NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
604033 |
5jyh   |
30089 | cing | 1-original | 6 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 ALA 1 H1 ALA 1 27.654 19.704 37.500
2 H2 ALA 1 H2 ALA 1 27.781 21.341 37.444
3 H3 ALA 1 H3 ALA 1 28.075 20.451 36.097
4 HA ALA 1 HA ALA 1 25.468 20.610 37.455
5 HB1 ALA 1 HB1 ALA 1 24.784 21.964 35.430
6 HB2 ALA 1 HB2 ALA 1 25.959 22.783 36.449
7 HB3 ALA 1 HB3 ALA 1 26.482 22.014 34.935
8 H LYS 2 H LYS 2 24.011 19.015 36.816
9 HA LYS 2 HA LYS 2 24.427 17.622 34.239
10 HB2 LYS 2 HB2 LYS 2 24.612 15.426 35.147
11 HB3 LYS 2 HB3 LYS 2 25.892 16.431 35.807
12 HG2 LYS 2 HG2 LYS 2 24.584 16.659 37.944
13 HG3 LYS 2 HG3 LYS 2 23.312 15.656 37.255
14 HD2 LYS 2 HD2 LYS 2 24.672 14.281 38.694
15 HD3 LYS 2 HD3 LYS 2 24.932 13.753 37.028
16 HE2 LYS 2 HE2 LYS 2 27.078 14.970 36.962
17 HE3 LYS 2 HE3 LYS 2 26.742 15.668 38.550
18 HZ1 LYS 2 HZ1 LYS 2 27.280 12.793 38.007
19 HZ2 LYS 2 HZ2 LYS 2 28.234 13.848 38.801
20 HZ3 LYS 2 HZ3 LYS 2 26.810 13.363 39.464
21 H ASN 3 H ASN 3 22.206 18.568 36.738
22 HA ASN 3 HA ASN 3 20.053 16.908 35.703
23 HB2 ASN 3 HB2 ASN 3 18.666 17.883 37.241
24 HB3 ASN 3 HB3 ASN 3 20.235 17.836 38.048
25 HD21 ASN 3 HD21 ASN 3 20.342 21.337 38.513
26 HD22 ASN 3 HD22 ASN 3 21.271 19.821 38.520
27 H GLN 4 H GLN 4 21.058 20.261 35.162
28 HA GLN 4 HA GLN 4 19.599 20.137 32.554
29 HB2 GLN 4 HB2 GLN 4 18.705 22.339 32.761
30 HB3 GLN 4 HB3 GLN 4 18.160 21.363 34.114
31 HG2 GLN 4 HG2 GLN 4 19.876 22.457 35.574
32 HG3 GLN 4 HG3 GLN 4 20.377 23.457 34.193
33 HE21 GLN 4 HE21 GLN 4 18.450 24.687 33.084
34 HE22 GLN 4 HE22 GLN 4 17.282 25.364 34.227
35 H PHE 5 H PHE 5 22.575 20.563 33.945
36 HA PHE 5 HA PHE 5 24.570 21.378 33.246
37 HB2 PHE 5 HB2 PHE 5 23.373 21.358 30.476
38 HB3 PHE 5 HB3 PHE 5 25.073 21.347 30.889
39 HD1 PHE 5 HD1 PHE 5 26.101 19.313 31.991
40 HD2 PHE 5 HD2 PHE 5 22.062 19.327 30.485
41 HE1 PHE 5 HE1 PHE 5 26.082 16.836 32.015
42 HE2 PHE 5 HE2 PHE 5 22.057 16.830 30.493
43 HZ PHE 5 HZ PHE 5 24.064 15.593 31.258
44 H GLY 6 H GLY 6 22.464 23.382 34.002
45 HA2 GLY 6 HA2 GLY 6 22.415 25.706 34.219
46 HA3 GLY 6 HA3 GLY 6 23.841 25.825 33.187
47 H CYS 7 H CYS 7 21.823 24.037 31.336
48 HA CYS 7 HA CYS 7 21.095 26.278 29.638
49 HB2 CYS 7 HB2 CYS 7 20.599 23.288 29.404
50 HB3 CYS 7 HB3 CYS 7 20.302 24.456 28.147
51 H PHE 8 H PHE 8 19.084 27.016 29.152
52 HA PHE 8 HA PHE 8 16.701 25.456 29.823
53 HB2 PHE 8 HB2 PHE 8 17.059 26.779 31.900
54 HB3 PHE 8 HB3 PHE 8 17.008 28.254 30.955
55 HD1 PHE 8 HD1 PHE 8 14.901 29.153 30.091
56 HD2 PHE 8 HD2 PHE 8 15.019 25.448 32.296
57 HE1 PHE 8 HE1 PHE 8 12.428 29.212 30.334
58 HE2 PHE 8 HE2 PHE 8 12.547 25.527 32.557
59 HZ PHE 8 HZ PHE 8 11.253 27.403 31.569
60 H ALA 9 H ALA 9 14.998 25.891 28.415
61 HA ALA 9 HA ALA 9 14.113 26.409 26.399
62 HB1 ALA 9 HB1 ALA 9 14.768 29.212 27.373
63 HB2 ALA 9 HB2 ALA 9 13.536 28.778 26.174
64 HB3 ALA 9 HB3 ALA 9 13.365 28.223 27.847
65 H ASN 10 H ASN 10 16.814 25.646 26.050
66 HA ASN 10 HA ASN 10 18.335 25.418 24.403
67 HB2 ASN 10 HB2 ASN 10 16.712 27.312 22.660
68 HB3 ASN 10 HB3 ASN 10 18.009 26.279 22.136
69 HD21 ASN 10 HD21 ASN 10 14.646 26.377 22.978
70 HD22 ASN 10 HD22 ASN 10 14.349 24.647 22.751
71 H VAL 11 H VAL 11 18.407 27.800 26.420
72 HA VAL 11 HA VAL 11 20.716 29.215 25.153
73 HB VAL 11 HB VAL 11 18.560 30.436 26.923
74 HG11 VAL 11 HG11 VAL 11 20.684 31.643 27.176
75 HG12 VAL 11 HG12 VAL 11 20.897 31.703 25.410
76 HG13 VAL 11 HG13 VAL 11 19.588 32.603 26.202
77 HG21 VAL 11 HG21 VAL 11 19.031 30.714 23.914
78 HG22 VAL 11 HG22 VAL 11 17.611 29.998 24.706
79 HG23 VAL 11 HG23 VAL 11 17.914 31.716 24.872
80 H ASP 12 H ASP 12 22.412 29.780 26.408
81 HA ASP 12 HA ASP 12 22.980 28.441 28.892
82 HB2 ASP 12 HB2 ASP 12 24.452 30.695 27.442
83 HB3 ASP 12 HB3 ASP 12 25.115 29.710 28.740
84 H VAL 13 H VAL 13 20.683 29.917 29.428
85 HA VAL 13 HA VAL 13 21.199 32.576 30.427
86 HB VAL 13 HB VAL 13 18.945 32.098 31.719
87 HG11 VAL 13 HG11 VAL 13 19.062 32.322 28.697
88 HG12 VAL 13 HG12 VAL 13 17.704 32.776 29.737
89 HG13 VAL 13 HG13 VAL 13 19.234 33.664 29.848
90 HG21 VAL 13 HG21 VAL 13 18.933 29.609 31.232
91 HG22 VAL 13 HG22 VAL 13 17.497 30.492 30.688
92 HG23 VAL 13 HG23 VAL 13 18.723 30.008 29.512
93 H LYS 14 H LYS 14 20.737 29.497 32.243
94 HA LYS 14 HA LYS 14 21.417 30.884 34.751
95 HB2 LYS 14 HB2 LYS 14 20.684 27.970 34.375
96 HB3 LYS 14 HB3 LYS 14 20.704 28.927 35.854
97 HG2 LYS 14 HG2 LYS 14 18.992 30.491 34.546
98 HG3 LYS 14 HG3 LYS 14 18.801 29.081 33.497
99 HD2 LYS 14 HD2 LYS 14 17.072 28.995 35.080
100 HD3 LYS 14 HD3 LYS 14 18.232 27.732 35.552
101 HE2 LYS 14 HE2 LYS 14 19.147 29.161 37.311
102 HE3 LYS 14 HE3 LYS 14 18.240 30.556 36.714
103 HZ1 LYS 14 HZ1 LYS 14 17.215 29.591 38.664
104 HZ2 LYS 14 HZ2 LYS 14 16.190 29.430 37.363
105 HZ3 LYS 14 HZ3 LYS 14 17.024 28.140 37.938
106 H GLY 15 H GLY 15 23.082 28.831 32.470
107 HA2 GLY 15 HA2 GLY 15 25.638 29.514 33.480
108 HA3 GLY 15 HA3 GLY 15 25.235 27.889 34.054
109 H ASP 16 H ASP 16 27.303 27.756 32.676
110 HA ASP 16 HA ASP 16 26.742 27.260 29.807
111 HB2 ASP 16 HB2 ASP 16 29.059 27.218 29.451
112 HB3 ASP 16 HB3 ASP 16 28.798 28.552 30.567
113 H CYS 17 H CYS 17 27.129 25.320 28.783
114 HA CYS 17 HA CYS 17 27.317 22.852 30.461
115 HB2 CYS 17 HB2 CYS 17 25.430 22.969 28.933
116 HB3 CYS 17 HB3 CYS 17 26.506 23.336 27.580
117 H LYS 18 H LYS 18 29.255 24.987 28.573
118 HA LYS 18 HA LYS 18 30.986 23.263 27.206
119 HB2 LYS 18 HB2 LYS 18 30.824 25.754 27.040
120 HB3 LYS 18 HB3 LYS 18 31.765 25.906 28.523
121 HG2 LYS 18 HG2 LYS 18 32.863 24.154 26.324
122 HG3 LYS 18 HG3 LYS 18 32.810 25.873 25.991
123 HD2 LYS 18 HD2 LYS 18 34.111 24.829 28.527
124 HD3 LYS 18 HD3 LYS 18 34.973 24.882 26.975
125 HE2 LYS 18 HE2 LYS 18 34.340 27.322 26.779
126 HE3 LYS 18 HE3 LYS 18 33.725 27.255 28.430
127 HZ1 LYS 18 HZ1 LYS 18 35.995 26.691 29.167
128 HZ2 LYS 18 HZ2 LYS 18 36.548 26.715 27.621
129 HZ3 LYS 18 HZ3 LYS 18 36.007 28.089 28.322
130 H ARG 19 H ARG 19 31.150 24.132 30.692
131 HA ARG 19 HA ARG 19 33.586 22.674 31.170
132 HB2 ARG 19 HB2 ARG 19 31.447 23.946 32.784
133 HB3 ARG 19 HB3 ARG 19 32.080 22.495 33.550
134 HG2 ARG 19 HG2 ARG 19 33.315 24.465 34.286
135 HG3 ARG 19 HG3 ARG 19 34.355 23.339 33.426
136 HD2 ARG 19 HD2 ARG 19 34.940 25.524 32.790
137 HD3 ARG 19 HD3 ARG 19 34.201 24.768 31.378
138 HE ARG 19 HE ARG 19 32.053 26.067 32.162
139 HH11 ARG 19 HH11 ARG 19 35.310 27.327 31.955
140 HH12 ARG 19 HH12 ARG 19 34.755 28.976 32.274
141 HH21 ARG 19 HH21 ARG 19 31.491 28.165 32.643
142 HH22 ARG 19 HH22 ARG 19 32.733 29.419 32.669
143 H HIS 20 H HIS 20 30.347 21.332 30.827
144 HA HIS 20 HA HIS 20 31.188 18.666 31.776
145 HB2 HIS 20 HB2 HIS 20 28.895 19.146 32.069
146 HB3 HIS 20 HB3 HIS 20 28.712 19.789 30.445
147 HD2 HIS 20 HD2 HIS 20 27.761 18.245 28.656
148 HE1 HIS 20 HE1 HIS 20 28.071 14.506 30.662
149 HE2 HIS 20 HE2 HIS 20 27.191 15.681 28.587
150 H CYS 21 H CYS 21 30.720 20.240 28.557
151 HA CYS 21 HA CYS 21 31.556 17.795 27.200
152 HB2 CYS 21 HB2 CYS 21 30.940 20.577 26.211
153 HB3 CYS 21 HB3 CYS 21 31.359 19.240 25.155
154 H LYS 22 H LYS 22 33.339 20.738 28.170
155 HA LYS 22 HA LYS 22 35.689 20.310 26.643
156 HB2 LYS 22 HB2 LYS 22 35.146 22.360 27.953
157 HB3 LYS 22 HB3 LYS 22 35.326 21.454 29.449
158 HG2 LYS 22 HG2 LYS 22 37.242 22.752 29.245
159 HG3 LYS 22 HG3 LYS 22 37.770 21.122 28.881
160 HD2 LYS 22 HD2 LYS 22 37.108 23.214 26.755
161 HD3 LYS 22 HD3 LYS 22 38.702 23.034 27.458
162 HE2 LYS 22 HE2 LYS 22 37.727 20.448 26.523
163 HE3 LYS 22 HE3 LYS 22 37.615 21.660 25.229
164 HZ1 LYS 22 HZ1 LYS 22 39.784 20.503 25.293
165 HZ2 LYS 22 HZ2 LYS 22 39.966 22.137 25.566
166 HZ3 LYS 22 HZ3 LYS 22 40.058 21.094 26.822
167 H ALA 23 H ALA 23 34.590 18.735 29.645
168 HA ALA 23 HA ALA 23 37.004 17.256 30.197
169 HB1 ALA 23 HB1 ALA 23 34.092 16.716 30.911
170 HB2 ALA 23 HB2 ALA 23 35.505 15.953 31.664
171 HB3 ALA 23 HB3 ALA 23 35.234 17.696 31.857
172 H GLU 24 H GLU 24 34.549 16.857 27.776
173 HA GLU 24 HA GLU 24 35.488 14.148 26.984
174 HB2 GLU 24 HB2 GLU 24 33.231 15.803 25.830
175 HB3 GLU 24 HB3 GLU 24 33.554 14.115 25.518
176 HG2 GLU 24 HG2 GLU 24 32.739 15.152 28.272
177 HG3 GLU 24 HG3 GLU 24 31.594 14.718 27.024
178 H ASP 25 H ASP 25 36.649 17.138 26.674
179 HA ASP 25 HA ASP 25 37.628 18.506 25.250
180 HB2 ASP 25 HB2 ASP 25 39.128 16.459 25.171
181 HB3 ASP 25 HB3 ASP 25 38.457 16.146 23.571
182 H LYS 26 H LYS 26 34.875 18.204 24.821
183 HA LYS 26 HA LYS 26 34.504 18.742 21.902
184 HB2 LYS 26 HB2 LYS 26 32.595 17.562 23.952
185 HB3 LYS 26 HB3 LYS 26 32.191 17.949 22.286
186 HG2 LYS 26 HG2 LYS 26 34.500 16.300 22.099
187 HG3 LYS 26 HG3 LYS 26 33.515 15.582 23.387
188 HD2 LYS 26 HD2 LYS 26 31.552 15.562 21.851
189 HD3 LYS 26 HD3 LYS 26 32.545 16.354 20.621
190 HE2 LYS 26 HE2 LYS 26 32.427 14.024 20.085
191 HE3 LYS 26 HE3 LYS 26 34.080 14.431 20.553
192 HZ1 LYS 26 HZ1 LYS 26 33.270 12.338 21.481
193 HZ2 LYS 26 HZ2 LYS 26 33.718 13.336 22.680
194 HZ3 LYS 26 HZ3 LYS 26 32.118 13.133 22.379
195 H GLU 27 H GLU 27 32.729 20.074 21.280
196 HA GLU 27 HA GLU 27 32.454 22.522 22.900
197 HB2 GLU 27 HB2 GLU 27 31.151 21.607 20.297
198 HB3 GLU 27 HB3 GLU 27 30.720 23.077 21.164
199 HG2 GLU 27 HG2 GLU 27 33.240 23.697 21.017
200 HG3 GLU 27 HG3 GLU 27 33.329 22.456 19.766
201 H GLY 28 H GLY 28 30.615 23.124 23.961
202 HA2 GLY 28 HA2 GLY 28 28.481 21.056 24.472
203 HA3 GLY 28 HA3 GLY 28 28.938 22.285 25.649
204 H ILE 29 H ILE 29 26.331 21.571 24.013
205 HA ILE 29 HA ILE 29 25.654 24.360 23.415
206 HB ILE 29 HB ILE 29 26.533 23.472 21.393
207 HG12 ILE 29 HG12 ILE 29 24.596 25.112 21.526
208 HG13 ILE 29 HG13 ILE 29 25.067 24.424 19.981
209 HG21 ILE 29 HG21 ILE 29 26.182 21.128 21.464
210 HG22 ILE 29 HG22 ILE 29 24.418 21.311 21.459
211 HG23 ILE 29 HG23 ILE 29 25.377 21.765 20.034
212 HD11 ILE 29 HD11 ILE 29 22.615 24.577 20.255
213 HD12 ILE 29 HD12 ILE 29 23.176 22.931 19.956
214 HD13 ILE 29 HD13 ILE 29 22.699 23.421 21.599
215 H CYS 30 H CYS 30 23.836 24.953 24.250
216 HA CYS 30 HA CYS 30 22.210 23.120 25.744
217 HB2 CYS 30 HB2 CYS 30 21.866 26.062 25.065
218 HB3 CYS 30 HB3 CYS 30 20.819 25.161 26.160
219 H HIS 31 H HIS 31 20.809 21.757 24.923
220 HA HIS 31 HA HIS 31 18.846 22.642 22.827
221 HB2 HIS 31 HB2 HIS 31 19.967 19.894 23.410
222 HB3 HIS 31 HB3 HIS 31 18.420 20.135 22.607
223 HD2 HIS 31 HD2 HIS 31 22.198 20.745 21.985
224 HE1 HIS 31 HE1 HIS 31 20.241 20.657 18.212
225 HE2 HIS 31 HE2 HIS 31 22.488 20.560 19.402
226 H GLY 32 H GLY 32 17.257 23.458 23.891
227 HA2 GLY 32 HA2 GLY 32 15.382 23.683 25.206
228 HA3 GLY 32 HA3 GLY 32 15.483 21.951 25.504
229 H THR 33 H THR 33 15.422 21.532 27.548
230 HA THR 33 HA THR 33 16.703 23.242 29.620
231 HB THR 33 HB THR 33 15.337 21.896 31.197
232 HG1 THR 33 HG1 THR 33 13.910 20.478 30.424
233 HG21 THR 33 HG21 THR 33 13.633 23.046 28.940
234 HG22 THR 33 HG22 THR 33 13.173 22.836 30.638
235 HG23 THR 33 HG23 THR 33 14.422 24.014 30.204
236 H LYS 34 H LYS 34 17.892 21.126 27.716
237 HA LYS 34 HA LYS 34 19.766 19.875 29.640
238 HB2 LYS 34 HB2 LYS 34 18.361 18.649 27.207
239 HB3 LYS 34 HB3 LYS 34 19.684 17.870 28.061
240 HG2 LYS 34 HG2 LYS 34 16.975 18.533 29.272
241 HG3 LYS 34 HG3 LYS 34 17.540 16.946 28.719
242 HD2 LYS 34 HD2 LYS 34 19.511 17.246 30.370
243 HD3 LYS 34 HD3 LYS 34 18.568 18.555 31.098
244 HE2 LYS 34 HE2 LYS 34 17.693 15.695 30.683
245 HE3 LYS 34 HE3 LYS 34 18.262 16.383 32.215
246 HZ1 LYS 34 HZ1 LYS 34 15.879 16.364 32.232
247 HZ2 LYS 34 HZ2 LYS 34 16.329 17.923 32.084
248 HZ3 LYS 34 HZ3 LYS 34 15.769 17.112 30.770
249 H CYS 35 H CYS 35 21.447 18.701 27.970
250 HA CYS 35 HA CYS 35 22.416 20.712 26.021
251 HB2 CYS 35 HB2 CYS 35 23.520 21.116 28.185
252 HB3 CYS 35 HB3 CYS 35 24.056 19.433 28.227
253 H LYS 36 H LYS 36 23.989 19.876 24.546
254 HA LYS 36 HA LYS 36 24.318 16.967 24.201
255 HB2 LYS 36 HB2 LYS 36 23.064 19.046 22.437
256 HB3 LYS 36 HB3 LYS 36 24.155 18.014 21.636
257 HG2 LYS 36 HG2 LYS 36 22.832 16.031 22.548
258 HG3 LYS 36 HG3 LYS 36 21.714 17.202 23.282
259 HD2 LYS 36 HD2 LYS 36 21.241 18.108 20.977
260 HD3 LYS 36 HD3 LYS 36 22.260 16.809 20.311
261 HE2 LYS 36 HE2 LYS 36 20.797 15.140 21.476
262 HE3 LYS 36 HE3 LYS 36 19.769 16.458 22.051
263 HZ1 LYS 36 HZ1 LYS 36 20.288 15.894 19.178
264 HZ2 LYS 36 HZ2 LYS 36 18.968 15.354 19.987
265 HZ3 LYS 36 HZ3 LYS 36 19.184 16.971 19.776
266 H CYS 37 H CYS 37 26.401 16.560 23.554
267 HA CYS 37 HA CYS 37 28.258 18.874 23.418
268 HB2 CYS 37 HB2 CYS 37 28.944 15.948 23.360
269 HB3 CYS 37 HB3 CYS 37 30.066 17.293 23.330
270 H GLY 38 H GLY 38 29.190 19.571 21.631
271 HA2 GLY 38 HA2 GLY 38 28.104 18.727 19.002
272 HA3 GLY 38 HA3 GLY 38 29.028 20.198 19.360
273 H VAL 39 H VAL 39 30.621 19.914 17.831
274 HA VAL 39 HA VAL 39 32.087 17.468 17.528
275 HB VAL 39 HB VAL 39 33.720 18.936 16.206
276 HG11 VAL 39 HG11 VAL 39 32.216 19.139 14.326
277 HG12 VAL 39 HG12 VAL 39 31.898 17.633 15.196
278 HG13 VAL 39 HG13 VAL 39 30.794 19.016 15.385
279 HG21 VAL 39 HG21 VAL 39 31.617 21.098 16.660
280 HG22 VAL 39 HG22 VAL 39 33.249 21.074 17.355
281 HG23 VAL 39 HG23 VAL 39 33.023 21.175 15.601
282 HA PRO 40 HA PRO 40 35.431 17.791 20.463
283 HB2 PRO 40 HB2 PRO 40 37.530 16.737 19.042
284 HB3 PRO 40 HB3 PRO 40 36.239 15.784 19.828
285 HG2 PRO 40 HG2 PRO 40 36.474 16.579 16.930
286 HG3 PRO 40 HG3 PRO 40 35.959 15.008 17.615
287 HD2 PRO 40 HD2 PRO 40 34.198 16.902 16.701
288 HD3 PRO 40 HD3 PRO 40 33.779 15.846 18.070
289 H ILE 41 H ILE 41 36.901 19.409 21.014
290 HA ILE 41 HA ILE 41 36.859 21.718 19.280
291 HB ILE 41 HB ILE 41 37.775 22.936 21.056
292 HG12 ILE 41 HG12 ILE 41 38.432 21.575 23.256
293 HG13 ILE 41 HG13 ILE 41 38.855 20.324 22.092
294 HG21 ILE 41 HG21 ILE 41 36.268 22.562 22.849
295 HG22 ILE 41 HG22 ILE 41 35.426 22.007 21.389
296 HG23 ILE 41 HG23 ILE 41 36.149 20.838 22.530
297 HD11 ILE 41 HD11 ILE 41 40.437 21.972 21.000
298 HD12 ILE 41 HD12 ILE 41 39.938 23.181 22.192
299 HD13 ILE 41 HD13 ILE 41 40.790 21.712 22.711
300 H SER 42 H SER 42 39.243 19.294 20.109
301 HA SER 42 HA SER 42 41.552 20.628 19.135
302 HB2 SER 42 HB2 SER 42 40.976 17.705 19.757
303 HB3 SER 42 HB3 SER 42 42.580 18.340 19.340
304 HG SER 42 HG SER 42 41.222 18.486 21.711
305 H TYR 43 H TYR 43 42.399 20.794 17.153
306 HA TYR 43 HA TYR 43 42.002 18.688 15.178
307 HB2 TYR 43 HB2 TYR 43 41.174 19.984 13.405
308 HB3 TYR 43 HB3 TYR 43 40.078 20.147 14.754
309 HD1 TYR 43 HD1 TYR 43 42.172 21.938 12.384
310 HD2 TYR 43 HD2 TYR 43 40.279 22.191 16.242
311 HE1 TYR 43 HE1 TYR 43 42.398 24.405 12.337
312 HE2 TYR 43 HE2 TYR 43 40.581 24.606 16.258
313 HH TYR 43 HH TYR 43 41.672 26.424 13.356
314 H LEU 44 H LEU 44 43.519 18.540 13.620
315 HA LEU 44 HA LEU 44 46.095 19.905 14.112
316 HB2 LEU 44 HB2 LEU 44 46.026 17.467 14.168
317 HB3 LEU 44 HB3 LEU 44 45.278 17.412 12.577
318 HG LEU 44 HG LEU 44 47.335 18.361 11.564
319 HD11 LEU 44 HD11 LEU 44 48.458 18.084 14.389
320 HD12 LEU 44 HD12 LEU 44 49.424 18.377 12.928
321 HD13 LEU 44 HD13 LEU 44 48.268 19.597 13.473
322 HD21 LEU 44 HD21 LEU 44 46.964 15.924 11.712
323 HD22 LEU 44 HD22 LEU 44 47.791 15.891 13.286
324 HD23 LEU 44 HD23 LEU 44 48.682 16.330 11.815
Start of MODEL 2
1 H1 ALA 1 H1 ALA 1 23.350 24.378 40.408
2 H2 ALA 1 H2 ALA 1 22.267 25.590 40.148
3 H3 ALA 1 H3 ALA 1 23.574 25.439 39.162
4 HA ALA 1 HA ALA 1 21.375 23.516 39.387
5 HB1 ALA 1 HB1 ALA 1 20.707 24.199 37.168
6 HB2 ALA 1 HB2 ALA 1 20.765 25.636 38.201
7 HB3 ALA 1 HB3 ALA 1 22.072 25.329 37.038
8 H LYS 2 H LYS 2 21.758 21.527 38.544
9 HA LYS 2 HA LYS 2 24.157 21.021 36.852
10 HB2 LYS 2 HB2 LYS 2 24.805 19.119 38.144
11 HB3 LYS 2 HB3 LYS 2 24.843 20.560 39.152
12 HG2 LYS 2 HG2 LYS 2 22.838 19.868 40.346
13 HG3 LYS 2 HG3 LYS 2 22.546 18.553 39.200
14 HD2 LYS 2 HD2 LYS 2 23.461 17.482 41.064
15 HD3 LYS 2 HD3 LYS 2 24.782 17.567 39.897
16 HE2 LYS 2 HE2 LYS 2 25.508 19.725 41.123
17 HE3 LYS 2 HE3 LYS 2 24.331 19.290 42.372
18 HZ1 LYS 2 HZ1 LYS 2 26.543 18.427 42.906
19 HZ2 LYS 2 HZ2 LYS 2 25.550 17.147 42.621
20 HZ3 LYS 2 HZ3 LYS 2 26.636 17.632 41.493
21 H ASN 3 H ASN 3 20.971 19.974 37.950
22 HA ASN 3 HA ASN 3 20.769 17.615 36.365
23 HB2 ASN 3 HB2 ASN 3 18.329 17.853 36.914
24 HB3 ASN 3 HB3 ASN 3 19.429 17.838 38.287
25 HD21 ASN 3 HD21 ASN 3 17.594 20.485 39.591
26 HD22 ASN 3 HD22 ASN 3 17.878 18.758 39.659
27 H GLN 4 H GLN 4 19.695 20.914 35.715
28 HA GLN 4 HA GLN 4 18.941 20.284 32.948
29 HB2 GLN 4 HB2 GLN 4 18.155 22.519 32.831
30 HB3 GLN 4 HB3 GLN 4 17.702 21.894 34.413
31 HG2 GLN 4 HG2 GLN 4 19.765 23.089 35.345
32 HG3 GLN 4 HG3 GLN 4 19.951 23.824 33.737
33 HE21 GLN 4 HE21 GLN 4 17.843 24.932 32.866
34 HE22 GLN 4 HE22 GLN 4 16.970 25.866 34.097
35 H PHE 5 H PHE 5 21.918 20.390 34.274
36 HA PHE 5 HA PHE 5 24.025 21.003 33.717
37 HB2 PHE 5 HB2 PHE 5 22.921 21.046 30.897
38 HB3 PHE 5 HB3 PHE 5 24.619 21.133 31.292
39 HD1 PHE 5 HD1 PHE 5 25.921 19.273 31.802
40 HD2 PHE 5 HD2 PHE 5 21.639 18.879 31.458
41 HE1 PHE 5 HE1 PHE 5 26.142 16.795 31.726
42 HE2 PHE 5 HE2 PHE 5 21.877 16.404 31.355
43 HZ PHE 5 HZ PHE 5 24.136 15.370 31.486
44 H GLY 6 H GLY 6 21.784 23.197 33.957
45 HA2 GLY 6 HA2 GLY 6 22.016 25.545 34.326
46 HA3 GLY 6 HA3 GLY 6 23.505 25.527 33.382
47 H CYS 7 H CYS 7 21.390 23.820 31.471
48 HA CYS 7 HA CYS 7 21.050 26.069 29.653
49 HB2 CYS 7 HB2 CYS 7 20.207 23.155 29.484
50 HB3 CYS 7 HB3 CYS 7 20.016 24.318 28.201
51 H PHE 8 H PHE 8 19.232 27.134 29.163
52 HA PHE 8 HA PHE 8 16.628 25.826 29.452
53 HB2 PHE 8 HB2 PHE 8 16.876 26.904 31.676
54 HB3 PHE 8 HB3 PHE 8 17.089 28.449 30.895
55 HD1 PHE 8 HD1 PHE 8 15.220 29.739 30.104
56 HD2 PHE 8 HD2 PHE 8 14.679 25.703 31.531
57 HE1 PHE 8 HE1 PHE 8 12.745 30.067 30.120
58 HE2 PHE 8 HE2 PHE 8 12.212 26.004 31.470
59 HZ PHE 8 HZ PHE 8 11.251 28.186 30.782
60 H ALA 9 H ALA 9 15.126 26.546 27.917
61 HA ALA 9 HA ALA 9 14.519 27.341 25.900
62 HB1 ALA 9 HB1 ALA 9 14.296 29.756 25.743
63 HB2 ALA 9 HB2 ALA 9 13.912 29.194 27.383
64 HB3 ALA 9 HB3 ALA 9 15.476 29.977 27.055
65 H ASN 10 H ASN 10 16.994 26.097 25.736
66 HA ASN 10 HA ASN 10 18.788 25.769 24.484
67 HB2 ASN 10 HB2 ASN 10 17.442 27.616 22.460
68 HB3 ASN 10 HB3 ASN 10 18.804 26.569 22.139
69 HD21 ASN 10 HD21 ASN 10 16.978 24.258 21.144
70 HD22 ASN 10 HD22 ASN 10 18.530 24.519 21.868
71 H VAL 11 H VAL 11 18.881 28.089 26.407
72 HA VAL 11 HA VAL 11 21.388 29.367 25.403
73 HB VAL 11 HB VAL 11 19.176 30.597 27.093
74 HG11 VAL 11 HG11 VAL 11 21.762 31.820 26.035
75 HG12 VAL 11 HG12 VAL 11 20.458 32.708 26.846
76 HG13 VAL 11 HG13 VAL 11 21.381 31.515 27.750
77 HG21 VAL 11 HG21 VAL 11 20.113 31.209 24.252
78 HG22 VAL 11 HG22 VAL 11 18.557 30.493 24.700
79 HG23 VAL 11 HG23 VAL 11 18.922 32.155 25.166
80 H ASP 12 H ASP 12 23.031 29.712 26.829
81 HA ASP 12 HA ASP 12 23.305 27.890 29.074
82 HB2 ASP 12 HB2 ASP 12 25.183 30.108 28.161
83 HB3 ASP 12 HB3 ASP 12 25.609 28.699 29.120
84 H VAL 13 H VAL 13 21.219 29.532 29.775
85 HA VAL 13 HA VAL 13 21.983 32.012 31.009
86 HB VAL 13 HB VAL 13 19.622 31.833 32.078
87 HG11 VAL 13 HG11 VAL 13 20.341 33.166 30.004
88 HG12 VAL 13 HG12 VAL 13 19.602 31.858 29.067
89 HG13 VAL 13 HG13 VAL 13 18.623 32.786 30.203
90 HG21 VAL 13 HG21 VAL 13 19.271 29.382 31.666
91 HG22 VAL 13 HG22 VAL 13 18.043 30.434 30.942
92 HG23 VAL 13 HG23 VAL 13 19.299 29.716 29.916
93 H LYS 14 H LYS 14 20.930 28.968 32.684
94 HA LYS 14 HA LYS 14 21.771 30.121 35.272
95 HB2 LYS 14 HB2 LYS 14 20.367 27.543 34.495
96 HB3 LYS 14 HB3 LYS 14 20.886 27.939 36.144
97 HG2 LYS 14 HG2 LYS 14 19.639 30.117 35.973
98 HG3 LYS 14 HG3 LYS 14 18.962 29.567 34.425
99 HD2 LYS 14 HD2 LYS 14 17.876 27.688 35.509
100 HD3 LYS 14 HD3 LYS 14 18.694 28.051 37.051
101 HE2 LYS 14 HE2 LYS 14 17.683 30.422 36.795
102 HE3 LYS 14 HE3 LYS 14 16.585 29.700 35.609
103 HZ1 LYS 14 HZ1 LYS 14 15.604 29.743 37.824
104 HZ2 LYS 14 HZ2 LYS 14 15.809 28.188 37.368
105 HZ3 LYS 14 HZ3 LYS 14 16.857 28.874 38.452
106 H GLY 15 H GLY 15 23.288 28.257 32.828
107 HA2 GLY 15 HA2 GLY 15 25.797 28.322 34.142
108 HA3 GLY 15 HA3 GLY 15 25.146 26.693 34.332
109 H ASP 16 H ASP 16 27.401 26.760 33.026
110 HA ASP 16 HA ASP 16 27.009 27.332 30.146
111 HB2 ASP 16 HB2 ASP 16 28.865 28.385 31.399
112 HB3 ASP 16 HB3 ASP 16 29.517 26.774 31.758
113 H CYS 17 H CYS 17 26.384 25.697 28.844
114 HA CYS 17 HA CYS 17 26.746 22.904 29.481
115 HB2 CYS 17 HB2 CYS 17 24.930 23.663 28.176
116 HB3 CYS 17 HB3 CYS 17 25.956 24.490 27.019
117 H LYS 18 H LYS 18 28.751 25.194 27.633
118 HA LYS 18 HA LYS 18 30.587 23.373 26.445
119 HB2 LYS 18 HB2 LYS 18 30.440 25.651 25.835
120 HB3 LYS 18 HB3 LYS 18 30.842 26.234 27.423
121 HG2 LYS 18 HG2 LYS 18 32.712 24.674 25.641
122 HG3 LYS 18 HG3 LYS 18 32.556 26.438 25.665
123 HD2 LYS 18 HD2 LYS 18 33.579 24.801 27.997
124 HD3 LYS 18 HD3 LYS 18 34.550 25.663 26.808
125 HE2 LYS 18 HE2 LYS 18 32.964 27.710 27.554
126 HE3 LYS 18 HE3 LYS 18 32.839 26.738 29.028
127 HZ1 LYS 18 HZ1 LYS 18 35.328 27.716 27.778
128 HZ2 LYS 18 HZ2 LYS 18 34.664 28.323 29.126
129 HZ3 LYS 18 HZ3 LYS 18 35.275 26.784 29.168
130 H ARG 19 H ARG 19 30.547 24.590 29.876
131 HA ARG 19 HA ARG 19 32.956 23.406 30.656
132 HB2 ARG 19 HB2 ARG 19 31.259 25.038 31.785
133 HB3 ARG 19 HB3 ARG 19 30.444 23.584 32.378
134 HG2 ARG 19 HG2 ARG 19 32.548 22.892 33.515
135 HG3 ARG 19 HG3 ARG 19 33.363 24.339 32.885
136 HD2 ARG 19 HD2 ARG 19 30.942 24.302 34.745
137 HD3 ARG 19 HD3 ARG 19 32.624 24.631 35.192
138 HE ARG 19 HE ARG 19 31.932 26.482 33.175
139 HH11 ARG 19 HH11 ARG 19 31.050 25.972 36.565
140 HH12 ARG 19 HH12 ARG 19 30.726 27.678 36.746
141 HH21 ARG 19 HH21 ARG 19 31.346 28.462 33.463
142 HH22 ARG 19 HH22 ARG 19 30.577 28.994 34.958
143 H HIS 20 H HIS 20 29.816 21.762 30.337
144 HA HIS 20 HA HIS 20 30.773 19.249 31.518
145 HB2 HIS 20 HB2 HIS 20 28.437 19.533 31.590
146 HB3 HIS 20 HB3 HIS 20 28.344 20.079 29.924
147 HD2 HIS 20 HD2 HIS 20 27.476 18.414 28.257
148 HE1 HIS 20 HE1 HIS 20 28.318 14.741 30.235
149 HE2 HIS 20 HE2 HIS 20 27.254 15.785 28.178
150 H CYS 21 H CYS 21 30.459 20.488 28.132
151 HA CYS 21 HA CYS 21 31.537 18.031 27.066
152 HB2 CYS 21 HB2 CYS 21 30.909 20.739 25.881
153 HB3 CYS 21 HB3 CYS 21 31.470 19.378 24.914
154 H LYS 22 H LYS 22 33.080 21.069 28.022
155 HA LYS 22 HA LYS 22 35.632 20.686 26.840
156 HB2 LYS 22 HB2 LYS 22 34.941 22.796 27.857
157 HB3 LYS 22 HB3 LYS 22 34.777 22.038 29.434
158 HG2 LYS 22 HG2 LYS 22 36.789 23.382 29.370
159 HG3 LYS 22 HG3 LYS 22 37.172 21.691 29.603
160 HD2 LYS 22 HD2 LYS 22 38.798 22.530 28.107
161 HD3 LYS 22 HD3 LYS 22 37.725 21.550 27.125
162 HE2 LYS 22 HE2 LYS 22 38.054 23.447 25.815
163 HE3 LYS 22 HE3 LYS 22 36.481 23.753 26.559
164 HZ1 LYS 22 HZ1 LYS 22 39.063 24.842 27.559
165 HZ2 LYS 22 HZ2 LYS 22 38.049 25.666 26.606
166 HZ3 LYS 22 HZ3 LYS 22 37.596 25.261 28.134
167 H ALA 23 H ALA 23 34.247 19.262 29.793
168 HA ALA 23 HA ALA 23 36.669 17.949 30.668
169 HB1 ALA 23 HB1 ALA 23 33.749 17.256 31.144
170 HB2 ALA 23 HB2 ALA 23 35.130 16.642 32.072
171 HB3 ALA 23 HB3 ALA 23 34.723 18.369 32.119
172 H GLU 24 H GLU 24 34.376 17.146 28.111
173 HA GLU 24 HA GLU 24 35.677 14.507 27.628
174 HB2 GLU 24 HB2 GLU 24 33.250 15.791 26.316
175 HB3 GLU 24 HB3 GLU 24 33.934 14.203 25.937
176 HG2 GLU 24 HG2 GLU 24 33.557 13.523 28.335
177 HG3 GLU 24 HG3 GLU 24 32.725 15.063 28.594
178 H ASP 25 H ASP 25 36.597 17.512 27.096
179 HA ASP 25 HA ASP 25 37.598 18.787 25.562
180 HB2 ASP 25 HB2 ASP 25 38.774 16.122 24.751
181 HB3 ASP 25 HB3 ASP 25 39.364 17.686 24.196
182 H LYS 26 H LYS 26 34.996 18.366 24.985
183 HA LYS 26 HA LYS 26 34.805 18.553 21.994
184 HB2 LYS 26 HB2 LYS 26 32.811 17.405 23.989
185 HB3 LYS 26 HB3 LYS 26 32.435 17.823 22.323
186 HG2 LYS 26 HG2 LYS 26 34.623 16.239 21.898
187 HG3 LYS 26 HG3 LYS 26 33.978 15.510 23.387
188 HD2 LYS 26 HD2 LYS 26 31.788 15.230 22.321
189 HD3 LYS 26 HD3 LYS 26 32.376 16.089 20.872
190 HE2 LYS 26 HE2 LYS 26 33.974 14.338 20.385
191 HE3 LYS 26 HE3 LYS 26 33.623 13.508 21.909
192 HZ1 LYS 26 HZ1 LYS 26 32.527 12.625 19.822
193 HZ2 LYS 26 HZ2 LYS 26 31.503 12.889 21.110
194 HZ3 LYS 26 HZ3 LYS 26 31.539 13.897 19.820
195 H GLU 27 H GLU 27 32.905 19.790 21.260
196 HA GLU 27 HA GLU 27 32.542 22.341 22.728
197 HB2 GLU 27 HB2 GLU 27 31.572 21.315 20.036
198 HB3 GLU 27 HB3 GLU 27 31.299 22.927 20.666
199 HG2 GLU 27 HG2 GLU 27 34.173 22.053 20.479
200 HG3 GLU 27 HG3 GLU 27 33.293 22.294 18.980
201 H GLY 28 H GLY 28 30.374 23.032 23.233
202 HA2 GLY 28 HA2 GLY 28 28.448 20.806 23.859
203 HA3 GLY 28 HA3 GLY 28 28.686 22.187 24.894
204 H ILE 29 H ILE 29 26.124 21.321 24.067
205 HA ILE 29 HA ILE 29 25.088 23.701 22.727
206 HB ILE 29 HB ILE 29 25.479 22.188 20.907
207 HG12 ILE 29 HG12 ILE 29 23.413 23.713 21.104
208 HG13 ILE 29 HG13 ILE 29 23.632 22.647 19.725
209 HG21 ILE 29 HG21 ILE 29 25.449 20.009 21.849
210 HG22 ILE 29 HG22 ILE 29 23.703 20.118 22.167
211 HG23 ILE 29 HG23 ILE 29 24.311 20.115 20.505
212 HD11 ILE 29 HD11 ILE 29 21.983 21.102 20.502
213 HD12 ILE 29 HD12 ILE 29 21.922 21.863 22.096
214 HD13 ILE 29 HD13 ILE 29 21.290 22.727 20.679
215 H CYS 30 H CYS 30 23.376 24.437 23.804
216 HA CYS 30 HA CYS 30 21.906 22.717 25.703
217 HB2 CYS 30 HB2 CYS 30 21.705 25.663 25.026
218 HB3 CYS 30 HB3 CYS 30 20.606 24.822 26.124
219 H HIS 31 H HIS 31 20.596 21.273 24.667
220 HA HIS 31 HA HIS 31 18.677 22.272 22.609
221 HB2 HIS 31 HB2 HIS 31 18.063 19.934 22.309
222 HB3 HIS 31 HB3 HIS 31 19.741 20.291 21.910
223 HD2 HIS 31 HD2 HIS 31 21.659 19.492 23.766
224 HE1 HIS 31 HE1 HIS 31 19.118 16.537 25.572
225 HE2 HIS 31 HE2 HIS 31 21.480 17.467 25.502
226 H GLY 32 H GLY 32 17.285 23.445 23.603
227 HA2 GLY 32 HA2 GLY 32 15.481 24.097 24.898
228 HA3 GLY 32 HA3 GLY 32 15.229 22.401 25.325
229 H THR 33 H THR 33 15.770 21.730 27.283
230 HA THR 33 HA THR 33 17.052 23.593 29.228
231 HB THR 33 HB THR 33 15.622 22.700 30.954
232 HG1 THR 33 HG1 THR 33 13.797 21.376 30.152
233 HG21 THR 33 HG21 THR 33 13.552 23.669 30.312
234 HG22 THR 33 HG22 THR 33 14.770 24.540 29.366
235 HG23 THR 33 HG23 THR 33 13.798 23.278 28.596
236 H LYS 34 H LYS 34 18.129 21.192 27.523
237 HA LYS 34 HA LYS 34 19.798 20.120 29.753
238 HB2 LYS 34 HB2 LYS 34 18.760 18.426 27.455
239 HB3 LYS 34 HB3 LYS 34 19.715 17.860 28.821
240 HG2 LYS 34 HG2 LYS 34 16.855 18.911 28.959
241 HG3 LYS 34 HG3 LYS 34 17.298 17.225 28.883
242 HD2 LYS 34 HD2 LYS 34 18.374 18.891 31.175
243 HD3 LYS 34 HD3 LYS 34 16.683 18.383 31.155
244 HE2 LYS 34 HE2 LYS 34 17.460 16.017 30.769
245 HE3 LYS 34 HE3 LYS 34 19.114 16.561 31.074
246 HZ1 LYS 34 HZ1 LYS 34 18.042 15.672 33.060
247 HZ2 LYS 34 HZ2 LYS 34 18.381 17.276 33.295
248 HZ3 LYS 34 HZ3 LYS 34 16.851 16.810 32.995
249 H CYS 35 H CYS 35 21.855 19.185 28.969
250 HA CYS 35 HA CYS 35 22.967 20.751 26.684
251 HB2 CYS 35 HB2 CYS 35 23.929 21.181 28.891
252 HB3 CYS 35 HB3 CYS 35 24.289 19.455 29.051
253 H LYS 36 H LYS 36 24.463 19.697 25.246
254 HA LYS 36 HA LYS 36 24.943 16.833 25.312
255 HB2 LYS 36 HB2 LYS 36 22.942 17.960 23.555
256 HB3 LYS 36 HB3 LYS 36 24.269 17.655 22.568
257 HG2 LYS 36 HG2 LYS 36 24.292 15.278 23.679
258 HG3 LYS 36 HG3 LYS 36 22.738 15.766 24.389
259 HD2 LYS 36 HD2 LYS 36 23.309 15.663 21.389
260 HD3 LYS 36 HD3 LYS 36 22.570 14.356 22.322
261 HE2 LYS 36 HE2 LYS 36 20.823 16.126 23.065
262 HE3 LYS 36 HE3 LYS 36 21.462 17.131 21.750
263 HZ1 LYS 36 HZ1 LYS 36 20.884 15.338 20.210
264 HZ2 LYS 36 HZ2 LYS 36 20.314 14.411 21.473
265 HZ3 LYS 36 HZ3 LYS 36 19.566 15.814 21.063
266 H CYS 37 H CYS 37 26.616 16.405 23.585
267 HA CYS 37 HA CYS 37 28.327 18.794 23.201
268 HB2 CYS 37 HB2 CYS 37 29.256 15.925 23.138
269 HB3 CYS 37 HB3 CYS 37 30.215 17.387 23.029
270 H GLY 38 H GLY 38 29.517 19.072 21.388
271 HA2 GLY 38 HA2 GLY 38 28.198 18.371 18.790
272 HA3 GLY 38 HA3 GLY 38 29.136 19.833 19.157
273 H VAL 39 H VAL 39 30.808 19.647 17.729
274 HA VAL 39 HA VAL 39 32.275 17.206 17.432
275 HB VAL 39 HB VAL 39 33.755 18.531 15.943
276 HG11 VAL 39 HG11 VAL 39 32.132 18.922 14.198
277 HG12 VAL 39 HG12 VAL 39 31.661 17.478 15.114
278 HG13 VAL 39 HG13 VAL 39 30.806 19.012 15.372
279 HG21 VAL 39 HG21 VAL 39 33.660 20.713 17.090
280 HG22 VAL 39 HG22 VAL 39 33.241 20.839 15.376
281 HG23 VAL 39 HG23 VAL 39 31.962 20.900 16.602
282 HA PRO 40 HA PRO 40 35.698 17.534 20.309
283 HB2 PRO 40 HB2 PRO 40 37.347 17.201 17.806
284 HB3 PRO 40 HB3 PRO 40 37.512 16.361 19.388
285 HG2 PRO 40 HG2 PRO 40 36.348 15.119 17.274
286 HG3 PRO 40 HG3 PRO 40 35.664 14.961 18.927
287 HD2 PRO 40 HD2 PRO 40 34.665 16.699 16.658
288 HD3 PRO 40 HD3 PRO 40 33.769 15.766 17.880
289 H ILE 41 H ILE 41 37.187 19.165 21.013
290 HA ILE 41 HA ILE 41 36.598 21.718 20.020
291 HB ILE 41 HB ILE 41 38.269 22.600 21.597
292 HG12 ILE 41 HG12 ILE 41 39.056 20.921 23.380
293 HG13 ILE 41 HG13 ILE 41 38.881 19.677 22.147
294 HG21 ILE 41 HG21 ILE 41 35.916 22.149 22.163
295 HG22 ILE 41 HG22 ILE 41 36.374 20.528 22.721
296 HG23 ILE 41 HG23 ILE 41 36.992 21.966 23.549
297 HD11 ILE 41 HD11 ILE 41 41.200 20.626 22.484
298 HD12 ILE 41 HD12 ILE 41 40.635 20.682 20.821
299 HD13 ILE 41 HD13 ILE 41 40.615 22.162 21.811
300 H SER 42 H SER 42 39.316 19.779 19.010
301 HA SER 42 HA SER 42 39.869 21.637 16.882
302 HB2 SER 42 HB2 SER 42 41.122 22.373 19.126
303 HB3 SER 42 HB3 SER 42 42.271 21.118 18.651
304 HG SER 42 HG SER 42 42.459 23.448 17.934
305 H TYR 43 H TYR 43 39.024 18.995 17.036
306 HA TYR 43 HA TYR 43 41.262 17.401 15.852
307 HB2 TYR 43 HB2 TYR 43 39.416 16.190 17.907
308 HB3 TYR 43 HB3 TYR 43 40.891 15.528 17.246
309 HD1 TYR 43 HD1 TYR 43 43.031 17.214 17.579
310 HD2 TYR 43 HD2 TYR 43 39.571 16.951 20.145
311 HE1 TYR 43 HE1 TYR 43 44.295 18.295 19.422
312 HE2 TYR 43 HE2 TYR 43 40.861 18.010 21.986
313 HH TYR 43 HH TYR 43 42.911 18.796 22.654
314 H LEU 44 H LEU 44 38.646 18.693 14.886
315 HA LEU 44 HA LEU 44 38.167 16.749 12.810
316 HB2 LEU 44 HB2 LEU 44 36.600 15.894 14.558
317 HB3 LEU 44 HB3 LEU 44 35.869 17.498 14.677
318 HG LEU 44 HG LEU 44 35.075 17.315 12.336
319 HD11 LEU 44 HD11 LEU 44 36.769 15.798 11.375
320 HD12 LEU 44 HD12 LEU 44 35.165 15.099 11.200
321 HD13 LEU 44 HD13 LEU 44 36.245 14.498 12.469
322 HD21 LEU 44 HD21 LEU 44 33.699 16.548 14.251
323 HD22 LEU 44 HD22 LEU 44 34.346 14.908 14.028
324 HD23 LEU 44 HD23 LEU 44 33.359 15.663 12.760
Start of MODEL 3
1 H1 ALA 1 H1 ALA 1 27.774 20.383 37.251
2 H2 ALA 1 H2 ALA 1 26.655 21.574 37.314
3 H3 ALA 1 H3 ALA 1 27.431 21.252 35.902
4 HA ALA 1 HA ALA 1 25.271 20.367 35.713
5 HB1 ALA 1 HB1 ALA 1 27.059 18.997 34.687
6 HB2 ALA 1 HB2 ALA 1 27.295 18.136 36.218
7 HB3 ALA 1 HB3 ALA 1 25.768 17.978 35.332
8 H LYS 2 H LYS 2 23.634 20.554 37.110
9 HA LYS 2 HA LYS 2 23.577 18.809 39.562
10 HB2 LYS 2 HB2 LYS 2 23.707 21.115 40.241
11 HB3 LYS 2 HB3 LYS 2 22.470 21.593 39.070
12 HG2 LYS 2 HG2 LYS 2 20.770 20.285 40.341
13 HG3 LYS 2 HG3 LYS 2 22.024 19.791 41.490
14 HD2 LYS 2 HD2 LYS 2 20.603 21.605 42.345
15 HD3 LYS 2 HD3 LYS 2 22.296 22.114 42.219
16 HE2 LYS 2 HE2 LYS 2 21.881 23.418 40.268
17 HE3 LYS 2 HE3 LYS 2 20.286 22.688 40.002
18 HZ1 LYS 2 HZ1 LYS 2 20.346 24.976 41.078
19 HZ2 LYS 2 HZ2 LYS 2 19.391 23.856 41.784
20 HZ3 LYS 2 HZ3 LYS 2 20.845 24.224 42.464
21 H ASN 3 H ASN 3 21.588 20.302 37.008
22 HA ASN 3 HA ASN 3 19.966 17.875 36.761
23 HB2 ASN 3 HB2 ASN 3 17.828 19.074 37.172
24 HB3 ASN 3 HB3 ASN 3 18.806 18.862 38.623
25 HD21 ASN 3 HD21 ASN 3 17.466 22.249 38.891
26 HD22 ASN 3 HD22 ASN 3 16.978 20.589 39.218
27 H GLN 4 H GLN 4 20.445 21.224 35.772
28 HA GLN 4 HA GLN 4 19.321 20.591 33.079
29 HB2 GLN 4 HB2 GLN 4 18.441 22.793 33.004
30 HB3 GLN 4 HB3 GLN 4 18.006 22.105 34.566
31 HG2 GLN 4 HG2 GLN 4 19.988 23.342 35.580
32 HG3 GLN 4 HG3 GLN 4 20.232 24.116 34.009
33 HE21 GLN 4 HE21 GLN 4 18.169 25.243 33.096
34 HE22 GLN 4 HE22 GLN 4 17.307 26.179 34.325
35 H PHE 5 H PHE 5 22.328 20.892 34.287
36 HA PHE 5 HA PHE 5 24.345 21.626 33.595
37 HB2 PHE 5 HB2 PHE 5 23.140 21.375 30.823
38 HB3 PHE 5 HB3 PHE 5 24.853 21.464 31.195
39 HD1 PHE 5 HD1 PHE 5 26.086 19.593 32.081
40 HD2 PHE 5 HD2 PHE 5 21.814 19.348 31.552
41 HE1 PHE 5 HE1 PHE 5 26.167 17.142 32.463
42 HE2 PHE 5 HE2 PHE 5 21.898 16.916 32.019
43 HZ PHE 5 HZ PHE 5 24.083 15.801 32.439
44 H GLY 6 H GLY 6 22.288 23.750 34.128
45 HA2 GLY 6 HA2 GLY 6 22.357 26.065 34.207
46 HA3 GLY 6 HA3 GLY 6 23.775 26.073 33.167
47 H CYS 7 H CYS 7 21.636 24.197 31.501
48 HA CYS 7 HA CYS 7 20.976 26.293 29.588
49 HB2 CYS 7 HB2 CYS 7 20.381 23.311 29.688
50 HB3 CYS 7 HB3 CYS 7 19.943 24.356 28.365
51 H PHE 8 H PHE 8 19.047 27.220 29.241
52 HA PHE 8 HA PHE 8 16.595 25.729 29.858
53 HB2 PHE 8 HB2 PHE 8 16.961 27.000 31.914
54 HB3 PHE 8 HB3 PHE 8 17.042 28.505 31.000
55 HD1 PHE 8 HD1 PHE 8 15.039 29.633 30.280
56 HD2 PHE 8 HD2 PHE 8 14.837 25.693 32.031
57 HE1 PHE 8 HE1 PHE 8 12.538 29.752 30.293
58 HE2 PHE 8 HE2 PHE 8 12.360 25.811 32.030
59 HZ PHE 8 HZ PHE 8 11.216 27.806 31.130
60 H ALA 9 H ALA 9 15.070 25.993 28.284
61 HA ALA 9 HA ALA 9 14.312 26.459 26.216
62 HB1 ALA 9 HB1 ALA 9 13.249 28.174 27.605
63 HB2 ALA 9 HB2 ALA 9 14.576 29.302 27.244
64 HB3 ALA 9 HB3 ALA 9 13.499 28.745 25.943
65 H ASN 10 H ASN 10 16.695 25.649 25.759
66 HA ASN 10 HA ASN 10 18.537 25.606 24.477
67 HB2 ASN 10 HB2 ASN 10 17.018 27.577 22.732
68 HB3 ASN 10 HB3 ASN 10 18.405 26.630 22.222
69 HD21 ASN 10 HD21 ASN 10 15.618 25.014 20.903
70 HD22 ASN 10 HD22 ASN 10 16.437 26.568 20.724
71 H VAL 11 H VAL 11 18.284 28.208 26.427
72 HA VAL 11 HA VAL 11 20.818 29.444 25.414
73 HB VAL 11 HB VAL 11 18.709 30.728 27.179
74 HG11 VAL 11 HG11 VAL 11 20.967 31.681 27.545
75 HG12 VAL 11 HG12 VAL 11 21.184 31.869 25.790
76 HG13 VAL 11 HG13 VAL 11 19.959 32.817 26.654
77 HG21 VAL 11 HG21 VAL 11 18.223 32.149 25.202
78 HG22 VAL 11 HG22 VAL 11 19.334 31.163 24.223
79 HG23 VAL 11 HG23 VAL 11 17.847 30.460 24.877
80 H ASP 12 H ASP 12 22.555 29.573 26.676
81 HA ASP 12 HA ASP 12 22.635 28.271 29.298
82 HB2 ASP 12 HB2 ASP 12 25.031 28.946 29.189
83 HB3 ASP 12 HB3 ASP 12 24.482 27.869 27.915
84 H VAL 13 H VAL 13 20.837 29.780 29.958
85 HA VAL 13 HA VAL 13 21.612 32.493 30.816
86 HB VAL 13 HB VAL 13 19.290 32.250 32.071
87 HG11 VAL 13 HG11 VAL 13 19.445 32.457 29.059
88 HG12 VAL 13 HG12 VAL 13 18.157 33.079 30.106
89 HG13 VAL 13 HG13 VAL 13 19.784 33.774 30.204
90 HG21 VAL 13 HG21 VAL 13 19.028 29.792 31.582
91 HG22 VAL 13 HG22 VAL 13 17.693 30.826 31.053
92 HG23 VAL 13 HG23 VAL 13 18.847 30.218 29.860
93 H LYS 14 H LYS 14 21.070 29.371 32.440
94 HA LYS 14 HA LYS 14 21.826 30.565 35.070
95 HB2 LYS 14 HB2 LYS 14 21.044 27.696 34.490
96 HB3 LYS 14 HB3 LYS 14 21.147 28.484 36.053
97 HG2 LYS 14 HG2 LYS 14 19.095 29.000 33.862
98 HG3 LYS 14 HG3 LYS 14 18.838 28.108 35.345
99 HD2 LYS 14 HD2 LYS 14 19.397 31.085 35.102
100 HD3 LYS 14 HD3 LYS 14 17.854 30.335 35.493
101 HE2 LYS 14 HE2 LYS 14 20.372 30.364 37.185
102 HE3 LYS 14 HE3 LYS 14 18.886 31.251 37.503
103 HZ1 LYS 14 HZ1 LYS 14 17.771 29.078 37.798
104 HZ2 LYS 14 HZ2 LYS 14 19.205 28.293 37.598
105 HZ3 LYS 14 HZ3 LYS 14 18.988 29.290 38.874
106 H GLY 15 H GLY 15 23.319 28.791 32.501
107 HA2 GLY 15 HA2 GLY 15 25.925 29.452 33.216
108 HA3 GLY 15 HA3 GLY 15 25.655 27.869 33.962
109 H ASP 16 H ASP 16 27.608 28.169 32.006
110 HA ASP 16 HA ASP 16 26.510 27.301 29.440
111 HB2 ASP 16 HB2 ASP 16 28.661 27.292 28.570
112 HB3 ASP 16 HB3 ASP 16 28.552 28.700 29.610
113 H CYS 17 H CYS 17 26.497 25.403 28.497
114 HA CYS 17 HA CYS 17 26.782 22.930 30.126
115 HB2 CYS 17 HB2 CYS 17 24.888 22.496 29.051
116 HB3 CYS 17 HB3 CYS 17 25.014 23.974 28.142
117 H LYS 18 H LYS 18 28.365 24.687 27.527
118 HA LYS 18 HA LYS 18 29.927 22.629 26.422
119 HB2 LYS 18 HB2 LYS 18 29.702 24.926 25.556
120 HB3 LYS 18 HB3 LYS 18 30.775 25.518 26.820
121 HG2 LYS 18 HG2 LYS 18 31.744 23.194 25.154
122 HG3 LYS 18 HG3 LYS 18 31.567 24.730 24.322
123 HD2 LYS 18 HD2 LYS 18 33.076 24.635 26.940
124 HD3 LYS 18 HD3 LYS 18 33.864 24.043 25.478
125 HE2 LYS 18 HE2 LYS 18 32.500 26.760 25.503
126 HE3 LYS 18 HE3 LYS 18 34.126 26.572 26.160
127 HZ1 LYS 18 HZ1 LYS 18 34.907 25.776 24.095
128 HZ2 LYS 18 HZ2 LYS 18 33.416 25.762 23.381
129 HZ3 LYS 18 HZ3 LYS 18 34.169 27.182 23.815
130 H ARG 19 H ARG 19 30.614 24.280 29.539
131 HA ARG 19 HA ARG 19 33.083 23.004 30.073
132 HB2 ARG 19 HB2 ARG 19 31.175 24.552 31.534
133 HB3 ARG 19 HB3 ARG 19 31.306 23.060 32.421
134 HG2 ARG 19 HG2 ARG 19 32.895 24.593 33.335
135 HG3 ARG 19 HG3 ARG 19 33.791 23.328 32.500
136 HD2 ARG 19 HD2 ARG 19 34.812 25.455 32.055
137 HD3 ARG 19 HD3 ARG 19 34.122 24.863 30.550
138 HE ARG 19 HE ARG 19 32.161 26.413 30.987
139 HH11 ARG 19 HH11 ARG 19 35.317 27.286 32.342
140 HH12 ARG 19 HH12 ARG 19 34.843 28.977 32.409
141 HH21 ARG 19 HH21 ARG 19 31.688 28.517 31.318
142 HH22 ARG 19 HH22 ARG 19 32.948 29.638 31.842
143 H HIS 20 H HIS 20 29.885 21.433 30.263
144 HA HIS 20 HA HIS 20 31.015 19.025 31.507
145 HB2 HIS 20 HB2 HIS 20 28.781 19.407 32.065
146 HB3 HIS 20 HB3 HIS 20 28.325 19.846 30.424
147 HD2 HIS 20 HD2 HIS 20 27.462 18.064 28.826
148 HE1 HIS 20 HE1 HIS 20 28.158 14.572 31.176
149 HE2 HIS 20 HE2 HIS 20 27.168 15.439 28.993
150 H CYS 21 H CYS 21 30.497 20.122 28.214
151 HA CYS 21 HA CYS 21 31.239 17.562 26.986
152 HB2 CYS 21 HB2 CYS 21 30.706 20.392 26.028
153 HB3 CYS 21 HB3 CYS 21 31.163 19.155 24.913
154 H LYS 22 H LYS 22 32.967 20.598 27.746
155 HA LYS 22 HA LYS 22 35.354 20.170 26.372
156 HB2 LYS 22 HB2 LYS 22 34.458 22.213 27.588
157 HB3 LYS 22 HB3 LYS 22 34.979 21.480 29.114
158 HG2 LYS 22 HG2 LYS 22 37.337 21.527 28.293
159 HG3 LYS 22 HG3 LYS 22 36.759 22.190 26.748
160 HD2 LYS 22 HD2 LYS 22 35.701 24.091 28.154
161 HD3 LYS 22 HD3 LYS 22 36.707 23.506 29.502
162 HE2 LYS 22 HE2 LYS 22 38.731 23.807 28.121
163 HE3 LYS 22 HE3 LYS 22 37.718 24.198 26.724
164 HZ1 LYS 22 HZ1 LYS 22 36.899 26.156 27.994
165 HZ2 LYS 22 HZ2 LYS 22 38.012 25.879 29.160
166 HZ3 LYS 22 HZ3 LYS 22 38.521 26.238 27.657
167 H ALA 23 H ALA 23 34.377 18.825 29.474
168 HA ALA 23 HA ALA 23 36.903 17.726 30.259
169 HB1 ALA 23 HB1 ALA 23 35.036 18.146 31.783
170 HB2 ALA 23 HB2 ALA 23 34.032 16.964 30.917
171 HB3 ALA 23 HB3 ALA 23 35.473 16.428 31.822
172 H GLU 24 H GLU 24 34.745 16.691 27.749
173 HA GLU 24 HA GLU 24 36.218 14.093 27.467
174 HB2 GLU 24 HB2 GLU 24 33.358 14.692 26.632
175 HB3 GLU 24 HB3 GLU 24 34.252 13.195 26.338
176 HG2 GLU 24 HG2 GLU 24 34.554 12.997 28.866
177 HG3 GLU 24 HG3 GLU 24 33.400 14.321 29.027
178 H ASP 25 H ASP 25 36.725 16.943 26.429
179 HA ASP 25 HA ASP 25 37.441 18.006 24.573
180 HB2 ASP 25 HB2 ASP 25 39.174 16.389 24.493
181 HB3 ASP 25 HB3 ASP 25 38.136 15.176 23.762
182 H LYS 26 H LYS 26 35.026 18.371 24.659
183 HA LYS 26 HA LYS 26 33.975 18.267 21.879
184 HB2 LYS 26 HB2 LYS 26 32.383 17.585 24.384
185 HB3 LYS 26 HB3 LYS 26 31.728 17.755 22.762
186 HG2 LYS 26 HG2 LYS 26 33.691 15.633 23.677
187 HG3 LYS 26 HG3 LYS 26 31.951 15.423 23.610
188 HD2 LYS 26 HD2 LYS 26 31.827 15.662 21.283
189 HD3 LYS 26 HD3 LYS 26 33.474 16.269 21.109
190 HE2 LYS 26 HE2 LYS 26 32.699 13.451 21.999
191 HE3 LYS 26 HE3 LYS 26 33.333 13.906 20.411
192 HZ1 LYS 26 HZ1 LYS 26 35.163 13.114 21.698
193 HZ2 LYS 26 HZ2 LYS 26 35.353 14.742 21.628
194 HZ3 LYS 26 HZ3 LYS 26 34.808 14.080 22.990
195 H GLU 27 H GLU 27 32.762 19.982 21.270
196 HA GLU 27 HA GLU 27 32.414 22.324 23.014
197 HB2 GLU 27 HB2 GLU 27 31.528 21.602 20.201
198 HB3 GLU 27 HB3 GLU 27 31.031 23.086 20.994
199 HG2 GLU 27 HG2 GLU 27 33.950 22.305 20.572
200 HG3 GLU 27 HG3 GLU 27 33.013 23.259 19.423
201 H GLY 28 H GLY 28 30.221 23.014 23.572
202 HA2 GLY 28 HA2 GLY 28 28.120 20.888 23.630
203 HA3 GLY 28 HA3 GLY 28 28.548 21.690 25.128
204 H ILE 29 H ILE 29 25.949 21.588 23.770
205 HA ILE 29 HA ILE 29 25.343 24.453 23.542
206 HB ILE 29 HB ILE 29 26.095 23.825 21.342
207 HG12 ILE 29 HG12 ILE 29 24.133 25.403 21.752
208 HG13 ILE 29 HG13 ILE 29 24.573 24.928 20.121
209 HG21 ILE 29 HG21 ILE 29 24.889 22.273 19.857
210 HG22 ILE 29 HG22 ILE 29 25.740 21.475 21.175
211 HG23 ILE 29 HG23 ILE 29 23.978 21.672 21.259
212 HD11 ILE 29 HD11 ILE 29 22.293 23.598 21.620
213 HD12 ILE 29 HD12 ILE 29 22.102 24.995 20.541
214 HD13 ILE 29 HD13 ILE 29 22.701 23.455 19.902
215 H CYS 30 H CYS 30 23.152 24.938 24.000
216 HA CYS 30 HA CYS 30 21.897 22.867 25.624
217 HB2 CYS 30 HB2 CYS 30 21.112 25.724 25.048
218 HB3 CYS 30 HB3 CYS 30 20.307 24.665 26.206
219 H HIS 31 H HIS 31 20.533 21.423 24.919
220 HA HIS 31 HA HIS 31 18.532 22.086 22.776
221 HB2 HIS 31 HB2 HIS 31 19.905 19.481 23.459
222 HB3 HIS 31 HB3 HIS 31 18.299 19.496 22.739
223 HD2 HIS 31 HD2 HIS 31 21.764 21.095 21.849
224 HE1 HIS 31 HE1 HIS 31 19.842 20.035 18.207
225 HE2 HIS 31 HE2 HIS 31 21.944 21.030 19.204
226 H GLY 32 H GLY 32 16.984 23.016 23.940
227 HA2 GLY 32 HA2 GLY 32 15.161 23.204 25.328
228 HA3 GLY 32 HA3 GLY 32 15.352 21.521 25.807
229 H THR 33 H THR 33 15.897 21.194 27.797
230 HA THR 33 HA THR 33 17.303 23.224 29.495
231 HB THR 33 HB THR 33 16.110 22.357 31.410
232 HG1 THR 33 HG1 THR 33 14.966 20.601 29.493
233 HG21 THR 33 HG21 THR 33 13.883 23.208 30.938
234 HG22 THR 33 HG22 THR 33 15.068 24.212 30.110
235 HG23 THR 33 HG23 THR 33 14.135 23.025 29.190
236 H LYS 34 H LYS 34 18.294 20.930 27.760
237 HA LYS 34 HA LYS 34 20.203 19.716 29.692
238 HB2 LYS 34 HB2 LYS 34 18.567 18.422 27.464
239 HB3 LYS 34 HB3 LYS 34 19.960 17.635 28.182
240 HG2 LYS 34 HG2 LYS 34 17.479 18.494 29.748
241 HG3 LYS 34 HG3 LYS 34 17.798 16.876 29.105
242 HD2 LYS 34 HD2 LYS 34 19.994 16.926 30.442
243 HD3 LYS 34 HD3 LYS 34 19.334 18.319 31.316
244 HE2 LYS 34 HE2 LYS 34 17.593 15.903 30.979
245 HE3 LYS 34 HE3 LYS 34 19.010 15.708 32.029
246 HZ1 LYS 34 HZ1 LYS 34 17.081 16.368 33.287
247 HZ2 LYS 34 HZ2 LYS 34 18.200 17.561 33.377
248 HZ3 LYS 34 HZ3 LYS 34 16.876 17.732 32.415
249 H CYS 35 H CYS 35 22.030 18.609 28.438
250 HA CYS 35 HA CYS 35 23.167 20.646 26.576
251 HB2 CYS 35 HB2 CYS 35 24.158 20.318 28.864
252 HB3 CYS 35 HB3 CYS 35 24.552 18.666 28.402
253 H LYS 36 H LYS 36 24.053 20.061 24.648
254 HA LYS 36 HA LYS 36 24.142 17.193 23.797
255 HB2 LYS 36 HB2 LYS 36 22.232 18.425 22.793
256 HB3 LYS 36 HB3 LYS 36 23.328 19.729 22.352
257 HG2 LYS 36 HG2 LYS 36 22.928 18.595 20.345
258 HG3 LYS 36 HG3 LYS 36 24.552 18.155 20.834
259 HD2 LYS 36 HD2 LYS 36 23.541 16.190 20.024
260 HD3 LYS 36 HD3 LYS 36 23.575 16.008 21.785
261 HE2 LYS 36 HE2 LYS 36 21.183 16.644 21.903
262 HE3 LYS 36 HE3 LYS 36 21.156 16.916 20.150
263 HZ1 LYS 36 HZ1 LYS 36 21.739 14.332 21.472
264 HZ2 LYS 36 HZ2 LYS 36 20.304 14.696 20.779
265 HZ3 LYS 36 HZ3 LYS 36 21.667 14.548 19.846
266 H CYS 37 H CYS 37 26.207 16.658 23.452
267 HA CYS 37 HA CYS 37 28.279 18.670 23.017
268 HB2 CYS 37 HB2 CYS 37 28.494 15.688 23.120
269 HB3 CYS 37 HB3 CYS 37 29.834 16.808 22.993
270 H GLY 38 H GLY 38 29.506 19.112 21.360
271 HA2 GLY 38 HA2 GLY 38 28.620 18.330 18.610
272 HA3 GLY 38 HA3 GLY 38 29.302 19.888 19.103
273 H VAL 39 H VAL 39 30.941 19.819 17.560
274 HA VAL 39 HA VAL 39 32.853 17.734 17.278
275 HB VAL 39 HB VAL 39 34.292 19.540 16.257
276 HG11 VAL 39 HG11 VAL 39 31.480 19.207 15.195
277 HG12 VAL 39 HG12 VAL 39 32.892 19.750 14.264
278 HG13 VAL 39 HG13 VAL 39 32.852 18.109 14.942
279 HG21 VAL 39 HG21 VAL 39 33.474 21.494 17.496
280 HG22 VAL 39 HG22 VAL 39 33.322 21.710 15.747
281 HG23 VAL 39 HG23 VAL 39 31.888 21.343 16.713
282 HA PRO 40 HA PRO 40 35.627 18.150 20.613
283 HB2 PRO 40 HB2 PRO 40 38.104 17.574 19.527
284 HB3 PRO 40 HB3 PRO 40 36.824 16.359 19.826
285 HG2 PRO 40 HG2 PRO 40 37.443 17.825 17.263
286 HG3 PRO 40 HG3 PRO 40 37.171 16.066 17.489
287 HD2 PRO 40 HD2 PRO 40 35.176 17.662 16.613
288 HD3 PRO 40 HD3 PRO 40 34.819 16.403 17.818
289 H ILE 41 H ILE 41 37.124 19.446 21.689
290 HA ILE 41 HA ILE 41 37.278 22.174 20.639
291 HB ILE 41 HB ILE 41 38.183 22.773 22.816
292 HG12 ILE 41 HG12 ILE 41 37.856 21.112 24.728
293 HG13 ILE 41 HG13 ILE 41 37.875 19.848 23.504
294 HG21 ILE 41 HG21 ILE 41 36.092 22.510 24.033
295 HG22 ILE 41 HG22 ILE 41 35.751 22.766 22.315
296 HG23 ILE 41 HG23 ILE 41 35.641 21.134 23.008
297 HD11 ILE 41 HD11 ILE 41 40.051 20.203 24.711
298 HD12 ILE 41 HD12 ILE 41 40.217 20.380 22.965
299 HD13 ILE 41 HD13 ILE 41 40.152 21.824 23.998
300 H SER 42 H SER 42 39.239 19.492 20.488
301 HA SER 42 HA SER 42 41.803 20.765 20.461
302 HB2 SER 42 HB2 SER 42 40.952 18.040 19.443
303 HB3 SER 42 HB3 SER 42 42.612 18.603 19.740
304 HG SER 42 HG SER 42 40.510 18.209 21.637
305 H TYR 43 H TYR 43 41.251 22.519 18.981
306 HA TYR 43 HA TYR 43 40.882 21.994 16.099
307 HB2 TYR 43 HB2 TYR 43 41.458 24.598 17.570
308 HB3 TYR 43 HB3 TYR 43 40.980 24.449 15.890
309 HD1 TYR 43 HD1 TYR 43 38.649 23.730 15.294
310 HD2 TYR 43 HD2 TYR 43 39.846 24.555 19.346
311 HE1 TYR 43 HE1 TYR 43 36.263 23.833 15.975
312 HE2 TYR 43 HE2 TYR 43 37.459 24.627 20.030
313 HH TYR 43 HH TYR 43 35.265 24.435 19.367
314 H LEU 44 H LEU 44 43.509 23.175 18.182
315 HA LEU 44 HA LEU 44 45.594 22.751 16.158
316 HB2 LEU 44 HB2 LEU 44 46.250 25.127 16.059
317 HB3 LEU 44 HB3 LEU 44 44.672 24.824 15.386
318 HG LEU 44 HG LEU 44 43.627 25.746 17.490
319 HD11 LEU 44 HD11 LEU 44 45.425 25.572 19.102
320 HD12 LEU 44 HD12 LEU 44 46.517 26.526 18.069
321 HD13 LEU 44 HD13 LEU 44 45.097 27.278 18.828
322 HD21 LEU 44 HD21 LEU 44 43.890 27.056 15.434
323 HD22 LEU 44 HD22 LEU 44 44.093 28.075 16.860
324 HD23 LEU 44 HD23 LEU 44 45.521 27.551 15.934
Start of MODEL 4
1 H1 ALA 1 H1 ALA 1 28.480 20.586 36.003
2 H2 ALA 1 H2 ALA 1 28.313 18.977 36.311
3 H3 ALA 1 H3 ALA 1 28.092 20.058 37.526
4 HA ALA 1 HA ALA 1 26.173 20.986 36.416
5 HB1 ALA 1 HB1 ALA 1 26.837 20.400 34.108
6 HB2 ALA 1 HB2 ALA 1 26.592 18.677 34.471
7 HB3 ALA 1 HB3 ALA 1 25.220 19.790 34.500
8 H LYS 2 H LYS 2 24.086 20.235 37.067
9 HA LYS 2 HA LYS 2 24.153 17.708 38.693
10 HB2 LYS 2 HB2 LYS 2 24.753 19.803 39.941
11 HB3 LYS 2 HB3 LYS 2 23.164 20.460 39.533
12 HG2 LYS 2 HG2 LYS 2 22.079 18.639 40.827
13 HG3 LYS 2 HG3 LYS 2 23.656 17.896 41.106
14 HD2 LYS 2 HD2 LYS 2 23.002 19.125 43.106
15 HD3 LYS 2 HD3 LYS 2 24.397 19.897 42.362
16 HE2 LYS 2 HE2 LYS 2 22.930 21.641 43.027
17 HE3 LYS 2 HE3 LYS 2 22.850 21.564 41.269
18 HZ1 LYS 2 HZ1 LYS 2 20.876 20.204 43.025
19 HZ2 LYS 2 HZ2 LYS 2 20.641 21.730 42.454
20 HZ3 LYS 2 HZ3 LYS 2 20.746 20.444 41.435
21 H ASN 3 H ASN 3 22.095 20.032 36.954
22 HA ASN 3 HA ASN 3 19.922 17.962 36.896
23 HB2 ASN 3 HB2 ASN 3 19.623 20.899 37.674
24 HB3 ASN 3 HB3 ASN 3 18.278 19.856 37.216
25 HD21 ASN 3 HD21 ASN 3 18.275 18.002 40.271
26 HD22 ASN 3 HD22 ASN 3 17.899 17.891 38.545
27 H GLN 4 H GLN 4 20.936 21.150 35.526
28 HA GLN 4 HA GLN 4 19.653 20.328 32.951
29 HB2 GLN 4 HB2 GLN 4 18.742 22.460 32.749
30 HB3 GLN 4 HB3 GLN 4 18.330 21.817 34.329
31 HG2 GLN 4 HG2 GLN 4 20.266 23.276 35.257
32 HG3 GLN 4 HG3 GLN 4 20.272 24.044 33.640
33 HE21 GLN 4 HE21 GLN 4 16.776 24.726 33.972
34 HE22 GLN 4 HE22 GLN 4 18.043 24.590 32.788
35 H PHE 5 H PHE 5 22.679 20.795 34.082
36 HA PHE 5 HA PHE 5 24.666 21.520 33.272
37 HB2 PHE 5 HB2 PHE 5 23.421 21.287 30.537
38 HB3 PHE 5 HB3 PHE 5 25.134 21.273 30.927
39 HD1 PHE 5 HD1 PHE 5 21.991 19.334 30.964
40 HD2 PHE 5 HD2 PHE 5 26.209 19.251 31.835
41 HE1 PHE 5 HE1 PHE 5 21.923 16.850 31.148
42 HE2 PHE 5 HE2 PHE 5 26.111 16.784 32.061
43 HZ PHE 5 HZ PHE 5 23.933 15.586 31.712
44 H GLY 6 H GLY 6 22.789 23.544 34.057
45 HA2 GLY 6 HA2 GLY 6 22.552 25.842 34.026
46 HA3 GLY 6 HA3 GLY 6 23.910 25.907 32.903
47 H CYS 7 H CYS 7 21.851 23.976 31.240
48 HA CYS 7 HA CYS 7 21.045 26.120 29.469
49 HB2 CYS 7 HB2 CYS 7 20.499 23.133 29.423
50 HB3 CYS 7 HB3 CYS 7 20.030 24.236 28.159
51 H PHE 8 H PHE 8 19.145 27.033 29.145
52 HA PHE 8 HA PHE 8 16.687 25.474 29.567
53 HB2 PHE 8 HB2 PHE 8 16.947 26.644 31.752
54 HB3 PHE 8 HB3 PHE 8 16.968 28.181 30.911
55 HD1 PHE 8 HD1 PHE 8 14.954 29.147 29.934
56 HD2 PHE 8 HD2 PHE 8 14.894 25.305 31.888
57 HE1 PHE 8 HE1 PHE 8 12.460 29.097 29.786
58 HE2 PHE 8 HE2 PHE 8 12.410 25.270 31.765
59 HZ PHE 8 HZ PHE 8 11.203 27.144 30.693
60 H ALA 9 H ALA 9 15.079 25.985 28.053
61 HA ALA 9 HA ALA 9 14.354 26.648 26.028
62 HB1 ALA 9 HB1 ALA 9 13.786 29.029 25.874
63 HB2 ALA 9 HB2 ALA 9 13.425 28.367 27.474
64 HB3 ALA 9 HB3 ALA 9 14.870 29.388 27.237
65 H ASN 10 H ASN 10 16.730 25.680 25.593
66 HA ASN 10 HA ASN 10 18.616 25.624 24.373
67 HB2 ASN 10 HB2 ASN 10 17.118 27.557 22.559
68 HB3 ASN 10 HB3 ASN 10 18.498 26.564 22.095
69 HD21 ASN 10 HD21 ASN 10 15.852 24.881 20.732
70 HD22 ASN 10 HD22 ASN 10 16.591 26.463 20.525
71 H VAL 11 H VAL 11 18.597 27.962 26.460
72 HA VAL 11 HA VAL 11 21.006 29.354 25.343
73 HB VAL 11 HB VAL 11 18.761 30.555 26.997
74 HG11 VAL 11 HG11 VAL 11 21.317 31.855 25.915
75 HG12 VAL 11 HG12 VAL 11 19.945 32.725 26.627
76 HG13 VAL 11 HG13 VAL 11 20.892 31.642 27.630
77 HG21 VAL 11 HG21 VAL 11 18.208 30.306 24.577
78 HG22 VAL 11 HG22 VAL 11 18.422 31.999 25.006
79 HG23 VAL 11 HG23 VAL 11 19.714 31.137 24.141
80 H ASP 12 H ASP 12 22.619 29.919 26.698
81 HA ASP 12 HA ASP 12 23.119 28.319 29.069
82 HB2 ASP 12 HB2 ASP 12 24.683 30.625 27.789
83 HB3 ASP 12 HB3 ASP 12 25.281 29.580 29.071
84 H VAL 13 H VAL 13 20.889 29.591 29.827
85 HA VAL 13 HA VAL 13 21.392 32.250 30.948
86 HB VAL 13 HB VAL 13 19.074 31.713 32.124
87 HG11 VAL 13 HG11 VAL 13 19.497 33.428 30.397
88 HG12 VAL 13 HG12 VAL 13 19.296 32.187 29.140
89 HG13 VAL 13 HG13 VAL 13 17.934 32.614 30.192
90 HG21 VAL 13 HG21 VAL 13 18.908 29.826 29.749
91 HG22 VAL 13 HG22 VAL 13 19.004 29.305 31.455
92 HG23 VAL 13 HG23 VAL 13 17.637 30.286 30.886
93 H LYS 14 H LYS 14 20.921 29.041 32.473
94 HA LYS 14 HA LYS 14 21.490 30.192 35.152
95 HB2 LYS 14 HB2 LYS 14 20.819 27.362 34.240
96 HB3 LYS 14 HB3 LYS 14 21.085 27.819 35.909
97 HG2 LYS 14 HG2 LYS 14 18.901 28.966 34.102
98 HG3 LYS 14 HG3 LYS 14 18.678 27.647 35.236
99 HD2 LYS 14 HD2 LYS 14 19.468 30.491 36.024
100 HD3 LYS 14 HD3 LYS 14 17.843 29.802 36.105
101 HE2 LYS 14 HE2 LYS 14 18.612 28.065 37.673
102 HE3 LYS 14 HE3 LYS 14 20.261 28.706 37.615
103 HZ1 LYS 14 HZ1 LYS 14 18.920 29.450 39.538
104 HZ2 LYS 14 HZ2 LYS 14 19.513 30.719 38.656
105 HZ3 LYS 14 HZ3 LYS 14 17.933 30.274 38.524
106 H GLY 15 H GLY 15 23.231 28.406 32.700
107 HA2 GLY 15 HA2 GLY 15 25.793 29.079 33.798
108 HA3 GLY 15 HA3 GLY 15 25.407 27.402 34.197
109 H ASP 16 H ASP 16 27.541 27.452 32.765
110 HA ASP 16 HA ASP 16 26.896 27.386 29.877
111 HB2 ASP 16 HB2 ASP 16 29.271 27.529 29.499
112 HB3 ASP 16 HB3 ASP 16 28.620 28.892 30.395
113 H CYS 17 H CYS 17 26.089 25.521 29.328
114 HA CYS 17 HA CYS 17 26.716 22.945 30.295
115 HB2 CYS 17 HB2 CYS 17 24.851 22.624 29.115
116 HB3 CYS 17 HB3 CYS 17 24.984 24.224 28.460
117 H LYS 18 H LYS 18 28.221 24.745 27.646
118 HA LYS 18 HA LYS 18 29.755 22.610 26.607
119 HB2 LYS 18 HB2 LYS 18 29.387 24.816 25.559
120 HB3 LYS 18 HB3 LYS 18 30.530 25.550 26.679
121 HG2 LYS 18 HG2 LYS 18 31.444 23.112 25.169
122 HG3 LYS 18 HG3 LYS 18 31.158 24.548 24.206
123 HD2 LYS 18 HD2 LYS 18 32.935 24.541 26.680
124 HD3 LYS 18 HD3 LYS 18 33.538 24.146 25.069
125 HE2 LYS 18 HE2 LYS 18 32.281 26.808 25.904
126 HE3 LYS 18 HE3 LYS 18 33.999 26.483 25.653
127 HZ1 LYS 18 HZ1 LYS 18 31.886 26.703 23.636
128 HZ2 LYS 18 HZ2 LYS 18 33.421 27.275 23.568
129 HZ3 LYS 18 HZ3 LYS 18 33.157 25.702 23.308
130 H ARG 19 H ARG 19 30.266 24.204 29.718
131 HA ARG 19 HA ARG 19 32.941 23.323 30.104
132 HB2 ARG 19 HB2 ARG 19 31.328 24.887 31.533
133 HB3 ARG 19 HB3 ARG 19 30.887 23.395 32.336
134 HG2 ARG 19 HG2 ARG 19 32.619 24.476 33.612
135 HG3 ARG 19 HG3 ARG 19 33.300 23.014 32.905
136 HD2 ARG 19 HD2 ARG 19 34.867 24.873 32.772
137 HD3 ARG 19 HD3 ARG 19 34.426 24.375 31.149
138 HE ARG 19 HE ARG 19 32.622 26.391 31.624
139 HH11 ARG 19 HH11 ARG 19 36.174 26.445 31.839
140 HH12 ARG 19 HH12 ARG 19 36.125 28.211 31.763
141 HH21 ARG 19 HH21 ARG 19 32.777 28.456 31.368
142 HH22 ARG 19 HH22 ARG 19 34.363 29.276 31.460
143 H HIS 20 H HIS 20 29.889 21.542 30.455
144 HA HIS 20 HA HIS 20 31.117 19.125 31.543
145 HB2 HIS 20 HB2 HIS 20 28.875 19.162 32.044
146 HB3 HIS 20 HB3 HIS 20 28.413 19.940 30.540
147 HD2 HIS 20 HD2 HIS 20 27.582 18.495 28.567
148 HE1 HIS 20 HE1 HIS 20 28.182 14.632 30.257
149 HE2 HIS 20 HE2 HIS 20 27.165 15.898 28.314
150 H CYS 21 H CYS 21 30.214 20.160 28.208
151 HA CYS 21 HA CYS 21 31.228 17.747 26.986
152 HB2 CYS 21 HB2 CYS 21 30.759 20.537 25.898
153 HB3 CYS 21 HB3 CYS 21 31.089 19.140 24.902
154 H LYS 22 H LYS 22 32.844 20.875 27.718
155 HA LYS 22 HA LYS 22 35.265 20.307 26.353
156 HB2 LYS 22 HB2 LYS 22 34.577 22.529 27.114
157 HB3 LYS 22 HB3 LYS 22 34.788 22.058 28.806
158 HG2 LYS 22 HG2 LYS 22 37.177 21.792 28.516
159 HG3 LYS 22 HG3 LYS 22 37.056 21.985 26.763
160 HD2 LYS 22 HD2 LYS 22 36.310 24.175 28.749
161 HD3 LYS 22 HD3 LYS 22 37.925 23.991 28.046
162 HE2 LYS 22 HE2 LYS 22 37.005 24.191 25.771
163 HE3 LYS 22 HE3 LYS 22 35.371 24.364 26.427
164 HZ1 LYS 22 HZ1 LYS 22 35.996 26.400 27.459
165 HZ2 LYS 22 HZ2 LYS 22 37.572 26.253 27.025
166 HZ3 LYS 22 HZ3 LYS 22 36.423 26.519 25.877
167 H ALA 23 H ALA 23 34.188 19.260 29.535
168 HA ALA 23 HA ALA 23 36.677 18.111 30.407
169 HB1 ALA 23 HB1 ALA 23 33.798 17.417 31.127
170 HB2 ALA 23 HB2 ALA 23 35.243 16.975 32.053
171 HB3 ALA 23 HB3 ALA 23 34.777 18.680 31.901
172 H GLU 24 H GLU 24 34.258 16.988 28.092
173 HA GLU 24 HA GLU 24 35.528 14.304 27.895
174 HB2 GLU 24 HB2 GLU 24 33.173 15.333 26.283
175 HB3 GLU 24 HB3 GLU 24 33.755 13.679 26.469
176 HG2 GLU 24 HG2 GLU 24 33.211 14.086 29.031
177 HG3 GLU 24 HG3 GLU 24 32.165 15.359 28.398
178 H ASP 25 H ASP 25 36.426 17.202 26.928
179 HA ASP 25 HA ASP 25 37.530 18.203 25.330
180 HB2 ASP 25 HB2 ASP 25 38.695 15.735 25.467
181 HB3 ASP 25 HB3 ASP 25 38.362 15.843 23.748
182 H LYS 26 H LYS 26 34.803 18.050 25.005
183 HA LYS 26 HA LYS 26 34.339 18.248 22.058
184 HB2 LYS 26 HB2 LYS 26 32.804 16.999 24.367
185 HB3 LYS 26 HB3 LYS 26 31.915 17.624 22.996
186 HG2 LYS 26 HG2 LYS 26 34.213 15.687 22.540
187 HG3 LYS 26 HG3 LYS 26 32.611 15.106 23.032
188 HD2 LYS 26 HD2 LYS 26 31.544 16.232 21.174
189 HD3 LYS 26 HD3 LYS 26 33.069 16.972 20.684
190 HE2 LYS 26 HE2 LYS 26 32.869 15.270 19.151
191 HE3 LYS 26 HE3 LYS 26 33.960 14.571 20.353
192 HZ1 LYS 26 HZ1 LYS 26 32.186 13.036 19.695
193 HZ2 LYS 26 HZ2 LYS 26 32.004 13.405 21.292
194 HZ3 LYS 26 HZ3 LYS 26 31.022 14.092 20.195
195 H GLU 27 H GLU 27 32.854 19.798 21.302
196 HA GLU 27 HA GLU 27 32.378 22.177 22.958
197 HB2 GLU 27 HB2 GLU 27 31.602 21.378 20.137
198 HB3 GLU 27 HB3 GLU 27 31.074 22.878 20.884
199 HG2 GLU 27 HG2 GLU 27 34.031 22.194 20.655
200 HG3 GLU 27 HG3 GLU 27 33.130 22.940 19.348
201 H GLY 28 H GLY 28 30.209 22.942 23.320
202 HA2 GLY 28 HA2 GLY 28 28.047 20.887 23.485
203 HA3 GLY 28 HA3 GLY 28 28.530 21.738 24.945
204 H ILE 29 H ILE 29 25.922 21.593 23.419
205 HA ILE 29 HA ILE 29 25.345 24.475 23.344
206 HB ILE 29 HB ILE 29 26.020 23.915 21.120
207 HG12 ILE 29 HG12 ILE 29 24.025 25.469 21.639
208 HG13 ILE 29 HG13 ILE 29 24.466 25.075 19.987
209 HG21 ILE 29 HG21 ILE 29 25.658 21.557 20.937
210 HG22 ILE 29 HG22 ILE 29 23.901 21.757 21.055
211 HG23 ILE 29 HG23 ILE 29 24.788 22.385 19.649
212 HD11 ILE 29 HD11 ILE 29 22.221 23.639 21.441
213 HD12 ILE 29 HD12 ILE 29 21.998 25.079 20.429
214 HD13 ILE 29 HD13 ILE 29 22.616 23.581 19.714
215 H CYS 30 H CYS 30 23.292 25.013 23.960
216 HA CYS 30 HA CYS 30 21.918 22.998 25.486
217 HB2 CYS 30 HB2 CYS 30 21.269 25.899 24.931
218 HB3 CYS 30 HB3 CYS 30 20.388 24.861 26.072
219 H HIS 31 H HIS 31 20.498 21.623 24.875
220 HA HIS 31 HA HIS 31 18.404 22.298 22.816
221 HB2 HIS 31 HB2 HIS 31 19.767 19.690 23.518
222 HB3 HIS 31 HB3 HIS 31 18.159 19.730 22.787
223 HD2 HIS 31 HD2 HIS 31 21.667 21.259 21.956
224 HE1 HIS 31 HE1 HIS 31 19.936 19.802 18.346
225 HE2 HIS 31 HE2 HIS 31 22.008 20.831 19.370
226 H GLY 32 H GLY 32 16.871 23.168 24.016
227 HA2 GLY 32 HA2 GLY 32 15.150 23.408 25.513
228 HA3 GLY 32 HA3 GLY 32 15.251 21.677 25.858
229 H THR 33 H THR 33 15.438 21.435 27.935
230 HA THR 33 HA THR 33 16.982 23.211 29.698
231 HB THR 33 HB THR 33 15.975 22.046 31.526
232 HG1 THR 33 HG1 THR 33 15.528 20.054 31.260
233 HG21 THR 33 HG21 THR 33 13.783 22.322 29.450
234 HG22 THR 33 HG22 THR 33 13.666 22.532 31.208
235 HG23 THR 33 HG23 THR 33 14.570 23.704 30.224
236 H LYS 34 H LYS 34 18.305 21.259 27.753
237 HA LYS 34 HA LYS 34 20.216 20.020 29.680
238 HB2 LYS 34 HB2 LYS 34 18.797 18.624 27.377
239 HB3 LYS 34 HB3 LYS 34 20.155 17.926 28.242
240 HG2 LYS 34 HG2 LYS 34 17.423 18.552 29.450
241 HG3 LYS 34 HG3 LYS 34 18.006 16.980 28.908
242 HD2 LYS 34 HD2 LYS 34 19.911 17.215 30.579
243 HD3 LYS 34 HD3 LYS 34 19.044 18.600 31.269
244 HE2 LYS 34 HE2 LYS 34 17.028 17.068 31.508
245 HE3 LYS 34 HE3 LYS 34 18.082 15.736 30.968
246 HZ1 LYS 34 HZ1 LYS 34 19.418 15.972 32.857
247 HZ2 LYS 34 HZ2 LYS 34 18.664 17.350 33.391
248 HZ3 LYS 34 HZ3 LYS 34 17.872 15.905 33.390
249 H CYS 35 H CYS 35 22.170 19.193 28.608
250 HA CYS 35 HA CYS 35 23.169 21.032 26.504
251 HB2 CYS 35 HB2 CYS 35 24.347 20.514 28.728
252 HB3 CYS 35 HB3 CYS 35 24.682 18.920 28.081
253 H LYS 36 H LYS 36 24.234 20.183 24.616
254 HA LYS 36 HA LYS 36 24.082 17.269 24.031
255 HB2 LYS 36 HB2 LYS 36 22.134 18.428 22.973
256 HB3 LYS 36 HB3 LYS 36 23.231 19.587 22.252
257 HG2 LYS 36 HG2 LYS 36 22.536 18.184 20.548
258 HG3 LYS 36 HG3 LYS 36 24.217 17.762 20.843
259 HD2 LYS 36 HD2 LYS 36 21.923 16.174 22.077
260 HD3 LYS 36 HD3 LYS 36 22.432 15.897 20.407
261 HE2 LYS 36 HE2 LYS 36 24.702 15.340 21.107
262 HE3 LYS 36 HE3 LYS 36 24.304 15.739 22.784
263 HZ1 LYS 36 HZ1 LYS 36 24.191 13.387 22.498
264 HZ2 LYS 36 HZ2 LYS 36 22.666 13.917 22.753
265 HZ3 LYS 36 HZ3 LYS 36 23.148 13.483 21.240
266 H CYS 37 H CYS 37 26.189 16.667 23.665
267 HA CYS 37 HA CYS 37 28.161 18.720 23.083
268 HB2 CYS 37 HB2 CYS 37 28.581 15.769 23.448
269 HB3 CYS 37 HB3 CYS 37 29.828 16.998 23.378
270 H GLY 38 H GLY 38 29.320 19.100 21.377
271 HA2 GLY 38 HA2 GLY 38 28.315 18.162 18.760
272 HA3 GLY 38 HA3 GLY 38 29.099 19.702 19.157
273 H VAL 39 H VAL 39 30.917 19.912 18.120
274 HA VAL 39 HA VAL 39 32.570 17.640 17.304
275 HB VAL 39 HB VAL 39 33.913 19.463 16.122
276 HG11 VAL 39 HG11 VAL 39 32.322 19.613 14.316
277 HG12 VAL 39 HG12 VAL 39 32.253 18.006 15.048
278 HG13 VAL 39 HG13 VAL 39 30.974 19.193 15.402
279 HG21 VAL 39 HG21 VAL 39 32.930 21.615 15.759
280 HG22 VAL 39 HG22 VAL 39 31.546 21.241 16.798
281 HG23 VAL 39 HG23 VAL 39 33.178 21.388 17.497
282 HA PRO 40 HA PRO 40 35.722 17.839 20.317
283 HB2 PRO 40 HB2 PRO 40 38.060 17.444 18.853
284 HB3 PRO 40 HB3 PRO 40 36.883 16.173 19.304
285 HG2 PRO 40 HG2 PRO 40 37.089 17.709 16.704
286 HG3 PRO 40 HG3 PRO 40 36.860 15.946 16.943
287 HD2 PRO 40 HD2 PRO 40 34.767 17.549 16.389
288 HD3 PRO 40 HD3 PRO 40 34.570 16.260 17.596
289 H ILE 41 H ILE 41 37.191 19.192 21.378
290 HA ILE 41 HA ILE 41 36.973 21.958 20.545
291 HB ILE 41 HB ILE 41 37.990 22.519 22.680
292 HG12 ILE 41 HG12 ILE 41 38.067 20.498 24.372
293 HG13 ILE 41 HG13 ILE 41 38.458 19.548 22.943
294 HG21 ILE 41 HG21 ILE 41 35.576 22.182 22.439
295 HG22 ILE 41 HG22 ILE 41 35.789 20.470 22.871
296 HG23 ILE 41 HG23 ILE 41 36.131 21.745 24.057
297 HD11 ILE 41 HD11 ILE 41 40.459 20.328 24.207
298 HD12 ILE 41 HD12 ILE 41 40.460 20.961 22.560
299 HD13 ILE 41 HD13 ILE 41 39.983 22.009 23.914
300 H SER 42 H SER 42 39.564 19.725 20.087
301 HA SER 42 HA SER 42 41.732 21.525 20.178
302 HB2 SER 42 HB2 SER 42 42.769 19.849 18.475
303 HB3 SER 42 HB3 SER 42 42.440 19.371 20.140
304 HG SER 42 HG SER 42 40.671 18.260 19.535
305 H TYR 43 H TYR 43 42.111 23.312 19.105
306 HA TYR 43 HA TYR 43 40.914 23.815 16.466
307 HB2 TYR 43 HB2 TYR 43 42.346 25.646 18.407
308 HB3 TYR 43 HB3 TYR 43 41.747 26.139 16.827
309 HD1 TYR 43 HD1 TYR 43 39.203 25.395 16.322
310 HD2 TYR 43 HD2 TYR 43 40.892 26.128 20.224
311 HE1 TYR 43 HE1 TYR 43 36.927 25.666 17.251
312 HE2 TYR 43 HE2 TYR 43 38.596 26.410 21.155
313 HH TYR 43 HH TYR 43 35.686 26.010 19.097
314 H LEU 44 H LEU 44 42.244 22.016 15.753
315 HA LEU 44 HA LEU 44 44.941 22.780 14.765
316 HB2 LEU 44 HB2 LEU 44 45.199 20.391 14.250
317 HB3 LEU 44 HB3 LEU 44 44.983 20.748 15.946
318 HG LEU 44 HG LEU 44 42.670 19.907 15.872
319 HD11 LEU 44 HD11 LEU 44 43.289 19.270 12.952
320 HD12 LEU 44 HD12 LEU 44 41.923 18.606 13.872
321 HD13 LEU 44 HD13 LEU 44 41.999 20.338 13.561
322 HD21 LEU 44 HD21 LEU 44 44.742 18.030 14.649
323 HD22 LEU 44 HD22 LEU 44 44.571 18.417 16.377
324 HD23 LEU 44 HD23 LEU 44 43.284 17.553 15.531
Start of MODEL 5
1 H1 ALA 1 H1 ALA 1 25.855 23.731 39.234
2 H2 ALA 1 H2 ALA 1 26.771 24.396 38.042
3 H3 ALA 1 H3 ALA 1 27.044 22.843 38.491
4 HA ALA 1 HA ALA 1 24.538 23.804 37.317
5 HB1 ALA 1 HB1 ALA 1 26.295 24.024 35.653
6 HB2 ALA 1 HB2 ALA 1 26.850 22.358 35.953
7 HB3 ALA 1 HB3 ALA 1 25.251 22.653 35.237
8 H LYS 2 H LYS 2 22.904 22.456 37.620
9 HA LYS 2 HA LYS 2 23.300 19.572 38.246
10 HB2 LYS 2 HB2 LYS 2 21.987 21.629 40.076
11 HB3 LYS 2 HB3 LYS 2 21.726 19.889 40.222
12 HG2 LYS 2 HG2 LYS 2 24.049 19.467 40.663
13 HG3 LYS 2 HG3 LYS 2 24.474 21.170 40.435
14 HD2 LYS 2 HD2 LYS 2 22.580 20.166 42.592
15 HD3 LYS 2 HD3 LYS 2 24.312 20.449 42.830
16 HE2 LYS 2 HE2 LYS 2 24.045 22.822 42.187
17 HE3 LYS 2 HE3 LYS 2 22.319 22.578 41.936
18 HZ1 LYS 2 HZ1 LYS 2 22.071 22.071 44.265
19 HZ2 LYS 2 HZ2 LYS 2 23.694 22.183 44.537
20 HZ3 LYS 2 HZ3 LYS 2 22.860 23.525 44.108
21 H ASN 3 H ASN 3 21.832 18.398 37.355
22 HA ASN 3 HA ASN 3 20.001 17.519 36.461
23 HB2 ASN 3 HB2 ASN 3 18.345 19.776 37.607
24 HB3 ASN 3 HB3 ASN 3 17.817 18.149 37.205
25 HD21 ASN 3 HD21 ASN 3 19.400 18.938 40.856
26 HD22 ASN 3 HD22 ASN 3 19.051 20.186 39.675
27 H GLN 4 H GLN 4 20.532 20.889 35.581
28 HA GLN 4 HA GLN 4 19.406 20.294 32.884
29 HB2 GLN 4 HB2 GLN 4 18.559 22.454 32.781
30 HB3 GLN 4 HB3 GLN 4 18.009 21.670 34.253
31 HG2 GLN 4 HG2 GLN 4 19.951 22.938 35.459
32 HG3 GLN 4 HG3 GLN 4 20.024 23.919 33.965
33 HE21 GLN 4 HE21 GLN 4 16.550 24.718 34.314
34 HE22 GLN 4 HE22 GLN 4 17.820 24.560 33.113
35 H PHE 5 H PHE 5 22.417 20.479 34.139
36 HA PHE 5 HA PHE 5 24.454 21.195 33.429
37 HB2 PHE 5 HB2 PHE 5 23.174 21.432 30.696
38 HB3 PHE 5 HB3 PHE 5 24.884 21.314 31.041
39 HD1 PHE 5 HD1 PHE 5 21.703 19.415 30.937
40 HD2 PHE 5 HD2 PHE 5 25.953 19.262 31.538
41 HE1 PHE 5 HE1 PHE 5 21.653 16.936 30.623
42 HE2 PHE 5 HE2 PHE 5 25.889 16.780 31.328
43 HZ PHE 5 HZ PHE 5 23.759 15.626 30.812
44 H GLY 6 H GLY 6 22.347 23.423 34.079
45 HA2 GLY 6 HA2 GLY 6 22.466 25.747 34.235
46 HA3 GLY 6 HA3 GLY 6 23.854 25.750 33.142
47 H CYS 7 H CYS 7 21.639 23.955 31.466
48 HA CYS 7 HA CYS 7 20.961 26.201 29.737
49 HB2 CYS 7 HB2 CYS 7 20.314 23.243 29.507
50 HB3 CYS 7 HB3 CYS 7 20.026 24.446 28.275
51 H PHE 8 H PHE 8 19.018 27.083 29.390
52 HA PHE 8 HA PHE 8 16.596 25.505 29.873
53 HB2 PHE 8 HB2 PHE 8 16.776 26.636 32.046
54 HB3 PHE 8 HB3 PHE 8 16.841 28.198 31.250
55 HD1 PHE 8 HD1 PHE 8 14.875 29.150 30.113
56 HD2 PHE 8 HD2 PHE 8 14.675 25.374 32.183
57 HE1 PHE 8 HE1 PHE 8 12.388 29.147 29.878
58 HE2 PHE 8 HE2 PHE 8 12.202 25.391 31.977
59 HZ PHE 8 HZ PHE 8 11.060 27.259 30.818
60 H ALA 9 H ALA 9 15.095 25.812 28.345
61 HA ALA 9 HA ALA 9 14.347 26.326 26.282
62 HB1 ALA 9 HB1 ALA 9 13.507 28.615 26.016
63 HB2 ALA 9 HB2 ALA 9 13.141 27.943 27.611
64 HB3 ALA 9 HB3 ALA 9 14.454 29.130 27.425
65 H ASN 10 H ASN 10 16.741 25.582 25.902
66 HA ASN 10 HA ASN 10 18.451 25.500 24.440
67 HB2 ASN 10 HB2 ASN 10 17.036 27.682 22.885
68 HB3 ASN 10 HB3 ASN 10 18.192 26.554 22.234
69 HD21 ASN 10 HD21 ASN 10 14.848 25.697 21.363
70 HD22 ASN 10 HD22 ASN 10 15.324 27.285 21.865
71 H VAL 11 H VAL 11 18.444 27.927 26.593
72 HA VAL 11 HA VAL 11 20.927 29.198 25.479
73 HB VAL 11 HB VAL 11 18.758 30.490 27.175
74 HG11 VAL 11 HG11 VAL 11 20.973 31.501 27.656
75 HG12 VAL 11 HG12 VAL 11 21.282 31.681 25.915
76 HG13 VAL 11 HG13 VAL 11 19.991 32.605 26.704
77 HG21 VAL 11 HG21 VAL 11 18.359 31.898 25.167
78 HG22 VAL 11 HG22 VAL 11 19.548 30.943 24.255
79 HG23 VAL 11 HG23 VAL 11 18.039 30.204 24.813
80 H ASP 12 H ASP 12 22.602 29.665 26.834
81 HA ASP 12 HA ASP 12 23.025 28.044 29.209
82 HB2 ASP 12 HB2 ASP 12 24.697 30.228 27.899
83 HB3 ASP 12 HB3 ASP 12 25.251 29.181 29.195
84 H VAL 13 H VAL 13 20.836 29.536 29.866
85 HA VAL 13 HA VAL 13 21.423 32.144 30.975
86 HB VAL 13 HB VAL 13 19.058 31.722 32.115
87 HG11 VAL 13 HG11 VAL 13 19.570 33.334 30.339
88 HG12 VAL 13 HG12 VAL 13 19.397 32.045 29.131
89 HG13 VAL 13 HG13 VAL 13 18.004 32.543 30.102
90 HG21 VAL 13 HG21 VAL 13 18.996 29.267 31.517
91 HG22 VAL 13 HG22 VAL 13 17.628 30.243 30.950
92 HG23 VAL 13 HG23 VAL 13 18.880 29.762 29.803
93 H LYS 14 H LYS 14 21.127 28.980 32.524
94 HA LYS 14 HA LYS 14 21.668 30.214 35.200
95 HB2 LYS 14 HB2 LYS 14 20.636 27.481 34.427
96 HB3 LYS 14 HB3 LYS 14 21.111 27.936 36.077
97 HG2 LYS 14 HG2 LYS 14 19.452 29.749 36.092
98 HG3 LYS 14 HG3 LYS 14 19.008 29.419 34.413
99 HD2 LYS 14 HD2 LYS 14 17.333 28.480 35.810
100 HD3 LYS 14 HD3 LYS 14 18.259 27.152 35.068
101 HE2 LYS 14 HE2 LYS 14 19.517 26.839 37.191
102 HE3 LYS 14 HE3 LYS 14 18.691 28.229 37.900
103 HZ1 LYS 14 HZ1 LYS 14 17.387 25.699 37.068
104 HZ2 LYS 14 HZ2 LYS 14 17.698 26.161 38.606
105 HZ3 LYS 14 HZ3 LYS 14 16.594 27.008 37.719
106 H GLY 15 H GLY 15 23.299 28.435 32.707
107 HA2 GLY 15 HA2 GLY 15 25.870 28.880 33.864
108 HA3 GLY 15 HA3 GLY 15 25.395 27.214 34.186
109 H ASP 16 H ASP 16 27.609 27.680 32.686
110 HA ASP 16 HA ASP 16 27.005 27.689 29.839
111 HB2 ASP 16 HB2 ASP 16 29.437 27.719 29.573
112 HB3 ASP 16 HB3 ASP 16 28.802 29.064 30.540
113 H CYS 17 H CYS 17 26.343 25.925 28.868
114 HA CYS 17 HA CYS 17 26.810 23.179 29.663
115 HB2 CYS 17 HB2 CYS 17 24.932 23.567 28.468
116 HB3 CYS 17 HB3 CYS 17 25.652 24.751 27.395
117 H LYS 18 H LYS 18 28.825 25.373 27.712
118 HA LYS 18 HA LYS 18 30.506 23.500 26.407
119 HB2 LYS 18 HB2 LYS 18 30.622 25.940 26.147
120 HB3 LYS 18 HB3 LYS 18 31.295 26.132 27.756
121 HG2 LYS 18 HG2 LYS 18 32.656 24.298 25.762
122 HG3 LYS 18 HG3 LYS 18 32.809 26.027 25.541
123 HD2 LYS 18 HD2 LYS 18 33.553 24.686 28.167
124 HD3 LYS 18 HD3 LYS 18 34.682 24.836 26.837
125 HE2 LYS 18 HE2 LYS 18 33.213 27.236 27.982
126 HE3 LYS 18 HE3 LYS 18 34.700 26.624 28.711
127 HZ1 LYS 18 HZ1 LYS 18 35.895 27.082 26.724
128 HZ2 LYS 18 HZ2 LYS 18 34.547 27.447 25.850
129 HZ3 LYS 18 HZ3 LYS 18 35.042 28.424 27.074
130 H ARG 19 H ARG 19 30.444 24.329 29.876
131 HA ARG 19 HA ARG 19 32.901 23.258 30.705
132 HB2 ARG 19 HB2 ARG 19 31.172 24.762 31.781
133 HB3 ARG 19 HB3 ARG 19 30.213 23.333 32.150
134 HG2 ARG 19 HG2 ARG 19 31.899 22.494 33.674
135 HG3 ARG 19 HG3 ARG 19 33.050 23.755 33.171
136 HD2 ARG 19 HD2 ARG 19 30.309 24.332 34.385
137 HD3 ARG 19 HD3 ARG 19 31.788 24.263 35.318
138 HE ARG 19 HE ARG 19 31.025 26.346 33.335
139 HH11 ARG 19 HH11 ARG 19 33.411 25.458 35.738
140 HH12 ARG 19 HH12 ARG 19 34.374 26.872 35.381
141 HH21 ARG 19 HH21 ARG 19 32.377 27.799 32.693
142 HH22 ARG 19 HH22 ARG 19 33.894 28.113 33.555
143 H HIS 20 H HIS 20 29.780 21.600 30.372
144 HA HIS 20 HA HIS 20 30.638 19.021 31.375
145 HB2 HIS 20 HB2 HIS 20 28.314 19.504 31.381
146 HB3 HIS 20 HB3 HIS 20 28.320 20.058 29.713
147 HD2 HIS 20 HD2 HIS 20 27.395 18.450 28.008
148 HE1 HIS 20 HE1 HIS 20 27.953 14.749 30.022
149 HE2 HIS 20 HE2 HIS 20 26.959 15.872 27.948
150 H CYS 21 H CYS 21 30.423 20.415 28.085
151 HA CYS 21 HA CYS 21 31.410 17.982 26.843
152 HB2 CYS 21 HB2 CYS 21 30.950 20.781 25.787
153 HB3 CYS 21 HB3 CYS 21 31.367 19.399 24.783
154 H LYS 22 H LYS 22 33.002 20.939 28.006
155 HA LYS 22 HA LYS 22 35.593 20.436 26.923
156 HB2 LYS 22 HB2 LYS 22 35.007 22.573 27.944
157 HB3 LYS 22 HB3 LYS 22 34.663 21.791 29.477
158 HG2 LYS 22 HG2 LYS 22 36.662 22.881 29.824
159 HG3 LYS 22 HG3 LYS 22 37.119 21.203 29.676
160 HD2 LYS 22 HD2 LYS 22 37.452 23.362 27.544
161 HD3 LYS 22 HD3 LYS 22 38.701 22.738 28.622
162 HE2 LYS 22 HE2 LYS 22 38.149 20.418 27.610
163 HE3 LYS 22 HE3 LYS 22 37.344 21.319 26.312
164 HZ1 LYS 22 HZ1 LYS 22 39.490 22.401 25.852
165 HZ2 LYS 22 HZ2 LYS 22 40.189 21.593 27.121
166 HZ3 LYS 22 HZ3 LYS 22 39.669 20.753 25.842
167 H ALA 23 H ALA 23 33.991 19.114 29.837
168 HA ALA 23 HA ALA 23 36.226 17.489 30.656
169 HB1 ALA 23 HB1 ALA 23 33.250 17.182 31.184
170 HB2 ALA 23 HB2 ALA 23 34.553 16.379 32.074
171 HB3 ALA 23 HB3 ALA 23 34.387 18.141 32.147
172 H GLU 24 H GLU 24 34.060 17.095 27.970
173 HA GLU 24 HA GLU 24 34.944 14.282 27.496
174 HB2 GLU 24 HB2 GLU 24 32.899 16.000 26.047
175 HB3 GLU 24 HB3 GLU 24 33.245 14.317 25.698
176 HG2 GLU 24 HG2 GLU 24 32.218 15.145 28.448
177 HG3 GLU 24 HG3 GLU 24 31.137 14.969 27.077
178 H ASP 25 H ASP 25 36.166 17.255 27.068
179 HA ASP 25 HA ASP 25 37.327 18.475 25.682
180 HB2 ASP 25 HB2 ASP 25 38.795 16.361 26.132
181 HB3 ASP 25 HB3 ASP 25 38.635 16.085 24.400
182 H LYS 26 H LYS 26 34.893 18.344 24.887
183 HA LYS 26 HA LYS 26 34.854 18.543 21.903
184 HB2 LYS 26 HB2 LYS 26 32.636 17.653 23.790
185 HB3 LYS 26 HB3 LYS 26 32.473 17.887 22.057
186 HG2 LYS 26 HG2 LYS 26 34.663 16.104 22.355
187 HG3 LYS 26 HG3 LYS 26 33.441 15.577 23.529
188 HD2 LYS 26 HD2 LYS 26 31.750 15.552 21.702
189 HD3 LYS 26 HD3 LYS 26 33.021 16.041 20.559
190 HE2 LYS 26 HE2 LYS 26 34.346 14.000 21.209
191 HE3 LYS 26 HE3 LYS 26 33.019 13.513 22.269
192 HZ1 LYS 26 HZ1 LYS 26 33.014 13.565 19.306
193 HZ2 LYS 26 HZ2 LYS 26 32.632 12.325 20.292
194 HZ3 LYS 26 HZ3 LYS 26 31.601 13.584 20.150
195 H GLU 27 H GLU 27 32.947 19.853 21.161
196 HA GLU 27 HA GLU 27 32.630 22.401 22.664
197 HB2 GLU 27 HB2 GLU 27 31.857 21.465 19.883
198 HB3 GLU 27 HB3 GLU 27 31.280 22.980 20.562
199 HG2 GLU 27 HG2 GLU 27 34.252 22.333 20.326
200 HG3 GLU 27 HG3 GLU 27 33.329 23.104 19.041
201 H GLY 28 H GLY 28 30.552 23.169 23.201
202 HA2 GLY 28 HA2 GLY 28 28.378 21.115 23.530
203 HA3 GLY 28 HA3 GLY 28 28.886 22.134 24.871
204 H ILE 29 H ILE 29 26.190 21.842 23.704
205 HA ILE 29 HA ILE 29 25.534 24.644 23.246
206 HB ILE 29 HB ILE 29 26.186 23.943 21.078
207 HG12 ILE 29 HG12 ILE 29 24.080 25.379 21.498
208 HG13 ILE 29 HG13 ILE 29 24.544 24.898 19.875
209 HG21 ILE 29 HG21 ILE 29 24.243 21.645 21.196
210 HG22 ILE 29 HG22 ILE 29 25.070 22.221 19.732
211 HG23 ILE 29 HG23 ILE 29 26.008 21.567 21.074
212 HD11 ILE 29 HD11 ILE 29 22.392 23.505 21.502
213 HD12 ILE 29 HD12 ILE 29 22.134 24.725 20.238
214 HD13 ILE 29 HD13 ILE 29 22.837 23.172 19.813
215 H CYS 30 H CYS 30 23.488 25.155 23.993
216 HA CYS 30 HA CYS 30 22.174 23.084 25.559
217 HB2 CYS 30 HB2 CYS 30 21.601 26.023 25.137
218 HB3 CYS 30 HB3 CYS 30 20.615 24.960 26.161
219 H HIS 31 H HIS 31 20.694 21.773 24.907
220 HA HIS 31 HA HIS 31 18.645 22.578 22.863
221 HB2 HIS 31 HB2 HIS 31 19.943 19.908 23.405
222 HB3 HIS 31 HB3 HIS 31 18.293 19.989 22.816
223 HD2 HIS 31 HD2 HIS 31 21.848 21.056 21.675
224 HE1 HIS 31 HE1 HIS 31 19.417 20.643 18.202
225 HE2 HIS 31 HE2 HIS 31 21.786 21.022 19.030
226 H GLY 32 H GLY 32 17.076 23.412 24.033
227 HA2 GLY 32 HA2 GLY 32 15.270 23.556 25.433
228 HA3 GLY 32 HA3 GLY 32 15.370 21.817 25.674
229 H THR 33 H THR 33 15.778 21.179 27.694
230 HA THR 33 HA THR 33 17.139 22.979 29.647
231 HB THR 33 HB THR 33 16.077 21.679 31.424
232 HG1 THR 33 HG1 THR 33 14.542 20.190 30.943
233 HG21 THR 33 HG21 THR 33 14.930 23.702 30.430
234 HG22 THR 33 HG22 THR 33 13.973 22.599 29.416
235 HG23 THR 33 HG23 THR 33 13.832 22.531 31.186
236 H LYS 34 H LYS 34 18.238 20.978 27.574
237 HA LYS 34 HA LYS 34 20.127 19.558 29.404
238 HB2 LYS 34 HB2 LYS 34 19.027 18.645 26.716
239 HB3 LYS 34 HB3 LYS 34 20.211 17.773 27.670
240 HG2 LYS 34 HG2 LYS 34 17.382 18.363 28.655
241 HG3 LYS 34 HG3 LYS 34 17.860 16.899 27.788
242 HD2 LYS 34 HD2 LYS 34 19.592 16.479 29.579
243 HD3 LYS 34 HD3 LYS 34 18.882 17.805 30.517
244 HE2 LYS 34 HE2 LYS 34 17.390 15.347 29.497
245 HE3 LYS 34 HE3 LYS 34 18.079 15.488 31.120
246 HZ1 LYS 34 HZ1 LYS 34 15.902 17.187 30.033
247 HZ2 LYS 34 HZ2 LYS 34 15.776 16.012 31.170
248 HZ3 LYS 34 HZ3 LYS 34 16.604 17.386 31.511
249 H CYS 35 H CYS 35 22.200 19.066 28.490
250 HA CYS 35 HA CYS 35 23.217 21.054 26.499
251 HB2 CYS 35 HB2 CYS 35 24.268 21.071 28.729
252 HB3 CYS 35 HB3 CYS 35 24.686 19.355 28.527
253 H LYS 36 H LYS 36 24.353 20.321 24.687
254 HA LYS 36 HA LYS 36 24.334 17.409 24.035
255 HB2 LYS 36 HB2 LYS 36 22.394 18.587 23.012
256 HB3 LYS 36 HB3 LYS 36 23.476 19.844 22.424
257 HG2 LYS 36 HG2 LYS 36 22.938 18.517 20.558
258 HG3 LYS 36 HG3 LYS 36 24.617 18.170 20.966
259 HD2 LYS 36 HD2 LYS 36 23.548 16.121 20.402
260 HD3 LYS 36 HD3 LYS 36 23.848 16.088 22.148
261 HE2 LYS 36 HE2 LYS 36 21.478 16.659 22.588
262 HE3 LYS 36 HE3 LYS 36 21.176 16.821 20.849
263 HZ1 LYS 36 HZ1 LYS 36 20.495 14.620 21.623
264 HZ2 LYS 36 HZ2 LYS 36 21.784 14.470 20.619
265 HZ3 LYS 36 HZ3 LYS 36 21.997 14.340 22.240
266 H CYS 37 H CYS 37 26.342 16.799 23.513
267 HA CYS 37 HA CYS 37 28.385 18.861 22.988
268 HB2 CYS 37 HB2 CYS 37 28.838 15.908 23.321
269 HB3 CYS 37 HB3 CYS 37 30.049 17.177 23.179
270 H GLY 38 H GLY 38 29.459 19.228 21.281
271 HA2 GLY 38 HA2 GLY 38 28.515 18.244 18.645
272 HA3 GLY 38 HA3 GLY 38 29.397 19.739 19.020
273 H VAL 39 H VAL 39 31.160 19.496 17.660
274 HA VAL 39 HA VAL 39 32.635 17.075 17.462
275 HB VAL 39 HB VAL 39 34.272 18.401 16.153
276 HG11 VAL 39 HG11 VAL 39 31.394 18.958 15.367
277 HG12 VAL 39 HG12 VAL 39 32.812 18.925 14.302
278 HG13 VAL 39 HG13 VAL 39 32.283 17.437 15.105
279 HG21 VAL 39 HG21 VAL 39 34.220 20.539 17.319
280 HG22 VAL 39 HG22 VAL 39 33.815 20.754 15.610
281 HG23 VAL 39 HG23 VAL 39 32.535 20.799 16.837
282 HA PRO 40 HA PRO 40 35.866 17.309 20.586
283 HB2 PRO 40 HB2 PRO 40 37.681 16.850 18.222
284 HB3 PRO 40 HB3 PRO 40 37.667 16.025 19.813
285 HG2 PRO 40 HG2 PRO 40 36.615 14.825 17.629
286 HG3 PRO 40 HG3 PRO 40 35.806 14.705 19.224
287 HD2 PRO 40 HD2 PRO 40 35.042 16.479 16.884
288 HD3 PRO 40 HD3 PRO 40 34.019 15.603 18.048
289 H ILE 41 H ILE 41 37.386 18.948 21.313
290 HA ILE 41 HA ILE 41 36.987 21.475 20.173
291 HB ILE 41 HB ILE 41 38.674 22.359 21.706
292 HG12 ILE 41 HG12 ILE 41 39.413 20.854 23.590
293 HG13 ILE 41 HG13 ILE 41 39.073 19.475 22.552
294 HG21 ILE 41 HG21 ILE 41 36.286 22.047 22.257
295 HG22 ILE 41 HG22 ILE 41 36.670 20.465 22.965
296 HG23 ILE 41 HG23 ILE 41 37.334 21.950 23.674
297 HD11 ILE 41 HD11 ILE 41 41.039 21.703 21.848
298 HD12 ILE 41 HD12 ILE 41 41.494 20.216 22.702
299 HD13 ILE 41 HD13 ILE 41 40.885 20.115 21.056
300 H SER 42 H SER 42 39.486 19.257 19.301
301 HA SER 42 HA SER 42 41.069 19.263 17.692
302 HB2 SER 42 HB2 SER 42 38.886 19.300 16.559
303 HB3 SER 42 HB3 SER 42 39.077 21.019 16.270
304 HG SER 42 HG SER 42 40.447 20.601 14.676
305 H TYR 43 H TYR 43 42.988 20.096 17.932
306 HA TYR 43 HA TYR 43 43.620 22.941 17.920
307 HB2 TYR 43 HB2 TYR 43 45.345 20.447 17.762
308 HB3 TYR 43 HB3 TYR 43 45.995 22.080 17.803
309 HD1 TYR 43 HD1 TYR 43 44.895 19.346 19.856
310 HD2 TYR 43 HD2 TYR 43 45.270 23.643 19.735
311 HE1 TYR 43 HE1 TYR 43 44.727 19.426 22.332
312 HE2 TYR 43 HE2 TYR 43 45.114 23.715 22.219
313 HH TYR 43 HH TYR 43 44.737 20.765 24.186
314 H LEU 44 H LEU 44 42.649 21.046 15.409
315 HA LEU 44 HA LEU 44 43.889 22.863 13.395
316 HB2 LEU 44 HB2 LEU 44 44.549 20.504 13.041
317 HB3 LEU 44 HB3 LEU 44 42.852 20.029 13.025
318 HG LEU 44 HG LEU 44 42.474 21.334 10.962
319 HD11 LEU 44 HD11 LEU 44 44.445 22.191 9.695
320 HD12 LEU 44 HD12 LEU 44 44.164 23.099 11.181
321 HD13 LEU 44 HD13 LEU 44 45.471 21.892 11.116
322 HD21 LEU 44 HD21 LEU 44 44.859 19.441 10.804
323 HD22 LEU 44 HD22 LEU 44 43.149 18.958 10.851
324 HD23 LEU 44 HD23 LEU 44 43.770 19.874 9.469
Start of MODEL 6
1 H1 ALA 1 H1 ALA 1 26.980 20.826 39.440
2 H2 ALA 1 H2 ALA 1 27.775 21.046 38.017
3 H3 ALA 1 H3 ALA 1 27.438 19.522 38.550
4 HA ALA 1 HA ALA 1 25.400 21.500 37.828
5 HB1 ALA 1 HB1 ALA 1 26.682 20.826 35.842
6 HB2 ALA 1 HB2 ALA 1 26.389 19.117 36.215
7 HB3 ALA 1 HB3 ALA 1 25.034 20.181 35.782
8 H LYS 2 H LYS 2 23.169 20.569 37.688
9 HA LYS 2 HA LYS 2 22.822 18.430 39.770
10 HB2 LYS 2 HB2 LYS 2 22.609 20.598 40.785
11 HB3 LYS 2 HB3 LYS 2 21.529 21.162 39.489
12 HG2 LYS 2 HG2 LYS 2 19.766 19.656 40.251
13 HG3 LYS 2 HG3 LYS 2 20.855 18.889 41.415
14 HD2 LYS 2 HD2 LYS 2 19.262 20.440 42.460
15 HD3 LYS 2 HD3 LYS 2 20.947 20.917 42.748
16 HE2 LYS 2 HE2 LYS 2 20.797 22.671 41.065
17 HE3 LYS 2 HE3 LYS 2 19.197 22.119 40.559
18 HZ1 LYS 2 HZ1 LYS 2 19.092 24.041 42.017
19 HZ2 LYS 2 HZ2 LYS 2 18.303 22.784 42.660
20 HZ3 LYS 2 HZ3 LYS 2 19.787 23.209 43.267
21 H ASN 3 H ASN 3 21.338 19.989 36.947
22 HA ASN 3 HA ASN 3 19.881 17.562 36.305
23 HB2 ASN 3 HB2 ASN 3 17.633 18.491 36.447
24 HB3 ASN 3 HB3 ASN 3 18.359 18.339 38.045
25 HD21 ASN 3 HD21 ASN 3 16.445 21.540 37.715
26 HD22 ASN 3 HD22 ASN 3 16.039 19.862 37.371
27 H GLN 4 H GLN 4 20.228 21.029 35.675
28 HA GLN 4 HA GLN 4 19.350 20.568 32.852
29 HB2 GLN 4 HB2 GLN 4 18.422 22.661 32.825
30 HB3 GLN 4 HB3 GLN 4 17.921 21.885 34.324
31 HG2 GLN 4 HG2 GLN 4 19.811 23.198 35.498
32 HG3 GLN 4 HG3 GLN 4 19.942 24.122 33.970
33 HE21 GLN 4 HE21 GLN 4 16.485 24.955 34.148
34 HE22 GLN 4 HE22 GLN 4 17.817 24.828 33.032
35 H PHE 5 H PHE 5 22.299 20.739 34.202
36 HA PHE 5 HA PHE 5 24.319 21.646 33.775
37 HB2 PHE 5 HB2 PHE 5 23.369 21.853 30.904
38 HB3 PHE 5 HB3 PHE 5 25.021 21.728 31.478
39 HD1 PHE 5 HD1 PHE 5 25.948 19.600 32.288
40 HD2 PHE 5 HD2 PHE 5 21.909 19.895 30.842
41 HE1 PHE 5 HE1 PHE 5 25.838 17.137 32.079
42 HE2 PHE 5 HE2 PHE 5 21.808 17.403 30.624
43 HZ PHE 5 HZ PHE 5 23.779 16.037 31.240
44 H GLY 6 H GLY 6 22.055 23.685 34.248
45 HA2 GLY 6 HA2 GLY 6 21.991 26.016 34.492
46 HA3 GLY 6 HA3 GLY 6 23.498 26.154 33.582
47 H CYS 7 H CYS 7 21.654 24.283 31.595
48 HA CYS 7 HA CYS 7 20.994 26.444 29.785
49 HB2 CYS 7 HB2 CYS 7 20.416 23.462 29.686
50 HB3 CYS 7 HB3 CYS 7 20.144 24.574 28.376
51 H PHE 8 H PHE 8 19.048 27.263 29.267
52 HA PHE 8 HA PHE 8 16.621 25.728 29.710
53 HB2 PHE 8 HB2 PHE 8 16.737 26.889 31.853
54 HB3 PHE 8 HB3 PHE 8 16.888 28.441 31.041
55 HD1 PHE 8 HD1 PHE 8 14.974 29.485 29.894
56 HD2 PHE 8 HD2 PHE 8 14.581 25.740 31.997
57 HE1 PHE 8 HE1 PHE 8 12.506 29.557 29.591
58 HE2 PHE 8 HE2 PHE 8 12.123 25.822 31.674
59 HZ PHE 8 HZ PHE 8 11.086 27.707 30.446
60 H ALA 9 H ALA 9 15.230 25.921 28.113
61 HA ALA 9 HA ALA 9 14.471 26.377 26.046
62 HB1 ALA 9 HB1 ALA 9 14.466 29.198 27.162
63 HB2 ALA 9 HB2 ALA 9 13.521 28.625 25.769
64 HB3 ALA 9 HB3 ALA 9 13.209 27.957 27.381
65 H ASN 10 H ASN 10 16.870 25.730 25.618
66 HA ASN 10 HA ASN 10 18.671 25.785 24.297
67 HB2 ASN 10 HB2 ASN 10 16.985 27.655 22.584
68 HB3 ASN 10 HB3 ASN 10 18.428 26.813 22.043
69 HD21 ASN 10 HD21 ASN 10 15.862 24.870 20.813
70 HD22 ASN 10 HD22 ASN 10 16.368 26.530 20.559
71 H VAL 11 H VAL 11 18.492 28.084 26.407
72 HA VAL 11 HA VAL 11 20.956 29.490 25.465
73 HB VAL 11 HB VAL 11 18.708 30.705 27.101
74 HG11 VAL 11 HG11 VAL 11 20.879 31.733 27.647
75 HG12 VAL 11 HG12 VAL 11 21.256 31.927 25.921
76 HG13 VAL 11 HG13 VAL 11 19.933 32.840 26.674
77 HG21 VAL 11 HG21 VAL 11 19.524 31.213 24.200
78 HG22 VAL 11 HG22 VAL 11 18.018 30.445 24.733
79 HG23 VAL 11 HG23 VAL 11 18.307 32.128 25.116
80 H ASP 12 H ASP 12 22.492 29.982 26.986
81 HA ASP 12 HA ASP 12 22.785 28.213 29.262
82 HB2 ASP 12 HB2 ASP 12 25.060 29.201 29.299
83 HB3 ASP 12 HB3 ASP 12 24.622 28.479 27.765
84 H VAL 13 H VAL 13 20.635 30.060 29.665
85 HA VAL 13 HA VAL 13 21.324 32.516 30.837
86 HB VAL 13 HB VAL 13 18.969 32.201 32.050
87 HG11 VAL 13 HG11 VAL 13 19.502 33.714 30.183
88 HG12 VAL 13 HG12 VAL 13 19.218 32.376 29.050
89 HG13 VAL 13 HG13 VAL 13 17.892 32.987 30.057
90 HG21 VAL 13 HG21 VAL 13 18.716 30.128 29.838
91 HG22 VAL 13 HG22 VAL 13 18.835 29.734 31.574
92 HG23 VAL 13 HG23 VAL 13 17.476 30.697 30.963
93 H LYS 14 H LYS 14 21.136 29.452 32.521
94 HA LYS 14 HA LYS 14 21.923 30.833 35.080
95 HB2 LYS 14 HB2 LYS 14 20.671 28.086 34.681
96 HB3 LYS 14 HB3 LYS 14 21.128 28.772 36.233
97 HG2 LYS 14 HG2 LYS 14 19.053 30.006 34.358
98 HG3 LYS 14 HG3 LYS 14 18.665 28.896 35.650
99 HD2 LYS 14 HD2 LYS 14 20.101 31.530 36.142
100 HD3 LYS 14 HD3 LYS 14 18.340 31.358 36.140
101 HE2 LYS 14 HE2 LYS 14 18.611 29.537 37.894
102 HE3 LYS 14 HE3 LYS 14 20.313 29.987 38.021
103 HZ1 LYS 14 HZ1 LYS 14 18.059 31.881 38.524
104 HZ2 LYS 14 HZ2 LYS 14 18.871 31.091 39.690
105 HZ3 LYS 14 HZ3 LYS 14 19.644 32.189 38.775
106 H GLY 15 H GLY 15 23.200 28.959 32.576
107 HA2 GLY 15 HA2 GLY 15 25.835 29.236 33.372
108 HA3 GLY 15 HA3 GLY 15 25.365 27.641 33.973
109 H ASP 16 H ASP 16 27.336 28.247 31.921
110 HA ASP 16 HA ASP 16 26.182 27.282 29.389
111 HB2 ASP 16 HB2 ASP 16 28.441 27.525 28.516
112 HB3 ASP 16 HB3 ASP 16 27.916 29.007 29.319
113 H CYS 17 H CYS 17 26.342 25.282 28.549
114 HA CYS 17 HA CYS 17 27.267 23.162 30.362
115 HB2 CYS 17 HB2 CYS 17 25.865 21.759 29.372
116 HB3 CYS 17 HB3 CYS 17 24.998 23.280 29.386
117 H LYS 18 H LYS 18 28.721 24.827 27.873
118 HA LYS 18 HA LYS 18 30.089 22.732 26.515
119 HB2 LYS 18 HB2 LYS 18 29.938 25.073 25.728
120 HB3 LYS 18 HB3 LYS 18 31.139 25.560 26.928
121 HG2 LYS 18 HG2 LYS 18 31.806 23.226 25.119
122 HG3 LYS 18 HG3 LYS 18 31.719 24.806 24.365
123 HD2 LYS 18 HD2 LYS 18 33.373 24.520 26.873
124 HD3 LYS 18 HD3 LYS 18 34.005 23.832 25.384
125 HE2 LYS 18 HE2 LYS 18 32.919 26.652 25.357
126 HE3 LYS 18 HE3 LYS 18 34.510 26.361 26.073
127 HZ1 LYS 18 HZ1 LYS 18 33.824 25.536 23.308
128 HZ2 LYS 18 HZ2 LYS 18 34.568 26.953 23.687
129 HZ3 LYS 18 HZ3 LYS 18 35.319 25.541 24.037
130 H ARG 19 H ARG 19 30.818 24.025 29.741
131 HA ARG 19 HA ARG 19 33.433 22.734 29.899
132 HB2 ARG 19 HB2 ARG 19 31.624 24.204 31.747
133 HB3 ARG 19 HB3 ARG 19 32.448 22.877 32.510
134 HG2 ARG 19 HG2 ARG 19 33.904 24.658 32.846
135 HG3 ARG 19 HG3 ARG 19 34.643 23.756 31.527
136 HD2 ARG 19 HD2 ARG 19 34.738 26.112 30.965
137 HD3 ARG 19 HD3 ARG 19 33.560 25.365 29.895
138 HE ARG 19 HE ARG 19 31.872 26.622 30.896
139 HH11 ARG 19 HH11 ARG 19 34.683 26.897 33.063
140 HH12 ARG 19 HH12 ARG 19 33.819 28.114 34.011
141 HH21 ARG 19 HH21 ARG 19 31.066 28.268 32.079
142 HH22 ARG 19 HH22 ARG 19 31.985 28.849 33.482
143 H HIS 20 H HIS 20 30.173 21.584 30.713
144 HA HIS 20 HA HIS 20 30.957 18.947 31.551
145 HB2 HIS 20 HB2 HIS 20 28.768 19.463 32.080
146 HB3 HIS 20 HB3 HIS 20 28.443 20.266 30.559
147 HD2 HIS 20 HD2 HIS 20 27.433 18.930 28.603
148 HE1 HIS 20 HE1 HIS 20 27.399 15.063 30.363
149 HE2 HIS 20 HE2 HIS 20 26.688 16.420 28.340
150 H CYS 21 H CYS 21 30.380 20.257 28.251
151 HA CYS 21 HA CYS 21 31.073 17.721 26.989
152 HB2 CYS 21 HB2 CYS 21 30.654 20.540 26.009
153 HB3 CYS 21 HB3 CYS 21 31.203 19.280 24.921
154 H LYS 22 H LYS 22 33.022 20.548 27.975
155 HA LYS 22 HA LYS 22 35.413 19.757 26.737
156 HB2 LYS 22 HB2 LYS 22 34.753 21.980 27.863
157 HB3 LYS 22 HB3 LYS 22 35.145 21.218 29.402
158 HG2 LYS 22 HG2 LYS 22 37.005 22.525 28.691
159 HG3 LYS 22 HG3 LYS 22 37.484 20.829 28.558
160 HD2 LYS 22 HD2 LYS 22 37.104 20.892 26.092
161 HD3 LYS 22 HD3 LYS 22 36.403 22.519 26.258
162 HE2 LYS 22 HE2 LYS 22 38.555 22.956 25.560
163 HE3 LYS 22 HE3 LYS 22 38.578 23.222 27.300
164 HZ1 LYS 22 HZ1 LYS 22 39.641 21.033 27.578
165 HZ2 LYS 22 HZ2 LYS 22 39.571 20.733 25.959
166 HZ3 LYS 22 HZ3 LYS 22 40.500 21.954 26.528
167 H ALA 23 H ALA 23 33.851 18.369 29.518
168 HA ALA 23 HA ALA 23 36.102 16.901 30.555
169 HB1 ALA 23 HB1 ALA 23 34.402 15.549 31.643
170 HB2 ALA 23 HB2 ALA 23 33.905 17.251 31.707
171 HB3 ALA 23 HB3 ALA 23 33.153 16.147 30.537
172 H GLU 24 H GLU 24 34.312 16.582 27.586
173 HA GLU 24 HA GLU 24 35.772 14.079 26.887
174 HB2 GLU 24 HB2 GLU 24 33.238 15.159 25.594
175 HB3 GLU 24 HB3 GLU 24 34.114 13.677 25.178
176 HG2 GLU 24 HG2 GLU 24 33.685 12.922 27.604
177 HG3 GLU 24 HG3 GLU 24 32.537 14.256 27.710
178 H ASP 25 H ASP 25 36.535 17.053 26.880
179 HA ASP 25 HA ASP 25 37.509 18.641 25.699
180 HB2 ASP 25 HB2 ASP 25 39.104 16.713 25.554
181 HB3 ASP 25 HB3 ASP 25 38.577 16.477 23.897
182 H LYS 26 H LYS 26 34.777 18.062 24.857
183 HA LYS 26 HA LYS 26 34.753 18.920 21.997
184 HB2 LYS 26 HB2 LYS 26 32.743 17.437 23.727
185 HB3 LYS 26 HB3 LYS 26 32.356 18.141 22.166
186 HG2 LYS 26 HG2 LYS 26 34.576 16.704 21.453
187 HG3 LYS 26 HG3 LYS 26 33.967 15.699 22.790
188 HD2 LYS 26 HD2 LYS 26 31.747 15.602 21.721
189 HD3 LYS 26 HD3 LYS 26 32.316 16.735 20.476
190 HE2 LYS 26 HE2 LYS 26 33.999 15.059 19.735
191 HE3 LYS 26 HE3 LYS 26 33.334 13.902 20.901
192 HZ1 LYS 26 HZ1 LYS 26 31.240 13.982 19.767
193 HZ2 LYS 26 HZ2 LYS 26 31.706 15.180 18.755
194 HZ3 LYS 26 HZ3 LYS 26 32.384 13.676 18.639
195 H GLU 27 H GLU 27 33.126 20.241 21.231
196 HA GLU 27 HA GLU 27 32.439 22.599 22.841
197 HB2 GLU 27 HB2 GLU 27 31.792 21.626 20.042
198 HB3 GLU 27 HB3 GLU 27 31.072 23.079 20.704
199 HG2 GLU 27 HG2 GLU 27 34.097 22.730 20.538
200 HG3 GLU 27 HG3 GLU 27 33.139 23.316 19.186
201 H GLY 28 H GLY 28 30.294 23.084 23.430
202 HA2 GLY 28 HA2 GLY 28 28.338 20.825 23.581
203 HA3 GLY 28 HA3 GLY 28 28.818 21.672 25.047
204 H ILE 29 H ILE 29 26.208 21.286 23.624
205 HA ILE 29 HA ILE 29 25.373 24.110 23.264
206 HB ILE 29 HB ILE 29 25.860 23.253 21.136
207 HG12 ILE 29 HG12 ILE 29 23.737 24.608 21.590
208 HG13 ILE 29 HG13 ILE 29 24.068 23.961 19.990
209 HG21 ILE 29 HG21 ILE 29 25.857 20.892 21.333
210 HG22 ILE 29 HG22 ILE 29 24.115 20.852 21.667
211 HG23 ILE 29 HG23 ILE 29 24.716 21.341 20.065
212 HD11 ILE 29 HD11 ILE 29 22.436 22.210 20.258
213 HD12 ILE 29 HD12 ILE 29 22.152 22.658 21.954
214 HD13 ILE 29 HD13 ILE 29 21.689 23.764 20.647
215 H CYS 30 H CYS 30 23.606 24.694 24.260
216 HA CYS 30 HA CYS 30 22.111 22.905 25.952
217 HB2 CYS 30 HB2 CYS 30 21.682 25.794 25.109
218 HB3 CYS 30 HB3 CYS 30 20.660 24.948 26.270
219 H HIS 31 H HIS 31 20.825 21.427 25.148
220 HA HIS 31 HA HIS 31 18.785 21.976 23.022
221 HB2 HIS 31 HB2 HIS 31 20.006 19.458 24.178
222 HB3 HIS 31 HB3 HIS 31 18.379 19.418 23.515
223 HD2 HIS 31 HD2 HIS 31 21.989 20.147 22.318
224 HE1 HIS 31 HE1 HIS 31 19.653 19.049 18.923
225 HE2 HIS 31 HE2 HIS 31 22.006 19.608 19.727
226 H GLY 32 H GLY 32 17.365 23.261 24.139
227 HA2 GLY 32 HA2 GLY 32 15.568 23.772 25.481
228 HA3 GLY 32 HA3 GLY 32 15.380 22.052 25.786
229 H THR 33 H THR 33 15.735 21.385 27.799
230 HA THR 33 HA THR 33 17.356 23.021 29.711
231 HB THR 33 HB THR 33 16.061 22.017 31.551
232 HG1 THR 33 HG1 THR 33 14.002 21.219 31.008
233 HG21 THR 33 HG21 THR 33 14.085 23.436 31.221
234 HG22 THR 33 HG22 THR 33 15.560 24.222 30.668
235 HG23 THR 33 HG23 THR 33 14.427 23.539 29.481
236 H LYS 34 H LYS 34 18.322 20.993 27.812
237 HA LYS 34 HA LYS 34 20.071 19.560 29.724
238 HB2 LYS 34 HB2 LYS 34 18.671 18.296 27.321
239 HB3 LYS 34 HB3 LYS 34 19.968 17.513 28.215
240 HG2 LYS 34 HG2 LYS 34 17.309 18.334 29.439
241 HG3 LYS 34 HG3 LYS 34 17.676 16.730 28.837
242 HD2 LYS 34 HD2 LYS 34 19.379 16.354 30.481
243 HD3 LYS 34 HD3 LYS 34 19.371 18.038 31.016
244 HE2 LYS 34 HE2 LYS 34 16.863 16.358 31.168
245 HE3 LYS 34 HE3 LYS 34 18.107 16.266 32.438
246 HZ1 LYS 34 HZ1 LYS 34 17.018 18.879 31.605
247 HZ2 LYS 34 HZ2 LYS 34 16.272 17.996 32.771
248 HZ3 LYS 34 HZ3 LYS 34 17.806 18.499 32.980
249 H CYS 35 H CYS 35 21.950 18.495 28.418
250 HA CYS 35 HA CYS 35 22.939 20.430 26.363
251 HB2 CYS 35 HB2 CYS 35 24.037 20.521 28.649
252 HB3 CYS 35 HB3 CYS 35 24.635 18.895 28.337
253 H LYS 36 H LYS 36 24.401 19.596 24.781
254 HA LYS 36 HA LYS 36 24.803 16.729 24.417
255 HB2 LYS 36 HB2 LYS 36 22.848 18.318 22.914
256 HB3 LYS 36 HB3 LYS 36 24.183 17.919 21.863
257 HG2 LYS 36 HG2 LYS 36 23.761 15.458 22.877
258 HG3 LYS 36 HG3 LYS 36 22.192 16.167 23.296
259 HD2 LYS 36 HD2 LYS 36 22.036 14.978 21.175
260 HD3 LYS 36 HD3 LYS 36 21.825 16.717 20.877
261 HE2 LYS 36 HE2 LYS 36 24.151 16.918 20.120
262 HE3 LYS 36 HE3 LYS 36 24.496 15.266 20.649
263 HZ1 LYS 36 HZ1 LYS 36 24.204 15.395 18.302
264 HZ2 LYS 36 HZ2 LYS 36 22.983 14.470 18.932
265 HZ3 LYS 36 HZ3 LYS 36 22.720 16.023 18.399
266 H CYS 37 H CYS 37 26.645 16.409 23.052
267 HA CYS 37 HA CYS 37 28.363 18.813 22.791
268 HB2 CYS 37 HB2 CYS 37 29.291 15.952 22.866
269 HB3 CYS 37 HB3 CYS 37 30.249 17.422 22.989
270 H GLY 38 H GLY 38 29.670 19.226 21.102
271 HA2 GLY 38 HA2 GLY 38 28.620 18.556 18.414
272 HA3 GLY 38 HA3 GLY 38 29.646 19.887 18.910
273 H VAL 39 H VAL 39 31.581 19.792 17.991
274 HA VAL 39 HA VAL 39 33.022 17.225 17.733
275 HB VAL 39 HB VAL 39 34.438 18.382 16.079
276 HG11 VAL 39 HG11 VAL 39 31.487 18.492 15.373
277 HG12 VAL 39 HG12 VAL 39 32.858 18.344 14.258
278 HG13 VAL 39 HG13 VAL 39 32.497 17.027 15.381
279 HG21 VAL 39 HG21 VAL 39 32.473 20.666 16.070
280 HG22 VAL 39 HG22 VAL 39 34.051 20.735 16.886
281 HG23 VAL 39 HG23 VAL 39 33.958 20.482 15.133
282 HA PRO 40 HA PRO 40 36.209 18.269 20.638
283 HB2 PRO 40 HB2 PRO 40 38.078 18.120 18.268
284 HB3 PRO 40 HB3 PRO 40 38.309 17.483 19.934
285 HG2 PRO 40 HG2 PRO 40 37.496 15.817 17.963
286 HG3 PRO 40 HG3 PRO 40 36.706 15.743 19.567
287 HD2 PRO 40 HD2 PRO 40 35.670 17.076 17.046
288 HD3 PRO 40 HD3 PRO 40 34.807 16.117 18.266
289 H ILE 41 H ILE 41 37.215 20.071 21.451
290 HA ILE 41 HA ILE 41 36.545 22.609 20.337
291 HB ILE 41 HB ILE 41 37.812 23.563 22.198
292 HG12 ILE 41 HG12 ILE 41 38.513 21.633 23.952
293 HG13 ILE 41 HG13 ILE 41 38.899 20.766 22.493
294 HG21 ILE 41 HG21 ILE 41 36.121 21.224 23.111
295 HG22 ILE 41 HG22 ILE 41 36.376 22.770 23.935
296 HG23 ILE 41 HG23 ILE 41 35.464 22.729 22.430
297 HD11 ILE 41 HD11 ILE 41 40.420 22.632 21.809
298 HD12 ILE 41 HD12 ILE 41 39.982 23.503 23.291
299 HD13 ILE 41 HD13 ILE 41 40.854 21.957 23.387
300 H SER 42 H SER 42 39.262 20.722 19.555
301 HA SER 42 HA SER 42 41.367 22.471 19.424
302 HB2 SER 42 HB2 SER 42 42.186 20.972 17.503
303 HB3 SER 42 HB3 SER 42 41.841 20.232 19.065
304 HG SER 42 HG SER 42 40.372 20.083 16.664
305 H TYR 43 H TYR 43 42.063 24.095 18.276
306 HA TYR 43 HA TYR 43 40.273 25.419 16.377
307 HB2 TYR 43 HB2 TYR 43 43.031 26.202 17.417
308 HB3 TYR 43 HB3 TYR 43 41.914 27.248 16.549
309 HD1 TYR 43 HD1 TYR 43 42.919 26.055 19.806
310 HD2 TYR 43 HD2 TYR 43 39.613 27.741 17.608
311 HE1 TYR 43 HE1 TYR 43 41.831 26.736 21.943
312 HE2 TYR 43 HE2 TYR 43 38.516 28.386 19.746
313 HH TYR 43 HH TYR 43 40.083 27.869 22.906
314 H LEU 44 H LEU 44 42.942 23.292 16.064
315 HA LEU 44 HA LEU 44 42.990 23.668 13.121
316 HB2 LEU 44 HB2 LEU 44 44.968 24.815 14.067
317 HB3 LEU 44 HB3 LEU 44 45.423 23.347 14.936
318 HG LEU 44 HG LEU 44 45.840 22.184 12.794
319 HD11 LEU 44 HD11 LEU 44 45.929 23.508 10.690
320 HD12 LEU 44 HD12 LEU 44 44.281 23.331 11.300
321 HD13 LEU 44 HD13 LEU 44 45.144 24.868 11.533
322 HD21 LEU 44 HD21 LEU 44 47.641 23.421 13.940
323 HD22 LEU 44 HD22 LEU 44 47.850 23.446 12.183
324 HD23 LEU 44 HD23 LEU 44 47.223 24.887 13.023
Start of MODEL 7
1 H1 ALA 1 H1 ALA 1 27.578 25.272 35.733
2 H2 ALA 1 H2 ALA 1 27.896 24.682 34.230
3 H3 ALA 1 H3 ALA 1 28.731 24.123 35.540
4 HA ALA 1 HA ALA 1 25.855 23.782 35.076
5 HB1 ALA 1 HB1 ALA 1 28.096 21.726 34.884
6 HB2 ALA 1 HB2 ALA 1 26.362 21.380 34.751
7 HB3 ALA 1 HB3 ALA 1 27.159 22.379 33.527
8 H LYS 2 H LYS 2 24.641 22.894 36.698
9 HA LYS 2 HA LYS 2 25.900 21.771 39.137
10 HB2 LYS 2 HB2 LYS 2 25.782 24.281 39.404
11 HB3 LYS 2 HB3 LYS 2 24.042 24.179 39.162
12 HG2 LYS 2 HG2 LYS 2 24.005 22.642 41.262
13 HG3 LYS 2 HG3 LYS 2 25.704 23.071 41.470
14 HD2 LYS 2 HD2 LYS 2 24.352 24.485 42.891
15 HD3 LYS 2 HD3 LYS 2 25.011 25.497 41.596
16 HE2 LYS 2 HE2 LYS 2 22.875 25.287 40.342
17 HE3 LYS 2 HE3 LYS 2 22.240 24.203 41.588
18 HZ1 LYS 2 HZ1 LYS 2 22.917 27.070 42.024
19 HZ2 LYS 2 HZ2 LYS 2 21.426 26.464 41.862
20 HZ3 LYS 2 HZ3 LYS 2 22.311 26.032 43.156
21 H ASN 3 H ASN 3 22.923 22.517 37.353
22 HA ASN 3 HA ASN 3 21.471 20.232 38.584
23 HB2 ASN 3 HB2 ASN 3 19.577 21.814 39.128
24 HB3 ASN 3 HB3 ASN 3 21.012 21.977 40.125
25 HD21 ASN 3 HD21 ASN 3 20.175 25.431 39.573
26 HD22 ASN 3 HD22 ASN 3 19.989 24.086 40.695
27 H GLN 4 H GLN 4 21.209 22.890 36.212
28 HA GLN 4 HA GLN 4 19.740 21.082 34.336
29 HB2 GLN 4 HB2 GLN 4 18.569 22.963 33.552
30 HB3 GLN 4 HB3 GLN 4 18.427 22.873 35.305
31 HG2 GLN 4 HG2 GLN 4 20.352 24.655 35.371
32 HG3 GLN 4 HG3 GLN 4 20.010 24.870 33.644
33 HE21 GLN 4 HE21 GLN 4 16.572 25.408 34.318
34 HE22 GLN 4 HE22 GLN 4 17.753 25.205 33.042
35 H PHE 5 H PHE 5 22.723 21.352 34.563
36 HA PHE 5 HA PHE 5 24.587 21.838 33.384
37 HB2 PHE 5 HB2 PHE 5 22.771 21.321 31.018
38 HB3 PHE 5 HB3 PHE 5 24.530 21.320 31.006
39 HD1 PHE 5 HD1 PHE 5 21.573 19.530 32.466
40 HD2 PHE 5 HD2 PHE 5 25.788 19.417 31.590
41 HE1 PHE 5 HE1 PHE 5 21.643 17.125 33.078
42 HE2 PHE 5 HE2 PHE 5 25.823 16.994 32.118
43 HZ PHE 5 HZ PHE 5 23.760 15.848 32.905
44 H GLY 6 H GLY 6 23.019 24.222 34.116
45 HA2 GLY 6 HA2 GLY 6 23.051 26.508 33.778
46 HA3 GLY 6 HA3 GLY 6 24.267 26.259 32.520
47 H CYS 7 H CYS 7 21.671 24.389 31.602
48 HA CYS 7 HA CYS 7 21.037 26.313 29.485
49 HB2 CYS 7 HB2 CYS 7 20.538 23.334 29.811
50 HB3 CYS 7 HB3 CYS 7 20.165 24.263 28.373
51 H PHE 8 H PHE 8 19.082 27.069 28.946
52 HA PHE 8 HA PHE 8 16.686 25.661 29.822
53 HB2 PHE 8 HB2 PHE 8 17.065 27.266 31.691
54 HB3 PHE 8 HB3 PHE 8 16.961 28.595 30.547
55 HD1 PHE 8 HD1 PHE 8 14.828 29.189 29.459
56 HD2 PHE 8 HD2 PHE 8 15.097 26.062 32.420
57 HE1 PHE 8 HE1 PHE 8 12.338 29.126 29.649
58 HE2 PHE 8 HE2 PHE 8 12.627 25.985 32.579
59 HZ PHE 8 HZ PHE 8 11.247 27.477 31.176
60 H ALA 9 H ALA 9 15.235 25.587 28.272
61 HA ALA 9 HA ALA 9 14.316 25.753 26.240
62 HB1 ALA 9 HB1 ALA 9 13.127 27.487 27.420
63 HB2 ALA 9 HB2 ALA 9 14.359 28.697 26.983
64 HB3 ALA 9 HB3 ALA 9 13.343 27.962 25.723
65 H ASN 10 H ASN 10 16.672 25.065 25.688
66 HA ASN 10 HA ASN 10 18.355 24.929 24.201
67 HB2 ASN 10 HB2 ASN 10 16.556 26.686 22.500
68 HB3 ASN 10 HB3 ASN 10 17.963 25.856 21.891
69 HD21 ASN 10 HD21 ASN 10 15.106 23.972 21.048
70 HD22 ASN 10 HD22 ASN 10 15.488 25.662 20.870
71 H VAL 11 H VAL 11 18.386 27.478 26.086
72 HA VAL 11 HA VAL 11 20.781 28.662 24.730
73 HB VAL 11 HB VAL 11 18.704 30.221 26.317
74 HG11 VAL 11 HG11 VAL 11 19.935 32.192 25.343
75 HG12 VAL 11 HG12 VAL 11 20.976 31.262 26.407
76 HG13 VAL 11 HG13 VAL 11 21.133 31.094 24.643
77 HG21 VAL 11 HG21 VAL 11 19.208 30.104 23.306
78 HG22 VAL 11 HG22 VAL 11 17.732 29.598 24.147
79 HG23 VAL 11 HG23 VAL 11 18.180 31.299 24.118
80 H ASP 12 H ASP 12 22.494 29.276 25.967
81 HA ASP 12 HA ASP 12 22.760 28.187 28.660
82 HB2 ASP 12 HB2 ASP 12 25.058 28.808 28.491
83 HB3 ASP 12 HB3 ASP 12 24.562 27.942 27.053
84 H VAL 13 H VAL 13 20.714 29.777 28.875
85 HA VAL 13 HA VAL 13 21.332 32.539 29.600
86 HB VAL 13 HB VAL 13 18.907 32.327 30.648
87 HG11 VAL 13 HG11 VAL 13 19.485 33.675 28.717
88 HG12 VAL 13 HG12 VAL 13 19.388 32.236 27.683
89 HG13 VAL 13 HG13 VAL 13 17.931 32.847 28.490
90 HG21 VAL 13 HG21 VAL 13 17.468 30.710 29.701
91 HG22 VAL 13 HG22 VAL 13 18.731 30.048 28.662
92 HG23 VAL 13 HG23 VAL 13 18.825 29.812 30.416
93 H LYS 14 H LYS 14 21.048 29.547 31.406
94 HA LYS 14 HA LYS 14 20.887 31.039 33.992
95 HB2 LYS 14 HB2 LYS 14 20.786 28.034 33.747
96 HB3 LYS 14 HB3 LYS 14 20.224 29.061 35.055
97 HG2 LYS 14 HG2 LYS 14 18.966 28.664 32.332
98 HG3 LYS 14 HG3 LYS 14 18.335 28.137 33.880
99 HD2 LYS 14 HD2 LYS 14 18.625 31.044 33.053
100 HD3 LYS 14 HD3 LYS 14 17.145 30.102 32.904
101 HE2 LYS 14 HE2 LYS 14 16.913 29.854 35.275
102 HE3 LYS 14 HE3 LYS 14 18.535 30.483 35.581
103 HZ1 LYS 14 HZ1 LYS 14 17.866 32.628 34.870
104 HZ2 LYS 14 HZ2 LYS 14 16.400 32.117 34.331
105 HZ3 LYS 14 HZ3 LYS 14 16.717 32.116 35.943
106 H GLY 15 H GLY 15 23.177 29.044 32.222
107 HA2 GLY 15 HA2 GLY 15 25.440 30.014 33.727
108 HA3 GLY 15 HA3 GLY 15 25.011 28.387 34.252
109 H ASP 16 H ASP 16 26.744 27.243 33.407
110 HA ASP 16 HA ASP 16 27.047 27.250 30.441
111 HB2 ASP 16 HB2 ASP 16 29.370 26.979 30.601
112 HB3 ASP 16 HB3 ASP 16 28.945 28.346 31.633
113 H CYS 17 H CYS 17 27.213 25.519 29.357
114 HA CYS 17 HA CYS 17 27.024 22.752 30.521
115 HB2 CYS 17 HB2 CYS 17 25.181 22.698 29.287
116 HB3 CYS 17 HB3 CYS 17 25.490 24.250 28.589
117 H LYS 18 H LYS 18 28.924 24.919 28.597
118 HA LYS 18 HA LYS 18 30.723 23.475 27.120
119 HB2 LYS 18 HB2 LYS 18 30.916 25.871 27.421
120 HB3 LYS 18 HB3 LYS 18 31.087 25.709 29.160
121 HG2 LYS 18 HG2 LYS 18 33.194 26.307 28.410
122 HG3 LYS 18 HG3 LYS 18 33.333 24.615 28.810
123 HD2 LYS 18 HD2 LYS 18 34.484 24.654 26.831
124 HD3 LYS 18 HD3 LYS 18 32.885 24.254 26.197
125 HE2 LYS 18 HE2 LYS 18 32.474 26.573 25.563
126 HE3 LYS 18 HE3 LYS 18 33.847 27.133 26.526
127 HZ1 LYS 18 HZ1 LYS 18 34.440 27.131 24.220
128 HZ2 LYS 18 HZ2 LYS 18 35.338 26.005 24.993
129 HZ3 LYS 18 HZ3 LYS 18 34.066 25.559 24.012
130 H ARG 19 H ARG 19 30.989 23.759 30.736
131 HA ARG 19 HA ARG 19 33.309 22.116 30.892
132 HB2 ARG 19 HB2 ARG 19 31.291 23.123 32.903
133 HB3 ARG 19 HB3 ARG 19 32.466 21.891 33.393
134 HG2 ARG 19 HG2 ARG 19 34.327 23.255 32.602
135 HG3 ARG 19 HG3 ARG 19 33.232 24.537 32.080
136 HD2 ARG 19 HD2 ARG 19 33.449 23.571 34.967
137 HD3 ARG 19 HD3 ARG 19 34.457 24.852 34.276
138 HE ARG 19 HE ARG 19 31.640 25.386 33.834
139 HH11 ARG 19 HH11 ARG 19 34.229 25.785 36.245
140 HH12 ARG 19 HH12 ARG 19 33.391 27.184 36.922
141 HH21 ARG 19 HH21 ARG 19 30.668 27.029 34.916
142 HH22 ARG 19 HH22 ARG 19 31.547 27.857 36.212
143 H HIS 20 H HIS 20 30.004 21.009 30.621
144 HA HIS 20 HA HIS 20 30.613 18.255 31.475
145 HB2 HIS 20 HB2 HIS 20 28.371 19.021 31.738
146 HB3 HIS 20 HB3 HIS 20 28.277 19.603 30.080
147 HD2 HIS 20 HD2 HIS 20 27.140 18.088 28.412
148 HE1 HIS 20 HE1 HIS 20 27.490 14.345 30.424
149 HE2 HIS 20 HE2 HIS 20 26.547 15.493 28.356
150 H CYS 21 H CYS 21 30.253 19.912 28.283
151 HA CYS 21 HA CYS 21 31.020 17.499 26.839
152 HB2 CYS 21 HB2 CYS 21 30.585 20.384 26.058
153 HB3 CYS 21 HB3 CYS 21 31.093 19.180 24.892
154 H LYS 22 H LYS 22 32.841 20.287 28.060
155 HA LYS 22 HA LYS 22 35.269 19.831 26.678
156 HB2 LYS 22 HB2 LYS 22 34.708 21.883 27.928
157 HB3 LYS 22 HB3 LYS 22 34.710 20.990 29.433
158 HG2 LYS 22 HG2 LYS 22 36.669 22.195 29.456
159 HG3 LYS 22 HG3 LYS 22 37.207 20.571 29.102
160 HD2 LYS 22 HD2 LYS 22 36.815 22.805 27.049
161 HD3 LYS 22 HD3 LYS 22 38.332 22.472 27.850
162 HE2 LYS 22 HE2 LYS 22 36.893 20.617 25.915
163 HE3 LYS 22 HE3 LYS 22 38.311 21.612 25.595
164 HZ1 LYS 22 HZ1 LYS 22 39.084 19.405 26.047
165 HZ2 LYS 22 HZ2 LYS 22 39.486 20.302 27.356
166 HZ3 LYS 22 HZ3 LYS 22 38.219 19.260 27.415
167 H ALA 23 H ALA 23 33.951 18.143 29.490
168 HA ALA 23 HA ALA 23 36.336 16.645 30.137
169 HB1 ALA 23 HB1 ALA 23 34.456 17.026 31.696
170 HB2 ALA 23 HB2 ALA 23 33.384 16.085 30.642
171 HB3 ALA 23 HB3 ALA 23 34.745 15.290 31.457
172 H GLU 24 H GLU 24 33.833 16.242 27.692
173 HA GLU 24 HA GLU 24 34.862 13.608 26.780
174 HB2 GLU 24 HB2 GLU 24 32.710 15.368 25.550
175 HB3 GLU 24 HB3 GLU 24 33.056 13.697 25.164
176 HG2 GLU 24 HG2 GLU 24 31.884 14.748 27.766
177 HG3 GLU 24 HG3 GLU 24 31.016 13.923 26.481
178 H ASP 25 H ASP 25 36.142 16.501 26.702
179 HA ASP 25 HA ASP 25 37.325 17.856 25.478
180 HB2 ASP 25 HB2 ASP 25 38.627 15.663 25.438
181 HB3 ASP 25 HB3 ASP 25 38.166 15.544 23.740
182 H LYS 26 H LYS 26 34.628 17.795 24.729
183 HA LYS 26 HA LYS 26 34.641 18.717 21.879
184 HB2 LYS 26 HB2 LYS 26 32.397 17.498 23.519
185 HB3 LYS 26 HB3 LYS 26 32.223 18.213 21.918
186 HG2 LYS 26 HG2 LYS 26 34.255 16.429 21.423
187 HG3 LYS 26 HG3 LYS 26 33.363 15.591 22.704
188 HD2 LYS 26 HD2 LYS 26 31.255 15.939 21.379
189 HD3 LYS 26 HD3 LYS 26 32.237 16.686 20.093
190 HE2 LYS 26 HE2 LYS 26 33.523 14.602 19.842
191 HE3 LYS 26 HE3 LYS 26 32.684 13.896 21.225
192 HZ1 LYS 26 HZ1 LYS 26 30.603 14.451 19.686
193 HZ2 LYS 26 HZ2 LYS 26 31.700 14.149 18.498
194 HZ3 LYS 26 HZ3 LYS 26 31.373 13.019 19.657
195 H GLU 27 H GLU 27 32.894 20.249 21.377
196 HA GLU 27 HA GLU 27 32.700 22.540 23.238
197 HB2 GLU 27 HB2 GLU 27 31.645 21.994 20.441
198 HB3 GLU 27 HB3 GLU 27 31.365 23.493 21.306
199 HG2 GLU 27 HG2 GLU 27 34.217 22.559 20.837
200 HG3 GLU 27 HG3 GLU 27 33.289 23.248 19.521
201 H GLY 28 H GLY 28 30.672 23.235 24.012
202 HA2 GLY 28 HA2 GLY 28 28.467 21.197 24.173
203 HA3 GLY 28 HA3 GLY 28 28.838 22.332 25.450
204 H ILE 29 H ILE 29 26.246 21.877 23.938
205 HA ILE 29 HA ILE 29 25.632 24.699 23.574
206 HB ILE 29 HB ILE 29 26.344 23.947 21.374
207 HG12 ILE 29 HG12 ILE 29 24.470 25.632 21.811
208 HG13 ILE 29 HG13 ILE 29 24.825 25.101 20.177
209 HG21 ILE 29 HG21 ILE 29 25.015 22.410 19.986
210 HG22 ILE 29 HG22 ILE 29 25.891 21.618 21.297
211 HG23 ILE 29 HG23 ILE 29 24.143 21.888 21.441
212 HD11 ILE 29 HD11 ILE 29 22.577 23.899 21.819
213 HD12 ILE 29 HD12 ILE 29 22.377 25.276 20.714
214 HD13 ILE 29 HD13 ILE 29 22.886 23.699 20.085
215 H CYS 30 H CYS 30 23.560 25.146 24.262
216 HA CYS 30 HA CYS 30 22.362 23.078 25.898
217 HB2 CYS 30 HB2 CYS 30 21.692 25.975 25.332
218 HB3 CYS 30 HB3 CYS 30 20.733 24.954 26.420
219 H HIS 31 H HIS 31 20.798 21.725 25.460
220 HA HIS 31 HA HIS 31 18.682 22.435 23.463
221 HB2 HIS 31 HB2 HIS 31 20.066 19.777 23.854
222 HB3 HIS 31 HB3 HIS 31 18.444 19.908 23.196
223 HD2 HIS 31 HD2 HIS 31 21.894 21.557 22.317
224 HE1 HIS 31 HE1 HIS 31 19.983 20.409 18.685
225 HE2 HIS 31 HE2 HIS 31 22.081 21.410 19.671
226 H GLY 32 H GLY 32 16.939 22.879 24.526
227 HA2 GLY 32 HA2 GLY 32 15.217 22.900 26.096
228 HA3 GLY 32 HA3 GLY 32 15.665 21.254 26.537
229 H THR 33 H THR 33 16.014 21.134 28.633
230 HA THR 33 HA THR 33 17.649 23.186 30.068
231 HB THR 33 HB THR 33 16.772 22.255 32.167
232 HG1 THR 33 HG1 THR 33 14.701 20.989 30.835
233 HG21 THR 33 HG21 THR 33 15.709 24.204 31.168
234 HG22 THR 33 HG22 THR 33 14.633 23.186 30.209
235 HG23 THR 33 HG23 THR 33 14.505 23.210 31.982
236 H LYS 34 H LYS 34 18.697 21.183 28.271
237 HA LYS 34 HA LYS 34 20.612 19.786 30.079
238 HB2 LYS 34 HB2 LYS 34 19.253 18.564 27.637
239 HB3 LYS 34 HB3 LYS 34 20.443 17.773 28.657
240 HG2 LYS 34 HG2 LYS 34 17.651 18.619 29.559
241 HG3 LYS 34 HG3 LYS 34 18.110 17.008 29.042
242 HD2 LYS 34 HD2 LYS 34 19.587 16.691 30.903
243 HD3 LYS 34 HD3 LYS 34 19.438 18.364 31.437
244 HE2 LYS 34 HE2 LYS 34 17.049 16.492 31.214
245 HE3 LYS 34 HE3 LYS 34 18.041 16.567 32.668
246 HZ1 LYS 34 HZ1 LYS 34 16.671 18.962 31.544
247 HZ2 LYS 34 HZ2 LYS 34 16.046 17.991 32.708
248 HZ3 LYS 34 HZ3 LYS 34 17.419 18.838 33.003
249 H CYS 35 H CYS 35 22.500 18.963 28.818
250 HA CYS 35 HA CYS 35 23.467 21.026 26.895
251 HB2 CYS 35 HB2 CYS 35 24.674 20.453 29.048
252 HB3 CYS 35 HB3 CYS 35 24.972 18.857 28.392
253 H LYS 36 H LYS 36 24.590 20.258 24.945
254 HA LYS 36 HA LYS 36 24.362 17.449 24.143
255 HB2 LYS 36 HB2 LYS 36 22.316 18.702 23.360
256 HB3 LYS 36 HB3 LYS 36 23.349 19.852 22.535
257 HG2 LYS 36 HG2 LYS 36 23.687 16.935 21.908
258 HG3 LYS 36 HG3 LYS 36 22.220 17.732 21.335
259 HD2 LYS 36 HD2 LYS 36 23.344 19.168 19.904
260 HD3 LYS 36 HD3 LYS 36 24.897 19.036 20.743
261 HE2 LYS 36 HE2 LYS 36 25.360 16.917 19.927
262 HE3 LYS 36 HE3 LYS 36 23.665 16.557 19.565
263 HZ1 LYS 36 HZ1 LYS 36 24.964 17.032 17.542
264 HZ2 LYS 36 HZ2 LYS 36 23.703 18.051 17.743
265 HZ3 LYS 36 HZ3 LYS 36 25.225 18.589 18.066
266 H CYS 37 H CYS 37 26.256 16.930 23.017
267 HA CYS 37 HA CYS 37 28.261 19.100 22.939
268 HB2 CYS 37 HB2 CYS 37 28.753 16.165 22.550
269 HB3 CYS 37 HB3 CYS 37 29.942 17.445 22.764
270 H GLY 38 H GLY 38 29.294 19.924 21.328
271 HA2 GLY 38 HA2 GLY 38 28.304 19.577 18.573
272 HA3 GLY 38 HA3 GLY 38 29.359 20.853 19.188
273 H VAL 39 H VAL 39 31.270 20.736 18.106
274 HA VAL 39 HA VAL 39 32.395 18.171 17.293
275 HB VAL 39 HB VAL 39 34.103 19.555 16.123
276 HG11 VAL 39 HG11 VAL 39 32.074 18.795 14.960
277 HG12 VAL 39 HG12 VAL 39 31.224 20.287 15.445
278 HG13 VAL 39 HG13 VAL 39 32.629 20.362 14.365
279 HG21 VAL 39 HG21 VAL 39 33.789 21.945 15.861
280 HG22 VAL 39 HG22 VAL 39 32.420 21.949 16.983
281 HG23 VAL 39 HG23 VAL 39 34.060 21.565 17.564
282 HA PRO 40 HA PRO 40 35.658 17.803 20.375
283 HB2 PRO 40 HB2 PRO 40 37.468 17.410 18.019
284 HB3 PRO 40 HB3 PRO 40 37.290 16.416 19.496
285 HG2 PRO 40 HG2 PRO 40 36.212 15.628 17.131
286 HG3 PRO 40 HG3 PRO 40 35.369 15.363 18.687
287 HD2 PRO 40 HD2 PRO 40 34.778 17.501 16.611
288 HD3 PRO 40 HD3 PRO 40 33.687 16.536 17.639
289 H ILE 41 H ILE 41 37.190 19.254 21.299
290 HA ILE 41 HA ILE 41 37.253 21.877 20.151
291 HB ILE 41 HB ILE 41 38.511 22.594 22.001
292 HG12 ILE 41 HG12 ILE 41 38.980 20.708 23.837
293 HG13 ILE 41 HG13 ILE 41 39.186 19.695 22.422
294 HG21 ILE 41 HG21 ILE 41 36.512 20.545 23.011
295 HG22 ILE 41 HG22 ILE 41 36.977 22.085 23.757
296 HG23 ILE 41 HG23 ILE 41 36.072 22.088 22.245
297 HD11 ILE 41 HD11 ILE 41 40.699 22.254 23.122
298 HD12 ILE 41 HD12 ILE 41 41.329 20.597 23.142
299 HD13 ILE 41 HD13 ILE 41 40.943 21.367 21.608
300 H SER 42 H SER 42 39.545 19.182 20.047
301 HA SER 42 HA SER 42 41.820 20.698 19.329
302 HB2 SER 42 HB2 SER 42 41.731 18.310 20.215
303 HB3 SER 42 HB3 SER 42 41.374 17.792 18.554
304 HG SER 42 HG SER 42 43.439 18.036 18.127
305 H TYR 43 H TYR 43 42.616 21.464 17.457
306 HA TYR 43 HA TYR 43 41.000 21.172 14.981
307 HB2 TYR 43 HB2 TYR 43 43.358 22.961 15.655
308 HB3 TYR 43 HB3 TYR 43 42.486 22.975 14.130
309 HD1 TYR 43 HD1 TYR 43 39.976 23.516 14.114
310 HD2 TYR 43 HD2 TYR 43 42.509 24.208 17.541
311 HE1 TYR 43 HE1 TYR 43 38.281 25.066 15.056
312 HE2 TYR 43 HE2 TYR 43 40.819 25.782 18.460
313 HH TYR 43 HH TYR 43 37.773 26.540 16.734
314 H LEU 44 H LEU 44 43.538 19.490 16.321
315 HA LEU 44 HA LEU 44 44.156 18.056 13.851
316 HB2 LEU 44 HB2 LEU 44 46.652 18.187 14.348
317 HB3 LEU 44 HB3 LEU 44 45.895 19.573 13.615
318 HG LEU 44 HG LEU 44 45.933 20.820 15.734
319 HD11 LEU 44 HD11 LEU 44 47.278 19.952 17.637
320 HD12 LEU 44 HD12 LEU 44 45.808 19.023 17.392
321 HD13 LEU 44 HD13 LEU 44 47.371 18.363 16.847
322 HD21 LEU 44 HD21 LEU 44 48.613 19.568 14.977
323 HD22 LEU 44 HD22 LEU 44 47.821 20.940 14.162
324 HD23 LEU 44 HD23 LEU 44 48.370 21.108 15.832
Start of MODEL 8
1 H1 ALA 1 H1 ALA 1 28.456 23.997 33.506
2 H2 ALA 1 H2 ALA 1 29.331 23.291 34.720
3 H3 ALA 1 H3 ALA 1 28.922 24.885 34.821
4 HA ALA 1 HA ALA 1 27.557 23.657 36.273
5 HB1 ALA 1 HB1 ALA 1 26.582 25.602 35.130
6 HB2 ALA 1 HB2 ALA 1 26.048 24.565 33.791
7 HB3 ALA 1 HB3 ALA 1 25.373 24.340 35.417
8 H LYS 2 H LYS 2 25.781 22.044 36.537
9 HA LYS 2 HA LYS 2 26.090 19.661 34.750
10 HB2 LYS 2 HB2 LYS 2 27.854 19.673 36.518
11 HB3 LYS 2 HB3 LYS 2 26.630 19.809 37.752
12 HG2 LYS 2 HG2 LYS 2 26.721 17.607 37.941
13 HG3 LYS 2 HG3 LYS 2 25.769 17.507 36.473
14 HD2 LYS 2 HD2 LYS 2 28.803 17.483 36.646
15 HD3 LYS 2 HD3 LYS 2 27.752 16.075 36.384
16 HE2 LYS 2 HE2 LYS 2 26.856 17.345 34.316
17 HE3 LYS 2 HE3 LYS 2 28.245 18.428 34.510
18 HZ1 LYS 2 HZ1 LYS 2 29.703 16.467 34.242
19 HZ2 LYS 2 HZ2 LYS 2 28.394 15.472 34.142
20 HZ3 LYS 2 HZ3 LYS 2 28.691 16.565 32.971
21 H ASN 3 H ASN 3 24.349 20.821 37.741
22 HA ASN 3 HA ASN 3 22.603 18.581 37.647
23 HB2 ASN 3 HB2 ASN 3 22.121 21.196 39.104
24 HB3 ASN 3 HB3 ASN 3 21.376 19.642 39.445
25 HD21 ASN 3 HD21 ASN 3 24.101 18.712 41.518
26 HD22 ASN 3 HD22 ASN 3 22.452 18.315 41.021
27 H GLN 4 H GLN 4 22.234 21.754 36.122
28 HA GLN 4 HA GLN 4 20.197 20.489 34.370
29 HB2 GLN 4 HB2 GLN 4 18.868 22.409 34.151
30 HB3 GLN 4 HB3 GLN 4 18.953 22.021 35.866
31 HG2 GLN 4 HG2 GLN 4 20.423 23.882 36.301
32 HG3 GLN 4 HG3 GLN 4 20.695 24.175 34.575
33 HE21 GLN 4 HE21 GLN 4 18.563 24.696 33.247
34 HE22 GLN 4 HE22 GLN 4 17.469 25.743 34.146
35 H PHE 5 H PHE 5 23.139 20.997 34.355
36 HA PHE 5 HA PHE 5 24.845 21.822 33.138
37 HB2 PHE 5 HB2 PHE 5 22.989 21.556 30.780
38 HB3 PHE 5 HB3 PHE 5 24.748 21.455 30.821
39 HD1 PHE 5 HD1 PHE 5 21.595 19.680 31.582
40 HD2 PHE 5 HD2 PHE 5 25.896 19.449 31.651
41 HE1 PHE 5 HE1 PHE 5 21.457 17.209 31.855
42 HE2 PHE 5 HE2 PHE 5 25.750 16.982 31.935
43 HZ PHE 5 HZ PHE 5 23.536 15.866 32.012
44 H GLY 6 H GLY 6 22.785 23.978 34.036
45 HA2 GLY 6 HA2 GLY 6 22.695 26.271 33.904
46 HA3 GLY 6 HA3 GLY 6 24.024 26.232 32.734
47 H CYS 7 H CYS 7 21.651 24.221 31.506
48 HA CYS 7 HA CYS 7 21.029 26.235 29.465
49 HB2 CYS 7 HB2 CYS 7 20.550 23.245 29.613
50 HB3 CYS 7 HB3 CYS 7 20.103 24.249 28.255
51 H PHE 8 H PHE 8 19.154 27.158 29.103
52 HA PHE 8 HA PHE 8 16.659 25.689 29.610
53 HB2 PHE 8 HB2 PHE 8 17.012 27.011 31.709
54 HB3 PHE 8 HB3 PHE 8 17.020 28.482 30.753
55 HD1 PHE 8 HD1 PHE 8 14.965 29.422 29.844
56 HD2 PHE 8 HD2 PHE 8 14.946 25.673 31.980
57 HE1 PHE 8 HE1 PHE 8 12.474 29.483 29.962
58 HE2 PHE 8 HE2 PHE 8 12.462 25.735 32.062
59 HZ PHE 8 HZ PHE 8 11.228 27.632 31.044
60 H ALA 9 H ALA 9 15.050 26.185 28.062
61 HA ALA 9 HA ALA 9 14.304 26.800 26.024
62 HB1 ALA 9 HB1 ALA 9 15.124 29.566 26.975
63 HB2 ALA 9 HB2 ALA 9 13.876 29.175 25.770
64 HB3 ALA 9 HB3 ALA 9 13.651 28.699 27.460
65 H ASN 10 H ASN 10 16.790 25.704 25.707
66 HA ASN 10 HA ASN 10 18.643 25.507 24.466
67 HB2 ASN 10 HB2 ASN 10 17.153 27.108 22.351
68 HB3 ASN 10 HB3 ASN 10 18.499 26.013 22.088
69 HD21 ASN 10 HD21 ASN 10 15.698 24.231 21.091
70 HD22 ASN 10 HD22 ASN 10 16.955 25.301 20.483
71 H VAL 11 H VAL 11 18.671 27.842 26.285
72 HA VAL 11 HA VAL 11 21.000 29.262 25.073
73 HB VAL 11 HB VAL 11 18.816 30.531 26.761
74 HG11 VAL 11 HG11 VAL 11 21.043 31.579 27.175
75 HG12 VAL 11 HG12 VAL 11 21.301 31.729 25.427
76 HG13 VAL 11 HG13 VAL 11 20.015 32.649 26.229
77 HG21 VAL 11 HG21 VAL 11 18.402 31.897 24.715
78 HG22 VAL 11 HG22 VAL 11 19.573 30.909 23.818
79 HG23 VAL 11 HG23 VAL 11 18.070 30.192 24.422
80 H ASP 12 H ASP 12 22.702 29.693 26.406
81 HA ASP 12 HA ASP 12 22.943 28.192 28.894
82 HB2 ASP 12 HB2 ASP 12 25.256 28.739 28.783
83 HB3 ASP 12 HB3 ASP 12 24.718 28.220 27.201
84 H VAL 13 H VAL 13 20.928 29.769 29.406
85 HA VAL 13 HA VAL 13 21.612 32.409 30.440
86 HB VAL 13 HB VAL 13 19.207 32.026 31.572
87 HG11 VAL 13 HG11 VAL 13 19.654 32.587 28.641
88 HG12 VAL 13 HG12 VAL 13 18.191 32.977 29.568
89 HG13 VAL 13 HG13 VAL 13 19.727 33.753 29.978
90 HG21 VAL 13 HG21 VAL 13 17.720 30.673 30.317
91 HG22 VAL 13 HG22 VAL 13 18.962 30.217 29.148
92 HG23 VAL 13 HG23 VAL 13 19.056 29.619 30.817
93 H LYS 14 H LYS 14 21.057 29.273 31.995
94 HA LYS 14 HA LYS 14 21.186 30.535 34.693
95 HB2 LYS 14 HB2 LYS 14 20.785 27.590 34.159
96 HB3 LYS 14 HB3 LYS 14 20.358 28.511 35.587
97 HG2 LYS 14 HG2 LYS 14 19.019 28.588 32.861
98 HG3 LYS 14 HG3 LYS 14 18.372 27.882 34.321
99 HD2 LYS 14 HD2 LYS 14 18.907 30.878 34.089
100 HD3 LYS 14 HD3 LYS 14 17.408 30.104 33.570
101 HE2 LYS 14 HE2 LYS 14 17.094 29.162 35.846
102 HE3 LYS 14 HE3 LYS 14 18.531 30.030 36.406
103 HZ1 LYS 14 HZ1 LYS 14 16.255 31.458 35.129
104 HZ2 LYS 14 HZ2 LYS 14 16.251 31.119 36.728
105 HZ3 LYS 14 HZ3 LYS 14 17.418 32.094 36.074
106 H GLY 15 H GLY 15 23.296 28.845 32.568
107 HA2 GLY 15 HA2 GLY 15 25.626 29.385 34.168
108 HA3 GLY 15 HA3 GLY 15 25.162 27.691 34.359
109 H ASP 16 H ASP 16 27.057 26.916 33.291
110 HA ASP 16 HA ASP 16 27.067 27.289 30.338
111 HB2 ASP 16 HB2 ASP 16 29.457 27.037 30.306
112 HB3 ASP 16 HB3 ASP 16 28.988 28.391 31.335
113 H CYS 17 H CYS 17 26.840 25.655 29.129
114 HA CYS 17 HA CYS 17 26.929 22.845 30.082
115 HB2 CYS 17 HB2 CYS 17 25.010 23.100 28.931
116 HB3 CYS 17 HB3 CYS 17 25.593 24.430 27.966
117 H LYS 18 H LYS 18 28.880 25.150 28.342
118 HA LYS 18 HA LYS 18 30.668 23.530 26.921
119 HB2 LYS 18 HB2 LYS 18 30.910 25.952 26.948
120 HB3 LYS 18 HB3 LYS 18 31.133 25.969 28.692
121 HG2 LYS 18 HG2 LYS 18 33.276 26.358 27.751
122 HG3 LYS 18 HG3 LYS 18 33.305 24.758 28.434
123 HD2 LYS 18 HD2 LYS 18 34.456 24.520 26.426
124 HD3 LYS 18 HD3 LYS 18 32.850 23.885 26.031
125 HE2 LYS 18 HE2 LYS 18 32.206 26.009 24.972
126 HE3 LYS 18 HE3 LYS 18 33.650 26.796 25.594
127 HZ1 LYS 18 HZ1 LYS 18 33.994 26.305 23.312
128 HZ2 LYS 18 HZ2 LYS 18 34.988 25.319 24.155
129 HZ3 LYS 18 HZ3 LYS 18 33.591 24.767 23.428
130 H ARG 19 H ARG 19 30.853 24.175 30.505
131 HA ARG 19 HA ARG 19 33.195 22.724 30.992
132 HB2 ARG 19 HB2 ARG 19 30.989 23.767 32.613
133 HB3 ARG 19 HB3 ARG 19 31.508 22.211 33.233
134 HG2 ARG 19 HG2 ARG 19 33.815 22.933 33.400
135 HG3 ARG 19 HG3 ARG 19 33.433 24.498 32.673
136 HD2 ARG 19 HD2 ARG 19 32.174 23.538 35.281
137 HD3 ARG 19 HD3 ARG 19 33.706 24.421 35.205
138 HE ARG 19 HE ARG 19 31.537 25.754 33.760
139 HH11 ARG 19 HH11 ARG 19 32.969 25.573 36.997
140 HH12 ARG 19 HH12 ARG 19 32.745 27.313 37.210
141 HH21 ARG 19 HH21 ARG 19 30.973 27.729 34.337
142 HH22 ARG 19 HH22 ARG 19 31.470 28.408 35.885
143 H HIS 20 H HIS 20 29.936 21.352 30.787
144 HA HIS 20 HA HIS 20 30.627 18.676 31.591
145 HB2 HIS 20 HB2 HIS 20 28.340 19.414 31.688
146 HB3 HIS 20 HB3 HIS 20 28.331 19.861 29.983
147 HD2 HIS 20 HD2 HIS 20 27.338 18.131 28.370
148 HE1 HIS 20 HE1 HIS 20 27.671 14.622 30.756
149 HE2 HIS 20 HE2 HIS 20 26.759 15.568 28.582
150 H CYS 21 H CYS 21 30.443 20.195 28.345
151 HA CYS 21 HA CYS 21 31.299 17.698 27.063
152 HB2 CYS 21 HB2 CYS 21 30.692 20.482 26.051
153 HB3 CYS 21 HB3 CYS 21 31.157 19.149 25.001
154 H LYS 22 H LYS 22 32.942 20.652 28.127
155 HA LYS 22 HA LYS 22 35.383 20.299 26.705
156 HB2 LYS 22 HB2 LYS 22 34.454 22.234 28.254
157 HB3 LYS 22 HB3 LYS 22 35.267 21.381 29.537
158 HG2 LYS 22 HG2 LYS 22 36.419 22.759 27.083
159 HG3 LYS 22 HG3 LYS 22 36.581 23.212 28.766
160 HD2 LYS 22 HD2 LYS 22 38.665 22.383 28.410
161 HD3 LYS 22 HD3 LYS 22 37.885 20.906 28.987
162 HE2 LYS 22 HE2 LYS 22 37.480 20.259 26.585
163 HE3 LYS 22 HE3 LYS 22 38.264 21.756 26.070
164 HZ1 LYS 22 HZ1 LYS 22 40.327 20.978 27.013
165 HZ2 LYS 22 HZ2 LYS 22 39.627 19.662 27.700
166 HZ3 LYS 22 HZ3 LYS 22 39.750 19.732 26.082
167 H ALA 23 H ALA 23 34.198 18.810 29.722
168 HA ALA 23 HA ALA 23 36.541 17.240 30.280
169 HB1 ALA 23 HB1 ALA 23 33.616 16.844 31.001
170 HB2 ALA 23 HB2 ALA 23 34.989 16.021 31.768
171 HB3 ALA 23 HB3 ALA 23 34.802 17.777 31.935
172 H GLU 24 H GLU 24 34.198 16.857 27.744
173 HA GLU 24 HA GLU 24 35.093 14.071 27.164
174 HB2 GLU 24 HB2 GLU 24 32.913 15.658 25.777
175 HB3 GLU 24 HB3 GLU 24 33.209 13.929 25.697
176 HG2 GLU 24 HG2 GLU 24 32.151 15.505 28.071
177 HG3 GLU 24 HG3 GLU 24 31.256 14.398 27.057
178 H ASP 25 H ASP 25 36.334 16.950 26.738
179 HA ASP 25 HA ASP 25 37.501 18.155 25.358
180 HB2 ASP 25 HB2 ASP 25 38.688 15.808 25.356
181 HB3 ASP 25 HB3 ASP 25 38.272 15.806 23.648
182 H LYS 26 H LYS 26 34.822 18.174 24.843
183 HA LYS 26 HA LYS 26 34.544 18.740 21.919
184 HB2 LYS 26 HB2 LYS 26 32.713 17.342 23.908
185 HB3 LYS 26 HB3 LYS 26 32.115 18.056 22.428
186 HG2 LYS 26 HG2 LYS 26 34.195 16.514 21.436
187 HG3 LYS 26 HG3 LYS 26 33.625 15.536 22.814
188 HD2 LYS 26 HD2 LYS 26 31.303 15.693 21.954
189 HD3 LYS 26 HD3 LYS 26 31.884 16.742 20.640
190 HE2 LYS 26 HE2 LYS 26 33.284 14.877 19.806
191 HE3 LYS 26 HE3 LYS 26 32.598 13.822 21.052
192 HZ1 LYS 26 HZ1 LYS 26 31.041 15.200 18.916
193 HZ2 LYS 26 HZ2 LYS 26 31.314 13.566 19.019
194 HZ3 LYS 26 HZ3 LYS 26 30.379 14.320 20.108
195 H GLU 27 H GLU 27 32.831 20.063 21.277
196 HA GLU 27 HA GLU 27 32.289 22.511 22.760
197 HB2 GLU 27 HB2 GLU 27 31.261 21.196 20.203
198 HB3 GLU 27 HB3 GLU 27 30.496 22.634 20.845
199 HG2 GLU 27 HG2 GLU 27 33.466 22.504 20.166
200 HG3 GLU 27 HG3 GLU 27 32.210 23.067 19.054
201 H GLY 28 H GLY 28 30.409 23.042 23.760
202 HA2 GLY 28 HA2 GLY 28 28.325 20.943 24.282
203 HA3 GLY 28 HA3 GLY 28 28.716 22.224 25.413
204 H ILE 29 H ILE 29 26.150 21.418 23.770
205 HA ILE 29 HA ILE 29 25.437 24.213 23.283
206 HB ILE 29 HB ILE 29 26.134 23.427 21.146
207 HG12 ILE 29 HG12 ILE 29 24.144 24.991 21.516
208 HG13 ILE 29 HG13 ILE 29 24.529 24.407 19.908
209 HG21 ILE 29 HG21 ILE 29 24.883 21.742 19.831
210 HG22 ILE 29 HG22 ILE 29 25.860 21.087 21.143
211 HG23 ILE 29 HG23 ILE 29 24.095 21.212 21.338
212 HD11 ILE 29 HD11 ILE 29 22.090 24.442 20.421
213 HD12 ILE 29 HD12 ILE 29 22.690 22.855 19.912
214 HD13 ILE 29 HD13 ILE 29 22.350 23.162 21.622
215 H CYS 30 H CYS 30 23.462 24.763 24.028
216 HA CYS 30 HA CYS 30 22.126 22.855 25.701
217 HB2 CYS 30 HB2 CYS 30 21.412 25.696 24.943
218 HB3 CYS 30 HB3 CYS 30 20.533 24.718 26.135
219 H HIS 31 H HIS 31 20.767 21.387 25.183
220 HA HIS 31 HA HIS 31 18.725 21.696 23.005
221 HB2 HIS 31 HB2 HIS 31 20.087 19.287 24.246
222 HB3 HIS 31 HB3 HIS 31 18.453 19.157 23.609
223 HD2 HIS 31 HD2 HIS 31 21.677 20.791 22.060
224 HE1 HIS 31 HE1 HIS 31 19.739 18.441 19.076
225 HE2 HIS 31 HE2 HIS 31 21.605 20.106 19.508
226 H GLY 32 H GLY 32 17.135 22.851 24.010
227 HA2 GLY 32 HA2 GLY 32 15.386 23.343 25.435
228 HA3 GLY 32 HA3 GLY 32 15.440 21.663 25.954
229 H THR 33 H THR 33 15.810 21.385 28.010
230 HA THR 33 HA THR 33 17.295 23.360 29.660
231 HB THR 33 HB THR 33 16.215 22.401 31.592
232 HG1 THR 33 HG1 THR 33 14.525 20.823 31.128
233 HG21 THR 33 HG21 THR 33 13.989 23.123 31.222
234 HG22 THR 33 HG22 THR 33 14.970 24.091 30.116
235 HG23 THR 33 HG23 THR 33 14.037 22.717 29.492
236 H LYS 34 H LYS 34 18.403 21.109 27.887
237 HA LYS 34 HA LYS 34 20.222 19.830 29.878
238 HB2 LYS 34 HB2 LYS 34 19.012 18.545 27.392
239 HB3 LYS 34 HB3 LYS 34 20.118 17.773 28.513
240 HG2 LYS 34 HG2 LYS 34 17.283 18.684 29.199
241 HG3 LYS 34 HG3 LYS 34 17.776 17.042 28.782
242 HD2 LYS 34 HD2 LYS 34 19.305 16.996 30.732
243 HD3 LYS 34 HD3 LYS 34 18.750 18.593 31.227
244 HE2 LYS 34 HE2 LYS 34 16.967 16.137 30.915
245 HE3 LYS 34 HE3 LYS 34 17.688 16.670 32.439
246 HZ1 LYS 34 HZ1 LYS 34 16.467 18.772 32.205
247 HZ2 LYS 34 HZ2 LYS 34 15.732 18.230 30.832
248 HZ3 LYS 34 HZ3 LYS 34 15.431 17.498 32.261
249 H CYS 35 H CYS 35 22.207 18.942 28.789
250 HA CYS 35 HA CYS 35 23.244 20.825 26.709
251 HB2 CYS 35 HB2 CYS 35 24.367 20.642 28.921
252 HB3 CYS 35 HB3 CYS 35 24.735 18.957 28.562
253 H LYS 36 H LYS 36 24.401 19.938 24.899
254 HA LYS 36 HA LYS 36 24.365 17.013 24.406
255 HB2 LYS 36 HB2 LYS 36 22.292 18.296 23.509
256 HB3 LYS 36 HB3 LYS 36 23.402 19.106 22.413
257 HG2 LYS 36 HG2 LYS 36 22.916 16.112 22.526
258 HG3 LYS 36 HG3 LYS 36 22.074 17.240 21.466
259 HD2 LYS 36 HD2 LYS 36 24.998 16.557 21.405
260 HD3 LYS 36 HD3 LYS 36 23.759 16.113 20.225
261 HE2 LYS 36 HE2 LYS 36 23.451 18.625 19.806
262 HE3 LYS 36 HE3 LYS 36 24.930 18.867 20.756
263 HZ1 LYS 36 HZ1 LYS 36 24.657 17.351 18.224
264 HZ2 LYS 36 HZ2 LYS 36 25.538 18.708 18.451
265 HZ3 LYS 36 HZ3 LYS 36 26.000 17.262 19.126
266 H CYS 37 H CYS 37 26.444 16.503 23.696
267 HA CYS 37 HA CYS 37 28.241 18.750 23.194
268 HB2 CYS 37 HB2 CYS 37 28.964 15.820 23.219
269 HB3 CYS 37 HB3 CYS 37 30.048 17.207 23.257
270 H GLY 38 H GLY 38 29.385 19.233 21.393
271 HA2 GLY 38 HA2 GLY 38 28.111 18.453 18.804
272 HA3 GLY 38 HA3 GLY 38 28.979 19.938 19.164
273 H VAL 39 H VAL 39 30.797 20.093 18.161
274 HA VAL 39 HA VAL 39 32.406 17.770 17.296
275 HB VAL 39 HB VAL 39 33.698 19.611 16.062
276 HG11 VAL 39 HG11 VAL 39 32.074 19.708 14.248
277 HG12 VAL 39 HG12 VAL 39 32.107 18.090 14.971
278 HG13 VAL 39 HG13 VAL 39 30.772 19.205 15.347
279 HG21 VAL 39 HG21 VAL 39 32.645 21.709 15.635
280 HG22 VAL 39 HG22 VAL 39 31.271 21.325 16.681
281 HG23 VAL 39 HG23 VAL 39 32.901 21.544 17.374
282 HA PRO 40 HA PRO 40 35.550 18.134 20.309
283 HB2 PRO 40 HB2 PRO 40 37.898 17.778 18.938
284 HB3 PRO 40 HB3 PRO 40 36.709 16.469 19.255
285 HG2 PRO 40 HG2 PRO 40 36.948 18.233 16.802
286 HG3 PRO 40 HG3 PRO 40 36.882 16.437 16.846
287 HD2 PRO 40 HD2 PRO 40 34.665 17.834 16.344
288 HD3 PRO 40 HD3 PRO 40 34.537 16.518 17.529
289 H ILE 41 H ILE 41 37.203 19.498 21.221
290 HA ILE 41 HA ILE 41 37.163 22.250 20.321
291 HB ILE 41 HB ILE 41 38.705 22.686 22.163
292 HG12 ILE 41 HG12 ILE 41 38.989 20.939 23.933
293 HG13 ILE 41 HG13 ILE 41 38.473 19.728 22.765
294 HG21 ILE 41 HG21 ILE 41 36.253 21.062 22.953
295 HG22 ILE 41 HG22 ILE 41 37.037 22.342 23.902
296 HG23 ILE 41 HG23 ILE 41 36.230 22.746 22.384
297 HD11 ILE 41 HD11 ILE 41 40.893 21.518 22.380
298 HD12 ILE 41 HD12 ILE 41 40.964 19.915 23.124
299 HD13 ILE 41 HD13 ILE 41 40.469 20.063 21.437
300 H SER 42 H SER 42 38.832 19.814 19.098
301 HA SER 42 HA SER 42 41.374 20.859 18.379
302 HB2 SER 42 HB2 SER 42 39.645 18.706 17.116
303 HB3 SER 42 HB3 SER 42 41.368 18.977 16.762
304 HG SER 42 HG SER 42 40.605 17.381 18.555
305 H TYR 43 H TYR 43 40.037 23.011 17.863
306 HA TYR 43 HA TYR 43 38.625 23.343 15.480
307 HB2 TYR 43 HB2 TYR 43 40.366 25.447 16.800
308 HB3 TYR 43 HB3 TYR 43 38.955 25.728 15.797
309 HD1 TYR 43 HD1 TYR 43 36.781 24.187 16.817
310 HD2 TYR 43 HD2 TYR 43 39.993 26.031 19.023
311 HE1 TYR 43 HE1 TYR 43 35.311 24.345 18.816
312 HE2 TYR 43 HE2 TYR 43 38.524 26.169 21.033
313 HH TYR 43 HH TYR 43 35.118 25.061 21.048
314 H LEU 44 H LEU 44 42.069 23.004 15.715
315 HA LEU 44 HA LEU 44 42.338 23.205 12.806
316 HB2 LEU 44 HB2 LEU 44 44.210 24.635 12.770
317 HB3 LEU 44 HB3 LEU 44 42.959 25.490 13.645
318 HG LEU 44 HG LEU 44 45.244 24.015 15.016
319 HD11 LEU 44 HD11 LEU 44 46.386 26.167 15.182
320 HD12 LEU 44 HD12 LEU 44 46.143 25.731 13.487
321 HD13 LEU 44 HD13 LEU 44 45.097 26.952 14.255
322 HD21 LEU 44 HD21 LEU 44 43.394 26.254 15.957
323 HD22 LEU 44 HD22 LEU 44 43.383 24.575 16.531
324 HD23 LEU 44 HD23 LEU 44 44.772 25.603 16.874
Start of MODEL 9
1 H1 ALA 1 H1 ALA 1 28.337 23.879 35.662
2 H2 ALA 1 H2 ALA 1 28.401 23.757 34.032
3 H3 ALA 1 H3 ALA 1 29.271 22.719 34.972
4 HA ALA 1 HA ALA 1 26.344 22.837 34.766
5 HB1 ALA 1 HB1 ALA 1 28.317 20.656 33.959
6 HB2 ALA 1 HB2 ALA 1 26.562 20.529 33.879
7 HB3 ALA 1 HB3 ALA 1 27.402 21.705 32.850
8 H LYS 2 H LYS 2 25.115 21.700 36.373
9 HA LYS 2 HA LYS 2 26.586 19.946 38.274
10 HB2 LYS 2 HB2 LYS 2 26.636 22.274 39.162
11 HB3 LYS 2 HB3 LYS 2 24.861 22.313 39.089
12 HG2 LYS 2 HG2 LYS 2 24.757 20.458 40.734
13 HG3 LYS 2 HG3 LYS 2 26.513 20.333 40.729
14 HD2 LYS 2 HD2 LYS 2 25.690 21.522 42.707
15 HD3 LYS 2 HD3 LYS 2 26.710 22.576 41.697
16 HE2 LYS 2 HE2 LYS 2 24.735 23.661 40.745
17 HE3 LYS 2 HE3 LYS 2 23.658 22.545 41.590
18 HZ1 LYS 2 HZ1 LYS 2 23.942 24.718 42.753
19 HZ2 LYS 2 HZ2 LYS 2 24.418 23.426 43.686
20 HZ3 LYS 2 HZ3 LYS 2 25.540 24.355 42.982
21 H ASN 3 H ASN 3 23.401 21.067 37.120
22 HA ASN 3 HA ASN 3 22.320 18.364 37.597
23 HB2 ASN 3 HB2 ASN 3 20.258 19.323 38.649
24 HB3 ASN 3 HB3 ASN 3 21.703 19.350 39.643
25 HD21 ASN 3 HD21 ASN 3 21.112 22.722 40.406
26 HD22 ASN 3 HD22 ASN 3 21.834 21.193 40.862
27 H GLN 4 H GLN 4 21.563 21.566 36.249
28 HA GLN 4 HA GLN 4 20.185 20.224 33.954
29 HB2 GLN 4 HB2 GLN 4 18.775 22.095 33.660
30 HB3 GLN 4 HB3 GLN 4 18.662 21.582 35.340
31 HG2 GLN 4 HG2 GLN 4 20.001 23.474 36.067
32 HG3 GLN 4 HG3 GLN 4 20.383 23.926 34.408
33 HE21 GLN 4 HE21 GLN 4 18.457 24.640 32.965
34 HE22 GLN 4 HE22 GLN 4 17.256 25.567 33.864
35 H PHE 5 H PHE 5 23.108 20.949 34.376
36 HA PHE 5 HA PHE 5 24.852 21.868 33.304
37 HB2 PHE 5 HB2 PHE 5 23.195 21.524 30.799
38 HB3 PHE 5 HB3 PHE 5 24.949 21.550 30.944
39 HD1 PHE 5 HD1 PHE 5 26.200 19.586 31.626
40 HD2 PHE 5 HD2 PHE 5 21.888 19.539 31.645
41 HE1 PHE 5 HE1 PHE 5 26.217 17.138 32.041
42 HE2 PHE 5 HE2 PHE 5 21.928 17.085 32.041
43 HZ PHE 5 HZ PHE 5 24.087 15.888 32.242
44 H GLY 6 H GLY 6 22.596 23.903 34.009
45 HA2 GLY 6 HA2 GLY 6 22.469 26.214 33.929
46 HA3 GLY 6 HA3 GLY 6 23.916 26.238 32.908
47 H CYS 7 H CYS 7 21.666 24.155 31.489
48 HA CYS 7 HA CYS 7 21.016 26.145 29.415
49 HB2 CYS 7 HB2 CYS 7 20.674 23.138 29.579
50 HB3 CYS 7 HB3 CYS 7 20.211 24.103 28.210
51 H PHE 8 H PHE 8 19.049 26.992 29.094
52 HA PHE 8 HA PHE 8 16.662 25.392 29.680
53 HB2 PHE 8 HB2 PHE 8 17.003 26.663 31.787
54 HB3 PHE 8 HB3 PHE 8 16.933 28.168 30.882
55 HD1 PHE 8 HD1 PHE 8 14.845 28.986 29.923
56 HD2 PHE 8 HD2 PHE 8 14.998 25.257 32.084
57 HE1 PHE 8 HE1 PHE 8 12.356 28.891 29.954
58 HE2 PHE 8 HE2 PHE 8 12.517 25.139 32.072
59 HZ PHE 8 HZ PHE 8 11.194 26.939 30.990
60 H ALA 9 H ALA 9 15.082 25.651 28.180
61 HA ALA 9 HA ALA 9 14.226 26.145 26.162
62 HB1 ALA 9 HB1 ALA 9 13.105 27.756 27.555
63 HB2 ALA 9 HB2 ALA 9 14.396 28.946 27.293
64 HB3 ALA 9 HB3 ALA 9 13.366 28.437 25.940
65 H ASN 10 H ASN 10 16.576 25.400 25.631
66 HA ASN 10 HA ASN 10 18.282 25.309 24.201
67 HB2 ASN 10 HB2 ASN 10 16.680 27.353 22.610
68 HB3 ASN 10 HB3 ASN 10 18.023 26.430 21.976
69 HD21 ASN 10 HD21 ASN 10 15.017 24.944 20.897
70 HD22 ASN 10 HD22 ASN 10 15.910 26.432 20.645
71 H VAL 11 H VAL 11 18.242 27.808 26.250
72 HA VAL 11 HA VAL 11 20.765 28.999 25.147
73 HB VAL 11 HB VAL 11 18.655 30.408 26.815
74 HG11 VAL 11 HG11 VAL 11 19.919 32.467 26.094
75 HG12 VAL 11 HG12 VAL 11 20.906 31.419 27.100
76 HG13 VAL 11 HG13 VAL 11 21.143 31.428 25.336
77 HG21 VAL 11 HG21 VAL 11 19.263 30.645 23.825
78 HG22 VAL 11 HG22 VAL 11 17.763 30.027 24.540
79 HG23 VAL 11 HG23 VAL 11 18.183 31.722 24.742
80 H ASP 12 H ASP 12 22.410 29.485 26.563
81 HA ASP 12 HA ASP 12 22.564 28.047 29.090
82 HB2 ASP 12 HB2 ASP 12 24.907 28.750 29.046
83 HB3 ASP 12 HB3 ASP 12 24.416 27.926 27.587
84 H VAL 13 H VAL 13 20.539 29.892 29.215
85 HA VAL 13 HA VAL 13 21.170 32.442 30.361
86 HB VAL 13 HB VAL 13 18.766 32.142 31.399
87 HG11 VAL 13 HG11 VAL 13 19.193 32.243 28.416
88 HG12 VAL 13 HG12 VAL 13 17.745 32.785 29.291
89 HG13 VAL 13 HG13 VAL 13 19.295 33.608 29.546
90 HG21 VAL 13 HG21 VAL 13 18.558 30.009 29.243
91 HG22 VAL 13 HG22 VAL 13 18.706 29.629 30.970
92 HG23 VAL 13 HG23 VAL 13 17.322 30.562 30.379
93 H LYS 14 H LYS 14 21.010 29.295 31.805
94 HA LYS 14 HA LYS 14 21.088 30.434 34.573
95 HB2 LYS 14 HB2 LYS 14 20.407 27.635 33.568
96 HB3 LYS 14 HB3 LYS 14 20.482 28.084 35.263
97 HG2 LYS 14 HG2 LYS 14 18.634 29.435 33.255
98 HG3 LYS 14 HG3 LYS 14 18.183 28.040 34.208
99 HD2 LYS 14 HD2 LYS 14 19.217 30.584 35.516
100 HD3 LYS 14 HD3 LYS 14 17.534 30.415 35.064
101 HE2 LYS 14 HE2 LYS 14 18.962 28.418 36.870
102 HE3 LYS 14 HE3 LYS 14 18.116 29.848 37.473
103 HZ1 LYS 14 HZ1 LYS 14 16.850 27.658 35.893
104 HZ2 LYS 14 HZ2 LYS 14 16.635 27.990 37.518
105 HZ3 LYS 14 HZ3 LYS 14 16.110 29.028 36.368
106 H GLY 15 H GLY 15 23.290 28.945 32.348
107 HA2 GLY 15 HA2 GLY 15 25.491 29.591 33.987
108 HA3 GLY 15 HA3 GLY 15 25.063 27.947 34.438
109 H ASP 16 H ASP 16 26.797 26.872 33.700
110 HA ASP 16 HA ASP 16 27.634 27.239 30.873
111 HB2 ASP 16 HB2 ASP 16 29.872 26.439 31.728
112 HB3 ASP 16 HB3 ASP 16 29.344 28.069 32.170
113 H CYS 17 H CYS 17 27.471 25.764 29.539
114 HA CYS 17 HA CYS 17 27.161 22.888 30.247
115 HB2 CYS 17 HB2 CYS 17 25.275 23.447 29.106
116 HB3 CYS 17 HB3 CYS 17 26.012 24.771 28.266
117 H LYS 18 H LYS 18 29.128 25.186 28.387
118 HA LYS 18 HA LYS 18 30.711 23.411 26.876
119 HB2 LYS 18 HB2 LYS 18 30.740 25.849 26.699
120 HB3 LYS 18 HB3 LYS 18 31.538 26.002 28.260
121 HG2 LYS 18 HG2 LYS 18 32.781 24.276 26.110
122 HG3 LYS 18 HG3 LYS 18 32.857 26.015 25.926
123 HD2 LYS 18 HD2 LYS 18 33.890 24.575 28.409
124 HD3 LYS 18 HD3 LYS 18 34.878 24.875 27.008
125 HE2 LYS 18 HE2 LYS 18 33.544 26.988 28.771
126 HE3 LYS 18 HE3 LYS 18 35.259 26.563 28.754
127 HZ1 LYS 18 HZ1 LYS 18 34.934 28.524 27.461
128 HZ2 LYS 18 HZ2 LYS 18 35.281 27.302 26.383
129 HZ3 LYS 18 HZ3 LYS 18 33.741 27.859 26.572
130 H ARG 19 H ARG 19 31.127 24.211 30.361
131 HA ARG 19 HA ARG 19 33.554 22.732 30.700
132 HB2 ARG 19 HB2 ARG 19 31.378 23.667 32.601
133 HB3 ARG 19 HB3 ARG 19 32.797 22.756 33.162
134 HG2 ARG 19 HG2 ARG 19 34.324 24.421 32.236
135 HG3 ARG 19 HG3 ARG 19 32.994 25.310 31.512
136 HD2 ARG 19 HD2 ARG 19 33.770 26.413 33.533
137 HD3 ARG 19 HD3 ARG 19 32.102 25.882 33.709
138 HE ARG 19 HE ARG 19 34.474 24.402 34.818
139 HH11 ARG 19 HH11 ARG 19 31.120 24.720 36.927
140 HH12 ARG 19 HH12 ARG 19 31.035 25.217 35.239
141 HH21 ARG 19 HH21 ARG 19 34.374 23.910 37.015
142 HH22 ARG 19 HH22 ARG 19 32.807 23.974 37.811
143 H HIS 20 H HIS 20 30.262 21.505 30.564
144 HA HIS 20 HA HIS 20 30.979 18.840 31.590
145 HB2 HIS 20 HB2 HIS 20 28.690 19.469 31.771
146 HB3 HIS 20 HB3 HIS 20 28.595 19.974 30.090
147 HD2 HIS 20 HD2 HIS 20 27.601 18.316 28.438
148 HE1 HIS 20 HE1 HIS 20 27.940 14.723 30.699
149 HE2 HIS 20 HE2 HIS 20 27.012 15.772 28.554
150 H CYS 21 H CYS 21 30.526 20.289 28.314
151 HA CYS 21 HA CYS 21 31.319 17.856 26.996
152 HB2 CYS 21 HB2 CYS 21 31.002 20.738 26.091
153 HB3 CYS 21 HB3 CYS 21 31.352 19.424 24.980
154 H LYS 22 H LYS 22 33.254 20.678 28.050
155 HA LYS 22 HA LYS 22 35.646 19.975 26.717
156 HB2 LYS 22 HB2 LYS 22 35.143 22.154 27.881
157 HB3 LYS 22 HB3 LYS 22 35.277 21.299 29.424
158 HG2 LYS 22 HG2 LYS 22 37.289 22.361 29.263
159 HG3 LYS 22 HG3 LYS 22 37.731 20.767 28.740
160 HD2 LYS 22 HD2 LYS 22 37.081 23.059 26.834
161 HD3 LYS 22 HD3 LYS 22 38.690 22.771 27.450
162 HE2 LYS 22 HE2 LYS 22 37.111 20.759 25.803
163 HE3 LYS 22 HE3 LYS 22 38.267 21.912 25.145
164 HZ1 LYS 22 HZ1 LYS 22 39.152 20.049 27.247
165 HZ2 LYS 22 HZ2 LYS 22 39.187 19.596 25.664
166 HZ3 LYS 22 HZ3 LYS 22 40.069 20.844 26.165
167 H ALA 23 H ALA 23 34.251 18.658 29.665
168 HA ALA 23 HA ALA 23 36.539 16.987 30.371
169 HB1 ALA 23 HB1 ALA 23 34.934 16.019 31.964
170 HB2 ALA 23 HB2 ALA 23 34.909 17.787 32.021
171 HB3 ALA 23 HB3 ALA 23 33.608 16.906 31.193
172 H GLU 24 H GLU 24 34.125 16.714 27.892
173 HA GLU 24 HA GLU 24 34.788 13.850 27.398
174 HB2 GLU 24 HB2 GLU 24 32.684 15.591 26.130
175 HB3 GLU 24 HB3 GLU 24 32.909 13.896 25.820
176 HG2 GLU 24 HG2 GLU 24 32.201 14.931 28.608
177 HG3 GLU 24 HG3 GLU 24 30.988 14.661 27.357
178 H ASP 25 H ASP 25 36.164 16.657 26.860
179 HA ASP 25 HA ASP 25 37.328 17.809 25.449
180 HB2 ASP 25 HB2 ASP 25 38.555 15.545 25.511
181 HB3 ASP 25 HB3 ASP 25 38.074 15.376 23.832
182 H LYS 26 H LYS 26 34.723 18.033 24.875
183 HA LYS 26 HA LYS 26 34.623 18.551 21.916
184 HB2 LYS 26 HB2 LYS 26 32.402 17.547 23.742
185 HB3 LYS 26 HB3 LYS 26 32.213 18.048 22.063
186 HG2 LYS 26 HG2 LYS 26 34.271 16.244 21.813
187 HG3 LYS 26 HG3 LYS 26 33.348 15.544 23.166
188 HD2 LYS 26 HD2 LYS 26 31.274 15.800 21.679
189 HD3 LYS 26 HD3 LYS 26 32.402 16.292 20.381
190 HE2 LYS 26 HE2 LYS 26 33.647 14.131 20.757
191 HE3 LYS 26 HE3 LYS 26 32.379 13.654 21.904
192 HZ1 LYS 26 HZ1 LYS 26 30.810 14.102 19.902
193 HZ2 LYS 26 HZ2 LYS 26 32.165 13.959 18.973
194 HZ3 LYS 26 HZ3 LYS 26 31.683 12.704 19.883
195 H GLU 27 H GLU 27 32.869 20.022 21.328
196 HA GLU 27 HA GLU 27 32.657 22.501 22.922
197 HB2 GLU 27 HB2 GLU 27 31.548 21.541 20.250
198 HB3 GLU 27 HB3 GLU 27 31.182 23.128 20.923
199 HG2 GLU 27 HG2 GLU 27 34.078 22.281 20.501
200 HG3 GLU 27 HG3 GLU 27 33.092 22.857 19.162
201 H GLY 28 H GLY 28 30.569 23.295 23.563
202 HA2 GLY 28 HA2 GLY 28 28.395 21.254 23.957
203 HA3 GLY 28 HA3 GLY 28 28.881 22.321 25.247
204 H ILE 29 H ILE 29 26.218 21.897 23.833
205 HA ILE 29 HA ILE 29 25.549 24.722 23.408
206 HB ILE 29 HB ILE 29 26.264 23.994 21.238
207 HG12 ILE 29 HG12 ILE 29 24.239 25.508 21.621
208 HG13 ILE 29 HG13 ILE 29 24.658 24.974 20.012
209 HG21 ILE 29 HG21 ILE 29 26.037 21.670 21.127
210 HG22 ILE 29 HG22 ILE 29 24.275 21.722 21.369
211 HG23 ILE 29 HG23 ILE 29 25.018 22.333 19.869
212 HD11 ILE 29 HD11 ILE 29 22.477 23.623 21.620
213 HD12 ILE 29 HD12 ILE 29 22.203 24.943 20.492
214 HD13 ILE 29 HD13 ILE 29 22.848 23.412 19.911
215 H CYS 30 H CYS 30 23.314 25.162 23.825
216 HA CYS 30 HA CYS 30 22.197 23.116 25.623
217 HB2 CYS 30 HB2 CYS 30 21.505 26.020 25.180
218 HB3 CYS 30 HB3 CYS 30 20.635 24.948 26.269
219 H HIS 31 H HIS 31 20.702 21.776 25.130
220 HA HIS 31 HA HIS 31 18.588 22.420 23.094
221 HB2 HIS 31 HB2 HIS 31 19.997 19.813 23.712
222 HB3 HIS 31 HB3 HIS 31 18.345 19.839 23.094
223 HD2 HIS 31 HD2 HIS 31 21.818 21.252 22.010
224 HE1 HIS 31 HE1 HIS 31 19.426 20.689 18.518
225 HE2 HIS 31 HE2 HIS 31 21.742 21.332 19.377
226 H GLY 32 H GLY 32 16.982 23.196 24.226
227 HA2 GLY 32 HA2 GLY 32 15.315 23.429 25.810
228 HA3 GLY 32 HA3 GLY 32 15.445 21.688 26.086
229 H THR 33 H THR 33 15.810 21.235 28.122
230 HA THR 33 HA THR 33 17.140 23.081 29.992
231 HB THR 33 HB THR 33 16.300 21.592 31.734
232 HG1 THR 33 HG1 THR 33 15.132 19.786 31.178
233 HG21 THR 33 HG21 THR 33 14.046 22.038 29.750
234 HG22 THR 33 HG22 THR 33 13.959 21.988 31.519
235 HG23 THR 33 HG23 THR 33 14.761 23.344 30.705
236 H LYS 34 H LYS 34 18.461 21.006 27.934
237 HA LYS 34 HA LYS 34 20.519 19.948 29.827
238 HB2 LYS 34 HB2 LYS 34 19.294 18.562 27.406
239 HB3 LYS 34 HB3 LYS 34 20.573 17.900 28.411
240 HG2 LYS 34 HG2 LYS 34 17.722 18.471 29.326
241 HG3 LYS 34 HG3 LYS 34 18.405 16.907 28.876
242 HD2 LYS 34 HD2 LYS 34 20.077 17.147 30.728
243 HD3 LYS 34 HD3 LYS 34 19.225 18.586 31.285
244 HE2 LYS 34 HE2 LYS 34 18.099 15.768 31.058
245 HE3 LYS 34 HE3 LYS 34 18.602 16.566 32.555
246 HZ1 LYS 34 HZ1 LYS 34 16.330 17.322 30.814
247 HZ2 LYS 34 HZ2 LYS 34 16.230 16.682 32.309
248 HZ3 LYS 34 HZ3 LYS 34 16.814 18.209 32.143
249 H CYS 35 H CYS 35 22.530 19.333 28.864
250 HA CYS 35 HA CYS 35 23.451 21.150 26.697
251 HB2 CYS 35 HB2 CYS 35 24.570 21.111 28.891
252 HB3 CYS 35 HB3 CYS 35 24.965 19.399 28.649
253 H LYS 36 H LYS 36 24.247 20.387 24.775
254 HA LYS 36 HA LYS 36 24.302 17.452 24.185
255 HB2 LYS 36 HB2 LYS 36 22.268 18.921 23.358
256 HB3 LYS 36 HB3 LYS 36 23.422 19.633 22.257
257 HG2 LYS 36 HG2 LYS 36 22.647 16.706 22.373
258 HG3 LYS 36 HG3 LYS 36 21.997 17.900 21.253
259 HD2 LYS 36 HD2 LYS 36 24.883 16.977 21.369
260 HD3 LYS 36 HD3 LYS 36 23.663 16.476 20.202
261 HE2 LYS 36 HE2 LYS 36 23.450 18.933 19.524
262 HE3 LYS 36 HE3 LYS 36 24.895 19.236 20.515
263 HZ1 LYS 36 HZ1 LYS 36 25.565 18.852 18.271
264 HZ2 LYS 36 HZ2 LYS 36 26.016 17.500 19.115
265 HZ3 LYS 36 HZ3 LYS 36 24.676 17.499 18.124
266 H CYS 37 H CYS 37 26.428 17.005 23.667
267 HA CYS 37 HA CYS 37 28.205 19.234 23.161
268 HB2 CYS 37 HB2 CYS 37 28.897 16.315 23.090
269 HB3 CYS 37 HB3 CYS 37 30.014 17.667 23.128
270 H GLY 38 H GLY 38 29.363 19.811 21.448
271 HA2 GLY 38 HA2 GLY 38 28.336 19.167 18.733
272 HA3 GLY 38 HA3 GLY 38 29.347 20.540 19.201
273 H VAL 39 H VAL 39 31.187 20.293 17.942
274 HA VAL 39 HA VAL 39 32.292 17.665 17.456
275 HB VAL 39 HB VAL 39 33.876 18.823 15.975
276 HG11 VAL 39 HG11 VAL 39 32.292 19.512 14.307
277 HG12 VAL 39 HG12 VAL 39 31.629 18.132 15.202
278 HG13 VAL 39 HG13 VAL 39 31.027 19.773 15.524
279 HG21 VAL 39 HG21 VAL 39 34.198 20.941 17.160
280 HG22 VAL 39 HG22 VAL 39 33.675 21.194 15.487
281 HG23 VAL 39 HG23 VAL 39 32.522 21.407 16.813
282 HA PRO 40 HA PRO 40 35.791 17.611 20.270
283 HB2 PRO 40 HB2 PRO 40 37.416 17.097 17.770
284 HB3 PRO 40 HB3 PRO 40 37.463 16.232 19.340
285 HG2 PRO 40 HG2 PRO 40 36.160 15.173 17.195
286 HG3 PRO 40 HG3 PRO 40 35.458 15.057 18.842
287 HD2 PRO 40 HD2 PRO 40 34.685 16.970 16.614
288 HD3 PRO 40 HD3 PRO 40 33.673 16.106 17.793
289 H ILE 41 H ILE 41 37.415 19.065 20.946
290 HA ILE 41 HA ILE 41 37.036 21.663 19.887
291 HB ILE 41 HB ILE 41 38.526 22.441 21.631
292 HG12 ILE 41 HG12 ILE 41 39.278 20.886 23.413
293 HG13 ILE 41 HG13 ILE 41 38.886 19.520 22.351
294 HG21 ILE 41 HG21 ILE 41 36.493 20.395 22.598
295 HG22 ILE 41 HG22 ILE 41 37.008 21.872 23.438
296 HG23 ILE 41 HG23 ILE 41 36.083 21.997 21.941
297 HD11 ILE 41 HD11 ILE 41 40.667 20.108 20.834
298 HD12 ILE 41 HD12 ILE 41 40.867 21.707 21.581
299 HD13 ILE 41 HD13 ILE 41 41.337 20.238 22.457
300 H SER 42 H SER 42 39.381 19.522 18.731
301 HA SER 42 HA SER 42 40.908 21.699 17.557
302 HB2 SER 42 HB2 SER 42 42.438 20.029 16.772
303 HB3 SER 42 HB3 SER 42 42.145 19.811 18.508
304 HG SER 42 HG SER 42 42.046 17.957 16.805
305 H TYR 43 H TYR 43 38.187 20.932 16.978
306 HA TYR 43 HA TYR 43 36.628 20.942 15.315
307 HB2 TYR 43 HB2 TYR 43 38.608 22.951 14.238
308 HB3 TYR 43 HB3 TYR 43 36.927 22.826 13.762
309 HD1 TYR 43 HD1 TYR 43 39.220 24.162 16.252
310 HD2 TYR 43 HD2 TYR 43 35.093 23.018 15.540
311 HE1 TYR 43 HE1 TYR 43 38.516 25.400 18.315
312 HE2 TYR 43 HE2 TYR 43 34.401 24.246 17.607
313 HH TYR 43 HH TYR 43 35.081 25.534 19.373
314 H LEU 44 H LEU 44 37.232 18.686 14.909
315 HA LEU 44 HA LEU 44 38.519 17.871 12.456
316 HB2 LEU 44 HB2 LEU 44 36.864 16.564 14.627
317 HB3 LEU 44 HB3 LEU 44 37.070 15.721 13.100
318 HG LEU 44 HG LEU 44 39.457 15.650 13.306
319 HD11 LEU 44 HD11 LEU 44 39.131 17.236 15.881
320 HD12 LEU 44 HD12 LEU 44 40.618 16.415 15.362
321 HD13 LEU 44 HD13 LEU 44 39.984 17.761 14.412
322 HD21 LEU 44 HD21 LEU 44 38.086 13.939 14.487
323 HD22 LEU 44 HD22 LEU 44 39.648 14.232 15.283
324 HD23 LEU 44 HD23 LEU 44 38.166 14.921 15.965
Start of MODEL 10
1 H1 ALA 1 H1 ALA 1 26.491 24.144 38.005
2 H2 ALA 1 H2 ALA 1 25.889 23.398 39.351
3 H3 ALA 1 H3 ALA 1 25.290 24.841 38.872
4 HA ALA 1 HA ALA 1 23.807 23.002 38.335
5 HB1 ALA 1 HB1 ALA 1 23.398 23.616 35.990
6 HB2 ALA 1 HB2 ALA 1 23.584 25.023 37.039
7 HB3 ALA 1 HB3 ALA 1 24.923 24.533 35.965
8 H LYS 2 H LYS 2 23.503 21.009 37.711
9 HA LYS 2 HA LYS 2 25.335 19.572 35.830
10 HB2 LYS 2 HB2 LYS 2 26.114 19.216 38.173
11 HB3 LYS 2 HB3 LYS 2 24.502 18.668 38.619
12 HG2 LYS 2 HG2 LYS 2 24.724 16.717 37.081
13 HG3 LYS 2 HG3 LYS 2 26.329 17.307 36.598
14 HD2 LYS 2 HD2 LYS 2 26.699 15.607 38.232
15 HD3 LYS 2 HD3 LYS 2 27.012 17.143 39.051
16 HE2 LYS 2 HE2 LYS 2 24.562 17.038 39.863
17 HE3 LYS 2 HE3 LYS 2 24.514 15.397 39.204
18 HZ1 LYS 2 HZ1 LYS 2 25.122 15.174 41.474
19 HZ2 LYS 2 HZ2 LYS 2 26.543 14.993 40.673
20 HZ3 LYS 2 HZ3 LYS 2 26.165 16.420 41.427
21 H ASN 3 H ASN 3 22.188 19.720 37.500
22 HA ASN 3 HA ASN 3 21.111 17.445 36.048
23 HB2 ASN 3 HB2 ASN 3 19.795 19.480 37.892
24 HB3 ASN 3 HB3 ASN 3 19.008 18.041 37.233
25 HD21 ASN 3 HD21 ASN 3 20.947 15.765 39.261
26 HD22 ASN 3 HD22 ASN 3 19.897 15.883 37.843
27 H GLN 4 H GLN 4 20.602 21.053 35.684
28 HA GLN 4 HA GLN 4 19.554 20.431 32.959
29 HB2 GLN 4 HB2 GLN 4 18.609 22.530 32.882
30 HB3 GLN 4 HB3 GLN 4 18.130 21.716 34.352
31 HG2 GLN 4 HG2 GLN 4 19.909 23.148 35.567
32 HG3 GLN 4 HG3 GLN 4 19.982 24.091 34.042
33 HE21 GLN 4 HE21 GLN 4 16.460 24.683 34.189
34 HE22 GLN 4 HE22 GLN 4 17.816 24.641 33.080
35 H PHE 5 H PHE 5 22.523 20.765 34.165
36 HA PHE 5 HA PHE 5 24.544 21.631 33.574
37 HB2 PHE 5 HB2 PHE 5 23.454 21.617 30.752
38 HB3 PHE 5 HB3 PHE 5 25.131 21.499 31.236
39 HD1 PHE 5 HD1 PHE 5 21.965 19.722 30.864
40 HD2 PHE 5 HD2 PHE 5 25.988 19.394 32.348
41 HE1 PHE 5 HE1 PHE 5 21.722 17.236 30.960
42 HE2 PHE 5 HE2 PHE 5 25.716 16.936 32.517
43 HZ PHE 5 HZ PHE 5 23.598 15.855 31.792
44 H GLY 6 H GLY 6 22.212 23.615 33.941
45 HA2 GLY 6 HA2 GLY 6 22.204 25.949 34.233
46 HA3 GLY 6 HA3 GLY 6 23.651 26.065 33.235
47 H CYS 7 H CYS 7 21.810 24.173 31.337
48 HA CYS 7 HA CYS 7 20.979 26.330 29.602
49 HB2 CYS 7 HB2 CYS 7 20.492 23.340 29.453
50 HB3 CYS 7 HB3 CYS 7 20.147 24.482 28.175
51 H PHE 8 H PHE 8 19.004 27.074 29.144
52 HA PHE 8 HA PHE 8 16.595 25.495 29.635
53 HB2 PHE 8 HB2 PHE 8 16.840 26.689 31.794
54 HB3 PHE 8 HB3 PHE 8 16.915 28.214 30.940
55 HD1 PHE 8 HD1 PHE 8 14.926 29.272 30.014
56 HD2 PHE 8 HD2 PHE 8 14.720 25.459 32.024
57 HE1 PHE 8 HE1 PHE 8 12.443 29.441 30.096
58 HE2 PHE 8 HE2 PHE 8 12.242 25.631 32.105
59 HZ PHE 8 HZ PHE 8 11.107 27.609 31.122
60 H ALA 9 H ALA 9 14.996 25.949 28.077
61 HA ALA 9 HA ALA 9 14.280 26.584 26.044
62 HB1 ALA 9 HB1 ALA 9 13.639 28.932 25.878
63 HB2 ALA 9 HB2 ALA 9 13.360 28.316 27.520
64 HB3 ALA 9 HB3 ALA 9 14.766 29.351 27.190
65 H ASN 10 H ASN 10 16.731 25.672 25.682
66 HA ASN 10 HA ASN 10 18.591 25.595 24.449
67 HB2 ASN 10 HB2 ASN 10 17.140 27.511 22.580
68 HB3 ASN 10 HB3 ASN 10 18.493 26.472 22.156
69 HD21 ASN 10 HD21 ASN 10 15.781 24.832 20.832
70 HD22 ASN 10 HD22 ASN 10 16.514 26.397 20.588
71 H VAL 11 H VAL 11 18.439 28.022 26.459
72 HA VAL 11 HA VAL 11 20.870 29.444 25.429
73 HB VAL 11 HB VAL 11 18.548 30.580 27.032
74 HG11 VAL 11 HG11 VAL 11 19.664 32.778 26.682
75 HG12 VAL 11 HG12 VAL 11 20.622 31.718 27.699
76 HG13 VAL 11 HG13 VAL 11 21.075 31.947 25.992
77 HG21 VAL 11 HG21 VAL 11 19.488 31.163 24.182
78 HG22 VAL 11 HG22 VAL 11 17.998 30.307 24.623
79 HG23 VAL 11 HG23 VAL 11 18.179 32.008 25.038
80 H ASP 12 H ASP 12 22.414 30.126 26.926
81 HA ASP 12 HA ASP 12 22.828 28.386 29.222
82 HB2 ASP 12 HB2 ASP 12 25.055 29.224 29.184
83 HB3 ASP 12 HB3 ASP 12 24.579 28.879 27.528
84 H VAL 13 H VAL 13 20.633 29.922 29.811
85 HA VAL 13 HA VAL 13 21.183 32.463 30.998
86 HB VAL 13 HB VAL 13 18.899 31.973 32.220
87 HG11 VAL 13 HG11 VAL 13 19.257 33.568 30.386
88 HG12 VAL 13 HG12 VAL 13 19.090 32.247 29.206
89 HG13 VAL 13 HG13 VAL 13 17.719 32.707 30.225
90 HG21 VAL 13 HG21 VAL 13 18.870 29.511 31.687
91 HG22 VAL 13 HG22 VAL 13 17.459 30.426 31.133
92 HG23 VAL 13 HG23 VAL 13 18.697 29.943 29.963
93 H LYS 14 H LYS 14 20.914 29.273 32.601
94 HA LYS 14 HA LYS 14 21.879 30.520 35.148
95 HB2 LYS 14 HB2 LYS 14 20.696 27.782 34.541
96 HB3 LYS 14 HB3 LYS 14 21.378 28.228 36.099
97 HG2 LYS 14 HG2 LYS 14 18.953 29.502 34.766
98 HG3 LYS 14 HG3 LYS 14 18.990 28.430 36.167
99 HD2 LYS 14 HD2 LYS 14 20.578 30.278 37.206
100 HD3 LYS 14 HD3 LYS 14 19.861 31.328 35.976
101 HE2 LYS 14 HE2 LYS 14 18.380 29.713 38.084
102 HE3 LYS 14 HE3 LYS 14 18.732 31.448 38.189
103 HZ1 LYS 14 HZ1 LYS 14 16.485 30.989 37.444
104 HZ2 LYS 14 HZ2 LYS 14 17.291 31.807 36.291
105 HZ3 LYS 14 HZ3 LYS 14 17.014 30.166 36.134
106 H GLY 15 H GLY 15 23.140 28.634 32.534
107 HA2 GLY 15 HA2 GLY 15 25.815 29.075 33.269
108 HA3 GLY 15 HA3 GLY 15 25.398 27.486 33.904
109 H ASP 16 H ASP 16 27.379 27.673 32.057
110 HA ASP 16 HA ASP 16 26.238 27.167 29.387
111 HB2 ASP 16 HB2 ASP 16 28.173 28.761 29.946
112 HB3 ASP 16 HB3 ASP 16 29.177 27.320 30.094
113 H CYS 17 H CYS 17 26.056 25.296 28.454
114 HA CYS 17 HA CYS 17 26.745 22.718 29.559
115 HB2 CYS 17 HB2 CYS 17 24.861 22.752 28.281
116 HB3 CYS 17 HB3 CYS 17 25.491 23.908 27.125
117 H LYS 18 H LYS 18 28.617 24.997 27.740
118 HA LYS 18 HA LYS 18 30.659 23.596 26.498
119 HB2 LYS 18 HB2 LYS 18 30.684 26.030 26.719
120 HB3 LYS 18 HB3 LYS 18 30.673 25.926 28.471
121 HG2 LYS 18 HG2 LYS 18 32.830 26.615 27.979
122 HG3 LYS 18 HG3 LYS 18 33.011 24.938 28.397
123 HD2 LYS 18 HD2 LYS 18 34.397 25.199 26.537
124 HD3 LYS 18 HD3 LYS 18 32.944 24.477 25.823
125 HE2 LYS 18 HE2 LYS 18 32.133 26.783 25.240
126 HE3 LYS 18 HE3 LYS 18 33.568 27.467 26.022
127 HZ1 LYS 18 HZ1 LYS 18 34.896 26.183 24.353
128 HZ2 LYS 18 HZ2 LYS 18 33.508 25.873 23.530
129 HZ3 LYS 18 HZ3 LYS 18 33.979 27.418 23.740
130 H ARG 19 H ARG 19 30.366 24.057 30.049
131 HA ARG 19 HA ARG 19 32.942 22.897 30.602
132 HB2 ARG 19 HB2 ARG 19 30.606 23.551 32.454
133 HB3 ARG 19 HB3 ARG 19 32.237 23.097 32.984
134 HG2 ARG 19 HG2 ARG 19 33.125 25.025 31.567
135 HG3 ARG 19 HG3 ARG 19 31.462 25.572 31.371
136 HD2 ARG 19 HD2 ARG 19 32.877 25.233 34.052
137 HD3 ARG 19 HD3 ARG 19 32.791 26.745 33.140
138 HE ARG 19 HE ARG 19 30.150 25.613 33.615
139 HH11 ARG 19 HH11 ARG 19 32.561 27.742 35.116
140 HH12 ARG 19 HH12 ARG 19 31.343 28.341 36.232
141 HH21 ARG 19 HH21 ARG 19 28.803 26.431 34.963
142 HH22 ARG 19 HH22 ARG 19 29.297 27.547 36.232
143 H HIS 20 H HIS 20 29.798 21.369 30.420
144 HA HIS 20 HA HIS 20 30.717 18.824 31.528
145 HB2 HIS 20 HB2 HIS 20 28.434 19.536 31.773
146 HB3 HIS 20 HB3 HIS 20 28.248 19.767 30.033
147 HD2 HIS 20 HD2 HIS 20 27.279 17.844 28.717
148 HE1 HIS 20 HE1 HIS 20 27.481 14.774 31.682
149 HE2 HIS 20 HE2 HIS 20 26.544 15.385 29.390
150 H CYS 21 H CYS 21 30.297 20.115 28.193
151 HA CYS 21 HA CYS 21 31.178 17.596 26.990
152 HB2 CYS 21 HB2 CYS 21 30.653 20.355 25.906
153 HB3 CYS 21 HB3 CYS 21 31.209 19.025 24.899
154 H LYS 22 H LYS 22 32.875 20.682 27.825
155 HA LYS 22 HA LYS 22 35.326 20.099 26.568
156 HB2 LYS 22 HB2 LYS 22 34.535 22.289 27.530
157 HB3 LYS 22 HB3 LYS 22 34.866 21.670 29.143
158 HG2 LYS 22 HG2 LYS 22 36.615 23.166 28.357
159 HG3 LYS 22 HG3 LYS 22 37.281 21.551 28.603
160 HD2 LYS 22 HD2 LYS 22 37.610 21.189 26.304
161 HD3 LYS 22 HD3 LYS 22 36.289 22.273 25.857
162 HE2 LYS 22 HE2 LYS 22 38.262 23.345 25.160
163 HE3 LYS 22 HE3 LYS 22 37.618 24.229 26.545
164 HZ1 LYS 22 HZ1 LYS 22 39.903 22.303 26.668
165 HZ2 LYS 22 HZ2 LYS 22 40.046 23.939 26.680
166 HZ3 LYS 22 HZ3 LYS 22 39.339 23.200 27.926
167 H ALA 23 H ALA 23 34.068 18.880 29.627
168 HA ALA 23 HA ALA 23 36.416 17.680 30.694
169 HB1 ALA 23 HB1 ALA 23 34.760 16.297 31.924
170 HB2 ALA 23 HB2 ALA 23 34.293 18.005 31.915
171 HB3 ALA 23 HB3 ALA 23 33.481 16.847 30.835
172 H GLU 24 H GLU 24 34.351 16.698 28.000
173 HA GLU 24 HA GLU 24 35.877 14.163 27.622
174 HB2 GLU 24 HB2 GLU 24 33.239 15.158 26.498
175 HB3 GLU 24 HB3 GLU 24 33.985 13.624 26.075
176 HG2 GLU 24 HG2 GLU 24 33.124 14.434 28.906
177 HG3 GLU 24 HG3 GLU 24 32.190 13.453 27.800
178 H ASP 25 H ASP 25 36.466 17.165 26.942
179 HA ASP 25 HA ASP 25 37.553 18.390 25.500
180 HB2 ASP 25 HB2 ASP 25 38.936 16.106 25.552
181 HB3 ASP 25 HB3 ASP 25 38.570 16.143 23.825
182 H LYS 26 H LYS 26 34.815 17.953 24.912
183 HA LYS 26 HA LYS 26 34.690 18.599 21.986
184 HB2 LYS 26 HB2 LYS 26 32.588 17.380 23.818
185 HB3 LYS 26 HB3 LYS 26 32.310 17.903 22.169
186 HG2 LYS 26 HG2 LYS 26 34.549 16.152 22.002
187 HG3 LYS 26 HG3 LYS 26 33.435 15.398 23.165
188 HD2 LYS 26 HD2 LYS 26 31.590 15.606 21.505
189 HD3 LYS 26 HD3 LYS 26 32.699 16.422 20.400
190 HE2 LYS 26 HE2 LYS 26 32.600 14.214 19.594
191 HE3 LYS 26 HE3 LYS 26 34.155 14.337 20.438
192 HZ1 LYS 26 HZ1 LYS 26 32.803 12.284 20.914
193 HZ2 LYS 26 HZ2 LYS 26 33.222 13.123 22.273
194 HZ3 LYS 26 HZ3 LYS 26 31.686 13.201 21.630
195 H GLU 27 H GLU 27 32.943 20.068 21.365
196 HA GLU 27 HA GLU 27 32.602 22.371 23.210
197 HB2 GLU 27 HB2 GLU 27 31.752 21.804 20.351
198 HB3 GLU 27 HB3 GLU 27 31.190 23.202 21.248
199 HG2 GLU 27 HG2 GLU 27 34.129 22.608 20.756
200 HG3 GLU 27 HG3 GLU 27 33.146 23.580 19.670
201 H GLY 28 H GLY 28 30.492 22.966 23.904
202 HA2 GLY 28 HA2 GLY 28 28.395 20.822 23.979
203 HA3 GLY 28 HA3 GLY 28 28.612 22.004 25.244
204 H ILE 29 H ILE 29 26.115 21.509 23.875
205 HA ILE 29 HA ILE 29 25.544 24.254 23.214
206 HB ILE 29 HB ILE 29 26.132 23.473 21.063
207 HG12 ILE 29 HG12 ILE 29 24.100 25.012 21.532
208 HG13 ILE 29 HG13 ILE 29 24.489 24.486 19.909
209 HG21 ILE 29 HG21 ILE 29 24.851 21.783 19.784
210 HG22 ILE 29 HG22 ILE 29 25.870 21.134 21.067
211 HG23 ILE 29 HG23 ILE 29 24.113 21.250 21.315
212 HD11 ILE 29 HD11 ILE 29 22.687 22.922 19.840
213 HD12 ILE 29 HD12 ILE 29 22.387 23.080 21.583
214 HD13 ILE 29 HD13 ILE 29 22.035 24.431 20.496
215 H CYS 30 H CYS 30 23.575 24.882 23.941
216 HA CYS 30 HA CYS 30 22.135 23.004 25.642
217 HB2 CYS 30 HB2 CYS 30 21.627 25.910 24.929
218 HB3 CYS 30 HB3 CYS 30 20.654 24.974 26.068
219 H HIS 31 H HIS 31 20.639 21.646 25.023
220 HA HIS 31 HA HIS 31 18.588 22.417 22.962
221 HB2 HIS 31 HB2 HIS 31 19.954 19.769 23.481
222 HB3 HIS 31 HB3 HIS 31 18.288 19.815 22.931
223 HD2 HIS 31 HD2 HIS 31 21.823 20.655 21.666
224 HE1 HIS 31 HE1 HIS 31 19.184 20.728 18.317
225 HE2 HIS 31 HE2 HIS 31 21.620 20.770 19.019
226 H GLY 32 H GLY 32 16.914 23.064 23.975
227 HA2 GLY 32 HA2 GLY 32 15.147 23.292 25.417
228 HA3 GLY 32 HA3 GLY 32 15.356 21.602 25.879
229 H THR 33 H THR 33 15.837 21.307 27.927
230 HA THR 33 HA THR 33 17.361 23.346 29.480
231 HB THR 33 HB THR 33 16.309 22.741 31.473
232 HG1 THR 33 HG1 THR 33 14.846 21.127 31.653
233 HG21 THR 33 HG21 THR 33 14.031 22.653 29.467
234 HG22 THR 33 HG22 THR 33 13.981 23.241 31.140
235 HG23 THR 33 HG23 THR 33 14.884 24.142 29.901
236 H LYS 34 H LYS 34 18.379 21.129 27.726
237 HA LYS 34 HA LYS 34 20.247 19.963 29.717
238 HB2 LYS 34 HB2 LYS 34 18.810 18.385 27.552
239 HB3 LYS 34 HB3 LYS 34 20.079 17.737 28.583
240 HG2 LYS 34 HG2 LYS 34 17.363 18.724 29.556
241 HG3 LYS 34 HG3 LYS 34 17.799 17.053 29.257
242 HD2 LYS 34 HD2 LYS 34 19.371 16.985 31.039
243 HD3 LYS 34 HD3 LYS 34 19.326 18.724 31.305
244 HE2 LYS 34 HE2 LYS 34 16.936 16.875 31.645
245 HE3 LYS 34 HE3 LYS 34 18.029 17.321 32.957
246 HZ1 LYS 34 HZ1 LYS 34 17.070 19.659 31.640
247 HZ2 LYS 34 HZ2 LYS 34 15.825 18.721 32.160
248 HZ3 LYS 34 HZ3 LYS 34 16.949 19.229 33.232
249 H CYS 35 H CYS 35 22.094 18.783 28.607
250 HA CYS 35 HA CYS 35 23.276 20.625 26.605
251 HB2 CYS 35 HB2 CYS 35 24.283 20.306 28.866
252 HB3 CYS 35 HB3 CYS 35 24.530 18.605 28.475
253 H LYS 36 H LYS 36 24.300 19.877 24.726
254 HA LYS 36 HA LYS 36 24.329 16.996 24.040
255 HB2 LYS 36 HB2 LYS 36 22.263 18.387 23.172
256 HB3 LYS 36 HB3 LYS 36 23.427 19.174 22.113
257 HG2 LYS 36 HG2 LYS 36 22.935 16.183 22.188
258 HG3 LYS 36 HG3 LYS 36 22.020 17.293 21.190
259 HD2 LYS 36 HD2 LYS 36 25.004 16.794 20.986
260 HD3 LYS 36 HD3 LYS 36 23.770 16.138 19.915
261 HE2 LYS 36 HE2 LYS 36 23.170 18.470 19.213
262 HE3 LYS 36 HE3 LYS 36 24.479 19.091 20.222
263 HZ1 LYS 36 HZ1 LYS 36 24.785 17.270 17.903
264 HZ2 LYS 36 HZ2 LYS 36 25.220 18.849 17.949
265 HZ3 LYS 36 HZ3 LYS 36 26.034 17.769 18.879
266 H CYS 37 H CYS 37 26.350 16.557 23.108
267 HA CYS 37 HA CYS 37 28.202 18.845 22.974
268 HB2 CYS 37 HB2 CYS 37 28.866 15.930 22.645
269 HB3 CYS 37 HB3 CYS 37 29.992 17.282 22.756
270 H GLY 38 H GLY 38 29.358 19.589 21.329
271 HA2 GLY 38 HA2 GLY 38 28.435 19.115 18.539
272 HA3 GLY 38 HA3 GLY 38 29.418 20.454 19.136
273 H VAL 39 H VAL 39 31.207 20.236 17.830
274 HA VAL 39 HA VAL 39 32.493 17.727 17.384
275 HB VAL 39 HB VAL 39 34.227 19.086 16.206
276 HG11 VAL 39 HG11 VAL 39 32.815 19.810 14.379
277 HG12 VAL 39 HG12 VAL 39 32.224 18.280 15.031
278 HG13 VAL 39 HG13 VAL 39 31.378 19.797 15.417
279 HG21 VAL 39 HG21 VAL 39 33.871 21.473 15.849
280 HG22 VAL 39 HG22 VAL 39 32.518 21.490 16.993
281 HG23 VAL 39 HG23 VAL 39 34.170 21.129 17.556
282 HA PRO 40 HA PRO 40 35.734 17.606 20.521
283 HB2 PRO 40 HB2 PRO 40 37.552 17.042 18.211
284 HB3 PRO 40 HB3 PRO 40 37.351 16.136 19.738
285 HG2 PRO 40 HG2 PRO 40 36.314 15.234 17.368
286 HG3 PRO 40 HG3 PRO 40 35.467 15.001 18.924
287 HD2 PRO 40 HD2 PRO 40 34.863 17.041 16.765
288 HD3 PRO 40 HD3 PRO 40 33.774 16.126 17.843
289 H ILE 41 H ILE 41 37.134 19.251 21.318
290 HA ILE 41 HA ILE 41 37.082 21.762 19.979
291 HB ILE 41 HB ILE 41 38.424 22.629 21.775
292 HG12 ILE 41 HG12 ILE 41 38.780 20.821 23.752
293 HG13 ILE 41 HG13 ILE 41 39.051 19.762 22.377
294 HG21 ILE 41 HG21 ILE 41 36.348 20.676 22.828
295 HG22 ILE 41 HG22 ILE 41 36.858 22.205 23.558
296 HG23 ILE 41 HG23 ILE 41 35.981 22.224 22.030
297 HD11 ILE 41 HD11 ILE 41 41.164 20.711 23.176
298 HD12 ILE 41 HD12 ILE 41 40.817 21.387 21.574
299 HD13 ILE 41 HD13 ILE 41 40.520 22.357 23.031
300 H SER 42 H SER 42 39.328 19.231 19.630
301 HA SER 42 HA SER 42 41.169 18.870 18.488
302 HB2 SER 42 HB2 SER 42 39.748 20.783 16.657
303 HB3 SER 42 HB3 SER 42 40.867 19.459 16.225
304 HG SER 42 HG SER 42 38.266 19.247 17.348
305 H TYR 43 H TYR 43 42.022 20.732 20.297
306 HA TYR 43 HA TYR 43 44.240 22.029 18.729
307 HB2 TYR 43 HB2 TYR 43 43.193 22.715 21.495
308 HB3 TYR 43 HB3 TYR 43 44.593 23.451 20.729
309 HD1 TYR 43 HD1 TYR 43 44.046 24.244 18.135
310 HD2 TYR 43 HD2 TYR 43 41.284 24.087 21.452
311 HE1 TYR 43 HE1 TYR 43 42.656 25.997 17.067
312 HE2 TYR 43 HE2 TYR 43 39.917 25.855 20.394
313 HH TYR 43 HH TYR 43 39.788 27.393 18.686
314 H LEU 44 H LEU 44 43.553 19.524 20.983
315 HA LEU 44 HA LEU 44 46.452 18.965 21.348
316 HB2 LEU 44 HB2 LEU 44 45.458 20.131 23.358
317 HB3 LEU 44 HB3 LEU 44 44.313 18.806 23.520
318 HG LEU 44 HG LEU 44 46.206 17.228 23.924
319 HD11 LEU 44 HD11 LEU 44 48.446 18.218 24.449
320 HD12 LEU 44 HD12 LEU 44 48.035 18.371 22.742
321 HD13 LEU 44 HD13 LEU 44 47.884 19.778 23.816
322 HD21 LEU 44 HD21 LEU 44 45.065 18.339 25.806
323 HD22 LEU 44 HD22 LEU 44 46.782 18.120 26.163
324 HD23 LEU 44 HD23 LEU 44 46.175 19.721 25.693
Start of MODEL 11
1 H1 ALA 1 H1 ALA 1 26.266 21.909 39.426
2 H2 ALA 1 H2 ALA 1 25.906 23.503 39.271
3 H3 ALA 1 H3 ALA 1 26.873 22.771 38.147
4 HA ALA 1 HA ALA 1 24.041 22.131 38.648
5 HB1 ALA 1 HB1 ALA 1 24.156 24.308 37.599
6 HB2 ALA 1 HB2 ALA 1 25.368 23.739 36.427
7 HB3 ALA 1 HB3 ALA 1 23.718 23.148 36.339
8 H LYS 2 H LYS 2 23.252 20.359 37.603
9 HA LYS 2 HA LYS 2 24.965 18.892 35.643
10 HB2 LYS 2 HB2 LYS 2 24.917 16.831 36.920
11 HB3 LYS 2 HB3 LYS 2 25.776 18.098 37.802
12 HG2 LYS 2 HG2 LYS 2 23.791 18.434 39.254
13 HG3 LYS 2 HG3 LYS 2 22.892 17.224 38.338
14 HD2 LYS 2 HD2 LYS 2 23.623 16.214 40.326
15 HD3 LYS 2 HD3 LYS 2 24.567 15.496 39.025
16 HE2 LYS 2 HE2 LYS 2 26.528 16.827 39.638
17 HE3 LYS 2 HE3 LYS 2 25.559 17.805 40.759
18 HZ1 LYS 2 HZ1 LYS 2 26.757 16.132 42.016
19 HZ2 LYS 2 HZ2 LYS 2 25.149 15.729 42.023
20 HZ3 LYS 2 HZ3 LYS 2 26.183 14.906 41.089
21 H ASN 3 H ASN 3 21.771 19.281 37.150
22 HA ASN 3 HA ASN 3 20.668 17.140 35.510
23 HB2 ASN 3 HB2 ASN 3 18.540 17.763 36.516
24 HB3 ASN 3 HB3 ASN 3 19.807 17.344 37.657
25 HD21 ASN 3 HD21 ASN 3 18.432 19.967 39.511
26 HD22 ASN 3 HD22 ASN 3 18.489 18.226 39.249
27 H GLN 4 H GLN 4 20.498 20.663 35.346
28 HA GLN 4 HA GLN 4 19.659 20.342 32.496
29 HB2 GLN 4 HB2 GLN 4 18.482 22.405 32.529
30 HB3 GLN 4 HB3 GLN 4 17.891 21.412 33.858
31 HG2 GLN 4 HG2 GLN 4 19.332 22.713 35.434
32 HG3 GLN 4 HG3 GLN 4 19.855 23.739 34.087
33 HE21 GLN 4 HE21 GLN 4 18.026 24.930 32.896
34 HE22 GLN 4 HE22 GLN 4 16.786 25.573 33.974
35 H PHE 5 H PHE 5 22.288 20.923 34.307
36 HA PHE 5 HA PHE 5 24.362 21.730 33.944
37 HB2 PHE 5 HB2 PHE 5 23.575 22.071 31.057
38 HB3 PHE 5 HB3 PHE 5 25.193 21.916 31.700
39 HD1 PHE 5 HD1 PHE 5 26.022 19.693 32.526
40 HD2 PHE 5 HD2 PHE 5 22.198 20.163 30.608
41 HE1 PHE 5 HE1 PHE 5 25.906 17.251 32.149
42 HE2 PHE 5 HE2 PHE 5 22.075 17.697 30.253
43 HZ PHE 5 HZ PHE 5 23.913 16.245 31.026
44 H GLY 6 H GLY 6 21.904 23.716 34.130
45 HA2 GLY 6 HA2 GLY 6 21.798 26.040 34.467
46 HA3 GLY 6 HA3 GLY 6 23.379 26.244 33.698
47 H CYS 7 H CYS 7 21.664 24.307 31.602
48 HA CYS 7 HA CYS 7 21.040 26.484 29.744
49 HB2 CYS 7 HB2 CYS 7 20.768 23.455 29.607
50 HB3 CYS 7 HB3 CYS 7 20.254 24.520 28.334
51 H PHE 8 H PHE 8 19.048 27.192 29.175
52 HA PHE 8 HA PHE 8 16.683 25.528 29.626
53 HB2 PHE 8 HB2 PHE 8 16.801 26.749 31.758
54 HB3 PHE 8 HB3 PHE 8 16.874 28.275 30.905
55 HD1 PHE 8 HD1 PHE 8 14.908 29.229 29.793
56 HD2 PHE 8 HD2 PHE 8 14.688 25.540 32.012
57 HE1 PHE 8 HE1 PHE 8 12.426 29.312 29.692
58 HE2 PHE 8 HE2 PHE 8 12.210 25.624 31.903
59 HZ PHE 8 HZ PHE 8 11.079 27.501 30.731
60 H ALA 9 H ALA 9 15.232 25.757 28.014
61 HA ALA 9 HA ALA 9 14.467 26.257 25.943
62 HB1 ALA 9 HB1 ALA 9 14.525 29.061 27.104
63 HB2 ALA 9 HB2 ALA 9 13.531 28.500 25.743
64 HB3 ALA 9 HB3 ALA 9 13.260 27.832 27.359
65 H ASN 10 H ASN 10 16.923 25.630 25.520
66 HA ASN 10 HA ASN 10 18.762 25.760 24.231
67 HB2 ASN 10 HB2 ASN 10 16.965 27.564 22.559
68 HB3 ASN 10 HB3 ASN 10 18.529 26.977 22.007
69 HD21 ASN 10 HD21 ASN 10 16.183 24.803 20.640
70 HD22 ASN 10 HD22 ASN 10 16.314 26.553 20.602
71 H VAL 11 H VAL 11 18.425 28.132 26.352
72 HA VAL 11 HA VAL 11 20.867 29.586 25.403
73 HB VAL 11 HB VAL 11 18.599 30.707 27.079
74 HG11 VAL 11 HG11 VAL 11 20.733 31.830 27.591
75 HG12 VAL 11 HG12 VAL 11 21.063 32.035 25.854
76 HG13 VAL 11 HG13 VAL 11 19.715 32.892 26.627
77 HG21 VAL 11 HG21 VAL 11 19.341 31.178 24.158
78 HG22 VAL 11 HG22 VAL 11 17.845 30.431 24.758
79 HG23 VAL 11 HG23 VAL 11 18.155 32.137 25.074
80 H ASP 12 H ASP 12 22.467 30.036 26.799
81 HA ASP 12 HA ASP 12 22.922 28.378 29.114
82 HB2 ASP 12 HB2 ASP 12 24.496 30.772 28.088
83 HB3 ASP 12 HB3 ASP 12 25.096 29.477 29.125
84 H VAL 13 H VAL 13 20.634 29.997 29.639
85 HA VAL 13 HA VAL 13 21.147 32.530 30.804
86 HB VAL 13 HB VAL 13 18.839 31.992 32.051
87 HG11 VAL 13 HG11 VAL 13 17.667 32.783 30.094
88 HG12 VAL 13 HG12 VAL 13 19.202 33.639 30.263
89 HG13 VAL 13 HG13 VAL 13 19.037 32.352 29.046
90 HG21 VAL 13 HG21 VAL 13 18.868 29.547 31.436
91 HG22 VAL 13 HG22 VAL 13 17.443 30.452 30.908
92 HG23 VAL 13 HG23 VAL 13 18.693 30.026 29.729
93 H LYS 14 H LYS 14 20.900 29.404 32.510
94 HA LYS 14 HA LYS 14 21.580 30.822 35.071
95 HB2 LYS 14 HB2 LYS 14 20.686 27.946 34.709
96 HB3 LYS 14 HB3 LYS 14 20.914 28.805 36.227
97 HG2 LYS 14 HG2 LYS 14 18.812 29.378 34.100
98 HG3 LYS 14 HG3 LYS 14 18.553 28.635 35.679
99 HD2 LYS 14 HD2 LYS 14 19.153 30.742 36.820
100 HD3 LYS 14 HD3 LYS 14 19.508 31.512 35.253
101 HE2 LYS 14 HE2 LYS 14 17.214 31.021 34.494
102 HE3 LYS 14 HE3 LYS 14 16.816 30.382 36.100
103 HZ1 LYS 14 HZ1 LYS 14 16.158 32.703 35.795
104 HZ2 LYS 14 HZ2 LYS 14 17.272 32.590 37.009
105 HZ3 LYS 14 HZ3 LYS 14 17.707 33.149 35.510
106 H GLY 15 H GLY 15 23.034 28.832 32.667
107 HA2 GLY 15 HA2 GLY 15 25.655 29.433 33.426
108 HA3 GLY 15 HA3 GLY 15 25.285 27.859 34.148
109 H ASP 16 H ASP 16 27.311 28.011 32.371
110 HA ASP 16 HA ASP 16 26.362 27.122 29.733
111 HB2 ASP 16 HB2 ASP 16 28.752 26.962 29.196
112 HB3 ASP 16 HB3 ASP 16 28.283 28.559 29.768
113 H CYS 17 H CYS 17 26.493 25.126 28.882
114 HA CYS 17 HA CYS 17 27.180 22.849 30.664
115 HB2 CYS 17 HB2 CYS 17 25.776 21.554 29.481
116 HB3 CYS 17 HB3 CYS 17 24.925 23.090 29.504
117 H LYS 18 H LYS 18 28.478 24.714 28.097
118 HA LYS 18 HA LYS 18 29.864 22.756 26.659
119 HB2 LYS 18 HB2 LYS 18 29.444 25.206 26.118
120 HB3 LYS 18 HB3 LYS 18 30.846 25.588 27.113
121 HG2 LYS 18 HG2 LYS 18 31.295 23.413 25.129
122 HG3 LYS 18 HG3 LYS 18 30.829 24.936 24.391
123 HD2 LYS 18 HD2 LYS 18 33.067 24.669 26.438
124 HD3 LYS 18 HD3 LYS 18 33.322 24.431 24.711
125 HE2 LYS 18 HE2 LYS 18 32.416 27.019 26.059
126 HE3 LYS 18 HE3 LYS 18 33.995 26.673 25.344
127 HZ1 LYS 18 HZ1 LYS 18 32.937 27.787 23.662
128 HZ2 LYS 18 HZ2 LYS 18 32.560 26.234 23.214
129 HZ3 LYS 18 HZ3 LYS 18 31.467 27.216 23.967
130 H ARG 19 H ARG 19 30.822 24.106 29.808
131 HA ARG 19 HA ARG 19 33.475 22.933 29.836
132 HB2 ARG 19 HB2 ARG 19 31.560 23.982 31.893
133 HB3 ARG 19 HB3 ARG 19 32.869 22.929 32.435
134 HG2 ARG 19 HG2 ARG 19 34.542 24.351 31.385
135 HG3 ARG 19 HG3 ARG 19 33.290 25.444 30.774
136 HD2 ARG 19 HD2 ARG 19 33.659 24.845 33.744
137 HD3 ARG 19 HD3 ARG 19 34.548 26.126 32.904
138 HE ARG 19 HE ARG 19 31.769 26.490 32.358
139 HH11 ARG 19 HH11 ARG 19 33.099 28.224 35.693
140 HH12 ARG 19 HH12 ARG 19 33.976 26.815 35.110
141 HH21 ARG 19 HH21 ARG 19 30.708 28.204 33.283
142 HH22 ARG 19 HH22 ARG 19 31.303 28.900 34.771
143 H HIS 20 H HIS 20 30.303 21.512 30.583
144 HA HIS 20 HA HIS 20 31.344 18.966 31.513
145 HB2 HIS 20 HB2 HIS 20 29.222 19.161 32.253
146 HB3 HIS 20 HB3 HIS 20 28.700 20.184 30.942
147 HD2 HIS 20 HD2 HIS 20 27.669 19.068 28.763
148 HE1 HIS 20 HE1 HIS 20 27.442 15.084 30.244
149 HE2 HIS 20 HE2 HIS 20 26.728 16.636 28.354
150 H CYS 21 H CYS 21 30.470 20.160 28.250
151 HA CYS 21 HA CYS 21 31.210 17.619 26.967
152 HB2 CYS 21 HB2 CYS 21 30.646 20.429 25.983
153 HB3 CYS 21 HB3 CYS 21 31.055 19.133 24.891
154 H LYS 22 H LYS 22 32.954 20.686 27.578
155 HA LYS 22 HA LYS 22 35.339 20.042 26.180
156 HB2 LYS 22 HB2 LYS 22 34.775 22.278 26.905
157 HB3 LYS 22 HB3 LYS 22 34.841 21.799 28.607
158 HG2 LYS 22 HG2 LYS 22 37.218 21.460 28.530
159 HG3 LYS 22 HG3 LYS 22 37.272 21.697 26.772
160 HD2 LYS 22 HD2 LYS 22 36.253 23.850 28.674
161 HD3 LYS 22 HD3 LYS 22 37.973 23.656 28.322
162 HE2 LYS 22 HE2 LYS 22 37.671 24.055 25.977
163 HE3 LYS 22 HE3 LYS 22 35.906 24.003 26.105
164 HZ1 LYS 22 HZ1 LYS 22 37.061 26.274 26.066
165 HZ2 LYS 22 HZ2 LYS 22 35.881 26.054 27.218
166 HZ3 LYS 22 HZ3 LYS 22 37.442 26.004 27.639
167 H ALA 23 H ALA 23 34.291 19.040 29.389
168 HA ALA 23 HA ALA 23 36.674 17.900 30.413
169 HB1 ALA 23 HB1 ALA 23 33.786 16.894 30.624
170 HB2 ALA 23 HB2 ALA 23 35.112 16.515 31.722
171 HB3 ALA 23 HB3 ALA 23 34.506 18.170 31.629
172 H GLU 24 H GLU 24 34.615 16.755 27.768
173 HA GLU 24 HA GLU 24 36.212 14.239 27.537
174 HB2 GLU 24 HB2 GLU 24 33.326 14.757 26.733
175 HB3 GLU 24 HB3 GLU 24 34.228 13.241 26.490
176 HG2 GLU 24 HG2 GLU 24 34.593 13.075 28.952
177 HG3 GLU 24 HG3 GLU 24 33.614 14.522 29.197
178 H ASP 25 H ASP 25 36.702 17.008 26.462
179 HA ASP 25 HA ASP 25 37.487 18.054 24.616
180 HB2 ASP 25 HB2 ASP 25 39.092 16.228 24.630
181 HB3 ASP 25 HB3 ASP 25 38.038 15.225 23.641
182 H LYS 26 H LYS 26 34.965 18.399 24.653
183 HA LYS 26 HA LYS 26 34.023 18.263 21.826
184 HB2 LYS 26 HB2 LYS 26 32.345 17.636 24.293
185 HB3 LYS 26 HB3 LYS 26 31.753 17.730 22.642
186 HG2 LYS 26 HG2 LYS 26 33.735 15.677 23.674
187 HG3 LYS 26 HG3 LYS 26 31.995 15.427 23.610
188 HD2 LYS 26 HD2 LYS 26 31.860 15.547 21.298
189 HD3 LYS 26 HD3 LYS 26 33.449 16.277 21.093
190 HE2 LYS 26 HE2 LYS 26 32.896 13.393 21.900
191 HE3 LYS 26 HE3 LYS 26 33.571 13.979 20.371
192 HZ1 LYS 26 HZ1 LYS 26 35.422 13.341 21.614
193 HZ2 LYS 26 HZ2 LYS 26 35.393 14.969 21.809
194 HZ3 LYS 26 HZ3 LYS 26 34.881 14.006 23.023
195 H GLU 27 H GLU 27 32.744 19.962 21.131
196 HA GLU 27 HA GLU 27 32.352 22.306 22.867
197 HB2 GLU 27 HB2 GLU 27 31.475 21.554 20.060
198 HB3 GLU 27 HB3 GLU 27 30.748 22.915 20.906
199 HG2 GLU 27 HG2 GLU 27 33.696 22.594 20.297
200 HG3 GLU 27 HG3 GLU 27 32.576 23.642 19.436
201 H GLY 28 H GLY 28 30.202 22.974 23.474
202 HA2 GLY 28 HA2 GLY 28 28.106 20.857 23.658
203 HA3 GLY 28 HA3 GLY 28 28.692 21.589 25.151
204 H ILE 29 H ILE 29 26.049 21.596 23.503
205 HA ILE 29 HA ILE 29 25.517 24.510 23.680
206 HB ILE 29 HB ILE 29 26.190 24.059 21.447
207 HG12 ILE 29 HG12 ILE 29 24.176 25.584 22.018
208 HG13 ILE 29 HG13 ILE 29 24.637 25.275 20.354
209 HG21 ILE 29 HG21 ILE 29 25.001 22.612 19.881
210 HG22 ILE 29 HG22 ILE 29 25.848 21.726 21.141
211 HG23 ILE 29 HG23 ILE 29 24.081 21.911 21.234
212 HD11 ILE 29 HD11 ILE 29 22.161 25.238 20.796
213 HD12 ILE 29 HD12 ILE 29 22.802 23.807 19.973
214 HD13 ILE 29 HD13 ILE 29 22.409 23.729 21.697
215 H CYS 30 H CYS 30 23.525 25.084 24.374
216 HA CYS 30 HA CYS 30 22.048 23.158 25.856
217 HB2 CYS 30 HB2 CYS 30 21.323 25.976 24.999
218 HB3 CYS 30 HB3 CYS 30 20.477 25.029 26.233
219 H HIS 31 H HIS 31 20.706 21.676 25.170
220 HA HIS 31 HA HIS 31 18.768 22.198 22.924
221 HB2 HIS 31 HB2 HIS 31 20.142 19.676 23.858
222 HB3 HIS 31 HB3 HIS 31 18.523 19.593 23.179
223 HD2 HIS 31 HD2 HIS 31 21.828 21.369 22.004
224 HE1 HIS 31 HE1 HIS 31 19.990 19.547 18.618
225 HE2 HIS 31 HE2 HIS 31 21.942 20.983 19.399
226 H GLY 32 H GLY 32 17.163 23.195 23.966
227 HA2 GLY 32 HA2 GLY 32 15.374 23.557 25.389
228 HA3 GLY 32 HA3 GLY 32 15.353 21.820 25.691
229 H THR 33 H THR 33 15.626 21.299 27.703
230 HA THR 33 HA THR 33 17.276 22.893 29.604
231 HB THR 33 HB THR 33 16.010 21.902 31.420
232 HG1 THR 33 HG1 THR 33 14.468 20.728 29.353
233 HG21 THR 33 HG21 THR 33 13.934 23.092 31.093
234 HG22 THR 33 HG22 THR 33 15.259 24.008 30.340
235 HG23 THR 33 HG23 THR 33 14.149 23.065 29.327
236 H LYS 34 H LYS 34 18.344 20.956 27.699
237 HA LYS 34 HA LYS 34 20.148 19.606 29.640
238 HB2 LYS 34 HB2 LYS 34 18.918 18.312 27.166
239 HB3 LYS 34 HB3 LYS 34 20.257 17.622 28.046
240 HG2 LYS 34 HG2 LYS 34 17.525 18.128 29.284
241 HG3 LYS 34 HG3 LYS 34 18.061 16.592 28.581
242 HD2 LYS 34 HD2 LYS 34 20.022 16.625 30.215
243 HD3 LYS 34 HD3 LYS 34 19.223 18.004 31.011
244 HE2 LYS 34 HE2 LYS 34 17.188 16.551 31.299
245 HE3 LYS 34 HE3 LYS 34 18.104 15.191 30.623
246 HZ1 LYS 34 HZ1 LYS 34 18.101 15.268 33.105
247 HZ2 LYS 34 HZ2 LYS 34 19.619 15.308 32.503
248 HZ3 LYS 34 HZ3 LYS 34 18.912 16.686 33.045
249 H CYS 35 H CYS 35 22.117 18.746 28.360
250 HA CYS 35 HA CYS 35 23.121 20.862 26.515
251 HB2 CYS 35 HB2 CYS 35 24.304 20.250 28.694
252 HB3 CYS 35 HB3 CYS 35 24.679 18.697 27.970
253 H LYS 36 H LYS 36 24.476 20.094 24.682
254 HA LYS 36 HA LYS 36 24.190 17.260 23.811
255 HB2 LYS 36 HB2 LYS 36 22.323 18.774 22.921
256 HB3 LYS 36 HB3 LYS 36 23.553 19.655 22.034
257 HG2 LYS 36 HG2 LYS 36 22.994 16.683 21.697
258 HG3 LYS 36 HG3 LYS 36 22.186 17.942 20.781
259 HD2 LYS 36 HD2 LYS 36 25.126 17.284 20.714
260 HD3 LYS 36 HD3 LYS 36 23.918 17.028 19.439
261 HE2 LYS 36 HE2 LYS 36 23.613 19.580 19.424
262 HE3 LYS 36 HE3 LYS 36 25.056 19.657 20.449
263 HZ1 LYS 36 HZ1 LYS 36 26.007 19.797 18.381
264 HZ2 LYS 36 HZ2 LYS 36 25.976 18.143 18.481
265 HZ3 LYS 36 HZ3 LYS 36 24.846 18.938 17.632
266 H CYS 37 H CYS 37 26.260 16.612 23.487
267 HA CYS 37 HA CYS 37 28.365 18.587 23.044
268 HB2 CYS 37 HB2 CYS 37 28.599 15.609 23.317
269 HB3 CYS 37 HB3 CYS 37 29.910 16.752 23.270
270 H GLY 38 H GLY 38 29.395 19.097 21.327
271 HA2 GLY 38 HA2 GLY 38 28.566 18.066 18.672
272 HA3 GLY 38 HA3 GLY 38 29.295 19.639 19.061
273 H VAL 39 H VAL 39 30.966 19.620 17.651
274 HA VAL 39 HA VAL 39 32.797 17.428 17.332
275 HB VAL 39 HB VAL 39 34.162 19.148 16.052
276 HG11 VAL 39 HG11 VAL 39 32.582 17.604 14.981
277 HG12 VAL 39 HG12 VAL 39 31.265 18.773 15.215
278 HG13 VAL 39 HG13 VAL 39 32.630 19.172 14.153
279 HG21 VAL 39 HG21 VAL 39 31.754 20.951 16.458
280 HG22 VAL 39 HG22 VAL 39 33.347 21.189 17.210
281 HG23 VAL 39 HG23 VAL 39 33.175 21.257 15.449
282 HA PRO 40 HA PRO 40 35.652 18.151 20.536
283 HB2 PRO 40 HB2 PRO 40 38.014 17.214 19.554
284 HB3 PRO 40 HB3 PRO 40 36.614 16.155 19.890
285 HG2 PRO 40 HG2 PRO 40 37.402 17.377 17.231
286 HG3 PRO 40 HG3 PRO 40 37.023 15.665 17.586
287 HD2 PRO 40 HD2 PRO 40 35.122 17.326 16.596
288 HD3 PRO 40 HD3 PRO 40 34.699 16.151 17.865
289 H ILE 41 H ILE 41 37.546 19.296 21.358
290 HA ILE 41 HA ILE 41 37.685 21.906 19.963
291 HB ILE 41 HB ILE 41 37.791 22.947 22.010
292 HG12 ILE 41 HG12 ILE 41 37.520 21.419 24.196
293 HG13 ILE 41 HG13 ILE 41 38.497 20.318 23.244
294 HG21 ILE 41 HG21 ILE 41 35.584 22.060 21.278
295 HG22 ILE 41 HG22 ILE 41 35.791 20.707 22.411
296 HG23 ILE 41 HG23 ILE 41 35.687 22.368 23.015
297 HD11 ILE 41 HD11 ILE 41 39.905 21.704 24.693
298 HD12 ILE 41 HD12 ILE 41 40.223 22.183 23.016
299 HD13 ILE 41 HD13 ILE 41 39.183 23.186 24.036
300 H SER 42 H SER 42 39.808 19.534 21.552
301 HA SER 42 HA SER 42 42.066 21.162 21.788
302 HB2 SER 42 HB2 SER 42 42.033 18.142 21.401
303 HB3 SER 42 HB3 SER 42 43.313 19.115 22.144
304 HG SER 42 HG SER 42 40.670 18.640 23.060
305 H TYR 43 H TYR 43 43.673 21.848 20.505
306 HA TYR 43 HA TYR 43 43.879 20.842 17.707
307 HB2 TYR 43 HB2 TYR 43 43.384 22.832 16.725
308 HB3 TYR 43 HB3 TYR 43 42.182 22.717 17.983
309 HD1 TYR 43 HD1 TYR 43 45.054 24.503 16.688
310 HD2 TYR 43 HD2 TYR 43 42.391 24.174 20.066
311 HE1 TYR 43 HE1 TYR 43 45.910 26.638 17.582
312 HE2 TYR 43 HE2 TYR 43 43.228 26.347 20.924
313 HH TYR 43 HH TYR 43 44.652 28.183 20.526
314 H LEU 44 H LEU 44 45.577 21.726 20.435
315 HA LEU 44 HA LEU 44 48.104 21.321 19.048
316 HB2 LEU 44 HB2 LEU 44 49.195 23.293 20.060
317 HB3 LEU 44 HB3 LEU 44 48.013 23.677 18.827
318 HG LEU 44 HG LEU 44 46.400 24.363 20.630
319 HD11 LEU 44 HD11 LEU 44 48.868 23.978 22.392
320 HD12 LEU 44 HD12 LEU 44 47.431 24.924 22.850
321 HD13 LEU 44 HD13 LEU 44 47.283 23.191 22.575
322 HD21 LEU 44 HD21 LEU 44 47.845 25.948 19.379
323 HD22 LEU 44 HD22 LEU 44 47.536 26.491 21.028
324 HD23 LEU 44 HD23 LEU 44 49.110 25.769 20.613
Start of MODEL 12
1 H1 ALA 1 H1 ALA 1 24.209 25.248 38.391
2 H2 ALA 1 H2 ALA 1 24.516 24.015 39.459
3 H3 ALA 1 H3 ALA 1 23.377 25.136 39.802
4 HA ALA 1 HA ALA 1 22.326 23.126 39.163
5 HB1 ALA 1 HB1 ALA 1 22.001 25.225 36.972
6 HB2 ALA 1 HB2 ALA 1 20.812 24.018 37.514
7 HB3 ALA 1 HB3 ALA 1 21.284 25.344 38.588
8 H LYS 2 H LYS 2 23.069 21.218 38.438
9 HA LYS 2 HA LYS 2 24.984 21.140 36.138
10 HB2 LYS 2 HB2 LYS 2 25.696 20.594 38.560
11 HB3 LYS 2 HB3 LYS 2 24.669 19.171 38.431
12 HG2 LYS 2 HG2 LYS 2 26.038 18.459 36.418
13 HG3 LYS 2 HG3 LYS 2 27.076 19.859 36.695
14 HD2 LYS 2 HD2 LYS 2 28.165 17.984 37.730
15 HD3 LYS 2 HD3 LYS 2 27.532 18.995 39.020
16 HE2 LYS 2 HE2 LYS 2 27.093 16.719 39.607
17 HE3 LYS 2 HE3 LYS 2 25.540 17.451 39.204
18 HZ1 LYS 2 HZ1 LYS 2 25.930 15.210 38.186
19 HZ2 LYS 2 HZ2 LYS 2 25.622 16.350 37.048
20 HZ3 LYS 2 HZ3 LYS 2 27.149 15.842 37.292
21 H ASN 3 H ASN 3 22.147 19.568 37.609
22 HA ASN 3 HA ASN 3 22.002 17.480 35.617
23 HB2 ASN 3 HB2 ASN 3 19.797 18.467 37.462
24 HB3 ASN 3 HB3 ASN 3 19.888 16.914 36.632
25 HD21 ASN 3 HD21 ASN 3 22.721 15.943 38.843
26 HD22 ASN 3 HD22 ASN 3 22.326 15.859 37.122
27 H GLN 4 H GLN 4 21.027 20.800 35.512
28 HA GLN 4 HA GLN 4 19.697 20.274 32.878
29 HB2 GLN 4 HB2 GLN 4 18.689 22.378 32.979
30 HB3 GLN 4 HB3 GLN 4 18.425 21.637 34.565
31 HG2 GLN 4 HG2 GLN 4 20.338 22.983 35.475
32 HG3 GLN 4 HG3 GLN 4 20.532 23.743 33.886
33 HE21 GLN 4 HE21 GLN 4 18.362 24.718 32.951
34 HE22 GLN 4 HE22 GLN 4 17.439 25.601 34.177
35 H PHE 5 H PHE 5 22.749 20.754 34.054
36 HA PHE 5 HA PHE 5 24.678 21.695 33.344
37 HB2 PHE 5 HB2 PHE 5 23.454 21.314 30.602
38 HB3 PHE 5 HB3 PHE 5 25.166 21.431 30.992
39 HD1 PHE 5 HD1 PHE 5 26.362 19.603 32.139
40 HD2 PHE 5 HD2 PHE 5 22.179 19.238 31.170
41 HE1 PHE 5 HE1 PHE 5 26.445 17.193 32.688
42 HE2 PHE 5 HE2 PHE 5 22.252 16.831 31.768
43 HZ PHE 5 HZ PHE 5 24.381 15.796 32.528
44 H GLY 6 H GLY 6 22.644 23.625 34.031
45 HA2 GLY 6 HA2 GLY 6 22.461 25.944 34.098
46 HA3 GLY 6 HA3 GLY 6 23.854 26.045 33.019
47 H CYS 7 H CYS 7 21.885 24.119 31.279
48 HA CYS 7 HA CYS 7 21.059 26.229 29.519
49 HB2 CYS 7 HB2 CYS 7 20.606 23.232 29.466
50 HB3 CYS 7 HB3 CYS 7 20.183 24.317 28.174
51 H PHE 8 H PHE 8 19.111 27.171 29.272
52 HA PHE 8 HA PHE 8 16.660 25.647 29.853
53 HB2 PHE 8 HB2 PHE 8 16.971 26.841 31.960
54 HB3 PHE 8 HB3 PHE 8 17.144 28.366 31.104
55 HD1 PHE 8 HD1 PHE 8 15.228 29.693 30.608
56 HD2 PHE 8 HD2 PHE 8 14.735 25.547 31.692
57 HE1 PHE 8 HE1 PHE 8 12.761 29.979 30.592
58 HE2 PHE 8 HE2 PHE 8 12.262 25.832 31.631
59 HZ PHE 8 HZ PHE 8 11.277 28.044 31.083
60 H ALA 9 H ALA 9 15.118 25.970 28.356
61 HA ALA 9 HA ALA 9 14.241 26.531 26.344
62 HB1 ALA 9 HB1 ALA 9 13.500 28.907 26.246
63 HB2 ALA 9 HB2 ALA 9 13.184 28.116 27.805
64 HB3 ALA 9 HB3 ALA 9 14.538 29.248 27.646
65 H ASN 10 H ASN 10 16.713 25.832 25.865
66 HA ASN 10 HA ASN 10 18.350 25.757 24.360
67 HB2 ASN 10 HB2 ASN 10 16.666 27.742 22.789
68 HB3 ASN 10 HB3 ASN 10 18.107 26.952 22.176
69 HD21 ASN 10 HD21 ASN 10 14.731 26.601 22.437
70 HD22 ASN 10 HD22 ASN 10 14.749 24.958 21.799
71 H VAL 11 H VAL 11 18.347 28.131 26.490
72 HA VAL 11 HA VAL 11 20.804 29.431 25.390
73 HB VAL 11 HB VAL 11 18.741 30.708 27.211
74 HG11 VAL 11 HG11 VAL 11 21.171 31.854 25.753
75 HG12 VAL 11 HG12 VAL 11 19.950 32.818 26.606
76 HG13 VAL 11 HG13 VAL 11 20.967 31.716 27.521
77 HG21 VAL 11 HG21 VAL 11 18.149 32.121 25.270
78 HG22 VAL 11 HG22 VAL 11 19.222 31.150 24.233
79 HG23 VAL 11 HG23 VAL 11 17.778 30.431 24.963
80 H ASP 12 H ASP 12 22.492 29.867 26.763
81 HA ASP 12 HA ASP 12 22.808 28.238 29.157
82 HB2 ASP 12 HB2 ASP 12 25.144 29.013 29.042
83 HB3 ASP 12 HB3 ASP 12 24.567 28.262 27.563
84 H VAL 13 H VAL 13 20.779 30.004 29.658
85 HA VAL 13 HA VAL 13 21.566 32.496 30.864
86 HB VAL 13 HB VAL 13 19.191 32.362 31.919
87 HG11 VAL 13 HG11 VAL 13 18.170 33.128 29.921
88 HG12 VAL 13 HG12 VAL 13 19.853 33.696 29.935
89 HG13 VAL 13 HG13 VAL 13 19.383 32.310 28.926
90 HG21 VAL 13 HG21 VAL 13 18.906 29.874 31.592
91 HG22 VAL 13 HG22 VAL 13 17.612 30.872 30.908
92 HG23 VAL 13 HG23 VAL 13 18.835 30.169 29.836
93 H LYS 14 H LYS 14 21.264 29.309 32.270
94 HA LYS 14 HA LYS 14 21.866 30.433 35.000
95 HB2 LYS 14 HB2 LYS 14 20.727 27.735 34.233
96 HB3 LYS 14 HB3 LYS 14 21.159 28.248 35.868
97 HG2 LYS 14 HG2 LYS 14 19.530 30.115 35.729
98 HG3 LYS 14 HG3 LYS 14 19.119 29.656 34.075
99 HD2 LYS 14 HD2 LYS 14 17.416 28.743 35.383
100 HD3 LYS 14 HD3 LYS 14 18.478 27.400 34.938
101 HE2 LYS 14 HE2 LYS 14 19.591 27.656 37.222
102 HE3 LYS 14 HE3 LYS 14 18.365 28.876 37.618
103 HZ1 LYS 14 HZ1 LYS 14 17.693 26.729 38.459
104 HZ2 LYS 14 HZ2 LYS 14 16.681 27.081 37.199
105 HZ3 LYS 14 HZ3 LYS 14 17.864 26.020 36.976
106 H GLY 15 H GLY 15 23.371 28.913 32.371
107 HA2 GLY 15 HA2 GLY 15 25.937 29.272 33.156
108 HA3 GLY 15 HA3 GLY 15 25.571 27.676 33.845
109 H ASP 16 H ASP 16 27.551 27.835 32.068
110 HA ASP 16 HA ASP 16 26.567 27.073 29.400
111 HB2 ASP 16 HB2 ASP 16 28.838 27.159 28.708
112 HB3 ASP 16 HB3 ASP 16 28.524 28.587 29.689
113 H CYS 17 H CYS 17 26.776 25.093 28.442
114 HA CYS 17 HA CYS 17 27.385 22.754 30.182
115 HB2 CYS 17 HB2 CYS 17 25.283 22.802 28.909
116 HB3 CYS 17 HB3 CYS 17 26.200 22.942 27.406
117 H LYS 18 H LYS 18 28.879 24.722 27.719
118 HA LYS 18 HA LYS 18 30.621 22.894 26.500
119 HB2 LYS 18 HB2 LYS 18 30.340 25.251 25.837
120 HB3 LYS 18 HB3 LYS 18 31.275 25.777 27.238
121 HG2 LYS 18 HG2 LYS 18 32.500 23.714 25.387
122 HG3 LYS 18 HG3 LYS 18 32.342 25.345 24.767
123 HD2 LYS 18 HD2 LYS 18 33.623 24.905 27.476
124 HD3 LYS 18 HD3 LYS 18 34.557 24.627 26.001
125 HE2 LYS 18 HE2 LYS 18 34.448 26.850 25.305
126 HE3 LYS 18 HE3 LYS 18 32.990 27.199 26.242
127 HZ1 LYS 18 HZ1 LYS 18 35.013 28.199 27.196
128 HZ2 LYS 18 HZ2 LYS 18 34.231 27.236 28.232
129 HZ3 LYS 18 HZ3 LYS 18 35.626 26.703 27.531
130 H ARG 19 H ARG 19 31.051 24.324 29.762
131 HA ARG 19 HA ARG 19 33.519 23.074 30.412
132 HB2 ARG 19 HB2 ARG 19 31.093 24.066 31.886
133 HB3 ARG 19 HB3 ARG 19 32.192 23.028 32.787
134 HG2 ARG 19 HG2 ARG 19 34.027 24.485 32.555
135 HG3 ARG 19 HG3 ARG 19 33.304 25.365 31.205
136 HD2 ARG 19 HD2 ARG 19 33.343 26.619 33.387
137 HD3 ARG 19 HD3 ARG 19 31.799 26.520 32.575
138 HE ARG 19 HE ARG 19 32.580 24.859 34.965
139 HH11 ARG 19 HH11 ARG 19 29.961 26.473 33.173
140 HH12 ARG 19 HH12 ARG 19 28.824 26.021 34.431
141 HH21 ARG 19 HH21 ARG 19 31.089 24.378 36.371
142 HH22 ARG 19 HH22 ARG 19 29.417 24.924 36.185
143 H HIS 20 H HIS 20 30.296 21.484 30.540
144 HA HIS 20 HA HIS 20 31.332 19.022 31.703
145 HB2 HIS 20 HB2 HIS 20 29.020 19.532 31.988
146 HB3 HIS 20 HB3 HIS 20 28.773 19.789 30.265
147 HD2 HIS 20 HD2 HIS 20 27.698 17.866 28.991
148 HE1 HIS 20 HE1 HIS 20 28.603 14.620 31.607
149 HE2 HIS 20 HE2 HIS 20 27.266 15.317 29.560
150 H CYS 21 H CYS 21 30.705 20.079 28.354
151 HA CYS 21 HA CYS 21 31.557 17.562 27.180
152 HB2 CYS 21 HB2 CYS 21 31.033 20.315 26.054
153 HB3 CYS 21 HB3 CYS 21 31.396 18.922 25.052
154 H LYS 22 H LYS 22 33.247 20.625 27.905
155 HA LYS 22 HA LYS 22 35.736 20.169 26.624
156 HB2 LYS 22 HB2 LYS 22 35.139 22.344 27.477
157 HB3 LYS 22 HB3 LYS 22 34.849 21.702 29.076
158 HG2 LYS 22 HG2 LYS 22 36.723 22.943 29.358
159 HG3 LYS 22 HG3 LYS 22 37.332 21.311 29.341
160 HD2 LYS 22 HD2 LYS 22 37.547 23.383 27.109
161 HD3 LYS 22 HD3 LYS 22 38.805 22.875 28.229
162 HE2 LYS 22 HE2 LYS 22 38.160 20.465 27.125
163 HE3 LYS 22 HE3 LYS 22 37.767 21.535 25.776
164 HZ1 LYS 22 HZ1 LYS 22 40.374 21.334 27.206
165 HZ2 LYS 22 HZ2 LYS 22 40.068 20.770 25.700
166 HZ3 LYS 22 HZ3 LYS 22 40.079 22.418 26.036
167 H ALA 23 H ALA 23 34.494 18.872 29.681
168 HA ALA 23 HA ALA 23 36.992 17.836 30.650
169 HB1 ALA 23 HB1 ALA 23 34.125 16.928 31.062
170 HB2 ALA 23 HB2 ALA 23 35.537 16.402 32.014
171 HB3 ALA 23 HB3 ALA 23 35.020 18.106 32.053
172 H GLU 24 H GLU 24 34.873 16.756 28.075
173 HA GLU 24 HA GLU 24 36.656 14.436 27.516
174 HB2 GLU 24 HB2 GLU 24 33.835 14.905 26.483
175 HB3 GLU 24 HB3 GLU 24 34.872 13.505 26.193
176 HG2 GLU 24 HG2 GLU 24 34.888 13.247 28.790
177 HG3 GLU 24 HG3 GLU 24 33.490 14.326 28.748
178 H ASP 25 H ASP 25 36.952 17.412 26.891
179 HA ASP 25 HA ASP 25 37.706 18.747 25.296
180 HB2 ASP 25 HB2 ASP 25 39.223 16.535 25.319
181 HB3 ASP 25 HB3 ASP 25 38.740 16.486 23.631
182 H LYS 26 H LYS 26 34.947 17.909 24.854
183 HA LYS 26 HA LYS 26 34.562 18.565 21.962
184 HB2 LYS 26 HB2 LYS 26 32.816 17.209 24.061
185 HB3 LYS 26 HB3 LYS 26 32.169 17.809 22.553
186 HG2 LYS 26 HG2 LYS 26 34.452 16.132 21.932
187 HG3 LYS 26 HG3 LYS 26 33.399 15.289 23.084
188 HD2 LYS 26 HD2 LYS 26 31.435 15.719 21.614
189 HD3 LYS 26 HD3 LYS 26 32.489 16.583 20.486
190 HE2 LYS 26 HE2 LYS 26 32.272 14.481 19.512
191 HE3 LYS 26 HE3 LYS 26 33.859 14.423 20.294
192 HZ1 LYS 26 HZ1 LYS 26 32.872 13.118 22.071
193 HZ2 LYS 26 HZ2 LYS 26 31.365 13.329 21.505
194 HZ3 LYS 26 HZ3 LYS 26 32.438 12.435 20.630
195 H GLU 27 H GLU 27 32.833 19.988 21.406
196 HA GLU 27 HA GLU 27 32.340 22.261 23.196
197 HB2 GLU 27 HB2 GLU 27 31.179 21.486 20.477
198 HB3 GLU 27 HB3 GLU 27 30.768 22.937 21.394
199 HG2 GLU 27 HG2 GLU 27 33.346 23.402 21.372
200 HG3 GLU 27 HG3 GLU 27 33.370 22.277 20.011
201 H GLY 28 H GLY 28 30.295 22.811 23.972
202 HA2 GLY 28 HA2 GLY 28 28.171 20.699 24.138
203 HA3 GLY 28 HA3 GLY 28 28.623 21.641 25.553
204 H ILE 29 H ILE 29 26.029 21.337 23.977
205 HA ILE 29 HA ILE 29 25.449 24.200 23.468
206 HB ILE 29 HB ILE 29 26.160 23.273 21.403
207 HG12 ILE 29 HG12 ILE 29 24.132 24.848 21.580
208 HG13 ILE 29 HG13 ILE 29 24.598 24.145 20.041
209 HG21 ILE 29 HG21 ILE 29 24.127 21.061 21.677
210 HG22 ILE 29 HG22 ILE 29 24.972 21.489 20.172
211 HG23 ILE 29 HG23 ILE 29 25.893 20.931 21.562
212 HD11 ILE 29 HD11 ILE 29 22.346 22.999 21.721
213 HD12 ILE 29 HD12 ILE 29 22.134 24.189 20.423
214 HD13 ILE 29 HD13 ILE 29 22.781 22.587 20.054
215 H CYS 30 H CYS 30 23.532 24.884 24.178
216 HA CYS 30 HA CYS 30 21.930 23.074 25.759
217 HB2 CYS 30 HB2 CYS 30 21.517 25.988 25.009
218 HB3 CYS 30 HB3 CYS 30 20.549 25.074 26.179
219 H HIS 31 H HIS 31 20.541 21.737 25.048
220 HA HIS 31 HA HIS 31 18.732 22.307 22.727
221 HB2 HIS 31 HB2 HIS 31 20.108 19.811 23.670
222 HB3 HIS 31 HB3 HIS 31 18.446 19.658 23.127
223 HD2 HIS 31 HD2 HIS 31 21.939 20.202 21.717
224 HE1 HIS 31 HE1 HIS 31 19.252 20.299 18.408
225 HE2 HIS 31 HE2 HIS 31 21.711 20.205 19.101
226 H GLY 32 H GLY 32 17.076 23.309 23.600
227 HA2 GLY 32 HA2 GLY 32 15.159 23.718 24.815
228 HA3 GLY 32 HA3 GLY 32 15.131 22.003 25.219
229 H THR 33 H THR 33 15.304 21.513 27.327
230 HA THR 33 HA THR 33 16.443 23.534 29.232
231 HB THR 33 HB THR 33 15.019 22.505 30.943
232 HG1 THR 33 HG1 THR 33 13.255 21.171 29.711
233 HG21 THR 33 HG21 THR 33 12.902 23.374 30.217
234 HG22 THR 33 HG22 THR 33 14.157 24.407 29.523
235 HG23 THR 33 HG23 THR 33 13.335 23.213 28.501
236 H LYS 34 H LYS 34 17.718 21.290 27.609
237 HA LYS 34 HA LYS 34 19.426 20.077 29.712
238 HB2 LYS 34 HB2 LYS 34 18.083 18.587 27.408
239 HB3 LYS 34 HB3 LYS 34 19.181 17.867 28.576
240 HG2 LYS 34 HG2 LYS 34 16.424 19.004 29.229
241 HG3 LYS 34 HG3 LYS 34 16.779 17.322 28.972
242 HD2 LYS 34 HD2 LYS 34 18.135 18.926 31.176
243 HD3 LYS 34 HD3 LYS 34 16.594 18.077 31.374
244 HE2 LYS 34 HE2 LYS 34 17.718 15.957 30.634
245 HE3 LYS 34 HE3 LYS 34 19.266 16.810 30.611
246 HZ1 LYS 34 HZ1 LYS 34 18.992 17.243 32.999
247 HZ2 LYS 34 HZ2 LYS 34 17.513 16.530 33.004
248 HZ3 LYS 34 HZ3 LYS 34 18.849 15.639 32.733
249 H CYS 35 H CYS 35 21.059 18.566 28.125
250 HA CYS 35 HA CYS 35 22.188 20.441 26.082
251 HB2 CYS 35 HB2 CYS 35 23.233 20.904 28.233
252 HB3 CYS 35 HB3 CYS 35 23.658 19.197 28.424
253 H LYS 36 H LYS 36 23.719 19.574 24.587
254 HA LYS 36 HA LYS 36 24.209 16.695 24.378
255 HB2 LYS 36 HB2 LYS 36 22.730 18.540 22.553
256 HB3 LYS 36 HB3 LYS 36 23.937 17.587 21.758
257 HG2 LYS 36 HG2 LYS 36 22.853 15.525 22.673
258 HG3 LYS 36 HG3 LYS 36 21.686 16.538 23.559
259 HD2 LYS 36 HD2 LYS 36 20.806 17.401 21.430
260 HD3 LYS 36 HD3 LYS 36 21.956 16.404 20.512
261 HE2 LYS 36 HE2 LYS 36 21.000 14.370 21.520
262 HE3 LYS 36 HE3 LYS 36 19.914 15.358 22.521
263 HZ1 LYS 36 HZ1 LYS 36 18.780 14.513 20.479
264 HZ2 LYS 36 HZ2 LYS 36 18.837 16.149 20.504
265 HZ3 LYS 36 HZ3 LYS 36 19.862 15.322 19.543
266 H CYS 37 H CYS 37 26.245 16.341 23.445
267 HA CYS 37 HA CYS 37 28.044 18.692 23.287
268 HB2 CYS 37 HB2 CYS 37 28.793 15.767 23.257
269 HB3 CYS 37 HB3 CYS 37 29.897 17.138 23.198
270 H GLY 38 H GLY 38 29.420 19.052 21.558
271 HA2 GLY 38 HA2 GLY 38 28.155 18.546 18.901
272 HA3 GLY 38 HA3 GLY 38 29.088 19.944 19.382
273 H VAL 39 H VAL 39 31.007 20.067 18.609
274 HA VAL 39 HA VAL 39 32.435 17.724 17.486
275 HB VAL 39 HB VAL 39 33.728 19.496 16.205
276 HG11 VAL 39 HG11 VAL 39 30.733 19.311 15.729
277 HG12 VAL 39 HG12 VAL 39 31.986 19.703 14.530
278 HG13 VAL 39 HG13 VAL 39 31.947 18.092 15.264
279 HG21 VAL 39 HG21 VAL 39 33.194 21.454 17.612
280 HG22 VAL 39 HG22 VAL 39 32.767 21.682 15.909
281 HG23 VAL 39 HG23 VAL 39 31.494 21.353 17.092
282 HA PRO 40 HA PRO 40 35.862 18.070 20.286
283 HB2 PRO 40 HB2 PRO 40 38.019 17.511 18.637
284 HB3 PRO 40 HB3 PRO 40 36.875 16.288 19.269
285 HG2 PRO 40 HG2 PRO 40 36.875 17.659 16.570
286 HG3 PRO 40 HG3 PRO 40 36.641 15.918 16.932
287 HD2 PRO 40 HD2 PRO 40 34.543 17.566 16.461
288 HD3 PRO 40 HD3 PRO 40 34.407 16.309 17.711
289 H ILE 41 H ILE 41 37.235 19.672 21.053
290 HA ILE 41 HA ILE 41 36.887 22.230 19.854
291 HB ILE 41 HB ILE 41 38.234 23.124 21.665
292 HG12 ILE 41 HG12 ILE 41 38.847 21.709 23.595
293 HG13 ILE 41 HG13 ILE 41 38.544 20.273 22.619
294 HG21 ILE 41 HG21 ILE 41 35.790 22.705 21.847
295 HG22 ILE 41 HG22 ILE 41 36.126 21.122 22.580
296 HG23 ILE 41 HG23 ILE 41 36.610 22.618 23.412
297 HD11 ILE 41 HD11 ILE 41 40.449 20.695 21.237
298 HD12 ILE 41 HD12 ILE 41 40.610 22.364 21.845
299 HD13 ILE 41 HD13 ILE 41 40.975 20.978 22.897
300 H SER 42 H SER 42 39.341 20.014 19.095
301 HA SER 42 HA SER 42 41.033 22.063 17.946
302 HB2 SER 42 HB2 SER 42 42.465 20.141 17.274
303 HB3 SER 42 HB3 SER 42 42.125 20.178 19.020
304 HG SER 42 HG SER 42 41.887 18.114 18.014
305 H TYR 43 H TYR 43 38.318 21.210 17.139
306 HA TYR 43 HA TYR 43 36.975 20.934 15.276
307 HB2 TYR 43 HB2 TYR 43 38.682 23.304 14.510
308 HB3 TYR 43 HB3 TYR 43 37.066 22.943 13.899
309 HD1 TYR 43 HD1 TYR 43 35.108 22.793 15.598
310 HD2 TYR 43 HD2 TYR 43 38.935 24.538 16.543
311 HE1 TYR 43 HE1 TYR 43 34.090 23.994 17.520
312 HE2 TYR 43 HE2 TYR 43 37.915 25.704 18.479
313 HH TYR 43 HH TYR 43 34.451 25.422 19.323
314 H LEU 44 H LEU 44 38.237 18.875 14.899
315 HA LEU 44 HA LEU 44 39.960 18.555 12.637
316 HB2 LEU 44 HB2 LEU 44 38.193 16.521 14.068
317 HB3 LEU 44 HB3 LEU 44 39.566 16.147 13.039
318 HG LEU 44 HG LEU 44 39.708 17.597 15.717
319 HD11 LEU 44 HD11 LEU 44 40.524 14.776 14.911
320 HD12 LEU 44 HD12 LEU 44 40.711 15.526 16.515
321 HD13 LEU 44 HD13 LEU 44 39.090 15.211 15.880
322 HD21 LEU 44 HD21 LEU 44 41.546 18.311 14.253
323 HD22 LEU 44 HD22 LEU 44 42.159 17.220 15.499
324 HD23 LEU 44 HD23 LEU 44 41.913 16.615 13.843
Start of MODEL 13
1 H1 ALA 1 H1 ALA 1 28.314 20.709 37.327
2 H2 ALA 1 H2 ALA 1 27.985 19.176 37.805
3 H3 ALA 1 H3 ALA 1 27.741 20.417 38.844
4 HA ALA 1 HA ALA 1 26.042 21.340 37.422
5 HB1 ALA 1 HB1 ALA 1 25.154 19.982 35.567
6 HB2 ALA 1 HB2 ALA 1 26.857 20.388 35.296
7 HB3 ALA 1 HB3 ALA 1 26.412 18.760 35.849
8 H LYS 2 H LYS 2 23.695 20.449 37.466
9 HA LYS 2 HA LYS 2 23.431 18.571 39.805
10 HB2 LYS 2 HB2 LYS 2 23.560 21.009 40.409
11 HB3 LYS 2 HB3 LYS 2 22.126 21.289 39.413
12 HG2 LYS 2 HG2 LYS 2 20.845 19.703 40.910
13 HG3 LYS 2 HG3 LYS 2 22.312 19.488 41.874
14 HD2 LYS 2 HD2 LYS 2 20.931 21.087 42.998
15 HD3 LYS 2 HD3 LYS 2 22.307 21.980 42.321
16 HE2 LYS 2 HE2 LYS 2 20.862 22.652 40.369
17 HE3 LYS 2 HE3 LYS 2 19.518 21.755 41.087
18 HZ1 LYS 2 HZ1 LYS 2 19.347 24.065 41.666
19 HZ2 LYS 2 HZ2 LYS 2 19.723 23.236 43.046
20 HZ3 LYS 2 HZ3 LYS 2 20.859 24.127 42.273
21 H ASN 3 H ASN 3 21.711 20.113 37.092
22 HA ASN 3 HA ASN 3 19.837 17.838 36.876
23 HB2 ASN 3 HB2 ASN 3 17.877 19.362 37.296
24 HB3 ASN 3 HB3 ASN 3 18.820 18.998 38.732
25 HD21 ASN 3 HD21 ASN 3 18.150 22.591 38.931
26 HD22 ASN 3 HD22 ASN 3 17.234 21.091 39.169
27 H GLN 4 H GLN 4 20.581 21.163 35.826
28 HA GLN 4 HA GLN 4 19.370 20.549 33.154
29 HB2 GLN 4 HB2 GLN 4 18.374 22.688 33.088
30 HB3 GLN 4 HB3 GLN 4 17.980 21.999 34.659
31 HG2 GLN 4 HG2 GLN 4 19.848 23.348 35.671
32 HG3 GLN 4 HG3 GLN 4 20.138 24.081 34.090
33 HE21 GLN 4 HE21 GLN 4 18.118 25.173 33.066
34 HE22 GLN 4 HE22 GLN 4 17.212 26.160 34.224
35 H PHE 5 H PHE 5 22.310 21.061 34.461
36 HA PHE 5 HA PHE 5 24.319 21.790 33.768
37 HB2 PHE 5 HB2 PHE 5 23.221 21.570 30.956
38 HB3 PHE 5 HB3 PHE 5 24.912 21.592 31.460
39 HD1 PHE 5 HD1 PHE 5 21.822 19.544 31.424
40 HD2 PHE 5 HD2 PHE 5 26.038 19.651 32.277
41 HE1 PHE 5 HE1 PHE 5 21.859 17.063 31.586
42 HE2 PHE 5 HE2 PHE 5 26.055 17.187 32.436
43 HZ PHE 5 HZ PHE 5 23.978 15.880 32.083
44 H GLY 6 H GLY 6 22.259 23.876 34.326
45 HA2 GLY 6 HA2 GLY 6 22.175 26.203 34.317
46 HA3 GLY 6 HA3 GLY 6 23.634 26.236 33.328
47 H CYS 7 H CYS 7 21.659 24.280 31.577
48 HA CYS 7 HA CYS 7 20.939 26.391 29.702
49 HB2 CYS 7 HB2 CYS 7 20.684 23.366 29.650
50 HB3 CYS 7 HB3 CYS 7 20.181 24.407 28.343
51 H PHE 8 H PHE 8 18.946 27.072 29.163
52 HA PHE 8 HA PHE 8 16.594 25.416 29.694
53 HB2 PHE 8 HB2 PHE 8 16.760 26.741 31.785
54 HB3 PHE 8 HB3 PHE 8 16.735 28.218 30.848
55 HD1 PHE 8 HD1 PHE 8 14.678 29.047 29.803
56 HD2 PHE 8 HD2 PHE 8 14.736 25.378 32.075
57 HE1 PHE 8 HE1 PHE 8 12.188 29.018 29.838
58 HE2 PHE 8 HE2 PHE 8 12.253 25.361 32.112
59 HZ PHE 8 HZ PHE 8 10.978 27.174 30.985
60 H ALA 9 H ALA 9 15.018 25.713 28.154
61 HA ALA 9 HA ALA 9 14.233 26.180 26.082
62 HB1 ALA 9 HB1 ALA 9 13.175 27.880 27.486
63 HB2 ALA 9 HB2 ALA 9 14.493 29.019 27.118
64 HB3 ALA 9 HB3 ALA 9 13.408 28.457 25.830
65 H ASN 10 H ASN 10 16.744 25.466 25.706
66 HA ASN 10 HA ASN 10 18.487 25.448 24.276
67 HB2 ASN 10 HB2 ASN 10 16.925 27.403 22.544
68 HB3 ASN 10 HB3 ASN 10 18.177 26.301 22.004
69 HD21 ASN 10 HD21 ASN 10 15.028 24.975 21.083
70 HD22 ASN 10 HD22 ASN 10 15.692 26.587 20.907
71 H VAL 11 H VAL 11 18.377 27.795 26.362
72 HA VAL 11 HA VAL 11 20.750 29.237 25.256
73 HB VAL 11 HB VAL 11 18.493 30.469 26.882
74 HG11 VAL 11 HG11 VAL 11 20.596 31.634 27.351
75 HG12 VAL 11 HG12 VAL 11 20.993 31.686 25.620
76 HG13 VAL 11 HG13 VAL 11 19.639 32.630 26.264
77 HG21 VAL 11 HG21 VAL 11 19.247 30.813 23.948
78 HG22 VAL 11 HG22 VAL 11 17.758 30.076 24.569
79 HG23 VAL 11 HG23 VAL 11 18.045 31.794 24.814
80 H ASP 12 H ASP 12 22.328 29.837 26.626
81 HA ASP 12 HA ASP 12 22.776 28.424 29.104
82 HB2 ASP 12 HB2 ASP 12 24.965 29.359 28.983
83 HB3 ASP 12 HB3 ASP 12 24.499 28.878 27.365
84 H VAL 13 H VAL 13 20.466 29.960 29.458
85 HA VAL 13 HA VAL 13 20.894 32.587 30.509
86 HB VAL 13 HB VAL 13 18.568 32.099 31.674
87 HG11 VAL 13 HG11 VAL 13 18.967 33.582 29.751
88 HG12 VAL 13 HG12 VAL 13 18.835 32.179 28.666
89 HG13 VAL 13 HG13 VAL 13 17.437 32.692 29.632
90 HG21 VAL 13 HG21 VAL 13 17.222 30.435 30.651
91 HG22 VAL 13 HG22 VAL 13 18.503 29.936 29.536
92 HG23 VAL 13 HG23 VAL 13 18.656 29.604 31.281
93 H LYS 14 H LYS 14 20.918 29.494 32.184
94 HA LYS 14 HA LYS 14 21.414 30.919 34.787
95 HB2 LYS 14 HB2 LYS 14 20.685 27.995 34.412
96 HB3 LYS 14 HB3 LYS 14 20.782 28.888 35.921
97 HG2 LYS 14 HG2 LYS 14 18.727 29.304 33.705
98 HG3 LYS 14 HG3 LYS 14 18.467 28.502 35.253
99 HD2 LYS 14 HD2 LYS 14 18.862 30.616 36.465
100 HD3 LYS 14 HD3 LYS 14 19.243 31.438 34.951
101 HE2 LYS 14 HE2 LYS 14 17.034 32.038 35.522
102 HE3 LYS 14 HE3 LYS 14 16.943 30.987 34.106
103 HZ1 LYS 14 HZ1 LYS 14 16.222 29.187 35.545
104 HZ2 LYS 14 HZ2 LYS 14 16.494 30.116 36.903
105 HZ3 LYS 14 HZ3 LYS 14 15.295 30.516 35.884
106 H GLY 15 H GLY 15 23.052 28.924 32.442
107 HA2 GLY 15 HA2 GLY 15 25.611 29.694 33.357
108 HA3 GLY 15 HA3 GLY 15 25.277 28.103 34.045
109 H ASP 16 H ASP 16 27.375 28.030 32.480
110 HA ASP 16 HA ASP 16 26.551 27.309 29.726
111 HB2 ASP 16 HB2 ASP 16 28.671 27.511 29.028
112 HB3 ASP 16 HB3 ASP 16 28.773 28.608 30.396
113 H CYS 17 H CYS 17 27.083 25.297 28.782
114 HA CYS 17 HA CYS 17 27.500 23.036 30.691
115 HB2 CYS 17 HB2 CYS 17 25.982 21.760 29.643
116 HB3 CYS 17 HB3 CYS 17 25.187 23.328 29.635
117 H LYS 18 H LYS 18 28.908 24.765 28.183
118 HA LYS 18 HA LYS 18 30.165 22.670 26.693
119 HB2 LYS 18 HB2 LYS 18 29.984 25.061 25.999
120 HB3 LYS 18 HB3 LYS 18 31.227 25.477 27.177
121 HG2 LYS 18 HG2 LYS 18 31.869 23.227 25.297
122 HG3 LYS 18 HG3 LYS 18 31.687 24.796 24.538
123 HD2 LYS 18 HD2 LYS 18 33.479 24.373 26.955
124 HD3 LYS 18 HD3 LYS 18 34.044 24.018 25.329
125 HE2 LYS 18 HE2 LYS 18 33.016 26.738 26.272
126 HE3 LYS 18 HE3 LYS 18 34.712 26.267 26.124
127 HZ1 LYS 18 HZ1 LYS 18 32.785 26.576 23.908
128 HZ2 LYS 18 HZ2 LYS 18 34.152 27.425 24.188
129 HZ3 LYS 18 HZ3 LYS 18 34.216 25.825 23.710
130 H ARG 19 H ARG 19 31.128 24.122 29.822
131 HA ARG 19 HA ARG 19 33.609 22.699 30.053
132 HB2 ARG 19 HB2 ARG 19 31.633 23.773 32.077
133 HB3 ARG 19 HB3 ARG 19 33.004 22.780 32.602
134 HG2 ARG 19 HG2 ARG 19 34.595 24.269 31.507
135 HG3 ARG 19 HG3 ARG 19 33.287 25.283 30.890
136 HD2 ARG 19 HD2 ARG 19 33.667 24.829 33.871
137 HD3 ARG 19 HD3 ARG 19 34.595 26.050 32.979
138 HE ARG 19 HE ARG 19 31.780 26.324 32.406
139 HH11 ARG 19 HH11 ARG 19 33.957 27.126 35.075
140 HH12 ARG 19 HH12 ARG 19 33.057 28.594 35.397
141 HH21 ARG 19 HH21 ARG 19 30.704 27.970 32.994
142 HH22 ARG 19 HH22 ARG 19 31.212 29.044 34.296
143 H HIS 20 H HIS 20 30.329 21.417 30.694
144 HA HIS 20 HA HIS 20 31.241 18.834 31.626
145 HB2 HIS 20 HB2 HIS 20 29.058 19.294 32.228
146 HB3 HIS 20 HB3 HIS 20 28.632 20.009 30.691
147 HD2 HIS 20 HD2 HIS 20 27.627 18.518 28.819
148 HE1 HIS 20 HE1 HIS 20 27.624 14.814 30.921
149 HE2 HIS 20 HE2 HIS 20 26.814 16.018 28.815
150 H CYS 21 H CYS 21 30.494 20.001 28.313
151 HA CYS 21 HA CYS 21 31.227 17.455 27.040
152 HB2 CYS 21 HB2 CYS 21 30.826 20.275 26.045
153 HB3 CYS 21 HB3 CYS 21 31.244 18.952 24.986
154 H LYS 22 H LYS 22 33.086 20.416 27.887
155 HA LYS 22 HA LYS 22 35.432 19.698 26.450
156 HB2 LYS 22 HB2 LYS 22 34.862 21.954 27.361
157 HB3 LYS 22 HB3 LYS 22 35.283 21.378 28.983
158 HG2 LYS 22 HG2 LYS 22 37.607 21.014 28.289
159 HG3 LYS 22 HG3 LYS 22 37.187 21.309 26.599
160 HD2 LYS 22 HD2 LYS 22 38.294 23.265 27.429
161 HD3 LYS 22 HD3 LYS 22 36.589 23.669 27.175
162 HE2 LYS 22 HE2 LYS 22 36.209 23.261 29.653
163 HE3 LYS 22 HE3 LYS 22 37.949 23.018 29.835
164 HZ1 LYS 22 HZ1 LYS 22 37.319 25.276 30.363
165 HZ2 LYS 22 HZ2 LYS 22 38.280 25.312 29.053
166 HZ3 LYS 22 HZ3 LYS 22 36.638 25.513 28.892
167 H ALA 23 H ALA 23 34.314 18.624 29.609
168 HA ALA 23 HA ALA 23 36.690 17.189 30.362
169 HB1 ALA 23 HB1 ALA 23 35.235 16.143 31.987
170 HB2 ALA 23 HB2 ALA 23 34.840 17.868 31.888
171 HB3 ALA 23 HB3 ALA 23 33.783 16.670 31.101
172 H GLU 24 H GLU 24 34.599 16.593 27.746
173 HA GLU 24 HA GLU 24 35.694 13.847 27.360
174 HB2 GLU 24 HB2 GLU 24 33.059 14.971 26.332
175 HB3 GLU 24 HB3 GLU 24 33.703 13.350 26.035
176 HG2 GLU 24 HG2 GLU 24 33.652 12.895 28.481
177 HG3 GLU 24 HG3 GLU 24 32.941 14.486 28.750
178 H ASP 25 H ASP 25 36.673 16.655 26.653
179 HA ASP 25 HA ASP 25 37.781 17.691 25.006
180 HB2 ASP 25 HB2 ASP 25 38.698 15.224 25.022
181 HB3 ASP 25 HB3 ASP 25 37.989 15.139 23.415
182 H LYS 26 H LYS 26 34.901 17.677 24.836
183 HA LYS 26 HA LYS 26 34.327 18.191 21.942
184 HB2 LYS 26 HB2 LYS 26 32.768 16.951 24.243
185 HB3 LYS 26 HB3 LYS 26 31.917 17.726 22.937
186 HG2 LYS 26 HG2 LYS 26 33.931 15.559 22.297
187 HG3 LYS 26 HG3 LYS 26 32.325 15.140 22.918
188 HD2 LYS 26 HD2 LYS 26 31.252 16.459 21.126
189 HD3 LYS 26 HD3 LYS 26 32.846 16.880 20.492
190 HE2 LYS 26 HE2 LYS 26 32.395 15.158 19.093
191 HE3 LYS 26 HE3 LYS 26 33.176 14.247 20.387
192 HZ1 LYS 26 HZ1 LYS 26 30.921 13.652 21.184
193 HZ2 LYS 26 HZ2 LYS 26 30.239 14.556 19.998
194 HZ3 LYS 26 HZ3 LYS 26 31.058 13.242 19.591
195 H GLU 27 H GLU 27 32.972 19.939 21.421
196 HA GLU 27 HA GLU 27 32.677 22.149 23.328
197 HB2 GLU 27 HB2 GLU 27 31.719 21.663 20.485
198 HB3 GLU 27 HB3 GLU 27 31.387 23.140 21.382
199 HG2 GLU 27 HG2 GLU 27 34.247 22.190 20.944
200 HG3 GLU 27 HG3 GLU 27 33.364 23.099 19.722
201 H GLY 28 H GLY 28 30.529 22.932 23.885
202 HA2 GLY 28 HA2 GLY 28 28.275 20.970 23.784
203 HA3 GLY 28 HA3 GLY 28 28.774 21.626 25.331
204 H ILE 29 H ILE 29 26.202 21.733 23.846
205 HA ILE 29 HA ILE 29 25.654 24.631 23.919
206 HB ILE 29 HB ILE 29 26.393 24.131 21.681
207 HG12 ILE 29 HG12 ILE 29 24.420 25.727 22.238
208 HG13 ILE 29 HG13 ILE 29 24.923 25.423 20.585
209 HG21 ILE 29 HG21 ILE 29 25.121 22.718 20.103
210 HG22 ILE 29 HG22 ILE 29 25.957 21.812 21.360
211 HG23 ILE 29 HG23 ILE 29 24.203 22.055 21.474
212 HD11 ILE 29 HD11 ILE 29 22.436 25.471 20.927
213 HD12 ILE 29 HD12 ILE 29 23.049 24.011 20.134
214 HD13 ILE 29 HD13 ILE 29 22.584 23.955 21.839
215 H CYS 30 H CYS 30 23.463 25.149 24.263
216 HA CYS 30 HA CYS 30 22.103 23.156 25.855
217 HB2 CYS 30 HB2 CYS 30 21.337 25.985 25.081
218 HB3 CYS 30 HB3 CYS 30 20.493 24.985 26.269
219 H HIS 31 H HIS 31 20.808 21.626 25.133
220 HA HIS 31 HA HIS 31 18.786 22.205 22.991
221 HB2 HIS 31 HB2 HIS 31 20.162 19.634 23.789
222 HB3 HIS 31 HB3 HIS 31 18.576 19.643 23.027
223 HD2 HIS 31 HD2 HIS 31 21.813 21.658 22.115
224 HE1 HIS 31 HE1 HIS 31 20.371 19.800 18.575
225 HE2 HIS 31 HE2 HIS 31 22.141 21.327 19.513
226 H GLY 32 H GLY 32 17.132 23.028 24.028
227 HA2 GLY 32 HA2 GLY 32 15.302 23.194 25.413
228 HA3 GLY 32 HA3 GLY 32 15.511 21.487 25.810
229 H THR 33 H THR 33 15.937 21.077 27.872
230 HA THR 33 HA THR 33 17.234 23.113 29.635
231 HB THR 33 HB THR 33 16.127 22.039 31.512
232 HG1 THR 33 HG1 THR 33 14.323 20.548 30.540
233 HG21 THR 33 HG21 THR 33 14.040 22.502 29.344
234 HG22 THR 33 HG22 THR 33 13.870 22.729 31.101
235 HG23 THR 33 HG23 THR 33 14.912 23.812 30.164
236 H LYS 34 H LYS 34 18.509 21.115 27.790
237 HA LYS 34 HA LYS 34 20.343 19.767 29.705
238 HB2 LYS 34 HB2 LYS 34 18.879 18.485 27.342
239 HB3 LYS 34 HB3 LYS 34 20.157 17.701 28.240
240 HG2 LYS 34 HG2 LYS 34 17.471 18.532 29.360
241 HG3 LYS 34 HG3 LYS 34 17.939 16.902 28.918
242 HD2 LYS 34 HD2 LYS 34 19.514 16.700 30.688
243 HD3 LYS 34 HD3 LYS 34 19.509 18.425 31.045
244 HE2 LYS 34 HE2 LYS 34 17.223 16.508 31.565
245 HE3 LYS 34 HE3 LYS 34 18.326 17.231 32.750
246 HZ1 LYS 34 HZ1 LYS 34 17.448 19.439 31.828
247 HZ2 LYS 34 HZ2 LYS 34 16.229 18.581 31.156
248 HZ3 LYS 34 HZ3 LYS 34 16.427 18.599 32.803
249 H CYS 35 H CYS 35 22.191 18.677 28.455
250 HA CYS 35 HA CYS 35 23.306 20.759 26.615
251 HB2 CYS 35 HB2 CYS 35 24.343 20.506 28.896
252 HB3 CYS 35 HB3 CYS 35 24.851 18.887 28.422
253 H LYS 36 H LYS 36 24.096 20.201 24.679
254 HA LYS 36 HA LYS 36 24.233 17.347 23.865
255 HB2 LYS 36 HB2 LYS 36 22.278 18.844 22.999
256 HB3 LYS 36 HB3 LYS 36 23.519 19.788 22.179
257 HG2 LYS 36 HG2 LYS 36 22.709 18.298 20.554
258 HG3 LYS 36 HG3 LYS 36 24.256 17.606 21.077
259 HD2 LYS 36 HD2 LYS 36 22.516 16.379 22.834
260 HD3 LYS 36 HD3 LYS 36 21.447 16.617 21.464
261 HE2 LYS 36 HE2 LYS 36 23.130 15.497 19.985
262 HE3 LYS 36 HE3 LYS 36 24.180 15.280 21.395
263 HZ1 LYS 36 HZ1 LYS 36 22.942 13.281 20.992
264 HZ2 LYS 36 HZ2 LYS 36 22.370 13.930 22.402
265 HZ3 LYS 36 HZ3 LYS 36 21.497 14.061 21.013
266 H CYS 37 H CYS 37 26.197 16.818 23.185
267 HA CYS 37 HA CYS 37 28.252 18.910 23.019
268 HB2 CYS 37 HB2 CYS 37 28.605 15.927 22.837
269 HB3 CYS 37 HB3 CYS 37 29.875 17.131 22.912
270 H GLY 38 H GLY 38 29.591 19.374 21.365
271 HA2 GLY 38 HA2 GLY 38 28.474 19.030 18.619
272 HA3 GLY 38 HA3 GLY 38 29.359 20.422 19.243
273 H VAL 39 H VAL 39 31.223 20.613 18.180
274 HA VAL 39 HA VAL 39 32.676 18.315 17.141
275 HB VAL 39 HB VAL 39 34.200 20.025 16.154
276 HG11 VAL 39 HG11 VAL 39 31.257 20.490 15.553
277 HG12 VAL 39 HG12 VAL 39 32.646 20.816 14.488
278 HG13 VAL 39 HG13 VAL 39 32.251 19.152 14.936
279 HG21 VAL 39 HG21 VAL 39 32.274 22.089 17.279
280 HG22 VAL 39 HG22 VAL 39 33.950 21.825 17.813
281 HG23 VAL 39 HG23 VAL 39 33.622 22.375 16.167
282 HA PRO 40 HA PRO 40 36.018 17.926 20.084
283 HB2 PRO 40 HB2 PRO 40 37.764 18.454 17.670
284 HB3 PRO 40 HB3 PRO 40 37.966 17.216 18.938
285 HG2 PRO 40 HG2 PRO 40 36.905 16.578 16.511
286 HG3 PRO 40 HG3 PRO 40 36.229 15.879 18.016
287 HD2 PRO 40 HD2 PRO 40 35.099 18.110 16.323
288 HD3 PRO 40 HD3 PRO 40 34.276 16.842 17.262
289 H ILE 41 H ILE 41 37.502 19.274 21.259
290 HA ILE 41 HA ILE 41 37.190 22.120 20.787
291 HB ILE 41 HB ILE 41 38.411 22.391 22.918
292 HG12 ILE 41 HG12 ILE 41 38.616 20.434 24.418
293 HG13 ILE 41 HG13 ILE 41 38.295 19.357 23.057
294 HG21 ILE 41 HG21 ILE 41 35.933 22.230 22.714
295 HG22 ILE 41 HG22 ILE 41 36.044 20.478 22.975
296 HG23 ILE 41 HG23 ILE 41 36.520 21.609 24.258
297 HD11 ILE 41 HD11 ILE 41 40.655 21.272 23.083
298 HD12 ILE 41 HD12 ILE 41 40.710 19.644 23.786
299 HD13 ILE 41 HD13 ILE 41 40.406 19.827 22.061
300 H SER 42 H SER 42 39.504 20.084 19.644
301 HA SER 42 HA SER 42 41.999 21.099 20.024
302 HB2 SER 42 HB2 SER 42 41.684 19.088 18.822
303 HB3 SER 42 HB3 SER 42 40.786 19.894 17.525
304 HG SER 42 HG SER 42 42.976 19.376 17.013
305 H TYR 43 H TYR 43 43.223 22.791 19.551
306 HA TYR 43 HA TYR 43 42.589 24.674 17.353
307 HB2 TYR 43 HB2 TYR 43 42.451 26.562 18.710
308 HB3 TYR 43 HB3 TYR 43 41.324 25.392 19.370
309 HD1 TYR 43 HD1 TYR 43 44.257 27.439 20.003
310 HD2 TYR 43 HD2 TYR 43 41.995 24.060 21.444
311 HE1 TYR 43 HE1 TYR 43 45.415 27.588 22.167
312 HE2 TYR 43 HE2 TYR 43 43.159 24.204 23.614
313 HH TYR 43 HH TYR 43 44.633 25.424 24.927
314 H LEU 44 H LEU 44 44.352 26.579 17.517
315 HA LEU 44 HA LEU 44 46.983 25.588 18.401
316 HB2 LEU 44 HB2 LEU 44 48.073 26.239 16.320
317 HB3 LEU 44 HB3 LEU 44 47.034 24.848 16.134
318 HG LEU 44 HG LEU 44 46.124 27.621 15.315
319 HD11 LEU 44 HD11 LEU 44 46.973 27.078 13.043
320 HD12 LEU 44 HD12 LEU 44 48.277 27.244 14.222
321 HD13 LEU 44 HD13 LEU 44 47.766 25.626 13.695
322 HD21 LEU 44 HD21 LEU 44 45.459 24.845 14.215
323 HD22 LEU 44 HD22 LEU 44 44.404 25.789 15.282
324 HD23 LEU 44 HD23 LEU 44 44.770 26.385 13.672
Start of MODEL 14
1 H1 ALA 1 H1 ALA 1 21.143 22.917 40.274
2 H2 ALA 1 H2 ALA 1 20.389 24.364 40.406
3 H3 ALA 1 H3 ALA 1 21.985 24.292 40.033
4 HA ALA 1 HA ALA 1 19.824 23.287 38.325
5 HB1 ALA 1 HB1 ALA 1 19.786 25.760 38.529
6 HB2 ALA 1 HB2 ALA 1 21.476 25.830 38.004
7 HB3 ALA 1 HB3 ALA 1 20.222 25.237 36.893
8 H LYS 2 H LYS 2 21.489 21.335 38.603
9 HA LYS 2 HA LYS 2 23.802 21.477 36.714
10 HB2 LYS 2 HB2 LYS 2 24.444 21.122 39.000
11 HB3 LYS 2 HB3 LYS 2 23.188 19.903 39.251
12 HG2 LYS 2 HG2 LYS 2 24.322 18.370 37.653
13 HG3 LYS 2 HG3 LYS 2 25.608 19.569 37.429
14 HD2 LYS 2 HD2 LYS 2 24.829 18.224 40.062
15 HD3 LYS 2 HD3 LYS 2 26.188 17.762 39.025
16 HE2 LYS 2 HE2 LYS 2 27.099 20.109 39.291
17 HE3 LYS 2 HE3 LYS 2 25.784 20.435 40.439
18 HZ1 LYS 2 HZ1 LYS 2 26.640 18.674 41.836
19 HZ2 LYS 2 HZ2 LYS 2 27.844 18.309 40.765
20 HZ3 LYS 2 HZ3 LYS 2 27.839 19.754 41.573
21 H ASN 3 H ASN 3 20.966 19.588 37.744
22 HA ASN 3 HA ASN 3 21.323 17.418 35.896
23 HB2 ASN 3 HB2 ASN 3 18.876 18.475 37.377
24 HB3 ASN 3 HB3 ASN 3 18.916 16.957 36.491
25 HD21 ASN 3 HD21 ASN 3 21.057 15.382 38.979
26 HD22 ASN 3 HD22 ASN 3 20.741 15.393 37.243
27 H GLN 4 H GLN 4 19.820 20.643 35.577
28 HA GLN 4 HA GLN 4 18.985 20.165 32.788
29 HB2 GLN 4 HB2 GLN 4 18.066 22.215 32.826
30 HB3 GLN 4 HB3 GLN 4 17.774 21.575 34.438
31 HG2 GLN 4 HG2 GLN 4 19.760 23.006 35.240
32 HG3 GLN 4 HG3 GLN 4 19.705 23.763 33.622
33 HE21 GLN 4 HE21 GLN 4 16.302 24.743 34.037
34 HE22 GLN 4 HE22 GLN 4 17.534 24.421 32.832
35 H PHE 5 H PHE 5 21.992 20.500 34.193
36 HA PHE 5 HA PHE 5 24.028 21.241 33.606
37 HB2 PHE 5 HB2 PHE 5 22.956 21.189 30.780
38 HB3 PHE 5 HB3 PHE 5 24.657 21.375 31.215
39 HD1 PHE 5 HD1 PHE 5 21.909 18.973 30.863
40 HD2 PHE 5 HD2 PHE 5 25.936 19.570 32.271
41 HE1 PHE 5 HE1 PHE 5 22.297 16.510 30.833
42 HE2 PHE 5 HE2 PHE 5 26.275 17.119 32.326
43 HZ PHE 5 HZ PHE 5 24.476 15.590 31.576
44 H GLY 6 H GLY 6 21.851 23.235 34.179
45 HA2 GLY 6 HA2 GLY 6 21.746 25.555 34.416
46 HA3 GLY 6 HA3 GLY 6 23.310 25.666 33.530
47 H CYS 7 H CYS 7 21.341 23.891 31.507
48 HA CYS 7 HA CYS 7 20.867 26.157 29.745
49 HB2 CYS 7 HB2 CYS 7 20.318 23.173 29.466
50 HB3 CYS 7 HB3 CYS 7 19.993 24.349 28.229
51 H PHE 8 H PHE 8 19.010 27.134 29.355
52 HA PHE 8 HA PHE 8 16.467 25.662 29.523
53 HB2 PHE 8 HB2 PHE 8 16.647 26.727 31.759
54 HB3 PHE 8 HB3 PHE 8 16.795 28.300 30.997
55 HD1 PHE 8 HD1 PHE 8 14.884 29.431 30.021
56 HD2 PHE 8 HD2 PHE 8 14.520 25.472 31.686
57 HE1 PHE 8 HE1 PHE 8 12.406 29.520 29.730
58 HE2 PHE 8 HE2 PHE 8 12.058 25.575 31.408
59 HZ PHE 8 HZ PHE 8 11.001 27.575 30.398
60 H ALA 9 H ALA 9 15.126 26.161 27.866
61 HA ALA 9 HA ALA 9 14.541 26.851 25.810
62 HB1 ALA 9 HB1 ALA 9 14.796 29.565 27.135
63 HB2 ALA 9 HB2 ALA 9 13.851 29.199 25.674
64 HB3 ALA 9 HB3 ALA 9 13.401 28.464 27.225
65 H ASN 10 H ASN 10 16.937 25.997 25.502
66 HA ASN 10 HA ASN 10 18.837 25.946 24.318
67 HB2 ASN 10 HB2 ASN 10 17.431 28.021 22.603
68 HB3 ASN 10 HB3 ASN 10 18.919 27.223 22.131
69 HD21 ASN 10 HD21 ASN 10 16.269 25.521 20.587
70 HD22 ASN 10 HD22 ASN 10 16.476 27.245 20.807
71 H VAL 11 H VAL 11 18.626 28.190 26.544
72 HA VAL 11 HA VAL 11 21.252 29.434 25.818
73 HB VAL 11 HB VAL 11 18.941 30.711 27.316
74 HG11 VAL 11 HG11 VAL 11 21.643 31.875 26.478
75 HG12 VAL 11 HG12 VAL 11 20.294 32.765 27.188
76 HG13 VAL 11 HG13 VAL 11 21.124 31.554 28.149
77 HG21 VAL 11 HG21 VAL 11 20.126 31.324 24.561
78 HG22 VAL 11 HG22 VAL 11 18.523 30.631 24.866
79 HG23 VAL 11 HG23 VAL 11 18.871 32.276 25.386
80 H ASP 12 H ASP 12 22.799 29.610 27.363
81 HA ASP 12 HA ASP 12 22.706 27.853 29.665
82 HB2 ASP 12 HB2 ASP 12 25.021 28.564 30.008
83 HB3 ASP 12 HB3 ASP 12 24.717 28.048 28.364
84 H VAL 13 H VAL 13 20.678 29.892 29.932
85 HA VAL 13 HA VAL 13 21.391 32.194 31.390
86 HB VAL 13 HB VAL 13 18.951 31.927 32.383
87 HG11 VAL 13 HG11 VAL 13 18.028 32.868 30.388
88 HG12 VAL 13 HG12 VAL 13 19.681 33.482 30.593
89 HG13 VAL 13 HG13 VAL 13 19.346 32.196 29.412
90 HG21 VAL 13 HG21 VAL 13 18.724 29.966 30.090
91 HG22 VAL 13 HG22 VAL 13 18.730 29.494 31.808
92 HG23 VAL 13 HG23 VAL 13 17.450 30.552 31.172
93 H LYS 14 H LYS 14 20.932 28.966 32.690
94 HA LYS 14 HA LYS 14 21.513 30.015 35.448
95 HB2 LYS 14 HB2 LYS 14 20.147 27.444 34.574
96 HB3 LYS 14 HB3 LYS 14 20.576 27.843 36.237
97 HG2 LYS 14 HG2 LYS 14 18.639 29.419 34.481
98 HG3 LYS 14 HG3 LYS 14 18.235 28.323 35.798
99 HD2 LYS 14 HD2 LYS 14 19.638 29.847 37.325
100 HD3 LYS 14 HD3 LYS 14 19.644 31.021 35.994
101 HE2 LYS 14 HE2 LYS 14 17.190 31.101 36.006
102 HE3 LYS 14 HE3 LYS 14 17.147 29.850 37.262
103 HZ1 LYS 14 HZ1 LYS 14 18.409 31.401 38.702
104 HZ2 LYS 14 HZ2 LYS 14 18.217 32.608 37.584
105 HZ3 LYS 14 HZ3 LYS 14 16.916 31.958 38.322
106 H GLY 15 H GLY 15 23.175 28.454 32.927
107 HA2 GLY 15 HA2 GLY 15 25.587 28.710 34.269
108 HA3 GLY 15 HA3 GLY 15 25.100 27.061 34.645
109 H ASP 16 H ASP 16 27.417 28.001 33.150
110 HA ASP 16 HA ASP 16 27.020 27.672 30.357
111 HB2 ASP 16 HB2 ASP 16 29.378 27.880 30.111
112 HB3 ASP 16 HB3 ASP 16 28.751 29.070 31.246
113 H CYS 17 H CYS 17 26.422 25.965 29.412
114 HA CYS 17 HA CYS 17 26.932 23.228 30.166
115 HB2 CYS 17 HB2 CYS 17 24.976 23.372 29.080
116 HB3 CYS 17 HB3 CYS 17 25.425 24.811 28.192
117 H LYS 18 H LYS 18 28.624 25.476 27.948
118 HA LYS 18 HA LYS 18 30.047 23.540 26.478
119 HB2 LYS 18 HB2 LYS 18 29.932 25.992 26.051
120 HB3 LYS 18 HB3 LYS 18 31.138 26.264 27.309
121 HG2 LYS 18 HG2 LYS 18 31.695 24.247 25.105
122 HG3 LYS 18 HG3 LYS 18 31.755 25.949 24.705
123 HD2 LYS 18 HD2 LYS 18 33.362 24.902 27.040
124 HD3 LYS 18 HD3 LYS 18 33.944 24.729 25.391
125 HE2 LYS 18 HE2 LYS 18 33.569 27.242 25.096
126 HE3 LYS 18 HE3 LYS 18 33.289 27.333 26.843
127 HZ1 LYS 18 HZ1 LYS 18 35.637 27.775 26.185
128 HZ2 LYS 18 HZ2 LYS 18 35.497 26.480 27.201
129 HZ3 LYS 18 HZ3 LYS 18 35.754 26.269 25.573
130 H ARG 19 H ARG 19 30.803 24.661 29.819
131 HA ARG 19 HA ARG 19 33.311 23.362 30.036
132 HB2 ARG 19 HB2 ARG 19 31.416 24.658 31.852
133 HB3 ARG 19 HB3 ARG 19 32.083 23.201 32.592
134 HG2 ARG 19 HG2 ARG 19 34.399 24.004 31.909
135 HG3 ARG 19 HG3 ARG 19 33.659 25.550 31.476
136 HD2 ARG 19 HD2 ARG 19 33.578 24.221 34.217
137 HD3 ARG 19 HD3 ARG 19 34.660 25.529 33.719
138 HE ARG 19 HE ARG 19 32.053 26.470 33.231
139 HH11 ARG 19 HH11 ARG 19 34.033 25.646 36.060
140 HH12 ARG 19 HH12 ARG 19 33.088 26.685 37.096
141 HH21 ARG 19 HH21 ARG 19 30.942 27.705 34.601
142 HH22 ARG 19 HH22 ARG 19 31.450 27.938 36.272
143 H HIS 20 H HIS 20 30.083 21.923 30.457
144 HA HIS 20 HA HIS 20 30.978 19.383 31.491
145 HB2 HIS 20 HB2 HIS 20 28.680 19.950 31.746
146 HB3 HIS 20 HB3 HIS 20 28.481 20.313 30.036
147 HD2 HIS 20 HD2 HIS 20 27.490 18.490 28.568
148 HE1 HIS 20 HE1 HIS 20 28.276 15.070 30.976
149 HE2 HIS 20 HE2 HIS 20 27.171 15.885 28.833
150 H CYS 21 H CYS 21 30.491 20.559 28.152
151 HA CYS 21 HA CYS 21 31.397 18.041 26.986
152 HB2 CYS 21 HB2 CYS 21 30.900 20.781 25.796
153 HB3 CYS 21 HB3 CYS 21 31.211 19.337 24.856
154 H LYS 22 H LYS 22 32.981 21.168 27.733
155 HA LYS 22 HA LYS 22 35.485 20.643 26.511
156 HB2 LYS 22 HB2 LYS 22 34.667 22.837 27.484
157 HB3 LYS 22 HB3 LYS 22 34.926 22.163 29.089
158 HG2 LYS 22 HG2 LYS 22 36.743 23.575 28.650
159 HG3 LYS 22 HG3 LYS 22 37.383 21.947 28.553
160 HD2 LYS 22 HD2 LYS 22 36.452 23.379 26.051
161 HD3 LYS 22 HD3 LYS 22 38.002 23.827 26.750
162 HE2 LYS 22 HE2 LYS 22 37.379 20.929 26.171
163 HE3 LYS 22 HE3 LYS 22 37.855 22.023 24.862
164 HZ1 LYS 22 HZ1 LYS 22 39.678 20.712 26.127
165 HZ2 LYS 22 HZ2 LYS 22 39.956 22.309 25.781
166 HZ3 LYS 22 HZ3 LYS 22 39.521 21.869 27.289
167 H ALA 23 H ALA 23 34.167 19.518 29.620
168 HA ALA 23 HA ALA 23 36.555 18.254 30.593
169 HB1 ALA 23 HB1 ALA 23 33.628 17.615 31.143
170 HB2 ALA 23 HB2 ALA 23 35.023 17.138 32.134
171 HB3 ALA 23 HB3 ALA 23 34.594 18.851 31.986
172 H GLU 24 H GLU 24 34.598 17.378 27.893
173 HA GLU 24 HA GLU 24 35.973 14.736 27.734
174 HB2 GLU 24 HB2 GLU 24 33.365 15.582 26.412
175 HB3 GLU 24 HB3 GLU 24 34.189 14.026 26.223
176 HG2 GLU 24 HG2 GLU 24 33.958 13.635 28.682
177 HG3 GLU 24 HG3 GLU 24 33.029 15.132 28.783
178 H ASP 25 H ASP 25 36.663 17.669 26.903
179 HA ASP 25 HA ASP 25 37.417 18.905 25.193
180 HB2 ASP 25 HB2 ASP 25 38.673 16.266 24.438
181 HB3 ASP 25 HB3 ASP 25 39.125 17.820 23.734
182 H LYS 26 H LYS 26 34.856 18.456 24.833
183 HA LYS 26 HA LYS 26 34.434 18.263 21.874
184 HB2 LYS 26 HB2 LYS 26 32.747 17.427 24.265
185 HB3 LYS 26 HB3 LYS 26 32.040 17.676 22.688
186 HG2 LYS 26 HG2 LYS 26 34.421 15.861 22.654
187 HG3 LYS 26 HG3 LYS 26 33.059 15.290 23.633
188 HD2 LYS 26 HD2 LYS 26 31.521 15.642 21.751
189 HD3 LYS 26 HD3 LYS 26 32.872 16.220 20.755
190 HE2 LYS 26 HE2 LYS 26 33.865 14.027 20.695
191 HE3 LYS 26 HE3 LYS 26 32.745 13.415 21.921
192 HZ1 LYS 26 HZ1 LYS 26 30.924 13.676 20.375
193 HZ2 LYS 26 HZ2 LYS 26 31.825 14.428 19.270
194 HZ3 LYS 26 HZ3 LYS 26 32.077 12.842 19.582
195 H GLU 27 H GLU 27 32.711 19.563 21.010
196 HA GLU 27 HA GLU 27 32.388 22.225 22.206
197 HB2 GLU 27 HB2 GLU 27 31.218 20.891 19.754
198 HB3 GLU 27 HB3 GLU 27 30.895 22.560 20.214
199 HG2 GLU 27 HG2 GLU 27 33.727 21.528 19.742
200 HG3 GLU 27 HG3 GLU 27 32.698 22.129 18.450
201 H GLY 28 H GLY 28 30.484 23.040 23.085
202 HA2 GLY 28 HA2 GLY 28 28.301 21.089 23.742
203 HA3 GLY 28 HA3 GLY 28 29.030 22.076 25.001
204 H ILE 29 H ILE 29 26.247 21.797 23.755
205 HA ILE 29 HA ILE 29 25.575 24.648 23.498
206 HB ILE 29 HB ILE 29 26.220 24.035 21.298
207 HG12 ILE 29 HG12 ILE 29 24.086 25.424 21.767
208 HG13 ILE 29 HG13 ILE 29 24.579 25.009 20.138
209 HG21 ILE 29 HG21 ILE 29 26.079 21.686 21.258
210 HG22 ILE 29 HG22 ILE 29 24.308 21.702 21.389
211 HG23 ILE 29 HG23 ILE 29 25.115 22.322 19.926
212 HD11 ILE 29 HD11 ILE 29 22.476 23.437 21.659
213 HD12 ILE 29 HD12 ILE 29 22.119 24.805 20.583
214 HD13 ILE 29 HD13 ILE 29 22.869 23.336 19.932
215 H CYS 30 H CYS 30 23.491 25.123 24.107
216 HA CYS 30 HA CYS 30 22.141 23.065 25.653
217 HB2 CYS 30 HB2 CYS 30 21.488 25.958 25.094
218 HB3 CYS 30 HB3 CYS 30 20.526 24.905 26.149
219 H HIS 31 H HIS 31 20.793 21.632 24.866
220 HA HIS 31 HA HIS 31 18.926 22.259 22.605
221 HB2 HIS 31 HB2 HIS 31 20.137 19.715 23.648
222 HB3 HIS 31 HB3 HIS 31 18.497 19.662 22.992
223 HD2 HIS 31 HD2 HIS 31 21.999 20.920 21.802
224 HE1 HIS 31 HE1 HIS 31 19.777 19.730 18.365
225 HE2 HIS 31 HE2 HIS 31 22.013 20.625 19.179
226 H GLY 32 H GLY 32 17.448 23.487 23.627
227 HA2 GLY 32 HA2 GLY 32 15.594 24.014 24.867
228 HA3 GLY 32 HA3 GLY 32 15.360 22.288 25.158
229 H THR 33 H THR 33 16.050 21.390 27.010
230 HA THR 33 HA THR 33 16.945 23.129 29.265
231 HB THR 33 HB THR 33 15.471 21.502 30.635
232 HG1 THR 33 HG1 THR 33 14.886 19.925 29.296
233 HG21 THR 33 HG21 THR 33 13.454 22.776 30.119
234 HG22 THR 33 HG22 THR 33 14.857 23.850 30.064
235 HG23 THR 33 HG23 THR 33 14.120 23.286 28.552
236 H LYS 34 H LYS 34 18.379 21.058 27.411
237 HA LYS 34 HA LYS 34 20.180 20.085 29.568
238 HB2 LYS 34 HB2 LYS 34 19.162 18.507 27.149
239 HB3 LYS 34 HB3 LYS 34 20.476 17.964 28.189
240 HG2 LYS 34 HG2 LYS 34 17.629 18.457 29.120
241 HG3 LYS 34 HG3 LYS 34 18.321 16.883 28.708
242 HD2 LYS 34 HD2 LYS 34 20.052 17.216 30.485
243 HD3 LYS 34 HD3 LYS 34 19.229 18.692 31.011
244 HE2 LYS 34 HE2 LYS 34 17.933 15.969 30.777
245 HE3 LYS 34 HE3 LYS 34 18.680 16.570 32.271
246 HZ1 LYS 34 HZ1 LYS 34 17.017 18.284 32.407
247 HZ2 LYS 34 HZ2 LYS 34 16.409 17.915 30.908
248 HZ3 LYS 34 HZ3 LYS 34 16.244 16.859 32.127
249 H CYS 35 H CYS 35 22.286 19.311 28.652
250 HA CYS 35 HA CYS 35 23.322 21.128 26.526
251 HB2 CYS 35 HB2 CYS 35 24.319 21.121 28.846
252 HB3 CYS 35 HB3 CYS 35 24.786 19.442 28.576
253 H LYS 36 H LYS 36 24.279 20.228 24.649
254 HA LYS 36 HA LYS 36 24.383 17.257 24.405
255 HB2 LYS 36 HB2 LYS 36 22.352 18.354 23.337
256 HB3 LYS 36 HB3 LYS 36 23.450 19.151 22.209
257 HG2 LYS 36 HG2 LYS 36 23.479 16.132 22.578
258 HG3 LYS 36 HG3 LYS 36 22.230 16.895 21.608
259 HD2 LYS 36 HD2 LYS 36 25.170 17.356 20.995
260 HD3 LYS 36 HD3 LYS 36 24.286 15.960 20.376
261 HE2 LYS 36 HE2 LYS 36 22.688 17.331 19.218
262 HE3 LYS 36 HE3 LYS 36 23.298 18.803 19.983
263 HZ1 LYS 36 HZ1 LYS 36 24.970 17.177 18.122
264 HZ2 LYS 36 HZ2 LYS 36 24.102 18.504 17.698
265 HZ3 LYS 36 HZ3 LYS 36 25.313 18.617 18.799
266 H CYS 37 H CYS 37 26.366 16.644 24.032
267 HA CYS 37 HA CYS 37 28.350 18.604 23.194
268 HB2 CYS 37 HB2 CYS 37 28.738 15.732 23.950
269 HB3 CYS 37 HB3 CYS 37 30.012 16.924 23.718
270 H GLY 38 H GLY 38 29.310 18.866 21.374
271 HA2 GLY 38 HA2 GLY 38 28.315 17.449 18.993
272 HA3 GLY 38 HA3 GLY 38 29.055 19.048 19.084
273 H VAL 39 H VAL 39 30.798 19.073 17.830
274 HA VAL 39 HA VAL 39 32.415 16.731 17.392
275 HB VAL 39 HB VAL 39 33.872 18.255 16.018
276 HG11 VAL 39 HG11 VAL 39 30.911 18.273 15.360
277 HG12 VAL 39 HG12 VAL 39 32.264 18.451 14.221
278 HG13 VAL 39 HG13 VAL 39 32.045 16.922 15.097
279 HG21 VAL 39 HG21 VAL 39 33.052 20.477 15.435
280 HG22 VAL 39 HG22 VAL 39 31.800 20.371 16.683
281 HG23 VAL 39 HG23 VAL 39 33.521 20.372 17.142
282 HA PRO 40 HA PRO 40 35.617 17.283 20.396
283 HB2 PRO 40 HB2 PRO 40 37.783 16.159 19.144
284 HB3 PRO 40 HB3 PRO 40 36.400 15.213 19.772
285 HG2 PRO 40 HG2 PRO 40 36.881 16.146 16.936
286 HG3 PRO 40 HG3 PRO 40 36.403 14.517 17.515
287 HD2 PRO 40 HD2 PRO 40 34.577 16.318 16.574
288 HD3 PRO 40 HD3 PRO 40 34.153 15.261 17.940
289 H ILE 41 H ILE 41 37.360 18.700 20.909
290 HA ILE 41 HA ILE 41 37.208 21.094 19.377
291 HB ILE 41 HB ILE 41 38.634 22.108 21.032
292 HG12 ILE 41 HG12 ILE 41 39.196 20.744 23.118
293 HG13 ILE 41 HG13 ILE 41 39.003 19.308 22.109
294 HG21 ILE 41 HG21 ILE 41 36.473 20.344 22.251
295 HG22 ILE 41 HG22 ILE 41 37.085 21.872 22.902
296 HG23 ILE 41 HG23 ILE 41 36.204 21.862 21.373
297 HD11 ILE 41 HD11 ILE 41 40.910 21.569 21.372
298 HD12 ILE 41 HD12 ILE 41 41.384 20.224 22.436
299 HD13 ILE 41 HD13 ILE 41 40.906 19.902 20.768
300 H SER 42 H SER 42 39.486 18.570 19.016
301 HA SER 42 HA SER 42 41.257 20.214 17.405
302 HB2 SER 42 HB2 SER 42 42.436 18.006 16.960
303 HB3 SER 42 HB3 SER 42 42.423 18.604 18.616
304 HG SER 42 HG SER 42 41.090 16.367 17.526
305 H TYR 43 H TYR 43 38.467 19.537 16.879
306 HA TYR 43 HA TYR 43 36.967 19.179 15.191
307 HB2 TYR 43 HB2 TYR 43 38.972 21.059 13.910
308 HB3 TYR 43 HB3 TYR 43 37.301 20.851 13.405
309 HD1 TYR 43 HD1 TYR 43 39.380 22.864 15.392
310 HD2 TYR 43 HD2 TYR 43 35.482 21.037 15.351
311 HE1 TYR 43 HE1 TYR 43 38.607 24.453 17.168
312 HE2 TYR 43 HE2 TYR 43 34.703 22.638 17.085
313 HH TYR 43 HH TYR 43 35.248 24.397 18.435
314 H LEU 44 H LEU 44 38.672 16.950 15.175
315 HA LEU 44 HA LEU 44 37.918 15.922 12.556
316 HB2 LEU 44 HB2 LEU 44 40.319 16.764 12.353
317 HB3 LEU 44 HB3 LEU 44 40.773 15.563 13.568
318 HG LEU 44 HG LEU 44 39.872 13.788 11.995
319 HD11 LEU 44 HD11 LEU 44 39.653 14.370 9.605
320 HD12 LEU 44 HD12 LEU 44 38.428 15.194 10.571
321 HD13 LEU 44 HD13 LEU 44 39.854 16.090 10.004
322 HD21 LEU 44 HD21 LEU 44 42.276 14.260 12.171
323 HD22 LEU 44 HD22 LEU 44 41.849 13.888 10.494
324 HD23 LEU 44 HD23 LEU 44 42.121 15.573 10.982
Start of MODEL 15
1 H1 ALA 1 H1 ALA 1 28.499 21.418 37.003
2 H2 ALA 1 H2 ALA 1 28.077 20.184 38.003
3 H3 ALA 1 H3 ALA 1 28.041 21.734 38.555
4 HA ALA 1 HA ALA 1 25.849 21.111 38.197
5 HB1 ALA 1 HB1 ALA 1 25.107 22.766 36.553
6 HB2 ALA 1 HB2 ALA 1 26.434 23.425 37.528
7 HB3 ALA 1 HB3 ALA 1 26.743 22.857 35.871
8 H LYS 2 H LYS 2 24.429 19.763 37.288
9 HA LYS 2 HA LYS 2 25.130 18.198 34.824
10 HB2 LYS 2 HB2 LYS 2 24.616 17.063 37.620
11 HB3 LYS 2 HB3 LYS 2 24.728 16.102 36.174
12 HG2 LYS 2 HG2 LYS 2 27.118 17.819 36.861
13 HG3 LYS 2 HG3 LYS 2 26.716 16.491 37.932
14 HD2 LYS 2 HD2 LYS 2 28.292 15.699 36.303
15 HD3 LYS 2 HD3 LYS 2 26.714 14.931 36.060
16 HE2 LYS 2 HE2 LYS 2 26.234 16.472 34.191
17 HE3 LYS 2 HE3 LYS 2 27.822 17.246 34.414
18 HZ1 LYS 2 HZ1 LYS 2 27.399 14.374 33.808
19 HZ2 LYS 2 HZ2 LYS 2 27.837 15.509 32.676
20 HZ3 LYS 2 HZ3 LYS 2 28.863 15.149 33.894
21 H ASN 3 H ASN 3 22.711 18.900 37.378
22 HA ASN 3 HA ASN 3 20.789 17.103 36.261
23 HB2 ASN 3 HB2 ASN 3 20.543 19.271 38.378
24 HB3 ASN 3 HB3 ASN 3 19.240 18.168 37.931
25 HD21 ASN 3 HD21 ASN 3 22.417 16.663 40.051
26 HD22 ASN 3 HD22 ASN 3 22.423 18.339 39.522
27 H GLN 4 H GLN 4 21.341 20.533 35.570
28 HA GLN 4 HA GLN 4 19.688 20.047 33.151
29 HB2 GLN 4 HB2 GLN 4 18.611 22.158 33.191
30 HB3 GLN 4 HB3 GLN 4 18.247 21.331 34.703
31 HG2 GLN 4 HG2 GLN 4 19.870 22.721 35.903
32 HG3 GLN 4 HG3 GLN 4 20.373 23.507 34.398
33 HE21 GLN 4 HE21 GLN 4 18.402 24.540 33.108
34 HE22 GLN 4 HE22 GLN 4 17.260 25.395 34.154
35 H PHE 5 H PHE 5 22.661 20.566 34.219
36 HA PHE 5 HA PHE 5 24.617 21.397 33.461
37 HB2 PHE 5 HB2 PHE 5 23.283 21.468 30.754
38 HB3 PHE 5 HB3 PHE 5 25.003 21.375 31.084
39 HD1 PHE 5 HD1 PHE 5 26.029 19.280 31.949
40 HD2 PHE 5 HD2 PHE 5 21.860 19.499 30.870
41 HE1 PHE 5 HE1 PHE 5 25.918 16.799 31.814
42 HE2 PHE 5 HE2 PHE 5 21.766 17.014 30.739
43 HZ PHE 5 HZ PHE 5 23.802 15.673 31.187
44 H GLY 6 H GLY 6 22.325 23.473 34.008
45 HA2 GLY 6 HA2 GLY 6 22.278 25.804 34.127
46 HA3 GLY 6 HA3 GLY 6 23.758 25.875 33.167
47 H CYS 7 H CYS 7 21.638 23.923 31.437
48 HA CYS 7 HA CYS 7 21.012 26.092 29.553
49 HB2 CYS 7 HB2 CYS 7 20.583 23.081 29.500
50 HB3 CYS 7 HB3 CYS 7 20.170 24.162 28.191
51 H PHE 8 H PHE 8 19.027 26.960 29.162
52 HA PHE 8 HA PHE 8 16.681 25.308 29.793
53 HB2 PHE 8 HB2 PHE 8 17.039 26.559 31.908
54 HB3 PHE 8 HB3 PHE 8 16.829 28.064 31.031
55 HD1 PHE 8 HD1 PHE 8 14.657 28.879 30.472
56 HD2 PHE 8 HD2 PHE 8 15.132 24.881 32.006
57 HE1 PHE 8 HE1 PHE 8 12.185 28.678 30.727
58 HE2 PHE 8 HE2 PHE 8 12.667 24.694 32.301
59 HZ PHE 8 HZ PHE 8 11.195 26.590 31.655
60 H ALA 9 H ALA 9 15.167 25.399 28.351
61 HA ALA 9 HA ALA 9 14.173 25.776 26.367
62 HB1 ALA 9 HB1 ALA 9 12.850 27.103 27.907
63 HB2 ALA 9 HB2 ALA 9 13.875 28.523 27.620
64 HB3 ALA 9 HB3 ALA 9 12.882 27.860 26.303
65 H ASN 10 H ASN 10 16.622 25.529 25.754
66 HA ASN 10 HA ASN 10 18.167 25.762 24.148
67 HB2 ASN 10 HB2 ASN 10 15.894 27.256 22.803
68 HB3 ASN 10 HB3 ASN 10 17.428 27.041 21.999
69 HD21 ASN 10 HD21 ASN 10 15.059 24.488 21.258
70 HD22 ASN 10 HD22 ASN 10 14.494 25.752 22.311
71 H VAL 11 H VAL 11 18.024 27.953 26.358
72 HA VAL 11 HA VAL 11 20.118 29.679 25.083
73 HB VAL 11 HB VAL 11 18.151 30.530 27.229
74 HG11 VAL 11 HG11 VAL 11 20.307 31.820 27.244
75 HG12 VAL 11 HG12 VAL 11 20.116 32.127 25.504
76 HG13 VAL 11 HG13 VAL 11 18.971 32.806 26.669
77 HG21 VAL 11 HG21 VAL 11 16.953 30.270 25.074
78 HG22 VAL 11 HG22 VAL 11 17.147 31.972 25.465
79 HG23 VAL 11 HG23 VAL 11 18.199 31.219 24.251
80 H ASP 12 H ASP 12 21.873 30.238 26.241
81 HA ASP 12 HA ASP 12 22.821 28.445 28.314
82 HB2 ASP 12 HB2 ASP 12 23.949 29.696 26.187
83 HB3 ASP 12 HB3 ASP 12 24.323 30.906 27.389
84 H VAL 13 H VAL 13 20.608 29.831 29.267
85 HA VAL 13 HA VAL 13 21.159 32.337 30.516
86 HB VAL 13 HB VAL 13 18.962 31.615 31.892
87 HG11 VAL 13 HG11 VAL 13 19.133 33.492 30.374
88 HG12 VAL 13 HG12 VAL 13 18.964 32.398 28.989
89 HG13 VAL 13 HG13 VAL 13 17.621 32.596 30.134
90 HG21 VAL 13 HG21 VAL 13 18.646 29.929 29.400
91 HG22 VAL 13 HG22 VAL 13 18.952 29.267 31.019
92 HG23 VAL 13 HG23 VAL 13 17.480 30.210 30.693
93 H LYS 14 H LYS 14 21.062 29.093 31.966
94 HA LYS 14 HA LYS 14 21.529 30.340 34.642
95 HB2 LYS 14 HB2 LYS 14 20.590 27.510 34.038
96 HB3 LYS 14 HB3 LYS 14 20.690 28.289 35.604
97 HG2 LYS 14 HG2 LYS 14 18.740 28.867 33.370
98 HG3 LYS 14 HG3 LYS 14 18.408 28.249 34.985
99 HD2 LYS 14 HD2 LYS 14 19.317 31.048 34.246
100 HD3 LYS 14 HD3 LYS 14 17.723 30.576 34.828
101 HE2 LYS 14 HE2 LYS 14 18.647 30.007 37.029
102 HE3 LYS 14 HE3 LYS 14 20.292 30.279 36.449
103 HZ1 LYS 14 HZ1 LYS 14 18.199 32.358 36.630
104 HZ2 LYS 14 HZ2 LYS 14 19.526 32.215 37.618
105 HZ3 LYS 14 HZ3 LYS 14 19.701 32.603 36.031
106 H GLY 15 H GLY 15 23.340 28.515 32.333
107 HA2 GLY 15 HA2 GLY 15 25.734 29.000 33.743
108 HA3 GLY 15 HA3 GLY 15 25.222 27.377 34.183
109 H ASP 16 H ASP 16 27.574 27.631 33.102
110 HA ASP 16 HA ASP 16 27.559 27.506 30.194
111 HB2 ASP 16 HB2 ASP 16 29.962 27.658 30.376
112 HB3 ASP 16 HB3 ASP 16 29.155 28.916 31.301
113 H CYS 17 H CYS 17 26.370 25.591 29.972
114 HA CYS 17 HA CYS 17 27.043 22.929 30.486
115 HB2 CYS 17 HB2 CYS 17 25.103 23.030 29.363
116 HB3 CYS 17 HB3 CYS 17 25.504 24.531 28.583
117 H LYS 18 H LYS 18 28.736 25.060 28.271
118 HA LYS 18 HA LYS 18 30.572 23.659 26.857
119 HB2 LYS 18 HB2 LYS 18 30.743 26.082 27.223
120 HB3 LYS 18 HB3 LYS 18 31.027 25.846 28.937
121 HG2 LYS 18 HG2 LYS 18 33.101 26.479 28.085
122 HG3 LYS 18 HG3 LYS 18 33.255 24.772 28.404
123 HD2 LYS 18 HD2 LYS 18 34.354 25.148 26.355
124 HD3 LYS 18 HD3 LYS 18 32.822 24.396 25.881
125 HE2 LYS 18 HE2 LYS 18 31.862 26.634 25.380
126 HE3 LYS 18 HE3 LYS 18 33.318 27.421 26.002
127 HZ1 LYS 18 HZ1 LYS 18 34.566 26.386 24.160
128 HZ2 LYS 18 HZ2 LYS 18 33.168 25.712 23.572
129 HZ3 LYS 18 HZ3 LYS 18 33.349 27.316 23.602
130 H ARG 19 H ARG 19 30.761 23.805 30.468
131 HA ARG 19 HA ARG 19 33.276 22.400 30.522
132 HB2 ARG 19 HB2 ARG 19 31.292 23.163 32.678
133 HB3 ARG 19 HB3 ARG 19 32.723 22.181 33.027
134 HG2 ARG 19 HG2 ARG 19 34.172 23.907 31.970
135 HG3 ARG 19 HG3 ARG 19 32.773 24.964 31.773
136 HD2 ARG 19 HD2 ARG 19 33.613 23.847 34.480
137 HD3 ARG 19 HD3 ARG 19 34.352 25.303 33.797
138 HE ARG 19 HE ARG 19 31.827 26.062 33.605
139 HH11 ARG 19 HH11 ARG 19 32.485 25.611 37.511
140 HH12 ARG 19 HH12 ARG 19 33.577 24.836 36.382
141 HH21 ARG 19 HH21 ARG 19 30.544 27.007 35.047
142 HH22 ARG 19 HH22 ARG 19 30.805 26.836 36.779
143 H HIS 20 H HIS 20 29.984 21.025 30.744
144 HA HIS 20 HA HIS 20 30.949 18.360 31.496
145 HB2 HIS 20 HB2 HIS 20 28.722 18.647 32.042
146 HB3 HIS 20 HB3 HIS 20 28.349 19.545 30.573
147 HD2 HIS 20 HD2 HIS 20 27.415 18.292 28.535
148 HE1 HIS 20 HE1 HIS 20 27.668 14.287 29.950
149 HE2 HIS 20 HE2 HIS 20 26.797 15.779 28.078
150 H CYS 21 H CYS 21 30.420 19.988 28.376
151 HA CYS 21 HA CYS 21 31.091 17.545 26.886
152 HB2 CYS 21 HB2 CYS 21 30.679 20.419 26.050
153 HB3 CYS 21 HB3 CYS 21 30.921 19.088 24.938
154 H LYS 22 H LYS 22 32.851 20.561 27.822
155 HA LYS 22 HA LYS 22 35.247 20.008 26.453
156 HB2 LYS 22 HB2 LYS 22 34.519 22.162 27.465
157 HB3 LYS 22 HB3 LYS 22 34.780 21.476 29.081
158 HG2 LYS 22 HG2 LYS 22 37.195 21.116 28.456
159 HG3 LYS 22 HG3 LYS 22 36.857 21.906 26.900
160 HD2 LYS 22 HD2 LYS 22 36.152 23.971 28.155
161 HD3 LYS 22 HD3 LYS 22 36.564 23.128 29.680
162 HE2 LYS 22 HE2 LYS 22 38.823 22.655 28.711
163 HE3 LYS 22 HE3 LYS 22 38.386 23.656 27.313
164 HZ1 LYS 22 HZ1 LYS 22 38.182 25.556 28.826
165 HZ2 LYS 22 HZ2 LYS 22 38.488 24.638 30.128
166 HZ3 LYS 22 HZ3 LYS 22 39.681 24.894 29.003
167 H ALA 23 H ALA 23 34.059 18.784 29.571
168 HA ALA 23 HA ALA 23 36.439 17.613 30.581
169 HB1 ALA 23 HB1 ALA 23 34.874 16.216 31.880
170 HB2 ALA 23 HB2 ALA 23 34.345 17.909 31.864
171 HB3 ALA 23 HB3 ALA 23 33.535 16.711 30.828
172 H GLU 24 H GLU 24 34.452 16.610 27.884
173 HA GLU 24 HA GLU 24 36.092 14.141 27.548
174 HB2 GLU 24 HB2 GLU 24 33.191 14.524 26.762
175 HB3 GLU 24 HB3 GLU 24 34.170 13.075 26.517
176 HG2 GLU 24 HG2 GLU 24 34.509 12.910 28.988
177 HG3 GLU 24 HG3 GLU 24 33.385 14.251 29.219
178 H ASP 25 H ASP 25 36.490 16.966 26.617
179 HA ASP 25 HA ASP 25 37.209 18.127 24.781
180 HB2 ASP 25 HB2 ASP 25 38.828 16.229 25.003
181 HB3 ASP 25 HB3 ASP 25 37.903 15.331 23.811
182 H LYS 26 H LYS 26 34.681 18.178 24.767
183 HA LYS 26 HA LYS 26 33.901 18.256 21.883
184 HB2 LYS 26 HB2 LYS 26 32.184 17.525 24.297
185 HB3 LYS 26 HB3 LYS 26 31.581 17.743 22.660
186 HG2 LYS 26 HG2 LYS 26 33.608 15.628 23.459
187 HG3 LYS 26 HG3 LYS 26 31.870 15.378 23.510
188 HD2 LYS 26 HD2 LYS 26 31.576 15.717 21.215
189 HD3 LYS 26 HD3 LYS 26 33.240 16.288 20.945
190 HE2 LYS 26 HE2 LYS 26 32.363 13.490 21.795
191 HE3 LYS 26 HE3 LYS 26 32.974 13.949 20.203
192 HZ1 LYS 26 HZ1 LYS 26 34.688 12.915 21.560
193 HZ2 LYS 26 HZ2 LYS 26 35.118 14.444 21.226
194 HZ3 LYS 26 HZ3 LYS 26 34.552 14.076 22.719
195 H GLU 27 H GLU 27 32.641 20.012 21.285
196 HA GLU 27 HA GLU 27 32.384 22.315 23.023
197 HB2 GLU 27 HB2 GLU 27 31.395 21.585 20.250
198 HB3 GLU 27 HB3 GLU 27 30.633 22.925 21.095
199 HG2 GLU 27 HG2 GLU 27 33.592 22.732 20.467
200 HG3 GLU 27 HG3 GLU 27 32.403 23.679 19.583
201 H GLY 28 H GLY 28 30.566 23.076 23.985
202 HA2 GLY 28 HA2 GLY 28 28.230 21.196 24.265
203 HA3 GLY 28 HA3 GLY 28 28.836 22.129 25.622
204 H ILE 29 H ILE 29 26.243 21.966 23.874
205 HA ILE 29 HA ILE 29 25.713 24.867 23.825
206 HB ILE 29 HB ILE 29 26.550 24.306 21.640
207 HG12 ILE 29 HG12 ILE 29 24.630 25.958 22.061
208 HG13 ILE 29 HG13 ILE 29 25.133 25.569 20.426
209 HG21 ILE 29 HG21 ILE 29 24.322 22.293 21.330
210 HG22 ILE 29 HG22 ILE 29 25.372 22.881 20.030
211 HG23 ILE 29 HG23 ILE 29 26.063 21.970 21.377
212 HD11 ILE 29 HD11 ILE 29 22.668 25.718 20.688
213 HD12 ILE 29 HD12 ILE 29 23.209 24.148 20.072
214 HD13 ILE 29 HD13 ILE 29 22.717 24.313 21.768
215 H CYS 30 H CYS 30 23.618 25.405 24.344
216 HA CYS 30 HA CYS 30 22.166 23.310 25.702
217 HB2 CYS 30 HB2 CYS 30 21.581 26.257 25.341
218 HB3 CYS 30 HB3 CYS 30 20.637 25.154 26.348
219 H HIS 31 H HIS 31 20.817 21.968 24.892
220 HA HIS 31 HA HIS 31 18.968 22.661 22.639
221 HB2 HIS 31 HB2 HIS 31 20.414 20.128 23.419
222 HB3 HIS 31 HB3 HIS 31 18.828 20.016 22.683
223 HD2 HIS 31 HD2 HIS 31 22.013 22.105 21.762
224 HE1 HIS 31 HE1 HIS 31 20.490 20.335 18.200
225 HE2 HIS 31 HE2 HIS 31 22.349 21.766 19.149
226 H GLY 32 H GLY 32 17.215 23.405 23.598
227 HA2 GLY 32 HA2 GLY 32 15.342 23.570 24.987
228 HA3 GLY 32 HA3 GLY 32 15.489 21.830 25.246
229 H THR 33 H THR 33 15.761 21.283 27.343
230 HA THR 33 HA THR 33 17.112 23.131 29.255
231 HB THR 33 HB THR 33 16.057 21.790 31.018
232 HG1 THR 33 HG1 THR 33 14.478 20.301 30.408
233 HG21 THR 33 HG21 THR 33 13.854 22.621 30.756
234 HG22 THR 33 HG22 THR 33 14.884 23.757 29.866
235 HG23 THR 33 HG23 THR 33 13.943 22.545 28.985
236 H LYS 34 H LYS 34 18.350 21.057 27.281
237 HA LYS 34 HA LYS 34 20.153 19.692 29.244
238 HB2 LYS 34 HB2 LYS 34 18.983 18.708 26.603
239 HB3 LYS 34 HB3 LYS 34 20.195 17.841 27.526
240 HG2 LYS 34 HG2 LYS 34 17.408 18.518 28.540
241 HG3 LYS 34 HG3 LYS 34 17.907 16.970 27.856
242 HD2 LYS 34 HD2 LYS 34 19.660 16.837 29.692
243 HD3 LYS 34 HD3 LYS 34 18.865 18.210 30.477
244 HE2 LYS 34 HE2 LYS 34 17.455 15.627 29.680
245 HE3 LYS 34 HE3 LYS 34 18.214 15.867 31.252
246 HZ1 LYS 34 HZ1 LYS 34 16.699 17.782 31.591
247 HZ2 LYS 34 HZ2 LYS 34 15.915 17.394 30.192
248 HZ3 LYS 34 HZ3 LYS 34 15.926 16.335 31.445
249 H CYS 35 H CYS 35 22.207 18.942 28.267
250 HA CYS 35 HA CYS 35 23.397 21.072 26.525
251 HB2 CYS 35 HB2 CYS 35 24.249 20.832 28.839
252 HB3 CYS 35 HB3 CYS 35 24.720 19.172 28.470
253 H LYS 36 H LYS 36 23.920 20.483 24.473
254 HA LYS 36 HA LYS 36 24.046 17.651 23.664
255 HB2 LYS 36 HB2 LYS 36 22.398 19.059 22.510
256 HB3 LYS 36 HB3 LYS 36 23.586 20.342 22.306
257 HG2 LYS 36 HG2 LYS 36 23.302 19.310 20.202
258 HG3 LYS 36 HG3 LYS 36 24.908 18.883 20.786
259 HD2 LYS 36 HD2 LYS 36 23.941 16.656 21.566
260 HD3 LYS 36 HD3 LYS 36 22.401 17.138 20.808
261 HE2 LYS 36 HE2 LYS 36 23.703 17.554 18.680
262 HE3 LYS 36 HE3 LYS 36 25.126 16.883 19.499
263 HZ1 LYS 36 HZ1 LYS 36 22.578 15.433 18.958
264 HZ2 LYS 36 HZ2 LYS 36 24.000 15.140 18.215
265 HZ3 LYS 36 HZ3 LYS 36 23.849 14.814 19.820
266 H CYS 37 H CYS 37 26.043 16.918 23.579
267 HA CYS 37 HA CYS 37 28.319 18.733 23.241
268 HB2 CYS 37 HB2 CYS 37 28.416 15.746 23.533
269 HB3 CYS 37 HB3 CYS 37 29.761 16.856 23.550
270 H GLY 38 H GLY 38 29.552 19.012 21.552
271 HA2 GLY 38 HA2 GLY 38 28.544 18.087 18.893
272 HA3 GLY 38 HA3 GLY 38 29.184 19.675 19.309
273 H VAL 39 H VAL 39 30.970 20.031 18.262
274 HA VAL 39 HA VAL 39 32.784 17.929 17.391
275 HB VAL 39 HB VAL 39 33.951 19.852 16.286
276 HG11 VAL 39 HG11 VAL 39 30.988 19.575 15.672
277 HG12 VAL 39 HG12 VAL 39 32.274 20.051 14.547
278 HG13 VAL 39 HG13 VAL 39 32.245 18.407 15.219
279 HG21 VAL 39 HG21 VAL 39 31.578 21.527 17.152
280 HG22 VAL 39 HG22 VAL 39 33.231 21.688 17.790
281 HG23 VAL 39 HG23 VAL 39 32.901 22.001 16.076
282 HA PRO 40 HA PRO 40 35.867 18.247 20.451
283 HB2 PRO 40 HB2 PRO 40 38.272 18.013 19.093
284 HB3 PRO 40 HB3 PRO 40 37.125 16.680 19.364
285 HG2 PRO 40 HG2 PRO 40 37.352 18.449 16.925
286 HG3 PRO 40 HG3 PRO 40 37.251 16.657 16.983
287 HD2 PRO 40 HD2 PRO 40 35.065 18.142 16.477
288 HD3 PRO 40 HD3 PRO 40 34.911 16.752 17.575
289 H ILE 41 H ILE 41 37.619 19.456 21.475
290 HA ILE 41 HA ILE 41 37.632 22.290 20.576
291 HB ILE 41 HB ILE 41 37.584 22.953 22.840
292 HG12 ILE 41 HG12 ILE 41 36.750 21.236 24.597
293 HG13 ILE 41 HG13 ILE 41 37.511 20.027 23.565
294 HG21 ILE 41 HG21 ILE 41 35.277 22.402 23.289
295 HG22 ILE 41 HG22 ILE 41 35.498 22.438 21.524
296 HG23 ILE 41 HG23 ILE 41 35.443 20.877 22.397
297 HD11 ILE 41 HD11 ILE 41 38.979 22.430 24.740
298 HD12 ILE 41 HD12 ILE 41 38.827 20.874 25.575
299 HD13 ILE 41 HD13 ILE 41 39.698 20.957 24.053
300 H SER 42 H SER 42 39.726 19.700 21.741
301 HA SER 42 HA SER 42 41.876 19.564 22.176
302 HB2 SER 42 HB2 SER 42 41.916 20.940 19.488
303 HB3 SER 42 HB3 SER 42 43.094 19.765 20.142
304 HG SER 42 HG SER 42 41.344 19.077 18.606
305 H TYR 43 H TYR 43 41.052 21.911 23.479
306 HA TYR 43 HA TYR 43 43.700 23.126 23.897
307 HB2 TYR 43 HB2 TYR 43 42.903 25.323 24.270
308 HB3 TYR 43 HB3 TYR 43 42.597 24.787 22.634
309 HD1 TYR 43 HD1 TYR 43 40.508 25.166 21.700
310 HD2 TYR 43 HD2 TYR 43 40.871 25.023 25.997
311 HE1 TYR 43 HE1 TYR 43 38.141 25.785 21.915
312 HE2 TYR 43 HE2 TYR 43 38.496 25.620 26.208
313 HH TYR 43 HH TYR 43 36.491 26.423 23.343
314 H LEU 44 H LEU 44 43.880 24.206 26.048
315 HA LEU 44 HA LEU 44 43.295 22.287 28.049
316 HB2 LEU 44 HB2 LEU 44 44.681 23.558 29.451
317 HB3 LEU 44 HB3 LEU 44 45.362 23.654 27.840
318 HG LEU 44 HG LEU 44 43.847 25.851 29.311
319 HD11 LEU 44 HD11 LEU 44 46.756 25.579 28.466
320 HD12 LEU 44 HD12 LEU 44 46.040 26.928 29.370
321 HD13 LEU 44 HD13 LEU 44 46.128 25.314 30.107
322 HD21 LEU 44 HD21 LEU 44 45.176 25.915 26.559
323 HD22 LEU 44 HD22 LEU 44 43.442 26.156 26.905
324 HD23 LEU 44 HD23 LEU 44 44.623 27.339 27.461
Start of MODEL 16
1 H1 ALA 1 H1 ALA 1 21.922 25.142 37.134
2 H2 ALA 1 H2 ALA 1 23.247 24.879 38.093
3 H3 ALA 1 H3 ALA 1 21.832 25.429 38.737
4 HA ALA 1 HA ALA 1 22.246 23.088 39.205
5 HB1 ALA 1 HB1 ALA 1 19.785 23.762 37.548
6 HB2 ALA 1 HB2 ALA 1 19.997 22.276 38.493
7 HB3 ALA 1 HB3 ALA 1 19.971 23.847 39.307
8 H LYS 2 H LYS 2 22.664 21.049 38.442
9 HA LYS 2 HA LYS 2 24.097 21.095 35.830
10 HB2 LYS 2 HB2 LYS 2 25.515 19.375 36.691
11 HB3 LYS 2 HB3 LYS 2 25.488 20.750 37.787
12 HG2 LYS 2 HG2 LYS 2 23.958 19.513 39.308
13 HG3 LYS 2 HG3 LYS 2 23.910 18.164 38.172
14 HD2 LYS 2 HD2 LYS 2 25.409 17.661 40.001
15 HD3 LYS 2 HD3 LYS 2 26.329 17.775 38.496
16 HE2 LYS 2 HE2 LYS 2 27.201 19.949 39.072
17 HE3 LYS 2 HE3 LYS 2 26.062 20.125 40.415
18 HZ1 LYS 2 HZ1 LYS 2 27.159 18.396 41.592
19 HZ2 LYS 2 HZ2 LYS 2 28.173 18.045 40.349
20 HZ3 LYS 2 HZ3 LYS 2 28.317 19.480 41.138
21 H ASN 3 H ASN 3 21.510 19.472 37.506
22 HA ASN 3 HA ASN 3 21.100 17.340 35.601
23 HB2 ASN 3 HB2 ASN 3 18.701 17.594 36.446
24 HB3 ASN 3 HB3 ASN 3 19.956 17.147 37.622
25 HD21 ASN 3 HD21 ASN 3 18.810 19.715 39.714
26 HD22 ASN 3 HD22 ASN 3 19.185 17.988 39.540
27 H GLN 4 H GLN 4 20.350 20.771 35.529
28 HA GLN 4 HA GLN 4 19.271 20.411 32.748
29 HB2 GLN 4 HB2 GLN 4 18.315 22.518 32.788
30 HB3 GLN 4 HB3 GLN 4 17.924 21.792 34.340
31 HG2 GLN 4 HG2 GLN 4 19.711 23.129 35.411
32 HG3 GLN 4 HG3 GLN 4 20.121 23.833 33.837
33 HE21 GLN 4 HE21 GLN 4 18.031 24.858 32.648
34 HE22 GLN 4 HE22 GLN 4 17.176 25.944 33.754
35 H PHE 5 H PHE 5 22.246 20.678 34.060
36 HA PHE 5 HA PHE 5 24.266 21.530 33.551
37 HB2 PHE 5 HB2 PHE 5 23.219 21.313 30.721
38 HB3 PHE 5 HB3 PHE 5 24.905 21.514 31.158
39 HD1 PHE 5 HD1 PHE 5 26.272 19.706 31.899
40 HD2 PHE 5 HD2 PHE 5 22.033 19.136 31.356
41 HE1 PHE 5 HE1 PHE 5 26.575 17.247 32.065
42 HE2 PHE 5 HE2 PHE 5 22.338 16.686 31.570
43 HZ PHE 5 HZ PHE 5 24.609 15.734 31.893
44 H GLY 6 H GLY 6 22.120 23.534 34.052
45 HA2 GLY 6 HA2 GLY 6 21.958 25.856 34.162
46 HA3 GLY 6 HA3 GLY 6 23.475 25.979 33.272
47 H CYS 7 H CYS 7 21.582 24.081 31.324
48 HA CYS 7 HA CYS 7 21.071 26.227 29.443
49 HB2 CYS 7 HB2 CYS 7 20.370 23.277 29.374
50 HB3 CYS 7 HB3 CYS 7 20.196 24.373 28.044
51 H PHE 8 H PHE 8 19.190 27.251 29.032
52 HA PHE 8 HA PHE 8 16.637 25.871 29.533
53 HB2 PHE 8 HB2 PHE 8 16.990 27.154 31.605
54 HB3 PHE 8 HB3 PHE 8 17.170 28.631 30.673
55 HD1 PHE 8 HD1 PHE 8 15.263 29.730 29.614
56 HD2 PHE 8 HD2 PHE 8 14.786 26.068 31.849
57 HE1 PHE 8 HE1 PHE 8 12.783 29.998 29.551
58 HE2 PHE 8 HE2 PHE 8 12.317 26.349 31.793
59 HZ PHE 8 HZ PHE 8 11.316 28.305 30.630
60 H ALA 9 H ALA 9 15.108 26.282 28.020
61 HA ALA 9 HA ALA 9 14.467 26.647 25.876
62 HB1 ALA 9 HB1 ALA 9 13.392 28.420 27.135
63 HB2 ALA 9 HB2 ALA 9 14.762 29.508 26.837
64 HB3 ALA 9 HB3 ALA 9 13.754 28.951 25.488
65 H ASN 10 H ASN 10 16.801 25.751 25.630
66 HA ASN 10 HA ASN 10 18.588 25.442 24.364
67 HB2 ASN 10 HB2 ASN 10 17.308 27.167 22.239
68 HB3 ASN 10 HB3 ASN 10 18.335 25.767 22.048
69 HD21 ASN 10 HD21 ASN 10 15.268 24.578 21.071
70 HD22 ASN 10 HD22 ASN 10 16.774 25.277 20.496
71 H VAL 11 H VAL 11 18.837 27.793 26.170
72 HA VAL 11 HA VAL 11 21.319 28.932 24.970
73 HB VAL 11 HB VAL 11 19.210 30.488 26.536
74 HG11 VAL 11 HG11 VAL 11 20.613 32.479 25.971
75 HG12 VAL 11 HG12 VAL 11 21.481 31.366 27.018
76 HG13 VAL 11 HG13 VAL 11 21.846 31.412 25.282
77 HG21 VAL 11 HG21 VAL 11 18.979 31.821 24.445
78 HG22 VAL 11 HG22 VAL 11 20.068 30.694 23.608
79 HG23 VAL 11 HG23 VAL 11 18.488 30.150 24.201
80 H ASP 12 H ASP 12 23.015 29.234 26.399
81 HA ASP 12 HA ASP 12 22.962 27.899 28.975
82 HB2 ASP 12 HB2 ASP 12 25.305 28.282 29.062
83 HB3 ASP 12 HB3 ASP 12 24.868 27.702 27.472
84 H VAL 13 H VAL 13 21.052 29.692 29.352
85 HA VAL 13 HA VAL 13 21.955 32.276 30.287
86 HB VAL 13 HB VAL 13 19.543 32.242 31.399
87 HG11 VAL 13 HG11 VAL 13 18.617 33.085 29.320
88 HG12 VAL 13 HG12 VAL 13 20.263 33.690 29.555
89 HG13 VAL 13 HG13 VAL 13 19.955 32.375 28.399
90 HG21 VAL 13 HG21 VAL 13 19.162 29.785 30.924
91 HG22 VAL 13 HG22 VAL 13 17.929 30.893 30.293
92 HG23 VAL 13 HG23 VAL 13 19.121 30.190 29.194
93 H LYS 14 H LYS 14 20.872 29.399 32.141
94 HA LYS 14 HA LYS 14 21.425 30.850 34.682
95 HB2 LYS 14 HB2 LYS 14 20.209 28.093 34.322
96 HB3 LYS 14 HB3 LYS 14 20.218 29.075 35.780
97 HG2 LYS 14 HG2 LYS 14 18.674 29.593 33.221
98 HG3 LYS 14 HG3 LYS 14 18.019 29.099 34.770
99 HD2 LYS 14 HD2 LYS 14 19.380 31.790 34.305
100 HD3 LYS 14 HD3 LYS 14 17.652 31.497 34.138
101 HE2 LYS 14 HE2 LYS 14 17.504 30.786 36.500
102 HE3 LYS 14 HE3 LYS 14 19.243 31.065 36.702
103 HZ1 LYS 14 HZ1 LYS 14 17.276 33.163 35.939
104 HZ2 LYS 14 HZ2 LYS 14 17.906 32.979 37.453
105 HZ3 LYS 14 HZ3 LYS 14 18.894 33.397 36.236
106 H GLY 15 H GLY 15 23.102 28.725 32.673
107 HA2 GLY 15 HA2 GLY 15 25.504 29.052 34.075
108 HA3 GLY 15 HA3 GLY 15 24.900 27.438 34.487
109 H ASP 16 H ASP 16 27.230 27.448 33.198
110 HA ASP 16 HA ASP 16 26.774 27.145 30.297
111 HB2 ASP 16 HB2 ASP 16 29.153 27.048 30.065
112 HB3 ASP 16 HB3 ASP 16 28.723 28.444 31.051
113 H CYS 17 H CYS 17 27.044 25.355 29.135
114 HA CYS 17 HA CYS 17 27.386 22.748 30.545
115 HB2 CYS 17 HB2 CYS 17 25.337 23.083 29.248
116 HB3 CYS 17 HB3 CYS 17 26.303 23.398 27.806
117 H LYS 18 H LYS 18 29.115 25.037 28.596
118 HA LYS 18 HA LYS 18 30.789 23.492 27.052
119 HB2 LYS 18 HB2 LYS 18 30.654 25.985 27.173
120 HB3 LYS 18 HB3 LYS 18 31.613 25.960 28.657
121 HG2 LYS 18 HG2 LYS 18 32.628 24.628 26.114
122 HG3 LYS 18 HG3 LYS 18 32.703 26.375 26.263
123 HD2 LYS 18 HD2 LYS 18 33.969 24.533 28.320
124 HD3 LYS 18 HD3 LYS 18 34.803 25.107 26.869
125 HE2 LYS 18 HE2 LYS 18 34.301 27.470 27.594
126 HE3 LYS 18 HE3 LYS 18 33.653 26.826 29.108
127 HZ1 LYS 18 HZ1 LYS 18 36.423 26.537 28.115
128 HZ2 LYS 18 HZ2 LYS 18 35.937 27.476 29.363
129 HZ3 LYS 18 HZ3 LYS 18 35.864 25.829 29.512
130 H ARG 19 H ARG 19 31.242 24.085 30.573
131 HA ARG 19 HA ARG 19 33.652 22.611 30.899
132 HB2 ARG 19 HB2 ARG 19 31.382 23.501 32.649
133 HB3 ARG 19 HB3 ARG 19 32.361 22.170 33.274
134 HG2 ARG 19 HG2 ARG 19 34.390 23.421 33.097
135 HG3 ARG 19 HG3 ARG 19 33.593 24.757 32.253
136 HD2 ARG 19 HD2 ARG 19 32.703 23.914 35.030
137 HD3 ARG 19 HD3 ARG 19 34.137 24.924 34.802
138 HE ARG 19 HE ARG 19 31.582 25.783 33.518
139 HH11 ARG 19 HH11 ARG 19 34.027 26.533 36.031
140 HH12 ARG 19 HH12 ARG 19 33.419 28.183 36.094
141 HH21 ARG 19 HH21 ARG 19 30.892 27.810 33.944
142 HH22 ARG 19 HH22 ARG 19 31.851 28.867 35.003
143 H HIS 20 H HIS 20 30.350 21.285 30.806
144 HA HIS 20 HA HIS 20 31.080 18.590 31.580
145 HB2 HIS 20 HB2 HIS 20 28.789 19.075 31.757
146 HB3 HIS 20 HB3 HIS 20 28.712 19.863 30.191
147 HD2 HIS 20 HD2 HIS 20 27.581 18.519 28.347
148 HE1 HIS 20 HE1 HIS 20 28.474 14.561 29.620
149 HE2 HIS 20 HE2 HIS 20 27.287 15.933 27.857
150 H CYS 21 H CYS 21 30.712 20.146 28.353
151 HA CYS 21 HA CYS 21 31.574 17.699 27.050
152 HB2 CYS 21 HB2 CYS 21 30.946 20.479 26.062
153 HB3 CYS 21 HB3 CYS 21 31.381 19.143 24.988
154 H LYS 22 H LYS 22 33.295 20.714 27.995
155 HA LYS 22 HA LYS 22 35.665 20.176 26.562
156 HB2 LYS 22 HB2 LYS 22 34.884 22.330 27.688
157 HB3 LYS 22 HB3 LYS 22 35.386 21.646 29.227
158 HG2 LYS 22 HG2 LYS 22 37.069 23.166 28.344
159 HG3 LYS 22 HG3 LYS 22 37.741 21.528 28.340
160 HD2 LYS 22 HD2 LYS 22 37.346 21.326 25.921
161 HD3 LYS 22 HD3 LYS 22 36.378 22.805 25.923
162 HE2 LYS 22 HE2 LYS 22 38.414 23.424 25.033
163 HE3 LYS 22 HE3 LYS 22 38.421 24.047 26.689
164 HZ1 LYS 22 HZ1 LYS 22 39.624 21.410 26.054
165 HZ2 LYS 22 HZ2 LYS 22 40.504 22.730 25.806
166 HZ3 LYS 22 HZ3 LYS 22 39.969 22.441 27.334
167 H ALA 23 H ALA 23 34.509 18.758 29.588
168 HA ALA 23 HA ALA 23 36.951 17.528 30.439
169 HB1 ALA 23 HB1 ALA 23 34.830 17.681 31.743
170 HB2 ALA 23 HB2 ALA 23 34.084 16.527 30.621
171 HB3 ALA 23 HB3 ALA 23 35.440 16.015 31.639
172 H GLU 24 H GLU 24 34.726 16.750 27.812
173 HA GLU 24 HA GLU 24 36.309 14.362 26.979
174 HB2 GLU 24 HB2 GLU 24 33.623 15.430 26.020
175 HB3 GLU 24 HB3 GLU 24 34.384 13.937 25.486
176 HG2 GLU 24 HG2 GLU 24 33.470 14.499 28.353
177 HG3 GLU 24 HG3 GLU 24 32.549 13.628 27.151
178 H ASP 25 H ASP 25 36.709 17.481 26.686
179 HA ASP 25 HA ASP 25 37.368 19.050 25.325
180 HB2 ASP 25 HB2 ASP 25 39.224 17.219 25.349
181 HB3 ASP 25 HB3 ASP 25 38.865 17.099 23.629
182 H LYS 26 H LYS 26 34.825 18.221 24.672
183 HA LYS 26 HA LYS 26 34.521 18.951 21.781
184 HB2 LYS 26 HB2 LYS 26 32.653 17.490 23.690
185 HB3 LYS 26 HB3 LYS 26 32.168 18.122 22.126
186 HG2 LYS 26 HG2 LYS 26 34.419 16.622 21.451
187 HG3 LYS 26 HG3 LYS 26 33.682 15.690 22.776
188 HD2 LYS 26 HD2 LYS 26 31.498 15.734 21.592
189 HD3 LYS 26 HD3 LYS 26 32.249 16.691 20.292
190 HE2 LYS 26 HE2 LYS 26 33.811 14.844 19.806
191 HE3 LYS 26 HE3 LYS 26 33.087 13.887 21.108
192 HZ1 LYS 26 HZ1 LYS 26 32.150 13.294 18.940
193 HZ2 LYS 26 HZ2 LYS 26 30.968 13.931 19.882
194 HZ3 LYS 26 HZ3 LYS 26 31.644 14.817 18.669
195 H GLU 27 H GLU 27 32.703 20.268 21.247
196 HA GLU 27 HA GLU 27 32.244 22.629 22.883
197 HB2 GLU 27 HB2 GLU 27 30.964 21.513 20.352
198 HB3 GLU 27 HB3 GLU 27 30.487 23.041 21.083
199 HG2 GLU 27 HG2 GLU 27 33.336 22.483 20.191
200 HG3 GLU 27 HG3 GLU 27 32.118 23.118 19.106
201 H GLY 28 H GLY 28 30.388 23.063 24.041
202 HA2 GLY 28 HA2 GLY 28 28.417 20.861 24.544
203 HA3 GLY 28 HA3 GLY 28 28.646 22.244 25.587
204 H ILE 29 H ILE 29 26.113 21.210 24.323
205 HA ILE 29 HA ILE 29 25.285 23.698 22.969
206 HB ILE 29 HB ILE 29 25.883 22.301 21.191
207 HG12 ILE 29 HG12 ILE 29 23.802 23.677 21.080
208 HG13 ILE 29 HG13 ILE 29 24.086 22.467 19.836
209 HG21 ILE 29 HG21 ILE 29 24.190 20.075 22.276
210 HG22 ILE 29 HG22 ILE 29 24.850 20.148 20.626
211 HG23 ILE 29 HG23 ILE 29 25.949 20.095 22.001
212 HD11 ILE 29 HD11 ILE 29 22.146 22.154 22.127
213 HD12 ILE 29 HD12 ILE 29 21.736 22.511 20.455
214 HD13 ILE 29 HD13 ILE 29 22.453 20.948 20.862
215 H CYS 30 H CYS 30 23.701 24.529 23.999
216 HA CYS 30 HA CYS 30 21.877 22.937 25.690
217 HB2 CYS 30 HB2 CYS 30 22.011 25.911 25.056
218 HB3 CYS 30 HB3 CYS 30 20.849 25.155 26.142
219 H HIS 31 H HIS 31 20.486 21.721 24.482
220 HA HIS 31 HA HIS 31 18.969 23.072 22.272
221 HB2 HIS 31 HB2 HIS 31 18.325 20.781 21.606
222 HB3 HIS 31 HB3 HIS 31 20.048 21.060 21.566
223 HD2 HIS 31 HD2 HIS 31 21.593 19.650 23.109
224 HE1 HIS 31 HE1 HIS 31 18.555 17.488 25.238
225 HE2 HIS 31 HE2 HIS 31 21.052 17.680 24.846
226 H GLY 32 H GLY 32 18.450 22.969 25.416
227 HA2 GLY 32 HA2 GLY 32 15.733 23.726 25.307
228 HA3 GLY 32 HA3 GLY 32 15.763 21.999 25.626
229 H THR 33 H THR 33 15.153 21.909 27.693
230 HA THR 33 HA THR 33 16.448 23.367 29.882
231 HB THR 33 HB THR 33 14.975 21.897 31.286
232 HG1 THR 33 HG1 THR 33 13.609 20.533 30.297
233 HG21 THR 33 HG21 THR 33 13.477 23.274 29.001
234 HG22 THR 33 HG22 THR 33 12.845 22.875 30.610
235 HG23 THR 33 HG23 THR 33 14.124 24.086 30.444
236 H LYS 34 H LYS 34 17.856 21.430 27.981
237 HA LYS 34 HA LYS 34 19.457 19.815 29.851
238 HB2 LYS 34 HB2 LYS 34 17.863 18.635 27.522
239 HB3 LYS 34 HB3 LYS 34 19.089 17.762 28.410
240 HG2 LYS 34 HG2 LYS 34 16.443 18.736 29.533
241 HG3 LYS 34 HG3 LYS 34 16.826 17.098 29.064
242 HD2 LYS 34 HD2 LYS 34 18.307 18.551 31.303
243 HD3 LYS 34 HD3 LYS 34 16.856 17.595 31.534
244 HE2 LYS 34 HE2 LYS 34 18.092 15.634 30.447
245 HE3 LYS 34 HE3 LYS 34 19.560 16.619 30.566
246 HZ1 LYS 34 HZ1 LYS 34 17.858 15.692 32.817
247 HZ2 LYS 34 HZ2 LYS 34 19.449 15.289 32.538
248 HZ3 LYS 34 HZ3 LYS 34 19.055 16.791 32.991
249 H CYS 35 H CYS 35 21.190 18.652 28.491
250 HA CYS 35 HA CYS 35 22.156 20.430 26.292
251 HB2 CYS 35 HB2 CYS 35 23.082 21.025 28.556
252 HB3 CYS 35 HB3 CYS 35 23.841 19.428 28.603
253 H LYS 36 H LYS 36 24.207 19.483 25.306
254 HA LYS 36 HA LYS 36 24.563 16.604 25.050
255 HB2 LYS 36 HB2 LYS 36 22.976 18.293 23.215
256 HB3 LYS 36 HB3 LYS 36 24.287 17.670 22.400
257 HG2 LYS 36 HG2 LYS 36 23.515 15.324 23.183
258 HG3 LYS 36 HG3 LYS 36 22.101 16.152 23.884
259 HD2 LYS 36 HD2 LYS 36 21.491 15.256 21.712
260 HD3 LYS 36 HD3 LYS 36 21.507 17.021 21.622
261 HE2 LYS 36 HE2 LYS 36 23.873 16.857 20.679
262 HE3 LYS 36 HE3 LYS 36 23.670 15.101 20.627
263 HZ1 LYS 36 HZ1 LYS 36 21.980 17.069 19.171
264 HZ2 LYS 36 HZ2 LYS 36 23.204 16.196 18.527
265 HZ3 LYS 36 HZ3 LYS 36 21.854 15.414 19.093
266 H CYS 37 H CYS 37 26.461 16.313 23.607
267 HA CYS 37 HA CYS 37 28.195 18.725 23.386
268 HB2 CYS 37 HB2 CYS 37 29.053 15.826 23.251
269 HB3 CYS 37 HB3 CYS 37 30.079 17.259 23.200
270 H GLY 38 H GLY 38 29.274 19.240 21.576
271 HA2 GLY 38 HA2 GLY 38 27.943 18.625 18.988
272 HA3 GLY 38 HA3 GLY 38 28.935 20.017 19.407
273 H VAL 39 H VAL 39 30.743 20.051 18.302
274 HA VAL 39 HA VAL 39 32.192 17.604 17.556
275 HB VAL 39 HB VAL 39 33.448 19.127 16.010
276 HG11 VAL 39 HG11 VAL 39 30.438 19.121 15.618
277 HG12 VAL 39 HG12 VAL 39 31.681 19.287 14.362
278 HG13 VAL 39 HG13 VAL 39 31.532 17.767 15.258
279 HG21 VAL 39 HG21 VAL 39 31.353 21.214 16.723
280 HG22 VAL 39 HG22 VAL 39 33.069 21.282 17.186
281 HG23 VAL 39 HG23 VAL 39 32.608 21.329 15.479
282 HA PRO 40 HA PRO 40 35.794 18.261 20.169
283 HB2 PRO 40 HB2 PRO 40 37.254 18.188 17.517
284 HB3 PRO 40 HB3 PRO 40 37.678 17.380 19.056
285 HG2 PRO 40 HG2 PRO 40 36.485 15.987 17.077
286 HG3 PRO 40 HG3 PRO 40 35.948 15.781 18.779
287 HD2 PRO 40 HD2 PRO 40 34.606 17.401 16.592
288 HD3 PRO 40 HD3 PRO 40 33.909 16.358 17.859
289 H ILE 41 H ILE 41 36.930 20.074 20.954
290 HA ILE 41 HA ILE 41 36.489 22.594 19.559
291 HB ILE 41 HB ILE 41 37.199 23.662 21.502
292 HG12 ILE 41 HG12 ILE 41 37.848 21.941 23.536
293 HG13 ILE 41 HG13 ILE 41 38.634 21.137 22.187
294 HG21 ILE 41 HG21 ILE 41 35.698 22.827 23.194
295 HG22 ILE 41 HG22 ILE 41 34.972 22.539 21.604
296 HG23 ILE 41 HG23 ILE 41 35.753 21.206 22.498
297 HD11 ILE 41 HD11 ILE 41 40.065 22.813 23.380
298 HD12 ILE 41 HD12 ILE 41 39.843 23.240 21.678
299 HD13 ILE 41 HD13 ILE 41 38.937 24.098 22.939
300 H SER 42 H SER 42 39.091 20.399 19.772
301 HA SER 42 HA SER 42 41.280 20.371 19.202
302 HB2 SER 42 HB2 SER 42 39.949 21.501 16.744
303 HB3 SER 42 HB3 SER 42 41.327 20.380 16.840
304 HG SER 42 HG SER 42 39.924 18.804 17.721
305 H TYR 43 H TYR 43 41.339 22.693 20.646
306 HA TYR 43 HA TYR 43 43.538 24.112 19.297
307 HB2 TYR 43 HB2 TYR 43 42.704 26.149 19.010
308 HB3 TYR 43 HB3 TYR 43 41.214 25.271 18.778
309 HD1 TYR 43 HD1 TYR 43 39.392 25.458 20.470
310 HD2 TYR 43 HD2 TYR 43 43.173 27.463 20.993
311 HE1 TYR 43 HE1 TYR 43 38.425 26.808 22.317
312 HE2 TYR 43 HE2 TYR 43 42.220 28.805 22.827
313 HH TYR 43 HH TYR 43 38.775 28.551 23.802
314 H LEU 44 H LEU 44 41.803 23.552 22.288
315 HA LEU 44 HA LEU 44 44.214 24.301 23.882
316 HB2 LEU 44 HB2 LEU 44 42.684 26.099 24.171
317 HB3 LEU 44 HB3 LEU 44 41.304 25.017 24.350
318 HG LEU 44 HG LEU 44 42.043 24.284 26.535
319 HD11 LEU 44 HD11 LEU 44 44.484 24.276 26.278
320 HD12 LEU 44 HD12 LEU 44 44.486 26.041 26.091
321 HD13 LEU 44 HD13 LEU 44 44.021 25.295 27.638
322 HD21 LEU 44 HD21 LEU 44 40.772 26.394 26.325
323 HD22 LEU 44 HD22 LEU 44 41.848 26.398 27.737
324 HD23 LEU 44 HD23 LEU 44 42.301 27.303 26.276
Start of MODEL 17
1 H1 ALA 1 H1 ALA 1 27.172 21.658 38.259
2 H2 ALA 1 H2 ALA 1 26.166 20.795 39.208
3 H3 ALA 1 H3 ALA 1 26.123 22.439 39.272
4 HA ALA 1 HA ALA 1 24.237 21.659 38.046
5 HB1 ALA 1 HB1 ALA 1 26.398 23.033 36.392
6 HB2 ALA 1 HB2 ALA 1 24.721 22.841 35.855
7 HB3 ALA 1 HB3 ALA 1 25.069 23.770 37.324
8 H LYS 2 H LYS 2 23.638 19.652 37.555
9 HA LYS 2 HA LYS 2 24.961 18.203 35.274
10 HB2 LYS 2 HB2 LYS 2 25.641 17.413 37.546
11 HB3 LYS 2 HB3 LYS 2 23.948 17.066 37.914
12 HG2 LYS 2 HG2 LYS 2 23.933 15.406 36.010
13 HG3 LYS 2 HG3 LYS 2 25.658 15.717 35.781
14 HD2 LYS 2 HD2 LYS 2 24.303 14.542 38.254
15 HD3 LYS 2 HD3 LYS 2 25.329 13.684 37.092
16 HE2 LYS 2 HE2 LYS 2 27.241 15.165 37.727
17 HE3 LYS 2 HE3 LYS 2 26.207 15.963 38.915
18 HZ1 LYS 2 HZ1 LYS 2 27.052 13.107 38.975
19 HZ2 LYS 2 HZ2 LYS 2 27.540 14.287 39.987
20 HZ3 LYS 2 HZ3 LYS 2 25.984 13.799 40.051
21 H ASN 3 H ASN 3 21.986 18.941 37.054
22 HA ASN 3 HA ASN 3 20.434 17.061 35.436
23 HB2 ASN 3 HB2 ASN 3 19.542 18.922 37.661
24 HB3 ASN 3 HB3 ASN 3 18.611 17.603 36.948
25 HD21 ASN 3 HD21 ASN 3 20.533 15.048 38.608
26 HD22 ASN 3 HD22 ASN 3 19.636 15.338 37.132
27 H GLN 4 H GLN 4 21.022 20.549 35.254
28 HA GLN 4 HA GLN 4 19.576 20.377 32.673
29 HB2 GLN 4 HB2 GLN 4 18.616 22.508 32.819
30 HB3 GLN 4 HB3 GLN 4 18.137 21.633 34.264
31 HG2 GLN 4 HG2 GLN 4 19.786 22.901 35.602
32 HG3 GLN 4 HG3 GLN 4 20.358 23.729 34.146
33 HE21 GLN 4 HE21 GLN 4 18.459 24.862 32.844
34 HE22 GLN 4 HE22 GLN 4 17.407 25.824 33.914
35 H PHE 5 H PHE 5 22.475 20.826 34.194
36 HA PHE 5 HA PHE 5 24.525 21.543 33.633
37 HB2 PHE 5 HB2 PHE 5 23.579 21.527 30.769
38 HB3 PHE 5 HB3 PHE 5 25.227 21.466 31.358
39 HD1 PHE 5 HD1 PHE 5 26.181 19.423 32.337
40 HD2 PHE 5 HD2 PHE 5 22.144 19.544 30.828
41 HE1 PHE 5 HE1 PHE 5 26.137 16.945 32.252
42 HE2 PHE 5 HE2 PHE 5 22.111 17.048 30.721
43 HZ PHE 5 HZ PHE 5 24.102 15.761 31.439
44 H GLY 6 H GLY 6 22.357 23.632 34.040
45 HA2 GLY 6 HA2 GLY 6 22.369 25.949 34.135
46 HA3 GLY 6 HA3 GLY 6 23.782 26.018 33.109
47 H CYS 7 H CYS 7 21.890 24.087 31.304
48 HA CYS 7 HA CYS 7 21.102 26.238 29.507
49 HB2 CYS 7 HB2 CYS 7 20.823 23.215 29.397
50 HB3 CYS 7 HB3 CYS 7 20.329 24.286 28.114
51 H PHE 8 H PHE 8 19.120 27.002 29.067
52 HA PHE 8 HA PHE 8 16.748 25.350 29.567
53 HB2 PHE 8 HB2 PHE 8 17.104 26.626 31.707
54 HB3 PHE 8 HB3 PHE 8 16.894 28.111 30.824
55 HD1 PHE 8 HD1 PHE 8 14.675 28.774 29.965
56 HD2 PHE 8 HD2 PHE 8 15.240 25.145 32.224
57 HE1 PHE 8 HE1 PHE 8 12.219 28.664 30.419
58 HE2 PHE 8 HE2 PHE 8 12.791 25.027 32.655
59 HZ PHE 8 HZ PHE 8 11.294 26.799 31.759
60 H ALA 9 H ALA 9 15.277 25.621 27.955
61 HA ALA 9 HA ALA 9 14.436 26.253 25.954
62 HB1 ALA 9 HB1 ALA 9 13.391 27.779 27.557
63 HB2 ALA 9 HB2 ALA 9 14.640 28.994 27.228
64 HB3 ALA 9 HB3 ALA 9 13.524 28.508 25.935
65 H ASN 10 H ASN 10 16.905 25.633 25.438
66 HA ASN 10 HA ASN 10 18.700 25.809 24.108
67 HB2 ASN 10 HB2 ASN 10 17.013 27.705 22.433
68 HB3 ASN 10 HB3 ASN 10 18.376 26.752 21.883
69 HD21 ASN 10 HD21 ASN 10 15.498 25.194 20.679
70 HD22 ASN 10 HD22 ASN 10 16.551 26.570 20.347
71 H VAL 11 H VAL 11 18.535 27.924 26.300
72 HA VAL 11 HA VAL 11 20.767 29.656 25.314
73 HB VAL 11 HB VAL 11 18.317 30.444 26.922
74 HG11 VAL 11 HG11 VAL 11 20.273 31.641 27.914
75 HG12 VAL 11 HG12 VAL 11 20.753 32.179 26.287
76 HG13 VAL 11 HG13 VAL 11 19.236 32.736 27.024
77 HG21 VAL 11 HG21 VAL 11 18.013 32.112 25.109
78 HG22 VAL 11 HG22 VAL 11 19.423 31.450 24.265
79 HG23 VAL 11 HG23 VAL 11 17.965 30.461 24.485
80 H ASP 12 H ASP 12 22.332 30.173 26.815
81 HA ASP 12 HA ASP 12 22.855 28.270 28.936
82 HB2 ASP 12 HB2 ASP 12 24.416 30.805 28.329
83 HB3 ASP 12 HB3 ASP 12 25.016 29.301 29.008
84 H VAL 13 H VAL 13 20.488 29.611 29.588
85 HA VAL 13 HA VAL 13 20.691 32.100 30.822
86 HB VAL 13 HB VAL 13 18.575 30.389 32.038
87 HG11 VAL 13 HG11 VAL 13 18.548 32.943 30.388
88 HG12 VAL 13 HG12 VAL 13 17.205 32.302 31.368
89 HG13 VAL 13 HG13 VAL 13 18.673 32.884 32.166
90 HG21 VAL 13 HG21 VAL 13 18.477 30.908 29.064
91 HG22 VAL 13 HG22 VAL 13 18.623 29.305 29.830
92 HG23 VAL 13 HG23 VAL 13 17.172 30.283 30.075
93 H LYS 14 H LYS 14 20.893 28.946 32.475
94 HA LYS 14 HA LYS 14 21.225 30.303 35.102
95 HB2 LYS 14 HB2 LYS 14 20.921 27.377 34.418
96 HB3 LYS 14 HB3 LYS 14 21.113 28.031 36.039
97 HG2 LYS 14 HG2 LYS 14 18.795 28.614 34.149
98 HG3 LYS 14 HG3 LYS 14 18.800 27.418 35.442
99 HD2 LYS 14 HD2 LYS 14 19.162 29.240 37.121
100 HD3 LYS 14 HD3 LYS 14 19.045 30.437 35.803
101 HE2 LYS 14 HE2 LYS 14 16.831 29.490 35.191
102 HE3 LYS 14 HE3 LYS 14 16.933 28.375 36.562
103 HZ1 LYS 14 HZ1 LYS 14 17.053 30.376 38.014
104 HZ2 LYS 14 HZ2 LYS 14 16.813 31.330 36.710
105 HZ3 LYS 14 HZ3 LYS 14 15.628 30.286 37.170
106 H GLY 15 H GLY 15 23.061 28.606 32.642
107 HA2 GLY 15 HA2 GLY 15 25.586 29.604 33.382
108 HA3 GLY 15 HA3 GLY 15 25.435 28.000 34.110
109 H ASP 16 H ASP 16 27.420 28.265 32.372
110 HA ASP 16 HA ASP 16 26.612 27.374 29.688
111 HB2 ASP 16 HB2 ASP 16 28.883 27.477 29.073
112 HB3 ASP 16 HB3 ASP 16 28.561 28.906 30.048
113 H CYS 17 H CYS 17 26.865 25.406 28.780
114 HA CYS 17 HA CYS 17 27.477 23.122 30.570
115 HB2 CYS 17 HB2 CYS 17 26.101 21.819 29.447
116 HB3 CYS 17 HB3 CYS 17 25.235 23.341 29.502
117 H LYS 18 H LYS 18 29.060 24.969 28.355
118 HA LYS 18 HA LYS 18 30.527 23.141 26.752
119 HB2 LYS 18 HB2 LYS 18 30.651 25.575 26.511
120 HB3 LYS 18 HB3 LYS 18 31.573 25.724 28.008
121 HG2 LYS 18 HG2 LYS 18 32.559 23.916 25.774
122 HG3 LYS 18 HG3 LYS 18 32.734 25.646 25.605
123 HD2 LYS 18 HD2 LYS 18 33.817 24.272 28.078
124 HD3 LYS 18 HD3 LYS 18 34.738 24.229 26.584
125 HE2 LYS 18 HE2 LYS 18 33.735 26.839 27.779
126 HE3 LYS 18 HE3 LYS 18 35.240 26.089 28.309
127 HZ1 LYS 18 HZ1 LYS 18 34.700 26.816 25.482
128 HZ2 LYS 18 HZ2 LYS 18 35.544 27.738 26.548
129 HZ3 LYS 18 HZ3 LYS 18 36.142 26.277 26.093
130 H ARG 19 H ARG 19 31.165 24.074 30.166
131 HA ARG 19 HA ARG 19 33.632 22.656 30.366
132 HB2 ARG 19 HB2 ARG 19 31.612 23.516 32.445
133 HB3 ARG 19 HB3 ARG 19 33.149 22.763 32.858
134 HG2 ARG 19 HG2 ARG 19 34.454 24.502 31.843
135 HG3 ARG 19 HG3 ARG 19 33.027 25.249 31.117
136 HD2 ARG 19 HD2 ARG 19 33.507 24.988 34.099
137 HD3 ARG 19 HD3 ARG 19 33.837 26.448 33.146
138 HE ARG 19 HE ARG 19 31.365 26.367 32.504
139 HH11 ARG 19 HH11 ARG 19 32.280 25.044 35.679
140 HH12 ARG 19 HH12 ARG 19 30.610 25.207 36.214
141 HH21 ARG 19 HH21 ARG 19 29.500 26.777 33.444
142 HH22 ARG 19 HH22 ARG 19 29.120 26.098 35.046
143 H HIS 20 H HIS 20 30.335 21.394 30.953
144 HA HIS 20 HA HIS 20 31.116 18.761 31.770
145 HB2 HIS 20 HB2 HIS 20 28.890 19.213 32.160
146 HB3 HIS 20 HB3 HIS 20 28.649 20.026 30.621
147 HD2 HIS 20 HD2 HIS 20 27.553 18.738 28.722
148 HE1 HIS 20 HE1 HIS 20 27.899 14.757 30.171
149 HE2 HIS 20 HE2 HIS 20 26.966 16.211 28.297
150 H CYS 21 H CYS 21 30.476 19.962 28.428
151 HA CYS 21 HA CYS 21 31.255 17.431 27.167
152 HB2 CYS 21 HB2 CYS 21 30.784 20.252 26.180
153 HB3 CYS 21 HB3 CYS 21 31.118 18.909 25.113
154 H LYS 22 H LYS 22 33.011 20.395 28.026
155 HA LYS 22 HA LYS 22 35.408 19.874 26.648
156 HB2 LYS 22 HB2 LYS 22 34.685 22.039 27.582
157 HB3 LYS 22 HB3 LYS 22 34.833 21.392 29.218
158 HG2 LYS 22 HG2 LYS 22 36.693 22.817 28.769
159 HG3 LYS 22 HG3 LYS 22 37.238 21.159 28.954
160 HD2 LYS 22 HD2 LYS 22 37.158 21.061 26.316
161 HD3 LYS 22 HD3 LYS 22 37.048 22.841 26.416
162 HE2 LYS 22 HE2 LYS 22 39.018 22.856 27.859
163 HE3 LYS 22 HE3 LYS 22 39.096 21.086 27.819
164 HZ1 LYS 22 HZ1 LYS 22 39.440 21.316 25.334
165 HZ2 LYS 22 HZ2 LYS 22 39.612 22.965 25.602
166 HZ3 LYS 22 HZ3 LYS 22 40.658 21.890 26.255
167 H ALA 23 H ALA 23 34.193 18.452 29.603
168 HA ALA 23 HA ALA 23 36.580 17.325 30.646
169 HB1 ALA 23 HB1 ALA 23 35.095 15.716 31.706
170 HB2 ALA 23 HB2 ALA 23 34.323 17.311 31.734
171 HB3 ALA 23 HB3 ALA 23 33.798 16.086 30.556
172 H GLU 24 H GLU 24 34.929 16.630 27.657
173 HA GLU 24 HA GLU 24 36.885 14.460 27.036
174 HB2 GLU 24 HB2 GLU 24 34.053 14.713 25.955
175 HB3 GLU 24 HB3 GLU 24 35.229 13.435 25.620
176 HG2 GLU 24 HG2 GLU 24 35.224 12.969 28.162
177 HG3 GLU 24 HG3 GLU 24 33.805 14.019 28.255
178 H ASP 25 H ASP 25 36.775 17.503 26.651
179 HA ASP 25 HA ASP 25 37.419 19.113 25.259
180 HB2 ASP 25 HB2 ASP 25 39.306 17.505 24.931
181 HB3 ASP 25 HB3 ASP 25 38.553 17.007 23.419
182 H LYS 26 H LYS 26 34.750 17.757 24.785
183 HA LYS 26 HA LYS 26 34.044 18.448 22.010
184 HB2 LYS 26 HB2 LYS 26 32.470 17.453 24.422
185 HB3 LYS 26 HB3 LYS 26 31.766 17.723 22.844
186 HG2 LYS 26 HG2 LYS 26 34.078 15.766 23.214
187 HG3 LYS 26 HG3 LYS 26 32.420 15.335 23.647
188 HD2 LYS 26 HD2 LYS 26 31.665 15.980 21.365
189 HD3 LYS 26 HD3 LYS 26 33.358 16.278 20.914
190 HE2 LYS 26 HE2 LYS 26 32.870 14.072 20.139
191 HE3 LYS 26 HE3 LYS 26 33.828 13.843 21.612
192 HZ1 LYS 26 HZ1 LYS 26 31.860 12.399 21.608
193 HZ2 LYS 26 HZ2 LYS 26 31.695 13.486 22.814
194 HZ3 LYS 26 HZ3 LYS 26 30.854 13.695 21.432
195 H GLU 27 H GLU 27 32.605 20.076 21.433
196 HA GLU 27 HA GLU 27 32.285 22.428 23.124
197 HB2 GLU 27 HB2 GLU 27 32.508 22.371 20.578
198 HB3 GLU 27 HB3 GLU 27 30.924 21.620 20.538
199 HG2 GLU 27 HG2 GLU 27 30.450 23.809 20.123
200 HG3 GLU 27 HG3 GLU 27 30.068 23.671 21.830
201 H GLY 28 H GLY 28 30.530 22.918 24.343
202 HA2 GLY 28 HA2 GLY 28 28.236 20.966 24.472
203 HA3 GLY 28 HA3 GLY 28 28.780 21.922 25.844
204 H ILE 29 H ILE 29 26.257 21.689 23.841
205 HA ILE 29 HA ILE 29 25.699 24.598 23.878
206 HB ILE 29 HB ILE 29 26.549 24.064 21.691
207 HG12 ILE 29 HG12 ILE 29 24.558 25.672 22.128
208 HG13 ILE 29 HG13 ILE 29 25.132 25.333 20.510
209 HG21 ILE 29 HG21 ILE 29 26.111 21.728 21.434
210 HG22 ILE 29 HG22 ILE 29 24.355 21.989 21.476
211 HG23 ILE 29 HG23 ILE 29 25.319 22.590 20.114
212 HD11 ILE 29 HD11 ILE 29 23.274 23.903 20.012
213 HD12 ILE 29 HD12 ILE 29 22.723 23.920 21.696
214 HD13 ILE 29 HD13 ILE 29 22.640 25.398 20.719
215 H CYS 30 H CYS 30 23.606 25.190 24.234
216 HA CYS 30 HA CYS 30 22.067 23.232 25.688
217 HB2 CYS 30 HB2 CYS 30 21.522 26.144 25.027
218 HB3 CYS 30 HB3 CYS 30 20.615 25.158 26.179
219 H HIS 31 H HIS 31 20.755 21.818 24.815
220 HA HIS 31 HA HIS 31 18.775 22.677 22.724
221 HB2 HIS 31 HB2 HIS 31 20.065 19.985 23.237
222 HB3 HIS 31 HB3 HIS 31 18.494 20.134 22.453
223 HD2 HIS 31 HD2 HIS 31 22.116 21.477 21.894
224 HE1 HIS 31 HE1 HIS 31 20.200 21.246 18.099
225 HE2 HIS 31 HE2 HIS 31 22.416 21.664 19.262
226 H GLY 32 H GLY 32 17.116 23.397 23.836
227 HA2 GLY 32 HA2 GLY 32 15.329 23.503 25.293
228 HA3 GLY 32 HA3 GLY 32 15.496 21.764 25.553
229 H THR 33 H THR 33 15.762 21.313 27.577
230 HA THR 33 HA THR 33 17.129 23.131 29.507
231 HB THR 33 HB THR 33 15.912 22.049 31.262
232 HG1 THR 33 HG1 THR 33 14.974 20.299 29.208
233 HG21 THR 33 HG21 THR 33 13.662 22.725 30.760
234 HG22 THR 33 HG22 THR 33 14.760 23.852 29.947
235 HG23 THR 33 HG23 THR 33 13.940 22.591 29.007
236 H LYS 34 H LYS 34 18.409 21.165 27.604
237 HA LYS 34 HA LYS 34 20.246 19.931 29.566
238 HB2 LYS 34 HB2 LYS 34 18.990 18.533 27.147
239 HB3 LYS 34 HB3 LYS 34 20.304 17.856 28.100
240 HG2 LYS 34 HG2 LYS 34 17.521 18.475 29.163
241 HG3 LYS 34 HG3 LYS 34 18.098 16.887 28.671
242 HD2 LYS 34 HD2 LYS 34 19.736 16.791 30.421
243 HD3 LYS 34 HD3 LYS 34 19.507 18.475 30.876
244 HE2 LYS 34 HE2 LYS 34 17.387 16.326 31.121
245 HE3 LYS 34 HE3 LYS 34 18.450 16.899 32.425
246 HZ1 LYS 34 HZ1 LYS 34 16.229 18.278 31.128
247 HZ2 LYS 34 HZ2 LYS 34 16.606 18.168 32.722
248 HZ3 LYS 34 HZ3 LYS 34 17.459 19.199 31.745
249 H CYS 35 H CYS 35 22.244 19.190 28.621
250 HA CYS 35 HA CYS 35 23.264 21.028 26.539
251 HB2 CYS 35 HB2 CYS 35 24.467 20.473 28.760
252 HB3 CYS 35 HB3 CYS 35 24.816 18.904 28.034
253 H LYS 36 H LYS 36 24.299 20.204 24.647
254 HA LYS 36 HA LYS 36 24.112 17.324 23.974
255 HB2 LYS 36 HB2 LYS 36 22.315 18.467 22.843
256 HB3 LYS 36 HB3 LYS 36 23.356 19.820 22.423
257 HG2 LYS 36 HG2 LYS 36 23.974 17.057 21.364
258 HG3 LYS 36 HG3 LYS 36 22.700 18.061 20.640
259 HD2 LYS 36 HD2 LYS 36 24.302 19.920 20.322
260 HD3 LYS 36 HD3 LYS 36 25.629 18.910 20.902
261 HE2 LYS 36 HE2 LYS 36 23.866 18.300 18.543
262 HE3 LYS 36 HE3 LYS 36 25.449 19.108 18.476
263 HZ1 LYS 36 HZ1 LYS 36 25.854 16.796 18.043
264 HZ2 LYS 36 HZ2 LYS 36 26.369 17.033 19.556
265 HZ3 LYS 36 HZ3 LYS 36 24.948 16.295 19.324
266 H CYS 37 H CYS 37 26.160 16.624 23.686
267 HA CYS 37 HA CYS 37 28.325 18.600 23.385
268 HB2 CYS 37 HB2 CYS 37 28.522 15.596 23.517
269 HB3 CYS 37 HB3 CYS 37 29.863 16.721 23.475
270 H GLY 38 H GLY 38 29.339 19.171 21.581
271 HA2 GLY 38 HA2 GLY 38 28.183 18.291 19.010
272 HA3 GLY 38 HA3 GLY 38 29.102 19.760 19.393
273 H VAL 39 H VAL 39 30.730 19.774 18.021
274 HA VAL 39 HA VAL 39 32.507 17.443 17.646
275 HB VAL 39 HB VAL 39 33.625 18.941 15.980
276 HG11 VAL 39 HG11 VAL 39 31.785 17.381 15.363
277 HG12 VAL 39 HG12 VAL 39 30.636 18.726 15.490
278 HG13 VAL 39 HG13 VAL 39 31.942 18.785 14.288
279 HG21 VAL 39 HG21 VAL 39 32.771 21.036 15.329
280 HG22 VAL 39 HG22 VAL 39 31.335 20.871 16.347
281 HG23 VAL 39 HG23 VAL 39 32.925 21.095 17.101
282 HA PRO 40 HA PRO 40 35.741 18.770 20.412
283 HB2 PRO 40 HB2 PRO 40 37.382 19.257 17.916
284 HB3 PRO 40 HB3 PRO 40 37.882 18.495 19.461
285 HG2 PRO 40 HG2 PRO 40 37.230 16.951 17.332
286 HG3 PRO 40 HG3 PRO 40 36.665 16.511 18.977
287 HD2 PRO 40 HD2 PRO 40 35.095 17.801 16.749
288 HD3 PRO 40 HD3 PRO 40 34.577 16.607 17.957
289 H ILE 41 H ILE 41 36.476 20.700 21.356
290 HA ILE 41 HA ILE 41 34.996 22.955 20.672
291 HB ILE 41 HB ILE 41 36.410 24.243 22.307
292 HG12 ILE 41 HG12 ILE 41 37.588 22.759 24.000
293 HG13 ILE 41 HG13 ILE 41 37.728 21.531 22.752
294 HG21 ILE 41 HG21 ILE 41 35.164 21.663 23.265
295 HG22 ILE 41 HG22 ILE 41 35.348 23.163 24.189
296 HG23 ILE 41 HG23 ILE 41 34.276 23.143 22.794
297 HD11 ILE 41 HD11 ILE 41 39.692 23.123 23.214
298 HD12 ILE 41 HD12 ILE 41 39.267 22.866 21.533
299 HD13 ILE 41 HD13 ILE 41 38.751 24.358 22.361
300 H SER 42 H SER 42 38.395 22.435 19.743
301 HA SER 42 HA SER 42 39.842 23.584 18.601
302 HB2 SER 42 HB2 SER 42 39.250 24.019 16.431
303 HB3 SER 42 HB3 SER 42 38.178 22.727 16.975
304 HG SER 42 HG SER 42 36.642 24.459 17.470
305 H TYR 43 H TYR 43 38.752 25.181 20.677
306 HA TYR 43 HA TYR 43 40.345 27.545 20.049
307 HB2 TYR 43 HB2 TYR 43 38.901 29.248 20.838
308 HB3 TYR 43 HB3 TYR 43 38.197 28.391 19.474
309 HD1 TYR 43 HD1 TYR 43 36.435 26.703 19.856
310 HD2 TYR 43 HD2 TYR 43 37.627 29.465 22.903
311 HE1 TYR 43 HE1 TYR 43 34.554 25.918 21.271
312 HE2 TYR 43 HE2 TYR 43 35.681 28.792 24.281
313 HH TYR 43 HH TYR 43 33.378 26.219 23.212
314 H LEU 44 H LEU 44 38.271 26.885 22.907
315 HA LEU 44 HA LEU 44 40.705 26.734 24.622
316 HB2 LEU 44 HB2 LEU 44 39.756 29.023 24.552
317 HB3 LEU 44 HB3 LEU 44 38.189 28.383 25.056
318 HG LEU 44 HG LEU 44 39.131 27.714 27.237
319 HD11 LEU 44 HD11 LEU 44 41.668 29.034 26.193
320 HD12 LEU 44 HD12 LEU 44 41.377 28.589 27.889
321 HD13 LEU 44 HD13 LEU 44 41.483 27.329 26.656
322 HD21 LEU 44 HD21 LEU 44 39.689 30.607 26.463
323 HD22 LEU 44 HD22 LEU 44 39.410 29.993 28.109
324 HD23 LEU 44 HD23 LEU 44 38.104 29.937 26.914
Start of MODEL 18
1 H1 ALA 1 H1 ALA 1 27.836 23.913 37.413
2 H2 ALA 1 H2 ALA 1 28.020 22.274 37.559
3 H3 ALA 1 H3 ALA 1 27.386 23.142 38.793
4 HA ALA 1 HA ALA 1 25.480 23.740 37.465
5 HB1 ALA 1 HB1 ALA 1 26.780 21.886 35.420
6 HB2 ALA 1 HB2 ALA 1 25.134 22.549 35.325
7 HB3 ALA 1 HB3 ALA 1 26.525 23.636 35.254
8 H LYS 2 H LYS 2 23.572 22.480 37.485
9 HA LYS 2 HA LYS 2 23.744 19.775 38.760
10 HB2 LYS 2 HB2 LYS 2 23.761 21.668 40.345
11 HB3 LYS 2 HB3 LYS 2 22.231 22.256 39.698
12 HG2 LYS 2 HG2 LYS 2 21.126 20.163 40.478
13 HG3 LYS 2 HG3 LYS 2 22.682 19.596 41.106
14 HD2 LYS 2 HD2 LYS 2 21.175 22.095 42.020
15 HD3 LYS 2 HD3 LYS 2 21.294 20.558 42.896
16 HE2 LYS 2 HE2 LYS 2 23.742 20.825 43.069
17 HE3 LYS 2 HE3 LYS 2 23.651 22.368 42.199
18 HZ1 LYS 2 HZ1 LYS 2 22.570 23.374 44.031
19 HZ2 LYS 2 HZ2 LYS 2 22.140 21.945 44.718
20 HZ3 LYS 2 HZ3 LYS 2 23.687 22.426 44.762
21 H ASN 3 H ASN 3 22.709 18.521 37.350
22 HA ASN 3 HA ASN 3 21.108 17.421 36.276
23 HB2 ASN 3 HB2 ASN 3 19.224 19.178 37.884
24 HB3 ASN 3 HB3 ASN 3 18.718 17.814 36.904
25 HD21 ASN 3 HD21 ASN 3 18.938 16.240 40.112
26 HD22 ASN 3 HD22 ASN 3 17.855 17.305 39.201
27 H GLN 4 H GLN 4 21.123 20.830 35.609
28 HA GLN 4 HA GLN 4 19.867 20.263 32.951
29 HB2 GLN 4 HB2 GLN 4 18.838 22.378 32.966
30 HB3 GLN 4 HB3 GLN 4 18.496 21.649 34.531
31 HG2 GLN 4 HG2 GLN 4 20.381 23.030 35.508
32 HG3 GLN 4 HG3 GLN 4 20.548 23.820 33.933
33 HE21 GLN 4 HE21 GLN 4 18.402 24.832 33.034
34 HE22 GLN 4 HE22 GLN 4 17.451 25.667 34.267
35 H PHE 5 H PHE 5 22.873 20.642 34.169
36 HA PHE 5 HA PHE 5 24.858 21.425 33.467
37 HB2 PHE 5 HB2 PHE 5 23.641 21.666 30.726
38 HB3 PHE 5 HB3 PHE 5 25.326 21.436 31.121
39 HD1 PHE 5 HD1 PHE 5 26.016 19.230 32.261
40 HD2 PHE 5 HD2 PHE 5 22.147 19.865 30.532
41 HE1 PHE 5 HE1 PHE 5 25.630 16.760 32.220
42 HE2 PHE 5 HE2 PHE 5 21.800 17.389 30.387
43 HZ PHE 5 HZ PHE 5 23.514 15.851 31.251
44 H GLY 6 H GLY 6 22.522 23.539 33.866
45 HA2 GLY 6 HA2 GLY 6 22.621 25.881 34.101
46 HA3 GLY 6 HA3 GLY 6 24.009 25.932 33.011
47 H CYS 7 H CYS 7 21.882 23.977 31.406
48 HA CYS 7 HA CYS 7 21.148 26.050 29.514
49 HB2 CYS 7 HB2 CYS 7 20.502 23.083 29.656
50 HB3 CYS 7 HB3 CYS 7 20.051 24.127 28.334
51 H PHE 8 H PHE 8 19.297 27.074 29.247
52 HA PHE 8 HA PHE 8 16.766 25.664 29.697
53 HB2 PHE 8 HB2 PHE 8 17.173 26.818 31.883
54 HB3 PHE 8 HB3 PHE 8 17.231 28.350 31.035
55 HD1 PHE 8 HD1 PHE 8 15.224 29.426 30.192
56 HD2 PHE 8 HD2 PHE 8 15.062 25.582 32.142
57 HE1 PHE 8 HE1 PHE 8 12.733 29.582 30.319
58 HE2 PHE 8 HE2 PHE 8 12.586 25.741 32.264
59 HZ PHE 8 HZ PHE 8 11.425 27.723 31.327
60 H ALA 9 H ALA 9 15.157 26.270 28.215
61 HA ALA 9 HA ALA 9 14.336 27.070 26.290
62 HB1 ALA 9 HB1 ALA 9 15.154 29.733 27.481
63 HB2 ALA 9 HB2 ALA 9 13.913 29.466 26.239
64 HB3 ALA 9 HB3 ALA 9 13.678 28.809 27.860
65 H ASN 10 H ASN 10 16.751 25.992 25.758
66 HA ASN 10 HA ASN 10 18.460 25.817 24.349
67 HB2 ASN 10 HB2 ASN 10 17.034 27.900 22.654
68 HB3 ASN 10 HB3 ASN 10 18.235 26.764 22.088
69 HD21 ASN 10 HD21 ASN 10 15.044 25.594 21.128
70 HD22 ASN 10 HD22 ASN 10 16.005 27.019 20.807
71 H VAL 11 H VAL 11 18.708 27.989 26.499
72 HA VAL 11 HA VAL 11 21.182 29.264 25.413
73 HB VAL 11 HB VAL 11 19.090 30.611 27.169
74 HG11 VAL 11 HG11 VAL 11 20.412 32.680 26.729
75 HG12 VAL 11 HG12 VAL 11 21.360 31.513 27.639
76 HG13 VAL 11 HG13 VAL 11 21.646 31.719 25.896
77 HG21 VAL 11 HG21 VAL 11 18.297 30.443 24.851
78 HG22 VAL 11 HG22 VAL 11 18.764 32.101 25.194
79 HG23 VAL 11 HG23 VAL 11 19.841 31.060 24.239
80 H ASP 12 H ASP 12 22.844 29.598 26.777
81 HA ASP 12 HA ASP 12 23.141 27.988 29.203
82 HB2 ASP 12 HB2 ASP 12 24.981 29.981 27.820
83 HB3 ASP 12 HB3 ASP 12 25.450 28.917 29.129
84 H VAL 13 H VAL 13 21.098 29.557 29.893
85 HA VAL 13 HA VAL 13 21.878 32.165 30.983
86 HB VAL 13 HB VAL 13 19.477 31.976 32.047
87 HG11 VAL 13 HG11 VAL 13 18.499 32.892 30.070
88 HG12 VAL 13 HG12 VAL 13 20.161 33.482 30.210
89 HG13 VAL 13 HG13 VAL 13 19.771 32.186 29.057
90 HG21 VAL 13 HG21 VAL 13 19.186 29.534 31.523
91 HG22 VAL 13 HG22 VAL 13 17.911 30.601 30.917
92 HG23 VAL 13 HG23 VAL 13 19.128 29.968 29.796
93 H LYS 14 H LYS 14 21.281 28.989 32.390
94 HA LYS 14 HA LYS 14 21.833 30.065 35.136
95 HB2 LYS 14 HB2 LYS 14 20.854 27.285 34.424
96 HB3 LYS 14 HB3 LYS 14 20.989 28.017 36.014
97 HG2 LYS 14 HG2 LYS 14 18.995 28.718 33.850
98 HG3 LYS 14 HG3 LYS 14 18.680 27.887 35.364
99 HD2 LYS 14 HD2 LYS 14 19.540 30.769 35.036
100 HD3 LYS 14 HD3 LYS 14 17.915 30.234 35.420
101 HE2 LYS 14 HE2 LYS 14 20.307 29.687 37.236
102 HE3 LYS 14 HE3 LYS 14 19.348 31.167 37.329
103 HZ1 LYS 14 HZ1 LYS 14 18.254 28.433 37.734
104 HZ2 LYS 14 HZ2 LYS 14 18.599 29.511 38.905
105 HZ3 LYS 14 HZ3 LYS 14 17.396 29.847 37.836
106 H GLY 15 H GLY 15 23.529 28.685 32.600
107 HA2 GLY 15 HA2 GLY 15 26.032 29.039 33.692
108 HA3 GLY 15 HA3 GLY 15 25.639 27.381 34.149
109 H ASP 16 H ASP 16 27.817 27.709 32.591
110 HA ASP 16 HA ASP 16 27.112 27.501 29.756
111 HB2 ASP 16 HB2 ASP 16 29.578 27.396 29.405
112 HB3 ASP 16 HB3 ASP 16 28.935 28.867 30.105
113 H CYS 17 H CYS 17 26.328 25.711 28.998
114 HA CYS 17 HA CYS 17 26.850 23.018 29.899
115 HB2 CYS 17 HB2 CYS 17 24.944 23.012 28.827
116 HB3 CYS 17 HB3 CYS 17 25.288 24.451 27.910
117 H LYS 18 H LYS 18 28.571 25.080 27.543
118 HA LYS 18 HA LYS 18 30.367 23.375 26.328
119 HB2 LYS 18 HB2 LYS 18 30.525 25.737 25.961
120 HB3 LYS 18 HB3 LYS 18 30.721 26.076 27.673
121 HG2 LYS 18 HG2 LYS 18 32.804 26.490 26.564
122 HG3 LYS 18 HG3 LYS 18 32.986 25.151 27.669
123 HD2 LYS 18 HD2 LYS 18 34.231 24.583 25.731
124 HD3 LYS 18 HD3 LYS 18 32.793 23.568 25.715
125 HE2 LYS 18 HE2 LYS 18 33.158 24.319 23.473
126 HE3 LYS 18 HE3 LYS 18 31.718 25.146 24.078
127 HZ1 LYS 18 HZ1 LYS 18 34.437 26.362 23.944
128 HZ2 LYS 18 HZ2 LYS 18 33.244 26.623 22.869
129 HZ3 LYS 18 HZ3 LYS 18 33.040 27.132 24.404
130 H ARG 19 H ARG 19 30.548 24.374 29.824
131 HA ARG 19 HA ARG 19 32.955 23.029 30.429
132 HB2 ARG 19 HB2 ARG 19 31.537 24.862 31.568
133 HB3 ARG 19 HB3 ARG 19 30.653 23.550 32.329
134 HG2 ARG 19 HG2 ARG 19 32.801 22.731 33.316
135 HG3 ARG 19 HG3 ARG 19 33.664 24.050 32.502
136 HD2 ARG 19 HD2 ARG 19 31.484 24.348 34.614
137 HD3 ARG 19 HD3 ARG 19 33.225 24.572 34.817
138 HE ARG 19 HE ARG 19 31.794 26.301 32.855
139 HH11 ARG 19 HH11 ARG 19 31.745 28.365 33.126
140 HH12 ARG 19 HH12 ARG 19 32.576 29.155 34.463
141 HH21 ARG 19 HH21 ARG 19 33.477 26.226 35.997
142 HH22 ARG 19 HH22 ARG 19 33.807 27.940 35.853
143 H HIS 20 H HIS 20 29.706 21.649 30.164
144 HA HIS 20 HA HIS 20 30.489 19.126 31.508
145 HB2 HIS 20 HB2 HIS 20 28.211 19.722 31.712
146 HB3 HIS 20 HB3 HIS 20 28.040 20.033 29.984
147 HD2 HIS 20 HD2 HIS 20 27.134 18.158 28.538
148 HE1 HIS 20 HE1 HIS 20 27.638 14.852 31.172
149 HE2 HIS 20 HE2 HIS 20 26.679 15.592 28.938
150 H CYS 21 H CYS 21 30.080 20.280 28.140
151 HA CYS 21 HA CYS 21 30.952 17.752 26.996
152 HB2 CYS 21 HB2 CYS 21 30.591 20.556 25.908
153 HB3 CYS 21 HB3 CYS 21 31.065 19.226 24.885
154 H LYS 22 H LYS 22 32.686 20.687 28.027
155 HA LYS 22 HA LYS 22 35.192 20.109 26.930
156 HB2 LYS 22 HB2 LYS 22 34.350 22.288 27.798
157 HB3 LYS 22 HB3 LYS 22 34.391 21.642 29.450
158 HG2 LYS 22 HG2 LYS 22 36.281 23.116 28.939
159 HG3 LYS 22 HG3 LYS 22 36.819 21.475 29.340
160 HD2 LYS 22 HD2 LYS 22 37.198 20.940 26.996
161 HD3 LYS 22 HD3 LYS 22 36.460 22.487 26.476
162 HE2 LYS 22 HE2 LYS 22 38.171 23.731 27.586
163 HE3 LYS 22 HE3 LYS 22 38.831 22.259 28.347
164 HZ1 LYS 22 HZ1 LYS 22 38.827 22.899 25.461
165 HZ2 LYS 22 HZ2 LYS 22 40.138 22.824 26.410
166 HZ3 LYS 22 HZ3 LYS 22 39.317 21.431 26.063
167 H ALA 23 H ALA 23 33.729 18.874 29.907
168 HA ALA 23 HA ALA 23 36.069 17.656 31.034
169 HB1 ALA 23 HB1 ALA 23 34.411 16.322 32.266
170 HB2 ALA 23 HB2 ALA 23 33.937 18.033 32.217
171 HB3 ALA 23 HB3 ALA 23 33.132 16.854 31.159
172 H GLU 24 H GLU 24 34.238 16.876 28.197
173 HA GLU 24 HA GLU 24 35.749 14.349 27.757
174 HB2 GLU 24 HB2 GLU 24 33.307 15.367 26.276
175 HB3 GLU 24 HB3 GLU 24 33.997 13.759 26.203
176 HG2 GLU 24 HG2 GLU 24 32.587 14.983 28.632
177 HG3 GLU 24 HG3 GLU 24 31.873 13.896 27.472
178 H ASP 25 H ASP 25 36.229 17.486 27.245
179 HA ASP 25 HA ASP 25 37.085 18.921 25.840
180 HB2 ASP 25 HB2 ASP 25 38.878 17.085 26.084
181 HB3 ASP 25 HB3 ASP 25 38.601 16.782 24.379
182 H LYS 26 H LYS 26 34.509 18.242 25.087
183 HA LYS 26 HA LYS 26 34.483 18.650 22.126
184 HB2 LYS 26 HB2 LYS 26 32.427 17.373 23.979
185 HB3 LYS 26 HB3 LYS 26 32.150 17.759 22.290
186 HG2 LYS 26 HG2 LYS 26 34.526 16.305 22.177
187 HG3 LYS 26 HG3 LYS 26 33.630 15.500 23.488
188 HD2 LYS 26 HD2 LYS 26 31.738 15.099 21.986
189 HD3 LYS 26 HD3 LYS 26 32.458 16.158 20.769
190 HE2 LYS 26 HE2 LYS 26 32.824 13.926 20.025
191 HE3 LYS 26 HE3 LYS 26 34.372 14.644 20.491
192 HZ1 LYS 26 HZ1 LYS 26 32.842 12.634 22.065
193 HZ2 LYS 26 HZ2 LYS 26 34.220 12.411 21.239
194 HZ3 LYS 26 HZ3 LYS 26 34.249 13.338 22.573
195 H GLU 27 H GLU 27 32.803 19.809 21.184
196 HA GLU 27 HA GLU 27 32.140 22.404 22.344
197 HB2 GLU 27 HB2 GLU 27 31.160 20.874 19.919
198 HB3 GLU 27 HB3 GLU 27 30.583 22.474 20.322
199 HG2 GLU 27 HG2 GLU 27 33.529 21.853 19.855
200 HG3 GLU 27 HG3 GLU 27 32.409 22.290 18.562
201 H GLY 28 H GLY 28 30.145 22.992 23.196
202 HA2 GLY 28 HA2 GLY 28 28.056 20.893 23.655
203 HA3 GLY 28 HA3 GLY 28 28.606 21.920 24.968
204 H ILE 29 H ILE 29 25.960 21.429 23.397
205 HA ILE 29 HA ILE 29 25.182 24.271 23.320
206 HB ILE 29 HB ILE 29 25.772 23.781 21.082
207 HG12 ILE 29 HG12 ILE 29 23.705 25.169 21.699
208 HG13 ILE 29 HG13 ILE 29 24.069 24.801 20.023
209 HG21 ILE 29 HG21 ILE 29 23.859 21.446 21.117
210 HG22 ILE 29 HG22 ILE 29 24.586 22.155 19.652
211 HG23 ILE 29 HG23 ILE 29 25.618 21.425 20.893
212 HD11 ILE 29 HD11 ILE 29 21.645 24.629 20.599
213 HD12 ILE 29 HD12 ILE 29 22.326 23.165 19.877
214 HD13 ILE 29 HD13 ILE 29 22.019 23.231 21.622
215 H CYS 30 H CYS 30 23.248 24.765 24.079
216 HA CYS 30 HA CYS 30 21.872 22.765 25.631
217 HB2 CYS 30 HB2 CYS 30 21.266 25.685 25.079
218 HB3 CYS 30 HB3 CYS 30 20.398 24.671 26.242
219 H HIS 31 H HIS 31 20.674 21.250 24.621
220 HA HIS 31 HA HIS 31 18.561 22.088 22.691
221 HB2 HIS 31 HB2 HIS 31 19.741 19.409 23.444
222 HB3 HIS 31 HB3 HIS 31 18.140 19.539 22.715
223 HD2 HIS 31 HD2 HIS 31 21.768 20.690 21.865
224 HE1 HIS 31 HE1 HIS 31 19.623 20.289 18.209
225 HE2 HIS 31 HE2 HIS 31 21.885 20.811 19.228
226 H GLY 32 H GLY 32 17.243 23.259 23.915
227 HA2 GLY 32 HA2 GLY 32 15.502 23.705 25.349
228 HA3 GLY 32 HA3 GLY 32 15.388 21.988 25.724
229 H THR 33 H THR 33 15.771 21.515 27.736
230 HA THR 33 HA THR 33 17.404 23.254 29.512
231 HB THR 33 HB THR 33 16.300 22.199 31.389
232 HG1 THR 33 HG1 THR 33 14.736 20.704 31.112
233 HG21 THR 33 HG21 THR 33 14.204 23.005 29.337
234 HG22 THR 33 HG22 THR 33 14.076 23.104 31.105
235 HG23 THR 33 HG23 THR 33 15.202 24.155 30.233
236 H LYS 34 H LYS 34 18.282 20.911 27.612
237 HA LYS 34 HA LYS 34 20.223 19.772 29.571
238 HB2 LYS 34 HB2 LYS 34 18.806 18.292 27.334
239 HB3 LYS 34 HB3 LYS 34 20.114 17.617 28.289
240 HG2 LYS 34 HG2 LYS 34 17.442 18.520 29.473
241 HG3 LYS 34 HG3 LYS 34 17.820 16.874 28.957
242 HD2 LYS 34 HD2 LYS 34 19.737 16.851 30.580
243 HD3 LYS 34 HD3 LYS 34 19.143 18.400 31.232
244 HE2 LYS 34 HE2 LYS 34 16.968 17.307 31.727
245 HE3 LYS 34 HE3 LYS 34 17.575 15.792 31.028
246 HZ1 LYS 34 HZ1 LYS 34 19.227 15.701 32.800
247 HZ2 LYS 34 HZ2 LYS 34 18.675 17.095 33.456
248 HZ3 LYS 34 HZ3 LYS 34 17.705 15.764 33.423
249 H CYS 35 H CYS 35 22.204 18.937 28.546
250 HA CYS 35 HA CYS 35 23.153 20.779 26.399
251 HB2 CYS 35 HB2 CYS 35 24.237 20.740 28.673
252 HB3 CYS 35 HB3 CYS 35 24.708 19.070 28.348
253 H LYS 36 H LYS 36 24.232 19.947 24.560
254 HA LYS 36 HA LYS 36 24.360 17.001 24.147
255 HB2 LYS 36 HB2 LYS 36 22.143 17.954 23.406
256 HB3 LYS 36 HB3 LYS 36 23.018 19.020 22.302
257 HG2 LYS 36 HG2 LYS 36 23.733 17.268 20.948
258 HG3 LYS 36 HG3 LYS 36 23.400 16.030 22.174
259 HD2 LYS 36 HD2 LYS 36 21.222 17.633 20.757
260 HD3 LYS 36 HD3 LYS 36 21.819 16.060 20.219
261 HE2 LYS 36 HE2 LYS 36 21.222 15.093 22.452
262 HE3 LYS 36 HE3 LYS 36 20.461 16.626 22.892
263 HZ1 LYS 36 HZ1 LYS 36 18.914 14.943 21.987
264 HZ2 LYS 36 HZ2 LYS 36 18.875 16.318 21.088
265 HZ3 LYS 36 HZ3 LYS 36 19.689 14.989 20.538
266 H CYS 37 H CYS 37 26.296 16.497 23.366
267 HA CYS 37 HA CYS 37 28.094 18.698 22.716
268 HB2 CYS 37 HB2 CYS 37 28.953 15.843 23.053
269 HB3 CYS 37 HB3 CYS 37 29.920 17.293 23.073
270 H GLY 38 H GLY 38 29.404 18.971 21.031
271 HA2 GLY 38 HA2 GLY 38 28.444 17.920 18.394
272 HA3 GLY 38 HA3 GLY 38 29.181 19.489 18.712
273 H VAL 39 H VAL 39 30.972 19.496 17.477
274 HA VAL 39 HA VAL 39 32.800 17.249 17.283
275 HB VAL 39 HB VAL 39 34.287 18.926 16.123
276 HG11 VAL 39 HG11 VAL 39 31.474 18.612 15.034
277 HG12 VAL 39 HG12 VAL 39 32.941 18.970 14.097
278 HG13 VAL 39 HG13 VAL 39 32.788 17.419 14.937
279 HG21 VAL 39 HG21 VAL 39 31.942 20.825 16.406
280 HG22 VAL 39 HG22 VAL 39 33.565 20.992 17.129
281 HG23 VAL 39 HG23 VAL 39 33.369 21.044 15.377
282 HA PRO 40 HA PRO 40 35.605 17.976 20.618
283 HB2 PRO 40 HB2 PRO 40 38.048 17.454 19.531
284 HB3 PRO 40 HB3 PRO 40 36.839 16.192 19.928
285 HG2 PRO 40 HG2 PRO 40 37.336 17.508 17.241
286 HG3 PRO 40 HG3 PRO 40 37.210 15.764 17.601
287 HD2 PRO 40 HD2 PRO 40 35.102 17.134 16.657
288 HD3 PRO 40 HD3 PRO 40 34.812 15.949 17.940
289 H ILE 41 H ILE 41 36.988 19.613 21.460
290 HA ILE 41 HA ILE 41 36.706 22.117 20.005
291 HB ILE 41 HB ILE 41 37.480 23.214 21.952
292 HG12 ILE 41 HG12 ILE 41 37.856 21.561 24.052
293 HG13 ILE 41 HG13 ILE 41 38.548 20.546 22.792
294 HG21 ILE 41 HG21 ILE 41 35.706 20.939 22.860
295 HG22 ILE 41 HG22 ILE 41 35.767 22.582 23.510
296 HG23 ILE 41 HG23 ILE 41 35.143 22.314 21.870
297 HD11 ILE 41 HD11 ILE 41 40.264 21.996 23.856
298 HD12 ILE 41 HD12 ILE 41 40.062 22.444 22.161
299 HD13 ILE 41 HD13 ILE 41 39.333 23.437 23.398
300 H SER 42 H SER 42 39.323 19.886 20.420
301 HA SER 42 HA SER 42 41.489 19.842 19.908
302 HB2 SER 42 HB2 SER 42 40.287 20.847 17.348
303 HB3 SER 42 HB3 SER 42 41.641 19.708 17.559
304 HG SER 42 HG SER 42 39.327 19.013 17.084
305 H TYR 43 H TYR 43 41.385 22.303 21.184
306 HA TYR 43 HA TYR 43 43.805 23.435 20.104
307 HB2 TYR 43 HB2 TYR 43 43.359 25.461 19.402
308 HB3 TYR 43 HB3 TYR 43 41.891 24.675 18.884
309 HD1 TYR 43 HD1 TYR 43 39.757 25.036 20.230
310 HD2 TYR 43 HD2 TYR 43 43.393 27.213 21.006
311 HE1 TYR 43 HE1 TYR 43 38.473 26.726 21.494
312 HE2 TYR 43 HE2 TYR 43 42.115 28.908 22.265
313 HH TYR 43 HH TYR 43 38.535 28.772 22.553
314 H LEU 44 H LEU 44 41.421 24.628 22.596
315 HA LEU 44 HA LEU 44 43.428 24.058 24.679
316 HB2 LEU 44 HB2 LEU 44 43.726 26.435 23.530
317 HB3 LEU 44 HB3 LEU 44 42.351 26.879 24.512
318 HG LEU 44 HG LEU 44 44.415 27.550 25.547
319 HD11 LEU 44 HD11 LEU 44 42.619 26.687 27.087
320 HD12 LEU 44 HD12 LEU 44 43.503 25.147 27.163
321 HD13 LEU 44 HD13 LEU 44 44.261 26.636 27.746
322 HD21 LEU 44 HD21 LEU 44 45.884 25.860 24.472
323 HD22 LEU 44 HD22 LEU 44 46.179 26.038 26.213
324 HD23 LEU 44 HD23 LEU 44 45.288 24.635 25.606
Start of MODEL 19
1 H1 ALA 1 H1 ALA 1 28.291 24.910 34.871
2 H2 ALA 1 H2 ALA 1 28.811 24.391 33.413
3 H3 ALA 1 H3 ALA 1 29.302 23.609 34.799
4 HA ALA 1 HA ALA 1 26.570 23.751 33.739
5 HB1 ALA 1 HB1 ALA 1 26.803 21.286 33.378
6 HB2 ALA 1 HB2 ALA 1 27.937 22.219 32.395
7 HB3 ALA 1 HB3 ALA 1 28.505 21.395 33.855
8 H LYS 2 H LYS 2 24.858 22.808 35.089
9 HA LYS 2 HA LYS 2 25.633 21.833 37.763
10 HB2 LYS 2 HB2 LYS 2 24.089 23.456 38.824
11 HB3 LYS 2 HB3 LYS 2 25.508 24.158 38.109
12 HG2 LYS 2 HG2 LYS 2 24.206 24.989 36.171
13 HG3 LYS 2 HG3 LYS 2 22.768 24.178 36.776
14 HD2 LYS 2 HD2 LYS 2 22.647 26.533 37.353
15 HD3 LYS 2 HD3 LYS 2 22.849 25.591 38.825
16 HE2 LYS 2 HE2 LYS 2 25.370 26.112 38.665
17 HE3 LYS 2 HE3 LYS 2 24.955 27.237 37.360
18 HZ1 LYS 2 HZ1 LYS 2 24.020 27.353 40.172
19 HZ2 LYS 2 HZ2 LYS 2 25.079 28.382 39.448
20 HZ3 LYS 2 HZ3 LYS 2 23.489 28.373 38.986
21 H ASN 3 H ASN 3 22.774 22.205 38.498
22 HA ASN 3 HA ASN 3 21.760 19.607 38.219
23 HB2 ASN 3 HB2 ASN 3 19.638 20.643 38.964
24 HB3 ASN 3 HB3 ASN 3 21.006 21.237 39.901
25 HD21 ASN 3 HD21 ASN 3 18.689 23.953 38.114
26 HD22 ASN 3 HD22 ASN 3 18.133 22.348 38.539
27 H GLN 4 H GLN 4 21.254 22.464 36.230
28 HA GLN 4 HA GLN 4 19.628 20.926 34.254
29 HB2 GLN 4 HB2 GLN 4 18.611 22.951 33.620
30 HB3 GLN 4 HB3 GLN 4 18.425 22.616 35.339
31 HG2 GLN 4 HG2 GLN 4 20.438 24.282 35.690
32 HG3 GLN 4 HG3 GLN 4 20.061 24.785 34.013
33 HE21 GLN 4 HE21 GLN 4 16.652 25.439 34.865
34 HE22 GLN 4 HE22 GLN 4 17.740 25.094 33.541
35 H PHE 5 H PHE 5 22.636 21.180 34.634
36 HA PHE 5 HA PHE 5 24.527 21.371 33.408
37 HB2 PHE 5 HB2 PHE 5 22.682 21.292 31.003
38 HB3 PHE 5 HB3 PHE 5 24.433 21.196 30.960
39 HD1 PHE 5 HD1 PHE 5 25.579 19.194 31.273
40 HD2 PHE 5 HD2 PHE 5 21.402 19.422 32.325
41 HE1 PHE 5 HE1 PHE 5 25.536 16.750 31.689
42 HE2 PHE 5 HE2 PHE 5 21.392 16.985 32.805
43 HZ PHE 5 HZ PHE 5 23.487 15.658 32.506
44 H GLY 6 H GLY 6 22.397 23.883 33.543
45 HA2 GLY 6 HA2 GLY 6 23.088 26.202 33.661
46 HA3 GLY 6 HA3 GLY 6 24.288 25.858 32.402
47 H CYS 7 H CYS 7 21.753 24.114 31.322
48 HA CYS 7 HA CYS 7 21.077 26.195 29.374
49 HB2 CYS 7 HB2 CYS 7 20.500 23.224 29.480
50 HB3 CYS 7 HB3 CYS 7 20.057 24.280 28.163
51 H PHE 8 H PHE 8 19.174 27.084 29.037
52 HA PHE 8 HA PHE 8 16.706 25.683 29.754
53 HB2 PHE 8 HB2 PHE 8 17.191 27.021 31.821
54 HB3 PHE 8 HB3 PHE 8 17.148 28.484 30.853
55 HD1 PHE 8 HD1 PHE 8 15.051 29.377 29.967
56 HD2 PHE 8 HD2 PHE 8 15.158 25.745 32.291
57 HE1 PHE 8 HE1 PHE 8 12.557 29.402 30.141
58 HE2 PHE 8 HE2 PHE 8 12.686 25.745 32.416
59 HZ PHE 8 HZ PHE 8 11.382 27.555 31.331
60 H ALA 9 H ALA 9 15.047 26.136 28.271
61 HA ALA 9 HA ALA 9 14.173 26.764 26.296
62 HB1 ALA 9 HB1 ALA 9 13.474 28.583 27.739
63 HB2 ALA 9 HB2 ALA 9 14.956 29.501 27.357
64 HB3 ALA 9 HB3 ALA 9 13.756 29.188 26.097
65 H ASN 10 H ASN 10 16.548 25.704 25.736
66 HA ASN 10 HA ASN 10 18.247 25.478 24.279
67 HB2 ASN 10 HB2 ASN 10 16.558 27.345 22.566
68 HB3 ASN 10 HB3 ASN 10 17.908 26.407 21.959
69 HD21 ASN 10 HD21 ASN 10 14.878 24.718 21.192
70 HD22 ASN 10 HD22 ASN 10 15.593 26.264 20.785
71 H VAL 11 H VAL 11 18.410 27.897 26.247
72 HA VAL 11 HA VAL 11 20.816 29.131 24.971
73 HB VAL 11 HB VAL 11 18.790 30.510 26.763
74 HG11 VAL 11 HG11 VAL 11 21.237 31.617 25.284
75 HG12 VAL 11 HG12 VAL 11 20.042 32.580 26.158
76 HG13 VAL 11 HG13 VAL 11 21.085 31.481 27.050
77 HG21 VAL 11 HG21 VAL 11 19.411 30.879 23.786
78 HG22 VAL 11 HG22 VAL 11 17.925 30.189 24.454
79 HG23 VAL 11 HG23 VAL 11 18.300 31.881 24.749
80 H ASP 12 H ASP 12 22.527 29.617 26.188
81 HA ASP 12 HA ASP 12 23.176 27.969 28.480
82 HB2 ASP 12 HB2 ASP 12 24.493 28.581 26.356
83 HB3 ASP 12 HB3 ASP 12 24.698 30.179 27.031
84 H VAL 13 H VAL 13 21.067 29.609 29.224
85 HA VAL 13 HA VAL 13 21.835 32.176 30.341
86 HB VAL 13 HB VAL 13 19.470 31.877 31.496
87 HG11 VAL 13 HG11 VAL 13 19.578 32.247 28.499
88 HG12 VAL 13 HG12 VAL 13 18.392 32.887 29.645
89 HG13 VAL 13 HG13 VAL 13 20.055 33.479 29.670
90 HG21 VAL 13 HG21 VAL 13 19.104 30.000 29.138
91 HG22 VAL 13 HG22 VAL 13 19.240 29.445 30.813
92 HG23 VAL 13 HG23 VAL 13 17.914 30.524 30.335
93 H LYS 14 H LYS 14 20.907 29.099 31.887
94 HA LYS 14 HA LYS 14 21.173 30.230 34.595
95 HB2 LYS 14 HB2 LYS 14 20.422 27.454 33.591
96 HB3 LYS 14 HB3 LYS 14 20.420 27.937 35.286
97 HG2 LYS 14 HG2 LYS 14 18.691 29.244 33.130
98 HG3 LYS 14 HG3 LYS 14 18.163 27.970 34.217
99 HD2 LYS 14 HD2 LYS 14 18.639 29.418 36.174
100 HD3 LYS 14 HD3 LYS 14 19.096 30.739 35.072
101 HE2 LYS 14 HE2 LYS 14 16.872 30.819 34.126
102 HE3 LYS 14 HE3 LYS 14 16.369 29.391 35.057
103 HZ1 LYS 14 HZ1 LYS 14 15.693 31.524 36.108
104 HZ2 LYS 14 HZ2 LYS 14 16.696 30.636 37.084
105 HZ3 LYS 14 HZ3 LYS 14 17.264 31.946 36.277
106 H GLY 15 H GLY 15 23.323 28.826 32.417
107 HA2 GLY 15 HA2 GLY 15 25.630 29.325 33.885
108 HA3 GLY 15 HA3 GLY 15 25.195 27.665 34.302
109 H ASP 16 H ASP 16 27.420 27.457 33.204
110 HA ASP 16 HA ASP 16 27.299 27.548 30.264
111 HB2 ASP 16 HB2 ASP 16 29.636 27.305 30.304
112 HB3 ASP 16 HB3 ASP 16 29.189 28.539 31.487
113 H CYS 17 H CYS 17 26.730 25.919 29.062
114 HA CYS 17 HA CYS 17 26.900 23.090 29.900
115 HB2 CYS 17 HB2 CYS 17 25.035 23.682 28.664
116 HB3 CYS 17 HB3 CYS 17 25.909 24.730 27.575
117 H LYS 18 H LYS 18 29.037 25.315 28.267
118 HA LYS 18 HA LYS 18 30.799 23.715 26.844
119 HB2 LYS 18 HB2 LYS 18 31.217 26.089 27.025
120 HB3 LYS 18 HB3 LYS 18 31.223 26.026 28.782
121 HG2 LYS 18 HG2 LYS 18 33.442 26.433 28.168
122 HG3 LYS 18 HG3 LYS 18 33.403 24.785 28.717
123 HD2 LYS 18 HD2 LYS 18 34.663 24.446 26.869
124 HD3 LYS 18 HD3 LYS 18 33.097 24.311 26.053
125 HE2 LYS 18 HE2 LYS 18 33.222 26.674 25.377
126 HE3 LYS 18 HE3 LYS 18 34.670 26.916 26.371
127 HZ1 LYS 18 HZ1 LYS 18 34.519 25.167 23.982
128 HZ2 LYS 18 HZ2 LYS 18 35.193 26.629 24.021
129 HZ3 LYS 18 HZ3 LYS 18 35.904 25.442 24.905
130 H ARG 19 H ARG 19 30.883 24.114 30.454
131 HA ARG 19 HA ARG 19 33.118 22.400 30.752
132 HB2 ARG 19 HB2 ARG 19 31.083 23.560 32.616
133 HB3 ARG 19 HB3 ARG 19 32.106 22.241 33.204
134 HG2 ARG 19 HG2 ARG 19 34.148 23.397 32.447
135 HG3 ARG 19 HG3 ARG 19 33.203 24.781 31.911
136 HD2 ARG 19 HD2 ARG 19 33.304 23.766 34.790
137 HD3 ARG 19 HD3 ARG 19 34.365 25.017 34.122
138 HE ARG 19 HE ARG 19 31.683 25.772 33.601
139 HH11 ARG 19 HH11 ARG 19 33.993 25.636 36.272
140 HH12 ARG 19 HH12 ARG 19 33.315 27.025 37.049
141 HH21 ARG 19 HH21 ARG 19 30.805 27.392 34.658
142 HH22 ARG 19 HH22 ARG 19 31.553 28.105 36.081
143 H HIS 20 H HIS 20 29.798 21.350 30.388
144 HA HIS 20 HA HIS 20 30.360 18.656 31.435
145 HB2 HIS 20 HB2 HIS 20 28.095 19.313 31.613
146 HB3 HIS 20 HB3 HIS 20 28.037 19.898 29.947
147 HD2 HIS 20 HD2 HIS 20 27.148 18.295 28.179
148 HE1 HIS 20 HE1 HIS 20 27.341 14.620 30.305
149 HE2 HIS 20 HE2 HIS 20 26.575 15.722 28.149
150 H CYS 21 H CYS 21 30.342 20.189 28.202
151 HA CYS 21 HA CYS 21 31.145 17.680 26.903
152 HB2 CYS 21 HB2 CYS 21 30.724 20.528 25.984
153 HB3 CYS 21 HB3 CYS 21 31.132 19.215 24.897
154 H LYS 22 H LYS 22 32.836 20.599 28.038
155 HA LYS 22 HA LYS 22 35.419 20.133 27.005
156 HB2 LYS 22 HB2 LYS 22 34.650 22.184 28.171
157 HB3 LYS 22 HB3 LYS 22 34.499 21.262 29.662
158 HG2 LYS 22 HG2 LYS 22 36.377 22.611 29.883
159 HG3 LYS 22 HG3 LYS 22 36.971 20.968 29.736
160 HD2 LYS 22 HD2 LYS 22 36.931 22.991 27.432
161 HD3 LYS 22 HD3 LYS 22 38.260 22.783 28.562
162 HE2 LYS 22 HE2 LYS 22 38.096 20.230 27.848
163 HE3 LYS 22 HE3 LYS 22 37.321 20.916 26.402
164 HZ1 LYS 22 HZ1 LYS 22 39.344 22.388 26.256
165 HZ2 LYS 22 HZ2 LYS 22 40.003 21.506 27.476
166 HZ3 LYS 22 HZ3 LYS 22 39.664 20.769 26.032
167 H ALA 23 H ALA 23 33.786 18.516 29.707
168 HA ALA 23 HA ALA 23 35.965 17.064 30.800
169 HB1 ALA 23 HB1 ALA 23 33.070 16.168 30.464
170 HB2 ALA 23 HB2 ALA 23 34.230 15.660 31.701
171 HB3 ALA 23 HB3 ALA 23 33.613 17.315 31.709
172 H GLU 24 H GLU 24 34.368 16.682 27.731
173 HA GLU 24 HA GLU 24 35.791 14.129 27.131
174 HB2 GLU 24 HB2 GLU 24 33.309 15.382 25.881
175 HB3 GLU 24 HB3 GLU 24 34.035 13.843 25.411
176 HG2 GLU 24 HG2 GLU 24 33.547 12.889 27.607
177 HG3 GLU 24 HG3 GLU 24 32.908 14.430 28.190
178 H ASP 25 H ASP 25 36.531 17.187 26.926
179 HA ASP 25 HA ASP 25 37.452 18.696 25.586
180 HB2 ASP 25 HB2 ASP 25 39.111 16.752 25.585
181 HB3 ASP 25 HB3 ASP 25 38.609 16.454 23.919
182 H LYS 26 H LYS 26 34.808 18.308 25.021
183 HA LYS 26 HA LYS 26 34.452 18.761 22.080
184 HB2 LYS 26 HB2 LYS 26 32.576 17.667 24.213
185 HB3 LYS 26 HB3 LYS 26 32.089 18.021 22.572
186 HG2 LYS 26 HG2 LYS 26 34.386 16.103 22.920
187 HG3 LYS 26 HG3 LYS 26 32.799 15.581 23.472
188 HD2 LYS 26 HD2 LYS 26 31.853 16.186 21.221
189 HD3 LYS 26 HD3 LYS 26 33.506 16.544 20.683
190 HE2 LYS 26 HE2 LYS 26 33.277 14.316 19.994
191 HE3 LYS 26 HE3 LYS 26 34.059 14.139 21.569
192 HZ1 LYS 26 HZ1 LYS 26 31.182 13.798 20.962
193 HZ2 LYS 26 HZ2 LYS 26 32.227 12.613 21.446
194 HZ3 LYS 26 HZ3 LYS 26 31.742 13.790 22.485
195 H GLU 27 H GLU 27 32.841 20.293 21.444
196 HA GLU 27 HA GLU 27 32.409 22.595 23.215
197 HB2 GLU 27 HB2 GLU 27 31.551 21.893 20.385
198 HB3 GLU 27 HB3 GLU 27 30.990 23.338 21.213
199 HG2 GLU 27 HG2 GLU 27 33.950 22.758 20.826
200 HG3 GLU 27 HG3 GLU 27 32.968 23.584 19.622
201 H GLY 28 H GLY 28 30.443 23.225 24.010
202 HA2 GLY 28 HA2 GLY 28 28.313 21.148 24.256
203 HA3 GLY 28 HA3 GLY 28 28.553 22.443 25.377
204 H ILE 29 H ILE 29 26.061 21.674 24.013
205 HA ILE 29 HA ILE 29 25.254 24.313 23.096
206 HB ILE 29 HB ILE 29 25.969 23.302 21.031
207 HG12 ILE 29 HG12 ILE 29 23.879 24.756 21.251
208 HG13 ILE 29 HG13 ILE 29 24.297 24.009 19.721
209 HG21 ILE 29 HG21 ILE 29 24.863 21.367 19.993
210 HG22 ILE 29 HG22 ILE 29 25.830 20.945 21.409
211 HG23 ILE 29 HG23 ILE 29 24.059 21.011 21.537
212 HD11 ILE 29 HD11 ILE 29 22.574 22.332 19.955
213 HD12 ILE 29 HD12 ILE 29 22.196 22.874 21.601
214 HD13 ILE 29 HD13 ILE 29 21.865 23.933 20.215
215 H CYS 30 H CYS 30 23.181 24.782 23.738
216 HA CYS 30 HA CYS 30 21.996 22.885 25.589
217 HB2 CYS 30 HB2 CYS 30 21.314 25.734 24.856
218 HB3 CYS 30 HB3 CYS 30 20.433 24.780 26.058
219 H HIS 31 H HIS 31 20.606 21.429 25.159
220 HA HIS 31 HA HIS 31 18.439 21.777 23.107
221 HB2 HIS 31 HB2 HIS 31 19.750 19.331 24.337
222 HB3 HIS 31 HB3 HIS 31 18.131 19.264 23.647
223 HD2 HIS 31 HD2 HIS 31 21.547 20.678 22.241
224 HE1 HIS 31 HE1 HIS 31 19.681 18.320 19.230
225 HE2 HIS 31 HE2 HIS 31 21.682 19.786 19.769
226 H GLY 32 H GLY 32 17.068 23.121 24.301
227 HA2 GLY 32 HA2 GLY 32 15.446 23.690 25.825
228 HA3 GLY 32 HA3 GLY 32 15.328 21.981 26.245
229 H THR 33 H THR 33 15.640 21.621 28.310
230 HA THR 33 HA THR 33 17.278 23.339 30.069
231 HB THR 33 HB THR 33 16.346 22.043 31.892
232 HG1 THR 33 HG1 THR 33 14.871 20.590 29.965
233 HG21 THR 33 HG21 THR 33 14.021 22.624 31.731
234 HG22 THR 33 HG22 THR 33 14.954 23.884 30.897
235 HG23 THR 33 HG23 THR 33 14.082 22.666 29.958
236 H LYS 34 H LYS 34 18.309 21.189 28.007
237 HA LYS 34 HA LYS 34 20.235 19.765 29.808
238 HB2 LYS 34 HB2 LYS 34 18.830 18.667 27.340
239 HB3 LYS 34 HB3 LYS 34 19.975 17.815 28.356
240 HG2 LYS 34 HG2 LYS 34 17.236 18.733 29.307
241 HG3 LYS 34 HG3 LYS 34 17.635 17.127 28.706
242 HD2 LYS 34 HD2 LYS 34 19.377 16.900 30.494
243 HD3 LYS 34 HD3 LYS 34 18.846 18.435 31.185
244 HE2 LYS 34 HE2 LYS 34 17.030 16.019 30.732
245 HE3 LYS 34 HE3 LYS 34 17.892 16.342 32.241
246 HZ1 LYS 34 HZ1 LYS 34 15.743 18.009 31.057
247 HZ2 LYS 34 HZ2 LYS 34 15.747 17.214 32.489
248 HZ3 LYS 34 HZ3 LYS 34 16.704 18.535 32.284
249 H CYS 35 H CYS 35 22.078 18.793 28.542
250 HA CYS 35 HA CYS 35 23.129 20.772 26.546
251 HB2 CYS 35 HB2 CYS 35 23.998 21.142 28.787
252 HB3 CYS 35 HB3 CYS 35 24.476 19.442 28.889
253 H LYS 36 H LYS 36 24.086 19.972 24.774
254 HA LYS 36 HA LYS 36 24.637 17.097 24.406
255 HB2 LYS 36 HB2 LYS 36 22.678 18.831 23.144
256 HB3 LYS 36 HB3 LYS 36 23.929 18.538 21.963
257 HG2 LYS 36 HG2 LYS 36 22.148 16.923 21.752
258 HG3 LYS 36 HG3 LYS 36 23.620 16.083 22.269
259 HD2 LYS 36 HD2 LYS 36 22.776 15.956 24.584
260 HD3 LYS 36 HD3 LYS 36 21.366 16.957 24.149
261 HE2 LYS 36 HE2 LYS 36 20.621 15.267 22.566
262 HE3 LYS 36 HE3 LYS 36 22.063 14.289 22.874
263 HZ1 LYS 36 HZ1 LYS 36 20.045 14.953 24.947
264 HZ2 LYS 36 HZ2 LYS 36 20.102 13.516 24.125
265 HZ3 LYS 36 HZ3 LYS 36 21.302 13.913 25.134
266 H CYS 37 H CYS 37 26.334 16.721 23.020
267 HA CYS 37 HA CYS 37 28.346 18.923 23.045
268 HB2 CYS 37 HB2 CYS 37 28.821 15.955 23.081
269 HB3 CYS 37 HB3 CYS 37 30.039 17.213 23.187
270 H GLY 38 H GLY 38 29.285 19.666 21.347
271 HA2 GLY 38 HA2 GLY 38 28.518 18.780 18.655
272 HA3 GLY 38 HA3 GLY 38 29.346 20.280 19.140
273 H VAL 39 H VAL 39 31.161 20.369 17.988
274 HA VAL 39 HA VAL 39 32.805 18.078 17.383
275 HB VAL 39 HB VAL 39 34.245 19.795 16.240
276 HG11 VAL 39 HG11 VAL 39 32.457 18.619 15.035
277 HG12 VAL 39 HG12 VAL 39 31.287 19.882 15.488
278 HG13 VAL 39 HG13 VAL 39 32.662 20.262 14.440
279 HG21 VAL 39 HG21 VAL 39 32.064 21.804 16.968
280 HG22 VAL 39 HG22 VAL 39 33.671 21.734 17.729
281 HG23 VAL 39 HG23 VAL 39 33.528 22.070 16.008
282 HA PRO 40 HA PRO 40 35.992 18.441 20.491
283 HB2 PRO 40 HB2 PRO 40 37.886 18.693 18.155
284 HB3 PRO 40 HB3 PRO 40 38.020 17.662 19.623
285 HG2 PRO 40 HG2 PRO 40 37.208 16.599 17.253
286 HG3 PRO 40 HG3 PRO 40 36.445 16.120 18.804
287 HD2 PRO 40 HD2 PRO 40 35.344 18.007 16.706
288 HD3 PRO 40 HD3 PRO 40 34.523 16.807 17.736
289 H ILE 41 H ILE 41 37.206 20.120 21.541
290 HA ILE 41 HA ILE 41 36.260 22.688 20.783
291 HB ILE 41 HB ILE 41 37.558 23.610 22.667
292 HG12 ILE 41 HG12 ILE 41 38.288 21.912 24.381
293 HG13 ILE 41 HG13 ILE 41 38.389 20.712 23.114
294 HG21 ILE 41 HG21 ILE 41 35.857 21.188 23.320
295 HG22 ILE 41 HG22 ILE 41 36.102 22.626 24.326
296 HG23 ILE 41 HG23 ILE 41 35.220 22.764 22.809
297 HD11 ILE 41 HD11 ILE 41 39.906 23.308 22.826
298 HD12 ILE 41 HD12 ILE 41 40.509 22.067 23.949
299 HD13 ILE 41 HD13 ILE 41 40.337 21.670 22.246
300 H SER 42 H SER 42 39.565 21.410 20.293
301 HA SER 42 HA SER 42 41.437 22.429 19.667
302 HB2 SER 42 HB2 SER 42 39.487 22.752 17.364
303 HB3 SER 42 HB3 SER 42 41.267 22.795 17.233
304 HG SER 42 HG SER 42 39.984 20.637 17.066
305 H TYR 43 H TYR 43 40.082 24.421 21.178
306 HA TYR 43 HA TYR 43 42.062 26.441 20.701
307 HB2 TYR 43 HB2 TYR 43 40.782 28.407 20.532
308 HB3 TYR 43 HB3 TYR 43 40.336 27.314 19.229
309 HD1 TYR 43 HD1 TYR 43 39.206 28.918 22.365
310 HD2 TYR 43 HD2 TYR 43 38.128 26.338 19.090
311 HE1 TYR 43 HE1 TYR 43 36.889 28.808 23.217
312 HE2 TYR 43 HE2 TYR 43 35.819 26.196 19.957
313 HH TYR 43 HH TYR 43 34.356 26.820 21.612
314 H LEU 44 H LEU 44 39.085 25.891 22.700
315 HA LEU 44 HA LEU 44 40.774 26.010 25.110
316 HB2 LEU 44 HB2 LEU 44 39.904 28.336 24.587
317 HB3 LEU 44 HB3 LEU 44 38.279 27.701 24.867
318 HG LEU 44 HG LEU 44 39.018 27.074 27.204
319 HD11 LEU 44 HD11 LEU 44 40.996 28.230 28.124
320 HD12 LEU 44 HD12 LEU 44 41.456 27.040 26.904
321 HD13 LEU 44 HD13 LEU 44 41.443 28.768 26.490
322 HD21 LEU 44 HD21 LEU 44 38.858 29.368 28.046
323 HD22 LEU 44 HD22 LEU 44 39.265 30.006 26.431
324 HD23 LEU 44 HD23 LEU 44 37.742 29.126 26.693
Start of MODEL 20
1 H1 ALA 1 H1 ALA 1 28.875 23.852 34.358
2 H2 ALA 1 H2 ALA 1 29.640 22.985 35.531
3 H3 ALA 1 H3 ALA 1 28.499 24.076 35.953
4 HA ALA 1 HA ALA 1 26.803 22.755 34.820
5 HB1 ALA 1 HB1 ALA 1 28.302 21.667 33.210
6 HB2 ALA 1 HB2 ALA 1 29.051 20.737 34.528
7 HB3 ALA 1 HB3 ALA 1 27.345 20.487 34.120
8 H LYS 2 H LYS 2 25.454 22.146 36.409
9 HA LYS 2 HA LYS 2 26.556 20.952 38.922
10 HB2 LYS 2 HB2 LYS 2 26.576 23.353 39.179
11 HB3 LYS 2 HB3 LYS 2 24.913 23.491 38.602
12 HG2 LYS 2 HG2 LYS 2 24.044 22.429 40.595
13 HG3 LYS 2 HG3 LYS 2 25.673 21.968 41.123
14 HD2 LYS 2 HD2 LYS 2 24.906 23.888 42.404
15 HD3 LYS 2 HD3 LYS 2 26.284 24.325 41.400
16 HE2 LYS 2 HE2 LYS 2 24.626 25.276 39.699
17 HE3 LYS 2 HE3 LYS 2 23.351 25.005 40.908
18 HZ1 LYS 2 HZ1 LYS 2 25.760 26.716 41.242
19 HZ2 LYS 2 HZ2 LYS 2 24.227 27.266 41.054
20 HZ3 LYS 2 HZ3 LYS 2 24.646 26.457 42.422
21 H ASN 3 H ASN 3 23.449 22.003 37.484
22 HA ASN 3 HA ASN 3 22.141 19.496 38.500
23 HB2 ASN 3 HB2 ASN 3 20.276 20.944 39.253
24 HB3 ASN 3 HB3 ASN 3 21.776 21.268 40.123
25 HD21 ASN 3 HD21 ASN 3 20.207 24.536 39.287
26 HD22 ASN 3 HD22 ASN 3 19.767 23.133 40.300
27 H GLN 4 H GLN 4 21.938 22.162 36.233
28 HA GLN 4 HA GLN 4 20.257 20.519 34.369
29 HB2 GLN 4 HB2 GLN 4 18.920 22.440 33.832
30 HB3 GLN 4 HB3 GLN 4 18.900 22.228 35.580
31 HG2 GLN 4 HG2 GLN 4 20.651 24.035 35.770
32 HG3 GLN 4 HG3 GLN 4 20.567 24.260 34.018
33 HE21 GLN 4 HE21 GLN 4 18.489 25.042 33.062
34 HE22 GLN 4 HE22 GLN 4 17.491 26.030 34.139
35 H PHE 5 H PHE 5 23.254 21.277 34.540
36 HA PHE 5 HA PHE 5 24.948 22.061 33.317
37 HB2 PHE 5 HB2 PHE 5 23.232 21.628 30.885
38 HB3 PHE 5 HB3 PHE 5 24.983 21.598 31.006
39 HD1 PHE 5 HD1 PHE 5 21.878 19.700 31.464
40 HD2 PHE 5 HD2 PHE 5 26.133 19.649 32.098
41 HE1 PHE 5 HE1 PHE 5 21.811 17.220 31.720
42 HE2 PHE 5 HE2 PHE 5 26.058 17.193 32.412
43 HZ PHE 5 HZ PHE 5 23.892 15.968 32.197
44 H GLY 6 H GLY 6 22.767 24.111 34.103
45 HA2 GLY 6 HA2 GLY 6 22.564 26.395 33.938
46 HA3 GLY 6 HA3 GLY 6 23.923 26.393 32.807
47 H CYS 7 H CYS 7 21.729 24.302 31.472
48 HA CYS 7 HA CYS 7 20.980 26.278 29.462
49 HB2 CYS 7 HB2 CYS 7 20.577 23.282 29.652
50 HB3 CYS 7 HB3 CYS 7 20.159 24.251 28.262
51 H PHE 8 H PHE 8 19.046 27.145 29.102
52 HA PHE 8 HA PHE 8 16.611 25.615 29.711
53 HB2 PHE 8 HB2 PHE 8 16.918 26.965 31.762
54 HB3 PHE 8 HB3 PHE 8 16.929 28.430 30.794
55 HD1 PHE 8 HD1 PHE 8 14.895 29.322 29.797
56 HD2 PHE 8 HD2 PHE 8 14.836 25.663 32.076
57 HE1 PHE 8 HE1 PHE 8 12.407 29.393 29.858
58 HE2 PHE 8 HE2 PHE 8 12.354 25.727 32.134
59 HZ PHE 8 HZ PHE 8 11.136 27.580 31.010
60 H ALA 9 H ALA 9 15.004 25.918 28.224
61 HA ALA 9 HA ALA 9 14.157 26.344 26.178
62 HB1 ALA 9 HB1 ALA 9 13.442 28.645 25.835
63 HB2 ALA 9 HB2 ALA 9 13.249 28.165 27.529
64 HB3 ALA 9 HB3 ALA 9 14.605 29.211 27.052
65 H ASN 10 H ASN 10 16.582 25.454 25.743
66 HA ASN 10 HA ASN 10 18.232 25.219 24.242
67 HB2 ASN 10 HB2 ASN 10 16.690 27.198 22.510
68 HB3 ASN 10 HB3 ASN 10 17.907 26.081 21.936
69 HD21 ASN 10 HD21 ASN 10 14.665 24.794 21.210
70 HD22 ASN 10 HD22 ASN 10 15.464 26.321 20.884
71 H VAL 11 H VAL 11 18.325 27.720 26.205
72 HA VAL 11 HA VAL 11 20.783 28.917 24.979
73 HB VAL 11 HB VAL 11 18.667 30.377 26.607
74 HG11 VAL 11 HG11 VAL 11 21.159 31.357 25.116
75 HG12 VAL 11 HG12 VAL 11 19.917 32.403 25.824
76 HG13 VAL 11 HG13 VAL 11 20.900 31.399 26.876
77 HG21 VAL 11 HG21 VAL 11 18.160 31.606 24.526
78 HG22 VAL 11 HG22 VAL 11 19.291 30.581 23.623
79 HG23 VAL 11 HG23 VAL 11 17.812 29.895 24.321
80 H ASP 12 H ASP 12 22.467 29.404 26.287
81 HA ASP 12 HA ASP 12 22.781 28.123 28.858
82 HB2 ASP 12 HB2 ASP 12 25.044 28.784 28.667
83 HB3 ASP 12 HB3 ASP 12 24.528 28.272 27.077
84 H VAL 13 H VAL 13 20.666 29.836 29.193
85 HA VAL 13 HA VAL 13 21.390 32.476 30.104
86 HB VAL 13 HB VAL 13 19.024 32.281 31.255
87 HG11 VAL 13 HG11 VAL 13 17.973 32.941 29.175
88 HG12 VAL 13 HG12 VAL 13 19.592 33.658 29.294
89 HG13 VAL 13 HG13 VAL 13 19.318 32.250 28.250
90 HG21 VAL 13 HG21 VAL 13 17.493 30.741 30.309
91 HG22 VAL 13 HG22 VAL 13 18.693 30.086 29.188
92 HG23 VAL 13 HG23 VAL 13 18.846 29.777 30.931
93 H LYS 14 H LYS 14 20.936 29.435 31.862
94 HA LYS 14 HA LYS 14 21.200 30.875 34.462
95 HB2 LYS 14 HB2 LYS 14 20.543 27.956 33.969
96 HB3 LYS 14 HB3 LYS 14 20.550 28.779 35.523
97 HG2 LYS 14 HG2 LYS 14 18.665 29.317 33.199
98 HG3 LYS 14 HG3 LYS 14 18.282 28.514 34.715
99 HD2 LYS 14 HD2 LYS 14 18.643 30.617 35.967
100 HD3 LYS 14 HD3 LYS 14 19.083 31.452 34.455
101 HE2 LYS 14 HE2 LYS 14 16.886 30.884 33.491
102 HE3 LYS 14 HE3 LYS 14 16.404 30.116 35.010
103 HZ1 LYS 14 HZ1 LYS 14 17.121 32.988 34.710
104 HZ2 LYS 14 HZ2 LYS 14 15.592 32.419 34.789
105 HZ3 LYS 14 HZ3 LYS 14 16.553 32.287 36.096
106 H GLY 15 H GLY 15 23.257 28.992 32.374
107 HA2 GLY 15 HA2 GLY 15 25.574 29.685 33.915
108 HA3 GLY 15 HA3 GLY 15 25.075 28.064 34.374
109 H ASP 16 H ASP 16 26.991 27.170 33.641
110 HA ASP 16 HA ASP 16 27.537 27.197 30.718
111 HB2 ASP 16 HB2 ASP 16 29.791 26.434 31.217
112 HB3 ASP 16 HB3 ASP 16 29.417 27.968 31.997
113 H CYS 17 H CYS 17 27.427 25.586 29.509
114 HA CYS 17 HA CYS 17 27.116 22.750 30.421
115 HB2 CYS 17 HB2 CYS 17 25.188 23.147 29.270
116 HB3 CYS 17 HB3 CYS 17 25.840 24.490 28.382
117 H LYS 18 H LYS 18 29.036 25.022 28.533
118 HA LYS 18 HA LYS 18 30.829 23.535 27.080
119 HB2 LYS 18 HB2 LYS 18 31.058 25.931 27.324
120 HB3 LYS 18 HB3 LYS 18 31.293 25.799 29.061
121 HG2 LYS 18 HG2 LYS 18 33.420 26.301 28.248
122 HG3 LYS 18 HG3 LYS 18 33.496 24.608 28.616
123 HD2 LYS 18 HD2 LYS 18 34.589 24.665 26.615
124 HD3 LYS 18 HD3 LYS 18 32.947 24.284 26.053
125 HE2 LYS 18 HE2 LYS 18 32.564 26.626 25.440
126 HE3 LYS 18 HE3 LYS 18 34.043 27.123 26.260
127 HZ1 LYS 18 HZ1 LYS 18 34.489 27.099 23.956
128 HZ2 LYS 18 HZ2 LYS 18 35.295 25.807 24.553
129 HZ3 LYS 18 HZ3 LYS 18 33.907 25.601 23.698
130 H ARG 19 H ARG 19 31.098 23.859 30.695
131 HA ARG 19 HA ARG 19 33.451 22.261 30.868
132 HB2 ARG 19 HB2 ARG 19 31.341 22.997 32.919
133 HB3 ARG 19 HB3 ARG 19 32.711 21.953 33.314
134 HG2 ARG 19 HG2 ARG 19 34.276 23.715 32.409
135 HG3 ARG 19 HG3 ARG 19 32.901 24.823 32.302
136 HD2 ARG 19 HD2 ARG 19 33.729 23.390 34.870
137 HD3 ARG 19 HD3 ARG 19 34.387 24.957 34.382
138 HE ARG 19 HE ARG 19 31.534 25.101 34.308
139 HH11 ARG 19 HH11 ARG 19 34.032 24.802 36.783
140 HH12 ARG 19 HH12 ARG 19 33.127 25.832 37.891
141 HH21 ARG 19 HH21 ARG 19 30.522 26.378 35.738
142 HH22 ARG 19 HH22 ARG 19 31.104 26.519 37.386
143 H HIS 20 H HIS 20 30.117 21.109 30.696
144 HA HIS 20 HA HIS 20 30.774 18.383 31.556
145 HB2 HIS 20 HB2 HIS 20 28.516 19.142 31.787
146 HB3 HIS 20 HB3 HIS 20 28.424 19.632 30.096
147 HD2 HIS 20 HD2 HIS 20 27.235 18.009 28.566
148 HE1 HIS 20 HE1 HIS 20 27.658 14.393 30.790
149 HE2 HIS 20 HE2 HIS 20 26.569 15.443 28.757
150 H CYS 21 H CYS 21 30.421 20.002 28.362
151 HA CYS 21 HA CYS 21 31.157 17.577 26.936
152 HB2 CYS 21 HB2 CYS 21 30.731 20.460 26.122
153 HB3 CYS 21 HB3 CYS 21 31.132 19.201 24.966
154 H LYS 22 H LYS 22 32.986 20.445 28.026
155 HA LYS 22 HA LYS 22 35.384 19.980 26.656
156 HB2 LYS 22 HB2 LYS 22 34.632 22.057 27.747
157 HB3 LYS 22 HB3 LYS 22 34.761 21.294 29.335
158 HG2 LYS 22 HG2 LYS 22 36.600 22.820 28.876
159 HG3 LYS 22 HG3 LYS 22 37.166 21.167 29.137
160 HD2 LYS 22 HD2 LYS 22 37.421 20.873 26.662
161 HD3 LYS 22 HD3 LYS 22 36.863 22.556 26.421
162 HE2 LYS 22 HE2 LYS 22 38.666 23.412 27.725
163 HE3 LYS 22 HE3 LYS 22 39.105 21.784 28.293
164 HZ1 LYS 22 HZ1 LYS 22 39.529 22.925 25.602
165 HZ2 LYS 22 HZ2 LYS 22 40.651 22.307 26.591
166 HZ3 LYS 22 HZ3 LYS 22 39.614 21.277 25.868
167 H ALA 23 H ALA 23 34.089 18.303 29.420
168 HA ALA 23 HA ALA 23 36.521 17.025 30.322
169 HB1 ALA 23 HB1 ALA 23 34.974 15.521 31.445
170 HB2 ALA 23 HB2 ALA 23 34.373 17.180 31.596
171 HB3 ALA 23 HB3 ALA 23 33.629 16.069 30.427
172 H GLU 24 H GLU 24 34.272 16.418 27.650
173 HA GLU 24 HA GLU 24 35.759 14.028 26.699
174 HB2 GLU 24 HB2 GLU 24 33.296 15.441 25.615
175 HB3 GLU 24 HB3 GLU 24 34.013 13.993 24.942
176 HG2 GLU 24 HG2 GLU 24 32.870 14.190 27.759
177 HG3 GLU 24 HG3 GLU 24 31.992 13.594 26.354
178 H ASP 25 H ASP 25 36.467 17.127 26.761
179 HA ASP 25 HA ASP 25 37.286 18.779 25.573
180 HB2 ASP 25 HB2 ASP 25 39.083 16.923 25.508
181 HB3 ASP 25 HB3 ASP 25 38.724 16.837 23.780
182 H LYS 26 H LYS 26 34.714 18.189 24.833
183 HA LYS 26 HA LYS 26 34.540 18.960 21.943
184 HB2 LYS 26 HB2 LYS 26 32.567 17.558 23.789
185 HB3 LYS 26 HB3 LYS 26 32.151 18.218 22.216
186 HG2 LYS 26 HG2 LYS 26 34.436 16.616 21.704
187 HG3 LYS 26 HG3 LYS 26 33.468 15.700 22.881
188 HD2 LYS 26 HD2 LYS 26 31.449 16.073 21.415
189 HD3 LYS 26 HD3 LYS 26 32.517 16.862 20.228
190 HE2 LYS 26 HE2 LYS 26 33.851 14.770 20.075
191 HE3 LYS 26 HE3 LYS 26 32.770 14.014 21.257
192 HZ1 LYS 26 HZ1 LYS 26 32.093 14.844 18.496
193 HZ2 LYS 26 HZ2 LYS 26 31.960 13.367 19.170
194 HZ3 LYS 26 HZ3 LYS 26 30.917 14.547 19.634
195 H GLU 27 H GLU 27 32.900 20.409 21.344
196 HA GLU 27 HA GLU 27 32.390 22.716 23.045
197 HB2 GLU 27 HB2 GLU 27 31.470 21.732 20.315
198 HB3 GLU 27 HB3 GLU 27 30.686 23.101 21.083
199 HG2 GLU 27 HG2 GLU 27 33.679 22.948 20.521
200 HG3 GLU 27 HG3 GLU 27 32.493 23.742 19.482
201 H GLY 28 H GLY 28 30.558 23.233 24.077
202 HA2 GLY 28 HA2 GLY 28 28.399 21.174 24.385
203 HA3 GLY 28 HA3 GLY 28 28.901 22.232 25.683
204 H ILE 29 H ILE 29 26.321 21.690 24.034
205 HA ILE 29 HA ILE 29 25.560 24.500 23.545
206 HB ILE 29 HB ILE 29 26.499 23.643 21.531
207 HG12 ILE 29 HG12 ILE 29 24.548 25.214 21.523
208 HG13 ILE 29 HG13 ILE 29 25.020 24.437 20.025
209 HG21 ILE 29 HG21 ILE 29 25.479 21.871 20.176
210 HG22 ILE 29 HG22 ILE 29 26.275 21.296 21.623
211 HG23 ILE 29 HG23 ILE 29 24.498 21.384 21.580
212 HD11 ILE 29 HD11 ILE 29 23.140 22.840 20.229
213 HD12 ILE 29 HD12 ILE 29 22.610 23.663 21.707
214 HD13 ILE 29 HD13 ILE 29 22.625 24.524 20.154
215 H CYS 30 H CYS 30 23.563 25.005 24.173
216 HA CYS 30 HA CYS 30 22.197 23.052 25.792
217 HB2 CYS 30 HB2 CYS 30 21.572 25.939 25.134
218 HB3 CYS 30 HB3 CYS 30 20.644 24.946 26.267
219 H HIS 31 H HIS 31 20.862 21.602 25.139
220 HA HIS 31 HA HIS 31 18.821 22.135 23.011
221 HB2 HIS 31 HB2 HIS 31 20.188 19.578 23.896
222 HB3 HIS 31 HB3 HIS 31 18.605 19.561 23.135
223 HD2 HIS 31 HD2 HIS 31 22.187 20.853 22.260
224 HE1 HIS 31 HE1 HIS 31 20.242 19.795 18.624
225 HE2 HIS 31 HE2 HIS 31 22.414 20.630 19.635
226 H GLY 32 H GLY 32 17.174 22.989 24.087
227 HA2 GLY 32 HA2 GLY 32 15.303 23.117 25.419
228 HA3 GLY 32 HA3 GLY 32 15.598 21.458 25.931
229 H THR 33 H THR 33 15.916 21.257 28.062
230 HA THR 33 HA THR 33 17.174 23.459 29.646
231 HB THR 33 HB THR 33 16.167 22.435 31.606
232 HG1 THR 33 HG1 THR 33 14.557 20.682 30.936
233 HG21 THR 33 HG21 THR 33 14.792 24.033 30.203
234 HG22 THR 33 HG22 THR 33 14.024 22.626 29.443
235 HG23 THR 33 HG23 THR 33 13.854 22.910 31.190
236 H LYS 34 H LYS 34 18.433 21.192 27.947
237 HA LYS 34 HA LYS 34 20.323 20.145 29.999
238 HB2 LYS 34 HB2 LYS 34 19.135 18.655 27.617
239 HB3 LYS 34 HB3 LYS 34 20.318 17.996 28.739
240 HG2 LYS 34 HG2 LYS 34 17.466 18.800 29.464
241 HG3 LYS 34 HG3 LYS 34 18.034 17.165 29.143
242 HD2 LYS 34 HD2 LYS 34 19.637 17.354 31.043
243 HD3 LYS 34 HD3 LYS 34 18.953 18.930 31.460
244 HE2 LYS 34 HE2 LYS 34 17.428 16.299 31.331
245 HE3 LYS 34 HE3 LYS 34 18.062 17.033 32.811
246 HZ1 LYS 34 HZ1 LYS 34 15.934 18.144 31.065
247 HZ2 LYS 34 HZ2 LYS 34 15.767 17.578 32.592
248 HZ3 LYS 34 HZ3 LYS 34 16.608 18.960 32.337
249 H CYS 35 H CYS 35 22.334 19.315 29.080
250 HA CYS 35 HA CYS 35 23.410 21.011 26.899
251 HB2 CYS 35 HB2 CYS 35 24.508 20.681 29.134
252 HB3 CYS 35 HB3 CYS 35 24.815 19.011 28.683
253 H LYS 36 H LYS 36 24.516 20.093 25.119
254 HA LYS 36 HA LYS 36 24.488 17.216 24.584
255 HB2 LYS 36 HB2 LYS 36 22.426 18.696 23.567
256 HB3 LYS 36 HB3 LYS 36 23.633 19.043 22.338
257 HG2 LYS 36 HG2 LYS 36 22.847 16.230 23.216
258 HG3 LYS 36 HG3 LYS 36 21.971 17.111 21.972
259 HD2 LYS 36 HD2 LYS 36 24.930 16.449 21.771
260 HD3 LYS 36 HD3 LYS 36 23.626 15.455 21.129
261 HE2 LYS 36 HE2 LYS 36 22.884 17.270 19.674
262 HE3 LYS 36 HE3 LYS 36 24.144 18.346 20.304
263 HZ1 LYS 36 HZ1 LYS 36 25.816 16.975 19.334
264 HZ2 LYS 36 HZ2 LYS 36 24.775 15.751 19.026
265 HZ3 LYS 36 HZ3 LYS 36 24.673 17.135 18.156
266 H CYS 37 H CYS 37 26.347 16.735 23.379
267 HA CYS 37 HA CYS 37 28.268 18.969 23.115
268 HB2 CYS 37 HB2 CYS 37 28.859 16.013 23.025
269 HB3 CYS 37 HB3 CYS 37 30.008 17.343 23.136
270 H GLY 38 H GLY 38 29.429 19.494 21.395
271 HA2 GLY 38 HA2 GLY 38 28.294 18.905 18.721
272 HA3 GLY 38 HA3 GLY 38 29.264 20.282 19.201
273 H VAL 39 H VAL 39 31.178 20.326 18.348
274 HA VAL 39 HA VAL 39 32.625 17.897 17.504
275 HB VAL 39 HB VAL 39 33.929 19.481 16.060
276 HG11 VAL 39 HG11 VAL 39 32.223 19.772 14.374
277 HG12 VAL 39 HG12 VAL 39 32.005 18.212 15.190
278 HG13 VAL 39 HG13 VAL 39 30.933 19.577 15.576
279 HG21 VAL 39 HG21 VAL 39 33.136 21.726 15.632
280 HG22 VAL 39 HG22 VAL 39 31.878 21.567 16.868
281 HG23 VAL 39 HG23 VAL 39 33.592 21.569 17.334
282 HA PRO 40 HA PRO 40 36.095 18.432 20.297
283 HB2 PRO 40 HB2 PRO 40 37.675 18.798 17.731
284 HB3 PRO 40 HB3 PRO 40 38.116 17.853 19.187
285 HG2 PRO 40 HG2 PRO 40 37.092 16.606 17.013
286 HG3 PRO 40 HG3 PRO 40 36.531 16.148 18.654
287 HD2 PRO 40 HD2 PRO 40 35.119 17.864 16.609
288 HD3 PRO 40 HD3 PRO 40 34.456 16.699 17.785
289 H ILE 41 H ILE 41 37.136 20.186 21.323
290 HA ILE 41 HA ILE 41 36.364 22.816 20.434
291 HB ILE 41 HB ILE 41 37.627 23.661 22.356
292 HG12 ILE 41 HG12 ILE 41 38.274 21.993 24.124
293 HG13 ILE 41 HG13 ILE 41 38.292 20.745 22.883
294 HG21 ILE 41 HG21 ILE 41 35.243 22.893 22.432
295 HG22 ILE 41 HG22 ILE 41 35.827 21.325 23.027
296 HG23 ILE 41 HG23 ILE 41 36.074 22.791 23.990
297 HD11 ILE 41 HD11 ILE 41 40.514 21.955 23.657
298 HD12 ILE 41 HD12 ILE 41 40.309 21.547 21.970
299 HD13 ILE 41 HD13 ILE 41 39.993 23.204 22.513
300 H SER 42 H SER 42 39.273 20.976 20.069
301 HA SER 42 HA SER 42 41.143 21.174 18.994
302 HB2 SER 42 HB2 SER 42 39.026 21.140 17.382
303 HB3 SER 42 HB3 SER 42 39.699 22.662 16.833
304 HG SER 42 HG SER 42 40.893 20.070 16.884
305 H TYR 43 H TYR 43 40.841 23.520 20.686
306 HA TYR 43 HA TYR 43 43.353 24.658 19.983
307 HB2 TYR 43 HB2 TYR 43 43.064 26.678 19.156
308 HB3 TYR 43 HB3 TYR 43 41.669 25.929 18.441
309 HD1 TYR 43 HD1 TYR 43 39.417 26.152 19.900
310 HD2 TYR 43 HD2 TYR 43 42.864 28.716 20.196
311 HE1 TYR 43 HE1 TYR 43 38.026 27.897 20.947
312 HE2 TYR 43 HE2 TYR 43 41.475 30.477 21.227
313 HH TYR 43 HH TYR 43 37.933 30.079 21.677
314 H LEU 44 H LEU 44 40.590 25.034 22.184
315 HA LEU 44 HA LEU 44 42.398 26.083 24.312
316 HB2 LEU 44 HB2 LEU 44 41.118 27.847 23.138
317 HB3 LEU 44 HB3 LEU 44 39.611 27.059 23.553
318 HG LEU 44 HG LEU 44 40.209 29.106 24.834
319 HD11 LEU 44 HD11 LEU 44 38.585 27.476 25.729
320 HD12 LEU 44 HD12 LEU 44 39.893 26.691 26.643
321 HD13 LEU 44 HD13 LEU 44 39.454 28.370 26.990
322 HD21 LEU 44 HD21 LEU 44 42.255 27.369 26.251
323 HD22 LEU 44 HD22 LEU 44 42.637 28.661 25.087
324 HD23 LEU 44 HD23 LEU 44 41.836 29.053 26.617
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