Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
631395 | 6b9w RC | 30351 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 GLY 1 H1 GLY 1 14.255 22.595 13.450
2 H2 GLY 1 H2 GLY 1 14.956 23.758 12.521
3 H3 GLY 1 H3 GLY 1 14.676 24.028 14.127
4 HA2 GLY 1 HA2 GLY 1 16.243 22.280 14.715
5 HA3 GLY 1 HA3 GLY 1 16.558 22.073 12.981
6 H SER 2 H SER 2 17.499 23.644 15.777
7 HA SER 2 HA SER 2 18.237 26.256 14.933
8 HB2 SER 2 HB2 SER 2 18.122 25.592 17.276
9 HB3 SER 2 HB3 SER 2 19.424 24.415 17.041
10 HG SER 2 HG SER 2 19.546 27.227 17.157
11 H ALA 3 H ALA 3 20.237 27.205 14.331
12 HA ALA 3 HA ALA 3 22.067 25.642 12.692
13 HB1 ALA 3 HB1 ALA 3 22.237 28.476 13.823
14 HB2 ALA 3 HB2 ALA 3 23.280 27.786 12.568
15 HB3 ALA 3 HB3 ALA 3 21.552 28.014 12.244
16 H CYS 4 H CYS 4 21.830 26.320 16.100
17 HA CYS 4 HA CYS 4 24.060 24.532 16.634
18 HB2 CYS 4 HB2 CYS 4 25.306 26.565 16.520
19 HB3 CYS 4 HB3 CYS 4 24.132 27.417 17.525
20 H GLN 5 H GLN 5 22.682 23.108 17.545
21 HA GLN 5 HA GLN 5 20.729 23.757 19.591
22 HB2 GLN 5 HB2 GLN 5 22.147 21.127 18.970
23 HB3 GLN 5 HB3 GLN 5 20.792 21.357 20.085
24 HG2 GLN 5 HG2 GLN 5 19.378 22.182 18.261
25 HG3 GLN 5 HG3 GLN 5 20.671 21.872 17.092
26 HE21 GLN 5 HE21 GLN 5 18.276 18.982 17.056
27 HE22 GLN 5 HE22 GLN 5 18.166 20.711 16.752
28 H PHE 6 H PHE 6 21.036 24.222 21.701
29 HA PHE 6 HA PHE 6 23.612 24.826 22.620
30 HB2 PHE 6 HB2 PHE 6 22.583 25.308 24.781
31 HB3 PHE 6 HB3 PHE 6 21.669 25.985 23.450
32 HD1 PHE 6 HD1 PHE 6 19.331 25.560 23.265
33 HD2 PHE 6 HD2 PHE 6 21.748 23.088 25.845
34 HE1 PHE 6 HE1 PHE 6 17.296 24.449 24.128
35 HE2 PHE 6 HE2 PHE 6 19.725 21.901 26.616
36 HZ PHE 6 HZ PHE 6 17.474 22.604 25.790
37 H TRP 7 H TRP 7 21.834 21.753 23.123
38 HA TRP 7 HA TRP 7 23.217 20.826 25.345
39 HB2 TRP 7 HB2 TRP 7 22.452 18.681 24.850
40 HB3 TRP 7 HB3 TRP 7 21.228 19.773 24.232
41 HD1 TRP 7 HD1 TRP 7 21.038 19.940 21.561
42 HE1 TRP 7 HE1 TRP 7 21.827 18.478 19.612
43 HE3 TRP 7 HE3 TRP 7 24.317 16.946 24.099
44 HZ2 TRP 7 HZ2 TRP 7 23.638 16.266 19.207
45 HZ3 TRP 7 HZ3 TRP 7 25.572 15.175 22.899
46 HH2 TRP 7 HH2 TRP 7 25.245 14.823 20.464
47 H SER 8 H SER 8 24.319 20.646 21.951
48 HA SER 8 HA SER 8 26.589 18.978 22.471
49 HB2 SER 8 HB2 SER 8 25.672 19.249 20.242
50 HB3 SER 8 HB3 SER 8 26.107 20.966 20.242
51 HG SER 8 HG SER 8 27.626 19.527 19.175
52 H CYS 9 H CYS 9 26.238 22.559 22.355
53 HA CYS 9 HA CYS 9 28.977 23.139 23.111
54 HB2 CYS 9 HB2 CYS 9 26.381 24.692 23.115
55 HB3 CYS 9 HB3 CYS 9 27.843 25.345 23.863
56 H ASN 10 H ASN 10 25.965 22.648 25.004
57 HA ASN 10 HA ASN 10 26.928 23.314 27.561
58 HB2 ASN 10 HB2 ASN 10 24.555 22.888 26.980
59 HB3 ASN 10 HB3 ASN 10 24.910 21.185 26.739
60 HD21 ASN 10 HD21 ASN 10 24.432 20.441 30.113
61 HD22 ASN 10 HD22 ASN 10 24.634 19.834 28.481
62 H SER 11 H SER 11 26.829 19.996 26.105
63 HA SER 11 HA SER 11 28.363 18.759 28.137
64 HB2 SER 11 HB2 SER 11 28.108 18.092 25.179
65 HB3 SER 11 HB3 SER 11 28.854 17.043 26.411
66 HG SER 11 HG SER 11 26.976 16.392 26.865
67 H SER 12 H SER 12 29.431 20.562 25.256
68 HA SER 12 HA SER 12 32.234 19.906 25.462
69 HB2 SER 12 HB2 SER 12 30.971 22.363 24.178
70 HB3 SER 12 HB3 SER 12 32.599 21.724 23.901
71 HG SER 12 HG SER 12 30.093 20.600 23.193
72 H CYS 13 H CYS 13 30.277 22.538 26.889
73 HA CYS 13 HA CYS 13 32.568 23.853 28.095
74 HB2 CYS 13 HB2 CYS 13 29.556 24.038 28.489
75 HB3 CYS 13 HB3 CYS 13 30.726 25.083 29.311
76 H ILE 14 H ILE 14 29.938 21.719 29.442
77 HA ILE 14 HA ILE 14 30.982 21.646 32.045
78 HB ILE 14 HB ILE 14 29.477 19.445 30.597
79 HG12 ILE 14 HG12 ILE 14 28.321 21.479 32.534
80 HG13 ILE 14 HG13 ILE 14 28.364 21.839 30.821
81 HG21 ILE 14 HG21 ILE 14 30.065 20.090 33.497
82 HG22 ILE 14 HG22 ILE 14 28.843 18.881 33.019
83 HG23 ILE 14 HG23 ILE 14 30.545 18.613 32.630
84 HD11 ILE 14 HD11 ILE 14 26.934 19.460 32.060
85 HD12 ILE 14 HD12 ILE 14 26.202 20.924 31.420
86 HD13 ILE 14 HD13 ILE 14 27.052 19.798 30.321
87 H SER 15 H SER 15 31.921 19.504 29.310
88 HA SER 15 HA SER 15 33.787 17.919 30.790
89 HB2 SER 15 HB2 SER 15 34.774 17.456 28.540
90 HB3 SER 15 HB3 SER 15 33.029 17.169 28.657
91 HG SER 15 HG SER 15 32.646 18.734 27.343
92 H ARG 16 H ARG 16 34.110 21.202 29.617
93 HA ARG 16 HA ARG 16 37.037 21.313 30.134
94 HB2 ARG 16 HB2 ARG 16 34.997 23.496 29.481
95 HB3 ARG 16 HB3 ARG 16 36.717 23.786 29.755
96 HG2 ARG 16 HG2 ARG 16 37.324 22.368 27.865
97 HG3 ARG 16 HG3 ARG 16 35.637 21.853 27.704
98 HD2 ARG 16 HD2 ARG 16 36.337 23.488 25.970
99 HD3 ARG 16 HD3 ARG 16 34.925 23.970 26.915
100 HE ARG 16 HE ARG 16 37.331 25.089 28.080
101 HH11 ARG 16 HH11 ARG 16 35.527 25.542 25.116
102 HH12 ARG 16 HH12 ARG 16 35.646 27.261 25.202
103 HH21 ARG 16 HH21 ARG 16 37.575 27.267 28.039
104 HH22 ARG 16 HH22 ARG 16 36.753 28.219 26.813
105 H GLY 17 H GLY 17 34.061 22.047 31.855
106 HA2 GLY 17 HA2 GLY 17 34.634 21.503 34.328
107 HA3 GLY 17 HA3 GLY 17 35.594 22.986 34.246
108 H TYR 18 H TYR 18 32.961 23.665 32.257
109 HA TYR 18 HA TYR 18 31.727 25.270 34.342
110 HB2 TYR 18 HB2 TYR 18 31.024 24.788 31.439
111 HB3 TYR 18 HB3 TYR 18 30.440 26.106 32.439
112 HD1 TYR 18 HD1 TYR 18 33.107 24.998 30.295
113 HD2 TYR 18 HD2 TYR 18 32.169 27.731 33.464
114 HE1 TYR 18 HE1 TYR 18 34.957 26.500 29.538
115 HE2 TYR 18 HE2 TYR 18 34.005 29.239 32.721
116 HH TYR 18 HH TYR 18 35.791 29.476 31.292
117 H ARG 19 H ARG 19 29.091 25.327 33.599
118 HA ARG 19 HA ARG 19 27.910 22.639 34.216
119 HB2 ARG 19 HB2 ARG 19 27.153 25.224 35.625
120 HB3 ARG 19 HB3 ARG 19 26.335 23.688 35.748
121 HG2 ARG 19 HG2 ARG 19 27.555 23.516 37.623
122 HG3 ARG 19 HG3 ARG 19 28.678 22.750 36.511
123 HD2 ARG 19 HD2 ARG 19 29.876 24.256 37.982
124 HD3 ARG 19 HD3 ARG 19 29.929 24.913 36.344
125 HE ARG 19 HE ARG 19 27.713 25.933 37.975
126 HH11 ARG 19 HH11 ARG 19 31.115 26.574 37.303
127 HH12 ARG 19 HH12 ARG 19 30.855 28.314 37.439
128 HH21 ARG 19 HH21 ARG 19 27.541 27.994 38.275
129 HH22 ARG 19 HH22 ARG 19 28.907 29.087 38.170
130 H GLN 20 H GLN 20 28.020 25.210 32.142
131 HA GLN 20 HA GLN 20 25.550 24.595 30.781
132 HB2 GLN 20 HB2 GLN 20 24.980 26.285 32.641
133 HB3 GLN 20 HB3 GLN 20 25.915 27.446 31.702
134 HG2 GLN 20 HG2 GLN 20 24.393 27.077 29.760
135 HG3 GLN 20 HG3 GLN 20 23.468 25.922 30.717
136 HE21 GLN 20 HE21 GLN 20 21.922 29.391 30.694
137 HE22 GLN 20 HE22 GLN 20 22.263 28.138 29.512
138 H GLY 21 H GLY 21 25.437 25.331 28.642
139 HA2 GLY 21 HA2 GLY 21 27.354 27.124 27.548
140 HA3 GLY 21 HA3 GLY 21 27.799 25.466 27.122
141 H TYR 22 H TYR 22 27.085 27.579 25.347
142 HA TYR 22 HA TYR 22 24.958 26.502 23.653
143 HB2 TYR 22 HB2 TYR 22 23.601 28.680 23.892
144 HB3 TYR 22 HB3 TYR 22 23.447 27.492 25.168
145 HD1 TYR 22 HD1 TYR 22 24.865 30.826 24.338
146 HD2 TYR 22 HD2 TYR 22 24.200 27.877 27.410
147 HE1 TYR 22 HE1 TYR 22 25.601 32.450 26.065
148 HE2 TYR 22 HE2 TYR 22 25.008 29.491 29.135
149 HH TYR 22 HH TYR 22 26.172 31.438 29.438
150 H CYS 23 H CYS 23 24.650 28.030 21.698
151 HA CYS 23 HA CYS 23 27.168 29.508 21.076
152 HB2 CYS 23 HB2 CYS 23 24.805 28.711 19.363
153 HB3 CYS 23 HB3 CYS 23 26.090 29.784 18.825
154 H TRP 24 H TRP 24 27.005 31.653 20.097
155 HA TRP 24 HA TRP 24 25.228 33.528 21.435
156 HB2 TRP 24 HB2 TRP 24 27.065 33.919 19.047
157 HB3 TRP 24 HB3 TRP 24 26.340 35.171 20.039
158 HD1 TRP 24 HD1 TRP 24 27.470 33.070 22.660
159 HE1 TRP 24 HE1 TRP 24 29.761 33.812 23.539
160 HE3 TRP 24 HE3 TRP 24 28.955 35.963 18.710
161 HZ2 TRP 24 HZ2 TRP 24 31.970 35.425 22.643
162 HZ3 TRP 24 HZ3 TRP 24 31.127 37.150 18.785
163 HH2 TRP 24 HH2 TRP 24 32.637 36.902 20.744
164 H GLY 25 H GLY 25 24.165 35.266 19.912
165 HA2 GLY 25 HA2 GLY 25 21.970 33.903 18.708
166 HA3 GLY 25 HA3 GLY 25 22.202 35.656 18.810
167 H ILE 26 H ILE 26 24.807 35.366 17.135
168 HA ILE 26 HA ILE 26 23.486 34.934 14.476
169 HB ILE 26 HB ILE 26 25.159 37.337 15.257
170 HG12 ILE 26 HG12 ILE 26 22.165 37.033 14.785
171 HG13 ILE 26 HG13 ILE 26 22.959 37.431 16.307
172 HG21 ILE 26 HG21 ILE 26 25.439 36.661 12.859
173 HG22 ILE 26 HG22 ILE 26 23.677 36.722 12.656
174 HG23 ILE 26 HG23 ILE 26 24.612 38.191 13.017
175 HD11 ILE 26 HD11 ILE 26 22.775 39.225 13.866
176 HD12 ILE 26 HD12 ILE 26 22.024 39.445 15.451
177 HD13 ILE 26 HD13 ILE 26 23.786 39.570 15.294
178 H GLN 27 H GLN 27 26.825 35.611 15.739
179 HA GLN 27 HA GLN 27 27.809 33.734 13.646
180 HB2 GLN 27 HB2 GLN 27 29.253 35.256 12.783
181 HB3 GLN 27 HB3 GLN 27 27.847 36.239 13.095
182 HG2 GLN 27 HG2 GLN 27 30.449 36.154 14.666
183 HG3 GLN 27 HG3 GLN 27 29.880 37.445 13.633
184 HE21 GLN 27 HE21 GLN 27 29.310 38.573 17.108
185 HE22 GLN 27 HE22 GLN 27 30.729 38.083 16.151
186 H TYR 28 H TYR 28 29.306 32.300 14.141
187 HA TYR 28 HA TYR 28 31.067 32.470 16.442
188 HB2 TYR 28 HB2 TYR 28 29.884 30.479 17.591
189 HB3 TYR 28 HB3 TYR 28 29.253 32.092 17.819
190 HD1 TYR 28 HD1 TYR 28 28.645 28.859 16.066
191 HD2 TYR 28 HD2 TYR 28 27.064 32.744 17.053
192 HE1 TYR 28 HE1 TYR 28 26.384 28.141 15.306
193 HE2 TYR 28 HE2 TYR 28 24.818 32.044 16.267
194 HH TYR 28 HH TYR 28 23.522 30.131 15.873
195 H LYS 29 H LYS 29 32.706 31.234 16.236
196 HA LYS 29 HA LYS 29 32.665 28.638 14.724
197 HB2 LYS 29 HB2 LYS 29 35.024 30.390 15.527
198 HB3 LYS 29 HB3 LYS 29 35.108 28.908 14.584
199 HG2 LYS 29 HG2 LYS 29 33.734 31.488 13.722
200 HG3 LYS 29 HG3 LYS 29 35.318 30.956 13.197
201 HD2 LYS 29 HD2 LYS 29 34.432 29.178 11.874
202 HD3 LYS 29 HD3 LYS 29 32.862 29.249 12.675
203 HE2 LYS 29 HE2 LYS 29 32.602 30.253 10.522
204 HE3 LYS 29 HE3 LYS 29 32.423 31.469 11.791
205 HZ1 LYS 29 HZ1 LYS 29 33.772 32.352 10.031
206 HZ2 LYS 29 HZ2 LYS 29 34.706 32.188 11.324
207 HZ3 LYS 29 HZ3 LYS 29 34.828 31.075 10.089
208 H TYR 30 H TYR 30 32.893 30.070 17.836
209 HA TYR 30 HA TYR 30 33.440 27.434 19.113
210 HB2 TYR 30 HB2 TYR 30 34.420 30.124 20.099
211 HB3 TYR 30 HB3 TYR 30 34.822 28.548 20.742
212 HD1 TYR 30 HD1 TYR 30 36.012 26.884 18.932
213 HD2 TYR 30 HD2 TYR 30 35.993 31.195 18.760
214 HE1 TYR 30 HE1 TYR 30 38.142 26.851 17.631
215 HE2 TYR 30 HE2 TYR 30 38.102 31.156 17.454
216 HH TYR 30 HH TYR 30 39.861 28.120 16.746
217 H CYS 31 H CYS 31 32.569 27.238 21.298
218 HA CYS 31 HA CYS 31 29.857 28.334 21.461
219 HB2 CYS 31 HB2 CYS 31 31.440 26.444 23.235
220 HB3 CYS 31 HB3 CYS 31 29.742 26.802 23.456
221 H GLN 32 H GLN 32 28.967 29.066 23.561
222 HA GLN 32 HA GLN 32 30.818 30.659 25.264
223 HB2 GLN 32 HB2 GLN 32 29.067 31.980 24.241
224 HB3 GLN 32 HB3 GLN 32 27.816 30.893 24.848
225 HG2 GLN 32 HG2 GLN 32 28.204 31.511 27.135
226 HG3 GLN 32 HG3 GLN 32 29.735 32.276 26.733
227 HE21 GLN 32 HE21 GLN 32 27.385 35.055 27.269
228 HE22 GLN 32 HE22 GLN 32 28.014 33.726 28.264
229 H CYS 33 H CYS 33 30.884 30.180 27.421
230 HA CYS 33 HA CYS 33 29.411 27.758 28.486
231 HB2 CYS 33 HB2 CYS 33 32.294 28.637 28.983
232 HB3 CYS 33 HB3 CYS 33 31.449 27.231 29.647
233 H GLN 34 H GLN 34 29.126 27.694 30.664
234 HA GLN 34 HA GLN 34 27.705 28.581 32.172
235 HB2 GLN 34 HB2 GLN 34 30.115 28.488 33.049
236 HB3 GLN 34 HB3 GLN 34 30.117 30.250 32.960
237 HG2 GLN 34 HG2 GLN 34 29.507 29.469 35.216
238 HG3 GLN 34 HG3 GLN 34 28.145 30.290 34.458
239 HE21 GLN 34 HE21 GLN 34 26.178 27.488 35.465
240 HE22 GLN 34 HE22 GLN 34 26.497 29.220 35.638
Start of MODEL 2
1 H1 GLY 1 H1 GLY 1 28.338 17.598 11.312
2 H2 GLY 1 H2 GLY 1 29.401 18.682 11.976
3 H3 GLY 1 H3 GLY 1 28.664 19.012 10.538
4 HA2 GLY 1 HA2 GLY 1 26.515 19.121 11.568
5 HA3 GLY 1 HA3 GLY 1 27.272 18.722 13.118
6 H SER 2 H SER 2 27.230 21.129 10.484
7 HA SER 2 HA SER 2 29.021 22.940 11.822
8 HB2 SER 2 HB2 SER 2 27.155 23.462 9.482
9 HB3 SER 2 HB3 SER 2 28.628 24.372 9.923
10 HG SER 2 HG SER 2 29.101 22.918 8.308
11 H ALA 3 H ALA 3 25.455 22.825 11.635
12 HA ALA 3 HA ALA 3 24.979 25.400 12.786
13 HB1 ALA 3 HB1 ALA 3 22.702 24.540 13.144
14 HB2 ALA 3 HB2 ALA 3 23.302 24.143 11.523
15 HB3 ALA 3 HB3 ALA 3 23.257 22.889 12.789
16 H CYS 4 H CYS 4 24.452 26.048 14.888
17 HA CYS 4 HA CYS 4 25.691 24.450 17.028
18 HB2 CYS 4 HB2 CYS 4 25.787 26.430 18.310
19 HB3 CYS 4 HB3 CYS 4 26.321 26.791 16.683
20 H GLN 5 H GLN 5 24.649 23.481 18.655
21 HA GLN 5 HA GLN 5 21.877 24.247 19.351
22 HB2 GLN 5 HB2 GLN 5 22.801 21.376 18.893
23 HB3 GLN 5 HB3 GLN 5 21.343 21.834 19.778
24 HG2 GLN 5 HG2 GLN 5 20.279 22.779 17.904
25 HG3 GLN 5 HG3 GLN 5 21.737 22.689 16.911
26 HE21 GLN 5 HE21 GLN 5 19.649 19.922 15.734
27 HE22 GLN 5 HE22 GLN 5 19.556 21.688 15.762
28 H PHE 6 H PHE 6 21.658 24.472 21.533
29 HA PHE 6 HA PHE 6 23.838 24.789 23.120
30 HB2 PHE 6 HB2 PHE 6 22.445 25.121 24.974
31 HB3 PHE 6 HB3 PHE 6 21.471 25.550 23.607
32 HD1 PHE 6 HD1 PHE 6 19.666 23.971 22.757
33 HD2 PHE 6 HD2 PHE 6 21.779 23.310 26.462
34 HE1 PHE 6 HE1 PHE 6 17.970 22.284 23.424
35 HE2 PHE 6 HE2 PHE 6 20.075 21.630 27.130
36 HZ PHE 6 HZ PHE 6 18.179 21.105 25.604
37 H TRP 7 H TRP 7 21.897 21.776 23.194
38 HA TRP 7 HA TRP 7 23.110 20.473 25.273
39 HB2 TRP 7 HB2 TRP 7 22.155 18.488 24.434
40 HB3 TRP 7 HB3 TRP 7 21.081 19.800 23.959
41 HD1 TRP 7 HD1 TRP 7 20.962 20.376 21.355
42 HE1 TRP 7 HE1 TRP 7 21.678 19.131 19.215
43 HE3 TRP 7 HE3 TRP 7 23.946 16.785 23.448
44 HZ2 TRP 7 HZ2 TRP 7 23.180 16.779 18.522
45 HZ3 TRP 7 HZ3 TRP 7 25.021 15.060 22.027
46 HH2 TRP 7 HH2 TRP 7 24.616 15.029 19.578
47 H SER 8 H SER 8 24.254 20.406 21.908
48 HA SER 8 HA SER 8 26.338 18.491 22.266
49 HB2 SER 8 HB2 SER 8 25.294 18.893 20.133
50 HB3 SER 8 HB3 SER 8 25.826 20.582 20.130
51 HG SER 8 HG SER 8 27.536 18.296 20.145
52 H CYS 9 H CYS 9 26.194 21.943 22.753
53 HA CYS 9 HA CYS 9 29.117 22.254 23.182
54 HB2 CYS 9 HB2 CYS 9 26.749 24.157 23.165
55 HB3 CYS 9 HB3 CYS 9 28.404 24.626 23.614
56 H ASN 10 H ASN 10 26.086 22.078 25.023
57 HA ASN 10 HA ASN 10 26.971 23.012 27.507
58 HB2 ASN 10 HB2 ASN 10 24.632 22.691 26.759
59 HB3 ASN 10 HB3 ASN 10 24.841 20.937 26.819
60 HD21 ASN 10 HD21 ASN 10 23.638 21.044 30.101
61 HD22 ASN 10 HD22 ASN 10 23.869 20.104 28.619
62 H SER 11 H SER 11 26.722 19.524 26.503
63 HA SER 11 HA SER 11 28.097 18.532 28.805
64 HB2 SER 11 HB2 SER 11 27.896 17.360 26.010
65 HB3 SER 11 HB3 SER 11 28.526 16.502 27.435
66 HG SER 11 HG SER 11 26.568 16.691 28.434
67 H SER 12 H SER 12 29.421 19.803 25.745
68 HA SER 12 HA SER 12 32.158 19.044 26.241
69 HB2 SER 12 HB2 SER 12 31.377 19.716 24.007
70 HB3 SER 12 HB3 SER 12 31.052 21.351 24.595
71 HG SER 12 HG SER 12 33.400 20.219 23.820
72 H CYS 13 H CYS 13 30.506 22.243 26.750
73 HA CYS 13 HA CYS 13 32.546 23.539 28.130
74 HB2 CYS 13 HB2 CYS 13 29.515 23.705 28.366
75 HB3 CYS 13 HB3 CYS 13 30.608 24.843 29.126
76 H ILE 14 H ILE 14 29.842 21.618 29.652
77 HA ILE 14 HA ILE 14 30.833 21.868 32.284
78 HB ILE 14 HB ILE 14 29.346 19.477 31.137
79 HG12 ILE 14 HG12 ILE 14 28.035 21.702 32.714
80 HG13 ILE 14 HG13 ILE 14 28.225 21.924 30.991
81 HG21 ILE 14 HG21 ILE 14 29.871 20.604 33.914
82 HG22 ILE 14 HG22 ILE 14 28.651 19.335 33.609
83 HG23 ILE 14 HG23 ILE 14 30.360 19.010 33.304
84 HD11 ILE 14 HD11 ILE 14 26.741 19.616 32.316
85 HD12 ILE 14 HD12 ILE 14 26.023 21.013 31.497
86 HD13 ILE 14 HD13 ILE 14 26.961 19.830 30.566
87 H SER 15 H SER 15 31.717 19.436 29.796
88 HA SER 15 HA SER 15 33.556 18.012 31.497
89 HB2 SER 15 HB2 SER 15 33.537 18.087 28.466
90 HB3 SER 15 HB3 SER 15 34.300 16.874 29.513
91 HG SER 15 HG SER 15 31.567 17.443 29.091
92 H ARG 16 H ARG 16 33.903 21.065 29.920
93 HA ARG 16 HA ARG 16 36.870 21.095 30.146
94 HB2 ARG 16 HB2 ARG 16 34.854 23.227 29.314
95 HB3 ARG 16 HB3 ARG 16 36.605 23.470 29.374
96 HG2 ARG 16 HG2 ARG 16 36.983 21.759 27.704
97 HG3 ARG 16 HG3 ARG 16 35.292 21.256 27.791
98 HD2 ARG 16 HD2 ARG 16 35.701 22.517 25.748
99 HD3 ARG 16 HD3 ARG 16 34.529 23.316 26.806
100 HE ARG 16 HE ARG 16 37.344 24.212 27.060
101 HH11 ARG 16 HH11 ARG 16 34.398 24.805 25.229
102 HH12 ARG 16 HH12 ARG 16 34.750 26.510 25.076
103 HH21 ARG 16 HH21 ARG 16 37.642 26.353 26.952
104 HH22 ARG 16 HH22 ARG 16 36.481 27.379 26.103
105 H GLY 17 H GLY 17 34.102 22.056 32.024
106 HA2 GLY 17 HA2 GLY 17 34.908 21.919 34.475
107 HA3 GLY 17 HA3 GLY 17 35.813 23.385 34.083
108 H TYR 18 H TYR 18 33.010 23.669 32.279
109 HA TYR 18 HA TYR 18 31.937 25.627 34.167
110 HB2 TYR 18 HB2 TYR 18 31.216 24.857 31.326
111 HB3 TYR 18 HB3 TYR 18 30.700 26.301 32.153
112 HD1 TYR 18 HD1 TYR 18 32.743 27.712 33.267
113 HD2 TYR 18 HD2 TYR 18 33.137 24.984 29.981
114 HE1 TYR 18 HE1 TYR 18 34.721 28.986 32.464
115 HE2 TYR 18 HE2 TYR 18 35.146 26.257 29.162
116 HH TYR 18 HH TYR 18 36.236 29.248 30.813
117 H ARG 19 H ARG 19 29.276 25.741 33.338
118 HA ARG 19 HA ARG 19 27.981 23.174 34.155
119 HB2 ARG 19 HB2 ARG 19 27.358 25.866 35.395
120 HB3 ARG 19 HB3 ARG 19 26.313 24.461 35.481
121 HG2 ARG 19 HG2 ARG 19 27.341 23.989 37.396
122 HG3 ARG 19 HG3 ARG 19 28.586 23.296 36.376
123 HD2 ARG 19 HD2 ARG 19 29.699 24.634 37.966
124 HD3 ARG 19 HD3 ARG 19 29.763 25.583 36.467
125 HE ARG 19 HE ARG 19 27.460 26.483 37.721
126 HH11 ARG 19 HH11 ARG 19 30.831 26.380 38.797
127 HH12 ARG 19 HH12 ARG 19 30.559 27.793 39.813
128 HH21 ARG 19 HH21 ARG 19 27.198 27.969 39.263
129 HH22 ARG 19 HH22 ARG 19 28.527 28.413 40.312
130 H GLN 20 H GLN 20 28.183 25.516 31.808
131 HA GLN 20 HA GLN 20 25.634 24.804 30.607
132 HB2 GLN 20 HB2 GLN 20 25.425 26.901 32.265
133 HB3 GLN 20 HB3 GLN 20 26.149 27.746 30.905
134 HG2 GLN 20 HG2 GLN 20 23.813 28.005 30.638
135 HG3 GLN 20 HG3 GLN 20 24.241 26.769 29.467
136 HE21 GLN 20 HE21 GLN 20 21.739 24.652 30.844
137 HE22 GLN 20 HE22 GLN 20 22.612 25.219 29.429
138 H GLY 21 H GLY 21 25.473 25.409 28.384
139 HA2 GLY 21 HA2 GLY 21 27.577 26.866 27.068
140 HA3 GLY 21 HA3 GLY 21 27.655 25.150 26.677
141 H TYR 22 H TYR 22 27.004 27.606 25.038
142 HA TYR 22 HA TYR 22 24.629 26.709 23.552
143 HB2 TYR 22 HB2 TYR 22 23.521 29.032 24.053
144 HB3 TYR 22 HB3 TYR 22 23.349 27.720 25.192
145 HD1 TYR 22 HD1 TYR 22 25.696 30.597 24.495
146 HD2 TYR 22 HD2 TYR 22 23.730 28.117 27.410
147 HE1 TYR 22 HE1 TYR 22 26.814 31.878 26.314
148 HE2 TYR 22 HE2 TYR 22 24.833 29.457 29.257
149 HH TYR 22 HH TYR 22 26.514 30.974 29.730
150 H CYS 23 H CYS 23 23.983 28.327 21.874
151 HA CYS 23 HA CYS 23 26.141 29.236 20.226
152 HB2 CYS 23 HB2 CYS 23 23.227 30.075 20.289
153 HB3 CYS 23 HB3 CYS 23 24.314 30.300 18.941
154 H TRP 24 H TRP 24 26.813 31.352 19.688
155 HA TRP 24 HA TRP 24 26.503 33.518 21.683
156 HB2 TRP 24 HB2 TRP 24 28.006 33.165 19.087
157 HB3 TRP 24 HB3 TRP 24 27.668 34.779 19.654
158 HD1 TRP 24 HD1 TRP 24 30.273 32.364 19.817
159 HE1 TRP 24 HE1 TRP 24 31.943 32.807 21.688
160 HE3 TRP 24 HE3 TRP 24 27.536 35.738 22.537
161 HZ2 TRP 24 HZ2 TRP 24 32.130 34.505 24.024
162 HZ3 TRP 24 HZ3 TRP 24 28.501 36.767 24.577
163 HH2 TRP 24 HH2 TRP 24 30.788 36.159 25.337
164 H GLY 25 H GLY 25 25.704 35.717 20.925
165 HA2 GLY 25 HA2 GLY 25 23.052 35.476 19.860
166 HA3 GLY 25 HA3 GLY 25 23.923 36.981 20.197
167 H ILE 26 H ILE 26 26.071 36.793 18.437
168 HA ILE 26 HA ILE 26 25.080 36.209 15.716
169 HB ILE 26 HB ILE 26 25.720 38.350 14.808
170 HG12 ILE 26 HG12 ILE 26 26.121 39.278 17.670
171 HG13 ILE 26 HG13 ILE 26 27.383 39.027 16.456
172 HG21 ILE 26 HG21 ILE 26 23.362 37.891 15.417
173 HG22 ILE 26 HG22 ILE 26 23.623 38.759 16.946
174 HG23 ILE 26 HG23 ILE 26 23.771 39.608 15.399
175 HD11 ILE 26 HD11 ILE 26 25.222 41.145 16.430
176 HD12 ILE 26 HD12 ILE 26 26.979 41.366 16.517
177 HD13 ILE 26 HD13 ILE 26 26.245 40.777 15.017
178 H GLN 27 H GLN 27 27.836 36.519 17.862
179 HA GLN 27 HA GLN 27 29.747 36.253 15.613
180 HB2 GLN 27 HB2 GLN 27 30.239 36.446 18.608
181 HB3 GLN 27 HB3 GLN 27 31.469 36.357 17.340
182 HG2 GLN 27 HG2 GLN 27 30.154 38.438 16.350
183 HG3 GLN 27 HG3 GLN 27 29.641 38.654 18.020
184 HE21 GLN 27 HE21 GLN 27 32.952 40.416 17.084
185 HE22 GLN 27 HE22 GLN 27 31.396 40.309 16.270
186 H TYR 28 H TYR 28 28.481 34.215 15.095
187 HA TYR 28 HA TYR 28 28.632 31.911 16.706
188 HB2 TYR 28 HB2 TYR 28 28.196 31.940 13.715
189 HB3 TYR 28 HB3 TYR 28 27.598 30.777 14.884
190 HD1 TYR 28 HD1 TYR 28 26.802 33.686 12.999
191 HD2 TYR 28 HD2 TYR 28 25.943 31.710 16.740
192 HE1 TYR 28 HE1 TYR 28 24.660 34.934 13.169
193 HE2 TYR 28 HE2 TYR 28 23.788 32.947 16.886
194 HH TYR 28 HH TYR 28 22.809 35.050 16.004
195 H LYS 29 H LYS 29 31.423 32.851 16.227
196 HA LYS 29 HA LYS 29 32.857 31.114 14.441
197 HB2 LYS 29 HB2 LYS 29 33.628 32.590 16.992
198 HB3 LYS 29 HB3 LYS 29 34.790 31.607 16.092
199 HG2 LYS 29 HG2 LYS 29 34.445 32.936 14.072
200 HG3 LYS 29 HG3 LYS 29 33.242 33.939 14.890
201 HD2 LYS 29 HD2 LYS 29 36.151 33.707 15.781
202 HD3 LYS 29 HD3 LYS 29 35.548 34.947 14.671
203 HE2 LYS 29 HE2 LYS 29 33.953 35.746 16.389
204 HE3 LYS 29 HE3 LYS 29 34.570 34.533 17.532
205 HZ1 LYS 29 HZ1 LYS 29 36.722 35.591 17.443
206 HZ2 LYS 29 HZ2 LYS 29 36.253 36.656 16.306
207 HZ3 LYS 29 HZ3 LYS 29 35.606 36.739 17.820
208 H TYR 30 H TYR 30 31.788 30.625 17.737
209 HA TYR 30 HA TYR 30 31.444 27.844 17.453
210 HB2 TYR 30 HB2 TYR 30 33.907 27.751 17.837
211 HB3 TYR 30 HB3 TYR 30 33.714 28.696 19.305
212 HD1 TYR 30 HD1 TYR 30 31.856 25.656 17.955
213 HD2 TYR 30 HD2 TYR 30 34.320 27.317 21.087
214 HE1 TYR 30 HE1 TYR 30 31.567 23.581 19.287
215 HE2 TYR 30 HE2 TYR 30 34.049 25.231 22.403
216 HH TYR 30 HH TYR 30 31.878 22.579 21.361
217 H CYS 31 H CYS 31 30.930 27.039 19.982
218 HA CYS 31 HA CYS 31 28.856 28.798 21.028
219 HB2 CYS 31 HB2 CYS 31 30.104 26.173 21.865
220 HB3 CYS 31 HB3 CYS 31 28.901 26.978 22.861
221 H GLN 32 H GLN 32 28.686 29.352 23.259
222 HA GLN 32 HA GLN 32 31.211 30.119 24.649
223 HB2 GLN 32 HB2 GLN 32 29.966 32.085 24.053
224 HB3 GLN 32 HB3 GLN 32 28.458 31.393 24.608
225 HG2 GLN 32 HG2 GLN 32 29.169 33.125 26.114
226 HG3 GLN 32 HG3 GLN 32 29.192 31.589 26.962
227 HE21 GLN 32 HE21 GLN 32 32.329 33.573 27.758
228 HE22 GLN 32 HE22 GLN 32 30.633 33.989 27.845
229 H CYS 33 H CYS 33 31.342 29.663 26.850
230 HA CYS 33 HA CYS 33 29.496 27.562 28.005
231 HB2 CYS 33 HB2 CYS 33 32.406 28.176 28.609
232 HB3 CYS 33 HB3 CYS 33 31.416 26.896 29.281
233 H GLN 34 H GLN 34 29.372 27.586 30.315
234 HA GLN 34 HA GLN 34 28.306 28.514 32.035
235 HB2 GLN 34 HB2 GLN 34 30.740 28.432 32.558
236 HB3 GLN 34 HB3 GLN 34 30.900 30.110 32.077
237 HG2 GLN 34 HG2 GLN 34 30.845 29.937 34.465
238 HG3 GLN 34 HG3 GLN 34 29.386 30.762 33.917
239 HE21 GLN 34 HE21 GLN 34 28.134 28.528 36.500
240 HE22 GLN 34 HE22 GLN 34 29.129 29.985 36.393
Start of MODEL 3
1 H1 GLY 1 H1 GLY 1 16.505 26.669 8.719
2 H2 GLY 1 H2 GLY 1 18.045 26.183 9.083
3 H3 GLY 1 H3 GLY 1 17.645 27.771 9.144
4 HA2 GLY 1 HA2 GLY 1 16.105 27.356 10.961
5 HA3 GLY 1 HA3 GLY 1 16.637 25.659 10.931
6 H SER 2 H SER 2 17.496 25.757 13.067
7 HA SER 2 HA SER 2 19.579 27.654 13.767
8 HB2 SER 2 HB2 SER 2 18.954 25.003 15.092
9 HB3 SER 2 HB3 SER 2 19.803 26.395 15.790
10 HG SER 2 HG SER 2 17.812 26.701 16.523
11 H ALA 3 H ALA 3 21.757 27.521 13.477
12 HA ALA 3 HA ALA 3 22.998 25.195 12.173
13 HB1 ALA 3 HB1 ALA 3 25.020 26.605 12.280
14 HB2 ALA 3 HB2 ALA 3 23.645 27.514 11.626
15 HB3 ALA 3 HB3 ALA 3 24.170 27.779 13.305
16 H CYS 4 H CYS 4 22.487 26.263 15.414
17 HA CYS 4 HA CYS 4 24.146 24.134 16.643
18 HB2 CYS 4 HB2 CYS 4 25.530 26.126 16.511
19 HB3 CYS 4 HB3 CYS 4 24.250 27.130 17.171
20 H GLN 5 H GLN 5 23.329 23.436 18.672
21 HA GLN 5 HA GLN 5 20.873 24.745 19.770
22 HB2 GLN 5 HB2 GLN 5 21.396 21.766 19.487
23 HB3 GLN 5 HB3 GLN 5 20.024 22.469 20.329
24 HG2 GLN 5 HG2 GLN 5 20.588 22.799 17.345
25 HG3 GLN 5 HG3 GLN 5 19.525 21.584 18.038
26 HE21 GLN 5 HE21 GLN 5 17.161 24.070 17.007
27 HE22 GLN 5 HE22 GLN 5 18.256 22.890 16.261
28 H PHE 6 H PHE 6 20.732 24.814 22.023
29 HA PHE 6 HA PHE 6 23.096 25.024 23.398
30 HB2 PHE 6 HB2 PHE 6 21.858 25.311 25.422
31 HB3 PHE 6 HB3 PHE 6 20.948 26.020 24.118
32 HD1 PHE 6 HD1 PHE 6 18.754 25.144 23.472
33 HD2 PHE 6 HD2 PHE 6 21.108 23.155 26.490
34 HE1 PHE 6 HE1 PHE 6 16.826 23.689 24.026
35 HE2 PHE 6 HE2 PHE 6 19.197 21.652 26.978
36 HZ PHE 6 HZ PHE 6 17.058 21.911 25.748
37 H TRP 7 H TRP 7 21.152 21.985 23.333
38 HA TRP 7 HA TRP 7 22.541 20.641 25.382
39 HB2 TRP 7 HB2 TRP 7 21.728 18.646 24.552
40 HB3 TRP 7 HB3 TRP 7 20.453 19.833 24.260
41 HD1 TRP 7 HD1 TRP 7 20.031 20.459 21.671
42 HE1 TRP 7 HE1 TRP 7 20.731 19.390 19.415
43 HE3 TRP 7 HE3 TRP 7 23.364 16.991 23.391
44 HZ2 TRP 7 HZ2 TRP 7 22.626 17.449 18.491
45 HZ3 TRP 7 HZ3 TRP 7 24.697 15.627 21.799
46 HH2 TRP 7 HH2 TRP 7 24.371 15.879 19.351
47 H SER 8 H SER 8 23.459 21.081 21.998
48 HA SER 8 HA SER 8 25.662 19.211 21.970
49 HB2 SER 8 HB2 SER 8 24.494 20.024 19.943
50 HB3 SER 8 HB3 SER 8 25.133 21.651 20.232
51 HG SER 8 HG SER 8 26.324 19.469 19.127
52 H CYS 9 H CYS 9 25.344 22.714 22.636
53 HA CYS 9 HA CYS 9 28.173 23.084 23.172
54 HB2 CYS 9 HB2 CYS 9 25.665 24.746 23.542
55 HB3 CYS 9 HB3 CYS 9 27.219 25.274 24.186
56 H ASN 10 H ASN 10 25.409 22.318 25.267
57 HA ASN 10 HA ASN 10 26.536 23.038 27.718
58 HB2 ASN 10 HB2 ASN 10 24.190 22.465 27.329
59 HB3 ASN 10 HB3 ASN 10 24.610 20.753 27.116
60 HD21 ASN 10 HD21 ASN 10 24.544 20.217 30.634
61 HD22 ASN 10 HD22 ASN 10 24.494 19.501 29.043
62 H SER 11 H SER 11 26.713 19.738 26.229
63 HA SER 11 HA SER 11 28.444 18.717 28.268
64 HB2 SER 11 HB2 SER 11 28.908 16.878 26.736
65 HB3 SER 11 HB3 SER 11 27.178 17.265 26.751
66 HG SER 11 HG SER 11 27.345 17.513 24.711
67 H SER 12 H SER 12 29.226 20.430 25.250
68 HA SER 12 HA SER 12 32.072 20.013 25.305
69 HB2 SER 12 HB2 SER 12 31.081 20.803 23.273
70 HB3 SER 12 HB3 SER 12 30.359 22.202 24.083
71 HG SER 12 HG SER 12 33.147 21.702 23.703
72 H CYS 13 H CYS 13 30.126 22.839 26.478
73 HA CYS 13 HA CYS 13 32.309 24.185 27.686
74 HB2 CYS 13 HB2 CYS 13 29.340 24.115 28.300
75 HB3 CYS 13 HB3 CYS 13 30.467 25.202 29.107
76 H ILE 14 H ILE 14 30.012 21.826 29.265
77 HA ILE 14 HA ILE 14 31.404 21.850 31.730
78 HB ILE 14 HB ILE 14 29.817 19.571 30.499
79 HG12 ILE 14 HG12 ILE 14 28.903 21.558 32.618
80 HG13 ILE 14 HG13 ILE 14 28.652 21.907 30.919
81 HG21 ILE 14 HG21 ILE 14 30.917 20.205 33.264
82 HG22 ILE 14 HG22 ILE 14 29.640 18.982 33.014
83 HG23 ILE 14 HG23 ILE 14 31.234 18.758 32.281
84 HD11 ILE 14 HD11 ILE 14 26.644 20.938 31.803
85 HD12 ILE 14 HD12 ILE 14 27.368 19.788 30.663
86 HD13 ILE 14 HD13 ILE 14 27.512 19.521 32.416
87 H SER 15 H SER 15 32.158 19.897 28.799
88 HA SER 15 HA SER 15 34.271 18.376 29.976
89 HB2 SER 15 HB2 SER 15 33.284 17.852 27.777
90 HB3 SER 15 HB3 SER 15 33.970 19.341 27.101
91 HG SER 15 HG SER 15 35.355 17.133 28.218
92 H ARG 16 H ARG 16 34.202 21.665 28.727
93 HA ARG 16 HA ARG 16 37.107 22.145 28.938
94 HB2 ARG 16 HB2 ARG 16 34.773 24.067 28.574
95 HB3 ARG 16 HB3 ARG 16 36.478 24.514 28.497
96 HG2 ARG 16 HG2 ARG 16 36.823 23.141 26.528
97 HG3 ARG 16 HG3 ARG 16 35.236 22.402 26.719
98 HD2 ARG 16 HD2 ARG 16 35.221 24.020 24.881
99 HD3 ARG 16 HD3 ARG 16 34.101 24.476 26.176
100 HE ARG 16 HE ARG 16 36.728 25.696 26.501
101 HH11 ARG 16 HH11 ARG 16 33.833 26.249 24.507
102 HH12 ARG 16 HH12 ARG 16 33.950 27.978 24.836
103 HH21 ARG 16 HH21 ARG 16 36.911 27.745 26.532
104 HH22 ARG 16 HH22 ARG 16 35.844 28.806 25.624
105 H GLY 17 H GLY 17 34.520 22.118 31.192
106 HA2 GLY 17 HA2 GLY 17 35.338 21.713 33.476
107 HA3 GLY 17 HA3 GLY 17 36.356 23.146 33.329
108 H TYR 18 H TYR 18 33.370 23.726 31.770
109 HA TYR 18 HA TYR 18 32.450 25.426 33.939
110 HB2 TYR 18 HB2 TYR 18 31.435 24.827 31.148
111 HB3 TYR 18 HB3 TYR 18 30.742 26.016 32.196
112 HD1 TYR 18 HD1 TYR 18 31.919 28.043 32.885
113 HD2 TYR 18 HD2 TYR 18 33.654 25.259 30.116
114 HE1 TYR 18 HE1 TYR 18 33.481 29.795 32.130
115 HE2 TYR 18 HE2 TYR 18 35.225 27.044 29.302
116 HH TYR 18 HH TYR 18 35.090 30.354 30.708
117 H ARG 19 H ARG 19 29.749 25.339 33.578
118 HA ARG 19 HA ARG 19 28.760 22.655 34.460
119 HB2 ARG 19 HB2 ARG 19 28.265 25.274 35.925
120 HB3 ARG 19 HB3 ARG 19 27.276 23.835 36.111
121 HG2 ARG 19 HG2 ARG 19 28.641 23.409 37.843
122 HG3 ARG 19 HG3 ARG 19 29.605 22.635 36.596
123 HD2 ARG 19 HD2 ARG 19 31.090 23.905 37.932
124 HD3 ARG 19 HD3 ARG 19 30.941 24.808 36.424
125 HE ARG 19 HE ARG 19 29.133 26.165 37.745
126 HH11 ARG 19 HH11 ARG 19 32.137 25.073 39.232
127 HH12 ARG 19 HH12 ARG 19 31.886 26.150 40.594
128 HH21 ARG 19 HH21 ARG 19 29.075 27.594 39.275
129 HH22 ARG 19 HH22 ARG 19 30.447 27.822 40.356
130 H GLN 20 H GLN 20 28.452 25.083 32.227
131 HA GLN 20 HA GLN 20 25.984 24.128 31.210
132 HB2 GLN 20 HB2 GLN 20 25.443 25.989 33.114
133 HB3 GLN 20 HB3 GLN 20 25.808 27.074 31.764
134 HG2 GLN 20 HG2 GLN 20 24.138 25.548 30.428
135 HG3 GLN 20 HG3 GLN 20 23.641 24.946 31.999
136 HE21 GLN 20 HE21 GLN 20 21.400 27.742 30.817
137 HE22 GLN 20 HE22 GLN 20 22.008 26.286 30.050
138 H GLY 21 H GLY 21 25.414 25.108 29.142
139 HA2 GLY 21 HA2 GLY 21 27.316 26.754 27.774
140 HA3 GLY 21 HA3 GLY 21 27.459 25.063 27.296
141 H TYR 22 H TYR 22 26.601 27.465 25.835
142 HA TYR 22 HA TYR 22 24.194 26.511 24.475
143 HB2 TYR 22 HB2 TYR 22 23.140 28.876 24.968
144 HB3 TYR 22 HB3 TYR 22 22.953 27.514 26.060
145 HD1 TYR 22 HD1 TYR 22 25.036 30.583 25.579
146 HD2 TYR 22 HD2 TYR 22 23.468 27.663 28.312
147 HE1 TYR 22 HE1 TYR 22 25.970 31.886 27.494
148 HE2 TYR 22 HE2 TYR 22 24.439 28.958 30.241
149 HH TYR 22 HH TYR 22 26.427 31.887 29.719
150 H CYS 23 H CYS 23 23.591 28.176 22.684
151 HA CYS 23 HA CYS 23 26.097 28.535 21.188
152 HB2 CYS 23 HB2 CYS 23 23.209 28.868 20.333
153 HB3 CYS 23 HB3 CYS 23 24.605 28.747 19.266
154 H TRP 24 H TRP 24 26.841 30.397 20.237
155 HA TRP 24 HA TRP 24 25.885 33.058 21.112
156 HB2 TRP 24 HB2 TRP 24 27.988 32.162 19.121
157 HB3 TRP 24 HB3 TRP 24 27.681 33.832 19.547
158 HD1 TRP 24 HD1 TRP 24 29.566 30.814 20.577
159 HE1 TRP 24 HE1 TRP 24 31.190 31.354 22.486
160 HE3 TRP 24 HE3 TRP 24 27.800 35.448 21.822
161 HZ2 TRP 24 HZ2 TRP 24 31.737 33.576 24.238
162 HZ3 TRP 24 HZ3 TRP 24 28.901 36.757 23.623
163 HH2 TRP 24 HH2 TRP 24 30.872 35.847 24.824
164 H GLY 25 H GLY 25 25.647 34.691 19.141
165 HA2 GLY 25 HA2 GLY 25 23.358 33.950 17.602
166 HA3 GLY 25 HA3 GLY 25 24.286 35.440 17.455
167 H ILE 26 H ILE 26 26.521 35.079 16.285
168 HA ILE 26 HA ILE 26 26.385 33.153 14.025
169 HB ILE 26 HB ILE 26 26.678 35.026 12.391
170 HG12 ILE 26 HG12 ILE 26 25.607 36.832 14.595
171 HG13 ILE 26 HG13 ILE 26 27.302 36.768 14.122
172 HG21 ILE 26 HG21 ILE 26 23.975 35.132 13.766
173 HG22 ILE 26 HG22 ILE 26 24.349 35.444 12.063
174 HG23 ILE 26 HG23 ILE 26 24.525 33.812 12.703
175 HD11 ILE 26 HD11 ILE 26 26.690 37.458 11.806
176 HD12 ILE 26 HD12 ILE 26 24.998 37.642 12.337
177 HD13 ILE 26 HD13 ILE 26 26.264 38.660 13.041
178 H GLN 27 H GLN 27 28.262 32.979 12.763
179 HA GLN 27 HA GLN 27 30.399 32.885 12.196
180 HB2 GLN 27 HB2 GLN 27 30.435 35.724 13.227
181 HB3 GLN 27 HB3 GLN 27 31.727 35.022 12.277
182 HG2 GLN 27 HG2 GLN 27 28.836 35.197 11.297
183 HG3 GLN 27 HG3 GLN 27 30.049 36.433 11.020
184 HE21 GLN 27 HE21 GLN 27 29.928 34.076 8.071
185 HE22 GLN 27 HE22 GLN 27 28.584 34.687 9.008
186 H TYR 28 H TYR 28 29.804 32.639 15.351
187 HA TYR 28 HA TYR 28 32.234 32.835 16.752
188 HB2 TYR 28 HB2 TYR 28 31.094 31.104 18.237
189 HB3 TYR 28 HB3 TYR 28 30.203 32.577 17.917
190 HD1 TYR 28 HD1 TYR 28 30.426 28.943 16.991
191 HD2 TYR 28 HD2 TYR 28 28.106 32.579 16.746
192 HE1 TYR 28 HE1 TYR 28 28.476 27.656 16.123
193 HE2 TYR 28 HE2 TYR 28 26.180 31.293 15.850
194 HH TYR 28 HH TYR 28 25.291 29.097 15.815
195 H LYS 29 H LYS 29 33.715 31.256 17.514
196 HA LYS 29 HA LYS 29 34.199 28.875 15.727
197 HB2 LYS 29 HB2 LYS 29 36.102 30.404 17.564
198 HB3 LYS 29 HB3 LYS 29 36.491 28.921 16.720
199 HG2 LYS 29 HG2 LYS 29 37.464 30.533 15.403
200 HG3 LYS 29 HG3 LYS 29 36.018 30.065 14.529
201 HD2 LYS 29 HD2 LYS 29 36.506 32.484 14.423
202 HD3 LYS 29 HD3 LYS 29 34.925 32.181 15.132
203 HE2 LYS 29 HE2 LYS 29 35.769 32.570 17.374
204 HE3 LYS 29 HE3 LYS 29 37.436 32.604 16.807
205 HZ1 LYS 29 HZ1 LYS 29 37.043 34.650 15.707
206 HZ2 LYS 29 HZ2 LYS 29 35.432 34.613 15.948
207 HZ3 LYS 29 HZ3 LYS 29 36.449 34.820 17.236
208 H TYR 30 H TYR 30 32.906 29.632 18.694
209 HA TYR 30 HA TYR 30 33.241 26.916 19.807
210 HB2 TYR 30 HB2 TYR 30 33.846 29.460 21.371
211 HB3 TYR 30 HB3 TYR 30 33.895 27.823 22.000
212 HD1 TYR 30 HD1 TYR 30 35.642 26.188 21.163
213 HD2 TYR 30 HD2 TYR 30 35.759 30.416 20.305
214 HE1 TYR 30 HE1 TYR 30 38.041 25.995 20.524
215 HE2 TYR 30 HE2 TYR 30 38.158 30.219 19.671
216 HH TYR 30 HH TYR 30 39.759 28.659 18.993
217 H CYS 31 H CYS 31 31.939 26.833 21.950
218 HA CYS 31 HA CYS 31 29.245 28.016 21.670
219 HB2 CYS 31 HB2 CYS 31 30.573 26.115 23.630
220 HB3 CYS 31 HB3 CYS 31 28.892 26.625 23.737
221 H GLN 32 H GLN 32 28.276 28.921 23.756
222 HA GLN 32 HA GLN 32 30.140 30.726 25.227
223 HB2 GLN 32 HB2 GLN 32 28.186 31.674 23.877
224 HB3 GLN 32 HB3 GLN 32 27.122 30.865 25.004
225 HG2 GLN 32 HG2 GLN 32 28.192 32.183 26.868
226 HG3 GLN 32 HG3 GLN 32 29.186 33.012 25.677
227 HE21 GLN 32 HE21 GLN 32 26.264 35.199 26.409
228 HE22 GLN 32 HE22 GLN 32 27.784 34.737 27.161
229 H CYS 33 H CYS 33 30.465 30.243 27.385
230 HA CYS 33 HA CYS 33 29.062 27.824 28.576
231 HB2 CYS 33 HB2 CYS 33 31.913 28.799 28.908
232 HB3 CYS 33 HB3 CYS 33 31.194 27.324 29.539
233 H GLN 34 H GLN 34 29.359 27.648 30.932
234 HA GLN 34 HA GLN 34 27.555 29.329 32.081
235 HB2 GLN 34 HB2 GLN 34 28.237 27.156 32.996
236 HB3 GLN 34 HB3 GLN 34 29.778 27.840 33.497
237 HG2 GLN 34 HG2 GLN 34 28.685 27.854 35.478
238 HG3 GLN 34 HG3 GLN 34 28.306 29.484 34.956
239 HE21 GLN 34 HE21 GLN 34 24.780 28.554 34.375
240 HE22 GLN 34 HE22 GLN 34 25.979 29.676 33.767
Start of MODEL 4
1 H1 GLY 1 H1 GLY 1 28.592 21.746 6.644
2 H2 GLY 1 H2 GLY 1 29.964 22.584 6.982
3 H3 GLY 1 H3 GLY 1 28.489 23.282 7.262
4 HA2 GLY 1 HA2 GLY 1 29.580 20.908 8.627
5 HA3 GLY 1 HA3 GLY 1 29.513 22.549 9.319
6 H SER 2 H SER 2 28.087 22.276 10.955
7 HA SER 2 HA SER 2 25.261 21.942 10.142
8 HB2 SER 2 HB2 SER 2 24.729 20.683 12.189
9 HB3 SER 2 HB3 SER 2 25.780 19.776 11.094
10 HG SER 2 HG SER 2 27.419 19.970 12.419
11 H ALA 3 H ALA 3 23.763 22.908 11.585
12 HA ALA 3 HA ALA 3 24.577 25.482 12.602
13 HB1 ALA 3 HB1 ALA 3 22.226 25.702 13.176
14 HB2 ALA 3 HB2 ALA 3 22.398 25.092 11.522
15 HB3 ALA 3 HB3 ALA 3 21.940 23.980 12.839
16 H CYS 4 H CYS 4 24.593 26.208 14.719
17 HA CYS 4 HA CYS 4 25.762 24.337 16.582
18 HB2 CYS 4 HB2 CYS 4 26.533 26.639 16.228
19 HB3 CYS 4 HB3 CYS 4 25.011 27.271 16.861
20 H GLN 5 H GLN 5 24.795 23.132 18.110
21 HA GLN 5 HA GLN 5 22.007 23.783 18.973
22 HB2 GLN 5 HB2 GLN 5 23.541 21.168 19.088
23 HB3 GLN 5 HB3 GLN 5 21.873 21.452 19.594
24 HG2 GLN 5 HG2 GLN 5 21.207 21.956 17.278
25 HG3 GLN 5 HG3 GLN 5 22.873 21.682 16.732
26 HE21 GLN 5 HE21 GLN 5 22.704 18.101 17.216
27 HE22 GLN 5 HE22 GLN 5 23.829 19.468 17.164
28 H PHE 6 H PHE 6 21.693 24.430 21.065
29 HA PHE 6 HA PHE 6 23.899 24.926 22.761
30 HB2 PHE 6 HB2 PHE 6 22.339 25.523 24.507
31 HB3 PHE 6 HB3 PHE 6 21.808 26.173 22.969
32 HD1 PHE 6 HD1 PHE 6 19.629 25.638 22.082
33 HD2 PHE 6 HD2 PHE 6 21.199 23.479 25.475
34 HE1 PHE 6 HE1 PHE 6 17.438 24.506 22.372
35 HE2 PHE 6 HE2 PHE 6 19.034 22.276 25.697
36 HZ PHE 6 HZ PHE 6 17.146 22.796 24.162
37 H TRP 7 H TRP 7 21.837 21.968 22.646
38 HA TRP 7 HA TRP 7 22.746 20.932 25.117
39 HB2 TRP 7 HB2 TRP 7 21.828 18.913 24.549
40 HB3 TRP 7 HB3 TRP 7 20.834 20.066 23.670
41 HD1 TRP 7 HD1 TRP 7 21.135 20.066 21.005
42 HE1 TRP 7 HE1 TRP 7 22.020 18.317 19.311
43 HE3 TRP 7 HE3 TRP 7 23.581 16.967 24.252
44 HZ2 TRP 7 HZ2 TRP 7 23.710 15.996 19.366
45 HZ3 TRP 7 HZ3 TRP 7 24.824 14.999 23.404
46 HH2 TRP 7 HH2 TRP 7 24.915 14.509 20.974
47 H SER 8 H SER 8 24.253 20.805 21.959
48 HA SER 8 HA SER 8 26.354 18.914 22.673
49 HB2 SER 8 HB2 SER 8 25.398 19.070 20.422
50 HB3 SER 8 HB3 SER 8 25.983 20.736 20.263
51 HG SER 8 HG SER 8 28.033 20.039 20.199
52 H CYS 9 H CYS 9 26.097 22.484 22.312
53 HA CYS 9 HA CYS 9 28.795 23.064 23.140
54 HB2 CYS 9 HB2 CYS 9 26.199 24.612 23.087
55 HB3 CYS 9 HB3 CYS 9 27.612 25.274 23.901
56 H ASN 10 H ASN 10 25.798 22.507 25.015
57 HA ASN 10 HA ASN 10 26.720 23.311 27.537
58 HB2 ASN 10 HB2 ASN 10 24.368 22.822 26.871
59 HB3 ASN 10 HB3 ASN 10 24.734 21.111 26.836
60 HD21 ASN 10 HD21 ASN 10 24.094 20.813 30.274
61 HD22 ASN 10 HD22 ASN 10 24.478 19.990 28.759
62 H SER 11 H SER 11 26.789 19.921 26.215
63 HA SER 11 HA SER 11 28.426 18.982 28.398
64 HB2 SER 11 HB2 SER 11 28.766 16.984 26.994
65 HB3 SER 11 HB3 SER 11 27.074 17.449 27.216
66 HG SER 11 HG SER 11 27.456 16.869 25.110
67 H SER 12 H SER 12 29.290 20.366 25.227
68 HA SER 12 HA SER 12 32.093 19.836 25.315
69 HB2 SER 12 HB2 SER 12 31.117 20.684 23.291
70 HB3 SER 12 HB3 SER 12 30.564 22.160 24.100
71 HG SER 12 HG SER 12 32.759 21.935 22.820
72 H CYS 13 H CYS 13 30.317 22.722 26.545
73 HA CYS 13 HA CYS 13 32.520 23.977 27.831
74 HB2 CYS 13 HB2 CYS 13 29.510 24.012 28.284
75 HB3 CYS 13 HB3 CYS 13 30.614 25.008 29.209
76 H ILE 14 H ILE 14 29.985 21.820 29.291
77 HA ILE 14 HA ILE 14 31.140 21.753 31.842
78 HB ILE 14 HB ILE 14 29.476 19.642 30.427
79 HG12 ILE 14 HG12 ILE 14 28.621 21.635 32.567
80 HG13 ILE 14 HG13 ILE 14 28.532 22.071 30.877
81 HG21 ILE 14 HG21 ILE 14 30.328 20.028 33.312
82 HG22 ILE 14 HG22 ILE 14 29.004 18.929 32.848
83 HG23 ILE 14 HG23 ILE 14 30.648 18.613 32.289
84 HD11 ILE 14 HD11 ILE 14 27.035 20.110 30.455
85 HD12 ILE 14 HD12 ILE 14 27.022 19.787 32.203
86 HD13 ILE 14 HD13 ILE 14 26.364 21.308 31.583
87 H SER 15 H SER 15 32.039 19.666 29.046
88 HA SER 15 HA SER 15 33.844 17.994 30.482
89 HB2 SER 15 HB2 SER 15 33.012 17.577 28.168
90 HB3 SER 15 HB3 SER 15 34.056 18.891 27.591
91 HG SER 15 HG SER 15 35.331 17.162 27.382
92 H ARG 16 H ARG 16 34.264 21.276 29.328
93 HA ARG 16 HA ARG 16 37.186 21.381 29.776
94 HB2 ARG 16 HB2 ARG 16 35.132 23.578 29.245
95 HB3 ARG 16 HB3 ARG 16 36.878 23.801 29.306
96 HG2 ARG 16 HG2 ARG 16 37.215 22.426 27.343
97 HG3 ARG 16 HG3 ARG 16 35.539 21.865 27.404
98 HD2 ARG 16 HD2 ARG 16 35.873 23.522 25.606
99 HD3 ARG 16 HD3 ARG 16 34.671 24.011 26.813
100 HE ARG 16 HE ARG 16 37.393 25.010 27.325
101 HH11 ARG 16 HH11 ARG 16 34.367 25.901 25.713
102 HH12 ARG 16 HH12 ARG 16 34.588 27.572 26.278
103 HH21 ARG 16 HH21 ARG 16 37.578 27.073 27.777
104 HH22 ARG 16 HH22 ARG 16 36.300 28.216 27.286
105 H GLY 17 H GLY 17 34.305 21.966 31.665
106 HA2 GLY 17 HA2 GLY 17 35.028 21.522 34.102
107 HA3 GLY 17 HA3 GLY 17 35.912 23.045 33.949
108 H TYR 18 H TYR 18 33.196 23.581 32.103
109 HA TYR 18 HA TYR 18 32.048 25.217 34.177
110 HB2 TYR 18 HB2 TYR 18 31.326 24.690 31.281
111 HB3 TYR 18 HB3 TYR 18 30.579 25.920 32.268
112 HD1 TYR 18 HD1 TYR 18 31.691 27.986 32.859
113 HD2 TYR 18 HD2 TYR 18 33.753 24.913 30.659
114 HE1 TYR 18 HE1 TYR 18 33.487 29.608 32.293
115 HE2 TYR 18 HE2 TYR 18 35.575 26.545 30.101
116 HH TYR 18 HH TYR 18 35.355 29.977 30.984
117 H ARG 19 H ARG 19 29.417 25.285 33.628
118 HA ARG 19 HA ARG 19 28.199 22.652 34.381
119 HB2 ARG 19 HB2 ARG 19 27.847 25.213 35.973
120 HB3 ARG 19 HB3 ARG 19 26.842 23.788 36.115
121 HG2 ARG 19 HG2 ARG 19 28.191 23.316 37.830
122 HG3 ARG 19 HG3 ARG 19 29.084 22.488 36.571
123 HD2 ARG 19 HD2 ARG 19 30.576 23.743 38.079
124 HD3 ARG 19 HD3 ARG 19 30.684 24.369 36.445
125 HE ARG 19 HE ARG 19 29.876 26.393 37.143
126 HH11 ARG 19 HH11 ARG 19 29.441 24.272 39.926
127 HH12 ARG 19 HH12 ARG 19 28.429 25.462 40.722
128 HH21 ARG 19 HH21 ARG 19 28.639 27.842 38.337
129 HH22 ARG 19 HH22 ARG 19 28.037 27.340 39.911
130 H GLN 20 H GLN 20 28.178 24.911 32.108
131 HA GLN 20 HA GLN 20 25.620 24.320 31.113
132 HB2 GLN 20 HB2 GLN 20 25.230 26.255 32.933
133 HB3 GLN 20 HB3 GLN 20 25.891 27.272 31.665
134 HG2 GLN 20 HG2 GLN 20 23.595 27.443 31.359
135 HG3 GLN 20 HG3 GLN 20 24.025 26.260 30.134
136 HE21 GLN 20 HE21 GLN 20 22.273 23.589 31.882
137 HE22 GLN 20 HE22 GLN 20 23.559 23.862 30.723
138 H GLY 21 H GLY 21 25.298 25.234 28.919
139 HA2 GLY 21 HA2 GLY 21 27.168 27.031 27.797
140 HA3 GLY 21 HA3 GLY 21 27.588 25.398 27.280
141 H TYR 22 H TYR 22 26.696 27.642 25.706
142 HA TYR 22 HA TYR 22 24.544 26.479 24.106
143 HB2 TYR 22 HB2 TYR 22 23.215 28.720 24.393
144 HB3 TYR 22 HB3 TYR 22 23.064 27.435 25.569
145 HD1 TYR 22 HD1 TYR 22 23.411 27.747 27.800
146 HD2 TYR 22 HD2 TYR 22 24.920 30.660 25.011
147 HE1 TYR 22 HE1 TYR 22 24.071 29.247 29.711
148 HE2 TYR 22 HE2 TYR 22 25.561 32.149 26.890
149 HH TYR 22 HH TYR 22 25.551 32.463 29.158
150 H CYS 23 H CYS 23 23.915 28.393 22.375
151 HA CYS 23 HA CYS 23 26.532 28.855 21.086
152 HB2 CYS 23 HB2 CYS 23 23.714 28.886 19.989
153 HB3 CYS 23 HB3 CYS 23 25.182 29.023 19.034
154 H TRP 24 H TRP 24 26.910 30.696 19.781
155 HA TRP 24 HA TRP 24 26.295 33.328 20.920
156 HB2 TRP 24 HB2 TRP 24 27.900 32.298 18.558
157 HB3 TRP 24 HB3 TRP 24 27.656 34.001 18.864
158 HD1 TRP 24 HD1 TRP 24 28.926 31.062 21.068
159 HE1 TRP 24 HE1 TRP 24 31.060 31.799 22.269
160 HE3 TRP 24 HE3 TRP 24 29.198 35.850 19.302
161 HZ2 TRP 24 HZ2 TRP 24 32.720 34.170 22.370
162 HZ3 TRP 24 HZ3 TRP 24 31.118 37.301 19.889
163 HH2 TRP 24 HH2 TRP 24 32.881 36.476 21.439
164 H GLY 25 H GLY 25 25.525 35.091 19.390
165 HA2 GLY 25 HA2 GLY 25 22.951 34.409 18.300
166 HA3 GLY 25 HA3 GLY 25 23.779 35.966 18.150
167 H ILE 26 H ILE 26 25.981 35.419 16.679
168 HA ILE 26 HA ILE 26 25.255 33.883 14.245
169 HB ILE 26 HB ILE 26 25.945 35.679 12.758
170 HG12 ILE 26 HG12 ILE 26 25.851 37.474 15.216
171 HG13 ILE 26 HG13 ILE 26 27.311 36.978 14.355
172 HG21 ILE 26 HG21 ILE 26 23.549 35.196 13.280
173 HG22 ILE 26 HG22 ILE 26 23.574 36.522 14.464
174 HG23 ILE 26 HG23 ILE 26 23.847 36.847 12.740
175 HD11 ILE 26 HD11 ILE 26 26.744 39.212 13.655
176 HD12 ILE 26 HD12 ILE 26 26.443 38.116 12.288
177 HD13 ILE 26 HD13 ILE 26 25.086 38.742 13.257
178 H GLN 27 H GLN 27 27.843 35.124 16.304
179 HA GLN 27 HA GLN 27 29.899 34.107 14.447
180 HB2 GLN 27 HB2 GLN 27 30.097 35.413 17.178
181 HB3 GLN 27 HB3 GLN 27 31.479 34.811 16.259
182 HG2 GLN 27 HG2 GLN 27 30.950 36.346 14.396
183 HG3 GLN 27 HG3 GLN 27 29.604 37.011 15.337
184 HE21 GLN 27 HE21 GLN 27 31.719 38.940 17.472
185 HE22 GLN 27 HE22 GLN 27 30.074 38.405 17.141
186 H TYR 28 H TYR 28 28.707 32.003 14.550
187 HA TYR 28 HA TYR 28 28.711 30.320 16.799
188 HB2 TYR 28 HB2 TYR 28 28.712 29.406 13.917
189 HB3 TYR 28 HB3 TYR 28 27.965 28.604 15.289
190 HD1 TYR 28 HD1 TYR 28 26.287 30.433 16.642
191 HD2 TYR 28 HD2 TYR 28 27.181 30.293 12.419
192 HE1 TYR 28 HE1 TYR 28 24.160 31.611 16.135
193 HE2 TYR 28 HE2 TYR 28 25.060 31.490 11.934
194 HH TYR 28 HH TYR 28 23.074 32.821 14.492
195 H LYS 29 H LYS 29 31.536 31.163 15.254
196 HA LYS 29 HA LYS 29 33.044 28.829 14.958
197 HB2 LYS 29 HB2 LYS 29 35.024 30.267 15.384
198 HB3 LYS 29 HB3 LYS 29 33.878 30.927 14.228
199 HG2 LYS 29 HG2 LYS 29 32.935 32.351 16.150
200 HG3 LYS 29 HG3 LYS 29 34.323 31.825 17.105
201 HD2 LYS 29 HD2 LYS 29 35.853 32.882 15.478
202 HD3 LYS 29 HD3 LYS 29 34.478 33.254 14.410
203 HE2 LYS 29 HE2 LYS 29 33.451 34.546 16.342
204 HE3 LYS 29 HE3 LYS 29 34.974 34.362 17.211
205 HZ1 LYS 29 HZ1 LYS 29 34.696 35.658 14.551
206 HZ2 LYS 29 HZ2 LYS 29 34.737 36.466 15.959
207 HZ3 LYS 29 HZ3 LYS 29 36.070 35.601 15.476
208 H TYR 30 H TYR 30 32.140 30.298 18.051
209 HA TYR 30 HA TYR 30 33.259 27.892 19.414
210 HB2 TYR 30 HB2 TYR 30 33.286 30.635 20.681
211 HB3 TYR 30 HB3 TYR 30 34.029 29.165 21.280
212 HD1 TYR 30 HD1 TYR 30 34.748 32.254 19.971
213 HD2 TYR 30 HD2 TYR 30 35.821 28.113 19.408
214 HE1 TYR 30 HE1 TYR 30 36.915 32.955 18.972
215 HE2 TYR 30 HE2 TYR 30 37.997 28.817 18.419
216 HH TYR 30 HH TYR 30 39.383 30.565 17.974
217 H CYS 31 H CYS 31 32.216 27.475 21.524
218 HA CYS 31 HA CYS 31 29.344 28.182 21.646
219 HB2 CYS 31 HB2 CYS 31 31.190 26.559 23.441
220 HB3 CYS 31 HB3 CYS 31 29.456 26.721 23.686
221 H GLN 32 H GLN 32 28.574 28.835 23.985
222 HA GLN 32 HA GLN 32 30.527 30.537 25.440
223 HB2 GLN 32 HB2 GLN 32 29.050 31.999 24.168
224 HB3 GLN 32 HB3 GLN 32 27.617 31.235 24.866
225 HG2 GLN 32 HG2 GLN 32 28.003 32.166 27.007
226 HG3 GLN 32 HG3 GLN 32 29.724 32.413 26.708
227 HE21 GLN 32 HE21 GLN 32 27.428 35.580 26.122
228 HE22 GLN 32 HE22 GLN 32 27.041 34.239 27.201
229 H CYS 33 H CYS 33 30.808 29.789 27.403
230 HA CYS 33 HA CYS 33 29.084 27.639 28.546
231 HB2 CYS 33 HB2 CYS 33 31.810 28.696 29.363
232 HB3 CYS 33 HB3 CYS 33 31.033 27.191 29.847
233 H GLN 34 H GLN 34 29.339 27.659 31.076
234 HA GLN 34 HA GLN 34 27.340 29.434 31.962
235 HB2 GLN 34 HB2 GLN 34 27.796 27.351 33.076
236 HB3 GLN 34 HB3 GLN 34 29.398 27.856 33.554
237 HG2 GLN 34 HG2 GLN 34 27.114 29.586 34.485
238 HG3 GLN 34 HG3 GLN 34 27.167 27.956 35.135
239 HE21 GLN 34 HE21 GLN 34 30.576 30.010 36.167
240 HE22 GLN 34 HE22 GLN 34 30.138 29.936 34.465
Start of MODEL 5
1 H1 GLY 1 H1 GLY 1 24.352 27.062 5.172
2 H2 GLY 1 H2 GLY 1 24.193 27.645 6.702
3 H3 GLY 1 H3 GLY 1 22.848 27.314 5.802
4 HA2 GLY 1 HA2 GLY 1 23.400 24.970 5.787
5 HA3 GLY 1 HA3 GLY 1 24.810 25.352 6.798
6 H SER 2 H SER 2 23.061 23.501 7.769
7 HA SER 2 HA SER 2 20.822 24.419 9.201
8 HB2 SER 2 HB2 SER 2 22.589 22.075 9.957
9 HB3 SER 2 HB3 SER 2 20.870 22.304 10.337
10 HG SER 2 HG SER 2 20.367 22.068 8.188
11 H ALA 3 H ALA 3 20.409 24.990 11.293
12 HA ALA 3 HA ALA 3 22.354 26.732 12.491
13 HB1 ALA 3 HB1 ALA 3 19.568 25.887 13.393
14 HB2 ALA 3 HB2 ALA 3 20.478 27.290 13.992
15 HB3 ALA 3 HB3 ALA 3 19.945 27.237 12.301
16 H CYS 4 H CYS 4 23.018 26.827 14.691
17 HA CYS 4 HA CYS 4 23.951 24.313 15.787
18 HB2 CYS 4 HB2 CYS 4 25.127 25.639 17.341
19 HB3 CYS 4 HB3 CYS 4 25.195 26.436 15.779
20 H GLN 5 H GLN 5 23.734 23.892 18.199
21 HA GLN 5 HA GLN 5 21.094 24.552 19.369
22 HB2 GLN 5 HB2 GLN 5 22.186 21.725 19.109
23 HB3 GLN 5 HB3 GLN 5 20.763 22.201 20.029
24 HG2 GLN 5 HG2 GLN 5 21.061 22.398 17.009
25 HG3 GLN 5 HG3 GLN 5 20.193 21.150 17.879
26 HE21 GLN 5 HE21 GLN 5 17.646 23.526 16.702
27 HE22 GLN 5 HE22 GLN 5 18.864 22.501 15.934
28 H PHE 6 H PHE 6 21.060 24.512 21.669
29 HA PHE 6 HA PHE 6 23.590 25.104 22.851
30 HB2 PHE 6 HB2 PHE 6 22.432 25.409 24.929
31 HB3 PHE 6 HB3 PHE 6 21.523 26.143 23.631
32 HD1 PHE 6 HD1 PHE 6 21.630 23.155 25.893
33 HD2 PHE 6 HD2 PHE 6 19.231 25.568 23.241
34 HE1 PHE 6 HE1 PHE 6 19.617 21.853 26.525
35 HE2 PHE 6 HE2 PHE 6 17.215 24.311 23.934
36 HZ PHE 6 HZ PHE 6 17.401 22.432 25.555
37 H TRP 7 H TRP 7 21.681 22.057 22.899
38 HA TRP 7 HA TRP 7 22.887 20.875 25.090
39 HB2 TRP 7 HB2 TRP 7 22.036 18.823 24.383
40 HB3 TRP 7 HB3 TRP 7 20.913 20.024 23.782
41 HD1 TRP 7 HD1 TRP 7 20.842 20.374 21.148
42 HE1 TRP 7 HE1 TRP 7 21.736 19.069 19.105
43 HE3 TRP 7 HE3 TRP 7 23.898 17.081 23.588
44 HZ2 TRP 7 HZ2 TRP 7 23.603 16.961 18.603
45 HZ3 TRP 7 HZ3 TRP 7 25.243 15.437 22.291
46 HH2 TRP 7 HH2 TRP 7 25.133 15.390 19.817
47 H SER 8 H SER 8 24.176 20.853 21.772
48 HA SER 8 HA SER 8 26.313 19.014 22.275
49 HB2 SER 8 HB2 SER 8 25.493 19.497 20.038
50 HB3 SER 8 HB3 SER 8 26.061 21.175 20.154
51 HG SER 8 HG SER 8 27.423 18.989 19.425
52 H CYS 9 H CYS 9 26.192 22.595 22.311
53 HA CYS 9 HA CYS 9 28.902 22.991 23.235
54 HB2 CYS 9 HB2 CYS 9 26.387 24.686 23.196
55 HB3 CYS 9 HB3 CYS 9 27.873 25.240 23.968
56 H ASN 10 H ASN 10 25.829 22.359 24.947
57 HA ASN 10 HA ASN 10 26.614 23.141 27.523
58 HB2 ASN 10 HB2 ASN 10 24.302 22.660 26.772
59 HB3 ASN 10 HB3 ASN 10 24.678 20.932 26.743
60 HD21 ASN 10 HD21 ASN 10 23.995 20.596 30.166
61 HD22 ASN 10 HD22 ASN 10 24.256 19.792 28.622
62 H SER 11 H SER 11 26.720 19.773 26.225
63 HA SER 11 HA SER 11 28.255 18.721 28.406
64 HB2 SER 11 HB2 SER 11 28.145 17.783 25.515
65 HB3 SER 11 HB3 SER 11 28.750 16.853 26.901
66 HG SER 11 HG SER 11 26.560 16.355 26.340
67 H SER 12 H SER 12 29.291 20.332 25.387
68 HA SER 12 HA SER 12 32.083 19.735 25.587
69 HB2 SER 12 HB2 SER 12 30.978 20.492 23.540
70 HB3 SER 12 HB3 SER 12 30.641 22.062 24.273
71 HG SER 12 HG SER 12 32.465 21.908 22.847
72 H CYS 13 H CYS 13 30.282 22.695 26.662
73 HA CYS 13 HA CYS 13 32.504 23.925 27.963
74 HB2 CYS 13 HB2 CYS 13 29.500 24.080 28.355
75 HB3 CYS 13 HB3 CYS 13 30.630 25.088 29.236
76 H ILE 14 H ILE 14 29.891 21.805 29.406
77 HA ILE 14 HA ILE 14 31.035 21.815 31.975
78 HB ILE 14 HB ILE 14 29.454 19.581 30.659
79 HG12 ILE 14 HG12 ILE 14 28.425 21.644 32.651
80 HG13 ILE 14 HG13 ILE 14 28.390 22.005 30.937
81 HG21 ILE 14 HG21 ILE 14 30.279 20.263 33.507
82 HG22 ILE 14 HG22 ILE 14 29.006 19.064 33.146
83 HG23 ILE 14 HG23 ILE 14 30.669 18.786 32.608
84 HD11 ILE 14 HD11 ILE 14 26.965 19.678 32.282
85 HD12 ILE 14 HD12 ILE 14 26.237 21.137 31.586
86 HD13 ILE 14 HD13 ILE 14 27.027 19.952 30.526
87 H SER 15 H SER 15 31.896 19.626 29.238
88 HA SER 15 HA SER 15 33.841 18.075 30.559
89 HB2 SER 15 HB2 SER 15 32.996 17.797 28.196
90 HB3 SER 15 HB3 SER 15 34.036 19.140 27.712
91 HG SER 15 HG SER 15 34.628 16.543 28.258
92 H ARG 16 H ARG 16 34.142 21.356 29.258
93 HA ARG 16 HA ARG 16 37.037 21.625 29.648
94 HB2 ARG 16 HB2 ARG 16 34.858 23.715 29.244
95 HB3 ARG 16 HB3 ARG 16 36.586 24.085 29.346
96 HG2 ARG 16 HG2 ARG 16 37.068 22.828 27.354
97 HG3 ARG 16 HG3 ARG 16 35.452 22.112 27.363
98 HD2 ARG 16 HD2 ARG 16 35.707 23.841 25.617
99 HD3 ARG 16 HD3 ARG 16 34.401 24.157 26.761
100 HE ARG 16 HE ARG 16 36.823 25.526 27.589
101 HH11 ARG 16 HH11 ARG 16 34.271 25.821 25.142
102 HH12 ARG 16 HH12 ARG 16 34.444 27.579 25.171
103 HH21 ARG 16 HH21 ARG 16 36.851 27.689 27.538
104 HH22 ARG 16 HH22 ARG 16 35.804 28.567 26.404
105 H GLY 17 H GLY 17 34.235 22.187 31.656
106 HA2 GLY 17 HA2 GLY 17 35.070 21.699 34.079
107 HA3 GLY 17 HA3 GLY 17 35.899 23.252 33.897
108 H TYR 18 H TYR 18 33.119 23.745 32.134
109 HA TYR 18 HA TYR 18 32.039 25.377 34.267
110 HB2 TYR 18 HB2 TYR 18 31.188 24.860 31.402
111 HB3 TYR 18 HB3 TYR 18 30.615 26.174 32.390
112 HD1 TYR 18 HD1 TYR 18 33.123 25.145 30.105
113 HD2 TYR 18 HD2 TYR 18 32.491 27.766 33.450
114 HE1 TYR 18 HE1 TYR 18 35.136 26.461 29.446
115 HE2 TYR 18 HE2 TYR 18 34.476 29.114 32.767
116 HH TYR 18 HH TYR 18 35.888 29.521 30.599
117 H ARG 19 H ARG 19 29.368 25.442 33.645
118 HA ARG 19 HA ARG 19 28.241 22.825 34.583
119 HB2 ARG 19 HB2 ARG 19 27.434 25.579 35.611
120 HB3 ARG 19 HB3 ARG 19 26.597 24.067 35.929
121 HG2 ARG 19 HG2 ARG 19 27.765 24.279 37.837
122 HG3 ARG 19 HG3 ARG 19 28.854 23.226 36.933
123 HD2 ARG 19 HD2 ARG 19 30.353 25.084 36.475
124 HD3 ARG 19 HD3 ARG 19 29.127 26.258 36.993
125 HE ARG 19 HE ARG 19 29.970 24.310 39.025
126 HH11 ARG 19 HH11 ARG 19 30.675 27.487 37.770
127 HH12 ARG 19 HH12 ARG 19 31.191 28.121 39.310
128 HH21 ARG 19 HH21 ARG 19 30.711 25.032 40.891
129 HH22 ARG 19 HH22 ARG 19 31.274 26.683 41.100
130 H GLN 20 H GLN 20 28.211 25.150 32.158
131 HA GLN 20 HA GLN 20 25.902 24.095 30.891
132 HB2 GLN 20 HB2 GLN 20 25.121 26.005 32.642
133 HB3 GLN 20 HB3 GLN 20 25.665 27.071 31.332
134 HG2 GLN 20 HG2 GLN 20 24.137 25.799 29.760
135 HG3 GLN 20 HG3 GLN 20 23.669 24.770 31.106
136 HE21 GLN 20 HE21 GLN 20 20.829 26.884 31.141
137 HE22 GLN 20 HE22 GLN 20 21.471 25.299 30.722
138 H GLY 21 H GLY 21 25.582 25.024 28.714
139 HA2 GLY 21 HA2 GLY 21 27.603 26.753 27.627
140 HA3 GLY 21 HA3 GLY 21 27.839 25.074 27.136
141 H TYR 22 H TYR 22 27.188 27.418 25.539
142 HA TYR 22 HA TYR 22 24.817 26.504 24.067
143 HB2 TYR 22 HB2 TYR 22 23.872 28.945 24.408
144 HB3 TYR 22 HB3 TYR 22 23.544 27.627 25.520
145 HD1 TYR 22 HD1 TYR 22 24.201 27.646 27.783
146 HD2 TYR 22 HD2 TYR 22 25.482 30.776 25.115
147 HE1 TYR 22 HE1 TYR 22 25.135 28.921 29.728
148 HE2 TYR 22 HE2 TYR 22 26.345 32.065 27.069
149 HH TYR 22 HH TYR 22 26.356 30.721 30.368
150 H CYS 23 H CYS 23 24.290 28.161 22.267
151 HA CYS 23 HA CYS 23 26.897 28.827 20.963
152 HB2 CYS 23 HB2 CYS 23 26.187 27.738 18.998
153 HB3 CYS 23 HB3 CYS 23 25.943 26.626 20.328
154 H TRP 24 H TRP 24 26.595 30.073 18.896
155 HA TRP 24 HA TRP 24 25.094 32.553 19.587
156 HB2 TRP 24 HB2 TRP 24 27.520 32.063 17.844
157 HB3 TRP 24 HB3 TRP 24 26.874 33.627 18.275
158 HD1 TRP 24 HD1 TRP 24 29.263 31.023 19.458
159 HE1 TRP 24 HE1 TRP 24 30.425 31.820 21.601
160 HE3 TRP 24 HE3 TRP 24 26.178 34.948 20.649
161 HZ2 TRP 24 HZ2 TRP 24 30.223 34.039 23.422
162 HZ3 TRP 24 HZ3 TRP 24 26.717 36.396 22.602
163 HH2 TRP 24 HH2 TRP 24 28.753 35.980 23.959
164 H GLY 25 H GLY 25 25.248 33.916 17.216
165 HA2 GLY 25 HA2 GLY 25 23.113 32.953 15.554
166 HA3 GLY 25 HA3 GLY 25 24.148 34.349 15.255
167 H ILE 26 H ILE 26 25.959 34.130 13.907
168 HA ILE 26 HA ILE 26 26.272 31.566 12.389
169 HB ILE 26 HB ILE 26 26.064 32.852 10.253
170 HG12 ILE 26 HG12 ILE 26 24.516 34.951 11.815
171 HG13 ILE 26 HG13 ILE 26 26.227 35.151 11.478
172 HG21 ILE 26 HG21 ILE 26 23.662 32.639 10.118
173 HG22 ILE 26 HG22 ILE 26 24.293 31.339 11.125
174 HG23 ILE 26 HG23 ILE 26 23.495 32.730 11.880
175 HD11 ILE 26 HD11 ILE 26 25.796 34.955 9.039
176 HD12 ILE 26 HD12 ILE 26 24.054 34.824 9.372
177 HD13 ILE 26 HD13 ILE 26 24.930 36.309 9.786
178 H GLN 27 H GLN 27 27.880 34.398 13.589
179 HA GLN 27 HA GLN 27 30.378 33.534 12.181
180 HB2 GLN 27 HB2 GLN 27 29.645 36.400 12.826
181 HB3 GLN 27 HB3 GLN 27 31.097 35.827 12.010
182 HG2 GLN 27 HG2 GLN 27 28.255 35.850 10.946
183 HG3 GLN 27 HG3 GLN 27 29.602 36.822 10.409
184 HE21 GLN 27 HE21 GLN 27 29.118 34.215 7.852
185 HE22 GLN 27 HE22 GLN 27 28.184 35.557 8.527
186 H TYR 28 H TYR 28 31.045 32.258 13.871
187 HA TYR 28 HA TYR 28 32.256 33.566 16.193
188 HB2 TYR 28 HB2 TYR 28 31.057 32.174 17.821
189 HB3 TYR 28 HB3 TYR 28 29.974 33.261 16.997
190 HD1 TYR 28 HD1 TYR 28 30.750 29.767 17.721
191 HD2 TYR 28 HD2 TYR 28 28.423 32.399 15.201
192 HE1 TYR 28 HE1 TYR 28 29.213 27.880 17.156
193 HE2 TYR 28 HE2 TYR 28 26.922 30.504 14.601
194 HH TYR 28 HH TYR 28 26.324 28.397 15.106
195 H LYS 29 H LYS 29 33.648 32.103 17.393
196 HA LYS 29 HA LYS 29 34.577 29.778 15.719
197 HB2 LYS 29 HB2 LYS 29 36.846 30.368 16.422
198 HB3 LYS 29 HB3 LYS 29 36.045 31.583 15.433
199 HG2 LYS 29 HG2 LYS 29 35.654 32.978 17.443
200 HG3 LYS 29 HG3 LYS 29 36.427 31.731 18.455
201 HD2 LYS 29 HD2 LYS 29 38.491 31.975 17.056
202 HD3 LYS 29 HD3 LYS 29 37.699 33.282 16.146
203 HE2 LYS 29 HE2 LYS 29 37.458 34.558 18.293
204 HE3 LYS 29 HE3 LYS 29 38.307 33.249 19.128
205 HZ1 LYS 29 HZ1 LYS 29 39.389 35.046 17.041
206 HZ2 LYS 29 HZ2 LYS 29 39.963 34.843 18.582
207 HZ3 LYS 29 HZ3 LYS 29 40.154 33.654 17.457
208 H TYR 30 H TYR 30 33.480 30.450 18.906
209 HA TYR 30 HA TYR 30 33.969 27.619 19.598
210 HB2 TYR 30 HB2 TYR 30 34.755 29.911 21.437
211 HB3 TYR 30 HB3 TYR 30 34.770 28.214 21.862
212 HD1 TYR 30 HD1 TYR 30 36.851 30.857 20.981
213 HD2 TYR 30 HD2 TYR 30 36.218 26.669 20.132
214 HE1 TYR 30 HE1 TYR 30 39.236 30.627 20.303
215 HE2 TYR 30 HE2 TYR 30 38.603 26.452 19.443
216 HH TYR 30 HH TYR 30 40.589 27.587 19.007
217 H CYS 31 H CYS 31 32.709 26.997 21.612
218 HA CYS 31 HA CYS 31 30.009 28.129 21.670
219 HB2 CYS 31 HB2 CYS 31 31.481 26.179 23.478
220 HB3 CYS 31 HB3 CYS 31 29.784 26.587 23.658
221 H GLN 32 H GLN 32 29.010 28.962 23.687
222 HA GLN 32 HA GLN 32 30.873 30.531 25.420
223 HB2 GLN 32 HB2 GLN 32 29.091 31.771 24.055
224 HB3 GLN 32 HB3 GLN 32 27.900 31.007 25.110
225 HG2 GLN 32 HG2 GLN 32 29.134 31.997 27.097
226 HG3 GLN 32 HG3 GLN 32 30.244 32.764 25.954
227 HE21 GLN 32 HE21 GLN 32 28.058 35.484 26.771
228 HE22 GLN 32 HE22 GLN 32 29.568 34.675 27.214
229 H CYS 33 H CYS 33 30.647 30.284 27.706
230 HA CYS 33 HA CYS 33 29.198 27.778 28.593
231 HB2 CYS 33 HB2 CYS 33 32.016 28.675 29.265
232 HB3 CYS 33 HB3 CYS 33 31.199 27.199 29.770
233 H GLN 34 H GLN 34 29.015 27.484 30.805
234 HA GLN 34 HA GLN 34 27.803 28.070 32.660
235 HB2 GLN 34 HB2 GLN 34 30.251 28.118 33.207
236 HB3 GLN 34 HB3 GLN 34 30.212 29.877 33.118
237 HG2 GLN 34 HG2 GLN 34 28.689 29.982 35.018
238 HG3 GLN 34 HG3 GLN 34 28.400 28.243 34.952
239 HE21 GLN 34 HE21 GLN 34 31.588 29.601 37.030
240 HE22 GLN 34 HE22 GLN 34 30.233 30.603 36.580
Start of MODEL 6
1 H1 GLY 1 H1 GLY 1 27.804 24.027 8.315
2 H2 GLY 1 H2 GLY 1 26.675 24.946 7.545
3 H3 GLY 1 H3 GLY 1 26.475 24.546 9.134
4 HA2 GLY 1 HA2 GLY 1 28.689 26.173 8.091
5 HA3 GLY 1 HA3 GLY 1 27.222 26.850 8.819
6 H SER 2 H SER 2 29.096 27.784 10.226
7 HA SER 2 HA SER 2 30.131 25.965 12.299
8 HB2 SER 2 HB2 SER 2 31.161 28.065 13.169
9 HB3 SER 2 HB3 SER 2 31.584 27.679 11.495
10 HG SER 2 HG SER 2 30.957 29.647 11.163
11 H ALA 3 H ALA 3 27.168 27.670 11.915
12 HA ALA 3 HA ALA 3 26.464 28.250 14.588
13 HB1 ALA 3 HB1 ALA 3 24.736 27.163 12.322
14 HB2 ALA 3 HB2 ALA 3 24.146 28.005 13.773
15 HB3 ALA 3 HB3 ALA 3 25.145 28.870 12.590
16 H CYS 4 H CYS 4 24.950 27.040 16.009
17 HA CYS 4 HA CYS 4 25.129 24.104 15.950
18 HB2 CYS 4 HB2 CYS 4 26.255 24.007 18.131
19 HB3 CYS 4 HB3 CYS 4 27.252 24.711 16.878
20 H GLN 5 H GLN 5 24.115 23.113 17.875
21 HA GLN 5 HA GLN 5 21.713 24.581 18.894
22 HB2 GLN 5 HB2 GLN 5 22.390 21.612 18.865
23 HB3 GLN 5 HB3 GLN 5 20.879 22.326 19.396
24 HG2 GLN 5 HG2 GLN 5 21.994 21.999 16.608
25 HG3 GLN 5 HG3 GLN 5 20.441 21.457 17.230
26 HE21 GLN 5 HE21 GLN 5 20.607 24.892 15.207
27 HE22 GLN 5 HE22 GLN 5 21.642 23.490 15.034
28 H PHE 6 H PHE 6 21.624 25.075 21.107
29 HA PHE 6 HA PHE 6 23.874 25.173 22.633
30 HB2 PHE 6 HB2 PHE 6 22.490 25.677 24.568
31 HB3 PHE 6 HB3 PHE 6 21.829 26.427 23.129
32 HD1 PHE 6 HD1 PHE 6 19.586 25.887 22.359
33 HD2 PHE 6 HD2 PHE 6 21.389 23.653 25.581
34 HE1 PHE 6 HE1 PHE 6 17.410 24.786 22.829
35 HE2 PHE 6 HE2 PHE 6 19.227 22.525 26.011
36 HZ PHE 6 HZ PHE 6 17.226 23.098 24.641
37 H TRP 7 H TRP 7 21.765 22.257 22.617
38 HA TRP 7 HA TRP 7 23.044 21.023 24.858
39 HB2 TRP 7 HB2 TRP 7 22.005 19.051 24.272
40 HB3 TRP 7 HB3 TRP 7 20.880 20.339 23.871
41 HD1 TRP 7 HD1 TRP 7 22.411 20.703 20.858
42 HE1 TRP 7 HE1 TRP 7 21.760 19.038 19.013
43 HE3 TRP 7 HE3 TRP 7 20.329 17.071 23.787
44 HZ2 TRP 7 HZ2 TRP 7 20.454 16.478 18.850
45 HZ3 TRP 7 HZ3 TRP 7 19.334 15.045 22.753
46 HH2 TRP 7 HH2 TRP 7 19.393 14.738 20.287
47 H SER 8 H SER 8 24.169 21.406 21.607
48 HA SER 8 HA SER 8 26.415 19.519 21.807
49 HB2 SER 8 HB2 SER 8 25.993 21.754 19.808
50 HB3 SER 8 HB3 SER 8 27.034 20.341 19.637
51 HG SER 8 HG SER 8 24.870 20.425 18.607
52 H CYS 9 H CYS 9 25.852 22.518 23.227
53 HA CYS 9 HA CYS 9 28.781 23.054 23.492
54 HB2 CYS 9 HB2 CYS 9 26.366 24.860 23.753
55 HB3 CYS 9 HB3 CYS 9 27.990 25.316 24.263
56 H ASN 10 H ASN 10 25.751 22.415 25.305
57 HA ASN 10 HA ASN 10 26.667 23.202 27.838
58 HB2 ASN 10 HB2 ASN 10 24.340 22.821 27.315
59 HB3 ASN 10 HB3 ASN 10 24.604 21.109 27.071
60 HD21 ASN 10 HD21 ASN 10 23.822 22.376 30.777
61 HD22 ASN 10 HD22 ASN 10 23.646 23.433 29.367
62 H SER 11 H SER 11 26.570 19.686 26.880
63 HA SER 11 HA SER 11 28.293 18.889 29.017
64 HB2 SER 11 HB2 SER 11 27.729 17.496 26.377
65 HB3 SER 11 HB3 SER 11 28.546 16.774 27.777
66 HG SER 11 HG SER 11 25.872 17.675 27.526
67 H SER 12 H SER 12 29.081 20.022 25.749
68 HA SER 12 HA SER 12 31.886 19.433 25.754
69 HB2 SER 12 HB2 SER 12 30.663 20.190 23.759
70 HB3 SER 12 HB3 SER 12 30.378 21.763 24.511
71 HG SER 12 HG SER 12 32.740 20.642 23.494
72 H CYS 13 H CYS 13 30.218 22.483 26.811
73 HA CYS 13 HA CYS 13 32.485 23.701 28.008
74 HB2 CYS 13 HB2 CYS 13 29.497 23.937 28.394
75 HB3 CYS 13 HB3 CYS 13 30.614 24.880 29.358
76 H ILE 14 H ILE 14 30.017 21.517 29.578
77 HA ILE 14 HA ILE 14 31.337 21.582 32.096
78 HB ILE 14 HB ILE 14 29.752 19.250 30.962
79 HG12 ILE 14 HG12 ILE 14 28.759 21.407 32.851
80 HG13 ILE 14 HG13 ILE 14 28.579 21.624 31.132
81 HG21 ILE 14 HG21 ILE 14 30.651 20.138 33.742
82 HG22 ILE 14 HG22 ILE 14 29.425 18.875 33.497
83 HG23 ILE 14 HG23 ILE 14 31.079 18.622 32.929
84 HD11 ILE 14 HD11 ILE 14 26.526 20.747 32.031
85 HD12 ILE 14 HD12 ILE 14 27.269 19.521 30.986
86 HD13 ILE 14 HD13 ILE 14 27.359 19.361 32.755
87 H SER 15 H SER 15 32.048 19.511 29.265
88 HA SER 15 HA SER 15 34.112 17.955 30.504
89 HB2 SER 15 HB2 SER 15 33.804 18.666 27.573
90 HB3 SER 15 HB3 SER 15 34.795 17.367 28.257
91 HG SER 15 HG SER 15 31.972 17.648 28.285
92 H ARG 16 H ARG 16 34.140 21.236 29.403
93 HA ARG 16 HA ARG 16 37.086 21.588 29.629
94 HB2 ARG 16 HB2 ARG 16 34.852 23.593 29.133
95 HB3 ARG 16 HB3 ARG 16 36.581 23.958 29.133
96 HG2 ARG 16 HG2 ARG 16 36.961 22.592 27.182
97 HG3 ARG 16 HG3 ARG 16 35.350 21.873 27.331
98 HD2 ARG 16 HD2 ARG 16 35.419 23.432 25.479
99 HD3 ARG 16 HD3 ARG 16 34.249 23.897 26.719
100 HE ARG 16 HE ARG 16 36.845 25.226 27.031
101 HH11 ARG 16 HH11 ARG 16 33.893 25.407 25.084
102 HH12 ARG 16 HH12 ARG 16 34.067 27.156 24.945
103 HH21 ARG 16 HH21 ARG 16 36.812 27.490 26.874
104 HH22 ARG 16 HH22 ARG 16 35.621 28.230 25.848
105 H GLY 17 H GLY 17 34.260 21.933 31.649
106 HA2 GLY 17 HA2 GLY 17 34.891 21.470 34.011
107 HA3 GLY 17 HA3 GLY 17 36.049 22.798 33.903
108 H TYR 18 H TYR 18 33.168 23.547 32.166
109 HA TYR 18 HA TYR 18 32.174 25.307 34.295
110 HB2 TYR 18 HB2 TYR 18 31.384 24.827 31.403
111 HB3 TYR 18 HB3 TYR 18 30.748 26.097 32.417
112 HD1 TYR 18 HD1 TYR 18 33.726 24.916 30.609
113 HD2 TYR 18 HD2 TYR 18 32.074 28.067 33.024
114 HE1 TYR 18 HE1 TYR 18 35.615 26.419 29.934
115 HE2 TYR 18 HE2 TYR 18 33.954 29.558 32.364
116 HH TYR 18 HH TYR 18 36.057 29.643 31.356
117 H ARG 19 H ARG 19 29.490 25.317 33.604
118 HA ARG 19 HA ARG 19 28.360 22.649 34.399
119 HB2 ARG 19 HB2 ARG 19 27.791 25.283 35.789
120 HB3 ARG 19 HB3 ARG 19 26.825 23.826 35.950
121 HG2 ARG 19 HG2 ARG 19 28.131 23.561 37.774
122 HG3 ARG 19 HG3 ARG 19 29.046 22.621 36.607
123 HD2 ARG 19 HD2 ARG 19 30.568 23.957 37.928
124 HD3 ARG 19 HD3 ARG 19 30.596 24.594 36.307
125 HE ARG 19 HE ARG 19 29.593 26.558 37.029
126 HH11 ARG 19 HH11 ARG 19 29.683 24.283 39.752
127 HH12 ARG 19 HH12 ARG 19 29.129 25.531 40.855
128 HH21 ARG 19 HH21 ARG 19 28.771 27.988 38.526
129 HH22 ARG 19 HH22 ARG 19 28.727 27.500 40.222
130 H GLN 20 H GLN 20 28.264 25.032 32.135
131 HA GLN 20 HA GLN 20 25.703 24.386 31.023
132 HB2 GLN 20 HB2 GLN 20 25.519 26.296 33.023
133 HB3 GLN 20 HB3 GLN 20 25.833 27.321 31.629
134 HG2 GLN 20 HG2 GLN 20 23.842 26.488 30.507
135 HG3 GLN 20 HG3 GLN 20 23.650 25.191 31.693
136 HE21 GLN 20 HE21 GLN 20 21.141 27.363 33.010
137 HE22 GLN 20 HE22 GLN 20 21.436 25.900 32.076
138 H GLY 21 H GLY 21 25.351 25.443 28.927
139 HA2 GLY 21 HA2 GLY 21 27.409 26.993 27.741
140 HA3 GLY 21 HA3 GLY 21 27.664 25.301 27.320
141 H TYR 22 H TYR 22 26.845 27.764 25.772
142 HA TYR 22 HA TYR 22 24.564 26.682 24.252
143 HB2 TYR 22 HB2 TYR 22 23.560 29.157 24.619
144 HB3 TYR 22 HB3 TYR 22 23.161 27.767 25.610
145 HD1 TYR 22 HD1 TYR 22 23.248 27.900 27.892
146 HD2 TYR 22 HD2 TYR 22 25.683 30.575 25.567
147 HE1 TYR 22 HE1 TYR 22 23.973 29.063 29.992
148 HE2 TYR 22 HE2 TYR 22 26.488 31.661 27.671
149 HH TYR 22 HH TYR 22 26.412 31.691 29.938
150 H CYS 23 H CYS 23 23.998 28.030 22.362
151 HA CYS 23 HA CYS 23 26.478 28.852 20.983
152 HB2 CYS 23 HB2 CYS 23 23.673 28.264 19.988
153 HB3 CYS 23 HB3 CYS 23 25.061 28.630 18.961
154 H TRP 24 H TRP 24 26.660 30.762 19.776
155 HA TRP 24 HA TRP 24 25.339 33.165 20.834
156 HB2 TRP 24 HB2 TRP 24 27.477 32.590 18.754
157 HB3 TRP 24 HB3 TRP 24 26.776 34.180 18.949
158 HD1 TRP 24 HD1 TRP 24 28.971 31.703 20.867
159 HE1 TRP 24 HE1 TRP 24 30.301 32.989 22.683
160 HE3 TRP 24 HE3 TRP 24 26.636 36.250 20.544
161 HZ2 TRP 24 HZ2 TRP 24 30.379 35.635 23.768
162 HZ3 TRP 24 HZ3 TRP 24 27.361 38.135 21.982
163 HH2 TRP 24 HH2 TRP 24 29.217 37.839 23.605
164 H GLY 25 H GLY 25 24.245 34.724 19.417
165 HA2 GLY 25 HA2 GLY 25 22.133 33.537 17.931
166 HA3 GLY 25 HA3 GLY 25 22.514 35.263 18.013
167 H ILE 26 H ILE 26 24.865 35.537 16.775
168 HA ILE 26 HA ILE 26 24.792 34.155 14.125
169 HB ILE 26 HB ILE 26 25.192 36.250 12.969
170 HG12 ILE 26 HG12 ILE 26 24.426 37.694 15.534
171 HG13 ILE 26 HG13 ILE 26 26.093 37.498 14.990
172 HG21 ILE 26 HG21 ILE 26 22.578 36.368 14.525
173 HG22 ILE 26 HG22 ILE 26 22.897 36.985 12.896
174 HG23 ILE 26 HG23 ILE 26 22.898 35.245 13.186
175 HD11 ILE 26 HD11 ILE 26 25.648 38.719 12.933
176 HD12 ILE 26 HD12 ILE 26 23.939 38.923 13.389
177 HD13 ILE 26 HD13 ILE 26 25.207 39.688 14.350
178 H GLN 27 H GLN 27 26.642 35.209 16.735
179 HA GLN 27 HA GLN 27 29.103 35.699 15.309
180 HB2 GLN 27 HB2 GLN 27 28.638 35.642 18.324
181 HB3 GLN 27 HB3 GLN 27 29.954 36.402 17.442
182 HG2 GLN 27 HG2 GLN 27 28.701 38.232 17.936
183 HG3 GLN 27 HG3 GLN 27 28.044 37.873 16.349
184 HE21 GLN 27 HE21 GLN 27 25.335 38.428 19.023
185 HE22 GLN 27 HE22 GLN 27 26.755 39.394 18.583
186 H TYR 28 H TYR 28 28.791 33.299 14.539
187 HA TYR 28 HA TYR 28 29.259 31.150 16.289
188 HB2 TYR 28 HB2 TYR 28 29.612 31.194 13.294
189 HB3 TYR 28 HB3 TYR 28 29.187 29.797 14.292
190 HD1 TYR 28 HD1 TYR 28 27.808 31.190 11.795
191 HD2 TYR 28 HD2 TYR 28 27.020 31.124 16.034
192 HE1 TYR 28 HE1 TYR 28 25.424 31.729 11.366
193 HE2 TYR 28 HE2 TYR 28 24.663 31.693 15.601
194 HH TYR 28 HH TYR 28 23.177 32.433 14.019
195 H LYS 29 H LYS 29 31.609 32.878 16.627
196 HA LYS 29 HA LYS 29 33.944 31.530 15.540
197 HB2 LYS 29 HB2 LYS 29 33.674 33.150 18.118
198 HB3 LYS 29 HB3 LYS 29 35.160 32.467 17.491
199 HG2 LYS 29 HG2 LYS 29 35.355 34.599 16.766
200 HG3 LYS 29 HG3 LYS 29 34.703 33.818 15.325
201 HD2 LYS 29 HD2 LYS 29 32.469 34.758 15.800
202 HD3 LYS 29 HD3 LYS 29 33.021 35.320 17.388
203 HE2 LYS 29 HE2 LYS 29 33.036 37.236 16.001
204 HE3 LYS 29 HE3 LYS 29 34.727 36.773 16.233
205 HZ1 LYS 29 HZ1 LYS 29 34.337 37.304 13.957
206 HZ2 LYS 29 HZ2 LYS 29 34.606 35.698 13.993
207 HZ3 LYS 29 HZ3 LYS 29 33.052 36.272 13.851
208 H TYR 30 H TYR 30 32.224 31.122 18.687
209 HA TYR 30 HA TYR 30 32.937 28.266 18.811
210 HB2 TYR 30 HB2 TYR 30 33.874 30.263 20.924
211 HB3 TYR 30 HB3 TYR 30 34.034 28.516 21.025
212 HD1 TYR 30 HD1 TYR 30 35.681 31.533 20.049
213 HD2 TYR 30 HD2 TYR 30 35.424 27.329 19.158
214 HE1 TYR 30 HE1 TYR 30 37.900 31.628 18.945
215 HE2 TYR 30 HE2 TYR 30 37.644 27.430 18.065
216 HH TYR 30 HH TYR 30 39.637 30.362 18.074
217 H CYS 31 H CYS 31 32.078 27.341 20.985
218 HA CYS 31 HA CYS 31 29.369 28.188 21.611
219 HB2 CYS 31 HB2 CYS 31 31.386 26.419 23.066
220 HB3 CYS 31 HB3 CYS 31 29.732 26.645 23.610
221 H GLN 32 H GLN 32 28.686 28.925 23.824
222 HA GLN 32 HA GLN 32 30.755 30.471 25.340
223 HB2 GLN 32 HB2 GLN 32 29.117 31.948 24.197
224 HB3 GLN 32 HB3 GLN 32 27.806 31.120 25.036
225 HG2 GLN 32 HG2 GLN 32 28.895 31.795 27.232
226 HG3 GLN 32 HG3 GLN 32 30.067 32.725 26.299
227 HE21 GLN 32 HE21 GLN 32 27.133 34.865 27.453
228 HE22 GLN 32 HE22 GLN 32 28.058 33.659 28.337
229 H CYS 33 H CYS 33 31.132 29.649 27.296
230 HA CYS 33 HA CYS 33 29.298 27.625 28.532
231 HB2 CYS 33 HB2 CYS 33 32.053 28.598 29.360
232 HB3 CYS 33 HB3 CYS 33 31.175 27.173 29.929
233 H GLN 34 H GLN 34 29.484 27.815 31.070
234 HA GLN 34 HA GLN 34 27.392 29.563 31.687
235 HB2 GLN 34 HB2 GLN 34 27.913 27.497 32.851
236 HB3 GLN 34 HB3 GLN 34 29.398 28.171 33.476
237 HG2 GLN 34 HG2 GLN 34 26.962 29.735 34.193
238 HG3 GLN 34 HG3 GLN 34 26.937 28.074 34.765
239 HE21 GLN 34 HE21 GLN 34 30.004 30.384 36.293
240 HE22 GLN 34 HE22 GLN 34 29.752 30.393 34.549
Start of MODEL 7
1 H1 GLY 1 H1 GLY 1 28.070 24.996 14.386
2 H2 GLY 1 H2 GLY 1 28.599 26.528 14.011
3 H3 GLY 1 H3 GLY 1 29.665 25.290 14.096
4 HA2 GLY 1 HA2 GLY 1 29.289 25.772 11.807
5 HA3 GLY 1 HA3 GLY 1 28.564 24.201 12.205
6 H SER 2 H SER 2 27.193 24.623 10.295
7 HA SER 2 HA SER 2 25.498 26.954 10.335
8 HB2 SER 2 HB2 SER 2 24.676 26.261 8.220
9 HB3 SER 2 HB3 SER 2 26.435 26.115 8.288
10 HG SER 2 HG SER 2 25.518 24.369 7.264
11 H ALA 3 H ALA 3 25.056 24.064 11.956
12 HA ALA 3 HA ALA 3 22.304 24.869 12.613
13 HB1 ALA 3 HB1 ALA 3 21.357 22.621 12.241
14 HB2 ALA 3 HB2 ALA 3 21.951 23.333 10.729
15 HB3 ALA 3 HB3 ALA 3 22.911 22.084 11.551
16 H CYS 4 H CYS 4 23.989 25.458 14.363
17 HA CYS 4 HA CYS 4 24.868 23.361 16.184
18 HB2 CYS 4 HB2 CYS 4 26.041 25.499 15.825
19 HB3 CYS 4 HB3 CYS 4 24.712 26.364 16.586
20 H GLN 5 H GLN 5 24.099 22.844 18.229
21 HA GLN 5 HA GLN 5 21.431 23.877 19.094
22 HB2 GLN 5 HB2 GLN 5 22.435 21.018 19.329
23 HB3 GLN 5 HB3 GLN 5 20.865 21.614 19.800
24 HG2 GLN 5 HG2 GLN 5 21.992 21.190 17.011
25 HG3 GLN 5 HG3 GLN 5 20.634 20.359 17.753
26 HE21 GLN 5 HE21 GLN 5 19.541 22.995 15.208
27 HE22 GLN 5 HE22 GLN 5 20.648 21.628 15.159
28 H PHE 6 H PHE 6 21.332 24.456 21.294
29 HA PHE 6 HA PHE 6 23.675 24.926 22.651
30 HB2 PHE 6 HB2 PHE 6 22.466 25.498 24.639
31 HB3 PHE 6 HB3 PHE 6 21.581 26.064 23.260
32 HD1 PHE 6 HD1 PHE 6 19.289 25.389 22.878
33 HD2 PHE 6 HD2 PHE 6 21.665 23.393 25.880
34 HE1 PHE 6 HE1 PHE 6 17.271 24.205 23.706
35 HE2 PHE 6 HE2 PHE 6 19.666 22.157 26.642
36 HZ PHE 6 HZ PHE 6 17.454 22.566 25.568
37 H TRP 7 H TRP 7 21.739 21.910 23.046
38 HA TRP 7 HA TRP 7 22.994 20.957 25.345
39 HB2 TRP 7 HB2 TRP 7 22.105 18.868 24.879
40 HB3 TRP 7 HB3 TRP 7 20.980 20.004 24.159
41 HD1 TRP 7 HD1 TRP 7 20.944 20.055 21.466
42 HE1 TRP 7 HE1 TRP 7 21.713 18.405 19.640
43 HE3 TRP 7 HE3 TRP 7 23.799 16.947 24.348
44 HZ2 TRP 7 HZ2 TRP 7 23.218 15.948 19.498
45 HZ3 TRP 7 HZ3 TRP 7 24.856 14.931 23.351
46 HH2 TRP 7 HH2 TRP 7 24.543 14.402 20.950
47 H SER 8 H SER 8 24.207 20.788 22.021
48 HA SER 8 HA SER 8 26.386 18.974 22.587
49 HB2 SER 8 HB2 SER 8 25.407 19.376 20.321
50 HB3 SER 8 HB3 SER 8 26.170 20.975 20.322
51 HG SER 8 HG SER 8 27.324 18.404 20.248
52 H CYS 9 H CYS 9 26.155 22.562 22.390
53 HA CYS 9 HA CYS 9 28.890 23.078 23.200
54 HB2 CYS 9 HB2 CYS 9 26.351 24.726 23.239
55 HB3 CYS 9 HB3 CYS 9 27.893 25.338 23.832
56 H ASN 10 H ASN 10 25.841 22.676 25.061
57 HA ASN 10 HA ASN 10 26.809 23.421 27.608
58 HB2 ASN 10 HB2 ASN 10 24.400 22.948 26.781
59 HB3 ASN 10 HB3 ASN 10 24.725 21.247 27.089
60 HD21 ASN 10 HD21 ASN 10 24.309 21.659 30.604
61 HD22 ASN 10 HD22 ASN 10 24.773 20.543 29.321
62 H SER 11 H SER 11 26.644 20.161 26.140
63 HA SER 11 HA SER 11 28.032 18.743 28.163
64 HB2 SER 11 HB2 SER 11 28.142 18.119 25.191
65 HB3 SER 11 HB3 SER 11 28.337 17.007 26.562
66 HG SER 11 HG SER 11 25.961 18.366 25.731
67 H SER 12 H SER 12 29.327 20.418 25.261
68 HA SER 12 HA SER 12 32.082 19.726 25.625
69 HB2 SER 12 HB2 SER 12 31.250 20.654 23.524
70 HB3 SER 12 HB3 SER 12 30.791 22.159 24.332
71 HG SER 12 HG SER 12 33.368 21.114 23.812
72 H CYS 13 H CYS 13 30.291 22.686 26.702
73 HA CYS 13 HA CYS 13 32.455 23.866 28.092
74 HB2 CYS 13 HB2 CYS 13 29.448 24.057 28.311
75 HB3 CYS 13 HB3 CYS 13 30.519 24.990 29.352
76 H ILE 14 H ILE 14 29.877 21.684 29.465
77 HA ILE 14 HA ILE 14 31.068 21.594 32.035
78 HB ILE 14 HB ILE 14 29.498 19.401 30.639
79 HG12 ILE 14 HG12 ILE 14 28.455 21.386 32.701
80 HG13 ILE 14 HG13 ILE 14 28.376 21.785 30.999
81 HG21 ILE 14 HG21 ILE 14 30.270 20.000 33.527
82 HG22 ILE 14 HG22 ILE 14 29.069 18.757 33.073
83 HG23 ILE 14 HG23 ILE 14 30.755 18.587 32.583
84 HD11 ILE 14 HD11 ILE 14 26.268 20.843 31.726
85 HD12 ILE 14 HD12 ILE 14 27.038 19.753 30.551
86 HD13 ILE 14 HD13 ILE 14 27.058 19.368 32.287
87 H SER 15 H SER 15 31.870 19.640 29.136
88 HA SER 15 HA SER 15 33.879 18.021 30.354
89 HB2 SER 15 HB2 SER 15 33.906 18.994 27.479
90 HB3 SER 15 HB3 SER 15 34.704 17.563 28.156
91 HG SER 15 HG SER 15 31.889 18.025 28.014
92 H ARG 16 H ARG 16 34.006 21.393 29.393
93 HA ARG 16 HA ARG 16 36.936 21.645 29.745
94 HB2 ARG 16 HB2 ARG 16 34.745 23.709 29.324
95 HB3 ARG 16 HB3 ARG 16 36.463 24.085 29.444
96 HG2 ARG 16 HG2 ARG 16 36.954 22.919 27.403
97 HG3 ARG 16 HG3 ARG 16 35.363 22.144 27.412
98 HD2 ARG 16 HD2 ARG 16 35.464 23.901 25.718
99 HD3 ARG 16 HD3 ARG 16 34.230 24.204 26.948
100 HE ARG 16 HE ARG 16 36.652 25.567 27.675
101 HH11 ARG 16 HH11 ARG 16 34.206 25.844 25.123
102 HH12 ARG 16 HH12 ARG 16 34.485 27.574 25.038
103 HH21 ARG 16 HH21 ARG 16 36.523 27.793 27.731
104 HH22 ARG 16 HH22 ARG 16 35.429 28.628 26.693
105 H GLY 17 H GLY 17 34.154 21.785 31.790
106 HA2 GLY 17 HA2 GLY 17 34.871 21.319 34.171
107 HA3 GLY 17 HA3 GLY 17 35.813 22.817 34.075
108 H TYR 18 H TYR 18 33.058 23.418 32.269
109 HA TYR 18 HA TYR 18 31.989 25.102 34.391
110 HB2 TYR 18 HB2 TYR 18 31.302 24.733 31.457
111 HB3 TYR 18 HB3 TYR 18 30.628 25.957 32.480
112 HD1 TYR 18 HD1 TYR 18 31.763 27.979 33.016
113 HD2 TYR 18 HD2 TYR 18 33.828 24.802 30.981
114 HE1 TYR 18 HE1 TYR 18 33.648 29.521 32.532
115 HE2 TYR 18 HE2 TYR 18 35.752 26.346 30.533
116 HH TYR 18 HH TYR 18 36.444 28.633 30.563
117 H ARG 19 H ARG 19 29.353 25.295 33.677
118 HA ARG 19 HA ARG 19 27.998 22.707 34.275
119 HB2 ARG 19 HB2 ARG 19 27.642 25.201 35.964
120 HB3 ARG 19 HB3 ARG 19 26.554 23.829 35.961
121 HG2 ARG 19 HG2 ARG 19 27.774 23.132 37.707
122 HG3 ARG 19 HG3 ARG 19 28.792 22.454 36.451
123 HD2 ARG 19 HD2 ARG 19 30.290 23.495 37.897
124 HD3 ARG 19 HD3 ARG 19 30.143 24.678 36.594
125 HE ARG 19 HE ARG 19 28.236 25.565 38.340
126 HH11 ARG 19 HH11 ARG 19 31.645 24.913 38.816
127 HH12 ARG 19 HH12 ARG 19 31.690 25.838 40.296
128 HH21 ARG 19 HH21 ARG 19 28.399 26.799 40.095
129 HH22 ARG 19 HH22 ARG 19 29.925 26.901 40.989
130 H GLN 20 H GLN 20 28.215 25.048 32.097
131 HA GLN 20 HA GLN 20 25.630 24.606 31.003
132 HB2 GLN 20 HB2 GLN 20 25.224 26.419 32.774
133 HB3 GLN 20 HB3 GLN 20 26.194 27.504 31.777
134 HG2 GLN 20 HG2 GLN 20 24.614 27.461 29.999
135 HG3 GLN 20 HG3 GLN 20 23.878 25.975 30.574
136 HE21 GLN 20 HE21 GLN 20 21.392 28.477 31.379
137 HE22 GLN 20 HE22 GLN 20 22.009 27.536 30.001
138 H GLY 21 H GLY 21 25.435 25.521 28.793
139 HA2 GLY 21 HA2 GLY 21 27.370 27.214 27.695
140 HA3 GLY 21 HA3 GLY 21 27.812 25.564 27.229
141 H TYR 22 H TYR 22 27.211 27.508 25.378
142 HA TYR 22 HA TYR 22 24.868 26.502 23.917
143 HB2 TYR 22 HB2 TYR 22 23.923 28.973 23.946
144 HB3 TYR 22 HB3 TYR 22 23.563 27.809 25.205
145 HD1 TYR 22 HD1 TYR 22 23.945 28.194 27.380
146 HD2 TYR 22 HD2 TYR 22 25.934 30.655 24.485
147 HE1 TYR 22 HE1 TYR 22 24.871 29.629 29.250
148 HE2 TYR 22 HE2 TYR 22 26.866 32.079 26.324
149 HH TYR 22 HH TYR 22 27.287 32.110 28.628
150 H CYS 23 H CYS 23 24.416 27.732 21.947
151 HA CYS 23 HA CYS 23 26.879 28.250 20.409
152 HB2 CYS 23 HB2 CYS 23 23.988 28.184 19.509
153 HB3 CYS 23 HB3 CYS 23 25.406 28.014 18.498
154 H TRP 24 H TRP 24 26.531 29.937 18.609
155 HA TRP 24 HA TRP 24 25.065 32.362 19.479
156 HB2 TRP 24 HB2 TRP 24 27.897 32.266 18.465
157 HB3 TRP 24 HB3 TRP 24 26.970 33.748 18.725
158 HD1 TRP 24 HD1 TRP 24 29.111 31.239 20.459
159 HE1 TRP 24 HE1 TRP 24 29.277 31.723 22.968
160 HE3 TRP 24 HE3 TRP 24 25.515 34.843 20.836
161 HZ2 TRP 24 HZ2 TRP 24 28.120 33.587 24.882
162 HZ3 TRP 24 HZ3 TRP 24 25.043 35.938 23.025
163 HH2 TRP 24 HH2 TRP 24 26.358 35.327 25.039
164 H GLY 25 H GLY 25 23.614 31.006 17.990
165 HA2 GLY 25 HA2 GLY 25 22.326 31.265 16.075
166 HA3 GLY 25 HA3 GLY 25 23.427 32.548 15.574
167 H ILE 26 H ILE 26 24.409 32.182 13.720
168 HA ILE 26 HA ILE 26 25.001 29.397 12.819
169 HB ILE 26 HB ILE 26 22.868 30.216 11.909
170 HG12 ILE 26 HG12 ILE 26 25.004 29.876 9.780
171 HG13 ILE 26 HG13 ILE 26 24.326 28.580 10.785
172 HG21 ILE 26 HG21 ILE 26 24.478 32.299 10.366
173 HG22 ILE 26 HG22 ILE 26 22.746 31.964 10.213
174 HG23 ILE 26 HG23 ILE 26 23.359 32.645 11.706
175 HD11 ILE 26 HD11 ILE 26 22.072 29.036 9.839
176 HD12 ILE 26 HD12 ILE 26 22.805 30.232 8.742
177 HD13 ILE 26 HD13 ILE 26 23.262 28.527 8.627
178 H GLN 27 H GLN 27 25.881 32.828 12.489
179 HA GLN 27 HA GLN 27 28.512 32.032 11.309
180 HB2 GLN 27 HB2 GLN 27 27.216 33.527 9.938
181 HB3 GLN 27 HB3 GLN 27 26.962 34.653 11.265
182 HG2 GLN 27 HG2 GLN 27 29.235 35.392 11.240
183 HG3 GLN 27 HG3 GLN 27 29.752 34.001 10.288
184 HE21 GLN 27 HE21 GLN 27 29.792 36.460 7.664
185 HE22 GLN 27 HE22 GLN 27 30.799 35.759 8.921
186 H TYR 28 H TYR 28 29.630 31.432 13.107
187 HA TYR 28 HA TYR 28 30.682 33.412 14.899
188 HB2 TYR 28 HB2 TYR 28 29.821 32.694 16.979
189 HB3 TYR 28 HB3 TYR 28 28.408 32.903 15.964
190 HD1 TYR 28 HD1 TYR 28 30.412 30.591 17.917
191 HD2 TYR 28 HD2 TYR 28 27.239 30.845 15.027
192 HE1 TYR 28 HE1 TYR 28 30.034 28.137 18.126
193 HE2 TYR 28 HE2 TYR 28 26.811 28.413 15.281
194 HH TYR 28 HH TYR 28 29.073 26.318 17.150
195 H LYS 29 H LYS 29 32.357 32.540 16.256
196 HA LYS 29 HA LYS 29 33.889 30.469 14.896
197 HB2 LYS 29 HB2 LYS 29 34.474 32.284 17.274
198 HB3 LYS 29 HB3 LYS 29 35.667 31.230 16.510
199 HG2 LYS 29 HG2 LYS 29 35.610 32.406 14.454
200 HG3 LYS 29 HG3 LYS 29 34.177 33.340 14.909
201 HD2 LYS 29 HD2 LYS 29 36.845 33.589 16.354
202 HD3 LYS 29 HD3 LYS 29 36.317 34.596 15.002
203 HE2 LYS 29 HE2 LYS 29 34.222 35.144 16.336
204 HE3 LYS 29 HE3 LYS 29 35.022 34.416 17.736
205 HZ1 LYS 29 HZ1 LYS 29 36.825 36.033 17.453
206 HZ2 LYS 29 HZ2 LYS 29 36.108 36.656 16.115
207 HZ3 LYS 29 HZ3 LYS 29 35.391 36.837 17.579
208 H TYR 30 H TYR 30 32.674 30.794 18.268
209 HA TYR 30 HA TYR 30 32.965 27.910 18.711
210 HB2 TYR 30 HB2 TYR 30 34.403 28.459 20.806
211 HB3 TYR 30 HB3 TYR 30 35.161 28.369 19.225
212 HD1 TYR 30 HD1 TYR 30 36.589 30.070 18.520
213 HD2 TYR 30 HD2 TYR 30 33.748 30.902 21.646
214 HE1 TYR 30 HE1 TYR 30 37.592 32.322 18.843
215 HE2 TYR 30 HE2 TYR 30 34.784 33.143 21.964
216 HH TYR 30 HH TYR 30 36.182 34.841 20.735
217 H CYS 31 H CYS 31 32.033 27.127 20.610
218 HA CYS 31 HA CYS 31 29.642 28.354 21.536
219 HB2 CYS 31 HB2 CYS 31 31.433 26.292 22.894
220 HB3 CYS 31 HB3 CYS 31 29.771 26.610 23.340
221 H GLN 32 H GLN 32 29.153 28.873 23.853
222 HA GLN 32 HA GLN 32 31.452 29.796 25.473
223 HB2 GLN 32 HB2 GLN 32 28.982 31.453 24.890
224 HB3 GLN 32 HB3 GLN 32 29.941 31.705 26.328
225 HG2 GLN 32 HG2 GLN 32 31.011 31.945 23.486
226 HG3 GLN 32 HG3 GLN 32 30.617 33.290 24.560
227 HE21 GLN 32 HE21 GLN 32 34.316 32.470 24.565
228 HE22 GLN 32 HE22 GLN 32 33.123 33.113 23.410
229 H CYS 33 H CYS 33 30.968 30.017 27.732
230 HA CYS 33 HA CYS 33 29.278 27.704 28.649
231 HB2 CYS 33 HB2 CYS 33 32.025 28.564 29.601
232 HB3 CYS 33 HB3 CYS 33 31.135 27.122 30.037
233 H GLN 34 H GLN 34 29.561 27.738 31.258
234 HA GLN 34 HA GLN 34 27.527 29.454 32.076
235 HB2 GLN 34 HB2 GLN 34 28.132 27.394 33.277
236 HB3 GLN 34 HB3 GLN 34 29.638 28.141 33.839
237 HG2 GLN 34 HG2 GLN 34 28.342 29.854 35.080
238 HG3 GLN 34 HG3 GLN 34 26.843 29.191 34.436
239 HE21 GLN 34 HE21 GLN 34 26.590 27.116 37.275
240 HE22 GLN 34 HE22 GLN 34 25.784 28.013 35.979
Start of MODEL 8
1 H1 GLY 1 H1 GLY 1 27.302 17.713 9.192
2 H2 GLY 1 H2 GLY 1 28.391 18.937 8.996
3 H3 GLY 1 H3 GLY 1 26.899 19.045 8.322
4 HA2 GLY 1 HA2 GLY 1 25.882 19.083 10.537
5 HA3 GLY 1 HA3 GLY 1 27.520 19.030 11.206
6 H SER 2 H SER 2 25.288 20.969 9.211
7 HA SER 2 HA SER 2 27.126 23.289 9.342
8 HB2 SER 2 HB2 SER 2 25.808 24.301 7.721
9 HB3 SER 2 HB3 SER 2 26.004 22.610 7.227
10 HG SER 2 HG SER 2 23.890 22.363 7.350
11 H ALA 3 H ALA 3 24.843 22.167 11.421
12 HA ALA 3 HA ALA 3 23.918 24.867 12.291
13 HB1 ALA 3 HB1 ALA 3 21.867 23.716 13.055
14 HB2 ALA 3 HB2 ALA 3 22.145 23.467 11.321
15 HB3 ALA 3 HB3 ALA 3 22.520 22.169 12.473
16 H CYS 4 H CYS 4 23.403 25.158 14.536
17 HA CYS 4 HA CYS 4 24.931 23.426 16.436
18 HB2 CYS 4 HB2 CYS 4 26.081 25.562 16.179
19 HB3 CYS 4 HB3 CYS 4 24.597 26.432 16.592
20 H GLN 5 H GLN 5 24.009 22.939 18.370
21 HA GLN 5 HA GLN 5 21.336 23.985 19.091
22 HB2 GLN 5 HB2 GLN 5 22.077 21.026 18.861
23 HB3 GLN 5 HB3 GLN 5 20.733 21.645 19.788
24 HG2 GLN 5 HG2 GLN 5 19.675 21.078 17.825
25 HG3 GLN 5 HG3 GLN 5 19.909 22.802 17.619
26 HE21 GLN 5 HE21 GLN 5 20.720 21.429 14.342
27 HE22 GLN 5 HE22 GLN 5 19.436 22.121 15.308
28 H PHE 6 H PHE 6 21.204 24.464 21.244
29 HA PHE 6 HA PHE 6 23.565 24.893 22.595
30 HB2 PHE 6 HB2 PHE 6 22.255 25.431 24.591
31 HB3 PHE 6 HB3 PHE 6 21.605 26.153 23.143
32 HD1 PHE 6 HD1 PHE 6 19.336 25.832 22.508
33 HD2 PHE 6 HD2 PHE 6 21.078 23.404 25.620
34 HE1 PHE 6 HE1 PHE 6 17.094 24.915 23.046
35 HE2 PHE 6 HE2 PHE 6 18.849 22.409 26.079
36 HZ PHE 6 HZ PHE 6 16.850 23.177 24.810
37 H TRP 7 H TRP 7 21.562 21.961 22.970
38 HA TRP 7 HA TRP 7 22.696 21.025 25.363
39 HB2 TRP 7 HB2 TRP 7 21.710 18.971 24.910
40 HB3 TRP 7 HB3 TRP 7 20.663 20.147 24.123
41 HD1 TRP 7 HD1 TRP 7 20.583 20.107 21.503
42 HE1 TRP 7 HE1 TRP 7 21.462 18.507 19.654
43 HE3 TRP 7 HE3 TRP 7 23.666 17.180 24.347
44 HZ2 TRP 7 HZ2 TRP 7 23.253 16.295 19.463
45 HZ3 TRP 7 HZ3 TRP 7 25.032 15.404 23.282
46 HH2 TRP 7 HH2 TRP 7 24.839 14.958 20.847
47 H SER 8 H SER 8 24.008 20.793 22.067
48 HA SER 8 HA SER 8 26.045 18.833 22.777
49 HB2 SER 8 HB2 SER 8 24.997 18.998 20.533
50 HB3 SER 8 HB3 SER 8 25.828 20.539 20.278
51 HG SER 8 HG SER 8 27.111 18.055 20.894
52 H CYS 9 H CYS 9 25.971 22.386 22.418
53 HA CYS 9 HA CYS 9 28.778 22.796 23.073
54 HB2 CYS 9 HB2 CYS 9 26.288 24.515 23.072
55 HB3 CYS 9 HB3 CYS 9 27.754 25.084 23.863
56 H ASN 10 H ASN 10 25.788 22.453 25.004
57 HA ASN 10 HA ASN 10 26.798 23.316 27.474
58 HB2 ASN 10 HB2 ASN 10 24.405 22.884 26.804
59 HB3 ASN 10 HB3 ASN 10 24.698 21.157 26.976
60 HD21 ASN 10 HD21 ASN 10 23.756 23.273 30.201
61 HD22 ASN 10 HD22 ASN 10 23.579 23.878 28.560
62 H SER 11 H SER 11 26.742 19.922 26.243
63 HA SER 11 HA SER 11 28.137 18.798 28.488
64 HB2 SER 11 HB2 SER 11 28.478 16.880 26.918
65 HB3 SER 11 HB3 SER 11 26.787 17.417 27.030
66 HG SER 11 HG SER 11 27.748 17.053 24.847
67 H SER 12 H SER 12 29.263 20.183 25.406
68 HA SER 12 HA SER 12 32.044 19.580 25.621
69 HB2 SER 12 HB2 SER 12 31.096 20.428 23.549
70 HB3 SER 12 HB3 SER 12 30.611 21.937 24.330
71 HG SER 12 HG SER 12 33.206 20.983 23.770
72 H CYS 13 H CYS 13 30.327 22.622 26.602
73 HA CYS 13 HA CYS 13 32.479 23.855 27.899
74 HB2 CYS 13 HB2 CYS 13 29.473 23.950 28.309
75 HB3 CYS 13 HB3 CYS 13 30.580 25.016 29.153
76 H ILE 14 H ILE 14 29.959 21.691 29.436
77 HA ILE 14 HA ILE 14 31.172 21.841 31.996
78 HB ILE 14 HB ILE 14 29.611 19.504 30.849
79 HG12 ILE 14 HG12 ILE 14 28.541 21.596 32.771
80 HG13 ILE 14 HG13 ILE 14 28.484 21.924 31.048
81 HG21 ILE 14 HG21 ILE 14 30.554 20.348 33.616
82 HG22 ILE 14 HG22 ILE 14 29.221 19.193 33.410
83 HG23 ILE 14 HG23 ILE 14 30.837 18.794 32.806
84 HD11 ILE 14 HD11 ILE 14 26.385 20.925 31.869
85 HD12 ILE 14 HD12 ILE 14 27.171 19.911 30.636
86 HD13 ILE 14 HD13 ILE 14 27.251 19.461 32.348
87 H SER 15 H SER 15 31.972 19.583 29.299
88 HA SER 15 HA SER 15 33.896 18.078 30.776
89 HB2 SER 15 HB2 SER 15 33.021 17.271 28.675
90 HB3 SER 15 HB3 SER 15 33.698 18.653 27.800
91 HG SER 15 HG SER 15 35.228 16.751 29.281
92 H ARG 16 H ARG 16 34.168 21.267 29.310
93 HA ARG 16 HA ARG 16 37.090 21.492 29.637
94 HB2 ARG 16 HB2 ARG 16 34.926 23.610 29.237
95 HB3 ARG 16 HB3 ARG 16 36.652 23.937 29.282
96 HG2 ARG 16 HG2 ARG 16 37.039 22.583 27.294
97 HG3 ARG 16 HG3 ARG 16 35.368 21.993 27.348
98 HD2 ARG 16 HD2 ARG 16 35.652 23.649 25.586
99 HD3 ARG 16 HD3 ARG 16 34.477 24.160 26.802
100 HE ARG 16 HE ARG 16 37.097 25.218 27.423
101 HH11 ARG 16 HH11 ARG 16 34.553 25.682 25.018
102 HH12 ARG 16 HH12 ARG 16 34.898 27.409 24.929
103 HH21 ARG 16 HH21 ARG 16 37.381 27.475 27.222
104 HH22 ARG 16 HH22 ARG 16 36.646 28.252 25.845
105 H GLY 17 H GLY 17 34.281 22.164 31.633
106 HA2 GLY 17 HA2 GLY 17 35.195 21.757 34.090
107 HA3 GLY 17 HA3 GLY 17 35.901 23.355 33.814
108 H TYR 18 H TYR 18 33.159 23.710 32.099
109 HA TYR 18 HA TYR 18 32.051 25.348 34.195
110 HB2 TYR 18 HB2 TYR 18 31.315 24.854 31.293
111 HB3 TYR 18 HB3 TYR 18 30.684 26.160 32.258
112 HD1 TYR 18 HD1 TYR 18 32.511 27.642 33.524
113 HD2 TYR 18 HD2 TYR 18 33.316 25.222 30.064
114 HE1 TYR 18 HE1 TYR 18 34.487 29.040 33.021
115 HE2 TYR 18 HE2 TYR 18 35.342 26.616 29.566
116 HH TYR 18 HH TYR 18 36.384 29.208 31.790
117 H ARG 19 H ARG 19 29.379 25.467 33.434
118 HA ARG 19 HA ARG 19 28.126 22.934 34.425
119 HB2 ARG 19 HB2 ARG 19 27.680 25.756 35.478
120 HB3 ARG 19 HB3 ARG 19 26.671 24.358 35.845
121 HG2 ARG 19 HG2 ARG 19 27.977 24.259 37.672
122 HG3 ARG 19 HG3 ARG 19 28.978 23.280 36.602
123 HD2 ARG 19 HD2 ARG 19 30.225 25.479 36.043
124 HD3 ARG 19 HD3 ARG 19 29.325 26.213 37.382
125 HE ARG 19 HE ARG 19 30.395 23.912 38.462
126 HH11 ARG 19 HH11 ARG 19 31.927 26.741 36.941
127 HH12 ARG 19 HH12 ARG 19 33.468 26.327 37.687
128 HH21 ARG 19 HH21 ARG 19 32.435 23.514 39.276
129 HH22 ARG 19 HH22 ARG 19 33.706 24.679 38.920
130 H GLN 20 H GLN 20 28.153 25.243 31.993
131 HA GLN 20 HA GLN 20 25.589 24.540 30.874
132 HB2 GLN 20 HB2 GLN 20 25.112 26.400 32.590
133 HB3 GLN 20 HB3 GLN 20 26.181 27.411 31.657
134 HG2 GLN 20 HG2 GLN 20 24.061 28.106 31.091
135 HG3 GLN 20 HG3 GLN 20 24.521 27.156 29.704
136 HE21 GLN 20 HE21 GLN 20 20.990 26.356 30.684
137 HE22 GLN 20 HE22 GLN 20 21.831 27.864 30.373
138 H GLY 21 H GLY 21 25.351 25.405 28.651
139 HA2 GLY 21 HA2 GLY 21 27.304 27.067 27.558
140 HA3 GLY 21 HA3 GLY 21 27.708 25.425 27.065
141 H TYR 22 H TYR 22 27.043 27.544 25.324
142 HA TYR 22 HA TYR 22 24.929 26.402 23.674
143 HB2 TYR 22 HB2 TYR 22 23.600 28.621 23.735
144 HB3 TYR 22 HB3 TYR 22 23.387 27.462 25.030
145 HD1 TYR 22 HD1 TYR 22 25.046 30.728 24.216
146 HD2 TYR 22 HD2 TYR 22 23.803 27.950 27.275
147 HE1 TYR 22 HE1 TYR 22 25.573 32.414 25.974
148 HE2 TYR 22 HE2 TYR 22 24.345 29.609 29.029
149 HH TYR 22 HH TYR 22 25.721 32.836 28.237
150 H CYS 23 H CYS 23 24.623 27.713 21.630
151 HA CYS 23 HA CYS 23 27.166 28.995 20.778
152 HB2 CYS 23 HB2 CYS 23 24.723 27.981 19.325
153 HB3 CYS 23 HB3 CYS 23 25.832 29.109 18.554
154 H TRP 24 H TRP 24 27.166 31.042 19.722
155 HA TRP 24 HA TRP 24 25.690 33.108 21.069
156 HB2 TRP 24 HB2 TRP 24 27.503 33.134 18.650
157 HB3 TRP 24 HB3 TRP 24 26.918 34.573 19.429
158 HD1 TRP 24 HD1 TRP 24 29.369 31.665 20.104
159 HE1 TRP 24 HE1 TRP 24 31.032 32.405 21.910
160 HE3 TRP 24 HE3 TRP 24 27.317 36.214 21.291
161 HZ2 TRP 24 HZ2 TRP 24 31.393 34.629 23.683
162 HZ3 TRP 24 HZ3 TRP 24 28.362 37.627 23.060
163 HH2 TRP 24 HH2 TRP 24 30.393 36.848 24.252
164 H GLY 25 H GLY 25 24.498 31.179 18.622
165 HA2 GLY 25 HA2 GLY 25 22.532 31.359 17.402
166 HA3 GLY 25 HA3 GLY 25 22.336 32.987 18.040
167 H ILE 26 H ILE 26 24.524 34.325 17.078
168 HA ILE 26 HA ILE 26 24.444 34.102 14.087
169 HB ILE 26 HB ILE 26 24.162 36.558 15.847
170 HG12 ILE 26 HG12 ILE 26 22.288 35.720 13.601
171 HG13 ILE 26 HG13 ILE 26 22.077 35.101 15.236
172 HG21 ILE 26 HG21 ILE 26 24.069 37.873 13.687
173 HG22 ILE 26 HG22 ILE 26 25.645 37.215 14.053
174 HG23 ILE 26 HG23 ILE 26 24.612 36.422 12.832
175 HD11 ILE 26 HD11 ILE 26 22.009 38.047 14.493
176 HD12 ILE 26 HD12 ILE 26 20.642 37.012 14.918
177 HD13 ILE 26 HD13 ILE 26 21.873 37.377 16.139
178 H GLN 27 H GLN 27 26.367 34.173 13.113
179 HA GLN 27 HA GLN 27 28.603 34.307 12.734
180 HB2 GLN 27 HB2 GLN 27 27.527 36.657 12.722
181 HB3 GLN 27 HB3 GLN 27 28.371 36.932 14.227
182 HG2 GLN 27 HG2 GLN 27 29.842 37.807 12.679
183 HG3 GLN 27 HG3 GLN 27 30.523 36.204 12.915
184 HE21 GLN 27 HE21 GLN 27 30.617 36.340 9.316
185 HE22 GLN 27 HE22 GLN 27 31.570 36.655 10.759
186 H TYR 28 H TYR 28 29.236 32.499 14.129
187 HA TYR 28 HA TYR 28 31.235 33.288 16.166
188 HB2 TYR 28 HB2 TYR 28 30.296 31.686 17.812
189 HB3 TYR 28 HB3 TYR 28 29.241 33.038 17.455
190 HD1 TYR 28 HD1 TYR 28 27.060 32.674 16.449
191 HD2 TYR 28 HD2 TYR 28 29.798 29.380 16.909
192 HE1 TYR 28 HE1 TYR 28 25.286 31.101 15.727
193 HE2 TYR 28 HE2 TYR 28 28.037 27.817 16.135
194 HH TYR 28 HH TYR 28 24.812 28.968 15.035
195 H LYS 29 H LYS 29 32.717 31.758 16.792
196 HA LYS 29 HA LYS 29 33.053 29.353 15.025
197 HB2 LYS 29 HB2 LYS 29 35.257 30.841 16.479
198 HB3 LYS 29 HB3 LYS 29 35.410 29.651 15.181
199 HG2 LYS 29 HG2 LYS 29 34.262 31.325 13.637
200 HG3 LYS 29 HG3 LYS 29 34.337 32.490 14.971
201 HD2 LYS 29 HD2 LYS 29 36.900 31.941 15.014
202 HD3 LYS 29 HD3 LYS 29 36.609 31.289 13.380
203 HE2 LYS 29 HE2 LYS 29 35.511 33.497 12.795
204 HE3 LYS 29 HE3 LYS 29 35.937 34.081 14.409
205 HZ1 LYS 29 HZ1 LYS 29 37.788 33.335 12.222
206 HZ2 LYS 29 HZ2 LYS 29 37.610 34.811 12.957
207 HZ3 LYS 29 HZ3 LYS 29 38.309 33.576 13.776
208 H TYR 30 H TYR 30 32.468 30.259 18.273
209 HA TYR 30 HA TYR 30 33.199 27.555 19.271
210 HB2 TYR 30 HB2 TYR 30 34.009 30.200 20.542
211 HB3 TYR 30 HB3 TYR 30 34.243 28.612 21.259
212 HD1 TYR 30 HD1 TYR 30 35.612 26.872 19.861
213 HD2 TYR 30 HD2 TYR 30 35.747 31.133 19.224
214 HE1 TYR 30 HE1 TYR 30 37.808 26.627 18.713
215 HE2 TYR 30 HE2 TYR 30 37.923 30.889 18.049
216 HH TYR 30 HH TYR 30 39.520 27.692 17.664
217 H CYS 31 H CYS 31 32.296 27.051 21.353
218 HA CYS 31 HA CYS 31 29.564 28.048 21.761
219 HB2 CYS 31 HB2 CYS 31 31.338 26.212 23.418
220 HB3 CYS 31 HB3 CYS 31 29.620 26.458 23.676
221 H GLN 32 H GLN 32 28.852 29.061 23.706
222 HA GLN 32 HA GLN 32 30.872 30.524 25.353
223 HB2 GLN 32 HB2 GLN 32 29.375 32.090 24.358
224 HB3 GLN 32 HB3 GLN 32 27.977 31.063 24.646
225 HG2 GLN 32 HG2 GLN 32 27.920 32.964 26.113
226 HG3 GLN 32 HG3 GLN 32 28.071 31.491 27.048
227 HE21 GLN 32 HE21 GLN 32 30.219 33.885 28.733
228 HE22 GLN 32 HE22 GLN 32 28.518 33.766 28.322
229 H CYS 33 H CYS 33 30.750 30.212 27.636
230 HA CYS 33 HA CYS 33 29.277 27.739 28.538
231 HB2 CYS 33 HB2 CYS 33 32.192 28.446 29.026
232 HB3 CYS 33 HB3 CYS 33 31.340 27.019 29.569
233 H GLN 34 H GLN 34 29.110 27.457 30.770
234 HA GLN 34 HA GLN 34 28.016 28.140 32.631
235 HB2 GLN 34 HB2 GLN 34 30.314 27.996 33.380
236 HB3 GLN 34 HB3 GLN 34 30.549 29.731 33.129
237 HG2 GLN 34 HG2 GLN 34 29.012 30.271 34.877
238 HG3 GLN 34 HG3 GLN 34 28.312 28.657 34.899
239 HE21 GLN 34 HE21 GLN 34 30.720 29.260 37.795
240 HE22 GLN 34 HE22 GLN 34 29.361 30.184 37.147
Start of MODEL 9
1 H1 GLY 1 H1 GLY 1 25.346 24.914 9.416
2 H2 GLY 1 H2 GLY 1 26.968 25.141 9.344
3 H3 GLY 1 H3 GLY 1 26.109 25.644 10.672
4 HA2 GLY 1 HA2 GLY 1 26.520 22.857 9.805
5 HA3 GLY 1 HA3 GLY 1 27.300 23.636 11.200
6 H SER 2 H SER 2 26.420 22.874 13.019
7 HA SER 2 HA SER 2 23.962 21.567 13.369
8 HB2 SER 2 HB2 SER 2 25.907 21.485 14.907
9 HB3 SER 2 HB3 SER 2 25.575 23.160 15.394
10 HG SER 2 HG SER 2 24.306 22.323 16.808
11 H ALA 3 H ALA 3 21.975 22.159 14.441
12 HA ALA 3 HA ALA 3 20.920 24.697 13.552
13 HB1 ALA 3 HB1 ALA 3 19.670 22.455 15.190
14 HB2 ALA 3 HB2 ALA 3 18.797 23.771 14.384
15 HB3 ALA 3 HB3 ALA 3 19.688 22.578 13.423
16 H CYS 4 H CYS 4 22.954 25.277 15.480
17 HA CYS 4 HA CYS 4 23.459 26.296 17.444
18 HB2 CYS 4 HB2 CYS 4 21.692 27.820 15.899
19 HB3 CYS 4 HB3 CYS 4 21.114 28.052 17.532
20 H GLN 5 H GLN 5 21.989 23.860 17.935
21 HA GLN 5 HA GLN 5 20.147 24.296 20.181
22 HB2 GLN 5 HB2 GLN 5 21.521 21.759 19.216
23 HB3 GLN 5 HB3 GLN 5 20.230 21.854 20.387
24 HG2 GLN 5 HG2 GLN 5 20.036 22.510 17.427
25 HG3 GLN 5 HG3 GLN 5 19.422 21.068 18.217
26 HE21 GLN 5 HE21 GLN 5 17.183 24.485 18.261
27 HE22 GLN 5 HE22 GLN 5 18.834 24.514 17.666
28 H PHE 6 H PHE 6 20.686 24.319 22.336
29 HA PHE 6 HA PHE 6 23.354 24.976 23.017
30 HB2 PHE 6 HB2 PHE 6 22.575 25.186 25.279
31 HB3 PHE 6 HB3 PHE 6 21.422 25.905 24.179
32 HD1 PHE 6 HD1 PHE 6 22.069 22.761 26.177
33 HD2 PHE 6 HD2 PHE 6 19.122 25.386 24.430
34 HE1 PHE 6 HE1 PHE 6 20.265 21.366 27.135
35 HE2 PHE 6 HE2 PHE 6 17.324 24.056 25.493
36 HZ PHE 6 HZ PHE 6 17.882 22.018 26.808
37 H TRP 7 H TRP 7 21.654 21.825 23.268
38 HA TRP 7 HA TRP 7 23.236 20.634 25.218
39 HB2 TRP 7 HB2 TRP 7 22.449 18.553 24.503
40 HB3 TRP 7 HB3 TRP 7 21.164 19.697 24.170
41 HD1 TRP 7 HD1 TRP 7 20.655 20.212 21.626
42 HE1 TRP 7 HE1 TRP 7 21.254 19.047 19.375
43 HE3 TRP 7 HE3 TRP 7 24.191 16.933 23.318
44 HZ2 TRP 7 HZ2 TRP 7 22.976 16.950 18.484
45 HZ3 TRP 7 HZ3 TRP 7 25.266 15.327 21.748
46 HH2 TRP 7 HH2 TRP 7 24.670 15.331 19.340
47 H SER 8 H SER 8 23.961 20.801 21.751
48 HA SER 8 HA SER 8 26.296 19.201 21.724
49 HB2 SER 8 HB2 SER 8 25.068 19.906 19.723
50 HB3 SER 8 HB3 SER 8 25.572 21.588 19.982
51 HG SER 8 HG SER 8 27.181 19.310 19.438
52 H CYS 9 H CYS 9 25.907 22.612 22.576
53 HA CYS 9 HA CYS 9 28.789 23.161 22.896
54 HB2 CYS 9 HB2 CYS 9 26.193 24.700 23.281
55 HB3 CYS 9 HB3 CYS 9 27.735 25.314 23.890
56 H ASN 10 H ASN 10 25.942 22.543 24.937
57 HA ASN 10 HA ASN 10 26.982 23.214 27.449
58 HB2 ASN 10 HB2 ASN 10 24.601 22.859 26.945
59 HB3 ASN 10 HB3 ASN 10 24.901 21.155 26.615
60 HD21 ASN 10 HD21 ASN 10 24.346 20.280 29.935
61 HD22 ASN 10 HD22 ASN 10 24.309 19.844 28.229
62 H SER 11 H SER 11 26.943 19.903 25.941
63 HA SER 11 HA SER 11 28.288 18.636 28.099
64 HB2 SER 11 HB2 SER 11 28.608 16.787 26.647
65 HB3 SER 11 HB3 SER 11 27.071 17.536 26.155
66 HG SER 11 HG SER 11 28.176 17.272 24.264
67 H SER 12 H SER 12 29.639 20.344 25.287
68 HA SER 12 HA SER 12 32.401 19.711 25.770
69 HB2 SER 12 HB2 SER 12 31.650 20.502 23.600
70 HB3 SER 12 HB3 SER 12 31.112 22.040 24.298
71 HG SER 12 HG SER 12 33.788 21.039 24.269
72 H CYS 13 H CYS 13 30.513 22.704 26.618
73 HA CYS 13 HA CYS 13 32.531 23.913 28.168
74 HB2 CYS 13 HB2 CYS 13 29.507 24.001 28.303
75 HB3 CYS 13 HB3 CYS 13 30.538 25.022 29.300
76 H ILE 14 H ILE 14 29.895 21.684 29.407
77 HA ILE 14 HA ILE 14 30.873 21.679 32.055
78 HB ILE 14 HB ILE 14 29.595 19.304 30.650
79 HG12 ILE 14 HG12 ILE 14 28.093 21.202 32.468
80 HG13 ILE 14 HG13 ILE 14 28.249 21.634 30.777
81 HG21 ILE 14 HG21 ILE 14 28.941 18.847 33.118
82 HG22 ILE 14 HG22 ILE 14 30.662 18.687 32.756
83 HG23 ILE 14 HG23 ILE 14 30.067 20.163 33.533
84 HD11 ILE 14 HD11 ILE 14 27.065 19.011 31.801
85 HD12 ILE 14 HD12 ILE 14 26.161 20.418 31.223
86 HD13 ILE 14 HD13 ILE 14 27.193 19.516 30.101
87 H SER 15 H SER 15 31.945 19.587 29.327
88 HA SER 15 HA SER 15 33.759 17.999 30.846
89 HB2 SER 15 HB2 SER 15 33.965 18.738 27.903
90 HB3 SER 15 HB3 SER 15 34.745 17.370 28.719
91 HG SER 15 HG SER 15 32.003 17.825 28.195
92 H ARG 16 H ARG 16 34.161 21.273 29.664
93 HA ARG 16 HA ARG 16 37.077 21.409 30.136
94 HB2 ARG 16 HB2 ARG 16 34.968 23.563 29.646
95 HB3 ARG 16 HB3 ARG 16 36.696 23.873 29.784
96 HG2 ARG 16 HG2 ARG 16 37.196 22.635 27.789
97 HG3 ARG 16 HG3 ARG 16 35.583 21.911 27.774
98 HD2 ARG 16 HD2 ARG 16 35.822 23.580 26.012
99 HD3 ARG 16 HD3 ARG 16 34.531 23.967 27.146
100 HE ARG 16 HE ARG 16 36.972 25.314 27.925
101 HH11 ARG 16 HH11 ARG 16 34.606 25.556 25.274
102 HH12 ARG 16 HH12 ARG 16 34.741 27.302 25.303
103 HH21 ARG 16 HH21 ARG 16 37.054 27.438 27.798
104 HH22 ARG 16 HH22 ARG 16 36.078 28.332 26.630
105 H GLY 17 H GLY 17 34.165 22.030 31.992
106 HA2 GLY 17 HA2 GLY 17 34.744 21.498 34.449
107 HA3 GLY 17 HA3 GLY 17 35.732 22.957 34.365
108 H TYR 18 H TYR 18 33.113 23.650 32.403
109 HA TYR 18 HA TYR 18 31.840 25.311 34.419
110 HB2 TYR 18 HB2 TYR 18 31.172 24.788 31.521
111 HB3 TYR 18 HB3 TYR 18 30.590 26.116 32.494
112 HD1 TYR 18 HD1 TYR 18 33.167 25.058 30.284
113 HD2 TYR 18 HD2 TYR 18 32.357 27.712 33.561
114 HE1 TYR 18 HE1 TYR 18 35.097 26.495 29.586
115 HE2 TYR 18 HE2 TYR 18 34.268 29.146 32.872
116 HH TYR 18 HH TYR 18 35.989 29.450 31.389
117 H ARG 19 H ARG 19 29.217 25.288 33.567
118 HA ARG 19 HA ARG 19 28.101 22.570 34.066
119 HB2 ARG 19 HB2 ARG 19 27.335 25.035 35.636
120 HB3 ARG 19 HB3 ARG 19 26.336 23.592 35.530
121 HG2 ARG 19 HG2 ARG 19 27.351 22.901 37.380
122 HG3 ARG 19 HG3 ARG 19 28.657 22.412 36.305
123 HD2 ARG 19 HD2 ARG 19 29.648 23.627 38.104
124 HD3 ARG 19 HD3 ARG 19 29.698 24.697 36.693
125 HE ARG 19 HE ARG 19 27.286 25.232 38.122
126 HH11 ARG 19 HH11 ARG 19 30.714 25.811 38.317
127 HH12 ARG 19 HH12 ARG 19 30.555 27.121 39.458
128 HH21 ARG 19 HH21 ARG 19 27.126 27.023 39.566
129 HH22 ARG 19 HH22 ARG 19 28.626 27.767 40.115
130 H GLN 20 H GLN 20 28.213 25.092 32.008
131 HA GLN 20 HA GLN 20 25.584 24.668 30.799
132 HB2 GLN 20 HB2 GLN 20 25.328 26.374 32.713
133 HB3 GLN 20 HB3 GLN 20 26.426 27.397 31.815
134 HG2 GLN 20 HG2 GLN 20 24.809 27.518 29.946
135 HG3 GLN 20 HG3 GLN 20 23.773 26.372 30.807
136 HE21 GLN 20 HE21 GLN 20 22.027 29.260 31.840
137 HE22 GLN 20 HE22 GLN 20 22.101 28.024 30.615
138 H GLY 21 H GLY 21 25.466 25.387 28.666
139 HA2 GLY 21 HA2 GLY 21 27.402 27.113 27.513
140 HA3 GLY 21 HA3 GLY 21 27.782 25.447 27.069
141 H TYR 22 H TYR 22 26.977 27.699 25.406
142 HA TYR 22 HA TYR 22 24.816 26.555 23.788
143 HB2 TYR 22 HB2 TYR 22 23.489 28.758 24.001
144 HB3 TYR 22 HB3 TYR 22 23.354 27.571 25.282
145 HD1 TYR 22 HD1 TYR 22 24.989 30.821 24.382
146 HD2 TYR 22 HD2 TYR 22 23.940 28.043 27.522
147 HE1 TYR 22 HE1 TYR 22 25.695 32.485 26.100
148 HE2 TYR 22 HE2 TYR 22 24.707 29.683 29.230
149 HH TYR 22 HH TYR 22 25.676 31.697 29.603
150 H CYS 23 H CYS 23 24.334 28.074 21.881
151 HA CYS 23 HA CYS 23 26.914 28.894 20.765
152 HB2 CYS 23 HB2 CYS 23 25.840 29.001 18.687
153 HB3 CYS 23 HB3 CYS 23 25.206 27.571 19.482
154 H TRP 24 H TRP 24 27.362 30.967 19.827
155 HA TRP 24 HA TRP 24 26.243 33.333 21.134
156 HB2 TRP 24 HB2 TRP 24 28.291 32.918 18.940
157 HB3 TRP 24 HB3 TRP 24 27.845 34.497 19.537
158 HD1 TRP 24 HD1 TRP 24 30.461 32.095 19.936
159 HE1 TRP 24 HE1 TRP 24 31.938 32.700 21.932
160 HE3 TRP 24 HE3 TRP 24 27.177 35.103 22.485
161 HZ2 TRP 24 HZ2 TRP 24 31.827 34.514 24.187
162 HZ3 TRP 24 HZ3 TRP 24 27.898 36.255 24.563
163 HH2 TRP 24 HH2 TRP 24 30.224 35.994 25.404
164 H GLY 25 H GLY 25 24.562 31.651 19.022
165 HA2 GLY 25 HA2 GLY 25 22.718 32.273 17.760
166 HA3 GLY 25 HA3 GLY 25 23.175 33.965 17.916
167 H ILE 26 H ILE 26 25.175 34.614 16.537
168 HA ILE 26 HA ILE 26 25.305 33.221 13.896
169 HB ILE 26 HB ILE 26 24.403 36.074 14.403
170 HG12 ILE 26 HG12 ILE 26 22.563 34.449 14.487
171 HG13 ILE 26 HG13 ILE 26 22.418 35.552 13.146
172 HG21 ILE 26 HG21 ILE 26 25.271 34.867 11.751
173 HG22 ILE 26 HG22 ILE 26 24.299 36.343 11.908
174 HG23 ILE 26 HG23 ILE 26 25.921 36.304 12.579
175 HD11 ILE 26 HD11 ILE 26 23.408 32.680 12.881
176 HD12 ILE 26 HD12 ILE 26 21.775 33.258 12.531
177 HD13 ILE 26 HD13 ILE 26 23.133 33.828 11.553
178 H GLN 27 H GLN 27 27.194 33.448 12.792
179 HA GLN 27 HA GLN 27 29.373 33.716 12.435
180 HB2 GLN 27 HB2 GLN 27 28.643 36.598 13.014
181 HB3 GLN 27 HB3 GLN 27 30.233 36.071 12.453
182 HG2 GLN 27 HG2 GLN 27 28.788 34.777 10.610
183 HG3 GLN 27 HG3 GLN 27 27.629 36.058 10.943
184 HE21 GLN 27 HE21 GLN 27 30.269 36.869 8.214
185 HE22 GLN 27 HE22 GLN 27 29.238 35.480 8.493
186 H TYR 28 H TYR 28 29.966 32.303 14.016
187 HA TYR 28 HA TYR 28 31.971 33.357 15.915
188 HB2 TYR 28 HB2 TYR 28 31.133 31.778 17.662
189 HB3 TYR 28 HB3 TYR 28 30.063 33.128 17.332
190 HD1 TYR 28 HD1 TYR 28 30.578 29.454 16.620
191 HD2 TYR 28 HD2 TYR 28 27.831 32.794 16.635
192 HE1 TYR 28 HE1 TYR 28 28.702 27.912 16.099
193 HE2 TYR 28 HE2 TYR 28 25.958 31.219 16.180
194 HH TYR 28 HH TYR 28 26.318 27.742 16.006
195 H LYS 29 H LYS 29 33.339 31.560 16.731
196 HA LYS 29 HA LYS 29 33.539 29.238 14.840
197 HB2 LYS 29 HB2 LYS 29 35.944 29.141 15.396
198 HB3 LYS 29 HB3 LYS 29 35.466 30.596 14.525
199 HG2 LYS 29 HG2 LYS 29 35.516 31.912 16.593
200 HG3 LYS 29 HG3 LYS 29 35.923 30.467 17.535
201 HD2 LYS 29 HD2 LYS 29 38.071 30.285 16.317
202 HD3 LYS 29 HD3 LYS 29 37.611 31.675 15.314
203 HE2 LYS 29 HE2 LYS 29 37.356 33.018 17.475
204 HE3 LYS 29 HE3 LYS 29 38.074 31.651 18.333
205 HZ1 LYS 29 HZ1 LYS 29 39.775 33.244 17.782
206 HZ2 LYS 29 HZ2 LYS 29 40.033 31.910 16.867
207 HZ3 LYS 29 HZ3 LYS 29 39.345 33.236 16.177
208 H TYR 30 H TYR 30 33.266 30.172 18.228
209 HA TYR 30 HA TYR 30 33.225 27.300 19.019
210 HB2 TYR 30 HB2 TYR 30 34.418 29.551 20.665
211 HB3 TYR 30 HB3 TYR 30 34.459 27.831 21.029
212 HD1 TYR 30 HD1 TYR 30 35.420 26.674 18.420
213 HD2 TYR 30 HD2 TYR 30 36.657 30.175 20.615
214 HE1 TYR 30 HE1 TYR 30 37.629 26.567 17.337
215 HE2 TYR 30 HE2 TYR 30 38.917 30.002 19.596
216 HH TYR 30 HH TYR 30 39.805 27.297 17.474
217 H CYS 31 H CYS 31 32.264 27.045 21.245
218 HA CYS 31 HA CYS 31 29.720 28.463 21.444
219 HB2 CYS 31 HB2 CYS 31 31.053 26.359 23.190
220 HB3 CYS 31 HB3 CYS 31 29.382 26.875 23.350
221 H GLN 32 H GLN 32 28.911 29.222 23.586
222 HA GLN 32 HA GLN 32 30.964 30.575 25.298
223 HB2 GLN 32 HB2 GLN 32 29.482 32.193 24.326
224 HB3 GLN 32 HB3 GLN 32 28.067 31.243 24.713
225 HG2 GLN 32 HG2 GLN 32 28.185 33.174 26.134
226 HG3 GLN 32 HG3 GLN 32 28.322 31.720 27.102
227 HE21 GLN 32 HE21 GLN 32 30.799 34.314 28.300
228 HE22 GLN 32 HE22 GLN 32 29.101 34.494 27.860
229 H CYS 33 H CYS 33 30.946 30.126 27.453
230 HA CYS 33 HA CYS 33 29.301 27.795 28.478
231 HB2 CYS 33 HB2 CYS 33 32.086 28.707 29.251
232 HB3 CYS 33 HB3 CYS 33 31.219 27.289 29.819
233 H GLN 34 H GLN 34 29.593 27.823 30.972
234 HA GLN 34 HA GLN 34 27.527 29.229 31.967
235 HB2 GLN 34 HB2 GLN 34 28.678 27.289 32.993
236 HB3 GLN 34 HB3 GLN 34 29.998 28.368 33.478
237 HG2 GLN 34 HG2 GLN 34 27.980 29.657 34.705
238 HG3 GLN 34 HG3 GLN 34 27.235 28.064 34.637
239 HE21 GLN 34 HE21 GLN 34 29.695 28.715 37.622
240 HE22 GLN 34 HE22 GLN 34 28.578 29.852 36.856
Start of MODEL 10
1 H1 GLY 1 H1 GLY 1 29.659 23.542 19.361
2 H2 GLY 1 H2 GLY 1 30.851 24.487 18.709
3 H3 GLY 1 H3 GLY 1 31.186 22.951 19.230
4 HA2 GLY 1 HA2 GLY 1 31.097 22.934 16.879
5 HA3 GLY 1 HA3 GLY 1 29.751 22.010 17.563
6 H SER 2 H SER 2 30.225 23.647 15.018
7 HA SER 2 HA SER 2 28.910 26.055 14.940
8 HB2 SER 2 HB2 SER 2 30.352 25.081 13.192
9 HB3 SER 2 HB3 SER 2 29.036 23.992 12.711
10 HG SER 2 HG SER 2 29.373 26.140 11.593
11 H ALA 3 H ALA 3 27.218 22.922 14.810
12 HA ALA 3 HA ALA 3 24.670 23.852 13.950
13 HB1 ALA 3 HB1 ALA 3 25.394 21.610 15.886
14 HB2 ALA 3 HB2 ALA 3 23.851 21.795 15.025
15 HB3 ALA 3 HB3 ALA 3 25.338 21.481 14.112
16 H CYS 4 H CYS 4 26.311 24.477 16.941
17 HA CYS 4 HA CYS 4 25.807 25.523 18.836
18 HB2 CYS 4 HB2 CYS 4 24.324 27.030 16.712
19 HB3 CYS 4 HB3 CYS 4 24.274 27.597 18.380
20 H GLN 5 H GLN 5 24.089 23.170 18.409
21 HA GLN 5 HA GLN 5 21.501 23.728 19.637
22 HB2 GLN 5 HB2 GLN 5 23.005 21.091 19.373
23 HB3 GLN 5 HB3 GLN 5 21.332 21.323 19.907
24 HG2 GLN 5 HG2 GLN 5 20.720 22.279 17.763
25 HG3 GLN 5 HG3 GLN 5 22.350 21.993 17.129
26 HE21 GLN 5 HE21 GLN 5 19.884 19.205 16.305
27 HE22 GLN 5 HE22 GLN 5 20.006 20.918 15.910
28 H PHE 6 H PHE 6 21.218 24.204 21.769
29 HA PHE 6 HA PHE 6 23.335 24.600 23.472
30 HB2 PHE 6 HB2 PHE 6 21.833 24.909 25.288
31 HB3 PHE 6 HB3 PHE 6 21.121 25.566 23.833
32 HD1 PHE 6 HD1 PHE 6 18.893 24.973 23.240
33 HD2 PHE 6 HD2 PHE 6 21.038 22.567 26.115
34 HE1 PHE 6 HE1 PHE 6 16.840 23.661 23.696
35 HE2 PHE 6 HE2 PHE 6 19.007 21.190 26.477
36 HZ PHE 6 HZ PHE 6 16.901 21.749 25.284
37 H TRP 7 H TRP 7 21.495 21.487 23.331
38 HA TRP 7 HA TRP 7 22.786 20.305 25.557
39 HB2 TRP 7 HB2 TRP 7 21.852 18.319 24.881
40 HB3 TRP 7 HB3 TRP 7 20.753 19.505 24.201
41 HD1 TRP 7 HD1 TRP 7 21.180 19.958 21.442
42 HE1 TRP 7 HE1 TRP 7 21.845 18.343 19.588
43 HE3 TRP 7 HE3 TRP 7 23.087 16.193 24.339
44 HZ2 TRP 7 HZ2 TRP 7 22.999 15.697 19.383
45 HZ3 TRP 7 HZ3 TRP 7 23.927 14.106 23.278
46 HH2 TRP 7 HH2 TRP 7 23.881 13.849 20.813
47 H SER 8 H SER 8 23.914 20.576 22.222
48 HA SER 8 HA SER 8 26.171 18.729 22.595
49 HB2 SER 8 HB2 SER 8 24.862 18.815 20.512
50 HB3 SER 8 HB3 SER 8 25.371 20.488 20.251
51 HG SER 8 HG SER 8 26.557 18.433 19.365
52 H CYS 9 H CYS 9 25.623 22.241 22.643
53 HA CYS 9 HA CYS 9 28.482 22.878 22.935
54 HB2 CYS 9 HB2 CYS 9 25.908 24.411 23.408
55 HB3 CYS 9 HB3 CYS 9 27.467 25.032 23.926
56 H ASN 10 H ASN 10 25.735 22.302 25.164
57 HA ASN 10 HA ASN 10 26.929 22.918 27.617
58 HB2 ASN 10 HB2 ASN 10 24.555 22.548 27.207
59 HB3 ASN 10 HB3 ASN 10 24.813 20.850 26.851
60 HD21 ASN 10 HD21 ASN 10 23.883 21.823 30.520
61 HD22 ASN 10 HD22 ASN 10 23.743 22.935 29.165
62 H SER 11 H SER 11 26.868 19.654 26.013
63 HA SER 11 HA SER 11 28.429 18.377 28.015
64 HB2 SER 11 HB2 SER 11 28.773 16.636 26.277
65 HB3 SER 11 HB3 SER 11 27.096 17.121 26.484
66 HG SER 11 HG SER 11 27.467 17.100 24.300
67 H SER 12 H SER 12 29.485 20.080 25.058
68 HA SER 12 HA SER 12 32.295 19.543 25.419
69 HB2 SER 12 HB2 SER 12 31.377 20.281 23.266
70 HB3 SER 12 HB3 SER 12 30.940 21.844 23.972
71 HG SER 12 HG SER 12 33.519 20.776 23.464
72 H CYS 13 H CYS 13 30.360 22.521 26.329
73 HA CYS 13 HA CYS 13 32.399 23.889 27.668
74 HB2 CYS 13 HB2 CYS 13 29.392 23.743 28.026
75 HB3 CYS 13 HB3 CYS 13 30.400 24.830 28.973
76 H ILE 14 H ILE 14 29.990 21.635 29.242
77 HA ILE 14 HA ILE 14 31.165 21.806 31.781
78 HB ILE 14 HB ILE 14 29.685 19.462 30.540
79 HG12 ILE 14 HG12 ILE 14 28.760 21.677 32.429
80 HG13 ILE 14 HG13 ILE 14 28.441 21.694 30.709
81 HG21 ILE 14 HG21 ILE 14 30.460 20.134 33.417
82 HG22 ILE 14 HG22 ILE 14 29.320 18.830 32.979
83 HG23 ILE 14 HG23 ILE 14 30.999 18.722 32.487
84 HD11 ILE 14 HD11 ILE 14 27.335 19.735 32.749
85 HD12 ILE 14 HD12 ILE 14 26.464 20.896 31.743
86 HD13 ILE 14 HD13 ILE 14 27.242 19.476 30.990
87 H SER 15 H SER 15 32.240 19.634 29.106
88 HA SER 15 HA SER 15 34.124 18.165 30.650
89 HB2 SER 15 HB2 SER 15 35.086 17.478 28.643
90 HB3 SER 15 HB3 SER 15 33.400 17.760 28.225
91 HG SER 15 HG SER 15 34.058 19.810 27.354
92 H ARG 16 H ARG 16 34.313 21.433 29.467
93 HA ARG 16 HA ARG 16 37.198 21.818 29.988
94 HB2 ARG 16 HB2 ARG 16 35.007 23.766 29.134
95 HB3 ARG 16 HB3 ARG 16 36.731 24.115 29.174
96 HG2 ARG 16 HG2 ARG 16 37.164 22.578 27.367
97 HG3 ARG 16 HG3 ARG 16 35.553 21.867 27.504
98 HD2 ARG 16 HD2 ARG 16 35.691 23.298 25.538
99 HD3 ARG 16 HD3 ARG 16 34.472 23.845 26.694
100 HE ARG 16 HE ARG 16 37.040 25.180 27.067
101 HH11 ARG 16 HH11 ARG 16 34.299 25.375 24.810
102 HH12 ARG 16 HH12 ARG 16 34.390 27.133 24.874
103 HH21 ARG 16 HH21 ARG 16 37.168 27.295 26.775
104 HH22 ARG 16 HH22 ARG 16 35.921 28.148 25.831
105 H GLY 17 H GLY 17 34.328 22.017 31.871
106 HA2 GLY 17 HA2 GLY 17 34.915 21.987 34.293
107 HA3 GLY 17 HA3 GLY 17 35.834 23.468 34.032
108 H TYR 18 H TYR 18 33.140 23.710 32.086
109 HA TYR 18 HA TYR 18 31.811 25.575 33.917
110 HB2 TYR 18 HB2 TYR 18 31.317 24.760 31.042
111 HB3 TYR 18 HB3 TYR 18 30.515 26.059 31.865
112 HD1 TYR 18 HD1 TYR 18 31.628 28.210 32.240
113 HD2 TYR 18 HD2 TYR 18 33.761 24.905 30.538
114 HE1 TYR 18 HE1 TYR 18 33.413 29.773 31.480
115 HE2 TYR 18 HE2 TYR 18 35.577 26.463 29.783
116 HH TYR 18 HH TYR 18 35.286 29.985 30.102
117 H ARG 19 H ARG 19 29.209 25.460 33.239
118 HA ARG 19 HA ARG 19 28.127 22.792 34.090
119 HB2 ARG 19 HB2 ARG 19 27.621 25.440 35.489
120 HB3 ARG 19 HB3 ARG 19 26.647 23.981 35.706
121 HG2 ARG 19 HG2 ARG 19 27.999 23.585 37.428
122 HG3 ARG 19 HG3 ARG 19 28.997 22.848 36.188
123 HD2 ARG 19 HD2 ARG 19 30.103 25.260 36.031
124 HD3 ARG 19 HD3 ARG 19 29.297 25.512 37.589
125 HE ARG 19 HE ARG 19 30.925 23.065 37.240
126 HH11 ARG 19 HH11 ARG 19 30.961 26.341 38.645
127 HH12 ARG 19 HH12 ARG 19 32.333 25.889 39.660
128 HH21 ARG 19 HH21 ARG 19 32.513 22.655 38.773
129 HH22 ARG 19 HH22 ARG 19 33.115 24.002 39.732
130 H GLN 20 H GLN 20 28.000 24.914 31.686
131 HA GLN 20 HA GLN 20 25.447 24.218 30.648
132 HB2 GLN 20 HB2 GLN 20 25.065 26.115 32.510
133 HB3 GLN 20 HB3 GLN 20 25.653 27.190 31.242
134 HG2 GLN 20 HG2 GLN 20 23.790 26.569 29.806
135 HG3 GLN 20 HG3 GLN 20 23.351 25.232 30.883
136 HE21 GLN 20 HE21 GLN 20 20.891 27.475 32.112
137 HE22 GLN 20 HE22 GLN 20 21.243 25.898 31.390
138 H GLY 21 H GLY 21 25.062 25.398 28.518
139 HA2 GLY 21 HA2 GLY 21 27.148 26.848 27.292
140 HA3 GLY 21 HA3 GLY 21 27.346 25.160 26.842
141 H TYR 22 H TYR 22 26.815 27.476 25.227
142 HA TYR 22 HA TYR 22 24.611 26.743 23.472
143 HB2 TYR 22 HB2 TYR 22 23.448 29.026 23.952
144 HB3 TYR 22 HB3 TYR 22 23.164 27.682 25.029
145 HD1 TYR 22 HD1 TYR 22 23.564 27.803 27.330
146 HD2 TYR 22 HD2 TYR 22 25.157 30.853 24.728
147 HE1 TYR 22 HE1 TYR 22 24.360 29.079 29.312
148 HE2 TYR 22 HE2 TYR 22 25.907 32.145 26.720
149 HH TYR 22 HH TYR 22 25.240 31.042 30.050
150 H CYS 23 H CYS 23 24.336 29.132 22.039
151 HA CYS 23 HA CYS 23 27.137 30.094 21.551
152 HB2 CYS 23 HB2 CYS 23 24.977 29.398 19.557
153 HB3 CYS 23 HB3 CYS 23 26.353 30.400 19.149
154 H TRP 24 H TRP 24 27.408 32.158 20.689
155 HA TRP 24 HA TRP 24 25.554 34.282 21.457
156 HB2 TRP 24 HB2 TRP 24 28.147 34.176 19.867
157 HB3 TRP 24 HB3 TRP 24 27.260 35.665 20.149
158 HD1 TRP 24 HD1 TRP 24 29.658 33.298 21.814
159 HE1 TRP 24 HE1 TRP 24 30.383 34.232 24.101
160 HE3 TRP 24 HE3 TRP 24 26.316 37.163 22.239
161 HZ2 TRP 24 HZ2 TRP 24 29.745 36.464 25.787
162 HZ3 TRP 24 HZ3 TRP 24 26.407 38.679 24.198
163 HH2 TRP 24 HH2 TRP 24 28.094 38.330 25.990
164 H GLY 25 H GLY 25 24.946 35.934 19.713
165 HA2 GLY 25 HA2 GLY 25 23.261 34.731 17.803
166 HA3 GLY 25 HA3 GLY 25 23.685 36.451 17.863
167 H ILE 26 H ILE 26 26.277 36.617 17.137
168 HA ILE 26 HA ILE 26 26.625 35.102 14.586
169 HB ILE 26 HB ILE 26 27.145 37.334 13.463
170 HG12 ILE 26 HG12 ILE 26 25.257 38.501 15.557
171 HG13 ILE 26 HG13 ILE 26 27.002 38.678 15.642
172 HG21 ILE 26 HG21 ILE 26 24.219 36.785 14.126
173 HG22 ILE 26 HG22 ILE 26 24.886 37.575 12.678
174 HG23 ILE 26 HG23 ILE 26 25.197 35.871 12.951
175 HD11 ILE 26 HD11 ILE 26 27.023 39.808 13.426
176 HD12 ILE 26 HD12 ILE 26 25.243 39.727 13.400
177 HD13 ILE 26 HD13 ILE 26 26.066 40.669 14.649
178 H GLN 27 H GLN 27 28.265 37.405 16.857
179 HA GLN 27 HA GLN 27 30.785 36.870 15.382
180 HB2 GLN 27 HB2 GLN 27 30.122 38.887 17.551
181 HB3 GLN 27 HB3 GLN 27 31.689 38.724 16.752
182 HG2 GLN 27 HG2 GLN 27 29.120 39.433 15.288
183 HG3 GLN 27 HG3 GLN 27 30.264 40.601 15.922
184 HE21 GLN 27 HE21 GLN 27 31.318 40.500 12.494
185 HE22 GLN 27 HE22 GLN 27 30.124 41.259 13.548
186 H TYR 28 H TYR 28 31.194 34.740 16.003
187 HA TYR 28 HA TYR 28 32.655 34.437 18.552
188 HB2 TYR 28 HB2 TYR 28 31.376 32.472 19.239
189 HB3 TYR 28 HB3 TYR 28 30.386 33.910 19.224
190 HD1 TYR 28 HD1 TYR 28 30.983 30.618 17.638
191 HD2 TYR 28 HD2 TYR 28 28.563 34.182 17.582
192 HE1 TYR 28 HE1 TYR 28 29.292 29.448 16.256
193 HE2 TYR 28 HE2 TYR 28 26.861 33.015 16.200
194 HH TYR 28 HH TYR 28 27.420 29.772 14.902
195 H LYS 29 H LYS 29 33.743 32.368 18.731
196 HA LYS 29 HA LYS 29 34.132 30.815 16.205
197 HB2 LYS 29 HB2 LYS 29 36.529 30.850 16.399
198 HB3 LYS 29 HB3 LYS 29 35.922 32.511 16.362
199 HG2 LYS 29 HG2 LYS 29 36.091 32.505 18.911
200 HG3 LYS 29 HG3 LYS 29 36.917 30.947 18.788
201 HD2 LYS 29 HD2 LYS 29 38.735 31.988 17.477
202 HD3 LYS 29 HD3 LYS 29 37.840 33.526 17.468
203 HE2 LYS 29 HE2 LYS 29 37.847 33.362 20.049
204 HE3 LYS 29 HE3 LYS 29 39.068 32.097 19.858
205 HZ1 LYS 29 HZ1 LYS 29 40.065 34.227 20.217
206 HZ2 LYS 29 HZ2 LYS 29 40.461 33.761 18.693
207 HZ3 LYS 29 HZ3 LYS 29 39.278 34.903 18.921
208 H TYR 30 H TYR 30 33.303 30.605 19.406
209 HA TYR 30 HA TYR 30 33.415 27.671 19.273
210 HB2 TYR 30 HB2 TYR 30 34.013 28.894 21.944
211 HB3 TYR 30 HB3 TYR 30 34.379 27.291 21.357
212 HD1 TYR 30 HD1 TYR 30 36.387 27.071 19.667
213 HD2 TYR 30 HD2 TYR 30 35.616 30.543 22.112
214 HE1 TYR 30 HE1 TYR 30 38.780 27.764 19.457
215 HE2 TYR 30 HE2 TYR 30 38.002 31.208 21.917
216 HH TYR 30 HH TYR 30 40.236 29.617 19.741
217 H CYS 31 H CYS 31 31.992 26.759 21.150
218 HA CYS 31 HA CYS 31 29.482 28.174 21.514
219 HB2 CYS 31 HB2 CYS 31 30.800 25.926 23.085
220 HB3 CYS 31 HB3 CYS 31 29.158 26.493 23.352
221 H GLN 32 H GLN 32 28.747 29.204 23.381
222 HA GLN 32 HA GLN 32 30.746 30.392 25.249
223 HB2 GLN 32 HB2 GLN 32 29.197 31.918 24.017
224 HB3 GLN 32 HB3 GLN 32 27.830 31.046 24.700
225 HG2 GLN 32 HG2 GLN 32 28.034 32.993 25.981
226 HG3 GLN 32 HG3 GLN 32 28.642 31.714 27.010
227 HE21 GLN 32 HE21 GLN 32 30.892 34.518 27.579
228 HE22 GLN 32 HE22 GLN 32 29.351 33.796 28.061
229 H CYS 33 H CYS 33 30.466 30.035 27.504
230 HA CYS 33 HA CYS 33 28.889 27.590 28.259
231 HB2 CYS 33 HB2 CYS 33 31.666 28.437 29.099
232 HB3 CYS 33 HB3 CYS 33 30.817 26.954 29.521
233 H GLN 34 H GLN 34 29.190 27.481 30.885
234 HA GLN 34 HA GLN 34 27.296 29.410 31.728
235 HB2 GLN 34 HB2 GLN 34 27.586 27.057 32.551
236 HB3 GLN 34 HB3 GLN 34 28.851 27.597 33.616
237 HG2 GLN 34 HG2 GLN 34 26.260 29.137 33.739
238 HG3 GLN 34 HG3 GLN 34 26.140 27.451 34.187
239 HE21 GLN 34 HE21 GLN 34 26.678 29.375 37.302
240 HE22 GLN 34 HE22 GLN 34 25.390 29.121 36.146
Start of MODEL 11
1 H1 GLY 1 H1 GLY 1 31.997 19.377 9.641
2 H2 GLY 1 H2 GLY 1 30.598 18.918 8.916
3 H3 GLY 1 H3 GLY 1 30.590 19.421 10.497
4 HA2 GLY 1 HA2 GLY 1 31.286 21.641 9.822
5 HA3 GLY 1 HA3 GLY 1 31.253 21.078 8.154
6 H SER 2 H SER 2 29.197 21.586 11.016
7 HA SER 2 HA SER 2 26.934 22.496 9.366
8 HB2 SER 2 HB2 SER 2 25.376 21.071 10.634
9 HB3 SER 2 HB3 SER 2 26.520 20.103 9.673
10 HG SER 2 HG SER 2 26.267 19.310 11.813
11 H ALA 3 H ALA 3 25.156 23.402 10.913
12 HA ALA 3 HA ALA 3 26.287 25.403 12.592
13 HB1 ALA 3 HB1 ALA 3 24.192 25.667 11.342
14 HB2 ALA 3 HB2 ALA 3 23.405 24.427 12.344
15 HB3 ALA 3 HB3 ALA 3 23.930 25.970 13.059
16 H CYS 4 H CYS 4 26.311 25.715 14.810
17 HA CYS 4 HA CYS 4 26.576 23.467 16.555
18 HB2 CYS 4 HB2 CYS 4 27.033 25.213 18.232
19 HB3 CYS 4 HB3 CYS 4 27.918 25.466 16.727
20 H GLN 5 H GLN 5 25.495 23.271 18.711
21 HA GLN 5 HA GLN 5 22.645 24.107 18.828
22 HB2 GLN 5 HB2 GLN 5 23.626 21.238 18.987
23 HB3 GLN 5 HB3 GLN 5 22.086 21.786 19.629
24 HG2 GLN 5 HG2 GLN 5 22.843 22.090 16.708
25 HG3 GLN 5 HG3 GLN 5 21.908 20.747 17.363
26 HE21 GLN 5 HE21 GLN 5 19.488 23.281 16.088
27 HE22 GLN 5 HE22 GLN 5 20.805 22.306 15.393
28 H PHE 6 H PHE 6 21.933 24.570 20.868
29 HA PHE 6 HA PHE 6 23.685 25.054 22.908
30 HB2 PHE 6 HB2 PHE 6 21.905 25.564 24.280
31 HB3 PHE 6 HB3 PHE 6 21.235 25.792 22.682
32 HD1 PHE 6 HD1 PHE 6 19.602 24.111 21.749
33 HD2 PHE 6 HD2 PHE 6 21.085 23.891 25.800
34 HE1 PHE 6 HE1 PHE 6 17.786 22.514 22.331
35 HE2 PHE 6 HE2 PHE 6 19.262 22.303 26.373
36 HZ PHE 6 HZ PHE 6 17.618 21.610 24.639
37 H TRP 7 H TRP 7 21.811 21.975 22.672
38 HA TRP 7 HA TRP 7 22.792 20.899 25.094
39 HB2 TRP 7 HB2 TRP 7 21.759 18.926 24.502
40 HB3 TRP 7 HB3 TRP 7 20.800 20.150 23.693
41 HD1 TRP 7 HD1 TRP 7 21.348 20.386 20.960
42 HE1 TRP 7 HE1 TRP 7 21.928 18.584 19.216
43 HE3 TRP 7 HE3 TRP 7 22.615 16.577 24.133
44 HZ2 TRP 7 HZ2 TRP 7 22.868 15.870 19.212
45 HZ3 TRP 7 HZ3 TRP 7 23.272 14.362 23.231
46 HH2 TRP 7 HH2 TRP 7 23.392 13.993 20.780
47 H SER 8 H SER 8 24.149 20.584 21.801
48 HA SER 8 HA SER 8 26.364 18.889 22.486
49 HB2 SER 8 HB2 SER 8 25.903 20.848 20.208
50 HB3 SER 8 HB3 SER 8 27.265 19.707 20.285
51 HG SER 8 HG SER 8 25.247 19.062 19.105
52 H CYS 9 H CYS 9 26.057 22.479 22.272
53 HA CYS 9 HA CYS 9 28.736 23.067 23.103
54 HB2 CYS 9 HB2 CYS 9 26.092 24.536 23.313
55 HB3 CYS 9 HB3 CYS 9 27.576 25.197 23.978
56 H ASN 10 H ASN 10 25.761 22.515 25.041
57 HA ASN 10 HA ASN 10 26.722 23.269 27.550
58 HB2 ASN 10 HB2 ASN 10 24.379 22.921 27.115
59 HB3 ASN 10 HB3 ASN 10 24.635 21.236 26.685
60 HD21 ASN 10 HD21 ASN 10 24.395 22.249 30.614
61 HD22 ASN 10 HD22 ASN 10 24.386 23.481 29.355
62 H SER 11 H SER 11 26.667 19.883 26.285
63 HA SER 11 HA SER 11 28.044 18.732 28.512
64 HB2 SER 11 HB2 SER 11 28.402 16.820 26.950
65 HB3 SER 11 HB3 SER 11 26.727 17.400 26.974
66 HG SER 11 HG SER 11 27.189 17.280 24.850
67 H SER 12 H SER 12 29.246 20.050 25.435
68 HA SER 12 HA SER 12 31.998 19.331 25.749
69 HB2 SER 12 HB2 SER 12 30.872 21.688 24.185
70 HB3 SER 12 HB3 SER 12 32.449 20.908 23.967
71 HG SER 12 HG SER 12 29.854 19.942 23.363
72 H CYS 13 H CYS 13 30.268 22.394 26.610
73 HA CYS 13 HA CYS 13 32.551 23.698 27.759
74 HB2 CYS 13 HB2 CYS 13 29.560 23.912 28.249
75 HB3 CYS 13 HB3 CYS 13 30.736 24.961 29.024
76 H ILE 14 H ILE 14 29.930 21.755 29.395
77 HA ILE 14 HA ILE 14 31.119 21.719 31.918
78 HB ILE 14 HB ILE 14 29.513 19.533 30.555
79 HG12 ILE 14 HG12 ILE 14 28.549 21.498 32.661
80 HG13 ILE 14 HG13 ILE 14 28.501 21.952 30.970
81 HG21 ILE 14 HG21 ILE 14 30.721 18.588 32.441
82 HG22 ILE 14 HG22 ILE 14 30.367 20.016 33.425
83 HG23 ILE 14 HG23 ILE 14 29.064 18.870 32.999
84 HD11 ILE 14 HD11 ILE 14 26.343 21.096 31.598
85 HD12 ILE 14 HD12 ILE 14 27.098 19.956 30.459
86 HD13 ILE 14 HD13 ILE 14 27.046 19.592 32.199
87 H SER 15 H SER 15 31.995 19.615 29.161
88 HA SER 15 HA SER 15 33.808 17.925 30.506
89 HB2 SER 15 HB2 SER 15 32.963 17.674 28.157
90 HB3 SER 15 HB3 SER 15 34.060 18.979 27.666
91 HG SER 15 HG SER 15 34.651 16.399 28.628
92 H ARG 16 H ARG 16 34.321 21.267 29.425
93 HA ARG 16 HA ARG 16 37.238 21.286 29.950
94 HB2 ARG 16 HB2 ARG 16 35.243 23.566 29.542
95 HB3 ARG 16 HB3 ARG 16 36.979 23.770 29.755
96 HG2 ARG 16 HG2 ARG 16 37.419 22.496 27.698
97 HG3 ARG 16 HG3 ARG 16 35.681 22.195 27.509
98 HD2 ARG 16 HD2 ARG 16 36.462 23.990 26.020
99 HD3 ARG 16 HD3 ARG 16 35.221 24.525 27.160
100 HE ARG 16 HE ARG 16 38.044 25.023 27.952
101 HH11 ARG 16 HH11 ARG 16 35.245 26.508 26.409
102 HH12 ARG 16 HH12 ARG 16 35.608 28.072 27.107
103 HH21 ARG 16 HH21 ARG 16 38.647 27.045 28.379
104 HH22 ARG 16 HH22 ARG 16 37.636 28.414 27.951
105 H GLY 17 H GLY 17 34.318 22.086 31.750
106 HA2 GLY 17 HA2 GLY 17 35.070 21.679 34.275
107 HA3 GLY 17 HA3 GLY 17 35.843 23.241 34.012
108 H TYR 18 H TYR 18 33.203 23.661 32.145
109 HA TYR 18 HA TYR 18 31.891 25.303 34.112
110 HB2 TYR 18 HB2 TYR 18 31.219 24.645 31.235
111 HB3 TYR 18 HB3 TYR 18 30.536 25.963 32.160
112 HD1 TYR 18 HD1 TYR 18 33.343 24.908 30.174
113 HD2 TYR 18 HD2 TYR 18 32.078 27.775 33.090
114 HE1 TYR 18 HE1 TYR 18 35.246 26.372 29.547
115 HE2 TYR 18 HE2 TYR 18 33.970 29.286 32.440
116 HH TYR 18 HH TYR 18 35.830 29.569 31.002
117 H ARG 19 H ARG 19 29.379 25.365 33.609
118 HA ARG 19 HA ARG 19 28.029 22.760 34.220
119 HB2 ARG 19 HB2 ARG 19 27.666 25.345 35.782
120 HB3 ARG 19 HB3 ARG 19 26.669 23.902 35.900
121 HG2 ARG 19 HG2 ARG 19 27.951 23.582 37.706
122 HG3 ARG 19 HG3 ARG 19 28.791 22.606 36.516
123 HD2 ARG 19 HD2 ARG 19 30.326 23.805 37.928
124 HD3 ARG 19 HD3 ARG 19 30.511 24.381 36.277
125 HE ARG 19 HE ARG 19 28.771 26.235 37.346
126 HH11 ARG 19 HH11 ARG 19 31.878 25.054 38.428
127 HH12 ARG 19 HH12 ARG 19 32.250 26.565 39.242
128 HH21 ARG 19 HH21 ARG 19 29.323 28.074 38.257
129 HH22 ARG 19 HH22 ARG 19 30.894 28.305 39.037
130 H GLN 20 H GLN 20 28.264 25.059 32.002
131 HA GLN 20 HA GLN 20 25.653 24.727 30.895
132 HB2 GLN 20 HB2 GLN 20 25.655 26.748 32.750
133 HB3 GLN 20 HB3 GLN 20 26.247 27.636 31.348
134 HG2 GLN 20 HG2 GLN 20 24.245 27.184 30.138
135 HG3 GLN 20 HG3 GLN 20 23.755 25.906 31.258
136 HE21 GLN 20 HE21 GLN 20 23.349 29.533 33.083
137 HE22 GLN 20 HE22 GLN 20 24.919 29.169 32.389
138 H GLY 21 H GLY 21 25.474 25.735 28.750
139 HA2 GLY 21 HA2 GLY 21 27.590 27.083 27.456
140 HA3 GLY 21 HA3 GLY 21 27.806 25.351 27.169
141 H TYR 22 H TYR 22 27.067 27.667 25.430
142 HA TYR 22 HA TYR 22 24.989 26.535 23.778
143 HB2 TYR 22 HB2 TYR 22 23.707 28.884 24.130
144 HB3 TYR 22 HB3 TYR 22 23.327 27.408 24.992
145 HD1 TYR 22 HD1 TYR 22 25.990 30.031 25.638
146 HD2 TYR 22 HD2 TYR 22 22.525 27.895 27.074
147 HE1 TYR 22 HE1 TYR 22 26.329 30.993 27.927
148 HE2 TYR 22 HE2 TYR 22 22.833 28.929 29.326
149 HH TYR 22 HH TYR 22 25.712 30.636 30.222
150 H CYS 23 H CYS 23 24.686 27.857 21.832
151 HA CYS 23 HA CYS 23 26.869 29.811 21.345
152 HB2 CYS 23 HB2 CYS 23 27.024 29.160 19.079
153 HB3 CYS 23 HB3 CYS 23 27.335 27.769 20.100
154 H TRP 24 H TRP 24 26.396 31.664 20.303
155 HA TRP 24 HA TRP 24 23.705 32.685 20.635
156 HB2 TRP 24 HB2 TRP 24 26.300 33.862 19.585
157 HB3 TRP 24 HB3 TRP 24 24.845 34.799 19.873
158 HD1 TRP 24 HD1 TRP 24 24.988 32.596 22.771
159 HE1 TRP 24 HE1 TRP 24 26.002 33.798 24.785
160 HE3 TRP 24 HE3 TRP 24 27.315 36.458 20.339
161 HZ2 TRP 24 HZ2 TRP 24 27.406 36.257 25.310
162 HZ3 TRP 24 HZ3 TRP 24 28.458 38.235 21.632
163 HH2 TRP 24 HH2 TRP 24 28.486 38.167 24.114
164 H GLY 25 H GLY 25 22.820 34.240 18.908
165 HA2 GLY 25 HA2 GLY 25 22.491 32.790 16.388
166 HA3 GLY 25 HA3 GLY 25 21.603 34.218 16.932
167 H ILE 26 H ILE 26 24.537 35.367 17.425
168 HA ILE 26 HA ILE 26 25.759 35.555 14.845
169 HB ILE 26 HB ILE 26 23.824 37.173 14.647
170 HG12 ILE 26 HG12 ILE 26 26.534 38.529 14.356
171 HG13 ILE 26 HG13 ILE 26 25.970 37.230 13.300
172 HG21 ILE 26 HG21 ILE 26 25.423 38.974 16.520
173 HG22 ILE 26 HG22 ILE 26 23.869 39.321 15.740
174 HG23 ILE 26 HG23 ILE 26 23.962 38.088 16.996
175 HD11 ILE 26 HD11 ILE 26 25.544 39.359 12.240
176 HD12 ILE 26 HD12 ILE 26 23.993 38.600 12.660
177 HD13 ILE 26 HD13 ILE 26 24.636 39.939 13.643
178 H GLN 27 H GLN 27 27.827 36.594 14.938
179 HA GLN 27 HA GLN 27 29.805 37.009 15.809
180 HB2 GLN 27 HB2 GLN 27 28.465 39.187 15.990
181 HB3 GLN 27 HB3 GLN 27 28.463 38.903 17.728
182 HG2 GLN 27 HG2 GLN 27 30.335 40.314 17.283
183 HG3 GLN 27 HG3 GLN 27 31.025 38.732 17.590
184 HE21 GLN 27 HE21 GLN 27 32.912 39.834 14.687
185 HE22 GLN 27 HE22 GLN 27 32.895 39.979 16.433
186 H TYR 28 H TYR 28 29.741 34.746 16.562
187 HA TYR 28 HA TYR 28 31.004 34.748 19.240
188 HB2 TYR 28 HB2 TYR 28 30.005 32.582 19.781
189 HB3 TYR 28 HB3 TYR 28 28.785 33.835 19.656
190 HD1 TYR 28 HD1 TYR 28 29.886 30.592 18.410
191 HD2 TYR 28 HD2 TYR 28 27.375 33.991 17.522
192 HE1 TYR 28 HE1 TYR 28 28.713 29.271 16.666
193 HE2 TYR 28 HE2 TYR 28 26.210 32.678 15.791
194 HH TYR 28 HH TYR 28 27.182 29.340 14.933
195 H LYS 29 H LYS 29 32.885 33.497 19.299
196 HA LYS 29 HA LYS 29 33.883 32.457 16.715
197 HB2 LYS 29 HB2 LYS 29 35.596 31.742 18.931
198 HB3 LYS 29 HB3 LYS 29 35.919 32.721 17.520
199 HG2 LYS 29 HG2 LYS 29 35.034 34.728 18.716
200 HG3 LYS 29 HG3 LYS 29 34.814 33.722 20.167
201 HD2 LYS 29 HD2 LYS 29 37.265 33.168 20.113
202 HD3 LYS 29 HD3 LYS 29 37.433 34.265 18.724
203 HE2 LYS 29 HE2 LYS 29 36.468 36.106 20.147
204 HE3 LYS 29 HE3 LYS 29 36.537 35.011 21.537
205 HZ1 LYS 29 HZ1 LYS 29 38.944 34.907 21.260
206 HZ2 LYS 29 HZ2 LYS 29 38.863 35.834 19.887
207 HZ3 LYS 29 HZ3 LYS 29 38.483 36.488 21.332
208 H TYR 30 H TYR 30 32.784 31.180 19.809
209 HA TYR 30 HA TYR 30 31.906 28.692 18.637
210 HB2 TYR 30 HB2 TYR 30 34.409 28.336 19.002
211 HB3 TYR 30 HB3 TYR 30 34.135 28.563 20.722
212 HD1 TYR 30 HD1 TYR 30 34.144 26.538 21.907
213 HD2 TYR 30 HD2 TYR 30 32.555 26.596 17.895
214 HE1 TYR 30 HE1 TYR 30 33.614 24.110 22.072
215 HE2 TYR 30 HE2 TYR 30 32.009 24.171 18.078
216 HH TYR 30 HH TYR 30 33.283 22.183 20.533
217 H CYS 31 H CYS 31 31.445 27.227 20.908
218 HA CYS 31 HA CYS 31 29.201 28.376 22.073
219 HB2 CYS 31 HB2 CYS 31 31.072 26.292 23.262
220 HB3 CYS 31 HB3 CYS 31 29.386 26.508 23.709
221 H GLN 32 H GLN 32 28.782 29.672 23.842
222 HA GLN 32 HA GLN 32 30.854 31.343 24.793
223 HB2 GLN 32 HB2 GLN 32 28.423 31.898 24.553
224 HB3 GLN 32 HB3 GLN 32 28.092 30.908 25.980
225 HG2 GLN 32 HG2 GLN 32 29.600 32.425 27.320
226 HG3 GLN 32 HG3 GLN 32 29.816 33.418 25.874
227 HE21 GLN 32 HE21 GLN 32 27.219 35.208 27.666
228 HE22 GLN 32 HE22 GLN 32 28.967 35.075 27.498
229 H CYS 33 H CYS 33 29.202 28.710 26.474
230 HA CYS 33 HA CYS 33 29.490 27.561 28.425
231 HB2 CYS 33 HB2 CYS 33 32.328 28.555 28.557
232 HB3 CYS 33 HB3 CYS 33 31.611 27.165 29.334
233 H GLN 34 H GLN 34 29.490 27.657 30.595
234 HA GLN 34 HA GLN 34 28.649 28.438 32.476
235 HB2 GLN 34 HB2 GLN 34 30.885 29.537 32.588
236 HB3 GLN 34 HB3 GLN 34 30.189 31.016 31.958
237 HG2 GLN 34 HG2 GLN 34 28.795 31.272 33.942
238 HG3 GLN 34 HG3 GLN 34 29.302 29.686 34.535
239 HE21 GLN 34 HE21 GLN 34 31.421 31.901 36.484
240 HE22 GLN 34 HE22 GLN 34 29.762 31.327 36.450
Start of MODEL 12
1 H1 GLY 1 H1 GLY 1 25.366 20.287 7.475
2 H2 GLY 1 H2 GLY 1 23.953 20.219 6.634
3 H3 GLY 1 H3 GLY 1 23.928 20.162 8.280
4 HA2 GLY 1 HA2 GLY 1 24.818 22.444 6.650
5 HA3 GLY 1 HA3 GLY 1 23.245 22.321 7.453
6 H SER 2 H SER 2 24.909 24.456 7.941
7 HA SER 2 HA SER 2 26.154 23.960 10.582
8 HB2 SER 2 HB2 SER 2 27.264 25.515 9.001
9 HB3 SER 2 HB3 SER 2 25.885 26.629 9.205
10 HG SER 2 HG SER 2 27.626 25.583 11.216
11 H ALA 3 H ALA 3 25.071 24.102 12.439
12 HA ALA 3 HA ALA 3 22.653 25.796 12.674
13 HB1 ALA 3 HB1 ALA 3 21.336 23.859 13.478
14 HB2 ALA 3 HB2 ALA 3 21.878 23.621 11.809
15 HB3 ALA 3 HB3 ALA 3 22.706 22.782 13.136
16 H CYS 4 H CYS 4 22.205 26.548 14.618
17 HA CYS 4 HA CYS 4 23.957 26.014 16.946
18 HB2 CYS 4 HB2 CYS 4 23.524 28.305 16.655
19 HB3 CYS 4 HB3 CYS 4 21.855 28.031 16.201
20 H GLN 5 H GLN 5 23.467 24.618 18.456
21 HA GLN 5 HA GLN 5 20.728 24.275 19.423
22 HB2 GLN 5 HB2 GLN 5 22.411 21.788 18.873
23 HB3 GLN 5 HB3 GLN 5 20.815 21.888 19.628
24 HG2 GLN 5 HG2 GLN 5 19.836 22.699 17.536
25 HG3 GLN 5 HG3 GLN 5 21.388 22.480 16.716
26 HE21 GLN 5 HE21 GLN 5 18.973 19.421 16.529
27 HE22 GLN 5 HE22 GLN 5 18.520 21.113 16.620
28 H PHE 6 H PHE 6 20.801 24.333 21.706
29 HA PHE 6 HA PHE 6 23.358 24.988 22.832
30 HB2 PHE 6 HB2 PHE 6 22.253 25.314 24.928
31 HB3 PHE 6 HB3 PHE 6 21.299 26.012 23.636
32 HD1 PHE 6 HD1 PHE 6 19.010 25.384 23.323
33 HD2 PHE 6 HD2 PHE 6 21.531 23.050 25.934
34 HE1 PHE 6 HE1 PHE 6 17.035 24.101 24.089
35 HE2 PHE 6 HE2 PHE 6 19.566 21.718 26.634
36 HZ PHE 6 HZ PHE 6 17.307 22.254 25.733
37 H TRP 7 H TRP 7 21.519 21.915 22.905
38 HA TRP 7 HA TRP 7 22.780 20.759 25.086
39 HB2 TRP 7 HB2 TRP 7 21.930 18.699 24.403
40 HB3 TRP 7 HB3 TRP 7 20.797 19.904 23.832
41 HD1 TRP 7 HD1 TRP 7 21.461 20.569 21.042
42 HE1 TRP 7 HE1 TRP 7 21.748 18.933 19.097
43 HE3 TRP 7 HE3 TRP 7 22.429 16.331 23.739
44 HZ2 TRP 7 HZ2 TRP 7 22.339 16.129 18.761
45 HZ3 TRP 7 HZ3 TRP 7 22.852 14.181 22.575
46 HH2 TRP 7 HH2 TRP 7 22.816 14.066 20.090
47 H SER 8 H SER 8 23.971 20.440 21.701
48 HA SER 8 HA SER 8 26.257 18.901 22.312
49 HB2 SER 8 HB2 SER 8 26.019 20.994 20.118
50 HB3 SER 8 HB3 SER 8 27.102 19.588 20.145
51 HG SER 8 HG SER 8 25.153 18.284 20.276
52 H CYS 9 H CYS 9 25.773 22.393 22.624
53 HA CYS 9 HA CYS 9 28.596 22.937 23.228
54 HB2 CYS 9 HB2 CYS 9 26.054 24.565 23.109
55 HB3 CYS 9 HB3 CYS 9 27.477 25.181 23.953
56 H ASN 10 H ASN 10 25.628 22.274 25.068
57 HA ASN 10 HA ASN 10 26.553 23.105 27.624
58 HB2 ASN 10 HB2 ASN 10 24.209 22.552 26.886
59 HB3 ASN 10 HB3 ASN 10 24.610 20.838 26.978
60 HD21 ASN 10 HD21 ASN 10 24.292 20.734 30.519
61 HD22 ASN 10 HD22 ASN 10 24.781 19.853 29.091
62 H SER 11 H SER 11 26.654 19.783 26.169
63 HA SER 11 HA SER 11 28.398 18.617 28.072
64 HB2 SER 11 HB2 SER 11 28.292 18.097 25.081
65 HB3 SER 11 HB3 SER 11 28.959 17.013 26.327
66 HG SER 11 HG SER 11 26.949 16.729 27.160
67 H SER 12 H SER 12 29.200 20.575 25.185
68 HA SER 12 HA SER 12 32.017 20.170 25.189
69 HB2 SER 12 HB2 SER 12 30.546 21.224 23.384
70 HB3 SER 12 HB3 SER 12 30.586 22.716 24.324
71 HG SER 12 HG SER 12 32.517 21.449 22.828
72 H CYS 13 H CYS 13 30.162 22.929 26.591
73 HA CYS 13 HA CYS 13 32.371 24.189 27.861
74 HB2 CYS 13 HB2 CYS 13 29.371 24.198 28.258
75 HB3 CYS 13 HB3 CYS 13 30.435 25.159 29.285
76 H ILE 14 H ILE 14 29.947 21.870 29.320
77 HA ILE 14 HA ILE 14 31.228 21.798 31.845
78 HB ILE 14 HB ILE 14 29.751 19.527 30.463
79 HG12 ILE 14 HG12 ILE 14 28.602 21.372 32.592
80 HG13 ILE 14 HG13 ILE 14 28.508 21.843 30.907
81 HG21 ILE 14 HG21 ILE 14 31.068 18.705 32.339
82 HG22 ILE 14 HG22 ILE 14 30.609 20.105 33.334
83 HG23 ILE 14 HG23 ILE 14 29.410 18.846 32.920
84 HD11 ILE 14 HD11 ILE 14 27.344 19.290 32.081
85 HD12 ILE 14 HD12 ILE 14 26.463 20.727 31.536
86 HD13 ILE 14 HD13 ILE 14 27.334 19.718 30.355
87 H SER 15 H SER 15 32.026 19.888 28.897
88 HA SER 15 HA SER 15 34.059 18.297 30.114
89 HB2 SER 15 HB2 SER 15 33.891 19.209 27.216
90 HB3 SER 15 HB3 SER 15 34.877 17.883 27.855
91 HG SER 15 HG SER 15 32.060 18.107 27.714
92 H ARG 16 H ARG 16 34.172 21.674 29.159
93 HA ARG 16 HA ARG 16 37.117 21.893 29.482
94 HB2 ARG 16 HB2 ARG 16 34.961 24.036 29.196
95 HB3 ARG 16 HB3 ARG 16 36.698 24.320 29.267
96 HG2 ARG 16 HG2 ARG 16 37.004 22.992 27.178
97 HG3 ARG 16 HG3 ARG 16 35.247 22.727 27.147
98 HD2 ARG 16 HD2 ARG 16 35.836 24.536 25.619
99 HD3 ARG 16 HD3 ARG 16 34.834 25.121 26.955
100 HE ARG 16 HE ARG 16 37.675 25.443 27.521
101 HH11 ARG 16 HH11 ARG 16 35.038 26.993 25.784
102 HH12 ARG 16 HH12 ARG 16 35.741 28.575 25.953
103 HH21 ARG 16 HH21 ARG 16 38.528 27.424 27.661
104 HH22 ARG 16 HH22 ARG 16 37.703 28.810 26.944
105 H GLY 17 H GLY 17 34.291 22.255 31.569
106 HA2 GLY 17 HA2 GLY 17 35.176 21.927 33.994
107 HA3 GLY 17 HA3 GLY 17 35.988 23.464 33.720
108 H TYR 18 H TYR 18 33.071 23.746 32.079
109 HA TYR 18 HA TYR 18 31.949 25.393 34.220
110 HB2 TYR 18 HB2 TYR 18 31.233 24.922 31.315
111 HB3 TYR 18 HB3 TYR 18 30.472 26.113 32.338
112 HD1 TYR 18 HD1 TYR 18 33.665 25.197 30.700
113 HD2 TYR 18 HD2 TYR 18 31.539 28.175 32.953
114 HE1 TYR 18 HE1 TYR 18 35.416 26.907 30.108
115 HE2 TYR 18 HE2 TYR 18 33.269 29.845 32.416
116 HH TYR 18 HH TYR 18 35.093 30.305 31.139
117 H ARG 19 H ARG 19 29.289 25.371 33.604
118 HA ARG 19 HA ARG 19 28.231 22.660 34.339
119 HB2 ARG 19 HB2 ARG 19 27.315 25.239 35.654
120 HB3 ARG 19 HB3 ARG 19 26.741 23.607 35.965
121 HG2 ARG 19 HG2 ARG 19 28.174 23.656 37.709
122 HG3 ARG 19 HG3 ARG 19 29.368 23.204 36.500
123 HD2 ARG 19 HD2 ARG 19 30.395 24.995 37.552
124 HD3 ARG 19 HD3 ARG 19 29.661 25.807 36.170
125 HE ARG 19 HE ARG 19 27.922 25.762 38.519
126 HH11 ARG 19 HH11 ARG 19 30.634 27.612 37.216
127 HH12 ARG 19 HH12 ARG 19 30.358 28.868 38.433
128 HH21 ARG 19 HH21 ARG 19 27.729 27.374 39.914
129 HH22 ARG 19 HH22 ARG 19 28.863 28.741 39.854
130 H GLN 20 H GLN 20 28.091 25.021 32.074
131 HA GLN 20 HA GLN 20 25.465 24.386 31.022
132 HB2 GLN 20 HB2 GLN 20 25.245 26.248 32.915
133 HB3 GLN 20 HB3 GLN 20 25.997 27.279 31.732
134 HG2 GLN 20 HG2 GLN 20 24.109 26.892 30.185
135 HG3 GLN 20 HG3 GLN 20 23.366 25.791 31.374
136 HE21 GLN 20 HE21 GLN 20 22.490 28.545 33.600
137 HE22 GLN 20 HE22 GLN 20 22.603 26.790 33.484
138 H GLY 21 H GLY 21 25.270 25.178 28.820
139 HA2 GLY 21 HA2 GLY 21 27.298 26.822 27.656
140 HA3 GLY 21 HA3 GLY 21 27.612 25.144 27.261
141 H TYR 22 H TYR 22 26.926 27.472 25.603
142 HA TYR 22 HA TYR 22 24.820 26.378 23.896
143 HB2 TYR 22 HB2 TYR 22 23.460 28.556 24.141
144 HB3 TYR 22 HB3 TYR 22 23.348 27.371 25.412
145 HD1 TYR 22 HD1 TYR 22 24.032 27.798 27.639
146 HD2 TYR 22 HD2 TYR 22 24.863 30.655 24.533
147 HE1 TYR 22 HE1 TYR 22 24.727 29.463 29.367
148 HE2 TYR 22 HE2 TYR 22 25.499 32.336 26.240
149 HH TYR 22 HH TYR 22 25.234 31.701 29.744
150 H CYS 23 H CYS 23 24.220 28.221 22.234
151 HA CYS 23 HA CYS 23 26.484 28.440 20.548
152 HB2 CYS 23 HB2 CYS 23 23.824 29.884 20.343
153 HB3 CYS 23 HB3 CYS 23 24.903 29.455 19.021
154 H TRP 24 H TRP 24 27.129 30.476 19.371
155 HA TRP 24 HA TRP 24 26.913 32.994 20.911
156 HB2 TRP 24 HB2 TRP 24 28.808 31.460 21.751
157 HB3 TRP 24 HB3 TRP 24 29.654 31.877 20.288
158 HD1 TRP 24 HD1 TRP 24 27.991 33.688 23.272
159 HE1 TRP 24 HE1 TRP 24 29.358 35.770 23.887
160 HE3 TRP 24 HE3 TRP 24 31.359 33.603 19.409
161 HZ2 TRP 24 HZ2 TRP 24 31.422 37.382 22.660
162 HZ3 TRP 24 HZ3 TRP 24 32.972 35.466 19.125
163 HH2 TRP 24 HH2 TRP 24 33.010 37.357 20.733
164 H GLY 25 H GLY 25 25.616 33.202 18.902
165 HA2 GLY 25 HA2 GLY 25 25.369 34.398 16.885
166 HA3 GLY 25 HA3 GLY 25 27.126 34.419 16.653
167 H ILE 26 H ILE 26 27.722 33.187 15.001
168 HA ILE 26 HA ILE 26 26.652 30.447 14.590
169 HB ILE 26 HB ILE 26 26.624 30.868 12.114
170 HG12 ILE 26 HG12 ILE 26 26.462 33.806 12.922
171 HG13 ILE 26 HG13 ILE 26 27.884 33.050 12.202
172 HG21 ILE 26 HG21 ILE 26 24.328 31.602 12.101
173 HG22 ILE 26 HG22 ILE 26 24.586 30.634 13.550
174 HG23 ILE 26 HG23 ILE 26 24.508 32.405 13.673
175 HD11 ILE 26 HD11 ILE 26 26.645 34.256 10.511
176 HD12 ILE 26 HD12 ILE 26 26.588 32.513 10.167
177 HD13 ILE 26 HD13 ILE 26 25.179 33.347 10.871
178 H GLN 27 H GLN 27 28.067 28.996 13.768
179 HA GLN 27 HA GLN 27 30.055 27.954 13.552
180 HB2 GLN 27 HB2 GLN 27 30.726 30.365 11.890
181 HB3 GLN 27 HB3 GLN 27 31.537 28.804 11.790
182 HG2 GLN 27 HG2 GLN 27 29.995 27.998 10.362
183 HG3 GLN 27 HG3 GLN 27 28.689 28.360 11.462
184 HE21 GLN 27 HE21 GLN 27 27.470 30.630 9.039
185 HE22 GLN 27 HE22 GLN 27 27.122 29.259 10.041
186 H TYR 28 H TYR 28 29.878 29.538 15.904
187 HA TYR 28 HA TYR 28 32.334 30.806 16.642
188 HB2 TYR 28 HB2 TYR 28 31.386 30.178 19.013
189 HB3 TYR 28 HB3 TYR 28 30.592 31.379 18.018
190 HD1 TYR 28 HD1 TYR 28 30.302 27.923 19.356
191 HD2 TYR 28 HD2 TYR 28 28.452 30.993 16.972
192 HE1 TYR 28 HE1 TYR 28 28.261 26.515 19.125
193 HE2 TYR 28 HE2 TYR 28 26.417 29.566 16.705
194 HH TYR 28 HH TYR 28 26.068 26.371 18.257
195 H LYS 29 H LYS 29 34.267 29.967 17.163
196 HA LYS 29 HA LYS 29 34.790 27.208 16.785
197 HB2 LYS 29 HB2 LYS 29 36.141 29.339 16.340
198 HB3 LYS 29 HB3 LYS 29 36.611 29.306 18.043
199 HG2 LYS 29 HG2 LYS 29 37.730 27.187 17.772
200 HG3 LYS 29 HG3 LYS 29 36.998 26.924 16.183
201 HD2 LYS 29 HD2 LYS 29 38.897 29.180 16.879
202 HD3 LYS 29 HD3 LYS 29 39.395 27.677 16.081
203 HE2 LYS 29 HE2 LYS 29 37.623 29.902 14.992
204 HE3 LYS 29 HE3 LYS 29 39.214 29.421 14.417
205 HZ1 LYS 29 HZ1 LYS 29 37.478 28.577 12.987
206 HZ2 LYS 29 HZ2 LYS 29 38.222 27.298 13.692
207 HZ3 LYS 29 HZ3 LYS 29 36.714 27.814 14.186
208 H TYR 30 H TYR 30 34.499 29.131 19.727
209 HA TYR 30 HA TYR 30 34.395 26.612 21.334
210 HB2 TYR 30 HB2 TYR 30 35.445 29.287 22.309
211 HB3 TYR 30 HB3 TYR 30 35.365 27.788 23.209
212 HD1 TYR 30 HD1 TYR 30 37.237 29.738 20.727
213 HD2 TYR 30 HD2 TYR 30 36.975 25.936 22.739
214 HE1 TYR 30 HE1 TYR 30 39.582 29.234 20.070
215 HE2 TYR 30 HE2 TYR 30 39.320 25.425 22.061
216 HH TYR 30 HH TYR 30 41.214 27.605 19.975
217 H CYS 31 H CYS 31 32.434 26.312 22.227
218 HA CYS 31 HA CYS 31 30.200 28.033 21.983
219 HB2 CYS 31 HB2 CYS 31 30.788 25.844 24.009
220 HB3 CYS 31 HB3 CYS 31 29.210 26.538 23.721
221 H GLN 32 H GLN 32 28.921 29.127 23.676
222 HA GLN 32 HA GLN 32 30.627 30.610 25.609
223 HB2 GLN 32 HB2 GLN 32 29.089 31.843 24.123
224 HB3 GLN 32 HB3 GLN 32 27.721 31.011 24.847
225 HG2 GLN 32 HG2 GLN 32 27.929 33.204 25.854
226 HG3 GLN 32 HG3 GLN 32 28.314 31.993 27.065
227 HE21 GLN 32 HE21 GLN 32 30.917 34.457 27.681
228 HE22 GLN 32 HE22 GLN 32 29.312 33.907 28.170
229 H CYS 33 H CYS 33 30.424 30.274 27.822
230 HA CYS 33 HA CYS 33 28.849 27.851 28.653
231 HB2 CYS 33 HB2 CYS 33 31.501 28.884 29.680
232 HB3 CYS 33 HB3 CYS 33 30.712 27.351 30.036
233 H GLN 34 H GLN 34 29.317 27.911 31.330
234 HA GLN 34 HA GLN 34 26.963 29.107 32.202
235 HB2 GLN 34 HB2 GLN 34 27.946 27.236 33.346
236 HB3 GLN 34 HB3 GLN 34 29.392 28.152 33.723
237 HG2 GLN 34 HG2 GLN 34 28.145 27.897 35.723
238 HG3 GLN 34 HG3 GLN 34 28.076 29.592 35.283
239 HE21 GLN 34 HE21 GLN 34 24.500 29.475 34.639
240 HE22 GLN 34 HE22 GLN 34 25.985 30.265 34.065
Start of MODEL 13
1 H1 GLY 1 H1 GLY 1 19.568 19.495 11.074
2 H2 GLY 1 H2 GLY 1 20.251 20.742 11.889
3 H3 GLY 1 H3 GLY 1 21.098 19.337 11.665
4 HA2 GLY 1 HA2 GLY 1 21.295 19.653 9.364
5 HA3 GLY 1 HA3 GLY 1 20.182 21.032 9.463
6 H SER 2 H SER 2 21.301 22.813 9.023
7 HA SER 2 HA SER 2 24.089 23.222 9.818
8 HB2 SER 2 HB2 SER 2 22.010 24.991 8.482
9 HB3 SER 2 HB3 SER 2 23.692 25.481 8.780
10 HG SER 2 HG SER 2 24.429 23.955 7.457
11 H ALA 3 H ALA 3 21.087 23.780 11.489
12 HA ALA 3 HA ALA 3 21.903 26.178 12.867
13 HB1 ALA 3 HB1 ALA 3 19.766 24.144 13.630
14 HB2 ALA 3 HB2 ALA 3 19.914 25.811 14.207
15 HB3 ALA 3 HB3 ALA 3 19.546 25.506 12.507
16 H CYS 4 H CYS 4 22.654 26.538 14.879
17 HA CYS 4 HA CYS 4 24.202 24.478 16.298
18 HB2 CYS 4 HB2 CYS 4 25.071 26.741 16.067
19 HB3 CYS 4 HB3 CYS 4 23.651 27.430 16.854
20 H GLN 5 H GLN 5 23.640 23.621 18.328
21 HA GLN 5 HA GLN 5 20.917 24.200 19.389
22 HB2 GLN 5 HB2 GLN 5 22.087 21.426 19.020
23 HB3 GLN 5 HB3 GLN 5 20.539 21.823 19.740
24 HG2 GLN 5 HG2 GLN 5 21.230 22.332 16.825
25 HG3 GLN 5 HG3 GLN 5 20.429 20.904 17.448
26 HE21 GLN 5 HE21 GLN 5 17.633 22.824 16.219
27 HE22 GLN 5 HE22 GLN 5 18.900 21.713 15.702
28 H PHE 6 H PHE 6 20.837 24.444 21.574
29 HA PHE 6 HA PHE 6 23.296 24.895 22.873
30 HB2 PHE 6 HB2 PHE 6 22.096 25.378 24.858
31 HB3 PHE 6 HB3 PHE 6 21.231 26.054 23.495
32 HD1 PHE 6 HD1 PHE 6 18.912 25.556 23.208
33 HD2 PHE 6 HD2 PHE 6 21.280 23.221 25.958
34 HE1 PHE 6 HE1 PHE 6 16.863 24.395 23.999
35 HE2 PHE 6 HE2 PHE 6 19.246 22.012 26.698
36 HZ PHE 6 HZ PHE 6 17.029 22.613 25.732
37 H TRP 7 H TRP 7 21.284 21.899 23.075
38 HA TRP 7 HA TRP 7 22.605 20.799 25.290
39 HB2 TRP 7 HB2 TRP 7 21.622 18.791 24.754
40 HB3 TRP 7 HB3 TRP 7 20.521 19.966 24.102
41 HD1 TRP 7 HD1 TRP 7 20.872 20.340 21.311
42 HE1 TRP 7 HE1 TRP 7 21.460 18.676 19.457
43 HE3 TRP 7 HE3 TRP 7 22.719 16.570 24.219
44 HZ2 TRP 7 HZ2 TRP 7 22.617 16.034 19.265
45 HZ3 TRP 7 HZ3 TRP 7 23.544 14.476 23.166
46 HH2 TRP 7 HH2 TRP 7 23.496 14.196 20.698
47 H SER 8 H SER 8 23.752 20.835 21.944
48 HA SER 8 HA SER 8 26.016 19.030 22.478
49 HB2 SER 8 HB2 SER 8 24.839 19.209 20.270
50 HB3 SER 8 HB3 SER 8 25.528 20.820 20.072
51 HG SER 8 HG SER 8 26.767 19.156 19.082
52 H CYS 9 H CYS 9 25.431 22.482 22.641
53 HA CYS 9 HA CYS 9 28.252 23.231 23.002
54 HB2 CYS 9 HB2 CYS 9 25.576 24.610 23.392
55 HB3 CYS 9 HB3 CYS 9 27.059 25.315 23.985
56 H ASN 10 H ASN 10 25.491 22.435 25.096
57 HA ASN 10 HA ASN 10 26.482 23.263 27.540
58 HB2 ASN 10 HB2 ASN 10 24.157 22.688 26.974
59 HB3 ASN 10 HB3 ASN 10 24.578 20.996 26.858
60 HD21 ASN 10 HD21 ASN 10 24.125 20.529 30.319
61 HD22 ASN 10 HD22 ASN 10 24.438 19.784 28.743
62 H SER 11 H SER 11 26.591 19.808 26.448
63 HA SER 11 HA SER 11 28.455 18.989 28.442
64 HB2 SER 11 HB2 SER 11 28.822 17.034 26.962
65 HB3 SER 11 HB3 SER 11 27.120 17.386 27.288
66 HG SER 11 HG SER 11 26.968 17.247 25.238
67 H SER 12 H SER 12 29.031 20.520 25.311
68 HA SER 12 HA SER 12 31.872 20.108 25.218
69 HB2 SER 12 HB2 SER 12 30.523 20.833 23.273
70 HB3 SER 12 HB3 SER 12 30.294 22.419 24.031
71 HG SER 12 HG SER 12 32.684 21.158 23.193
72 H CYS 13 H CYS 13 29.992 22.936 26.510
73 HA CYS 13 HA CYS 13 32.242 24.316 27.604
74 HB2 CYS 13 HB2 CYS 13 29.277 24.250 28.245
75 HB3 CYS 13 HB3 CYS 13 30.397 25.217 29.185
76 H ILE 14 H ILE 14 30.012 21.903 29.205
77 HA ILE 14 HA ILE 14 31.445 21.850 31.640
78 HB ILE 14 HB ILE 14 30.011 19.532 30.299
79 HG12 ILE 14 HG12 ILE 14 28.957 21.272 32.557
80 HG13 ILE 14 HG13 ILE 14 28.700 21.768 30.896
81 HG21 ILE 14 HG21 ILE 14 31.511 18.719 32.032
82 HG22 ILE 14 HG22 ILE 14 31.072 20.062 33.106
83 HG23 ILE 14 HG23 ILE 14 29.902 18.761 32.757
84 HD11 ILE 14 HD11 ILE 14 27.727 19.151 32.099
85 HD12 ILE 14 HD12 ILE 14 26.750 20.578 31.708
86 HD13 ILE 14 HD13 ILE 14 27.517 19.654 30.407
87 H SER 15 H SER 15 32.181 20.030 28.628
88 HA SER 15 HA SER 15 34.464 18.654 29.633
89 HB2 SER 15 HB2 SER 15 33.946 19.586 26.793
90 HB3 SER 15 HB3 SER 15 35.126 18.372 27.302
91 HG SER 15 HG SER 15 32.292 18.255 27.499
92 H ARG 16 H ARG 16 34.174 22.050 28.739
93 HA ARG 16 HA ARG 16 37.105 22.507 28.714
94 HB2 ARG 16 HB2 ARG 16 34.781 24.477 28.789
95 HB3 ARG 16 HB3 ARG 16 36.487 24.907 28.698
96 HG2 ARG 16 HG2 ARG 16 36.682 23.745 26.516
97 HG3 ARG 16 HG3 ARG 16 34.974 23.276 26.649
98 HD2 ARG 16 HD2 ARG 16 35.223 25.202 25.157
99 HD3 ARG 16 HD3 ARG 16 34.244 25.568 26.580
100 HE ARG 16 HE ARG 16 37.130 26.260 26.765
101 HH11 ARG 16 HH11 ARG 16 34.005 27.573 25.865
102 HH12 ARG 16 HH12 ARG 16 34.384 29.132 26.596
103 HH21 ARG 16 HH21 ARG 16 37.641 28.233 27.308
104 HH22 ARG 16 HH22 ARG 16 36.503 29.569 27.190
105 H GLY 17 H GLY 17 34.452 22.699 31.033
106 HA2 GLY 17 HA2 GLY 17 35.583 22.158 33.343
107 HA3 GLY 17 HA3 GLY 17 36.233 23.785 33.161
108 H TYR 18 H TYR 18 33.181 23.928 31.772
109 HA TYR 18 HA TYR 18 32.166 25.361 34.107
110 HB2 TYR 18 HB2 TYR 18 31.143 25.045 31.272
111 HB3 TYR 18 HB3 TYR 18 30.505 26.161 32.460
112 HD1 TYR 18 HD1 TYR 18 33.430 25.407 30.349
113 HD2 TYR 18 HD2 TYR 18 31.651 28.225 33.058
114 HE1 TYR 18 HE1 TYR 18 35.130 27.114 29.679
115 HE2 TYR 18 HE2 TYR 18 33.344 29.922 32.418
116 HH TYR 18 HH TYR 18 35.106 30.422 30.991
117 H ARG 19 H ARG 19 29.432 25.190 33.644
118 HA ARG 19 HA ARG 19 28.613 22.390 34.353
119 HB2 ARG 19 HB2 ARG 19 28.060 24.907 35.953
120 HB3 ARG 19 HB3 ARG 19 26.946 23.556 35.970
121 HG2 ARG 19 HG2 ARG 19 28.156 22.926 37.756
122 HG3 ARG 19 HG3 ARG 19 29.086 22.109 36.511
123 HD2 ARG 19 HD2 ARG 19 30.670 23.098 37.912
124 HD3 ARG 19 HD3 ARG 19 30.626 24.176 36.506
125 HE ARG 19 HE ARG 19 28.798 25.055 38.584
126 HH11 ARG 19 HH11 ARG 19 32.235 24.988 37.917
127 HH12 ARG 19 HH12 ARG 19 32.554 26.389 38.923
128 HH21 ARG 19 HH21 ARG 19 29.312 26.470 40.105
129 HH22 ARG 19 HH22 ARG 19 30.855 27.301 40.110
130 H GLN 20 H GLN 20 28.173 24.821 32.185
131 HA GLN 20 HA GLN 20 25.703 23.874 31.146
132 HB2 GLN 20 HB2 GLN 20 25.122 25.506 33.166
133 HB3 GLN 20 HB3 GLN 20 25.637 26.755 32.047
134 HG2 GLN 20 HG2 GLN 20 23.392 26.767 31.658
135 HG3 GLN 20 HG3 GLN 20 23.835 25.590 30.431
136 HE21 GLN 20 HE21 GLN 20 22.212 22.878 32.167
137 HE22 GLN 20 HE22 GLN 20 23.395 23.256 30.944
138 H GLY 21 H GLY 21 25.178 24.956 29.021
139 HA2 GLY 21 HA2 GLY 21 26.898 26.939 27.953
140 HA3 GLY 21 HA3 GLY 21 27.419 25.352 27.381
141 H TYR 22 H TYR 22 26.496 27.482 25.804
142 HA TYR 22 HA TYR 22 24.254 26.402 24.288
143 HB2 TYR 22 HB2 TYR 22 23.021 28.730 24.781
144 HB3 TYR 22 HB3 TYR 22 22.787 27.278 25.749
145 HD1 TYR 22 HD1 TYR 22 22.746 27.413 28.008
146 HD2 TYR 22 HD2 TYR 22 25.084 30.264 25.779
147 HE1 TYR 22 HE1 TYR 22 23.458 28.504 30.134
148 HE2 TYR 22 HE2 TYR 22 25.834 31.310 27.925
149 HH TYR 22 HH TYR 22 26.050 30.729 30.314
150 H CYS 23 H CYS 23 23.632 28.051 22.460
151 HA CYS 23 HA CYS 23 26.114 28.560 21.121
152 HB2 CYS 23 HB2 CYS 23 23.313 29.385 20.310
153 HB3 CYS 23 HB3 CYS 23 24.707 29.260 19.247
154 H TRP 24 H TRP 24 26.945 30.574 20.296
155 HA TRP 24 HA TRP 24 26.731 32.827 22.150
156 HB2 TRP 24 HB2 TRP 24 28.700 31.712 20.379
157 HB3 TRP 24 HB3 TRP 24 28.524 33.375 19.951
158 HD1 TRP 24 HD1 TRP 24 30.582 31.386 21.961
159 HE1 TRP 24 HE1 TRP 24 31.695 32.634 23.902
160 HE3 TRP 24 HE3 TRP 24 27.601 35.562 22.043
161 HZ2 TRP 24 HZ2 TRP 24 31.398 35.168 25.242
162 HZ3 TRP 24 HZ3 TRP 24 28.078 37.392 23.632
163 HH2 TRP 24 HH2 TRP 24 29.971 37.218 25.235
164 H GLY 25 H GLY 25 27.375 34.733 19.733
165 HA2 GLY 25 HA2 GLY 25 24.771 35.858 19.378
166 HA3 GLY 25 HA3 GLY 25 26.254 36.316 18.546
167 H ILE 26 H ILE 26 26.483 35.755 16.382
168 HA ILE 26 HA ILE 26 24.459 33.865 15.221
169 HB ILE 26 HB ILE 26 25.526 36.464 14.098
170 HG12 ILE 26 HG12 ILE 26 22.755 35.501 14.962
171 HG13 ILE 26 HG13 ILE 26 23.730 36.749 15.734
172 HG21 ILE 26 HG21 ILE 26 24.173 36.015 12.083
173 HG22 ILE 26 HG22 ILE 26 25.394 34.780 12.269
174 HG23 ILE 26 HG23 ILE 26 23.712 34.424 12.726
175 HD11 ILE 26 HD11 ILE 26 22.009 37.854 14.532
176 HD12 ILE 26 HD12 ILE 26 23.512 38.133 13.628
177 HD13 ILE 26 HD13 ILE 26 22.322 36.940 13.054
178 H GLN 27 H GLN 27 27.834 35.053 14.899
179 HA GLN 27 HA GLN 27 28.520 32.346 13.918
180 HB2 GLN 27 HB2 GLN 27 29.707 32.995 12.046
181 HB3 GLN 27 HB3 GLN 27 28.234 33.923 11.975
182 HG2 GLN 27 HG2 GLN 27 29.741 35.539 11.389
183 HG3 GLN 27 HG3 GLN 27 29.648 35.845 13.115
184 HE21 GLN 27 HE21 GLN 27 33.260 35.764 12.088
185 HE22 GLN 27 HE22 GLN 27 31.885 36.849 11.873
186 H TYR 28 H TYR 28 30.389 31.499 14.674
187 HA TYR 28 HA TYR 28 32.214 32.976 16.462
188 HB2 TYR 28 HB2 TYR 28 31.289 31.310 18.333
189 HB3 TYR 28 HB3 TYR 28 30.523 32.855 18.041
190 HD1 TYR 28 HD1 TYR 28 28.209 33.005 17.555
191 HD2 TYR 28 HD2 TYR 28 30.250 29.242 16.972
192 HE1 TYR 28 HE1 TYR 28 26.062 31.938 16.885
193 HE2 TYR 28 HE2 TYR 28 28.109 28.207 16.238
194 HH TYR 28 HH TYR 28 25.010 29.973 16.279
195 H LYS 29 H LYS 29 33.954 31.577 17.298
196 HA LYS 29 HA LYS 29 34.516 29.151 15.737
197 HB2 LYS 29 HB2 LYS 29 35.879 30.351 18.194
198 HB3 LYS 29 HB3 LYS 29 36.472 28.996 17.239
199 HG2 LYS 29 HG2 LYS 29 36.511 30.455 15.210
200 HG3 LYS 29 HG3 LYS 29 36.038 31.838 16.228
201 HD2 LYS 29 HD2 LYS 29 38.109 31.565 17.568
202 HD3 LYS 29 HD3 LYS 29 38.557 30.168 16.569
203 HE2 LYS 29 HE2 LYS 29 38.257 31.733 14.548
204 HE3 LYS 29 HE3 LYS 29 38.229 33.061 15.716
205 HZ1 LYS 29 HZ1 LYS 29 40.427 31.071 15.399
206 HZ2 LYS 29 HZ2 LYS 29 40.506 32.611 14.813
207 HZ3 LYS 29 HZ3 LYS 29 40.468 32.297 16.446
208 H TYR 30 H TYR 30 33.223 29.826 18.984
209 HA TYR 30 HA TYR 30 32.514 26.983 19.399
210 HB2 TYR 30 HB2 TYR 30 33.782 27.051 21.627
211 HB3 TYR 30 HB3 TYR 30 34.712 26.849 20.163
212 HD1 TYR 30 HD1 TYR 30 33.439 29.743 22.279
213 HD2 TYR 30 HD2 TYR 30 36.717 28.004 20.056
214 HE1 TYR 30 HE1 TYR 30 34.849 31.719 22.789
215 HE2 TYR 30 HE2 TYR 30 38.132 29.971 20.624
216 HH TYR 30 HH TYR 30 38.261 31.816 22.183
217 H CYS 31 H CYS 31 31.527 26.733 21.679
218 HA CYS 31 HA CYS 31 29.252 28.472 21.744
219 HB2 CYS 31 HB2 CYS 31 30.123 26.212 23.581
220 HB3 CYS 31 HB3 CYS 31 28.500 26.890 23.478
221 H GLN 32 H GLN 32 28.237 29.219 23.765
222 HA GLN 32 HA GLN 32 30.056 30.730 25.571
223 HB2 GLN 32 HB2 GLN 32 28.201 31.874 24.238
224 HB3 GLN 32 HB3 GLN 32 27.051 30.947 25.178
225 HG2 GLN 32 HG2 GLN 32 27.992 32.041 27.271
226 HG3 GLN 32 HG3 GLN 32 29.052 32.990 26.224
227 HE21 GLN 32 HE21 GLN 32 26.550 35.445 25.793
228 HE22 GLN 32 HE22 GLN 32 28.255 35.033 25.740
229 H CYS 33 H CYS 33 29.802 30.462 27.866
230 HA CYS 33 HA CYS 33 28.608 27.806 28.751
231 HB2 CYS 33 HB2 CYS 33 31.238 29.066 29.554
232 HB3 CYS 33 HB3 CYS 33 30.606 27.481 29.984
233 H GLN 34 H GLN 34 29.120 27.757 31.281
234 HA GLN 34 HA GLN 34 26.803 28.724 32.368
235 HB2 GLN 34 HB2 GLN 34 28.074 26.832 33.245
236 HB3 GLN 34 HB3 GLN 34 29.373 27.902 33.753
237 HG2 GLN 34 HG2 GLN 34 28.165 27.258 35.696
238 HG3 GLN 34 HG3 GLN 34 27.843 28.958 35.422
239 HE21 GLN 34 HE21 GLN 34 24.349 28.320 34.505
240 HE22 GLN 34 HE22 GLN 34 25.697 29.423 34.154
Start of MODEL 14
1 H1 GLY 1 H1 GLY 1 15.550 30.191 12.161
2 H2 GLY 1 H2 GLY 1 14.314 29.924 13.138
3 H3 GLY 1 H3 GLY 1 14.026 29.954 11.509
4 HA2 GLY 1 HA2 GLY 1 14.022 27.691 12.250
5 HA3 GLY 1 HA3 GLY 1 15.439 28.017 11.240
6 H SER 2 H SER 2 17.328 27.354 12.025
7 HA SER 2 HA SER 2 18.184 27.508 14.756
8 HB2 SER 2 HB2 SER 2 16.796 25.560 15.147
9 HB3 SER 2 HB3 SER 2 17.394 24.796 13.642
10 HG SER 2 HG SER 2 18.662 25.063 16.162
11 H ALA 3 H ALA 3 20.422 27.252 14.912
12 HA ALA 3 HA ALA 3 21.947 26.345 12.510
13 HB1 ALA 3 HB1 ALA 3 22.346 28.948 14.014
14 HB2 ALA 3 HB2 ALA 3 23.365 28.339 12.687
15 HB3 ALA 3 HB3 ALA 3 21.665 28.778 12.380
16 H CYS 4 H CYS 4 21.866 26.626 16.034
17 HA CYS 4 HA CYS 4 24.026 24.633 16.259
18 HB2 CYS 4 HB2 CYS 4 25.340 26.654 16.233
19 HB3 CYS 4 HB3 CYS 4 24.223 27.461 17.331
20 H GLN 5 H GLN 5 22.880 23.141 17.422
21 HA GLN 5 HA GLN 5 20.880 23.892 19.395
22 HB2 GLN 5 HB2 GLN 5 22.155 21.173 18.941
23 HB3 GLN 5 HB3 GLN 5 20.673 21.548 19.844
24 HG2 GLN 5 HG2 GLN 5 19.581 22.329 17.802
25 HG3 GLN 5 HG3 GLN 5 21.026 21.953 16.861
26 HE21 GLN 5 HE21 GLN 5 19.145 18.999 16.168
27 HE22 GLN 5 HE22 GLN 5 19.513 20.633 15.596
28 H PHE 6 H PHE 6 21.188 24.432 21.476
29 HA PHE 6 HA PHE 6 23.690 24.868 22.601
30 HB2 PHE 6 HB2 PHE 6 22.463 25.322 24.708
31 HB3 PHE 6 HB3 PHE 6 21.777 26.106 23.317
32 HD1 PHE 6 HD1 PHE 6 19.475 25.817 22.726
33 HD2 PHE 6 HD2 PHE 6 21.310 23.151 25.579
34 HE1 PHE 6 HE1 PHE 6 17.263 24.765 23.165
35 HE2 PHE 6 HE2 PHE 6 19.110 22.066 25.991
36 HZ PHE 6 HZ PHE 6 17.092 22.862 24.763
37 H TRP 7 H TRP 7 21.746 21.875 22.913
38 HA TRP 7 HA TRP 7 23.143 20.796 25.135
39 HB2 TRP 7 HB2 TRP 7 22.098 18.802 24.689
40 HB3 TRP 7 HB3 TRP 7 20.980 19.977 24.019
41 HD1 TRP 7 HD1 TRP 7 20.949 20.123 21.302
42 HE1 TRP 7 HE1 TRP 7 21.453 18.433 19.469
43 HE3 TRP 7 HE3 TRP 7 23.368 16.659 24.150
44 HZ2 TRP 7 HZ2 TRP 7 22.945 15.929 19.240
45 HZ3 TRP 7 HZ3 TRP 7 24.322 14.608 23.101
46 HH2 TRP 7 HH2 TRP 7 24.133 14.254 20.656
47 H SER 8 H SER 8 24.136 20.963 21.757
48 HA SER 8 HA SER 8 26.336 19.084 21.915
49 HB2 SER 8 HB2 SER 8 27.037 19.953 19.819
50 HB3 SER 8 HB3 SER 8 25.272 19.877 19.780
51 HG SER 8 HG SER 8 25.179 22.099 20.039
52 H CYS 9 H CYS 9 26.093 22.612 22.382
53 HA CYS 9 HA CYS 9 28.865 23.067 23.077
54 HB2 CYS 9 HB2 CYS 9 26.303 24.604 23.644
55 HB3 CYS 9 HB3 CYS 9 27.921 25.203 23.989
56 H ASN 10 H ASN 10 25.908 22.367 24.976
57 HA ASN 10 HA ASN 10 26.833 23.100 27.491
58 HB2 ASN 10 HB2 ASN 10 24.480 22.600 26.795
59 HB3 ASN 10 HB3 ASN 10 24.852 20.880 26.842
60 HD21 ASN 10 HD21 ASN 10 24.419 20.761 30.373
61 HD22 ASN 10 HD22 ASN 10 24.591 19.870 28.854
62 H SER 11 H SER 11 26.865 19.717 26.217
63 HA SER 11 HA SER 11 28.383 18.634 28.373
64 HB2 SER 11 HB2 SER 11 28.807 16.749 26.936
65 HB3 SER 11 HB3 SER 11 27.143 17.288 26.683
66 HG SER 11 HG SER 11 27.650 17.464 24.661
67 H SER 12 H SER 12 29.450 20.224 25.361
68 HA SER 12 HA SER 12 32.222 19.627 25.593
69 HB2 SER 12 HB2 SER 12 31.241 20.400 23.505
70 HB3 SER 12 HB3 SER 12 30.825 21.958 24.234
71 HG SER 12 HG SER 12 33.361 20.910 23.560
72 H CYS 13 H CYS 13 30.395 22.537 26.704
73 HA CYS 13 HA CYS 13 32.585 23.839 27.983
74 HB2 CYS 13 HB2 CYS 13 29.569 23.933 28.355
75 HB3 CYS 13 HB3 CYS 13 30.676 24.958 29.254
76 H ILE 14 H ILE 14 29.963 21.814 29.524
77 HA ILE 14 HA ILE 14 31.088 21.900 32.091
78 HB ILE 14 HB ILE 14 29.468 19.655 30.834
79 HG12 ILE 14 HG12 ILE 14 28.580 21.954 32.628
80 HG13 ILE 14 HG13 ILE 14 28.458 22.047 30.888
81 HG21 ILE 14 HG21 ILE 14 30.614 18.879 32.861
82 HG22 ILE 14 HG22 ILE 14 30.186 20.371 33.714
83 HG23 ILE 14 HG23 ILE 14 28.931 19.181 33.287
84 HD11 ILE 14 HD11 ILE 14 26.974 20.094 32.674
85 HD12 ILE 14 HD12 ILE 14 26.325 21.437 31.719
86 HD13 ILE 14 HD13 ILE 14 26.997 20.017 30.894
87 H SER 15 H SER 15 31.948 19.660 29.446
88 HA SER 15 HA SER 15 33.769 18.041 30.896
89 HB2 SER 15 HB2 SER 15 33.904 18.860 27.979
90 HB3 SER 15 HB3 SER 15 34.725 17.475 28.712
91 HG SER 15 HG SER 15 31.976 17.929 28.266
92 H ARG 16 H ARG 16 34.227 21.336 29.758
93 HA ARG 16 HA ARG 16 37.163 21.390 30.193
94 HB2 ARG 16 HB2 ARG 16 35.160 23.640 29.696
95 HB3 ARG 16 HB3 ARG 16 36.910 23.823 29.777
96 HG2 ARG 16 HG2 ARG 16 37.250 22.566 27.770
97 HG3 ARG 16 HG3 ARG 16 35.596 21.961 27.793
98 HD2 ARG 16 HD2 ARG 16 35.900 23.626 26.056
99 HD3 ARG 16 HD3 ARG 16 34.684 24.116 27.237
100 HE ARG 16 HE ARG 16 37.056 25.313 28.127
101 HH11 ARG 16 HH11 ARG 16 35.448 25.487 25.002
102 HH12 ARG 16 HH12 ARG 16 35.858 27.162 24.828
103 HH21 ARG 16 HH21 ARG 16 37.483 27.372 27.834
104 HH22 ARG 16 HH22 ARG 16 36.831 28.271 26.461
105 H GLY 17 H GLY 17 34.244 22.183 31.975
106 HA2 GLY 17 HA2 GLY 17 34.934 21.798 34.495
107 HA3 GLY 17 HA3 GLY 17 35.782 23.326 34.254
108 H TYR 18 H TYR 18 33.121 23.750 32.330
109 HA TYR 18 HA TYR 18 31.888 25.485 34.292
110 HB2 TYR 18 HB2 TYR 18 31.244 24.788 31.411
111 HB3 TYR 18 HB3 TYR 18 30.527 26.115 32.296
112 HD1 TYR 18 HD1 TYR 18 32.025 27.944 33.258
113 HD2 TYR 18 HD2 TYR 18 33.400 25.052 30.401
114 HE1 TYR 18 HE1 TYR 18 33.906 29.466 32.634
115 HE2 TYR 18 HE2 TYR 18 35.317 26.548 29.801
116 HH TYR 18 HH TYR 18 35.582 29.853 30.989
117 H ARG 19 H ARG 19 29.291 25.513 33.666
118 HA ARG 19 HA ARG 19 28.048 22.905 34.459
119 HB2 ARG 19 HB2 ARG 19 27.645 25.565 35.876
120 HB3 ARG 19 HB3 ARG 19 26.567 24.186 36.018
121 HG2 ARG 19 HG2 ARG 19 27.787 23.636 37.798
122 HG3 ARG 19 HG3 ARG 19 28.832 22.876 36.612
123 HD2 ARG 19 HD2 ARG 19 30.217 24.073 38.112
124 HD3 ARG 19 HD3 ARG 19 30.227 25.014 36.610
125 HE ARG 19 HE ARG 19 28.125 26.040 38.195
126 HH11 ARG 19 HH11 ARG 19 31.437 25.476 39.203
127 HH12 ARG 19 HH12 ARG 19 31.326 26.841 40.291
128 HH21 ARG 19 HH21 ARG 19 28.311 27.963 39.172
129 HH22 ARG 19 HH22 ARG 19 29.711 28.306 40.167
130 H GLN 20 H GLN 20 28.156 25.122 32.089
131 HA GLN 20 HA GLN 20 25.749 24.234 30.942
132 HB2 GLN 20 HB2 GLN 20 25.102 26.331 32.490
133 HB3 GLN 20 HB3 GLN 20 25.760 27.226 31.136
134 HG2 GLN 20 HG2 GLN 20 23.516 27.187 30.623
135 HG3 GLN 20 HG3 GLN 20 24.079 25.835 29.657
136 HE21 GLN 20 HE21 GLN 20 22.342 23.426 31.797
137 HE22 GLN 20 HE22 GLN 20 23.731 23.554 30.724
138 H GLY 21 H GLY 21 25.481 25.156 28.676
139 HA2 GLY 21 HA2 GLY 21 27.455 26.842 27.529
140 HA3 GLY 21 HA3 GLY 21 27.781 25.171 27.054
141 H TYR 22 H TYR 22 27.108 27.394 25.387
142 HA TYR 22 HA TYR 22 24.877 26.483 23.734
143 HB2 TYR 22 HB2 TYR 22 23.688 28.762 24.096
144 HB3 TYR 22 HB3 TYR 22 23.466 27.500 25.298
145 HD1 TYR 22 HD1 TYR 22 25.393 30.657 24.644
146 HD2 TYR 22 HD2 TYR 22 24.060 27.761 27.542
147 HE1 TYR 22 HE1 TYR 22 26.374 32.042 26.469
148 HE2 TYR 22 HE2 TYR 22 25.089 29.132 29.371
149 HH TYR 22 HH TYR 22 26.533 30.869 29.833
150 H CYS 23 H CYS 23 24.682 27.876 21.744
151 HA CYS 23 HA CYS 23 27.184 29.306 21.063
152 HB2 CYS 23 HB2 CYS 23 24.743 28.466 19.533
153 HB3 CYS 23 HB3 CYS 23 25.800 29.719 18.910
154 H TRP 24 H TRP 24 26.945 31.524 19.957
155 HA TRP 24 HA TRP 24 25.981 33.216 22.097
156 HB2 TRP 24 HB2 TRP 24 27.252 34.196 19.568
157 HB3 TRP 24 HB3 TRP 24 27.223 34.959 21.130
158 HD1 TRP 24 HD1 TRP 24 28.347 31.689 22.123
159 HE1 TRP 24 HE1 TRP 24 30.900 31.464 22.089
160 HE3 TRP 24 HE3 TRP 24 29.524 35.845 19.372
161 HZ2 TRP 24 HZ2 TRP 24 33.161 33.040 21.301
162 HZ3 TRP 24 HZ3 TRP 24 31.907 36.483 19.040
163 HH2 TRP 24 HH2 TRP 24 33.724 35.110 20.018
164 H GLY 25 H GLY 25 23.990 32.085 19.834
165 HA2 GLY 25 HA2 GLY 25 21.869 32.746 19.261
166 HA3 GLY 25 HA3 GLY 25 22.140 34.288 20.071
167 H ILE 26 H ILE 26 24.228 35.355 18.633
168 HA ILE 26 HA ILE 26 23.549 35.437 15.743
169 HB ILE 26 HB ILE 26 23.521 37.821 17.641
170 HG12 ILE 26 HG12 ILE 26 21.380 36.700 15.774
171 HG13 ILE 26 HG13 ILE 26 21.389 36.606 17.537
172 HG21 ILE 26 HG21 ILE 26 23.429 37.881 14.588
173 HG22 ILE 26 HG22 ILE 26 23.233 39.277 15.670
174 HG23 ILE 26 HG23 ILE 26 24.763 38.467 15.613
175 HD11 ILE 26 HD11 ILE 26 20.998 39.103 15.872
176 HD12 ILE 26 HD12 ILE 26 19.881 38.320 16.996
177 HD13 ILE 26 HD13 ILE 26 21.326 39.114 17.626
178 H GLN 27 H GLN 27 25.354 35.844 14.481
179 HA GLN 27 HA GLN 27 27.535 35.968 13.902
180 HB2 GLN 27 HB2 GLN 27 26.787 38.300 14.250
181 HB3 GLN 27 HB3 GLN 27 27.445 38.250 15.888
182 HG2 GLN 27 HG2 GLN 27 28.999 39.411 14.493
183 HG3 GLN 27 HG3 GLN 27 29.737 37.897 14.936
184 HE21 GLN 27 HE21 GLN 27 28.554 38.212 11.005
185 HE22 GLN 27 HE22 GLN 27 27.426 38.816 12.213
186 H TYR 28 H TYR 28 28.126 33.916 14.715
187 HA TYR 28 HA TYR 28 30.478 33.990 16.499
188 HB2 TYR 28 HB2 TYR 28 29.650 32.171 17.918
189 HB3 TYR 28 HB3 TYR 28 28.659 33.605 18.046
190 HD1 TYR 28 HD1 TYR 28 28.802 30.146 16.667
191 HD2 TYR 28 HD2 TYR 28 26.319 33.581 17.424
192 HE1 TYR 28 HE1 TYR 28 26.797 28.853 15.965
193 HE2 TYR 28 HE2 TYR 28 24.304 32.272 16.775
194 HH TYR 28 HH TYR 28 23.510 30.095 16.230
195 H LYS 29 H LYS 29 31.808 32.149 16.349
196 HA LYS 29 HA LYS 29 31.304 30.204 14.126
197 HB2 LYS 29 HB2 LYS 29 33.959 31.049 15.377
198 HB3 LYS 29 HB3 LYS 29 33.755 29.951 14.031
199 HG2 LYS 29 HG2 LYS 29 33.360 32.958 14.088
200 HG3 LYS 29 HG3 LYS 29 34.555 32.028 13.198
201 HD2 LYS 29 HD2 LYS 29 31.609 32.359 12.588
202 HD3 LYS 29 HD3 LYS 29 33.007 32.776 11.596
203 HE2 LYS 29 HE2 LYS 29 33.513 30.236 11.564
204 HE3 LYS 29 HE3 LYS 29 31.891 30.032 12.253
205 HZ1 LYS 29 HZ1 LYS 29 32.614 31.194 9.623
206 HZ2 LYS 29 HZ2 LYS 29 31.725 29.868 9.866
207 HZ3 LYS 29 HZ3 LYS 29 31.099 31.348 10.239
208 H TYR 30 H TYR 30 31.784 30.527 17.550
209 HA TYR 30 HA TYR 30 31.809 27.592 17.982
210 HB2 TYR 30 HB2 TYR 30 33.745 29.546 19.261
211 HB3 TYR 30 HB3 TYR 30 33.692 27.811 19.527
212 HD1 TYR 30 HD1 TYR 30 35.171 30.465 17.623
213 HD2 TYR 30 HD2 TYR 30 34.219 26.266 17.490
214 HE1 TYR 30 HE1 TYR 30 36.857 30.142 15.823
215 HE2 TYR 30 HE2 TYR 30 35.916 25.948 15.688
216 HH TYR 30 HH TYR 30 37.247 27.060 14.111
217 H CYS 31 H CYS 31 31.708 27.223 20.518
218 HA CYS 31 HA CYS 31 29.250 28.520 21.396
219 HB2 CYS 31 HB2 CYS 31 31.012 26.439 22.722
220 HB3 CYS 31 HB3 CYS 31 29.378 26.843 23.214
221 H GLN 32 H GLN 32 28.946 28.908 23.768
222 HA GLN 32 HA GLN 32 31.178 30.075 25.308
223 HB2 GLN 32 HB2 GLN 32 28.721 31.501 24.433
224 HB3 GLN 32 HB3 GLN 32 28.939 31.519 26.167
225 HG2 GLN 32 HG2 GLN 32 31.099 32.376 24.200
226 HG3 GLN 32 HG3 GLN 32 29.972 33.472 24.997
227 HE21 GLN 32 HE21 GLN 32 33.022 33.634 27.032
228 HE22 GLN 32 HE22 GLN 32 32.432 34.247 25.490
229 H CYS 33 H CYS 33 30.539 30.165 27.645
230 HA CYS 33 HA CYS 33 29.126 27.619 28.467
231 HB2 CYS 33 HB2 CYS 33 31.849 28.613 29.337
232 HB3 CYS 33 HB3 CYS 33 31.045 27.125 29.810
233 H GLN 34 H GLN 34 29.064 27.404 30.820
234 HA GLN 34 HA GLN 34 28.168 27.868 32.762
235 HB2 GLN 34 HB2 GLN 34 30.339 29.369 32.695
236 HB3 GLN 34 HB3 GLN 34 29.200 30.700 32.640
237 HG2 GLN 34 HG2 GLN 34 29.733 30.461 34.896
238 HG3 GLN 34 HG3 GLN 34 28.145 29.718 34.768
239 HE21 GLN 34 HE21 GLN 34 30.523 27.555 36.779
240 HE22 GLN 34 HE22 GLN 34 30.045 29.252 36.896
Start of MODEL 15
1 H1 GLY 1 H1 GLY 1 17.936 20.536 10.706
2 H2 GLY 1 H2 GLY 1 18.650 21.197 12.041
3 H3 GLY 1 H3 GLY 1 18.955 19.634 11.639
4 HA2 GLY 1 HA2 GLY 1 20.109 20.255 9.662
5 HA3 GLY 1 HA3 GLY 1 19.677 21.942 9.968
6 H SER 2 H SER 2 22.058 22.218 9.783
7 HA SER 2 HA SER 2 23.738 21.261 12.008
8 HB2 SER 2 HB2 SER 2 24.387 23.099 9.678
9 HB3 SER 2 HB3 SER 2 25.552 22.417 10.826
10 HG SER 2 HG SER 2 24.905 20.333 10.166
11 H ALA 3 H ALA 3 21.530 23.773 11.991
12 HA ALA 3 HA ALA 3 22.901 25.913 13.188
13 HB1 ALA 3 HB1 ALA 3 20.688 26.496 14.139
14 HB2 ALA 3 HB2 ALA 3 20.581 26.044 12.434
15 HB3 ALA 3 HB3 ALA 3 20.071 24.893 13.691
16 H CYS 4 H CYS 4 23.351 26.525 15.275
17 HA CYS 4 HA CYS 4 24.491 24.492 16.872
18 HB2 CYS 4 HB2 CYS 4 25.424 26.723 16.582
19 HB3 CYS 4 HB3 CYS 4 24.041 27.444 17.410
20 H GLN 5 H GLN 5 23.293 23.075 17.982
21 HA GLN 5 HA GLN 5 21.024 23.913 19.685
22 HB2 GLN 5 HB2 GLN 5 22.328 21.172 19.497
23 HB3 GLN 5 HB3 GLN 5 20.765 21.607 20.189
24 HG2 GLN 5 HG2 GLN 5 21.537 21.574 17.253
25 HG3 GLN 5 HG3 GLN 5 20.380 20.533 18.064
26 HE21 GLN 5 HE21 GLN 5 19.060 23.969 16.498
27 HE22 GLN 5 HE22 GLN 5 20.580 23.195 16.070
28 H PHE 6 H PHE 6 21.255 24.491 21.796
29 HA PHE 6 HA PHE 6 23.725 24.899 22.959
30 HB2 PHE 6 HB2 PHE 6 22.677 25.574 24.864
31 HB3 PHE 6 HB3 PHE 6 21.436 25.834 23.688
32 HD1 PHE 6 HD1 PHE 6 22.311 24.393 26.821
33 HD2 PHE 6 HD2 PHE 6 19.664 23.758 23.464
34 HE1 PHE 6 HE1 PHE 6 20.915 22.881 28.214
35 HE2 PHE 6 HE2 PHE 6 18.288 22.215 24.846
36 HZ PHE 6 HZ PHE 6 18.908 21.792 27.217
37 H TRP 7 H TRP 7 21.741 21.920 23.324
38 HA TRP 7 HA TRP 7 23.008 20.835 25.512
39 HB2 TRP 7 HB2 TRP 7 22.028 18.820 25.007
40 HB3 TRP 7 HB3 TRP 7 20.962 19.981 24.234
41 HD1 TRP 7 HD1 TRP 7 21.151 20.114 21.551
42 HE1 TRP 7 HE1 TRP 7 21.997 18.479 19.724
43 HE3 TRP 7 HE3 TRP 7 23.467 16.711 24.552
44 HZ2 TRP 7 HZ2 TRP 7 23.207 15.871 19.648
45 HZ3 TRP 7 HZ3 TRP 7 24.374 14.595 23.597
46 HH2 TRP 7 HH2 TRP 7 24.225 14.162 21.165
47 H SER 8 H SER 8 24.234 20.748 22.191
48 HA SER 8 HA SER 8 26.513 19.007 22.748
49 HB2 SER 8 HB2 SER 8 25.539 19.097 20.541
50 HB3 SER 8 HB3 SER 8 25.821 20.840 20.431
51 HG SER 8 HG SER 8 27.929 20.527 20.145
52 H CYS 9 H CYS 9 26.035 22.565 22.622
53 HA CYS 9 HA CYS 9 28.821 23.233 23.123
54 HB2 CYS 9 HB2 CYS 9 26.193 24.684 23.597
55 HB3 CYS 9 HB3 CYS 9 27.761 25.366 23.979
56 H ASN 10 H ASN 10 25.989 22.691 25.208
57 HA ASN 10 HA ASN 10 27.139 23.189 27.732
58 HB2 ASN 10 HB2 ASN 10 24.758 23.118 27.292
59 HB3 ASN 10 HB3 ASN 10 24.848 21.461 26.729
60 HD21 ASN 10 HD21 ASN 10 23.968 21.987 30.527
61 HD22 ASN 10 HD22 ASN 10 23.967 23.323 29.375
62 H SER 11 H SER 11 26.978 20.032 25.918
63 HA SER 11 HA SER 11 28.470 18.596 27.902
64 HB2 SER 11 HB2 SER 11 28.677 16.863 26.199
65 HB3 SER 11 HB3 SER 11 27.021 17.518 26.246
66 HG SER 11 HG SER 11 27.669 17.357 24.108
67 H SER 12 H SER 12 29.556 20.438 25.043
68 HA SER 12 HA SER 12 32.364 19.838 25.211
69 HB2 SER 12 HB2 SER 12 31.477 20.847 23.226
70 HB3 SER 12 HB3 SER 12 30.834 22.222 24.117
71 HG SER 12 HG SER 12 32.705 22.834 23.086
72 H CYS 13 H CYS 13 30.537 22.662 26.546
73 HA CYS 13 HA CYS 13 32.755 23.781 27.914
74 HB2 CYS 13 HB2 CYS 13 29.752 23.987 28.219
75 HB3 CYS 13 HB3 CYS 13 30.872 24.990 29.153
76 H ILE 14 H ILE 14 30.113 21.669 29.283
77 HA ILE 14 HA ILE 14 31.205 21.605 31.897
78 HB ILE 14 HB ILE 14 29.499 19.552 30.461
79 HG12 ILE 14 HG12 ILE 14 28.706 21.659 32.529
80 HG13 ILE 14 HG13 ILE 14 28.567 21.947 30.806
81 HG21 ILE 14 HG21 ILE 14 30.556 18.444 32.319
82 HG22 ILE 14 HG22 ILE 14 30.349 19.869 33.362
83 HG23 ILE 14 HG23 ILE 14 28.951 18.866 32.893
84 HD11 ILE 14 HD11 ILE 14 26.421 21.269 31.551
85 HD12 ILE 14 HD12 ILE 14 27.108 19.874 30.679
86 HD13 ILE 14 HD13 ILE 14 27.065 19.891 32.451
87 H SER 15 H SER 15 32.239 19.670 29.060
88 HA SER 15 HA SER 15 33.894 17.777 30.364
89 HB2 SER 15 HB2 SER 15 33.590 17.797 27.920
90 HB3 SER 15 HB3 SER 15 34.459 19.337 27.816
91 HG SER 15 HG SER 15 35.441 16.779 28.200
92 H ARG 16 H ARG 16 34.493 21.216 29.747
93 HA ARG 16 HA ARG 16 37.295 21.169 30.610
94 HB2 ARG 16 HB2 ARG 16 35.391 23.489 30.077
95 HB3 ARG 16 HB3 ARG 16 37.134 23.625 30.303
96 HG2 ARG 16 HG2 ARG 16 37.599 22.481 28.245
97 HG3 ARG 16 HG3 ARG 16 35.933 21.913 28.103
98 HD2 ARG 16 HD2 ARG 16 36.417 23.725 26.523
99 HD3 ARG 16 HD3 ARG 16 35.073 24.069 27.624
100 HE ARG 16 HE ARG 16 37.515 25.167 28.697
101 HH11 ARG 16 HH11 ARG 16 35.291 25.823 26.037
102 HH12 ARG 16 HH12 ARG 16 35.670 27.551 26.138
103 HH21 ARG 16 HH21 ARG 16 37.680 27.324 28.843
104 HH22 ARG 16 HH22 ARG 16 36.973 28.352 27.596
105 H GLY 17 H GLY 17 34.215 21.945 32.085
106 HA2 GLY 17 HA2 GLY 17 34.513 21.282 34.614
107 HA3 GLY 17 HA3 GLY 17 35.448 22.781 34.668
108 H TYR 18 H TYR 18 33.105 23.538 32.466
109 HA TYR 18 HA TYR 18 31.713 25.204 34.316
110 HB2 TYR 18 HB2 TYR 18 31.308 24.600 31.372
111 HB3 TYR 18 HB3 TYR 18 30.511 25.907 32.215
112 HD1 TYR 18 HD1 TYR 18 31.672 27.972 32.811
113 HD2 TYR 18 HD2 TYR 18 33.783 24.686 31.009
114 HE1 TYR 18 HE1 TYR 18 33.599 29.465 32.333
115 HE2 TYR 18 HE2 TYR 18 35.712 26.193 30.524
116 HH TYR 18 HH TYR 18 35.866 29.510 31.717
117 H ARG 19 H ARG 19 29.188 25.339 33.384
118 HA ARG 19 HA ARG 19 27.773 22.843 34.235
119 HB2 ARG 19 HB2 ARG 19 27.203 25.595 35.422
120 HB3 ARG 19 HB3 ARG 19 26.336 24.098 35.736
121 HG2 ARG 19 HG2 ARG 19 27.644 24.055 37.578
122 HG3 ARG 19 HG3 ARG 19 28.726 23.209 36.488
123 HD2 ARG 19 HD2 ARG 19 30.096 24.757 37.585
124 HD3 ARG 19 HD3 ARG 19 29.801 25.548 36.039
125 HE ARG 19 HE ARG 19 27.789 26.527 37.718
126 HH11 ARG 19 HH11 ARG 19 31.244 26.948 37.450
127 HH12 ARG 19 HH12 ARG 19 31.303 28.011 38.837
128 HH21 ARG 19 HH21 ARG 19 27.930 28.212 39.185
129 HH22 ARG 19 HH22 ARG 19 29.531 28.829 39.612
130 H GLN 20 H GLN 20 28.133 24.936 31.818
131 HA GLN 20 HA GLN 20 25.685 24.501 30.486
132 HB2 GLN 20 HB2 GLN 20 25.713 26.741 32.312
133 HB3 GLN 20 HB3 GLN 20 25.821 27.395 30.699
134 HG2 GLN 20 HG2 GLN 20 23.666 25.497 31.754
135 HG3 GLN 20 HG3 GLN 20 23.501 27.235 31.563
136 HE21 GLN 20 HE21 GLN 20 22.185 26.785 28.345
137 HE22 GLN 20 HE22 GLN 20 22.432 27.872 29.701
138 H GLY 21 H GLY 21 25.601 25.434 28.394
139 HA2 GLY 21 HA2 GLY 21 27.533 27.203 27.428
140 HA3 GLY 21 HA3 GLY 21 27.997 25.589 26.881
141 H TYR 22 H TYR 22 27.153 27.881 25.268
142 HA TYR 22 HA TYR 22 25.032 26.748 23.575
143 HB2 TYR 22 HB2 TYR 22 23.535 28.775 23.925
144 HB3 TYR 22 HB3 TYR 22 23.572 27.627 25.242
145 HD1 TYR 22 HD1 TYR 22 24.823 30.983 24.172
146 HD2 TYR 22 HD2 TYR 22 24.323 28.185 27.397
147 HE1 TYR 22 HE1 TYR 22 25.515 32.744 25.798
148 HE2 TYR 22 HE2 TYR 22 25.085 29.926 29.029
149 HH TYR 22 HH TYR 22 25.996 32.015 29.266
150 H CYS 23 H CYS 23 24.465 28.297 21.736
151 HA CYS 23 HA CYS 23 26.752 30.087 21.042
152 HB2 CYS 23 HB2 CYS 23 24.485 28.971 19.374
153 HB3 CYS 23 HB3 CYS 23 25.617 30.195 18.810
154 H TRP 24 H TRP 24 26.293 32.134 20.097
155 HA TRP 24 HA TRP 24 24.051 33.669 21.301
156 HB2 TRP 24 HB2 TRP 24 26.524 34.547 19.762
157 HB3 TRP 24 HB3 TRP 24 25.313 35.609 20.449
158 HD1 TRP 24 HD1 TRP 24 28.543 34.027 21.299
159 HE1 TRP 24 HE1 TRP 24 29.141 34.391 23.776
160 HE3 TRP 24 HE3 TRP 24 23.994 35.648 23.018
161 HZ2 TRP 24 HZ2 TRP 24 27.851 35.370 26.153
162 HZ3 TRP 24 HZ3 TRP 24 23.700 36.247 25.409
163 HH2 TRP 24 HH2 TRP 24 25.624 36.122 26.982
164 H GLY 25 H GLY 25 23.150 35.398 19.613
165 HA2 GLY 25 HA2 GLY 25 21.552 34.062 17.766
166 HA3 GLY 25 HA3 GLY 25 21.897 35.794 17.727
167 H ILE 26 H ILE 26 24.492 35.955 16.942
168 HA ILE 26 HA ILE 26 25.033 34.170 14.646
169 HB ILE 26 HB ILE 26 23.557 35.893 13.752
170 HG12 ILE 26 HG12 ILE 26 24.919 36.697 11.863
171 HG13 ILE 26 HG13 ILE 26 26.396 36.200 12.679
172 HG21 ILE 26 HG21 ILE 26 24.223 38.235 13.550
173 HG22 ILE 26 HG22 ILE 26 24.105 37.784 15.248
174 HG23 ILE 26 HG23 ILE 26 25.703 37.935 14.478
175 HD11 ILE 26 HD11 ILE 26 24.115 34.333 11.853
176 HD12 ILE 26 HD12 ILE 26 25.619 34.586 10.942
177 HD13 ILE 26 HD13 ILE 26 25.681 33.834 12.539
178 H GLN 27 H GLN 27 26.203 36.669 16.856
179 HA GLN 27 HA GLN 27 28.808 36.791 15.669
180 HB2 GLN 27 HB2 GLN 27 27.625 38.705 16.620
181 HB3 GLN 27 HB3 GLN 27 27.617 37.956 18.206
182 HG2 GLN 27 HG2 GLN 27 29.157 39.783 18.127
183 HG3 GLN 27 HG3 GLN 27 30.038 38.320 18.446
184 HE21 GLN 27 HE21 GLN 27 32.134 40.182 16.081
185 HE22 GLN 27 HE22 GLN 27 31.580 40.359 17.745
186 H TYR 28 H TYR 28 29.050 34.302 15.921
187 HA TYR 28 HA TYR 28 30.810 33.828 18.284
188 HB2 TYR 28 HB2 TYR 28 29.819 31.612 18.643
189 HB3 TYR 28 HB3 TYR 28 28.720 32.942 18.970
190 HD1 TYR 28 HD1 TYR 28 29.414 30.069 16.727
191 HD2 TYR 28 HD2 TYR 28 26.752 33.367 17.567
192 HE1 TYR 28 HE1 TYR 28 27.768 29.177 15.083
193 HE2 TYR 28 HE2 TYR 28 25.117 32.450 15.974
194 HH TYR 28 HH TYR 28 24.795 30.996 14.241
195 H LYS 29 H LYS 29 32.644 32.879 17.953
196 HA LYS 29 HA LYS 29 33.271 31.320 15.471
197 HB2 LYS 29 HB2 LYS 29 35.000 32.231 17.818
198 HB3 LYS 29 HB3 LYS 29 35.573 31.427 16.357
199 HG2 LYS 29 HG2 LYS 29 34.774 33.345 14.990
200 HG3 LYS 29 HG3 LYS 29 34.268 34.193 16.460
201 HD2 LYS 29 HD2 LYS 29 37.106 33.247 15.937
202 HD3 LYS 29 HD3 LYS 29 36.515 34.863 15.542
203 HE2 LYS 29 HE2 LYS 29 35.964 35.235 17.933
204 HE3 LYS 29 HE3 LYS 29 36.616 33.636 18.335
205 HZ1 LYS 29 HZ1 LYS 29 38.772 34.360 17.524
206 HZ2 LYS 29 HZ2 LYS 29 38.161 35.832 17.075
207 HZ3 LYS 29 HZ3 LYS 29 38.277 35.456 18.636
208 H TYR 30 H TYR 30 32.721 30.957 18.900
209 HA TYR 30 HA TYR 30 32.725 28.026 18.755
210 HB2 TYR 30 HB2 TYR 30 34.148 29.301 21.076
211 HB3 TYR 30 HB3 TYR 30 34.261 27.661 20.472
212 HD1 TYR 30 HD1 TYR 30 35.699 27.203 18.400
213 HD2 TYR 30 HD2 TYR 30 35.631 31.018 20.409
214 HE1 TYR 30 HE1 TYR 30 37.860 27.815 17.319
215 HE2 TYR 30 HE2 TYR 30 37.799 31.613 19.352
216 HH TYR 30 HH TYR 30 39.543 29.379 17.168
217 H CYS 31 H CYS 31 31.660 27.063 20.653
218 HA CYS 31 HA CYS 31 29.357 28.394 21.607
219 HB2 CYS 31 HB2 CYS 31 30.971 26.158 22.884
220 HB3 CYS 31 HB3 CYS 31 29.349 26.607 23.343
221 H GLN 32 H GLN 32 28.873 29.597 23.367
222 HA GLN 32 HA GLN 32 30.877 30.769 25.148
223 HB2 GLN 32 HB2 GLN 32 28.794 31.946 24.277
224 HB3 GLN 32 HB3 GLN 32 27.834 30.777 25.181
225 HG2 GLN 32 HG2 GLN 32 27.859 32.721 26.501
226 HG3 GLN 32 HG3 GLN 32 28.936 31.615 27.319
227 HE21 GLN 32 HE21 GLN 32 30.881 34.657 27.465
228 HE22 GLN 32 HE22 GLN 32 29.716 33.692 28.369
229 H CYS 33 H CYS 33 31.150 30.118 27.347
230 HA CYS 33 HA CYS 33 29.622 27.700 28.356
231 HB2 CYS 33 HB2 CYS 33 32.477 28.578 28.984
232 HB3 CYS 33 HB3 CYS 33 31.647 27.152 29.599
233 H GLN 34 H GLN 34 29.539 27.554 30.687
234 HA GLN 34 HA GLN 34 27.768 29.387 31.555
235 HB2 GLN 34 HB2 GLN 34 28.194 27.136 32.478
236 HB3 GLN 34 HB3 GLN 34 29.488 27.776 33.483
237 HG2 GLN 34 HG2 GLN 34 26.856 29.222 33.633
238 HG3 GLN 34 HG3 GLN 34 26.839 27.564 34.195
239 HE21 GLN 34 HE21 GLN 34 29.383 29.900 36.437
240 HE22 GLN 34 HE22 GLN 34 29.675 29.793 34.711
Start of MODEL 16
1 H1 GLY 1 H1 GLY 1 20.655 33.772 10.547
2 H2 GLY 1 H2 GLY 1 19.166 33.178 10.953
3 H3 GLY 1 H3 GLY 1 19.482 33.644 9.406
4 HA2 GLY 1 HA2 GLY 1 19.488 31.258 9.576
5 HA3 GLY 1 HA3 GLY 1 21.097 31.888 9.126
6 H SER 2 H SER 2 20.484 29.327 10.373
7 HA SER 2 HA SER 2 22.235 29.348 12.682
8 HB2 SER 2 HB2 SER 2 20.155 30.250 13.708
9 HB3 SER 2 HB3 SER 2 19.273 28.812 13.166
10 HG SER 2 HG SER 2 20.564 29.135 15.405
11 H ALA 3 H ALA 3 22.860 27.283 13.323
12 HA ALA 3 HA ALA 3 21.608 24.873 12.188
13 HB1 ALA 3 HB1 ALA 3 23.096 25.649 10.372
14 HB2 ALA 3 HB2 ALA 3 24.480 25.625 11.492
15 HB3 ALA 3 HB3 ALA 3 23.652 24.113 11.057
16 H CYS 4 H CYS 4 23.900 26.277 14.492
17 HA CYS 4 HA CYS 4 24.616 23.722 15.723
18 HB2 CYS 4 HB2 CYS 4 26.226 25.457 15.728
19 HB3 CYS 4 HB3 CYS 4 25.122 26.622 16.441
20 H GLN 5 H GLN 5 23.961 22.949 17.737
21 HA GLN 5 HA GLN 5 21.422 24.084 18.865
22 HB2 GLN 5 HB2 GLN 5 22.271 21.170 18.750
23 HB3 GLN 5 HB3 GLN 5 20.803 21.802 19.492
24 HG2 GLN 5 HG2 GLN 5 21.478 21.900 16.537
25 HG3 GLN 5 HG3 GLN 5 20.330 20.815 17.304
26 HE21 GLN 5 HE21 GLN 5 18.566 23.798 15.781
27 HE22 GLN 5 HE22 GLN 5 19.691 22.593 15.161
28 H PHE 6 H PHE 6 21.548 24.847 20.849
29 HA PHE 6 HA PHE 6 23.872 25.085 22.263
30 HB2 PHE 6 HB2 PHE 6 22.536 25.844 24.170
31 HB3 PHE 6 HB3 PHE 6 21.931 26.497 22.659
32 HD1 PHE 6 HD1 PHE 6 19.644 26.060 21.960
33 HD2 PHE 6 HD2 PHE 6 21.305 24.015 25.376
34 HE1 PHE 6 HE1 PHE 6 17.391 25.221 22.551
35 HE2 PHE 6 HE2 PHE 6 19.064 23.104 25.914
36 HZ PHE 6 HZ PHE 6 17.094 23.723 24.515
37 H TRP 7 H TRP 7 21.589 22.345 22.738
38 HA TRP 7 HA TRP 7 22.695 21.403 25.167
39 HB2 TRP 7 HB2 TRP 7 21.543 19.447 24.825
40 HB3 TRP 7 HB3 TRP 7 20.569 20.623 23.950
41 HD1 TRP 7 HD1 TRP 7 21.776 20.666 21.157
42 HE1 TRP 7 HE1 TRP 7 22.236 18.633 19.645
43 HE3 TRP 7 HE3 TRP 7 21.381 16.955 24.658
44 HZ2 TRP 7 HZ2 TRP 7 22.148 15.768 19.883
45 HZ3 TRP 7 HZ3 TRP 7 21.507 14.568 23.973
46 HH2 TRP 7 HH2 TRP 7 21.886 13.961 21.594
47 H SER 8 H SER 8 23.945 20.999 21.871
48 HA SER 8 HA SER 8 25.803 18.870 22.435
49 HB2 SER 8 HB2 SER 8 24.887 19.648 20.179
50 HB3 SER 8 HB3 SER 8 26.029 20.999 20.271
51 HG SER 8 HG SER 8 26.435 18.320 19.764
52 H CYS 9 H CYS 9 26.141 22.411 22.192
53 HA CYS 9 HA CYS 9 28.804 22.669 23.160
54 HB2 CYS 9 HB2 CYS 9 26.368 24.476 23.144
55 HB3 CYS 9 HB3 CYS 9 27.905 24.995 23.813
56 H ASN 10 H ASN 10 25.718 22.369 24.972
57 HA ASN 10 HA ASN 10 26.627 23.221 27.456
58 HB2 ASN 10 HB2 ASN 10 24.265 22.719 26.773
59 HB3 ASN 10 HB3 ASN 10 24.601 20.997 27.005
60 HD21 ASN 10 HD21 ASN 10 24.160 21.221 30.493
61 HD22 ASN 10 HD22 ASN 10 24.178 20.215 29.055
62 H SER 11 H SER 11 26.586 19.731 26.458
63 HA SER 11 HA SER 11 28.215 18.897 28.672
64 HB2 SER 11 HB2 SER 11 27.946 17.561 25.956
65 HB3 SER 11 HB3 SER 11 28.659 16.845 27.411
66 HG SER 11 HG SER 11 26.011 17.313 26.744
67 H SER 12 H SER 12 29.186 20.184 25.466
68 HA SER 12 HA SER 12 31.956 19.448 25.680
69 HB2 SER 12 HB2 SER 12 30.921 20.117 23.543
70 HB3 SER 12 HB3 SER 12 30.729 21.771 24.158
71 HG SER 12 HG SER 12 33.141 20.341 23.646
72 H CYS 13 H CYS 13 30.276 22.525 26.616
73 HA CYS 13 HA CYS 13 32.562 23.798 27.741
74 HB2 CYS 13 HB2 CYS 13 29.573 24.026 28.235
75 HB3 CYS 13 HB3 CYS 13 30.743 25.026 29.070
76 H ILE 14 H ILE 14 29.998 21.819 29.426
77 HA ILE 14 HA ILE 14 31.190 22.002 31.979
78 HB ILE 14 HB ILE 14 29.584 19.696 30.826
79 HG12 ILE 14 HG12 ILE 14 28.568 21.875 32.676
80 HG13 ILE 14 HG13 ILE 14 28.565 22.159 30.946
81 HG21 ILE 14 HG21 ILE 14 30.387 20.506 33.648
82 HG22 ILE 14 HG22 ILE 14 29.103 19.320 33.324
83 HG23 ILE 14 HG23 ILE 14 30.769 18.982 32.837
84 HD11 ILE 14 HD11 ILE 14 27.148 20.160 30.591
85 HD12 ILE 14 HD12 ILE 14 27.102 19.888 32.347
86 HD13 ILE 14 HD13 ILE 14 26.390 21.362 31.656
87 H SER 15 H SER 15 31.973 19.725 29.357
88 HA SER 15 HA SER 15 33.875 18.137 30.763
89 HB2 SER 15 HB2 SER 15 33.885 18.837 27.802
90 HB3 SER 15 HB3 SER 15 34.692 17.463 28.581
91 HG SER 15 HG SER 15 31.890 17.962 28.349
92 H ARG 16 H ARG 16 34.217 21.417 29.542
93 HA ARG 16 HA ARG 16 37.150 21.477 29.753
94 HB2 ARG 16 HB2 ARG 16 35.189 23.788 29.651
95 HB3 ARG 16 HB3 ARG 16 36.940 23.886 29.552
96 HG2 ARG 16 HG2 ARG 16 36.973 22.677 27.442
97 HG3 ARG 16 HG3 ARG 16 35.240 22.367 27.569
98 HD2 ARG 16 HD2 ARG 16 35.544 24.103 25.979
99 HD3 ARG 16 HD3 ARG 16 34.744 24.757 27.404
100 HE ARG 16 HE ARG 16 36.906 25.719 28.123
101 HH11 ARG 16 HH11 ARG 16 37.202 24.442 24.837
102 HH12 ARG 16 HH12 ARG 16 38.269 25.784 24.412
103 HH21 ARG 16 HH21 ARG 16 38.105 27.433 27.337
104 HH22 ARG 16 HH22 ARG 16 38.874 27.233 25.764
105 H GLY 17 H GLY 17 34.383 22.361 31.762
106 HA2 GLY 17 HA2 GLY 17 35.223 22.056 34.309
107 HA3 GLY 17 HA3 GLY 17 36.069 23.537 33.888
108 H TYR 18 H TYR 18 33.186 23.707 32.204
109 HA TYR 18 HA TYR 18 32.079 25.621 34.121
110 HB2 TYR 18 HB2 TYR 18 31.356 24.832 31.287
111 HB3 TYR 18 HB3 TYR 18 30.601 26.143 32.161
112 HD1 TYR 18 HD1 TYR 18 33.491 25.181 30.232
113 HD2 TYR 18 HD2 TYR 18 31.955 28.105 32.972
114 HE1 TYR 18 HE1 TYR 18 35.175 26.840 29.400
115 HE2 TYR 18 HE2 TYR 18 33.641 29.752 32.179
116 HH TYR 18 HH TYR 18 35.205 30.221 30.553
117 H ARG 19 H ARG 19 29.438 25.553 33.508
118 HA ARG 19 HA ARG 19 28.296 22.975 34.501
119 HB2 ARG 19 HB2 ARG 19 27.789 25.697 35.737
120 HB3 ARG 19 HB3 ARG 19 26.803 24.283 36.003
121 HG2 ARG 19 HG2 ARG 19 28.066 24.188 37.858
122 HG3 ARG 19 HG3 ARG 19 28.947 23.097 36.811
123 HD2 ARG 19 HD2 ARG 19 30.480 24.443 38.062
124 HD3 ARG 19 HD3 ARG 19 30.619 24.933 36.377
125 HE ARG 19 HE ARG 19 28.733 26.662 37.573
126 HH11 ARG 19 HH11 ARG 19 32.030 25.880 38.517
127 HH12 ARG 19 HH12 ARG 19 32.259 27.469 39.212
128 HH21 ARG 19 HH21 ARG 19 29.232 28.722 38.188
129 HH22 ARG 19 HH22 ARG 19 30.767 29.058 38.947
130 H GLN 20 H GLN 20 28.288 25.074 32.034
131 HA GLN 20 HA GLN 20 25.728 24.444 30.989
132 HB2 GLN 20 HB2 GLN 20 25.382 26.555 32.624
133 HB3 GLN 20 HB3 GLN 20 26.124 27.421 31.284
134 HG2 GLN 20 HG2 GLN 20 24.257 26.111 29.878
135 HG3 GLN 20 HG3 GLN 20 23.485 25.926 31.434
136 HE21 GLN 20 HE21 GLN 20 22.211 28.986 29.628
137 HE22 GLN 20 HE22 GLN 20 22.384 27.290 29.184
138 H GLY 21 H GLY 21 25.534 25.223 28.781
139 HA2 GLY 21 HA2 GLY 21 27.444 26.898 27.551
140 HA3 GLY 21 HA3 GLY 21 27.810 25.224 27.113
141 H TYR 22 H TYR 22 27.120 27.256 25.317
142 HA TYR 22 HA TYR 22 24.865 26.185 23.854
143 HB2 TYR 22 HB2 TYR 22 23.592 28.420 23.927
144 HB3 TYR 22 HB3 TYR 22 23.497 27.376 25.319
145 HD1 TYR 22 HD1 TYR 22 24.250 27.916 27.420
146 HD2 TYR 22 HD2 TYR 22 24.956 30.575 24.119
147 HE1 TYR 22 HE1 TYR 22 24.942 29.695 29.033
148 HE2 TYR 22 HE2 TYR 22 25.556 32.390 25.712
149 HH TYR 22 HH TYR 22 25.520 31.882 29.265
150 H CYS 23 H CYS 23 24.320 28.014 22.035
151 HA CYS 23 HA CYS 23 26.696 29.340 20.991
152 HB2 CYS 23 HB2 CYS 23 26.617 28.089 18.844
153 HB3 CYS 23 HB3 CYS 23 27.133 27.127 20.207
154 H TRP 24 H TRP 24 26.056 30.132 18.637
155 HA TRP 24 HA TRP 24 23.378 31.438 18.791
156 HB2 TRP 24 HB2 TRP 24 26.044 32.717 18.112
157 HB3 TRP 24 HB3 TRP 24 24.471 33.509 18.169
158 HD1 TRP 24 HD1 TRP 24 27.351 32.531 20.376
159 HE1 TRP 24 HE1 TRP 24 26.962 33.334 22.788
160 HE3 TRP 24 HE3 TRP 24 22.420 33.887 20.008
161 HZ2 TRP 24 HZ2 TRP 24 24.800 34.360 24.354
162 HZ3 TRP 24 HZ3 TRP 24 21.201 34.717 22.007
163 HH2 TRP 24 HH2 TRP 24 22.383 34.968 24.186
164 H GLY 25 H GLY 25 23.346 32.891 16.494
165 HA2 GLY 25 HA2 GLY 25 22.617 30.905 14.575
166 HA3 GLY 25 HA3 GLY 25 22.594 32.650 14.347
167 H ILE 26 H ILE 26 25.070 33.513 14.205
168 HA ILE 26 HA ILE 26 26.709 31.776 12.386
169 HB ILE 26 HB ILE 26 25.691 34.582 11.794
170 HG12 ILE 26 HG12 ILE 26 25.546 31.930 10.297
171 HG13 ILE 26 HG13 ILE 26 24.206 32.772 11.083
172 HG21 ILE 26 HG21 ILE 26 27.913 33.097 10.324
173 HG22 ILE 26 HG22 ILE 26 27.190 34.645 9.834
174 HG23 ILE 26 HG23 ILE 26 28.126 34.568 11.300
175 HD11 ILE 26 HD11 ILE 26 25.654 33.601 8.550
176 HD12 ILE 26 HD12 ILE 26 23.972 33.109 8.748
177 HD13 ILE 26 HD13 ILE 26 24.521 34.659 9.428
178 H GLN 27 H GLN 27 26.592 34.785 14.316
179 HA GLN 27 HA GLN 27 29.451 35.135 14.140
180 HB2 GLN 27 HB2 GLN 27 27.390 36.703 15.759
181 HB3 GLN 27 HB3 GLN 27 29.067 37.153 15.475
182 HG2 GLN 27 HG2 GLN 27 28.494 37.141 12.959
183 HG3 GLN 27 HG3 GLN 27 26.803 37.039 13.447
184 HE21 GLN 27 HE21 GLN 27 27.146 40.627 13.136
185 HE22 GLN 27 HE22 GLN 27 26.320 39.187 12.523
186 H TYR 28 H TYR 28 29.777 32.948 15.084
187 HA TYR 28 HA TYR 28 30.899 33.297 17.757
188 HB2 TYR 28 HB2 TYR 28 29.875 31.426 18.791
189 HB3 TYR 28 HB3 TYR 28 28.593 32.500 18.264
190 HD1 TYR 28 HD1 TYR 28 27.534 31.940 15.893
191 HD2 TYR 28 HD2 TYR 28 29.724 29.123 18.312
192 HE1 TYR 28 HE1 TYR 28 26.777 30.114 14.420
193 HE2 TYR 28 HE2 TYR 28 28.860 27.254 16.894
194 HH TYR 28 HH TYR 28 26.958 27.815 13.938
195 H LYS 29 H LYS 29 32.836 32.290 17.832
196 HA LYS 29 HA LYS 29 33.753 30.701 15.496
197 HB2 LYS 29 HB2 LYS 29 35.318 31.547 17.958
198 HB3 LYS 29 HB3 LYS 29 35.971 30.987 16.420
199 HG2 LYS 29 HG2 LYS 29 34.483 33.607 16.903
200 HG3 LYS 29 HG3 LYS 29 36.212 33.423 16.732
201 HD2 LYS 29 HD2 LYS 29 35.968 32.750 14.389
202 HD3 LYS 29 HD3 LYS 29 34.195 32.812 14.518
203 HE2 LYS 29 HE2 LYS 29 34.268 35.204 15.039
204 HE3 LYS 29 HE3 LYS 29 36.035 35.193 15.052
205 HZ1 LYS 29 HZ1 LYS 29 34.403 34.574 12.639
206 HZ2 LYS 29 HZ2 LYS 29 35.043 36.030 12.954
207 HZ3 LYS 29 HZ3 LYS 29 36.043 34.765 12.696
208 H TYR 30 H TYR 30 33.179 30.265 18.942
209 HA TYR 30 HA TYR 30 32.859 27.346 18.663
210 HB2 TYR 30 HB2 TYR 30 35.192 27.486 19.261
211 HB3 TYR 30 HB3 TYR 30 34.883 28.695 20.486
212 HD1 TYR 30 HD1 TYR 30 33.930 25.121 19.657
213 HD2 TYR 30 HD2 TYR 30 34.774 28.037 22.733
214 HE1 TYR 30 HE1 TYR 30 33.592 23.383 21.402
215 HE2 TYR 30 HE2 TYR 30 34.461 26.283 24.469
216 HH TYR 30 HH TYR 30 33.443 22.953 23.687
217 H CYS 31 H CYS 31 32.066 26.547 20.976
218 HA CYS 31 HA CYS 31 29.598 27.787 21.575
219 HB2 CYS 31 HB2 CYS 31 31.360 25.938 23.232
220 HB3 CYS 31 HB3 CYS 31 29.651 26.214 23.514
221 H GLN 32 H GLN 32 28.853 28.927 23.352
222 HA GLN 32 HA GLN 32 30.820 30.337 25.105
223 HB2 GLN 32 HB2 GLN 32 29.229 31.764 23.923
224 HB3 GLN 32 HB3 GLN 32 27.864 30.848 24.578
225 HG2 GLN 32 HG2 GLN 32 28.414 31.562 26.855
226 HG3 GLN 32 HG3 GLN 32 29.904 32.334 26.298
227 HE21 GLN 32 HE21 GLN 32 27.290 34.941 26.793
228 HE22 GLN 32 HE22 GLN 32 28.139 33.779 27.820
229 H CYS 33 H CYS 33 30.534 30.182 27.426
230 HA CYS 33 HA CYS 33 29.180 27.652 28.362
231 HB2 CYS 33 HB2 CYS 33 31.937 28.674 29.077
232 HB3 CYS 33 HB3 CYS 33 31.167 27.186 29.591
233 H GLN 34 H GLN 34 29.415 27.562 30.848
234 HA GLN 34 HA GLN 34 27.619 29.401 31.927
235 HB2 GLN 34 HB2 GLN 34 28.088 27.164 32.873
236 HB3 GLN 34 HB3 GLN 34 29.662 27.735 33.439
237 HG2 GLN 34 HG2 GLN 34 28.300 27.772 35.324
238 HG3 GLN 34 HG3 GLN 34 28.424 29.440 34.857
239 HE21 GLN 34 HE21 GLN 34 24.906 29.710 34.038
240 HE22 GLN 34 HE22 GLN 34 26.476 30.451 33.777
Start of MODEL 17
1 H1 GLY 1 H1 GLY 1 19.628 21.910 11.364
2 H2 GLY 1 H2 GLY 1 18.206 22.601 11.806
3 H3 GLY 1 H3 GLY 1 19.565 22.854 12.709
4 HA2 GLY 1 HA2 GLY 1 19.175 23.757 9.936
5 HA3 GLY 1 HA3 GLY 1 19.036 24.791 11.369
6 H SER 2 H SER 2 20.674 25.926 9.902
7 HA SER 2 HA SER 2 23.378 24.882 9.933
8 HB2 SER 2 HB2 SER 2 22.344 26.291 8.122
9 HB3 SER 2 HB3 SER 2 22.448 27.679 9.219
10 HG SER 2 HG SER 2 24.624 25.999 8.453
11 H ALA 3 H ALA 3 21.589 27.049 12.068
12 HA ALA 3 HA ALA 3 23.923 27.936 13.548
13 HB1 ALA 3 HB1 ALA 3 22.282 28.652 15.231
14 HB2 ALA 3 HB2 ALA 3 21.801 29.178 13.609
15 HB3 ALA 3 HB3 ALA 3 20.992 27.786 14.372
16 H CYS 4 H CYS 4 24.952 27.004 15.204
17 HA CYS 4 HA CYS 4 24.664 24.186 15.709
18 HB2 CYS 4 HB2 CYS 4 26.511 24.519 17.247
19 HB3 CYS 4 HB3 CYS 4 26.804 25.281 15.701
20 H GLN 5 H GLN 5 24.230 23.150 17.732
21 HA GLN 5 HA GLN 5 21.875 24.407 19.018
22 HB2 GLN 5 HB2 GLN 5 22.737 21.517 18.812
23 HB3 GLN 5 HB3 GLN 5 21.292 22.121 19.656
24 HG2 GLN 5 HG2 GLN 5 20.422 23.101 17.607
25 HG3 GLN 5 HG3 GLN 5 21.847 22.579 16.701
26 HE21 GLN 5 HE21 GLN 5 19.647 19.954 15.717
27 HE22 GLN 5 HE22 GLN 5 20.159 21.587 15.279
28 H PHE 6 H PHE 6 21.594 24.764 21.119
29 HA PHE 6 HA PHE 6 23.675 25.208 22.855
30 HB2 PHE 6 HB2 PHE 6 22.050 25.498 24.597
31 HB3 PHE 6 HB3 PHE 6 21.391 26.134 23.111
32 HD1 PHE 6 HD1 PHE 6 20.903 23.816 25.842
33 HD2 PHE 6 HD2 PHE 6 19.637 24.744 21.818
34 HE1 PHE 6 HE1 PHE 6 18.923 22.343 26.116
35 HE2 PHE 6 HE2 PHE 6 17.682 23.245 22.091
36 HZ PHE 6 HZ PHE 6 17.324 22.036 24.241
37 H TRP 7 H TRP 7 21.619 22.245 22.948
38 HA TRP 7 HA TRP 7 22.664 21.068 25.202
39 HB2 TRP 7 HB2 TRP 7 21.755 19.026 24.454
40 HB3 TRP 7 HB3 TRP 7 20.710 20.292 23.818
41 HD1 TRP 7 HD1 TRP 7 20.751 20.671 21.176
42 HE1 TRP 7 HE1 TRP 7 21.680 19.358 19.185
43 HE3 TRP 7 HE3 TRP 7 23.606 17.251 23.708
44 HZ2 TRP 7 HZ2 TRP 7 23.519 17.196 18.724
45 HZ3 TRP 7 HZ3 TRP 7 25.039 15.664 22.454
46 HH2 TRP 7 HH2 TRP 7 25.026 15.638 19.978
47 H SER 8 H SER 8 24.117 20.986 21.971
48 HA SER 8 HA SER 8 26.129 19.021 22.588
49 HB2 SER 8 HB2 SER 8 25.408 19.254 20.339
50 HB3 SER 8 HB3 SER 8 25.822 20.981 20.304
51 HG SER 8 HG SER 8 27.363 19.111 19.498
52 H CYS 9 H CYS 9 26.098 22.620 22.502
53 HA CYS 9 HA CYS 9 28.847 22.983 23.328
54 HB2 CYS 9 HB2 CYS 9 26.378 24.739 23.428
55 HB3 CYS 9 HB3 CYS 9 27.904 25.238 24.140
56 H ASN 10 H ASN 10 25.773 22.629 25.173
57 HA ASN 10 HA ASN 10 26.729 23.179 27.741
58 HB2 ASN 10 HB2 ASN 10 24.381 22.899 27.245
59 HB3 ASN 10 HB3 ASN 10 24.618 21.233 26.746
60 HD21 ASN 10 HD21 ASN 10 23.935 21.955 30.612
61 HD22 ASN 10 HD22 ASN 10 23.925 23.271 29.442
62 H SER 11 H SER 11 26.703 19.887 26.220
63 HA SER 11 HA SER 11 28.211 18.636 28.264
64 HB2 SER 11 HB2 SER 11 28.121 17.959 25.295
65 HB3 SER 11 HB3 SER 11 28.674 16.885 26.607
66 HG SER 11 HG SER 11 26.531 16.452 26.153
67 H SER 12 H SER 12 29.443 20.347 25.351
68 HA SER 12 HA SER 12 32.205 19.630 25.824
69 HB2 SER 12 HB2 SER 12 30.843 21.689 24.076
70 HB3 SER 12 HB3 SER 12 32.610 21.579 24.205
71 HG SER 12 HG SER 12 32.603 19.561 23.438
72 H CYS 13 H CYS 13 30.343 22.639 26.674
73 HA CYS 13 HA CYS 13 32.508 23.963 27.960
74 HB2 CYS 13 HB2 CYS 13 29.494 24.005 28.280
75 HB3 CYS 13 HB3 CYS 13 30.548 25.016 29.260
76 H ILE 14 H ILE 14 30.038 21.677 29.408
77 HA ILE 14 HA ILE 14 31.282 21.664 31.968
78 HB ILE 14 HB ILE 14 29.729 19.425 30.625
79 HG12 ILE 14 HG12 ILE 14 28.675 21.348 32.738
80 HG13 ILE 14 HG13 ILE 14 28.584 21.789 31.046
81 HG21 ILE 14 HG21 ILE 14 30.639 19.990 33.483
82 HG22 ILE 14 HG22 ILE 14 29.379 18.783 33.103
83 HG23 ILE 14 HG23 ILE 14 31.027 18.570 32.502
84 HD11 ILE 14 HD11 ILE 14 27.300 19.719 30.556
85 HD12 ILE 14 HD12 ILE 14 27.305 19.330 32.291
86 HD13 ILE 14 HD13 ILE 14 26.487 20.792 31.716
87 H SER 15 H SER 15 32.070 19.685 29.077
88 HA SER 15 HA SER 15 34.082 18.079 30.302
89 HB2 SER 15 HB2 SER 15 34.042 19.040 27.419
90 HB3 SER 15 HB3 SER 15 34.951 17.676 28.078
91 HG SER 15 HG SER 15 32.125 17.961 27.904
92 H ARG 16 H ARG 16 34.238 21.443 29.247
93 HA ARG 16 HA ARG 16 37.160 21.692 29.641
94 HB2 ARG 16 HB2 ARG 16 34.972 23.810 29.449
95 HB3 ARG 16 HB3 ARG 16 36.690 24.142 29.635
96 HG2 ARG 16 HG2 ARG 16 37.181 23.083 27.490
97 HG3 ARG 16 HG3 ARG 16 35.488 22.572 27.339
98 HD2 ARG 16 HD2 ARG 16 36.052 24.577 25.948
99 HD3 ARG 16 HD3 ARG 16 34.709 24.799 27.075
100 HE ARG 16 HE ARG 16 37.283 25.681 28.176
101 HH11 ARG 16 HH11 ARG 16 34.544 26.822 26.230
102 HH12 ARG 16 HH12 ARG 16 34.783 28.453 26.854
103 HH21 ARG 16 HH21 ARG 16 37.410 27.716 28.844
104 HH22 ARG 16 HH22 ARG 16 36.224 28.916 28.287
105 H GLY 17 H GLY 17 34.249 22.337 31.540
106 HA2 GLY 17 HA2 GLY 17 34.989 21.586 34.006
107 HA3 GLY 17 HA3 GLY 17 35.778 23.167 33.930
108 H TYR 18 H TYR 18 33.037 23.643 32.136
109 HA TYR 18 HA TYR 18 31.887 25.223 34.274
110 HB2 TYR 18 HB2 TYR 18 31.132 24.785 31.368
111 HB3 TYR 18 HB3 TYR 18 30.380 25.980 32.393
112 HD1 TYR 18 HD1 TYR 18 31.291 28.119 32.733
113 HD2 TYR 18 HD2 TYR 18 33.709 25.015 30.979
114 HE1 TYR 18 HE1 TYR 18 32.990 29.804 32.107
115 HE2 TYR 18 HE2 TYR 18 35.437 26.703 30.387
116 HH TYR 18 HH TYR 18 34.921 30.183 30.902
117 H ARG 19 H ARG 19 29.232 25.259 33.569
118 HA ARG 19 HA ARG 19 28.072 22.623 34.422
119 HB2 ARG 19 HB2 ARG 19 27.346 25.344 35.586
120 HB3 ARG 19 HB3 ARG 19 26.445 23.862 35.816
121 HG2 ARG 19 HG2 ARG 19 27.619 23.900 37.766
122 HG3 ARG 19 HG3 ARG 19 28.610 22.841 36.789
123 HD2 ARG 19 HD2 ARG 19 29.960 24.393 38.117
124 HD3 ARG 19 HD3 ARG 19 30.211 24.669 36.395
125 HE ARG 19 HE ARG 19 28.168 26.410 37.586
126 HH11 ARG 19 HH11 ARG 19 31.650 26.129 37.329
127 HH12 ARG 19 HH12 ARG 19 31.866 27.855 37.436
128 HH21 ARG 19 HH21 ARG 19 28.494 28.529 37.639
129 HH22 ARG 19 HH22 ARG 19 30.078 29.236 37.369
130 H GLN 20 H GLN 20 28.163 24.917 32.034
131 HA GLN 20 HA GLN 20 25.661 24.257 30.789
132 HB2 GLN 20 HB2 GLN 20 25.759 26.447 32.688
133 HB3 GLN 20 HB3 GLN 20 25.541 27.117 31.088
134 HG2 GLN 20 HG2 GLN 20 23.803 24.918 32.332
135 HG3 GLN 20 HG3 GLN 20 23.475 26.643 32.422
136 HE21 GLN 20 HE21 GLN 20 21.592 26.465 29.459
137 HE22 GLN 20 HE22 GLN 20 21.622 26.838 31.191
138 H GLY 21 H GLY 21 25.377 25.425 28.725
139 HA2 GLY 21 HA2 GLY 21 27.439 26.955 27.581
140 HA3 GLY 21 HA3 GLY 21 27.718 25.267 27.140
141 H TYR 22 H TYR 22 26.950 27.689 25.575
142 HA TYR 22 HA TYR 22 24.728 26.654 23.966
143 HB2 TYR 22 HB2 TYR 22 23.666 29.096 24.392
144 HB3 TYR 22 HB3 TYR 22 23.242 27.655 25.297
145 HD1 TYR 22 HD1 TYR 22 25.604 30.571 25.471
146 HD2 TYR 22 HD2 TYR 22 23.335 27.601 27.618
147 HE1 TYR 22 HE1 TYR 22 26.397 31.525 27.639
148 HE2 TYR 22 HE2 TYR 22 24.101 28.589 29.782
149 HH TYR 22 HH TYR 22 26.759 30.774 29.921
150 H CYS 23 H CYS 23 24.245 28.130 22.110
151 HA CYS 23 HA CYS 23 26.821 28.896 20.895
152 HB2 CYS 23 HB2 CYS 23 24.100 28.141 19.799
153 HB3 CYS 23 HB3 CYS 23 25.319 28.918 18.796
154 H TRP 24 H TRP 24 27.053 30.704 19.526
155 HA TRP 24 HA TRP 24 25.838 33.216 20.438
156 HB2 TRP 24 HB2 TRP 24 27.974 32.468 18.424
157 HB3 TRP 24 HB3 TRP 24 27.372 34.108 18.587
158 HD1 TRP 24 HD1 TRP 24 29.184 31.473 20.737
159 HE1 TRP 24 HE1 TRP 24 30.687 32.675 22.446
160 HE3 TRP 24 HE3 TRP 24 27.852 36.323 19.748
161 HZ2 TRP 24 HZ2 TRP 24 31.022 35.329 23.457
162 HZ3 TRP 24 HZ3 TRP 24 28.797 38.174 21.107
163 HH2 TRP 24 HH2 TRP 24 30.356 37.700 22.975
164 H GLY 25 H GLY 25 25.041 34.813 18.875
165 HA2 GLY 25 HA2 GLY 25 22.754 33.822 17.531
166 HA3 GLY 25 HA3 GLY 25 23.400 35.469 17.408
167 H ILE 26 H ILE 26 25.871 34.893 16.153
168 HA ILE 26 HA ILE 26 25.323 33.194 13.762
169 HB ILE 26 HB ILE 26 26.316 34.764 12.229
170 HG12 ILE 26 HG12 ILE 26 26.462 36.714 14.556
171 HG13 ILE 26 HG13 ILE 26 27.820 35.983 13.699
172 HG21 ILE 26 HG21 ILE 26 24.446 36.247 11.969
173 HG22 ILE 26 HG22 ILE 26 23.854 34.715 12.600
174 HG23 ILE 26 HG23 ILE 26 24.012 36.112 13.685
175 HD11 ILE 26 HD11 ILE 26 27.563 38.254 12.958
176 HD12 ILE 26 HD12 ILE 26 27.126 37.175 11.620
177 HD13 ILE 26 HD13 ILE 26 25.858 38.005 12.558
178 H GLN 27 H GLN 27 27.606 34.321 16.121
179 HA GLN 27 HA GLN 27 29.967 33.495 14.680
180 HB2 GLN 27 HB2 GLN 27 29.598 34.393 17.560
181 HB3 GLN 27 HB3 GLN 27 31.152 34.204 16.759
182 HG2 GLN 27 HG2 GLN 27 29.034 36.164 15.771
183 HG3 GLN 27 HG3 GLN 27 30.237 36.552 16.984
184 HE21 GLN 27 HE21 GLN 27 32.784 37.111 14.631
185 HE22 GLN 27 HE22 GLN 27 32.061 37.517 16.197
186 H TYR 28 H TYR 28 28.857 31.214 14.471
187 HA TYR 28 HA TYR 28 28.787 29.463 16.686
188 HB2 TYR 28 HB2 TYR 28 29.173 28.612 13.819
189 HB3 TYR 28 HB3 TYR 28 28.356 27.726 15.097
190 HD1 TYR 28 HD1 TYR 28 27.494 28.698 12.188
191 HD2 TYR 28 HD2 TYR 28 26.609 30.061 16.191
192 HE1 TYR 28 HE1 TYR 28 25.432 29.784 11.360
193 HE2 TYR 28 HE2 TYR 28 24.584 31.203 15.359
194 HH TYR 28 HH TYR 28 23.799 31.282 11.859
195 H LYS 29 H LYS 29 31.607 30.502 15.105
196 HA LYS 29 HA LYS 29 33.445 28.453 15.033
197 HB2 LYS 29 HB2 LYS 29 33.843 31.249 16.189
198 HB3 LYS 29 HB3 LYS 29 35.148 30.165 15.696
199 HG2 LYS 29 HG2 LYS 29 34.479 30.269 13.378
200 HG3 LYS 29 HG3 LYS 29 33.019 31.191 13.781
201 HD2 LYS 29 HD2 LYS 29 34.344 33.057 14.610
202 HD3 LYS 29 HD3 LYS 29 35.852 32.192 14.300
203 HE2 LYS 29 HE2 LYS 29 33.812 32.856 12.121
204 HE3 LYS 29 HE3 LYS 29 35.114 33.948 12.587
205 HZ1 LYS 29 HZ1 LYS 29 35.504 31.228 11.467
206 HZ2 LYS 29 HZ2 LYS 29 35.849 32.684 10.753
207 HZ3 LYS 29 HZ3 LYS 29 36.707 32.164 12.057
208 H TYR 30 H TYR 30 32.421 30.083 18.038
209 HA TYR 30 HA TYR 30 33.614 27.871 19.617
210 HB2 TYR 30 HB2 TYR 30 33.987 30.815 20.286
211 HB3 TYR 30 HB3 TYR 30 34.568 29.446 21.216
212 HD1 TYR 30 HD1 TYR 30 36.330 27.934 20.264
213 HD2 TYR 30 HD2 TYR 30 35.255 31.661 18.384
214 HE1 TYR 30 HE1 TYR 30 38.376 27.821 18.869
215 HE2 TYR 30 HE2 TYR 30 37.313 31.528 16.963
216 HH TYR 30 HH TYR 30 39.390 28.631 17.008
217 H CYS 31 H CYS 31 32.499 27.256 21.420
218 HA CYS 31 HA CYS 31 29.751 28.174 21.809
219 HB2 CYS 31 HB2 CYS 31 31.543 26.309 23.390
220 HB3 CYS 31 HB3 CYS 31 29.862 26.612 23.789
221 H GLN 32 H GLN 32 28.876 29.120 23.689
222 HA GLN 32 HA GLN 32 30.726 30.674 25.454
223 HB2 GLN 32 HB2 GLN 32 29.095 31.989 24.086
224 HB3 GLN 32 HB3 GLN 32 27.774 31.106 24.850
225 HG2 GLN 32 HG2 GLN 32 28.535 31.987 27.078
226 HG3 GLN 32 HG3 GLN 32 29.814 32.870 26.261
227 HE21 GLN 32 HE21 GLN 32 27.194 35.364 26.783
228 HE22 GLN 32 HE22 GLN 32 28.186 34.345 27.816
229 H CYS 33 H CYS 33 30.794 30.079 27.583
230 HA CYS 33 HA CYS 33 29.100 27.751 28.508
231 HB2 CYS 33 HB2 CYS 33 31.800 28.736 29.419
232 HB3 CYS 33 HB3 CYS 33 30.956 27.246 29.872
233 H GLN 34 H GLN 34 29.395 27.779 31.127
234 HA GLN 34 HA GLN 34 27.314 29.528 31.882
235 HB2 GLN 34 HB2 GLN 34 27.779 27.322 32.937
236 HB3 GLN 34 HB3 GLN 34 29.165 28.022 33.759
237 HG2 GLN 34 HG2 GLN 34 27.209 27.847 35.246
238 HG3 GLN 34 HG3 GLN 34 27.749 29.509 35.056
239 HE21 GLN 34 HE21 GLN 34 24.732 30.579 33.371
240 HE22 GLN 34 HE22 GLN 34 26.475 30.872 33.463
Start of MODEL 18
1 H1 GLY 1 H1 GLY 1 17.922 20.471 10.213
2 H2 GLY 1 H2 GLY 1 17.427 21.194 8.803
3 H3 GLY 1 H3 GLY 1 16.350 20.882 9.998
4 HA2 GLY 1 HA2 GLY 1 16.901 23.219 9.905
5 HA3 GLY 1 HA3 GLY 1 17.325 22.461 11.454
6 H SER 2 H SER 2 18.426 24.777 9.717
7 HA SER 2 HA SER 2 21.290 24.098 9.511
8 HB2 SER 2 HB2 SER 2 20.297 25.554 7.859
9 HB3 SER 2 HB3 SER 2 19.661 26.632 9.112
10 HG SER 2 HG SER 2 21.580 27.435 9.502
11 H ALA 3 H ALA 3 19.152 25.486 11.969
12 HA ALA 3 HA ALA 3 21.154 27.141 13.199
13 HB1 ALA 3 HB1 ALA 3 18.489 26.156 14.285
14 HB2 ALA 3 HB2 ALA 3 19.443 27.513 14.909
15 HB3 ALA 3 HB3 ALA 3 18.732 27.606 13.287
16 H CYS 4 H CYS 4 22.278 26.942 15.120
17 HA CYS 4 HA CYS 4 22.885 24.241 16.099
18 HB2 CYS 4 HB2 CYS 4 24.664 25.819 15.749
19 HB3 CYS 4 HB3 CYS 4 23.909 27.010 16.806
20 H GLN 5 H GLN 5 22.742 23.654 18.340
21 HA GLN 5 HA GLN 5 20.649 24.983 19.984
22 HB2 GLN 5 HB2 GLN 5 20.934 22.003 19.442
23 HB3 GLN 5 HB3 GLN 5 19.927 22.709 20.697
24 HG2 GLN 5 HG2 GLN 5 18.750 24.020 18.833
25 HG3 GLN 5 HG3 GLN 5 19.600 22.978 17.691
26 HE21 GLN 5 HE21 GLN 5 16.173 21.611 18.298
27 HE22 GLN 5 HE22 GLN 5 16.922 22.996 17.516
28 H PHE 6 H PHE 6 20.949 24.790 22.252
29 HA PHE 6 HA PHE 6 23.590 25.001 23.055
30 HB2 PHE 6 HB2 PHE 6 22.822 25.181 25.325
31 HB3 PHE 6 HB3 PHE 6 21.737 26.032 24.262
32 HD1 PHE 6 HD1 PHE 6 22.105 22.744 26.095
33 HD2 PHE 6 HD2 PHE 6 19.408 25.707 24.487
34 HE1 PHE 6 HE1 PHE 6 20.177 21.459 26.949
35 HE2 PHE 6 HE2 PHE 6 17.489 24.448 25.408
36 HZ PHE 6 HZ PHE 6 17.859 22.325 26.646
37 H TRP 7 H TRP 7 21.670 21.978 23.127
38 HA TRP 7 HA TRP 7 23.464 20.493 24.746
39 HB2 TRP 7 HB2 TRP 7 22.353 18.602 24.048
40 HB3 TRP 7 HB3 TRP 7 21.142 19.863 23.935
41 HD1 TRP 7 HD1 TRP 7 20.544 20.663 21.382
42 HE1 TRP 7 HE1 TRP 7 20.834 19.560 19.069
43 HE3 TRP 7 HE3 TRP 7 23.685 16.826 22.671
44 HZ2 TRP 7 HZ2 TRP 7 21.931 17.122 18.018
45 HZ3 TRP 7 HZ3 TRP 7 24.331 15.121 20.988
46 HH2 TRP 7 HH2 TRP 7 23.430 15.224 18.671
47 H SER 8 H SER 8 23.789 21.495 21.409
48 HA SER 8 HA SER 8 26.083 19.804 20.813
49 HB2 SER 8 HB2 SER 8 24.316 20.924 19.205
50 HB3 SER 8 HB3 SER 8 25.457 22.283 19.233
51 HG SER 8 HG SER 8 25.900 19.557 18.559
52 H CYS 9 H CYS 9 25.951 22.151 23.010
53 HA CYS 9 HA CYS 9 28.836 22.889 22.809
54 HB2 CYS 9 HB2 CYS 9 26.386 24.630 23.198
55 HB3 CYS 9 HB3 CYS 9 27.948 25.115 23.843
56 H ASN 10 H ASN 10 25.972 22.465 24.912
57 HA ASN 10 HA ASN 10 26.980 23.274 27.317
58 HB2 ASN 10 HB2 ASN 10 24.615 22.767 26.808
59 HB3 ASN 10 HB3 ASN 10 24.968 21.037 26.804
60 HD21 ASN 10 HD21 ASN 10 24.312 20.949 30.278
61 HD22 ASN 10 HD22 ASN 10 24.262 20.092 28.759
62 H SER 11 H SER 11 26.984 19.813 26.287
63 HA SER 11 HA SER 11 28.466 18.947 28.580
64 HB2 SER 11 HB2 SER 11 27.056 17.472 27.171
65 HB3 SER 11 HB3 SER 11 28.260 17.604 25.870
66 HG SER 11 HG SER 11 28.701 16.614 28.514
67 H SER 12 H SER 12 29.594 20.210 25.437
68 HA SER 12 HA SER 12 32.358 19.558 25.722
69 HB2 SER 12 HB2 SER 12 31.227 22.030 24.363
70 HB3 SER 12 HB3 SER 12 32.745 21.191 24.012
71 HG SER 12 HG SER 12 30.923 20.747 22.584
72 H CYS 13 H CYS 13 30.528 22.534 26.650
73 HA CYS 13 HA CYS 13 32.704 23.820 28.002
74 HB2 CYS 13 HB2 CYS 13 29.685 24.032 28.162
75 HB3 CYS 13 HB3 CYS 13 30.736 24.966 29.208
76 H ILE 14 H ILE 14 29.999 21.823 29.434
77 HA ILE 14 HA ILE 14 31.054 21.755 32.012
78 HB ILE 14 HB ILE 14 29.598 19.510 30.574
79 HG12 ILE 14 HG12 ILE 14 28.428 21.459 32.587
80 HG13 ILE 14 HG13 ILE 14 28.468 21.902 30.893
81 HG21 ILE 14 HG21 ILE 14 30.699 18.615 32.533
82 HG22 ILE 14 HG22 ILE 14 30.323 20.073 33.468
83 HG23 ILE 14 HG23 ILE 14 29.034 18.922 33.042
84 HD11 ILE 14 HD11 ILE 14 27.147 19.902 30.299
85 HD12 ILE 14 HD12 ILE 14 27.069 19.445 32.016
86 HD13 ILE 14 HD13 ILE 14 26.317 20.951 31.467
87 H SER 15 H SER 15 32.047 19.600 29.314
88 HA SER 15 HA SER 15 33.839 17.986 30.798
89 HB2 SER 15 HB2 SER 15 34.026 18.829 27.880
90 HB3 SER 15 HB3 SER 15 34.933 17.510 28.641
91 HG SER 15 HG SER 15 32.120 17.734 28.293
92 H ARG 16 H ARG 16 34.323 21.247 29.527
93 HA ARG 16 HA ARG 16 37.197 21.399 30.064
94 HB2 ARG 16 HB2 ARG 16 35.083 23.562 29.645
95 HB3 ARG 16 HB3 ARG 16 36.796 23.883 29.840
96 HG2 ARG 16 HG2 ARG 16 37.329 22.708 27.790
97 HG3 ARG 16 HG3 ARG 16 35.677 22.089 27.678
98 HD2 ARG 16 HD2 ARG 16 36.127 23.917 26.071
99 HD3 ARG 16 HD3 ARG 16 34.789 24.259 27.173
100 HE ARG 16 HE ARG 16 37.355 25.314 28.102
101 HH11 ARG 16 HH11 ARG 16 34.839 26.080 25.746
102 HH12 ARG 16 HH12 ARG 16 34.951 27.801 26.080
103 HH21 ARG 16 HH21 ARG 16 37.432 27.518 28.431
104 HH22 ARG 16 HH22 ARG 16 36.484 28.581 27.424
105 H GLY 17 H GLY 17 34.298 22.015 31.918
106 HA2 GLY 17 HA2 GLY 17 34.908 21.451 34.388
107 HA3 GLY 17 HA3 GLY 17 35.802 22.972 34.308
108 H TYR 18 H TYR 18 33.131 23.499 32.345
109 HA TYR 18 HA TYR 18 31.935 25.170 34.420
110 HB2 TYR 18 HB2 TYR 18 31.425 24.847 31.447
111 HB3 TYR 18 HB3 TYR 18 30.696 26.072 32.461
112 HD1 TYR 18 HD1 TYR 18 31.995 27.912 33.436
113 HD2 TYR 18 HD2 TYR 18 33.845 24.955 30.932
114 HE1 TYR 18 HE1 TYR 18 33.959 29.398 33.168
115 HE2 TYR 18 HE2 TYR 18 35.851 26.459 30.653
116 HH TYR 18 HH TYR 18 36.950 28.405 31.832
117 H ARG 19 H ARG 19 29.334 25.382 33.613
118 HA ARG 19 HA ARG 19 27.971 22.782 34.133
119 HB2 ARG 19 HB2 ARG 19 27.718 25.210 35.939
120 HB3 ARG 19 HB3 ARG 19 26.509 23.933 35.844
121 HG2 ARG 19 HG2 ARG 19 27.665 23.138 37.600
122 HG3 ARG 19 HG3 ARG 19 28.489 22.304 36.288
123 HD2 ARG 19 HD2 ARG 19 30.103 24.468 36.437
124 HD3 ARG 19 HD3 ARG 19 29.418 24.562 38.063
125 HE ARG 19 HE ARG 19 30.383 21.904 37.242
126 HH11 ARG 19 HH11 ARG 19 31.665 24.927 38.497
127 HH12 ARG 19 HH12 ARG 19 32.977 24.060 39.284
128 HH21 ARG 19 HH21 ARG 19 32.045 20.956 38.386
129 HH22 ARG 19 HH22 ARG 19 33.181 22.021 39.217
130 H GLN 20 H GLN 20 28.285 24.925 31.933
131 HA GLN 20 HA GLN 20 25.624 24.850 30.896
132 HB2 GLN 20 HB2 GLN 20 26.291 27.092 32.578
133 HB3 GLN 20 HB3 GLN 20 26.411 27.682 30.930
134 HG2 GLN 20 HG2 GLN 20 24.097 26.931 30.478
135 HG3 GLN 20 HG3 GLN 20 24.010 26.291 32.127
136 HE21 GLN 20 HE21 GLN 20 23.826 29.600 33.633
137 HE22 GLN 20 HE22 GLN 20 24.483 27.997 33.937
138 H GLY 21 H GLY 21 25.589 25.466 28.693
139 HA2 GLY 21 HA2 GLY 21 27.579 27.029 27.524
140 HA3 GLY 21 HA3 GLY 21 28.002 25.375 27.135
141 H TYR 22 H TYR 22 27.145 27.698 25.462
142 HA TYR 22 HA TYR 22 25.065 26.433 23.806
143 HB2 TYR 22 HB2 TYR 22 23.683 28.571 23.930
144 HB3 TYR 22 HB3 TYR 22 23.623 27.510 25.317
145 HD1 TYR 22 HD1 TYR 22 24.503 28.135 27.454
146 HD2 TYR 22 HD2 TYR 22 24.885 30.774 24.065
147 HE1 TYR 22 HE1 TYR 22 25.192 29.975 28.970
148 HE2 TYR 22 HE2 TYR 22 25.476 32.652 25.590
149 HH TYR 22 HH TYR 22 25.227 32.298 29.102
150 H CYS 23 H CYS 23 24.495 27.833 21.920
151 HA CYS 23 HA CYS 23 26.954 29.106 20.798
152 HB2 CYS 23 HB2 CYS 23 25.905 28.260 18.581
153 HB3 CYS 23 HB3 CYS 23 26.823 27.175 19.609
154 H TRP 24 H TRP 24 26.696 30.773 19.264
155 HA TRP 24 HA TRP 24 24.468 32.606 19.840
156 HB2 TRP 24 HB2 TRP 24 26.975 32.907 18.169
157 HB3 TRP 24 HB3 TRP 24 25.871 34.192 18.585
158 HD1 TRP 24 HD1 TRP 24 28.883 32.422 19.825
159 HE1 TRP 24 HE1 TRP 24 29.622 33.277 22.092
160 HE3 TRP 24 HE3 TRP 24 24.690 35.115 21.029
161 HZ2 TRP 24 HZ2 TRP 24 28.510 34.911 24.219
162 HZ3 TRP 24 HZ3 TRP 24 24.533 36.249 23.236
163 HH2 TRP 24 HH2 TRP 24 26.431 36.148 24.839
164 H GLY 25 H GLY 25 23.843 33.932 17.690
165 HA2 GLY 25 HA2 GLY 25 22.133 32.110 16.275
166 HA3 GLY 25 HA3 GLY 25 22.284 33.844 15.997
167 H ILE 26 H ILE 26 24.569 34.383 14.921
168 HA ILE 26 HA ILE 26 25.402 32.448 12.829
169 HB ILE 26 HB ILE 26 24.135 35.157 12.367
170 HG12 ILE 26 HG12 ILE 26 22.620 33.211 12.264
171 HG13 ILE 26 HG13 ILE 26 22.733 34.073 10.750
172 HG21 ILE 26 HG21 ILE 26 25.957 33.715 10.417
173 HG22 ILE 26 HG22 ILE 26 24.815 34.991 9.954
174 HG23 ILE 26 HG23 ILE 26 26.132 35.361 11.057
175 HD11 ILE 26 HD11 ILE 26 22.663 31.671 10.357
176 HD12 ILE 26 HD12 ILE 26 24.217 32.307 9.818
177 HD13 ILE 26 HD13 ILE 26 24.106 31.415 11.356
178 H GLN 27 H GLN 27 27.461 32.529 12.401
179 HA GLN 27 HA GLN 27 29.638 32.866 12.545
180 HB2 GLN 27 HB2 GLN 27 28.768 35.674 11.942
181 HB3 GLN 27 HB3 GLN 27 30.471 35.219 12.050
182 HG2 GLN 27 HG2 GLN 27 28.431 33.960 10.177
183 HG3 GLN 27 HG3 GLN 27 29.681 35.107 9.719
184 HE21 GLN 27 HE21 GLN 27 30.774 31.433 9.179
185 HE22 GLN 27 HE22 GLN 27 29.180 32.156 8.938
186 H TYR 28 H TYR 28 30.104 32.034 14.381
187 HA TYR 28 HA TYR 28 31.234 33.819 16.454
188 HB2 TYR 28 HB2 TYR 28 30.361 32.205 18.169
189 HB3 TYR 28 HB3 TYR 28 29.179 33.266 17.425
190 HD1 TYR 28 HD1 TYR 28 27.495 32.390 15.799
191 HD2 TYR 28 HD2 TYR 28 30.228 29.766 17.870
192 HE1 TYR 28 HE1 TYR 28 26.063 30.436 15.212
193 HE2 TYR 28 HE2 TYR 28 28.795 27.818 17.280
194 HH TYR 28 HH TYR 28 26.992 27.085 15.975
195 H LYS 29 H LYS 29 33.001 32.895 17.628
196 HA LYS 29 HA LYS 29 34.540 30.961 15.994
197 HB2 LYS 29 HB2 LYS 29 35.419 32.502 18.458
198 HB3 LYS 29 HB3 LYS 29 36.446 31.659 17.291
199 HG2 LYS 29 HG2 LYS 29 35.585 33.297 15.520
200 HG3 LYS 29 HG3 LYS 29 34.789 34.162 16.848
201 HD2 LYS 29 HD2 LYS 29 37.096 34.297 17.962
202 HD3 LYS 29 HD3 LYS 29 37.748 33.788 16.388
203 HE2 LYS 29 HE2 LYS 29 36.398 35.744 15.386
204 HE3 LYS 29 HE3 LYS 29 36.137 36.288 17.044
205 HZ1 LYS 29 HZ1 LYS 29 38.647 36.352 17.258
206 HZ2 LYS 29 HZ2 LYS 29 38.758 36.003 15.658
207 HZ3 LYS 29 HZ3 LYS 29 38.078 37.391 16.129
208 H TYR 30 H TYR 30 33.049 31.066 19.188
209 HA TYR 30 HA TYR 30 33.715 28.202 19.693
210 HB2 TYR 30 HB2 TYR 30 34.141 30.421 21.725
211 HB3 TYR 30 HB3 TYR 30 34.577 28.732 21.886
212 HD1 TYR 30 HD1 TYR 30 36.383 27.820 20.207
213 HD2 TYR 30 HD2 TYR 30 35.748 32.003 21.038
214 HE1 TYR 30 HE1 TYR 30 38.718 28.305 19.517
215 HE2 TYR 30 HE2 TYR 30 38.085 32.493 20.305
216 HH TYR 30 HH TYR 30 40.421 29.944 19.755
217 H CYS 31 H CYS 31 32.453 27.263 21.490
218 HA CYS 31 HA CYS 31 29.732 28.309 21.800
219 HB2 CYS 31 HB2 CYS 31 31.303 26.143 23.255
220 HB3 CYS 31 HB3 CYS 31 29.602 26.479 23.531
221 H GLN 32 H GLN 32 28.926 29.488 23.587
222 HA GLN 32 HA GLN 32 30.948 30.586 25.494
223 HB2 GLN 32 HB2 GLN 32 29.565 32.299 24.617
224 HB3 GLN 32 HB3 GLN 32 28.076 31.397 24.958
225 HG2 GLN 32 HG2 GLN 32 28.233 31.736 27.278
226 HG3 GLN 32 HG3 GLN 32 29.975 31.996 27.241
227 HE21 GLN 32 HE21 GLN 32 27.661 35.208 27.309
228 HE22 GLN 32 HE22 GLN 32 27.019 33.591 27.504
229 H CYS 33 H CYS 33 31.168 29.753 27.450
230 HA CYS 33 HA CYS 33 29.433 27.543 28.425
231 HB2 CYS 33 HB2 CYS 33 32.050 28.650 29.474
232 HB3 CYS 33 HB3 CYS 33 31.247 27.158 29.954
233 H GLN 34 H GLN 34 29.684 27.764 31.116
234 HA GLN 34 HA GLN 34 27.593 29.491 31.940
235 HB2 GLN 34 HB2 GLN 34 28.502 27.456 33.139
236 HB3 GLN 34 HB3 GLN 34 29.905 28.423 33.602
237 HG2 GLN 34 HG2 GLN 34 28.408 29.988 34.845
238 HG3 GLN 34 HG3 GLN 34 27.022 29.004 34.362
239 HE21 GLN 34 HE21 GLN 34 27.418 27.400 37.500
240 HE22 GLN 34 HE22 GLN 34 26.456 28.480 36.491
Start of MODEL 19
1 H1 GLY 1 H1 GLY 1 18.491 30.329 7.153
2 H2 GLY 1 H2 GLY 1 19.249 30.536 8.603
3 H3 GLY 1 H3 GLY 1 17.818 29.715 8.519
4 HA2 GLY 1 HA2 GLY 1 18.849 27.989 7.199
5 HA3 GLY 1 HA3 GLY 1 20.389 28.856 7.392
6 H SER 2 H SER 2 20.687 26.518 8.135
7 HA SER 2 HA SER 2 19.632 25.427 10.438
8 HB2 SER 2 HB2 SER 2 22.409 25.011 9.267
9 HB3 SER 2 HB3 SER 2 21.640 23.964 10.476
10 HG SER 2 HG SER 2 20.686 24.530 7.852
11 H ALA 3 H ALA 3 19.839 25.625 12.564
12 HA ALA 3 HA ALA 3 21.838 27.501 13.652
13 HB1 ALA 3 HB1 ALA 3 19.443 27.894 14.079
14 HB2 ALA 3 HB2 ALA 3 19.330 26.313 14.885
15 HB3 ALA 3 HB3 ALA 3 20.332 27.587 15.582
16 H CYS 4 H CYS 4 22.969 27.173 15.525
17 HA CYS 4 HA CYS 4 24.119 24.572 16.118
18 HB2 CYS 4 HB2 CYS 4 25.479 26.457 16.399
19 HB3 CYS 4 HB3 CYS 4 24.242 27.341 17.286
20 H GLN 5 H GLN 5 23.220 23.004 17.392
21 HA GLN 5 HA GLN 5 20.940 23.540 19.173
22 HB2 GLN 5 HB2 GLN 5 22.510 20.962 18.770
23 HB3 GLN 5 HB3 GLN 5 20.985 21.184 19.643
24 HG2 GLN 5 HG2 GLN 5 19.853 21.863 17.609
25 HG3 GLN 5 HG3 GLN 5 21.311 21.571 16.664
26 HE21 GLN 5 HE21 GLN 5 19.082 18.602 16.294
27 HE22 GLN 5 HE22 GLN 5 19.119 20.306 15.828
28 H PHE 6 H PHE 6 21.221 24.357 21.186
29 HA PHE 6 HA PHE 6 23.591 24.925 22.386
30 HB2 PHE 6 HB2 PHE 6 22.373 25.376 24.426
31 HB3 PHE 6 HB3 PHE 6 21.490 25.953 23.039
32 HD1 PHE 6 HD1 PHE 6 21.590 23.258 25.639
33 HD2 PHE 6 HD2 PHE 6 19.235 25.234 22.614
34 HE1 PHE 6 HE1 PHE 6 19.596 22.000 26.372
35 HE2 PHE 6 HE2 PHE 6 17.223 24.006 23.386
36 HZ PHE 6 HZ PHE 6 17.394 22.369 25.255
37 H TRP 7 H TRP 7 21.852 21.832 22.901
38 HA TRP 7 HA TRP 7 23.214 20.994 25.195
39 HB2 TRP 7 HB2 TRP 7 22.349 18.883 24.806
40 HB3 TRP 7 HB3 TRP 7 21.195 19.939 24.013
41 HD1 TRP 7 HD1 TRP 7 21.533 20.078 21.243
42 HE1 TRP 7 HE1 TRP 7 22.268 18.327 19.533
43 HE3 TRP 7 HE3 TRP 7 23.733 16.750 24.451
44 HZ2 TRP 7 HZ2 TRP 7 23.780 15.861 19.556
45 HZ3 TRP 7 HZ3 TRP 7 24.806 14.694 23.575
46 HH2 TRP 7 HH2 TRP 7 24.855 14.241 21.132
47 H SER 8 H SER 8 24.358 20.813 21.836
48 HA SER 8 HA SER 8 26.560 19.044 22.334
49 HB2 SER 8 HB2 SER 8 25.593 19.538 20.069
50 HB3 SER 8 HB3 SER 8 26.321 21.153 20.154
51 HG SER 8 HG SER 8 27.448 18.690 19.645
52 H CYS 9 H CYS 9 26.292 22.587 22.315
53 HA CYS 9 HA CYS 9 29.001 23.119 23.189
54 HB2 CYS 9 HB2 CYS 9 26.387 24.681 23.212
55 HB3 CYS 9 HB3 CYS 9 27.878 25.322 23.892
56 H ASN 10 H ASN 10 25.899 22.683 24.943
57 HA ASN 10 HA ASN 10 26.742 23.504 27.452
58 HB2 ASN 10 HB2 ASN 10 24.412 22.964 26.536
59 HB3 ASN 10 HB3 ASN 10 24.717 21.281 26.975
60 HD21 ASN 10 HD21 ASN 10 23.908 21.985 30.371
61 HD22 ASN 10 HD22 ASN 10 24.379 20.745 29.214
62 H SER 11 H SER 11 26.606 20.067 26.377
63 HA SER 11 HA SER 11 28.022 19.145 28.724
64 HB2 SER 11 HB2 SER 11 27.474 17.731 26.094
65 HB3 SER 11 HB3 SER 11 28.031 16.975 27.604
66 HG SER 11 HG SER 11 25.832 16.787 27.656
67 H SER 12 H SER 12 29.173 20.311 25.576
68 HA SER 12 HA SER 12 31.907 19.396 25.905
69 HB2 SER 12 HB2 SER 12 31.010 20.095 23.740
70 HB3 SER 12 HB3 SER 12 30.825 21.756 24.329
71 HG SER 12 HG SER 12 32.790 21.191 23.123
72 H CYS 13 H CYS 13 30.297 22.561 26.726
73 HA CYS 13 HA CYS 13 32.540 23.716 28.007
74 HB2 CYS 13 HB2 CYS 13 29.543 24.060 28.308
75 HB3 CYS 13 HB3 CYS 13 30.685 24.989 29.269
76 H ILE 14 H ILE 14 29.910 21.689 29.535
77 HA ILE 14 HA ILE 14 31.104 21.710 32.116
78 HB ILE 14 HB ILE 14 29.526 19.454 30.826
79 HG12 ILE 14 HG12 ILE 14 28.498 21.513 32.813
80 HG13 ILE 14 HG13 ILE 14 28.426 21.850 31.098
81 HG21 ILE 14 HG21 ILE 14 29.105 18.920 33.316
82 HG22 ILE 14 HG22 ILE 14 30.758 18.652 32.770
83 HG23 ILE 14 HG23 ILE 14 30.374 20.115 33.685
84 HD11 ILE 14 HD11 ILE 14 27.065 19.507 32.473
85 HD12 ILE 14 HD12 ILE 14 26.296 20.971 31.839
86 HD13 ILE 14 HD13 ILE 14 27.055 19.821 30.722
87 H SER 15 H SER 15 31.934 19.697 29.289
88 HA SER 15 HA SER 15 33.897 18.079 30.641
89 HB2 SER 15 HB2 SER 15 33.728 18.742 27.679
90 HB3 SER 15 HB3 SER 15 34.598 17.402 28.428
91 HG SER 15 HG SER 15 31.801 17.854 28.255
92 H ARG 16 H ARG 16 34.070 21.373 29.483
93 HA ARG 16 HA ARG 16 37.016 21.549 29.792
94 HB2 ARG 16 HB2 ARG 16 34.925 23.740 29.432
95 HB3 ARG 16 HB3 ARG 16 36.670 23.979 29.476
96 HG2 ARG 16 HG2 ARG 16 36.910 22.577 27.434
97 HG3 ARG 16 HG3 ARG 16 35.158 22.311 27.441
98 HD2 ARG 16 HD2 ARG 16 35.704 24.002 25.791
99 HD3 ARG 16 HD3 ARG 16 34.749 24.705 27.103
100 HE ARG 16 HE ARG 16 37.690 24.959 27.388
101 HH11 ARG 16 HH11 ARG 16 34.927 26.650 25.965
102 HH12 ARG 16 HH12 ARG 16 35.569 28.196 26.430
103 HH21 ARG 16 HH21 ARG 16 38.532 26.836 27.601
104 HH22 ARG 16 HH22 ARG 16 37.673 28.331 27.245
105 H GLY 17 H GLY 17 34.164 21.970 31.772
106 HA2 GLY 17 HA2 GLY 17 34.861 21.366 34.159
107 HA3 GLY 17 HA3 GLY 17 35.793 22.865 34.120
108 H TYR 18 H TYR 18 33.059 23.527 32.344
109 HA TYR 18 HA TYR 18 31.988 25.206 34.451
110 HB2 TYR 18 HB2 TYR 18 31.307 24.776 31.517
111 HB3 TYR 18 HB3 TYR 18 30.625 26.037 32.506
112 HD1 TYR 18 HD1 TYR 18 31.866 27.980 33.207
113 HD2 TYR 18 HD2 TYR 18 33.745 24.868 30.924
114 HE1 TYR 18 HE1 TYR 18 33.796 29.474 32.772
115 HE2 TYR 18 HE2 TYR 18 35.672 26.388 30.422
116 HH TYR 18 HH TYR 18 35.682 29.785 31.526
117 H ARG 19 H ARG 19 29.321 25.370 33.630
118 HA ARG 19 HA ARG 19 28.060 22.776 34.490
119 HB2 ARG 19 HB2 ARG 19 27.121 25.494 35.452
120 HB3 ARG 19 HB3 ARG 19 26.464 23.922 35.843
121 HG2 ARG 19 HG2 ARG 19 27.714 24.025 37.719
122 HG3 ARG 19 HG3 ARG 19 29.038 23.538 36.678
123 HD2 ARG 19 HD2 ARG 19 29.808 25.423 37.913
124 HD3 ARG 19 HD3 ARG 19 29.509 25.985 36.261
125 HE ARG 19 HE ARG 19 27.176 26.388 37.922
126 HH11 ARG 19 HH11 ARG 19 30.334 27.800 37.295
127 HH12 ARG 19 HH12 ARG 19 29.946 29.269 38.187
128 HH21 ARG 19 HH21 ARG 19 26.688 28.443 38.795
129 HH22 ARG 19 HH22 ARG 19 27.917 29.686 38.772
130 H GLN 20 H GLN 20 28.221 25.076 32.072
131 HA GLN 20 HA GLN 20 25.853 24.274 30.715
132 HB2 GLN 20 HB2 GLN 20 25.243 26.103 32.643
133 HB3 GLN 20 HB3 GLN 20 25.774 27.215 31.385
134 HG2 GLN 20 HG2 GLN 20 24.048 26.278 29.855
135 HG3 GLN 20 HG3 GLN 20 23.643 25.047 31.070
136 HE21 GLN 20 HE21 GLN 20 21.060 27.270 32.046
137 HE22 GLN 20 HE22 GLN 20 21.454 25.669 31.408
138 H GLY 21 H GLY 21 25.574 25.450 28.664
139 HA2 GLY 21 HA2 GLY 21 27.486 27.217 27.632
140 HA3 GLY 21 HA3 GLY 21 27.977 25.591 27.155
141 H TYR 22 H TYR 22 27.194 27.798 25.432
142 HA TYR 22 HA TYR 22 25.085 26.632 23.773
143 HB2 TYR 22 HB2 TYR 22 23.716 28.887 24.111
144 HB3 TYR 22 HB3 TYR 22 23.490 27.492 25.139
145 HD1 TYR 22 HD1 TYR 22 25.691 30.574 25.074
146 HD2 TYR 22 HD2 TYR 22 23.334 27.823 27.407
147 HE1 TYR 22 HE1 TYR 22 26.231 31.850 27.145
148 HE2 TYR 22 HE2 TYR 22 23.877 29.098 29.466
149 HH TYR 22 HH TYR 22 24.671 31.095 30.274
150 H CYS 23 H CYS 23 24.489 28.041 21.921
151 HA CYS 23 HA CYS 23 26.740 29.765 20.973
152 HB2 CYS 23 HB2 CYS 23 24.461 28.374 19.532
153 HB3 CYS 23 HB3 CYS 23 25.558 29.514 18.766
154 H TRP 24 H TRP 24 25.773 31.532 19.418
155 HA TRP 24 HA TRP 24 23.278 32.797 20.413
156 HB2 TRP 24 HB2 TRP 24 26.016 34.080 20.342
157 HB3 TRP 24 HB3 TRP 24 24.509 34.987 20.518
158 HD1 TRP 24 HD1 TRP 24 27.153 33.542 22.521
159 HE1 TRP 24 HE1 TRP 24 26.523 33.473 25.032
160 HE3 TRP 24 HE3 TRP 24 22.117 34.362 22.132
161 HZ2 TRP 24 HZ2 TRP 24 24.144 33.619 26.618
162 HZ3 TRP 24 HZ3 TRP 24 20.691 34.424 24.164
163 HH2 TRP 24 HH2 TRP 24 21.687 34.055 26.409
164 H GLY 25 H GLY 25 22.256 32.457 18.440
165 HA2 GLY 25 HA2 GLY 25 21.540 33.127 16.345
166 HA3 GLY 25 HA3 GLY 25 22.552 34.559 16.547
167 H ILE 26 H ILE 26 24.154 34.804 15.130
168 HA ILE 26 HA ILE 26 25.033 32.498 13.402
169 HB ILE 26 HB ILE 26 24.572 35.422 12.744
170 HG12 ILE 26 HG12 ILE 26 23.089 33.040 11.545
171 HG13 ILE 26 HG13 ILE 26 22.499 33.881 12.972
172 HG21 ILE 26 HG21 ILE 26 25.070 34.793 10.370
173 HG22 ILE 26 HG22 ILE 26 26.467 34.607 11.411
174 HG23 ILE 26 HG23 ILE 26 25.534 33.174 10.919
175 HD11 ILE 26 HD11 ILE 26 22.474 36.036 11.704
176 HD12 ILE 26 HD12 ILE 26 22.846 35.111 10.229
177 HD13 ILE 26 HD13 ILE 26 21.347 34.800 11.119
178 H GLN 27 H GLN 27 26.014 35.560 14.940
179 HA GLN 27 HA GLN 27 28.839 35.208 14.109
180 HB2 GLN 27 HB2 GLN 27 27.418 37.510 15.503
181 HB3 GLN 27 HB3 GLN 27 29.072 37.531 14.911
182 HG2 GLN 27 HG2 GLN 27 26.559 37.259 13.182
183 HG3 GLN 27 HG3 GLN 27 27.486 38.731 13.426
184 HE21 GLN 27 HE21 GLN 27 28.562 37.043 10.202
185 HE22 GLN 27 HE22 GLN 27 27.011 37.664 10.781
186 H TYR 28 H TYR 28 29.936 33.812 15.406
187 HA TYR 28 HA TYR 28 30.643 34.640 18.080
188 HB2 TYR 28 HB2 TYR 28 30.079 32.434 19.157
189 HB3 TYR 28 HB3 TYR 28 28.721 33.485 18.837
190 HD1 TYR 28 HD1 TYR 28 30.254 30.232 18.051
191 HD2 TYR 28 HD2 TYR 28 27.060 32.966 17.091
192 HE1 TYR 28 HE1 TYR 28 29.022 28.397 16.894
193 HE2 TYR 28 HE2 TYR 28 25.821 31.127 15.988
194 HH TYR 28 HH TYR 28 27.207 27.928 15.400
195 H LYS 29 H LYS 29 32.523 33.526 18.873
196 HA LYS 29 HA LYS 29 34.283 32.462 16.754
197 HB2 LYS 29 HB2 LYS 29 34.653 32.899 19.751
198 HB3 LYS 29 HB3 LYS 29 35.952 32.470 18.636
199 HG2 LYS 29 HG2 LYS 29 34.327 35.046 18.462
200 HG3 LYS 29 HG3 LYS 29 35.863 34.878 19.315
201 HD2 LYS 29 HD2 LYS 29 37.022 34.263 17.251
202 HD3 LYS 29 HD3 LYS 29 35.495 34.330 16.334
203 HE2 LYS 29 HE2 LYS 29 35.213 36.683 16.892
204 HE3 LYS 29 HE3 LYS 29 36.688 36.664 17.885
205 HZ1 LYS 29 HZ1 LYS 29 36.602 36.138 14.964
206 HZ2 LYS 29 HZ2 LYS 29 37.142 37.529 15.660
207 HZ3 LYS 29 HZ3 LYS 29 37.965 36.128 15.890
208 H TYR 30 H TYR 30 32.720 31.188 19.630
209 HA TYR 30 HA TYR 30 33.199 28.362 19.045
210 HB2 TYR 30 HB2 TYR 30 34.335 28.273 21.463
211 HB3 TYR 30 HB3 TYR 30 35.263 28.528 20.008
212 HD1 TYR 30 HD1 TYR 30 33.361 30.747 22.448
213 HD2 TYR 30 HD2 TYR 30 36.985 30.043 20.218
214 HE1 TYR 30 HE1 TYR 30 34.272 32.905 23.233
215 HE2 TYR 30 HE2 TYR 30 37.891 32.221 20.984
216 HH TYR 30 HH TYR 30 37.478 34.146 22.129
217 H CYS 31 H CYS 31 32.421 27.128 21.259
218 HA CYS 31 HA CYS 31 29.718 28.060 21.873
219 HB2 CYS 31 HB2 CYS 31 31.516 25.961 23.136
220 HB3 CYS 31 HB3 CYS 31 29.858 26.246 23.609
221 H GLN 32 H GLN 32 29.103 29.423 23.492
222 HA GLN 32 HA GLN 32 31.110 30.537 25.371
223 HB2 GLN 32 HB2 GLN 32 28.113 31.035 25.208
224 HB3 GLN 32 HB3 GLN 32 29.290 31.939 26.156
225 HG2 GLN 32 HG2 GLN 32 29.054 31.863 23.113
226 HG3 GLN 32 HG3 GLN 32 28.676 33.208 24.192
227 HE21 GLN 32 HE21 GLN 32 32.144 34.083 24.703
228 HE22 GLN 32 HE22 GLN 32 30.592 34.099 25.534
229 H CYS 33 H CYS 33 31.127 30.037 27.574
230 HA CYS 33 HA CYS 33 29.471 27.691 28.530
231 HB2 CYS 33 HB2 CYS 33 32.270 28.529 29.358
232 HB3 CYS 33 HB3 CYS 33 31.377 27.107 29.860
233 H GLN 34 H GLN 34 29.475 27.601 30.941
234 HA GLN 34 HA GLN 34 27.765 29.546 31.815
235 HB2 GLN 34 HB2 GLN 34 27.945 27.292 32.776
236 HB3 GLN 34 HB3 GLN 34 29.448 27.746 33.592
237 HG2 GLN 34 HG2 GLN 34 27.562 27.769 35.138
238 HG3 GLN 34 HG3 GLN 34 28.245 29.376 34.979
239 HE21 GLN 34 HE21 GLN 34 25.247 30.753 33.532
240 HE22 GLN 34 HE22 GLN 34 27.014 30.948 33.589
Start of MODEL 20
1 H1 GLY 1 H1 GLY 1 20.423 21.178 6.506
2 H2 GLY 1 H2 GLY 1 21.025 19.639 6.459
3 H3 GLY 1 H3 GLY 1 21.074 20.592 5.115
4 HA2 GLY 1 HA2 GLY 1 23.242 20.376 6.178
5 HA3 GLY 1 HA3 GLY 1 22.663 22.047 6.051
6 H SER 2 H SER 2 24.580 21.611 7.886
7 HA SER 2 HA SER 2 23.521 20.809 10.469
8 HB2 SER 2 HB2 SER 2 25.745 21.170 11.273
9 HB3 SER 2 HB3 SER 2 25.816 20.284 9.751
10 HG SER 2 HG SER 2 27.294 22.162 10.176
11 H ALA 3 H ALA 3 23.535 21.993 12.412
12 HA ALA 3 HA ALA 3 23.720 24.929 12.398
13 HB1 ALA 3 HB1 ALA 3 21.171 23.444 13.174
14 HB2 ALA 3 HB2 ALA 3 21.457 25.187 13.359
15 HB3 ALA 3 HB3 ALA 3 21.370 24.475 11.736
16 H CYS 4 H CYS 4 23.639 25.813 14.666
17 HA CYS 4 HA CYS 4 25.032 24.052 16.523
18 HB2 CYS 4 HB2 CYS 4 25.623 26.387 16.364
19 HB3 CYS 4 HB3 CYS 4 24.015 26.863 16.921
20 H GLN 5 H GLN 5 24.204 22.796 18.067
21 HA GLN 5 HA GLN 5 21.460 23.372 19.091
22 HB2 GLN 5 HB2 GLN 5 22.810 20.655 19.102
23 HB3 GLN 5 HB3 GLN 5 21.210 21.047 19.695
24 HG2 GLN 5 HG2 GLN 5 22.067 21.231 16.775
25 HG3 GLN 5 HG3 GLN 5 21.096 19.952 17.489
26 HE21 GLN 5 HE21 GLN 5 18.805 22.447 15.863
27 HE22 GLN 5 HE22 GLN 5 20.117 21.433 15.280
28 H PHE 6 H PHE 6 21.379 24.128 21.107
29 HA PHE 6 HA PHE 6 23.755 24.689 22.499
30 HB2 PHE 6 HB2 PHE 6 22.475 25.503 24.298
31 HB3 PHE 6 HB3 PHE 6 21.658 25.962 22.822
32 HD1 PHE 6 HD1 PHE 6 19.332 25.416 22.549
33 HD2 PHE 6 HD2 PHE 6 21.606 23.579 25.714
34 HE1 PHE 6 HE1 PHE 6 17.252 24.419 23.466
35 HE2 PHE 6 HE2 PHE 6 19.546 22.551 26.598
36 HZ PHE 6 HZ PHE 6 17.355 22.979 25.487
37 H TRP 7 H TRP 7 21.634 21.816 22.897
38 HA TRP 7 HA TRP 7 22.726 20.983 25.355
39 HB2 TRP 7 HB2 TRP 7 21.699 18.949 25.067
40 HB3 TRP 7 HB3 TRP 7 20.666 20.136 24.279
41 HD1 TRP 7 HD1 TRP 7 22.329 19.901 21.393
42 HE1 TRP 7 HE1 TRP 7 21.718 17.908 19.890
43 HE3 TRP 7 HE3 TRP 7 20.266 16.813 24.915
44 HZ2 TRP 7 HZ2 TRP 7 20.384 15.370 20.163
45 HZ3 TRP 7 HZ3 TRP 7 19.240 14.650 24.243
46 HH2 TRP 7 HH2 TRP 7 19.297 13.923 21.873
47 H SER 8 H SER 8 24.105 20.554 22.162
48 HA SER 8 HA SER 8 26.208 18.717 22.982
49 HB2 SER 8 HB2 SER 8 26.018 20.445 20.485
50 HB3 SER 8 HB3 SER 8 27.022 19.004 20.729
51 HG SER 8 HG SER 8 25.247 18.262 19.691
52 H CYS 9 H CYS 9 26.045 22.255 22.265
53 HA CYS 9 HA CYS 9 28.737 22.905 22.986
54 HB2 CYS 9 HB2 CYS 9 26.106 24.397 22.943
55 HB3 CYS 9 HB3 CYS 9 27.490 25.126 23.738
56 H ASN 10 H ASN 10 25.820 22.581 24.987
57 HA ASN 10 HA ASN 10 26.801 23.417 27.471
58 HB2 ASN 10 HB2 ASN 10 24.433 22.910 26.693
59 HB3 ASN 10 HB3 ASN 10 24.779 21.206 26.882
60 HD21 ASN 10 HD21 ASN 10 24.039 21.340 30.309
61 HD22 ASN 10 HD22 ASN 10 24.539 20.343 28.940
62 H SER 11 H SER 11 26.791 20.067 26.135
63 HA SER 11 HA SER 11 28.347 18.860 28.190
64 HB2 SER 11 HB2 SER 11 28.075 18.191 25.235
65 HB3 SER 11 HB3 SER 11 28.846 17.146 26.436
66 HG SER 11 HG SER 11 26.642 16.673 26.040
67 H SER 12 H SER 12 29.464 20.501 25.150
68 HA SER 12 HA SER 12 32.233 19.867 25.525
69 HB2 SER 12 HB2 SER 12 30.996 22.263 24.116
70 HB3 SER 12 HB3 SER 12 32.697 21.759 24.022
71 HG SER 12 HG SER 12 31.906 20.740 22.351
72 H CYS 13 H CYS 13 30.400 22.824 26.537
73 HA CYS 13 HA CYS 13 32.546 24.061 27.924
74 HB2 CYS 13 HB2 CYS 13 29.531 24.124 28.248
75 HB3 CYS 13 HB3 CYS 13 30.603 25.137 29.197
76 H ILE 14 H ILE 14 30.019 21.811 29.311
77 HA ILE 14 HA ILE 14 31.216 21.741 31.875
78 HB ILE 14 HB ILE 14 29.614 19.567 30.487
79 HG12 ILE 14 HG12 ILE 14 28.557 21.466 32.606
80 HG13 ILE 14 HG13 ILE 14 28.576 22.009 30.939
81 HG21 ILE 14 HG21 ILE 14 30.534 20.081 33.340
82 HG22 ILE 14 HG22 ILE 14 29.175 18.991 32.980
83 HG23 ILE 14 HG23 ILE 14 30.796 18.623 32.372
84 HD11 ILE 14 HD11 ILE 14 27.201 20.075 30.253
85 HD12 ILE 14 HD12 ILE 14 27.178 19.500 31.929
86 HD13 ILE 14 HD13 ILE 14 26.407 21.041 31.516
87 H SER 15 H SER 15 32.035 19.760 29.012
88 HA SER 15 HA SER 15 33.915 18.032 30.312
89 HB2 SER 15 HB2 SER 15 33.918 19.000 27.427
90 HB3 SER 15 HB3 SER 15 34.793 17.603 28.067
91 HG SER 15 HG SER 15 31.962 17.972 28.045
92 H ARG 16 H ARG 16 34.239 21.344 29.178
93 HA ARG 16 HA ARG 16 37.149 21.559 29.667
94 HB2 ARG 16 HB2 ARG 16 35.021 23.734 29.380
95 HB3 ARG 16 HB3 ARG 16 36.757 24.000 29.488
96 HG2 ARG 16 HG2 ARG 16 37.120 22.840 27.368
97 HG3 ARG 16 HG3 ARG 16 35.415 22.381 27.309
98 HD2 ARG 16 HD2 ARG 16 35.867 24.238 25.786
99 HD3 ARG 16 HD3 ARG 16 34.728 24.699 27.056
100 HE ARG 16 HE ARG 16 37.459 25.382 27.789
101 HH11 ARG 16 HH11 ARG 16 34.902 26.572 25.615
102 HH12 ARG 16 HH12 ARG 16 35.480 28.196 25.777
103 HH21 ARG 16 HH21 ARG 16 37.964 27.476 28.038
104 HH22 ARG 16 HH22 ARG 16 37.067 28.717 27.185
105 H GLY 17 H GLY 17 34.187 22.179 31.497
106 HA2 GLY 17 HA2 GLY 17 34.796 21.435 33.928
107 HA3 GLY 17 HA3 GLY 17 35.755 22.916 33.931
108 H TYR 18 H TYR 18 32.997 23.573 32.088
109 HA TYR 18 HA TYR 18 31.926 25.231 34.251
110 HB2 TYR 18 HB2 TYR 18 31.263 24.928 31.307
111 HB3 TYR 18 HB3 TYR 18 30.570 26.136 32.351
112 HD1 TYR 18 HD1 TYR 18 31.654 28.221 32.768
113 HD2 TYR 18 HD2 TYR 18 33.846 24.980 30.960
114 HE1 TYR 18 HE1 TYR 18 33.471 29.791 32.148
115 HE2 TYR 18 HE2 TYR 18 35.681 26.563 30.355
116 HH TYR 18 HH TYR 18 36.518 28.746 30.650
117 H ARG 19 H ARG 19 29.259 25.404 33.532
118 HA ARG 19 HA ARG 19 28.002 22.777 34.235
119 HB2 ARG 19 HB2 ARG 19 27.506 25.395 35.716
120 HB3 ARG 19 HB3 ARG 19 26.559 23.924 35.878
121 HG2 ARG 19 HG2 ARG 19 27.909 23.659 37.670
122 HG3 ARG 19 HG3 ARG 19 28.857 22.795 36.461
123 HD2 ARG 19 HD2 ARG 19 30.126 25.044 36.128
124 HD3 ARG 19 HD3 ARG 19 29.288 25.598 37.583
125 HE ARG 19 HE ARG 19 30.392 23.126 38.249
126 HH11 ARG 19 HH11 ARG 19 31.870 26.133 37.131
127 HH12 ARG 19 HH12 ARG 19 33.395 25.690 37.875
128 HH21 ARG 19 HH21 ARG 19 32.234 22.725 39.176
129 HH22 ARG 19 HH22 ARG 19 33.623 23.778 38.998
130 H GLN 20 H GLN 20 28.112 25.077 31.985
131 HA GLN 20 HA GLN 20 25.597 24.510 30.818
132 HB2 GLN 20 HB2 GLN 20 25.060 26.344 32.564
133 HB3 GLN 20 HB3 GLN 20 25.986 27.438 31.537
134 HG2 GLN 20 HG2 GLN 20 24.435 27.009 29.651
135 HG3 GLN 20 HG3 GLN 20 23.609 25.771 30.597
136 HE21 GLN 20 HE21 GLN 20 21.246 28.209 31.490
137 HE22 GLN 20 HE22 GLN 20 21.570 26.599 30.879
138 H GLY 21 H GLY 21 25.451 25.338 28.624
139 HA2 GLY 21 HA2 GLY 21 27.270 27.205 27.577
140 HA3 GLY 21 HA3 GLY 21 27.815 25.597 27.078
141 H TYR 22 H TYR 22 27.035 27.660 25.325
142 HA TYR 22 HA TYR 22 25.005 26.477 23.612
143 HB2 TYR 22 HB2 TYR 22 23.486 28.553 23.794
144 HB3 TYR 22 HB3 TYR 22 23.394 27.351 25.065
145 HD1 TYR 22 HD1 TYR 22 23.697 27.850 27.311
146 HD2 TYR 22 HD2 TYR 22 24.898 30.705 24.304
147 HE1 TYR 22 HE1 TYR 22 24.257 29.500 29.097
148 HE2 TYR 22 HE2 TYR 22 25.402 32.359 26.082
149 HH TYR 22 HH TYR 22 25.433 32.777 28.313
150 H CYS 23 H CYS 23 24.575 28.000 21.639
151 HA CYS 23 HA CYS 23 27.091 29.412 20.949
152 HB2 CYS 23 HB2 CYS 23 24.675 28.624 19.318
153 HB3 CYS 23 HB3 CYS 23 25.951 29.668 18.710
154 H TRP 24 H TRP 24 27.283 31.509 20.350
155 HA TRP 24 HA TRP 24 25.453 33.585 21.280
156 HB2 TRP 24 HB2 TRP 24 27.942 33.521 19.531
157 HB3 TRP 24 HB3 TRP 24 27.035 34.988 19.808
158 HD1 TRP 24 HD1 TRP 24 29.814 33.052 21.237
159 HE1 TRP 24 HE1 TRP 24 30.688 34.246 23.346
160 HE3 TRP 24 HE3 TRP 24 25.976 36.364 22.008
161 HZ2 TRP 24 HZ2 TRP 24 29.770 36.190 25.224
162 HZ3 TRP 24 HZ3 TRP 24 26.025 37.896 23.954
163 HH2 TRP 24 HH2 TRP 24 27.893 37.800 25.590
164 H GLY 25 H GLY 25 24.476 35.182 19.776
165 HA2 GLY 25 HA2 GLY 25 23.427 34.037 17.264
166 HA3 GLY 25 HA3 GLY 25 23.047 35.610 17.972
167 H ILE 26 H ILE 26 26.206 35.914 18.176
168 HA ILE 26 HA ILE 26 26.690 36.790 15.376
169 HB ILE 26 HB ILE 26 26.487 38.527 17.842
170 HG12 ILE 26 HG12 ILE 26 25.376 38.660 14.999
171 HG13 ILE 26 HG13 ILE 26 24.479 38.234 16.456
172 HG21 ILE 26 HG21 ILE 26 27.537 40.390 16.661
173 HG22 ILE 26 HG22 ILE 26 28.685 39.099 16.845
174 HG23 ILE 26 HG23 ILE 26 27.885 39.353 15.264
175 HD11 ILE 26 HD11 ILE 26 24.796 40.521 17.342
176 HD12 ILE 26 HD12 ILE 26 25.599 40.978 15.823
177 HD13 ILE 26 HD13 ILE 26 23.917 40.467 15.798
178 H GLN 27 H GLN 27 28.611 36.625 14.663
179 HA GLN 27 HA GLN 27 30.805 36.094 14.405
180 HB2 GLN 27 HB2 GLN 27 30.856 38.270 16.510
181 HB3 GLN 27 HB3 GLN 27 32.265 37.786 15.564
182 HG2 GLN 27 HG2 GLN 27 31.433 38.620 13.554
183 HG3 GLN 27 HG3 GLN 27 29.762 38.549 14.066
184 HE21 GLN 27 HE21 GLN 27 30.354 42.099 14.026
185 HE22 GLN 27 HE22 GLN 27 29.828 40.733 13.026
186 H TYR 28 H TYR 28 30.455 33.864 15.286
187 HA TYR 28 HA TYR 28 32.375 33.380 17.508
188 HB2 TYR 28 HB2 TYR 28 30.847 31.914 18.666
189 HB3 TYR 28 HB3 TYR 28 30.138 33.511 18.515
190 HD1 TYR 28 HD1 TYR 28 28.293 33.916 16.865
191 HD2 TYR 28 HD2 TYR 28 29.800 29.958 17.645
192 HE1 TYR 28 HE1 TYR 28 26.348 32.957 15.661
193 HE2 TYR 28 HE2 TYR 28 27.866 28.989 16.420
194 HH TYR 28 HH TYR 28 26.192 29.461 14.927
195 H LYS 29 H LYS 29 33.529 31.591 17.463
196 HA LYS 29 HA LYS 29 32.771 29.272 15.783
197 HB2 LYS 29 HB2 LYS 29 35.060 28.988 14.947
198 HB3 LYS 29 HB3 LYS 29 34.231 30.426 14.368
199 HG2 LYS 29 HG2 LYS 29 35.508 31.775 16.123
200 HG3 LYS 29 HG3 LYS 29 36.409 30.308 16.500
201 HD2 LYS 29 HD2 LYS 29 37.643 31.795 15.005
202 HD3 LYS 29 HD3 LYS 29 37.301 30.246 14.208
203 HE2 LYS 29 HE2 LYS 29 35.541 31.228 12.869
204 HE3 LYS 29 HE3 LYS 29 35.565 32.720 13.827
205 HZ1 LYS 29 HZ1 LYS 29 36.711 32.950 11.695
206 HZ2 LYS 29 HZ2 LYS 29 37.722 33.224 12.957
207 HZ3 LYS 29 HZ3 LYS 29 37.842 31.817 12.144
208 H TYR 30 H TYR 30 33.071 30.167 18.775
209 HA TYR 30 HA TYR 30 33.482 27.370 19.654
210 HB2 TYR 30 HB2 TYR 30 34.623 29.798 21.091
211 HB3 TYR 30 HB3 TYR 30 34.606 28.156 21.710
212 HD1 TYR 30 HD1 TYR 30 36.111 26.412 20.773
213 HD2 TYR 30 HD2 TYR 30 36.220 30.497 19.384
214 HE1 TYR 30 HE1 TYR 30 38.334 26.006 19.720
215 HE2 TYR 30 HE2 TYR 30 38.417 30.066 18.301
216 HH TYR 30 HH TYR 30 40.155 26.957 18.669
217 H CYS 31 H CYS 31 32.191 26.807 21.475
218 HA CYS 31 HA CYS 31 29.671 28.191 21.787
219 HB2 CYS 31 HB2 CYS 31 30.971 26.053 23.510
220 HB3 CYS 31 HB3 CYS 31 29.278 26.497 23.538
221 H GLN 32 H GLN 32 28.887 29.411 23.508
222 HA GLN 32 HA GLN 32 30.763 30.695 25.395
223 HB2 GLN 32 HB2 GLN 32 28.451 31.551 24.124
224 HB3 GLN 32 HB3 GLN 32 27.811 31.064 25.684
225 HG2 GLN 32 HG2 GLN 32 30.107 33.025 25.237
226 HG3 GLN 32 HG3 GLN 32 28.422 33.475 25.492
227 HE21 GLN 32 HE21 GLN 32 28.622 33.261 29.015
228 HE22 GLN 32 HE22 GLN 32 27.603 33.577 27.630
229 H CYS 33 H CYS 33 30.445 30.427 27.730
230 HA CYS 33 HA CYS 33 29.208 27.833 28.584
231 HB2 CYS 33 HB2 CYS 33 32.015 28.773 29.254
232 HB3 CYS 33 HB3 CYS 33 31.241 27.289 29.770
233 H GLN 34 H GLN 34 29.231 27.622 30.981
234 HA GLN 34 HA GLN 34 27.411 29.190 32.077
235 HB2 GLN 34 HB2 GLN 34 28.158 27.102 33.079
236 HB3 GLN 34 HB3 GLN 34 29.632 27.874 33.669
237 HG2 GLN 34 HG2 GLN 34 28.113 27.625 35.497
238 HG3 GLN 34 HG3 GLN 34 28.282 29.333 35.160
239 HE21 GLN 34 HE21 GLN 34 24.814 29.685 34.197
240 HE22 GLN 34 HE22 GLN 34 26.423 30.360 33.850