS 12 33.014 30.521 25.175
94 H ARG 13 H ARG 13 30.534 32.903 26.928
95 HA ARG 13 HA ARG 13 32.538 34.969 26.459
96 HB2 ARG 13 HB2 ARG 13 30.300 35.179 25.606
97 HB3 ARG 13 HB3 ARG 13 29.612 35.178 27.237
98 HG2 ARG 13 HG2 ARG 13 30.614 37.366 27.685
99 HG3 ARG 13 HG3 ARG 13 31.519 37.295 26.159
100 HD2 ARG 13 HD2 ARG 13 29.595 38.735 25.865
101 HD3 ARG 13 HD3 ARG 13 29.395 37.276 24.898
102 HE ARG 13 HE ARG 13 28.085 37.599 27.592
103 HH11 ARG 13 HH11 ARG 13 27.575 36.862 24.135
104 HH12 ARG 13 HH12 ARG 13 25.858 36.704 24.432
105 HH21 ARG 13 HH21 ARG 13 26.067 37.231 27.812
106 HH22 ARG 13 HH22 ARG 13 25.025 36.716 26.493
107 H SER 14 H SER 14 31.500 33.392 29.375
108 HA SER 14 HA SER 14 32.179 35.345 31.301
109 HB2 SER 14 HB2 SER 14 31.145 33.140 31.773
110 HB3 SER 14 HB3 SER 14 32.696 32.350 31.427
111 HG SER 14 HG SER 14 32.087 32.869 33.675
112 H LEU 15 H LEU 15 34.288 33.034 29.568
113 HA LEU 15 HA LEU 15 36.792 34.226 30.563
114 HB2 LEU 15 HB2 LEU 15 36.293 32.193 28.349
115 HB3 LEU 15 HB3 LEU 15 37.836 32.552 29.113
116 HG LEU 15 HG LEU 15 35.433 31.221 30.444
117 HD11 LEU 15 HD11 LEU 15 38.162 30.127 29.645
118 HD12 LEU 15 HD12 LEU 15 36.868 29.236 30.473
119 HD13 LEU 15 HD13 LEU 15 36.624 29.801 28.814
120 HD21 LEU 15 HD21 LEU 15 36.981 30.796 32.336
121 HD22 LEU 15 HD22 LEU 15 38.214 31.812 31.560
122 HD23 LEU 15 HD23 LEU 15 36.677 32.520 32.121
123 H GLY 16 H GLY 16 34.612 34.857 27.995
124 HA2 GLY 16 HA2 GLY 16 34.731 36.741 26.541
125 HA3 GLY 16 HA3 GLY 16 36.492 36.690 26.598
126 H LEU 17 H LEU 17 35.317 33.528 26.146
127 HA LEU 17 HA LEU 17 36.229 33.506 23.351
128 HB2 LEU 17 HB2 LEU 17 35.229 31.243 25.123
129 HB3 LEU 17 HB3 LEU 17 35.956 31.066 23.534
130 HG LEU 17 HG LEU 17 37.251 31.819 26.125
131 HD11 LEU 17 HD11 LEU 17 37.892 29.711 24.038
132 HD12 LEU 17 HD12 LEU 17 38.818 30.003 25.521
133 HD13 LEU 17 HD13 LEU 17 37.157 29.450 25.640
134 HD21 LEU 17 HD21 LEU 17 38.220 33.433 24.515
135 HD22 LEU 17 HD22 LEU 17 39.404 32.182 24.881
136 HD23 LEU 17 HD23 LEU 17 38.502 32.115 23.353
137 H LEU 18 H LEU 18 35.081 32.265 21.735
138 HA LEU 18 HA LEU 18 32.232 32.988 21.474
139 HB2 LEU 18 HB2 LEU 18 34.166 31.488 19.674
140 HB3 LEU 18 HB3 LEU 18 32.503 31.880 19.244
141 HG LEU 18 HG LEU 18 34.642 33.970 19.880
142 HD11 LEU 18 HD11 LEU 18 35.237 32.711 17.863
143 HD12 LEU 18 HD12 LEU 18 33.616 32.998 17.189
144 HD13 LEU 18 HD13 LEU 18 34.730 34.358 17.458
145 HD21 LEU 18 HD21 LEU 18 31.874 34.196 18.618
146 HD22 LEU 18 HD22 LEU 18 32.360 34.818 20.212
147 HD23 LEU 18 HD23 LEU 18 33.062 35.510 18.746
148 H GLY 19 H GLY 19 30.560 31.512 21.446
149 HA2 GLY 19 HA2 GLY 19 31.068 28.858 22.736
150 HA3 GLY 19 HA3 GLY 19 29.544 29.738 22.750
151 H LYS 20 H LYS 20 30.684 27.016 21.699
152 HA LYS 20 HA LYS 20 29.124 26.859 19.173
153 HB2 LYS 20 HB2 LYS 20 31.752 27.391 19.010
154 HB3 LYS 20 HB3 LYS 20 31.912 25.670 19.348
155 HG2 LYS 20 HG2 LYS 20 31.954 25.820 16.993
156 HG3 LYS 20 HG3 LYS 20 30.277 25.369 17.320
157 HD2 LYS 20 HD2 LYS 20 30.069 27.123 15.789
158 HD3 LYS 20 HD3 LYS 20 29.825 27.930 17.361
159 HE2 LYS 20 HE2 LYS 20 32.126 28.747 17.359
160 HE3 LYS 20 HE3 LYS 20 32.495 27.810 15.896
161 HZ1 LYS 20 HZ1 LYS 20 30.949 29.134 14.679
162 HZ2 LYS 20 HZ2 LYS 20 30.523 30.016 16.024
163 HZ3 LYS 20 HZ3 LYS 20 32.046 30.124 15.390
164 H CYS 21 H CYS 21 28.914 24.498 18.436
165 HA CYS 21 HA CYS 21 29.145 22.577 20.710
166 HB2 CYS 21 HB2 CYS 21 26.848 23.500 20.603
167 HB3 CYS 21 HB3 CYS 21 26.731 22.944 18.929
168 H ILE 22 H ILE 22 30.384 20.960 20.155
169 HA ILE 22 HA ILE 22 31.010 20.278 17.426
170 HB ILE 22 HB ILE 22 32.553 20.150 19.296
171 HG12 ILE 22 HG12 ILE 22 32.297 17.367 18.096
172 HG13 ILE 22 HG13 ILE 22 32.803 18.775 17.161
173 HG21 ILE 22 HG21 ILE 22 31.009 19.212 21.050
174 HG22 ILE 22 HG22 ILE 22 31.110 17.639 20.224
175 HG23 ILE 22 HG23 ILE 22 32.549 18.368 20.944
176 HD11 ILE 22 HD11 ILE 22 34.254 17.646 19.585
177 HD12 ILE 22 HD12 ILE 22 34.769 17.579 17.895
178 HD13 ILE 22 HD13 ILE 22 34.706 19.141 18.731
179 H GLY 23 H GLY 23 28.542 19.145 19.537
180 HA2 GLY 23 HA2 GLY 23 27.137 17.746 17.465
181 HA3 GLY 23 HA3 GLY 23 27.924 16.572 18.524
182 H GLU 24 H GLU 24 27.605 17.177 20.976
183 HA GLU 24 HA GLU 24 24.810 18.086 21.560
184 HB2 GLU 24 HB2 GLU 24 26.196 15.604 22.674
185 HB3 GLU 24 HB3 GLU 24 24.570 16.148 23.089
186 HG2 GLU 24 HG2 GLU 24 23.768 15.654 20.845
187 HG3 GLU 24 HG3 GLU 24 25.393 15.325 20.270
188 H GLU 25 H GLU 25 27.992 18.700 22.122
189 HA GLU 25 HA GLU 25 27.687 19.470 24.989
190 HB2 GLU 25 HB2 GLU 25 30.051 18.298 23.495
191 HB3 GLU 25 HB3 GLU 25 30.134 18.946 25.146
192 HG2 GLU 25 HG2 GLU 25 28.787 17.234 26.039
193 HG3 GLU 25 HG3 GLU 25 28.138 16.753 24.477
194 H CYS 26 H CYS 26 28.343 21.468 25.625
195 HA CYS 26 HA CYS 26 28.908 23.514 23.652
196 HB2 CYS 26 HB2 CYS 26 27.650 24.098 25.597
197 HB3 CYS 26 HB3 CYS 26 28.868 23.416 26.673
198 H LYS 27 H LYS 27 30.730 24.105 22.802
199 HA LYS 27 HA LYS 27 33.378 23.620 24.090
200 HB2 LYS 27 HB2 LYS 27 32.627 24.080 21.171
201 HB3 LYS 27 HB3 LYS 27 34.242 23.775 21.772
202 HG2 LYS 27 HG2 LYS 27 31.923 21.770 21.827
203 HG3 LYS 27 HG3 LYS 27 33.202 21.871 20.634
204 HD2 LYS 27 HD2 LYS 27 34.092 20.240 21.876
205 HD3 LYS 27 HD3 LYS 27 34.803 21.627 22.712
206 HE2 LYS 27 HE2 LYS 27 33.219 21.422 24.531
207 HE3 LYS 27 HE3 LYS 27 32.247 20.249 23.631
208 HZ1 LYS 27 HZ1 LYS 27 35.040 19.742 24.531
209 HZ2 LYS 27 HZ2 LYS 27 33.681 19.157 25.278
210 HZ3 LYS 27 HZ3 LYS 27 34.040 18.659 23.787
211 H CYS 28 H CYS 28 34.589 25.359 24.539
212 HA CYS 28 HA CYS 28 33.772 28.104 23.644
213 HB2 CYS 28 HB2 CYS 28 35.614 27.317 25.898
214 HB3 CYS 28 HB3 CYS 28 35.054 28.936 25.454
215 H VAL 29 H VAL 29 35.041 29.172 22.217
216 HA VAL 29 HA VAL 29 37.711 28.045 21.556
217 HB VAL 29 HB VAL 29 37.049 28.185 19.103
218 HG11 VAL 29 HG11 VAL 29 35.693 26.015 20.728
219 HG12 VAL 29 HG12 VAL 29 36.220 25.928 19.039
220 HG13 VAL 29 HG13 VAL 29 37.427 26.064 20.332
221 HG21 VAL 29 HG21 VAL 29 34.221 27.947 20.214
222 HG22 VAL 29 HG22 VAL 29 34.878 29.371 19.374
223 HG23 VAL 29 HG23 VAL 29 34.714 27.831 18.513
224 HA PRO 30 HA PRO 30 38.896 32.213 20.948
225 HB2 PRO 30 HB2 PRO 30 41.211 31.961 19.534
226 HB3 PRO 30 HB3 PRO 30 41.038 31.394 21.222
227 HG2 PRO 30 HG2 PRO 30 40.874 29.790 18.664
228 HG3 PRO 30 HG3 PRO 30 41.745 29.386 20.174
229 HD2 PRO 30 HD2 PRO 30 39.246 28.411 19.539
230 HD3 PRO 30 HD3 PRO 30 39.786 28.666 21.220
231 H TYR 31 H TYR 31 39.475 33.871 19.334
232 HA TYR 31 HA TYR 31 37.535 33.941 17.186
233 HB2 TYR 31 HB2 TYR 31 39.800 35.844 17.894
234 HB3 TYR 31 HB3 TYR 31 38.485 36.179 16.776
235 HD1 TYR 31 HD1 TYR 31 36.205 36.603 17.571
236 HD2 TYR 31 HD2 TYR 31 39.425 35.830 20.342
237 HE1 TYR 31 HE1 TYR 31 34.788 37.412 19.458
238 HE2 TYR 31 HE2 TYR 31 37.990 36.603 22.222
239 HH TYR 31 HH TYR 31 35.666 36.937 22.772
240 H ASN 32 H ASN 32 37.824 33.839 14.995
241 HA ASN 32 HA ASN 32 40.377 32.693 13.989
242 HB2 ASN 32 HB2 ASN 32 37.642 32.968 12.680
243 HB3 ASN 32 HB3 ASN 32 39.056 32.228 11.935
244 HD21 ASN 32 HD21 ASN 32 36.774 29.865 14.144
245 HD22 ASN 32 HD22 ASN 32 36.238 31.421 13.500
Start of MODEL 20
1 H1 ALA 1 H1 ALA 1 21.618 14.076 19.942
2 H2 ALA 1 H2 ALA 1 20.487 14.805 18.990
3 H3 ALA 1 H3 ALA 1 20.074 13.451 19.841
4 HA ALA 1 HA ALA 1 19.146 15.311 20.894
5 HB1 ALA 1 HB1 ALA 1 20.140 15.095 23.137
6 HB2 ALA 1 HB2 ALA 1 19.945 13.510 22.371
7 HB3 ALA 1 HB3 ALA 1 21.554 14.263 22.451
8 H PHE 2 H PHE 2 19.272 17.391 21.728
9 HA PHE 2 HA PHE 2 21.074 19.089 20.219
10 HB2 PHE 2 HB2 PHE 2 18.920 19.741 22.268
11 HB3 PHE 2 HB3 PHE 2 19.678 20.888 21.177
12 HD1 PHE 2 HD1 PHE 2 19.292 20.732 18.689
13 HD2 PHE 2 HD2 PHE 2 17.190 18.212 21.496
14 HE1 PHE 2 HE1 PHE 2 17.659 20.114 16.926
15 HE2 PHE 2 HE2 PHE 2 15.595 17.580 19.731
16 HZ PHE 2 HZ PHE 2 15.797 18.544 17.442
17 H CYS 3 H CYS 3 22.506 20.693 20.966
18 HA CYS 3 HA CYS 3 23.700 20.259 23.650
19 HB2 CYS 3 HB2 CYS 3 25.492 21.621 22.907
20 HB3 CYS 3 HB3 CYS 3 25.142 20.494 21.605
21 H ASN 4 H ASN 4 24.178 22.197 25.017
22 HA ASN 4 HA ASN 4 21.829 23.946 25.297
23 HB2 ASN 4 HB2 ASN 4 24.361 23.874 26.960
24 HB3 ASN 4 HB3 ASN 4 22.838 24.635 27.395
25 HD21 ASN 4 HD21 ASN 4 23.409 20.910 28.542
26 HD22 ASN 4 HD22 ASN 4 24.667 22.100 28.156
27 H LEU 5 H LEU 5 22.757 24.743 22.905
28 HA LEU 5 HA LEU 5 24.998 26.403 22.786
29 HB2 LEU 5 HB2 LEU 5 23.755 25.423 20.884
30 HB3 LEU 5 HB3 LEU 5 22.480 26.598 21.086
31 HG LEU 5 HG LEU 5 24.133 26.922 19.208
32 HD11 LEU 5 HD11 LEU 5 23.969 29.350 21.034
33 HD12 LEU 5 HD12 LEU 5 24.235 29.307 19.291
34 HD13 LEU 5 HD13 LEU 5 22.688 28.781 19.940
35 HD21 LEU 5 HD21 LEU 5 26.046 27.946 21.347
36 HD22 LEU 5 HD22 LEU 5 26.217 26.414 20.456
37 HD23 LEU 5 HD23 LEU 5 26.278 27.949 19.591
38 H ARG 6 H ARG 6 21.701 27.374 23.718
39 HA ARG 6 HA ARG 6 22.161 30.219 23.650
40 HB2 ARG 6 HB2 ARG 6 19.938 28.977 23.592
41 HB3 ARG 6 HB3 ARG 6 20.115 28.705 25.322
42 HG2 ARG 6 HG2 ARG 6 20.093 31.157 25.721
43 HG3 ARG 6 HG3 ARG 6 20.028 31.435 23.973
44 HD2 ARG 6 HD2 ARG 6 17.804 31.669 24.837
45 HD3 ARG 6 HD3 ARG 6 17.869 30.182 23.871
46 HE ARG 6 HE ARG 6 18.403 29.426 26.532
47 HH11 ARG 6 HH11 ARG 6 15.628 30.870 24.931
48 HH12 ARG 6 HH12 ARG 6 14.579 30.540 26.290
49 HH21 ARG 6 HH21 ARG 6 16.923 28.649 27.947
50 HH22 ARG 6 HH22 ARG 6 15.351 29.436 28.024
51 H ARG 7 H ARG 7 22.790 27.820 26.157
52 HA ARG 7 HA ARG 7 23.661 29.820 28.152
53 HB2 ARG 7 HB2 ARG 7 22.709 27.518 28.698
54 HB3 ARG 7 HB3 ARG 7 24.203 26.819 28.069
55 HG2 ARG 7 HG2 ARG 7 25.414 28.334 29.817
56 HG3 ARG 7 HG3 ARG 7 23.807 28.601 30.505
57 HD2 ARG 7 HD2 ARG 7 25.312 25.981 30.186
58 HD3 ARG 7 HD3 ARG 7 24.902 26.791 31.703
59 HE ARG 7 HE ARG 7 22.438 26.376 30.953
60 HH11 ARG 7 HH11 ARG 7 25.013 24.067 30.943
61 HH12 ARG 7 HH12 ARG 7 23.996 22.717 30.525
62 HH21 ARG 7 HH21 ARG 7 21.134 24.715 30.435
63 HH22 ARG 7 HH22 ARG 7 21.761 23.057 30.450
64 H CYS 8 H CYS 8 25.166 27.561 25.849
65 HA CYS 8 HA CYS 8 27.882 27.992 26.571
66 HB2 CYS 8 HB2 CYS 8 26.812 26.143 25.165
67 HB3 CYS 8 HB3 CYS 8 26.710 27.304 23.843
68 H GLU 9 H GLU 9 25.949 29.746 24.070
69 HA GLU 9 HA GLU 9 28.116 31.353 23.206
70 HB2 GLU 9 HB2 GLU 9 26.537 32.743 22.136
71 HB3 GLU 9 HB3 GLU 9 25.972 31.079 21.998
72 HG2 GLU 9 HG2 GLU 9 24.361 31.497 23.853
73 HG3 GLU 9 HG3 GLU 9 24.901 33.175 23.935
74 H LEU 10 H LEU 10 26.145 31.742 26.120
75 HA LEU 10 HA LEU 10 27.371 34.396 26.656
76 HB2 LEU 10 HB2 LEU 10 25.746 34.667 28.406
77 HB3 LEU 10 HB3 LEU 10 25.037 34.358 26.841
78 HG LEU 10 HG LEU 10 24.582 31.975 27.594
79 HD11 LEU 10 HD11 LEU 10 25.201 33.158 30.337
80 HD12 LEU 10 HD12 LEU 10 24.326 31.633 30.053
81 HD13 LEU 10 HD13 LEU 10 26.007 31.762 29.612
82 HD21 LEU 10 HD21 LEU 10 22.864 33.740 27.509
83 HD22 LEU 10 HD22 LEU 10 22.576 32.629 28.844
84 HD23 LEU 10 HD23 LEU 10 23.286 34.237 29.157
85 H SER 11 H SER 11 27.548 31.097 27.789
86 HA SER 11 HA SER 11 29.045 31.589 30.218
87 HB2 SER 11 HB2 SER 11 27.802 29.549 30.018
88 HB3 SER 11 HB3 SER 11 28.554 29.163 28.463
89 HG SER 11 HG SER 11 29.771 29.144 31.037
90 H CYS 12 H CYS 12 30.013 30.483 26.899
91 HA CYS 12 HA CYS 12 32.831 30.624 27.451
92 HB2 CYS 12 HB2 CYS 12 31.323 30.897 24.830
93 HB3 CYS 12 HB3 CYS 12 33.046 30.564 24.995
94 H ARG 13 H ARG 13 30.436 33.059 26.558
95 HA ARG 13 HA ARG 13 32.335 35.177 25.931
96 HB2 ARG 13 HB2 ARG 13 30.096 35.407 25.142
97 HB3 ARG 13 HB3 ARG 13 29.417 35.254 26.763
98 HG2 ARG 13 HG2 ARG 13 30.224 37.382 27.445
99 HG3 ARG 13 HG3 ARG 13 31.349 37.492 26.084
100 HD2 ARG 13 HD2 ARG 13 29.479 39.019 25.794
101 HD3 ARG 13 HD3 ARG 13 29.549 37.813 24.521
102 HE ARG 13 HE ARG 13 27.492 37.033 25.089
103 HH11 ARG 13 HH11 ARG 13 28.535 38.887 27.893
104 HH12 ARG 13 HH12 ARG 13 26.907 38.985 28.529
105 HH21 ARG 13 HH21 ARG 13 25.478 37.251 25.930
106 HH22 ARG 13 HH22 ARG 13 25.248 38.058 27.469
107 H SER 14 H SER 14 30.841 34.105 28.998
108 HA SER 14 HA SER 14 31.977 36.136 30.620
109 HB2 SER 14 HB2 SER 14 30.203 34.649 31.420
110 HB3 SER 14 HB3 SER 14 31.290 33.262 31.311
111 HG SER 14 HG SER 14 31.488 33.756 33.318
112 H LEU 15 H LEU 15 33.398 33.130 29.368
113 HA LEU 15 HA LEU 15 35.875 33.356 30.896
114 HB2 LEU 15 HB2 LEU 15 35.279 31.739 28.396
115 HB3 LEU 15 HB3 LEU 15 36.654 31.535 29.455
116 HG LEU 15 HG LEU 15 33.744 31.027 30.221
117 HD11 LEU 15 HD11 LEU 15 34.660 29.419 28.592
118 HD12 LEU 15 HD12 LEU 15 36.048 29.110 29.653
119 HD13 LEU 15 HD13 LEU 15 34.409 28.664 30.168
120 HD21 LEU 15 HD21 LEU 15 34.714 29.937 32.234
121 HD22 LEU 15 HD22 LEU 15 36.335 30.492 31.766
122 HD23 LEU 15 HD23 LEU 15 35.064 31.661 32.210
123 H GLY 16 H GLY 16 34.731 34.702 27.885
124 HA2 GLY 16 HA2 GLY 16 35.836 36.467 26.700
125 HA3 GLY 16 HA3 GLY 16 37.398 35.900 27.278
126 H LEU 17 H LEU 17 35.039 33.627 25.985
127 HA LEU 17 HA LEU 17 36.597 33.265 23.457
128 HB2 LEU 17 HB2 LEU 17 35.368 31.153 25.271
129 HB3 LEU 17 HB3 LEU 17 36.166 30.835 23.736
130 HG LEU 17 HG LEU 17 37.446 31.898 26.248
131 HD11 LEU 17 HD11 LEU 17 37.753 29.215 24.896
132 HD12 LEU 17 HD12 LEU 17 38.712 29.788 26.273
133 HD13 LEU 17 HD13 LEU 17 36.982 29.553 26.470
134 HD21 LEU 17 HD21 LEU 17 39.626 31.636 25.106
135 HD22 LEU 17 HD22 LEU 17 38.790 31.151 23.617
136 HD23 LEU 17 HD23 LEU 17 38.628 32.806 24.243
137 H LEU 18 H LEU 18 35.370 32.119 21.749
138 HA LEU 18 HA LEU 18 32.528 33.002 21.602
139 HB2 LEU 18 HB2 LEU 18 34.334 31.544 19.643
140 HB3 LEU 18 HB3 LEU 18 32.653 31.916 19.333
141 HG LEU 18 HG LEU 18 34.828 34.002 19.848
142 HD11 LEU 18 HD11 LEU 18 33.471 33.139 17.245
143 HD12 LEU 18 HD12 LEU 18 34.649 34.452 17.434
144 HD13 LEU 18 HD13 LEU 18 35.149 32.787 17.721
145 HD21 LEU 18 HD21 LEU 18 32.619 34.886 20.452
146 HD22 LEU 18 HD22 LEU 18 33.120 35.583 18.918
147 HD23 LEU 18 HD23 LEU 18 31.913 34.279 18.932
148 H GLY 19 H GLY 19 30.805 31.630 21.698
149 HA2 GLY 19 HA2 GLY 19 31.266 28.871 22.743
150 HA3 GLY 19 HA3 GLY 19 29.765 29.784 22.849
151 H LYS 20 H LYS 20 31.070 27.192 21.503
152 HA LYS 20 HA LYS 20 29.306 27.058 19.075
153 HB2 LYS 20 HB2 LYS 20 32.274 26.697 19.371
154 HB3 LYS 20 HB3 LYS 20 31.477 25.385 18.552
155 HG2 LYS 20 HG2 LYS 20 32.328 26.937 16.958
156 HG3 LYS 20 HG3 LYS 20 30.569 26.868 16.853
157 HD2 LYS 20 HD2 LYS 20 30.326 29.026 17.874
158 HD3 LYS 20 HD3 LYS 20 32.009 29.033 18.430
159 HE2 LYS 20 HE2 LYS 20 31.769 30.522 16.534
160 HE3 LYS 20 HE3 LYS 20 32.801 29.151 16.105
161 HZ1 LYS 20 HZ1 LYS 20 31.112 29.755 14.408
162 HZ2 LYS 20 HZ2 LYS 20 30.938 28.181 14.879
163 HZ3 LYS 20 HZ3 LYS 20 29.912 29.328 15.395
164 H CYS 21 H CYS 21 28.948 24.707 18.443
165 HA CYS 21 HA CYS 21 29.237 22.836 20.757
166 HB2 CYS 21 HB2 CYS 21 26.939 23.012 18.793
167 HB3 CYS 21 HB3 CYS 21 27.223 21.672 19.900
168 H ILE 22 H ILE 22 30.344 21.038 20.395
169 HA ILE 22 HA ILE 22 31.518 20.528 17.736
170 HB ILE 22 HB ILE 22 32.793 20.425 19.856
171 HG12 ILE 22 HG12 ILE 22 32.812 17.741 18.413
172 HG13 ILE 22 HG13 ILE 22 33.478 19.235 17.745
173 HG21 ILE 22 HG21 ILE 22 31.307 17.818 20.441
174 HG22 ILE 22 HG22 ILE 22 32.605 18.546 21.400
175 HG23 ILE 22 HG23 ILE 22 31.047 19.348 21.305
176 HD11 ILE 22 HD11 ILE 22 34.440 17.785 20.244
177 HD12 ILE 22 HD12 ILE 22 35.280 17.958 18.695
178 HD13 ILE 22 HD13 ILE 22 35.023 19.383 19.720
179 H GLY 23 H GLY 23 28.826 19.493 19.469
180 HA2 GLY 23 HA2 GLY 23 27.164 18.041 18.101
181 HA3 GLY 23 HA3 GLY 23 28.482 16.858 18.121
182 H GLU 24 H GLU 24 25.829 18.056 19.797
183 HA GLU 24 HA GLU 24 24.804 17.709 21.741
184 HB2 GLU 24 HB2 GLU 24 26.656 15.367 22.288
185 HB3 GLU 24 HB3 GLU 24 25.045 15.682 22.920
186 HG2 GLU 24 HG2 GLU 24 24.384 15.710 20.336
187 HG3 GLU 24 HG3 GLU 24 25.859 14.773 20.155
188 H GLU 25 H GLU 25 28.258 18.166 22.062
189 HA GLU 25 HA GLU 25 27.889 19.362 24.786
190 HB2 GLU 25 HB2 GLU 25 30.063 17.792 23.496
191 HB3 GLU 25 HB3 GLU 25 30.622 19.173 24.403
192 HG2 GLU 25 HG2 GLU 25 28.705 17.108 25.542
193 HG3 GLU 25 HG3 GLU 25 30.456 17.019 25.700
194 H CYS 26 H CYS 26 28.892 21.203 25.367
195 HA CYS 26 HA CYS 26 29.020 23.380 23.380
196 HB2 CYS 26 HB2 CYS 26 27.851 23.835 25.434
197 HB3 CYS 26 HB3 CYS 26 29.168 23.191 26.404
198 H LYS 27 H LYS 27 30.793 24.560 22.906
199 HA LYS 27 HA LYS 27 33.484 23.821 23.935
200 HB2 LYS 27 HB2 LYS 27 32.448 23.236 21.308
201 HB3 LYS 27 HB3 LYS 27 33.590 24.549 21.122
202 HG2 LYS 27 HG2 LYS 27 34.725 22.500 20.780
203 HG3 LYS 27 HG3 LYS 27 35.329 23.195 22.278
204 HD2 LYS 27 HD2 LYS 27 33.025 21.277 22.554
205 HD3 LYS 27 HD3 LYS 27 34.503 20.574 21.921
206 HE2 LYS 27 HE2 LYS 27 34.349 22.133 24.535
207 HE3 LYS 27 HE3 LYS 27 34.247 20.376 24.376
208 HZ1 LYS 27 HZ1 LYS 27 36.506 20.586 24.667
209 HZ2 LYS 27 HZ2 LYS 27 36.474 20.762 23.039
210 HZ3 LYS 27 HZ3 LYS 27 36.605 22.076 23.973
211 H CYS 28 H CYS 28 34.433 25.488 24.721
212 HA CYS 28 HA CYS 28 33.877 28.283 23.810
213 HB2 CYS 28 HB2 CYS 28 35.426 27.285 26.206
214 HB3 CYS 28 HB3 CYS 28 35.024 28.953 25.793
215 H VAL 29 H VAL 29 35.197 29.152 22.356
216 HA VAL 29 HA VAL 29 37.907 27.975 21.943
217 HB VAL 29 HB VAL 29 37.421 27.961 19.484
218 HG11 VAL 29 HG11 VAL 29 35.700 26.070 21.138
219 HG12 VAL 29 HG12 VAL 29 36.335 25.793 19.507
220 HG13 VAL 29 HG13 VAL 29 37.447 25.899 20.880
221 HG21 VAL 29 HG21 VAL 29 35.356 29.378 19.500
222 HG22 VAL 29 HG22 VAL 29 35.121 27.813 18.701
223 HG23 VAL 29 HG23 VAL 29 34.497 28.064 20.343
224 HA PRO 30 HA PRO 30 39.243 32.106 21.407
225 HB2 PRO 30 HB2 PRO 30 41.629 31.813 20.132
226 HB3 PRO 30 HB3 PRO 30 41.342 31.150 21.776
227 HG2 PRO 30 HG2 PRO 30 41.158 29.687 19.121
228 HG3 PRO 30 HG3 PRO 30 42.049 29.191 20.594
229 HD2 PRO 30 HD2 PRO 30 39.544 28.278 20.001
230 HD3 PRO 30 HD3 PRO 30 40.065 28.547 21.682
231 H TYR 31 H TYR 31 40.047 33.724 19.728
232 HA TYR 31 HA TYR 31 38.330 33.631 17.353
233 HB2 TYR 31 HB2 TYR 31 40.285 35.707 18.397
234 HB3 TYR 31 HB3 TYR 31 39.374 35.875 16.902
235 HD1 TYR 31 HD1 TYR 31 39.003 35.592 20.613
236 HD2 TYR 31 HD2 TYR 31 37.050 36.466 16.877
237 HE1 TYR 31 HE1 TYR 31 37.002 36.400 21.840
238 HE2 TYR 31 HE2 TYR 31 35.075 37.320 18.115
239 HH TYR 31 HH TYR 31 34.172 37.789 20.162
240 H ASN 32 H ASN 32 39.028 33.831 15.250
241 HA ASN 32 HA ASN 32 41.642 32.552 14.560
242 HB2 ASN 32 HB2 ASN 32 39.102 32.673 12.914
243 HB3 ASN 32 HB3 ASN 32 40.527 31.701 12.563
244 HD21 ASN 32 HD21 ASN 32 37.527 29.947 14.271
245 HD22 ASN 32 HD22 ASN 32 37.559 31.184 13.021