Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
594036 | 2mwj RC | 25331 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 THR 1 H1 THR 1 -8.518 6.051 2.548
2 H2 THR 1 H2 THR 1 -7.217 6.793 1.739
3 H3 THR 1 H3 THR 1 -7.190 6.595 3.454
4 HA THR 1 HA THR 1 -6.031 4.688 2.915
5 HB THR 1 HB THR 1 -7.883 2.796 2.167
6 HG21 THR 1 HG21 THR 1 -8.751 2.677 4.471
7 HG22 THR 1 HG22 THR 1 -8.052 4.294 4.872
8 HG23 THR 1 HG23 THR 1 -6.995 2.908 4.425
9 H GLN 2 H GLN 2 -5.602 2.825 1.233
10 HA GLN 2 HA GLN 2 -5.303 4.018 -1.393
11 HB2 GLN 2 HB2 GLN 2 -3.515 2.702 0.208
12 HB3 GLN 2 HB3 GLN 2 -4.420 1.271 -0.324
13 HG2 GLN 2 HG2 GLN 2 -2.364 1.542 -1.657
14 HG3 GLN 2 HG3 GLN 2 -3.775 1.726 -2.728
15 HE21 GLN 2 HE21 GLN 2 -3.108 4.342 -0.588
16 HE22 GLN 2 HE22 GLN 2 -2.234 5.335 -1.656
17 H SER 3 H SER 3 -5.596 2.419 -3.324
18 HA SER 3 HA SER 3 -8.017 0.910 -3.079
19 HB2 SER 3 HB2 SER 3 -6.334 0.503 -5.521
20 HB3 SER 3 HB3 SER 3 -8.037 1.151 -5.373
21 H HIS 4 H HIS 4 -7.816 -1.307 -4.522
22 HA HIS 4 HA HIS 4 -6.235 -3.106 -2.911
23 HB2 HIS 4 HB2 HIS 4 -8.545 -3.598 -4.037
24 HB3 HIS 4 HB3 HIS 4 -7.640 -3.800 -5.575
25 HD1 HIS 4 HD1 HIS 4 -9.140 -6.189 -4.561
26 HD2 HIS 4 HD2 HIS 4 -5.334 -5.351 -3.001
27 HE1 HIS 4 HE1 HIS 4 -8.267 -8.325 -3.539
28 HE2 HIS 4 HE2 HIS 4 -6.259 -7.508 -2.215
29 H TYR 5 H TYR 5 -4.192 -3.685 -3.259
30 HA TYR 5 HA TYR 5 -2.354 -4.269 -4.096
31 HB2 TYR 5 HB2 TYR 5 -3.308 -3.827 -6.969
32 HB3 TYR 5 HB3 TYR 5 -1.897 -4.800 -6.422
33 HD1 TYR 5 HD1 TYR 5 -2.378 -6.828 -4.849
34 HD2 TYR 5 HD2 TYR 5 -5.407 -4.829 -7.144
35 HE1 TYR 5 HE1 TYR 5 -3.835 -8.819 -4.656
36 HE2 TYR 5 HE2 TYR 5 -6.878 -6.820 -6.937
37 HH TYR 5 HH TYR 5 -5.845 -9.721 -5.141
38 H GLY 6 H GLY 6 -3.457 -1.359 -3.878
39 HA2 GLY 6 HA2 GLY 6 -1.507 0.176 -5.374
40 HA3 GLY 6 HA3 GLY 6 -2.645 0.750 -4.114
41 H GLN 7 H GLN 7 -0.296 1.970 -3.851
42 HA GLN 7 HA GLN 7 1.447 0.282 -2.196
43 HB2 GLN 7 HB2 GLN 7 2.385 1.587 -4.043
44 HB3 GLN 7 HB3 GLN 7 1.754 3.098 -3.341
45 HG2 GLN 7 HG2 GLN 7 3.258 2.900 -1.379
46 HG3 GLN 7 HG3 GLN 7 3.721 1.226 -1.849
47 HE21 GLN 7 HE21 GLN 7 5.942 1.876 -1.894
48 HE22 GLN 7 HE22 GLN 7 6.559 2.830 -3.238
49 H CYS 8 H CYS 8 1.744 0.641 0.074
50 HA CYS 8 HA CYS 8 0.295 3.029 1.181
51 HB2 CYS 8 HB2 CYS 8 -0.227 1.687 3.228
52 HB3 CYS 8 HB3 CYS 8 -1.038 1.163 1.746
53 H GLY 9 H GLY 9 3.301 1.499 0.867
54 HA2 GLY 9 HA2 GLY 9 4.488 3.411 2.691
55 HA3 GLY 9 HA3 GLY 9 4.482 1.702 3.283
56 H GLY 10 H GLY 10 6.118 4.002 1.216
57 HA2 GLY 10 HA2 GLY 10 8.125 1.942 0.787
58 HA3 GLY 10 HA3 GLY 10 7.401 2.701 -0.692
59 H ILE 11 H ILE 11 10.139 3.008 0.086
60 HA ILE 11 HA ILE 11 10.556 5.424 1.419
61 HB ILE 11 HB ILE 11 12.059 3.864 -0.693
62 HG12 ILE 11 HG12 ILE 11 11.767 3.118 1.814
63 HG13 ILE 11 HG13 ILE 11 13.399 3.094 1.112
64 HG21 ILE 11 HG21 ILE 11 12.810 6.112 -1.208
65 HG22 ILE 11 HG22 ILE 11 14.068 5.424 -0.127
66 HG23 ILE 11 HG23 ILE 11 12.854 6.584 0.526
67 HD11 ILE 11 HD11 ILE 11 12.462 5.570 2.666
68 HD12 ILE 11 HD12 ILE 11 14.136 5.010 2.304
69 HD13 ILE 11 HD13 ILE 11 13.131 4.119 3.500
70 H GLY 12 H GLY 12 9.843 4.870 -2.008
71 HA2 GLY 12 HA2 GLY 12 9.622 7.798 -2.449
72 HA3 GLY 12 HA3 GLY 12 9.691 6.502 -3.698
73 H TYR 13 H TYR 13 7.657 7.126 -0.763
74 HA TYR 13 HA TYR 13 5.339 7.026 -2.567
75 HB2 TYR 13 HB2 TYR 13 5.722 4.747 -1.545
76 HB3 TYR 13 HB3 TYR 13 5.643 5.503 0.092
77 HD1 TYR 13 HD1 TYR 13 3.714 5.699 -3.141
78 HD2 TYR 13 HD2 TYR 13 3.570 5.234 1.149
79 HE1 TYR 13 HE1 TYR 13 1.244 5.653 -3.223
80 HE2 TYR 13 HE2 TYR 13 1.087 5.210 1.039
81 HH TYR 13 HH TYR 13 -0.510 4.417 -1.074
82 H SER 14 H SER 14 3.719 8.418 -2.149
83 HA SER 14 HA SER 14 3.701 9.852 0.431
84 HB2 SER 14 HB2 SER 14 3.142 11.992 -0.944
85 HB3 SER 14 HB3 SER 14 4.839 11.413 -0.998
86 HG SER 14 HG SER 14 4.565 10.680 -3.013
87 H GLY 15 H GLY 15 1.843 8.177 -1.905
88 HA2 GLY 15 HA2 GLY 15 -0.617 9.525 -1.593
89 HA3 GLY 15 HA3 GLY 15 -0.335 7.817 -2.086
90 HA PRO 16 HA PRO 16 -2.658 8.044 1.956
91 HB2 PRO 16 HB2 PRO 16 -4.056 5.681 0.702
92 HB3 PRO 16 HB3 PRO 16 -4.779 7.128 1.512
93 HG2 PRO 16 HG2 PRO 16 -4.472 6.569 -1.341
94 HG3 PRO 16 HG3 PRO 16 -5.120 8.078 -0.626
95 HD2 PRO 16 HD2 PRO 16 -2.603 7.713 -1.993
96 HD3 PRO 16 HD3 PRO 16 -3.122 9.191 -1.065
97 H THR 17 H THR 17 -1.846 7.089 3.767
98 HA THR 17 HA THR 17 0.014 4.955 3.406
99 HB THR 17 HB THR 17 0.486 5.538 5.853
100 HG1 THR 17 HG1 THR 17 -0.549 7.574 6.391
101 HG21 THR 17 HG21 THR 17 0.289 7.963 3.912
102 HG22 THR 17 HG22 THR 17 1.568 6.707 3.836
103 HG23 THR 17 HG23 THR 17 1.424 7.756 5.292
104 H VAL 18 H VAL 18 -3.132 4.750 3.707
105 HA VAL 18 HA VAL 18 -3.128 2.410 5.539
106 HB VAL 18 HB VAL 18 -5.515 4.294 5.107
107 HG11 VAL 18 HG11 VAL 18 -6.576 3.064 6.876
108 HG12 VAL 18 HG12 VAL 18 -5.025 2.408 7.499
109 HG13 VAL 18 HG13 VAL 18 -5.762 1.743 6.002
110 HG21 VAL 18 HG21 VAL 18 -4.160 5.793 6.263
111 HG22 VAL 18 HG22 VAL 18 -3.218 4.497 7.081
112 HG23 VAL 18 HG23 VAL 18 -4.879 4.884 7.644
113 H CYS 19 H CYS 19 -4.551 0.670 4.689
114 HA CYS 19 HA CYS 19 -4.808 0.824 1.777
115 HB2 CYS 19 HB2 CYS 19 -4.814 -1.394 3.864
116 HB3 CYS 19 HB3 CYS 19 -5.134 -1.727 2.148
117 H ALA 20 H ALA 20 -6.664 0.008 0.673
118 HA ALA 20 HA ALA 20 -8.922 1.211 0.933
119 HB1 ALA 20 HB1 ALA 20 -9.217 -1.655 0.021
120 HB2 ALA 20 HB2 ALA 20 -8.166 -0.539 -0.890
121 HB3 ALA 20 HB3 ALA 20 -9.899 -0.140 -0.673
122 H SER 21 H SER 21 -11.228 0.679 1.560
123 HA SER 21 HA SER 21 -11.130 -0.148 4.278
124 HB2 SER 21 HB2 SER 21 -12.711 1.587 3.271
125 HB3 SER 21 HB3 SER 21 -13.670 0.228 2.590
126 HG SER 21 HG SER 21 -13.660 -0.579 4.856
127 H GLY 22 H GLY 22 -10.882 -2.034 1.736
128 HA2 GLY 22 HA2 GLY 22 -11.771 -4.462 3.102
129 HA3 GLY 22 HA3 GLY 22 -12.014 -4.236 1.330
130 H THR 23 H THR 23 -9.025 -2.837 2.507
131 HA THR 23 HA THR 23 -7.601 -5.269 1.655
132 HB THR 23 HB THR 23 -5.943 -4.092 0.326
133 HG1 THR 23 HG1 THR 23 -7.351 -1.941 1.154
134 HG21 THR 23 HG21 THR 23 -7.959 -2.992 -1.389
135 HG22 THR 23 HG22 THR 23 -8.725 -4.408 -0.564
136 HG23 THR 23 HG23 THR 23 -7.185 -4.606 -1.448
137 H THR 24 H THR 24 -5.417 -5.398 2.444
138 HA THR 24 HA THR 24 -5.015 -3.806 4.932
139 HB THR 24 HB THR 24 -3.556 -6.424 4.762
140 HG1 THR 24 HG1 THR 24 -6.061 -6.407 3.965
141 HG21 THR 24 HG21 THR 24 -5.574 -5.135 6.728
142 HG22 THR 24 HG22 THR 24 -3.773 -4.961 6.850
143 HG23 THR 24 HG23 THR 24 -4.551 -6.579 7.048
144 H CYS 25 H CYS 25 -2.914 -2.979 5.529
145 HA CYS 25 HA CYS 25 -1.087 -2.708 3.266
146 HB2 CYS 25 HB2 CYS 25 -1.606 -0.659 4.723
147 HB3 CYS 25 HB3 CYS 25 -0.834 -1.493 6.082
148 H GLN 26 H GLN 26 -0.042 -4.540 2.864
149 HA GLN 26 HA GLN 26 1.478 -5.673 5.142
150 HB2 GLN 26 HB2 GLN 26 0.868 -7.174 2.569
151 HB3 GLN 26 HB3 GLN 26 1.436 -7.800 4.145
152 HG2 GLN 26 HG2 GLN 26 -0.795 -7.162 5.194
153 HG3 GLN 26 HG3 GLN 26 -1.380 -6.596 3.604
154 HE21 GLN 26 HE21 GLN 26 -2.624 -8.106 2.558
155 HE22 GLN 26 HE22 GLN 26 -2.476 -9.831 2.762
156 H VAL 27 H VAL 27 3.534 -5.302 5.103
157 HA VAL 27 HA VAL 27 4.814 -3.806 3.126
158 HB VAL 27 HB VAL 27 5.949 -5.455 5.413
159 HG11 VAL 27 HG11 VAL 27 7.224 -3.236 3.653
160 HG12 VAL 27 HG12 VAL 27 7.749 -4.960 3.750
161 HG13 VAL 27 HG13 VAL 27 7.936 -3.887 5.173
162 HG21 VAL 27 HG21 VAL 27 4.350 -3.702 6.207
163 HG22 VAL 27 HG22 VAL 27 5.102 -2.483 5.121
164 HG23 VAL 27 HG23 VAL 27 6.029 -3.138 6.512
165 H LEU 28 H LEU 28 6.272 -4.285 1.520
166 HA LEU 28 HA LEU 28 6.357 -7.130 0.714
167 HB2 LEU 28 HB2 LEU 28 6.116 -4.503 -0.743
168 HB3 LEU 28 HB3 LEU 28 7.382 -5.567 -1.442
169 HG LEU 28 HG LEU 28 5.517 -5.988 -2.710
170 HD11 LEU 28 HD11 LEU 28 6.812 -8.011 -1.570
171 HD12 LEU 28 HD12 LEU 28 5.348 -8.304 -2.584
172 HD13 LEU 28 HD13 LEU 28 5.221 -8.322 -0.784
173 HD21 LEU 28 HD21 LEU 28 3.993 -5.515 -0.192
174 HD22 LEU 28 HD22 LEU 28 3.383 -6.920 -1.133
175 HD23 LEU 28 HD23 LEU 28 3.524 -5.311 -1.918
176 H ASN 29 H ASN 29 8.385 -4.261 0.287
177 HA ASN 29 HA ASN 29 10.725 -5.893 1.061
178 HB2 ASN 29 HB2 ASN 29 11.027 -3.841 -1.199
179 HB3 ASN 29 HB3 ASN 29 11.968 -5.348 -0.878
180 HD21 ASN 29 HD21 ASN 29 10.527 -4.207 -3.351
181 HD22 ASN 29 HD22 ASN 29 9.530 -5.554 -3.855
182 HA PRO 30 HA PRO 30 11.604 -2.275 3.385
183 HB2 PRO 30 HB2 PRO 30 14.439 -1.841 2.406
184 HB3 PRO 30 HB3 PRO 30 13.891 -2.409 4.021
185 HG2 PRO 30 HG2 PRO 30 15.151 -4.073 2.147
186 HG3 PRO 30 HG3 PRO 30 13.963 -4.673 3.377
187 HD2 PRO 30 HD2 PRO 30 13.491 -4.047 0.426
188 HD3 PRO 30 HD3 PRO 30 12.850 -5.415 1.449
189 H TYR 31 H TYR 31 11.384 -1.965 0.183
190 HA TYR 31 HA TYR 31 11.524 0.983 0.207
191 HB2 TYR 31 HB2 TYR 31 12.485 -0.947 -2.013
192 HB3 TYR 31 HB3 TYR 31 12.245 0.820 -2.274
193 HD1 TYR 31 HD2 TYR 31 14.353 -1.737 -0.541
194 HD2 TYR 31 HD1 TYR 31 13.691 2.447 -1.248
195 HE1 TYR 31 HE2 TYR 31 16.548 -1.204 0.491
196 HE2 TYR 31 HE1 TYR 31 15.860 2.973 -0.194
197 HH TYR 31 HH TYR 31 17.637 2.151 0.932
198 H TYR 32 H TYR 32 9.364 -1.566 0.185
199 HA TYR 32 HA TYR 32 7.405 -0.026 -1.215
200 HB2 TYR 32 HB2 TYR 32 8.553 -1.130 -3.192
201 HB3 TYR 32 HB3 TYR 32 8.294 -2.734 -2.415
202 HD1 TYR 32 HD2 TYR 32 6.499 0.284 -3.705
203 HD2 TYR 32 HD1 TYR 32 6.306 -3.908 -2.924
204 HE1 TYR 32 HE2 TYR 32 4.160 0.244 -4.559
205 HE2 TYR 32 HE1 TYR 32 4.006 -3.984 -3.842
206 HH TYR 32 HH TYR 32 2.185 -1.056 -4.568
207 H SER 33 H SER 33 5.282 -0.568 -0.563
208 HA SER 33 HA SER 33 4.742 -3.079 0.790
209 HB2 SER 33 HB2 SER 33 3.924 -0.400 2.124
210 HB3 SER 33 HB3 SER 33 3.611 -2.044 2.740
211 HG SER 33 HG SER 33 6.041 -0.582 2.537
212 H GLN 34 H GLN 34 2.446 -3.574 0.523
213 HA GLN 34 HA GLN 34 1.033 -1.559 -1.093
214 HB2 GLN 34 HB2 GLN 34 0.697 -2.945 -2.922
215 HB3 GLN 34 HB3 GLN 34 2.334 -3.439 -2.425
216 HG2 GLN 34 HG2 GLN 34 1.324 -5.440 -1.188
217 HG3 GLN 34 HG3 GLN 34 -0.294 -4.952 -1.769
218 HE21 GLN 34 HE21 GLN 34 -0.146 -4.384 -4.363
219 HE22 GLN 34 HE22 GLN 34 0.413 -5.807 -5.207
220 H CYS 35 H CYS 35 -1.200 -2.366 -1.576
221 HA CYS 35 HA CYS 35 -2.420 -3.217 0.966
222 HB2 CYS 35 HB2 CYS 35 -3.378 -1.577 -1.447
223 HB3 CYS 35 HB3 CYS 35 -4.429 -1.977 -0.050
224 H LEU 36 H LEU 36 -3.524 -5.147 1.129
225 HA LEU 36 HA LEU 36 -4.382 -6.396 -1.423
226 HB2 LEU 36 HB2 LEU 36 -3.559 -7.801 1.143
227 HB3 LEU 36 HB3 LEU 36 -3.927 -8.548 -0.436
228 HG LEU 36 HG LEU 36 -1.586 -8.668 -0.114
229 HD11 LEU 36 HD11 LEU 36 -1.944 -6.276 -2.029
230 HD12 LEU 36 HD12 LEU 36 -2.510 -7.930 -2.419
231 HD13 LEU 36 HD13 LEU 36 -0.751 -7.621 -2.136
232 HD21 LEU 36 HD21 LEU 36 -0.129 -7.073 0.740
233 HD22 LEU 36 HD22 LEU 36 -1.659 -6.525 1.528
234 HD23 LEU 36 HD23 LEU 36 -1.050 -5.682 0.094
235 H1 MAN 101 H1 MAN 37 -10.086 2.435 2.064
236 H2 MAN 101 H2 MAN 37 -8.683 3.216 0.131
237 H3 MAN 101 H3 MAN 37 -9.126 5.568 0.442
238 H4 MAN 101 H4 MAN 37 -11.849 5.077 -0.773
239 H5 MAN 101 H5 MAN 37 -11.105 5.848 2.111
240 H61 MAN 101 H61 MAN 37 -13.735 5.015 0.789
241 H62 MAN 101 H62 MAN 37 -13.303 6.663 1.375
242 HO2 MAN 101 HO2 MAN 37 -11.356 2.999 -0.791
243 HO3 MAN 101 HO3 MAN 37 -8.739 5.966 -1.597
244 HO4 MAN 101 HO4 MAN 37 -11.565 7.171 -1.076
245 HO6 MAN 101 HO6 MAN 37 -13.151 5.651 3.550
246 H1 MAN 102 H1 MAN 38 -7.609 3.106 -6.802
247 H2 MAN 102 H2 MAN 38 -6.225 1.123 -7.468
248 H3 MAN 102 H3 MAN 38 -4.349 1.611 -5.899
249 H4 MAN 102 H4 MAN 38 -3.714 3.837 -7.898
250 H5 MAN 102 H5 MAN 38 -4.515 3.973 -4.943
251 H61 MAN 102 H61 MAN 38 -4.371 6.219 -7.029
252 H62 MAN 102 H62 MAN 38 -3.042 5.856 -5.871
253 HO2 MAN 102 HO2 MAN 38 -5.159 2.143 -9.276
254 HO3 MAN 102 HO3 MAN 38 -2.660 1.420 -7.673
255 HO4 MAN 102 HO4 MAN 38 -2.332 3.521 -5.432
256 HO6 MAN 102 HO6 MAN 38 -5.749 6.302 -5.087
Start of MODEL 2
1 H1 THR 1 H1 THR 1 -8.372 6.315 1.801
2 H2 THR 1 H2 THR 1 -7.012 6.604 2.779
3 H3 THR 1 H3 THR 1 -8.323 5.657 3.357
4 HA THR 1 HA THR 1 -6.214 4.519 2.446
5 HB THR 1 HB THR 1 -7.924 2.585 1.662
6 HG21 THR 1 HG21 THR 1 -8.830 2.238 3.928
7 HG22 THR 1 HG22 THR 1 -8.294 3.876 4.452
8 HG23 THR 1 HG23 THR 1 -7.102 2.639 3.943
9 H GLN 2 H GLN 2 -6.106 2.854 0.228
10 HA GLN 2 HA GLN 2 -6.754 4.555 -2.129
11 HB2 GLN 2 HB2 GLN 2 -4.825 3.008 -3.229
12 HB3 GLN 2 HB3 GLN 2 -4.460 4.463 -2.396
13 HG2 GLN 2 HG2 GLN 2 -4.595 1.764 -0.801
14 HG3 GLN 2 HG3 GLN 2 -3.167 2.124 -1.819
15 HE21 GLN 2 HE21 GLN 2 -3.978 5.119 -0.941
16 HE22 GLN 2 HE22 GLN 2 -2.931 5.221 0.433
17 H SER 3 H SER 3 -5.619 1.217 -2.386
18 HA SER 3 HA SER 3 -8.243 0.272 -3.141
19 HB2 SER 3 HB2 SER 3 -6.370 -0.036 -5.468
20 HB3 SER 3 HB3 SER 3 -8.139 0.398 -5.462
21 H HIS 4 H HIS 4 -7.768 -1.909 -4.447
22 HA HIS 4 HA HIS 4 -6.047 -3.440 -2.708
23 HB2 HIS 4 HB2 HIS 4 -8.271 -4.227 -3.816
24 HB3 HIS 4 HB3 HIS 4 -7.349 -4.376 -5.352
25 HD1 HIS 4 HD1 HIS 4 -8.585 -6.879 -4.282
26 HD2 HIS 4 HD2 HIS 4 -4.909 -5.612 -2.704
27 HE1 HIS 4 HE1 HIS 4 -7.474 -8.901 -3.238
28 HE2 HIS 4 HE2 HIS 4 -5.504 -7.944 -2.010
29 H TYR 5 H TYR 5 -3.953 -3.929 -3.042
30 HA TYR 5 HA TYR 5 -2.042 -4.242 -3.852
31 HB2 TYR 5 HB2 TYR 5 -3.032 -3.978 -6.727
32 HB3 TYR 5 HB3 TYR 5 -1.541 -4.800 -6.148
33 HD1 TYR 5 HD1 TYR 5 -1.875 -6.846 -4.496
34 HD2 TYR 5 HD2 TYR 5 -5.014 -5.171 -6.906
35 HE1 TYR 5 HE1 TYR 5 -3.139 -8.961 -4.320
36 HE2 TYR 5 HE2 TYR 5 -6.292 -7.281 -6.705
37 HH TYR 5 HH TYR 5 -6.237 -9.452 -6.006
38 H GLY 6 H GLY 6 -3.435 -1.522 -3.589
39 HA2 GLY 6 HA2 GLY 6 -1.736 0.318 -5.031
40 HA3 GLY 6 HA3 GLY 6 -2.826 0.658 -3.622
41 H GLN 7 H GLN 7 -0.410 1.981 -3.677
42 HA GLN 7 HA GLN 7 1.366 0.388 -1.992
43 HB2 GLN 7 HB2 GLN 7 2.204 1.688 -3.894
44 HB3 GLN 7 HB3 GLN 7 1.557 3.194 -3.182
45 HG2 GLN 7 HG2 GLN 7 3.142 2.976 -1.228
46 HG3 GLN 7 HG3 GLN 7 3.672 1.363 -1.839
47 HE21 GLN 7 HE21 GLN 7 5.834 2.236 -1.966
48 HE22 GLN 7 HE22 GLN 7 6.264 3.344 -3.279
49 H CYS 8 H CYS 8 1.794 0.901 0.169
50 HA CYS 8 HA CYS 8 0.363 3.231 1.347
51 HB2 CYS 8 HB2 CYS 8 -1.071 1.741 2.238
52 HB3 CYS 8 HB3 CYS 8 0.004 0.358 1.948
53 H GLY 9 H GLY 9 3.347 1.470 1.029
54 HA2 GLY 9 HA2 GLY 9 4.635 3.370 2.865
55 HA3 GLY 9 HA3 GLY 9 4.569 1.644 3.374
56 H GLY 10 H GLY 10 5.732 3.830 0.761
57 HA2 GLY 10 HA2 GLY 10 8.152 2.151 0.725
58 HA3 GLY 10 HA3 GLY 10 7.327 2.522 -0.837
59 H ILE 11 H ILE 11 9.938 3.375 -0.125
60 HA ILE 11 HA ILE 11 10.061 5.983 0.767
61 HB ILE 11 HB ILE 11 11.713 4.169 -0.972
62 HG12 ILE 11 HG12 ILE 11 13.470 5.039 0.782
63 HG13 ILE 11 HG13 ILE 11 12.082 5.764 1.636
64 HG21 ILE 11 HG21 ILE 11 12.226 7.208 -0.768
65 HG22 ILE 11 HG22 ILE 11 11.980 6.239 -2.273
66 HG23 ILE 11 HG23 ILE 11 13.452 5.995 -1.284
67 HD11 ILE 11 HD11 ILE 11 12.345 3.689 2.758
68 HD12 ILE 11 HD12 ILE 11 12.867 2.825 1.287
69 HD13 ILE 11 HD13 ILE 11 11.126 3.202 1.545
70 H GLY 12 H GLY 12 9.068 4.822 -2.381
71 HA2 GLY 12 HA2 GLY 12 8.561 7.602 -3.306
72 HA3 GLY 12 HA3 GLY 12 8.520 6.091 -4.288
73 H TYR 13 H TYR 13 6.896 7.402 -1.313
74 HA TYR 13 HA TYR 13 4.381 6.763 -2.666
75 HB2 TYR 13 HB2 TYR 13 4.987 4.844 -1.067
76 HB3 TYR 13 HB3 TYR 13 5.034 6.040 0.280
77 HD1 TYR 13 HD1 TYR 13 2.813 5.402 -2.699
78 HD2 TYR 13 HD2 TYR 13 3.050 5.887 1.587
79 HE1 TYR 13 HE1 TYR 13 0.370 5.303 -2.554
80 HE2 TYR 13 HE2 TYR 13 0.570 5.804 1.702
81 HH TYR 13 HH TYR 13 -1.119 4.487 -0.324
82 H SER 14 H SER 14 2.825 8.306 -2.492
83 HA SER 14 HA SER 14 2.979 10.246 -0.299
84 HB2 SER 14 HB2 SER 14 3.158 11.036 -3.265
85 HB3 SER 14 HB3 SER 14 2.750 12.192 -1.943
86 HG SER 14 HG SER 14 5.009 10.616 -1.527
87 H GLY 15 H GLY 15 1.065 8.837 0.235
88 HA2 GLY 15 HA2 GLY 15 -1.272 10.232 -0.552
89 HA3 GLY 15 HA3 GLY 15 -1.153 8.567 -1.277
90 HA PRO 16 HA PRO 16 -3.207 8.426 2.924
91 HB2 PRO 16 HB2 PRO 16 -4.702 6.135 1.707
92 HB3 PRO 16 HB3 PRO 16 -5.347 7.660 2.430
93 HG2 PRO 16 HG2 PRO 16 -4.791 6.958 -0.443
94 HG3 PRO 16 HG3 PRO 16 -5.810 8.289 0.178
95 HD2 PRO 16 HD2 PRO 16 -3.331 8.601 -1.045
96 HD3 PRO 16 HD3 PRO 16 -3.943 9.774 0.208
97 H THR 17 H THR 17 -2.274 7.303 4.640
98 HA THR 17 HA THR 17 -0.525 5.109 3.919
99 HB THR 17 HB THR 17 -0.962 6.456 6.613
100 HG1 THR 17 HG1 THR 17 0.127 7.964 5.640
101 HG21 THR 17 HG21 THR 17 0.312 4.632 7.291
102 HG22 THR 17 HG22 THR 17 1.677 5.525 6.534
103 HG23 THR 17 HG23 THR 17 0.840 4.220 5.624
104 H VAL 18 H VAL 18 -3.178 4.329 3.530
105 HA VAL 18 HA VAL 18 -3.489 2.194 5.490
106 HB VAL 18 HB VAL 18 -5.852 4.075 4.957
107 HG11 VAL 18 HG11 VAL 18 -7.080 2.675 6.525
108 HG12 VAL 18 HG12 VAL 18 -5.583 1.973 7.220
109 HG13 VAL 18 HG13 VAL 18 -6.161 1.449 5.608
110 HG21 VAL 18 HG21 VAL 18 -4.274 3.862 7.584
111 HG22 VAL 18 HG22 VAL 18 -5.732 4.873 7.269
112 HG23 VAL 18 HG23 VAL 18 -4.179 5.255 6.452
113 H CYS 19 H CYS 19 -4.383 0.424 4.455
114 HA CYS 19 HA CYS 19 -4.630 0.679 1.582
115 HB2 CYS 19 HB2 CYS 19 -4.503 -1.529 3.677
116 HB3 CYS 19 HB3 CYS 19 -4.768 -1.948 1.975
117 H ALA 20 H ALA 20 -6.476 -0.256 0.397
118 HA ALA 20 HA ALA 20 -8.829 0.924 0.635
119 HB1 ALA 20 HB1 ALA 20 -9.669 -0.540 -0.998
120 HB2 ALA 20 HB2 ALA 20 -8.964 -1.974 -0.182
121 HB3 ALA 20 HB3 ALA 20 -7.898 -0.885 -1.077
122 H SER 21 H SER 21 -11.141 0.351 1.390
123 HA SER 21 HA SER 21 -11.107 -0.486 4.006
124 HB2 SER 21 HB2 SER 21 -13.516 -0.321 2.103
125 HB3 SER 21 HB3 SER 21 -13.537 -0.174 3.909
126 HG SER 21 HG SER 21 -13.239 1.844 2.299
127 H GLY 22 H GLY 22 -10.608 -2.497 1.637
128 HA2 GLY 22 HA2 GLY 22 -11.583 -4.868 3.048
129 HA3 GLY 22 HA3 GLY 22 -11.717 -4.738 1.250
130 H THR 23 H THR 23 -8.891 -3.151 2.476
131 HA THR 23 HA THR 23 -7.293 -5.545 1.942
132 HB THR 23 HB THR 23 -5.659 -4.360 0.596
133 HG1 THR 23 HG1 THR 23 -6.853 -2.283 1.446
134 HG21 THR 23 HG21 THR 23 -8.220 -5.152 -0.379
135 HG22 THR 23 HG22 THR 23 -6.703 -4.912 -1.280
136 HG23 THR 23 HG23 THR 23 -7.881 -3.559 -1.175
137 H THR 24 H THR 24 -5.270 -5.576 2.903
138 HA THR 24 HA THR 24 -4.833 -3.634 5.127
139 HB THR 24 HB THR 24 -5.250 -5.917 5.865
140 HG1 THR 24 HG1 THR 24 -3.072 -6.346 6.743
141 HG21 THR 24 HG21 THR 24 -4.639 -7.568 4.401
142 HG22 THR 24 HG22 THR 24 -2.962 -7.408 5.039
143 HG23 THR 24 HG23 THR 24 -3.463 -6.550 3.545
144 H CYS 25 H CYS 25 -2.480 -3.272 5.781
145 HA CYS 25 HA CYS 25 -0.889 -2.765 3.332
146 HB2 CYS 25 HB2 CYS 25 -1.510 -0.770 4.772
147 HB3 CYS 25 HB3 CYS 25 -0.618 -1.497 6.124
148 H GLN 26 H GLN 26 0.530 -4.324 2.910
149 HA GLN 26 HA GLN 26 2.073 -5.366 5.218
150 HB2 GLN 26 HB2 GLN 26 1.522 -7.018 2.728
151 HB3 GLN 26 HB3 GLN 26 2.206 -7.553 4.279
152 HG2 GLN 26 HG2 GLN 26 0.026 -7.333 5.429
153 HG3 GLN 26 HG3 GLN 26 -0.718 -6.549 4.001
154 HE21 GLN 26 HE21 GLN 26 -2.178 -7.994 3.202
155 HE22 GLN 26 HE22 GLN 26 -1.839 -9.664 2.857
156 H VAL 27 H VAL 27 4.158 -5.028 5.067
157 HA VAL 27 HA VAL 27 5.273 -3.539 3.007
158 HB VAL 27 HB VAL 27 6.691 -5.140 5.163
159 HG11 VAL 27 HG11 VAL 27 7.584 -2.918 3.201
160 HG12 VAL 27 HG12 VAL 27 8.376 -4.497 3.546
161 HG13 VAL 27 HG13 VAL 27 8.418 -3.175 4.767
162 HG21 VAL 27 HG21 VAL 27 5.636 -2.222 5.125
163 HG22 VAL 27 HG22 VAL 27 6.693 -2.927 6.390
164 HG23 VAL 27 HG23 VAL 27 5.028 -3.552 6.166
165 H LEU 28 H LEU 28 6.745 -3.949 1.373
166 HA LEU 28 HA LEU 28 6.713 -6.756 0.462
167 HB2 LEU 28 HB2 LEU 28 6.092 -4.259 -0.847
168 HB3 LEU 28 HB3 LEU 28 7.668 -4.707 -1.529
169 HG LEU 28 HG LEU 28 6.261 -5.673 -3.037
170 HD11 LEU 28 HD11 LEU 28 6.185 -8.095 -1.200
171 HD12 LEU 28 HD12 LEU 28 7.786 -7.459 -1.727
172 HD13 LEU 28 HD13 LEU 28 6.574 -7.991 -2.952
173 HD21 LEU 28 HD21 LEU 28 4.178 -5.074 -1.862
174 HD22 LEU 28 HD22 LEU 28 4.405 -6.425 -0.691
175 HD23 LEU 28 HD23 LEU 28 4.111 -6.789 -2.430
176 H ASN 29 H ASN 29 8.764 -3.884 0.141
177 HA ASN 29 HA ASN 29 11.149 -5.537 0.675
178 HB2 ASN 29 HB2 ASN 29 11.178 -3.284 -1.454
179 HB3 ASN 29 HB3 ASN 29 12.352 -4.632 -1.221
180 HD21 ASN 29 HD21 ASN 29 9.969 -3.586 -3.302
181 HD22 ASN 29 HD22 ASN 29 9.465 -5.157 -3.886
182 HA PRO 30 HA PRO 30 11.932 -2.093 3.292
183 HB2 PRO 30 HB2 PRO 30 14.745 -1.605 2.169
184 HB3 PRO 30 HB3 PRO 30 14.276 -2.030 3.854
185 HG2 PRO 30 HG2 PRO 30 15.451 -3.877 2.165
186 HG3 PRO 30 HG3 PRO 30 14.145 -4.366 3.323
187 HD2 PRO 30 HD2 PRO 30 13.899 -3.771 0.328
188 HD3 PRO 30 HD3 PRO 30 13.163 -5.117 1.314
189 H TYR 31 H TYR 31 11.640 -1.565 0.149
190 HA TYR 31 HA TYR 31 11.618 1.360 0.322
191 HB2 TYR 31 HB2 TYR 31 12.907 -0.398 -1.846
192 HB3 TYR 31 HB3 TYR 31 12.309 1.249 -2.258
193 HD1 TYR 31 HD2 TYR 31 14.655 -0.581 0.082
194 HD2 TYR 31 HD1 TYR 31 13.555 3.152 -1.737
195 HE1 TYR 31 HE2 TYR 31 16.601 0.516 1.148
196 HE2 TYR 31 HE1 TYR 31 15.534 4.227 -0.712
197 HH TYR 31 HH TYR 31 17.136 3.028 1.860
198 H TYR 32 H TYR 32 9.576 -1.232 0.167
199 HA TYR 32 HA TYR 32 7.590 0.328 -1.188
200 HB2 TYR 32 HB2 TYR 32 8.724 -0.670 -3.205
201 HB3 TYR 32 HB3 TYR 32 8.534 -2.307 -2.478
202 HD1 TYR 32 HD2 TYR 32 6.579 0.694 -3.551
203 HD2 TYR 32 HD1 TYR 32 6.624 -3.546 -3.110
204 HE1 TYR 32 HE2 TYR 32 4.239 0.581 -4.421
205 HE2 TYR 32 HE1 TYR 32 4.321 -3.688 -4.003
206 HH TYR 32 HH TYR 32 2.737 -2.336 -5.334
207 H SER 33 H SER 33 5.444 -0.279 -0.571
208 HA SER 33 HA SER 33 5.020 -2.863 0.694
209 HB2 SER 33 HB2 SER 33 4.050 -0.294 2.116
210 HB3 SER 33 HB3 SER 33 3.781 -1.974 2.641
211 HG SER 33 HG SER 33 6.189 -0.449 2.566
212 H GLN 34 H GLN 34 2.855 -3.550 0.331
213 HA GLN 34 HA GLN 34 1.308 -1.628 -1.298
214 HB2 GLN 34 HB2 GLN 34 0.795 -3.210 -2.911
215 HB3 GLN 34 HB3 GLN 34 2.531 -3.466 -2.608
216 HG2 GLN 34 HG2 GLN 34 2.045 -5.478 -1.165
217 HG3 GLN 34 HG3 GLN 34 0.301 -5.229 -1.359
218 HE21 GLN 34 HE21 GLN 34 -0.084 -4.725 -4.014
219 HE22 GLN 34 HE22 GLN 34 0.399 -6.168 -4.900
220 H CYS 35 H CYS 35 -0.941 -2.636 -1.651
221 HA CYS 35 HA CYS 35 -2.087 -3.271 0.968
222 HB2 CYS 35 HB2 CYS 35 -3.181 -1.857 -1.533
223 HB3 CYS 35 HB3 CYS 35 -4.183 -2.196 -0.092
224 H LEU 36 H LEU 36 -3.308 -5.148 1.317
225 HA LEU 36 HA LEU 36 -4.024 -6.692 -1.113
226 HB2 LEU 36 HB2 LEU 36 -3.185 -7.886 1.546
227 HB3 LEU 36 HB3 LEU 36 -3.445 -8.721 -0.008
228 HG LEU 36 HG LEU 36 -1.119 -8.676 0.447
229 HD11 LEU 36 HD11 LEU 36 -0.288 -7.867 -1.629
230 HD12 LEU 36 HD12 LEU 36 -1.410 -6.458 -1.654
231 HD13 LEU 36 HD13 LEU 36 -2.052 -8.104 -1.945
232 HD21 LEU 36 HD21 LEU 36 -0.734 -5.661 0.433
233 HD22 LEU 36 HD22 LEU 36 0.182 -6.955 1.251
234 HD23 LEU 36 HD23 LEU 36 -1.407 -6.396 1.903
235 H1 MAN 101 H1 MAN 37 -10.170 2.053 1.676
236 H2 MAN 101 H2 MAN 37 -8.869 2.835 -0.316
237 H3 MAN 101 H3 MAN 37 -9.508 5.238 0.131
238 H4 MAN 101 H4 MAN 37 -12.114 4.445 -1.182
239 H5 MAN 101 H5 MAN 37 -11.463 5.396 1.681
240 H61 MAN 101 H61 MAN 37 -13.980 4.208 0.397
241 H62 MAN 101 H62 MAN 37 -13.728 5.945 0.832
242 HO2 MAN 101 HO2 MAN 37 -10.521 1.353 -0.892
243 HO3 MAN 101 HO3 MAN 37 -9.654 4.197 -2.481
244 HO4 MAN 101 HO4 MAN 37 -11.144 6.581 -1.542
245 HO6 MAN 101 HO6 MAN 37 -14.860 4.704 2.507
246 H1 MAN 102 H1 MAN 38 -7.664 2.073 -7.180
247 H2 MAN 102 H2 MAN 38 -5.787 0.436 -7.302
248 H3 MAN 102 H3 MAN 38 -4.455 1.517 -5.485
249 H4 MAN 102 H4 MAN 38 -3.809 3.586 -7.633
250 H5 MAN 102 H5 MAN 38 -5.374 3.909 -5.015
251 H61 MAN 102 H61 MAN 38 -5.035 5.838 -7.362
252 H62 MAN 102 H62 MAN 38 -4.147 5.945 -5.800
253 HO2 MAN 102 HO2 MAN 38 -4.882 1.205 -9.160
254 HO3 MAN 102 HO3 MAN 38 -3.341 0.060 -6.867
255 HO4 MAN 102 HO4 MAN 38 -2.967 3.446 -4.878
256 HO6 MAN 102 HO6 MAN 38 -6.992 5.956 -6.108
Start of MODEL 3
1 H1 THR 1 H1 THR 1 -6.623 5.997 3.842
2 H2 THR 1 H2 THR 1 -8.227 5.457 3.572
3 H3 THR 1 H3 THR 1 -7.450 6.424 2.398
4 HA THR 1 HA THR 1 -5.902 4.218 2.816
5 HB THR 1 HB THR 1 -7.798 2.473 2.014
6 HG21 THR 1 HG21 THR 1 -6.778 2.310 4.229
7 HG22 THR 1 HG22 THR 1 -8.508 1.933 4.288
8 HG23 THR 1 HG23 THR 1 -7.910 3.510 4.932
9 H GLN 2 H GLN 2 -6.135 2.753 0.419
10 HA GLN 2 HA GLN 2 -6.874 4.709 -1.693
11 HB2 GLN 2 HB2 GLN 2 -5.045 3.316 -3.099
12 HB3 GLN 2 HB3 GLN 2 -4.602 4.658 -2.143
13 HG2 GLN 2 HG2 GLN 2 -4.651 1.860 -0.744
14 HG3 GLN 2 HG3 GLN 2 -3.375 2.170 -1.956
15 HE21 GLN 2 HE21 GLN 2 -4.166 5.120 -0.570
16 HE22 GLN 2 HE22 GLN 2 -2.823 5.151 0.540
17 H SER 3 H SER 3 -5.733 1.471 -2.402
18 HA SER 3 HA SER 3 -8.411 0.564 -3.090
19 HB2 SER 3 HB2 SER 3 -6.476 0.348 -5.407
20 HB3 SER 3 HB3 SER 3 -8.258 0.727 -5.412
21 H HIS 4 H HIS 4 -8.030 -1.572 -4.454
22 HA HIS 4 HA HIS 4 -6.283 -3.223 -2.843
23 HB2 HIS 4 HB2 HIS 4 -8.579 -3.959 -3.782
24 HB3 HIS 4 HB3 HIS 4 -7.826 -3.991 -5.414
25 HD1 HIS 4 HD1 HIS 4 -8.894 -6.590 -4.609
26 HD2 HIS 4 HD2 HIS 4 -5.192 -5.417 -3.018
27 HE1 HIS 4 HE1 HIS 4 -7.729 -8.686 -3.813
28 HE2 HIS 4 HE2 HIS 4 -5.711 -7.833 -2.541
29 H TYR 5 H TYR 5 -4.210 -3.732 -3.347
30 HA TYR 5 HA TYR 5 -2.410 -4.096 -4.360
31 HB2 TYR 5 HB2 TYR 5 -3.673 -3.551 -7.099
32 HB3 TYR 5 HB3 TYR 5 -2.130 -4.397 -6.802
33 HD1 TYR 5 HD1 TYR 5 -2.270 -6.542 -5.176
34 HD2 TYR 5 HD2 TYR 5 -5.590 -4.804 -7.284
35 HE1 TYR 5 HE1 TYR 5 -3.467 -8.700 -5.070
36 HE2 TYR 5 HE2 TYR 5 -6.801 -6.966 -7.154
37 HH TYR 5 HH TYR 5 -5.292 -9.897 -5.950
38 H GLY 6 H GLY 6 -3.649 -1.316 -3.792
39 HA2 GLY 6 HA2 GLY 6 -1.844 0.492 -5.123
40 HA3 GLY 6 HA3 GLY 6 -2.784 0.779 -3.610
41 H GLN 7 H GLN 7 -0.339 1.899 -3.677
42 HA GLN 7 HA GLN 7 1.326 0.102 -2.043
43 HB2 GLN 7 HB2 GLN 7 2.481 1.119 -3.906
44 HB3 GLN 7 HB3 GLN 7 1.847 2.749 -3.504
45 HG2 GLN 7 HG2 GLN 7 3.177 2.906 -1.471
46 HG3 GLN 7 HG3 GLN 7 3.571 1.158 -1.503
47 HE21 GLN 7 HE21 GLN 7 5.750 2.052 -1.258
48 HE22 GLN 7 HE22 GLN 7 6.633 2.398 -2.748
49 H CYS 8 H CYS 8 1.533 0.549 0.158
50 HA CYS 8 HA CYS 8 0.255 3.082 1.122
51 HB2 CYS 8 HB2 CYS 8 -1.187 1.746 2.205
52 HB3 CYS 8 HB3 CYS 8 -0.229 0.300 1.796
53 H GLY 9 H GLY 9 3.160 1.185 1.074
54 HA2 GLY 9 HA2 GLY 9 4.389 3.053 3.027
55 HA3 GLY 9 HA3 GLY 9 4.501 1.265 3.218
56 H GLY 10 H GLY 10 5.897 4.071 1.701
57 HA2 GLY 10 HA2 GLY 10 8.098 2.409 1.114
58 HA3 GLY 10 HA3 GLY 10 7.260 2.906 -0.409
59 H ILE 11 H ILE 11 9.668 3.851 -0.266
60 HA ILE 11 HA ILE 11 9.655 6.342 1.188
61 HB ILE 11 HB ILE 11 11.896 6.301 0.900
62 HG12 ILE 11 HG12 ILE 11 12.136 6.710 -1.455
63 HG13 ILE 11 HG13 ILE 11 13.177 5.354 -0.988
64 HG21 ILE 11 HG21 ILE 11 11.370 3.349 0.205
65 HG22 ILE 11 HG22 ILE 11 11.068 4.042 1.848
66 HG23 ILE 11 HG23 ILE 11 12.716 4.031 1.157
67 HD11 ILE 11 HD11 ILE 11 10.789 4.059 -1.945
68 HD12 ILE 11 HD12 ILE 11 12.334 4.252 -2.842
69 HD13 ILE 11 HD13 ILE 11 11.041 5.462 -3.044
70 H GLY 12 H GLY 12 8.532 5.264 -1.726
71 HA2 GLY 12 HA2 GLY 12 8.715 7.852 -3.169
72 HA3 GLY 12 HA3 GLY 12 8.774 6.206 -3.933
73 H TYR 13 H TYR 13 6.822 7.098 -1.198
74 HA TYR 13 HA TYR 13 4.410 6.879 -2.852
75 HB2 TYR 13 HB2 TYR 13 4.860 4.689 -1.806
76 HB3 TYR 13 HB3 TYR 13 5.053 5.461 -0.182
77 HD1 TYR 13 HD1 TYR 13 2.699 5.444 -3.111
78 HD2 TYR 13 HD2 TYR 13 3.129 5.446 1.178
79 HE1 TYR 13 HE1 TYR 13 0.238 5.594 -2.858
80 HE2 TYR 13 HE2 TYR 13 0.660 5.542 1.411
81 HH TYR 13 HH TYR 13 -1.191 4.628 -0.452
82 H SER 14 H SER 14 3.350 8.733 -2.749
83 HA SER 14 HA SER 14 3.194 10.153 -0.173
84 HB2 SER 14 HB2 SER 14 2.890 12.266 -1.704
85 HB3 SER 14 HB3 SER 14 4.523 11.573 -1.430
86 HG SER 14 HG SER 14 2.979 11.585 -3.756
87 H GLY 15 H GLY 15 1.352 8.544 0.088
88 HA2 GLY 15 HA2 GLY 15 -1.042 10.046 -0.493
89 HA3 GLY 15 HA3 GLY 15 -0.928 8.385 -1.221
90 HA PRO 16 HA PRO 16 -2.829 8.282 3.062
91 HB2 PRO 16 HB2 PRO 16 -4.509 6.116 1.873
92 HB3 PRO 16 HB3 PRO 16 -5.034 7.650 2.658
93 HG2 PRO 16 HG2 PRO 16 -4.676 7.002 -0.254
94 HG3 PRO 16 HG3 PRO 16 -5.562 8.382 0.465
95 HD2 PRO 16 HD2 PRO 16 -3.130 8.557 -0.891
96 HD3 PRO 16 HD3 PRO 16 -3.614 9.743 0.405
97 H THR 17 H THR 17 -1.881 7.059 4.699
98 HA THR 17 HA THR 17 -0.193 4.910 3.820
99 HB THR 17 HB THR 17 -0.631 6.018 6.629
100 HG1 THR 17 HG1 THR 17 0.788 6.908 4.375
101 HG21 THR 17 HG21 THR 17 2.007 5.383 6.532
102 HG22 THR 17 HG22 THR 17 1.444 4.195 5.291
103 HG23 THR 17 HG23 THR 17 0.771 4.159 6.954
104 H VAL 18 H VAL 18 -2.870 4.120 3.488
105 HA VAL 18 HA VAL 18 -3.002 1.828 5.264
106 HB VAL 18 HB VAL 18 -5.456 3.659 5.133
107 HG11 VAL 18 HG11 VAL 18 -4.857 1.458 7.224
108 HG12 VAL 18 HG12 VAL 18 -5.587 0.984 5.654
109 HG13 VAL 18 HG13 VAL 18 -6.447 2.121 6.727
110 HG21 VAL 18 HG21 VAL 18 -5.062 4.138 7.590
111 HG22 VAL 18 HG22 VAL 18 -3.874 4.925 6.487
112 HG23 VAL 18 HG23 VAL 18 -3.415 3.448 7.408
113 H CYS 19 H CYS 19 -4.204 0.159 4.223
114 HA CYS 19 HA CYS 19 -4.532 0.594 1.359
115 HB2 CYS 19 HB2 CYS 19 -4.421 -1.741 3.331
116 HB3 CYS 19 HB3 CYS 19 -4.650 -2.036 1.599
117 H ALA 20 H ALA 20 -6.540 -0.179 0.257
118 HA ALA 20 HA ALA 20 -8.814 0.979 0.758
119 HB1 ALA 20 HB1 ALA 20 -9.060 -1.879 -0.158
120 HB2 ALA 20 HB2 ALA 20 -8.078 -0.743 -1.092
121 HB3 ALA 20 HB3 ALA 20 -9.821 -0.382 -0.825
122 H SER 21 H SER 21 -11.077 0.330 1.463
123 HA SER 21 HA SER 21 -10.846 -0.571 4.159
124 HB2 SER 21 HB2 SER 21 -12.853 0.744 2.457
125 HB3 SER 21 HB3 SER 21 -13.645 -0.410 3.570
126 HG SER 21 HG SER 21 -12.290 0.631 5.235
127 H GLY 22 H GLY 22 -10.608 -2.412 1.698
128 HA2 GLY 22 HA2 GLY 22 -11.542 -4.828 3.055
129 HA3 GLY 22 HA3 GLY 22 -11.741 -4.610 1.273
130 H THR 23 H THR 23 -8.854 -3.055 2.370
131 HA THR 23 HA THR 23 -7.303 -5.434 1.760
132 HB THR 23 HB THR 23 -5.725 -4.362 0.376
133 HG1 THR 23 HG1 THR 23 -5.649 -2.374 0.557
134 HG21 THR 23 HG21 THR 23 -8.135 -3.606 -1.248
135 HG22 THR 23 HG22 THR 23 -8.192 -5.251 -0.481
136 HG23 THR 23 HG23 THR 23 -6.807 -4.803 -1.510
137 H THR 24 H THR 24 -5.302 -5.597 2.679
138 HA THR 24 HA THR 24 -4.815 -3.706 4.920
139 HB THR 24 HB THR 24 -3.467 -6.422 4.863
140 HG1 THR 24 HG1 THR 24 -5.463 -7.065 5.996
141 HG21 THR 24 HG21 THR 24 -4.899 -4.666 7.001
142 HG22 THR 24 HG22 THR 24 -3.106 -4.777 6.799
143 HG23 THR 24 HG23 THR 24 -4.035 -6.211 7.333
144 H CYS 25 H CYS 25 -2.466 -3.374 5.589
145 HA CYS 25 HA CYS 25 -0.872 -2.965 3.150
146 HB2 CYS 25 HB2 CYS 25 -1.484 -1.014 4.678
147 HB3 CYS 25 HB3 CYS 25 -0.469 -1.746 5.944
148 H GLN 26 H GLN 26 0.487 -4.552 2.690
149 HA GLN 26 HA GLN 26 1.918 -5.800 4.978
150 HB2 GLN 26 HB2 GLN 26 1.337 -7.178 2.336
151 HB3 GLN 26 HB3 GLN 26 2.029 -7.895 3.807
152 HG2 GLN 26 HG2 GLN 26 -0.099 -7.647 5.053
153 HG3 GLN 26 HG3 GLN 26 -0.857 -6.741 3.703
154 HE21 GLN 26 HE21 GLN 26 -2.374 -8.039 2.735
155 HE22 GLN 26 HE22 GLN 26 -2.143 -9.721 2.381
156 H VAL 27 H VAL 27 3.933 -5.247 5.041
157 HA VAL 27 HA VAL 27 5.189 -3.751 3.050
158 HB VAL 27 HB VAL 27 6.382 -5.217 5.429
159 HG11 VAL 27 HG11 VAL 27 8.214 -4.671 3.910
160 HG12 VAL 27 HG12 VAL 27 8.202 -3.405 5.178
161 HG13 VAL 27 HG13 VAL 27 7.553 -3.038 3.545
162 HG21 VAL 27 HG21 VAL 27 4.617 -3.599 6.135
163 HG22 VAL 27 HG22 VAL 27 5.323 -2.313 5.103
164 HG23 VAL 27 HG23 VAL 27 6.237 -2.936 6.514
165 H LEU 28 H LEU 28 6.727 -4.169 1.483
166 HA LEU 28 HA LEU 28 6.958 -7.013 0.764
167 HB2 LEU 28 HB2 LEU 28 6.440 -4.494 -0.688
168 HB3 LEU 28 HB3 LEU 28 7.968 -5.167 -1.298
169 HG LEU 28 HG LEU 28 6.430 -5.978 -2.752
170 HD11 LEU 28 HD11 LEU 28 7.976 -7.742 -1.450
171 HD12 LEU 28 HD12 LEU 28 6.771 -8.300 -2.669
172 HD13 LEU 28 HD13 LEU 28 6.396 -8.406 -0.908
173 HD21 LEU 28 HD21 LEU 28 4.486 -5.394 -1.010
174 HD22 LEU 28 HD22 LEU 28 4.533 -7.151 -0.664
175 HD23 LEU 28 HD23 LEU 28 4.202 -6.578 -2.345
176 H ASN 29 H ASN 29 8.848 -4.017 0.444
177 HA ASN 29 HA ASN 29 11.249 -5.482 1.322
178 HB2 ASN 29 HB2 ASN 29 11.735 -3.416 -0.846
179 HB3 ASN 29 HB3 ASN 29 12.499 -5.020 -0.571
180 HD21 ASN 29 HD21 ASN 29 11.227 -3.512 -3.008
181 HD22 ASN 29 HD22 ASN 29 10.199 -4.753 -3.685
182 HA PRO 30 HA PRO 30 11.729 -1.776 3.659
183 HB2 PRO 30 HB2 PRO 30 14.590 -1.195 2.842
184 HB3 PRO 30 HB3 PRO 30 13.976 -1.762 4.434
185 HG2 PRO 30 HG2 PRO 30 15.448 -3.384 2.685
186 HG3 PRO 30 HG3 PRO 30 14.213 -4.031 3.842
187 HD2 PRO 30 HD2 PRO 30 13.899 -3.466 0.853
188 HD3 PRO 30 HD3 PRO 30 13.290 -4.869 1.849
189 H TYR 31 H TYR 31 11.474 -1.527 0.529
190 HA TYR 31 HA TYR 31 11.513 1.390 0.479
191 HB2 TYR 31 HB2 TYR 31 12.829 -0.527 -1.540
192 HB3 TYR 31 HB3 TYR 31 12.256 1.091 -2.083
193 HD1 TYR 31 HD1 TYR 31 13.174 3.088 -1.231
194 HD2 TYR 31 HD2 TYR 31 14.838 -0.648 0.002
195 HE1 TYR 31 HE1 TYR 31 15.136 4.294 -0.307
196 HE2 TYR 31 HE2 TYR 31 16.833 0.548 0.890
197 HH TYR 31 HH TYR 31 17.881 3.224 0.152
198 H TYR 32 H TYR 32 9.517 -1.263 0.394
199 HA TYR 32 HA TYR 32 7.515 0.127 -1.084
200 HB2 TYR 32 HB2 TYR 32 8.813 -0.811 -3.029
201 HB3 TYR 32 HB3 TYR 32 8.717 -2.450 -2.293
202 HD1 TYR 32 HD2 TYR 32 6.660 0.360 -3.649
203 HD2 TYR 32 HD1 TYR 32 6.873 -3.825 -2.840
204 HE1 TYR 32 HE2 TYR 32 4.433 0.052 -4.706
205 HE2 TYR 32 HE1 TYR 32 4.688 -4.167 -3.932
206 HH TYR 32 HH TYR 32 3.132 -3.117 -5.363
207 H SER 33 H SER 33 5.434 -0.573 -0.545
208 HA SER 33 HA SER 33 5.017 -3.141 0.767
209 HB2 SER 33 HB2 SER 33 3.977 -0.517 2.005
210 HB3 SER 33 HB3 SER 33 3.760 -2.148 2.679
211 HG SER 33 HG SER 33 6.078 -2.123 3.052
212 H GLN 34 H GLN 34 3.007 -3.951 0.269
213 HA GLN 34 HA GLN 34 1.499 -2.317 -1.652
214 HB2 GLN 34 HB2 GLN 34 2.598 -4.921 -1.757
215 HB3 GLN 34 HB3 GLN 34 0.887 -5.236 -1.606
216 HG2 GLN 34 HG2 GLN 34 1.242 -3.074 -3.588
217 HG3 GLN 34 HG3 GLN 34 2.545 -4.294 -3.856
218 HE21 GLN 34 HE21 GLN 34 0.037 -3.494 -5.442
219 HE22 GLN 34 HE22 GLN 34 -0.627 -5.067 -5.799
220 H CYS 35 H CYS 35 -0.809 -3.038 -1.898
221 HA CYS 35 HA CYS 35 -2.141 -3.334 0.711
222 HB2 CYS 35 HB2 CYS 35 -2.855 -1.746 -1.830
223 HB3 CYS 35 HB3 CYS 35 -4.062 -2.016 -0.551
224 H LEU 36 H LEU 36 -3.363 -5.190 0.976
225 HA LEU 36 HA LEU 36 -4.299 -6.464 -1.517
226 HB2 LEU 36 HB2 LEU 36 -3.340 -8.105 0.848
227 HB3 LEU 36 HB3 LEU 36 -3.556 -8.563 -0.861
228 HG LEU 36 HG LEU 36 -1.239 -8.576 -0.311
229 HD11 LEU 36 HD11 LEU 36 -0.685 -7.730 -2.353
230 HD12 LEU 36 HD12 LEU 36 -1.014 -6.040 -1.832
231 HD13 LEU 36 HD13 LEU 36 -2.347 -7.045 -2.450
232 HD21 LEU 36 HD21 LEU 36 -1.692 -6.568 1.531
233 HD22 LEU 36 HD22 LEU 36 -0.833 -5.648 0.277
234 HD23 LEU 36 HD23 LEU 36 -0.069 -7.113 0.960
235 H1 MAN 101 H1 MAN 37 -10.019 2.063 2.167
236 H2 MAN 101 H2 MAN 37 -8.850 2.970 0.161
237 H3 MAN 101 H3 MAN 37 -9.306 5.329 0.874
238 H4 MAN 101 H4 MAN 37 -12.042 4.854 -0.308
239 H5 MAN 101 H5 MAN 37 -11.118 5.472 2.562
240 H61 MAN 101 H61 MAN 37 -13.815 4.500 1.468
241 H62 MAN 101 H62 MAN 37 -13.422 6.205 1.889
242 HO2 MAN 101 HO2 MAN 37 -11.644 2.827 -0.357
243 HO3 MAN 101 HO3 MAN 37 -9.883 4.834 -1.860
244 HO4 MAN 101 HO4 MAN 37 -10.577 7.140 0.384
245 HO6 MAN 101 HO6 MAN 37 -13.021 4.074 3.765
246 H1 MAN 102 H1 MAN 38 -7.998 2.566 -6.935
247 H2 MAN 102 H2 MAN 38 -6.223 0.858 -7.366
248 H3 MAN 102 H3 MAN 38 -4.661 1.773 -5.649
249 H4 MAN 102 H4 MAN 38 -4.114 3.909 -7.766
250 H5 MAN 102 H5 MAN 38 -5.365 4.153 -4.978
251 H61 MAN 102 H61 MAN 38 -5.135 6.200 -7.244
252 H62 MAN 102 H62 MAN 38 -4.136 6.170 -5.746
253 HO2 MAN 102 HO2 MAN 38 -6.071 3.310 -8.770
254 HO3 MAN 102 HO3 MAN 38 -2.875 1.114 -6.743
255 HO4 MAN 102 HO4 MAN 38 -2.273 3.767 -6.691
256 HO6 MAN 102 HO6 MAN 38 -6.997 6.363 -5.841
Start of MODEL 4
1 H1 THR 1 H1 THR 1 -8.364 6.316 2.958
2 H2 THR 1 H2 THR 1 -9.353 6.188 1.610
3 H3 THR 1 H3 THR 1 -7.927 7.104 1.486
4 HA THR 1 HA THR 1 -6.691 4.987 1.862
5 HB THR 1 HB THR 1 -8.311 2.852 1.481
6 HG21 THR 1 HG21 THR 1 -7.557 2.673 3.634
7 HG22 THR 1 HG22 THR 1 -9.126 3.340 4.097
8 HG23 THR 1 HG23 THR 1 -7.659 4.398 3.974
9 H GLN 2 H GLN 2 -6.668 3.061 -0.125
10 HA GLN 2 HA GLN 2 -7.597 4.394 -2.590
11 HB2 GLN 2 HB2 GLN 2 -5.473 3.654 -3.701
12 HB3 GLN 2 HB3 GLN 2 -5.257 4.855 -2.441
13 HG2 GLN 2 HG2 GLN 2 -5.026 2.278 -1.070
14 HG3 GLN 2 HG3 GLN 2 -4.136 2.069 -2.603
15 HE21 GLN 2 HE21 GLN 2 -4.248 3.839 0.474
16 HE22 GLN 2 HE22 GLN 2 -2.772 4.683 0.213
17 H SER 3 H SER 3 -5.804 1.711 -3.378
18 HA SER 3 HA SER 3 -8.268 0.113 -3.680
19 HB2 SER 3 HB2 SER 3 -6.104 -0.315 -5.708
20 HB3 SER 3 HB3 SER 3 -7.883 0.021 -5.949
21 H HIS 4 H HIS 4 -7.565 -2.141 -4.598
22 HA HIS 4 HA HIS 4 -5.902 -3.440 -2.611
23 HB2 HIS 4 HB2 HIS 4 -8.064 -4.411 -3.739
24 HB3 HIS 4 HB3 HIS 4 -7.083 -4.596 -5.233
25 HD1 HIS 4 HD1 HIS 4 -8.075 -7.164 -4.441
26 HD2 HIS 4 HD2 HIS 4 -4.945 -5.581 -2.170
27 HE1 HIS 4 HE1 HIS 4 -6.912 -9.113 -3.319
28 HE2 HIS 4 HE2 HIS 4 -5.406 -7.905 -1.652
29 H TYR 5 H TYR 5 -3.765 -4.192 -2.942
30 HA TYR 5 HA TYR 5 -1.838 -4.461 -3.769
31 HB2 TYR 5 HB2 TYR 5 -2.947 -4.252 -6.612
32 HB3 TYR 5 HB3 TYR 5 -1.359 -4.934 -6.124
33 HD1 TYR 5 HD1 TYR 5 -1.318 -7.033 -4.631
34 HD2 TYR 5 HD2 TYR 5 -4.884 -5.579 -6.525
35 HE1 TYR 5 HE1 TYR 5 -2.363 -9.234 -4.314
36 HE2 TYR 5 HE2 TYR 5 -5.928 -7.817 -6.243
37 HH TYR 5 HH TYR 5 -4.196 -10.521 -4.738
38 H GLY 6 H GLY 6 -3.285 -1.719 -3.600
39 HA2 GLY 6 HA2 GLY 6 -1.588 0.084 -5.039
40 HA3 GLY 6 HA3 GLY 6 -2.688 0.449 -3.646
41 H GLN 7 H GLN 7 -0.488 1.875 -3.483
42 HA GLN 7 HA GLN 7 1.489 0.273 -2.017
43 HB2 GLN 7 HB2 GLN 7 2.225 1.701 -3.836
44 HB3 GLN 7 HB3 GLN 7 1.501 3.137 -3.065
45 HG2 GLN 7 HG2 GLN 7 3.117 2.983 -1.157
46 HG3 GLN 7 HG3 GLN 7 3.702 1.388 -1.755
47 HE21 GLN 7 HE21 GLN 7 5.837 2.243 -1.949
48 HE22 GLN 7 HE22 GLN 7 6.247 3.369 -3.246
49 H CYS 8 H CYS 8 2.026 0.755 0.158
50 HA CYS 8 HA CYS 8 0.372 2.874 1.468
51 HB2 CYS 8 HB2 CYS 8 -0.007 1.444 3.419
52 HB3 CYS 8 HB3 CYS 8 -0.718 0.781 1.952
53 H GLY 9 H GLY 9 3.473 1.430 1.084
54 HA2 GLY 9 HA2 GLY 9 4.641 3.318 2.976
55 HA3 GLY 9 HA3 GLY 9 4.650 1.585 3.478
56 H GLY 10 H GLY 10 5.646 3.743 0.761
57 HA2 GLY 10 HA2 GLY 10 8.179 2.220 0.760
58 HA3 GLY 10 HA3 GLY 10 7.334 2.573 -0.796
59 H ILE 11 H ILE 11 9.918 3.635 0.095
60 HA ILE 11 HA ILE 11 9.808 6.224 0.968
61 HB ILE 11 HB ILE 11 11.500 4.720 -1.035
62 HG12 ILE 11 HG12 ILE 11 11.517 4.371 1.587
63 HG13 ILE 11 HG13 ILE 11 13.063 4.505 0.715
64 HG21 ILE 11 HG21 ILE 11 11.825 7.698 -0.301
65 HG22 ILE 11 HG22 ILE 11 11.718 6.965 -1.941
66 HG23 ILE 11 HG23 ILE 11 13.173 6.683 -0.934
67 HD11 ILE 11 HD11 ILE 11 12.974 5.840 2.878
68 HD12 ILE 11 HD12 ILE 11 11.762 6.928 2.101
69 HD13 ILE 11 HD13 ILE 11 13.430 6.796 1.431
70 H GLY 12 H GLY 12 9.051 5.121 -2.317
71 HA2 GLY 12 HA2 GLY 12 8.382 7.870 -3.166
72 HA3 GLY 12 HA3 GLY 12 8.347 6.360 -4.148
73 H TYR 13 H TYR 13 6.751 7.548 -1.116
74 HA TYR 13 HA TYR 13 4.202 7.038 -2.463
75 HB2 TYR 13 HB2 TYR 13 4.946 4.941 -1.139
76 HB3 TYR 13 HB3 TYR 13 4.947 5.963 0.345
77 HD1 TYR 13 HD1 TYR 13 2.696 5.550 -2.663
78 HD2 TYR 13 HD2 TYR 13 3.068 5.557 1.641
79 HE1 TYR 13 HE1 TYR 13 0.258 5.215 -2.445
80 HE2 TYR 13 HE2 TYR 13 0.602 5.271 1.825
81 HH TYR 13 HH TYR 13 -1.210 4.318 -0.816
82 H SER 14 H SER 14 2.738 8.599 -2.091
83 HA SER 14 HA SER 14 2.952 10.204 0.398
84 HB2 SER 14 HB2 SER 14 2.578 11.274 -2.470
85 HB3 SER 14 HB3 SER 14 2.323 12.267 -0.985
86 HG SER 14 HG SER 14 4.772 10.927 -1.525
87 H GLY 15 H GLY 15 1.059 8.047 -1.132
88 HA2 GLY 15 HA2 GLY 15 -1.457 9.508 -1.015
89 HA3 GLY 15 HA3 GLY 15 -1.178 7.776 -1.431
90 HA PRO 16 HA PRO 16 -3.126 8.232 2.820
91 HB2 PRO 16 HB2 PRO 16 -4.846 5.956 1.959
92 HB3 PRO 16 HB3 PRO 16 -5.350 7.628 2.433
93 HG2 PRO 16 HG2 PRO 16 -4.820 6.407 -0.301
94 HG3 PRO 16 HG3 PRO 16 -5.874 7.814 0.082
95 HD2 PRO 16 HD2 PRO 16 -3.429 8.014 -1.164
96 HD3 PRO 16 HD3 PRO 16 -3.996 9.313 -0.016
97 H THR 17 H THR 17 -2.310 7.070 4.645
98 HA THR 17 HA THR 17 -0.615 4.862 3.967
99 HB THR 17 HB THR 17 -1.323 5.907 6.753
100 HG1 THR 17 HG1 THR 17 0.427 6.866 4.751
101 HG21 THR 17 HG21 THR 17 0.095 3.954 6.964
102 HG22 THR 17 HG22 THR 17 1.234 5.330 7.012
103 HG23 THR 17 HG23 THR 17 1.050 4.362 5.497
104 H VAL 18 H VAL 18 -3.610 4.591 3.839
105 HA VAL 18 HA VAL 18 -3.866 1.988 5.145
106 HB VAL 18 HB VAL 18 -5.977 4.213 5.338
107 HG11 VAL 18 HG11 VAL 18 -7.479 2.621 6.176
108 HG12 VAL 18 HG12 VAL 18 -6.195 1.696 7.013
109 HG13 VAL 18 HG13 VAL 18 -6.490 1.429 5.268
110 HG21 VAL 18 HG21 VAL 18 -5.570 4.007 7.850
111 HG22 VAL 18 HG22 VAL 18 -4.163 4.679 6.956
112 HG23 VAL 18 HG23 VAL 18 -4.151 2.961 7.485
113 H CYS 19 H CYS 19 -4.814 0.595 3.615
114 HA CYS 19 HA CYS 19 -5.537 1.830 1.035
115 HB2 CYS 19 HB2 CYS 19 -4.355 -0.812 1.879
116 HB3 CYS 19 HB3 CYS 19 -5.224 -0.686 0.312
117 H ALA 20 H ALA 20 -7.242 0.360 -0.160
118 HA ALA 20 HA ALA 20 -9.651 0.895 0.377
119 HB1 ALA 20 HB1 ALA 20 -9.402 -1.998 -0.272
120 HB2 ALA 20 HB2 ALA 20 -8.549 -0.834 -1.327
121 HB3 ALA 20 HB3 ALA 20 -10.332 -0.695 -1.095
122 H SER 21 H SER 21 -11.581 0.405 1.658
123 HA SER 21 HA SER 21 -11.117 -0.480 4.229
124 HB2 SER 21 HB2 SER 21 -13.686 -0.140 2.628
125 HB3 SER 21 HB3 SER 21 -13.686 -0.494 4.402
126 HG SER 21 HG SER 21 -13.711 1.784 3.952
127 H GLY 22 H GLY 22 -10.870 -2.532 1.863
128 HA2 GLY 22 HA2 GLY 22 -11.498 -4.898 3.483
129 HA3 GLY 22 HA3 GLY 22 -11.840 -4.846 1.711
130 H THR 23 H THR 23 -9.032 -3.056 2.434
131 HA THR 23 HA THR 23 -7.312 -5.350 1.790
132 HB THR 23 HB THR 23 -5.809 -3.933 0.430
133 HG1 THR 23 HG1 THR 23 -7.374 -2.057 1.448
134 HG21 THR 23 HG21 THR 23 -8.681 -4.438 -0.428
135 HG22 THR 23 HG22 THR 23 -7.131 -4.929 -1.179
136 HG23 THR 23 HG23 THR 23 -7.744 -3.261 -1.414
137 H THR 24 H THR 24 -5.495 -5.471 2.910
138 HA THR 24 HA THR 24 -5.005 -3.541 5.091
139 HB THR 24 HB THR 24 -5.198 -5.967 5.529
140 HG1 THR 24 HG1 THR 24 -2.891 -6.077 6.447
141 HG21 THR 24 HG21 THR 24 -3.753 -7.568 4.612
142 HG22 THR 24 HG22 THR 24 -2.386 -6.392 4.381
143 HG23 THR 24 HG23 THR 24 -3.756 -6.402 3.260
144 H CYS 25 H CYS 25 -2.336 -3.732 5.552
145 HA CYS 25 HA CYS 25 -0.901 -2.915 3.100
146 HB2 CYS 25 HB2 CYS 25 -1.447 -0.809 4.123
147 HB3 CYS 25 HB3 CYS 25 -1.132 -1.427 5.769
148 H GLN 26 H GLN 26 0.811 -4.282 2.837
149 HA GLN 26 HA GLN 26 2.215 -5.151 5.280
150 HB2 GLN 26 HB2 GLN 26 1.725 -7.003 2.907
151 HB3 GLN 26 HB3 GLN 26 2.646 -7.394 4.380
152 HG2 GLN 26 HG2 GLN 26 0.645 -7.302 5.807
153 HG3 GLN 26 HG3 GLN 26 -0.345 -6.653 4.463
154 HE21 GLN 26 HE21 GLN 26 -1.763 -8.228 3.793
155 HE22 GLN 26 HE22 GLN 26 -1.345 -9.914 3.610
156 H VAL 27 H VAL 27 4.399 -5.123 5.160
157 HA VAL 27 HA VAL 27 5.490 -3.597 3.080
158 HB VAL 27 HB VAL 27 6.834 -4.995 5.396
159 HG11 VAL 27 HG11 VAL 27 7.955 -2.938 3.361
160 HG12 VAL 27 HG12 VAL 27 8.560 -4.607 3.671
161 HG13 VAL 27 HG13 VAL 27 8.737 -3.339 4.927
162 HG21 VAL 27 HG21 VAL 27 5.154 -2.580 5.197
163 HG22 VAL 27 HG22 VAL 27 6.831 -2.077 5.540
164 HG23 VAL 27 HG23 VAL 27 6.009 -3.241 6.640
165 H LEU 28 H LEU 28 6.934 -3.930 1.474
166 HA LEU 28 HA LEU 28 7.107 -6.748 0.614
167 HB2 LEU 28 HB2 LEU 28 6.397 -4.297 -0.761
168 HB3 LEU 28 HB3 LEU 28 8.001 -4.716 -1.395
169 HG LEU 28 HG LEU 28 6.642 -5.721 -2.907
170 HD11 LEU 28 HD11 LEU 28 6.712 -8.154 -1.079
171 HD12 LEU 28 HD12 LEU 28 8.266 -7.389 -1.564
172 HD13 LEU 28 HD13 LEU 28 7.137 -8.010 -2.823
173 HD21 LEU 28 HD21 LEU 28 4.522 -5.242 -1.570
174 HD22 LEU 28 HD22 LEU 28 4.784 -6.792 -0.694
175 HD23 LEU 28 HD23 LEU 28 4.508 -6.802 -2.476
176 H ASN 29 H ASN 29 9.008 -3.755 0.299
177 HA ASN 29 HA ASN 29 11.451 -5.240 1.013
178 HB2 ASN 29 HB2 ASN 29 11.705 -3.159 -1.223
179 HB3 ASN 29 HB3 ASN 29 12.645 -4.663 -0.930
180 HD21 ASN 29 HD21 ASN 29 10.482 -3.264 -3.059
181 HD22 ASN 29 HD22 ASN 29 9.829 -4.751 -3.715
182 HA PRO 30 HA PRO 30 12.053 -1.536 3.328
183 HB2 PRO 30 HB2 PRO 30 14.870 -0.932 2.406
184 HB3 PRO 30 HB3 PRO 30 14.326 -1.551 4.004
185 HG2 PRO 30 HG2 PRO 30 15.729 -3.103 2.127
186 HG3 PRO 30 HG3 PRO 30 14.589 -3.792 3.354
187 HD2 PRO 30 HD2 PRO 30 14.078 -3.205 0.401
188 HD3 PRO 30 HD3 PRO 30 13.534 -4.614 1.425
189 H TYR 31 H TYR 31 11.633 -1.258 0.231
190 HA TYR 31 HA TYR 31 11.673 1.677 0.156
191 HB2 TYR 31 HB2 TYR 31 12.873 -0.269 -1.915
192 HB3 TYR 31 HB3 TYR 31 12.327 1.374 -2.416
193 HD1 TYR 31 HD1 TYR 31 13.263 3.375 -1.380
194 HD2 TYR 31 HD2 TYR 31 14.963 -0.493 -0.618
195 HE1 TYR 31 HE1 TYR 31 15.306 4.453 -0.482
196 HE2 TYR 31 HE2 TYR 31 17.018 0.595 0.258
197 HH TYR 31 HH TYR 31 17.925 3.581 -0.311
198 H TYR 32 H TYR 32 9.699 -1.039 0.113
199 HA TYR 32 HA TYR 32 7.627 0.411 -1.189
200 HB2 TYR 32 HB2 TYR 32 8.685 -0.452 -3.274
201 HB3 TYR 32 HB3 TYR 32 8.721 -2.109 -2.572
202 HD1 TYR 32 HD2 TYR 32 6.393 0.658 -3.475
203 HD2 TYR 32 HD1 TYR 32 6.905 -3.555 -3.042
204 HE1 TYR 32 HE2 TYR 32 4.028 0.304 -4.192
205 HE2 TYR 32 HE1 TYR 32 4.582 -3.934 -3.820
206 HH TYR 32 HH TYR 32 2.822 -2.663 -5.173
207 H SER 33 H SER 33 5.560 -0.283 -0.550
208 HA SER 33 HA SER 33 5.242 -2.904 0.655
209 HB2 SER 33 HB2 SER 33 4.346 -0.348 2.132
210 HB3 SER 33 HB3 SER 33 3.983 -2.023 2.640
211 HG SER 33 HG SER 33 6.087 -0.535 3.261
212 H GLN 34 H GLN 34 3.092 -3.641 0.367
213 HA GLN 34 HA GLN 34 1.447 -1.798 -1.248
214 HB2 GLN 34 HB2 GLN 34 1.060 -3.349 -2.895
215 HB3 GLN 34 HB3 GLN 34 2.768 -3.695 -2.498
216 HG2 GLN 34 HG2 GLN 34 2.083 -5.670 -1.079
217 HG3 GLN 34 HG3 GLN 34 0.364 -5.385 -1.479
218 HE21 GLN 34 HE21 GLN 34 0.343 -4.812 -4.161
219 HE22 GLN 34 HE22 GLN 34 0.894 -6.252 -5.002
220 H CYS 35 H CYS 35 -0.755 -2.805 -1.587
221 HA CYS 35 HA CYS 35 -1.779 -3.602 1.040
222 HB2 CYS 35 HB2 CYS 35 -3.154 -2.110 -1.281
223 HB3 CYS 35 HB3 CYS 35 -3.819 -2.410 0.365
224 H LEU 36 H LEU 36 -3.413 -5.098 1.421
225 HA LEU 36 HA LEU 36 -3.922 -6.863 -0.881
226 HB2 LEU 36 HB2 LEU 36 -3.331 -7.966 1.884
227 HB3 LEU 36 HB3 LEU 36 -3.543 -8.824 0.342
228 HG LEU 36 HG LEU 36 -1.257 -8.890 0.968
229 HD11 LEU 36 HD11 LEU 36 -1.968 -8.344 -1.528
230 HD12 LEU 36 HD12 LEU 36 -0.218 -8.263 -1.070
231 HD13 LEU 36 HD13 LEU 36 -1.187 -6.763 -1.230
232 HD21 LEU 36 HD21 LEU 36 -1.538 -6.474 2.251
233 HD22 LEU 36 HD22 LEU 36 -0.628 -5.937 0.806
234 HD23 LEU 36 HD23 LEU 36 0.042 -7.230 1.841
235 H1 MAN 101 H1 MAN 37 -10.429 2.125 1.832
236 H2 MAN 101 H2 MAN 37 -9.506 2.866 -0.356
237 H3 MAN 101 H3 MAN 37 -10.195 5.214 -0.050
238 H4 MAN 101 H4 MAN 37 -12.948 4.271 -0.876
239 H5 MAN 101 H5 MAN 37 -11.981 5.337 1.848
240 H61 MAN 101 H61 MAN 37 -14.581 3.980 0.966
241 H62 MAN 101 H62 MAN 37 -14.351 5.743 1.297
242 HO2 MAN 101 HO2 MAN 37 -12.296 2.295 -0.656
243 HO3 MAN 101 HO3 MAN 37 -10.057 5.545 -2.113
244 HO4 MAN 101 HO4 MAN 37 -12.553 6.365 -1.497
245 HO6 MAN 101 HO6 MAN 37 -15.182 4.590 3.161
246 H1 MAN 102 H1 MAN 38 -7.491 1.729 -7.655
247 H2 MAN 102 H2 MAN 38 -5.707 -0.037 -7.717
248 H3 MAN 102 H3 MAN 38 -4.294 1.116 -5.993
249 H4 MAN 102 H4 MAN 38 -3.585 2.929 -8.352
250 H5 MAN 102 H5 MAN 38 -4.941 3.474 -5.665
251 H61 MAN 102 H61 MAN 38 -4.687 5.302 -8.108
252 H62 MAN 102 H62 MAN 38 -3.686 5.426 -6.613
253 HO2 MAN 102 HO2 MAN 38 -5.932 0.724 -9.723
254 HO3 MAN 102 HO3 MAN 38 -2.325 0.529 -6.973
255 HO4 MAN 102 HO4 MAN 38 -1.888 3.395 -7.184
256 HO6 MAN 102 HO6 MAN 38 -6.541 5.476 -6.651
Start of MODEL 5
1 H1 THR 1 H1 THR 1 -8.343 5.706 3.556
2 H2 THR 1 H2 THR 1 -7.365 6.694 2.561
3 H3 THR 1 H3 THR 1 -6.760 6.110 4.067
4 HA THR 1 HA THR 1 -5.925 4.456 2.836
5 HB THR 1 HB THR 1 -7.830 2.682 2.119
6 HG21 THR 1 HG21 THR 1 -8.537 2.165 4.411
7 HG22 THR 1 HG22 THR 1 -7.855 3.718 5.030
8 HG23 THR 1 HG23 THR 1 -6.795 2.477 4.286
9 H GLN 2 H GLN 2 -6.296 3.027 0.534
10 HA GLN 2 HA GLN 2 -7.155 4.920 -1.571
11 HB2 GLN 2 HB2 GLN 2 -5.182 3.855 -2.893
12 HB3 GLN 2 HB3 GLN 2 -4.852 4.989 -1.579
13 HG2 GLN 2 HG2 GLN 2 -4.471 2.841 -0.030
14 HG3 GLN 2 HG3 GLN 2 -4.423 1.893 -1.540
15 HE21 GLN 2 HE21 GLN 2 -3.105 4.325 -3.001
16 HE22 GLN 2 HE22 GLN 2 -1.535 4.356 -2.272
17 H SER 3 H SER 3 -5.834 1.814 -2.406
18 HA SER 3 HA SER 3 -8.537 0.802 -3.035
19 HB2 SER 3 HB2 SER 3 -6.508 0.581 -5.251
20 HB3 SER 3 HB3 SER 3 -8.309 0.874 -5.353
21 H HIS 4 H HIS 4 -8.001 -1.315 -4.521
22 HA HIS 4 HA HIS 4 -6.430 -3.015 -2.732
23 HB2 HIS 4 HB2 HIS 4 -8.757 -3.615 -3.700
24 HB3 HIS 4 HB3 HIS 4 -7.971 -3.787 -5.306
25 HD1 HIS 4 HD1 HIS 4 -9.369 -6.181 -4.072
26 HD2 HIS 4 HD2 HIS 4 -5.395 -5.326 -3.010
27 HE1 HIS 4 HE1 HIS 4 -8.382 -8.290 -3.113
28 HE2 HIS 4 HE2 HIS 4 -6.248 -7.484 -2.059
29 H TYR 5 H TYR 5 -4.374 -3.628 -3.220
30 HA TYR 5 HA TYR 5 -2.589 -4.131 -4.186
31 HB2 TYR 5 HB2 TYR 5 -3.839 -3.695 -6.949
32 HB3 TYR 5 HB3 TYR 5 -2.321 -4.582 -6.588
33 HD1 TYR 5 HD1 TYR 5 -2.497 -6.601 -4.897
34 HD2 TYR 5 HD2 TYR 5 -5.841 -4.873 -6.967
35 HE1 TYR 5 HE1 TYR 5 -3.787 -8.678 -4.538
36 HE2 TYR 5 HE2 TYR 5 -7.136 -6.966 -6.612
37 HH TYR 5 HH TYR 5 -5.816 -9.670 -4.719
38 H GLY 6 H GLY 6 -3.657 -1.257 -3.802
39 HA2 GLY 6 HA2 GLY 6 -1.784 0.356 -5.279
40 HA3 GLY 6 HA3 GLY 6 -2.722 0.828 -3.809
41 H GLN 7 H GLN 7 -0.253 1.846 -3.924
42 HA GLN 7 HA GLN 7 1.485 0.037 -2.381
43 HB2 GLN 7 HB2 GLN 7 2.468 1.372 -4.250
44 HB3 GLN 7 HB3 GLN 7 1.819 2.876 -3.538
45 HG2 GLN 7 HG2 GLN 7 3.277 2.646 -1.523
46 HG3 GLN 7 HG3 GLN 7 3.842 1.027 -2.097
47 HE21 GLN 7 HE21 GLN 7 5.966 2.214 -1.851
48 HE22 GLN 7 HE22 GLN 7 6.516 3.159 -3.237
49 H CYS 8 H CYS 8 1.487 0.270 -0.100
50 HA CYS 8 HA CYS 8 0.158 2.746 0.943
51 HB2 CYS 8 HB2 CYS 8 -1.153 1.295 1.976
52 HB3 CYS 8 HB3 CYS 8 -0.087 -0.105 1.634
53 H GLY 9 H GLY 9 3.256 1.210 0.695
54 HA2 GLY 9 HA2 GLY 9 4.361 3.209 2.548
55 HA3 GLY 9 HA3 GLY 9 4.276 1.516 3.161
56 H GLY 10 H GLY 10 5.791 3.691 0.803
57 HA2 GLY 10 HA2 GLY 10 8.096 1.902 0.929
58 HA3 GLY 10 HA3 GLY 10 7.446 2.326 -0.708
59 H ILE 11 H ILE 11 10.019 3.132 0.254
60 HA ILE 11 HA ILE 11 10.042 5.770 1.123
61 HB ILE 11 HB ILE 11 11.806 4.031 -0.593
62 HG12 ILE 11 HG12 ILE 11 11.493 3.877 2.029
63 HG13 ILE 11 HG13 ILE 11 13.135 3.819 1.347
64 HG21 ILE 11 HG21 ILE 11 12.291 6.183 -1.608
65 HG22 ILE 11 HG22 ILE 11 13.602 5.890 -0.418
66 HG23 ILE 11 HG23 ILE 11 12.262 7.027 -0.019
67 HD11 ILE 11 HD11 ILE 11 11.893 6.436 2.401
68 HD12 ILE 11 HD12 ILE 11 13.611 6.128 1.950
69 HD13 ILE 11 HD13 ILE 11 12.909 5.321 3.390
70 H GLY 12 H GLY 12 9.458 4.555 -2.145
71 HA2 GLY 12 HA2 GLY 12 9.111 7.289 -3.197
72 HA3 GLY 12 HA3 GLY 12 8.973 5.730 -4.084
73 H TYR 13 H TYR 13 7.326 6.997 -1.120
74 HA TYR 13 HA TYR 13 4.802 6.744 -2.598
75 HB2 TYR 13 HB2 TYR 13 5.286 4.644 -1.135
76 HB3 TYR 13 HB3 TYR 13 5.249 5.744 0.295
77 HD1 TYR 13 HD1 TYR 13 3.262 5.199 -2.864
78 HD2 TYR 13 HD2 TYR 13 3.203 5.771 1.407
79 HE1 TYR 13 HE1 TYR 13 0.789 5.237 -2.897
80 HE2 TYR 13 HE2 TYR 13 0.737 5.744 1.361
81 HH TYR 13 HH TYR 13 -1.051 4.767 -0.288
82 H SER 14 H SER 14 3.554 8.476 -2.417
83 HA SER 14 HA SER 14 3.874 10.252 -0.064
84 HB2 SER 14 HB2 SER 14 3.804 11.046 -3.026
85 HB3 SER 14 HB3 SER 14 3.624 12.231 -1.669
86 HG SER 14 HG SER 14 5.847 11.742 -2.620
87 H GLY 15 H GLY 15 1.820 8.187 -0.702
88 HA2 GLY 15 HA2 GLY 15 -0.570 9.948 -0.902
89 HA3 GLY 15 HA3 GLY 15 -0.434 8.271 -1.549
90 HA PRO 16 HA PRO 16 -2.387 8.126 2.678
91 HB2 PRO 16 HB2 PRO 16 -4.395 6.251 1.770
92 HB3 PRO 16 HB3 PRO 16 -4.610 8.042 1.947
93 HG2 PRO 16 HG2 PRO 16 -3.740 6.426 -0.517
94 HG3 PRO 16 HG3 PRO 16 -5.041 7.693 -0.441
95 HD2 PRO 16 HD2 PRO 16 -2.587 8.277 -1.394
96 HD3 PRO 16 HD3 PRO 16 -3.306 9.442 -0.187
97 H THR 17 H THR 17 -1.078 6.894 3.983
98 HA THR 17 HA THR 17 -0.042 4.439 3.043
99 HB THR 17 HB THR 17 1.555 4.623 4.666
100 HG1 THR 17 HG1 THR 17 -0.420 4.967 6.372
101 HG21 THR 17 HG21 THR 17 2.127 6.958 4.979
102 HG22 THR 17 HG22 THR 17 0.425 7.491 4.899
103 HG23 THR 17 HG23 THR 17 1.262 6.906 3.402
104 H VAL 18 H VAL 18 -2.767 4.116 3.149
105 HA VAL 18 HA VAL 18 -3.052 1.998 5.156
106 HB VAL 18 HB VAL 18 -5.339 4.001 4.881
107 HG11 VAL 18 HG11 VAL 18 -5.613 1.501 5.798
108 HG12 VAL 18 HG12 VAL 18 -6.215 2.825 6.841
109 HG13 VAL 18 HG13 VAL 18 -4.629 2.059 7.190
110 HG21 VAL 18 HG21 VAL 18 -4.673 4.879 7.162
111 HG22 VAL 18 HG22 VAL 18 -3.552 5.366 5.835
112 HG23 VAL 18 HG23 VAL 18 -3.095 4.039 6.968
113 H CYS 19 H CYS 19 -4.225 0.317 4.295
114 HA CYS 19 HA CYS 19 -4.802 0.539 1.463
115 HB2 CYS 19 HB2 CYS 19 -4.625 -1.677 3.555
116 HB3 CYS 19 HB3 CYS 19 -4.915 -2.036 1.839
117 H ALA 20 H ALA 20 -6.750 -0.094 0.523
118 HA ALA 20 HA ALA 20 -9.023 1.104 1.033
119 HB1 ALA 20 HB1 ALA 20 -9.164 -1.748 0.040
120 HB2 ALA 20 HB2 ALA 20 -8.380 -0.463 -0.923
121 HB3 ALA 20 HB3 ALA 20 -10.123 -0.323 -0.497
122 H SER 21 H SER 21 -11.286 0.475 1.807
123 HA SER 21 HA SER 21 -11.029 -0.450 4.482
124 HB2 SER 21 HB2 SER 21 -12.642 1.294 3.488
125 HB3 SER 21 HB3 SER 21 -13.645 -0.093 2.919
126 HG SER 21 HG SER 21 -14.332 0.611 4.971
127 H GLY 22 H GLY 22 -10.738 -2.293 1.969
128 HA2 GLY 22 HA2 GLY 22 -11.625 -4.753 3.271
129 HA3 GLY 22 HA3 GLY 22 -11.878 -4.511 1.501
130 H THR 23 H THR 23 -8.952 -2.987 2.624
131 HA THR 23 HA THR 23 -7.419 -5.349 1.893
132 HB THR 23 HB THR 23 -5.810 -4.157 0.570
133 HG1 THR 23 HG1 THR 23 -6.442 -2.265 -0.482
134 HG21 THR 23 HG21 THR 23 -8.278 -5.099 -0.325
135 HG22 THR 23 HG22 THR 23 -6.880 -4.622 -1.329
136 HG23 THR 23 HG23 THR 23 -8.238 -3.454 -1.068
137 H THR 24 H THR 24 -5.272 -5.414 2.656
138 HA THR 24 HA THR 24 -4.756 -3.643 4.996
139 HB THR 24 HB THR 24 -5.366 -5.961 5.568
140 HG1 THR 24 HG1 THR 24 -3.651 -4.700 6.735
141 HG21 THR 24 HG21 THR 24 -3.728 -6.664 3.318
142 HG22 THR 24 HG22 THR 24 -4.463 -7.776 4.506
143 HG23 THR 24 HG23 THR 24 -2.783 -7.174 4.746
144 H CYS 25 H CYS 25 -2.523 -3.161 5.623
145 HA CYS 25 HA CYS 25 -0.789 -2.728 3.327
146 HB2 CYS 25 HB2 CYS 25 -0.645 -1.974 6.308
147 HB3 CYS 25 HB3 CYS 25 0.684 -1.621 5.173
148 H GLN 26 H GLN 26 0.279 -4.599 2.703
149 HA GLN 26 HA GLN 26 1.815 -5.937 4.874
150 HB2 GLN 26 HB2 GLN 26 1.214 -7.264 2.217
151 HB3 GLN 26 HB3 GLN 26 1.786 -7.999 3.731
152 HG2 GLN 26 HG2 GLN 26 -0.426 -7.572 4.836
153 HG3 GLN 26 HG3 GLN 26 -1.032 -6.753 3.371
154 HE21 GLN 26 HE21 GLN 26 -2.222 -9.073 4.620
155 HE22 GLN 26 HE22 GLN 26 -2.218 -10.308 3.380
156 H VAL 27 H VAL 27 3.893 -5.580 4.819
157 HA VAL 27 HA VAL 27 5.109 -3.991 2.892
158 HB VAL 27 HB VAL 27 6.420 -5.786 4.974
159 HG11 VAL 27 HG11 VAL 27 8.103 -5.015 3.322
160 HG12 VAL 27 HG12 VAL 27 8.280 -4.034 4.808
161 HG13 VAL 27 HG13 VAL 27 7.452 -3.334 3.372
162 HG21 VAL 27 HG21 VAL 27 5.265 -2.916 5.070
163 HG22 VAL 27 HG22 VAL 27 6.472 -3.516 6.257
164 HG23 VAL 27 HG23 VAL 27 4.861 -4.304 6.140
165 H LEU 28 H LEU 28 6.577 -4.329 1.263
166 HA LEU 28 HA LEU 28 6.637 -7.098 0.246
167 HB2 LEU 28 HB2 LEU 28 6.019 -4.557 -1.003
168 HB3 LEU 28 HB3 LEU 28 7.634 -4.977 -1.622
169 HG LEU 28 HG LEU 28 6.318 -5.907 -3.229
170 HD11 LEU 28 HD11 LEU 28 7.806 -7.680 -1.910
171 HD12 LEU 28 HD12 LEU 28 6.674 -8.206 -3.206
172 HD13 LEU 28 HD13 LEU 28 6.207 -8.389 -1.475
173 HD21 LEU 28 HD21 LEU 28 4.104 -5.594 -2.674
174 HD22 LEU 28 HD22 LEU 28 4.299 -6.222 -0.992
175 HD23 LEU 28 HD23 LEU 28 4.176 -7.366 -2.377
176 H ASN 29 H ASN 29 8.627 -4.155 0.187
177 HA ASN 29 HA ASN 29 11.021 -5.779 0.751
178 HB2 ASN 29 HB2 ASN 29 11.306 -3.444 -1.220
179 HB3 ASN 29 HB3 ASN 29 12.264 -4.964 -1.084
180 HD21 ASN 29 HD21 ASN 29 10.924 -3.540 -3.445
181 HD22 ASN 29 HD22 ASN 29 9.899 -4.782 -4.128
182 HA PRO 30 HA PRO 30 11.582 -2.437 3.537
183 HB2 PRO 30 HB2 PRO 30 14.443 -1.816 2.642
184 HB3 PRO 30 HB3 PRO 30 13.874 -2.366 4.254
185 HG2 PRO 30 HG2 PRO 30 15.220 -4.049 2.504
186 HG3 PRO 30 HG3 PRO 30 13.906 -4.656 3.591
187 HD2 PRO 30 HD2 PRO 30 13.744 -3.977 0.614
188 HD3 PRO 30 HD3 PRO 30 12.987 -5.348 1.548
189 H TYR 31 H TYR 31 11.433 -1.752 0.425
190 HA TYR 31 HA TYR 31 11.414 1.174 0.716
191 HB2 TYR 31 HB2 TYR 31 12.742 -0.490 -1.527
192 HB3 TYR 31 HB3 TYR 31 12.294 1.238 -1.764
193 HD1 TYR 31 HD2 TYR 31 14.361 -1.053 0.420
194 HD2 TYR 31 HD1 TYR 31 13.703 2.953 -0.982
195 HE1 TYR 31 HE2 TYR 31 16.338 -0.278 1.689
196 HE2 TYR 31 HE1 TYR 31 15.714 3.708 0.240
197 HH TYR 31 HH TYR 31 17.780 2.786 1.189
198 H TYR 32 H TYR 32 9.421 -1.449 0.346
199 HA TYR 32 HA TYR 32 7.502 0.082 -1.126
200 HB2 TYR 32 HB2 TYR 32 8.838 -0.888 -3.049
201 HB3 TYR 32 HB3 TYR 32 8.587 -2.532 -2.359
202 HD1 TYR 32 HD2 TYR 32 6.719 0.484 -3.560
203 HD2 TYR 32 HD1 TYR 32 6.767 -3.764 -3.206
204 HE1 TYR 32 HE2 TYR 32 4.510 0.371 -4.702
205 HE2 TYR 32 HE1 TYR 32 4.580 -3.905 -4.348
206 HH TYR 32 HH TYR 32 2.774 -0.940 -5.255
207 H SER 33 H SER 33 5.364 -0.537 -0.604
208 HA SER 33 HA SER 33 4.901 -3.139 0.617
209 HB2 SER 33 HB2 SER 33 3.965 -0.559 2.026
210 HB3 SER 33 HB3 SER 33 3.512 -2.230 2.485
211 HG SER 33 HG SER 33 5.751 -0.768 3.070
212 H GLN 34 H GLN 34 2.847 -3.876 0.208
213 HA GLN 34 HA GLN 34 1.304 -2.223 -1.657
214 HB2 GLN 34 HB2 GLN 34 2.241 -4.970 -1.717
215 HB3 GLN 34 HB3 GLN 34 0.487 -4.994 -1.792
216 HG2 GLN 34 HG2 GLN 34 0.849 -3.037 -3.665
217 HG3 GLN 34 HG3 GLN 34 2.504 -3.722 -3.693
218 HE21 GLN 34 HE21 GLN 34 -0.361 -3.896 -5.299
219 HE22 GLN 34 HE22 GLN 34 -0.288 -5.576 -5.803
220 H CYS 35 H CYS 35 -0.995 -2.874 -1.841
221 HA CYS 35 HA CYS 35 -2.271 -3.229 0.792
222 HB2 CYS 35 HB2 CYS 35 -3.006 -1.590 -1.725
223 HB3 CYS 35 HB3 CYS 35 -4.250 -1.927 -0.471
224 H LEU 36 H LEU 36 -3.405 -5.119 1.087
225 HA LEU 36 HA LEU 36 -4.457 -6.350 -1.393
226 HB2 LEU 36 HB2 LEU 36 -3.355 -7.942 0.951
227 HB3 LEU 36 HB3 LEU 36 -3.738 -8.473 -0.714
228 HG LEU 36 HG LEU 36 -1.391 -8.480 -0.414
229 HD11 LEU 36 HD11 LEU 36 -1.381 -5.883 -1.943
230 HD12 LEU 36 HD12 LEU 36 -2.575 -7.082 -2.520
231 HD13 LEU 36 HD13 LEU 36 -0.821 -7.519 -2.434
232 HD21 LEU 36 HD21 LEU 36 -0.958 -5.545 0.175
233 HD22 LEU 36 HD22 LEU 36 -0.106 -7.008 0.754
234 HD23 LEU 36 HD23 LEU 36 -1.698 -6.527 1.458
235 H1 MAN 101 H1 MAN 37 -10.061 2.204 2.417
236 H2 MAN 101 H2 MAN 37 -8.954 3.094 0.366
237 H3 MAN 101 H3 MAN 37 -9.492 5.448 0.937
238 H4 MAN 101 H4 MAN 37 -12.265 4.772 -0.068
239 H5 MAN 101 H5 MAN 37 -11.232 5.603 2.706
240 H61 MAN 101 H61 MAN 37 -13.955 4.631 1.688
241 H62 MAN 101 H62 MAN 37 -13.538 6.295 2.225
242 HO2 MAN 101 HO2 MAN 37 -10.345 2.398 -1.063
243 HO3 MAN 101 HO3 MAN 37 -10.260 4.854 -1.723
244 HO4 MAN 101 HO4 MAN 37 -10.904 7.191 0.506
245 HO6 MAN 101 HO6 MAN 37 -12.871 4.952 4.302
246 H1 MAN 102 H1 MAN 38 -7.879 2.692 -6.979
247 H2 MAN 102 H2 MAN 38 -5.936 1.124 -7.083
248 H3 MAN 102 H3 MAN 38 -4.754 2.200 -5.151
249 H4 MAN 102 H4 MAN 38 -4.030 4.342 -7.210
250 H5 MAN 102 H5 MAN 38 -5.748 4.500 -4.681
251 H61 MAN 102 H61 MAN 38 -5.397 6.587 -6.879
252 H62 MAN 102 H62 MAN 38 -4.481 6.584 -5.331
253 HO2 MAN 102 HO2 MAN 38 -6.289 3.146 -8.744
254 HO3 MAN 102 HO3 MAN 38 -3.609 0.904 -6.928
255 HO4 MAN 102 HO4 MAN 38 -2.412 3.983 -5.736
256 HO6 MAN 102 HO6 MAN 38 -7.339 6.514 -5.493
Start of MODEL 6
1 H1 THR 1 H1 THR 1 -8.047 6.330 2.267
2 H2 THR 1 H2 THR 1 -6.477 6.626 2.844
3 H3 THR 1 H3 THR 1 -7.606 5.757 3.798
4 HA THR 1 HA THR 1 -5.898 4.434 2.622
5 HB THR 1 HB THR 1 -7.792 2.662 1.955
6 HG21 THR 1 HG21 THR 1 -6.875 2.665 4.214
7 HG22 THR 1 HG22 THR 1 -8.622 2.378 4.254
8 HG23 THR 1 HG23 THR 1 -7.967 3.979 4.759
9 H GLN 2 H GLN 2 -5.977 2.831 0.355
10 HA GLN 2 HA GLN 2 -6.798 4.596 -1.904
11 HB2 GLN 2 HB2 GLN 2 -4.998 3.014 -3.218
12 HB3 GLN 2 HB3 GLN 2 -4.629 4.495 -2.482
13 HG2 GLN 2 HG2 GLN 2 -4.528 1.837 -0.790
14 HG3 GLN 2 HG3 GLN 2 -3.244 2.138 -2.006
15 HE21 GLN 2 HE21 GLN 2 -3.552 5.115 -1.463
16 HE22 GLN 2 HE22 GLN 2 -2.534 5.300 -0.090
17 H SER 3 H SER 3 -5.708 1.320 -2.351
18 HA SER 3 HA SER 3 -8.364 0.402 -3.103
19 HB2 SER 3 HB2 SER 3 -6.355 0.149 -5.358
20 HB3 SER 3 HB3 SER 3 -8.151 0.475 -5.426
21 H HIS 4 H HIS 4 -7.702 -1.748 -4.619
22 HA HIS 4 HA HIS 4 -6.136 -3.371 -2.754
23 HB2 HIS 4 HB2 HIS 4 -8.394 -4.072 -3.866
24 HB3 HIS 4 HB3 HIS 4 -7.471 -4.249 -5.398
25 HD1 HIS 4 HD1 HIS 4 -8.769 -6.716 -4.380
26 HD2 HIS 4 HD2 HIS 4 -5.130 -5.545 -2.666
27 HE1 HIS 4 HE1 HIS 4 -7.731 -8.774 -3.319
28 HE2 HIS 4 HE2 HIS 4 -5.840 -7.791 -1.965
29 H TYR 5 H TYR 5 -4.049 -3.930 -3.133
30 HA TYR 5 HA TYR 5 -2.172 -4.293 -3.964
31 HB2 TYR 5 HB2 TYR 5 -3.208 -3.996 -6.820
32 HB3 TYR 5 HB3 TYR 5 -1.738 -4.876 -6.270
33 HD1 TYR 5 HD1 TYR 5 -2.137 -6.863 -4.543
34 HD2 TYR 5 HD2 TYR 5 -5.206 -5.134 -7.005
35 HE1 TYR 5 HE1 TYR 5 -3.479 -8.937 -4.336
36 HE2 TYR 5 HE2 TYR 5 -6.551 -7.198 -6.785
37 HH TYR 5 HH TYR 5 -6.611 -9.320 -6.013
38 H GLY 6 H GLY 6 -3.476 -1.509 -3.769
39 HA2 GLY 6 HA2 GLY 6 -1.707 0.224 -5.234
40 HA3 GLY 6 HA3 GLY 6 -2.788 0.656 -3.847
41 H GLN 7 H GLN 7 -0.418 1.941 -3.772
42 HA GLN 7 HA GLN 7 1.399 0.264 -2.188
43 HB2 GLN 7 HB2 GLN 7 2.249 1.650 -4.038
44 HB3 GLN 7 HB3 GLN 7 1.604 3.122 -3.261
45 HG2 GLN 7 HG2 GLN 7 3.166 2.831 -1.320
46 HG3 GLN 7 HG3 GLN 7 3.667 1.217 -1.945
47 HE21 GLN 7 HE21 GLN 7 5.845 2.158 -1.887
48 HE22 GLN 7 HE22 GLN 7 6.363 3.190 -3.226
49 H CYS 8 H CYS 8 1.780 0.703 0.036
50 HA CYS 8 HA CYS 8 0.232 2.965 1.228
51 HB2 CYS 8 HB2 CYS 8 -0.379 1.562 3.135
52 HB3 CYS 8 HB3 CYS 8 -0.969 0.934 1.582
53 H GLY 9 H GLY 9 3.268 1.370 0.971
54 HA2 GLY 9 HA2 GLY 9 4.470 3.209 2.882
55 HA3 GLY 9 HA3 GLY 9 4.414 1.476 3.384
56 H GLY 10 H GLY 10 5.683 3.711 0.853
57 HA2 GLY 10 HA2 GLY 10 8.046 1.940 0.837
58 HA3 GLY 10 HA3 GLY 10 7.302 2.428 -0.732
59 H ILE 11 H ILE 11 9.941 3.143 0.336
60 HA ILE 11 HA ILE 11 10.039 5.735 1.256
61 HB ILE 11 HB ILE 11 11.732 4.051 -0.598
62 HG12 ILE 11 HG12 ILE 11 11.463 3.710 2.015
63 HG13 ILE 11 HG13 ILE 11 13.085 3.646 1.286
64 HG21 ILE 11 HG21 ILE 11 12.279 6.255 -1.457
65 HG22 ILE 11 HG22 ILE 11 13.589 5.841 -0.304
66 HG23 ILE 11 HG23 ILE 11 12.283 6.982 0.189
67 HD11 ILE 11 HD11 ILE 11 11.976 6.233 2.540
68 HD12 ILE 11 HD12 ILE 11 13.674 5.868 2.055
69 HD13 ILE 11 HD13 ILE 11 12.940 5.006 3.447
70 H GLY 12 H GLY 12 9.504 4.692 -2.094
71 HA2 GLY 12 HA2 GLY 12 9.035 7.505 -2.926
72 HA3 GLY 12 HA3 GLY 12 9.174 6.051 -3.985
73 H TYR 13 H TYR 13 7.170 7.263 -1.241
74 HA TYR 13 HA TYR 13 4.841 6.550 -2.866
75 HB2 TYR 13 HB2 TYR 13 5.342 4.682 -1.183
76 HB3 TYR 13 HB3 TYR 13 5.275 5.913 0.127
77 HD1 TYR 13 HD1 TYR 13 3.116 5.492 -2.945
78 HD2 TYR 13 HD2 TYR 13 3.389 5.342 1.371
79 HE1 TYR 13 HE1 TYR 13 0.676 5.405 -2.792
80 HE2 TYR 13 HE2 TYR 13 0.908 5.243 1.486
81 HH TYR 13 HH TYR 13 -0.849 4.339 -0.430
82 H SER 14 H SER 14 3.378 8.165 -3.010
83 HA SER 14 HA SER 14 3.270 10.150 -0.811
84 HB2 SER 14 HB2 SER 14 3.214 10.798 -3.821
85 HB3 SER 14 HB3 SER 14 3.039 11.981 -2.471
86 HG SER 14 HG SER 14 5.234 10.545 -2.019
87 H GLY 15 H GLY 15 1.490 8.363 -0.388
88 HA2 GLY 15 HA2 GLY 15 -0.961 9.663 -1.188
89 HA3 GLY 15 HA3 GLY 15 -0.744 7.932 -1.698
90 HA PRO 16 HA PRO 16 -2.733 8.276 2.540
91 HB2 PRO 16 HB2 PRO 16 -4.268 5.939 1.395
92 HB3 PRO 16 HB3 PRO 16 -4.899 7.387 2.256
93 HG2 PRO 16 HG2 PRO 16 -4.796 6.873 -0.631
94 HG3 PRO 16 HG3 PRO 16 -5.382 8.369 0.154
95 HD2 PRO 16 HD2 PRO 16 -2.994 8.014 -1.406
96 HD3 PRO 16 HD3 PRO 16 -3.391 9.462 -0.374
97 H THR 17 H THR 17 -1.912 7.136 4.390
98 HA THR 17 HA THR 17 -0.107 4.997 3.722
99 HB THR 17 HB THR 17 0.481 5.309 6.214
100 HG1 THR 17 HG1 THR 17 -0.494 6.944 7.194
101 HG21 THR 17 HG21 THR 17 0.605 7.459 4.002
102 HG22 THR 17 HG22 THR 17 1.890 6.375 4.619
103 HG23 THR 17 HG23 THR 17 1.323 7.764 5.618
104 H VAL 18 H VAL 18 -2.895 4.294 3.472
105 HA VAL 18 HA VAL 18 -3.134 2.144 5.435
106 HB VAL 18 HB VAL 18 -5.490 4.066 4.995
107 HG11 VAL 18 HG11 VAL 18 -5.752 1.490 5.837
108 HG12 VAL 18 HG12 VAL 18 -6.597 2.782 6.730
109 HG13 VAL 18 HG13 VAL 18 -5.052 2.124 7.363
110 HG21 VAL 18 HG21 VAL 18 -3.531 4.078 7.348
111 HG22 VAL 18 HG22 VAL 18 -5.142 4.882 7.346
112 HG23 VAL 18 HG23 VAL 18 -3.861 5.426 6.201
113 H CYS 19 H CYS 19 -4.453 0.430 4.489
114 HA CYS 19 HA CYS 19 -4.716 0.751 1.590
115 HB2 CYS 19 HB2 CYS 19 -4.523 -1.504 3.613
116 HB3 CYS 19 HB3 CYS 19 -4.937 -1.877 1.930
117 H ALA 20 H ALA 20 -6.602 -0.174 0.513
118 HA ALA 20 HA ALA 20 -8.902 1.094 0.815
119 HB1 ALA 20 HB1 ALA 20 -9.068 -1.790 -0.030
120 HB2 ALA 20 HB2 ALA 20 -8.151 -0.610 -0.998
121 HB3 ALA 20 HB3 ALA 20 -9.911 -0.355 -0.719
122 H SER 21 H SER 21 -11.191 0.520 1.528
123 HA SER 21 HA SER 21 -11.007 -0.250 4.259
124 HB2 SER 21 HB2 SER 21 -12.635 1.403 2.989
125 HB3 SER 21 HB3 SER 21 -13.656 -0.060 2.736
126 HG SER 21 HG SER 21 -14.282 0.791 4.679
127 H GLY 22 H GLY 22 -10.746 -2.200 1.807
128 HA2 GLY 22 HA2 GLY 22 -11.656 -4.604 3.200
129 HA3 GLY 22 HA3 GLY 22 -11.891 -4.415 1.421
130 H THR 23 H THR 23 -8.946 -2.890 2.473
131 HA THR 23 HA THR 23 -7.453 -5.309 1.839
132 HB THR 23 HB THR 23 -5.825 -4.237 0.473
133 HG1 THR 23 HG1 THR 23 -6.199 -2.281 -0.480
134 HG21 THR 23 HG21 THR 23 -8.520 -4.804 -0.382
135 HG22 THR 23 HG22 THR 23 -7.014 -4.824 -1.330
136 HG23 THR 23 HG23 THR 23 -8.014 -3.326 -1.281
137 H THR 24 H THR 24 -5.446 -5.508 2.804
138 HA THR 24 HA THR 24 -4.949 -3.676 5.088
139 HB THR 24 HB THR 24 -5.278 -5.945 5.823
140 HG1 THR 24 HG1 THR 24 -3.504 -4.894 6.835
141 HG21 THR 24 HG21 THR 24 -3.402 -6.576 3.484
142 HG22 THR 24 HG22 THR 24 -4.944 -7.347 3.972
143 HG23 THR 24 HG23 THR 24 -3.444 -7.680 4.896
144 H CYS 25 H CYS 25 -2.730 -3.005 5.662
145 HA CYS 25 HA CYS 25 -1.037 -2.659 3.279
146 HB2 CYS 25 HB2 CYS 25 -1.608 -0.579 4.582
147 HB3 CYS 25 HB3 CYS 25 -0.932 -1.323 6.054
148 H GLN 26 H GLN 26 0.263 -4.349 2.951
149 HA GLN 26 HA GLN 26 1.771 -5.302 5.326
150 HB2 GLN 26 HB2 GLN 26 1.297 -7.025 2.873
151 HB3 GLN 26 HB3 GLN 26 1.909 -7.501 4.481
152 HG2 GLN 26 HG2 GLN 26 -0.376 -6.996 5.499
153 HG3 GLN 26 HG3 GLN 26 -1.017 -6.601 3.889
154 HE21 GLN 26 HE21 GLN 26 0.063 -8.606 2.281
155 HE22 GLN 26 HE22 GLN 26 -0.567 -10.147 2.830
156 H VAL 27 H VAL 27 3.904 -5.205 5.203
157 HA VAL 27 HA VAL 27 5.083 -3.765 3.156
158 HB VAL 27 HB VAL 27 6.378 -5.339 5.394
159 HG11 VAL 27 HG11 VAL 27 8.230 -4.941 3.973
160 HG12 VAL 27 HG12 VAL 27 8.200 -3.397 4.902
161 HG13 VAL 27 HG13 VAL 27 7.522 -3.451 3.250
162 HG21 VAL 27 HG21 VAL 27 4.779 -3.527 6.187
163 HG22 VAL 27 HG22 VAL 27 5.655 -2.328 5.183
164 HG23 VAL 27 HG23 VAL 27 6.490 -3.129 6.547
165 H LEU 28 H LEU 28 6.446 -4.161 1.479
166 HA LEU 28 HA LEU 28 6.482 -6.975 0.577
167 HB2 LEU 28 HB2 LEU 28 5.866 -4.446 -0.758
168 HB3 LEU 28 HB3 LEU 28 7.343 -5.072 -1.518
169 HG LEU 28 HG LEU 28 5.868 -7.383 -1.419
170 HD11 LEU 28 HD11 LEU 28 3.964 -5.001 -1.933
171 HD12 LEU 28 HD12 LEU 28 3.859 -6.180 -0.573
172 HD13 LEU 28 HD13 LEU 28 3.599 -6.733 -2.271
173 HD21 LEU 28 HD21 LEU 28 7.196 -6.316 -3.348
174 HD22 LEU 28 HD22 LEU 28 5.690 -5.406 -3.767
175 HD23 LEU 28 HD23 LEU 28 5.690 -7.196 -3.785
176 H ASN 29 H ASN 29 8.482 -4.132 -0.034
177 HA ASN 29 HA ASN 29 10.878 -5.790 0.471
178 HB2 ASN 29 HB2 ASN 29 10.923 -3.406 -1.481
179 HB3 ASN 29 HB3 ASN 29 11.992 -4.861 -1.429
180 HD21 ASN 29 HD21 ASN 29 10.348 -3.580 -3.667
181 HD22 ASN 29 HD22 ASN 29 9.371 -4.911 -4.244
182 HA PRO 30 HA PRO 30 11.845 -2.553 3.276
183 HB2 PRO 30 HB2 PRO 30 14.614 -1.956 2.160
184 HB3 PRO 30 HB3 PRO 30 14.183 -2.667 3.751
185 HG2 PRO 30 HG2 PRO 30 15.314 -4.156 1.673
186 HG3 PRO 30 HG3 PRO 30 14.172 -4.869 2.885
187 HD2 PRO 30 HD2 PRO 30 13.593 -3.958 0.031
188 HD3 PRO 30 HD3 PRO 30 12.963 -5.402 0.952
189 H TYR 31 H TYR 31 11.495 -1.790 0.156
190 HA TYR 31 HA TYR 31 11.502 1.123 0.578
191 HB2 TYR 31 HB2 TYR 31 12.683 -0.446 -1.809
192 HB3 TYR 31 HB3 TYR 31 12.231 1.292 -1.947
193 HD1 TYR 31 HD2 TYR 31 14.444 -1.106 -0.057
194 HD2 TYR 31 HD1 TYR 31 13.626 2.986 -1.074
195 HE1 TYR 31 HE2 TYR 31 16.509 -0.396 1.111
196 HE2 TYR 31 HE1 TYR 31 15.708 3.683 0.060
197 HH TYR 31 HH TYR 31 17.868 2.716 0.745
198 H TYR 32 H TYR 32 9.445 -1.418 0.287
199 HA TYR 32 HA TYR 32 7.485 0.177 -1.068
200 HB2 TYR 32 HB2 TYR 32 8.669 -0.774 -3.075
201 HB3 TYR 32 HB3 TYR 32 8.429 -2.430 -2.411
202 HD1 TYR 32 HD2 TYR 32 6.655 0.602 -3.667
203 HD2 TYR 32 HD1 TYR 32 6.411 -3.576 -2.863
204 HE1 TYR 32 HE2 TYR 32 4.349 0.565 -4.609
205 HE2 TYR 32 HE1 TYR 32 4.139 -3.652 -3.863
206 HH TYR 32 HH TYR 32 2.631 -0.802 -5.302
207 H SER 33 H SER 33 5.325 -0.432 -0.537
208 HA SER 33 HA SER 33 4.830 -3.035 0.647
209 HB2 SER 33 HB2 SER 33 4.080 -0.456 2.172
210 HB3 SER 33 HB3 SER 33 3.626 -2.113 2.641
211 HG SER 33 HG SER 33 6.354 -1.478 2.248
212 H GLN 34 H GLN 34 2.600 -3.598 0.385
213 HA GLN 34 HA GLN 34 1.146 -1.623 -1.248
214 HB2 GLN 34 HB2 GLN 34 0.674 -3.113 -2.958
215 HB3 GLN 34 HB3 GLN 34 2.372 -3.481 -2.600
216 HG2 GLN 34 HG2 GLN 34 1.664 -5.510 -1.236
217 HG3 GLN 34 HG3 GLN 34 -0.039 -5.143 -1.537
218 HE21 GLN 34 HE21 GLN 34 0.032 -4.414 -4.291
219 HE22 GLN 34 HE22 GLN 34 0.328 -5.923 -5.132
220 H CYS 35 H CYS 35 -1.075 -2.522 -1.698
221 HA CYS 35 HA CYS 35 -2.308 -3.211 0.859
222 HB2 CYS 35 HB2 CYS 35 -3.332 -1.873 -1.720
223 HB3 CYS 35 HB3 CYS 35 -4.361 -2.192 -0.288
224 H LEU 36 H LEU 36 -3.450 -5.081 1.254
225 HA LEU 36 HA LEU 36 -4.100 -6.723 -1.124
226 HB2 LEU 36 HB2 LEU 36 -3.315 -7.751 1.643
227 HB3 LEU 36 HB3 LEU 36 -3.583 -8.686 0.146
228 HG LEU 36 HG LEU 36 -1.262 -8.620 0.574
229 HD11 LEU 36 HD11 LEU 36 -1.636 -6.527 -1.647
230 HD12 LEU 36 HD12 LEU 36 -2.080 -8.250 -1.838
231 HD13 LEU 36 HD13 LEU 36 -0.364 -7.790 -1.507
232 HD21 LEU 36 HD21 LEU 36 0.052 -6.807 1.289
233 HD22 LEU 36 HD22 LEU 36 -1.560 -6.283 1.922
234 HD23 LEU 36 HD23 LEU 36 -0.916 -5.601 0.415
235 H1 MAN 101 H1 MAN 37 -10.027 2.275 2.066
236 H2 MAN 101 H2 MAN 37 -8.778 2.998 0.031
237 H3 MAN 101 H3 MAN 37 -9.253 5.417 0.470
238 H4 MAN 101 H4 MAN 37 -11.962 4.829 -0.711
239 H5 MAN 101 H5 MAN 37 -11.128 5.720 2.116
240 H61 MAN 101 H61 MAN 37 -13.763 4.705 0.912
241 H62 MAN 101 H62 MAN 37 -13.376 6.404 1.367
242 HO2 MAN 101 HO2 MAN 37 -10.544 2.714 -1.531
243 HO3 MAN 101 HO3 MAN 37 -9.327 4.322 -2.093
244 HO4 MAN 101 HO4 MAN 37 -10.749 6.894 -1.033
245 HO6 MAN 101 HO6 MAN 37 -12.867 4.934 3.530
246 H1 MAN 102 H1 MAN 38 -7.767 2.280 -7.067
247 H2 MAN 102 H2 MAN 38 -5.880 0.664 -7.270
248 H3 MAN 102 H3 MAN 38 -4.551 1.693 -5.426
249 H4 MAN 102 H4 MAN 38 -3.923 3.855 -7.503
250 H5 MAN 102 H5 MAN 38 -5.451 4.043 -4.866
251 H61 MAN 102 H61 MAN 38 -5.207 6.076 -7.127
252 H62 MAN 102 H62 MAN 38 -4.222 6.101 -5.618
253 HO2 MAN 102 HO2 MAN 38 -4.950 1.550 -9.095
254 HO3 MAN 102 HO3 MAN 38 -2.995 1.598 -7.817
255 HO4 MAN 102 HO4 MAN 38 -2.174 3.571 -6.164
256 HO6 MAN 102 HO6 MAN 38 -7.081 6.081 -5.709
Start of MODEL 7
1 H1 THR 1 H1 THR 1 -10.099 5.613 -0.467
2 H2 THR 1 H2 THR 1 -10.159 6.066 1.169
3 H3 THR 1 H3 THR 1 -10.265 4.450 0.765
4 HA THR 1 HA THR 1 -7.936 6.237 0.898
5 HB THR 1 HB THR 1 -8.004 3.173 1.084
6 HG21 THR 1 HG21 THR 1 -5.823 5.131 1.032
7 HG22 THR 1 HG22 THR 1 -5.727 3.361 1.068
8 HG23 THR 1 HG23 THR 1 -5.836 4.290 2.600
9 H GLN 2 H GLN 2 -6.303 3.869 -0.686
10 HA GLN 2 HA GLN 2 -6.773 5.111 -3.282
11 HB2 GLN 2 HB2 GLN 2 -4.659 3.857 -3.884
12 HB3 GLN 2 HB3 GLN 2 -4.476 4.999 -2.589
13 HG2 GLN 2 HG2 GLN 2 -5.238 2.239 -1.520
14 HG3 GLN 2 HG3 GLN 2 -3.785 2.186 -2.553
15 HE21 GLN 2 HE21 GLN 2 -4.142 5.206 -0.832
16 HE22 GLN 2 HE22 GLN 2 -3.055 4.782 0.425
17 H SER 3 H SER 3 -5.477 2.149 -3.770
18 HA SER 3 HA SER 3 -7.980 0.841 -4.574
19 HB2 SER 3 HB2 SER 3 -5.622 0.142 -6.256
20 HB3 SER 3 HB3 SER 3 -7.256 0.794 -6.746
21 H HIS 4 H HIS 4 -7.222 -1.514 -5.393
22 HA HIS 4 HA HIS 4 -6.008 -2.871 -3.108
23 HB2 HIS 4 HB2 HIS 4 -8.141 -3.714 -4.288
24 HB3 HIS 4 HB3 HIS 4 -7.168 -3.940 -5.784
25 HD1 HIS 4 HD1 HIS 4 -8.355 -6.444 -5.138
26 HD2 HIS 4 HD2 HIS 4 -5.206 -5.197 -2.683
27 HE1 HIS 4 HE1 HIS 4 -7.439 -8.505 -3.988
28 HE2 HIS 4 HE2 HIS 4 -5.963 -7.436 -2.198
29 H TYR 5 H TYR 5 -3.877 -3.862 -3.256
30 HA TYR 5 HA TYR 5 -1.904 -4.272 -3.985
31 HB2 TYR 5 HB2 TYR 5 -2.842 -4.112 -6.876
32 HB3 TYR 5 HB3 TYR 5 -1.342 -4.877 -6.251
33 HD1 TYR 5 HD1 TYR 5 -1.681 -6.748 -4.382
34 HD2 TYR 5 HD2 TYR 5 -4.732 -5.446 -7.111
35 HE1 TYR 5 HE1 TYR 5 -2.868 -8.885 -4.061
36 HE2 TYR 5 HE2 TYR 5 -5.919 -7.609 -6.798
37 HH TYR 5 HH TYR 5 -4.658 -10.140 -4.637
38 H GLY 6 H GLY 6 -3.120 -1.499 -3.760
39 HA2 GLY 6 HA2 GLY 6 -1.268 0.194 -5.198
40 HA3 GLY 6 HA3 GLY 6 -2.399 0.652 -3.858
41 H GLN 7 H GLN 7 -0.196 1.945 -3.503
42 HA GLN 7 HA GLN 7 1.656 0.267 -1.950
43 HB2 GLN 7 HB2 GLN 7 2.486 1.755 -3.777
44 HB3 GLN 7 HB3 GLN 7 1.765 3.165 -2.964
45 HG2 GLN 7 HG2 GLN 7 3.290 2.925 -1.011
46 HG3 GLN 7 HG3 GLN 7 3.875 1.328 -1.628
47 HE21 GLN 7 HE21 GLN 7 6.015 2.381 -1.529
48 HE22 GLN 7 HE22 GLN 7 6.499 3.400 -2.890
49 H CYS 8 H CYS 8 1.872 0.653 0.308
50 HA CYS 8 HA CYS 8 0.306 2.954 1.410
51 HB2 CYS 8 HB2 CYS 8 -0.332 1.499 3.349
52 HB3 CYS 8 HB3 CYS 8 -1.011 1.046 1.786
53 H GLY 9 H GLY 9 3.344 1.413 1.264
54 HA2 GLY 9 HA2 GLY 9 4.367 3.132 3.394
55 HA3 GLY 9 HA3 GLY 9 4.345 1.361 3.744
56 H GLY 10 H GLY 10 5.456 3.740 1.282
57 HA2 GLY 10 HA2 GLY 10 8.024 2.316 1.335
58 HA3 GLY 10 HA3 GLY 10 7.234 2.555 -0.262
59 H ILE 11 H ILE 11 9.564 3.683 -0.105
60 HA ILE 11 HA ILE 11 9.495 6.244 1.139
61 HB ILE 11 HB ILE 11 11.707 6.331 0.659
62 HG12 ILE 11 HG12 ILE 11 11.741 6.599 -1.734
63 HG13 ILE 11 HG13 ILE 11 12.898 5.348 -1.260
64 HG21 ILE 11 HG21 ILE 11 12.659 4.144 1.026
65 HG22 ILE 11 HG22 ILE 11 11.322 3.321 0.174
66 HG23 ILE 11 HG23 ILE 11 11.046 4.087 1.790
67 HD11 ILE 11 HD11 ILE 11 12.001 4.054 -2.955
68 HD12 ILE 11 HD12 ILE 11 10.632 5.176 -3.158
69 HD13 ILE 11 HD13 ILE 11 10.531 3.853 -1.942
70 H GLY 12 H GLY 12 8.320 5.018 -1.719
71 HA2 GLY 12 HA2 GLY 12 8.359 7.575 -3.234
72 HA3 GLY 12 HA3 GLY 12 8.256 5.901 -3.924
73 H TYR 13 H TYR 13 6.598 7.468 -1.191
74 HA TYR 13 HA TYR 13 4.073 6.926 -2.551
75 HB2 TYR 13 HB2 TYR 13 4.826 4.962 -0.995
76 HB3 TYR 13 HB3 TYR 13 4.807 6.127 0.371
77 HD1 TYR 13 HD1 TYR 13 2.593 5.534 -2.639
78 HD2 TYR 13 HD2 TYR 13 2.892 5.640 1.673
79 HE1 TYR 13 HE1 TYR 13 0.155 5.332 -2.461
80 HE2 TYR 13 HE2 TYR 13 0.422 5.365 1.816
81 HH TYR 13 HH TYR 13 -1.155 4.117 -0.330
82 H SER 14 H SER 14 2.665 8.585 -2.403
83 HA SER 14 HA SER 14 2.910 10.432 -0.123
84 HB2 SER 14 HB2 SER 14 2.717 12.384 -1.709
85 HB3 SER 14 HB3 SER 14 4.234 11.436 -1.888
86 HG SER 14 HG SER 14 2.111 11.727 -3.656
87 H GLY 15 H GLY 15 1.009 8.448 -0.174
88 HA2 GLY 15 HA2 GLY 15 -1.439 10.042 -0.528
89 HA3 GLY 15 HA3 GLY 15 -1.301 8.347 -1.153
90 HA PRO 16 HA PRO 16 -3.034 8.430 3.215
91 HB2 PRO 16 HB2 PRO 16 -4.924 6.375 2.352
92 HB3 PRO 16 HB3 PRO 16 -5.307 8.066 2.782
93 HG2 PRO 16 HG2 PRO 16 -4.777 6.843 0.027
94 HG3 PRO 16 HG3 PRO 16 -5.890 8.199 0.445
95 HD2 PRO 16 HD2 PRO 16 -3.479 8.574 -0.789
96 HD3 PRO 16 HD3 PRO 16 -4.030 9.754 0.486
97 H THR 17 H THR 17 -2.461 6.965 4.895
98 HA THR 17 HA THR 17 -0.647 4.942 4.032
99 HB THR 17 HB THR 17 -1.511 5.596 6.890
100 HG1 THR 17 HG1 THR 17 0.390 6.968 6.680
101 HG21 THR 17 HG21 THR 17 0.670 3.967 5.585
102 HG22 THR 17 HG22 THR 17 0.042 3.920 7.257
103 HG23 THR 17 HG23 THR 17 1.297 5.129 6.803
104 H VAL 18 H VAL 18 -3.571 4.389 3.637
105 HA VAL 18 HA VAL 18 -3.711 1.782 5.026
106 HB VAL 18 HB VAL 18 -6.271 3.386 4.511
107 HG11 VAL 18 HG11 VAL 18 -5.498 0.696 5.631
108 HG12 VAL 18 HG12 VAL 18 -7.110 1.287 5.107
109 HG13 VAL 18 HG13 VAL 18 -6.525 1.648 6.756
110 HG21 VAL 18 HG21 VAL 18 -5.177 4.871 5.986
111 HG22 VAL 18 HG22 VAL 18 -4.391 3.533 6.913
112 HG23 VAL 18 HG23 VAL 18 -6.154 3.817 7.073
113 H CYS 19 H CYS 19 -6.087 0.973 3.528
114 HA CYS 19 HA CYS 19 -5.184 1.346 0.733
115 HB2 CYS 19 HB2 CYS 19 -5.807 -1.319 2.008
116 HB3 CYS 19 HB3 CYS 19 -5.048 -0.946 0.423
117 H ALA 20 H ALA 20 -6.988 0.950 -0.827
118 HA ALA 20 HA ALA 20 -9.461 1.891 -0.355
119 HB1 ALA 20 HB1 ALA 20 -9.956 1.149 -2.485
120 HB2 ALA 20 HB2 ALA 20 -9.389 -0.540 -2.158
121 HB3 ALA 20 HB3 ALA 20 -8.206 0.743 -2.438
122 H SER 21 H SER 21 -11.643 1.186 0.271
123 HA SER 21 HA SER 21 -12.860 0.076 1.820
124 HB2 SER 21 HB2 SER 21 -12.605 -1.892 -0.502
125 HB3 SER 21 HB3 SER 21 -14.044 -1.678 0.596
126 HG SER 21 HG SER 21 -14.015 -0.505 -1.515
127 H GLY 22 H GLY 22 -12.420 -3.195 1.068
128 HA2 GLY 22 HA2 GLY 22 -11.179 -3.759 3.659
129 HA3 GLY 22 HA3 GLY 22 -11.960 -4.887 2.504
130 H THR 23 H THR 23 -9.248 -2.610 1.889
131 HA THR 23 HA THR 23 -7.608 -5.015 1.314
132 HB THR 23 HB THR 23 -5.966 -3.616 0.120
133 HG1 THR 23 HG1 THR 23 -8.030 -1.768 0.502
134 HG21 THR 23 HG21 THR 23 -8.172 -3.033 -1.710
135 HG22 THR 23 HG22 THR 23 -8.570 -4.558 -0.827
136 HG23 THR 23 HG23 THR 23 -7.011 -4.394 -1.698
137 H THR 24 H THR 24 -5.749 -5.406 2.389
138 HA THR 24 HA THR 24 -5.232 -3.857 4.854
139 HB THR 24 HB THR 24 -3.881 -6.506 4.042
140 HG1 THR 24 HG1 THR 24 -6.459 -6.087 4.989
141 HG21 THR 24 HG21 THR 24 -2.887 -5.552 6.084
142 HG22 THR 24 HG22 THR 24 -4.085 -6.753 6.661
143 HG23 THR 24 HG23 THR 24 -4.508 -5.003 6.683
144 H CYS 25 H CYS 25 -2.799 -3.522 5.475
145 HA CYS 25 HA CYS 25 -1.191 -2.930 3.053
146 HB2 CYS 25 HB2 CYS 25 -1.759 -0.903 4.390
147 HB3 CYS 25 HB3 CYS 25 -1.197 -1.700 5.877
148 H GLN 26 H GLN 26 0.475 -4.365 2.719
149 HA GLN 26 HA GLN 26 1.757 -5.515 5.120
150 HB2 GLN 26 HB2 GLN 26 1.262 -7.018 2.512
151 HB3 GLN 26 HB3 GLN 26 2.165 -7.627 3.935
152 HG2 GLN 26 HG2 GLN 26 0.087 -7.470 5.362
153 HG3 GLN 26 HG3 GLN 26 -0.837 -6.860 3.944
154 HE21 GLN 26 HE21 GLN 26 -2.295 -8.629 3.840
155 HE22 GLN 26 HE22 GLN 26 -1.755 -10.229 3.398
156 H VAL 27 H VAL 27 3.935 -5.592 5.160
157 HA VAL 27 HA VAL 27 5.271 -3.885 3.371
158 HB VAL 27 HB VAL 27 6.361 -5.624 5.596
159 HG11 VAL 27 HG11 VAL 27 8.286 -5.234 4.265
160 HG12 VAL 27 HG12 VAL 27 8.306 -3.826 5.382
161 HG13 VAL 27 HG13 VAL 27 7.730 -3.615 3.696
162 HG21 VAL 27 HG21 VAL 27 6.529 -3.179 6.618
163 HG22 VAL 27 HG22 VAL 27 4.923 -3.987 6.590
164 HG23 VAL 27 HG23 VAL 27 5.315 -2.732 5.370
165 H LEU 28 H LEU 28 6.728 -4.134 1.759
166 HA LEU 28 HA LEU 28 6.882 -6.880 0.692
167 HB2 LEU 28 HB2 LEU 28 6.142 -4.417 -0.522
168 HB3 LEU 28 HB3 LEU 28 7.813 -4.603 -1.070
169 HG LEU 28 HG LEU 28 6.711 -5.624 -2.771
170 HD11 LEU 28 HD11 LEU 28 8.259 -7.354 -1.422
171 HD12 LEU 28 HD12 LEU 28 7.250 -7.898 -2.806
172 HD13 LEU 28 HD13 LEU 28 6.688 -8.181 -1.118
173 HD21 LEU 28 HD21 LEU 28 4.627 -6.979 -2.506
174 HD22 LEU 28 HD22 LEU 28 4.447 -5.329 -1.800
175 HD23 LEU 28 HD23 LEU 28 4.698 -6.749 -0.719
176 H ASN 29 H ASN 29 8.843 -3.911 0.637
177 HA ASN 29 HA ASN 29 11.236 -5.454 1.359
178 HB2 ASN 29 HB2 ASN 29 12.051 -3.450 -0.648
179 HB3 ASN 29 HB3 ASN 29 12.293 -5.222 -0.633
180 HD21 ASN 29 HD21 ASN 29 11.037 -2.726 -2.466
181 HD22 ASN 29 HD22 ASN 29 9.937 -3.698 -3.419
182 HA PRO 30 HA PRO 30 11.860 -1.849 3.794
183 HB2 PRO 30 HB2 PRO 30 14.716 -1.277 3.100
184 HB3 PRO 30 HB3 PRO 30 14.074 -2.086 4.568
185 HG2 PRO 30 HG2 PRO 30 15.553 -3.373 2.500
186 HG3 PRO 30 HG3 PRO 30 14.495 -4.202 3.713
187 HD2 PRO 30 HD2 PRO 30 13.885 -3.473 0.827
188 HD3 PRO 30 HD3 PRO 30 13.339 -4.909 1.810
189 H TYR 31 H TYR 31 11.494 -1.480 0.720
190 HA TYR 31 HA TYR 31 11.727 1.426 0.740
191 HB2 TYR 31 HB2 TYR 31 13.028 -0.508 -1.231
192 HB3 TYR 31 HB3 TYR 31 12.321 0.990 -1.931
193 HD1 TYR 31 HD2 TYR 31 15.019 -0.293 0.350
194 HD2 TYR 31 HD1 TYR 31 13.128 3.114 -1.403
195 HE1 TYR 31 HE2 TYR 31 16.907 1.143 1.084
196 HE2 TYR 31 HE1 TYR 31 14.984 4.568 -0.631
197 HH TYR 31 HH TYR 31 17.630 3.307 1.342
198 H TYR 32 H TYR 32 9.596 -1.166 0.530
199 HA TYR 32 HA TYR 32 7.612 0.439 -0.710
200 HB2 TYR 32 HB2 TYR 32 8.706 -0.309 -2.843
201 HB3 TYR 32 HB3 TYR 32 8.686 -1.992 -2.222
202 HD1 TYR 32 HD2 TYR 32 6.464 0.775 -3.320
203 HD2 TYR 32 HD1 TYR 32 6.904 -3.420 -2.695
204 HE1 TYR 32 HE2 TYR 32 4.169 0.410 -4.216
205 HE2 TYR 32 HE1 TYR 32 4.659 -3.815 -3.657
206 HH TYR 32 HH TYR 32 2.341 -1.366 -4.019
207 H SER 33 H SER 33 5.519 -0.265 -0.200
208 HA SER 33 HA SER 33 5.128 -2.967 0.784
209 HB2 SER 33 HB2 SER 33 4.285 -0.509 2.435
210 HB3 SER 33 HB3 SER 33 3.833 -2.205 2.796
211 HG SER 33 HG SER 33 5.665 -1.501 4.006
212 H GLN 34 H GLN 34 2.972 -3.649 0.417
213 HA GLN 34 HA GLN 34 1.407 -1.714 -1.154
214 HB2 GLN 34 HB2 GLN 34 1.121 -3.181 -2.949
215 HB3 GLN 34 HB3 GLN 34 2.797 -3.571 -2.459
216 HG2 GLN 34 HG2 GLN 34 1.969 -5.601 -1.198
217 HG3 GLN 34 HG3 GLN 34 0.295 -5.238 -1.727
218 HE21 GLN 34 HE21 GLN 34 0.173 -4.804 -4.277
219 HE22 GLN 34 HE22 GLN 34 0.940 -6.102 -5.172
220 H CYS 35 H CYS 35 -0.797 -2.678 -1.635
221 HA CYS 35 HA CYS 35 -1.797 -3.837 0.868
222 HB2 CYS 35 HB2 CYS 35 -3.175 -1.984 -1.169
223 HB3 CYS 35 HB3 CYS 35 -3.928 -2.644 0.332
224 H LEU 36 H LEU 36 -3.641 -5.180 1.006
225 HA LEU 36 HA LEU 36 -4.266 -6.590 -1.489
226 HB2 LEU 36 HB2 LEU 36 -3.908 -8.107 1.127
227 HB3 LEU 36 HB3 LEU 36 -4.025 -8.715 -0.549
228 HG LEU 36 HG LEU 36 -1.825 -9.053 0.260
229 HD11 LEU 36 HD11 LEU 36 -1.097 -6.637 -1.365
230 HD12 LEU 36 HD12 LEU 36 -2.300 -7.709 -2.125
231 HD13 LEU 36 HD13 LEU 36 -0.681 -8.359 -1.635
232 HD21 LEU 36 HD21 LEU 36 -1.079 -6.147 0.753
233 HD22 LEU 36 HD22 LEU 36 -0.533 -7.656 1.540
234 HD23 LEU 36 HD23 LEU 36 -2.146 -6.944 1.949
235 H1 MAN 101 H1 MAN 37 -7.947 2.315 3.301
236 H2 MAN 101 H2 MAN 37 -9.898 2.641 1.705
237 H3 MAN 101 H3 MAN 37 -10.313 4.950 2.854
238 H4 MAN 101 H4 MAN 37 -11.666 3.247 4.932
239 H5 MAN 101 H5 MAN 37 -9.306 5.229 4.999
240 H61 MAN 101 H61 MAN 37 -10.289 3.155 7.048
241 H62 MAN 101 H62 MAN 37 -10.584 4.931 7.128
242 HO2 MAN 101 HO2 MAN 37 -10.453 0.799 2.862
243 HO3 MAN 101 HO3 MAN 37 -12.559 3.294 2.429
244 HO4 MAN 101 HO4 MAN 37 -12.776 5.207 4.447
245 HO6 MAN 101 HO6 MAN 37 -7.922 4.426 6.764
246 H1 MAN 102 H1 MAN 38 -6.427 2.425 -8.259
247 H2 MAN 102 H2 MAN 38 -4.917 0.418 -8.194
248 H3 MAN 102 H3 MAN 38 -3.568 1.289 -6.283
249 H4 MAN 102 H4 MAN 38 -2.277 3.089 -8.384
250 H5 MAN 102 H5 MAN 38 -3.961 3.776 -5.918
251 H61 MAN 102 H61 MAN 38 -3.062 5.545 -8.254
252 H62 MAN 102 H62 MAN 38 -2.294 5.501 -6.628
253 HO2 MAN 102 HO2 MAN 38 -4.964 1.596 -10.162
254 HO3 MAN 102 HO3 MAN 38 -2.453 -0.362 -7.213
255 HO4 MAN 102 HO4 MAN 38 -1.116 2.126 -6.476
256 HO6 MAN 102 HO6 MAN 38 -5.031 6.121 -7.199
Start of MODEL 8
1 H1 THR 1 H1 THR 1 -10.016 6.376 0.993
2 H2 THR 1 H2 THR 1 -10.019 4.715 0.645
3 H3 THR 1 H3 THR 1 -9.857 5.852 -0.622
4 HA THR 1 HA THR 1 -7.796 6.602 0.846
5 HB THR 1 HB THR 1 -7.908 3.546 1.119
6 HG21 THR 1 HG21 THR 1 -5.658 5.416 1.033
7 HG22 THR 1 HG22 THR 1 -5.638 3.652 1.165
8 HG23 THR 1 HG23 THR 1 -5.742 4.660 2.653
9 H GLN 2 H GLN 2 -6.152 4.142 -0.627
10 HA GLN 2 HA GLN 2 -6.410 5.423 -3.216
11 HB2 GLN 2 HB2 GLN 2 -4.287 4.159 -3.644
12 HB3 GLN 2 HB3 GLN 2 -4.227 5.234 -2.240
13 HG2 GLN 2 HG2 GLN 2 -4.574 3.199 -0.648
14 HG3 GLN 2 HG3 GLN 2 -4.501 2.130 -2.080
15 HE21 GLN 2 HE21 GLN 2 -2.530 3.944 0.183
16 HE22 GLN 2 HE22 GLN 2 -1.053 3.597 -0.674
17 H SER 3 H SER 3 -5.258 2.494 -3.903
18 HA SER 3 HA SER 3 -7.866 1.282 -4.520
19 HB2 SER 3 HB2 SER 3 -5.643 0.270 -6.169
20 HB3 SER 3 HB3 SER 3 -7.183 1.107 -6.683
21 H HIS 4 H HIS 4 -7.315 -1.176 -5.195
22 HA HIS 4 HA HIS 4 -6.144 -2.494 -2.848
23 HB2 HIS 4 HB2 HIS 4 -8.416 -3.218 -3.800
24 HB3 HIS 4 HB3 HIS 4 -7.597 -3.598 -5.354
25 HD1 HIS 4 HD1 HIS 4 -8.919 -5.947 -4.521
26 HD2 HIS 4 HD2 HIS 4 -5.499 -4.921 -2.351
27 HE1 HIS 4 HE1 HIS 4 -8.067 -8.066 -3.393
28 HE2 HIS 4 HE2 HIS 4 -6.275 -7.161 -1.852
29 H TYR 5 H TYR 5 -4.130 -3.683 -3.065
30 HA TYR 5 HA TYR 5 -2.273 -4.365 -3.857
31 HB2 TYR 5 HB2 TYR 5 -3.341 -4.202 -6.704
32 HB3 TYR 5 HB3 TYR 5 -1.840 -5.023 -6.159
33 HD1 TYR 5 HD1 TYR 5 -2.016 -6.942 -4.460
34 HD2 TYR 5 HD2 TYR 5 -5.409 -5.326 -6.536
35 HE1 TYR 5 HE1 TYR 5 -3.301 -9.006 -3.968
36 HE2 TYR 5 HE2 TYR 5 -6.666 -7.422 -6.109
37 HH TYR 5 HH TYR 5 -6.319 -9.753 -5.465
38 H GLY 6 H GLY 6 -3.252 -1.402 -3.884
39 HA2 GLY 6 HA2 GLY 6 -1.196 -0.062 -5.399
40 HA3 GLY 6 HA3 GLY 6 -2.343 0.652 -4.197
41 H GLN 7 H GLN 7 0.151 1.646 -4.138
42 HA GLN 7 HA GLN 7 1.706 0.036 -2.230
43 HB2 GLN 7 HB2 GLN 7 2.696 1.097 -4.330
44 HB3 GLN 7 HB3 GLN 7 2.379 2.697 -3.612
45 HG2 GLN 7 HG2 GLN 7 3.899 2.107 -1.654
46 HG3 GLN 7 HG3 GLN 7 4.143 0.472 -2.374
47 HE21 GLN 7 HE21 GLN 7 6.140 2.676 -1.859
48 HE22 GLN 7 HE22 GLN 7 6.925 2.836 -3.409
49 H CYS 8 H CYS 8 1.633 0.642 0.037
50 HA CYS 8 HA CYS 8 0.478 3.358 0.583
51 HB2 CYS 8 HB2 CYS 8 -0.740 2.522 2.445
52 HB3 CYS 8 HB3 CYS 8 -1.117 1.521 1.027
53 H GLY 9 H GLY 9 3.309 1.680 0.799
54 HA2 GLY 9 HA2 GLY 9 4.320 3.471 2.862
55 HA3 GLY 9 HA3 GLY 9 4.084 1.763 3.391
56 H GLY 10 H GLY 10 5.473 3.396 0.503
57 HA2 GLY 10 HA2 GLY 10 7.962 1.827 1.060
58 HA3 GLY 10 HA3 GLY 10 7.348 2.072 -0.603
59 H ILE 11 H ILE 11 9.834 3.045 0.630
60 HA ILE 11 HA ILE 11 9.930 5.700 1.138
61 HB ILE 11 HB ILE 11 11.643 3.790 -0.457
62 HG12 ILE 11 HG12 ILE 11 11.280 3.765 2.180
63 HG13 ILE 11 HG13 ILE 11 12.905 3.530 1.496
64 HG21 ILE 11 HG21 ILE 11 12.268 6.771 0.037
65 HG22 ILE 11 HG22 ILE 11 12.263 5.885 -1.528
66 HG23 ILE 11 HG23 ILE 11 13.538 5.541 -0.316
67 HD11 ILE 11 HD11 ILE 11 13.588 5.819 2.010
68 HD12 ILE 11 HD12 ILE 11 12.832 5.123 3.481
69 HD13 ILE 11 HD13 ILE 11 11.905 6.284 2.459
70 H GLY 12 H GLY 12 9.311 4.301 -2.042
71 HA2 GLY 12 HA2 GLY 12 9.195 6.966 -3.304
72 HA3 GLY 12 HA3 GLY 12 9.055 5.364 -4.096
73 H TYR 13 H TYR 13 7.089 6.197 -1.237
74 HA TYR 13 HA TYR 13 4.816 6.687 -3.049
75 HB2 TYR 13 HB2 TYR 13 4.745 4.320 -2.227
76 HB3 TYR 13 HB3 TYR 13 4.718 4.910 -0.522
77 HD1 TYR 13 HD1 TYR 13 3.047 5.107 -3.867
78 HD2 TYR 13 HD2 TYR 13 2.579 5.503 0.394
79 HE1 TYR 13 HE1 TYR 13 0.602 5.439 -4.167
80 HE2 TYR 13 HE2 TYR 13 0.148 5.815 0.051
81 HH TYR 13 HH TYR 13 -1.384 4.934 -2.633
82 H SER 14 H SER 14 4.030 8.629 -2.688
83 HA SER 14 HA SER 14 4.124 9.775 0.038
84 HB2 SER 14 HB2 SER 14 3.917 11.180 -2.699
85 HB3 SER 14 HB3 SER 14 3.983 12.018 -1.100
86 HG SER 14 HG SER 14 6.074 11.544 -0.937
87 H GLY 15 H GLY 15 2.018 7.990 -0.503
88 HA2 GLY 15 HA2 GLY 15 -0.308 9.834 -0.790
89 HA3 GLY 15 HA3 GLY 15 -0.230 8.146 -1.366
90 HA PRO 16 HA PRO 16 -2.199 8.112 2.797
91 HB2 PRO 16 HB2 PRO 16 -3.760 5.778 1.936
92 HB3 PRO 16 HB3 PRO 16 -4.357 7.465 2.192
93 HG2 PRO 16 HG2 PRO 16 -3.390 6.059 -0.341
94 HG3 PRO 16 HG3 PRO 16 -4.719 7.286 -0.197
95 HD2 PRO 16 HD2 PRO 16 -2.286 7.900 -1.225
96 HD3 PRO 16 HD3 PRO 16 -3.091 9.094 -0.113
97 H THR 17 H THR 17 -2.588 6.221 4.411
98 HA THR 17 HA THR 17 -0.336 4.292 4.161
99 HB THR 17 HB THR 17 -0.316 4.526 6.771
100 HG1 THR 17 HG1 THR 17 -1.473 6.979 5.963
101 HG21 THR 17 HG21 THR 17 1.577 5.377 5.681
102 HG22 THR 17 HG22 THR 17 0.908 6.899 6.372
103 HG23 THR 17 HG23 THR 17 0.665 6.498 4.632
104 H VAL 18 H VAL 18 -3.384 4.332 3.733
105 HA VAL 18 HA VAL 18 -3.907 1.800 5.130
106 HB VAL 18 HB VAL 18 -6.220 3.713 4.514
107 HG11 VAL 18 HG11 VAL 18 -6.988 2.306 6.717
108 HG12 VAL 18 HG12 VAL 18 -5.752 1.146 6.119
109 HG13 VAL 18 HG13 VAL 18 -7.155 1.611 5.094
110 HG21 VAL 18 HG21 VAL 18 -4.247 4.365 6.596
111 HG22 VAL 18 HG22 VAL 18 -5.821 3.941 7.301
112 HG23 VAL 18 HG23 VAL 18 -5.736 5.214 6.048
113 H CYS 19 H CYS 19 -6.255 1.239 3.596
114 HA CYS 19 HA CYS 19 -5.311 1.523 0.798
115 HB2 CYS 19 HB2 CYS 19 -6.126 -0.998 2.264
116 HB3 CYS 19 HB3 CYS 19 -5.458 -0.841 0.594
117 H ALA 20 H ALA 20 -7.092 1.147 -0.803
118 HA ALA 20 HA ALA 20 -9.529 2.235 -0.319
119 HB1 ALA 20 HB1 ALA 20 -8.237 1.128 -2.416
120 HB2 ALA 20 HB2 ALA 20 -9.941 1.682 -2.504
121 HB3 ALA 20 HB3 ALA 20 -9.537 -0.064 -2.266
122 H SER 21 H SER 21 -11.347 1.767 0.991
123 HA SER 21 HA SER 21 -12.831 0.611 2.104
124 HB2 SER 21 HB2 SER 21 -12.665 -1.606 -0.003
125 HB3 SER 21 HB3 SER 21 -14.103 -1.069 0.969
126 HG SER 21 HG SER 21 -13.257 -0.236 -1.405
127 H GLY 22 H GLY 22 -12.750 -2.644 1.756
128 HA2 GLY 22 HA2 GLY 22 -11.334 -3.039 4.262
129 HA3 GLY 22 HA3 GLY 22 -12.231 -4.234 3.266
130 H THR 23 H THR 23 -9.436 -2.212 2.429
131 HA THR 23 HA THR 23 -7.968 -4.719 1.769
132 HB THR 23 HB THR 23 -6.380 -3.315 0.433
133 HG1 THR 23 HG1 THR 23 -8.549 -1.545 0.803
134 HG21 THR 23 HG21 THR 23 -8.811 -4.458 -0.429
135 HG22 THR 23 HG22 THR 23 -7.518 -3.749 -1.458
136 HG23 THR 23 HG23 THR 23 -8.964 -2.779 -1.057
137 H THR 24 H THR 24 -5.945 -5.087 2.689
138 HA THR 24 HA THR 24 -5.270 -3.418 5.063
139 HB THR 24 HB THR 24 -5.638 -5.706 5.698
140 HG1 THR 24 HG1 THR 24 -3.583 -4.863 6.506
141 HG21 THR 24 HG21 THR 24 -3.864 -7.382 4.309
142 HG22 THR 24 HG22 THR 24 -4.325 -6.222 3.035
143 HG23 THR 24 HG23 THR 24 -5.595 -7.133 3.909
144 H CYS 25 H CYS 25 -2.908 -2.970 5.590
145 HA CYS 25 HA CYS 25 -1.285 -2.540 3.164
146 HB2 CYS 25 HB2 CYS 25 -1.474 -1.337 5.960
147 HB3 CYS 25 HB3 CYS 25 0.148 -1.336 5.221
148 H GLN 26 H GLN 26 0.140 -4.252 2.735
149 HA GLN 26 HA GLN 26 1.559 -5.365 5.087
150 HB2 GLN 26 HB2 GLN 26 0.911 -6.901 2.551
151 HB3 GLN 26 HB3 GLN 26 1.826 -7.521 3.942
152 HG2 GLN 26 HG2 GLN 26 -0.149 -7.306 5.458
153 HG3 GLN 26 HG3 GLN 26 -1.154 -6.676 4.120
154 HE21 GLN 26 HE21 GLN 26 -2.465 -8.274 3.259
155 HE22 GLN 26 HE22 GLN 26 -2.058 -9.971 3.198
156 H VAL 27 H VAL 27 3.760 -6.007 4.741
157 HA VAL 27 HA VAL 27 5.048 -4.220 2.794
158 HB VAL 27 HB VAL 27 6.013 -5.317 5.457
159 HG11 VAL 27 HG11 VAL 27 8.009 -5.242 4.149
160 HG12 VAL 27 HG12 VAL 27 7.968 -3.607 4.894
161 HG13 VAL 27 HG13 VAL 27 7.472 -3.816 3.184
162 HG21 VAL 27 HG21 VAL 27 6.094 -2.439 5.275
163 HG22 VAL 27 HG22 VAL 27 4.984 -3.437 6.278
164 HG23 VAL 27 HG23 VAL 27 4.498 -2.917 4.635
165 H LEU 28 H LEU 28 6.489 -4.894 1.378
166 HA LEU 28 HA LEU 28 6.924 -7.796 1.083
167 HB2 LEU 28 HB2 LEU 28 7.338 -5.705 -1.148
168 HB3 LEU 28 HB3 LEU 28 7.104 -7.464 -1.269
169 HG LEU 28 HG LEU 28 5.220 -6.304 -2.174
170 HD11 LEU 28 HD11 LEU 28 4.782 -8.407 -0.770
171 HD12 LEU 28 HD12 LEU 28 3.358 -7.321 -1.011
172 HD13 LEU 28 HD13 LEU 28 4.235 -7.326 0.563
173 HD21 LEU 28 HD21 LEU 28 4.013 -4.536 -1.271
174 HD22 LEU 28 HD22 LEU 28 5.609 -4.227 -0.507
175 HD23 LEU 28 HD23 LEU 28 4.297 -5.034 0.422
176 H ASN 29 H ASN 29 8.405 -4.572 0.449
177 HA ASN 29 HA ASN 29 11.024 -5.733 1.133
178 HB2 ASN 29 HB2 ASN 29 10.847 -3.502 -0.966
179 HB3 ASN 29 HB3 ASN 29 12.105 -4.771 -0.725
180 HD21 ASN 29 HD21 ASN 29 10.056 -3.821 -3.034
181 HD22 ASN 29 HD22 ASN 29 9.496 -5.372 -3.608
182 HA PRO 30 HA PRO 30 11.079 -2.207 3.817
183 HB2 PRO 30 HB2 PRO 30 13.948 -1.538 2.938
184 HB3 PRO 30 HB3 PRO 30 13.331 -1.830 4.606
185 HG2 PRO 30 HG2 PRO 30 14.805 -3.730 3.211
186 HG3 PRO 30 HG3 PRO 30 13.475 -4.194 4.349
187 HD2 PRO 30 HD2 PRO 30 13.435 -4.157 1.304
188 HD3 PRO 30 HD3 PRO 30 12.582 -5.249 2.491
189 H TYR 31 H TYR 31 11.881 -1.752 0.544
190 HA TYR 31 HA TYR 31 11.403 1.156 0.623
191 HB2 TYR 31 HB2 TYR 31 12.741 -0.715 -1.434
192 HB3 TYR 31 HB3 TYR 31 12.339 1.000 -1.808
193 HD1 TYR 31 HD2 TYR 31 14.421 -1.207 0.427
194 HD2 TYR 31 HD1 TYR 31 13.583 2.795 -0.895
195 HE1 TYR 31 HE2 TYR 31 16.412 -0.374 1.650
196 HE2 TYR 31 HE1 TYR 31 15.549 3.620 0.344
197 HH TYR 31 HH TYR 31 17.189 3.090 1.813
198 H TYR 32 H TYR 32 9.405 -1.465 0.469
199 HA TYR 32 HA TYR 32 7.509 -0.044 -1.183
200 HB2 TYR 32 HB2 TYR 32 8.796 -1.283 -2.943
201 HB3 TYR 32 HB3 TYR 32 8.539 -2.805 -2.010
202 HD1 TYR 32 HD2 TYR 32 6.719 -0.075 -3.839
203 HD2 TYR 32 HD1 TYR 32 6.654 -4.127 -2.474
204 HE1 TYR 32 HE2 TYR 32 4.498 -0.414 -4.925
205 HE2 TYR 32 HE1 TYR 32 4.446 -4.463 -3.554
206 HH TYR 32 HH TYR 32 2.463 -1.920 -4.512
207 H SER 33 H SER 33 5.408 -0.332 -0.399
208 HA SER 33 HA SER 33 4.783 -2.877 0.915
209 HB2 SER 33 HB2 SER 33 4.092 -0.230 2.261
210 HB3 SER 33 HB3 SER 33 3.632 -1.869 2.810
211 HG SER 33 HG SER 33 6.260 -1.907 2.446
212 H GLN 34 H GLN 34 2.595 -3.472 0.578
213 HA GLN 34 HA GLN 34 1.115 -1.605 -1.113
214 HB2 GLN 34 HB2 GLN 34 0.964 -2.991 -2.955
215 HB3 GLN 34 HB3 GLN 34 2.548 -3.550 -2.358
216 HG2 GLN 34 HG2 GLN 34 1.344 -5.504 -1.173
217 HG3 GLN 34 HG3 GLN 34 -0.192 -4.945 -1.923
218 HE21 GLN 34 HE21 GLN 34 0.037 -4.552 -4.455
219 HE22 GLN 34 HE22 GLN 34 0.709 -5.963 -5.228
220 H CYS 35 H CYS 35 -1.101 -2.440 -1.542
221 HA CYS 35 HA CYS 35 -2.095 -3.510 0.976
222 HB2 CYS 35 HB2 CYS 35 -3.465 -1.808 -1.186
223 HB3 CYS 35 HB3 CYS 35 -4.246 -2.402 0.325
224 H LEU 36 H LEU 36 -3.862 -4.900 1.241
225 HA LEU 36 HA LEU 36 -4.599 -6.417 -1.161
226 HB2 LEU 36 HB2 LEU 36 -4.124 -7.867 1.451
227 HB3 LEU 36 HB3 LEU 36 -4.317 -8.505 -0.203
228 HG LEU 36 HG LEU 36 -2.064 -8.788 0.512
229 HD11 LEU 36 HD11 LEU 36 -2.687 -7.418 -1.895
230 HD12 LEU 36 HD12 LEU 36 -1.136 -8.268 -1.513
231 HD13 LEU 36 HD13 LEU 36 -1.306 -6.511 -1.216
232 HD21 LEU 36 HD21 LEU 36 -2.318 -6.574 2.101
233 HD22 LEU 36 HD22 LEU 36 -1.297 -5.869 0.815
234 HD23 LEU 36 HD23 LEU 36 -0.755 -7.353 1.648
235 H1 MAN 101 H1 MAN 37 -7.898 2.794 3.358
236 H2 MAN 101 H2 MAN 37 -9.812 2.974 1.787
237 H3 MAN 101 H3 MAN 37 -10.371 5.346 2.693
238 H4 MAN 101 H4 MAN 37 -11.662 3.742 4.905
239 H5 MAN 101 H5 MAN 37 -9.335 5.762 4.961
240 H61 MAN 101 H61 MAN 37 -10.359 3.695 6.991
241 H62 MAN 101 H62 MAN 37 -10.581 5.476 7.102
242 HO2 MAN 101 HO2 MAN 37 -11.454 1.989 3.269
243 HO3 MAN 101 HO3 MAN 37 -12.383 5.009 1.783
244 HO4 MAN 101 HO4 MAN 37 -11.438 6.578 4.762
245 HO6 MAN 101 HO6 MAN 37 -8.101 5.489 7.088
246 H1 MAN 102 H1 MAN 38 -6.131 2.533 -8.304
247 H2 MAN 102 H2 MAN 38 -4.935 0.348 -8.069
248 H3 MAN 102 H3 MAN 38 -3.417 1.132 -6.259
249 H4 MAN 102 H4 MAN 38 -2.029 2.634 -8.526
250 H5 MAN 102 H5 MAN 38 -3.467 3.661 -6.014
251 H61 MAN 102 H61 MAN 38 -2.343 5.123 -8.472
252 H62 MAN 102 H62 MAN 38 -1.639 5.144 -6.813
253 HO2 MAN 102 HO2 MAN 38 -4.069 0.506 -9.979
254 HO3 MAN 102 HO3 MAN 38 -2.065 0.081 -8.546
255 HO4 MAN 102 HO4 MAN 38 -0.392 2.731 -7.201
256 HO6 MAN 102 HO6 MAN 38 -4.248 6.058 -7.562
Start of MODEL 9
1 H1 THR 1 H1 THR 1 -7.224 6.256 3.321
2 H2 THR 1 H2 THR 1 -8.743 5.593 2.899
3 H3 THR 1 H3 THR 1 -7.904 6.550 1.769
4 HA THR 1 HA THR 1 -6.255 4.478 2.477
5 HB THR 1 HB THR 1 -7.960 2.538 1.688
6 HG21 THR 1 HG21 THR 1 -8.923 2.191 3.922
7 HG22 THR 1 HG22 THR 1 -8.392 3.826 4.465
8 HG23 THR 1 HG23 THR 1 -7.194 2.577 3.977
9 H GLN 2 H GLN 2 -6.139 2.814 0.264
10 HA GLN 2 HA GLN 2 -6.794 4.465 -2.119
11 HB2 GLN 2 HB2 GLN 2 -4.817 3.004 -3.185
12 HB3 GLN 2 HB3 GLN 2 -4.479 4.436 -2.300
13 HG2 GLN 2 HG2 GLN 2 -4.656 1.765 -0.698
14 HG3 GLN 2 HG3 GLN 2 -3.263 1.977 -1.798
15 HE21 GLN 2 HE21 GLN 2 -4.075 5.040 -0.790
16 HE22 GLN 2 HE22 GLN 2 -2.868 5.136 0.457
17 H SER 3 H SER 3 -5.557 1.157 -2.427
18 HA SER 3 HA SER 3 -8.194 0.214 -3.213
19 HB2 SER 3 HB2 SER 3 -6.209 0.097 -5.485
20 HB3 SER 3 HB3 SER 3 -8.015 0.332 -5.549
21 H HIS 4 H HIS 4 -7.568 -1.884 -4.684
22 HA HIS 4 HA HIS 4 -5.925 -3.439 -2.859
23 HB2 HIS 4 HB2 HIS 4 -8.138 -4.181 -4.048
24 HB3 HIS 4 HB3 HIS 4 -7.153 -4.373 -5.539
25 HD1 HIS 4 HD1 HIS 4 -8.517 -6.807 -4.343
26 HD2 HIS 4 HD2 HIS 4 -4.772 -5.595 -2.892
27 HE1 HIS 4 HE1 HIS 4 -7.466 -8.810 -3.225
28 HE2 HIS 4 HE2 HIS 4 -5.504 -7.792 -2.002
29 H TYR 5 H TYR 5 -3.831 -3.856 -3.153
30 HA TYR 5 HA TYR 5 -1.923 -4.234 -3.925
31 HB2 TYR 5 HB2 TYR 5 -2.903 -4.010 -6.815
32 HB3 TYR 5 HB3 TYR 5 -1.412 -4.825 -6.236
33 HD1 TYR 5 HD1 TYR 5 -1.712 -6.830 -4.558
34 HD2 TYR 5 HD2 TYR 5 -4.899 -5.192 -6.929
35 HE1 TYR 5 HE1 TYR 5 -2.962 -8.949 -4.337
36 HE2 TYR 5 HE2 TYR 5 -6.167 -7.313 -6.683
37 HH TYR 5 HH TYR 5 -4.827 -10.107 -4.942
38 H GLY 6 H GLY 6 -3.260 -1.470 -3.786
39 HA2 GLY 6 HA2 GLY 6 -1.435 0.231 -5.233
40 HA3 GLY 6 HA3 GLY 6 -2.604 0.703 -3.928
41 H GLN 7 H GLN 7 -0.221 1.998 -3.893
42 HA GLN 7 HA GLN 7 1.558 0.428 -2.197
43 HB2 GLN 7 HB2 GLN 7 2.394 1.803 -4.049
44 HB3 GLN 7 HB3 GLN 7 1.723 3.277 -3.292
45 HG2 GLN 7 HG2 GLN 7 3.266 3.034 -1.339
46 HG3 GLN 7 HG3 GLN 7 3.785 1.410 -1.917
47 HE21 GLN 7 HE21 GLN 7 5.968 2.244 -1.974
48 HE22 GLN 7 HE22 GLN 7 6.472 3.318 -3.284
49 H CYS 8 H CYS 8 1.861 0.817 0.005
50 HA CYS 8 HA CYS 8 0.327 3.076 1.205
51 HB2 CYS 8 HB2 CYS 8 -0.387 1.672 3.048
52 HB3 CYS 8 HB3 CYS 8 -0.889 0.987 1.485
53 H GLY 9 H GLY 9 3.377 1.545 0.930
54 HA2 GLY 9 HA2 GLY 9 4.521 3.306 2.927
55 HA3 GLY 9 HA3 GLY 9 4.415 1.578 3.433
56 H GLY 10 H GLY 10 5.603 3.579 0.664
57 HA2 GLY 10 HA2 GLY 10 8.069 1.912 0.812
58 HA3 GLY 10 HA3 GLY 10 7.335 2.372 -0.762
59 H ILE 11 H ILE 11 9.930 3.149 0.274
60 HA ILE 11 HA ILE 11 10.114 5.723 1.150
61 HB ILE 11 HB ILE 11 11.637 3.991 -0.796
62 HG12 ILE 11 HG12 ILE 11 11.548 3.803 1.866
63 HG13 ILE 11 HG13 ILE 11 13.082 3.579 0.996
64 HG21 ILE 11 HG21 ILE 11 13.534 5.713 -0.785
65 HG22 ILE 11 HG22 ILE 11 12.359 6.922 -0.146
66 HG23 ILE 11 HG23 ILE 11 12.112 6.185 -1.767
67 HD11 ILE 11 HD11 ILE 11 13.887 5.800 1.566
68 HD12 ILE 11 HD12 ILE 11 13.249 5.061 3.071
69 HD13 ILE 11 HD13 ILE 11 12.273 6.301 2.195
70 H GLY 12 H GLY 12 9.222 4.732 -2.122
71 HA2 GLY 12 HA2 GLY 12 8.788 7.566 -2.903
72 HA3 GLY 12 HA3 GLY 12 8.770 6.112 -3.968
73 H TYR 13 H TYR 13 7.010 7.311 -1.017
74 HA TYR 13 HA TYR 13 4.561 6.842 -2.537
75 HB2 TYR 13 HB2 TYR 13 5.023 4.768 -1.088
76 HB3 TYR 13 HB3 TYR 13 5.038 5.840 0.358
77 HD1 TYR 13 HD1 TYR 13 2.929 5.544 -2.753
78 HD2 TYR 13 HD2 TYR 13 3.006 5.607 1.560
79 HE1 TYR 13 HE1 TYR 13 0.472 5.521 -2.710
80 HE2 TYR 13 HE2 TYR 13 0.523 5.561 1.580
81 HH TYR 13 HH TYR 13 -1.104 4.485 -0.492
82 H SER 14 H SER 14 3.210 8.542 -2.433
83 HA SER 14 HA SER 14 3.347 10.275 -0.036
84 HB2 SER 14 HB2 SER 14 3.111 11.525 -2.834
85 HB3 SER 14 HB3 SER 14 3.614 12.262 -1.262
86 HG SER 14 HG SER 14 5.415 11.929 -2.583
87 H GLY 15 H GLY 15 1.362 8.477 -0.083
88 HA2 GLY 15 HA2 GLY 15 -0.991 10.100 -0.733
89 HA3 GLY 15 HA3 GLY 15 -0.835 8.424 -1.410
90 HA PRO 16 HA PRO 16 -3.077 8.478 2.706
91 HB2 PRO 16 HB2 PRO 16 -4.684 6.248 1.545
92 HB3 PRO 16 HB3 PRO 16 -5.241 7.861 2.124
93 HG2 PRO 16 HG2 PRO 16 -4.534 6.944 -0.673
94 HG3 PRO 16 HG3 PRO 16 -5.582 8.316 -0.190
95 HD2 PRO 16 HD2 PRO 16 -3.049 8.603 -1.261
96 HD3 PRO 16 HD3 PRO 16 -3.686 9.780 -0.024
97 H THR 17 H THR 17 -2.211 7.391 4.477
98 HA THR 17 HA THR 17 -0.539 5.161 3.880
99 HB THR 17 HB THR 17 -1.130 6.295 6.648
100 HG1 THR 17 HG1 THR 17 0.684 7.644 6.037
101 HG21 THR 17 HG21 THR 17 0.374 4.389 6.786
102 HG22 THR 17 HG22 THR 17 1.489 5.786 6.709
103 HG23 THR 17 HG23 THR 17 1.188 4.790 5.236
104 H VAL 18 H VAL 18 -3.210 4.367 3.426
105 HA VAL 18 HA VAL 18 -3.572 2.273 5.431
106 HB VAL 18 HB VAL 18 -5.949 4.098 4.803
107 HG11 VAL 18 HG11 VAL 18 -5.575 2.181 7.213
108 HG12 VAL 18 HG12 VAL 18 -6.182 1.529 5.656
109 HG13 VAL 18 HG13 VAL 18 -7.108 2.795 6.512
110 HG21 VAL 18 HG21 VAL 18 -4.346 5.472 6.151
111 HG22 VAL 18 HG22 VAL 18 -4.306 4.167 7.390
112 HG23 VAL 18 HG23 VAL 18 -5.838 5.053 7.060
113 H CYS 19 H CYS 19 -4.610 0.484 4.449
114 HA CYS 19 HA CYS 19 -4.765 0.716 1.540
115 HB2 CYS 19 HB2 CYS 19 -4.547 -1.510 3.611
116 HB3 CYS 19 HB3 CYS 19 -4.886 -1.915 1.914
117 H ALA 20 H ALA 20 -6.551 -0.287 0.356
118 HA ALA 20 HA ALA 20 -8.924 0.846 0.580
119 HB1 ALA 20 HB1 ALA 20 -8.948 -2.055 -0.244
120 HB2 ALA 20 HB2 ALA 20 -8.025 -0.865 -1.191
121 HB3 ALA 20 HB3 ALA 20 -9.806 -0.663 -0.980
122 H SER 21 H SER 21 -11.182 0.220 1.274
123 HA SER 21 HA SER 21 -11.113 -0.547 3.976
124 HB2 SER 21 HB2 SER 21 -12.776 1.022 2.924
125 HB3 SER 21 HB3 SER 21 -13.559 -0.384 2.122
126 HG SER 21 HG SER 21 -13.726 -1.249 4.363
127 H GLY 22 H GLY 22 -10.661 -2.579 1.555
128 HA2 GLY 22 HA2 GLY 22 -11.452 -4.957 3.067
129 HA3 GLY 22 HA3 GLY 22 -11.697 -4.865 1.283
130 H THR 23 H THR 23 -8.817 -3.222 2.327
131 HA THR 23 HA THR 23 -7.225 -5.613 1.640
132 HB THR 23 HB THR 23 -5.653 -4.365 0.262
133 HG1 THR 23 HG1 THR 23 -6.949 -2.330 1.265
134 HG21 THR 23 HG21 THR 23 -7.739 -3.443 -1.468
135 HG22 THR 23 HG22 THR 23 -8.427 -4.868 -0.593
136 HG23 THR 23 HG23 THR 23 -6.883 -5.018 -1.474
137 H THR 24 H THR 24 -5.089 -5.584 2.476
138 HA THR 24 HA THR 24 -4.829 -3.920 4.920
139 HB THR 24 HB THR 24 -3.072 -6.328 4.820
140 HG1 THR 24 HG1 THR 24 -5.364 -6.805 3.743
141 HG21 THR 24 HG21 THR 24 -5.367 -5.360 6.647
142 HG22 THR 24 HG22 THR 24 -3.612 -4.980 6.893
143 HG23 THR 24 HG23 THR 24 -4.208 -6.680 7.020
144 H CYS 25 H CYS 25 -2.783 -2.933 5.522
145 HA CYS 25 HA CYS 25 -0.962 -2.565 3.250
146 HB2 CYS 25 HB2 CYS 25 -1.659 -0.530 4.568
147 HB3 CYS 25 HB3 CYS 25 -0.981 -1.265 6.040
148 H GLN 26 H GLN 26 0.367 -4.259 2.929
149 HA GLN 26 HA GLN 26 1.893 -5.149 5.313
150 HB2 GLN 26 HB2 GLN 26 1.282 -6.923 2.913
151 HB3 GLN 26 HB3 GLN 26 2.055 -7.376 4.457
152 HG2 GLN 26 HG2 GLN 26 -0.105 -6.936 5.686
153 HG3 GLN 26 HG3 GLN 26 -0.884 -6.423 4.142
154 HE21 GLN 26 HE21 GLN 26 -2.501 -8.137 4.396
155 HE22 GLN 26 HE22 GLN 26 -2.043 -9.779 4.056
156 H VAL 27 H VAL 27 4.029 -5.138 5.184
157 HA VAL 27 HA VAL 27 5.198 -3.684 3.113
158 HB VAL 27 HB VAL 27 6.504 -5.219 5.370
159 HG11 VAL 27 HG11 VAL 27 7.656 -3.218 3.306
160 HG12 VAL 27 HG12 VAL 27 8.255 -4.860 3.739
161 HG13 VAL 27 HG13 VAL 27 8.426 -3.501 4.902
162 HG21 VAL 27 HG21 VAL 27 6.623 -2.315 5.666
163 HG22 VAL 27 HG22 VAL 27 5.808 -3.517 6.720
164 HG23 VAL 27 HG23 VAL 27 4.909 -2.748 5.365
165 H LEU 28 H LEU 28 6.585 -4.073 1.460
166 HA LEU 28 HA LEU 28 6.590 -6.900 0.594
167 HB2 LEU 28 HB2 LEU 28 5.831 -4.451 -0.760
168 HB3 LEU 28 HB3 LEU 28 7.335 -4.960 -1.542
169 HG LEU 28 HG LEU 28 5.982 -7.379 -1.345
170 HD11 LEU 28 HD11 LEU 28 3.904 -5.316 -2.271
171 HD12 LEU 28 HD12 LEU 28 3.984 -5.849 -0.550
172 HD13 LEU 28 HD13 LEU 28 3.671 -7.053 -1.851
173 HD21 LEU 28 HD21 LEU 28 5.701 -5.508 -3.772
174 HD22 LEU 28 HD22 LEU 28 5.800 -7.298 -3.722
175 HD23 LEU 28 HD23 LEU 28 7.253 -6.318 -3.325
176 H ASN 29 H ASN 29 8.555 -4.058 -0.099
177 HA ASN 29 HA ASN 29 10.992 -5.663 0.392
178 HB2 ASN 29 HB2 ASN 29 10.596 -3.398 -1.701
179 HB3 ASN 29 HB3 ASN 29 12.114 -4.336 -1.433
180 HD21 ASN 29 HD21 ASN 29 9.390 -4.218 -3.440
181 HD22 ASN 29 HD22 ASN 29 9.427 -5.899 -3.923
182 HA PRO 30 HA PRO 30 11.796 -2.385 3.217
183 HB2 PRO 30 HB2 PRO 30 14.618 -1.935 2.080
184 HB3 PRO 30 HB3 PRO 30 14.151 -2.343 3.771
185 HG2 PRO 30 HG2 PRO 30 15.256 -4.220 2.056
186 HG3 PRO 30 HG3 PRO 30 13.969 -4.674 3.247
187 HD2 PRO 30 HD2 PRO 30 13.694 -4.182 0.247
188 HD3 PRO 30 HD3 PRO 30 12.870 -5.400 1.324
189 H TYR 31 H TYR 31 11.592 -1.712 0.081
190 HA TYR 31 HA TYR 31 11.594 1.214 0.389
191 HB2 TYR 31 HB2 TYR 31 12.776 -0.520 -1.875
192 HB3 TYR 31 HB3 TYR 31 12.261 1.176 -2.195
193 HD1 TYR 31 HD2 TYR 31 14.560 -0.906 -0.030
194 HD2 TYR 31 HD1 TYR 31 13.585 2.990 -1.554
195 HE1 TYR 31 HE2 TYR 31 16.560 0.029 1.079
196 HE2 TYR 31 HE1 TYR 31 15.610 3.914 -0.471
197 HH TYR 31 HH TYR 31 17.563 1.996 1.749
198 H TYR 32 H TYR 32 9.519 -1.366 0.175
199 HA TYR 32 HA TYR 32 7.551 0.211 -1.192
200 HB2 TYR 32 HB2 TYR 32 8.720 -0.817 -3.186
201 HB3 TYR 32 HB3 TYR 32 8.462 -2.449 -2.467
202 HD1 TYR 32 HD2 TYR 32 6.660 0.621 -3.603
203 HD2 TYR 32 HD1 TYR 32 6.455 -3.603 -3.019
204 HE1 TYR 32 HE2 TYR 32 4.341 0.608 -4.523
205 HE2 TYR 32 HE1 TYR 32 4.184 -3.646 -4.012
206 HH TYR 32 HH TYR 32 2.786 -2.051 -5.608
207 H SER 33 H SER 33 5.451 -0.279 -0.475
208 HA SER 33 HA SER 33 4.936 -2.927 0.629
209 HB2 SER 33 HB2 SER 33 4.215 -0.367 2.188
210 HB3 SER 33 HB3 SER 33 3.760 -2.041 2.637
211 HG SER 33 HG SER 33 5.612 -1.371 3.779
212 H GLN 34 H GLN 34 2.726 -3.500 0.348
213 HA GLN 34 HA GLN 34 1.238 -1.491 -1.201
214 HB2 GLN 34 HB2 GLN 34 0.805 -2.912 -2.978
215 HB3 GLN 34 HB3 GLN 34 2.497 -3.306 -2.591
216 HG2 GLN 34 HG2 GLN 34 1.703 -5.363 -1.287
217 HG3 GLN 34 HG3 GLN 34 0.023 -4.985 -1.730
218 HE21 GLN 34 HE21 GLN 34 0.285 -4.215 -4.442
219 HE22 GLN 34 HE22 GLN 34 0.694 -5.698 -5.287
220 H CYS 35 H CYS 35 -0.988 -2.354 -1.642
221 HA CYS 35 HA CYS 35 -2.223 -3.160 0.879
222 HB2 CYS 35 HB2 CYS 35 -3.233 -1.847 -1.715
223 HB3 CYS 35 HB3 CYS 35 -4.313 -2.216 -0.337
224 H LEU 36 H LEU 36 -3.102 -5.144 1.242
225 HA LEU 36 HA LEU 36 -3.785 -6.760 -1.141
226 HB2 LEU 36 HB2 LEU 36 -2.896 -7.720 1.625
227 HB3 LEU 36 HB3 LEU 36 -3.208 -8.717 0.169
228 HG LEU 36 HG LEU 36 -0.872 -8.601 0.455
229 HD11 LEU 36 HD11 LEU 36 -0.093 -7.667 -1.671
230 HD12 LEU 36 HD12 LEU 36 -1.472 -6.514 -1.745
231 HD13 LEU 36 HD13 LEU 36 -1.777 -8.270 -1.924
232 HD21 LEU 36 HD21 LEU 36 -1.039 -6.382 1.889
233 HD22 LEU 36 HD22 LEU 36 -0.685 -5.556 0.347
234 HD23 LEU 36 HD23 LEU 36 0.481 -6.748 0.980
235 H1 MAN 101 H1 MAN 37 -10.192 1.984 1.705
236 H2 MAN 101 H2 MAN 37 -8.824 2.806 -0.213
237 H3 MAN 101 H3 MAN 37 -9.542 5.172 0.129
238 H4 MAN 101 H4 MAN 37 -12.086 4.275 -1.234
239 H5 MAN 101 H5 MAN 37 -11.488 5.327 1.601
240 H61 MAN 101 H61 MAN 37 -14.025 4.130 0.381
241 H62 MAN 101 H62 MAN 37 -13.727 5.888 0.677
242 HO2 MAN 101 HO2 MAN 37 -10.055 2.149 -1.858
243 HO3 MAN 101 HO3 MAN 37 -8.980 5.651 -1.812
244 HO4 MAN 101 HO4 MAN 37 -11.943 6.360 -1.751
245 HO6 MAN 101 HO6 MAN 37 -14.876 4.622 2.422
246 H1 MAN 102 H1 MAN 38 -7.495 2.118 -7.259
247 H2 MAN 102 H2 MAN 38 -5.430 0.720 -7.184
248 H3 MAN 102 H3 MAN 38 -4.512 1.886 -5.165
249 H4 MAN 102 H4 MAN 38 -3.831 4.078 -7.182
250 H5 MAN 102 H5 MAN 38 -5.720 4.111 -4.762
251 H61 MAN 102 H61 MAN 38 -5.360 6.166 -7.001
252 H62 MAN 102 H62 MAN 38 -4.645 6.314 -5.357
253 HO2 MAN 102 HO2 MAN 38 -4.610 1.518 -8.971
254 HO3 MAN 102 HO3 MAN 38 -2.804 1.708 -7.432
255 HO4 MAN 102 HO4 MAN 38 -3.399 4.244 -4.361
256 HO6 MAN 102 HO6 MAN 38 -7.430 5.990 -5.935
Start of MODEL 10
1 H1 THR 1 H1 THR 1 -7.984 6.346 3.284
2 H2 THR 1 H2 THR 1 -9.368 5.470 2.781
3 H3 THR 1 H3 THR 1 -8.389 6.237 1.616
4 HA THR 1 HA THR 1 -6.792 4.424 3.003
5 HB THR 1 HB THR 1 -8.373 2.352 2.066
6 HG21 THR 1 HG21 THR 1 -8.768 3.636 4.849
7 HG22 THR 1 HG22 THR 1 -7.548 2.416 4.337
8 HG23 THR 1 HG23 THR 1 -9.265 1.981 4.320
9 H GLN 2 H GLN 2 -6.050 2.668 1.293
10 HA GLN 2 HA GLN 2 -5.640 3.948 -1.256
11 HB2 GLN 2 HB2 GLN 2 -3.939 2.607 0.412
12 HB3 GLN 2 HB3 GLN 2 -4.715 1.172 -0.274
13 HG2 GLN 2 HG2 GLN 2 -2.579 1.575 -1.432
14 HG3 GLN 2 HG3 GLN 2 -3.875 1.860 -2.617
15 HE21 GLN 2 HE21 GLN 2 -3.430 4.258 -0.148
16 HE22 GLN 2 HE22 GLN 2 -2.522 5.362 -1.068
17 H SER 3 H SER 3 -5.696 2.416 -3.230
18 HA SER 3 HA SER 3 -8.035 0.739 -3.265
19 HB2 SER 3 HB2 SER 3 -6.066 0.564 -5.521
20 HB3 SER 3 HB3 SER 3 -7.852 0.973 -5.556
21 H HIS 4 H HIS 4 -7.553 -1.438 -4.684
22 HA HIS 4 HA HIS 4 -5.860 -3.077 -2.989
23 HB2 HIS 4 HB2 HIS 4 -8.109 -3.842 -4.023
24 HB3 HIS 4 HB3 HIS 4 -7.269 -3.889 -5.613
25 HD1 HIS 4 HD1 HIS 4 -8.297 -6.513 -4.945
26 HD2 HIS 4 HD2 HIS 4 -4.855 -5.246 -2.918
27 HE1 HIS 4 HE1 HIS 4 -7.132 -8.582 -4.086
28 HE2 HIS 4 HE2 HIS 4 -5.434 -7.577 -2.466
29 H TYR 5 H TYR 5 -3.783 -3.620 -3.406
30 HA TYR 5 HA TYR 5 -1.935 -4.047 -4.299
31 HB2 TYR 5 HB2 TYR 5 -3.010 -3.546 -7.125
32 HB3 TYR 5 HB3 TYR 5 -1.476 -4.369 -6.691
33 HD1 TYR 5 HD1 TYR 5 -1.580 -6.560 -5.351
34 HD2 TYR 5 HD2 TYR 5 -5.022 -4.755 -7.179
35 HE1 TYR 5 HE1 TYR 5 -2.766 -8.726 -5.246
36 HE2 TYR 5 HE2 TYR 5 -6.208 -6.934 -7.085
37 HH TYR 5 HH TYR 5 -4.663 -9.871 -5.851
38 H GLY 6 H GLY 6 -3.204 -1.167 -4.025
39 HA2 GLY 6 HA2 GLY 6 -1.285 0.514 -5.396
40 HA3 GLY 6 HA3 GLY 6 -2.475 0.988 -4.128
41 H GLN 7 H GLN 7 -0.117 2.239 -3.804
42 HA GLN 7 HA GLN 7 1.610 0.496 -2.194
43 HB2 GLN 7 HB2 GLN 7 2.528 1.929 -3.977
44 HB3 GLN 7 HB3 GLN 7 1.962 3.380 -3.116
45 HG2 GLN 7 HG2 GLN 7 3.506 2.828 -1.171
46 HG3 GLN 7 HG3 GLN 7 3.941 1.273 -1.984
47 HE21 GLN 7 HE21 GLN 7 6.118 2.390 -1.539
48 HE22 GLN 7 HE22 GLN 7 6.744 3.314 -2.900
49 H CYS 8 H CYS 8 1.963 0.872 0.093
50 HA CYS 8 HA CYS 8 0.357 3.110 1.249
51 HB2 CYS 8 HB2 CYS 8 -0.849 1.836 2.720
52 HB3 CYS 8 HB3 CYS 8 -0.747 0.807 1.265
53 H GLY 9 H GLY 9 3.335 1.536 1.149
54 HA2 GLY 9 HA2 GLY 9 4.363 3.168 3.343
55 HA3 GLY 9 HA3 GLY 9 4.377 1.376 3.570
56 H GLY 10 H GLY 10 5.611 4.060 1.568
57 HA2 GLY 10 HA2 GLY 10 8.010 2.375 1.174
58 HA3 GLY 10 HA3 GLY 10 7.267 3.201 -0.245
59 H ILE 11 H ILE 11 9.784 3.816 0.355
60 HA ILE 11 HA ILE 11 9.882 6.017 2.175
61 HB ILE 11 HB ILE 11 12.124 5.839 1.972
62 HG12 ILE 11 HG12 ILE 11 12.509 6.681 -0.258
63 HG13 ILE 11 HG13 ILE 11 13.442 5.198 -0.005
64 HG21 ILE 11 HG21 ILE 11 12.752 3.498 1.794
65 HG22 ILE 11 HG22 ILE 11 11.413 3.151 0.662
66 HG23 ILE 11 HG23 ILE 11 11.072 3.511 2.403
67 HD11 ILE 11 HD11 ILE 11 11.517 5.823 -2.137
68 HD12 ILE 11 HD12 ILE 11 10.992 4.320 -1.298
69 HD13 ILE 11 HD13 ILE 11 12.628 4.433 -2.029
70 H GLY 12 H GLY 12 8.969 5.597 -0.997
71 HA2 GLY 12 HA2 GLY 12 9.238 8.441 -1.802
72 HA3 GLY 12 HA3 GLY 12 9.526 7.023 -2.901
73 H TYR 13 H TYR 13 7.169 7.208 -0.355
74 HA TYR 13 HA TYR 13 5.050 6.907 -2.367
75 HB2 TYR 13 HB2 TYR 13 5.449 4.864 -0.972
76 HB3 TYR 13 HB3 TYR 13 5.318 5.857 0.522
77 HD1 TYR 13 HD1 TYR 13 3.379 5.630 -2.721
78 HD2 TYR 13 HD2 TYR 13 3.282 5.473 1.596
79 HE1 TYR 13 HE1 TYR 13 0.915 5.648 -2.771
80 HE2 TYR 13 HE2 TYR 13 0.791 5.478 1.510
81 HH TYR 13 HH TYR 13 -0.788 4.624 -1.042
82 H SER 14 H SER 14 3.619 8.508 -2.508
83 HA SER 14 HA SER 14 3.044 10.140 -0.122
84 HB2 SER 14 HB2 SER 14 3.882 11.125 -2.880
85 HB3 SER 14 HB3 SER 14 2.871 12.166 -1.815
86 HG SER 14 HG SER 14 4.696 11.431 -0.207
87 H GLY 15 H GLY 15 1.256 8.551 -0.004
88 HA2 GLY 15 HA2 GLY 15 -1.048 9.802 -1.189
89 HA3 GLY 15 HA3 GLY 15 -0.710 8.093 -1.694
90 HA PRO 16 HA PRO 16 -3.382 8.174 2.144
91 HB2 PRO 16 HB2 PRO 16 -4.594 5.746 0.827
92 HB3 PRO 16 HB3 PRO 16 -5.417 7.221 1.458
93 HG2 PRO 16 HG2 PRO 16 -4.658 6.534 -1.318
94 HG3 PRO 16 HG3 PRO 16 -5.585 7.960 -0.776
95 HD2 PRO 16 HD2 PRO 16 -2.926 7.937 -1.792
96 HD3 PRO 16 HD3 PRO 16 -3.666 9.305 -0.846
97 H THR 17 H THR 17 -2.744 7.202 4.068
98 HA THR 17 HA THR 17 -0.732 5.188 3.797
99 HB THR 17 HB THR 17 -1.798 6.169 6.482
100 HG1 THR 17 HG1 THR 17 -0.030 7.673 4.936
101 HG21 THR 17 HG21 THR 17 0.236 4.565 6.250
102 HG22 THR 17 HG22 THR 17 0.594 6.122 7.058
103 HG23 THR 17 HG23 THR 17 1.077 5.852 5.335
104 H VAL 18 H VAL 18 -3.929 4.645 3.823
105 HA VAL 18 HA VAL 18 -3.741 2.266 5.620
106 HB VAL 18 HB VAL 18 -6.292 3.898 5.166
107 HG11 VAL 18 HG11 VAL 18 -7.273 2.474 6.845
108 HG12 VAL 18 HG12 VAL 18 -5.678 1.937 7.474
109 HG13 VAL 18 HG13 VAL 18 -6.309 1.297 5.919
110 HG21 VAL 18 HG21 VAL 18 -5.772 4.363 7.788
111 HG22 VAL 18 HG22 VAL 18 -5.245 5.477 6.473
112 HG23 VAL 18 HG23 VAL 18 -4.083 4.297 7.188
113 H CYS 19 H CYS 19 -4.759 0.378 4.653
114 HA CYS 19 HA CYS 19 -5.038 0.577 1.773
115 HB2 CYS 19 HB2 CYS 19 -4.963 -1.669 3.848
116 HB3 CYS 19 HB3 CYS 19 -5.191 -2.008 2.120
117 H ALA 20 H ALA 20 -6.830 -0.233 0.564
118 HA ALA 20 HA ALA 20 -9.211 0.721 0.825
119 HB1 ALA 20 HB1 ALA 20 -9.985 -0.668 -0.878
120 HB2 ALA 20 HB2 ALA 20 -9.139 -2.112 -0.222
121 HB3 ALA 20 HB3 ALA 20 -8.202 -0.838 -1.047
122 H SER 21 H SER 21 -11.474 -0.099 1.332
123 HA SER 21 HA SER 21 -11.474 -0.927 4.026
124 HB2 SER 21 HB2 SER 21 -13.134 0.625 2.822
125 HB3 SER 21 HB3 SER 21 -13.873 -0.849 2.111
126 HG SER 21 HG SER 21 -13.630 -0.235 4.907
127 H GLY 22 H GLY 22 -10.895 -2.791 1.467
128 HA2 GLY 22 HA2 GLY 22 -11.498 -5.294 2.869
129 HA3 GLY 22 HA3 GLY 22 -11.744 -5.129 1.091
130 H THR 23 H THR 23 -8.976 -3.378 2.293
131 HA THR 23 HA THR 23 -7.255 -5.646 1.532
132 HB THR 23 HB THR 23 -5.584 -4.217 0.461
133 HG1 THR 23 HG1 THR 23 -7.202 -2.326 1.253
134 HG21 THR 23 HG21 THR 23 -7.836 -3.533 -1.374
135 HG22 THR 23 HG22 THR 23 -7.876 -5.249 -0.785
136 HG23 THR 23 HG23 THR 23 -6.397 -4.596 -1.560
137 H THR 24 H THR 24 -5.221 -5.683 2.485
138 HA THR 24 HA THR 24 -4.903 -4.048 4.955
139 HB THR 24 HB THR 24 -3.933 -6.885 4.327
140 HG1 THR 24 HG1 THR 24 -6.269 -5.991 5.532
141 HG21 THR 24 HG21 THR 24 -4.244 -6.648 7.124
142 HG22 THR 24 HG22 THR 24 -3.658 -5.000 6.724
143 HG23 THR 24 HG23 THR 24 -2.681 -6.461 6.326
144 H CYS 25 H CYS 25 -2.447 -3.660 5.648
145 HA CYS 25 HA CYS 25 -0.881 -2.888 3.269
146 HB2 CYS 25 HB2 CYS 25 -0.965 -2.144 6.228
147 HB3 CYS 25 HB3 CYS 25 0.618 -1.988 5.437
148 H GLN 26 H GLN 26 0.454 -4.634 2.467
149 HA GLN 26 HA GLN 26 2.029 -6.018 4.594
150 HB2 GLN 26 HB2 GLN 26 1.733 -7.410 1.886
151 HB3 GLN 26 HB3 GLN 26 2.396 -7.978 3.427
152 HG2 GLN 26 HG2 GLN 26 -0.394 -8.149 2.441
153 HG3 GLN 26 HG3 GLN 26 0.500 -9.211 3.550
154 HE21 GLN 26 HE21 GLN 26 -1.651 -6.568 3.212
155 HE22 GLN 26 HE22 GLN 26 -1.841 -6.204 4.898
156 H VAL 27 H VAL 27 4.223 -6.516 4.065
157 HA VAL 27 HA VAL 27 5.351 -4.426 2.339
158 HB VAL 27 HB VAL 27 6.444 -5.881 4.767
159 HG11 VAL 27 HG11 VAL 27 8.364 -5.583 3.283
160 HG12 VAL 27 HG12 VAL 27 8.412 -4.197 4.425
161 HG13 VAL 27 HG13 VAL 27 7.800 -3.951 2.755
162 HG21 VAL 27 HG21 VAL 27 6.442 -2.911 4.724
163 HG22 VAL 27 HG22 VAL 27 5.784 -4.019 5.954
164 HG23 VAL 27 HG23 VAL 27 4.777 -3.556 4.537
165 H LEU 28 H LEU 28 6.690 -4.824 0.746
166 HA LEU 28 HA LEU 28 7.171 -7.632 -0.012
167 HB2 LEU 28 HB2 LEU 28 7.560 -5.080 -1.731
168 HB3 LEU 28 HB3 LEU 28 7.475 -6.790 -2.267
169 HG LEU 28 HG LEU 28 5.553 -5.622 -2.982
170 HD11 LEU 28 HD11 LEU 28 4.317 -7.106 -0.619
171 HD12 LEU 28 HD12 LEU 28 5.361 -8.017 -1.769
172 HD13 LEU 28 HD13 LEU 28 3.900 -7.153 -2.371
173 HD21 LEU 28 HD21 LEU 28 4.137 -4.197 -1.774
174 HD22 LEU 28 HD22 LEU 28 5.722 -3.873 -0.995
175 HD23 LEU 28 HD23 LEU 28 4.520 -4.941 -0.191
176 H ASN 29 H ASN 29 8.677 -4.345 0.215
177 HA ASN 29 HA ASN 29 11.252 -5.621 0.705
178 HB2 ASN 29 HB2 ASN 29 11.625 -3.264 -1.094
179 HB3 ASN 29 HB3 ASN 29 12.327 -4.907 -1.205
180 HD21 ASN 29 HD21 ASN 29 10.285 -6.558 -1.991
181 HD22 ASN 29 HD22 ASN 29 9.582 -5.922 -3.463
182 HA PRO 30 HA PRO 30 11.307 -2.280 3.567
183 HB2 PRO 30 HB2 PRO 30 14.019 -1.530 3.756
184 HB3 PRO 30 HB3 PRO 30 13.394 -3.109 4.357
185 HG2 PRO 30 HG2 PRO 30 14.742 -2.513 1.665
186 HG3 PRO 30 HG3 PRO 30 15.098 -3.862 2.817
187 HD2 PRO 30 HD2 PRO 30 13.480 -4.175 0.602
188 HD3 PRO 30 HD3 PRO 30 13.125 -5.068 2.153
189 H TYR 31 H TYR 31 11.679 -1.697 0.384
190 HA TYR 31 HA TYR 31 11.618 1.208 0.756
191 HB2 TYR 31 HB2 TYR 31 12.883 -0.521 -1.441
192 HB3 TYR 31 HB3 TYR 31 12.399 1.174 -1.800
193 HD1 TYR 31 HD1 TYR 31 13.357 3.011 -0.638
194 HD2 TYR 31 HD2 TYR 31 14.865 -0.917 0.062
195 HE1 TYR 31 HE1 TYR 31 15.371 4.003 0.408
196 HE2 TYR 31 HE2 TYR 31 16.910 0.063 1.099
197 HH TYR 31 HH TYR 31 17.480 3.564 1.117
198 H TYR 32 H TYR 32 9.524 -1.318 0.361
199 HA TYR 32 HA TYR 32 7.576 0.345 -0.914
200 HB2 TYR 32 HB2 TYR 32 8.802 -0.519 -2.956
201 HB3 TYR 32 HB3 TYR 32 8.571 -2.185 -2.339
202 HD1 TYR 32 HD2 TYR 32 6.738 0.822 -3.558
203 HD2 TYR 32 HD1 TYR 32 6.669 -3.397 -2.969
204 HE1 TYR 32 HE2 TYR 32 4.456 0.727 -4.570
205 HE2 TYR 32 HE1 TYR 32 4.416 -3.523 -4.004
206 HH TYR 32 HH TYR 32 2.793 -2.316 -5.151
207 H SER 33 H SER 33 5.487 -0.193 -0.308
208 HA SER 33 HA SER 33 4.900 -2.873 0.695
209 HB2 SER 33 HB2 SER 33 4.045 -0.405 2.280
210 HB3 SER 33 HB3 SER 33 3.694 -2.112 2.679
211 HG SER 33 HG SER 33 6.127 -2.262 2.760
212 H GLN 34 H GLN 34 2.683 -3.397 0.290
213 HA GLN 34 HA GLN 34 1.259 -1.315 -1.236
214 HB2 GLN 34 HB2 GLN 34 0.908 -2.641 -3.097
215 HB3 GLN 34 HB3 GLN 34 2.561 -3.107 -2.647
216 HG2 GLN 34 HG2 GLN 34 1.611 -5.194 -1.473
217 HG3 GLN 34 HG3 GLN 34 -0.027 -4.709 -2.044
218 HE21 GLN 34 HE21 GLN 34 0.203 -4.016 -4.649
219 HE22 GLN 34 HE22 GLN 34 0.790 -5.414 -5.523
220 H CYS 35 H CYS 35 -1.009 -2.040 -1.650
221 HA CYS 35 HA CYS 35 -2.183 -3.103 0.820
222 HB2 CYS 35 HB2 CYS 35 -3.211 -1.401 -1.502
223 HB3 CYS 35 HB3 CYS 35 -4.340 -2.056 -0.266
224 H LEU 36 H LEU 36 -3.252 -4.965 1.017
225 HA LEU 36 HA LEU 36 -3.661 -6.553 -1.435
226 HB2 LEU 36 HB2 LEU 36 -2.831 -7.418 1.400
227 HB3 LEU 36 HB3 LEU 36 -3.105 -8.508 0.007
228 HG LEU 36 HG LEU 36 -0.764 -8.309 0.246
229 HD11 LEU 36 HD11 LEU 36 -1.747 -8.095 -2.118
230 HD12 LEU 36 HD12 LEU 36 -0.070 -7.436 -1.944
231 HD13 LEU 36 HD13 LEU 36 -1.486 -6.325 -2.010
232 HD21 LEU 36 HD21 LEU 36 0.506 -6.342 0.692
233 HD22 LEU 36 HD22 LEU 36 -1.049 -5.953 1.533
234 HD23 LEU 36 HD23 LEU 36 -0.688 -5.291 -0.077
235 H1 MAN 101 H1 MAN 37 -10.538 1.741 1.969
236 H2 MAN 101 H2 MAN 37 -9.163 2.785 0.127
237 H3 MAN 101 H3 MAN 37 -9.911 5.015 0.420
238 H4 MAN 101 H4 MAN 37 -12.552 4.170 -0.814
239 H5 MAN 101 H5 MAN 37 -11.936 5.026 2.077
240 H61 MAN 101 H61 MAN 37 -14.442 3.884 0.744
241 H62 MAN 101 H62 MAN 37 -14.220 5.570 1.340
242 HO2 MAN 101 HO2 MAN 37 -10.201 1.835 -1.450
243 HO3 MAN 101 HO3 MAN 37 -10.112 5.552 -1.775
244 HO4 MAN 101 HO4 MAN 37 -12.596 6.298 -1.085
245 HO6 MAN 101 HO6 MAN 37 -14.001 4.624 3.508
246 H1 MAN 102 H1 MAN 38 -7.582 3.000 -6.878
247 H2 MAN 102 H2 MAN 38 -5.912 1.204 -7.439
248 H3 MAN 102 H3 MAN 38 -4.217 1.966 -5.761
249 H4 MAN 102 H4 MAN 38 -3.772 4.230 -7.766
250 H5 MAN 102 H5 MAN 38 -4.750 4.207 -4.853
251 H61 MAN 102 H61 MAN 38 -4.575 6.500 -6.880
252 H62 MAN 102 H62 MAN 38 -3.483 6.256 -5.470
253 HO2 MAN 102 HO2 MAN 38 -6.356 3.403 -8.845
254 HO3 MAN 102 HO3 MAN 38 -3.685 0.768 -7.904
255 HO4 MAN 102 HO4 MAN 38 -1.827 3.827 -6.866
256 HO6 MAN 102 HO6 MAN 38 -6.328 6.509 -5.314