Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
465314 | 2kk2 RC | 16350 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 TYR 1 H TYR 1 -14.458 8.768 2.070
2 HA TYR 1 HA TYR 1 -12.564 9.219 3.468
3 HB2 TYR 1 1HB TYR 1 -13.180 7.805 5.355
4 HB3 TYR 1 2HB TYR 1 -12.897 6.348 4.404
5 HD1 TYR 1 1HD TYR 1 -11.276 9.352 5.927
6 HD2 TYR 1 2HD TYR 1 -10.600 5.566 3.927
7 HE1 TYR 1 1HE TYR 1 -8.826 9.575 6.308
8 HE2 TYR 1 2HE TYR 1 -8.222 5.780 4.342
9 HH TYR 1 HH TYR 1 -6.677 8.508 6.094
10 H ASN 2 H ASN 2 -11.004 9.425 2.022
11 HA ASN 2 HA ASN 2 -10.407 7.213 0.148
12 HB2 ASN 2 1HB ASN 2 -10.316 10.160 -0.006
13 HB3 ASN 2 2HB ASN 2 -8.808 9.416 -0.523
14 HD21 ASN 2 1HD2 ASN 2 -8.793 9.053 -2.770
15 HD22 ASN 2 2HD2 ASN 2 -10.168 8.379 -3.598
16 HA PRO 3 HA PRO 3 -6.887 6.362 2.799
17 HB2 PRO 3 1HB PRO 3 -5.360 4.844 1.045
18 HB3 PRO 3 2HB PRO 3 -6.770 4.225 1.921
19 HG2 PRO 3 1HG PRO 3 -6.634 5.241 -0.897
20 HG3 PRO 3 2HG PRO 3 -7.536 3.822 -0.261
21 HD2 PRO 3 1HD PRO 3 -8.760 6.143 -0.810
22 HD3 PRO 3 2HD PRO 3 -9.254 5.102 0.565
23 H GLU 4 H GLU 4 -6.540 7.821 -0.377
24 HA GLU 4 HA GLU 4 -3.876 8.750 -0.143
25 HB2 GLU 4 1HB GLU 4 -6.238 9.942 -1.645
26 HB3 GLU 4 2HB GLU 4 -4.540 10.304 -1.948
27 HG2 GLU 4 1HG GLU 4 -5.883 7.598 -2.365
28 HG3 GLU 4 2HG GLU 4 -5.495 8.769 -3.617
29 H ASP 5 H ASP 5 -6.452 9.547 1.887
30 HA ASP 5 HA ASP 5 -5.726 12.312 2.455
31 HB2 ASP 5 1HB ASP 5 -8.051 11.198 2.739
32 HB3 ASP 5 2HB ASP 5 -7.367 10.396 4.152
33 H ASP 6 H ASP 6 -4.535 9.180 3.305
34 HA ASP 6 HA ASP 6 -2.642 10.279 5.341
35 HB2 ASP 6 1HB ASP 6 -4.449 7.876 5.696
36 HB3 ASP 6 2HB ASP 6 -2.986 8.148 6.620
37 H TYR 7 H TYR 7 -2.626 9.586 2.441
38 HA TYR 7 HA TYR 7 -0.744 7.431 2.064
39 HB2 TYR 7 1HB TYR 7 -1.838 8.201 0.150
40 HB3 TYR 7 2HB TYR 7 -1.641 9.899 0.567
41 HD1 TYR 7 2HD TYR 7 0.496 6.909 -0.250
42 HD2 TYR 7 1HD TYR 7 -0.193 11.123 -0.770
43 HE1 TYR 7 2HE TYR 7 2.415 7.027 -1.821
44 HE2 TYR 7 1HE TYR 7 1.729 11.251 -2.330
45 HH TYR 7 HH TYR 7 3.775 8.394 -3.081
46 H THR 8 H THR 8 1.532 7.560 2.200
47 HA THR 8 HA THR 8 2.650 10.005 3.457
48 HB THR 8 HB THR 8 4.202 8.468 4.631
49 HG1 THR 8 1HG THR 8 3.646 6.362 4.851
50 HG21 THR 8 3HG2 THR 8 2.142 9.483 5.633
51 HG22 THR 8 1HG2 THR 8 1.261 7.991 5.272
52 HG23 THR 8 2HG2 THR 8 2.645 7.989 6.393
53 HA PRO 9 HA PRO 9 4.870 9.407 -0.532
54 HB2 PRO 9 1HB PRO 9 5.434 12.155 -0.783
55 HB3 PRO 9 2HB PRO 9 4.178 11.255 -1.657
56 HG2 PRO 9 1HG PRO 9 3.866 13.135 0.600
57 HG3 PRO 9 2HG PRO 9 2.635 12.555 -0.534
58 HD2 PRO 9 1HD PRO 9 2.951 11.735 2.148
59 HD3 PRO 9 2HD PRO 9 1.966 10.909 0.924
60 H LEU 10 H LEU 10 5.654 11.241 2.472
61 HA LEU 10 HA LEU 10 8.019 12.270 2.002
62 HB2 LEU 10 1HB LEU 10 7.362 10.841 4.597
63 HB3 LEU 10 2HB LEU 10 8.253 12.311 4.366
64 HG LEU 10 HG LEU 10 6.357 13.176 5.133
65 HD11 LEU 10 1HD1 LEU 10 4.957 14.268 3.626
66 HD12 LEU 10 2HD1 LEU 10 6.471 14.056 2.732
67 HD13 LEU 10 3HD1 LEU 10 5.078 13.015 2.420
68 HD21 LEU 10 3HD2 LEU 10 4.593 11.061 3.913
69 HD22 LEU 10 1HD2 LEU 10 5.240 11.054 5.562
70 HD23 LEU 10 2HD2 LEU 10 4.129 12.324 5.068
71 H THR 11 H THR 11 7.463 8.895 3.078
72 HA THR 11 HA THR 11 10.308 8.213 2.636
73 HB THR 11 HB THR 11 9.434 6.166 4.010
74 HG1 THR 11 1HG THR 11 7.507 6.352 4.903
75 HG21 THR 11 3HG2 THR 11 10.938 7.883 4.957
76 HG22 THR 11 1HG2 THR 11 9.549 8.939 5.295
77 HG23 THR 11 2HG2 THR 11 9.723 7.393 6.144
78 H CYS 12 H CYS 12 7.068 7.825 1.235
79 HA CYS 12 HA CYS 12 7.500 5.072 0.641
80 HB2 CYS 12 1HB CYS 12 5.283 6.053 1.014
81 HB3 CYS 12 2HB CYS 12 5.403 6.918 -0.532
82 HA PRO 13 HA PRO 13 9.733 5.753 -3.204
83 HB2 PRO 13 1HB PRO 13 9.663 3.163 -4.222
84 HB3 PRO 13 2HB PRO 13 10.774 3.747 -2.943
85 HG2 PRO 13 1HG PRO 13 8.223 2.189 -2.666
86 HG3 PRO 13 2HG PRO 13 9.760 1.991 -1.775
87 HD2 PRO 13 1HD PRO 13 7.584 3.304 -0.761
88 HD3 PRO 13 2HD PRO 13 9.252 3.727 -0.324
89 H HIS 14 H HIS 14 6.407 5.130 -3.004
90 HA HIS 14 HA HIS 14 6.010 4.997 -5.958
91 HB2 HIS 14 1HB HIS 14 3.877 4.317 -3.926
92 HB3 HIS 14 2HB HIS 14 4.000 3.753 -5.580
93 HD1 HIS 14 1HD HIS 14 6.353 2.027 -5.958
94 HD2 HIS 14 2HD HIS 14 4.379 2.368 -2.230
95 HE1 HIS 14 1HE HIS 14 6.744 -0.111 -4.656
96 HE2 HIS 14 2HE HIS 14 5.635 0.127 -2.431
97 H THR 15 H THR 15 4.312 6.395 -6.849
98 HA THR 15 HA THR 15 4.111 8.959 -5.412
99 HB THR 15 HB THR 15 3.465 9.705 -7.711
100 HG1 THR 15 1HG THR 15 3.900 8.075 -9.375
101 HG21 THR 15 3HG2 THR 15 5.668 9.494 -8.734
102 HG22 THR 15 1HG2 THR 15 5.859 9.750 -6.990
103 HG23 THR 15 2HG2 THR 15 6.083 8.127 -7.681
104 H ILE 16 H ILE 16 1.997 10.066 -5.501
105 HA ILE 16 HA ILE 16 -0.105 8.461 -4.583
106 HB ILE 16 HB ILE 16 0.387 10.944 -4.242
107 HG12 ILE 16 1HG1 ILE 16 -2.502 10.059 -4.645
108 HG13 ILE 16 2HG1 ILE 16 -1.479 9.767 -3.234
109 HG21 ILE 16 1HG2 ILE 16 0.344 11.492 -6.708
110 HG22 ILE 16 2HG2 ILE 16 -1.427 11.358 -6.632
111 HG23 ILE 16 3HG2 ILE 16 -0.587 12.580 -5.660
112 HD11 ILE 16 3HD1 ILE 16 -2.889 11.622 -2.700
113 HD12 ILE 16 1HD1 ILE 16 -1.248 12.245 -2.914
114 HD13 ILE 16 2HD1 ILE 16 -2.468 12.470 -4.197
115 H SER 17 H SER 17 0.797 9.040 -7.858
116 HA SER 17 HA SER 17 -1.660 8.566 -9.219
117 HB2 SER 17 1HB SER 17 1.300 8.114 -9.828
118 HB3 SER 17 2HB SER 17 0.009 7.997 -11.006
119 HG SER 17 HG SER 17 1.142 9.928 -11.040
120 H VAL 18 H VAL 18 1.050 6.538 -7.938
121 HA VAL 18 HA VAL 18 -0.284 4.078 -8.904
122 HB VAL 18 HB VAL 18 1.670 3.269 -9.876
123 HG11 VAL 18 1HG1 VAL 18 1.808 6.164 -10.762
124 HG12 VAL 18 2HG1 VAL 18 2.113 4.701 -11.700
125 HG13 VAL 18 3HG1 VAL 18 0.459 5.090 -11.189
126 HG21 VAL 18 3HG2 VAL 18 3.070 5.317 -8.261
127 HG22 VAL 18 1HG2 VAL 18 3.536 3.670 -8.670
128 HG23 VAL 18 2HG2 VAL 18 3.809 4.964 -9.863
129 H VAL 19 H VAL 19 -0.500 5.184 -6.352
130 HA VAL 19 HA VAL 19 1.241 3.428 -4.745
131 HB VAL 19 HB VAL 19 1.078 5.648 -3.948
132 HG11 VAL 19 1HG1 VAL 19 -0.927 6.722 -3.120
133 HG12 VAL 19 2HG1 VAL 19 -1.201 6.314 -4.809
134 HG13 VAL 19 3HG1 VAL 19 -1.938 5.355 -3.511
135 HG21 VAL 19 3HG2 VAL 19 1.188 3.698 -2.389
136 HG22 VAL 19 1HG2 VAL 19 0.414 5.131 -1.640
137 HG23 VAL 19 2HG2 VAL 19 -0.552 3.773 -2.215
138 H TRP 20 H TRP 20 -2.290 3.940 -5.325
139 HA TRP 20 HA TRP 20 -3.104 1.986 -3.503
140 HB2 TRP 20 1HB TRP 20 -4.511 3.756 -4.535
141 HB3 TRP 20 2HB TRP 20 -4.554 2.860 -6.037
142 HD1 TRP 20 HD TRP 20 -6.434 1.154 -6.291
143 HE1 TRP 20 1HE TRP 20 -8.191 0.069 -4.784
144 HE3 TRP 20 3HE TRP 20 -4.670 2.728 -1.725
145 HZ2 TRP 20 2HZ TRP 20 -8.791 -0.060 -1.939
146 HZ3 TRP 20 3HZ TRP 20 -5.819 2.064 0.331
147 HH2 TRP 20 HH TRP 20 -7.955 0.784 0.219
148 H TYR 21 H TYR 21 -2.943 1.658 -7.075
149 HA TYR 21 HA TYR 21 -3.443 -1.127 -7.270
150 HB2 TYR 21 1HB TYR 21 -3.398 0.058 -9.303
151 HB3 TYR 21 2HB TYR 21 -1.921 0.921 -8.894
152 HD1 TYR 21 2HD TYR 21 -3.249 -2.362 -10.069
153 HD2 TYR 21 1HD TYR 21 0.288 -0.008 -9.254
154 HE1 TYR 21 2HE TYR 21 -1.860 -4.074 -11.149
155 HE2 TYR 21 1HE TYR 21 1.699 -1.775 -10.247
156 HH TYR 21 HH TYR 21 1.728 -3.814 -11.358
157 H GLU 22 H GLU 22 -0.401 0.670 -6.539
158 HA GLU 22 HA GLU 22 1.259 -1.503 -7.178
159 HB2 GLU 22 1HB GLU 22 2.621 0.427 -7.257
160 HB3 GLU 22 2HB GLU 22 1.261 1.254 -6.608
161 HG2 GLU 22 1HG GLU 22 3.132 1.715 -5.329
162 HG3 GLU 22 2HG GLU 22 2.079 0.773 -4.295
163 H CYS 23 H CYS 23 -0.231 -0.410 -4.035
164 HA CYS 23 HA CYS 23 1.410 -2.416 -2.623
165 HB2 CYS 23 1HB CYS 23 -0.185 -0.004 -1.719
166 HB3 CYS 23 2HB CYS 23 0.212 -1.305 -0.604
167 H THR 24 H THR 24 -1.399 -2.462 -4.358
168 HA THR 24 HA THR 24 -2.557 -4.334 -2.411
169 HB THR 24 HB THR 24 -4.773 -3.680 -3.016
170 HG1 THR 24 1HG THR 24 -3.714 -1.553 -4.517
171 HG21 THR 24 3HG2 THR 24 -3.795 -2.428 -1.175
172 HG22 THR 24 1HG2 THR 24 -3.029 -1.274 -2.270
173 HG23 THR 24 2HG2 THR 24 -4.780 -1.318 -2.160
174 H GLU 25 H GLU 25 -1.325 -4.033 -5.572
175 HA GLU 25 HA GLU 25 -2.630 -6.550 -6.466
176 HB2 GLU 25 1HB GLU 25 -3.575 -4.173 -7.135
177 HB3 GLU 25 2HB GLU 25 -2.213 -4.101 -8.212
178 HG2 GLU 25 1HG GLU 25 -2.997 -5.711 -9.637
179 HG3 GLU 25 2HG GLU 25 -3.770 -6.633 -8.354
180 H ASN 26 H ASN 26 0.013 -4.228 -6.919
181 HA ASN 26 HA ASN 26 1.540 -5.952 -8.723
182 HB2 ASN 26 1HB ASN 26 2.013 -3.590 -8.764
183 HB3 ASN 26 2HB ASN 26 2.413 -3.614 -7.036
184 HD21 ASN 26 1HD2 ASN 26 4.444 -2.748 -7.389
185 HD22 ASN 26 2HD2 ASN 26 5.774 -3.763 -7.922
186 H THR 27 H THR 27 1.558 -8.012 -7.739
187 HA THR 27 HA THR 27 2.255 -8.552 -5.092
188 HB THR 27 HB THR 27 2.531 -10.873 -5.904
189 HG1 THR 27 1HG THR 27 2.317 -11.323 -7.971
190 HG21 THR 27 3HG2 THR 27 0.103 -9.447 -7.104
191 HG22 THR 27 1HG2 THR 27 0.208 -11.124 -6.584
192 HG23 THR 27 2HG2 THR 27 0.284 -9.824 -5.382
193 H ALA 28 H ALA 28 4.451 -7.609 -7.595
194 HA ALA 28 HA ALA 28 6.789 -8.742 -6.417
195 HB1 ALA 28 1HB ALA 28 6.574 -6.286 -8.195
196 HB2 ALA 28 2HB ALA 28 8.005 -7.296 -7.916
197 HB3 ALA 28 3HB ALA 28 6.614 -7.976 -8.780
198 H ASN 29 H ASN 29 4.802 -6.210 -5.154
199 HA ASN 29 HA ASN 29 6.584 -6.351 -2.955
200 HB2 ASN 29 1HB ASN 29 7.589 -4.313 -2.662
201 HB3 ASN 29 2HB ASN 29 7.576 -4.363 -4.447
202 HD21 ASN 29 1HD2 ASN 29 5.315 -3.712 -5.303
203 HD22 ASN 29 2HD2 ASN 29 5.026 -2.064 -4.780
204 H CYS 30 H CYS 30 3.427 -6.069 -3.974
205 HA CYS 30 HA CYS 30 2.395 -4.380 -1.924
206 HB2 CYS 30 1HB CYS 30 0.248 -5.214 -2.511
207 HB3 CYS 30 2HB CYS 30 1.159 -4.894 -3.975
208 H GLY 31 H GLY 31 1.216 -4.906 -0.018
209 HA2 GLY 31 1HA GLY 31 0.468 -7.094 1.259
210 HA3 GLY 31 2HA GLY 31 2.225 -7.250 1.391
211 H THR 32 H THR 32 1.402 -7.090 3.792
212 HA THR 32 HA THR 32 0.318 -4.689 4.765
213 HB THR 32 HB THR 32 1.944 -6.808 6.227
214 HG1 THR 32 1HG THR 32 -0.205 -7.448 6.791
215 HG21 THR 32 3HG2 THR 32 0.073 -4.671 7.359
216 HG22 THR 32 1HG2 THR 32 0.771 -6.012 8.267
217 HG23 THR 32 2HG2 THR 32 1.826 -4.753 7.616
218 H ALA 33 H ALA 33 3.799 -5.662 4.544
219 HA ALA 33 HA ALA 33 4.794 -3.313 5.803
220 HB1 ALA 33 1HB ALA 33 6.214 -5.274 5.447
221 HB2 ALA 33 2HB ALA 33 6.092 -5.080 3.678
222 HB3 ALA 33 3HB ALA 33 6.930 -3.869 4.657
223 H CYS 34 H CYS 34 3.584 -3.864 2.532
224 HA CYS 34 HA CYS 34 4.771 -1.532 1.341
225 HB2 CYS 34 1HB CYS 34 3.714 -3.580 0.208
226 HB3 CYS 34 2HB CYS 34 2.154 -2.810 0.474
227 H CYS 35 H CYS 35 1.514 -2.264 2.651
228 HA CYS 35 HA CYS 35 0.434 0.346 2.387
229 HB2 CYS 35 1HB CYS 35 -0.178 -1.855 4.398
230 HB3 CYS 35 2HB CYS 35 -1.157 -0.411 4.165
231 H ASP 36 H ASP 36 2.188 -1.190 5.152
232 HA ASP 36 HA ASP 36 2.053 1.083 6.844
233 HB2 ASP 36 1HB ASP 36 3.524 -1.515 6.788
234 HB3 ASP 36 2HB ASP 36 4.278 -0.231 7.717
235 H SER 37 H SER 37 3.948 0.779 4.037
236 HA SER 37 HA SER 37 5.650 3.060 4.919
237 HB2 SER 37 1HB SER 37 6.278 0.676 3.181
238 HB3 SER 37 2HB SER 37 7.150 2.205 2.981
239 HG SER 37 HG SER 37 7.252 0.406 5.094
240 H CYS 38 H CYS 38 2.849 2.702 3.408
241 HA CYS 38 HA CYS 38 3.466 5.126 1.836
242 HB2 CYS 38 1HB CYS 38 2.856 2.644 0.547
243 HB3 CYS 38 2HB CYS 38 1.413 3.606 0.481
244 H PHE 39 H PHE 39 1.396 3.587 4.142
245 HA PHE 39 HA PHE 39 -0.462 5.833 3.954
246 HB2 PHE 39 1HB PHE 39 -1.240 2.887 3.861
247 HB3 PHE 39 2HB PHE 39 -2.343 4.211 4.198
248 HD1 PHE 39 1HD PHE 39 -2.729 6.021 2.456
249 HD2 PHE 39 2HD PHE 39 -0.755 2.281 1.562
250 HE1 PHE 39 1HE PHE 39 -3.328 6.252 0.054
251 HE2 PHE 39 2HE PHE 39 -1.560 2.405 -0.755
252 HZ PHE 39 HZ PHE 39 -2.814 4.428 -1.518
253 H GLU 40 H GLU 40 -1.497 6.230 5.917
254 HA GLU 40 HA GLU 40 -0.775 4.502 8.228
255 HB2 GLU 40 1HB GLU 40 -1.188 7.499 8.163
256 HB3 GLU 40 2HB GLU 40 -0.751 6.592 9.580
257 HG2 GLU 40 1HG GLU 40 1.021 6.730 7.142
258 HG3 GLU 40 2HG GLU 40 1.095 7.899 8.448
259 H LEU 41 H LEU 41 -2.280 4.851 10.072
260 HA LEU 41 HA LEU 41 -4.335 4.721 11.031
261 HB2 LEU 41 1HB LEU 41 -5.034 7.089 9.273
262 HB3 LEU 41 2HB LEU 41 -5.545 6.757 10.927
263 HG LEU 41 HG LEU 41 -2.803 7.644 9.920
264 HD11 LEU 41 1HD1 LEU 41 -3.226 9.708 10.994
265 HD12 LEU 41 2HD1 LEU 41 -4.573 9.335 9.923
266 HD13 LEU 41 3HD1 LEU 41 -4.770 9.123 11.683
267 HD21 LEU 41 3HD2 LEU 41 -2.125 7.903 12.273
268 HD22 LEU 41 1HD2 LEU 41 -3.650 7.136 12.787
269 HD23 LEU 41 2HD2 LEU 41 -2.433 6.209 11.878
270 H THR 42 H THR 42 -6.712 6.001 9.340
271 HA THR 42 HA THR 42 -7.918 3.577 8.603
272 HB THR 42 HB THR 42 -8.612 6.418 7.782
273 HG1 THR 42 1HG THR 42 -9.556 6.610 9.700
274 HG21 THR 42 3HG2 THR 42 -10.438 4.019 8.274
275 HG22 THR 42 1HG2 THR 42 -10.922 5.664 7.772
276 HG23 THR 42 2HG2 THR 42 -10.003 4.637 6.667
277 H GLY 43 H GLY 43 -5.701 5.697 6.794
278 HA2 GLY 43 1HA GLY 43 -6.374 4.778 4.142
279 HA3 GLY 43 2HA GLY 43 -4.898 5.610 4.668
280 H ASN 44 H ASN 44 -4.071 3.884 6.675
281 HA ASN 44 HA ASN 44 -2.678 1.829 5.320
282 HB2 ASN 44 1HB ASN 44 -1.918 2.794 7.430
283 HB3 ASN 44 2HB ASN 44 -3.241 2.000 8.294
284 HD21 ASN 44 1HD2 ASN 44 -0.219 1.531 6.508
285 HD22 ASN 44 2HD2 ASN 44 0.024 -0.107 7.135
286 H THR 45 H THR 45 -5.440 1.740 7.562
287 HA THR 45 HA THR 45 -6.226 -0.917 7.451
288 HB THR 45 HB THR 45 -8.088 1.467 7.385
289 HG1 THR 45 1HG THR 45 -6.477 1.714 9.068
290 HG21 THR 45 3HG2 THR 45 -8.545 -1.128 8.860
291 HG22 THR 45 1HG2 THR 45 -9.664 0.228 8.648
292 HG23 THR 45 2HG2 THR 45 -9.218 -0.764 7.260
293 H MET 46 H MET 46 -7.374 1.727 5.240
294 HA MET 46 HA MET 46 -9.023 0.040 3.677
295 HB2 MET 46 1HB MET 46 -7.719 2.714 3.081
296 HB3 MET 46 2HB MET 46 -8.866 1.944 1.985
297 HG2 MET 46 1HG MET 46 -9.817 2.165 4.779
298 HG3 MET 46 2HG MET 46 -9.400 3.697 4.039
299 HE1 MET 46 3HE MET 46 -12.939 0.997 2.919
300 HE2 MET 46 1HE MET 46 -11.286 0.355 3.008
301 HE3 MET 46 2HE MET 46 -12.067 1.005 4.467
302 H CYS 47 H CYS 47 -5.569 0.961 3.284
303 HA CYS 47 HA CYS 47 -5.104 -0.316 0.787
304 HB2 CYS 47 1HB CYS 47 -3.604 1.311 1.802
305 HB3 CYS 47 2HB CYS 47 -3.255 0.235 3.139
306 H LEU 48 H LEU 48 -4.606 -1.566 4.161
307 HA LEU 48 HA LEU 48 -3.851 -4.188 3.489
308 HB2 LEU 48 1HB LEU 48 -5.442 -3.123 5.863
309 HB3 LEU 48 2HB LEU 48 -4.796 -4.743 5.746
310 HG LEU 48 HG LEU 48 -3.145 -2.192 5.802
311 HD11 LEU 48 1HD1 LEU 48 -3.518 -4.387 7.881
312 HD12 LEU 48 2HD1 LEU 48 -2.444 -2.981 8.026
313 HD13 LEU 48 3HD1 LEU 48 -4.197 -2.746 7.967
314 HD21 LEU 48 3HD2 LEU 48 -1.199 -3.566 5.996
315 HD22 LEU 48 1HD2 LEU 48 -2.161 -5.062 5.844
316 HD23 LEU 48 2HD2 LEU 48 -1.994 -3.937 4.477
317 H LEU 49 H LEU 49 -7.110 -2.874 4.087
318 HA LEU 49 HA LEU 49 -8.632 -5.148 3.671
319 HB2 LEU 49 1HB LEU 49 -9.056 -2.257 3.606
320 HB3 LEU 49 2HB LEU 49 -10.030 -3.026 2.366
321 HG LEU 49 HG LEU 49 -10.029 -3.930 5.258
322 HD11 LEU 49 1HD1 LEU 49 -10.792 -1.599 5.118
323 HD12 LEU 49 2HD1 LEU 49 -11.922 -2.023 3.801
324 HD13 LEU 49 3HD1 LEU 49 -12.165 -2.668 5.426
325 HD21 LEU 49 3HD2 LEU 49 -12.061 -5.115 4.591
326 HD22 LEU 49 1HD2 LEU 49 -12.000 -4.385 2.963
327 HD23 LEU 49 2HD2 LEU 49 -10.791 -5.567 3.473
328 H GLN 50 H GLN 50 -7.213 -3.071 1.104
329 HA GLN 50 HA GLN 50 -8.549 -4.556 -1.024
330 HB2 GLN 50 1HB GLN 50 -7.871 -2.064 -0.973
331 HB3 GLN 50 2HB GLN 50 -6.234 -2.620 -1.182
332 HG2 GLN 50 1HG GLN 50 -7.024 -2.054 -3.362
333 HG3 GLN 50 2HG GLN 50 -7.017 -3.817 -3.315
334 HE21 GLN 50 1HE2 GLN 50 -8.629 -3.832 -5.085
335 HE22 GLN 50 2HE2 GLN 50 -10.302 -3.498 -4.680
336 H ALA 51 H ALA 51 -5.200 -4.280 0.306
337 HA ALA 51 HA ALA 51 -3.906 -5.937 -1.555
338 HB1 ALA 51 1HB ALA 51 -3.219 -5.526 1.394
339 HB2 ALA 51 2HB ALA 51 -2.112 -6.091 0.129
340 HB3 ALA 51 3HB ALA 51 -2.750 -4.436 0.073
341 H GLY 52 H GLY 52 -5.534 -6.809 1.499
342 HA2 GLY 52 1HA GLY 52 -5.146 -9.717 0.947
343 HA3 GLY 52 2HA GLY 52 -5.517 -8.957 2.494
344 H ALA 53 H ALA 53 -7.111 -8.268 -0.614
345 HA ALA 53 HA ALA 53 -9.609 -7.921 0.333
346 HB1 ALA 53 1HB ALA 53 -8.819 -9.087 -2.370
347 HB2 ALA 53 2HB ALA 53 -10.426 -8.432 -1.968
348 HB3 ALA 53 3HB ALA 53 -9.014 -7.377 -1.948
349 H ALA 54 H ALA 54 -8.883 -11.029 -1.339
350 HA ALA 54 HA ALA 54 -10.075 -12.570 0.759
351 HB1 ALA 54 1HB ALA 54 -11.453 -12.642 -1.948
352 HB2 ALA 54 2HB ALA 54 -11.900 -13.517 -0.463
353 HB3 ALA 54 3HB ALA 54 -12.102 -11.763 -0.533
354 H GLY 55 H GLY 55 -7.532 -12.458 -0.256
355 HA2 GLY 55 1HA GLY 55 -6.376 -14.716 -0.795
356 HA3 GLY 55 2HA GLY 55 -7.158 -14.488 -2.385
357 H SER 56 H SER 56 -6.659 -12.643 -3.652
358 HA SER 56 HA SER 56 -5.145 -11.396 -4.766
359 HB2 SER 56 1HB SER 56 -5.499 -9.926 -2.759
360 HB3 SER 56 2HB SER 56 -4.049 -10.631 -2.032
361 HG SER 56 HG SER 56 -3.712 -8.653 -3.068
362 H GLY 57 H GLY 57 -2.440 -10.912 -4.267
363 HA2 GLY 57 1HA GLY 57 -1.120 -13.538 -3.883
364 HA3 GLY 57 2HA GLY 57 -0.719 -12.584 -5.295
365 H CYS 58 H CYS 58 -1.482 -10.653 -2.530
366 HA CYS 58 HA CYS 58 1.221 -9.634 -2.323
367 HB2 CYS 58 1HB CYS 58 -1.273 -9.078 -0.667
368 HB3 CYS 58 2HB CYS 58 0.214 -8.139 -0.655
369 H ASP 59 H ASP 59 2.040 -9.239 0.088
370 HA ASP 59 HA ASP 59 1.823 -11.790 1.610
371 HB2 ASP 59 1HB ASP 59 4.072 -10.977 0.331
372 HB3 ASP 59 2HB ASP 59 4.327 -10.139 1.838
373 H MET 60 H MET 60 0.342 -11.289 3.137
374 HA MET 60 HA MET 60 0.701 -8.807 4.697
375 HB2 MET 60 1HB MET 60 -1.585 -10.819 4.696
376 HB3 MET 60 2HB MET 60 -1.446 -9.395 5.730
377 HG2 MET 60 1HG MET 60 -1.188 -8.099 3.454
378 HG3 MET 60 2HG MET 60 -1.959 -9.533 2.764
379 HE1 MET 60 3HE MET 60 -5.359 -9.654 4.767
380 HE2 MET 60 1HE MET 60 -4.201 -10.550 3.771
381 HE3 MET 60 2HE MET 60 -3.858 -10.259 5.494
382 H GLU 61 H GLU 61 2.332 -9.160 6.040
383 HA GLU 61 HA GLU 61 3.649 -10.047 7.680
384 HB2 GLU 61 1HB GLU 61 0.847 -9.788 8.763
385 HB3 GLU 61 2HB GLU 61 2.146 -10.349 9.828
386 HG2 GLU 61 1HG GLU 61 2.308 -7.761 8.289
387 HG3 GLU 61 2HG GLU 61 1.639 -7.890 9.915
Start of MODEL 2
1 H1 TYR 1 H TYR 1 -13.907 9.836 1.411
2 HA TYR 1 HA TYR 1 -12.338 9.918 3.172
3 HB2 TYR 1 1HB TYR 1 -12.972 7.995 4.396
4 HB3 TYR 1 2HB TYR 1 -12.541 6.908 3.080
5 HD1 TYR 1 1HD TYR 1 -10.825 9.667 5.036
6 HD2 TYR 1 2HD TYR 1 -10.537 5.664 3.371
7 HE1 TYR 1 1HE TYR 1 -8.471 9.517 5.755
8 HE2 TYR 1 2HE TYR 1 -8.251 5.531 4.124
9 HH TYR 1 HH TYR 1 -6.527 8.130 5.903
10 H ASN 2 H ASN 2 -11.447 7.094 1.132
11 HA ASN 2 HA ASN 2 -9.938 6.656 -0.320
12 HB2 ASN 2 1HB ASN 2 -9.825 9.565 -0.839
13 HB3 ASN 2 2HB ASN 2 -8.390 8.639 -1.203
14 HD21 ASN 2 1HD2 ASN 2 -8.355 8.258 -3.424
15 HD22 ASN 2 2HD2 ASN 2 -9.762 7.734 -4.292
16 HA PRO 3 HA PRO 3 -6.682 6.292 2.824
17 HB2 PRO 3 1HB PRO 3 -5.012 4.697 1.170
18 HB3 PRO 3 2HB PRO 3 -6.200 4.104 2.334
19 HG2 PRO 3 1HG PRO 3 -6.447 4.354 -0.607
20 HG3 PRO 3 2HG PRO 3 -7.262 3.216 0.527
21 HD2 PRO 3 1HD PRO 3 -8.543 5.273 -0.622
22 HD3 PRO 3 2HD PRO 3 -8.946 4.652 0.992
23 H GLU 4 H GLU 4 -6.293 7.482 -0.437
24 HA GLU 4 HA GLU 4 -3.648 8.457 -0.264
25 HB2 GLU 4 1HB GLU 4 -6.077 9.242 -1.896
26 HB3 GLU 4 2HB GLU 4 -4.473 9.917 -2.194
27 HG2 GLU 4 1HG GLU 4 -3.535 7.807 -2.792
28 HG3 GLU 4 2HG GLU 4 -4.873 6.899 -2.087
29 H ASP 5 H ASP 5 -6.268 9.434 1.630
30 HA ASP 5 HA ASP 5 -5.525 12.222 2.073
31 HB2 ASP 5 1HB ASP 5 -7.812 11.199 2.514
32 HB3 ASP 5 2HB ASP 5 -7.087 10.305 3.847
33 H ASP 6 H ASP 6 -4.510 9.057 3.257
34 HA ASP 6 HA ASP 6 -2.563 10.238 5.209
35 HB2 ASP 6 1HB ASP 6 -4.207 7.701 5.419
36 HB3 ASP 6 2HB ASP 6 -2.812 8.045 6.388
37 H TYR 7 H TYR 7 -2.491 9.624 2.282
38 HA TYR 7 HA TYR 7 -0.528 7.513 1.943
39 HB2 TYR 7 1HB TYR 7 -1.586 8.051 -0.045
40 HB3 TYR 7 2HB TYR 7 -1.615 9.780 0.299
41 HD1 TYR 7 2HD TYR 7 0.788 7.003 -0.482
42 HD2 TYR 7 1HD TYR 7 -0.094 11.214 -0.727
43 HE1 TYR 7 2HE TYR 7 2.695 7.323 -2.073
44 HE2 TYR 7 1HE TYR 7 1.822 11.548 -2.242
45 HH TYR 7 HH TYR 7 3.247 10.423 -3.685
46 H THR 8 H THR 8 1.647 7.684 2.405
47 HA THR 8 HA THR 8 2.647 10.329 3.322
48 HB THR 8 HB THR 8 4.170 9.020 4.738
49 HG1 THR 8 1HG THR 8 4.193 7.047 3.763
50 HG21 THR 8 3HG2 THR 8 2.468 8.594 6.392
51 HG22 THR 8 1HG2 THR 8 1.928 9.979 5.446
52 HG23 THR 8 2HG2 THR 8 1.218 8.393 5.148
53 HA PRO 9 HA PRO 9 5.051 9.559 -0.531
54 HB2 PRO 9 1HB PRO 9 5.757 12.204 -0.938
55 HB3 PRO 9 2HB PRO 9 4.273 11.453 -1.573
56 HG2 PRO 9 1HG PRO 9 4.614 13.160 0.882
57 HG3 PRO 9 2HG PRO 9 3.267 13.168 -0.300
58 HD2 PRO 9 1HD PRO 9 3.096 11.958 2.115
59 HD3 PRO 9 2HD PRO 9 2.278 11.287 0.684
60 H LEU 10 H LEU 10 5.855 11.311 2.450
61 HA LEU 10 HA LEU 10 8.543 11.662 2.405
62 HB2 LEU 10 1HB LEU 10 6.587 10.664 4.538
63 HB3 LEU 10 2HB LEU 10 8.284 10.946 4.879
64 HG LEU 10 HG LEU 10 8.068 13.256 4.049
65 HD11 LEU 10 1HD1 LEU 10 6.165 13.329 2.642
66 HD12 LEU 10 2HD1 LEU 10 5.109 12.663 3.928
67 HD13 LEU 10 3HD1 LEU 10 5.780 14.304 4.039
68 HD21 LEU 10 3HD2 LEU 10 6.267 12.541 6.385
69 HD22 LEU 10 1HD2 LEU 10 8.009 12.795 6.453
70 HD23 LEU 10 2HD2 LEU 10 6.941 14.144 6.052
71 H THR 11 H THR 11 6.776 8.601 3.002
72 HA THR 11 HA THR 11 9.298 7.084 3.099
73 HB THR 11 HB THR 11 7.593 5.614 4.516
74 HG1 THR 11 1HG THR 11 5.965 6.770 5.412
75 HG21 THR 11 3HG2 THR 11 9.607 6.749 5.407
76 HG22 THR 11 1HG2 THR 11 8.717 8.276 5.518
77 HG23 THR 11 2HG2 THR 11 8.247 6.901 6.535
78 H CYS 12 H CYS 12 6.659 7.656 1.048
79 HA CYS 12 HA CYS 12 6.377 4.859 0.325
80 HB2 CYS 12 1HB CYS 12 4.436 6.439 0.506
81 HB3 CYS 12 2HB CYS 12 4.985 7.191 -1.004
82 HA PRO 13 HA PRO 13 9.326 5.514 -3.105
83 HB2 PRO 13 1HB PRO 13 9.540 2.907 -3.920
84 HB3 PRO 13 2HB PRO 13 10.349 3.563 -2.471
85 HG2 PRO 13 1HG PRO 13 7.751 2.033 -2.622
86 HG3 PRO 13 2HG PRO 13 9.106 1.757 -1.502
87 HD2 PRO 13 1HD PRO 13 6.903 3.165 -0.811
88 HD3 PRO 13 2HD PRO 13 8.523 3.590 -0.186
89 H HIS 14 H HIS 14 6.136 5.502 -3.240
90 HA HIS 14 HA HIS 14 5.870 4.900 -6.134
91 HB2 HIS 14 1HB HIS 14 3.651 4.354 -4.210
92 HB3 HIS 14 2HB HIS 14 3.900 3.709 -5.826
93 HD1 HIS 14 1HD HIS 14 6.289 2.014 -5.887
94 HD2 HIS 14 2HD HIS 14 3.757 2.363 -2.556
95 HE1 HIS 14 1HE HIS 14 6.425 -0.126 -4.596
96 HE2 HIS 14 2HE HIS 14 4.962 0.066 -2.615
97 H THR 15 H THR 15 4.894 6.573 -7.191
98 HA THR 15 HA THR 15 4.300 8.973 -5.645
99 HB THR 15 HB THR 15 4.107 10.014 -7.812
100 HG1 THR 15 1HG THR 15 4.771 7.623 -9.166
101 HG21 THR 15 3HG2 THR 15 6.356 9.705 -6.949
102 HG22 THR 15 1HG2 THR 15 6.458 8.085 -7.650
103 HG23 THR 15 2HG2 THR 15 6.369 9.488 -8.711
104 H ILE 16 H ILE 16 2.198 10.129 -5.742
105 HA ILE 16 HA ILE 16 0.203 8.338 -4.999
106 HB ILE 16 HB ILE 16 0.532 10.742 -4.327
107 HG12 ILE 16 1HG1 ILE 16 -2.318 9.807 -4.870
108 HG13 ILE 16 2HG1 ILE 16 -1.307 9.379 -3.489
109 HG21 ILE 16 1HG2 ILE 16 -0.485 12.514 -5.526
110 HG22 ILE 16 2HG2 ILE 16 0.496 11.592 -6.687
111 HG23 ILE 16 3HG2 ILE 16 -1.272 11.404 -6.670
112 HD11 ILE 16 3HD1 ILE 16 -2.404 12.133 -4.164
113 HD12 ILE 16 1HD1 ILE 16 -2.741 11.137 -2.743
114 HD13 ILE 16 2HD1 ILE 16 -1.138 11.860 -2.941
115 H SER 17 H SER 17 1.012 9.413 -8.154
116 HA SER 17 HA SER 17 -1.416 9.054 -9.587
117 HB2 SER 17 1HB SER 17 0.628 10.167 -10.458
118 HB3 SER 17 2HB SER 17 1.489 8.622 -10.409
119 HG SER 17 HG SER 17 -0.484 9.559 -12.168
120 H VAL 18 H VAL 18 1.064 6.831 -8.335
121 HA VAL 18 HA VAL 18 -0.532 4.463 -9.195
122 HB VAL 18 HB VAL 18 1.314 3.393 -10.212
123 HG11 VAL 18 1HG1 VAL 18 1.417 6.210 -11.350
124 HG12 VAL 18 2HG1 VAL 18 1.765 4.684 -12.172
125 HG13 VAL 18 3HG1 VAL 18 0.111 5.041 -11.658
126 HG21 VAL 18 3HG2 VAL 18 3.521 4.898 -10.501
127 HG22 VAL 18 1HG2 VAL 18 2.955 5.530 -8.925
128 HG23 VAL 18 2HG2 VAL 18 3.278 3.787 -9.148
129 H VAL 19 H VAL 19 -0.373 5.627 -6.582
130 HA VAL 19 HA VAL 19 1.368 3.673 -5.198
131 HB VAL 19 HB VAL 19 1.396 5.907 -4.366
132 HG11 VAL 19 1HG1 VAL 19 -1.492 5.565 -3.435
133 HG12 VAL 19 2HG1 VAL 19 -0.437 6.946 -3.142
134 HG13 VAL 19 3HG1 VAL 19 -0.995 6.583 -4.779
135 HG21 VAL 19 3HG2 VAL 19 0.136 4.000 -2.348
136 HG22 VAL 19 1HG2 VAL 19 1.822 3.947 -2.873
137 HG23 VAL 19 2HG2 VAL 19 1.211 5.360 -1.993
138 H TRP 20 H TRP 20 -2.205 4.301 -5.308
139 HA TRP 20 HA TRP 20 -2.804 2.233 -3.515
140 HB2 TRP 20 1HB TRP 20 -4.407 3.958 -4.174
141 HB3 TRP 20 2HB TRP 20 -4.484 3.303 -5.809
142 HD1 TRP 20 HD TRP 20 -6.275 1.520 -6.234
143 HE1 TRP 20 1HE TRP 20 -7.917 0.177 -4.836
144 HE3 TRP 20 3HE TRP 20 -4.488 2.682 -1.548
145 HZ2 TRP 20 2HZ TRP 20 -8.414 -0.342 -2.009
146 HZ3 TRP 20 3HZ TRP 20 -5.492 1.670 0.423
147 HH2 TRP 20 HH TRP 20 -7.516 0.219 0.211
148 H TYR 21 H TYR 21 -2.980 2.033 -7.114
149 HA TYR 21 HA TYR 21 -3.488 -0.690 -7.408
150 HB2 TYR 21 1HB TYR 21 -3.485 0.494 -9.409
151 HB3 TYR 21 2HB TYR 21 -2.037 1.397 -8.993
152 HD1 TYR 21 1HD TYR 21 -3.169 -2.006 -10.108
153 HD2 TYR 21 2HD TYR 21 0.131 0.751 -9.687
154 HE1 TYR 21 1HE TYR 21 -1.725 -3.499 -11.458
155 HE2 TYR 21 2HE TYR 21 1.562 -0.747 -11.055
156 HH TYR 21 HH TYR 21 0.176 -3.415 -12.881
157 H GLU 22 H GLU 22 -0.221 0.878 -7.020
158 HA GLU 22 HA GLU 22 1.321 -1.450 -7.578
159 HB2 GLU 22 1HB GLU 22 2.690 0.454 -7.717
160 HB3 GLU 22 2HB GLU 22 1.436 1.306 -6.927
161 HG2 GLU 22 1HG GLU 22 3.429 1.563 -5.884
162 HG3 GLU 22 2HG GLU 22 2.284 0.923 -4.725
163 H CYS 23 H CYS 23 -0.099 -0.100 -4.494
164 HA CYS 23 HA CYS 23 1.653 -1.843 -2.934
165 HB2 CYS 23 1HB CYS 23 0.984 0.727 -2.627
166 HB3 CYS 23 2HB CYS 23 -0.425 0.060 -1.852
167 H THR 24 H THR 24 -1.406 -1.969 -4.427
168 HA THR 24 HA THR 24 -2.326 -3.877 -2.434
169 HB THR 24 HB THR 24 -4.539 -3.130 -2.590
170 HG1 THR 24 1HG THR 24 -3.633 -1.130 -4.384
171 HG21 THR 24 3HG2 THR 24 -2.760 -0.692 -2.160
172 HG22 THR 24 1HG2 THR 24 -4.433 -0.908 -1.605
173 HG23 THR 24 2HG2 THR 24 -3.150 -1.950 -0.966
174 H GLU 25 H GLU 25 -1.303 -3.705 -5.581
175 HA GLU 25 HA GLU 25 -2.868 -6.100 -6.327
176 HB2 GLU 25 1HB GLU 25 -3.661 -3.909 -7.360
177 HB3 GLU 25 2HB GLU 25 -2.165 -3.850 -8.259
178 HG2 GLU 25 1HG GLU 25 -3.650 -6.438 -8.392
179 HG3 GLU 25 2HG GLU 25 -4.464 -5.047 -9.107
180 H ASN 26 H ASN 26 -0.080 -4.076 -7.197
181 HA ASN 26 HA ASN 26 1.228 -6.017 -8.780
182 HB2 ASN 26 1HB ASN 26 1.606 -3.571 -8.878
183 HB3 ASN 26 2HB ASN 26 2.457 -3.659 -7.323
184 HD21 ASN 26 1HD2 ASN 26 4.173 -2.626 -8.556
185 HD22 ASN 26 2HD2 ASN 26 5.232 -3.575 -9.577
186 H THR 27 H THR 27 1.510 -8.051 -7.691
187 HA THR 27 HA THR 27 1.823 -8.248 -4.934
188 HB THR 27 HB THR 27 2.205 -10.622 -5.250
189 HG1 THR 27 1HG THR 27 2.378 -10.058 -8.022
190 HG21 THR 27 3HG2 THR 27 0.227 -11.246 -6.557
191 HG22 THR 27 1HG2 THR 27 -0.092 -9.899 -5.453
192 HG23 THR 27 2HG2 THR 27 0.103 -9.602 -7.193
193 H ALA 28 H ALA 28 4.327 -7.798 -7.251
194 HA ALA 28 HA ALA 28 6.571 -8.854 -5.926
195 HB1 ALA 28 1HB ALA 28 6.285 -6.338 -7.648
196 HB2 ALA 28 2HB ALA 28 7.799 -7.195 -7.315
197 HB3 ALA 28 3HB ALA 28 6.540 -7.989 -8.266
198 H ASN 29 H ASN 29 4.542 -6.191 -5.064
199 HA ASN 29 HA ASN 29 6.507 -5.242 -3.021
200 HB2 ASN 29 1HB ASN 29 4.588 -3.467 -4.537
201 HB3 ASN 29 2HB ASN 29 5.916 -2.968 -3.492
202 HD21 ASN 29 1HD2 ASN 29 5.253 -2.288 -6.302
203 HD22 ASN 29 2HD2 ASN 29 6.508 -2.856 -7.369
204 H CYS 30 H CYS 30 3.109 -5.287 -4.110
205 HA CYS 30 HA CYS 30 1.809 -4.164 -2.037
206 HB2 CYS 30 1HB CYS 30 0.461 -4.533 -3.779
207 HB3 CYS 30 2HB CYS 30 1.118 -6.113 -4.174
208 H GLY 31 H GLY 31 0.962 -4.612 -0.100
209 HA2 GLY 31 1HA GLY 31 0.144 -6.717 1.166
210 HA3 GLY 31 2HA GLY 31 1.887 -7.046 1.264
211 H THR 32 H THR 32 1.037 -6.936 3.580
212 HA THR 32 HA THR 32 0.158 -4.644 4.777
213 HB THR 32 HB THR 32 1.935 -6.695 6.154
214 HG1 THR 32 1HG THR 32 0.659 -8.025 5.464
215 HG21 THR 32 3HG2 THR 32 -0.498 -5.425 7.385
216 HG22 THR 32 1HG2 THR 32 0.841 -6.295 8.131
217 HG23 THR 32 2HG2 THR 32 1.112 -4.671 7.506
218 H ALA 33 H ALA 33 3.620 -5.536 4.364
219 HA ALA 33 HA ALA 33 4.558 -3.343 5.963
220 HB1 ALA 33 1HB ALA 33 5.896 -5.408 5.516
221 HB2 ALA 33 2HB ALA 33 6.008 -4.944 3.796
222 HB3 ALA 33 3HB ALA 33 6.765 -3.947 5.033
223 H CYS 34 H CYS 34 4.069 -3.743 2.417
224 HA CYS 34 HA CYS 34 5.051 -1.210 1.601
225 HB2 CYS 34 1HB CYS 34 4.443 -2.953 -0.001
226 HB3 CYS 34 2HB CYS 34 2.746 -2.854 0.461
227 H CYS 35 H CYS 35 1.743 -2.236 2.588
228 HA CYS 35 HA CYS 35 0.505 0.261 2.390
229 HB2 CYS 35 1HB CYS 35 -0.028 -2.048 4.289
230 HB3 CYS 35 2HB CYS 35 -1.059 -0.629 4.175
231 H ASP 36 H ASP 36 2.055 -1.132 5.377
232 HA ASP 36 HA ASP 36 1.596 1.266 6.892
233 HB2 ASP 36 1HB ASP 36 2.443 -1.368 7.381
234 HB3 ASP 36 2HB ASP 36 3.827 -0.411 7.803
235 H SER 37 H SER 37 3.818 0.820 4.490
236 HA SER 37 HA SER 37 5.678 2.933 5.497
237 HB2 SER 37 1HB SER 37 5.825 1.304 2.930
238 HB3 SER 37 2HB SER 37 7.083 2.337 3.624
239 HG SER 37 HG SER 37 6.129 -0.182 4.446
240 H CYS 38 H CYS 38 2.899 2.550 3.411
241 HA CYS 38 HA CYS 38 3.505 5.139 2.029
242 HB2 CYS 38 1HB CYS 38 2.195 2.579 1.091
243 HB3 CYS 38 2HB CYS 38 1.916 4.109 0.276
244 H PHE 39 H PHE 39 1.251 3.512 4.124
245 HA PHE 39 HA PHE 39 -0.673 5.704 3.912
246 HB2 PHE 39 1HB PHE 39 -1.334 2.743 3.679
247 HB3 PHE 39 2HB PHE 39 -2.497 4.019 3.936
248 HD1 PHE 39 1HD PHE 39 -2.591 5.937 2.196
249 HD2 PHE 39 2HD PHE 39 -0.788 2.101 1.453
250 HE1 PHE 39 1HE PHE 39 -3.045 6.174 -0.253
251 HE2 PHE 39 2HE PHE 39 -1.241 2.310 -0.943
252 HZ PHE 39 HZ PHE 39 -2.413 4.346 -1.799
253 H GLU 40 H GLU 40 -1.473 6.138 5.899
254 HA GLU 40 HA GLU 40 -0.720 4.310 8.145
255 HB2 GLU 40 1HB GLU 40 -0.905 7.315 8.259
256 HB3 GLU 40 2HB GLU 40 -0.211 6.205 9.460
257 HG2 GLU 40 1HG GLU 40 1.370 5.485 7.452
258 HG3 GLU 40 2HG GLU 40 0.876 7.052 6.807
259 H LEU 41 H LEU 41 -2.022 4.615 10.063
260 HA LEU 41 HA LEU 41 -4.000 4.540 11.162
261 HB2 LEU 41 1HB LEU 41 -4.449 7.122 9.618
262 HB3 LEU 41 2HB LEU 41 -5.210 6.685 11.146
263 HG LEU 41 HG LEU 41 -2.220 7.145 10.754
264 HD11 LEU 41 1HD1 LEU 41 -2.587 9.209 12.007
265 HD12 LEU 41 2HD1 LEU 41 -3.521 9.184 10.511
266 HD13 LEU 41 3HD1 LEU 41 -4.335 8.881 12.074
267 HD21 LEU 41 3HD2 LEU 41 -2.623 5.565 12.591
268 HD22 LEU 41 1HD2 LEU 41 -2.122 7.132 13.222
269 HD23 LEU 41 2HD2 LEU 41 -3.837 6.659 13.299
270 H THR 42 H THR 42 -6.409 6.033 9.614
271 HA THR 42 HA THR 42 -7.883 3.700 8.964
272 HB THR 42 HB THR 42 -8.141 6.650 8.281
273 HG1 THR 42 1HG THR 42 -8.378 5.806 10.472
274 HG21 THR 42 3HG2 THR 42 -9.460 5.311 6.584
275 HG22 THR 42 1HG2 THR 42 -10.356 4.614 7.929
276 HG23 THR 42 2HG2 THR 42 -10.426 6.366 7.628
277 H GLY 43 H GLY 43 -5.603 5.574 6.993
278 HA2 GLY 43 1HA GLY 43 -6.439 4.543 4.440
279 HA3 GLY 43 2HA GLY 43 -4.947 5.422 4.829
280 H ASN 44 H ASN 44 -4.085 3.699 6.947
281 HA ASN 44 HA ASN 44 -2.772 1.591 5.541
282 HB2 ASN 44 1HB ASN 44 -1.991 2.567 7.761
283 HB3 ASN 44 2HB ASN 44 -3.270 1.656 8.556
284 HD21 ASN 44 1HD2 ASN 44 -0.472 1.407 6.427
285 HD22 ASN 44 2HD2 ASN 44 -0.067 -0.256 6.868
286 H THR 45 H THR 45 -5.565 1.540 7.866
287 HA THR 45 HA THR 45 -6.176 -1.137 7.598
288 HB THR 45 HB THR 45 -8.458 0.798 7.566
289 HG1 THR 45 1HG THR 45 -6.810 0.555 9.845
290 HG21 THR 45 3HG2 THR 45 -7.851 -1.577 9.346
291 HG22 THR 45 1HG2 THR 45 -9.368 -0.651 9.326
292 HG23 THR 45 2HG2 THR 45 -8.884 -1.609 7.910
293 H MET 46 H MET 46 -7.438 1.539 5.426
294 HA MET 46 HA MET 46 -8.917 -0.308 3.830
295 HB2 MET 46 1HB MET 46 -7.900 2.480 3.076
296 HB3 MET 46 2HB MET 46 -8.899 1.441 2.046
297 HG2 MET 46 1HG MET 46 -10.423 1.259 4.169
298 HG3 MET 46 2HG MET 46 -9.584 2.726 4.676
299 HE1 MET 46 3HE MET 46 -12.654 2.475 4.516
300 HE2 MET 46 1HE MET 46 -11.756 3.939 4.970
301 HE3 MET 46 2HE MET 46 -13.075 4.040 3.786
302 H CYS 47 H CYS 47 -5.505 0.773 3.482
303 HA CYS 47 HA CYS 47 -4.998 -0.470 0.980
304 HB2 CYS 47 1HB CYS 47 -3.571 1.213 2.076
305 HB3 CYS 47 2HB CYS 47 -3.135 0.053 3.323
306 H LEU 48 H LEU 48 -4.568 -1.741 4.321
307 HA LEU 48 HA LEU 48 -3.661 -4.325 3.649
308 HB2 LEU 48 1HB LEU 48 -5.436 -3.380 5.958
309 HB3 LEU 48 2HB LEU 48 -4.656 -4.939 5.866
310 HG LEU 48 HG LEU 48 -3.278 -2.242 6.117
311 HD11 LEU 48 1HD1 LEU 48 -2.491 -3.152 8.258
312 HD12 LEU 48 2HD1 LEU 48 -4.253 -3.095 8.184
313 HD13 LEU 48 3HD1 LEU 48 -3.401 -4.648 7.969
314 HD21 LEU 48 3HD2 LEU 48 -1.172 -3.469 6.265
315 HD22 LEU 48 1HD2 LEU 48 -2.025 -4.964 5.768
316 HD23 LEU 48 2HD2 LEU 48 -1.897 -3.580 4.664
317 H LEU 49 H LEU 49 -6.972 -3.154 4.161
318 HA LEU 49 HA LEU 49 -8.289 -5.582 3.698
319 HB2 LEU 49 1HB LEU 49 -8.953 -2.838 4.194
320 HB3 LEU 49 2HB LEU 49 -9.872 -3.302 2.798
321 HG LEU 49 HG LEU 49 -9.762 -5.068 5.293
322 HD11 LEU 49 1HD1 LEU 49 -10.329 -2.854 6.062
323 HD12 LEU 49 2HD1 LEU 49 -11.616 -2.705 4.825
324 HD13 LEU 49 3HD1 LEU 49 -11.730 -3.917 6.139
325 HD21 LEU 49 3HD2 LEU 49 -11.926 -4.683 3.176
326 HD22 LEU 49 1HD2 LEU 49 -10.805 -6.057 3.282
327 HD23 LEU 49 2HD2 LEU 49 -11.990 -5.796 4.566
328 H GLN 50 H GLN 50 -7.150 -3.244 1.277
329 HA GLN 50 HA GLN 50 -8.421 -4.706 -0.915
330 HB2 GLN 50 1HB GLN 50 -7.877 -2.283 -0.988
331 HB3 GLN 50 2HB GLN 50 -6.164 -2.670 -0.956
332 HG2 GLN 50 1HG GLN 50 -6.752 -2.219 -3.232
333 HG3 GLN 50 2HG GLN 50 -6.461 -3.955 -3.112
334 HE21 GLN 50 1HE2 GLN 50 -7.728 -4.605 -4.872
335 HE22 GLN 50 2HE2 GLN 50 -9.488 -4.506 -4.813
336 H ALA 51 H ALA 51 -5.011 -4.458 0.359
337 HA ALA 51 HA ALA 51 -3.932 -6.184 -1.626
338 HB1 ALA 51 1HB ALA 51 -2.538 -4.591 -0.387
339 HB2 ALA 51 2HB ALA 51 -2.840 -5.483 1.130
340 HB3 ALA 51 3HB ALA 51 -1.927 -6.226 -0.201
341 H GLY 52 H GLY 52 -4.770 -6.973 1.822
342 HA2 GLY 52 1HA GLY 52 -4.265 -9.833 1.334
343 HA3 GLY 52 2HA GLY 52 -4.670 -9.068 2.857
344 H ALA 53 H ALA 53 -6.678 -8.362 0.045
345 HA ALA 53 HA ALA 53 -9.058 -9.164 1.352
346 HB1 ALA 53 1HB ALA 53 -8.568 -8.623 -1.618
347 HB2 ALA 53 2HB ALA 53 -10.150 -8.697 -0.801
348 HB3 ALA 53 3HB ALA 53 -8.996 -7.431 -0.391
349 H ALA 54 H ALA 54 -8.267 -10.549 -1.868
350 HA ALA 54 HA ALA 54 -8.003 -13.261 -1.105
351 HB1 ALA 54 1HB ALA 54 -10.097 -14.035 -2.155
352 HB2 ALA 54 2HB ALA 54 -10.476 -12.996 -0.765
353 HB3 ALA 54 3HB ALA 54 -10.616 -12.357 -2.419
354 H GLY 55 H GLY 55 -7.591 -14.486 -3.048
355 HA2 GLY 55 1HA GLY 55 -6.980 -14.918 -5.200
356 HA3 GLY 55 2HA GLY 55 -7.595 -13.341 -5.707
357 H SER 56 H SER 56 -6.027 -11.856 -3.756
358 HA SER 56 HA SER 56 -4.378 -10.733 -5.409
359 HB2 SER 56 1HB SER 56 -3.318 -9.704 -3.312
360 HB3 SER 56 2HB SER 56 -5.074 -9.601 -3.554
361 HG SER 56 HG SER 56 -4.438 -10.103 -1.464
362 H GLY 57 H GLY 57 -2.959 -13.016 -2.951
363 HA2 GLY 57 1HA GLY 57 -0.925 -14.165 -3.101
364 HA3 GLY 57 2HA GLY 57 -0.692 -13.546 -4.741
365 H CYS 58 H CYS 58 -1.447 -11.333 -2.124
366 HA CYS 58 HA CYS 58 1.272 -10.123 -2.194
367 HB2 CYS 58 1HB CYS 58 -1.429 -9.116 -1.233
368 HB3 CYS 58 2HB CYS 58 0.088 -8.265 -1.017
369 H ASP 59 H ASP 59 2.056 -9.347 -0.039
370 HA ASP 59 HA ASP 59 2.094 -11.431 1.944
371 HB2 ASP 59 1HB ASP 59 3.338 -8.762 1.382
372 HB3 ASP 59 2HB ASP 59 3.161 -9.155 3.069
373 H MET 60 H MET 60 0.476 -11.705 3.547
374 HA MET 60 HA MET 60 -0.806 -9.259 4.585
375 HB2 MET 60 1HB MET 60 -2.940 -10.506 4.852
376 HB3 MET 60 2HB MET 60 -2.522 -10.010 3.216
377 HG2 MET 60 1HG MET 60 -1.825 -12.248 2.654
378 HG3 MET 60 2HG MET 60 -2.135 -12.813 4.312
379 HE1 MET 60 3HE MET 60 -4.940 -14.671 2.343
380 HE2 MET 60 1HE MET 60 -3.235 -14.429 1.896
381 HE3 MET 60 2HE MET 60 -3.671 -14.809 3.578
382 H GLU 61 H GLU 61 -0.792 -9.117 6.723
383 HA GLU 61 HA GLU 61 -0.501 -11.604 8.339
384 HB2 GLU 61 1HB GLU 61 0.040 -10.329 10.184
385 HB3 GLU 61 2HB GLU 61 0.892 -9.499 8.896
386 HG2 GLU 61 1HG GLU 61 -0.748 -7.722 8.847
387 HG3 GLU 61 2HG GLU 61 -1.806 -8.586 9.970
Start of MODEL 3
1 H1 TYR 1 H TYR 1 -14.468 8.269 0.947
2 HA TYR 1 HA TYR 1 -13.266 8.656 3.009
3 HB2 TYR 1 1HB TYR 1 -13.304 6.456 3.931
4 HB3 TYR 1 2HB TYR 1 -12.386 5.796 2.601
5 HD1 TYR 1 1HD TYR 1 -11.974 8.631 5.138
6 HD2 TYR 1 2HD TYR 1 -10.111 5.392 2.968
7 HE1 TYR 1 1HE TYR 1 -9.892 8.976 6.397
8 HE2 TYR 1 2HE TYR 1 -8.129 5.608 4.380
9 HH TYR 1 HH TYR 1 -7.281 8.314 6.259
10 H ASN 2 H ASN 2 -11.560 6.625 0.536
11 HA ASN 2 HA ASN 2 -9.971 6.941 -0.851
12 HB2 ASN 2 1HB ASN 2 -10.412 9.861 -0.513
13 HB3 ASN 2 2HB ASN 2 -8.926 9.235 -1.253
14 HD21 ASN 2 1HD2 ASN 2 -10.040 10.690 -2.893
15 HD22 ASN 2 2HD2 ASN 2 -11.045 9.800 -4.037
16 HA PRO 3 HA PRO 3 -7.161 6.392 2.681
17 HB2 PRO 3 1HB PRO 3 -5.325 4.803 1.245
18 HB3 PRO 3 2HB PRO 3 -6.723 4.188 2.138
19 HG2 PRO 3 1HG PRO 3 -6.481 4.703 -0.798
20 HG3 PRO 3 2HG PRO 3 -7.414 3.429 0.089
21 HD2 PRO 3 1HD PRO 3 -8.607 5.526 -1.016
22 HD3 PRO 3 2HD PRO 3 -9.182 4.769 0.518
23 H GLU 4 H GLU 4 -6.441 7.664 -0.504
24 HA GLU 4 HA GLU 4 -3.820 8.479 -0.029
25 HB2 GLU 4 1HB GLU 4 -5.983 9.400 -1.901
26 HB3 GLU 4 2HB GLU 4 -4.353 10.055 -1.983
27 HG2 GLU 4 1HG GLU 4 -3.362 7.941 -2.497
28 HG3 GLU 4 2HG GLU 4 -4.822 7.052 -2.064
29 H ASP 5 H ASP 5 -6.597 9.687 1.574
30 HA ASP 5 HA ASP 5 -5.687 12.388 2.100
31 HB2 ASP 5 1HB ASP 5 -7.589 10.447 3.414
32 HB3 ASP 5 2HB ASP 5 -6.995 11.814 4.346
33 H ASP 6 H ASP 6 -5.058 9.186 3.550
34 HA ASP 6 HA ASP 6 -3.004 10.348 5.385
35 HB2 ASP 6 1HB ASP 6 -4.570 7.767 5.561
36 HB3 ASP 6 2HB ASP 6 -3.205 8.182 6.585
37 H TYR 7 H TYR 7 -2.850 9.838 2.474
38 HA TYR 7 HA TYR 7 -0.817 7.891 1.885
39 HB2 TYR 7 1HB TYR 7 -2.014 9.227 0.181
40 HB3 TYR 7 2HB TYR 7 -1.425 10.716 0.888
41 HD1 TYR 7 2HD TYR 7 0.002 7.459 -0.456
42 HD2 TYR 7 1HD TYR 7 0.185 11.800 -0.397
43 HE1 TYR 7 2HE TYR 7 1.653 7.458 -2.209
44 HE2 TYR 7 1HE TYR 7 1.998 11.733 -2.099
45 HH TYR 7 HH TYR 7 3.417 8.642 -3.176
46 H THR 8 H THR 8 1.325 7.941 2.488
47 HA THR 8 HA THR 8 2.425 10.582 3.247
48 HB THR 8 HB THR 8 3.642 9.939 4.922
49 HG1 THR 8 1HG THR 8 4.010 7.274 4.106
50 HG21 THR 8 3HG2 THR 8 1.411 9.061 5.643
51 HG22 THR 8 1HG2 THR 8 1.876 7.454 5.075
52 HG23 THR 8 2HG2 THR 8 2.776 8.218 6.391
53 HA PRO 9 HA PRO 9 4.565 9.378 -0.591
54 HB2 PRO 9 1HB PRO 9 5.909 11.877 -0.681
55 HB3 PRO 9 2HB PRO 9 4.528 11.368 -1.682
56 HG2 PRO 9 1HG PRO 9 4.544 13.336 0.469
57 HG3 PRO 9 2HG PRO 9 3.196 12.869 -0.581
58 HD2 PRO 9 1HD PRO 9 3.682 12.128 2.187
59 HD3 PRO 9 2HD PRO 9 2.262 11.767 1.179
60 H LEU 10 H LEU 10 5.748 11.081 2.320
61 HA LEU 10 HA LEU 10 8.376 11.080 1.831
62 HB2 LEU 10 1HB LEU 10 6.785 11.151 4.407
63 HB3 LEU 10 2HB LEU 10 8.545 11.264 4.406
64 HG LEU 10 HG LEU 10 8.365 13.131 2.735
65 HD11 LEU 10 1HD1 LEU 10 6.248 14.489 2.822
66 HD12 LEU 10 2HD1 LEU 10 6.177 13.003 1.898
67 HD13 LEU 10 3HD1 LEU 10 5.439 13.079 3.530
68 HD21 LEU 10 3HD2 LEU 10 8.909 13.552 5.092
69 HD22 LEU 10 1HD2 LEU 10 7.912 14.856 4.463
70 HD23 LEU 10 2HD2 LEU 10 7.182 13.621 5.508
71 H THR 11 H THR 11 6.628 8.297 3.248
72 HA THR 11 HA THR 11 9.245 6.861 3.202
73 HB THR 11 HB THR 11 8.202 5.427 5.021
74 HG1 THR 11 1HG THR 11 6.035 6.274 4.842
75 HG21 THR 11 3HG2 THR 11 8.826 8.361 5.607
76 HG22 THR 11 1HG2 THR 11 8.840 7.046 6.782
77 HG23 THR 11 2HG2 THR 11 10.003 7.039 5.450
78 H CYS 12 H CYS 12 7.140 7.283 0.996
79 HA CYS 12 HA CYS 12 6.557 4.379 0.688
80 HB2 CYS 12 1HB CYS 12 4.716 5.939 0.574
81 HB3 CYS 12 2HB CYS 12 5.296 6.596 -0.928
82 HA PRO 13 HA PRO 13 9.698 4.355 -2.573
83 HB2 PRO 13 1HB PRO 13 9.033 1.846 -3.581
84 HB3 PRO 13 2HB PRO 13 10.128 2.158 -2.219
85 HG2 PRO 13 1HG PRO 13 7.234 1.353 -2.169
86 HG3 PRO 13 2HG PRO 13 8.586 0.795 -1.108
87 HD2 PRO 13 1HD PRO 13 6.792 2.642 -0.323
88 HD3 PRO 13 2HD PRO 13 8.508 2.752 0.186
89 H HIS 14 H HIS 14 6.520 5.045 -2.984
90 HA HIS 14 HA HIS 14 6.409 4.483 -5.903
91 HB2 HIS 14 1HB HIS 14 4.109 4.231 -3.910
92 HB3 HIS 14 2HB HIS 14 4.063 3.809 -5.586
93 HD1 HIS 14 1HD HIS 14 6.213 2.046 -6.165
94 HD2 HIS 14 2HD HIS 14 4.041 1.941 -2.599
95 HE1 HIS 14 1HE HIS 14 5.781 -0.294 -5.653
96 HE2 HIS 14 2HE HIS 14 4.853 -0.486 -3.306
97 H THR 15 H THR 15 4.107 5.773 -6.640
98 HA THR 15 HA THR 15 4.404 8.582 -5.725
99 HB THR 15 HB THR 15 4.050 9.294 -7.994
100 HG1 THR 15 1HG THR 15 4.073 7.502 -9.636
101 HG21 THR 15 3HG2 THR 15 6.079 8.600 -9.113
102 HG22 THR 15 1HG2 THR 15 6.419 8.711 -7.367
103 HG23 THR 15 2HG2 THR 15 6.183 7.117 -8.135
104 H ILE 16 H ILE 16 2.315 9.728 -5.728
105 HA ILE 16 HA ILE 16 0.131 8.104 -4.991
106 HB ILE 16 HB ILE 16 0.646 10.553 -4.459
107 HG12 ILE 16 1HG1 ILE 16 -2.236 9.752 -5.011
108 HG13 ILE 16 2HG1 ILE 16 -1.276 9.284 -3.603
109 HG21 ILE 16 1HG2 ILE 16 -0.311 12.284 -5.807
110 HG22 ILE 16 2HG2 ILE 16 0.688 11.272 -6.870
111 HG23 ILE 16 3HG2 ILE 16 -1.085 11.105 -6.889
112 HD11 ILE 16 3HD1 ILE 16 -2.637 11.132 -2.930
113 HD12 ILE 16 1HD1 ILE 16 -0.981 11.738 -3.050
114 HD13 ILE 16 2HD1 ILE 16 -2.160 12.102 -4.333
115 H SER 17 H SER 17 1.329 8.725 -8.145
116 HA SER 17 HA SER 17 -1.125 8.578 -9.589
117 HB2 SER 17 1HB SER 17 1.848 8.531 -10.280
118 HB3 SER 17 2HB SER 17 0.540 8.614 -11.455
119 HG SER 17 HG SER 17 1.119 10.730 -10.989
120 H VAL 18 H VAL 18 0.785 6.204 -8.056
121 HA VAL 18 HA VAL 18 -0.889 4.174 -9.440
122 HB VAL 18 HB VAL 18 1.138 2.568 -9.315
123 HG11 VAL 18 1HG1 VAL 18 0.079 3.326 -11.400
124 HG12 VAL 18 2HG1 VAL 18 1.254 4.677 -11.436
125 HG13 VAL 18 3HG1 VAL 18 1.828 2.985 -11.520
126 HG21 VAL 18 3HG2 VAL 18 2.640 4.182 -8.089
127 HG22 VAL 18 1HG2 VAL 18 3.346 3.459 -9.548
128 HG23 VAL 18 2HG2 VAL 18 2.752 5.117 -9.592
129 H VAL 19 H VAL 19 0.410 5.387 -6.448
130 HA VAL 19 HA VAL 19 1.187 3.127 -5.289
131 HB VAL 19 HB VAL 19 1.459 5.401 -4.314
132 HG11 VAL 19 1HG1 VAL 19 -0.295 6.543 -3.032
133 HG12 VAL 19 2HG1 VAL 19 -0.899 6.221 -4.660
134 HG13 VAL 19 3HG1 VAL 19 -1.426 5.229 -3.310
135 HG21 VAL 19 3HG2 VAL 19 0.242 3.568 -2.242
136 HG22 VAL 19 1HG2 VAL 19 1.900 3.489 -2.852
137 HG23 VAL 19 2HG2 VAL 19 1.347 4.915 -1.966
138 H TRP 20 H TRP 20 -2.331 3.999 -5.324
139 HA TRP 20 HA TRP 20 -3.078 1.985 -3.466
140 HB2 TRP 20 1HB TRP 20 -4.601 3.749 -4.280
141 HB3 TRP 20 2HB TRP 20 -4.636 2.988 -5.866
142 HD1 TRP 20 HD TRP 20 -6.424 1.197 -6.227
143 HE1 TRP 20 1HE TRP 20 -8.091 -0.085 -4.797
144 HE3 TRP 20 3HE TRP 20 -4.764 2.619 -1.569
145 HZ2 TRP 20 2HZ TRP 20 -8.694 -0.389 -1.939
146 HZ3 TRP 20 3HZ TRP 20 -5.798 1.681 0.435
147 HH2 TRP 20 HH TRP 20 -7.836 0.246 0.248
148 H TYR 21 H TYR 21 -2.991 1.767 -7.072
149 HA TYR 21 HA TYR 21 -3.303 -1.054 -7.256
150 HB2 TYR 21 1HB TYR 21 -3.470 0.324 -9.230
151 HB3 TYR 21 2HB TYR 21 -1.855 0.958 -9.021
152 HD1 TYR 21 2HD TYR 21 0.165 -0.405 -9.570
153 HD2 TYR 21 1HD TYR 21 -3.833 -1.924 -10.140
154 HE1 TYR 21 2HE TYR 21 1.061 -2.254 -10.962
155 HE2 TYR 21 1HE TYR 21 -2.953 -3.750 -11.547
156 HH TYR 21 HH TYR 21 -1.074 -4.619 -12.598
157 H GLU 22 H GLU 22 -0.259 0.959 -6.798
158 HA GLU 22 HA GLU 22 1.209 -1.396 -7.358
159 HB2 GLU 22 1HB GLU 22 2.429 0.138 -8.247
160 HB3 GLU 22 2HB GLU 22 1.546 1.405 -7.494
161 HG2 GLU 22 1HG GLU 22 2.713 1.927 -5.958
162 HG3 GLU 22 2HG GLU 22 3.433 0.422 -5.694
163 H CYS 23 H CYS 23 -0.036 -0.100 -4.469
164 HA CYS 23 HA CYS 23 1.743 -1.673 -2.715
165 HB2 CYS 23 1HB CYS 23 0.969 0.900 -2.530
166 HB3 CYS 23 2HB CYS 23 -0.410 0.182 -1.748
167 H THR 24 H THR 24 -1.397 -1.862 -4.254
168 HA THR 24 HA THR 24 -2.099 -3.906 -2.283
169 HB THR 24 HB THR 24 -4.355 -3.260 -2.197
170 HG1 THR 24 1HG THR 24 -3.726 -1.245 -4.080
171 HG21 THR 24 3HG2 THR 24 -2.673 -0.717 -1.948
172 HG22 THR 24 1HG2 THR 24 -4.301 -0.979 -1.284
173 HG23 THR 24 2HG2 THR 24 -2.938 -1.969 -0.701
174 H GLU 25 H GLU 25 -1.425 -3.513 -5.514
175 HA GLU 25 HA GLU 25 -3.007 -5.909 -6.224
176 HB2 GLU 25 1HB GLU 25 -3.809 -3.513 -7.035
177 HB3 GLU 25 2HB GLU 25 -2.513 -3.685 -8.202
178 HG2 GLU 25 1HG GLU 25 -3.438 -5.762 -9.053
179 HG3 GLU 25 2HG GLU 25 -4.639 -5.815 -7.771
180 H ASN 26 H ASN 26 -0.241 -3.840 -7.121
181 HA ASN 26 HA ASN 26 1.012 -5.649 -8.935
182 HB2 ASN 26 1HB ASN 26 1.538 -3.260 -8.848
183 HB3 ASN 26 2HB ASN 26 2.215 -3.481 -7.212
184 HD21 ASN 26 1HD2 ASN 26 4.096 -2.418 -8.270
185 HD22 ASN 26 2HD2 ASN 26 5.325 -3.526 -8.857
186 H THR 27 H THR 27 1.039 -7.725 -8.026
187 HA THR 27 HA THR 27 1.666 -8.519 -5.513
188 HB THR 27 HB THR 27 1.948 -10.728 -6.403
189 HG1 THR 27 1HG THR 27 2.417 -9.399 -8.881
190 HG21 THR 27 3HG2 THR 27 -0.330 -9.542 -6.496
191 HG22 THR 27 1HG2 THR 27 -0.059 -9.359 -8.244
192 HG23 THR 27 2HG2 THR 27 -0.131 -10.971 -7.508
193 H ALA 28 H ALA 28 4.058 -7.747 -7.980
194 HA ALA 28 HA ALA 28 6.338 -8.876 -6.771
195 HB1 ALA 28 1HB ALA 28 7.570 -7.325 -8.241
196 HB2 ALA 28 2HB ALA 28 6.231 -8.103 -9.096
197 HB3 ALA 28 3HB ALA 28 6.073 -6.413 -8.547
198 H ASN 29 H ASN 29 4.477 -6.268 -5.450
199 HA ASN 29 HA ASN 29 6.539 -6.131 -3.390
200 HB2 ASN 29 1HB ASN 29 7.136 -3.895 -3.425
201 HB3 ASN 29 2HB ASN 29 7.012 -4.206 -5.171
202 HD21 ASN 29 1HD2 ASN 29 5.257 -3.559 -6.368
203 HD22 ASN 29 2HD2 ASN 29 4.056 -2.499 -5.630
204 H CYS 30 H CYS 30 3.199 -5.662 -4.373
205 HA CYS 30 HA CYS 30 2.390 -3.952 -2.299
206 HB2 CYS 30 1HB CYS 30 0.146 -4.692 -2.814
207 HB3 CYS 30 2HB CYS 30 1.054 -4.344 -4.291
208 H GLY 31 H GLY 31 1.399 -4.322 -0.217
209 HA2 GLY 31 1HA GLY 31 0.782 -6.644 1.047
210 HA3 GLY 31 2HA GLY 31 2.560 -6.644 1.056
211 H THR 32 H THR 32 1.592 -6.730 3.425
212 HA THR 32 HA THR 32 0.601 -4.503 4.734
213 HB THR 32 HB THR 32 2.352 -6.785 5.707
214 HG1 THR 32 1HG THR 32 0.170 -7.390 6.484
215 HG21 THR 32 3HG2 THR 32 0.686 -4.867 7.388
216 HG22 THR 32 1HG2 THR 32 1.429 -6.359 7.971
217 HG23 THR 32 2HG2 THR 32 2.453 -5.026 7.432
218 H ALA 33 H ALA 33 4.087 -5.284 4.163
219 HA ALA 33 HA ALA 33 4.978 -3.079 5.797
220 HB1 ALA 33 1HB ALA 33 6.457 -4.564 3.584
221 HB2 ALA 33 2HB ALA 33 7.177 -3.514 4.820
222 HB3 ALA 33 3HB ALA 33 6.404 -5.032 5.305
223 H CYS 34 H CYS 34 4.199 -3.401 2.329
224 HA CYS 34 HA CYS 34 5.103 -0.765 1.570
225 HB2 CYS 34 1HB CYS 34 4.571 -2.499 -0.104
226 HB3 CYS 34 2HB CYS 34 2.875 -2.472 0.380
227 H CYS 35 H CYS 35 1.890 -2.067 2.561
228 HA CYS 35 HA CYS 35 0.533 0.399 2.554
229 HB2 CYS 35 1HB CYS 35 0.076 -2.143 4.158
230 HB3 CYS 35 2HB CYS 35 -1.026 -0.775 4.186
231 H ASP 36 H ASP 36 2.705 -0.939 5.044
232 HA ASP 36 HA ASP 36 1.698 0.714 7.116
233 HB2 ASP 36 1HB ASP 36 3.284 -1.446 7.184
234 HB3 ASP 36 2HB ASP 36 4.564 -0.243 7.159
235 H SER 37 H SER 37 4.025 1.357 4.646
236 HA SER 37 HA SER 37 4.844 3.879 6.042
237 HB2 SER 37 1HB SER 37 6.341 2.174 4.025
238 HB3 SER 37 2HB SER 37 6.925 3.682 4.759
239 HG SER 37 HG SER 37 7.049 1.212 5.757
240 H CYS 38 H CYS 38 3.236 2.678 3.178
241 HA CYS 38 HA CYS 38 3.409 5.303 1.866
242 HB2 CYS 38 1HB CYS 38 1.757 2.869 1.152
243 HB3 CYS 38 2HB CYS 38 1.972 4.244 0.162
244 H PHE 39 H PHE 39 1.393 3.855 4.285
245 HA PHE 39 HA PHE 39 -0.598 5.976 3.981
246 HB2 PHE 39 1HB PHE 39 -1.098 2.970 3.931
247 HB3 PHE 39 2HB PHE 39 -2.323 4.120 4.322
248 HD1 PHE 39 1HD PHE 39 -2.761 6.046 2.478
249 HD2 PHE 39 2HD PHE 39 -0.742 2.316 1.702
250 HE1 PHE 39 1HE PHE 39 -3.280 6.253 0.077
251 HE2 PHE 39 2HE PHE 39 -1.311 2.491 -0.683
252 HZ PHE 39 HZ PHE 39 -2.596 4.472 -1.499
253 H GLU 40 H GLU 40 -1.679 6.333 6.022
254 HA GLU 40 HA GLU 40 -0.709 4.702 8.316
255 HB2 GLU 40 1HB GLU 40 -1.184 7.690 8.320
256 HB3 GLU 40 2HB GLU 40 -0.596 6.706 9.669
257 HG2 GLU 40 1HG GLU 40 1.290 6.184 7.703
258 HG3 GLU 40 2HG GLU 40 0.775 7.844 7.387
259 H LEU 41 H LEU 41 -2.187 4.991 10.207
260 HA LEU 41 HA LEU 41 -4.227 4.698 11.180
261 HB2 LEU 41 1HB LEU 41 -4.871 7.200 9.590
262 HB3 LEU 41 2HB LEU 41 -5.546 6.713 11.148
263 HG LEU 41 HG LEU 41 -2.638 7.498 10.641
264 HD11 LEU 41 1HD1 LEU 41 -4.133 9.370 10.391
265 HD12 LEU 41 2HD1 LEU 41 -4.868 9.049 11.987
266 HD13 LEU 41 3HD1 LEU 41 -3.160 9.530 11.854
267 HD21 LEU 41 3HD2 LEU 41 -2.449 7.577 13.097
268 HD22 LEU 41 1HD2 LEU 41 -4.091 6.894 13.246
269 HD23 LEU 41 2HD2 LEU 41 -2.770 5.939 12.518
270 H THR 42 H THR 42 -6.720 5.965 9.568
271 HA THR 42 HA THR 42 -7.755 3.439 8.827
272 HB THR 42 HB THR 42 -8.726 6.219 8.065
273 HG1 THR 42 1HG THR 42 -8.720 6.203 10.161
274 HG21 THR 42 3HG2 THR 42 -10.971 5.168 8.008
275 HG22 THR 42 1HG2 THR 42 -9.919 4.539 6.733
276 HG23 THR 42 2HG2 THR 42 -10.212 3.566 8.201
277 H GLY 43 H GLY 43 -5.736 5.658 6.955
278 HA2 GLY 43 1HA GLY 43 -6.319 4.643 4.323
279 HA3 GLY 43 2HA GLY 43 -4.875 5.526 4.852
280 H ASN 44 H ASN 44 -4.018 3.846 6.900
281 HA ASN 44 HA ASN 44 -2.515 1.858 5.530
282 HB2 ASN 44 1HB ASN 44 -1.629 2.804 7.544
283 HB3 ASN 44 2HB ASN 44 -3.026 2.298 8.494
284 HD21 ASN 44 1HD2 ASN 44 -0.594 0.880 6.280
285 HD22 ASN 44 2HD2 ASN 44 -0.402 -0.600 7.247
286 H THR 45 H THR 45 -5.271 1.563 7.849
287 HA THR 45 HA THR 45 -5.797 -1.124 7.545
288 HB THR 45 HB THR 45 -7.656 1.192 7.866
289 HG1 THR 45 1HG THR 45 -6.953 1.026 9.942
290 HG21 THR 45 3HG2 THR 45 -9.080 -0.683 7.241
291 HG22 THR 45 1HG2 THR 45 -8.336 -1.682 8.514
292 HG23 THR 45 2HG2 THR 45 -9.305 -0.253 8.928
293 H MET 46 H MET 46 -7.170 1.527 5.416
294 HA MET 46 HA MET 46 -8.728 -0.373 3.947
295 HB2 MET 46 1HB MET 46 -7.816 2.419 3.163
296 HB3 MET 46 2HB MET 46 -8.848 1.385 2.168
297 HG2 MET 46 1HG MET 46 -10.295 1.170 4.384
298 HG3 MET 46 2HG MET 46 -9.466 2.663 4.816
299 HE1 MET 46 3HE MET 46 -11.203 1.016 1.646
300 HE2 MET 46 1HE MET 46 -12.446 1.094 2.921
301 HE3 MET 46 2HE MET 46 -12.607 2.098 1.473
302 H CYS 47 H CYS 47 -5.385 0.838 3.451
303 HA CYS 47 HA CYS 47 -4.869 -0.414 0.957
304 HB2 CYS 47 1HB CYS 47 -3.484 1.324 2.019
305 HB3 CYS 47 2HB CYS 47 -3.009 0.205 3.281
306 H LEU 48 H LEU 48 -4.280 -1.600 4.320
307 HA LEU 48 HA LEU 48 -3.400 -4.188 3.687
308 HB2 LEU 48 1HB LEU 48 -5.031 -3.151 6.043
309 HB3 LEU 48 2HB LEU 48 -4.292 -4.736 5.985
310 HG LEU 48 HG LEU 48 -2.668 -2.179 5.710
311 HD11 LEU 48 1HD1 LEU 48 -3.795 -2.097 7.868
312 HD12 LEU 48 2HD1 LEU 48 -3.312 -3.771 8.222
313 HD13 LEU 48 3HD1 LEU 48 -2.091 -2.482 8.096
314 HD21 LEU 48 3HD2 LEU 48 -0.798 -3.576 6.313
315 HD22 LEU 48 1HD2 LEU 48 -1.846 -5.010 6.425
316 HD23 LEU 48 2HD2 LEU 48 -1.583 -4.216 4.864
317 H LEU 49 H LEU 49 -6.727 -3.032 4.379
318 HA LEU 49 HA LEU 49 -8.005 -5.495 3.930
319 HB2 LEU 49 1HB LEU 49 -8.816 -2.650 3.951
320 HB3 LEU 49 2HB LEU 49 -9.807 -3.627 2.903
321 HG LEU 49 HG LEU 49 -9.348 -5.037 5.443
322 HD11 LEU 49 1HD1 LEU 49 -9.109 -2.963 6.500
323 HD12 LEU 49 2HD1 LEU 49 -10.450 -2.232 5.601
324 HD13 LEU 49 3HD1 LEU 49 -10.762 -3.500 6.827
325 HD21 LEU 49 3HD2 LEU 49 -11.775 -5.217 5.397
326 HD22 LEU 49 1HD2 LEU 49 -11.862 -4.040 4.065
327 HD23 LEU 49 2HD2 LEU 49 -11.079 -5.620 3.835
328 H GLN 50 H GLN 50 -7.133 -3.059 1.415
329 HA GLN 50 HA GLN 50 -8.301 -4.551 -0.704
330 HB2 GLN 50 1HB GLN 50 -7.728 -2.113 -0.680
331 HB3 GLN 50 2HB GLN 50 -6.031 -2.547 -0.842
332 HG2 GLN 50 1HG GLN 50 -6.817 -2.055 -3.041
333 HG3 GLN 50 2HG GLN 50 -6.656 -3.799 -2.996
334 HE21 GLN 50 1HE2 GLN 50 -8.219 -3.025 -5.028
335 HE22 GLN 50 2HE2 GLN 50 -9.917 -3.149 -4.642
336 H ALA 51 H ALA 51 -4.945 -4.464 0.617
337 HA ALA 51 HA ALA 51 -3.704 -6.044 -1.347
338 HB1 ALA 51 1HB ALA 51 -2.482 -4.785 0.388
339 HB2 ALA 51 2HB ALA 51 -3.138 -5.855 1.651
340 HB3 ALA 51 3HB ALA 51 -2.021 -6.498 0.440
341 H GLY 52 H GLY 52 -5.381 -7.067 1.645
342 HA2 GLY 52 1HA GLY 52 -5.193 -9.907 0.941
343 HA3 GLY 52 2HA GLY 52 -5.970 -9.202 2.357
344 H ALA 53 H ALA 53 -7.104 -7.770 -0.663
345 HA ALA 53 HA ALA 53 -9.725 -8.521 0.063
346 HB1 ALA 53 1HB ALA 53 -8.770 -7.025 -2.390
347 HB2 ALA 53 2HB ALA 53 -10.457 -7.257 -1.865
348 HB3 ALA 53 3HB ALA 53 -9.356 -6.334 -0.848
349 H ALA 54 H ALA 54 -10.019 -10.417 -0.097
350 HA ALA 54 HA ALA 54 -11.344 -12.187 -0.996
351 HB1 ALA 54 1HB ALA 54 -11.881 -9.921 -2.946
352 HB2 ALA 54 2HB ALA 54 -12.927 -11.317 -2.676
353 HB3 ALA 54 3HB ALA 54 -12.660 -10.160 -1.360
354 H GLY 55 H GLY 55 -8.758 -12.625 -1.708
355 HA2 GLY 55 1HA GLY 55 -8.309 -14.375 -3.650
356 HA3 GLY 55 2HA GLY 55 -8.513 -12.923 -4.654
357 H SER 56 H SER 56 -7.402 -11.333 -2.279
358 HA SER 56 HA SER 56 -5.528 -10.484 -1.469
359 HB2 SER 56 1HB SER 56 -5.702 -12.706 -0.331
360 HB3 SER 56 2HB SER 56 -4.548 -13.368 -1.493
361 HG SER 56 HG SER 56 -2.999 -12.486 -0.450
362 H GLY 57 H GLY 57 -2.924 -12.379 -2.637
363 HA2 GLY 57 1HA GLY 57 -1.961 -12.346 -4.887
364 HA3 GLY 57 2HA GLY 57 -2.693 -10.763 -5.138
365 H CYS 58 H CYS 58 -2.107 -9.899 -2.333
366 HA CYS 58 HA CYS 58 0.686 -9.084 -2.789
367 HB2 CYS 58 1HB CYS 58 -1.545 -8.174 -0.934
368 HB3 CYS 58 2HB CYS 58 0.031 -7.411 -1.029
369 H ASP 59 H ASP 59 1.893 -8.675 -0.645
370 HA ASP 59 HA ASP 59 2.033 -11.171 0.947
371 HB2 ASP 59 1HB ASP 59 4.089 -10.314 -0.050
372 HB3 ASP 59 2HB ASP 59 3.823 -8.722 0.679
373 H MET 60 H MET 60 0.103 -10.884 2.251
374 HA MET 60 HA MET 60 -0.217 -8.455 3.871
375 HB2 MET 60 1HB MET 60 -1.810 -10.913 3.331
376 HB3 MET 60 2HB MET 60 -2.009 -10.228 4.932
377 HG2 MET 60 1HG MET 60 -2.132 -8.347 2.610
378 HG3 MET 60 2HG MET 60 -3.493 -9.429 2.902
379 HE1 MET 60 3HE MET 60 -5.230 -9.246 4.709
380 HE2 MET 60 1HE MET 60 -4.002 -9.703 5.911
381 HE3 MET 60 2HE MET 60 -5.047 -8.304 6.206
382 H GLU 61 H GLU 61 2.202 -9.140 4.267
383 HA GLU 61 HA GLU 61 3.886 -9.530 5.583
384 HB2 GLU 61 1HB GLU 61 1.775 -9.197 7.517
385 HB3 GLU 61 2HB GLU 61 2.907 -10.422 8.073
386 HG2 GLU 61 1HG GLU 61 3.794 -7.678 7.139
387 HG3 GLU 61 2HG GLU 61 3.301 -8.021 8.799
Start of MODEL 4
1 H1 TYR 1 H TYR 1 -14.812 8.675 2.067
2 HA TYR 1 HA TYR 1 -12.797 9.087 3.363
3 HB2 TYR 1 1HB TYR 1 -13.216 7.321 5.060
4 HB3 TYR 1 2HB TYR 1 -12.939 6.088 3.841
5 HD1 TYR 1 2HD TYR 1 -11.274 9.171 5.303
6 HD2 TYR 1 1HD TYR 1 -10.765 5.246 3.530
7 HE1 TYR 1 2HE TYR 1 -8.822 9.357 5.565
8 HE2 TYR 1 1HE TYR 1 -8.360 5.412 3.859
9 HH TYR 1 HH TYR 1 -6.763 8.097 5.553
10 H ASN 2 H ASN 2 -10.617 8.826 2.337
11 HA ASN 2 HA ASN 2 -10.447 6.784 0.264
12 HB2 ASN 2 1HB ASN 2 -10.567 9.633 -0.386
13 HB3 ASN 2 2HB ASN 2 -8.977 9.016 -0.755
14 HD21 ASN 2 1HD2 ASN 2 -8.828 8.344 -2.936
15 HD22 ASN 2 2HD2 ASN 2 -10.096 7.402 -3.674
16 HA PRO 3 HA PRO 3 -6.833 6.215 2.659
17 HB2 PRO 3 1HB PRO 3 -5.271 4.634 1.019
18 HB3 PRO 3 2HB PRO 3 -6.743 4.070 1.855
19 HG2 PRO 3 1HG PRO 3 -6.465 4.986 -1.008
20 HG3 PRO 3 2HG PRO 3 -7.407 3.604 -0.367
21 HD2 PRO 3 1HD PRO 3 -8.600 5.922 -1.002
22 HD3 PRO 3 2HD PRO 3 -9.134 4.886 0.361
23 H GLU 4 H GLU 4 -6.419 7.556 -0.544
24 HA GLU 4 HA GLU 4 -3.734 8.453 -0.301
25 HB2 GLU 4 1HB GLU 4 -6.148 9.188 -1.959
26 HB3 GLU 4 2HB GLU 4 -4.649 10.108 -2.129
27 HG2 GLU 4 1HG GLU 4 -3.418 8.114 -2.776
28 HG3 GLU 4 2HG GLU 4 -4.762 7.065 -2.311
29 H ASP 5 H ASP 5 -6.579 9.513 1.405
30 HA ASP 5 HA ASP 5 -5.701 12.176 1.967
31 HB2 ASP 5 1HB ASP 5 -8.051 11.041 2.194
32 HB3 ASP 5 2HB ASP 5 -7.474 10.503 3.764
33 H ASP 6 H ASP 6 -4.533 9.144 3.108
34 HA ASP 6 HA ASP 6 -2.975 10.402 5.360
35 HB2 ASP 6 1HB ASP 6 -4.440 7.758 5.352
36 HB3 ASP 6 2HB ASP 6 -3.189 8.164 6.492
37 H TYR 7 H TYR 7 -2.461 9.739 2.457
38 HA TYR 7 HA TYR 7 -0.613 7.591 2.171
39 HB2 TYR 7 1HB TYR 7 -1.617 8.459 0.243
40 HB3 TYR 7 2HB TYR 7 -1.382 10.119 0.734
41 HD1 TYR 7 2HD TYR 7 0.623 7.137 -0.358
42 HD2 TYR 7 1HD TYR 7 0.217 11.430 -0.292
43 HE1 TYR 7 2HE TYR 7 2.417 7.356 -2.089
44 HE2 TYR 7 1HE TYR 7 2.015 11.649 -1.963
45 HH TYR 7 HH TYR 7 3.134 10.380 -3.700
46 H THR 8 H THR 8 1.612 7.517 2.691
47 HA THR 8 HA THR 8 2.734 9.932 3.976
48 HB THR 8 HB THR 8 4.378 8.178 4.928
49 HG1 THR 8 1HG THR 8 3.222 6.142 5.197
50 HG21 THR 8 3HG2 THR 8 2.653 9.361 6.232
51 HG22 THR 8 1HG2 THR 8 1.479 8.101 5.786
52 HG23 THR 8 2HG2 THR 8 2.926 7.710 6.772
53 HA PRO 9 HA PRO 9 5.109 9.525 0.044
54 HB2 PRO 9 1HB PRO 9 5.785 12.172 -0.256
55 HB3 PRO 9 2HB PRO 9 4.281 11.431 -0.877
56 HG2 PRO 9 1HG PRO 9 4.687 13.033 1.660
57 HG3 PRO 9 2HG PRO 9 3.314 13.096 0.504
58 HD2 PRO 9 1HD PRO 9 3.162 11.729 2.844
59 HD3 PRO 9 2HD PRO 9 2.362 11.146 1.354
60 H LEU 10 H LEU 10 6.087 10.840 3.215
61 HA LEU 10 HA LEU 10 8.844 11.258 2.436
62 HB2 LEU 10 1HB LEU 10 7.530 10.934 5.151
63 HB3 LEU 10 2HB LEU 10 9.248 11.149 4.919
64 HG LEU 10 HG LEU 10 7.014 13.115 4.446
65 HD11 LEU 10 1HD1 LEU 10 9.755 13.380 5.770
66 HD12 LEU 10 2HD1 LEU 10 8.441 14.581 5.786
67 HD13 LEU 10 3HD1 LEU 10 8.233 13.036 6.620
68 HD21 LEU 10 3HD2 LEU 10 8.665 14.668 3.371
69 HD22 LEU 10 1HD2 LEU 10 9.787 13.312 3.193
70 HD23 LEU 10 2HD2 LEU 10 8.202 13.314 2.359
71 H THR 11 H THR 11 7.047 8.394 3.356
72 HA THR 11 HA THR 11 9.573 6.827 3.163
73 HB THR 11 HB THR 11 7.710 4.956 3.514
74 HG1 THR 11 1HG THR 11 5.849 5.924 3.765
75 HG21 THR 11 3HG2 THR 11 8.741 6.782 5.707
76 HG22 THR 11 1HG2 THR 11 8.018 5.167 5.940
77 HG23 THR 11 2HG2 THR 11 9.533 5.340 5.034
78 H CYS 12 H CYS 12 6.448 7.480 1.486
79 HA CYS 12 HA CYS 12 6.457 5.043 0.306
80 HB2 CYS 12 1HB CYS 12 4.527 6.582 0.612
81 HB3 CYS 12 2HB CYS 12 5.046 7.463 -0.829
82 HA PRO 13 HA PRO 13 9.441 5.835 -3.009
83 HB2 PRO 13 1HB PRO 13 9.839 3.267 -3.845
84 HB3 PRO 13 2HB PRO 13 10.559 3.968 -2.362
85 HG2 PRO 13 1HG PRO 13 8.166 2.162 -2.633
86 HG3 PRO 13 2HG PRO 13 9.447 2.137 -1.397
87 HD2 PRO 13 1HD PRO 13 6.955 3.303 -1.041
88 HD3 PRO 13 2HD PRO 13 8.424 3.795 -0.162
89 H HIS 14 H HIS 14 6.335 5.806 -3.418
90 HA HIS 14 HA HIS 14 6.314 5.343 -6.355
91 HB2 HIS 14 1HB HIS 14 3.862 4.760 -4.689
92 HB3 HIS 14 2HB HIS 14 4.239 4.146 -6.275
93 HD1 HIS 14 1HD HIS 14 6.499 2.259 -6.199
94 HD2 HIS 14 2HD HIS 14 4.104 3.094 -2.816
95 HE1 HIS 14 1HE HIS 14 6.749 0.343 -4.578
96 HE2 HIS 14 2HE HIS 14 5.496 0.957 -2.406
97 H THR 15 H THR 15 4.722 6.773 -7.420
98 HA THR 15 HA THR 15 4.297 9.262 -5.933
99 HB THR 15 HB THR 15 3.604 10.074 -8.157
100 HG1 THR 15 1HG THR 15 4.076 8.508 -9.918
101 HG21 THR 15 3HG2 THR 15 5.747 9.988 -9.255
102 HG22 THR 15 1HG2 THR 15 6.042 9.992 -7.501
103 HG23 THR 15 2HG2 THR 15 6.196 8.490 -8.417
104 H ILE 16 H ILE 16 2.106 10.178 -5.735
105 HA ILE 16 HA ILE 16 0.235 8.289 -4.887
106 HB ILE 16 HB ILE 16 0.482 10.712 -4.232
107 HG12 ILE 16 1HG1 ILE 16 -2.372 9.760 -4.690
108 HG13 ILE 16 2HG1 ILE 16 -1.316 9.204 -3.387
109 HG21 ILE 16 1HG2 ILE 16 -1.500 11.263 -6.466
110 HG22 ILE 16 2HG2 ILE 16 -0.716 12.420 -5.378
111 HG23 ILE 16 3HG2 ILE 16 0.242 11.576 -6.606
112 HD11 ILE 16 3HD1 ILE 16 -2.627 10.898 -2.396
113 HD12 ILE 16 1HD1 ILE 16 -1.070 11.673 -2.698
114 HD13 ILE 16 2HD1 ILE 16 -2.447 11.987 -3.778
115 H SER 17 H SER 17 0.926 9.258 -8.091
116 HA SER 17 HA SER 17 -1.550 8.803 -9.408
117 HB2 SER 17 1HB SER 17 0.358 9.979 -10.427
118 HB3 SER 17 2HB SER 17 1.343 8.500 -10.328
119 HG SER 17 HG SER 17 -0.107 9.278 -12.318
120 H VAL 18 H VAL 18 1.004 6.679 -8.153
121 HA VAL 18 HA VAL 18 -0.590 4.269 -8.806
122 HB VAL 18 HB VAL 18 1.337 3.131 -9.746
123 HG11 VAL 18 1HG1 VAL 18 -0.113 4.336 -11.323
124 HG12 VAL 18 2HG1 VAL 18 0.960 5.768 -11.239
125 HG13 VAL 18 3HG1 VAL 18 1.566 4.241 -11.880
126 HG21 VAL 18 3HG2 VAL 18 3.261 5.114 -10.358
127 HG22 VAL 18 1HG2 VAL 18 2.730 5.485 -8.664
128 HG23 VAL 18 2HG2 VAL 18 3.340 3.889 -9.063
129 H VAL 19 H VAL 19 -0.712 5.055 -6.518
130 HA VAL 19 HA VAL 19 1.327 3.480 -4.984
131 HB VAL 19 HB VAL 19 1.414 5.765 -4.271
132 HG11 VAL 19 1HG1 VAL 19 -0.389 6.910 -3.140
133 HG12 VAL 19 2HG1 VAL 19 -0.916 6.444 -4.768
134 HG13 VAL 19 3HG1 VAL 19 -1.483 5.525 -3.375
135 HG21 VAL 19 3HG2 VAL 19 0.144 4.023 -2.121
136 HG22 VAL 19 1HG2 VAL 19 1.827 3.956 -2.635
137 HG23 VAL 19 2HG2 VAL 19 1.190 5.423 -1.860
138 H TRP 20 H TRP 20 -2.222 3.957 -5.354
139 HA TRP 20 HA TRP 20 -2.946 1.928 -3.454
140 HB2 TRP 20 1HB TRP 20 -4.496 3.669 -4.346
141 HB3 TRP 20 2HB TRP 20 -4.479 2.889 -5.915
142 HD1 TRP 20 HD TRP 20 -6.205 0.986 -6.257
143 HE1 TRP 20 1HE TRP 20 -7.838 -0.296 -4.788
144 HE3 TRP 20 3HE TRP 20 -4.553 2.590 -1.695
145 HZ2 TRP 20 2HZ TRP 20 -8.528 -0.407 -1.915
146 HZ3 TRP 20 3HZ TRP 20 -5.687 1.884 0.373
147 HH2 TRP 20 HH TRP 20 -7.746 0.521 0.268
148 H TYR 21 H TYR 21 -3.019 1.739 -7.050
149 HA TYR 21 HA TYR 21 -3.367 -1.015 -7.313
150 HB2 TYR 21 1HB TYR 21 -3.551 0.407 -9.238
151 HB3 TYR 21 2HB TYR 21 -1.923 1.044 -9.033
152 HD1 TYR 21 1HD TYR 21 0.076 -0.281 -9.647
153 HD2 TYR 21 2HD TYR 21 -3.928 -1.814 -10.234
154 HE1 TYR 21 1HE TYR 21 1.009 -2.231 -10.878
155 HE2 TYR 21 2HE TYR 21 -3.012 -3.707 -11.523
156 HH TYR 21 HH TYR 21 -1.173 -4.683 -12.420
157 H GLU 22 H GLU 22 -0.298 0.781 -6.832
158 HA GLU 22 HA GLU 22 1.461 -1.300 -7.569
159 HB2 GLU 22 1HB GLU 22 2.774 0.652 -7.432
160 HB3 GLU 22 2HB GLU 22 1.382 1.420 -6.795
161 HG2 GLU 22 1HG GLU 22 3.162 1.769 -5.375
162 HG3 GLU 22 2HG GLU 22 2.110 0.748 -4.441
163 H CYS 23 H CYS 23 -0.315 -0.482 -4.595
164 HA CYS 23 HA CYS 23 1.277 -2.306 -2.935
165 HB2 CYS 23 1HB CYS 23 0.783 0.325 -2.581
166 HB3 CYS 23 2HB CYS 23 -0.679 -0.301 -1.870
167 H THR 24 H THR 24 -1.619 -2.253 -4.673
168 HA THR 24 HA THR 24 -2.795 -4.226 -2.824
169 HB THR 24 HB THR 24 -4.946 -3.259 -3.100
170 HG1 THR 24 1HG THR 24 -4.664 -2.537 -5.247
171 HG21 THR 24 3HG2 THR 24 -3.038 -0.971 -2.456
172 HG22 THR 24 1HG2 THR 24 -4.764 -1.080 -2.047
173 HG23 THR 24 2HG2 THR 24 -3.592 -2.215 -1.342
174 H GLU 25 H GLU 25 -1.271 -4.183 -5.653
175 HA GLU 25 HA GLU 25 -2.975 -6.312 -6.772
176 HB2 GLU 25 1HB GLU 25 -3.480 -3.802 -7.587
177 HB3 GLU 25 2HB GLU 25 -2.118 -4.109 -8.651
178 HG2 GLU 25 1HG GLU 25 -3.279 -5.679 -9.903
179 HG3 GLU 25 2HG GLU 25 -4.205 -6.241 -8.508
180 H ASN 26 H ASN 26 0.002 -4.338 -7.268
181 HA ASN 26 HA ASN 26 1.302 -6.426 -8.825
182 HB2 ASN 26 1HB ASN 26 1.686 -4.037 -9.247
183 HB3 ASN 26 2HB ASN 26 2.338 -3.840 -7.613
184 HD21 ASN 26 1HD2 ASN 26 4.295 -3.047 -8.629
185 HD22 ASN 26 2HD2 ASN 26 5.490 -4.194 -9.191
186 H THR 27 H THR 27 1.335 -8.296 -7.403
187 HA THR 27 HA THR 27 2.180 -8.189 -4.708
188 HB THR 27 HB THR 27 2.153 -10.580 -4.746
189 HG1 THR 27 1HG THR 27 2.499 -10.286 -7.471
190 HG21 THR 27 3HG2 THR 27 -0.140 -9.532 -6.450
191 HG22 THR 27 1HG2 THR 27 -0.139 -10.942 -5.386
192 HG23 THR 27 2HG2 THR 27 0.002 -9.321 -4.698
193 H ALA 28 H ALA 28 4.210 -8.145 -7.485
194 HA ALA 28 HA ALA 28 6.632 -9.013 -6.329
195 HB1 ALA 28 1HB ALA 28 6.178 -6.669 -8.233
196 HB2 ALA 28 2HB ALA 28 7.701 -7.535 -7.968
197 HB3 ALA 28 3HB ALA 28 6.328 -8.377 -8.724
198 H ASN 29 H ASN 29 4.672 -6.235 -5.467
199 HA ASN 29 HA ASN 29 6.778 -5.550 -3.498
200 HB2 ASN 29 1HB ASN 29 5.046 -3.305 -4.400
201 HB3 ASN 29 2HB ASN 29 6.670 -3.304 -3.745
202 HD21 ASN 29 1HD2 ASN 29 5.466 -1.799 -6.013
203 HD22 ASN 29 2HD2 ASN 29 6.506 -2.198 -7.360
204 H CYS 30 H CYS 30 3.299 -5.650 -4.299
205 HA CYS 30 HA CYS 30 2.550 -4.208 -2.019
206 HB2 CYS 30 1HB CYS 30 0.314 -4.827 -2.464
207 HB3 CYS 30 2HB CYS 30 1.124 -4.355 -3.952
208 H GLY 31 H GLY 31 1.568 -4.673 -0.050
209 HA2 GLY 31 1HA GLY 31 0.747 -7.026 1.056
210 HA3 GLY 31 2HA GLY 31 2.509 -7.027 1.254
211 H THR 32 H THR 32 1.502 -7.019 3.536
212 HA THR 32 HA THR 32 0.261 -4.725 4.635
213 HB THR 32 HB THR 32 1.923 -6.959 5.860
214 HG1 THR 32 1HG THR 32 -0.206 -7.105 4.637
215 HG21 THR 32 3HG2 THR 32 1.832 -5.173 7.550
216 HG22 THR 32 1HG2 THR 32 0.079 -5.018 7.319
217 HG23 THR 32 2HG2 THR 32 0.754 -6.508 7.996
218 H ALA 33 H ALA 33 3.777 -5.516 4.443
219 HA ALA 33 HA ALA 33 4.582 -3.213 5.952
220 HB1 ALA 33 1HB ALA 33 6.018 -5.179 5.638
221 HB2 ALA 33 2HB ALA 33 6.083 -4.861 3.880
222 HB3 ALA 33 3HB ALA 33 6.809 -3.728 5.015
223 H CYS 34 H CYS 34 4.162 -3.822 2.456
224 HA CYS 34 HA CYS 34 5.022 -1.355 1.420
225 HB2 CYS 34 1HB CYS 34 4.446 -3.184 -0.041
226 HB3 CYS 34 2HB CYS 34 2.784 -3.196 0.508
227 H CYS 35 H CYS 35 1.777 -2.305 2.561
228 HA CYS 35 HA CYS 35 0.474 0.125 2.036
229 HB2 CYS 35 1HB CYS 35 -0.051 -2.067 4.061
230 HB3 CYS 35 2HB CYS 35 -1.082 -0.648 3.949
231 H ASP 36 H ASP 36 2.010 -0.957 5.096
232 HA ASP 36 HA ASP 36 1.483 1.442 6.557
233 HB2 ASP 36 1HB ASP 36 3.079 -0.994 6.859
234 HB3 ASP 36 2HB ASP 36 3.923 0.409 7.505
235 H SER 37 H SER 37 4.361 0.584 4.584
236 HA SER 37 HA SER 37 5.697 3.053 5.105
237 HB2 SER 37 1HB SER 37 6.013 0.942 2.941
238 HB3 SER 37 2HB SER 37 7.179 2.255 3.267
239 HG SER 37 HG SER 37 7.308 0.001 4.410
240 H CYS 38 H CYS 38 2.810 2.728 3.357
241 HA CYS 38 HA CYS 38 3.410 5.255 1.933
242 HB2 CYS 38 1HB CYS 38 2.144 2.711 0.911
243 HB3 CYS 38 2HB CYS 38 1.794 4.264 0.186
244 H PHE 39 H PHE 39 1.373 3.756 4.271
245 HA PHE 39 HA PHE 39 -0.572 5.942 4.053
246 HB2 PHE 39 1HB PHE 39 -1.256 2.964 3.964
247 HB3 PHE 39 2HB PHE 39 -2.402 4.254 4.220
248 HD1 PHE 39 1HD PHE 39 -2.644 6.046 2.344
249 HD2 PHE 39 2HD PHE 39 -0.801 2.197 1.769
250 HE1 PHE 39 1HE PHE 39 -3.073 6.185 -0.102
251 HE2 PHE 39 2HE PHE 39 -1.249 2.320 -0.651
252 HZ PHE 39 HZ PHE 39 -2.384 4.298 -1.586
253 H GLU 40 H GLU 40 -1.575 6.318 6.058
254 HA GLU 40 HA GLU 40 -0.850 4.568 8.369
255 HB2 GLU 40 1HB GLU 40 -1.296 7.551 8.358
256 HB3 GLU 40 2HB GLU 40 -0.743 6.590 9.740
257 HG2 GLU 40 1HG GLU 40 1.067 6.466 7.393
258 HG3 GLU 40 2HG GLU 40 0.729 8.093 7.947
259 H LEU 41 H LEU 41 -2.477 4.911 10.213
260 HA LEU 41 HA LEU 41 -4.552 4.898 11.067
261 HB2 LEU 41 1HB LEU 41 -4.946 7.251 9.162
262 HB3 LEU 41 2HB LEU 41 -5.851 6.938 10.647
263 HG LEU 41 HG LEU 41 -2.851 7.524 10.514
264 HD11 LEU 41 1HD1 LEU 41 -5.093 9.330 11.455
265 HD12 LEU 41 2HD1 LEU 41 -3.360 9.679 11.483
266 HD13 LEU 41 3HD1 LEU 41 -4.169 9.483 9.928
267 HD21 LEU 41 3HD2 LEU 41 -3.288 6.178 12.418
268 HD22 LEU 41 1HD2 LEU 41 -3.156 7.835 13.004
269 HD23 LEU 41 2HD2 LEU 41 -4.756 7.092 12.845
270 H THR 42 H THR 42 -6.977 5.971 9.383
271 HA THR 42 HA THR 42 -7.945 3.407 8.585
272 HB THR 42 HB THR 42 -8.923 6.224 8.138
273 HG1 THR 42 1HG THR 42 -9.186 5.177 10.221
274 HG21 THR 42 3HG2 THR 42 -10.411 3.680 7.355
275 HG22 THR 42 1HG2 THR 42 -11.016 5.376 7.280
276 HG23 THR 42 2HG2 THR 42 -9.728 4.829 6.215
277 H GLY 43 H GLY 43 -5.861 5.733 6.850
278 HA2 GLY 43 1HA GLY 43 -6.390 4.786 4.193
279 HA3 GLY 43 2HA GLY 43 -4.944 5.623 4.768
280 H ASN 44 H ASN 44 -4.057 3.945 6.706
281 HA ASN 44 HA ASN 44 -2.624 1.887 5.398
282 HB2 ASN 44 1HB ASN 44 -1.881 2.847 7.514
283 HB3 ASN 44 2HB ASN 44 -3.283 2.191 8.358
284 HD21 ASN 44 1HD2 ASN 44 -0.471 1.282 6.387
285 HD22 ASN 44 2HD2 ASN 44 -0.189 -0.210 7.308
286 H THR 45 H THR 45 -5.353 1.757 7.649
287 HA THR 45 HA THR 45 -6.061 -0.909 7.536
288 HB THR 45 HB THR 45 -8.080 1.347 7.607
289 HG1 THR 45 1HG THR 45 -6.343 1.800 9.135
290 HG21 THR 45 3HG2 THR 45 -9.190 -0.153 9.259
291 HG22 THR 45 1HG2 THR 45 -9.061 -0.893 7.658
292 HG23 THR 45 2HG2 THR 45 -7.955 -1.380 8.959
293 H MET 46 H MET 46 -7.302 1.649 5.269
294 HA MET 46 HA MET 46 -8.916 -0.186 3.802
295 HB2 MET 46 1HB MET 46 -7.741 2.497 2.974
296 HB3 MET 46 2HB MET 46 -8.920 1.591 2.033
297 HG2 MET 46 1HG MET 46 -9.815 1.827 4.776
298 HG3 MET 46 2HG MET 46 -9.381 3.409 4.152
299 HE1 MET 46 3HE MET 46 -11.208 0.151 2.700
300 HE2 MET 46 1HE MET 46 -11.912 0.559 4.283
301 HE3 MET 46 2HE MET 46 -12.885 0.740 2.812
302 H CYS 47 H CYS 47 -5.493 0.856 3.347
303 HA CYS 47 HA CYS 47 -5.085 -0.468 0.846
304 HB2 CYS 47 1HB CYS 47 -3.586 1.233 1.787
305 HB3 CYS 47 2HB CYS 47 -3.126 0.150 3.093
306 H LEU 48 H LEU 48 -4.516 -1.575 4.241
307 HA LEU 48 HA LEU 48 -3.725 -4.210 3.648
308 HB2 LEU 48 1HB LEU 48 -5.298 -3.120 6.022
309 HB3 LEU 48 2HB LEU 48 -4.550 -4.694 5.938
310 HG LEU 48 HG LEU 48 -3.050 -2.043 5.840
311 HD11 LEU 48 1HD1 LEU 48 -3.327 -4.086 8.073
312 HD12 LEU 48 2HD1 LEU 48 -2.270 -2.656 8.098
313 HD13 LEU 48 3HD1 LEU 48 -4.021 -2.450 8.045
314 HD21 LEU 48 3HD2 LEU 48 -1.018 -3.302 6.103
315 HD22 LEU 48 1HD2 LEU 48 -1.925 -4.836 6.055
316 HD23 LEU 48 2HD2 LEU 48 -1.832 -3.793 4.618
317 H LEU 49 H LEU 49 -6.965 -2.928 4.281
318 HA LEU 49 HA LEU 49 -8.519 -5.188 3.969
319 HB2 LEU 49 1HB LEU 49 -8.946 -2.405 4.117
320 HB3 LEU 49 2HB LEU 49 -9.760 -2.866 2.648
321 HG LEU 49 HG LEU 49 -10.205 -4.226 5.338
322 HD11 LEU 49 1HD1 LEU 49 -10.720 -1.868 5.521
323 HD12 LEU 49 2HD1 LEU 49 -11.701 -1.931 4.028
324 HD13 LEU 49 3HD1 LEU 49 -12.232 -2.804 5.466
325 HD21 LEU 49 3HD2 LEU 49 -12.295 -4.995 4.301
326 HD22 LEU 49 1HD2 LEU 49 -11.822 -4.227 2.748
327 HD23 LEU 49 2HD2 LEU 49 -10.897 -5.592 3.419
328 H GLN 50 H GLN 50 -7.068 -3.281 1.311
329 HA GLN 50 HA GLN 50 -8.390 -4.833 -0.772
330 HB2 GLN 50 1HB GLN 50 -7.410 -2.350 -0.722
331 HB3 GLN 50 2HB GLN 50 -5.906 -3.145 -1.117
332 HG2 GLN 50 1HG GLN 50 -8.487 -3.077 -2.664
333 HG3 GLN 50 2HG GLN 50 -6.976 -2.372 -3.120
334 HE21 GLN 50 1HE2 GLN 50 -8.650 -4.132 -4.727
335 HE22 GLN 50 2HE2 GLN 50 -7.553 -5.425 -5.195
336 H ALA 51 H ALA 51 -5.047 -4.389 0.399
337 HA ALA 51 HA ALA 51 -3.770 -6.205 -1.154
338 HB1 ALA 51 1HB ALA 51 -1.969 -6.133 0.625
339 HB2 ALA 51 2HB ALA 51 -2.625 -4.540 0.223
340 HB3 ALA 51 3HB ALA 51 -3.127 -5.363 1.714
341 H GLY 52 H GLY 52 -4.946 -6.879 2.173
342 HA2 GLY 52 1HA GLY 52 -4.831 -9.827 1.730
343 HA3 GLY 52 2HA GLY 52 -4.859 -8.992 3.293
344 H ALA 53 H ALA 53 -6.791 -8.781 0.278
345 HA ALA 53 HA ALA 53 -9.319 -8.477 1.608
346 HB1 ALA 53 1HB ALA 53 -8.992 -7.625 -0.648
347 HB2 ALA 53 2HB ALA 53 -8.601 -9.249 -1.250
348 HB3 ALA 53 3HB ALA 53 -10.252 -8.844 -0.674
349 H ALA 54 H ALA 54 -9.552 -11.033 -0.756
350 HA ALA 54 HA ALA 54 -8.942 -13.212 0.996
351 HB1 ALA 54 1HB ALA 54 -11.272 -12.562 1.775
352 HB2 ALA 54 2HB ALA 54 -11.849 -12.802 0.112
353 HB3 ALA 54 3HB ALA 54 -11.221 -14.176 1.047
354 H GLY 55 H GLY 55 -7.960 -12.339 -1.430
355 HA2 GLY 55 1HA GLY 55 -8.882 -14.452 -3.379
356 HA3 GLY 55 2HA GLY 55 -8.313 -12.880 -3.896
357 H SER 56 H SER 56 -6.370 -13.444 -1.398
358 HA SER 56 HA SER 56 -4.223 -13.878 -1.126
359 HB2 SER 56 1HB SER 56 -5.058 -16.274 -1.312
360 HB3 SER 56 2HB SER 56 -4.415 -16.171 -2.972
361 HG SER 56 HG SER 56 -2.602 -15.260 -1.148
362 H GLY 57 H GLY 57 -3.834 -12.092 -2.123
363 HA2 GLY 57 1HA GLY 57 -2.085 -12.221 -4.536
364 HA3 GLY 57 2HA GLY 57 -3.052 -10.773 -4.240
365 H CYS 58 H CYS 58 -2.328 -9.308 -2.797
366 HA CYS 58 HA CYS 58 0.386 -9.098 -2.316
367 HB2 CYS 58 1HB CYS 58 -1.880 -7.736 -0.860
368 HB3 CYS 58 2HB CYS 58 -0.244 -7.128 -0.980
369 H ASP 59 H ASP 59 1.688 -8.979 -0.471
370 HA ASP 59 HA ASP 59 1.188 -11.396 0.970
371 HB2 ASP 59 1HB ASP 59 3.329 -10.657 -0.268
372 HB3 ASP 59 2HB ASP 59 3.734 -9.760 1.194
373 H MET 60 H MET 60 0.309 -11.549 2.895
374 HA MET 60 HA MET 60 -0.073 -9.224 4.601
375 HB2 MET 60 1HB MET 60 -0.927 -12.130 4.789
376 HB3 MET 60 2HB MET 60 -1.386 -10.896 5.971
377 HG2 MET 60 1HG MET 60 -2.560 -9.599 4.334
378 HG3 MET 60 2HG MET 60 -1.970 -10.591 2.998
379 HE1 MET 60 3HE MET 60 -3.132 -12.740 2.099
380 HE2 MET 60 1HE MET 60 -2.327 -13.463 3.495
381 HE3 MET 60 2HE MET 60 -4.042 -13.820 3.173
382 H GLU 61 H GLU 61 0.480 -9.253 6.931
383 HA GLU 61 HA GLU 61 2.651 -11.141 7.688
384 HB2 GLU 61 1HB GLU 61 2.409 -8.186 8.393
385 HB3 GLU 61 2HB GLU 61 3.325 -9.355 9.339
386 HG2 GLU 61 1HG GLU 61 4.506 -9.983 7.101
387 HG3 GLU 61 2HG GLU 61 3.838 -8.463 6.493
Start of MODEL 5
1 H1 TYR 1 H TYR 1 -13.581 10.358 1.826
2 HA TYR 1 HA TYR 1 -12.022 10.264 3.696
3 HB2 TYR 1 1HB TYR 1 -12.842 8.267 4.751
4 HB3 TYR 1 2HB TYR 1 -12.486 7.279 3.336
5 HD1 TYR 1 1HD TYR 1 -10.627 9.728 5.550
6 HD2 TYR 1 2HD TYR 1 -10.537 5.865 3.548
7 HE1 TYR 1 1HE TYR 1 -8.228 9.516 6.029
8 HE2 TYR 1 2HE TYR 1 -8.191 5.645 4.110
9 HH TYR 1 HH TYR 1 -6.356 8.038 5.959
10 H ASN 2 H ASN 2 -10.846 7.516 2.043
11 HA ASN 2 HA ASN 2 -9.929 7.044 0.003
12 HB2 ASN 2 1HB ASN 2 -9.148 9.937 -0.014
13 HB3 ASN 2 2HB ASN 2 -8.259 8.738 -0.937
14 HD21 ASN 2 1HD2 ASN 2 -8.808 9.791 -2.973
15 HD22 ASN 2 2HD2 ASN 2 -10.431 9.548 -3.591
16 HA PRO 3 HA PRO 3 -6.485 6.291 2.784
17 HB2 PRO 3 1HB PRO 3 -4.933 4.672 1.150
18 HB3 PRO 3 2HB PRO 3 -6.380 4.106 2.017
19 HG2 PRO 3 1HG PRO 3 -6.174 4.969 -0.865
20 HG3 PRO 3 2HG PRO 3 -7.089 3.600 -0.160
21 HD2 PRO 3 1HD PRO 3 -8.297 5.884 -0.824
22 HD3 PRO 3 2HD PRO 3 -8.818 4.881 0.562
23 H GLU 4 H GLU 4 -6.241 7.681 -0.430
24 HA GLU 4 HA GLU 4 -3.665 8.770 -0.449
25 HB2 GLU 4 1HB GLU 4 -6.344 9.826 -1.394
26 HB3 GLU 4 2HB GLU 4 -4.837 10.625 -1.783
27 HG2 GLU 4 1HG GLU 4 -4.049 8.790 -3.089
28 HG3 GLU 4 2HG GLU 4 -5.297 7.705 -2.509
29 H ASP 5 H ASP 5 -6.339 9.566 1.726
30 HA ASP 5 HA ASP 5 -5.444 12.262 2.245
31 HB2 ASP 5 1HB ASP 5 -7.809 10.921 2.622
32 HB3 ASP 5 2HB ASP 5 -7.152 10.889 4.265
33 H ASP 6 H ASP 6 -4.445 9.136 3.324
34 HA ASP 6 HA ASP 6 -2.680 10.302 5.440
35 HB2 ASP 6 1HB ASP 6 -4.175 7.667 5.496
36 HB3 ASP 6 2HB ASP 6 -2.830 8.046 6.534
37 H TYR 7 H TYR 7 -2.492 9.722 2.460
38 HA TYR 7 HA TYR 7 -0.565 7.661 1.989
39 HB2 TYR 7 1HB TYR 7 -1.713 8.595 0.157
40 HB3 TYR 7 2HB TYR 7 -1.343 10.247 0.650
41 HD1 TYR 7 2HD TYR 7 0.629 7.148 -0.215
42 HD2 TYR 7 1HD TYR 7 0.024 11.377 -0.809
43 HE1 TYR 7 2HE TYR 7 2.476 7.181 -1.865
44 HE2 TYR 7 1HE TYR 7 1.871 11.423 -2.451
45 HH TYR 7 HH TYR 7 3.641 8.426 -3.370
46 H THR 8 H THR 8 1.680 7.696 2.420
47 HA THR 8 HA THR 8 2.750 10.170 3.678
48 HB THR 8 HB THR 8 4.309 8.657 4.806
49 HG1 THR 8 1HG THR 8 4.473 6.810 3.848
50 HG21 THR 8 3HG2 THR 8 1.441 7.745 5.269
51 HG22 THR 8 1HG2 THR 8 2.794 7.796 6.408
52 HG23 THR 8 2HG2 THR 8 2.076 9.303 5.822
53 HA PRO 9 HA PRO 9 4.996 9.768 -0.379
54 HB2 PRO 9 1HB PRO 9 5.497 12.462 -0.719
55 HB3 PRO 9 2HB PRO 9 4.046 11.615 -1.331
56 HG2 PRO 9 1HG PRO 9 4.330 13.272 1.175
57 HG3 PRO 9 2HG PRO 9 2.964 13.230 0.019
58 HD2 PRO 9 1HD PRO 9 2.916 11.903 2.397
59 HD3 PRO 9 2HD PRO 9 2.129 11.239 0.937
60 H LEU 10 H LEU 10 5.723 11.607 2.605
61 HA LEU 10 HA LEU 10 8.366 12.003 2.664
62 HB2 LEU 10 1HB LEU 10 6.380 10.883 4.684
63 HB3 LEU 10 2HB LEU 10 8.045 11.266 5.106
64 HG LEU 10 HG LEU 10 7.726 13.578 4.440
65 HD11 LEU 10 1HD1 LEU 10 4.830 12.873 3.919
66 HD12 LEU 10 2HD1 LEU 10 5.432 14.520 4.169
67 HD13 LEU 10 3HD1 LEU 10 6.011 13.624 2.795
68 HD21 LEU 10 3HD2 LEU 10 6.247 14.241 6.344
69 HD22 LEU 10 1HD2 LEU 10 5.669 12.567 6.452
70 HD23 LEU 10 2HD2 LEU 10 7.367 12.949 6.789
71 H THR 11 H THR 11 6.751 8.785 3.260
72 HA THR 11 HA THR 11 9.411 7.512 3.259
73 HB THR 11 HB THR 11 7.902 5.649 4.327
74 HG1 THR 11 1HG THR 11 6.074 6.331 5.258
75 HG21 THR 11 3HG2 THR 11 8.214 6.730 6.552
76 HG22 THR 11 1HG2 THR 11 9.645 6.894 5.516
77 HG23 THR 11 2HG2 THR 11 8.562 8.275 5.747
78 H CYS 12 H CYS 12 6.751 7.946 1.137
79 HA CYS 12 HA CYS 12 6.856 5.201 0.182
80 HB2 CYS 12 1HB CYS 12 4.780 6.471 0.678
81 HB3 CYS 12 2HB CYS 12 5.086 7.444 -0.762
82 HA PRO 13 HA PRO 13 9.464 6.542 -3.383
83 HB2 PRO 13 1HB PRO 13 9.829 3.866 -4.298
84 HB3 PRO 13 2HB PRO 13 10.939 4.839 -3.306
85 HG2 PRO 13 1HG PRO 13 9.047 2.721 -2.529
86 HG3 PRO 13 2HG PRO 13 10.577 3.184 -1.745
87 HD2 PRO 13 1HD PRO 13 8.050 3.790 -0.781
88 HD3 PRO 13 2HD PRO 13 9.522 4.748 -0.434
89 H HIS 14 H HIS 14 6.269 5.768 -3.233
90 HA HIS 14 HA HIS 14 6.006 5.341 -6.171
91 HB2 HIS 14 1HB HIS 14 4.046 4.115 -4.236
92 HB3 HIS 14 2HB HIS 14 4.362 3.700 -5.890
93 HD1 HIS 14 1HD HIS 14 6.499 2.126 -6.389
94 HD2 HIS 14 2HD HIS 14 5.491 2.929 -2.377
95 HE1 HIS 14 1HE HIS 14 7.348 0.265 -4.936
96 HE2 HIS 14 2HE HIS 14 7.083 0.918 -2.498
97 H THR 15 H THR 15 4.611 6.671 -7.163
98 HA THR 15 HA THR 15 3.990 9.076 -5.771
99 HB THR 15 HB THR 15 3.297 9.745 -8.068
100 HG1 THR 15 1HG THR 15 3.717 8.066 -9.695
101 HG21 THR 15 3HG2 THR 15 5.858 8.060 -8.064
102 HG22 THR 15 1HG2 THR 15 5.484 9.444 -9.130
103 HG23 THR 15 2HG2 THR 15 5.715 9.686 -7.385
104 H ILE 16 H ILE 16 1.778 10.080 -5.862
105 HA ILE 16 HA ILE 16 -0.061 8.406 -4.582
106 HB ILE 16 HB ILE 16 0.163 10.881 -4.427
107 HG12 ILE 16 1HG1 ILE 16 -2.716 9.969 -4.819
108 HG13 ILE 16 2HG1 ILE 16 -1.733 9.568 -3.406
109 HG21 ILE 16 1HG2 ILE 16 0.076 11.321 -6.901
110 HG22 ILE 16 2HG2 ILE 16 -1.667 10.989 -6.857
111 HG23 ILE 16 3HG2 ILE 16 -1.000 12.354 -5.945
112 HD11 ILE 16 3HD1 ILE 16 -2.620 12.336 -4.279
113 HD12 ILE 16 1HD1 ILE 16 -3.066 11.454 -2.814
114 HD13 ILE 16 2HD1 ILE 16 -1.409 12.043 -2.999
115 H SER 17 H SER 17 0.458 8.672 -7.972
116 HA SER 17 HA SER 17 -2.087 7.716 -8.921
117 HB2 SER 17 1HB SER 17 0.750 7.958 -10.028
118 HB3 SER 17 2HB SER 17 -0.673 7.543 -10.978
119 HG SER 17 HG SER 17 -0.139 9.681 -11.124
120 H VAL 18 H VAL 18 1.001 6.235 -7.817
121 HA VAL 18 HA VAL 18 0.015 3.570 -8.668
122 HB VAL 18 HB VAL 18 1.995 2.934 -9.664
123 HG11 VAL 18 1HG1 VAL 18 1.756 5.821 -10.624
124 HG12 VAL 18 2HG1 VAL 18 2.387 4.422 -11.507
125 HG13 VAL 18 3HG1 VAL 18 0.665 4.490 -11.106
126 HG21 VAL 18 3HG2 VAL 18 3.224 5.193 -8.157
127 HG22 VAL 18 1HG2 VAL 18 3.821 3.542 -8.469
128 HG23 VAL 18 2HG2 VAL 18 3.990 4.777 -9.738
129 H VAL 19 H VAL 19 -0.286 4.809 -6.168
130 HA VAL 19 HA VAL 19 1.644 3.223 -4.529
131 HB VAL 19 HB VAL 19 1.585 5.508 -3.905
132 HG11 VAL 19 1HG1 VAL 19 -1.403 5.262 -3.292
133 HG12 VAL 19 2HG1 VAL 19 -0.365 6.647 -2.948
134 HG13 VAL 19 3HG1 VAL 19 -0.692 6.183 -4.621
135 HG21 VAL 19 3HG2 VAL 19 1.135 5.232 -1.517
136 HG22 VAL 19 1HG2 VAL 19 0.211 3.759 -1.840
137 HG23 VAL 19 2HG2 VAL 19 1.943 3.806 -2.207
138 H TRP 20 H TRP 20 -1.873 3.772 -5.083
139 HA TRP 20 HA TRP 20 -2.777 1.769 -3.283
140 HB2 TRP 20 1HB TRP 20 -4.175 3.595 -4.215
141 HB3 TRP 20 2HB TRP 20 -4.099 2.859 -5.815
142 HD1 TRP 20 HD TRP 20 -5.962 1.146 -6.348
143 HE1 TRP 20 1HE TRP 20 -7.797 -0.039 -5.017
144 HE3 TRP 20 3HE TRP 20 -4.460 2.437 -1.636
145 HZ2 TRP 20 2HZ TRP 20 -8.649 -0.188 -2.208
146 HZ3 TRP 20 3HZ TRP 20 -5.765 1.756 0.323
147 HH2 TRP 20 HH TRP 20 -7.922 0.561 0.035
148 H TYR 21 H TYR 21 -2.638 1.660 -6.871
149 HA TYR 21 HA TYR 21 -3.156 -1.057 -7.203
150 HB2 TYR 21 1HB TYR 21 -3.158 0.406 -9.092
151 HB3 TYR 21 2HB TYR 21 -1.500 0.938 -8.787
152 HD1 TYR 21 2HD TYR 21 -3.581 -1.899 -9.997
153 HD2 TYR 21 1HD TYR 21 0.415 -0.322 -9.514
154 HE1 TYR 21 2HE TYR 21 -2.672 -3.823 -11.269
155 HE2 TYR 21 1HE TYR 21 1.324 -2.231 -10.812
156 HH TYR 21 HH TYR 21 -0.620 -5.065 -11.255
157 H GLU 22 H GLU 22 0.004 0.526 -6.422
158 HA GLU 22 HA GLU 22 1.760 -1.602 -7.083
159 HB2 GLU 22 1HB GLU 22 2.979 0.210 -7.147
160 HB3 GLU 22 2HB GLU 22 1.672 0.996 -6.449
161 HG2 GLU 22 1HG GLU 22 2.984 1.472 -4.972
162 HG3 GLU 22 2HG GLU 22 2.615 0.114 -4.094
163 H CYS 23 H CYS 23 -0.008 -0.573 -4.119
164 HA CYS 23 HA CYS 23 1.318 -2.675 -2.581
165 HB2 CYS 23 1HB CYS 23 -0.130 -0.117 -1.780
166 HB3 CYS 23 2HB CYS 23 0.231 -1.416 -0.639
167 H THR 24 H THR 24 -1.391 -2.529 -4.471
168 HA THR 24 HA THR 24 -2.643 -4.345 -2.577
169 HB THR 24 HB THR 24 -4.847 -3.614 -3.090
170 HG1 THR 24 1HG THR 24 -3.689 -1.529 -4.580
171 HG21 THR 24 3HG2 THR 24 -3.072 -1.275 -2.256
172 HG22 THR 24 1HG2 THR 24 -4.827 -1.316 -2.124
173 HG23 THR 24 2HG2 THR 24 -3.838 -2.473 -1.213
174 H GLU 25 H GLU 25 -1.620 -3.976 -5.862
175 HA GLU 25 HA GLU 25 -2.951 -6.520 -6.579
176 HB2 GLU 25 1HB GLU 25 -3.799 -4.351 -7.646
177 HB3 GLU 25 2HB GLU 25 -2.250 -4.220 -8.447
178 HG2 GLU 25 1HG GLU 25 -4.179 -6.543 -8.673
179 HG3 GLU 25 2HG GLU 25 -4.054 -5.240 -9.853
180 H ASN 26 H ASN 26 -0.255 -4.307 -7.275
181 HA ASN 26 HA ASN 26 1.226 -6.044 -8.895
182 HB2 ASN 26 1HB ASN 26 1.542 -3.609 -8.797
183 HB3 ASN 26 2HB ASN 26 2.204 -3.778 -7.157
184 HD21 ASN 26 1HD2 ASN 26 3.956 -2.536 -8.372
185 HD22 ASN 26 2HD2 ASN 26 5.257 -3.521 -8.984
186 H THR 27 H THR 27 1.868 -8.052 -8.288
187 HA THR 27 HA THR 27 2.355 -8.880 -5.658
188 HB THR 27 HB THR 27 3.378 -10.856 -7.202
189 HG1 THR 27 1HG THR 27 2.976 -10.599 -9.258
190 HG21 THR 27 3HG2 THR 27 1.301 -10.943 -5.840
191 HG22 THR 27 1HG2 THR 27 0.431 -10.058 -7.118
192 HG23 THR 27 2HG2 THR 27 1.091 -11.680 -7.430
193 H ALA 28 H ALA 28 4.483 -7.171 -7.775
194 HA ALA 28 HA ALA 28 6.958 -8.133 -6.611
195 HB1 ALA 28 1HB ALA 28 7.943 -6.237 -7.787
196 HB2 ALA 28 2HB ALA 28 6.802 -7.066 -8.861
197 HB3 ALA 28 3HB ALA 28 6.337 -5.533 -8.067
198 H ASN 29 H ASN 29 4.438 -6.412 -5.161
199 HA ASN 29 HA ASN 29 6.261 -5.191 -3.154
200 HB2 ASN 29 1HB ASN 29 4.271 -3.717 -4.912
201 HB3 ASN 29 2HB ASN 29 4.758 -3.096 -3.343
202 HD21 ASN 29 1HD2 ASN 29 5.335 -2.375 -6.278
203 HD22 ASN 29 2HD2 ASN 29 7.053 -2.200 -6.402
204 H CYS 30 H CYS 30 2.872 -5.833 -4.152
205 HA CYS 30 HA CYS 30 1.810 -4.551 -2.013
206 HB2 CYS 30 1HB CYS 30 -0.306 -5.506 -2.559
207 HB3 CYS 30 2HB CYS 30 0.585 -5.123 -4.029
208 H GLY 31 H GLY 31 1.147 -4.848 0.041
209 HA2 GLY 31 1HA GLY 31 0.417 -7.020 1.378
210 HA3 GLY 31 2HA GLY 31 2.170 -7.154 1.469
211 H THR 32 H THR 32 1.225 -6.964 3.855
212 HA THR 32 HA THR 32 0.215 -4.593 4.777
213 HB THR 32 HB THR 32 1.975 -6.547 6.282
214 HG1 THR 32 1HG THR 32 -0.711 -6.899 6.544
215 HG21 THR 32 3HG2 THR 32 0.489 -5.989 8.246
216 HG22 THR 32 1HG2 THR 32 1.523 -4.655 7.723
217 HG23 THR 32 2HG2 THR 32 -0.207 -4.670 7.308
218 H ALA 33 H ALA 33 3.713 -5.426 4.633
219 HA ALA 33 HA ALA 33 4.593 -3.013 5.901
220 HB1 ALA 33 1HB ALA 33 6.790 -3.580 4.985
221 HB2 ALA 33 2HB ALA 33 6.025 -5.020 5.645
222 HB3 ALA 33 3HB ALA 33 6.074 -4.756 3.881
223 H CYS 34 H CYS 34 3.896 -3.860 2.525
224 HA CYS 34 HA CYS 34 4.820 -1.530 1.222
225 HB2 CYS 34 1HB CYS 34 3.854 -3.706 0.255
226 HB3 CYS 34 2HB CYS 34 2.261 -3.000 0.504
227 H CYS 35 H CYS 35 1.616 -2.255 2.660
228 HA CYS 35 HA CYS 35 0.467 0.304 2.199
229 HB2 CYS 35 1HB CYS 35 -0.103 -1.746 4.375
230 HB3 CYS 35 2HB CYS 35 -1.083 -0.326 4.061
231 H ASP 36 H ASP 36 2.216 -0.968 5.115
232 HA ASP 36 HA ASP 36 1.777 1.447 6.583
233 HB2 ASP 36 1HB ASP 36 2.186 -0.936 7.402
234 HB3 ASP 36 2HB ASP 36 3.903 -0.638 7.140
235 H SER 37 H SER 37 4.334 0.702 4.308
236 HA SER 37 HA SER 37 5.945 3.019 5.153
237 HB2 SER 37 1HB SER 37 6.139 1.024 2.879
238 HB3 SER 37 2HB SER 37 7.251 2.397 3.075
239 HG SER 37 HG SER 37 7.465 0.090 4.237
240 H CYS 38 H CYS 38 3.003 2.833 3.494
241 HA CYS 38 HA CYS 38 3.597 5.324 1.988
242 HB2 CYS 38 1HB CYS 38 2.396 2.716 1.051
243 HB3 CYS 38 2HB CYS 38 2.062 4.231 0.245
244 H PHE 39 H PHE 39 1.455 3.721 4.172
245 HA PHE 39 HA PHE 39 -0.525 5.865 3.978
246 HB2 PHE 39 1HB PHE 39 -1.125 2.880 3.761
247 HB3 PHE 39 2HB PHE 39 -2.304 4.122 4.074
248 HD1 PHE 39 2HD PHE 39 -2.316 6.133 2.282
249 HD2 PHE 39 1HD PHE 39 -1.024 2.091 1.552
250 HE1 PHE 39 2HE PHE 39 -2.890 6.369 -0.129
251 HE2 PHE 39 1HE PHE 39 -1.666 2.289 -0.820
252 HZ PHE 39 HZ PHE 39 -2.621 4.409 -1.652
253 H GLU 40 H GLU 40 -1.347 6.259 5.993
254 HA GLU 40 HA GLU 40 -0.705 4.346 8.189
255 HB2 GLU 40 1HB GLU 40 -0.987 7.339 8.443
256 HB3 GLU 40 2HB GLU 40 -0.412 6.197 9.675
257 HG2 GLU 40 1HG GLU 40 1.382 5.815 7.569
258 HG3 GLU 40 2HG GLU 40 0.908 7.530 7.463
259 H LEU 41 H LEU 41 -2.221 4.605 10.074
260 HA LEU 41 HA LEU 41 -4.279 4.554 11.014
261 HB2 LEU 41 1HB LEU 41 -4.654 7.117 9.431
262 HB3 LEU 41 2HB LEU 41 -5.489 6.667 10.920
263 HG LEU 41 HG LEU 41 -2.499 7.224 10.663
264 HD11 LEU 41 1HD1 LEU 41 -4.730 8.886 11.889
265 HD12 LEU 41 2HD1 LEU 41 -2.992 9.265 11.926
266 HD13 LEU 41 3HD1 LEU 41 -3.849 9.227 10.381
267 HD21 LEU 41 3HD2 LEU 41 -2.916 5.615 12.469
268 HD22 LEU 41 1HD2 LEU 41 -2.492 7.193 13.133
269 HD23 LEU 41 2HD2 LEU 41 -4.190 6.660 13.136
270 H THR 42 H THR 42 -6.584 6.065 9.222
271 HA THR 42 HA THR 42 -7.836 3.590 8.533
272 HB THR 42 HB THR 42 -8.585 6.306 7.408
273 HG1 THR 42 1HG THR 42 -8.642 6.713 9.447
274 HG21 THR 42 3HG2 THR 42 -9.831 4.523 6.380
275 HG22 THR 42 1HG2 THR 42 -10.102 3.711 7.937
276 HG23 THR 42 2HG2 THR 42 -10.886 5.260 7.581
277 H GLY 43 H GLY 43 -5.537 5.644 6.761
278 HA2 GLY 43 1HA GLY 43 -6.188 4.707 4.140
279 HA3 GLY 43 2HA GLY 43 -4.684 5.503 4.658
280 H ASN 44 H ASN 44 -3.880 3.795 6.660
281 HA ASN 44 HA ASN 44 -2.611 1.622 5.352
282 HB2 ASN 44 1HB ASN 44 -1.903 2.616 7.562
283 HB3 ASN 44 2HB ASN 44 -3.236 1.759 8.337
284 HD21 ASN 44 1HD2 ASN 44 -0.262 1.451 6.501
285 HD22 ASN 44 2HD2 ASN 44 0.051 -0.236 6.923
286 H THR 45 H THR 45 -5.395 1.743 7.551
287 HA THR 45 HA THR 45 -6.184 -0.921 7.478
288 HB THR 45 HB THR 45 -8.206 1.345 7.492
289 HG1 THR 45 1HG THR 45 -6.389 1.777 9.043
290 HG21 THR 45 3HG2 THR 45 -9.105 -0.942 7.606
291 HG22 THR 45 1HG2 THR 45 -8.037 -1.305 8.984
292 HG23 THR 45 2HG2 THR 45 -9.327 -0.104 9.160
293 H MET 46 H MET 46 -7.307 1.688 5.212
294 HA MET 46 HA MET 46 -8.980 -0.101 3.733
295 HB2 MET 46 1HB MET 46 -7.937 2.681 3.036
296 HB3 MET 46 2HB MET 46 -9.014 1.727 2.015
297 HG2 MET 46 1HG MET 46 -10.394 1.467 4.285
298 HG3 MET 46 2HG MET 46 -9.542 2.948 4.703
299 HE1 MET 46 3HE MET 46 -13.177 4.092 3.976
300 HE2 MET 46 1HE MET 46 -12.572 2.627 4.777
301 HE3 MET 46 2HE MET 46 -11.802 4.198 5.093
302 H CYS 47 H CYS 47 -5.565 0.899 3.282
303 HA CYS 47 HA CYS 47 -5.120 -0.378 0.779
304 HB2 CYS 47 1HB CYS 47 -3.588 1.208 1.818
305 HB3 CYS 47 2HB CYS 47 -3.261 0.099 3.135
306 H LEU 48 H LEU 48 -4.749 -1.652 4.118
307 HA LEU 48 HA LEU 48 -4.102 -4.312 3.399
308 HB2 LEU 48 1HB LEU 48 -5.574 -3.169 5.806
309 HB3 LEU 48 2HB LEU 48 -5.030 -4.819 5.685
310 HG LEU 48 HG LEU 48 -3.232 -2.348 5.572
311 HD11 LEU 48 1HD1 LEU 48 -2.453 -3.146 7.788
312 HD12 LEU 48 2HD1 LEU 48 -4.158 -2.664 7.761
313 HD13 LEU 48 3HD1 LEU 48 -3.710 -4.397 7.755
314 HD21 LEU 48 3HD2 LEU 48 -2.357 -5.243 5.722
315 HD22 LEU 48 1HD2 LEU 48 -2.208 -4.192 4.289
316 HD23 LEU 48 2HD2 LEU 48 -1.369 -3.751 5.761
317 H LEU 49 H LEU 49 -7.277 -2.846 4.013
318 HA LEU 49 HA LEU 49 -8.910 -5.081 3.585
319 HB2 LEU 49 1HB LEU 49 -9.283 -2.223 3.734
320 HB3 LEU 49 2HB LEU 49 -10.161 -2.809 2.336
321 HG LEU 49 HG LEU 49 -11.213 -4.570 3.866
322 HD11 LEU 49 1HD1 LEU 49 -11.157 -4.102 6.298
323 HD12 LEU 49 2HD1 LEU 49 -9.532 -4.453 5.709
324 HD13 LEU 49 3HD1 LEU 49 -10.003 -2.775 6.033
325 HD21 LEU 49 3HD2 LEU 49 -11.698 -1.625 4.511
326 HD22 LEU 49 1HD2 LEU 49 -12.403 -2.533 3.156
327 HD23 LEU 49 2HD2 LEU 49 -12.828 -2.961 4.818
328 H GLN 50 H GLN 50 -7.342 -3.086 1.067
329 HA GLN 50 HA GLN 50 -8.640 -4.643 -1.055
330 HB2 GLN 50 1HB GLN 50 -8.093 -2.177 -1.147
331 HB3 GLN 50 2HB GLN 50 -6.401 -2.613 -1.198
332 HG2 GLN 50 1HG GLN 50 -7.013 -2.226 -3.450
333 HG3 GLN 50 2HG GLN 50 -6.941 -3.977 -3.303
334 HE21 GLN 50 1HE2 GLN 50 -8.511 -4.747 -4.756
335 HE22 GLN 50 2HE2 GLN 50 -10.166 -4.208 -4.726
336 H ALA 51 H ALA 51 -5.294 -4.301 0.323
337 HA ALA 51 HA ALA 51 -3.982 -5.983 -1.505
338 HB1 ALA 51 1HB ALA 51 -2.162 -6.020 0.135
339 HB2 ALA 51 2HB ALA 51 -2.852 -4.390 0.060
340 HB3 ALA 51 3HB ALA 51 -3.251 -5.464 1.415
341 H GLY 52 H GLY 52 -5.292 -6.795 1.753
342 HA2 GLY 52 1HA GLY 52 -4.814 -9.681 1.286
343 HA3 GLY 52 2HA GLY 52 -5.286 -8.890 2.788
344 H ALA 53 H ALA 53 -7.033 -8.050 -0.130
345 HA ALA 53 HA ALA 53 -9.380 -7.817 1.061
346 HB1 ALA 53 1HB ALA 53 -9.190 -7.038 -1.172
347 HB2 ALA 53 2HB ALA 53 -8.883 -8.670 -1.815
348 HB3 ALA 53 3HB ALA 53 -10.490 -8.237 -1.198
349 H ALA 54 H ALA 54 -8.889 -10.830 -0.833
350 HA ALA 54 HA ALA 54 -10.069 -12.370 1.276
351 HB1 ALA 54 1HB ALA 54 -11.500 -12.335 -1.419
352 HB2 ALA 54 2HB ALA 54 -11.926 -13.263 0.045
353 HB3 ALA 54 3HB ALA 54 -12.095 -11.506 0.045
354 H GLY 55 H GLY 55 -7.550 -12.264 0.188
355 HA2 GLY 55 1HA GLY 55 -6.387 -14.533 -0.242
356 HA3 GLY 55 2HA GLY 55 -7.230 -14.444 -1.805
357 H SER 56 H SER 56 -6.799 -12.591 -3.207
358 HA SER 56 HA SER 56 -5.158 -11.886 -4.630
359 HB2 SER 56 1HB SER 56 -4.720 -10.478 -2.032
360 HB3 SER 56 2HB SER 56 -3.755 -10.015 -3.464
361 HG SER 56 HG SER 56 -5.436 -9.104 -4.285
362 H GLY 57 H GLY 57 -2.392 -11.346 -4.377
363 HA2 GLY 57 1HA GLY 57 -1.161 -13.765 -3.140
364 HA3 GLY 57 2HA GLY 57 -0.699 -13.122 -4.726
365 H CYS 58 H CYS 58 -1.651 -10.870 -2.299
366 HA CYS 58 HA CYS 58 0.953 -9.622 -2.095
367 HB2 CYS 58 1HB CYS 58 -1.685 -9.143 -0.631
368 HB3 CYS 58 2HB CYS 58 -0.302 -8.068 -0.613
369 H ASP 59 H ASP 59 1.733 -9.122 0.226
370 HA ASP 59 HA ASP 59 1.741 -11.715 1.693
371 HB2 ASP 59 1HB ASP 59 3.875 -10.178 0.854
372 HB3 ASP 59 2HB ASP 59 3.711 -9.689 2.544
373 H MET 60 H MET 60 1.458 -11.767 3.996
374 HA MET 60 HA MET 60 0.057 -9.437 5.195
375 HB2 MET 60 1HB MET 60 -0.976 -12.290 4.944
376 HB3 MET 60 2HB MET 60 -1.644 -11.094 6.057
377 HG2 MET 60 1HG MET 60 -1.434 -10.539 3.085
378 HG3 MET 60 2HG MET 60 -2.742 -11.467 3.726
379 HE1 MET 60 3HE MET 60 -4.961 -8.905 5.593
380 HE2 MET 60 1HE MET 60 -4.778 -10.559 4.982
381 HE3 MET 60 2HE MET 60 -3.829 -10.013 6.389
382 H GLU 61 H GLU 61 1.336 -9.018 6.898
383 HA GLU 61 HA GLU 61 2.648 -11.183 8.400
384 HB2 GLU 61 1HB GLU 61 3.571 -9.513 9.791
385 HB3 GLU 61 2HB GLU 61 3.777 -9.013 8.110
386 HG2 GLU 61 1HG GLU 61 2.165 -7.344 8.277
387 HG3 GLU 61 2HG GLU 61 1.591 -7.882 9.869
Start of MODEL 6
1 H1 TYR 1 H TYR 1 -13.949 8.215 1.750
2 HA TYR 1 HA TYR 1 -12.354 9.727 3.713
3 HB2 TYR 1 1HB TYR 1 -12.916 7.683 4.751
4 HB3 TYR 1 2HB TYR 1 -12.590 6.741 3.298
5 HD1 TYR 1 1HD TYR 1 -10.679 9.371 5.238
6 HD2 TYR 1 2HD TYR 1 -10.599 5.387 3.482
7 HE1 TYR 1 1HE TYR 1 -8.277 9.201 5.683
8 HE2 TYR 1 2HE TYR 1 -8.210 5.289 3.879
9 HH TYR 1 HH TYR 1 -6.411 7.775 5.643
10 H ASN 2 H ASN 2 -11.137 7.120 1.782
11 HA ASN 2 HA ASN 2 -10.038 6.950 -0.176
12 HB2 ASN 2 1HB ASN 2 -10.384 9.567 -0.707
13 HB3 ASN 2 2HB ASN 2 -8.768 9.681 -0.104
14 HD21 ASN 2 1HD2 ASN 2 -7.691 10.076 -2.023
15 HD22 ASN 2 2HD2 ASN 2 -7.441 8.765 -3.185
16 HA PRO 3 HA PRO 3 -6.610 6.241 2.643
17 HB2 PRO 3 1HB PRO 3 -5.017 4.656 1.011
18 HB3 PRO 3 2HB PRO 3 -6.369 4.084 2.015
19 HG2 PRO 3 1HG PRO 3 -6.303 4.566 -0.925
20 HG3 PRO 3 2HG PRO 3 -7.303 3.422 0.030
21 HD2 PRO 3 1HD PRO 3 -8.176 5.837 -1.016
22 HD3 PRO 3 2HD PRO 3 -8.986 4.899 0.280
23 H GLU 4 H GLU 4 -6.205 7.614 -0.682
24 HA GLU 4 HA GLU 4 -3.646 8.603 -0.188
25 HB2 GLU 4 1HB GLU 4 -5.715 9.970 -1.902
26 HB3 GLU 4 2HB GLU 4 -3.987 10.136 -1.953
27 HG2 GLU 4 1HG GLU 4 -5.578 7.818 -3.007
28 HG3 GLU 4 2HG GLU 4 -4.411 8.833 -3.828
29 H ASP 5 H ASP 5 -6.571 9.548 1.481
30 HA ASP 5 HA ASP 5 -5.571 12.203 2.156
31 HB2 ASP 5 1HB ASP 5 -7.955 11.122 2.424
32 HB3 ASP 5 2HB ASP 5 -7.349 10.641 3.996
33 H ASP 6 H ASP 6 -4.680 8.948 3.235
34 HA ASP 6 HA ASP 6 -2.799 10.094 5.285
35 HB2 ASP 6 1HB ASP 6 -4.139 7.389 5.355
36 HB3 ASP 6 2HB ASP 6 -2.820 7.902 6.377
37 H TYR 7 H TYR 7 -2.612 9.740 2.300
38 HA TYR 7 HA TYR 7 -0.544 7.756 1.902
39 HB2 TYR 7 1HB TYR 7 -1.634 8.484 -0.027
40 HB3 TYR 7 2HB TYR 7 -1.504 10.194 0.398
41 HD1 TYR 7 1HD TYR 7 0.733 7.240 -0.234
42 HD2 TYR 7 2HD TYR 7 -0.023 11.406 -0.907
43 HE1 TYR 7 1HE TYR 7 2.668 7.320 -1.789
44 HE2 TYR 7 2HE TYR 7 1.946 11.500 -2.490
45 HH TYR 7 HH TYR 7 3.821 8.593 -3.317
46 H THR 8 H THR 8 1.618 7.988 2.244
47 HA THR 8 HA THR 8 2.595 10.557 3.368
48 HB THR 8 HB THR 8 4.063 9.062 4.752
49 HG1 THR 8 1HG THR 8 3.980 7.113 4.066
50 HG21 THR 8 3HG2 THR 8 1.893 10.188 5.485
51 HG22 THR 8 1HG2 THR 8 1.079 8.655 5.207
52 HG23 THR 8 2HG2 THR 8 2.375 8.763 6.417
53 HA PRO 9 HA PRO 9 4.959 9.756 -0.448
54 HB2 PRO 9 1HB PRO 9 5.764 12.310 -0.983
55 HB3 PRO 9 2HB PRO 9 4.162 11.686 -1.421
56 HG2 PRO 9 1HG PRO 9 4.913 13.301 1.030
57 HG3 PRO 9 2HG PRO 9 3.538 13.566 -0.083
58 HD2 PRO 9 1HD PRO 9 3.237 12.252 2.276
59 HD3 PRO 9 2HD PRO 9 2.354 11.709 0.821
60 H LEU 10 H LEU 10 5.911 11.405 2.576
61 HA LEU 10 HA LEU 10 8.577 11.929 1.848
62 HB2 LEU 10 1HB LEU 10 7.390 11.496 4.621
63 HB3 LEU 10 2HB LEU 10 9.017 12.051 4.287
64 HG LEU 10 HG LEU 10 6.422 13.529 3.863
65 HD11 LEU 10 1HD1 LEU 10 9.076 14.292 5.177
66 HD12 LEU 10 2HD1 LEU 10 7.561 15.228 5.222
67 HD13 LEU 10 3HD1 LEU 10 7.653 13.659 6.042
68 HD21 LEU 10 3HD2 LEU 10 7.691 15.381 2.805
69 HD22 LEU 10 1HD2 LEU 10 9.072 14.283 2.591
70 HD23 LEU 10 2HD2 LEU 10 7.510 13.969 1.785
71 H THR 11 H THR 11 7.202 8.875 3.061
72 HA THR 11 HA THR 11 9.891 7.769 2.503
73 HB THR 11 HB THR 11 9.808 6.204 4.296
74 HG1 THR 11 1HG THR 11 8.266 6.417 5.953
75 HG21 THR 11 3HG2 THR 11 10.718 8.540 4.643
76 HG22 THR 11 1HG2 THR 11 9.205 8.943 5.475
77 HG23 THR 11 2HG2 THR 11 10.264 7.678 6.112
78 H CYS 12 H CYS 12 6.981 7.933 1.161
79 HA CYS 12 HA CYS 12 6.900 5.100 0.332
80 HB2 CYS 12 1HB CYS 12 4.808 6.369 0.800
81 HB3 CYS 12 2HB CYS 12 5.176 7.405 -0.571
82 HA PRO 13 HA PRO 13 9.505 6.588 -3.123
83 HB2 PRO 13 1HB PRO 13 9.766 4.007 -4.296
84 HB3 PRO 13 2HB PRO 13 10.915 4.875 -3.251
85 HG2 PRO 13 1HG PRO 13 9.083 2.659 -2.586
86 HG3 PRO 13 2HG PRO 13 10.566 3.184 -1.762
87 HD2 PRO 13 1HD PRO 13 7.940 3.648 -0.870
88 HD3 PRO 13 2HD PRO 13 9.410 4.527 -0.330
89 H HIS 14 H HIS 14 6.311 5.501 -3.088
90 HA HIS 14 HA HIS 14 6.131 5.336 -6.047
91 HB2 HIS 14 1HB HIS 14 4.062 4.111 -4.184
92 HB3 HIS 14 2HB HIS 14 4.352 3.753 -5.838
93 HD1 HIS 14 1HD HIS 14 6.964 2.509 -6.282
94 HD2 HIS 14 2HD HIS 14 5.266 2.609 -2.418
95 HE1 HIS 14 1HE HIS 14 7.405 0.371 -5.059
96 HE2 HIS 14 2HE HIS 14 6.882 0.641 -2.689
97 H THR 15 H THR 15 4.648 6.472 -7.067
98 HA THR 15 HA THR 15 4.017 8.979 -5.766
99 HB THR 15 HB THR 15 3.354 9.613 -8.105
100 HG1 THR 15 1HG THR 15 4.402 7.048 -8.772
101 HG21 THR 15 3HG2 THR 15 6.055 8.249 -7.693
102 HG22 THR 15 1HG2 THR 15 5.672 9.428 -8.968
103 HG23 THR 15 2HG2 THR 15 5.627 9.912 -7.245
104 H ILE 16 H ILE 16 1.949 10.002 -5.867
105 HA ILE 16 HA ILE 16 -0.151 8.440 -4.874
106 HB ILE 16 HB ILE 16 0.504 10.846 -4.562
107 HG12 ILE 16 1HG1 ILE 16 -2.439 10.185 -4.900
108 HG13 ILE 16 2HG1 ILE 16 -1.433 9.742 -3.511
109 HG21 ILE 16 1HG2 ILE 16 -1.409 11.480 -6.808
110 HG22 ILE 16 2HG2 ILE 16 -0.379 12.583 -5.887
111 HG23 ILE 16 3HG2 ILE 16 0.364 11.457 -7.027
112 HD11 ILE 16 3HD1 ILE 16 -0.998 12.169 -3.058
113 HD12 ILE 16 1HD1 ILE 16 -2.162 12.580 -4.342
114 HD13 ILE 16 2HD1 ILE 16 -2.702 11.706 -2.900
115 H SER 17 H SER 17 0.788 8.581 -8.105
116 HA SER 17 HA SER 17 -1.807 8.054 -9.279
117 HB2 SER 17 1HB SER 17 1.119 7.985 -10.182
118 HB3 SER 17 2HB SER 17 -0.256 7.701 -11.233
119 HG SER 17 HG SER 17 -0.979 9.781 -10.806
120 H VAL 18 H VAL 18 0.858 6.203 -7.820
121 HA VAL 18 HA VAL 18 -0.353 3.661 -8.587
122 HB VAL 18 HB VAL 18 1.662 2.721 -9.497
123 HG11 VAL 18 1HG1 VAL 18 0.217 3.893 -11.135
124 HG12 VAL 18 2HG1 VAL 18 1.248 5.332 -10.985
125 HG13 VAL 18 3HG1 VAL 18 1.916 3.799 -11.592
126 HG21 VAL 18 3HG2 VAL 18 2.879 5.144 -8.407
127 HG22 VAL 18 1HG2 VAL 18 3.549 3.529 -8.671
128 HG23 VAL 18 2HG2 VAL 18 3.517 4.692 -10.039
129 H VAL 19 H VAL 19 -0.541 4.752 -6.256
130 HA VAL 19 HA VAL 19 1.511 3.379 -4.592
131 HB VAL 19 HB VAL 19 1.486 5.669 -4.090
132 HG11 VAL 19 1HG1 VAL 19 -1.516 5.600 -3.415
133 HG12 VAL 19 2HG1 VAL 19 -0.397 6.934 -3.269
134 HG13 VAL 19 3HG1 VAL 19 -0.794 6.304 -4.867
135 HG21 VAL 19 3HG2 VAL 19 0.126 4.117 -1.872
136 HG22 VAL 19 1HG2 VAL 19 1.857 4.096 -2.275
137 HG23 VAL 19 2HG2 VAL 19 1.073 5.579 -1.687
138 H TRP 20 H TRP 20 -2.015 4.031 -4.801
139 HA TRP 20 HA TRP 20 -2.921 1.940 -3.108
140 HB2 TRP 20 1HB TRP 20 -4.284 3.820 -3.916
141 HB3 TRP 20 2HB TRP 20 -4.231 3.220 -5.562
142 HD1 TRP 20 HD TRP 20 -6.320 1.913 -6.233
143 HE1 TRP 20 1HE TRP 20 -8.199 0.622 -5.027
144 HE3 TRP 20 3HE TRP 20 -4.624 2.349 -1.433
145 HZ2 TRP 20 2HZ TRP 20 -8.769 -0.284 -2.305
146 HZ3 TRP 20 3HZ TRP 20 -5.926 1.442 0.431
147 HH2 TRP 20 HH TRP 20 -8.032 0.173 0.023
148 H TYR 21 H TYR 21 -2.841 2.037 -6.713
149 HA TYR 21 HA TYR 21 -3.221 -0.659 -7.233
150 HB2 TYR 21 1HB TYR 21 -3.202 0.921 -9.010
151 HB3 TYR 21 2HB TYR 21 -1.558 1.455 -8.626
152 HD1 TYR 21 2HD TYR 21 -3.601 -1.309 -10.072
153 HD2 TYR 21 1HD TYR 21 0.394 0.205 -9.388
154 HE1 TYR 21 2HE TYR 21 -2.684 -3.011 -11.587
155 HE2 TYR 21 1HE TYR 21 1.321 -1.621 -10.799
156 HH TYR 21 HH TYR 21 -0.462 -4.282 -11.653
157 H GLU 22 H GLU 22 -0.067 0.869 -6.160
158 HA GLU 22 HA GLU 22 1.473 -1.366 -7.024
159 HB2 GLU 22 1HB GLU 22 2.937 0.269 -7.093
160 HB3 GLU 22 2HB GLU 22 1.779 1.162 -6.298
161 HG2 GLU 22 1HG GLU 22 3.062 1.515 -4.875
162 HG3 GLU 22 2HG GLU 22 2.832 0.029 -4.066
163 H CYS 23 H CYS 23 0.046 -0.335 -3.816
164 HA CYS 23 HA CYS 23 1.428 -2.546 -2.501
165 HB2 CYS 23 1HB CYS 23 -0.271 -0.276 -1.458
166 HB3 CYS 23 2HB CYS 23 0.423 -1.554 -0.464
167 H THR 24 H THR 24 -1.301 -2.283 -4.376
168 HA THR 24 HA THR 24 -2.634 -4.207 -2.653
169 HB THR 24 HB THR 24 -4.843 -3.414 -3.165
170 HG1 THR 24 1HG THR 24 -3.478 -1.315 -4.458
171 HG21 THR 24 3HG2 THR 24 -3.781 -2.496 -1.152
172 HG22 THR 24 1HG2 THR 24 -3.091 -1.152 -2.094
173 HG23 THR 24 2HG2 THR 24 -4.842 -1.298 -1.911
174 H GLU 25 H GLU 25 -1.305 -3.795 -5.749
175 HA GLU 25 HA GLU 25 -2.827 -6.146 -6.727
176 HB2 GLU 25 1HB GLU 25 -3.569 -3.892 -7.751
177 HB3 GLU 25 2HB GLU 25 -2.002 -3.780 -8.489
178 HG2 GLU 25 1HG GLU 25 -3.342 -6.421 -8.886
179 HG3 GLU 25 2HG GLU 25 -4.230 -5.060 -9.531
180 H ASN 26 H ASN 26 -0.012 -4.005 -7.286
181 HA ASN 26 HA ASN 26 1.446 -5.871 -8.814
182 HB2 ASN 26 1HB ASN 26 1.890 -3.484 -8.864
183 HB3 ASN 26 2HB ASN 26 2.433 -3.535 -7.160
184 HD21 ASN 26 1HD2 ASN 26 4.353 -2.536 -8.275
185 HD22 ASN 26 2HD2 ASN 26 5.586 -3.619 -8.915
186 H THR 27 H THR 27 1.732 -7.893 -7.952
187 HA THR 27 HA THR 27 2.223 -8.449 -5.251
188 HB THR 27 HB THR 27 2.569 -10.706 -5.944
189 HG1 THR 27 1HG THR 27 3.906 -10.635 -7.589
190 HG21 THR 27 3HG2 THR 27 0.233 -9.715 -6.224
191 HG22 THR 27 1HG2 THR 27 0.571 -9.559 -7.950
192 HG23 THR 27 2HG2 THR 27 0.569 -11.165 -7.187
193 H ALA 28 H ALA 28 4.456 -7.056 -7.380
194 HA ALA 28 HA ALA 28 6.960 -7.994 -6.351
195 HB1 ALA 28 1HB ALA 28 7.777 -5.788 -7.045
196 HB2 ALA 28 2HB ALA 28 6.672 -6.396 -8.290
197 HB3 ALA 28 3HB ALA 28 6.131 -5.167 -7.123
198 H ASN 29 H ASN 29 4.372 -6.111 -4.896
199 HA ASN 29 HA ASN 29 6.028 -5.680 -2.480
200 HB2 ASN 29 1HB ASN 29 5.770 -3.268 -2.561
201 HB3 ASN 29 2HB ASN 29 6.520 -3.807 -4.061
202 HD21 ASN 29 1HD2 ASN 29 5.754 -2.698 -5.658
203 HD22 ASN 29 2HD2 ASN 29 4.222 -2.063 -5.815
204 H CYS 30 H CYS 30 2.746 -5.832 -3.920
205 HA CYS 30 HA CYS 30 1.457 -4.573 -1.843
206 HB2 CYS 30 1HB CYS 30 -0.553 -5.586 -2.581
207 HB3 CYS 30 2HB CYS 30 0.445 -5.264 -3.984
208 H GLY 31 H GLY 31 0.570 -5.097 0.161
209 HA2 GLY 31 1HA GLY 31 0.242 -7.244 1.686
210 HA3 GLY 31 2HA GLY 31 2.004 -7.297 1.490
211 H THR 32 H THR 32 1.224 -7.102 3.999
212 HA THR 32 HA THR 32 0.263 -4.778 5.037
213 HB THR 32 HB THR 32 2.266 -6.590 6.436
214 HG1 THR 32 1HG THR 32 0.207 -7.710 7.024
215 HG21 THR 32 3HG2 THR 32 1.514 -4.576 7.738
216 HG22 THR 32 1HG2 THR 32 -0.166 -5.123 7.539
217 HG23 THR 32 2HG2 THR 32 0.986 -6.108 8.455
218 H ALA 33 H ALA 33 3.746 -5.600 4.683
219 HA ALA 33 HA ALA 33 4.647 -3.195 5.868
220 HB1 ALA 33 1HB ALA 33 6.010 -5.259 5.594
221 HB2 ALA 33 2HB ALA 33 6.099 -4.942 3.849
222 HB3 ALA 33 3HB ALA 33 6.844 -3.815 5.009
223 H CYS 34 H CYS 34 3.558 -3.718 2.516
224 HA CYS 34 HA CYS 34 4.959 -1.334 1.501
225 HB2 CYS 34 1HB CYS 34 4.351 -3.161 0.043
226 HB3 CYS 34 2HB CYS 34 2.628 -2.876 0.303
227 H CYS 35 H CYS 35 1.652 -2.240 2.538
228 HA CYS 35 HA CYS 35 0.435 0.295 2.303
229 HB2 CYS 35 1HB CYS 35 -0.008 -1.873 4.394
230 HB3 CYS 35 2HB CYS 35 -1.069 -0.496 4.121
231 H ASP 36 H ASP 36 2.192 -1.149 5.108
232 HA ASP 36 HA ASP 36 2.114 1.285 6.619
233 HB2 ASP 36 1HB ASP 36 2.214 -1.242 7.260
234 HB3 ASP 36 2HB ASP 36 3.958 -1.032 7.177
235 H SER 37 H SER 37 3.779 0.988 3.965
236 HA SER 37 HA SER 37 5.941 2.830 4.928
237 HB2 SER 37 1HB SER 37 5.975 0.707 2.807
238 HB3 SER 37 2HB SER 37 6.819 2.222 2.456
239 HG SER 37 HG SER 37 7.619 0.238 3.973
240 H CYS 38 H CYS 38 2.917 2.787 3.334
241 HA CYS 38 HA CYS 38 3.547 5.359 1.987
242 HB2 CYS 38 1HB CYS 38 2.258 2.829 0.910
243 HB3 CYS 38 2HB CYS 38 2.072 4.381 0.147
244 H PHE 39 H PHE 39 1.408 3.584 4.014
245 HA PHE 39 HA PHE 39 -0.639 5.671 3.853
246 HB2 PHE 39 1HB PHE 39 -1.071 2.663 3.646
247 HB3 PHE 39 2HB PHE 39 -2.321 3.827 3.966
248 HD1 PHE 39 2HD PHE 39 -2.387 5.890 2.185
249 HD2 PHE 39 1HD PHE 39 -0.935 1.900 1.403
250 HE1 PHE 39 2HE PHE 39 -2.910 6.147 -0.210
251 HE2 PHE 39 1HE PHE 39 -1.526 2.144 -0.982
252 HZ PHE 39 HZ PHE 39 -2.539 4.283 -1.774
253 H GLU 40 H GLU 40 -1.406 6.068 5.832
254 HA GLU 40 HA GLU 40 -0.574 4.264 8.074
255 HB2 GLU 40 1HB GLU 40 -0.885 7.257 8.266
256 HB3 GLU 40 2HB GLU 40 -0.137 6.166 9.437
257 HG2 GLU 40 1HG GLU 40 1.510 5.608 7.432
258 HG3 GLU 40 2HG GLU 40 0.897 7.175 6.841
259 H LEU 41 H LEU 41 -1.948 4.516 10.021
260 HA LEU 41 HA LEU 41 -3.957 4.434 11.095
261 HB2 LEU 41 1HB LEU 41 -4.392 7.005 9.557
262 HB3 LEU 41 2HB LEU 41 -5.136 6.565 11.102
263 HG LEU 41 HG LEU 41 -2.175 7.119 10.610
264 HD11 LEU 41 1HD1 LEU 41 -2.566 9.171 11.882
265 HD12 LEU 41 2HD1 LEU 41 -3.589 9.118 10.440
266 HD13 LEU 41 3HD1 LEU 41 -4.291 8.777 12.034
267 HD21 LEU 41 3HD2 LEU 41 -2.431 5.514 12.449
268 HD22 LEU 41 1HD2 LEU 41 -1.966 7.093 13.074
269 HD23 LEU 41 2HD2 LEU 41 -3.660 6.565 13.214
270 H THR 42 H THR 42 -6.202 6.091 9.230
271 HA THR 42 HA THR 42 -7.819 3.799 8.696
272 HB THR 42 HB THR 42 -7.995 6.561 7.433
273 HG1 THR 42 1HG THR 42 -8.036 6.965 9.516
274 HG21 THR 42 3HG2 THR 42 -9.524 4.833 6.443
275 HG22 THR 42 1HG2 THR 42 -10.171 4.529 8.061
276 HG23 THR 42 2HG2 THR 42 -10.389 6.119 7.296
277 H GLY 43 H GLY 43 -5.467 5.648 6.702
278 HA2 GLY 43 1HA GLY 43 -6.224 4.588 4.173
279 HA3 GLY 43 2HA GLY 43 -4.687 5.365 4.581
280 H ASN 44 H ASN 44 -3.815 3.713 6.590
281 HA ASN 44 HA ASN 44 -2.566 1.549 5.285
282 HB2 ASN 44 1HB ASN 44 -1.834 2.563 7.459
283 HB3 ASN 44 2HB ASN 44 -3.147 1.704 8.268
284 HD21 ASN 44 1HD2 ASN 44 -0.124 1.413 6.527
285 HD22 ASN 44 2HD2 ASN 44 0.190 -0.244 7.034
286 H THR 45 H THR 45 -5.338 1.661 7.490
287 HA THR 45 HA THR 45 -6.076 -1.029 7.453
288 HB THR 45 HB THR 45 -8.091 1.217 7.566
289 HG1 THR 45 1HG THR 45 -6.328 1.685 9.003
290 HG21 THR 45 3HG2 THR 45 -9.113 -0.963 7.627
291 HG22 THR 45 1HG2 THR 45 -7.974 -1.516 8.867
292 HG23 THR 45 2HG2 THR 45 -9.186 -0.268 9.250
293 H MET 46 H MET 46 -7.169 1.548 5.164
294 HA MET 46 HA MET 46 -8.898 -0.255 3.719
295 HB2 MET 46 1HB MET 46 -7.750 2.448 2.900
296 HB3 MET 46 2HB MET 46 -8.840 1.482 1.927
297 HG2 MET 46 1HG MET 46 -10.007 1.608 4.511
298 HG3 MET 46 2HG MET 46 -9.434 3.231 4.145
299 HE1 MET 46 3HE MET 46 -12.094 0.502 3.552
300 HE2 MET 46 1HE MET 46 -12.714 0.824 1.922
301 HE3 MET 46 2HE MET 46 -11.061 0.204 2.138
302 H CYS 47 H CYS 47 -5.462 0.722 3.283
303 HA CYS 47 HA CYS 47 -5.026 -0.589 0.788
304 HB2 CYS 47 1HB CYS 47 -3.507 1.040 1.765
305 HB3 CYS 47 2HB CYS 47 -3.154 -0.025 3.115
306 H LEU 48 H LEU 48 -4.540 -1.795 4.147
307 HA LEU 48 HA LEU 48 -3.943 -4.460 3.553
308 HB2 LEU 48 1HB LEU 48 -5.567 -3.278 5.843
309 HB3 LEU 48 2HB LEU 48 -4.980 -4.918 5.780
310 HG LEU 48 HG LEU 48 -3.233 -2.419 5.805
311 HD11 LEU 48 1HD1 LEU 48 -3.809 -4.456 7.983
312 HD12 LEU 48 2HD1 LEU 48 -2.656 -3.112 8.092
313 HD13 LEU 48 3HD1 LEU 48 -4.381 -2.771 7.941
314 HD21 LEU 48 3HD2 LEU 48 -2.343 -5.310 6.034
315 HD22 LEU 48 1HD2 LEU 48 -2.084 -4.251 4.632
316 HD23 LEU 48 2HD2 LEU 48 -1.350 -3.829 6.176
317 H LEU 49 H LEU 49 -7.124 -2.922 4.011
318 HA LEU 49 HA LEU 49 -8.780 -5.130 3.656
319 HB2 LEU 49 1HB LEU 49 -9.106 -2.392 3.965
320 HB3 LEU 49 2HB LEU 49 -9.848 -2.647 2.410
321 HG LEU 49 HG LEU 49 -10.527 -4.384 4.807
322 HD11 LEU 49 1HD1 LEU 49 -10.733 -2.072 5.560
323 HD12 LEU 49 2HD1 LEU 49 -11.738 -1.676 4.150
324 HD13 LEU 49 3HD1 LEU 49 -12.336 -2.807 5.379
325 HD21 LEU 49 3HD2 LEU 49 -12.761 -4.503 3.662
326 HD22 LEU 49 1HD2 LEU 49 -12.090 -3.571 2.313
327 HD23 LEU 49 2HD2 LEU 49 -11.441 -5.179 2.704
328 H GLN 50 H GLN 50 -7.359 -3.132 0.972
329 HA GLN 50 HA GLN 50 -8.742 -4.788 -1.001
330 HB2 GLN 50 1HB GLN 50 -8.276 -2.368 -1.331
331 HB3 GLN 50 2HB GLN 50 -6.551 -2.724 -1.347
332 HG2 GLN 50 1HG GLN 50 -7.253 -2.497 -3.623
333 HG3 GLN 50 2HG GLN 50 -6.957 -4.210 -3.373
334 HE21 GLN 50 1HE2 GLN 50 -8.757 -5.692 -3.588
335 HE22 GLN 50 2HE2 GLN 50 -10.366 -5.193 -3.964
336 H ALA 51 H ALA 51 -5.310 -4.416 0.149
337 HA ALA 51 HA ALA 51 -4.149 -6.197 -1.704
338 HB1 ALA 51 1HB ALA 51 -3.289 -5.614 1.175
339 HB2 ALA 51 2HB ALA 51 -2.263 -6.258 -0.121
340 HB3 ALA 51 3HB ALA 51 -2.894 -4.606 -0.236
341 H GLY 52 H GLY 52 -5.722 -6.846 1.407
342 HA2 GLY 52 1HA GLY 52 -5.309 -9.776 1.050
343 HA3 GLY 52 2HA GLY 52 -5.583 -8.936 2.582
344 H ALA 53 H ALA 53 -7.375 -8.342 -0.480
345 HA ALA 53 HA ALA 53 -9.800 -8.003 0.727
346 HB1 ALA 53 1HB ALA 53 -9.207 -8.892 -2.126
347 HB2 ALA 53 2HB ALA 53 -10.799 -8.365 -1.557
348 HB3 ALA 53 3HB ALA 53 -9.437 -7.239 -1.526
349 H ALA 54 H ALA 54 -9.101 -10.995 -1.156
350 HA ALA 54 HA ALA 54 -9.800 -12.689 1.018
351 HB1 ALA 54 1HB ALA 54 -12.121 -12.167 0.539
352 HB2 ALA 54 2HB ALA 54 -11.889 -12.517 -1.179
353 HB3 ALA 54 3HB ALA 54 -11.772 -13.819 0.012
354 H GLY 55 H GLY 55 -7.576 -13.134 0.180
355 HA2 GLY 55 1HA GLY 55 -6.582 -15.250 -0.458
356 HA3 GLY 55 2HA GLY 55 -7.682 -15.357 -1.822
357 H SER 56 H SER 56 -6.993 -12.316 -2.146
358 HA SER 56 HA SER 56 -6.247 -12.238 -4.508
359 HB2 SER 56 1HB SER 56 -4.938 -10.254 -2.642
360 HB3 SER 56 2HB SER 56 -5.692 -9.969 -4.214
361 HG SER 56 HG SER 56 -7.727 -10.499 -3.244
362 H GLY 57 H GLY 57 -3.235 -11.236 -2.813
363 HA2 GLY 57 1HA GLY 57 -1.566 -13.375 -3.547
364 HA3 GLY 57 2HA GLY 57 -1.710 -12.322 -4.961
365 H CYS 58 H CYS 58 -1.499 -11.617 -1.420
366 HA CYS 58 HA CYS 58 0.814 -9.823 -1.997
367 HB2 CYS 58 1HB CYS 58 -1.710 -9.213 -0.407
368 HB3 CYS 58 2HB CYS 58 -0.311 -8.178 -0.502
369 H ASP 59 H ASP 59 2.076 -9.329 -0.159
370 HA ASP 59 HA ASP 59 2.471 -11.676 1.564
371 HB2 ASP 59 1HB ASP 59 4.384 -10.712 0.395
372 HB3 ASP 59 2HB ASP 59 4.111 -9.161 1.196
373 H MET 60 H MET 60 0.632 -11.472 2.843
374 HA MET 60 HA MET 60 0.206 -9.041 4.441
375 HB2 MET 60 1HB MET 60 -1.357 -11.610 4.109
376 HB3 MET 60 2HB MET 60 -1.884 -10.226 5.085
377 HG2 MET 60 1HG MET 60 -2.495 -9.010 3.264
378 HG3 MET 60 2HG MET 60 -1.141 -9.540 2.292
379 HE1 MET 60 3HE MET 60 -4.969 -12.100 2.843
380 HE2 MET 60 1HE MET 60 -3.631 -12.156 3.999
381 HE3 MET 60 2HE MET 60 -4.567 -10.661 3.814
382 H GLU 61 H GLU 61 1.582 -8.945 6.140
383 HA GLU 61 HA GLU 61 2.195 -11.171 7.970
384 HB2 GLU 61 1HB GLU 61 2.465 -8.148 8.381
385 HB3 GLU 61 2HB GLU 61 3.019 -9.443 9.458
386 HG2 GLU 61 1HG GLU 61 4.378 -10.281 7.423
387 HG3 GLU 61 2HG GLU 61 4.091 -8.687 6.727
Start of MODEL 7
1 H1 TYR 1 H TYR 1 -14.400 8.330 0.631
2 HA TYR 1 HA TYR 1 -13.318 8.960 2.635
3 HB2 TYR 1 1HB TYR 1 -13.481 6.868 3.791
4 HB3 TYR 1 2HB TYR 1 -12.376 6.082 2.661
5 HD1 TYR 1 1HD TYR 1 -12.431 9.247 4.768
6 HD2 TYR 1 2HD TYR 1 -10.166 5.818 3.389
7 HE1 TYR 1 1HE TYR 1 -10.440 10.049 5.991
8 HE2 TYR 1 2HE TYR 1 -8.229 6.561 4.611
9 HH TYR 1 HH TYR 1 -7.342 8.379 6.203
10 H ASN 2 H ASN 2 -11.229 6.648 0.995
11 HA ASN 2 HA ASN 2 -9.886 6.746 -0.706
12 HB2 ASN 2 1HB ASN 2 -10.417 9.473 -1.026
13 HB3 ASN 2 2HB ASN 2 -8.738 9.441 -0.652
14 HD21 ASN 2 1HD2 ASN 2 -7.849 9.786 -2.788
15 HD22 ASN 2 2HD2 ASN 2 -7.983 8.495 -3.985
16 HA PRO 3 HA PRO 3 -6.743 6.076 2.450
17 HB2 PRO 3 1HB PRO 3 -5.224 4.920 0.146
18 HB3 PRO 3 2HB PRO 3 -5.613 4.154 1.709
19 HG2 PRO 3 1HG PRO 3 -6.881 3.666 -0.752
20 HG3 PRO 3 2HG PRO 3 -7.602 3.311 0.856
21 HD2 PRO 3 1HD PRO 3 -8.218 5.388 -1.111
22 HD3 PRO 3 2HD PRO 3 -9.187 4.776 0.275
23 H GLU 4 H GLU 4 -6.260 7.552 -0.746
24 HA GLU 4 HA GLU 4 -3.700 8.559 -0.272
25 HB2 GLU 4 1HB GLU 4 -5.903 9.872 -1.894
26 HB3 GLU 4 2HB GLU 4 -4.183 10.179 -2.019
27 HG2 GLU 4 1HG GLU 4 -5.650 7.687 -2.894
28 HG3 GLU 4 2HG GLU 4 -4.779 8.834 -3.896
29 H ASP 5 H ASP 5 -6.704 9.536 1.315
30 HA ASP 5 HA ASP 5 -5.905 12.149 2.083
31 HB2 ASP 5 1HB ASP 5 -8.148 10.906 2.484
32 HB3 ASP 5 2HB ASP 5 -7.353 10.194 3.894
33 H ASP 6 H ASP 6 -4.683 9.051 3.148
34 HA ASP 6 HA ASP 6 -3.117 10.178 5.467
35 HB2 ASP 6 1HB ASP 6 -4.295 7.472 4.875
36 HB3 ASP 6 2HB ASP 6 -3.076 7.735 6.128
37 H TYR 7 H TYR 7 -2.548 10.075 2.435
38 HA TYR 7 HA TYR 7 -0.535 8.141 1.890
39 HB2 TYR 7 1HB TYR 7 -1.790 9.149 0.141
40 HB3 TYR 7 2HB TYR 7 -1.419 10.774 0.692
41 HD1 TYR 7 2HD TYR 7 0.152 7.702 -0.825
42 HD2 TYR 7 1HD TYR 7 0.318 11.977 -0.243
43 HE1 TYR 7 2HE TYR 7 1.975 7.867 -2.518
44 HE2 TYR 7 1HE TYR 7 2.094 12.143 -1.991
45 HH TYR 7 HH TYR 7 3.974 9.860 -2.972
46 H THR 8 H THR 8 1.498 8.100 2.801
47 HA THR 8 HA THR 8 2.657 10.579 3.854
48 HB THR 8 HB THR 8 4.131 8.867 5.053
49 HG1 THR 8 1HG THR 8 3.178 6.808 5.241
50 HG21 THR 8 3HG2 THR 8 1.179 8.622 5.683
51 HG22 THR 8 1HG2 THR 8 2.548 8.512 6.801
52 HG23 THR 8 2HG2 THR 8 2.138 10.067 6.067
53 HA PRO 9 HA PRO 9 4.740 9.696 -0.145
54 HB2 PRO 9 1HB PRO 9 5.748 12.273 -0.677
55 HB3 PRO 9 2HB PRO 9 4.189 11.620 -1.211
56 HG2 PRO 9 1HG PRO 9 4.785 13.374 1.158
57 HG3 PRO 9 2HG PRO 9 3.374 13.417 0.067
58 HD2 PRO 9 1HD PRO 9 3.266 12.300 2.560
59 HD3 PRO 9 2HD PRO 9 2.349 11.620 1.183
60 H LEU 10 H LEU 10 6.258 11.436 2.605
61 HA LEU 10 HA LEU 10 8.905 11.506 1.788
62 HB2 LEU 10 1HB LEU 10 7.562 11.098 4.495
63 HB3 LEU 10 2HB LEU 10 9.263 11.440 4.301
64 HG LEU 10 HG LEU 10 7.718 13.299 4.986
65 HD11 LEU 10 1HD1 LEU 10 10.034 13.685 4.232
66 HD12 LEU 10 2HD1 LEU 10 9.465 13.837 2.554
67 HD13 LEU 10 3HD1 LEU 10 8.980 15.029 3.779
68 HD21 LEU 10 3HD2 LEU 10 6.589 14.693 3.424
69 HD22 LEU 10 1HD2 LEU 10 6.968 13.605 2.082
70 HD23 LEU 10 2HD2 LEU 10 5.880 13.085 3.413
71 H THR 11 H THR 11 7.061 8.931 3.547
72 HA THR 11 HA THR 11 9.339 7.135 3.604
73 HB THR 11 HB THR 11 7.409 5.703 4.706
74 HG1 THR 11 1HG THR 11 5.641 6.877 4.262
75 HG21 THR 11 3HG2 THR 11 7.804 6.933 6.815
76 HG22 THR 11 1HG2 THR 11 9.297 6.660 5.914
77 HG23 THR 11 2HG2 THR 11 8.546 8.268 5.893
78 H CYS 12 H CYS 12 6.762 7.800 1.387
79 HA CYS 12 HA CYS 12 6.602 5.034 0.510
80 HB2 CYS 12 1HB CYS 12 4.653 6.515 0.781
81 HB3 CYS 12 2HB CYS 12 5.191 7.455 -0.588
82 HA PRO 13 HA PRO 13 9.548 6.033 -2.820
83 HB2 PRO 13 1HB PRO 13 9.804 3.498 -3.861
84 HB3 PRO 13 2HB PRO 13 10.637 4.054 -2.367
85 HG2 PRO 13 1HG PRO 13 8.067 2.504 -2.635
86 HG3 PRO 13 2HG PRO 13 9.449 2.149 -1.571
87 HD2 PRO 13 1HD PRO 13 7.239 3.443 -0.686
88 HD3 PRO 13 2HD PRO 13 8.872 3.895 -0.098
89 H HIS 14 H HIS 14 6.266 5.466 -3.031
90 HA HIS 14 HA HIS 14 6.221 5.285 -6.007
91 HB2 HIS 14 1HB HIS 14 3.983 4.383 -4.162
92 HB3 HIS 14 2HB HIS 14 4.272 3.913 -5.835
93 HD1 HIS 14 1HD HIS 14 6.781 2.504 -6.160
94 HD2 HIS 14 2HD HIS 14 4.514 2.351 -2.575
95 HE1 HIS 14 1HE HIS 14 7.075 0.260 -5.157
96 HE2 HIS 14 2HE HIS 14 5.964 0.172 -2.909
97 H THR 15 H THR 15 4.568 6.689 -7.037
98 HA THR 15 HA THR 15 4.187 9.107 -5.412
99 HB THR 15 HB THR 15 3.693 10.145 -7.553
100 HG1 THR 15 1HG THR 15 3.801 8.987 -9.432
101 HG21 THR 15 3HG2 THR 15 6.108 9.624 -6.756
102 HG22 THR 15 1HG2 THR 15 6.116 8.359 -7.998
103 HG23 THR 15 2HG2 THR 15 5.875 10.071 -8.447
104 H ILE 16 H ILE 16 2.056 10.245 -5.550
105 HA ILE 16 HA ILE 16 -0.060 8.626 -4.803
106 HB ILE 16 HB ILE 16 0.390 11.024 -4.286
107 HG12 ILE 16 1HG1 ILE 16 -2.469 10.431 -5.124
108 HG13 ILE 16 2HG1 ILE 16 -1.684 9.804 -3.675
109 HG21 ILE 16 1HG2 ILE 16 -1.060 11.645 -6.882
110 HG22 ILE 16 2HG2 ILE 16 -0.430 12.799 -5.695
111 HG23 ILE 16 3HG2 ILE 16 0.697 11.823 -6.628
112 HD11 ILE 16 3HD1 ILE 16 -1.298 12.107 -2.845
113 HD12 ILE 16 1HD1 ILE 16 -2.186 12.748 -4.254
114 HD13 ILE 16 2HD1 ILE 16 -3.009 11.736 -3.062
115 H SER 17 H SER 17 1.060 9.105 -7.950
116 HA SER 17 HA SER 17 -1.313 8.697 -9.544
117 HB2 SER 17 1HB SER 17 0.744 9.646 -10.434
118 HB3 SER 17 2HB SER 17 1.649 8.209 -9.971
119 HG SER 17 HG SER 17 -0.484 8.046 -11.833
120 H VAL 18 H VAL 18 1.080 6.546 -7.920
121 HA VAL 18 HA VAL 18 -0.548 4.130 -8.472
122 HB VAL 18 HB VAL 18 1.497 3.008 -9.306
123 HG11 VAL 18 1HG1 VAL 18 0.864 5.421 -11.028
124 HG12 VAL 18 2HG1 VAL 18 1.610 3.887 -11.536
125 HG13 VAL 18 3HG1 VAL 18 -0.070 3.911 -10.970
126 HG21 VAL 18 3HG2 VAL 18 3.467 3.912 -8.863
127 HG22 VAL 18 1HG2 VAL 18 3.178 5.224 -10.054
128 HG23 VAL 18 2HG2 VAL 18 2.748 5.408 -8.324
129 H VAL 19 H VAL 19 -0.642 4.980 -6.143
130 HA VAL 19 HA VAL 19 1.483 3.531 -4.627
131 HB VAL 19 HB VAL 19 1.517 5.744 -4.109
132 HG11 VAL 19 1HG1 VAL 19 -0.826 6.489 -4.743
133 HG12 VAL 19 2HG1 VAL 19 -1.470 5.701 -3.304
134 HG13 VAL 19 3HG1 VAL 19 -0.391 7.060 -3.145
135 HG21 VAL 19 3HG2 VAL 19 1.296 5.768 -1.723
136 HG22 VAL 19 1HG2 VAL 19 0.169 4.407 -1.764
137 HG23 VAL 19 2HG2 VAL 19 1.846 4.170 -2.267
138 H TRP 20 H TRP 20 -2.050 4.049 -4.633
139 HA TRP 20 HA TRP 20 -2.796 2.035 -2.802
140 HB2 TRP 20 1HB TRP 20 -4.276 3.745 -3.669
141 HB3 TRP 20 2HB TRP 20 -4.134 3.154 -5.316
142 HD1 TRP 20 HD TRP 20 -6.030 1.618 -6.081
143 HE1 TRP 20 1HE TRP 20 -7.848 0.233 -4.983
144 HE3 TRP 20 3HE TRP 20 -4.584 2.256 -1.240
145 HZ2 TRP 20 2HZ TRP 20 -8.730 -0.347 -2.195
146 HZ3 TRP 20 3HZ TRP 20 -5.973 1.399 0.601
147 HH2 TRP 20 HH TRP 20 -8.074 0.113 0.118
148 H TYR 21 H TYR 21 -3.226 1.762 -6.284
149 HA TYR 21 HA TYR 21 -3.415 -0.911 -6.635
150 HB2 TYR 21 1HB TYR 21 -3.766 0.642 -8.435
151 HB3 TYR 21 2HB TYR 21 -2.114 1.250 -8.336
152 HD1 TYR 21 1HD TYR 21 -0.181 -0.091 -9.118
153 HD2 TYR 21 2HD TYR 21 -4.260 -1.413 -9.696
154 HE1 TYR 21 1HE TYR 21 0.629 -1.922 -10.494
155 HE2 TYR 21 2HE TYR 21 -3.459 -3.162 -11.235
156 HH TYR 21 HH TYR 21 -1.205 -4.597 -11.205
157 H GLU 22 H GLU 22 -0.266 0.871 -6.247
158 HA GLU 22 HA GLU 22 1.290 -1.284 -7.287
159 HB2 GLU 22 1HB GLU 22 2.721 0.617 -7.411
160 HB3 GLU 22 2HB GLU 22 1.478 1.455 -6.564
161 HG2 GLU 22 1HG GLU 22 3.425 1.807 -5.514
162 HG3 GLU 22 2HG GLU 22 2.597 0.781 -4.394
163 H CYS 23 H CYS 23 -0.021 -0.406 -4.079
164 HA CYS 23 HA CYS 23 1.590 -2.493 -2.766
165 HB2 CYS 23 1HB CYS 23 0.264 0.023 -1.722
166 HB3 CYS 23 2HB CYS 23 0.728 -1.297 -0.670
167 H THR 24 H THR 24 -1.427 -2.177 -4.215
168 HA THR 24 HA THR 24 -2.563 -4.102 -2.291
169 HB THR 24 HB THR 24 -4.777 -3.243 -2.778
170 HG1 THR 24 1HG THR 24 -4.470 -2.386 -4.828
171 HG21 THR 24 3HG2 THR 24 -2.938 -0.997 -1.898
172 HG22 THR 24 1HG2 THR 24 -4.680 -1.125 -1.613
173 HG23 THR 24 2HG2 THR 24 -3.572 -2.294 -0.873
174 H GLU 25 H GLU 25 -1.460 -3.807 -5.512
175 HA GLU 25 HA GLU 25 -3.133 -6.146 -6.281
176 HB2 GLU 25 1HB GLU 25 -3.766 -3.890 -7.306
177 HB3 GLU 25 2HB GLU 25 -2.263 -3.923 -8.192
178 HG2 GLU 25 1HG GLU 25 -3.890 -6.425 -8.332
179 HG3 GLU 25 2HG GLU 25 -4.659 -5.002 -8.999
180 H ASN 26 H ASN 26 -0.225 -4.296 -7.211
181 HA ASN 26 HA ASN 26 0.845 -6.284 -8.874
182 HB2 ASN 26 1HB ASN 26 1.520 -3.976 -9.057
183 HB3 ASN 26 2HB ASN 26 2.183 -3.993 -7.409
184 HD21 ASN 26 1HD2 ASN 26 4.067 -3.147 -8.718
185 HD22 ASN 26 2HD2 ASN 26 5.249 -4.384 -9.142
186 H THR 27 H THR 27 0.919 -8.284 -7.985
187 HA THR 27 HA THR 27 1.426 -8.994 -5.450
188 HB THR 27 HB THR 27 1.995 -11.281 -6.341
189 HG1 THR 27 1HG THR 27 2.379 -9.900 -8.617
190 HG21 THR 27 3HG2 THR 27 -0.307 -10.580 -5.738
191 HG22 THR 27 1HG2 THR 27 -0.528 -9.920 -7.367
192 HG23 THR 27 2HG2 THR 27 -0.289 -11.664 -7.136
193 H ALA 28 H ALA 28 3.991 -8.254 -7.705
194 HA ALA 28 HA ALA 28 6.172 -9.436 -6.326
195 HB1 ALA 28 1HB ALA 28 6.048 -6.945 -8.096
196 HB2 ALA 28 2HB ALA 28 7.520 -7.839 -7.671
197 HB3 ALA 28 3HB ALA 28 6.266 -8.617 -8.660
198 H ASN 29 H ASN 29 4.274 -6.578 -5.581
199 HA ASN 29 HA ASN 29 6.422 -5.422 -3.876
200 HB2 ASN 29 1HB ASN 29 4.046 -4.196 -5.343
201 HB3 ASN 29 2HB ASN 29 5.157 -3.345 -4.281
202 HD21 ASN 29 1HD2 ASN 29 5.263 -2.028 -6.080
203 HD22 ASN 29 2HD2 ASN 29 6.443 -2.319 -7.384
204 H CYS 30 H CYS 30 2.911 -5.737 -4.200
205 HA CYS 30 HA CYS 30 2.177 -4.327 -1.982
206 HB2 CYS 30 1HB CYS 30 -0.048 -5.426 -2.232
207 HB3 CYS 30 2HB CYS 30 0.640 -4.776 -3.704
208 H GLY 31 H GLY 31 0.655 -5.177 -0.169
209 HA2 GLY 31 1HA GLY 31 0.291 -7.003 1.386
210 HA3 GLY 31 2HA GLY 31 2.044 -7.278 1.422
211 H THR 32 H THR 32 1.053 -6.902 3.826
212 HA THR 32 HA THR 32 0.311 -4.428 4.718
213 HB THR 32 HB THR 32 1.903 -6.555 6.201
214 HG1 THR 32 1HG THR 32 -0.644 -6.455 5.206
215 HG21 THR 32 3HG2 THR 32 0.812 -5.851 8.220
216 HG22 THR 32 1HG2 THR 32 1.747 -4.498 7.557
217 HG23 THR 32 2HG2 THR 32 -0.022 -4.535 7.395
218 H ALA 33 H ALA 33 3.666 -5.644 4.639
219 HA ALA 33 HA ALA 33 4.941 -3.357 5.655
220 HB1 ALA 33 1HB ALA 33 5.909 -5.408 3.595
221 HB2 ALA 33 2HB ALA 33 6.951 -4.288 4.485
222 HB3 ALA 33 3HB ALA 33 6.047 -5.540 5.366
223 H CYS 34 H CYS 34 3.654 -3.830 2.386
224 HA CYS 34 HA CYS 34 5.163 -1.623 1.190
225 HB2 CYS 34 1HB CYS 34 4.198 -3.632 -0.031
226 HB3 CYS 34 2HB CYS 34 2.600 -2.926 0.192
227 H CYS 35 H CYS 35 1.824 -2.248 2.331
228 HA CYS 35 HA CYS 35 0.695 0.267 1.864
229 HB2 CYS 35 1HB CYS 35 0.149 -1.817 4.015
230 HB3 CYS 35 2HB CYS 35 -0.856 -0.402 3.771
231 H ASP 36 H ASP 36 2.316 -0.911 4.861
232 HA ASP 36 HA ASP 36 1.761 1.418 6.340
233 HB2 ASP 36 1HB ASP 36 2.338 -0.945 7.102
234 HB3 ASP 36 2HB ASP 36 4.032 -0.524 6.846
235 H SER 37 H SER 37 4.300 0.990 4.008
236 HA SER 37 HA SER 37 5.921 3.233 4.983
237 HB2 SER 37 1HB SER 37 5.749 1.683 2.363
238 HB3 SER 37 2HB SER 37 6.820 3.078 2.583
239 HG SER 37 HG SER 37 7.771 2.060 4.317
240 H CYS 38 H CYS 38 2.915 2.985 3.219
241 HA CYS 38 HA CYS 38 3.305 5.682 1.990
242 HB2 CYS 38 1HB CYS 38 1.904 3.201 0.957
243 HB3 CYS 38 2HB CYS 38 1.914 4.764 0.185
244 H PHE 39 H PHE 39 1.289 3.818 4.100
245 HA PHE 39 HA PHE 39 -0.775 5.926 4.012
246 HB2 PHE 39 1HB PHE 39 -1.183 2.909 3.787
247 HB3 PHE 39 2HB PHE 39 -2.438 4.075 4.075
248 HD1 PHE 39 2HD PHE 39 -2.484 6.109 2.211
249 HD2 PHE 39 1HD PHE 39 -0.961 2.120 1.588
250 HE1 PHE 39 2HE PHE 39 -2.910 6.310 -0.206
251 HE2 PHE 39 1HE PHE 39 -1.451 2.307 -0.826
252 HZ PHE 39 HZ PHE 39 -2.460 4.409 -1.710
253 H GLU 40 H GLU 40 -1.581 6.306 5.970
254 HA GLU 40 HA GLU 40 -0.808 4.569 8.259
255 HB2 GLU 40 1HB GLU 40 -1.458 7.524 8.165
256 HB3 GLU 40 2HB GLU 40 -0.970 6.668 9.610
257 HG2 GLU 40 1HG GLU 40 0.878 6.855 7.237
258 HG3 GLU 40 2HG GLU 40 0.770 8.087 8.484
259 H LEU 41 H LEU 41 -2.280 4.759 10.061
260 HA LEU 41 HA LEU 41 -4.363 4.371 10.985
261 HB2 LEU 41 1HB LEU 41 -4.662 7.080 9.660
262 HB3 LEU 41 2HB LEU 41 -5.620 6.504 11.025
263 HG LEU 41 HG LEU 41 -2.601 6.966 11.049
264 HD11 LEU 41 1HD1 LEU 41 -3.838 9.019 10.812
265 HD12 LEU 41 2HD1 LEU 41 -4.853 8.623 12.219
266 HD13 LEU 41 3HD1 LEU 41 -3.109 8.916 12.423
267 HD21 LEU 41 3HD2 LEU 41 -4.480 6.173 13.304
268 HD22 LEU 41 1HD2 LEU 41 -3.123 5.234 12.644
269 HD23 LEU 41 2HD2 LEU 41 -2.805 6.734 13.512
270 H THR 42 H THR 42 -6.492 6.142 9.019
271 HA THR 42 HA THR 42 -7.959 3.749 8.365
272 HB THR 42 HB THR 42 -8.293 6.537 7.189
273 HG1 THR 42 1HG THR 42 -8.416 6.850 9.252
274 HG21 THR 42 3HG2 THR 42 -9.610 4.876 5.994
275 HG22 THR 42 1HG2 THR 42 -10.179 4.161 7.483
276 HG23 THR 42 2HG2 THR 42 -10.699 5.812 7.019
277 H GLY 43 H GLY 43 -5.821 5.932 6.493
278 HA2 GLY 43 1HA GLY 43 -5.822 4.990 3.890
279 HA3 GLY 43 2HA GLY 43 -4.408 5.456 4.812
280 H ASN 44 H ASN 44 -4.003 3.816 6.654
281 HA ASN 44 HA ASN 44 -2.581 1.762 5.405
282 HB2 ASN 44 1HB ASN 44 -2.037 2.787 7.605
283 HB3 ASN 44 2HB ASN 44 -3.354 1.882 8.337
284 HD21 ASN 44 1HD2 ASN 44 -0.267 1.748 6.747
285 HD22 ASN 44 2HD2 ASN 44 0.180 0.174 7.377
286 H THR 45 H THR 45 -5.457 1.562 7.587
287 HA THR 45 HA THR 45 -5.838 -1.144 7.278
288 HB THR 45 HB THR 45 -8.045 0.883 7.782
289 HG1 THR 45 1HG THR 45 -5.893 -0.046 9.355
290 HG21 THR 45 3HG2 THR 45 -8.856 -1.438 7.636
291 HG22 THR 45 1HG2 THR 45 -7.616 -1.957 8.793
292 HG23 THR 45 2HG2 THR 45 -8.924 -0.870 9.311
293 H MET 46 H MET 46 -7.245 1.469 5.196
294 HA MET 46 HA MET 46 -8.862 -0.389 3.686
295 HB2 MET 46 1HB MET 46 -7.853 2.413 2.973
296 HB3 MET 46 2HB MET 46 -8.712 1.364 1.842
297 HG2 MET 46 1HG MET 46 -10.488 1.113 3.666
298 HG3 MET 46 2HG MET 46 -9.744 2.535 4.413
299 HE1 MET 46 3HE MET 46 -13.218 2.708 1.935
300 HE2 MET 46 1HE MET 46 -12.284 1.193 1.862
301 HE3 MET 46 2HE MET 46 -12.675 1.907 3.430
302 H CYS 47 H CYS 47 -5.434 0.651 3.367
303 HA CYS 47 HA CYS 47 -4.977 -0.655 0.849
304 HB2 CYS 47 1HB CYS 47 -3.564 1.124 1.835
305 HB3 CYS 47 2HB CYS 47 -3.031 0.008 3.082
306 H LEU 48 H LEU 48 -4.475 -1.719 4.253
307 HA LEU 48 HA LEU 48 -3.583 -4.323 3.720
308 HB2 LEU 48 1HB LEU 48 -5.336 -3.314 6.013
309 HB3 LEU 48 2HB LEU 48 -4.501 -4.845 5.946
310 HG LEU 48 HG LEU 48 -3.298 -2.077 6.198
311 HD11 LEU 48 1HD1 LEU 48 -4.024 -3.189 8.270
312 HD12 LEU 48 2HD1 LEU 48 -2.955 -4.568 7.890
313 HD13 LEU 48 3HD1 LEU 48 -2.269 -2.964 8.211
314 HD21 LEU 48 3HD2 LEU 48 -1.888 -3.218 4.563
315 HD22 LEU 48 1HD2 LEU 48 -1.069 -3.037 6.106
316 HD23 LEU 48 2HD2 LEU 48 -1.774 -4.622 5.650
317 H LEU 49 H LEU 49 -6.935 -3.183 4.210
318 HA LEU 49 HA LEU 49 -8.175 -5.650 3.706
319 HB2 LEU 49 1HB LEU 49 -9.074 -2.848 3.857
320 HB3 LEU 49 2HB LEU 49 -9.937 -3.722 2.607
321 HG LEU 49 HG LEU 49 -10.380 -5.578 4.290
322 HD11 LEU 49 1HD1 LEU 49 -9.450 -3.447 6.274
323 HD12 LEU 49 2HD1 LEU 49 -10.223 -5.003 6.675
324 HD13 LEU 49 3HD1 LEU 49 -8.621 -4.975 5.939
325 HD21 LEU 49 3HD2 LEU 49 -12.236 -4.353 5.367
326 HD22 LEU 49 1HD2 LEU 49 -11.507 -2.809 4.853
327 HD23 LEU 49 2HD2 LEU 49 -12.102 -3.969 3.644
328 H GLN 50 H GLN 50 -7.374 -3.130 1.165
329 HA GLN 50 HA GLN 50 -8.597 -4.753 -0.861
330 HB2 GLN 50 1HB GLN 50 -8.276 -2.288 -0.966
331 HB3 GLN 50 2HB GLN 50 -6.536 -2.510 -1.064
332 HG2 GLN 50 1HG GLN 50 -7.390 -2.084 -3.290
333 HG3 GLN 50 2HG GLN 50 -6.832 -3.735 -3.239
334 HE21 GLN 50 1HE2 GLN 50 -8.384 -5.478 -3.237
335 HE22 GLN 50 2HE2 GLN 50 -9.979 -5.214 -3.891
336 H ALA 51 H ALA 51 -5.262 -4.441 0.293
337 HA ALA 51 HA ALA 51 -4.068 -6.118 -1.732
338 HB1 ALA 51 1HB ALA 51 -2.169 -6.231 -0.188
339 HB2 ALA 51 2HB ALA 51 -2.775 -4.567 -0.209
340 HB3 ALA 51 3HB ALA 51 -3.161 -5.613 1.148
341 H GLY 52 H GLY 52 -4.914 -6.766 1.672
342 HA2 GLY 52 1HA GLY 52 -4.369 -9.581 1.418
343 HA3 GLY 52 2HA GLY 52 -4.779 -8.650 2.874
344 H ALA 53 H ALA 53 -7.183 -7.860 0.894
345 HA ALA 53 HA ALA 53 -9.379 -8.746 0.569
346 HB1 ALA 53 1HB ALA 53 -7.977 -8.205 -1.334
347 HB2 ALA 53 2HB ALA 53 -7.221 -9.823 -1.302
348 HB3 ALA 53 3HB ALA 53 -8.948 -9.653 -1.700
349 H ALA 54 H ALA 54 -7.178 -11.438 -0.079
350 HA ALA 54 HA ALA 54 -8.337 -13.175 1.841
351 HB1 ALA 54 1HB ALA 54 -9.645 -13.860 -0.169
352 HB2 ALA 54 2HB ALA 54 -8.139 -13.933 -1.123
353 HB3 ALA 54 3HB ALA 54 -8.399 -15.090 0.205
354 H GLY 55 H GLY 55 -6.660 -14.966 2.063
355 HA2 GLY 55 1HA GLY 55 -3.939 -13.979 1.836
356 HA3 GLY 55 2HA GLY 55 -4.453 -15.544 2.444
357 H SER 56 H SER 56 -4.820 -13.897 -0.708
358 HA SER 56 HA SER 56 -2.814 -15.418 -2.039
359 HB2 SER 56 1HB SER 56 -5.735 -15.848 -2.794
360 HB3 SER 56 2HB SER 56 -4.406 -15.969 -3.966
361 HG SER 56 HG SER 56 -5.230 -17.830 -2.330
362 H GLY 57 H GLY 57 -1.888 -13.475 -2.355
363 HA2 GLY 57 1HA GLY 57 -1.855 -11.707 -4.203
364 HA3 GLY 57 2HA GLY 57 -3.397 -11.179 -3.531
365 H CYS 58 H CYS 58 0.045 -11.595 -2.896
366 HA CYS 58 HA CYS 58 1.519 -10.865 -1.426
367 HB2 CYS 58 1HB CYS 58 -0.474 -8.649 -1.589
368 HB3 CYS 58 2HB CYS 58 0.985 -8.477 -0.605
369 H ASP 59 H ASP 59 1.903 -9.806 0.872
370 HA ASP 59 HA ASP 59 0.659 -11.878 2.542
371 HB2 ASP 59 1HB ASP 59 3.103 -11.640 2.549
372 HB3 ASP 59 2HB ASP 59 2.939 -9.995 3.187
373 H MET 60 H MET 60 -0.432 -11.510 4.507
374 HA MET 60 HA MET 60 -1.060 -8.773 5.278
375 HB2 MET 60 1HB MET 60 -3.471 -9.124 5.302
376 HB3 MET 60 2HB MET 60 -2.773 -9.189 3.697
377 HG2 MET 60 1HG MET 60 -4.178 -10.911 3.474
378 HG3 MET 60 2HG MET 60 -2.806 -11.820 4.091
379 HE1 MET 60 3HE MET 60 -6.097 -12.464 3.960
380 HE2 MET 60 1HE MET 60 -4.783 -13.621 4.276
381 HE3 MET 60 2HE MET 60 -6.159 -13.497 5.404
382 H GLU 61 H GLU 61 -0.769 -8.620 7.381
383 HA GLU 61 HA GLU 61 -0.649 -11.047 9.068
384 HB2 GLU 61 1HB GLU 61 0.075 -8.129 9.476
385 HB3 GLU 61 2HB GLU 61 -0.251 -9.185 10.866
386 HG2 GLU 61 1HG GLU 61 1.458 -10.822 9.881
387 HG3 GLU 61 2HG GLU 61 1.936 -9.516 8.788
Start of MODEL 8
1 H1 TYR 1 H TYR 1 -14.228 6.180 1.773
2 HA TYR 1 HA TYR 1 -12.698 8.534 2.696
3 HB2 TYR 1 1HB TYR 1 -13.327 7.218 4.624
4 HB3 TYR 1 2HB TYR 1 -12.703 5.752 3.877
5 HD1 TYR 1 1HD TYR 1 -11.783 9.073 5.327
6 HD2 TYR 1 2HD TYR 1 -10.305 5.311 3.798
7 HE1 TYR 1 1HE TYR 1 -9.526 9.622 6.169
8 HE2 TYR 1 2HE TYR 1 -8.069 5.868 4.602
9 HH TYR 1 HH TYR 1 -7.204 9.058 5.830
10 H ASN 2 H ASN 2 -11.296 8.918 0.949
11 HA ASN 2 HA ASN 2 -10.151 6.543 -0.364
12 HB2 ASN 2 1HB ASN 2 -10.307 9.336 -1.169
13 HB3 ASN 2 2HB ASN 2 -8.657 8.770 -1.235
14 HD21 ASN 2 1HD2 ASN 2 -8.095 7.911 -3.346
15 HD22 ASN 2 2HD2 ASN 2 -9.168 6.797 -4.124
16 HA PRO 3 HA PRO 3 -6.964 6.487 2.715
17 HB2 PRO 3 1HB PRO 3 -5.154 4.770 1.480
18 HB3 PRO 3 2HB PRO 3 -6.654 4.251 2.285
19 HG2 PRO 3 1HG PRO 3 -6.176 4.561 -0.647
20 HG3 PRO 3 2HG PRO 3 -7.204 3.392 0.280
21 HD2 PRO 3 1HD PRO 3 -8.221 5.546 -1.035
22 HD3 PRO 3 2HD PRO 3 -8.967 4.722 0.377
23 H GLU 4 H GLU 4 -6.438 7.655 -0.515
24 HA GLU 4 HA GLU 4 -3.791 8.678 -0.280
25 HB2 GLU 4 1HB GLU 4 -6.243 9.468 -1.874
26 HB3 GLU 4 2HB GLU 4 -4.698 10.300 -2.063
27 HG2 GLU 4 1HG GLU 4 -3.578 8.317 -2.801
28 HG3 GLU 4 2HG GLU 4 -4.917 7.277 -2.325
29 H ASP 5 H ASP 5 -6.724 9.621 1.342
30 HA ASP 5 HA ASP 5 -6.142 12.182 2.328
31 HB2 ASP 5 1HB ASP 5 -8.163 10.957 2.781
32 HB3 ASP 5 2HB ASP 5 -7.255 9.641 3.536
33 H ASP 6 H ASP 6 -4.700 9.044 3.330
34 HA ASP 6 HA ASP 6 -2.617 10.441 4.974
35 HB2 ASP 6 1HB ASP 6 -4.393 8.126 5.650
36 HB3 ASP 6 2HB ASP 6 -2.750 8.107 6.238
37 H TYR 7 H TYR 7 -2.582 9.807 2.182
38 HA TYR 7 HA TYR 7 -0.506 7.769 1.826
39 HB2 TYR 7 1HB TYR 7 -1.630 8.411 -0.159
40 HB3 TYR 7 2HB TYR 7 -1.515 10.130 0.214
41 HD1 TYR 7 2HD TYR 7 0.651 7.156 -0.540
42 HD2 TYR 7 1HD TYR 7 0.190 11.427 -0.763
43 HE1 TYR 7 2HE TYR 7 2.635 7.302 -2.039
44 HE2 TYR 7 1HE TYR 7 2.233 11.594 -2.137
45 HH TYR 7 HH TYR 7 4.005 8.665 -3.271
46 H THR 8 H THR 8 1.633 8.004 2.474
47 HA THR 8 HA THR 8 2.542 10.751 3.158
48 HB THR 8 HB THR 8 3.789 9.870 4.997
49 HG1 THR 8 1HG THR 8 3.128 7.800 5.825
50 HG21 THR 8 3HG2 THR 8 1.895 9.697 6.468
51 HG22 THR 8 1HG2 THR 8 1.368 10.694 5.128
52 HG23 THR 8 2HG2 THR 8 0.881 8.995 5.199
53 HA PRO 9 HA PRO 9 5.072 9.500 -0.348
54 HB2 PRO 9 1HB PRO 9 6.208 11.924 -0.930
55 HB3 PRO 9 2HB PRO 9 4.536 11.491 -1.398
56 HG2 PRO 9 1HG PRO 9 5.471 13.091 0.995
57 HG3 PRO 9 2HG PRO 9 4.129 13.461 -0.126
58 HD2 PRO 9 1HD PRO 9 3.683 12.302 2.279
59 HD3 PRO 9 2HD PRO 9 2.738 11.799 0.846
60 H LEU 10 H LEU 10 6.219 10.795 2.662
61 HA LEU 10 HA LEU 10 8.899 11.290 2.341
62 HB2 LEU 10 1HB LEU 10 6.955 10.372 4.449
63 HB3 LEU 10 2HB LEU 10 8.623 10.265 4.875
64 HG LEU 10 HG LEU 10 7.234 12.353 5.456
65 HD11 LEU 10 1HD1 LEU 10 9.633 12.414 5.706
66 HD12 LEU 10 2HD1 LEU 10 9.863 12.791 3.984
67 HD13 LEU 10 3HD1 LEU 10 9.090 13.970 5.071
68 HD21 LEU 10 3HD2 LEU 10 7.069 14.172 3.854
69 HD22 LEU 10 1HD2 LEU 10 7.630 13.129 2.549
70 HD23 LEU 10 2HD2 LEU 10 6.090 12.782 3.375
71 H THR 11 H THR 11 7.448 8.236 3.548
72 HA THR 11 HA THR 11 9.862 6.778 2.653
73 HB THR 11 HB THR 11 8.954 7.135 5.113
74 HG1 THR 11 1HG THR 11 10.309 5.471 5.604
75 HG21 THR 11 3HG2 THR 11 8.037 4.443 4.224
76 HG22 THR 11 1HG2 THR 11 7.928 5.141 5.876
77 HG23 THR 11 2HG2 THR 11 6.970 5.832 4.538
78 H CYS 12 H CYS 12 6.933 7.463 1.320
79 HA CYS 12 HA CYS 12 6.501 4.728 0.328
80 HB2 CYS 12 1HB CYS 12 4.612 6.285 0.867
81 HB3 CYS 12 2HB CYS 12 5.100 7.279 -0.484
82 HA PRO 13 HA PRO 13 9.416 6.069 -2.929
83 HB2 PRO 13 1HB PRO 13 9.764 3.600 -4.153
84 HB3 PRO 13 2HB PRO 13 10.683 4.209 -2.759
85 HG2 PRO 13 1HG PRO 13 8.429 2.263 -2.832
86 HG3 PRO 13 2HG PRO 13 9.840 2.350 -1.728
87 HD2 PRO 13 1HD PRO 13 7.272 3.188 -1.055
88 HD3 PRO 13 2HD PRO 13 8.786 3.759 -0.310
89 H HIS 14 H HIS 14 6.199 5.599 -3.185
90 HA HIS 14 HA HIS 14 6.143 5.377 -6.156
91 HB2 HIS 14 1HB HIS 14 3.924 4.394 -4.358
92 HB3 HIS 14 2HB HIS 14 4.205 3.998 -6.056
93 HD1 HIS 14 1HD HIS 14 6.623 2.562 -6.467
94 HD2 HIS 14 2HD HIS 14 4.698 2.469 -2.708
95 HE1 HIS 14 1HE HIS 14 7.096 0.318 -5.406
96 HE2 HIS 14 2HE HIS 14 6.069 0.309 -3.117
97 H THR 15 H THR 15 4.727 6.763 -7.175
98 HA THR 15 HA THR 15 4.278 9.223 -5.704
99 HB THR 15 HB THR 15 3.643 9.990 -8.001
100 HG1 THR 15 1HG THR 15 4.188 8.430 -9.700
101 HG21 THR 15 3HG2 THR 15 6.034 9.792 -7.081
102 HG22 THR 15 1HG2 THR 15 6.216 8.335 -8.066
103 HG23 THR 15 2HG2 THR 15 5.897 9.909 -8.841
104 H ILE 16 H ILE 16 2.186 10.309 -5.547
105 HA ILE 16 HA ILE 16 0.062 8.628 -4.817
106 HB ILE 16 HB ILE 16 0.523 10.975 -4.116
107 HG12 ILE 16 1HG1 ILE 16 -2.354 10.351 -4.892
108 HG13 ILE 16 2HG1 ILE 16 -1.500 9.722 -3.481
109 HG21 ILE 16 1HG2 ILE 16 -0.249 12.867 -5.301
110 HG22 ILE 16 2HG2 ILE 16 0.688 11.936 -6.469
111 HG23 ILE 16 3HG2 ILE 16 -1.098 11.880 -6.498
112 HD11 ILE 16 3HD1 ILE 16 -2.215 12.636 -4.007
113 HD12 ILE 16 1HD1 ILE 16 -2.878 11.565 -2.767
114 HD13 ILE 16 2HD1 ILE 16 -1.190 12.082 -2.663
115 H SER 17 H SER 17 1.135 9.305 -7.917
116 HA SER 17 HA SER 17 -1.256 9.228 -9.518
117 HB2 SER 17 1HB SER 17 1.190 9.818 -10.184
118 HB3 SER 17 2HB SER 17 1.480 8.079 -10.213
119 HG SER 17 HG SER 17 0.838 8.294 -12.188
120 H VAL 18 H VAL 18 0.942 6.751 -8.157
121 HA VAL 18 HA VAL 18 -1.036 4.583 -8.558
122 HB VAL 18 HB VAL 18 0.596 3.238 -9.798
123 HG11 VAL 18 1HG1 VAL 18 0.483 4.227 -11.989
124 HG12 VAL 18 2HG1 VAL 18 -1.015 4.615 -11.136
125 HG13 VAL 18 3HG1 VAL 18 0.247 5.845 -11.327
126 HG21 VAL 18 3HG2 VAL 18 2.574 4.968 -10.772
127 HG22 VAL 18 1HG2 VAL 18 2.365 5.440 -9.031
128 HG23 VAL 18 2HG2 VAL 18 2.713 3.787 -9.423
129 H VAL 19 H VAL 19 -0.661 5.395 -6.292
130 HA VAL 19 HA VAL 19 1.385 3.628 -5.084
131 HB VAL 19 HB VAL 19 1.530 5.801 -4.234
132 HG11 VAL 19 1HG1 VAL 19 -0.217 7.031 -3.070
133 HG12 VAL 19 2HG1 VAL 19 -0.773 6.648 -4.697
134 HG13 VAL 19 3HG1 VAL 19 -1.369 5.723 -3.310
135 HG21 VAL 19 3HG2 VAL 19 0.191 4.058 -2.123
136 HG22 VAL 19 1HG2 VAL 19 1.878 3.932 -2.652
137 HG23 VAL 19 2HG2 VAL 19 1.304 5.393 -1.830
138 H TRP 20 H TRP 20 -2.184 4.221 -4.859
139 HA TRP 20 HA TRP 20 -2.762 2.067 -3.179
140 HB2 TRP 20 1HB TRP 20 -4.399 3.735 -3.779
141 HB3 TRP 20 2HB TRP 20 -4.403 3.219 -5.459
142 HD1 TRP 20 HD TRP 20 -5.955 1.171 -6.076
143 HE1 TRP 20 1HE TRP 20 -7.622 -0.255 -4.822
144 HE3 TRP 20 3HE TRP 20 -4.651 2.504 -1.300
145 HZ2 TRP 20 2HZ TRP 20 -8.499 -0.564 -2.008
146 HZ3 TRP 20 3HZ TRP 20 -5.863 1.584 0.607
147 HH2 TRP 20 HH TRP 20 -7.881 0.142 0.264
148 H TYR 21 H TYR 21 -3.129 1.867 -6.796
149 HA TYR 21 HA TYR 21 -3.418 -0.852 -7.072
150 HB2 TYR 21 1HB TYR 21 -3.521 0.631 -8.957
151 HB3 TYR 21 2HB TYR 21 -1.857 1.164 -8.737
152 HD1 TYR 21 1HD TYR 21 0.070 -0.320 -9.368
153 HD2 TYR 21 2HD TYR 21 -4.018 -1.542 -10.046
154 HE1 TYR 21 1HE TYR 21 0.849 -2.177 -10.814
155 HE2 TYR 21 2HE TYR 21 -3.265 -3.191 -11.649
156 HH TYR 21 HH TYR 21 -1.401 -4.575 -12.021
157 H GLU 22 H GLU 22 -0.292 0.885 -6.727
158 HA GLU 22 HA GLU 22 1.401 -1.272 -7.460
159 HB2 GLU 22 1HB GLU 22 2.693 0.655 -7.544
160 HB3 GLU 22 2HB GLU 22 1.398 1.496 -6.785
161 HG2 GLU 22 1HG GLU 22 3.239 1.918 -5.528
162 HG3 GLU 22 2HG GLU 22 2.323 0.812 -4.519
163 H CYS 23 H CYS 23 -0.205 -0.333 -4.417
164 HA CYS 23 HA CYS 23 1.477 -2.147 -2.829
165 HB2 CYS 23 1HB CYS 23 0.747 0.495 -2.535
166 HB3 CYS 23 2HB CYS 23 -0.533 -0.281 -1.648
167 H THR 24 H THR 24 -1.439 -2.258 -4.519
168 HA THR 24 HA THR 24 -2.594 -4.078 -2.507
169 HB THR 24 HB THR 24 -4.819 -3.257 -3.037
170 HG1 THR 24 1HG THR 24 -3.471 -1.210 -4.436
171 HG21 THR 24 3HG2 THR 24 -4.695 -1.102 -1.866
172 HG22 THR 24 1HG2 THR 24 -3.620 -2.290 -1.107
173 HG23 THR 24 2HG2 THR 24 -2.944 -1.015 -2.130
174 H GLU 25 H GLU 25 -1.538 -3.855 -5.723
175 HA GLU 25 HA GLU 25 -3.112 -6.251 -6.514
176 HB2 GLU 25 1HB GLU 25 -3.768 -4.043 -7.641
177 HB3 GLU 25 2HB GLU 25 -2.184 -3.972 -8.346
178 HG2 GLU 25 1HG GLU 25 -3.804 -6.507 -8.677
179 HG3 GLU 25 2HG GLU 25 -4.321 -5.059 -9.538
180 H ASN 26 H ASN 26 -0.235 -4.269 -7.148
181 HA ASN 26 HA ASN 26 1.146 -6.256 -8.646
182 HB2 ASN 26 1HB ASN 26 1.507 -3.877 -8.970
183 HB3 ASN 26 2HB ASN 26 2.123 -3.719 -7.313
184 HD21 ASN 26 1HD2 ASN 26 4.026 -2.771 -8.374
185 HD22 ASN 26 2HD2 ASN 26 5.196 -3.786 -9.185
186 H THR 27 H THR 27 1.252 -8.168 -7.378
187 HA THR 27 HA THR 27 1.822 -8.404 -4.717
188 HB THR 27 HB THR 27 2.448 -10.808 -5.353
189 HG1 THR 27 1HG THR 27 3.109 -10.881 -7.335
190 HG21 THR 27 3HG2 THR 27 -0.126 -9.716 -6.578
191 HG22 THR 27 1HG2 THR 27 0.204 -11.395 -6.105
192 HG23 THR 27 2HG2 THR 27 0.113 -10.140 -4.868
193 H ALA 28 H ALA 28 4.207 -7.711 -7.167
194 HA ALA 28 HA ALA 28 6.581 -8.636 -5.911
195 HB1 ALA 28 1HB ALA 28 7.680 -6.922 -7.257
196 HB2 ALA 28 2HB ALA 28 6.417 -7.713 -8.220
197 HB3 ALA 28 3HB ALA 28 6.137 -6.092 -7.540
198 H ASN 29 H ASN 29 4.411 -6.037 -5.028
199 HA ASN 29 HA ASN 29 6.325 -5.100 -2.929
200 HB2 ASN 29 1HB ASN 29 4.368 -3.335 -4.444
201 HB3 ASN 29 2HB ASN 29 5.529 -2.835 -3.218
202 HD21 ASN 29 1HD2 ASN 29 5.252 -1.834 -5.940
203 HD22 ASN 29 2HD2 ASN 29 6.646 -2.267 -6.900
204 H CYS 30 H CYS 30 2.922 -5.278 -4.045
205 HA CYS 30 HA CYS 30 1.598 -4.376 -1.831
206 HB2 CYS 30 1HB CYS 30 0.311 -4.690 -3.674
207 HB3 CYS 30 2HB CYS 30 0.899 -6.280 -4.056
208 H GLY 31 H GLY 31 1.036 -5.015 0.123
209 HA2 GLY 31 1HA GLY 31 0.863 -7.384 1.441
210 HA3 GLY 31 2HA GLY 31 2.614 -7.072 1.332
211 H THR 32 H THR 32 1.631 -7.069 3.797
212 HA THR 32 HA THR 32 0.286 -4.742 4.673
213 HB THR 32 HB THR 32 1.937 -6.839 6.078
214 HG1 THR 32 1HG THR 32 -0.154 -7.659 6.575
215 HG21 THR 32 3HG2 THR 32 0.733 -6.208 8.175
216 HG22 THR 32 1HG2 THR 32 1.840 -4.932 7.622
217 HG23 THR 32 2HG2 THR 32 0.094 -4.770 7.373
218 H ALA 33 H ALA 33 3.850 -5.515 4.842
219 HA ALA 33 HA ALA 33 4.607 -3.090 6.027
220 HB1 ALA 33 1HB ALA 33 6.838 -3.534 5.035
221 HB2 ALA 33 2HB ALA 33 6.146 -4.995 5.761
222 HB3 ALA 33 3HB ALA 33 6.108 -4.782 4.001
223 H CYS 34 H CYS 34 4.171 -3.812 2.520
224 HA CYS 34 HA CYS 34 5.091 -1.351 1.530
225 HB2 CYS 34 1HB CYS 34 4.533 -3.125 0.022
226 HB3 CYS 34 2HB CYS 34 2.834 -3.120 0.493
227 H CYS 35 H CYS 35 1.809 -2.300 2.575
228 HA CYS 35 HA CYS 35 0.544 0.194 2.122
229 HB2 CYS 35 1HB CYS 35 -0.034 -2.081 4.048
230 HB3 CYS 35 2HB CYS 35 -1.067 -0.667 3.914
231 H ASP 36 H ASP 36 2.120 -1.090 5.124
232 HA ASP 36 HA ASP 36 1.524 1.225 6.723
233 HB2 ASP 36 1HB ASP 36 2.216 -1.239 7.315
234 HB3 ASP 36 2HB ASP 36 3.848 -0.603 7.262
235 H SER 37 H SER 37 4.141 0.552 4.510
236 HA SER 37 HA SER 37 5.645 2.950 5.247
237 HB2 SER 37 1HB SER 37 5.991 0.987 2.947
238 HB3 SER 37 2HB SER 37 7.157 2.210 3.477
239 HG SER 37 HG SER 37 6.254 -0.114 4.842
240 H CYS 38 H CYS 38 2.752 2.697 3.495
241 HA CYS 38 HA CYS 38 3.474 5.113 1.928
242 HB2 CYS 38 1HB CYS 38 2.174 2.550 1.016
243 HB3 CYS 38 2HB CYS 38 1.764 4.066 0.244
244 H PHE 39 H PHE 39 1.117 3.524 3.950
245 HA PHE 39 HA PHE 39 -0.608 5.884 3.778
246 HB2 PHE 39 1HB PHE 39 -1.505 2.962 3.606
247 HB3 PHE 39 2HB PHE 39 -2.564 4.330 3.867
248 HD1 PHE 39 1HD PHE 39 -2.743 6.132 2.064
249 HD2 PHE 39 2HD PHE 39 -0.976 2.250 1.414
250 HE1 PHE 39 1HE PHE 39 -3.179 6.312 -0.395
251 HE2 PHE 39 2HE PHE 39 -1.426 2.396 -0.976
252 HZ PHE 39 HZ PHE 39 -2.553 4.424 -1.895
253 H GLU 40 H GLU 40 -1.513 6.320 5.749
254 HA GLU 40 HA GLU 40 -0.726 4.530 7.994
255 HB2 GLU 40 1HB GLU 40 -0.944 7.540 8.095
256 HB3 GLU 40 2HB GLU 40 -0.197 6.447 9.263
257 HG2 GLU 40 1HG GLU 40 1.398 5.749 7.309
258 HG3 GLU 40 2HG GLU 40 0.791 7.204 6.507
259 H LEU 41 H LEU 41 -2.000 4.809 9.913
260 HA LEU 41 HA LEU 41 -4.002 4.617 11.025
261 HB2 LEU 41 1HB LEU 41 -4.537 7.202 9.525
262 HB3 LEU 41 2HB LEU 41 -5.306 6.709 11.039
263 HG LEU 41 HG LEU 41 -2.318 7.291 10.657
264 HD11 LEU 41 1HD1 LEU 41 -4.509 9.003 11.874
265 HD12 LEU 41 2HD1 LEU 41 -2.758 9.343 11.929
266 HD13 LEU 41 3HD1 LEU 41 -3.588 9.295 10.377
267 HD21 LEU 41 3HD2 LEU 41 -2.639 5.699 12.458
268 HD22 LEU 41 1HD2 LEU 41 -2.236 7.273 13.130
269 HD23 LEU 41 2HD2 LEU 41 -3.933 6.695 13.167
270 H THR 42 H THR 42 -6.498 6.044 9.397
271 HA THR 42 HA THR 42 -7.611 3.486 8.727
272 HB THR 42 HB THR 42 -8.554 6.303 8.052
273 HG1 THR 42 1HG THR 42 -8.700 4.614 10.297
274 HG21 THR 42 3HG2 THR 42 -10.143 3.716 8.254
275 HG22 THR 42 1HG2 THR 42 -10.807 5.351 8.011
276 HG23 THR 42 2HG2 THR 42 -9.817 4.615 6.757
277 H GLY 43 H GLY 43 -5.616 5.728 6.917
278 HA2 GLY 43 1HA GLY 43 -6.269 4.959 4.236
279 HA3 GLY 43 2HA GLY 43 -4.756 5.662 4.828
280 H ASN 44 H ASN 44 -3.982 3.853 6.724
281 HA ASN 44 HA ASN 44 -2.720 1.821 5.216
282 HB2 ASN 44 1HB ASN 44 -1.903 2.693 7.454
283 HB3 ASN 44 2HB ASN 44 -3.207 1.798 8.218
284 HD21 ASN 44 1HD2 ASN 44 -0.483 1.441 5.987
285 HD22 ASN 44 2HD2 ASN 44 -0.148 -0.244 6.382
286 H THR 45 H THR 45 -5.411 1.645 7.598
287 HA THR 45 HA THR 45 -5.917 -1.039 7.486
288 HB THR 45 HB THR 45 -8.186 0.961 7.546
289 HG1 THR 45 1HG THR 45 -6.115 0.696 9.475
290 HG21 THR 45 3HG2 THR 45 -8.978 -0.447 9.429
291 HG22 THR 45 1HG2 THR 45 -8.761 -1.406 7.952
292 HG23 THR 45 2HG2 THR 45 -7.552 -1.489 9.253
293 H MET 46 H MET 46 -7.162 1.448 5.231
294 HA MET 46 HA MET 46 -8.888 -0.324 3.762
295 HB2 MET 46 1HB MET 46 -7.577 2.323 2.998
296 HB3 MET 46 2HB MET 46 -8.734 1.467 1.985
297 HG2 MET 46 1HG MET 46 -9.569 1.830 4.801
298 HG3 MET 46 2HG MET 46 -9.303 3.327 3.977
299 HE1 MET 46 3HE MET 46 -10.392 3.620 1.455
300 HE2 MET 46 1HE MET 46 -10.579 1.966 0.837
301 HE3 MET 46 2HE MET 46 -12.004 3.006 1.029
302 H CYS 47 H CYS 47 -5.465 0.665 3.320
303 HA CYS 47 HA CYS 47 -5.019 -0.661 0.834
304 HB2 CYS 47 1HB CYS 47 -3.607 1.114 1.815
305 HB3 CYS 47 2HB CYS 47 -3.083 0.011 3.080
306 H LEU 48 H LEU 48 -4.437 -1.755 4.229
307 HA LEU 48 HA LEU 48 -3.538 -4.346 3.683
308 HB2 LEU 48 1HB LEU 48 -5.351 -3.386 5.950
309 HB3 LEU 48 2HB LEU 48 -4.460 -4.892 5.901
310 HG LEU 48 HG LEU 48 -3.277 -2.112 6.106
311 HD11 LEU 48 1HD1 LEU 48 -4.310 -2.977 8.155
312 HD12 LEU 48 2HD1 LEU 48 -3.362 -4.487 8.017
313 HD13 LEU 48 3HD1 LEU 48 -2.553 -2.942 8.320
314 HD21 LEU 48 3HD2 LEU 48 -1.815 -4.767 6.000
315 HD22 LEU 48 1HD2 LEU 48 -1.785 -3.525 4.733
316 HD23 LEU 48 2HD2 LEU 48 -1.097 -3.165 6.317
317 H LEU 49 H LEU 49 -6.890 -3.225 4.188
318 HA LEU 49 HA LEU 49 -8.165 -5.699 3.835
319 HB2 LEU 49 1HB LEU 49 -8.942 -2.874 3.846
320 HB3 LEU 49 2HB LEU 49 -9.887 -3.750 2.657
321 HG LEU 49 HG LEU 49 -9.507 -4.796 5.484
322 HD11 LEU 49 1HD1 LEU 49 -10.469 -2.505 5.587
323 HD12 LEU 49 2HD1 LEU 49 -11.815 -3.052 4.541
324 HD13 LEU 49 3HD1 LEU 49 -11.577 -3.754 6.154
325 HD21 LEU 49 3HD2 LEU 49 -11.666 -5.300 3.372
326 HD22 LEU 49 1HD2 LEU 49 -10.370 -6.418 3.819
327 HD23 LEU 49 2HD2 LEU 49 -11.616 -6.015 5.001
328 H GLN 50 H GLN 50 -7.120 -3.398 1.285
329 HA GLN 50 HA GLN 50 -8.334 -4.991 -0.778
330 HB2 GLN 50 1HB GLN 50 -7.790 -2.465 -0.775
331 HB3 GLN 50 2HB GLN 50 -6.134 -2.928 -1.141
332 HG2 GLN 50 1HG GLN 50 -7.294 -2.436 -3.222
333 HG3 GLN 50 2HG GLN 50 -6.973 -4.167 -3.162
334 HE21 GLN 50 1HE2 GLN 50 -8.843 -4.311 -4.830
335 HE22 GLN 50 2HE2 GLN 50 -10.377 -4.628 -4.073
336 H ALA 51 H ALA 51 -4.908 -4.600 0.329
337 HA ALA 51 HA ALA 51 -3.747 -6.417 -1.530
338 HB1 ALA 51 1HB ALA 51 -2.913 -5.647 1.307
339 HB2 ALA 51 2HB ALA 51 -1.910 -6.576 0.177
340 HB3 ALA 51 3HB ALA 51 -2.355 -4.913 -0.224
341 H GLY 52 H GLY 52 -5.249 -6.995 1.666
342 HA2 GLY 52 1HA GLY 52 -4.797 -9.805 1.756
343 HA3 GLY 52 2HA GLY 52 -5.968 -8.869 2.691
344 H ALA 53 H ALA 53 -6.541 -8.427 -0.681
345 HA ALA 53 HA ALA 53 -8.504 -10.667 -0.774
346 HB1 ALA 53 1HB ALA 53 -9.582 -8.736 0.353
347 HB2 ALA 53 2HB ALA 53 -9.197 -7.728 -1.064
348 HB3 ALA 53 3HB ALA 53 -10.316 -9.104 -1.227
349 H ALA 54 H ALA 54 -7.037 -7.903 -2.581
350 HA ALA 54 HA ALA 54 -8.461 -8.516 -4.984
351 HB1 ALA 54 1HB ALA 54 -7.249 -6.562 -5.844
352 HB2 ALA 54 2HB ALA 54 -7.956 -6.251 -4.244
353 HB3 ALA 54 3HB ALA 54 -6.217 -6.552 -4.399
354 H GLY 55 H GLY 55 -7.509 -10.789 -4.794
355 HA2 GLY 55 1HA GLY 55 -6.221 -12.207 -6.355
356 HA3 GLY 55 2HA GLY 55 -4.871 -11.080 -6.195
357 H SER 56 H SER 56 -5.512 -10.758 -3.146
358 HA SER 56 HA SER 56 -4.581 -11.631 -1.296
359 HB2 SER 56 1HB SER 56 -6.306 -13.760 -2.520
360 HB3 SER 56 2HB SER 56 -5.282 -14.223 -1.159
361 HG SER 56 HG SER 56 -6.129 -12.526 0.010
362 H GLY 57 H GLY 57 -2.904 -12.121 -3.900
363 HA2 GLY 57 1HA GLY 57 -1.057 -14.267 -2.966
364 HA3 GLY 57 2HA GLY 57 -1.051 -13.477 -4.545
365 H CYS 58 H CYS 58 -1.424 -11.249 -1.979
366 HA CYS 58 HA CYS 58 1.235 -10.137 -2.399
367 HB2 CYS 58 1HB CYS 58 -1.229 -9.301 -0.814
368 HB3 CYS 58 2HB CYS 58 0.261 -8.389 -0.816
369 H ASP 59 H ASP 59 2.197 -9.194 -0.207
370 HA ASP 59 HA ASP 59 2.837 -11.592 1.439
371 HB2 ASP 59 1HB ASP 59 4.584 -10.373 0.116
372 HB3 ASP 59 2HB ASP 59 4.352 -8.970 1.153
373 H MET 60 H MET 60 0.777 -11.357 2.594
374 HA MET 60 HA MET 60 0.323 -8.897 4.156
375 HB2 MET 60 1HB MET 60 -1.268 -11.497 4.252
376 HB3 MET 60 2HB MET 60 -1.665 -9.968 5.003
377 HG2 MET 60 1HG MET 60 -3.055 -10.041 3.203
378 HG3 MET 60 2HG MET 60 -1.794 -8.932 2.703
379 HE1 MET 60 3HE MET 60 -0.752 -12.779 2.404
380 HE2 MET 60 1HE MET 60 -2.514 -12.880 2.567
381 HE3 MET 60 2HE MET 60 -1.726 -13.294 1.023
382 H GLU 61 H GLU 61 1.797 -8.707 5.883
383 HA GLU 61 HA GLU 61 1.795 -10.911 7.878
384 HB2 GLU 61 1HB GLU 61 3.293 -9.852 9.160
385 HB3 GLU 61 2HB GLU 61 3.845 -9.385 7.565
386 HG2 GLU 61 1HG GLU 61 2.926 -7.157 7.845
387 HG3 GLU 61 2HG GLU 61 2.222 -7.576 9.406
Start of MODEL 9
1 H1 TYR 1 H TYR 1 -14.004 5.483 1.830
2 HA TYR 1 HA TYR 1 -13.119 8.236 2.509
3 HB2 TYR 1 1HB TYR 1 -13.402 7.175 4.621
4 HB3 TYR 1 2HB TYR 1 -12.880 5.622 3.998
5 HD1 TYR 1 1HD TYR 1 -11.512 9.099 4.683
6 HD2 TYR 1 2HD TYR 1 -10.713 4.877 4.172
7 HE1 TYR 1 1HE TYR 1 -9.122 9.482 5.170
8 HE2 TYR 1 2HE TYR 1 -8.360 5.256 4.680
9 HH TYR 1 HH TYR 1 -6.896 8.289 5.718
10 H ASN 2 H ASN 2 -11.445 8.846 1.309
11 HA ASN 2 HA ASN 2 -10.069 6.950 -0.432
12 HB2 ASN 2 1HB ASN 2 -10.294 9.924 -0.223
13 HB3 ASN 2 2HB ASN 2 -8.702 9.335 -0.678
14 HD21 ASN 2 1HD2 ASN 2 -8.418 9.103 -2.860
15 HD22 ASN 2 2HD2 ASN 2 -9.708 8.606 -3.959
16 HA PRO 3 HA PRO 3 -7.028 6.399 2.919
17 HB2 PRO 3 1HB PRO 3 -5.323 4.673 1.564
18 HB3 PRO 3 2HB PRO 3 -6.812 4.172 2.396
19 HG2 PRO 3 1HG PRO 3 -6.381 4.590 -0.507
20 HG3 PRO 3 2HG PRO 3 -7.454 3.428 0.351
21 HD2 PRO 3 1HD PRO 3 -8.345 5.724 -0.861
22 HD3 PRO 3 2HD PRO 3 -9.183 4.871 0.478
23 H GLU 4 H GLU 4 -6.439 7.493 -0.353
24 HA GLU 4 HA GLU 4 -3.892 8.584 -0.196
25 HB2 GLU 4 1HB GLU 4 -6.460 9.337 -1.626
26 HB3 GLU 4 2HB GLU 4 -4.976 10.261 -1.868
27 HG2 GLU 4 1HG GLU 4 -3.799 8.334 -2.735
28 HG3 GLU 4 2HG GLU 4 -5.019 7.243 -2.161
29 H ASP 5 H ASP 5 -6.648 9.573 1.763
30 HA ASP 5 HA ASP 5 -5.789 12.248 2.370
31 HB2 ASP 5 1HB ASP 5 -7.570 10.179 3.610
32 HB3 ASP 5 2HB ASP 5 -6.847 11.309 4.723
33 H ASP 6 H ASP 6 -4.748 9.052 3.427
34 HA ASP 6 HA ASP 6 -2.753 10.160 5.374
35 HB2 ASP 6 1HB ASP 6 -4.287 7.546 5.409
36 HB3 ASP 6 2HB ASP 6 -2.881 7.895 6.390
37 H TYR 7 H TYR 7 -2.708 9.705 2.335
38 HA TYR 7 HA TYR 7 -0.544 7.755 1.999
39 HB2 TYR 7 1HB TYR 7 -1.783 8.133 0.021
40 HB3 TYR 7 2HB TYR 7 -1.783 9.875 0.245
41 HD1 TYR 7 2HD TYR 7 0.555 7.011 -0.419
42 HD2 TYR 7 1HD TYR 7 -0.187 11.229 -0.790
43 HE1 TYR 7 2HE TYR 7 2.503 7.224 -1.956
44 HE2 TYR 7 1HE TYR 7 1.786 11.451 -2.300
45 HH TYR 7 HH TYR 7 3.877 8.723 -3.181
46 H THR 8 H THR 8 1.567 8.202 2.406
47 HA THR 8 HA THR 8 2.321 11.029 3.014
48 HB THR 8 HB THR 8 3.441 10.408 4.914
49 HG1 THR 8 1HG THR 8 3.847 8.101 3.723
50 HG21 THR 8 3HG2 THR 8 1.848 9.366 6.354
51 HG22 THR 8 1HG2 THR 8 0.913 10.267 5.151
52 HG23 THR 8 2HG2 THR 8 1.094 8.513 5.014
53 HA PRO 9 HA PRO 9 4.709 9.634 -0.519
54 HB2 PRO 9 1HB PRO 9 5.827 12.038 -1.318
55 HB3 PRO 9 2HB PRO 9 4.163 11.537 -1.682
56 HG2 PRO 9 1HG PRO 9 5.093 13.357 0.540
57 HG3 PRO 9 2HG PRO 9 3.669 13.540 -0.546
58 HD2 PRO 9 1HD PRO 9 3.400 12.569 1.967
59 HD3 PRO 9 2HD PRO 9 2.447 11.903 0.593
60 H LEU 10 H LEU 10 6.226 11.502 2.161
61 HA LEU 10 HA LEU 10 8.821 11.540 1.035
62 HB2 LEU 10 1HB LEU 10 8.035 11.662 3.975
63 HB3 LEU 10 2HB LEU 10 9.563 12.185 3.297
64 HG LEU 10 HG LEU 10 6.866 13.448 2.650
65 HD11 LEU 10 1HD1 LEU 10 7.501 15.260 4.090
66 HD12 LEU 10 2HD1 LEU 10 7.657 13.762 5.014
67 HD13 LEU 10 3HD1 LEU 10 9.100 14.549 4.382
68 HD21 LEU 10 3HD2 LEU 10 8.217 15.285 1.678
69 HD22 LEU 10 1HD2 LEU 10 9.687 14.306 1.878
70 HD23 LEU 10 2HD2 LEU 10 8.383 13.773 0.792
71 H THR 11 H THR 11 7.250 9.138 3.112
72 HA THR 11 HA THR 11 9.739 7.519 3.154
73 HB THR 11 HB THR 11 8.681 6.280 4.925
74 HG1 THR 11 1HG THR 11 6.654 8.184 5.231
75 HG21 THR 11 3HG2 THR 11 8.620 9.293 5.468
76 HG22 THR 11 1HG2 THR 11 8.727 8.004 6.675
77 HG23 THR 11 2HG2 THR 11 10.051 8.241 5.518
78 H CYS 12 H CYS 12 7.055 7.881 1.194
79 HA CYS 12 HA CYS 12 6.609 5.017 0.763
80 HB2 CYS 12 1HB CYS 12 4.711 6.600 0.853
81 HB3 CYS 12 2HB CYS 12 5.347 7.434 -0.565
82 HA PRO 13 HA PRO 13 9.644 5.457 -2.668
83 HB2 PRO 13 1HB PRO 13 9.530 2.821 -3.534
84 HB3 PRO 13 2HB PRO 13 10.554 3.436 -2.192
85 HG2 PRO 13 1HG PRO 13 7.887 2.038 -2.062
86 HG3 PRO 13 2HG PRO 13 9.304 1.821 -1.012
87 HD2 PRO 13 1HD PRO 13 7.140 3.313 -0.332
88 HD3 PRO 13 2HD PRO 13 8.789 3.675 0.262
89 H HIS 14 H HIS 14 6.471 5.804 -2.844
90 HA HIS 14 HA HIS 14 6.326 5.384 -5.756
91 HB2 HIS 14 1HB HIS 14 3.890 4.516 -4.126
92 HB3 HIS 14 2HB HIS 14 4.343 4.246 -5.770
93 HD1 HIS 14 1HD HIS 14 6.217 2.534 -6.437
94 HD2 HIS 14 2HD HIS 14 4.783 2.532 -2.442
95 HE1 HIS 14 1HE HIS 14 6.545 0.210 -5.457
96 HE2 HIS 14 2HE HIS 14 5.898 0.247 -3.032
97 H THR 15 H THR 15 4.340 6.349 -6.649
98 HA THR 15 HA THR 15 4.016 9.052 -5.441
99 HB THR 15 HB THR 15 3.428 9.739 -7.748
100 HG1 THR 15 1HG THR 15 4.274 7.084 -8.390
101 HG21 THR 15 3HG2 THR 15 5.718 9.970 -6.829
102 HG22 THR 15 1HG2 THR 15 6.163 8.396 -7.519
103 HG23 THR 15 2HG2 THR 15 5.694 9.731 -8.579
104 H ILE 16 H ILE 16 1.804 9.962 -5.612
105 HA ILE 16 HA ILE 16 -0.146 8.143 -4.773
106 HB ILE 16 HB ILE 16 0.029 10.553 -4.358
107 HG12 ILE 16 1HG1 ILE 16 -2.747 9.793 -5.347
108 HG13 ILE 16 2HG1 ILE 16 -2.014 9.115 -3.900
109 HG21 ILE 16 1HG2 ILE 16 0.348 11.331 -6.691
110 HG22 ILE 16 2HG2 ILE 16 -1.339 10.951 -7.042
111 HG23 ILE 16 3HG2 ILE 16 -0.930 12.198 -5.863
112 HD11 ILE 16 3HD1 ILE 16 -2.599 12.070 -4.329
113 HD12 ILE 16 1HD1 ILE 16 -3.491 10.956 -3.306
114 HD13 ILE 16 2HD1 ILE 16 -1.820 11.359 -2.897
115 H SER 17 H SER 17 0.944 8.553 -7.950
116 HA SER 17 HA SER 17 -1.394 8.070 -9.526
117 HB2 SER 17 1HB SER 17 1.613 7.812 -9.903
118 HB3 SER 17 2HB SER 17 0.437 7.557 -11.174
119 HG SER 17 HG SER 17 -0.149 9.666 -11.083
120 H VAL 18 H VAL 18 1.359 6.007 -8.054
121 HA VAL 18 HA VAL 18 -0.201 3.654 -8.545
122 HB VAL 18 HB VAL 18 2.262 4.568 -9.653
123 HG11 VAL 18 1HG1 VAL 18 3.247 2.369 -10.001
124 HG12 VAL 18 2HG1 VAL 18 3.440 3.359 -8.533
125 HG13 VAL 18 3HG1 VAL 18 2.252 2.025 -8.517
126 HG21 VAL 18 3HG2 VAL 18 0.696 4.421 -11.307
127 HG22 VAL 18 1HG2 VAL 18 1.680 2.978 -11.539
128 HG23 VAL 18 2HG2 VAL 18 0.083 2.893 -10.758
129 H VAL 19 H VAL 19 -0.666 4.069 -6.383
130 HA VAL 19 HA VAL 19 1.428 3.000 -4.651
131 HB VAL 19 HB VAL 19 1.451 5.305 -4.245
132 HG11 VAL 19 1HG1 VAL 19 -1.412 5.260 -3.158
133 HG12 VAL 19 2HG1 VAL 19 -0.302 6.623 -3.177
134 HG13 VAL 19 3HG1 VAL 19 -0.915 5.991 -4.703
135 HG21 VAL 19 3HG2 VAL 19 2.012 3.807 -2.444
136 HG22 VAL 19 1HG2 VAL 19 1.248 5.248 -1.774
137 HG23 VAL 19 2HG2 VAL 19 0.333 3.755 -1.902
138 H TRP 20 H TRP 20 -2.107 3.935 -4.916
139 HA TRP 20 HA TRP 20 -3.071 1.799 -3.322
140 HB2 TRP 20 1HB TRP 20 -4.397 3.801 -3.898
141 HB3 TRP 20 2HB TRP 20 -4.453 3.288 -5.575
142 HD1 TRP 20 HD TRP 20 -6.284 1.555 -6.250
143 HE1 TRP 20 1HE TRP 20 -8.089 0.248 -5.014
144 HE3 TRP 20 3HE TRP 20 -4.991 2.725 -1.419
145 HZ2 TRP 20 2HZ TRP 20 -8.743 -0.436 -2.225
146 HZ3 TRP 20 3HZ TRP 20 -6.109 1.617 0.461
147 HH2 TRP 20 HH TRP 20 -8.052 0.110 0.076
148 H TYR 21 H TYR 21 -2.906 2.146 -6.910
149 HA TYR 21 HA TYR 21 -3.321 -0.521 -7.653
150 HB2 TYR 21 1HB TYR 21 -3.142 0.914 -9.465
151 HB3 TYR 21 2HB TYR 21 -1.795 1.814 -8.773
152 HD1 TYR 21 1HD TYR 21 -2.627 -1.512 -10.346
153 HD2 TYR 21 2HD TYR 21 0.460 1.384 -9.378
154 HE1 TYR 21 1HE TYR 21 -0.955 -2.884 -11.548
155 HE2 TYR 21 2HE TYR 21 2.117 0.014 -10.563
156 HH TYR 21 HH TYR 21 1.386 -3.243 -11.768
157 H GLU 22 H GLU 22 -0.086 0.967 -6.658
158 HA GLU 22 HA GLU 22 1.315 -1.419 -7.422
159 HB2 GLU 22 1HB GLU 22 2.881 0.086 -7.404
160 HB3 GLU 22 2HB GLU 22 1.917 1.320 -6.684
161 HG2 GLU 22 1HG GLU 22 3.488 1.292 -5.222
162 HG3 GLU 22 2HG GLU 22 2.385 0.307 -4.377
163 H CYS 23 H CYS 23 -0.414 -0.497 -4.421
164 HA CYS 23 HA CYS 23 1.063 -2.503 -2.899
165 HB2 CYS 23 1HB CYS 23 0.451 0.064 -2.287
166 HB3 CYS 23 2HB CYS 23 -0.997 -0.707 -1.690
167 H THR 24 H THR 24 -1.583 -2.499 -4.877
168 HA THR 24 HA THR 24 -2.738 -4.573 -3.192
169 HB THR 24 HB THR 24 -5.035 -3.808 -3.496
170 HG1 THR 24 1HG THR 24 -3.911 -1.554 -4.815
171 HG21 THR 24 3HG2 THR 24 -4.992 -1.602 -2.411
172 HG22 THR 24 1HG2 THR 24 -3.915 -2.777 -1.618
173 HG23 THR 24 2HG2 THR 24 -3.247 -1.504 -2.649
174 H GLU 25 H GLU 25 -1.425 -3.828 -6.161
175 HA GLU 25 HA GLU 25 -2.669 -6.148 -7.554
176 HB2 GLU 25 1HB GLU 25 -3.361 -3.773 -8.156
177 HB3 GLU 25 2HB GLU 25 -1.753 -3.507 -8.782
178 HG2 GLU 25 1HG GLU 25 -2.059 -4.823 -10.629
179 HG3 GLU 25 2HG GLU 25 -3.105 -5.974 -9.805
180 H ASN 26 H ASN 26 0.142 -3.954 -7.387
181 HA ASN 26 HA ASN 26 1.782 -5.596 -9.105
182 HB2 ASN 26 1HB ASN 26 1.930 -3.109 -8.854
183 HB3 ASN 26 2HB ASN 26 2.627 -3.371 -7.236
184 HD21 ASN 26 1HD2 ASN 26 4.439 -2.130 -7.925
185 HD22 ASN 26 2HD2 ASN 26 5.664 -2.899 -8.947
186 H THR 27 H THR 27 1.501 -7.656 -8.035
187 HA THR 27 HA THR 27 2.094 -8.251 -5.404
188 HB THR 27 HB THR 27 2.300 -10.588 -6.177
189 HG1 THR 27 1HG THR 27 2.247 -11.091 -8.211
190 HG21 THR 27 3HG2 THR 27 0.030 -10.840 -6.918
191 HG22 THR 27 1HG2 THR 27 0.060 -9.489 -5.769
192 HG23 THR 27 2HG2 THR 27 -0.052 -9.174 -7.505
193 H ALA 28 H ALA 28 4.509 -7.499 -7.757
194 HA ALA 28 HA ALA 28 6.729 -8.773 -6.605
195 HB1 ALA 28 1HB ALA 28 6.866 -7.390 -8.611
196 HB2 ALA 28 2HB ALA 28 6.534 -5.920 -7.652
197 HB3 ALA 28 3HB ALA 28 8.027 -6.848 -7.370
198 H ASN 29 H ASN 29 4.749 -6.126 -5.282
199 HA ASN 29 HA ASN 29 6.527 -6.046 -2.880
200 HB2 ASN 29 1HB ASN 29 5.286 -3.490 -3.688
201 HB3 ASN 29 2HB ASN 29 6.864 -3.781 -2.969
202 HD21 ASN 29 1HD2 ASN 29 5.431 -2.505 -5.605
203 HD22 ASN 29 2HD2 ASN 29 6.404 -3.088 -6.916
204 H CYS 30 H CYS 30 3.170 -5.763 -4.129
205 HA CYS 30 HA CYS 30 2.185 -4.285 -2.017
206 HB2 CYS 30 1HB CYS 30 0.013 -5.151 -2.564
207 HB3 CYS 30 2HB CYS 30 0.918 -4.636 -3.999
208 H GLY 31 H GLY 31 1.026 -4.722 -0.037
209 HA2 GLY 31 1HA GLY 31 0.441 -7.024 1.270
210 HA3 GLY 31 2HA GLY 31 2.208 -6.979 1.336
211 H THR 32 H THR 32 1.272 -6.939 3.774
212 HA THR 32 HA THR 32 0.207 -4.572 4.774
213 HB THR 32 HB THR 32 1.923 -6.595 6.214
214 HG1 THR 32 1HG THR 32 -0.848 -6.664 6.326
215 HG21 THR 32 3HG2 THR 32 1.461 -4.556 7.610
216 HG22 THR 32 1HG2 THR 32 -0.271 -4.846 7.420
217 HG23 THR 32 2HG2 THR 32 0.731 -6.032 8.245
218 H ALA 33 H ALA 33 3.696 -5.490 4.545
219 HA ALA 33 HA ALA 33 4.624 -3.138 5.894
220 HB1 ALA 33 1HB ALA 33 6.809 -3.737 4.970
221 HB2 ALA 33 2HB ALA 33 5.983 -5.188 5.562
222 HB3 ALA 33 3HB ALA 33 6.062 -4.859 3.813
223 H CYS 34 H CYS 34 3.909 -3.838 2.485
224 HA CYS 34 HA CYS 34 4.947 -1.452 1.294
225 HB2 CYS 34 1HB CYS 34 4.364 -3.254 -0.074
226 HB3 CYS 34 2HB CYS 34 2.757 -3.403 0.561
227 H CYS 35 H CYS 35 1.774 -2.268 2.604
228 HA CYS 35 HA CYS 35 0.535 0.264 2.201
229 HB2 CYS 35 1HB CYS 35 -0.017 -1.822 4.342
230 HB3 CYS 35 2HB CYS 35 -1.008 -0.401 4.066
231 H ASP 36 H ASP 36 2.126 -1.037 5.112
232 HA ASP 36 HA ASP 36 1.643 1.050 6.862
233 HB2 ASP 36 1HB ASP 36 2.321 -1.329 7.228
234 HB3 ASP 36 2HB ASP 36 3.968 -0.878 6.812
235 H SER 37 H SER 37 4.239 0.900 4.521
236 HA SER 37 HA SER 37 5.346 3.441 5.628
237 HB2 SER 37 1HB SER 37 6.465 1.195 4.052
238 HB3 SER 37 2HB SER 37 7.295 2.735 4.134
239 HG SER 37 HG SER 37 7.345 2.686 6.304
240 H CYS 38 H CYS 38 2.929 3.028 3.773
241 HA CYS 38 HA CYS 38 3.674 5.380 2.154
242 HB2 CYS 38 1HB CYS 38 2.398 2.819 1.263
243 HB3 CYS 38 2HB CYS 38 1.991 4.303 0.455
244 H PHE 39 H PHE 39 1.271 3.599 4.012
245 HA PHE 39 HA PHE 39 -0.655 5.810 3.879
246 HB2 PHE 39 1HB PHE 39 -1.171 2.818 3.677
247 HB3 PHE 39 2HB PHE 39 -2.393 4.013 3.962
248 HD1 PHE 39 1HD PHE 39 -2.730 5.899 2.163
249 HD2 PHE 39 2HD PHE 39 -0.743 2.136 1.443
250 HE1 PHE 39 1HE PHE 39 -3.361 6.003 -0.237
251 HE2 PHE 39 2HE PHE 39 -1.391 2.240 -0.935
252 HZ PHE 39 HZ PHE 39 -2.725 4.125 -1.761
253 H GLU 40 H GLU 40 -1.450 6.215 5.871
254 HA GLU 40 HA GLU 40 -0.589 4.495 8.181
255 HB2 GLU 40 1HB GLU 40 -0.871 7.491 8.133
256 HB3 GLU 40 2HB GLU 40 -0.232 6.490 9.455
257 HG2 GLU 40 1HG GLU 40 1.407 5.717 7.366
258 HG3 GLU 40 2HG GLU 40 1.046 7.354 6.918
259 H LEU 41 H LEU 41 -1.898 4.929 10.185
260 HA LEU 41 HA LEU 41 -3.825 4.768 11.279
261 HB2 LEU 41 1HB LEU 41 -4.386 7.289 9.702
262 HB3 LEU 41 2HB LEU 41 -5.142 6.844 11.225
263 HG LEU 41 HG LEU 41 -2.154 7.339 10.826
264 HD11 LEU 41 1HD1 LEU 41 -2.495 9.416 12.056
265 HD12 LEU 41 2HD1 LEU 41 -3.354 9.360 10.518
266 HD13 LEU 41 3HD1 LEU 41 -4.273 9.142 12.039
267 HD21 LEU 41 3HD2 LEU 41 -2.099 7.385 13.327
268 HD22 LEU 41 1HD2 LEU 41 -3.765 6.777 13.346
269 HD23 LEU 41 2HD2 LEU 41 -2.425 5.803 12.640
270 H THR 42 H THR 42 -6.295 6.189 9.427
271 HA THR 42 HA THR 42 -7.416 3.544 8.973
272 HB THR 42 HB THR 42 -8.423 6.340 8.329
273 HG1 THR 42 1HG THR 42 -8.860 4.465 10.428
274 HG21 THR 42 3HG2 THR 42 -10.649 5.274 8.174
275 HG22 THR 42 1HG2 THR 42 -9.579 4.720 6.901
276 HG23 THR 42 2HG2 THR 42 -9.870 3.682 8.265
277 H GLY 43 H GLY 43 -5.595 5.819 6.966
278 HA2 GLY 43 1HA GLY 43 -6.376 4.827 4.403
279 HA3 GLY 43 2HA GLY 43 -4.846 5.613 4.791
280 H ASN 44 H ASN 44 -3.949 3.886 6.775
281 HA ASN 44 HA ASN 44 -2.612 1.841 5.372
282 HB2 ASN 44 1HB ASN 44 -1.823 2.751 7.541
283 HB3 ASN 44 2HB ASN 44 -3.191 2.035 8.367
284 HD21 ASN 44 1HD2 ASN 44 -0.359 1.304 6.371
285 HD22 ASN 44 2HD2 ASN 44 -0.175 -0.357 6.957
286 H THR 45 H THR 45 -5.360 1.673 7.681
287 HA THR 45 HA THR 45 -5.838 -1.047 7.463
288 HB THR 45 HB THR 45 -7.867 1.154 7.847
289 HG1 THR 45 1HG THR 45 -5.839 0.663 9.393
290 HG21 THR 45 3HG2 THR 45 -9.134 -0.520 9.229
291 HG22 THR 45 1HG2 THR 45 -9.127 -0.787 7.484
292 HG23 THR 45 2HG2 THR 45 -8.073 -1.767 8.548
293 H MET 46 H MET 46 -7.312 1.524 5.388
294 HA MET 46 HA MET 46 -8.946 -0.270 3.847
295 HB2 MET 46 1HB MET 46 -7.911 2.371 2.990
296 HB3 MET 46 2HB MET 46 -9.182 1.389 2.249
297 HG2 MET 46 1HG MET 46 -9.213 2.816 4.904
298 HG3 MET 46 2HG MET 46 -10.373 2.714 3.573
299 HE1 MET 46 3HE MET 46 -11.100 2.852 6.606
300 HE2 MET 46 1HE MET 46 -12.406 2.784 5.412
301 HE3 MET 46 2HE MET 46 -12.386 1.647 6.784
302 H CYS 47 H CYS 47 -5.547 0.765 3.426
303 HA CYS 47 HA CYS 47 -5.068 -0.428 0.849
304 HB2 CYS 47 1HB CYS 47 -3.565 1.214 1.832
305 HB3 CYS 47 2HB CYS 47 -3.186 0.170 3.173
306 H LEU 48 H LEU 48 -4.546 -1.643 4.189
307 HA LEU 48 HA LEU 48 -3.767 -4.254 3.522
308 HB2 LEU 48 1HB LEU 48 -5.387 -3.265 5.917
309 HB3 LEU 48 2HB LEU 48 -4.573 -4.810 5.788
310 HG LEU 48 HG LEU 48 -3.170 -2.106 5.770
311 HD11 LEU 48 1HD1 LEU 48 -2.390 -2.765 8.013
312 HD12 LEU 48 2HD1 LEU 48 -4.152 -2.615 7.964
313 HD13 LEU 48 3HD1 LEU 48 -3.386 -4.216 7.937
314 HD21 LEU 48 3HD2 LEU 48 -1.916 -3.789 4.511
315 HD22 LEU 48 1HD2 LEU 48 -1.130 -3.350 6.023
316 HD23 LEU 48 2HD2 LEU 48 -2.029 -4.897 5.884
317 H LEU 49 H LEU 49 -7.033 -2.993 4.266
318 HA LEU 49 HA LEU 49 -8.384 -5.363 3.881
319 HB2 LEU 49 1HB LEU 49 -9.175 -2.586 4.084
320 HB3 LEU 49 2HB LEU 49 -10.054 -3.307 2.739
321 HG LEU 49 HG LEU 49 -10.578 -5.279 4.367
322 HD11 LEU 49 1HD1 LEU 49 -8.918 -4.581 6.129
323 HD12 LEU 49 2HD1 LEU 49 -9.872 -3.117 6.414
324 HD13 LEU 49 3HD1 LEU 49 -10.568 -4.716 6.754
325 HD21 LEU 49 3HD2 LEU 49 -11.786 -2.519 4.823
326 HD22 LEU 49 1HD2 LEU 49 -12.263 -3.711 3.594
327 HD23 LEU 49 2HD2 LEU 49 -12.517 -4.073 5.306
328 H GLN 50 H GLN 50 -7.380 -3.153 1.179
329 HA GLN 50 HA GLN 50 -8.702 -4.763 -0.811
330 HB2 GLN 50 1HB GLN 50 -7.865 -2.285 -0.995
331 HB3 GLN 50 2HB GLN 50 -6.289 -2.968 -1.242
332 HG2 GLN 50 1HG GLN 50 -7.313 -2.505 -3.408
333 HG3 GLN 50 2HG GLN 50 -7.215 -4.267 -3.192
334 HE21 GLN 50 1HE2 GLN 50 -9.012 -4.978 -4.437
335 HE22 GLN 50 2HE2 GLN 50 -10.643 -4.513 -4.023
336 H ALA 51 H ALA 51 -5.233 -4.402 0.157
337 HA ALA 51 HA ALA 51 -4.084 -6.269 -1.514
338 HB1 ALA 51 1HB ALA 51 -3.330 -5.639 1.377
339 HB2 ALA 51 2HB ALA 51 -2.282 -6.421 0.178
340 HB3 ALA 51 3HB ALA 51 -2.808 -4.743 -0.061
341 H GLY 52 H GLY 52 -5.309 -6.940 1.802
342 HA2 GLY 52 1HA GLY 52 -5.133 -9.849 1.384
343 HA3 GLY 52 2HA GLY 52 -5.473 -8.988 2.875
344 H ALA 53 H ALA 53 -7.266 -8.300 -0.165
345 HA ALA 53 HA ALA 53 -9.815 -9.012 1.073
346 HB1 ALA 53 1HB ALA 53 -10.784 -8.480 -1.123
347 HB2 ALA 53 2HB ALA 53 -9.712 -7.161 -0.595
348 HB3 ALA 53 3HB ALA 53 -9.203 -8.296 -1.848
349 H ALA 54 H ALA 54 -8.552 -10.153 -2.080
350 HA ALA 54 HA ALA 54 -8.575 -12.927 -1.460
351 HB1 ALA 54 1HB ALA 54 -10.990 -11.668 -2.813
352 HB2 ALA 54 2HB ALA 54 -10.576 -13.362 -3.037
353 HB3 ALA 54 3HB ALA 54 -10.990 -12.751 -1.415
354 H GLY 55 H GLY 55 -7.793 -14.071 -3.242
355 HA2 GLY 55 1HA GLY 55 -6.943 -14.442 -5.367
356 HA3 GLY 55 2HA GLY 55 -7.443 -12.834 -5.879
357 H SER 56 H SER 56 -6.197 -11.087 -4.275
358 HA SER 56 HA SER 56 -3.862 -10.737 -5.617
359 HB2 SER 56 1HB SER 56 -4.668 -9.773 -2.886
360 HB3 SER 56 2HB SER 56 -3.253 -9.162 -3.725
361 HG SER 56 HG SER 56 -4.399 -8.145 -5.094
362 H GLY 57 H GLY 57 -1.913 -11.502 -5.632
363 HA2 GLY 57 1HA GLY 57 -0.746 -13.216 -3.524
364 HA3 GLY 57 2HA GLY 57 -0.063 -12.799 -5.113
365 H CYS 58 H CYS 58 -1.364 -10.675 -2.603
366 HA CYS 58 HA CYS 58 1.148 -9.138 -2.390
367 HB2 CYS 58 1HB CYS 58 -1.612 -8.875 -1.134
368 HB3 CYS 58 2HB CYS 58 -0.274 -7.754 -0.867
369 H ASP 59 H ASP 59 2.090 -9.006 -0.263
370 HA ASP 59 HA ASP 59 1.737 -11.569 1.215
371 HB2 ASP 59 1HB ASP 59 3.978 -11.037 0.161
372 HB3 ASP 59 2HB ASP 59 4.153 -9.735 1.365
373 H MET 60 H MET 60 0.286 -11.271 2.863
374 HA MET 60 HA MET 60 0.786 -8.945 4.639
375 HB2 MET 60 1HB MET 60 -1.470 -8.997 5.349
376 HB3 MET 60 2HB MET 60 -1.431 -8.781 3.593
377 HG2 MET 60 1HG MET 60 -2.237 -10.999 3.250
378 HG3 MET 60 2HG MET 60 -1.844 -11.478 4.907
379 HE1 MET 60 3HE MET 60 -4.718 -12.297 3.829
380 HE2 MET 60 1HE MET 60 -3.755 -12.626 5.293
381 HE3 MET 60 2HE MET 60 -5.402 -12.010 5.453
382 H GLU 61 H GLU 61 0.414 -9.215 6.833
383 HA GLU 61 HA GLU 61 1.747 -11.539 7.851
384 HB2 GLU 61 1HB GLU 61 1.721 -10.427 9.989
385 HB3 GLU 61 2HB GLU 61 2.251 -9.352 8.697
386 HG2 GLU 61 1HG GLU 61 0.037 -8.245 8.691
387 HG3 GLU 61 2HG GLU 61 -0.531 -9.345 9.945
Start of MODEL 10
1 H1 TYR 1 H TYR 1 -14.056 9.704 2.074
2 HA TYR 1 HA TYR 1 -12.079 9.294 3.357
3 HB2 TYR 1 1HB TYR 1 -13.186 7.593 4.890
4 HB3 TYR 1 2HB TYR 1 -12.969 6.396 3.614
5 HD1 TYR 1 1HD TYR 1 -11.159 9.016 5.600
6 HD2 TYR 1 2HD TYR 1 -10.777 5.345 3.315
7 HE1 TYR 1 1HE TYR 1 -8.744 9.064 5.922
8 HE2 TYR 1 2HE TYR 1 -8.367 5.372 3.716
9 HH TYR 1 HH TYR 1 -6.648 7.838 5.652
10 H ASN 2 H ASN 2 -10.280 9.113 1.965
11 HA ASN 2 HA ASN 2 -10.302 6.846 0.121
12 HB2 ASN 2 1HB ASN 2 -9.680 9.741 -0.532
13 HB3 ASN 2 2HB ASN 2 -8.687 8.490 -1.191
14 HD21 ASN 2 1HD2 ASN 2 -9.284 7.896 -3.215
15 HD22 ASN 2 2HD2 ASN 2 -10.925 7.927 -3.839
16 HA PRO 3 HA PRO 3 -6.758 6.081 2.584
17 HB2 PRO 3 1HB PRO 3 -5.082 4.722 0.793
18 HB3 PRO 3 2HB PRO 3 -6.434 3.985 1.658
19 HG2 PRO 3 1HG PRO 3 -6.353 4.996 -1.152
20 HG3 PRO 3 2HG PRO 3 -7.244 3.594 -0.488
21 HD2 PRO 3 1HD PRO 3 -8.498 5.906 -1.072
22 HD3 PRO 3 2HD PRO 3 -8.985 4.859 0.285
23 H GLU 4 H GLU 4 -6.373 7.863 -0.364
24 HA GLU 4 HA GLU 4 -3.734 8.827 -0.041
25 HB2 GLU 4 1HB GLU 4 -6.232 9.839 -1.409
26 HB3 GLU 4 2HB GLU 4 -4.698 10.704 -1.511
27 HG2 GLU 4 1HG GLU 4 -3.627 8.826 -2.601
28 HG3 GLU 4 2HG GLU 4 -4.995 7.773 -2.265
29 H ASP 5 H ASP 5 -6.502 9.450 1.945
30 HA ASP 5 HA ASP 5 -5.823 12.100 2.915
31 HB2 ASP 5 1HB ASP 5 -8.051 11.031 3.183
32 HB3 ASP 5 2HB ASP 5 -7.322 9.819 4.222
33 H ASP 6 H ASP 6 -4.456 8.920 3.415
34 HA ASP 6 HA ASP 6 -2.687 9.988 5.576
35 HB2 ASP 6 1HB ASP 6 -4.041 7.292 5.376
36 HB3 ASP 6 2HB ASP 6 -2.698 7.647 6.455
37 H TYR 7 H TYR 7 -2.447 9.720 2.488
38 HA TYR 7 HA TYR 7 -0.461 7.673 1.996
39 HB2 TYR 7 1HB TYR 7 -1.625 8.536 0.126
40 HB3 TYR 7 2HB TYR 7 -1.354 10.213 0.603
41 HD1 TYR 7 2HD TYR 7 0.931 7.253 -0.061
42 HD2 TYR 7 1HD TYR 7 -0.081 11.345 -0.973
43 HE1 TYR 7 2HE TYR 7 2.812 7.368 -1.670
44 HE2 TYR 7 1HE TYR 7 1.769 11.450 -2.603
45 HH TYR 7 HH TYR 7 3.698 8.513 -3.428
46 H THR 8 H THR 8 1.679 7.708 2.478
47 HA THR 8 HA THR 8 2.816 10.175 3.654
48 HB THR 8 HB THR 8 4.338 8.672 4.838
49 HG1 THR 8 1HG THR 8 4.458 6.889 3.679
50 HG21 THR 8 3HG2 THR 8 2.147 9.330 5.897
51 HG22 THR 8 1HG2 THR 8 1.455 7.817 5.302
52 HG23 THR 8 2HG2 THR 8 2.788 7.781 6.453
53 HA PRO 9 HA PRO 9 4.860 9.555 -0.515
54 HB2 PRO 9 1HB PRO 9 5.474 12.258 -0.898
55 HB3 PRO 9 2HB PRO 9 4.021 11.438 -1.511
56 HG2 PRO 9 1HG PRO 9 4.329 13.130 0.968
57 HG3 PRO 9 2HG PRO 9 2.940 13.050 -0.174
58 HD2 PRO 9 1HD PRO 9 2.893 11.793 2.237
59 HD3 PRO 9 2HD PRO 9 2.138 11.063 0.789
60 H LEU 10 H LEU 10 5.853 11.296 2.378
61 HA LEU 10 HA LEU 10 8.553 11.843 1.648
62 HB2 LEU 10 1HB LEU 10 7.416 11.320 4.425
63 HB3 LEU 10 2HB LEU 10 8.922 12.125 4.014
64 HG LEU 10 HG LEU 10 6.099 13.141 3.532
65 HD11 LEU 10 1HD1 LEU 10 6.977 13.392 5.811
66 HD12 LEU 10 2HD1 LEU 10 8.436 14.196 5.173
67 HD13 LEU 10 3HD1 LEU 10 6.850 14.960 5.004
68 HD21 LEU 10 3HD2 LEU 10 8.728 14.349 2.578
69 HD22 LEU 10 1HD2 LEU 10 7.349 13.837 1.570
70 HD23 LEU 10 2HD2 LEU 10 7.184 15.226 2.645
71 H THR 11 H THR 11 7.029 8.917 2.997
72 HA THR 11 HA THR 11 9.644 7.538 3.098
73 HB THR 11 HB THR 11 8.145 5.896 4.430
74 HG1 THR 11 1HG THR 11 6.250 6.591 5.095
75 HG21 THR 11 3HG2 THR 11 8.656 8.696 5.503
76 HG22 THR 11 1HG2 THR 11 8.372 7.251 6.488
77 HG23 THR 11 2HG2 THR 11 9.822 7.365 5.474
78 H CYS 12 H CYS 12 6.836 7.828 1.100
79 HA CYS 12 HA CYS 12 6.818 5.017 0.397
80 HB2 CYS 12 1HB CYS 12 4.778 6.424 0.655
81 HB3 CYS 12 2HB CYS 12 5.245 7.303 -0.811
82 HA PRO 13 HA PRO 13 9.397 5.884 -3.265
83 HB2 PRO 13 1HB PRO 13 9.796 3.316 -4.138
84 HB3 PRO 13 2HB PRO 13 10.615 4.029 -2.707
85 HG2 PRO 13 1HG PRO 13 8.228 2.191 -2.779
86 HG3 PRO 13 2HG PRO 13 9.658 2.171 -1.698
87 HD2 PRO 13 1HD PRO 13 7.180 3.289 -1.049
88 HD3 PRO 13 2HD PRO 13 8.729 3.766 -0.304
89 H HIS 14 H HIS 14 6.204 5.587 -3.208
90 HA HIS 14 HA HIS 14 5.925 5.098 -6.127
91 HB2 HIS 14 1HB HIS 14 3.755 4.384 -4.209
92 HB3 HIS 14 2HB HIS 14 3.933 3.860 -5.842
93 HD1 HIS 14 1HD HIS 14 6.337 1.994 -6.031
94 HD2 HIS 14 2HD HIS 14 4.066 2.554 -2.506
95 HE1 HIS 14 1HE HIS 14 6.868 0.036 -4.467
96 HE2 HIS 14 2HE HIS 14 5.598 0.442 -2.283
97 H THR 15 H THR 15 4.871 6.662 -7.149
98 HA THR 15 HA THR 15 4.202 9.114 -5.849
99 HB THR 15 HB THR 15 3.563 9.672 -8.214
100 HG1 THR 15 1HG THR 15 2.976 7.302 -8.567
101 HG21 THR 15 3HG2 THR 15 5.956 9.719 -7.404
102 HG22 THR 15 1HG2 THR 15 6.159 8.068 -8.022
103 HG23 THR 15 2HG2 THR 15 5.808 9.390 -9.147
104 H ILE 16 H ILE 16 2.031 10.086 -5.745
105 HA ILE 16 HA ILE 16 0.077 8.367 -4.780
106 HB ILE 16 HB ILE 16 0.298 10.792 -4.328
107 HG12 ILE 16 1HG1 ILE 16 -2.545 10.025 -5.109
108 HG13 ILE 16 2HG1 ILE 16 -1.729 9.434 -3.659
109 HG21 ILE 16 1HG2 ILE 16 -1.303 11.281 -6.849
110 HG22 ILE 16 2HG2 ILE 16 -0.590 12.465 -5.753
111 HG23 ILE 16 3HG2 ILE 16 0.445 11.463 -6.767
112 HD11 ILE 16 3HD1 ILE 16 -1.419 11.794 -2.885
113 HD12 ILE 16 1HD1 ILE 16 -2.411 12.329 -4.269
114 HD13 ILE 16 2HD1 ILE 16 -3.104 11.283 -3.025
115 H SER 17 H SER 17 0.728 9.175 -8.065
116 HA SER 17 HA SER 17 -1.645 8.690 -9.411
117 HB2 SER 17 1HB SER 17 1.168 8.362 -10.054
118 HB3 SER 17 2HB SER 17 -0.119 8.355 -11.246
119 HG SER 17 HG SER 17 -0.643 10.464 -10.610
120 H VAL 18 H VAL 18 0.742 6.586 -8.009
121 HA VAL 18 HA VAL 18 -0.654 4.071 -8.776
122 HB VAL 18 HB VAL 18 1.284 3.027 -9.657
123 HG11 VAL 18 1HG1 VAL 18 1.705 4.128 -11.743
124 HG12 VAL 18 2HG1 VAL 18 0.006 4.380 -11.296
125 HG13 VAL 18 3HG1 VAL 18 1.186 5.693 -11.101
126 HG21 VAL 18 3HG2 VAL 18 3.386 4.761 -10.065
127 HG22 VAL 18 1HG2 VAL 18 2.746 5.285 -8.467
128 HG23 VAL 18 2HG2 VAL 18 3.228 3.611 -8.704
129 H VAL 19 H VAL 19 -0.664 5.471 -6.303
130 HA VAL 19 HA VAL 19 1.012 3.543 -4.795
131 HB VAL 19 HB VAL 19 1.260 6.011 -4.307
132 HG11 VAL 19 1HG1 VAL 19 -1.392 5.703 -2.849
133 HG12 VAL 19 2HG1 VAL 19 -0.399 7.161 -2.994
134 HG13 VAL 19 3HG1 VAL 19 -1.226 6.487 -4.436
135 HG21 VAL 19 3HG2 VAL 19 1.425 5.724 -1.862
136 HG22 VAL 19 1HG2 VAL 19 0.527 4.236 -1.940
137 HG23 VAL 19 2HG2 VAL 19 2.093 4.337 -2.745
138 H TRP 20 H TRP 20 -2.054 3.570 -6.001
139 HA TRP 20 HA TRP 20 -3.027 1.898 -3.725
140 HB2 TRP 20 1HB TRP 20 -4.572 3.527 -4.914
141 HB3 TRP 20 2HB TRP 20 -4.408 2.556 -6.372
142 HD1 TRP 20 HD TRP 20 -6.197 0.728 -6.615
143 HE1 TRP 20 1HE TRP 20 -7.819 -0.501 -5.077
144 HE3 TRP 20 3HE TRP 20 -4.538 2.559 -2.129
145 HZ2 TRP 20 2HZ TRP 20 -8.497 -0.461 -2.190
146 HZ3 TRP 20 3HZ TRP 20 -5.597 1.855 -0.026
147 HH2 TRP 20 HH TRP 20 -7.648 0.458 -0.068
148 H TYR 21 H TYR 21 -2.434 1.703 -7.189
149 HA TYR 21 HA TYR 21 -2.979 -1.080 -7.434
150 HB2 TYR 21 1HB TYR 21 -3.066 0.373 -9.325
151 HB3 TYR 21 2HB TYR 21 -1.428 0.922 -9.096
152 HD1 TYR 21 2HD TYR 21 0.517 -0.506 -9.739
153 HD2 TYR 21 1HD TYR 21 -3.560 -1.732 -10.484
154 HE1 TYR 21 2HE TYR 21 1.326 -2.286 -11.261
155 HE2 TYR 21 1HE TYR 21 -2.759 -3.494 -11.995
156 HH TYR 21 HH TYR 21 -0.866 -4.778 -12.464
157 H GLU 22 H GLU 22 0.057 0.588 -6.515
158 HA GLU 22 HA GLU 22 1.930 -1.378 -7.269
159 HB2 GLU 22 1HB GLU 22 3.221 0.441 -6.857
160 HB3 GLU 22 2HB GLU 22 1.742 1.169 -6.870
161 HG2 GLU 22 1HG GLU 22 3.270 0.194 -4.423
162 HG3 GLU 22 2HG GLU 22 3.008 1.765 -5.194
163 H CYS 23 H CYS 23 0.257 -0.587 -4.257
164 HA CYS 23 HA CYS 23 1.506 -2.779 -2.738
165 HB2 CYS 23 1HB CYS 23 0.243 -0.094 -2.006
166 HB3 CYS 23 2HB CYS 23 0.359 -1.389 -0.824
167 H THR 24 H THR 24 -1.293 -2.328 -4.513
168 HA THR 24 HA THR 24 -2.534 -4.276 -2.782
169 HB THR 24 HB THR 24 -4.710 -3.414 -2.942
170 HG1 THR 24 1HG THR 24 -3.649 -1.322 -4.513
171 HG21 THR 24 3HG2 THR 24 -2.899 -1.077 -2.245
172 HG22 THR 24 1HG2 THR 24 -4.596 -1.253 -1.814
173 HG23 THR 24 2HG2 THR 24 -3.395 -2.382 -1.151
174 H GLU 25 H GLU 25 -1.511 -3.717 -5.942
175 HA GLU 25 HA GLU 25 -3.192 -5.942 -7.001
176 HB2 GLU 25 1HB GLU 25 -3.599 -3.324 -7.583
177 HB3 GLU 25 2HB GLU 25 -2.297 -3.634 -8.691
178 HG2 GLU 25 1HG GLU 25 -3.978 -4.205 -10.092
179 HG3 GLU 25 2HG GLU 25 -3.831 -5.777 -9.309
180 H ASN 26 H ASN 26 -0.163 -4.186 -6.985
181 HA ASN 26 HA ASN 26 1.216 -6.116 -8.732
182 HB2 ASN 26 1HB ASN 26 1.624 -3.719 -8.982
183 HB3 ASN 26 2HB ASN 26 2.190 -3.657 -7.298
184 HD21 ASN 26 1HD2 ASN 26 4.033 -2.718 -8.531
185 HD22 ASN 26 2HD2 ASN 26 5.331 -3.798 -9.048
186 H THR 27 H THR 27 1.506 -8.059 -7.778
187 HA THR 27 HA THR 27 2.065 -8.650 -5.115
188 HB THR 27 HB THR 27 3.010 -10.769 -6.404
189 HG1 THR 27 1HG THR 27 2.822 -10.671 -8.479
190 HG21 THR 27 3HG2 THR 27 0.093 -9.874 -6.591
191 HG22 THR 27 1HG2 THR 27 0.678 -11.539 -6.736
192 HG23 THR 27 2HG2 THR 27 0.848 -10.690 -5.200
193 H ALA 28 H ALA 28 4.257 -7.312 -7.529
194 HA ALA 28 HA ALA 28 6.666 -8.232 -6.259
195 HB1 ALA 28 1HB ALA 28 6.254 -5.788 -8.020
196 HB2 ALA 28 2HB ALA 28 7.773 -6.636 -7.698
197 HB3 ALA 28 3HB ALA 28 6.501 -7.450 -8.630
198 H ASN 29 H ASN 29 4.376 -6.070 -5.001
199 HA ASN 29 HA ASN 29 6.467 -5.244 -3.055
200 HB2 ASN 29 1HB ASN 29 4.286 -3.258 -3.669
201 HB3 ASN 29 2HB ASN 29 5.785 -3.033 -2.772
202 HD21 ASN 29 1HD2 ASN 29 4.177 -2.686 -5.698
203 HD22 ASN 29 2HD2 ASN 29 5.512 -2.206 -6.748
204 H CYS 30 H CYS 30 3.022 -5.735 -3.816
205 HA CYS 30 HA CYS 30 1.958 -4.567 -1.637
206 HB2 CYS 30 1HB CYS 30 -0.128 -5.513 -2.290
207 HB3 CYS 30 2HB CYS 30 0.820 -5.218 -3.721
208 H GLY 31 H GLY 31 0.962 -5.077 0.338
209 HA2 GLY 31 1HA GLY 31 0.471 -7.210 1.790
210 HA3 GLY 31 2HA GLY 31 2.230 -7.304 1.767
211 H THR 32 H THR 32 1.420 -7.057 4.200
212 HA THR 32 HA THR 32 0.251 -4.775 5.093
213 HB THR 32 HB THR 32 2.339 -6.348 6.619
214 HG1 THR 32 1HG THR 32 0.604 -7.696 7.222
215 HG21 THR 32 3HG2 THR 32 1.234 -5.817 8.593
216 HG22 THR 32 1HG2 THR 32 1.244 -4.297 7.713
217 HG23 THR 32 2HG2 THR 32 -0.253 -5.277 7.766
218 H ALA 33 H ALA 33 3.737 -5.410 4.993
219 HA ALA 33 HA ALA 33 4.444 -2.899 6.174
220 HB1 ALA 33 1HB ALA 33 6.082 -4.887 4.575
221 HB2 ALA 33 2HB ALA 33 6.756 -3.512 5.466
222 HB3 ALA 33 3HB ALA 33 5.928 -4.809 6.341
223 H CYS 34 H CYS 34 3.816 -3.924 2.873
224 HA CYS 34 HA CYS 34 4.869 -1.685 1.444
225 HB2 CYS 34 1HB CYS 34 3.797 -3.924 0.602
226 HB3 CYS 34 2HB CYS 34 2.271 -3.070 0.723
227 H CYS 35 H CYS 35 1.620 -2.346 2.843
228 HA CYS 35 HA CYS 35 0.503 0.191 2.280
229 HB2 CYS 35 1HB CYS 35 -0.159 -1.822 4.466
230 HB3 CYS 35 2HB CYS 35 -1.119 -0.398 4.098
231 H ASP 36 H ASP 36 1.945 -0.994 5.423
232 HA ASP 36 HA ASP 36 1.619 1.446 6.773
233 HB2 ASP 36 1HB ASP 36 3.335 -0.976 7.120
234 HB3 ASP 36 2HB ASP 36 3.789 0.474 7.999
235 H SER 37 H SER 37 4.256 0.554 4.534
236 HA SER 37 HA SER 37 5.860 2.879 5.250
237 HB2 SER 37 1HB SER 37 6.008 0.824 3.018
238 HB3 SER 37 2HB SER 37 7.220 2.085 3.277
239 HG SER 37 HG SER 37 7.375 -0.168 4.330
240 H CYS 38 H CYS 38 2.974 2.739 3.474
241 HA CYS 38 HA CYS 38 3.689 5.212 2.011
242 HB2 CYS 38 1HB CYS 38 2.417 2.655 1.008
243 HB3 CYS 38 2HB CYS 38 2.154 4.188 0.206
244 H PHE 39 H PHE 39 1.489 3.623 4.144
245 HA PHE 39 HA PHE 39 -0.449 5.800 3.947
246 HB2 PHE 39 1HB PHE 39 -1.080 2.823 3.803
247 HB3 PHE 39 2HB PHE 39 -2.248 4.081 4.111
248 HD1 PHE 39 2HD PHE 39 -2.354 6.036 2.278
249 HD2 PHE 39 1HD PHE 39 -0.884 2.038 1.615
250 HE1 PHE 39 2HE PHE 39 -2.974 6.201 -0.113
251 HE2 PHE 39 1HE PHE 39 -1.552 2.179 -0.756
252 HZ PHE 39 HZ PHE 39 -2.628 4.214 -1.602
253 H GLU 40 H GLU 40 -1.345 6.197 5.960
254 HA GLU 40 HA GLU 40 -0.687 4.288 8.165
255 HB2 GLU 40 1HB GLU 40 -1.101 7.280 8.322
256 HB3 GLU 40 2HB GLU 40 -0.564 6.209 9.631
257 HG2 GLU 40 1HG GLU 40 1.498 5.750 8.293
258 HG3 GLU 40 2HG GLU 40 0.934 7.040 7.221
259 H LEU 41 H LEU 41 -2.197 4.505 10.019
260 HA LEU 41 HA LEU 41 -4.254 4.425 10.994
261 HB2 LEU 41 1HB LEU 41 -4.576 7.042 9.488
262 HB3 LEU 41 2HB LEU 41 -5.358 6.596 10.997
263 HG LEU 41 HG LEU 41 -2.375 7.064 10.574
264 HD11 LEU 41 1HD1 LEU 41 -2.633 9.029 11.944
265 HD12 LEU 41 2HD1 LEU 41 -3.714 9.120 10.554
266 HD13 LEU 41 3HD1 LEU 41 -4.366 8.707 12.162
267 HD21 LEU 41 3HD2 LEU 41 -2.691 5.360 12.310
268 HD22 LEU 41 1HD2 LEU 41 -2.192 6.887 13.034
269 HD23 LEU 41 2HD2 LEU 41 -3.902 6.383 13.120
270 H THR 42 H THR 42 -6.337 6.152 9.025
271 HA THR 42 HA THR 42 -7.902 3.738 8.519
272 HB THR 42 HB THR 42 -8.358 6.643 7.739
273 HG1 THR 42 1HG THR 42 -8.375 6.101 10.023
274 HG21 THR 42 3HG2 THR 42 -10.423 4.400 7.902
275 HG22 THR 42 1HG2 THR 42 -10.659 6.076 7.348
276 HG23 THR 42 2HG2 THR 42 -9.724 4.949 6.367
277 H GLY 43 H GLY 43 -5.568 5.677 6.606
278 HA2 GLY 43 1HA GLY 43 -6.392 4.615 4.059
279 HA3 GLY 43 2HA GLY 43 -4.879 5.463 4.426
280 H ASN 44 H ASN 44 -3.975 3.826 6.473
281 HA ASN 44 HA ASN 44 -2.638 1.668 5.247
282 HB2 ASN 44 1HB ASN 44 -1.893 2.688 7.314
283 HB3 ASN 44 2HB ASN 44 -3.315 2.098 8.172
284 HD21 ASN 44 1HD2 ASN 44 -0.412 1.135 6.381
285 HD22 ASN 44 2HD2 ASN 44 -0.228 -0.394 7.270
286 H THR 45 H THR 45 -5.482 1.760 7.392
287 HA THR 45 HA THR 45 -6.212 -0.921 7.354
288 HB THR 45 HB THR 45 -8.110 1.427 7.313
289 HG1 THR 45 1HG THR 45 -6.545 1.723 8.959
290 HG21 THR 45 3HG2 THR 45 -9.549 0.020 8.758
291 HG22 THR 45 1HG2 THR 45 -9.359 -0.602 7.117
292 HG23 THR 45 2HG2 THR 45 -8.459 -1.350 8.455
293 H MET 46 H MET 46 -7.522 1.627 5.071
294 HA MET 46 HA MET 46 -8.985 -0.192 3.503
295 HB2 MET 46 1HB MET 46 -7.853 2.475 2.734
296 HB3 MET 46 2HB MET 46 -9.031 1.522 1.827
297 HG2 MET 46 1HG MET 46 -9.372 3.057 4.339
298 HG3 MET 46 2HG MET 46 -10.451 2.736 2.994
299 HE1 MET 46 3HE MET 46 -11.798 1.719 6.805
300 HE2 MET 46 1HE MET 46 -10.212 2.478 6.591
301 HE3 MET 46 2HE MET 46 -11.631 3.144 5.761
302 H CYS 47 H CYS 47 -5.556 0.846 3.122
303 HA CYS 47 HA CYS 47 -5.023 -0.516 0.681
304 HB2 CYS 47 1HB CYS 47 -3.546 1.154 1.645
305 HB3 CYS 47 2HB CYS 47 -3.226 0.149 3.050
306 H LEU 48 H LEU 48 -4.587 -1.626 4.108
307 HA LEU 48 HA LEU 48 -3.768 -4.258 3.549
308 HB2 LEU 48 1HB LEU 48 -5.403 -3.100 5.848
309 HB3 LEU 48 2HB LEU 48 -4.790 -4.735 5.819
310 HG LEU 48 HG LEU 48 -2.977 -2.300 5.617
311 HD11 LEU 48 1HD1 LEU 48 -4.150 -2.232 7.754
312 HD12 LEU 48 2HD1 LEU 48 -3.789 -3.944 8.047
313 HD13 LEU 48 3HD1 LEU 48 -2.474 -2.751 8.015
314 HD21 LEU 48 3HD2 LEU 48 -1.965 -4.363 4.755
315 HD22 LEU 48 1HD2 LEU 48 -1.231 -3.820 6.278
316 HD23 LEU 48 2HD2 LEU 48 -2.366 -5.200 6.278
317 H LEU 49 H LEU 49 -7.060 -2.940 4.064
318 HA LEU 49 HA LEU 49 -8.402 -5.374 3.750
319 HB2 LEU 49 1HB LEU 49 -9.163 -2.659 4.122
320 HB3 LEU 49 2HB LEU 49 -9.921 -3.100 2.620
321 HG LEU 49 HG LEU 49 -10.386 -5.334 4.367
322 HD11 LEU 49 1HD1 LEU 49 -9.638 -3.777 6.181
323 HD12 LEU 49 2HD1 LEU 49 -10.985 -2.701 5.777
324 HD13 LEU 49 3HD1 LEU 49 -11.299 -4.380 6.348
325 HD21 LEU 49 3HD2 LEU 49 -12.232 -3.075 3.534
326 HD22 LEU 49 1HD2 LEU 49 -11.967 -4.632 2.715
327 HD23 LEU 49 2HD2 LEU 49 -12.735 -4.602 4.305
328 H GLN 50 H GLN 50 -7.184 -3.235 1.189
329 HA GLN 50 HA GLN 50 -8.516 -4.750 -0.908
330 HB2 GLN 50 1HB GLN 50 -7.951 -2.291 -0.966
331 HB3 GLN 50 2HB GLN 50 -6.251 -2.732 -1.067
332 HG2 GLN 50 1HG GLN 50 -7.025 -2.313 -3.313
333 HG3 GLN 50 2HG GLN 50 -6.764 -4.037 -3.149
334 HE21 GLN 50 1HE2 GLN 50 -8.194 -4.772 -4.683
335 HE22 GLN 50 2HE2 GLN 50 -9.938 -4.657 -4.529
336 H ALA 51 H ALA 51 -5.138 -4.421 0.332
337 HA ALA 51 HA ALA 51 -3.870 -6.104 -1.513
338 HB1 ALA 51 1HB ALA 51 -2.053 -6.246 0.186
339 HB2 ALA 51 2HB ALA 51 -2.654 -4.591 0.020
340 HB3 ALA 51 3HB ALA 51 -3.136 -5.575 1.412
341 H GLY 52 H GLY 52 -5.123 -6.920 1.766
342 HA2 GLY 52 1HA GLY 52 -5.057 -9.803 1.150
343 HA3 GLY 52 2HA GLY 52 -5.053 -9.061 2.749
344 H ALA 53 H ALA 53 -7.082 -8.387 -0.123
345 HA ALA 53 HA ALA 53 -9.608 -8.374 1.263
346 HB1 ALA 53 1HB ALA 53 -10.498 -8.337 -1.074
347 HB2 ALA 53 2HB ALA 53 -9.246 -7.107 -0.836
348 HB3 ALA 53 3HB ALA 53 -8.862 -8.604 -1.701
349 H ALA 54 H ALA 54 -8.779 -10.439 -1.497
350 HA ALA 54 HA ALA 54 -9.063 -12.985 -0.299
351 HB1 ALA 54 1HB ALA 54 -11.172 -13.594 -1.507
352 HB2 ALA 54 2HB ALA 54 -11.484 -12.339 -0.284
353 HB3 ALA 54 3HB ALA 54 -11.380 -11.908 -2.003
354 H GLY 55 H GLY 55 -8.609 -14.554 -1.882
355 HA2 GLY 55 1HA GLY 55 -8.110 -15.543 -3.872
356 HA3 GLY 55 2HA GLY 55 -8.636 -14.083 -4.701
357 H SER 56 H SER 56 -6.482 -12.511 -3.033
358 HA SER 56 HA SER 56 -4.718 -12.675 -5.302
359 HB2 SER 56 1HB SER 56 -5.825 -10.653 -4.057
360 HB3 SER 56 2HB SER 56 -4.382 -10.760 -3.007
361 HG SER 56 HG SER 56 -4.571 -10.429 -5.820
362 H GLY 57 H GLY 57 -2.440 -11.630 -4.534
363 HA2 GLY 57 1HA GLY 57 -0.852 -13.877 -3.466
364 HA3 GLY 57 2HA GLY 57 -0.273 -12.469 -4.329
365 H CYS 58 H CYS 58 0.170 -10.588 -3.238
366 HA CYS 58 HA CYS 58 1.382 -9.549 -1.693
367 HB2 CYS 58 1HB CYS 58 -1.363 -9.703 -0.494
368 HB3 CYS 58 2HB CYS 58 -0.171 -8.434 -0.130
369 H ASP 59 H ASP 59 1.119 -9.275 1.163
370 HA ASP 59 HA ASP 59 1.779 -11.926 2.258
371 HB2 ASP 59 1HB ASP 59 3.755 -10.120 1.297
372 HB3 ASP 59 2HB ASP 59 3.682 -9.801 3.022
373 H MET 60 H MET 60 0.547 -12.011 4.140
374 HA MET 60 HA MET 60 -0.213 -9.465 5.475
375 HB2 MET 60 1HB MET 60 -1.391 -12.241 5.742
376 HB3 MET 60 2HB MET 60 -1.867 -10.821 6.671
377 HG2 MET 60 1HG MET 60 -2.019 -9.913 4.025
378 HG3 MET 60 2HG MET 60 -2.564 -11.575 3.922
379 HE1 MET 60 3HE MET 60 -2.902 -8.805 6.748
380 HE2 MET 60 1HE MET 60 -3.298 -7.941 5.247
381 HE3 MET 60 2HE MET 60 -4.550 -8.227 6.468
382 H GLU 61 H GLU 61 2.064 -9.362 6.091
383 HA GLU 61 HA GLU 61 3.071 -10.762 8.439
384 HB2 GLU 61 1HB GLU 61 4.549 -9.316 7.111
385 HB3 GLU 61 2HB GLU 61 3.457 -7.970 7.301
386 HG2 GLU 61 1HG GLU 61 5.320 -7.620 8.732
387 HG3 GLU 61 2HG GLU 61 3.912 -7.861 9.727
Start of MODEL 11
1 H1 TYR 1 H TYR 1 -14.238 8.474 0.762
2 HA TYR 1 HA TYR 1 -12.553 9.140 2.358
3 HB2 TYR 1 1HB TYR 1 -13.401 7.773 4.239
4 HB3 TYR 1 2HB TYR 1 -12.910 6.298 3.408
5 HD1 TYR 1 2HD TYR 1 -11.667 9.512 4.854
6 HD2 TYR 1 1HD TYR 1 -10.590 5.539 3.533
7 HE1 TYR 1 2HE TYR 1 -9.371 9.853 5.692
8 HE2 TYR 1 1HE TYR 1 -8.316 5.877 4.379
9 HH TYR 1 HH TYR 1 -7.265 8.934 5.946
10 H ASN 2 H ASN 2 -10.681 9.248 1.129
11 HA ASN 2 HA ASN 2 -9.960 6.914 -0.563
12 HB2 ASN 2 1HB ASN 2 -8.766 9.720 -0.386
13 HB3 ASN 2 2HB ASN 2 -8.184 8.426 -1.427
14 HD21 ASN 2 1HD2 ASN 2 -10.387 11.028 -1.218
15 HD22 ASN 2 2HD2 ASN 2 -11.268 10.639 -2.711
16 HA PRO 3 HA PRO 3 -6.845 6.124 2.627
17 HB2 PRO 3 1HB PRO 3 -5.104 4.550 1.037
18 HB3 PRO 3 2HB PRO 3 -6.431 3.951 2.051
19 HG2 PRO 3 1HG PRO 3 -6.352 4.214 -0.864
20 HG3 PRO 3 2HG PRO 3 -7.435 3.239 0.175
21 HD2 PRO 3 1HD PRO 3 -8.117 5.630 -1.157
22 HD3 PRO 3 2HD PRO 3 -9.061 4.788 0.112
23 H GLU 4 H GLU 4 -6.232 7.514 -0.550
24 HA GLU 4 HA GLU 4 -3.669 8.601 -0.244
25 HB2 GLU 4 1HB GLU 4 -6.195 9.738 -1.495
26 HB3 GLU 4 2HB GLU 4 -4.607 10.477 -1.679
27 HG2 GLU 4 1HG GLU 4 -3.734 8.611 -2.892
28 HG3 GLU 4 2HG GLU 4 -5.112 7.600 -2.487
29 H ASP 5 H ASP 5 -6.525 9.337 1.634
30 HA ASP 5 HA ASP 5 -5.896 12.063 2.298
31 HB2 ASP 5 1HB ASP 5 -8.104 10.615 2.378
32 HB3 ASP 5 2HB ASP 5 -7.570 10.231 4.007
33 H ASP 6 H ASP 6 -4.485 9.069 3.239
34 HA ASP 6 HA ASP 6 -2.778 10.397 5.279
35 HB2 ASP 6 1HB ASP 6 -4.493 7.961 5.699
36 HB3 ASP 6 2HB ASP 6 -2.878 7.951 6.365
37 H TYR 7 H TYR 7 -2.508 9.833 2.378
38 HA TYR 7 HA TYR 7 -0.538 7.672 2.182
39 HB2 TYR 7 1HB TYR 7 -1.618 8.089 0.175
40 HB3 TYR 7 2HB TYR 7 -1.556 9.834 0.361
41 HD1 TYR 7 1HD TYR 7 0.645 6.858 -0.327
42 HD2 TYR 7 2HD TYR 7 0.065 11.090 -0.690
43 HE1 TYR 7 1HE TYR 7 2.565 6.985 -1.900
44 HE2 TYR 7 2HE TYR 7 2.003 11.259 -2.219
45 HH TYR 7 HH TYR 7 3.733 8.334 -3.394
46 H THR 8 H THR 8 1.645 7.837 2.385
47 HA THR 8 HA THR 8 2.763 10.405 3.362
48 HB THR 8 HB THR 8 4.243 8.812 4.684
49 HG1 THR 8 1HG THR 8 3.376 6.806 5.072
50 HG21 THR 8 3HG2 THR 8 2.612 8.631 6.455
51 HG22 THR 8 1HG2 THR 8 2.357 10.170 5.637
52 HG23 THR 8 2HG2 THR 8 1.252 8.811 5.331
53 HA PRO 9 HA PRO 9 4.975 9.386 -0.521
54 HB2 PRO 9 1HB PRO 9 5.926 11.950 -1.046
55 HB3 PRO 9 2HB PRO 9 4.383 11.277 -1.628
56 HG2 PRO 9 1HG PRO 9 4.864 13.104 0.707
57 HG3 PRO 9 2HG PRO 9 3.485 13.081 -0.428
58 HD2 PRO 9 1HD PRO 9 3.355 12.025 2.093
59 HD3 PRO 9 2HD PRO 9 2.445 11.321 0.725
60 H LEU 10 H LEU 10 6.159 11.000 2.368
61 HA LEU 10 HA LEU 10 8.803 11.360 1.849
62 HB2 LEU 10 1HB LEU 10 7.456 10.593 4.478
63 HB3 LEU 10 2HB LEU 10 9.138 11.082 4.325
64 HG LEU 10 HG LEU 10 8.409 13.259 3.361
65 HD11 LEU 10 1HD1 LEU 10 5.991 13.917 3.823
66 HD12 LEU 10 2HD1 LEU 10 6.337 12.891 2.439
67 HD13 LEU 10 3HD1 LEU 10 5.642 12.184 3.945
68 HD21 LEU 10 3HD2 LEU 10 7.201 12.643 6.075
69 HD22 LEU 10 1HD2 LEU 10 8.928 12.994 5.778
70 HD23 LEU 10 2HD2 LEU 10 7.707 14.238 5.487
71 H THR 11 H THR 11 7.210 8.580 3.464
72 HA THR 11 HA THR 11 9.537 6.858 3.399
73 HB THR 11 HB THR 11 7.818 5.381 4.615
74 HG1 THR 11 1HG THR 11 5.877 6.141 4.079
75 HG21 THR 11 3HG2 THR 11 8.303 8.164 5.783
76 HG22 THR 11 1HG2 THR 11 7.887 6.700 6.686
77 HG23 THR 11 2HG2 THR 11 9.445 6.807 5.849
78 H CYS 12 H CYS 12 6.957 7.561 1.208
79 HA CYS 12 HA CYS 12 6.738 4.761 0.339
80 HB2 CYS 12 1HB CYS 12 4.729 6.152 0.836
81 HB3 CYS 12 2HB CYS 12 5.118 7.134 -0.568
82 HA PRO 13 HA PRO 13 9.594 6.107 -3.010
83 HB2 PRO 13 1HB PRO 13 9.897 3.551 -4.142
84 HB3 PRO 13 2HB PRO 13 10.869 4.239 -2.808
85 HG2 PRO 13 1HG PRO 13 8.521 2.381 -2.658
86 HG3 PRO 13 2HG PRO 13 10.051 2.340 -1.729
87 HD2 PRO 13 1HD PRO 13 7.742 3.321 -0.710
88 HD3 PRO 13 2HD PRO 13 9.333 4.046 -0.298
89 H HIS 14 H HIS 14 6.366 5.569 -3.134
90 HA HIS 14 HA HIS 14 6.197 5.177 -6.087
91 HB2 HIS 14 1HB HIS 14 4.069 4.325 -4.138
92 HB3 HIS 14 2HB HIS 14 4.289 3.799 -5.809
93 HD1 HIS 14 1HD HIS 14 6.902 2.400 -6.066
94 HD2 HIS 14 2HD HIS 14 4.610 2.364 -2.495
95 HE1 HIS 14 1HE HIS 14 7.155 0.181 -4.929
96 HE2 HIS 14 2HE HIS 14 6.085 0.283 -2.646
97 H THR 15 H THR 15 4.871 6.498 -7.111
98 HA THR 15 HA THR 15 4.217 9.022 -5.914
99 HB THR 15 HB THR 15 3.343 9.490 -8.169
100 HG1 THR 15 1HG THR 15 3.894 6.725 -8.628
101 HG21 THR 15 3HG2 THR 15 5.428 9.130 -9.435
102 HG22 THR 15 1HG2 THR 15 5.796 9.569 -7.754
103 HG23 THR 15 2HG2 THR 15 5.969 7.896 -8.290
104 H ILE 16 H ILE 16 2.117 9.956 -5.545
105 HA ILE 16 HA ILE 16 -0.026 8.319 -4.741
106 HB ILE 16 HB ILE 16 0.380 10.616 -4.042
107 HG12 ILE 16 1HG1 ILE 16 -2.392 10.340 -5.260
108 HG13 ILE 16 2HG1 ILE 16 -1.846 9.465 -3.830
109 HG21 ILE 16 1HG2 ILE 16 -0.694 11.501 -6.729
110 HG22 ILE 16 2HG2 ILE 16 -0.210 12.541 -5.371
111 HG23 ILE 16 3HG2 ILE 16 1.013 11.616 -6.231
112 HD11 ILE 16 3HD1 ILE 16 -1.492 11.582 -2.630
113 HD12 ILE 16 1HD1 ILE 16 -2.042 12.498 -4.060
114 HD13 ILE 16 2HD1 ILE 16 -3.158 11.426 -3.210
115 H SER 17 H SER 17 1.085 8.994 -7.852
116 HA SER 17 HA SER 17 -1.274 8.999 -9.420
117 HB2 SER 17 1HB SER 17 1.545 9.210 -9.801
118 HB3 SER 17 2HB SER 17 1.008 7.867 -10.805
119 HG SER 17 HG SER 17 -0.496 9.228 -11.757
120 H VAL 18 H VAL 18 0.645 6.446 -7.944
121 HA VAL 18 HA VAL 18 -1.171 4.363 -9.148
122 HB VAL 18 HB VAL 18 0.676 2.944 -9.725
123 HG11 VAL 18 1HG1 VAL 18 -0.018 4.616 -11.424
124 HG12 VAL 18 2HG1 VAL 18 1.257 5.721 -10.837
125 HG13 VAL 18 3HG1 VAL 18 1.702 4.145 -11.523
126 HG21 VAL 18 3HG2 VAL 18 2.492 5.139 -8.640
127 HG22 VAL 18 1HG2 VAL 18 2.314 3.499 -7.995
128 HG23 VAL 18 2HG2 VAL 18 3.040 3.729 -9.591
129 H VAL 19 H VAL 19 0.183 5.538 -6.262
130 HA VAL 19 HA VAL 19 1.147 3.302 -5.067
131 HB VAL 19 HB VAL 19 1.421 5.535 -4.184
132 HG11 VAL 19 1HG1 VAL 19 -1.461 5.424 -3.238
133 HG12 VAL 19 2HG1 VAL 19 -0.282 6.735 -2.989
134 HG13 VAL 19 3HG1 VAL 19 -0.891 6.377 -4.614
135 HG21 VAL 19 3HG2 VAL 19 1.246 5.075 -1.808
136 HG22 VAL 19 1HG2 VAL 19 0.142 3.727 -2.110
137 HG23 VAL 19 2HG2 VAL 19 1.818 3.636 -2.681
138 H TRP 20 H TRP 20 -2.385 4.017 -5.336
139 HA TRP 20 HA TRP 20 -3.152 1.986 -3.505
140 HB2 TRP 20 1HB TRP 20 -4.667 3.706 -4.433
141 HB3 TRP 20 2HB TRP 20 -4.612 2.929 -6.008
142 HD1 TRP 20 HD TRP 20 -6.605 1.415 -6.431
143 HE1 TRP 20 1HE TRP 20 -8.313 0.124 -5.073
144 HE3 TRP 20 3HE TRP 20 -4.733 2.342 -1.748
145 HZ2 TRP 20 2HZ TRP 20 -8.801 -0.477 -2.226
146 HZ3 TRP 20 3HZ TRP 20 -5.817 1.404 0.237
147 HH2 TRP 20 HH TRP 20 -7.883 0.009 0.018
148 H TYR 21 H TYR 21 -3.150 1.697 -7.097
149 HA TYR 21 HA TYR 21 -3.274 -1.058 -7.364
150 HB2 TYR 21 1HB TYR 21 -3.446 0.228 -9.311
151 HB3 TYR 21 2HB TYR 21 -1.998 1.166 -8.959
152 HD1 TYR 21 2HD TYR 21 -3.182 -2.232 -9.957
153 HD2 TYR 21 1HD TYR 21 0.123 0.539 -9.819
154 HE1 TYR 21 2HE TYR 21 -1.829 -3.797 -11.295
155 HE2 TYR 21 1HE TYR 21 1.492 -1.020 -11.182
156 HH TYR 21 HH TYR 21 0.346 -4.241 -12.086
157 H GLU 22 H GLU 22 -0.200 0.894 -6.970
158 HA GLU 22 HA GLU 22 1.548 -1.306 -7.397
159 HB2 GLU 22 1HB GLU 22 2.955 0.454 -7.464
160 HB3 GLU 22 2HB GLU 22 1.636 1.481 -7.011
161 HG2 GLU 22 1HG GLU 22 3.232 1.967 -5.522
162 HG3 GLU 22 2HG GLU 22 2.253 0.879 -4.568
163 H CYS 23 H CYS 23 -0.290 -0.302 -4.475
164 HA CYS 23 HA CYS 23 1.500 -1.870 -2.759
165 HB2 CYS 23 1HB CYS 23 0.682 0.647 -2.518
166 HB3 CYS 23 2HB CYS 23 -0.752 -0.075 -1.830
167 H THR 24 H THR 24 -1.426 -2.215 -4.443
168 HA THR 24 HA THR 24 -2.400 -4.156 -2.449
169 HB THR 24 HB THR 24 -4.675 -3.498 -2.922
170 HG1 THR 24 1HG THR 24 -3.610 -1.378 -4.456
171 HG21 THR 24 3HG2 THR 24 -3.555 -2.282 -1.102
172 HG22 THR 24 1HG2 THR 24 -2.952 -1.055 -2.233
173 HG23 THR 24 2HG2 THR 24 -4.694 -1.221 -1.950
174 H GLU 25 H GLU 25 -1.308 -3.845 -5.635
175 HA GLU 25 HA GLU 25 -2.748 -6.303 -6.488
176 HB2 GLU 25 1HB GLU 25 -3.556 -3.769 -7.032
177 HB3 GLU 25 2HB GLU 25 -2.419 -3.948 -8.345
178 HG2 GLU 25 1HG GLU 25 -3.655 -5.717 -9.339
179 HG3 GLU 25 2HG GLU 25 -4.509 -6.079 -7.832
180 H ASN 26 H ASN 26 0.002 -4.125 -6.937
181 HA ASN 26 HA ASN 26 1.373 -5.876 -8.865
182 HB2 ASN 26 1HB ASN 26 1.693 -3.477 -9.007
183 HB3 ASN 26 2HB ASN 26 2.210 -3.420 -7.313
184 HD21 ASN 26 1HD2 ASN 26 4.082 -2.253 -8.284
185 HD22 ASN 26 2HD2 ASN 26 5.413 -3.242 -8.860
186 H THR 27 H THR 27 1.683 -7.904 -7.887
187 HA THR 27 HA THR 27 2.216 -8.271 -5.166
188 HB THR 27 HB THR 27 2.472 -10.590 -5.674
189 HG1 THR 27 1HG THR 27 3.100 -11.263 -7.454
190 HG21 THR 27 3HG2 THR 27 0.355 -11.032 -6.781
191 HG22 THR 27 1HG2 THR 27 0.187 -9.623 -5.714
192 HG23 THR 27 2HG2 THR 27 0.310 -9.404 -7.471
193 H ALA 28 H ALA 28 4.516 -7.283 -7.480
194 HA ALA 28 HA ALA 28 6.881 -8.300 -6.272
195 HB1 ALA 28 1HB ALA 28 6.771 -7.040 -8.444
196 HB2 ALA 28 2HB ALA 28 6.445 -5.549 -7.520
197 HB3 ALA 28 3HB ALA 28 7.985 -6.412 -7.306
198 H ASN 29 H ASN 29 4.645 -5.767 -5.235
199 HA ASN 29 HA ASN 29 6.503 -5.089 -2.975
200 HB2 ASN 29 1HB ASN 29 4.577 -3.207 -4.355
201 HB3 ASN 29 2HB ASN 29 5.708 -2.807 -3.070
202 HD21 ASN 29 1HD2 ASN 29 5.415 -1.705 -5.769
203 HD22 ASN 29 2HD2 ASN 29 6.829 -2.049 -6.726
204 H CYS 30 H CYS 30 3.091 -5.490 -4.029
205 HA CYS 30 HA CYS 30 1.969 -4.148 -1.934
206 HB2 CYS 30 1HB CYS 30 -0.111 -5.134 -2.618
207 HB3 CYS 30 2HB CYS 30 0.849 -4.723 -4.035
208 H GLY 31 H GLY 31 0.369 -4.987 -0.311
209 HA2 GLY 31 1HA GLY 31 -0.220 -6.903 1.164
210 HA3 GLY 31 2HA GLY 31 1.490 -7.320 1.168
211 H THR 32 H THR 32 1.004 -7.210 3.478
212 HA THR 32 HA THR 32 0.195 -4.882 4.829
213 HB THR 32 HB THR 32 1.806 -7.273 5.789
214 HG1 THR 32 1HG THR 32 -0.521 -7.183 4.948
215 HG21 THR 32 3HG2 THR 32 2.148 -5.441 7.421
216 HG22 THR 32 1HG2 THR 32 0.391 -5.186 7.504
217 HG23 THR 32 2HG2 THR 32 1.096 -6.717 8.052
218 H ALA 33 H ALA 33 3.576 -5.846 4.044
219 HA ALA 33 HA ALA 33 4.688 -3.662 5.587
220 HB1 ALA 33 1HB ALA 33 6.808 -4.346 4.448
221 HB2 ALA 33 2HB ALA 33 5.960 -5.712 5.195
222 HB3 ALA 33 3HB ALA 33 5.887 -5.458 3.428
223 H CYS 34 H CYS 34 3.421 -3.883 2.299
224 HA CYS 34 HA CYS 34 4.768 -1.412 1.450
225 HB2 CYS 34 1HB CYS 34 3.976 -2.954 -0.238
226 HB3 CYS 34 2HB CYS 34 2.303 -2.797 0.317
227 H CYS 35 H CYS 35 1.475 -2.331 2.575
228 HA CYS 35 HA CYS 35 0.357 0.222 2.504
229 HB2 CYS 35 1HB CYS 35 -0.218 -2.112 4.368
230 HB3 CYS 35 2HB CYS 35 -1.241 -0.686 4.225
231 H ASP 36 H ASP 36 2.126 -1.331 5.199
232 HA ASP 36 HA ASP 36 1.837 0.870 7.015
233 HB2 ASP 36 1HB ASP 36 2.191 -1.652 7.405
234 HB3 ASP 36 2HB ASP 36 3.903 -1.341 7.092
235 H SER 37 H SER 37 3.742 0.745 4.264
236 HA SER 37 HA SER 37 5.668 2.738 5.364
237 HB2 SER 37 1HB SER 37 5.776 0.817 3.017
238 HB3 SER 37 2HB SER 37 6.777 2.279 3.062
239 HG SER 37 HG SER 37 7.589 1.643 5.054
240 H CYS 38 H CYS 38 2.838 2.515 3.418
241 HA CYS 38 HA CYS 38 3.525 5.088 2.059
242 HB2 CYS 38 1HB CYS 38 2.212 2.549 1.065
243 HB3 CYS 38 2HB CYS 38 2.003 4.082 0.237
244 H PHE 39 H PHE 39 1.293 3.643 4.229
245 HA PHE 39 HA PHE 39 -0.556 5.880 3.857
246 HB2 PHE 39 1HB PHE 39 -1.235 2.898 3.816
247 HB3 PHE 39 2HB PHE 39 -2.405 4.163 4.092
248 HD1 PHE 39 1HD PHE 39 -2.587 6.034 2.227
249 HD2 PHE 39 2HD PHE 39 -0.901 2.116 1.608
250 HE1 PHE 39 1HE PHE 39 -3.111 6.172 -0.195
251 HE2 PHE 39 2HE PHE 39 -1.470 2.228 -0.787
252 HZ PHE 39 HZ PHE 39 -2.606 4.249 -1.679
253 H GLU 40 H GLU 40 -1.703 6.282 5.812
254 HA GLU 40 HA GLU 40 -0.862 4.684 8.191
255 HB2 GLU 40 1HB GLU 40 -1.216 7.681 8.090
256 HB3 GLU 40 2HB GLU 40 -0.620 6.717 9.432
257 HG2 GLU 40 1HG GLU 40 1.249 5.910 7.854
258 HG3 GLU 40 2HG GLU 40 0.735 7.268 6.820
259 H LEU 41 H LEU 41 -2.258 5.016 10.015
260 HA LEU 41 HA LEU 41 -4.290 4.663 11.011
261 HB2 LEU 41 1HB LEU 41 -4.709 7.313 9.619
262 HB3 LEU 41 2HB LEU 41 -5.555 6.777 11.078
263 HG LEU 41 HG LEU 41 -2.537 7.228 10.871
264 HD11 LEU 41 1HD1 LEU 41 -2.925 9.262 12.142
265 HD12 LEU 41 2HD1 LEU 41 -3.733 9.292 10.574
266 HD13 LEU 41 3HD1 LEU 41 -4.691 9.002 12.050
267 HD21 LEU 41 3HD2 LEU 41 -3.028 5.609 12.609
268 HD22 LEU 41 1HD2 LEU 41 -2.617 7.152 13.352
269 HD23 LEU 41 2HD2 LEU 41 -4.321 6.643 13.275
270 H THR 42 H THR 42 -6.550 6.339 9.109
271 HA THR 42 HA THR 42 -8.001 3.900 8.644
272 HB THR 42 HB THR 42 -8.533 6.491 7.191
273 HG1 THR 42 1HG THR 42 -8.321 7.169 9.215
274 HG21 THR 42 3HG2 THR 42 -9.900 4.470 6.625
275 HG22 THR 42 1HG2 THR 42 -10.406 4.381 8.322
276 HG23 THR 42 2HG2 THR 42 -10.873 5.760 7.306
277 H GLY 43 H GLY 43 -5.857 5.933 6.574
278 HA2 GLY 43 1HA GLY 43 -6.501 4.720 4.096
279 HA3 GLY 43 2HA GLY 43 -5.017 5.619 4.479
280 H ASN 44 H ASN 44 -4.057 4.062 6.542
281 HA ASN 44 HA ASN 44 -2.659 1.921 5.322
282 HB2 ASN 44 1HB ASN 44 -1.871 3.008 7.340
283 HB3 ASN 44 2HB ASN 44 -3.264 2.460 8.257
284 HD21 ASN 44 1HD2 ASN 44 -0.383 1.427 6.479
285 HD22 ASN 44 2HD2 ASN 44 -0.176 -0.063 7.389
286 H THR 45 H THR 45 -5.513 1.960 7.449
287 HA THR 45 HA THR 45 -5.927 -0.816 7.529
288 HB THR 45 HB THR 45 -8.111 1.272 7.677
289 HG1 THR 45 1HG THR 45 -6.291 1.833 9.083
290 HG21 THR 45 3HG2 THR 45 -8.870 -1.091 7.790
291 HG22 THR 45 1HG2 THR 45 -7.747 -1.370 9.141
292 HG23 THR 45 2HG2 THR 45 -9.112 -0.253 9.328
293 H MET 46 H MET 46 -7.391 1.615 5.227
294 HA MET 46 HA MET 46 -8.889 -0.415 3.848
295 HB2 MET 46 1HB MET 46 -8.054 2.346 2.851
296 HB3 MET 46 2HB MET 46 -9.073 1.200 1.984
297 HG2 MET 46 1HG MET 46 -10.552 1.124 4.080
298 HG3 MET 46 2HG MET 46 -9.688 2.574 4.609
299 HE1 MET 46 3HE MET 46 -12.848 2.252 4.202
300 HE2 MET 46 1HE MET 46 -12.085 3.752 4.775
301 HE3 MET 46 2HE MET 46 -13.252 3.801 3.431
302 H CYS 47 H CYS 47 -5.575 0.861 3.335
303 HA CYS 47 HA CYS 47 -5.039 -0.561 0.913
304 HB2 CYS 47 1HB CYS 47 -3.611 1.220 1.815
305 HB3 CYS 47 2HB CYS 47 -3.179 0.213 3.192
306 H LEU 48 H LEU 48 -4.566 -1.506 4.357
307 HA LEU 48 HA LEU 48 -3.639 -4.118 3.858
308 HB2 LEU 48 1HB LEU 48 -5.188 -2.877 6.168
309 HB3 LEU 48 2HB LEU 48 -4.656 -4.543 6.188
310 HG LEU 48 HG LEU 48 -2.763 -2.173 5.825
311 HD11 LEU 48 1HD1 LEU 48 -2.122 -2.491 8.151
312 HD12 LEU 48 2HD1 LEU 48 -3.831 -2.097 8.051
313 HD13 LEU 48 3HD1 LEU 48 -3.298 -3.796 8.344
314 HD21 LEU 48 3HD2 LEU 48 -1.860 -4.287 4.950
315 HD22 LEU 48 1HD2 LEU 48 -1.008 -3.755 6.402
316 HD23 LEU 48 2HD2 LEU 48 -2.187 -5.085 6.505
317 H LEU 49 H LEU 49 -6.984 -2.942 4.265
318 HA LEU 49 HA LEU 49 -8.311 -5.368 3.931
319 HB2 LEU 49 1HB LEU 49 -9.078 -2.633 3.889
320 HB3 LEU 49 2HB LEU 49 -9.632 -3.271 2.358
321 HG LEU 49 HG LEU 49 -10.579 -5.266 3.844
322 HD11 LEU 49 1HD1 LEU 49 -11.268 -4.471 6.083
323 HD12 LEU 49 2HD1 LEU 49 -9.498 -4.461 5.944
324 HD13 LEU 49 3HD1 LEU 49 -10.404 -2.942 5.836
325 HD21 LEU 49 3HD2 LEU 49 -12.697 -4.063 4.120
326 HD22 LEU 49 1HD2 LEU 49 -11.886 -2.512 3.818
327 HD23 LEU 49 2HD2 LEU 49 -11.992 -3.756 2.534
328 H GLN 50 H GLN 50 -7.389 -3.161 1.177
329 HA GLN 50 HA GLN 50 -8.326 -5.036 -0.792
330 HB2 GLN 50 1HB GLN 50 -8.103 -2.507 -1.013
331 HB3 GLN 50 2HB GLN 50 -6.363 -2.729 -1.120
332 HG2 GLN 50 1HG GLN 50 -7.046 -2.554 -3.353
333 HG3 GLN 50 2HG GLN 50 -6.873 -4.294 -3.155
334 HE21 GLN 50 1HE2 GLN 50 -8.739 -5.582 -3.659
335 HE22 GLN 50 2HE2 GLN 50 -10.308 -4.901 -3.907
336 H ALA 51 H ALA 51 -4.984 -4.272 0.379
337 HA ALA 51 HA ALA 51 -3.703 -6.033 -1.490
338 HB1 ALA 51 1HB ALA 51 -2.749 -5.180 1.293
339 HB2 ALA 51 2HB ALA 51 -1.764 -5.791 -0.057
340 HB3 ALA 51 3HB ALA 51 -2.549 -4.208 -0.175
341 H GLY 52 H GLY 52 -4.851 -6.452 1.882
342 HA2 GLY 52 1HA GLY 52 -4.065 -9.231 2.077
343 HA3 GLY 52 2HA GLY 52 -4.937 -8.242 3.267
344 H ALA 53 H ALA 53 -5.729 -8.838 -0.115
345 HA ALA 53 HA ALA 53 -8.447 -9.768 0.284
346 HB1 ALA 53 1HB ALA 53 -7.691 -8.410 -1.631
347 HB2 ALA 53 2HB ALA 53 -6.533 -9.717 -2.060
348 HB3 ALA 53 3HB ALA 53 -8.294 -9.979 -2.179
349 H ALA 54 H ALA 54 -6.240 -11.307 1.442
350 HA ALA 54 HA ALA 54 -5.582 -13.277 2.039
351 HB1 ALA 54 1HB ALA 54 -6.514 -15.326 1.291
352 HB2 ALA 54 2HB ALA 54 -7.817 -14.131 1.516
353 HB3 ALA 54 3HB ALA 54 -7.259 -14.541 -0.128
354 H GLY 55 H GLY 55 -4.211 -14.954 1.257
355 HA2 GLY 55 1HA GLY 55 -2.031 -13.979 -0.280
356 HA3 GLY 55 2HA GLY 55 -2.191 -15.601 0.376
357 H SER 56 H SER 56 -4.335 -14.038 -2.037
358 HA SER 56 HA SER 56 -3.822 -16.084 -4.065
359 HB2 SER 56 1HB SER 56 -5.413 -13.486 -4.148
360 HB3 SER 56 2HB SER 56 -5.510 -14.830 -5.307
361 HG SER 56 HG SER 56 -7.169 -14.728 -3.581
362 H GLY 57 H GLY 57 -3.368 -12.486 -3.653
363 HA2 GLY 57 1HA GLY 57 -1.228 -12.567 -5.709
364 HA3 GLY 57 2HA GLY 57 -2.190 -11.180 -5.228
365 H CYS 58 H CYS 58 -1.782 -10.188 -3.180
366 HA CYS 58 HA CYS 58 0.983 -9.899 -2.491
367 HB2 CYS 58 1HB CYS 58 -1.419 -9.008 -0.871
368 HB3 CYS 58 2HB CYS 58 0.166 -8.264 -0.950
369 H ASP 59 H ASP 59 1.341 -9.758 0.080
370 HA ASP 59 HA ASP 59 0.317 -12.206 1.455
371 HB2 ASP 59 1HB ASP 59 2.668 -12.505 1.083
372 HB3 ASP 59 2HB ASP 59 3.009 -10.835 1.556
373 H MET 60 H MET 60 -0.636 -11.834 3.455
374 HA MET 60 HA MET 60 -0.155 -9.277 4.748
375 HB2 MET 60 1HB MET 60 -2.437 -8.876 5.299
376 HB3 MET 60 2HB MET 60 -2.375 -9.096 3.554
377 HG2 MET 60 1HG MET 60 -3.209 -11.197 5.609
378 HG3 MET 60 2HG MET 60 -4.314 -10.206 4.688
379 HE1 MET 60 3HE MET 60 -3.988 -14.260 3.679
380 HE2 MET 60 1HE MET 60 -3.346 -13.503 5.154
381 HE3 MET 60 2HE MET 60 -5.014 -13.175 4.644
382 H GLU 61 H GLU 61 -0.812 -9.348 7.029
383 HA GLU 61 HA GLU 61 -0.367 -12.016 8.279
384 HB2 GLU 61 1HB GLU 61 0.300 -9.151 9.073
385 HB3 GLU 61 2HB GLU 61 0.320 -10.488 10.237
386 HG2 GLU 61 1HG GLU 61 2.044 -10.327 7.715
387 HG3 GLU 61 2HG GLU 61 2.558 -9.849 9.328
Start of MODEL 12
1 H1 TYR 1 H TYR 1 -13.997 8.221 1.919
2 HA TYR 1 HA TYR 1 -12.543 9.601 4.073
3 HB2 TYR 1 1HB TYR 1 -13.098 7.499 5.002
4 HB3 TYR 1 2HB TYR 1 -12.701 6.636 3.503
5 HD1 TYR 1 1HD TYR 1 -10.968 9.226 5.688
6 HD2 TYR 1 2HD TYR 1 -10.642 5.395 3.646
7 HE1 TYR 1 1HE TYR 1 -8.538 9.303 5.905
8 HE2 TYR 1 2HE TYR 1 -8.235 5.463 3.955
9 HH TYR 1 HH TYR 1 -6.487 8.137 5.552
10 H ASN 2 H ASN 2 -11.768 7.340 1.333
11 HA ASN 2 HA ASN 2 -10.238 7.386 -0.261
12 HB2 ASN 2 1HB ASN 2 -10.587 10.254 0.093
13 HB3 ASN 2 2HB ASN 2 -8.929 9.884 -0.223
14 HD21 ASN 2 1HD2 ASN 2 -8.929 10.839 -2.246
15 HD22 ASN 2 2HD2 ASN 2 -9.822 10.171 -3.598
16 HA PRO 3 HA PRO 3 -6.888 6.435 2.595
17 HB2 PRO 3 1HB PRO 3 -5.356 5.115 0.579
18 HB3 PRO 3 2HB PRO 3 -6.392 4.398 1.862
19 HG2 PRO 3 1HG PRO 3 -6.913 4.646 -1.031
20 HG3 PRO 3 2HG PRO 3 -7.750 3.658 0.188
21 HD2 PRO 3 1HD PRO 3 -8.751 5.997 -0.956
22 HD3 PRO 3 2HD PRO 3 -9.337 5.168 0.514
23 H GLU 4 H GLU 4 -6.546 8.039 -0.510
24 HA GLU 4 HA GLU 4 -3.869 8.882 -0.263
25 HB2 GLU 4 1HB GLU 4 -6.294 9.974 -1.754
26 HB3 GLU 4 2HB GLU 4 -4.670 10.626 -1.958
27 HG2 GLU 4 1HG GLU 4 -3.812 8.543 -2.818
28 HG3 GLU 4 2HG GLU 4 -5.254 7.656 -2.323
29 H ASP 5 H ASP 5 -6.558 9.899 1.726
30 HA ASP 5 HA ASP 5 -5.556 12.529 2.404
31 HB2 ASP 5 1HB ASP 5 -7.707 10.796 3.258
32 HB3 ASP 5 2HB ASP 5 -6.815 11.275 4.675
33 H ASP 6 H ASP 6 -4.553 9.253 3.233
34 HA ASP 6 HA ASP 6 -2.594 10.224 5.306
35 HB2 ASP 6 1HB ASP 6 -4.167 7.640 5.205
36 HB3 ASP 6 2HB ASP 6 -2.796 7.947 6.260
37 H TYR 7 H TYR 7 -2.468 9.872 2.287
38 HA TYR 7 HA TYR 7 -0.516 7.784 1.784
39 HB2 TYR 7 1HB TYR 7 -1.678 8.613 -0.083
40 HB3 TYR 7 2HB TYR 7 -1.386 10.300 0.348
41 HD1 TYR 7 2HD TYR 7 0.605 7.185 -0.424
42 HD2 TYR 7 1HD TYR 7 0.217 11.459 -0.890
43 HE1 TYR 7 2HE TYR 7 2.574 7.205 -1.936
44 HE2 TYR 7 1HE TYR 7 2.203 11.498 -2.324
45 HH TYR 7 HH TYR 7 3.962 8.484 -3.289
46 H THR 8 H THR 8 1.652 7.830 2.353
47 HA THR 8 HA THR 8 2.798 10.385 3.367
48 HB THR 8 HB THR 8 4.239 8.784 4.718
49 HG1 THR 8 1HG THR 8 3.231 6.769 5.103
50 HG21 THR 8 3HG2 THR 8 1.233 8.726 5.270
51 HG22 THR 8 1HG2 THR 8 2.563 8.604 6.450
52 HG23 THR 8 2HG2 THR 8 2.295 10.117 5.597
53 HA PRO 9 HA PRO 9 5.126 9.471 -0.494
54 HB2 PRO 9 1HB PRO 9 6.068 12.065 -0.929
55 HB3 PRO 9 2HB PRO 9 4.523 11.408 -1.539
56 HG2 PRO 9 1HG PRO 9 5.029 13.095 0.917
57 HG3 PRO 9 2HG PRO 9 3.702 13.219 -0.269
58 HD2 PRO 9 1HD PRO 9 3.376 12.009 2.147
59 HD3 PRO 9 2HD PRO 9 2.548 11.386 0.691
60 H LEU 10 H LEU 10 6.227 11.320 2.384
61 HA LEU 10 HA LEU 10 8.887 11.419 2.158
62 HB2 LEU 10 1HB LEU 10 7.125 10.712 4.542
63 HB3 LEU 10 2HB LEU 10 8.869 10.871 4.678
64 HG LEU 10 HG LEU 10 8.710 13.162 3.678
65 HD11 LEU 10 1HD1 LEU 10 6.499 14.346 3.924
66 HD12 LEU 10 2HD1 LEU 10 6.620 13.226 2.582
67 HD13 LEU 10 3HD1 LEU 10 5.724 12.757 4.063
68 HD21 LEU 10 3HD2 LEU 10 7.176 12.763 6.286
69 HD22 LEU 10 1HD2 LEU 10 8.944 12.751 6.128
70 HD23 LEU 10 2HD2 LEU 10 8.043 14.231 5.780
71 H THR 11 H THR 11 7.097 8.511 3.442
72 HA THR 11 HA THR 11 9.526 6.904 3.336
73 HB THR 11 HB THR 11 7.782 5.295 4.449
74 HG1 THR 11 1HG THR 11 5.879 6.261 4.121
75 HG21 THR 11 3HG2 THR 11 8.069 6.467 6.614
76 HG22 THR 11 1HG2 THR 11 9.566 6.418 5.678
77 HG23 THR 11 2HG2 THR 11 8.631 7.919 5.744
78 H CYS 12 H CYS 12 7.003 7.585 1.139
79 HA CYS 12 HA CYS 12 6.716 4.814 0.300
80 HB2 CYS 12 1HB CYS 12 4.807 6.367 0.676
81 HB3 CYS 12 2HB CYS 12 5.288 7.241 -0.772
82 HA PRO 13 HA PRO 13 9.504 5.643 -3.237
83 HB2 PRO 13 1HB PRO 13 9.735 3.032 -4.106
84 HB3 PRO 13 2HB PRO 13 10.657 3.726 -2.762
85 HG2 PRO 13 1HG PRO 13 8.268 1.932 -2.698
86 HG3 PRO 13 2HG PRO 13 9.660 2.017 -1.565
87 HD2 PRO 13 1HD PRO 13 7.117 3.144 -1.161
88 HD3 PRO 13 2HD PRO 13 8.601 3.566 -0.274
89 H HIS 14 H HIS 14 6.354 5.594 -3.249
90 HA HIS 14 HA HIS 14 5.969 4.969 -6.129
91 HB2 HIS 14 1HB HIS 14 3.835 4.277 -4.117
92 HB3 HIS 14 2HB HIS 14 4.046 3.667 -5.765
93 HD1 HIS 14 1HD HIS 14 6.356 1.993 -6.020
94 HD2 HIS 14 2HD HIS 14 4.301 2.397 -2.384
95 HE1 HIS 14 1HE HIS 14 6.682 -0.086 -4.762
96 HE2 HIS 14 2HE HIS 14 5.708 0.241 -2.384
97 H THR 15 H THR 15 4.665 6.444 -7.159
98 HA THR 15 HA THR 15 4.312 8.953 -5.799
99 HB THR 15 HB THR 15 3.704 9.694 -8.041
100 HG1 THR 15 1HG THR 15 4.144 7.566 -9.533
101 HG21 THR 15 3HG2 THR 15 6.150 9.171 -7.395
102 HG22 THR 15 1HG2 THR 15 6.008 7.702 -8.342
103 HG23 THR 15 2HG2 THR 15 5.805 9.281 -9.135
104 H ILE 16 H ILE 16 2.183 10.103 -5.708
105 HA ILE 16 HA ILE 16 0.147 8.480 -4.656
106 HB ILE 16 HB ILE 16 0.479 10.860 -4.165
107 HG12 ILE 16 1HG1 ILE 16 -2.349 10.203 -5.093
108 HG13 ILE 16 2HG1 ILE 16 -1.628 9.631 -3.599
109 HG21 ILE 16 1HG2 ILE 16 0.786 11.625 -6.586
110 HG22 ILE 16 2HG2 ILE 16 -0.996 11.531 -6.732
111 HG23 ILE 16 3HG2 ILE 16 -0.238 12.632 -5.578
112 HD11 ILE 16 3HD1 ILE 16 -1.417 11.924 -2.772
113 HD12 ILE 16 1HD1 ILE 16 -2.112 12.560 -4.297
114 HD13 ILE 16 2HD1 ILE 16 -3.081 11.536 -3.231
115 H SER 17 H SER 17 0.918 9.096 -7.931
116 HA SER 17 HA SER 17 -1.587 8.645 -9.229
117 HB2 SER 17 1HB SER 17 0.526 9.662 -10.201
118 HB3 SER 17 2HB SER 17 1.258 8.064 -10.143
119 HG SER 17 HG SER 17 -1.204 8.317 -11.467
120 H VAL 18 H VAL 18 1.039 6.539 -8.029
121 HA VAL 18 HA VAL 18 -0.525 4.119 -8.735
122 HB VAL 18 HB VAL 18 1.334 3.086 -9.743
123 HG11 VAL 18 1HG1 VAL 18 1.595 4.324 -11.782
124 HG12 VAL 18 2HG1 VAL 18 -0.051 4.576 -11.196
125 HG13 VAL 18 3HG1 VAL 18 1.174 5.858 -11.003
126 HG21 VAL 18 3HG2 VAL 18 3.402 4.884 -10.139
127 HG22 VAL 18 1HG2 VAL 18 2.837 5.310 -8.490
128 HG23 VAL 18 2HG2 VAL 18 3.298 3.650 -8.833
129 H VAL 19 H VAL 19 -0.532 5.198 -6.233
130 HA VAL 19 HA VAL 19 1.383 3.447 -4.755
131 HB VAL 19 HB VAL 19 1.432 5.659 -4.075
132 HG11 VAL 19 1HG1 VAL 19 -1.508 5.523 -3.209
133 HG12 VAL 19 2HG1 VAL 19 -0.410 6.869 -2.942
134 HG13 VAL 19 3HG1 VAL 19 -0.895 6.444 -4.581
135 HG21 VAL 19 3HG2 VAL 19 0.185 3.936 -1.922
136 HG22 VAL 19 1HG2 VAL 19 1.868 3.922 -2.433
137 HG23 VAL 19 2HG2 VAL 19 1.197 5.360 -1.659
138 H TRP 20 H TRP 20 -2.219 3.976 -4.755
139 HA TRP 20 HA TRP 20 -2.889 1.990 -2.941
140 HB2 TRP 20 1HB TRP 20 -4.473 3.583 -3.733
141 HB3 TRP 20 2HB TRP 20 -4.337 3.015 -5.384
142 HD1 TRP 20 HD TRP 20 -5.853 0.981 -6.088
143 HE1 TRP 20 1HE TRP 20 -7.639 -0.431 -4.947
144 HE3 TRP 20 3HE TRP 20 -5.027 2.484 -1.293
145 HZ2 TRP 20 2HZ TRP 20 -8.740 -0.712 -2.225
146 HZ3 TRP 20 3HZ TRP 20 -6.434 1.642 0.550
147 HH2 TRP 20 HH TRP 20 -8.385 0.173 0.085
148 H TYR 21 H TYR 21 -3.284 1.479 -6.459
149 HA TYR 21 HA TYR 21 -3.519 -1.291 -6.413
150 HB2 TYR 21 1HB TYR 21 -4.086 -0.543 -8.437
151 HB3 TYR 21 2HB TYR 21 -2.957 0.783 -8.444
152 HD1 TYR 21 1HD TYR 21 -0.525 0.421 -9.085
153 HD2 TYR 21 2HD TYR 21 -3.542 -2.615 -9.519
154 HE1 TYR 21 1HE TYR 21 1.061 -0.957 -10.408
155 HE2 TYR 21 2HE TYR 21 -2.024 -3.974 -10.862
156 HH TYR 21 HH TYR 21 0.191 -4.259 -11.455
157 H GLU 22 H GLU 22 -0.419 0.653 -6.348
158 HA GLU 22 HA GLU 22 1.228 -1.522 -7.163
159 HB2 GLU 22 1HB GLU 22 2.542 0.370 -7.372
160 HB3 GLU 22 2HB GLU 22 1.267 1.244 -6.588
161 HG2 GLU 22 1HG GLU 22 3.235 1.653 -5.521
162 HG3 GLU 22 2HG GLU 22 2.355 0.675 -4.357
163 H CYS 23 H CYS 23 -0.209 -0.498 -3.984
164 HA CYS 23 HA CYS 23 1.563 -2.417 -2.633
165 HB2 CYS 23 1HB CYS 23 -0.002 -0.051 -1.625
166 HB3 CYS 23 2HB CYS 23 0.572 -1.326 -0.544
167 H THR 24 H THR 24 -1.478 -2.405 -4.103
168 HA THR 24 HA THR 24 -2.460 -4.353 -2.121
169 HB THR 24 HB THR 24 -4.708 -3.728 -2.765
170 HG1 THR 24 1HG THR 24 -4.336 -3.025 -4.848
171 HG21 THR 24 3HG2 THR 24 -3.023 -1.319 -1.935
172 HG22 THR 24 1HG2 THR 24 -4.780 -1.441 -1.796
173 HG23 THR 24 2HG2 THR 24 -3.730 -2.544 -0.881
174 H GLU 25 H GLU 25 -1.272 -4.112 -5.293
175 HA GLU 25 HA GLU 25 -2.720 -6.540 -6.185
176 HB2 GLU 25 1HB GLU 25 -3.764 -4.111 -6.588
177 HB3 GLU 25 2HB GLU 25 -2.571 -4.003 -7.847
178 HG2 GLU 25 1HG GLU 25 -3.630 -5.498 -9.215
179 HG3 GLU 25 2HG GLU 25 -4.192 -6.499 -7.870
180 H ASN 26 H ASN 26 -0.186 -4.089 -6.812
181 HA ASN 26 HA ASN 26 1.169 -5.686 -8.828
182 HB2 ASN 26 1HB ASN 26 1.406 -3.251 -8.788
183 HB3 ASN 26 2HB ASN 26 2.173 -3.377 -7.193
184 HD21 ASN 26 1HD2 ASN 26 4.030 -2.350 -7.973
185 HD22 ASN 26 2HD2 ASN 26 5.153 -3.205 -9.060
186 H THR 27 H THR 27 1.531 -7.655 -8.006
187 HA THR 27 HA THR 27 2.510 -8.353 -5.450
188 HB THR 27 HB THR 27 2.904 -10.560 -6.536
189 HG1 THR 27 1HG THR 27 1.957 -9.192 -8.878
190 HG21 THR 27 3HG2 THR 27 0.213 -9.334 -7.329
191 HG22 THR 27 1HG2 THR 27 0.582 -11.013 -6.909
192 HG23 THR 27 2HG2 THR 27 0.645 -9.745 -5.671
193 H ALA 28 H ALA 28 4.297 -6.717 -7.778
194 HA ALA 28 HA ALA 28 6.939 -7.764 -7.291
195 HB1 ALA 28 1HB ALA 28 6.389 -6.116 -9.093
196 HB2 ALA 28 2HB ALA 28 5.981 -4.926 -7.821
197 HB3 ALA 28 3HB ALA 28 7.635 -5.489 -7.979
198 H ASN 29 H ASN 29 4.661 -5.831 -5.320
199 HA ASN 29 HA ASN 29 6.698 -5.836 -3.181
200 HB2 ASN 29 1HB ASN 29 5.071 -3.309 -3.554
201 HB3 ASN 29 2HB ASN 29 6.551 -3.568 -2.670
202 HD21 ASN 29 1HD2 ASN 29 5.230 -2.151 -5.395
203 HD22 ASN 29 2HD2 ASN 29 6.522 -2.258 -6.552
204 H CYS 30 H CYS 30 3.556 -4.276 -3.389
205 HA CYS 30 HA CYS 30 1.985 -4.165 -1.822
206 HB2 CYS 30 1HB CYS 30 0.199 -5.618 -2.339
207 HB3 CYS 30 2HB CYS 30 1.080 -5.180 -3.791
208 H GLY 31 H GLY 31 0.390 -5.761 -0.362
209 HA2 GLY 31 1HA GLY 31 0.279 -7.070 1.576
210 HA3 GLY 31 2HA GLY 31 2.024 -7.286 1.552
211 H THR 32 H THR 32 1.088 -6.888 3.934
212 HA THR 32 HA THR 32 0.207 -4.505 4.816
213 HB THR 32 HB THR 32 1.985 -6.507 6.248
214 HG1 THR 32 1HG THR 32 -0.427 -6.690 7.072
215 HG21 THR 32 3HG2 THR 32 1.850 -4.274 7.489
216 HG22 THR 32 1HG2 THR 32 0.100 -4.509 7.547
217 HG23 THR 32 2HG2 THR 32 1.178 -5.659 8.338
218 H ALA 33 H ALA 33 3.763 -5.177 4.468
219 HA ALA 33 HA ALA 33 4.364 -2.683 5.864
220 HB1 ALA 33 1HB ALA 33 6.685 -3.127 5.297
221 HB2 ALA 33 2HB ALA 33 5.918 -4.634 5.888
222 HB3 ALA 33 3HB ALA 33 6.189 -4.372 4.154
223 H CYS 34 H CYS 34 3.984 -3.642 2.480
224 HA CYS 34 HA CYS 34 4.952 -1.234 1.282
225 HB2 CYS 34 1HB CYS 34 4.261 -3.372 0.099
226 HB3 CYS 34 2HB CYS 34 2.584 -2.858 0.297
227 H CYS 35 H CYS 35 1.710 -2.189 2.502
228 HA CYS 35 HA CYS 35 0.417 0.314 2.144
229 HB2 CYS 35 1HB CYS 35 -0.053 -1.712 4.361
230 HB3 CYS 35 2HB CYS 35 -1.093 -0.384 3.947
231 H ASP 36 H ASP 36 2.160 -0.954 5.068
232 HA ASP 36 HA ASP 36 1.615 1.338 6.613
233 HB2 ASP 36 1HB ASP 36 2.262 -1.055 7.303
234 HB3 ASP 36 2HB ASP 36 3.923 -0.577 7.076
235 H SER 37 H SER 37 4.331 0.717 4.546
236 HA SER 37 HA SER 37 5.823 3.102 5.335
237 HB2 SER 37 1HB SER 37 5.927 1.272 2.906
238 HB3 SER 37 2HB SER 37 7.052 2.611 3.177
239 HG SER 37 HG SER 37 6.697 0.433 4.999
240 H CYS 38 H CYS 38 2.930 2.798 3.451
241 HA CYS 38 HA CYS 38 3.529 5.353 2.001
242 HB2 CYS 38 1HB CYS 38 2.268 2.755 1.086
243 HB3 CYS 38 2HB CYS 38 2.049 4.258 0.221
244 H PHE 39 H PHE 39 1.285 3.696 4.051
245 HA PHE 39 HA PHE 39 -0.673 5.844 3.809
246 HB2 PHE 39 1HB PHE 39 -1.245 2.869 3.516
247 HB3 PHE 39 2HB PHE 39 -2.452 4.090 3.788
248 HD1 PHE 39 1HD PHE 39 -2.515 6.089 1.988
249 HD2 PHE 39 2HD PHE 39 -0.925 2.127 1.305
250 HE1 PHE 39 1HE PHE 39 -3.134 6.248 -0.392
251 HE2 PHE 39 2HE PHE 39 -1.581 2.264 -1.057
252 HZ PHE 39 HZ PHE 39 -2.751 4.298 -1.895
253 H GLU 40 H GLU 40 -1.463 6.243 5.775
254 HA GLU 40 HA GLU 40 -0.814 4.343 7.989
255 HB2 GLU 40 1HB GLU 40 -0.945 7.361 8.120
256 HB3 GLU 40 2HB GLU 40 -0.349 6.282 9.370
257 HG2 GLU 40 1HG GLU 40 1.339 5.497 7.447
258 HG3 GLU 40 2HG GLU 40 0.946 7.113 6.837
259 H LEU 41 H LEU 41 -2.127 4.697 9.918
260 HA LEU 41 HA LEU 41 -4.151 4.576 10.990
261 HB2 LEU 41 1HB LEU 41 -4.582 7.185 9.474
262 HB3 LEU 41 2HB LEU 41 -5.354 6.711 10.991
263 HG LEU 41 HG LEU 41 -2.343 7.155 10.603
264 HD11 LEU 41 1HD1 LEU 41 -2.661 9.190 11.914
265 HD12 LEU 41 2HD1 LEU 41 -3.519 9.231 10.377
266 HD13 LEU 41 3HD1 LEU 41 -4.431 8.941 11.876
267 HD21 LEU 41 3HD2 LEU 41 -3.967 6.572 13.114
268 HD22 LEU 41 1HD2 LEU 41 -2.708 5.557 12.399
269 HD23 LEU 41 2HD2 LEU 41 -2.256 7.102 13.094
270 H THR 42 H THR 42 -6.517 6.103 9.215
271 HA THR 42 HA THR 42 -7.844 3.695 8.599
272 HB THR 42 HB THR 42 -8.426 6.267 7.148
273 HG1 THR 42 1HG THR 42 -9.657 6.872 8.973
274 HG21 THR 42 3HG2 THR 42 -10.242 4.207 8.465
275 HG22 THR 42 1HG2 THR 42 -10.759 5.568 7.447
276 HG23 THR 42 2HG2 THR 42 -9.850 4.251 6.742
277 H GLY 43 H GLY 43 -5.566 5.630 6.674
278 HA2 GLY 43 1HA GLY 43 -6.252 4.659 4.072
279 HA3 GLY 43 2HA GLY 43 -4.749 5.458 4.580
280 H ASN 44 H ASN 44 -4.071 3.693 6.680
281 HA ASN 44 HA ASN 44 -2.807 1.538 5.300
282 HB2 ASN 44 1HB ASN 44 -2.063 2.547 7.511
283 HB3 ASN 44 2HB ASN 44 -3.318 1.617 8.297
284 HD21 ASN 44 1HD2 ASN 44 -0.453 1.492 6.329
285 HD22 ASN 44 2HD2 ASN 44 0.021 -0.137 6.799
286 H THR 45 H THR 45 -5.655 1.617 7.555
287 HA THR 45 HA THR 45 -6.352 -1.044 7.422
288 HB THR 45 HB THR 45 -8.553 0.987 7.430
289 HG1 THR 45 1HG THR 45 -6.562 0.925 9.467
290 HG21 THR 45 3HG2 THR 45 -8.998 -1.365 8.063
291 HG22 THR 45 1HG2 THR 45 -7.831 -1.216 9.396
292 HG23 THR 45 2HG2 THR 45 -9.315 -0.237 9.401
293 H MET 46 H MET 46 -7.248 1.513 5.124
294 HA MET 46 HA MET 46 -9.047 -0.140 3.576
295 HB2 MET 46 1HB MET 46 -7.761 2.532 2.790
296 HB3 MET 46 2HB MET 46 -8.950 1.633 1.870
297 HG2 MET 46 1HG MET 46 -9.709 1.988 4.677
298 HG3 MET 46 2HG MET 46 -9.361 3.509 3.897
299 HE1 MET 46 3HE MET 46 -10.449 2.914 0.848
300 HE2 MET 46 1HE MET 46 -12.163 3.370 0.949
301 HE3 MET 46 2HE MET 46 -10.923 4.431 1.660
302 H CYS 47 H CYS 47 -5.551 0.737 3.107
303 HA CYS 47 HA CYS 47 -5.168 -0.718 0.700
304 HB2 CYS 47 1HB CYS 47 -3.561 0.857 1.519
305 HB3 CYS 47 2HB CYS 47 -3.277 -0.042 2.971
306 H LEU 48 H LEU 48 -4.703 -1.732 4.128
307 HA LEU 48 HA LEU 48 -3.875 -4.350 3.684
308 HB2 LEU 48 1HB LEU 48 -5.624 -3.191 5.887
309 HB3 LEU 48 2HB LEU 48 -4.950 -4.803 5.898
310 HG LEU 48 HG LEU 48 -3.362 -2.223 5.988
311 HD11 LEU 48 1HD1 LEU 48 -2.793 -3.007 8.249
312 HD12 LEU 48 2HD1 LEU 48 -4.538 -2.801 8.064
313 HD13 LEU 48 3HD1 LEU 48 -3.816 -4.439 8.026
314 HD21 LEU 48 3HD2 LEU 48 -2.281 -5.055 6.074
315 HD22 LEU 48 1HD2 LEU 48 -2.072 -3.900 4.729
316 HD23 LEU 48 2HD2 LEU 48 -1.379 -3.531 6.291
317 H LEU 49 H LEU 49 -7.212 -3.111 3.977
318 HA LEU 49 HA LEU 49 -8.556 -5.559 3.680
319 HB2 LEU 49 1HB LEU 49 -9.312 -2.741 3.659
320 HB3 LEU 49 2HB LEU 49 -10.059 -3.511 2.282
321 HG LEU 49 HG LEU 49 -10.723 -5.423 3.994
322 HD11 LEU 49 1HD1 LEU 49 -11.060 -4.565 6.258
323 HD12 LEU 49 2HD1 LEU 49 -9.342 -4.396 5.832
324 HD13 LEU 49 3HD1 LEU 49 -10.372 -2.977 5.804
325 HD21 LEU 49 3HD2 LEU 49 -12.327 -3.995 2.800
326 HD22 LEU 49 1HD2 LEU 49 -12.820 -4.294 4.475
327 HD23 LEU 49 2HD2 LEU 49 -12.098 -2.727 4.023
328 H GLN 50 H GLN 50 -7.225 -3.439 1.091
329 HA GLN 50 HA GLN 50 -8.556 -5.036 -0.937
330 HB2 GLN 50 1HB GLN 50 -8.126 -2.604 -1.146
331 HB3 GLN 50 2HB GLN 50 -6.401 -2.932 -1.252
332 HG2 GLN 50 1HG GLN 50 -7.324 -2.654 -3.507
333 HG3 GLN 50 2HG GLN 50 -6.846 -4.336 -3.318
334 HE21 GLN 50 1HE2 GLN 50 -8.493 -5.974 -3.479
335 HE22 GLN 50 2HE2 GLN 50 -10.201 -5.621 -3.443
336 H ALA 51 H ALA 51 -5.160 -4.618 0.202
337 HA ALA 51 HA ALA 51 -3.914 -6.418 -1.573
338 HB1 ALA 51 1HB ALA 51 -2.699 -4.879 -0.023
339 HB2 ALA 51 2HB ALA 51 -3.228 -5.853 1.353
340 HB3 ALA 51 3HB ALA 51 -2.145 -6.558 0.137
341 H GLY 52 H GLY 52 -5.179 -7.051 1.721
342 HA2 GLY 52 1HA GLY 52 -4.797 -9.932 1.434
343 HA3 GLY 52 2HA GLY 52 -5.322 -9.044 2.866
344 H ALA 53 H ALA 53 -7.098 -8.295 -0.051
345 HA ALA 53 HA ALA 53 -9.564 -8.749 1.093
346 HB1 ALA 53 1HB ALA 53 -9.270 -7.433 -0.962
347 HB2 ALA 53 2HB ALA 53 -8.873 -8.907 -1.874
348 HB3 ALA 53 3HB ALA 53 -10.500 -8.678 -1.193
349 H ALA 54 H ALA 54 -8.144 -10.919 -1.403
350 HA ALA 54 HA ALA 54 -8.854 -13.271 0.079
351 HB1 ALA 54 1HB ALA 54 -10.165 -14.317 -1.711
352 HB2 ALA 54 2HB ALA 54 -10.961 -12.823 -1.161
353 HB3 ALA 54 3HB ALA 54 -10.045 -12.830 -2.680
354 H GLY 55 H GLY 55 -6.464 -12.542 -0.099
355 HA2 GLY 55 1HA GLY 55 -4.401 -13.433 -0.620
356 HA3 GLY 55 2HA GLY 55 -5.104 -14.359 -1.950
357 H SER 56 H SER 56 -6.225 -12.424 -3.587
358 HA SER 56 HA SER 56 -5.580 -11.437 -5.486
359 HB2 SER 56 1HB SER 56 -5.563 -9.396 -4.096
360 HB3 SER 56 2HB SER 56 -3.872 -9.670 -3.685
361 HG SER 56 HG SER 56 -4.994 -8.657 -5.995
362 H GLY 57 H GLY 57 -2.329 -10.703 -4.447
363 HA2 GLY 57 1HA GLY 57 -1.435 -13.430 -4.475
364 HA3 GLY 57 2HA GLY 57 -0.715 -12.515 -5.807
365 H CYS 58 H CYS 58 -1.650 -11.329 -2.549
366 HA CYS 58 HA CYS 58 1.099 -10.221 -2.237
367 HB2 CYS 58 1HB CYS 58 -1.577 -9.286 -1.159
368 HB3 CYS 58 2HB CYS 58 -0.021 -8.548 -0.797
369 H ASP 59 H ASP 59 1.904 -10.098 0.011
370 HA ASP 59 HA ASP 59 1.081 -12.485 1.597
371 HB2 ASP 59 1HB ASP 59 3.480 -12.190 0.877
372 HB3 ASP 59 2HB ASP 59 3.566 -10.773 1.924
373 H MET 60 H MET 60 0.872 -12.165 3.947
374 HA MET 60 HA MET 60 -0.525 -9.568 4.499
375 HB2 MET 60 1HB MET 60 -1.513 -12.431 4.845
376 HB3 MET 60 2HB MET 60 -2.296 -11.016 5.554
377 HG2 MET 60 1HG MET 60 -2.711 -10.049 3.367
378 HG3 MET 60 2HG MET 60 -1.796 -11.352 2.579
379 HE1 MET 60 3HE MET 60 -4.403 -11.989 5.567
380 HE2 MET 60 1HE MET 60 -4.978 -10.526 4.734
381 HE3 MET 60 2HE MET 60 -5.903 -12.041 4.627
382 H GLU 61 H GLU 61 1.611 -9.332 5.402
383 HA GLU 61 HA GLU 61 3.246 -9.430 6.821
384 HB2 GLU 61 1HB GLU 61 2.878 -9.149 9.256
385 HB3 GLU 61 2HB GLU 61 2.084 -7.994 8.211
386 HG2 GLU 61 1HG GLU 61 -0.064 -9.111 8.512
387 HG3 GLU 61 2HG GLU 61 0.687 -10.321 9.566
Start of MODEL 13
1 H1 TYR 1 H TYR 1 -14.006 10.019 1.376
2 HA TYR 1 HA TYR 1 -12.349 10.113 3.130
3 HB2 TYR 1 1HB TYR 1 -13.044 8.086 4.289
4 HB3 TYR 1 2HB TYR 1 -12.520 7.075 2.956
5 HD1 TYR 1 2HD TYR 1 -11.007 9.921 4.954
6 HD2 TYR 1 1HD TYR 1 -10.493 5.838 3.509
7 HE1 TYR 1 2HE TYR 1 -8.736 9.857 5.888
8 HE2 TYR 1 1HE TYR 1 -8.260 5.814 4.450
9 HH TYR 1 HH TYR 1 -6.695 8.609 6.074
10 H ASN 2 H ASN 2 -11.183 7.295 1.530
11 HA ASN 2 HA ASN 2 -10.116 6.753 -0.345
12 HB2 ASN 2 1HB ASN 2 -9.596 9.672 -0.670
13 HB3 ASN 2 2HB ASN 2 -8.684 8.448 -1.551
14 HD21 ASN 2 1HD2 ASN 2 -10.106 10.413 -2.916
15 HD22 ASN 2 2HD2 ASN 2 -11.339 9.500 -3.783
16 HA PRO 3 HA PRO 3 -6.857 6.491 2.692
17 HB2 PRO 3 1HB PRO 3 -5.096 4.818 1.343
18 HB3 PRO 3 2HB PRO 3 -6.590 4.274 2.148
19 HG2 PRO 3 1HG PRO 3 -6.168 4.721 -0.778
20 HG3 PRO 3 2HG PRO 3 -7.183 3.527 0.086
21 HD2 PRO 3 1HD PRO 3 -8.230 5.739 -1.064
22 HD3 PRO 3 2HD PRO 3 -8.922 4.864 0.349
23 H GLU 4 H GLU 4 -6.419 7.848 -0.455
24 HA GLU 4 HA GLU 4 -3.758 8.797 -0.335
25 HB2 GLU 4 1HB GLU 4 -6.280 9.978 -1.608
26 HB3 GLU 4 2HB GLU 4 -4.668 10.518 -1.939
27 HG2 GLU 4 1HG GLU 4 -4.266 8.849 -3.394
28 HG3 GLU 4 2HG GLU 4 -4.868 7.602 -2.295
29 H ASP 5 H ASP 5 -6.593 9.779 1.538
30 HA ASP 5 HA ASP 5 -5.805 12.389 2.348
31 HB2 ASP 5 1HB ASP 5 -7.681 10.298 3.267
32 HB3 ASP 5 2HB ASP 5 -6.934 11.132 4.603
33 H ASP 6 H ASP 6 -4.618 9.178 3.255
34 HA ASP 6 HA ASP 6 -2.705 10.348 5.214
35 HB2 ASP 6 1HB ASP 6 -4.410 7.861 5.497
36 HB3 ASP 6 2HB ASP 6 -2.942 8.132 6.417
37 H TYR 7 H TYR 7 -2.453 9.878 2.351
38 HA TYR 7 HA TYR 7 -0.573 7.701 1.981
39 HB2 TYR 7 1HB TYR 7 -1.593 8.536 0.028
40 HB3 TYR 7 2HB TYR 7 -1.302 10.216 0.467
41 HD1 TYR 7 2HD TYR 7 0.712 7.096 -0.233
42 HD2 TYR 7 1HD TYR 7 0.276 11.349 -0.782
43 HE1 TYR 7 2HE TYR 7 2.593 7.083 -1.855
44 HE2 TYR 7 1HE TYR 7 2.166 11.357 -2.373
45 HH TYR 7 HH TYR 7 3.874 8.357 -3.323
46 H THR 8 H THR 8 1.669 7.785 2.269
47 HA THR 8 HA THR 8 2.799 10.256 3.456
48 HB THR 8 HB THR 8 4.219 8.591 4.732
49 HG1 THR 8 1HG THR 8 3.240 6.532 4.954
50 HG21 THR 8 3HG2 THR 8 2.195 9.890 5.585
51 HG22 THR 8 1HG2 THR 8 1.217 8.463 5.219
52 HG23 THR 8 2HG2 THR 8 2.539 8.375 6.411
53 HA PRO 9 HA PRO 9 5.159 9.388 -0.416
54 HB2 PRO 9 1HB PRO 9 5.917 11.989 -0.896
55 HB3 PRO 9 2HB PRO 9 4.411 11.264 -1.504
56 HG2 PRO 9 1HG PRO 9 4.826 13.052 0.889
57 HG3 PRO 9 2HG PRO 9 3.468 13.053 -0.279
58 HD2 PRO 9 1HD PRO 9 3.337 11.912 2.207
59 HD3 PRO 9 2HD PRO 9 2.417 11.265 0.829
60 H LEU 10 H LEU 10 5.952 11.095 2.581
61 HA LEU 10 HA LEU 10 8.718 11.537 2.152
62 HB2 LEU 10 1HB LEU 10 7.324 10.874 4.780
63 HB3 LEU 10 2HB LEU 10 8.912 11.592 4.559
64 HG LEU 10 HG LEU 10 6.194 12.856 4.169
65 HD11 LEU 10 1HD1 LEU 10 7.172 14.567 5.656
66 HD12 LEU 10 2HD1 LEU 10 7.346 12.942 6.382
67 HD13 LEU 10 3HD1 LEU 10 8.735 13.745 5.621
68 HD21 LEU 10 3HD2 LEU 10 7.335 13.520 2.148
69 HD22 LEU 10 1HD2 LEU 10 7.328 14.884 3.270
70 HD23 LEU 10 2HD2 LEU 10 8.818 13.933 3.067
71 H THR 11 H THR 11 6.963 8.599 3.105
72 HA THR 11 HA THR 11 9.526 7.098 3.216
73 HB THR 11 HB THR 11 8.003 5.439 4.465
74 HG1 THR 11 1HG THR 11 5.974 6.244 4.074
75 HG21 THR 11 3HG2 THR 11 9.712 6.896 5.555
76 HG22 THR 11 1HG2 THR 11 8.479 8.173 5.738
77 HG23 THR 11 2HG2 THR 11 8.311 6.629 6.585
78 H CYS 12 H CYS 12 6.569 7.521 1.352
79 HA CYS 12 HA CYS 12 6.514 4.807 0.483
80 HB2 CYS 12 1HB CYS 12 4.545 6.339 0.633
81 HB3 CYS 12 2HB CYS 12 5.138 7.172 -0.801
82 HA PRO 13 HA PRO 13 9.580 5.581 -2.818
83 HB2 PRO 13 1HB PRO 13 9.847 2.993 -3.720
84 HB3 PRO 13 2HB PRO 13 10.579 3.596 -2.194
85 HG2 PRO 13 1HG PRO 13 8.051 2.026 -2.588
86 HG3 PRO 13 2HG PRO 13 9.329 1.773 -1.372
87 HD2 PRO 13 1HD PRO 13 6.973 3.126 -0.879
88 HD3 PRO 13 2HD PRO 13 8.497 3.493 -0.031
89 H HIS 14 H HIS 14 6.409 5.565 -3.130
90 HA HIS 14 HA HIS 14 6.271 5.019 -6.044
91 HB2 HIS 14 1HB HIS 14 4.035 4.266 -4.156
92 HB3 HIS 14 2HB HIS 14 4.309 3.708 -5.789
93 HD1 HIS 14 1HD HIS 14 6.694 2.152 -6.063
94 HD2 HIS 14 2HD HIS 14 4.396 2.256 -2.516
95 HE1 HIS 14 1HE HIS 14 6.925 -0.092 -4.931
96 HE2 HIS 14 2HE HIS 14 5.593 -0.022 -2.777
97 H THR 15 H THR 15 4.714 6.379 -7.120
98 HA THR 15 HA THR 15 4.267 8.935 -5.825
99 HB THR 15 HB THR 15 3.381 9.458 -8.092
100 HG1 THR 15 1HG THR 15 3.582 7.749 -9.685
101 HG21 THR 15 3HG2 THR 15 5.516 9.011 -9.355
102 HG22 THR 15 1HG2 THR 15 5.775 9.743 -7.768
103 HG23 THR 15 2HG2 THR 15 6.074 8.010 -8.011
104 H ILE 16 H ILE 16 2.083 9.935 -5.813
105 HA ILE 16 HA ILE 16 -0.118 8.392 -4.795
106 HB ILE 16 HB ILE 16 0.320 10.673 -4.402
107 HG12 ILE 16 1HG1 ILE 16 -2.165 10.664 -4.376
108 HG13 ILE 16 2HG1 ILE 16 -2.224 9.091 -4.936
109 HG21 ILE 16 1HG2 ILE 16 -0.977 12.217 -5.822
110 HG22 ILE 16 2HG2 ILE 16 0.416 11.537 -6.695
111 HG23 ILE 16 3HG2 ILE 16 -1.228 10.938 -7.019
112 HD11 ILE 16 3HD1 ILE 16 -2.235 8.714 -2.651
113 HD12 ILE 16 1HD1 ILE 16 -0.501 8.881 -2.795
114 HD13 ILE 16 2HD1 ILE 16 -1.476 10.289 -2.323
115 H SER 17 H SER 17 1.010 8.878 -8.026
116 HA SER 17 HA SER 17 -1.457 8.004 -9.290
117 HB2 SER 17 1HB SER 17 1.040 9.158 -10.143
118 HB3 SER 17 2HB SER 17 0.599 7.790 -11.191
119 HG SER 17 HG SER 17 -0.359 10.054 -11.569
120 H VAL 18 H VAL 18 1.182 6.306 -7.797
121 HA VAL 18 HA VAL 18 -0.161 3.792 -8.582
122 HB VAL 18 HB VAL 18 1.955 2.678 -9.097
123 HG11 VAL 18 1HG1 VAL 18 2.361 3.465 -11.300
124 HG12 VAL 18 2HG1 VAL 18 0.632 3.654 -10.947
125 HG13 VAL 18 3HG1 VAL 18 1.697 5.078 -10.938
126 HG21 VAL 18 3HG2 VAL 18 3.858 3.560 -8.391
127 HG22 VAL 18 1HG2 VAL 18 3.772 4.839 -9.660
128 HG23 VAL 18 2HG2 VAL 18 3.089 5.076 -8.015
129 H VAL 19 H VAL 19 -0.547 4.778 -6.264
130 HA VAL 19 HA VAL 19 1.269 3.145 -4.556
131 HB VAL 19 HB VAL 19 1.398 5.395 -3.974
132 HG11 VAL 19 1HG1 VAL 19 -0.413 6.661 -2.968
133 HG12 VAL 19 2HG1 VAL 19 -0.782 6.237 -4.646
134 HG13 VAL 19 3HG1 VAL 19 -1.571 5.366 -3.315
135 HG21 VAL 19 3HG2 VAL 19 1.695 3.721 -2.245
136 HG22 VAL 19 1HG2 VAL 19 1.029 5.231 -1.590
137 HG23 VAL 19 2HG2 VAL 19 -0.018 3.825 -1.816
138 H TRP 20 H TRP 20 -2.297 3.814 -4.787
139 HA TRP 20 HA TRP 20 -3.067 1.731 -3.068
140 HB2 TRP 20 1HB TRP 20 -4.587 3.463 -3.926
141 HB3 TRP 20 2HB TRP 20 -4.509 2.765 -5.544
142 HD1 TRP 20 HD TRP 20 -6.315 0.932 -6.037
143 HE1 TRP 20 1HE TRP 20 -8.044 -0.339 -4.657
144 HE3 TRP 20 3HE TRP 20 -4.740 2.290 -1.374
145 HZ2 TRP 20 2HZ TRP 20 -8.875 -0.443 -1.817
146 HZ3 TRP 20 3HZ TRP 20 -6.024 1.662 0.615
147 HH2 TRP 20 HH TRP 20 -8.194 0.480 0.375
148 H TYR 21 H TYR 21 -3.189 1.549 -6.670
149 HA TYR 21 HA TYR 21 -3.322 -1.147 -7.089
150 HB2 TYR 21 1HB TYR 21 -3.255 0.364 -8.974
151 HB3 TYR 21 2HB TYR 21 -1.686 1.004 -8.512
152 HD1 TYR 21 1HD TYR 21 -3.393 -2.141 -9.635
153 HD2 TYR 21 2HD TYR 21 0.310 0.065 -9.407
154 HE1 TYR 21 1HE TYR 21 -2.260 -3.931 -10.890
155 HE2 TYR 21 2HE TYR 21 1.462 -1.731 -10.651
156 HH TYR 21 HH TYR 21 -0.278 -4.709 -11.687
157 H GLU 22 H GLU 22 -0.253 0.676 -6.155
158 HA GLU 22 HA GLU 22 1.323 -1.508 -7.050
159 HB2 GLU 22 1HB GLU 22 2.619 0.416 -7.221
160 HB3 GLU 22 2HB GLU 22 1.440 1.234 -6.281
161 HG2 GLU 22 1HG GLU 22 3.452 1.447 -5.260
162 HG3 GLU 22 2HG GLU 22 2.510 0.453 -4.164
163 H CYS 23 H CYS 23 -0.150 -0.473 -3.884
164 HA CYS 23 HA CYS 23 1.634 -2.255 -2.417
165 HB2 CYS 23 1HB CYS 23 -0.361 -0.144 -1.565
166 HB3 CYS 23 2HB CYS 23 0.357 -1.300 -0.451
167 H THR 24 H THR 24 -1.391 -2.382 -4.002
168 HA THR 24 HA THR 24 -2.319 -4.421 -2.109
169 HB THR 24 HB THR 24 -4.578 -3.731 -2.433
170 HG1 THR 24 1HG THR 24 -3.639 -1.591 -4.023
171 HG21 THR 24 3HG2 THR 24 -2.858 -1.287 -1.819
172 HG22 THR 24 1HG2 THR 24 -4.577 -1.461 -1.457
173 HG23 THR 24 2HG2 THR 24 -3.400 -2.525 -0.670
174 H GLU 25 H GLU 25 -1.330 -3.965 -5.331
175 HA GLU 25 HA GLU 25 -2.754 -6.404 -6.208
176 HB2 GLU 25 1HB GLU 25 -3.799 -4.007 -6.765
177 HB3 GLU 25 2HB GLU 25 -2.535 -3.988 -7.993
178 HG2 GLU 25 1HG GLU 25 -3.331 -6.222 -8.789
179 HG3 GLU 25 2HG GLU 25 -4.644 -6.133 -7.620
180 H ASN 26 H ASN 26 -0.224 -3.996 -6.925
181 HA ASN 26 HA ASN 26 1.061 -5.385 -9.033
182 HB2 ASN 26 1HB ASN 26 1.439 -3.022 -8.557
183 HB3 ASN 26 2HB ASN 26 2.230 -3.458 -7.038
184 HD21 ASN 26 1HD2 ASN 26 4.109 -2.344 -7.600
185 HD22 ASN 26 2HD2 ASN 26 5.278 -3.085 -8.651
186 H THR 27 H THR 27 1.524 -7.449 -8.725
187 HA THR 27 HA THR 27 2.425 -8.875 -6.542
188 HB THR 27 HB THR 27 3.383 -10.420 -8.387
189 HG1 THR 27 1HG THR 27 2.038 -8.531 -10.069
190 HG21 THR 27 3HG2 THR 27 1.128 -11.018 -9.195
191 HG22 THR 27 1HG2 THR 27 1.137 -10.722 -7.446
192 HG23 THR 27 2HG2 THR 27 0.476 -9.500 -8.549
193 H ALA 28 H ALA 28 4.379 -6.696 -8.465
194 HA ALA 28 HA ALA 28 6.941 -7.775 -7.872
195 HB1 ALA 28 1HB ALA 28 7.762 -5.673 -8.746
196 HB2 ALA 28 2HB ALA 28 6.363 -6.165 -9.719
197 HB3 ALA 28 3HB ALA 28 6.193 -4.896 -8.476
198 H ASN 29 H ASN 29 4.797 -5.959 -5.720
199 HA ASN 29 HA ASN 29 6.937 -6.131 -3.754
200 HB2 ASN 29 1HB ASN 29 5.691 -3.416 -3.552
201 HB3 ASN 29 2HB ASN 29 7.249 -4.012 -3.050
202 HD21 ASN 29 1HD2 ASN 29 5.485 -2.318 -5.472
203 HD22 ASN 29 2HD2 ASN 29 6.624 -2.327 -6.769
204 H CYS 30 H CYS 30 3.887 -4.326 -3.898
205 HA CYS 30 HA CYS 30 2.314 -4.076 -2.371
206 HB2 CYS 30 1HB CYS 30 0.530 -5.721 -2.736
207 HB3 CYS 30 2HB CYS 30 1.324 -5.136 -4.161
208 H GLY 31 H GLY 31 0.709 -5.734 -0.808
209 HA2 GLY 31 1HA GLY 31 0.562 -7.018 1.058
210 HA3 GLY 31 2HA GLY 31 2.319 -7.104 1.176
211 H THR 32 H THR 32 1.088 -6.875 3.480
212 HA THR 32 HA THR 32 0.158 -4.525 4.510
213 HB THR 32 HB THR 32 1.736 -6.787 5.744
214 HG1 THR 32 1HG THR 32 -0.825 -6.631 6.427
215 HG21 THR 32 3HG2 THR 32 0.205 -4.569 7.188
216 HG22 THR 32 1HG2 THR 32 0.685 -6.110 7.921
217 HG23 THR 32 2HG2 THR 32 1.922 -4.989 7.362
218 H ALA 33 H ALA 33 3.641 -5.391 4.092
219 HA ALA 33 HA ALA 33 4.554 -3.128 5.651
220 HB1 ALA 33 1HB ALA 33 6.022 -4.758 3.529
221 HB2 ALA 33 2HB ALA 33 6.771 -3.677 4.717
222 HB3 ALA 33 3HB ALA 33 5.939 -5.143 5.262
223 H CYS 34 H CYS 34 3.705 -3.543 2.217
224 HA CYS 34 HA CYS 34 4.825 -0.975 1.365
225 HB2 CYS 34 1HB CYS 34 4.225 -2.907 -0.163
226 HB3 CYS 34 2HB CYS 34 2.533 -2.542 0.117
227 H CYS 35 H CYS 35 1.603 -2.244 2.333
228 HA CYS 35 HA CYS 35 0.198 0.190 2.178
229 HB2 CYS 35 1HB CYS 35 -0.178 -2.265 3.927
230 HB3 CYS 35 2HB CYS 35 -1.280 -0.898 3.974
231 H ASP 36 H ASP 36 2.302 -0.986 4.838
232 HA ASP 36 HA ASP 36 1.472 1.121 6.624
233 HB2 ASP 36 1HB ASP 36 2.603 -1.114 7.213
234 HB3 ASP 36 2HB ASP 36 4.124 -0.330 6.789
235 H SER 37 H SER 37 4.491 0.699 4.692
236 HA SER 37 HA SER 37 5.569 3.240 5.389
237 HB2 SER 37 1HB SER 37 6.113 1.186 3.228
238 HB3 SER 37 2HB SER 37 6.978 2.733 3.239
239 HG SER 37 HG SER 37 7.484 0.591 4.714
240 H CYS 38 H CYS 38 2.942 2.657 3.305
241 HA CYS 38 HA CYS 38 3.365 5.271 1.945
242 HB2 CYS 38 1HB CYS 38 2.107 2.685 0.989
243 HB3 CYS 38 2HB CYS 38 1.925 4.215 0.162
244 H PHE 39 H PHE 39 1.249 3.641 4.198
245 HA PHE 39 HA PHE 39 -0.626 5.835 3.883
246 HB2 PHE 39 1HB PHE 39 -1.498 2.922 3.768
247 HB3 PHE 39 2HB PHE 39 -2.548 4.272 4.050
248 HD1 PHE 39 1HD PHE 39 -2.512 6.193 2.183
249 HD2 PHE 39 2HD PHE 39 -1.276 2.119 1.572
250 HE1 PHE 39 1HE PHE 39 -3.075 6.379 -0.219
251 HE2 PHE 39 2HE PHE 39 -1.892 2.273 -0.816
252 HZ PHE 39 HZ PHE 39 -2.825 4.393 -1.701
253 H GLU 40 H GLU 40 -1.634 6.323 5.872
254 HA GLU 40 HA GLU 40 -0.935 4.552 8.180
255 HB2 GLU 40 1HB GLU 40 -1.068 7.565 8.289
256 HB3 GLU 40 2HB GLU 40 -0.459 6.444 9.528
257 HG2 GLU 40 1HG GLU 40 1.138 5.650 7.580
258 HG3 GLU 40 2HG GLU 40 0.750 7.248 6.939
259 H LEU 41 H LEU 41 -2.296 4.908 10.060
260 HA LEU 41 HA LEU 41 -4.336 4.699 11.035
261 HB2 LEU 41 1HB LEU 41 -4.727 7.342 9.575
262 HB3 LEU 41 2HB LEU 41 -5.578 6.826 11.037
263 HG LEU 41 HG LEU 41 -2.553 7.257 10.847
264 HD11 LEU 41 1HD1 LEU 41 -3.673 9.330 10.550
265 HD12 LEU 41 2HD1 LEU 41 -4.701 9.068 11.971
266 HD13 LEU 41 3HD1 LEU 41 -2.939 9.286 12.157
267 HD21 LEU 41 3HD2 LEU 41 -2.660 7.185 13.322
268 HD22 LEU 41 1HD2 LEU 41 -4.357 6.669 13.223
269 HD23 LEU 41 2HD2 LEU 41 -3.056 5.639 12.572
270 H THR 42 H THR 42 -6.673 6.237 9.286
271 HA THR 42 HA THR 42 -7.924 3.796 8.631
272 HB THR 42 HB THR 42 -8.648 6.505 7.467
273 HG1 THR 42 1HG THR 42 -8.801 5.525 10.097
274 HG21 THR 42 3HG2 THR 42 -10.115 4.766 6.687
275 HG22 THR 42 1HG2 THR 42 -10.204 4.027 8.301
276 HG23 THR 42 2HG2 THR 42 -10.959 5.602 8.007
277 H GLY 43 H GLY 43 -5.695 5.789 6.761
278 HA2 GLY 43 1HA GLY 43 -6.339 4.786 4.161
279 HA3 GLY 43 2HA GLY 43 -4.834 5.583 4.675
280 H ASN 44 H ASN 44 -4.142 3.884 6.795
281 HA ASN 44 HA ASN 44 -2.843 1.715 5.466
282 HB2 ASN 44 1HB ASN 44 -2.010 2.697 7.611
283 HB3 ASN 44 2HB ASN 44 -3.353 1.931 8.462
284 HD21 ASN 44 1HD2 ASN 44 -0.801 1.069 6.039
285 HD22 ASN 44 2HD2 ASN 44 -0.447 -0.482 6.803
286 H THR 45 H THR 45 -5.660 1.795 7.774
287 HA THR 45 HA THR 45 -6.332 -0.880 7.655
288 HB THR 45 HB THR 45 -8.607 1.086 7.453
289 HG1 THR 45 1HG THR 45 -6.733 1.141 9.563
290 HG21 THR 45 3HG2 THR 45 -9.483 -0.299 9.318
291 HG22 THR 45 1HG2 THR 45 -9.054 -1.273 7.897
292 HG23 THR 45 2HG2 THR 45 -7.984 -1.244 9.305
293 H MET 46 H MET 46 -7.549 1.705 5.392
294 HA MET 46 HA MET 46 -9.090 -0.027 3.853
295 HB2 MET 46 1HB MET 46 -7.804 2.690 3.283
296 HB3 MET 46 2HB MET 46 -8.823 1.855 2.117
297 HG2 MET 46 1HG MET 46 -9.740 2.091 4.981
298 HG3 MET 46 2HG MET 46 -9.801 3.506 3.981
299 HE1 MET 46 3HE MET 46 -11.488 3.913 2.108
300 HE2 MET 46 1HE MET 46 -10.566 2.708 1.181
301 HE3 MET 46 2HE MET 46 -12.319 2.622 1.226
302 H CYS 47 H CYS 47 -5.625 0.807 3.467
303 HA CYS 47 HA CYS 47 -5.236 -0.535 0.976
304 HB2 CYS 47 1HB CYS 47 -3.756 1.180 2.003
305 HB3 CYS 47 2HB CYS 47 -3.262 0.013 3.220
306 H LEU 48 H LEU 48 -4.786 -1.631 4.381
307 HA LEU 48 HA LEU 48 -3.968 -4.283 3.783
308 HB2 LEU 48 1HB LEU 48 -5.546 -3.169 6.150
309 HB3 LEU 48 2HB LEU 48 -4.814 -4.746 6.074
310 HG LEU 48 HG LEU 48 -3.368 -2.074 6.092
311 HD11 LEU 48 1HD1 LEU 48 -2.455 -2.874 8.222
312 HD12 LEU 48 2HD1 LEU 48 -4.226 -2.794 8.265
313 HD13 LEU 48 3HD1 LEU 48 -3.407 -4.359 8.082
314 HD21 LEU 48 3HD2 LEU 48 -2.070 -4.787 5.941
315 HD22 LEU 48 1HD2 LEU 48 -2.107 -3.594 4.628
316 HD23 LEU 48 2HD2 LEU 48 -1.261 -3.213 6.126
317 H LEU 49 H LEU 49 -7.193 -2.964 4.379
318 HA LEU 49 HA LEU 49 -8.756 -5.240 4.011
319 HB2 LEU 49 1HB LEU 49 -9.172 -2.393 4.120
320 HB3 LEU 49 2HB LEU 49 -10.065 -2.974 2.742
321 HG LEU 49 HG LEU 49 -10.295 -4.176 5.534
322 HD11 LEU 49 1HD1 LEU 49 -10.950 -1.826 5.582
323 HD12 LEU 49 2HD1 LEU 49 -12.031 -2.067 4.179
324 HD13 LEU 49 3HD1 LEU 49 -12.367 -2.861 5.736
325 HD21 LEU 49 3HD2 LEU 49 -11.048 -5.690 3.734
326 HD22 LEU 49 1HD2 LEU 49 -12.420 -5.089 4.661
327 HD23 LEU 49 2HD2 LEU 49 -12.061 -4.397 3.048
328 H GLN 50 H GLN 50 -7.275 -3.252 1.413
329 HA GLN 50 HA GLN 50 -8.592 -4.812 -0.664
330 HB2 GLN 50 1HB GLN 50 -7.917 -2.364 -0.789
331 HB3 GLN 50 2HB GLN 50 -6.236 -2.887 -0.868
332 HG2 GLN 50 1HG GLN 50 -7.099 -2.435 -3.123
333 HG3 GLN 50 2HG GLN 50 -6.765 -4.163 -2.963
334 HE21 GLN 50 1HE2 GLN 50 -8.467 -5.597 -3.480
335 HE22 GLN 50 2HE2 GLN 50 -10.147 -5.128 -3.400
336 H ALA 51 H ALA 51 -5.254 -4.503 0.621
337 HA ALA 51 HA ALA 51 -4.013 -6.289 -1.173
338 HB1 ALA 51 1HB ALA 51 -2.904 -4.538 0.274
339 HB2 ALA 51 2HB ALA 51 -3.164 -5.591 1.680
340 HB3 ALA 51 3HB ALA 51 -2.113 -6.100 0.342
341 H GLY 52 H GLY 52 -5.248 -6.868 2.171
342 HA2 GLY 52 1HA GLY 52 -4.523 -9.681 2.097
343 HA3 GLY 52 2HA GLY 52 -5.331 -8.803 3.396
344 H ALA 53 H ALA 53 -7.044 -8.241 0.485
345 HA ALA 53 HA ALA 53 -9.298 -9.825 1.352
346 HB1 ALA 53 1HB ALA 53 -9.505 -7.651 0.165
347 HB2 ALA 53 2HB ALA 53 -8.819 -8.392 -1.294
348 HB3 ALA 53 3HB ALA 53 -10.374 -8.952 -0.664
349 H ALA 54 H ALA 54 -6.558 -10.598 -0.489
350 HA ALA 54 HA ALA 54 -5.791 -12.201 -1.711
351 HB1 ALA 54 1HB ALA 54 -6.683 -13.763 -0.045
352 HB2 ALA 54 2HB ALA 54 -8.207 -13.867 -0.948
353 HB3 ALA 54 3HB ALA 54 -6.697 -14.454 -1.682
354 H GLY 55 H GLY 55 -5.867 -13.101 -3.737
355 HA2 GLY 55 1HA GLY 55 -6.922 -13.399 -5.934
356 HA3 GLY 55 2HA GLY 55 -7.948 -12.001 -5.593
357 H SER 56 H SER 56 -5.762 -10.413 -4.308
358 HA SER 56 HA SER 56 -4.396 -9.281 -6.528
359 HB2 SER 56 1HB SER 56 -3.782 -9.166 -3.553
360 HB3 SER 56 2HB SER 56 -3.050 -8.153 -4.804
361 HG SER 56 HG SER 56 -4.630 -6.946 -4.295
362 H GLY 57 H GLY 57 -2.724 -11.063 -3.825
363 HA2 GLY 57 1HA GLY 57 -1.230 -12.948 -4.564
364 HA3 GLY 57 2HA GLY 57 -0.654 -11.863 -5.839
365 H CYS 58 H CYS 58 -1.370 -11.073 -2.388
366 HA CYS 58 HA CYS 58 1.448 -11.041 -1.734
367 HB2 CYS 58 1HB CYS 58 -0.107 -8.524 -2.058
368 HB3 CYS 58 2HB CYS 58 0.748 -8.680 -0.538
369 H ASP 59 H ASP 59 1.610 -10.319 0.661
370 HA ASP 59 HA ASP 59 0.072 -12.428 2.039
371 HB2 ASP 59 1HB ASP 59 2.780 -11.488 2.082
372 HB3 ASP 59 2HB ASP 59 2.115 -11.097 3.650
373 H MET 60 H MET 60 -0.208 -11.803 4.597
374 HA MET 60 HA MET 60 -0.686 -9.024 5.014
375 HB2 MET 60 1HB MET 60 -2.931 -9.226 5.907
376 HB3 MET 60 2HB MET 60 -2.907 -9.659 4.192
377 HG2 MET 60 1HG MET 60 -3.609 -11.752 4.579
378 HG3 MET 60 2HG MET 60 -2.599 -11.986 5.993
379 HE1 MET 60 3HE MET 60 -3.223 -11.686 8.389
380 HE2 MET 60 1HE MET 60 -3.398 -9.927 8.207
381 HE3 MET 60 2HE MET 60 -4.678 -10.874 8.994
382 H GLU 61 H GLU 61 -1.006 -8.575 7.369
383 HA GLU 61 HA GLU 61 -0.216 -10.765 9.214
384 HB2 GLU 61 1HB GLU 61 1.204 -8.088 8.879
385 HB3 GLU 61 2HB GLU 61 1.489 -9.236 10.182
386 HG2 GLU 61 1HG GLU 61 2.436 -10.860 8.697
387 HG3 GLU 61 2HG GLU 61 1.966 -9.938 7.255
Start of MODEL 14
1 H1 TYR 1 H TYR 1 -13.330 10.134 1.603
2 HA TYR 1 HA TYR 1 -11.709 9.388 3.303
3 HB2 TYR 1 1HB TYR 1 -12.615 7.513 4.186
4 HB3 TYR 1 2HB TYR 1 -13.020 6.765 2.684
5 HD1 TYR 1 1HD TYR 1 -10.019 7.748 4.717
6 HD2 TYR 1 2HD TYR 1 -11.623 4.918 1.762
7 HE1 TYR 1 1HE TYR 1 -8.100 6.255 4.984
8 HE2 TYR 1 2HE TYR 1 -9.752 3.627 1.967
9 HH TYR 1 HH TYR 1 -7.559 3.788 4.690
10 H ASN 2 H ASN 2 -11.572 7.094 0.538
11 HA ASN 2 HA ASN 2 -9.990 6.641 -0.817
12 HB2 ASN 2 1HB ASN 2 -9.293 9.557 -0.763
13 HB3 ASN 2 2HB ASN 2 -8.423 8.375 -1.737
14 HD21 ASN 2 1HD2 ASN 2 -10.582 10.719 -2.092
15 HD22 ASN 2 2HD2 ASN 2 -11.701 10.022 -3.282
16 HA PRO 3 HA PRO 3 -6.957 5.927 2.375
17 HB2 PRO 3 1HB PRO 3 -5.139 4.388 0.924
18 HB3 PRO 3 2HB PRO 3 -6.634 3.782 1.643
19 HG2 PRO 3 1HG PRO 3 -6.129 4.484 -1.218
20 HG3 PRO 3 2HG PRO 3 -7.232 3.256 -0.501
21 HD2 PRO 3 1HD PRO 3 -8.108 5.622 -1.506
22 HD3 PRO 3 2HD PRO 3 -8.936 4.648 -0.249
23 H GLU 4 H GLU 4 -6.246 7.518 -0.592
24 HA GLU 4 HA GLU 4 -3.631 8.478 -0.202
25 HB2 GLU 4 1HB GLU 4 -6.094 9.593 -1.572
26 HB3 GLU 4 2HB GLU 4 -4.496 10.307 -1.769
27 HG2 GLU 4 1HG GLU 4 -3.630 8.530 -3.004
28 HG3 GLU 4 2HG GLU 4 -4.747 7.351 -2.347
29 H ASP 5 H ASP 5 -6.411 9.183 1.697
30 HA ASP 5 HA ASP 5 -6.040 11.845 2.574
31 HB2 ASP 5 1HB ASP 5 -7.953 10.208 2.881
32 HB3 ASP 5 2HB ASP 5 -7.014 9.425 4.143
33 H ASP 6 H ASP 6 -4.331 8.877 3.321
34 HA ASP 6 HA ASP 6 -2.556 10.172 5.375
35 HB2 ASP 6 1HB ASP 6 -3.763 7.409 5.352
36 HB3 ASP 6 2HB ASP 6 -2.483 7.934 6.442
37 H TYR 7 H TYR 7 -2.279 9.908 2.409
38 HA TYR 7 HA TYR 7 -0.299 7.898 1.793
39 HB2 TYR 7 1HB TYR 7 -1.492 8.979 0.003
40 HB3 TYR 7 2HB TYR 7 -1.091 10.583 0.605
41 HD1 TYR 7 2HD TYR 7 1.170 7.612 -0.091
42 HD2 TYR 7 1HD TYR 7 0.107 11.680 -1.076
43 HE1 TYR 7 2HE TYR 7 2.914 7.632 -1.809
44 HE2 TYR 7 1HE TYR 7 1.941 11.735 -2.736
45 HH TYR 7 HH TYR 7 4.019 8.891 -3.426
46 H THR 8 H THR 8 1.780 7.836 2.623
47 HA THR 8 HA THR 8 2.963 10.332 3.661
48 HB THR 8 HB THR 8 4.504 8.637 4.793
49 HG1 THR 8 1HG THR 8 3.633 6.581 5.021
50 HG21 THR 8 3HG2 THR 8 1.534 8.546 5.482
51 HG22 THR 8 1HG2 THR 8 2.918 8.279 6.577
52 HG23 THR 8 2HG2 THR 8 2.634 9.878 5.913
53 HA PRO 9 HA PRO 9 5.097 9.570 -0.408
54 HB2 PRO 9 1HB PRO 9 5.771 12.191 -0.932
55 HB3 PRO 9 2HB PRO 9 4.209 11.469 -1.387
56 HG2 PRO 9 1HG PRO 9 4.854 13.144 1.046
57 HG3 PRO 9 2HG PRO 9 3.440 13.240 -0.040
58 HD2 PRO 9 1HD PRO 9 3.265 11.984 2.328
59 HD3 PRO 9 2HD PRO 9 2.445 11.331 0.875
60 H LEU 10 H LEU 10 6.075 11.176 2.532
61 HA LEU 10 HA LEU 10 8.757 11.857 1.797
62 HB2 LEU 10 1HB LEU 10 7.543 11.291 4.546
63 HB3 LEU 10 2HB LEU 10 9.084 12.093 4.242
64 HG LEU 10 HG LEU 10 6.324 13.146 3.465
65 HD11 LEU 10 1HD1 LEU 10 6.827 14.925 5.085
66 HD12 LEU 10 2HD1 LEU 10 6.817 13.330 5.845
67 HD13 LEU 10 3HD1 LEU 10 8.371 14.139 5.487
68 HD21 LEU 10 3HD2 LEU 10 7.676 15.242 2.854
69 HD22 LEU 10 1HD2 LEU 10 9.104 14.196 2.883
70 HD23 LEU 10 2HD2 LEU 10 7.783 13.891 1.725
71 H THR 11 H THR 11 7.279 8.893 3.115
72 HA THR 11 HA THR 11 9.866 7.495 3.015
73 HB THR 11 HB THR 11 8.175 5.828 4.301
74 HG1 THR 11 1HG THR 11 6.850 7.159 5.672
75 HG21 THR 11 3HG2 THR 11 9.008 6.746 6.417
76 HG22 THR 11 1HG2 THR 11 10.286 6.733 5.205
77 HG23 THR 11 2HG2 THR 11 9.463 8.262 5.610
78 H CYS 12 H CYS 12 6.776 7.794 1.333
79 HA CYS 12 HA CYS 12 6.792 5.063 0.453
80 HB2 CYS 12 1HB CYS 12 4.745 6.423 0.804
81 HB3 CYS 12 2HB CYS 12 5.170 7.375 -0.624
82 HA PRO 13 HA PRO 13 9.475 6.064 -3.076
83 HB2 PRO 13 1HB PRO 13 9.959 3.519 -3.977
84 HB3 PRO 13 2HB PRO 13 10.748 4.245 -2.544
85 HG2 PRO 13 1HG PRO 13 8.480 2.295 -2.675
86 HG3 PRO 13 2HG PRO 13 9.816 2.377 -1.499
87 HD2 PRO 13 1HD PRO 13 7.223 3.370 -1.094
88 HD3 PRO 13 2HD PRO 13 8.663 3.881 -0.184
89 H HIS 14 H HIS 14 6.369 5.859 -3.238
90 HA HIS 14 HA HIS 14 6.216 5.492 -6.173
91 HB2 HIS 14 1HB HIS 14 3.945 4.513 -4.440
92 HB3 HIS 14 2HB HIS 14 4.303 4.092 -6.100
93 HD1 HIS 14 1HD HIS 14 6.567 2.413 -6.430
94 HD2 HIS 14 2HD HIS 14 4.752 2.795 -2.635
95 HE1 HIS 14 1HE HIS 14 7.111 0.344 -5.100
96 HE2 HIS 14 2HE HIS 14 6.169 0.671 -2.732
97 H THR 15 H THR 15 4.490 6.674 -7.144
98 HA THR 15 HA THR 15 4.107 9.222 -5.814
99 HB THR 15 HB THR 15 3.171 9.728 -8.177
100 HG1 THR 15 1HG THR 15 4.359 7.774 -9.456
101 HG21 THR 15 3HG2 THR 15 5.448 10.258 -7.539
102 HG22 THR 15 1HG2 THR 15 5.999 8.625 -7.900
103 HG23 THR 15 2HG2 THR 15 5.423 9.696 -9.212
104 H ILE 16 H ILE 16 2.022 10.294 -5.616
105 HA ILE 16 HA ILE 16 -0.224 8.660 -5.021
106 HB ILE 16 HB ILE 16 0.263 10.991 -4.260
107 HG12 ILE 16 1HG1 ILE 16 -2.564 10.443 -5.238
108 HG13 ILE 16 2HG1 ILE 16 -1.802 9.764 -3.802
109 HG21 ILE 16 1HG2 ILE 16 -0.426 12.923 -5.484
110 HG22 ILE 16 2HG2 ILE 16 0.704 12.019 -6.489
111 HG23 ILE 16 3HG2 ILE 16 -1.047 11.938 -6.818
112 HD11 ILE 16 3HD1 ILE 16 -1.536 12.048 -2.847
113 HD12 ILE 16 1HD1 ILE 16 -2.405 12.705 -4.264
114 HD13 ILE 16 2HD1 ILE 16 -3.226 11.606 -3.153
115 H SER 17 H SER 17 1.154 9.254 -7.977
116 HA SER 17 HA SER 17 -1.140 9.096 -9.720
117 HB2 SER 17 1HB SER 17 1.266 9.852 -10.286
118 HB3 SER 17 2HB SER 17 1.704 8.144 -10.222
119 HG SER 17 HG SER 17 -0.426 8.509 -11.842
120 H VAL 18 H VAL 18 1.189 6.721 -8.273
121 HA VAL 18 HA VAL 18 -0.700 4.518 -8.835
122 HB VAL 18 HB VAL 18 0.977 3.249 -10.020
123 HG11 VAL 18 1HG1 VAL 18 -0.414 4.765 -11.420
124 HG12 VAL 18 2HG1 VAL 18 0.918 5.950 -11.400
125 HG13 VAL 18 3HG1 VAL 18 1.157 4.349 -12.119
126 HG21 VAL 18 3HG2 VAL 18 3.131 4.864 -10.664
127 HG22 VAL 18 1HG2 VAL 18 2.699 5.365 -8.970
128 HG23 VAL 18 2HG2 VAL 18 3.041 3.687 -9.308
129 H VAL 19 H VAL 19 -0.606 5.271 -6.555
130 HA VAL 19 HA VAL 19 1.229 3.428 -5.195
131 HB VAL 19 HB VAL 19 1.439 5.693 -4.520
132 HG11 VAL 19 1HG1 VAL 19 -0.864 6.514 -4.868
133 HG12 VAL 19 2HG1 VAL 19 -1.424 5.551 -3.486
134 HG13 VAL 19 3HG1 VAL 19 -0.284 6.886 -3.235
135 HG21 VAL 19 3HG2 VAL 19 1.972 3.873 -2.977
136 HG22 VAL 19 1HG2 VAL 19 1.526 5.389 -2.183
137 HG23 VAL 19 2HG2 VAL 19 0.365 4.043 -2.246
138 H TRP 20 H TRP 20 -2.354 4.052 -5.379
139 HA TRP 20 HA TRP 20 -2.990 2.066 -3.500
140 HB2 TRP 20 1HB TRP 20 -4.648 3.639 -4.364
141 HB3 TRP 20 2HB TRP 20 -4.585 2.903 -5.955
142 HD1 TRP 20 HD TRP 20 -6.405 1.124 -6.385
143 HE1 TRP 20 1HE TRP 20 -8.002 -0.262 -4.980
144 HE3 TRP 20 3HE TRP 20 -4.540 2.196 -1.729
145 HZ2 TRP 20 2HZ TRP 20 -8.707 -0.504 -2.138
146 HZ3 TRP 20 3HZ TRP 20 -5.716 1.408 0.277
147 HH2 TRP 20 HH TRP 20 -7.878 0.175 0.079
148 H TYR 21 H TYR 21 -3.134 1.532 -7.070
149 HA TYR 21 HA TYR 21 -3.421 -1.304 -6.824
150 HB2 TYR 21 1HB TYR 21 -4.058 -0.617 -8.883
151 HB3 TYR 21 2HB TYR 21 -2.826 0.596 -9.036
152 HD1 TYR 21 1HD TYR 21 -0.398 -0.083 -9.592
153 HD2 TYR 21 2HD TYR 21 -3.746 -2.787 -9.850
154 HE1 TYR 21 1HE TYR 21 0.939 -1.588 -11.022
155 HE2 TYR 21 2HE TYR 21 -2.431 -4.287 -11.289
156 HH TYR 21 HH TYR 21 0.111 -4.719 -11.744
157 H GLU 22 H GLU 22 -0.432 0.760 -6.950
158 HA GLU 22 HA GLU 22 1.448 -1.242 -7.403
159 HB2 GLU 22 1HB GLU 22 2.715 0.662 -7.260
160 HB3 GLU 22 2HB GLU 22 1.246 1.487 -6.863
161 HG2 GLU 22 1HG GLU 22 2.865 2.038 -5.325
162 HG3 GLU 22 2HG GLU 22 1.733 1.063 -4.396
163 H CYS 23 H CYS 23 -0.430 -0.475 -4.447
164 HA CYS 23 HA CYS 23 1.338 -2.223 -2.885
165 HB2 CYS 23 1HB CYS 23 0.693 0.364 -2.469
166 HB3 CYS 23 2HB CYS 23 -0.697 -0.342 -1.716
167 H THR 24 H THR 24 -1.558 -2.429 -4.510
168 HA THR 24 HA THR 24 -2.646 -4.289 -2.486
169 HB THR 24 HB THR 24 -4.857 -3.465 -2.916
170 HG1 THR 24 1HG THR 24 -3.677 -1.320 -4.306
171 HG21 THR 24 3HG2 THR 24 -2.999 -1.178 -2.115
172 HG22 THR 24 1HG2 THR 24 -4.733 -1.302 -1.775
173 HG23 THR 24 2HG2 THR 24 -3.600 -2.460 -1.051
174 H GLU 25 H GLU 25 -1.538 -4.096 -5.651
175 HA GLU 25 HA GLU 25 -2.947 -6.614 -6.339
176 HB2 GLU 25 1HB GLU 25 -4.116 -4.520 -7.231
177 HB3 GLU 25 2HB GLU 25 -2.692 -4.202 -8.176
178 HG2 GLU 25 1HG GLU 25 -3.094 -5.929 -9.664
179 HG3 GLU 25 2HG GLU 25 -3.803 -6.953 -8.418
180 H ASN 26 H ASN 26 -0.297 -4.293 -6.948
181 HA ASN 26 HA ASN 26 1.119 -6.127 -8.731
182 HB2 ASN 26 1HB ASN 26 1.379 -3.762 -9.104
183 HB3 ASN 26 2HB ASN 26 1.909 -3.511 -7.436
184 HD21 ASN 26 1HD2 ASN 26 3.839 -2.545 -8.324
185 HD22 ASN 26 2HD2 ASN 26 5.147 -3.581 -8.884
186 H THR 27 H THR 27 1.615 -8.036 -7.633
187 HA THR 27 HA THR 27 2.079 -8.138 -4.838
188 HB THR 27 HB THR 27 2.676 -10.504 -5.270
189 HG1 THR 27 1HG THR 27 3.368 -10.978 -7.139
190 HG21 THR 27 3HG2 THR 27 0.202 -9.612 -6.848
191 HG22 THR 27 1HG2 THR 27 0.482 -11.197 -6.081
192 HG23 THR 27 2HG2 THR 27 0.289 -9.768 -5.085
193 H ALA 28 H ALA 28 4.280 -7.292 -7.381
194 HA ALA 28 HA ALA 28 6.778 -7.996 -6.320
195 HB1 ALA 28 1HB ALA 28 7.619 -6.057 -7.519
196 HB2 ALA 28 2HB ALA 28 6.331 -6.771 -8.507
197 HB3 ALA 28 3HB ALA 28 6.018 -5.311 -7.551
198 H ASN 29 H ASN 29 4.441 -5.597 -5.172
199 HA ASN 29 HA ASN 29 6.295 -4.891 -2.943
200 HB2 ASN 29 1HB ASN 29 4.423 -2.889 -4.228
201 HB3 ASN 29 2HB ASN 29 5.612 -2.607 -2.956
202 HD21 ASN 29 1HD2 ASN 29 5.260 -1.500 -5.793
203 HD22 ASN 29 2HD2 ASN 29 6.706 -2.002 -6.713
204 H CYS 30 H CYS 30 2.880 -5.103 -4.064
205 HA CYS 30 HA CYS 30 1.506 -4.265 -1.891
206 HB2 CYS 30 1HB CYS 30 0.238 -4.846 -3.729
207 HB3 CYS 30 2HB CYS 30 0.992 -6.390 -3.970
208 H GLY 31 H GLY 31 0.848 -4.929 0.127
209 HA2 GLY 31 1HA GLY 31 0.662 -7.338 1.340
210 HA3 GLY 31 2HA GLY 31 2.398 -7.032 1.360
211 H THR 32 H THR 32 1.723 -7.192 3.810
212 HA THR 32 HA THR 32 0.278 -5.017 4.988
213 HB THR 32 HB THR 32 2.206 -7.039 6.203
214 HG1 THR 32 1HG THR 32 -0.230 -7.401 7.028
215 HG21 THR 32 3HG2 THR 32 1.994 -5.075 7.710
216 HG22 THR 32 1HG2 THR 32 0.222 -5.204 7.620
217 HG23 THR 32 2HG2 THR 32 1.189 -6.498 8.375
218 H ALA 33 H ALA 33 3.824 -5.658 4.688
219 HA ALA 33 HA ALA 33 4.563 -3.275 6.108
220 HB1 ALA 33 1HB ALA 33 6.219 -4.844 4.070
221 HB2 ALA 33 2HB ALA 33 6.815 -3.690 5.268
222 HB3 ALA 33 3HB ALA 33 6.116 -5.226 5.804
223 H CYS 34 H CYS 34 4.059 -4.040 2.683
224 HA CYS 34 HA CYS 34 4.771 -1.627 1.468
225 HB2 CYS 34 1HB CYS 34 3.978 -3.654 0.373
226 HB3 CYS 34 2HB CYS 34 2.337 -3.362 0.895
227 H CYS 35 H CYS 35 1.536 -2.498 2.809
228 HA CYS 35 HA CYS 35 0.379 0.034 2.303
229 HB2 CYS 35 1HB CYS 35 -0.296 -2.128 4.328
230 HB3 CYS 35 2HB CYS 35 -1.276 -0.685 4.096
231 H ASP 36 H ASP 36 2.027 -1.241 5.250
232 HA ASP 36 HA ASP 36 1.508 1.187 6.692
233 HB2 ASP 36 1HB ASP 36 2.084 -1.309 7.455
234 HB3 ASP 36 2HB ASP 36 3.721 -0.681 7.523
235 H SER 37 H SER 37 4.139 0.275 4.602
236 HA SER 37 HA SER 37 5.967 2.358 5.245
237 HB2 SER 37 1HB SER 37 5.469 0.928 2.599
238 HB3 SER 37 2HB SER 37 6.869 1.934 2.970
239 HG SER 37 HG SER 37 6.105 -0.502 4.222
240 H CYS 38 H CYS 38 2.991 2.398 3.288
241 HA CYS 38 HA CYS 38 3.707 5.125 2.264
242 HB2 CYS 38 1HB CYS 38 2.344 2.738 0.980
243 HB3 CYS 38 2HB CYS 38 2.207 4.358 0.323
244 H PHE 39 H PHE 39 1.317 3.417 4.140
245 HA PHE 39 HA PHE 39 -0.459 5.758 3.964
246 HB2 PHE 39 1HB PHE 39 -1.309 2.815 3.856
247 HB3 PHE 39 2HB PHE 39 -2.373 4.173 4.100
248 HD1 PHE 39 2HD PHE 39 -2.636 5.918 2.235
249 HD2 PHE 39 1HD PHE 39 -0.880 2.032 1.624
250 HE1 PHE 39 2HE PHE 39 -3.268 6.004 -0.162
251 HE2 PHE 39 1HE PHE 39 -1.521 2.108 -0.758
252 HZ PHE 39 HZ PHE 39 -2.735 4.086 -1.643
253 H GLU 40 H GLU 40 -1.352 6.252 5.941
254 HA GLU 40 HA GLU 40 -0.689 4.454 8.223
255 HB2 GLU 40 1HB GLU 40 -0.873 7.475 8.279
256 HB3 GLU 40 2HB GLU 40 -0.357 6.448 9.590
257 HG2 GLU 40 1HG GLU 40 1.466 5.692 7.737
258 HG3 GLU 40 2HG GLU 40 1.087 7.338 7.221
259 H LEU 41 H LEU 41 -2.091 4.940 10.125
260 HA LEU 41 HA LEU 41 -4.126 4.927 11.136
261 HB2 LEU 41 1HB LEU 41 -4.512 7.399 9.399
262 HB3 LEU 41 2HB LEU 41 -5.302 7.059 10.944
263 HG LEU 41 HG LEU 41 -2.311 7.557 10.511
264 HD11 LEU 41 1HD1 LEU 41 -2.718 9.656 11.686
265 HD12 LEU 41 2HD1 LEU 41 -3.650 9.542 10.193
266 HD13 LEU 41 3HD1 LEU 41 -4.467 9.307 11.741
267 HD21 LEU 41 3HD2 LEU 41 -2.470 6.086 12.375
268 HD22 LEU 41 1HD2 LEU 41 -2.291 7.701 13.052
269 HD23 LEU 41 2HD2 LEU 41 -3.897 6.905 13.023
270 H THR 42 H THR 42 -6.274 6.442 9.043
271 HA THR 42 HA THR 42 -7.771 3.987 8.639
272 HB THR 42 HB THR 42 -8.201 6.782 7.499
273 HG1 THR 42 1HG THR 42 -9.494 7.069 9.337
274 HG21 THR 42 3HG2 THR 42 -10.479 6.197 7.117
275 HG22 THR 42 1HG2 THR 42 -9.602 4.816 6.493
276 HG23 THR 42 2HG2 THR 42 -10.355 4.700 8.080
277 H GLY 43 H GLY 43 -5.614 6.069 6.633
278 HA2 GLY 43 1HA GLY 43 -5.945 5.035 4.062
279 HA3 GLY 43 2HA GLY 43 -4.441 5.562 4.767
280 H ASN 44 H ASN 44 -3.937 3.855 6.743
281 HA ASN 44 HA ASN 44 -2.673 1.722 5.441
282 HB2 ASN 44 1HB ASN 44 -1.988 2.665 7.634
283 HB3 ASN 44 2HB ASN 44 -3.364 1.892 8.401
284 HD21 ASN 44 1HD2 ASN 44 -0.521 1.238 6.353
285 HD22 ASN 44 2HD2 ASN 44 -0.187 -0.308 7.096
286 H THR 45 H THR 45 -5.619 1.739 7.503
287 HA THR 45 HA THR 45 -6.187 -0.912 7.478
288 HB THR 45 HB THR 45 -8.332 1.208 7.303
289 HG1 THR 45 1HG THR 45 -7.859 1.819 9.334
290 HG21 THR 45 3HG2 THR 45 -9.462 -0.178 9.017
291 HG22 THR 45 1HG2 THR 45 -9.158 -1.090 7.526
292 HG23 THR 45 2HG2 THR 45 -8.117 -1.345 8.948
293 H MET 46 H MET 46 -7.504 1.469 4.980
294 HA MET 46 HA MET 46 -8.874 -0.787 3.775
295 HB2 MET 46 1HB MET 46 -8.713 1.948 2.435
296 HB3 MET 46 2HB MET 46 -9.653 0.545 2.016
297 HG2 MET 46 1HG MET 46 -10.441 0.578 4.501
298 HG3 MET 46 2HG MET 46 -9.840 2.241 4.510
299 HE1 MET 46 3HE MET 46 -13.415 0.542 2.101
300 HE2 MET 46 1HE MET 46 -11.810 0.503 1.342
301 HE3 MET 46 2HE MET 46 -12.105 -0.389 2.857
302 H CYS 47 H CYS 47 -5.706 0.678 3.203
303 HA CYS 47 HA CYS 47 -5.098 -0.738 0.791
304 HB2 CYS 47 1HB CYS 47 -3.726 1.078 1.724
305 HB3 CYS 47 2HB CYS 47 -3.291 0.079 3.099
306 H LEU 48 H LEU 48 -4.613 -1.679 4.262
307 HA LEU 48 HA LEU 48 -3.645 -4.250 3.772
308 HB2 LEU 48 1HB LEU 48 -5.322 -3.145 6.058
309 HB3 LEU 48 2HB LEU 48 -4.678 -4.769 6.025
310 HG LEU 48 HG LEU 48 -3.005 -2.228 6.010
311 HD11 LEU 48 1HD1 LEU 48 -3.506 -4.339 8.164
312 HD12 LEU 48 2HD1 LEU 48 -2.381 -2.976 8.291
313 HD13 LEU 48 3HD1 LEU 48 -4.111 -2.661 8.164
314 HD21 LEU 48 3HD2 LEU 48 -1.801 -3.997 4.811
315 HD22 LEU 48 1HD2 LEU 48 -1.088 -3.709 6.390
316 HD23 LEU 48 2HD2 LEU 48 -2.116 -5.140 6.146
317 H LEU 49 H LEU 49 -7.040 -3.177 4.176
318 HA LEU 49 HA LEU 49 -8.257 -5.692 3.832
319 HB2 LEU 49 1HB LEU 49 -9.141 -2.891 3.722
320 HB3 LEU 49 2HB LEU 49 -9.983 -3.864 2.539
321 HG LEU 49 HG LEU 49 -10.452 -5.540 4.436
322 HD11 LEU 49 1HD1 LEU 49 -10.401 -4.635 6.720
323 HD12 LEU 49 2HD1 LEU 49 -8.766 -4.614 6.035
324 HD13 LEU 49 3HD1 LEU 49 -9.695 -3.111 6.119
325 HD21 LEU 49 3HD2 LEU 49 -12.377 -4.203 5.261
326 HD22 LEU 49 1HD2 LEU 49 -11.661 -2.754 4.501
327 HD23 LEU 49 2HD2 LEU 49 -12.191 -4.123 3.503
328 H GLN 50 H GLN 50 -7.410 -3.338 1.193
329 HA GLN 50 HA GLN 50 -8.560 -4.961 -0.842
330 HB2 GLN 50 1HB GLN 50 -8.103 -2.507 -0.959
331 HB3 GLN 50 2HB GLN 50 -6.377 -2.849 -1.038
332 HG2 GLN 50 1HG GLN 50 -7.109 -2.454 -3.277
333 HG3 GLN 50 2HG GLN 50 -6.821 -4.186 -3.167
334 HE21 GLN 50 1HE2 GLN 50 -8.374 -5.339 -4.288
335 HE22 GLN 50 2HE2 GLN 50 -10.064 -4.901 -4.364
336 H ALA 51 H ALA 51 -5.125 -4.592 0.255
337 HA ALA 51 HA ALA 51 -3.993 -6.460 -1.597
338 HB1 ALA 51 1HB ALA 51 -3.130 -5.486 1.170
339 HB2 ALA 51 2HB ALA 51 -2.124 -6.529 0.145
340 HB3 ALA 51 3HB ALA 51 -2.555 -4.903 -0.395
341 H GLY 52 H GLY 52 -5.479 -6.843 1.621
342 HA2 GLY 52 1HA GLY 52 -4.794 -9.669 1.849
343 HA3 GLY 52 2HA GLY 52 -5.595 -8.639 3.019
344 H ALA 53 H ALA 53 -6.915 -8.622 -0.228
345 HA ALA 53 HA ALA 53 -9.474 -8.843 0.645
346 HB1 ALA 53 1HB ALA 53 -10.100 -9.346 -1.729
347 HB2 ALA 53 2HB ALA 53 -8.981 -7.987 -1.538
348 HB3 ALA 53 3HB ALA 53 -8.375 -9.566 -2.098
349 H ALA 54 H ALA 54 -7.885 -11.625 -1.050
350 HA ALA 54 HA ALA 54 -8.809 -13.518 0.867
351 HB1 ALA 54 1HB ALA 54 -11.019 -13.419 -0.070
352 HB2 ALA 54 2HB ALA 54 -10.386 -13.376 -1.739
353 HB3 ALA 54 3HB ALA 54 -10.269 -14.846 -0.775
354 H GLY 55 H GLY 55 -6.631 -14.039 0.774
355 HA2 GLY 55 1HA GLY 55 -4.820 -15.253 0.156
356 HA3 GLY 55 2HA GLY 55 -5.970 -16.322 -0.663
357 H SER 56 H SER 56 -5.130 -12.934 -1.396
358 HA SER 56 HA SER 56 -5.175 -13.345 -4.167
359 HB2 SER 56 1HB SER 56 -4.000 -10.972 -2.660
360 HB3 SER 56 2HB SER 56 -4.798 -10.990 -4.245
361 HG SER 56 HG SER 56 -6.710 -11.607 -3.223
362 H GLY 57 H GLY 57 -2.249 -12.192 -2.335
363 HA2 GLY 57 1HA GLY 57 -0.464 -14.185 -2.643
364 HA3 GLY 57 2HA GLY 57 -0.543 -13.575 -4.295
365 H CYS 58 H CYS 58 -0.443 -11.868 -1.059
366 HA CYS 58 HA CYS 58 1.674 -10.131 -2.247
367 HB2 CYS 58 1HB CYS 58 -0.742 -9.493 -0.555
368 HB3 CYS 58 2HB CYS 58 0.617 -8.418 -0.660
369 H ASP 59 H ASP 59 2.840 -8.868 -0.498
370 HA ASP 59 HA ASP 59 4.299 -10.723 1.197
371 HB2 ASP 59 1HB ASP 59 5.382 -9.090 -0.283
372 HB3 ASP 59 2HB ASP 59 4.579 -7.758 0.541
373 H MET 60 H MET 60 1.934 -10.891 2.362
374 HA MET 60 HA MET 60 1.562 -8.867 4.463
375 HB2 MET 60 1HB MET 60 0.376 -11.662 4.362
376 HB3 MET 60 2HB MET 60 -0.080 -10.316 5.400
377 HG2 MET 60 1HG MET 60 -1.767 -10.278 3.851
378 HG3 MET 60 2HG MET 60 -0.677 -9.046 3.227
379 HE1 MET 60 3HE MET 60 -2.523 -9.520 1.197
380 HE2 MET 60 1HE MET 60 -2.572 -11.033 0.253
381 HE3 MET 60 2HE MET 60 -3.145 -11.019 1.935
382 H GLU 61 H GLU 61 1.641 -9.527 6.752
383 HA GLU 61 HA GLU 61 3.456 -11.755 7.421
384 HB2 GLU 61 1HB GLU 61 2.847 -9.195 8.976
385 HB3 GLU 61 2HB GLU 61 3.327 -10.701 9.761
386 HG2 GLU 61 1HG GLU 61 5.402 -10.729 8.361
387 HG3 GLU 61 2HG GLU 61 4.969 -9.131 7.740
Start of MODEL 15
1 H1 TYR 1 H TYR 1 -13.918 5.527 2.522
2 HA TYR 1 HA TYR 1 -13.087 8.379 2.618
3 HB2 TYR 1 1HB TYR 1 -13.003 7.370 4.820
4 HB3 TYR 1 2HB TYR 1 -12.244 5.922 4.196
5 HD1 TYR 1 1HD TYR 1 -11.596 9.603 4.667
6 HD2 TYR 1 2HD TYR 1 -9.898 5.663 4.217
7 HE1 TYR 1 1HE TYR 1 -9.415 10.453 5.454
8 HE2 TYR 1 2HE TYR 1 -7.726 6.508 4.911
9 HH TYR 1 HH TYR 1 -7.151 9.986 5.732
10 H ASN 2 H ASN 2 -11.440 8.915 1.140
11 HA ASN 2 HA ASN 2 -10.365 6.787 -0.597
12 HB2 ASN 2 1HB ASN 2 -9.321 9.627 -0.361
13 HB3 ASN 2 2HB ASN 2 -9.015 8.471 -1.633
14 HD21 ASN 2 1HD2 ASN 2 -10.480 11.257 -1.142
15 HD22 ASN 2 2HD2 ASN 2 -11.857 11.165 -2.211
16 HA PRO 3 HA PRO 3 -7.212 5.904 2.622
17 HB2 PRO 3 1HB PRO 3 -5.682 5.143 0.125
18 HB3 PRO 3 2HB PRO 3 -5.782 4.283 1.689
19 HG2 PRO 3 1HG PRO 3 -7.271 3.568 -0.514
20 HG3 PRO 3 2HG PRO 3 -7.904 3.407 1.143
21 HD2 PRO 3 1HD PRO 3 -8.582 5.383 -0.973
22 HD3 PRO 3 2HD PRO 3 -9.527 4.743 0.414
23 H GLU 4 H GLU 4 -6.239 7.209 -0.506
24 HA GLU 4 HA GLU 4 -3.929 8.402 -0.161
25 HB2 GLU 4 1HB GLU 4 -6.344 9.228 -1.839
26 HB3 GLU 4 2HB GLU 4 -4.767 9.965 -2.091
27 HG2 GLU 4 1HG GLU 4 -3.733 7.918 -2.743
28 HG3 GLU 4 2HG GLU 4 -5.101 6.965 -2.155
29 H ASP 5 H ASP 5 -6.449 9.535 1.687
30 HA ASP 5 HA ASP 5 -5.738 12.371 1.919
31 HB2 ASP 5 1HB ASP 5 -7.970 11.841 2.520
32 HB3 ASP 5 2HB ASP 5 -7.469 10.415 3.436
33 H ASP 6 H ASP 6 -4.797 9.200 3.213
34 HA ASP 6 HA ASP 6 -3.155 10.119 5.421
35 HB2 ASP 6 1HB ASP 6 -2.720 7.904 5.771
36 HB3 ASP 6 2HB ASP 6 -4.394 7.920 5.217
37 H TYR 7 H TYR 7 -2.658 9.551 2.051
38 HA TYR 7 HA TYR 7 -0.578 8.138 1.990
39 HB2 TYR 7 1HB TYR 7 -1.611 8.351 -0.065
40 HB3 TYR 7 2HB TYR 7 -1.591 10.110 -0.027
41 HD1 TYR 7 2HD TYR 7 0.681 7.119 -0.473
42 HD2 TYR 7 1HD TYR 7 0.178 11.363 -0.923
43 HE1 TYR 7 2HE TYR 7 2.709 7.211 -1.898
44 HE2 TYR 7 1HE TYR 7 2.216 11.474 -2.341
45 HH TYR 7 HH TYR 7 4.075 8.531 -3.201
46 H THR 8 H THR 8 1.503 8.177 2.433
47 HA THR 8 HA THR 8 2.520 10.808 3.127
48 HB THR 8 HB THR 8 3.960 9.706 4.705
49 HG1 THR 8 1HG THR 8 2.835 7.256 3.802
50 HG21 THR 8 3HG2 THR 8 2.369 8.767 6.237
51 HG22 THR 8 1HG2 THR 8 1.600 10.128 5.408
52 HG23 THR 8 2HG2 THR 8 1.181 8.458 4.969
53 HA PRO 9 HA PRO 9 5.102 9.843 -0.570
54 HB2 PRO 9 1HB PRO 9 5.995 12.321 -1.175
55 HB3 PRO 9 2HB PRO 9 4.327 11.796 -1.552
56 HG2 PRO 9 1HG PRO 9 5.278 13.428 0.829
57 HG3 PRO 9 2HG PRO 9 3.868 13.746 -0.231
58 HD2 PRO 9 1HD PRO 9 3.594 12.497 2.166
59 HD3 PRO 9 2HD PRO 9 2.636 11.992 0.736
60 H LEU 10 H LEU 10 6.181 10.815 2.498
61 HA LEU 10 HA LEU 10 8.695 12.045 1.823
62 HB2 LEU 10 1HB LEU 10 7.841 10.887 4.489
63 HB3 LEU 10 2HB LEU 10 9.046 12.131 4.184
64 HG LEU 10 HG LEU 10 6.030 12.374 3.830
65 HD11 LEU 10 1HD1 LEU 10 6.148 13.904 5.692
66 HD12 LEU 10 2HD1 LEU 10 6.891 12.385 6.150
67 HD13 LEU 10 3HD1 LEU 10 7.916 13.788 5.763
68 HD21 LEU 10 3HD2 LEU 10 7.234 13.742 2.084
69 HD22 LEU 10 1HD2 LEU 10 6.302 14.691 3.228
70 HD23 LEU 10 2HD2 LEU 10 8.071 14.594 3.392
71 H THR 11 H THR 11 7.685 8.837 2.739
72 HA THR 11 HA THR 11 10.378 7.757 2.102
73 HB THR 11 HB THR 11 9.853 6.050 3.922
74 HG1 THR 11 1HG THR 11 8.373 6.869 5.553
75 HG21 THR 11 3HG2 THR 11 10.118 8.930 4.882
76 HG22 THR 11 1HG2 THR 11 10.634 7.472 5.743
77 HG23 THR 11 2HG2 THR 11 11.453 7.938 4.246
78 H CYS 12 H CYS 12 7.211 7.892 0.933
79 HA CYS 12 HA CYS 12 6.940 5.023 0.447
80 HB2 CYS 12 1HB CYS 12 4.952 6.405 0.734
81 HB3 CYS 12 2HB CYS 12 5.384 7.348 -0.703
82 HA PRO 13 HA PRO 13 9.593 5.600 -3.200
83 HB2 PRO 13 1HB PRO 13 9.760 2.954 -4.003
84 HB3 PRO 13 2HB PRO 13 10.694 3.683 -2.658
85 HG2 PRO 13 1HG PRO 13 8.203 2.009 -2.561
86 HG3 PRO 13 2HG PRO 13 9.617 1.936 -1.497
87 HD2 PRO 13 1HD PRO 13 7.273 3.231 -0.853
88 HD3 PRO 13 2HD PRO 13 8.875 3.709 -0.221
89 H HIS 14 H HIS 14 6.434 5.662 -3.331
90 HA HIS 14 HA HIS 14 6.221 5.320 -6.242
91 HB2 HIS 14 1HB HIS 14 3.951 4.298 -4.539
92 HB3 HIS 14 2HB HIS 14 4.227 3.926 -6.213
93 HD1 HIS 14 1HD HIS 14 6.257 2.018 -6.695
94 HD2 HIS 14 2HD HIS 14 4.962 2.715 -2.736
95 HE1 HIS 14 1HE HIS 14 6.822 -0.072 -5.298
96 HE2 HIS 14 2HE HIS 14 6.108 0.398 -2.924
97 H THR 15 H THR 15 4.638 6.686 -7.104
98 HA THR 15 HA THR 15 4.236 9.152 -5.570
99 HB THR 15 HB THR 15 3.411 9.948 -7.800
100 HG1 THR 15 1HG THR 15 4.237 7.371 -8.695
101 HG21 THR 15 3HG2 THR 15 5.771 10.151 -7.206
102 HG22 THR 15 1HG2 THR 15 6.112 8.523 -7.831
103 HG23 THR 15 2HG2 THR 15 5.589 9.812 -8.940
104 H ILE 16 H ILE 16 2.095 10.188 -5.417
105 HA ILE 16 HA ILE 16 -0.052 8.432 -4.793
106 HB ILE 16 HB ILE 16 0.380 10.800 -4.038
107 HG12 ILE 16 1HG1 ILE 16 -2.466 9.954 -4.776
108 HG13 ILE 16 2HG1 ILE 16 -1.562 9.496 -3.339
109 HG21 ILE 16 1HG2 ILE 16 -0.511 12.657 -5.223
110 HG22 ILE 16 2HG2 ILE 16 0.511 11.758 -6.352
111 HG23 ILE 16 3HG2 ILE 16 -1.261 11.618 -6.446
112 HD11 ILE 16 3HD1 ILE 16 -2.498 12.306 -4.045
113 HD12 ILE 16 1HD1 ILE 16 -3.112 11.259 -2.764
114 HD13 ILE 16 2HD1 ILE 16 -1.470 11.896 -2.649
115 H SER 17 H SER 17 1.168 9.236 -7.850
116 HA SER 17 HA SER 17 -1.232 9.101 -9.434
117 HB2 SER 17 1HB SER 17 0.896 9.975 -10.279
118 HB3 SER 17 2HB SER 17 1.637 8.374 -10.114
119 HG SER 17 HG SER 17 -0.604 8.891 -11.764
120 H VAL 18 H VAL 18 1.064 6.678 -8.071
121 HA VAL 18 HA VAL 18 -0.819 4.484 -8.677
122 HB VAL 18 HB VAL 18 0.846 3.208 -9.871
123 HG11 VAL 18 1HG1 VAL 18 0.935 4.404 -11.969
124 HG12 VAL 18 2HG1 VAL 18 -0.611 4.779 -11.192
125 HG13 VAL 18 3HG1 VAL 18 0.706 5.955 -11.163
126 HG21 VAL 18 3HG2 VAL 18 2.574 5.354 -8.855
127 HG22 VAL 18 1HG2 VAL 18 2.921 3.700 -9.238
128 HG23 VAL 18 2HG2 VAL 18 2.949 4.880 -10.574
129 H VAL 19 H VAL 19 -0.709 5.108 -6.402
130 HA VAL 19 HA VAL 19 1.260 3.349 -5.059
131 HB VAL 19 HB VAL 19 1.457 5.617 -4.352
132 HG11 VAL 19 1HG1 VAL 19 -0.233 6.819 -3.095
133 HG12 VAL 19 2HG1 VAL 19 -0.882 6.381 -4.682
134 HG13 VAL 19 3HG1 VAL 19 -1.374 5.474 -3.241
135 HG21 VAL 19 3HG2 VAL 19 0.412 3.885 -2.118
136 HG22 VAL 19 1HG2 VAL 19 2.055 3.888 -2.764
137 HG23 VAL 19 2HG2 VAL 19 1.422 5.318 -1.934
138 H TRP 20 H TRP 20 -2.279 3.895 -5.435
139 HA TRP 20 HA TRP 20 -3.056 2.055 -3.363
140 HB2 TRP 20 1HB TRP 20 -4.581 3.798 -4.226
141 HB3 TRP 20 2HB TRP 20 -4.576 3.059 -5.820
142 HD1 TRP 20 HD TRP 20 -6.554 1.495 -6.275
143 HE1 TRP 20 1HE TRP 20 -8.239 0.180 -4.879
144 HE3 TRP 20 3HE TRP 20 -4.649 2.463 -1.635
145 HZ2 TRP 20 2HZ TRP 20 -8.734 -0.347 -2.075
146 HZ3 TRP 20 3HZ TRP 20 -5.762 1.601 0.380
147 HH2 TRP 20 HH TRP 20 -7.845 0.225 0.183
148 H TYR 21 H TYR 21 -3.259 1.701 -6.939
149 HA TYR 21 HA TYR 21 -3.603 -1.085 -7.112
150 HB2 TYR 21 1HB TYR 21 -3.712 -0.073 -9.195
151 HB3 TYR 21 2HB TYR 21 -2.419 1.065 -8.833
152 HD1 TYR 21 2HD TYR 21 -3.111 -2.412 -9.948
153 HD2 TYR 21 1HD TYR 21 -0.110 0.625 -9.342
154 HE1 TYR 21 2HE TYR 21 -1.451 -3.854 -11.053
155 HE2 TYR 21 1HE TYR 21 1.606 -0.863 -10.357
156 HH TYR 21 HH TYR 21 0.868 -4.117 -11.600
157 H GLU 22 H GLU 22 -0.577 0.810 -6.680
158 HA GLU 22 HA GLU 22 1.134 -1.323 -7.290
159 HB2 GLU 22 1HB GLU 22 2.473 0.584 -7.447
160 HB3 GLU 22 2HB GLU 22 1.097 1.467 -6.885
161 HG2 GLU 22 1HG GLU 22 2.952 1.988 -5.568
162 HG3 GLU 22 2HG GLU 22 1.848 1.099 -4.538
163 H CYS 23 H CYS 23 -0.460 -0.319 -4.206
164 HA CYS 23 HA CYS 23 1.400 -2.004 -2.674
165 HB2 CYS 23 1HB CYS 23 0.668 0.504 -2.243
166 HB3 CYS 23 2HB CYS 23 -0.752 -0.230 -1.546
167 H THR 24 H THR 24 -1.562 -2.300 -4.257
168 HA THR 24 HA THR 24 -2.538 -4.231 -2.262
169 HB THR 24 HB THR 24 -4.816 -3.483 -2.708
170 HG1 THR 24 1HG THR 24 -3.730 -1.389 -4.248
171 HG21 THR 24 3HG2 THR 24 -4.722 -1.219 -1.770
172 HG22 THR 24 1HG2 THR 24 -3.591 -2.302 -0.931
173 HG23 THR 24 2HG2 THR 24 -2.994 -1.105 -2.087
174 H GLU 25 H GLU 25 -1.531 -3.881 -5.487
175 HA GLU 25 HA GLU 25 -2.850 -6.410 -6.314
176 HB2 GLU 25 1HB GLU 25 -3.804 -4.155 -7.098
177 HB3 GLU 25 2HB GLU 25 -2.365 -3.970 -8.071
178 HG2 GLU 25 1HG GLU 25 -2.942 -5.590 -9.575
179 HG3 GLU 25 2HG GLU 25 -3.771 -6.580 -8.370
180 H ASN 26 H ASN 26 -0.221 -4.134 -7.005
181 HA ASN 26 HA ASN 26 1.333 -5.836 -8.733
182 HB2 ASN 26 1HB ASN 26 1.677 -3.458 -8.777
183 HB3 ASN 26 2HB ASN 26 2.039 -3.454 -7.055
184 HD21 ASN 26 1HD2 ASN 26 3.990 -2.312 -7.348
185 HD22 ASN 26 2HD2 ASN 26 5.400 -3.135 -7.946
186 H THR 27 H THR 27 1.453 -7.914 -7.757
187 HA THR 27 HA THR 27 2.297 -8.509 -5.171
188 HB THR 27 HB THR 27 2.776 -10.800 -6.197
189 HG1 THR 27 1HG THR 27 1.633 -10.880 -8.289
190 HG21 THR 27 3HG2 THR 27 0.488 -11.337 -6.323
191 HG22 THR 27 1HG2 THR 27 0.526 -9.934 -5.262
192 HG23 THR 27 2HG2 THR 27 0.050 -9.735 -6.962
193 H ALA 28 H ALA 28 4.356 -7.151 -7.517
194 HA ALA 28 HA ALA 28 6.853 -8.296 -6.724
195 HB1 ALA 28 1HB ALA 28 6.225 -5.383 -7.366
196 HB2 ALA 28 2HB ALA 28 7.803 -6.167 -7.402
197 HB3 ALA 28 3HB ALA 28 6.551 -6.645 -8.584
198 H ASN 29 H ASN 29 4.728 -5.773 -5.215
199 HA ASN 29 HA ASN 29 6.379 -6.046 -2.765
200 HB2 ASN 29 1HB ASN 29 7.393 -4.013 -2.767
201 HB3 ASN 29 2HB ASN 29 7.180 -4.138 -4.527
202 HD21 ASN 29 1HD2 ASN 29 4.742 -3.515 -5.245
203 HD22 ASN 29 2HD2 ASN 29 4.599 -1.858 -4.719
204 H CYS 30 H CYS 30 3.200 -5.653 -4.007
205 HA CYS 30 HA CYS 30 2.075 -4.105 -1.929
206 HB2 CYS 30 1HB CYS 30 -0.004 -5.231 -2.497
207 HB3 CYS 30 2HB CYS 30 0.864 -4.753 -3.953
208 H GLY 31 H GLY 31 0.875 -4.819 0.018
209 HA2 GLY 31 1HA GLY 31 0.500 -7.106 1.281
210 HA3 GLY 31 2HA GLY 31 2.252 -7.064 1.359
211 H THR 32 H THR 32 1.499 -7.225 3.631
212 HA THR 32 HA THR 32 0.277 -5.169 5.043
213 HB THR 32 HB THR 32 2.162 -7.307 6.024
214 HG1 THR 32 1HG THR 32 -0.343 -7.222 5.046
215 HG21 THR 32 3HG2 THR 32 1.889 -5.513 7.737
216 HG22 THR 32 1HG2 THR 32 0.125 -5.577 7.523
217 HG23 THR 32 2HG2 THR 32 0.994 -6.967 8.198
218 H ALA 33 H ALA 33 3.791 -5.886 4.710
219 HA ALA 33 HA ALA 33 4.670 -3.583 6.135
220 HB1 ALA 33 1HB ALA 33 6.153 -5.491 5.700
221 HB2 ALA 33 2HB ALA 33 6.094 -5.172 3.957
222 HB3 ALA 33 3HB ALA 33 6.855 -4.013 5.042
223 H CYS 34 H CYS 34 3.794 -3.960 2.718
224 HA CYS 34 HA CYS 34 4.781 -1.398 1.842
225 HB2 CYS 34 1HB CYS 34 4.213 -3.160 0.305
226 HB3 CYS 34 2HB CYS 34 2.514 -3.132 0.782
227 H CYS 35 H CYS 35 1.470 -2.456 2.830
228 HA CYS 35 HA CYS 35 0.331 0.163 2.726
229 HB2 CYS 35 1HB CYS 35 -0.414 -2.323 4.311
230 HB3 CYS 35 2HB CYS 35 -1.420 -0.882 4.210
231 H ASP 36 H ASP 36 2.139 -1.538 5.213
232 HA ASP 36 HA ASP 36 1.728 0.371 7.364
233 HB2 ASP 36 1HB ASP 36 2.010 -2.148 7.420
234 HB3 ASP 36 2HB ASP 36 3.712 -1.898 7.011
235 H SER 37 H SER 37 3.423 0.672 4.563
236 HA SER 37 HA SER 37 5.440 2.534 5.767
237 HB2 SER 37 1HB SER 37 5.460 0.922 3.193
238 HB3 SER 37 2HB SER 37 6.491 2.335 3.426
239 HG SER 37 HG SER 37 6.418 0.458 5.483
240 H CYS 38 H CYS 38 3.473 2.279 2.715
241 HA CYS 38 HA CYS 38 3.876 5.135 2.259
242 HB2 CYS 38 1HB CYS 38 2.221 2.992 0.876
243 HB3 CYS 38 2HB CYS 38 2.300 4.663 0.334
244 H PHE 39 H PHE 39 1.383 3.235 3.817
245 HA PHE 39 HA PHE 39 -0.566 5.461 3.680
246 HB2 PHE 39 1HB PHE 39 -0.881 2.426 3.666
247 HB3 PHE 39 2HB PHE 39 -2.187 3.498 4.013
248 HD1 PHE 39 2HD PHE 39 -3.069 5.049 2.147
249 HD2 PHE 39 1HD PHE 39 -0.126 1.981 1.417
250 HE1 PHE 39 2HE PHE 39 -3.379 5.360 -0.246
251 HE2 PHE 39 1HE PHE 39 -0.620 2.106 -0.978
252 HZ PHE 39 HZ PHE 39 -2.233 3.797 -1.844
253 H GLU 40 H GLU 40 -1.878 5.644 5.685
254 HA GLU 40 HA GLU 40 -0.698 4.385 8.088
255 HB2 GLU 40 1HB GLU 40 -1.255 7.349 7.937
256 HB3 GLU 40 2HB GLU 40 -0.527 6.486 9.285
257 HG2 GLU 40 1HG GLU 40 1.457 6.058 7.767
258 HG3 GLU 40 2HG GLU 40 0.661 7.210 6.648
259 H LEU 41 H LEU 41 -1.997 4.653 9.957
260 HA LEU 41 HA LEU 41 -3.952 4.386 11.105
261 HB2 LEU 41 1HB LEU 41 -4.568 6.974 9.642
262 HB3 LEU 41 2HB LEU 41 -5.282 6.457 11.171
263 HG LEU 41 HG LEU 41 -2.312 7.054 10.743
264 HD11 LEU 41 1HD1 LEU 41 -3.645 9.062 10.483
265 HD12 LEU 41 2HD1 LEU 41 -4.474 8.753 12.032
266 HD13 LEU 41 3HD1 LEU 41 -2.726 9.110 11.991
267 HD21 LEU 41 3HD2 LEU 41 -2.214 7.053 13.224
268 HD22 LEU 41 1HD2 LEU 41 -3.901 6.481 13.280
269 HD23 LEU 41 2HD2 LEU 41 -2.617 5.471 12.566
270 H THR 42 H THR 42 -6.386 5.940 9.280
271 HA THR 42 HA THR 42 -7.599 3.342 8.783
272 HB THR 42 HB THR 42 -8.550 6.166 8.230
273 HG1 THR 42 1HG THR 42 -9.101 4.193 10.207
274 HG21 THR 42 3HG2 THR 42 -10.796 5.102 8.032
275 HG22 THR 42 1HG2 THR 42 -9.719 4.712 6.688
276 HG23 THR 42 2HG2 THR 42 -10.004 3.514 7.963
277 H GLY 43 H GLY 43 -5.709 5.631 6.792
278 HA2 GLY 43 1HA GLY 43 -6.641 4.574 4.261
279 HA3 GLY 43 2HA GLY 43 -5.202 5.536 4.551
280 H ASN 44 H ASN 44 -3.989 3.893 6.504
281 HA ASN 44 HA ASN 44 -2.678 1.752 5.202
282 HB2 ASN 44 1HB ASN 44 -1.614 2.590 7.086
283 HB3 ASN 44 2HB ASN 44 -3.056 2.487 8.097
284 HD21 ASN 44 1HD2 ASN 44 -0.505 0.663 6.549
285 HD22 ASN 44 2HD2 ASN 44 -0.654 -0.739 7.631
286 H THR 45 H THR 45 -5.408 1.754 7.530
287 HA THR 45 HA THR 45 -5.832 -1.023 7.439
288 HB THR 45 HB THR 45 -8.044 0.988 7.793
289 HG1 THR 45 1HG THR 45 -6.153 1.389 9.242
290 HG21 THR 45 3HG2 THR 45 -7.618 -1.836 8.852
291 HG22 THR 45 1HG2 THR 45 -8.905 -0.748 9.396
292 HG23 THR 45 2HG2 THR 45 -8.870 -1.284 7.719
293 H MET 46 H MET 46 -7.228 1.514 5.299
294 HA MET 46 HA MET 46 -8.906 -0.359 3.890
295 HB2 MET 46 1HB MET 46 -8.016 2.462 3.094
296 HB3 MET 46 2HB MET 46 -9.159 1.429 2.214
297 HG2 MET 46 1HG MET 46 -10.432 1.226 4.464
298 HG3 MET 46 2HG MET 46 -9.430 2.572 5.001
299 HE1 MET 46 3HE MET 46 -11.497 1.574 1.783
300 HE2 MET 46 1HE MET 46 -12.606 1.459 3.169
301 HE3 MET 46 2HE MET 46 -12.854 2.713 1.932
302 H CYS 47 H CYS 47 -5.573 0.866 3.296
303 HA CYS 47 HA CYS 47 -5.085 -0.490 0.850
304 HB2 CYS 47 1HB CYS 47 -3.630 1.232 1.779
305 HB3 CYS 47 2HB CYS 47 -3.217 0.211 3.144
306 H LEU 48 H LEU 48 -4.418 -1.622 4.210
307 HA LEU 48 HA LEU 48 -3.564 -4.211 3.632
308 HB2 LEU 48 1HB LEU 48 -5.207 -3.093 5.939
309 HB3 LEU 48 2HB LEU 48 -4.579 -4.729 5.917
310 HG LEU 48 HG LEU 48 -2.812 -2.259 5.708
311 HD11 LEU 48 1HD1 LEU 48 -2.285 -2.670 8.087
312 HD12 LEU 48 2HD1 LEU 48 -3.978 -2.243 7.863
313 HD13 LEU 48 3HD1 LEU 48 -3.525 -3.935 8.155
314 HD21 LEU 48 3HD2 LEU 48 -1.017 -3.796 6.363
315 HD22 LEU 48 1HD2 LEU 48 -2.150 -5.165 6.327
316 HD23 LEU 48 2HD2 LEU 48 -1.749 -4.289 4.833
317 H LEU 49 H LEU 49 -6.872 -2.984 4.107
318 HA LEU 49 HA LEU 49 -8.318 -5.372 3.829
319 HB2 LEU 49 1HB LEU 49 -8.873 -2.612 3.983
320 HB3 LEU 49 2HB LEU 49 -9.614 -3.073 2.482
321 HG LEU 49 HG LEU 49 -10.086 -4.702 5.005
322 HD11 LEU 49 1HD1 LEU 49 -10.463 -2.397 5.651
323 HD12 LEU 49 2HD1 LEU 49 -11.467 -2.112 4.210
324 HD13 LEU 49 3HD1 LEU 49 -12.021 -3.227 5.478
325 HD21 LEU 49 3HD2 LEU 49 -11.741 -4.167 2.501
326 HD22 LEU 49 1HD2 LEU 49 -10.897 -5.672 2.908
327 HD23 LEU 49 2HD2 LEU 49 -12.275 -5.141 3.885
328 H GLN 50 H GLN 50 -7.326 -3.143 1.149
329 HA GLN 50 HA GLN 50 -8.530 -4.739 -0.893
330 HB2 GLN 50 1HB GLN 50 -7.702 -2.260 -0.903
331 HB3 GLN 50 2HB GLN 50 -6.160 -2.865 -1.209
332 HG2 GLN 50 1HG GLN 50 -7.199 -2.262 -3.334
333 HG3 GLN 50 2HG GLN 50 -6.953 -4.007 -3.279
334 HE21 GLN 50 1HE2 GLN 50 -8.750 -5.348 -3.611
335 HE22 GLN 50 2HE2 GLN 50 -10.405 -4.755 -3.592
336 H ALA 51 H ALA 51 -5.243 -4.296 0.204
337 HA ALA 51 HA ALA 51 -3.837 -5.978 -1.545
338 HB1 ALA 51 1HB ALA 51 -3.205 -5.475 1.398
339 HB2 ALA 51 2HB ALA 51 -2.059 -6.048 0.164
340 HB3 ALA 51 3HB ALA 51 -2.742 -4.415 0.054
341 H GLY 52 H GLY 52 -5.629 -6.957 1.370
342 HA2 GLY 52 1HA GLY 52 -4.961 -9.818 0.829
343 HA3 GLY 52 2HA GLY 52 -5.592 -9.131 2.323
344 H ALA 53 H ALA 53 -7.268 -7.872 -0.434
345 HA ALA 53 HA ALA 53 -9.714 -8.526 0.704
346 HB1 ALA 53 1HB ALA 53 -10.709 -7.850 -1.491
347 HB2 ALA 53 2HB ALA 53 -9.525 -6.699 -0.864
348 HB3 ALA 53 3HB ALA 53 -9.079 -7.795 -2.191
349 H ALA 54 H ALA 54 -8.592 -9.854 -2.372
350 HA ALA 54 HA ALA 54 -8.800 -12.603 -1.890
351 HB1 ALA 54 1HB ALA 54 -11.209 -11.281 -3.253
352 HB2 ALA 54 2HB ALA 54 -10.782 -12.981 -3.496
353 HB3 ALA 54 3HB ALA 54 -11.234 -12.404 -1.880
354 H GLY 55 H GLY 55 -8.021 -13.653 -3.874
355 HA2 GLY 55 1HA GLY 55 -7.285 -13.802 -6.051
356 HA3 GLY 55 2HA GLY 55 -7.767 -12.135 -6.360
357 H SER 56 H SER 56 -6.359 -10.754 -4.371
358 HA SER 56 HA SER 56 -3.880 -10.413 -5.524
359 HB2 SER 56 1HB SER 56 -4.798 -9.765 -2.686
360 HB3 SER 56 2HB SER 56 -3.336 -9.114 -3.433
361 HG SER 56 HG SER 56 -4.574 -7.610 -4.081
362 H GLY 57 H GLY 57 -1.776 -10.728 -4.768
363 HA2 GLY 57 1HA GLY 57 -1.239 -13.223 -3.216
364 HA3 GLY 57 2HA GLY 57 -0.499 -12.848 -4.768
365 H CYS 58 H CYS 58 -1.190 -10.932 -1.840
366 HA CYS 58 HA CYS 58 1.407 -9.541 -2.131
367 HB2 CYS 58 1HB CYS 58 -1.143 -8.911 -0.587
368 HB3 CYS 58 2HB CYS 58 0.272 -7.885 -0.676
369 H ASP 59 H ASP 59 2.622 -9.096 -0.286
370 HA ASP 59 HA ASP 59 3.213 -11.292 1.439
371 HB2 ASP 59 1HB ASP 59 4.985 -9.936 0.690
372 HB3 ASP 59 2HB ASP 59 4.118 -8.447 1.025
373 H MET 60 H MET 60 1.470 -11.804 2.877
374 HA MET 60 HA MET 60 0.441 -9.577 4.564
375 HB2 MET 60 1HB MET 60 -0.882 -12.096 3.560
376 HB3 MET 60 2HB MET 60 -1.513 -11.155 4.911
377 HG2 MET 60 1HG MET 60 -0.922 -9.208 2.972
378 HG3 MET 60 2HG MET 60 -1.576 -10.531 2.042
379 HE1 MET 60 3HE MET 60 -3.990 -8.341 5.354
380 HE2 MET 60 1HE MET 60 -3.433 -9.965 5.770
381 HE3 MET 60 2HE MET 60 -2.246 -8.685 5.440
382 H GLU 61 H GLU 61 2.405 -9.773 5.651
383 HA GLU 61 HA GLU 61 4.085 -10.909 6.811
384 HB2 GLU 61 1HB GLU 61 1.839 -10.282 8.750
385 HB3 GLU 61 2HB GLU 61 3.340 -11.034 9.306
386 HG2 GLU 61 1HG GLU 61 4.565 -9.130 8.085
387 HG3 GLU 61 2HG GLU 61 3.007 -8.288 8.137
Start of MODEL 16
1 H1 TYR 1 H TYR 1 -14.392 5.956 2.324
2 HA TYR 1 HA TYR 1 -13.035 8.547 2.757
3 HB2 TYR 1 1HB TYR 1 -13.146 7.543 4.884
4 HB3 TYR 1 2HB TYR 1 -12.857 5.928 4.242
5 HD1 TYR 1 1HD TYR 1 -11.191 9.150 5.109
6 HD2 TYR 1 2HD TYR 1 -10.686 5.078 3.753
7 HE1 TYR 1 1HE TYR 1 -8.727 9.399 5.243
8 HE2 TYR 1 2HE TYR 1 -8.275 5.309 3.921
9 HH TYR 1 HH TYR 1 -6.589 7.757 5.442
10 H ASN 2 H ASN 2 -10.912 8.760 1.906
11 HA ASN 2 HA ASN 2 -10.284 6.791 -0.245
12 HB2 ASN 2 1HB ASN 2 -9.764 9.771 -0.105
13 HB3 ASN 2 2HB ASN 2 -9.074 8.700 -1.324
14 HD21 ASN 2 1HD2 ASN 2 -10.638 10.892 -2.012
15 HD22 ASN 2 2HD2 ASN 2 -12.166 10.317 -2.673
16 HA PRO 3 HA PRO 3 -6.862 6.062 2.540
17 HB2 PRO 3 1HB PRO 3 -5.231 4.549 0.863
18 HB3 PRO 3 2HB PRO 3 -6.619 3.938 1.795
19 HG2 PRO 3 1HG PRO 3 -6.520 4.722 -1.112
20 HG3 PRO 3 2HG PRO 3 -7.422 3.377 -0.334
21 HD2 PRO 3 1HD PRO 3 -8.640 5.652 -1.072
22 HD3 PRO 3 2HD PRO 3 -9.138 4.719 0.373
23 H GLU 4 H GLU 4 -6.425 7.619 -0.524
24 HA GLU 4 HA GLU 4 -3.748 8.454 -0.297
25 HB2 GLU 4 1HB GLU 4 -6.208 9.501 -1.715
26 HB3 GLU 4 2HB GLU 4 -4.622 10.266 -1.898
27 HG2 GLU 4 1HG GLU 4 -3.650 8.126 -2.691
28 HG3 GLU 4 2HG GLU 4 -5.224 7.343 -2.533
29 H ASP 5 H ASP 5 -6.386 9.431 1.749
30 HA ASP 5 HA ASP 5 -5.513 12.158 2.216
31 HB2 ASP 5 1HB ASP 5 -7.727 10.634 2.909
32 HB3 ASP 5 2HB ASP 5 -6.850 10.703 4.440
33 H ASP 6 H ASP 6 -4.686 8.978 3.477
34 HA ASP 6 HA ASP 6 -2.760 10.054 5.519
35 HB2 ASP 6 1HB ASP 6 -4.043 7.323 5.223
36 HB3 ASP 6 2HB ASP 6 -2.875 7.783 6.445
37 H TYR 7 H TYR 7 -2.515 9.715 2.449
38 HA TYR 7 HA TYR 7 -0.461 7.763 1.936
39 HB2 TYR 7 1HB TYR 7 -1.692 8.675 0.101
40 HB3 TYR 7 2HB TYR 7 -1.382 10.330 0.628
41 HD1 TYR 7 1HD TYR 7 0.746 7.326 -0.219
42 HD2 TYR 7 2HD TYR 7 -0.035 11.526 -0.808
43 HE1 TYR 7 1HE TYR 7 2.620 7.461 -1.840
44 HE2 TYR 7 2HE TYR 7 1.893 11.655 -2.375
45 HH TYR 7 HH TYR 7 3.733 8.752 -3.318
46 H THR 8 H THR 8 1.687 7.882 2.459
47 HA THR 8 HA THR 8 2.673 10.350 3.798
48 HB THR 8 HB THR 8 4.320 8.608 4.794
49 HG1 THR 8 1HG THR 8 2.114 6.930 4.325
50 HG21 THR 8 3HG2 THR 8 2.595 9.742 6.140
51 HG22 THR 8 1HG2 THR 8 1.389 8.542 5.627
52 HG23 THR 8 2HG2 THR 8 2.791 8.060 6.612
53 HA PRO 9 HA PRO 9 4.972 9.944 -0.246
54 HB2 PRO 9 1HB PRO 9 5.484 12.667 -0.519
55 HB3 PRO 9 2HB PRO 9 4.088 11.798 -1.248
56 HG2 PRO 9 1HG PRO 9 4.235 13.422 1.294
57 HG3 PRO 9 2HG PRO 9 2.907 13.368 0.089
58 HD2 PRO 9 1HD PRO 9 2.753 12.012 2.428
59 HD3 PRO 9 2HD PRO 9 2.144 11.287 0.918
60 H LEU 10 H LEU 10 5.938 11.503 2.836
61 HA LEU 10 HA LEU 10 8.493 12.416 1.865
62 HB2 LEU 10 1HB LEU 10 7.559 11.701 4.683
63 HB3 LEU 10 2HB LEU 10 9.088 12.481 4.288
64 HG LEU 10 HG LEU 10 6.313 13.651 3.803
65 HD11 LEU 10 1HD1 LEU 10 7.067 13.632 6.162
66 HD12 LEU 10 2HD1 LEU 10 8.527 14.529 5.694
67 HD13 LEU 10 3HD1 LEU 10 6.913 15.261 5.508
68 HD21 LEU 10 3HD2 LEU 10 9.026 14.779 3.100
69 HD22 LEU 10 1HD2 LEU 10 7.648 14.435 1.999
70 HD23 LEU 10 2HD2 LEU 10 7.536 15.733 3.189
71 H THR 11 H THR 11 7.383 9.402 3.465
72 HA THR 11 HA THR 11 9.960 8.122 2.958
73 HB THR 11 HB THR 11 8.394 6.256 4.176
74 HG1 THR 11 1HG THR 11 6.655 7.145 4.904
75 HG21 THR 11 3HG2 THR 11 9.743 8.626 5.546
76 HG22 THR 11 1HG2 THR 11 9.343 7.065 6.305
77 HG23 THR 11 2HG2 THR 11 10.547 7.127 5.014
78 H CYS 12 H CYS 12 6.667 8.185 1.494
79 HA CYS 12 HA CYS 12 6.846 5.489 0.645
80 HB2 CYS 12 1HB CYS 12 4.736 6.624 1.000
81 HB3 CYS 12 2HB CYS 12 5.072 7.712 -0.337
82 HA PRO 13 HA PRO 13 9.439 6.382 -2.984
83 HB2 PRO 13 1HB PRO 13 9.932 3.783 -3.786
84 HB3 PRO 13 2HB PRO 13 10.753 4.612 -2.433
85 HG2 PRO 13 1HG PRO 13 8.501 2.640 -2.348
86 HG3 PRO 13 2HG PRO 13 9.909 2.773 -1.261
87 HD2 PRO 13 1HD PRO 13 7.381 3.765 -0.676
88 HD3 PRO 13 2HD PRO 13 8.899 4.415 -0.002
89 H HIS 14 H HIS 14 6.305 6.097 -3.185
90 HA HIS 14 HA HIS 14 6.228 5.717 -6.111
91 HB2 HIS 14 1HB HIS 14 3.961 4.556 -4.505
92 HB3 HIS 14 2HB HIS 14 4.420 4.163 -6.145
93 HD1 HIS 14 1HD HIS 14 6.490 2.360 -6.447
94 HD2 HIS 14 2HD HIS 14 4.971 3.091 -2.581
95 HE1 HIS 14 1HE HIS 14 7.250 0.492 -4.982
96 HE2 HIS 14 2HE HIS 14 6.452 0.904 -2.654
97 H THR 15 H THR 15 4.610 7.036 -7.101
98 HA THR 15 HA THR 15 4.081 9.506 -5.706
99 HB THR 15 HB THR 15 3.103 10.002 -7.992
100 HG1 THR 15 1HG THR 15 3.644 8.171 -9.545
101 HG21 THR 15 3HG2 THR 15 5.470 10.434 -7.590
102 HG22 THR 15 1HG2 THR 15 5.873 8.747 -7.960
103 HG23 THR 15 2HG2 THR 15 5.250 9.820 -9.236
104 H ILE 16 H ILE 16 1.813 10.479 -5.729
105 HA ILE 16 HA ILE 16 -0.219 8.626 -4.941
106 HB ILE 16 HB ILE 16 0.078 11.035 -4.311
107 HG12 ILE 16 1HG1 ILE 16 -2.739 10.333 -5.261
108 HG13 ILE 16 2HG1 ILE 16 -1.962 9.611 -3.845
109 HG21 ILE 16 1HG2 ILE 16 0.253 11.854 -6.754
110 HG22 ILE 16 2HG2 ILE 16 -1.516 11.717 -6.813
111 HG23 ILE 16 3HG2 ILE 16 -0.745 12.822 -5.664
112 HD11 ILE 16 3HD1 ILE 16 -2.438 12.606 -4.150
113 HD12 ILE 16 1HD1 ILE 16 -3.464 11.502 -3.260
114 HD13 ILE 16 2HD1 ILE 16 -1.795 11.760 -2.721
115 H SER 17 H SER 17 1.044 9.347 -8.032
116 HA SER 17 HA SER 17 -1.258 8.772 -9.647
117 HB2 SER 17 1HB SER 17 1.583 9.154 -10.019
118 HB3 SER 17 2HB SER 17 0.915 7.943 -11.106
119 HG SER 17 HG SER 17 -0.347 10.435 -10.701
120 H VAL 18 H VAL 18 1.343 6.784 -8.046
121 HA VAL 18 HA VAL 18 -0.238 4.395 -8.702
122 HB VAL 18 HB VAL 18 1.659 3.191 -9.635
123 HG11 VAL 18 1HG1 VAL 18 0.234 4.489 -11.214
124 HG12 VAL 18 2HG1 VAL 18 1.425 5.808 -11.161
125 HG13 VAL 18 3HG1 VAL 18 1.889 4.222 -11.786
126 HG21 VAL 18 3HG2 VAL 18 3.661 5.044 -10.216
127 HG22 VAL 18 1HG2 VAL 18 3.120 5.491 -8.550
128 HG23 VAL 18 2HG2 VAL 18 3.649 3.864 -8.882
129 H VAL 19 H VAL 19 -0.238 5.405 -6.281
130 HA VAL 19 HA VAL 19 1.647 3.635 -4.816
131 HB VAL 19 HB VAL 19 1.674 5.891 -4.070
132 HG11 VAL 19 1HG1 VAL 19 -0.176 7.052 -3.026
133 HG12 VAL 19 2HG1 VAL 19 -0.636 6.588 -4.661
134 HG13 VAL 19 3HG1 VAL 19 -1.257 5.680 -3.276
135 HG21 VAL 19 3HG2 VAL 19 2.084 4.150 -2.423
136 HG22 VAL 19 1HG2 VAL 19 1.321 5.579 -1.689
137 HG23 VAL 19 2HG2 VAL 19 0.367 4.123 -1.987
138 H TRP 20 H TRP 20 -1.915 4.143 -5.093
139 HA TRP 20 HA TRP 20 -2.602 2.103 -3.319
140 HB2 TRP 20 1HB TRP 20 -4.222 3.701 -4.173
141 HB3 TRP 20 2HB TRP 20 -4.095 3.013 -5.793
142 HD1 TRP 20 HD TRP 20 -5.588 0.949 -6.338
143 HE1 TRP 20 1HE TRP 20 -7.326 -0.415 -5.058
144 HE3 TRP 20 3HE TRP 20 -4.475 2.524 -1.602
145 HZ2 TRP 20 2HZ TRP 20 -8.303 -0.581 -2.303
146 HZ3 TRP 20 3HZ TRP 20 -5.734 1.658 0.331
147 HH2 TRP 20 HH TRP 20 -7.699 0.169 -0.015
148 H TYR 21 H TYR 21 -2.740 1.640 -6.918
149 HA TYR 21 HA TYR 21 -3.070 -1.173 -6.787
150 HB2 TYR 21 1HB TYR 21 -3.619 -0.478 -8.795
151 HB3 TYR 21 2HB TYR 21 -2.446 0.770 -8.897
152 HD1 TYR 21 2HD TYR 21 0.186 -0.115 -9.285
153 HD2 TYR 21 1HD TYR 21 -3.396 -2.378 -9.986
154 HE1 TYR 21 2HE TYR 21 1.481 -1.753 -10.568
155 HE2 TYR 21 1HE TYR 21 -2.144 -4.005 -11.333
156 HH TYR 21 HH TYR 21 1.414 -3.866 -11.615
157 H GLU 22 H GLU 22 0.053 0.793 -6.560
158 HA GLU 22 HA GLU 22 1.746 -1.207 -7.352
159 HB2 GLU 22 1HB GLU 22 2.954 0.662 -7.306
160 HB3 GLU 22 2HB GLU 22 1.616 1.430 -6.583
161 HG2 GLU 22 1HG GLU 22 3.084 1.805 -5.231
162 HG3 GLU 22 2HG GLU 22 2.508 0.579 -4.270
163 H CYS 23 H CYS 23 0.278 -0.424 -4.213
164 HA CYS 23 HA CYS 23 1.662 -2.649 -2.864
165 HB2 CYS 23 1HB CYS 23 0.485 0.000 -1.929
166 HB3 CYS 23 2HB CYS 23 0.742 -1.331 -0.807
167 H THR 24 H THR 24 -1.288 -2.198 -4.396
168 HA THR 24 HA THR 24 -2.501 -3.953 -2.387
169 HB THR 24 HB THR 24 -4.705 -3.082 -2.903
170 HG1 THR 24 1HG THR 24 -3.296 -1.056 -4.263
171 HG21 THR 24 3HG2 THR 24 -2.799 -0.908 -1.965
172 HG22 THR 24 1HG2 THR 24 -4.546 -1.005 -1.663
173 HG23 THR 24 2HG2 THR 24 -3.462 -2.220 -0.968
174 H GLU 25 H GLU 25 -1.468 -3.854 -5.569
175 HA GLU 25 HA GLU 25 -3.317 -6.037 -6.377
176 HB2 GLU 25 1HB GLU 25 -3.703 -3.399 -6.985
177 HB3 GLU 25 2HB GLU 25 -2.639 -3.859 -8.289
178 HG2 GLU 25 1HG GLU 25 -4.192 -5.608 -9.010
179 HG3 GLU 25 2HG GLU 25 -5.202 -5.346 -7.583
180 H ASN 26 H ASN 26 -0.233 -4.260 -6.943
181 HA ASN 26 HA ASN 26 0.783 -6.383 -8.703
182 HB2 ASN 26 1HB ASN 26 1.647 -4.145 -9.083
183 HB3 ASN 26 2HB ASN 26 2.101 -3.996 -7.388
184 HD21 ASN 26 1HD2 ASN 26 4.249 -3.565 -8.183
185 HD22 ASN 26 2HD2 ASN 26 5.366 -4.901 -8.378
186 H THR 27 H THR 27 0.638 -8.245 -7.535
187 HA THR 27 HA THR 27 1.092 -8.739 -4.846
188 HB THR 27 HB THR 27 1.455 -11.113 -5.607
189 HG1 THR 27 1HG THR 27 1.369 -9.841 -8.161
190 HG21 THR 27 3HG2 THR 27 -0.827 -10.206 -5.249
191 HG22 THR 27 1HG2 THR 27 -0.893 -9.677 -6.939
192 HG23 THR 27 2HG2 THR 27 -0.782 -11.404 -6.545
193 H ALA 28 H ALA 28 3.604 -8.056 -7.156
194 HA ALA 28 HA ALA 28 5.773 -9.417 -5.817
195 HB1 ALA 28 1HB ALA 28 5.712 -6.997 -7.687
196 HB2 ALA 28 2HB ALA 28 7.154 -7.901 -7.218
197 HB3 ALA 28 3HB ALA 28 5.890 -8.696 -8.182
198 H ASN 29 H ASN 29 4.075 -6.439 -5.126
199 HA ASN 29 HA ASN 29 6.097 -5.856 -2.992
200 HB2 ASN 29 1HB ASN 29 4.449 -3.682 -4.302
201 HB3 ASN 29 2HB ASN 29 5.690 -3.525 -3.077
202 HD21 ASN 29 1HD2 ASN 29 5.539 -2.053 -5.403
203 HD22 ASN 29 2HD2 ASN 29 6.897 -2.401 -6.449
204 H CYS 30 H CYS 30 2.735 -5.693 -4.135
205 HA CYS 30 HA CYS 30 1.454 -4.653 -1.979
206 HB2 CYS 30 1HB CYS 30 0.148 -5.000 -3.816
207 HB3 CYS 30 2HB CYS 30 0.616 -6.669 -4.055
208 H GLY 31 H GLY 31 1.181 -5.047 0.037
209 HA2 GLY 31 1HA GLY 31 0.762 -7.403 1.326
210 HA3 GLY 31 2HA GLY 31 2.526 -7.200 1.291
211 H THR 32 H THR 32 1.528 -7.175 3.722
212 HA THR 32 HA THR 32 0.318 -4.815 4.634
213 HB THR 32 HB THR 32 1.789 -7.018 5.978
214 HG1 THR 32 1HG THR 32 -0.195 -7.597 6.534
215 HG21 THR 32 3HG2 THR 32 0.959 -6.280 8.168
216 HG22 THR 32 1HG2 THR 32 2.147 -5.139 7.525
217 HG23 THR 32 2HG2 THR 32 0.415 -4.743 7.464
218 H ALA 33 H ALA 33 3.809 -5.683 4.539
219 HA ALA 33 HA ALA 33 4.732 -3.314 5.862
220 HB1 ALA 33 1HB ALA 33 6.118 -5.362 5.520
221 HB2 ALA 33 2HB ALA 33 6.145 -5.045 3.774
222 HB3 ALA 33 3HB ALA 33 6.915 -3.904 4.897
223 H CYS 34 H CYS 34 3.952 -4.058 2.490
224 HA CYS 34 HA CYS 34 5.006 -1.724 1.251
225 HB2 CYS 34 1HB CYS 34 4.001 -3.906 0.279
226 HB3 CYS 34 2HB CYS 34 2.447 -3.110 0.379
227 H CYS 35 H CYS 35 1.758 -2.482 2.539
228 HA CYS 35 HA CYS 35 0.530 -0.016 1.928
229 HB2 CYS 35 1HB CYS 35 -0.029 -2.170 3.996
230 HB3 CYS 35 2HB CYS 35 -1.028 -0.728 3.860
231 H ASP 36 H ASP 36 2.023 -1.103 5.043
232 HA ASP 36 HA ASP 36 1.478 1.363 6.384
233 HB2 ASP 36 1HB ASP 36 2.042 -0.998 7.265
234 HB3 ASP 36 2HB ASP 36 3.736 -0.532 7.075
235 H SER 37 H SER 37 4.307 0.312 4.537
236 HA SER 37 HA SER 37 5.889 2.613 5.009
237 HB2 SER 37 1HB SER 37 5.850 0.806 2.573
238 HB3 SER 37 2HB SER 37 7.170 1.874 3.079
239 HG SER 37 HG SER 37 6.228 -0.515 4.231
240 H CYS 38 H CYS 38 2.848 2.628 3.342
241 HA CYS 38 HA CYS 38 3.592 5.219 2.116
242 HB2 CYS 38 1HB CYS 38 2.347 2.789 0.840
243 HB3 CYS 38 2HB CYS 38 2.024 4.399 0.235
244 H PHE 39 H PHE 39 1.293 3.477 4.059
245 HA PHE 39 HA PHE 39 -0.546 5.777 3.959
246 HB2 PHE 39 1HB PHE 39 -1.326 2.845 3.692
247 HB3 PHE 39 2HB PHE 39 -2.429 4.168 3.933
248 HD1 PHE 39 2HD PHE 39 -2.468 6.053 2.104
249 HD2 PHE 39 1HD PHE 39 -0.851 2.107 1.494
250 HE1 PHE 39 2HE PHE 39 -2.896 6.242 -0.336
251 HE2 PHE 39 1HE PHE 39 -1.301 2.279 -0.928
252 HZ PHE 39 HZ PHE 39 -2.342 4.324 -1.834
253 H GLU 40 H GLU 40 -1.276 6.221 5.947
254 HA GLU 40 HA GLU 40 -0.737 4.307 8.177
255 HB2 GLU 40 1HB GLU 40 -1.030 7.307 8.354
256 HB3 GLU 40 2HB GLU 40 -0.491 6.205 9.621
257 HG2 GLU 40 1HG GLU 40 1.363 5.628 7.712
258 HG3 GLU 40 2HG GLU 40 0.947 7.322 7.371
259 H LEU 41 H LEU 41 -2.311 4.723 10.070
260 HA LEU 41 HA LEU 41 -4.411 4.705 10.938
261 HB2 LEU 41 1HB LEU 41 -4.708 7.204 9.245
262 HB3 LEU 41 2HB LEU 41 -5.532 6.844 10.763
263 HG LEU 41 HG LEU 41 -2.545 7.370 10.401
264 HD11 LEU 41 1HD1 LEU 41 -3.937 9.361 10.137
265 HD12 LEU 41 2HD1 LEU 41 -4.711 9.053 11.704
266 HD13 LEU 41 3HD1 LEU 41 -2.972 9.437 11.615
267 HD21 LEU 41 3HD2 LEU 41 -2.793 5.819 12.232
268 HD22 LEU 41 1HD2 LEU 41 -2.488 7.412 12.903
269 HD23 LEU 41 2HD2 LEU 41 -4.153 6.731 12.908
270 H THR 42 H THR 42 -6.546 6.257 8.891
271 HA THR 42 HA THR 42 -8.019 3.844 8.479
272 HB THR 42 HB THR 42 -8.418 6.453 6.976
273 HG1 THR 42 1HG THR 42 -9.604 7.199 8.567
274 HG21 THR 42 3HG2 THR 42 -9.845 4.501 6.323
275 HG22 THR 42 1HG2 THR 42 -10.372 4.336 8.008
276 HG23 THR 42 2HG2 THR 42 -10.800 5.778 7.057
277 H GLY 43 H GLY 43 -5.755 5.740 6.462
278 HA2 GLY 43 1HA GLY 43 -6.309 4.556 3.936
279 HA3 GLY 43 2HA GLY 43 -4.818 5.380 4.421
280 H ASN 44 H ASN 44 -4.029 3.769 6.531
281 HA ASN 44 HA ASN 44 -2.669 1.607 5.341
282 HB2 ASN 44 1HB ASN 44 -2.090 2.699 7.545
283 HB3 ASN 44 2HB ASN 44 -3.432 1.848 8.296
284 HD21 ASN 44 1HD2 ASN 44 -0.512 1.377 6.335
285 HD22 ASN 44 2HD2 ASN 44 -0.119 -0.214 6.995
286 H THR 45 H THR 45 -5.444 1.622 7.531
287 HA THR 45 HA THR 45 -6.086 -1.046 7.483
288 HB THR 45 HB THR 45 -8.144 1.143 7.597
289 HG1 THR 45 1HG THR 45 -6.491 1.887 8.969
290 HG21 THR 45 3HG2 THR 45 -8.997 -1.176 7.926
291 HG22 THR 45 1HG2 THR 45 -7.880 -1.357 9.298
292 HG23 THR 45 2HG2 THR 45 -9.191 -0.170 9.374
293 H MET 46 H MET 46 -7.185 1.432 5.092
294 HA MET 46 HA MET 46 -8.880 -0.409 3.604
295 HB2 MET 46 1HB MET 46 -7.718 2.328 2.954
296 HB3 MET 46 2HB MET 46 -8.537 1.340 1.758
297 HG2 MET 46 1HG MET 46 -10.425 1.179 3.629
298 HG3 MET 46 2HG MET 46 -9.668 2.680 4.177
299 HE1 MET 46 3HE MET 46 -10.318 1.259 0.392
300 HE2 MET 46 1HE MET 46 -11.662 0.778 1.457
301 HE3 MET 46 2HE MET 46 -11.929 1.976 0.172
302 H CYS 47 H CYS 47 -5.459 0.709 3.211
303 HA CYS 47 HA CYS 47 -5.005 -0.646 0.745
304 HB2 CYS 47 1HB CYS 47 -3.566 1.122 1.658
305 HB3 CYS 47 2HB CYS 47 -3.090 0.084 2.995
306 H LEU 48 H LEU 48 -4.453 -1.650 4.144
307 HA LEU 48 HA LEU 48 -3.604 -4.279 3.671
308 HB2 LEU 48 1HB LEU 48 -5.220 -3.073 5.961
309 HB3 LEU 48 2HB LEU 48 -4.541 -4.688 5.976
310 HG LEU 48 HG LEU 48 -2.902 -2.123 5.800
311 HD11 LEU 48 1HD1 LEU 48 -2.169 -2.787 8.091
312 HD12 LEU 48 2HD1 LEU 48 -3.890 -2.398 8.013
313 HD13 LEU 48 3HD1 LEU 48 -3.357 -4.095 8.078
314 HD21 LEU 48 3HD2 LEU 48 -0.966 -3.523 6.157
315 HD22 LEU 48 1HD2 LEU 48 -1.979 -4.985 6.114
316 HD23 LEU 48 2HD2 LEU 48 -1.762 -3.974 4.654
317 H LEU 49 H LEU 49 -6.939 -3.055 4.183
318 HA LEU 49 HA LEU 49 -8.315 -5.422 3.793
319 HB2 LEU 49 1HB LEU 49 -9.051 -2.701 3.842
320 HB3 LEU 49 2HB LEU 49 -9.529 -3.199 2.240
321 HG LEU 49 HG LEU 49 -10.697 -5.224 3.397
322 HD11 LEU 49 1HD1 LEU 49 -10.208 -3.337 5.753
323 HD12 LEU 49 2HD1 LEU 49 -11.313 -4.744 5.778
324 HD13 LEU 49 3HD1 LEU 49 -9.576 -4.991 5.566
325 HD21 LEU 49 3HD2 LEU 49 -11.633 -2.356 3.829
326 HD22 LEU 49 1HD2 LEU 49 -11.937 -3.379 2.410
327 HD23 LEU 49 2HD2 LEU 49 -12.673 -3.803 3.962
328 H GLN 50 H GLN 50 -7.113 -3.292 1.152
329 HA GLN 50 HA GLN 50 -8.366 -4.921 -0.869
330 HB2 GLN 50 1HB GLN 50 -7.880 -2.467 -1.038
331 HB3 GLN 50 2HB GLN 50 -6.163 -2.831 -1.158
332 HG2 GLN 50 1HG GLN 50 -7.070 -2.471 -3.403
333 HG3 GLN 50 2HG GLN 50 -6.629 -4.171 -3.245
334 HE21 GLN 50 1HE2 GLN 50 -8.237 -5.660 -3.916
335 HE22 GLN 50 2HE2 GLN 50 -9.930 -5.362 -3.768
336 H ALA 51 H ALA 51 -4.971 -4.568 0.276
337 HA ALA 51 HA ALA 51 -3.792 -6.388 -1.551
338 HB1 ALA 51 1HB ALA 51 -1.958 -6.475 0.183
339 HB2 ALA 51 2HB ALA 51 -2.434 -4.831 -0.245
340 HB3 ALA 51 3HB ALA 51 -2.996 -5.552 1.284
341 H GLY 52 H GLY 52 -4.980 -6.877 1.797
342 HA2 GLY 52 1HA GLY 52 -4.520 -9.740 1.717
343 HA3 GLY 52 2HA GLY 52 -5.088 -8.750 3.065
344 H ALA 53 H ALA 53 -6.914 -8.315 0.130
345 HA ALA 53 HA ALA 53 -9.322 -8.585 1.200
346 HB1 ALA 53 1HB ALA 53 -8.966 -7.769 -1.070
347 HB2 ALA 53 2HB ALA 53 -8.632 -9.420 -1.647
348 HB3 ALA 53 3HB ALA 53 -10.244 -8.992 -1.051
349 H ALA 54 H ALA 54 -8.148 -11.407 -0.722
350 HA ALA 54 HA ALA 54 -8.414 -13.168 1.468
351 HB1 ALA 54 1HB ALA 54 -10.579 -13.475 -0.650
352 HB2 ALA 54 2HB ALA 54 -10.126 -14.718 0.527
353 HB3 ALA 54 3HB ALA 54 -10.821 -13.207 1.092
354 H GLY 55 H GLY 55 -6.262 -13.471 0.766
355 HA2 GLY 55 1HA GLY 55 -4.573 -14.567 -0.242
356 HA3 GLY 55 2HA GLY 55 -5.773 -15.851 -0.409
357 H SER 56 H SER 56 -5.496 -12.666 -2.110
358 HA SER 56 HA SER 56 -5.823 -13.823 -4.734
359 HB2 SER 56 1HB SER 56 -4.620 -11.123 -4.018
360 HB3 SER 56 2HB SER 56 -5.446 -11.581 -5.515
361 HG SER 56 HG SER 56 -6.483 -10.358 -3.548
362 H GLY 57 H GLY 57 -3.063 -12.462 -2.864
363 HA2 GLY 57 1HA GLY 57 -1.144 -14.343 -3.301
364 HA3 GLY 57 2HA GLY 57 -1.099 -13.439 -4.818
365 H CYS 58 H CYS 58 -1.893 -11.414 -2.078
366 HA CYS 58 HA CYS 58 0.806 -10.224 -2.125
367 HB2 CYS 58 1HB CYS 58 -1.777 -9.431 -0.732
368 HB3 CYS 58 2HB CYS 58 -0.291 -8.505 -0.740
369 H ASP 59 H ASP 59 1.804 -9.723 0.041
370 HA ASP 59 HA ASP 59 1.637 -12.147 1.777
371 HB2 ASP 59 1HB ASP 59 3.814 -11.435 0.677
372 HB3 ASP 59 2HB ASP 59 3.828 -10.050 1.769
373 H MET 60 H MET 60 0.581 -11.932 3.696
374 HA MET 60 HA MET 60 -0.605 -9.323 4.216
375 HB2 MET 60 1HB MET 60 -1.067 -12.132 5.259
376 HB3 MET 60 2HB MET 60 -1.861 -10.747 5.980
377 HG2 MET 60 1HG MET 60 -2.427 -10.173 3.418
378 HG3 MET 60 2HG MET 60 -2.303 -11.928 3.288
379 HE1 MET 60 3HE MET 60 -5.009 -13.091 5.891
380 HE2 MET 60 1HE MET 60 -3.866 -13.591 4.627
381 HE3 MET 60 2HE MET 60 -3.270 -12.879 6.147
382 H GLU 61 H GLU 61 2.277 -9.525 4.888
383 HA GLU 61 HA GLU 61 2.889 -8.113 7.015
384 HB2 GLU 61 1HB GLU 61 1.715 -10.505 8.111
385 HB3 GLU 61 2HB GLU 61 3.388 -10.378 8.623
386 HG2 GLU 61 1HG GLU 61 2.743 -7.852 9.102
387 HG3 GLU 61 2HG GLU 61 1.085 -8.458 9.051
Start of MODEL 17
1 H1 TYR 1 H TYR 1 -13.629 9.877 1.604
2 HA TYR 1 HA TYR 1 -12.247 9.394 3.535
3 HB2 TYR 1 1HB TYR 1 -13.315 7.161 3.962
4 HB3 TYR 1 2HB TYR 1 -12.305 6.471 2.688
5 HD1 TYR 1 2HD TYR 1 -12.324 8.251 5.910
6 HD2 TYR 1 1HD TYR 1 -9.841 6.179 3.041
7 HE1 TYR 1 2HE TYR 1 -10.371 8.574 7.376
8 HE2 TYR 1 1HE TYR 1 -7.899 6.545 4.441
9 HH TYR 1 HH TYR 1 -7.078 7.834 6.232
10 H ASN 2 H ASN 2 -11.695 7.221 0.726
11 HA ASN 2 HA ASN 2 -10.085 6.834 -0.558
12 HB2 ASN 2 1HB ASN 2 -10.285 9.583 -1.041
13 HB3 ASN 2 2HB ASN 2 -8.604 9.351 -0.750
14 HD21 ASN 2 1HD2 ASN 2 -7.799 9.454 -2.891
15 HD22 ASN 2 2HD2 ASN 2 -8.134 8.202 -4.069
16 HA PRO 3 HA PRO 3 -6.807 5.944 2.392
17 HB2 PRO 3 1HB PRO 3 -5.376 4.624 0.189
18 HB3 PRO 3 2HB PRO 3 -6.067 3.912 1.669
19 HG2 PRO 3 1HG PRO 3 -7.147 3.672 -0.936
20 HG3 PRO 3 2HG PRO 3 -7.898 3.215 0.634
21 HD2 PRO 3 1HD PRO 3 -8.556 5.404 -1.137
22 HD3 PRO 3 2HD PRO 3 -9.365 4.809 0.353
23 H GLU 4 H GLU 4 -6.472 7.570 -0.721
24 HA GLU 4 HA GLU 4 -3.771 8.403 -0.522
25 HB2 GLU 4 1HB GLU 4 -6.199 9.710 -1.823
26 HB3 GLU 4 2HB GLU 4 -4.536 10.245 -2.052
27 HG2 GLU 4 1HG GLU 4 -3.924 8.023 -2.970
28 HG3 GLU 4 2HG GLU 4 -5.601 7.481 -2.780
29 H ASP 5 H ASP 5 -6.597 9.565 1.337
30 HA ASP 5 HA ASP 5 -5.537 12.072 2.164
31 HB2 ASP 5 1HB ASP 5 -7.378 10.026 3.342
32 HB3 ASP 5 2HB ASP 5 -6.547 11.027 4.505
33 H ASP 6 H ASP 6 -4.562 8.820 3.111
34 HA ASP 6 HA ASP 6 -2.665 9.858 5.202
35 HB2 ASP 6 1HB ASP 6 -3.497 7.018 4.857
36 HB3 ASP 6 2HB ASP 6 -2.889 7.862 6.273
37 H TYR 7 H TYR 7 -2.405 9.505 2.115
38 HA TYR 7 HA TYR 7 -0.340 7.604 1.579
39 HB2 TYR 7 1HB TYR 7 -1.587 8.544 -0.229
40 HB3 TYR 7 2HB TYR 7 -1.243 10.191 0.297
41 HD1 TYR 7 2HD TYR 7 0.786 7.114 -0.594
42 HD2 TYR 7 1HD TYR 7 0.234 11.385 -1.010
43 HE1 TYR 7 2HE TYR 7 2.689 7.221 -2.170
44 HE2 TYR 7 1HE TYR 7 2.168 11.499 -2.526
45 HH TYR 7 HH TYR 7 3.959 8.527 -3.497
46 H THR 8 H THR 8 1.775 7.691 2.248
47 HA THR 8 HA THR 8 2.783 10.171 3.491
48 HB THR 8 HB THR 8 4.319 8.336 4.555
49 HG1 THR 8 1HG THR 8 3.109 6.312 4.692
50 HG21 THR 8 3HG2 THR 8 2.427 9.588 5.731
51 HG22 THR 8 1HG2 THR 8 1.404 8.197 5.330
52 HG23 THR 8 2HG2 THR 8 2.839 7.983 6.351
53 HA PRO 9 HA PRO 9 5.353 9.502 -0.334
54 HB2 PRO 9 1HB PRO 9 5.924 12.120 -0.920
55 HB3 PRO 9 2HB PRO 9 4.484 11.248 -1.503
56 HG2 PRO 9 1HG PRO 9 4.687 13.158 0.821
57 HG3 PRO 9 2HG PRO 9 3.390 12.985 -0.409
58 HD2 PRO 9 1HD PRO 9 3.193 11.930 2.119
59 HD3 PRO 9 2HD PRO 9 2.450 11.153 0.692
60 H LEU 10 H LEU 10 6.007 11.207 2.701
61 HA LEU 10 HA LEU 10 8.721 11.809 2.469
62 HB2 LEU 10 1HB LEU 10 6.764 11.025 4.635
63 HB3 LEU 10 2HB LEU 10 8.440 11.212 5.055
64 HG LEU 10 HG LEU 10 6.761 13.169 5.316
65 HD11 LEU 10 1HD1 LEU 10 9.179 13.273 5.787
66 HD12 LEU 10 2HD1 LEU 10 9.513 13.595 4.073
67 HD13 LEU 10 3HD1 LEU 10 8.621 14.784 5.061
68 HD21 LEU 10 3HD2 LEU 10 5.856 13.404 3.094
69 HD22 LEU 10 1HD2 LEU 10 6.776 14.844 3.520
70 HD23 LEU 10 2HD2 LEU 10 7.481 13.682 2.401
71 H THR 11 H THR 11 7.113 8.686 2.795
72 HA THR 11 HA THR 11 9.732 7.318 2.915
73 HB THR 11 HB THR 11 8.191 5.708 4.444
74 HG1 THR 11 1HG THR 11 6.437 6.917 4.514
75 HG21 THR 11 3HG2 THR 11 9.605 8.202 5.472
76 HG22 THR 11 1HG2 THR 11 9.143 6.797 6.448
77 HG23 THR 11 2HG2 THR 11 10.346 6.604 5.170
78 H CYS 12 H CYS 12 6.723 7.630 1.243
79 HA CYS 12 HA CYS 12 6.608 4.853 0.465
80 HB2 CYS 12 1HB CYS 12 4.603 6.241 0.797
81 HB3 CYS 12 2HB CYS 12 5.073 7.239 -0.569
82 HA PRO 13 HA PRO 13 9.375 5.619 -3.043
83 HB2 PRO 13 1HB PRO 13 9.242 2.992 -4.109
84 HB3 PRO 13 2HB PRO 13 10.404 3.628 -2.929
85 HG2 PRO 13 1HG PRO 13 8.036 1.918 -2.466
86 HG3 PRO 13 2HG PRO 13 9.533 2.048 -1.517
87 HD2 PRO 13 1HD PRO 13 7.067 3.158 -0.832
88 HD3 PRO 13 2HD PRO 13 8.646 3.699 -0.204
89 H HIS 14 H HIS 14 6.041 5.490 -3.348
90 HA HIS 14 HA HIS 14 6.124 5.336 -6.339
91 HB2 HIS 14 1HB HIS 14 3.822 4.340 -4.695
92 HB3 HIS 14 2HB HIS 14 4.098 3.948 -6.361
93 HD1 HIS 14 1HD HIS 14 5.939 1.875 -6.805
94 HD2 HIS 14 2HD HIS 14 4.851 2.779 -2.843
95 HE1 HIS 14 1HE HIS 14 6.695 -0.091 -5.318
96 HE2 HIS 14 2HE HIS 14 6.002 0.480 -2.966
97 H THR 15 H THR 15 4.665 6.844 -7.385
98 HA THR 15 HA THR 15 4.156 9.191 -5.771
99 HB THR 15 HB THR 15 3.397 10.129 -7.932
100 HG1 THR 15 1HG THR 15 3.630 8.784 -9.780
101 HG21 THR 15 3HG2 THR 15 5.963 8.504 -8.172
102 HG22 THR 15 1HG2 THR 15 5.568 9.986 -9.067
103 HG23 THR 15 2HG2 THR 15 5.822 10.017 -7.307
104 H ILE 16 H ILE 16 1.974 10.301 -5.710
105 HA ILE 16 HA ILE 16 -0.113 8.560 -4.951
106 HB ILE 16 HB ILE 16 0.368 10.957 -4.304
107 HG12 ILE 16 1HG1 ILE 16 -2.495 10.166 -4.928
108 HG13 ILE 16 2HG1 ILE 16 -1.562 9.691 -3.506
109 HG21 ILE 16 1HG2 ILE 16 -0.464 12.777 -5.536
110 HG22 ILE 16 2HG2 ILE 16 0.337 11.758 -6.748
111 HG23 ILE 16 3HG2 ILE 16 -1.432 11.736 -6.594
112 HD11 ILE 16 3HD1 ILE 16 -1.325 12.118 -2.880
113 HD12 ILE 16 1HD1 ILE 16 -2.426 12.529 -4.218
114 HD13 ILE 16 2HD1 ILE 16 -2.996 11.539 -2.876
115 H SER 17 H SER 17 0.993 9.288 -8.081
116 HA SER 17 HA SER 17 -1.439 9.093 -9.586
117 HB2 SER 17 1HB SER 17 0.934 9.922 -10.312
118 HB3 SER 17 2HB SER 17 1.332 8.218 -10.486
119 HG SER 17 HG SER 17 -0.661 9.714 -11.900
120 H VAL 18 H VAL 18 0.957 6.738 -8.288
121 HA VAL 18 HA VAL 18 -0.763 4.450 -9.055
122 HB VAL 18 HB VAL 18 1.053 3.334 -10.146
123 HG11 VAL 18 1HG1 VAL 18 1.329 4.549 -12.177
124 HG12 VAL 18 2HG1 VAL 18 -0.299 4.868 -11.565
125 HG13 VAL 18 3HG1 VAL 18 0.976 6.101 -11.399
126 HG21 VAL 18 3HG2 VAL 18 2.697 5.527 -8.995
127 HG22 VAL 18 1HG2 VAL 18 3.059 3.818 -9.240
128 HG23 VAL 18 2HG2 VAL 18 3.204 4.936 -10.620
129 H VAL 19 H VAL 19 -0.544 5.531 -6.525
130 HA VAL 19 HA VAL 19 1.265 3.585 -5.191
131 HB VAL 19 HB VAL 19 1.420 5.797 -4.348
132 HG11 VAL 19 1HG1 VAL 19 -0.327 6.936 -3.139
133 HG12 VAL 19 2HG1 VAL 19 -0.896 6.574 -4.773
134 HG13 VAL 19 3HG1 VAL 19 -1.468 5.607 -3.408
135 HG21 VAL 19 3HG2 VAL 19 1.892 3.924 -2.868
136 HG22 VAL 19 1HG2 VAL 19 1.206 5.280 -1.955
137 HG23 VAL 19 2HG2 VAL 19 0.207 3.874 -2.337
138 H TRP 20 H TRP 20 -2.313 4.307 -5.340
139 HA TRP 20 HA TRP 20 -2.984 2.288 -3.573
140 HB2 TRP 20 1HB TRP 20 -4.572 3.972 -4.333
141 HB3 TRP 20 2HB TRP 20 -4.637 3.235 -5.939
142 HD1 TRP 20 HD TRP 20 -6.493 1.465 -6.227
143 HE1 TRP 20 1HE TRP 20 -7.979 0.052 -4.679
144 HE3 TRP 20 3HE TRP 20 -4.319 2.602 -1.727
145 HZ2 TRP 20 2HZ TRP 20 -8.416 -0.215 -1.851
146 HZ3 TRP 20 3HZ TRP 20 -5.257 1.710 0.368
147 HH2 TRP 20 HH TRP 20 -7.377 0.395 0.316
148 H TYR 21 H TYR 21 -3.234 1.839 -7.173
149 HA TYR 21 HA TYR 21 -3.656 -0.941 -7.229
150 HB2 TYR 21 1HB TYR 21 -3.709 0.142 -9.318
151 HB3 TYR 21 2HB TYR 21 -2.201 1.009 -9.037
152 HD1 TYR 21 1HD TYR 21 -3.586 -2.364 -9.909
153 HD2 TYR 21 2HD TYR 21 -0.043 0.090 -9.566
154 HE1 TYR 21 1HE TYR 21 -2.214 -4.180 -10.877
155 HE2 TYR 21 2HE TYR 21 1.348 -1.778 -10.384
156 HH TYR 21 HH TYR 21 1.258 -3.873 -11.521
157 H GLU 22 H GLU 22 -0.528 0.869 -6.883
158 HA GLU 22 HA GLU 22 1.033 -1.365 -7.433
159 HB2 GLU 22 1HB GLU 22 2.432 0.575 -7.625
160 HB3 GLU 22 2HB GLU 22 1.123 1.413 -6.909
161 HG2 GLU 22 1HG GLU 22 3.074 1.817 -5.766
162 HG3 GLU 22 2HG GLU 22 1.979 1.030 -4.658
163 H CYS 23 H CYS 23 -0.403 -0.104 -4.318
164 HA CYS 23 HA CYS 23 1.400 -1.853 -2.813
165 HB2 CYS 23 1HB CYS 23 0.688 0.726 -2.421
166 HB3 CYS 23 2HB CYS 23 -0.629 -0.033 -1.563
167 H THR 24 H THR 24 -1.483 -2.152 -4.388
168 HA THR 24 HA THR 24 -2.488 -4.019 -2.372
169 HB THR 24 HB THR 24 -4.741 -3.307 -2.721
170 HG1 THR 24 1HG THR 24 -3.696 -1.260 -4.383
171 HG21 THR 24 3HG2 THR 24 -3.490 -2.131 -0.968
172 HG22 THR 24 1HG2 THR 24 -3.002 -0.869 -2.120
173 HG23 THR 24 2HG2 THR 24 -4.714 -1.087 -1.712
174 H GLU 25 H GLU 25 -1.044 -3.998 -5.261
175 HA GLU 25 HA GLU 25 -2.415 -6.418 -6.204
176 HB2 GLU 25 1HB GLU 25 -3.459 -4.009 -6.943
177 HB3 GLU 25 2HB GLU 25 -2.232 -4.121 -8.156
178 HG2 GLU 25 1HG GLU 25 -3.089 -6.392 -8.803
179 HG3 GLU 25 2HG GLU 25 -4.315 -6.250 -7.537
180 H ASN 26 H ASN 26 0.124 -4.000 -6.641
181 HA ASN 26 HA ASN 26 1.628 -5.628 -8.576
182 HB2 ASN 26 1HB ASN 26 1.832 -3.147 -8.511
183 HB3 ASN 26 2HB ASN 26 2.616 -3.306 -6.919
184 HD21 ASN 26 1HD2 ASN 26 4.345 -2.194 -7.628
185 HD22 ASN 26 2HD2 ASN 26 5.627 -3.004 -8.536
186 H THR 27 H THR 27 1.618 -7.643 -7.447
187 HA THR 27 HA THR 27 2.472 -8.175 -4.906
188 HB THR 27 HB THR 27 3.108 -10.473 -5.913
189 HG1 THR 27 1HG THR 27 3.068 -10.633 -7.978
190 HG21 THR 27 3HG2 THR 27 0.874 -10.028 -4.951
191 HG22 THR 27 1HG2 THR 27 0.333 -9.356 -6.505
192 HG23 THR 27 2HG2 THR 27 0.755 -11.076 -6.358
193 H ALA 28 H ALA 28 4.555 -7.330 -7.588
194 HA ALA 28 HA ALA 28 7.069 -8.146 -6.748
195 HB1 ALA 28 1HB ALA 28 6.237 -5.493 -7.998
196 HB2 ALA 28 2HB ALA 28 7.876 -6.115 -7.961
197 HB3 ALA 28 3HB ALA 28 6.645 -6.993 -8.875
198 H ASN 29 H ASN 29 5.007 -5.910 -5.038
199 HA ASN 29 HA ASN 29 6.969 -6.064 -2.922
200 HB2 ASN 29 1HB ASN 29 7.601 -3.832 -2.564
201 HB3 ASN 29 2HB ASN 29 7.545 -3.893 -4.327
202 HD21 ASN 29 1HD2 ASN 29 5.033 -3.654 -5.110
203 HD22 ASN 29 2HD2 ASN 29 4.688 -1.996 -4.669
204 H CYS 30 H CYS 30 3.628 -5.622 -3.905
205 HA CYS 30 HA CYS 30 2.770 -4.236 -1.605
206 HB2 CYS 30 1HB CYS 30 0.638 -4.546 -2.343
207 HB3 CYS 30 2HB CYS 30 1.627 -4.351 -3.778
208 H GLY 31 H GLY 31 1.316 -4.899 0.086
209 HA2 GLY 31 1HA GLY 31 0.508 -7.142 1.216
210 HA3 GLY 31 2HA GLY 31 2.260 -7.326 1.368
211 H THR 32 H THR 32 1.378 -7.253 3.753
212 HA THR 32 HA THR 32 0.291 -4.983 4.901
213 HB THR 32 HB THR 32 2.186 -7.050 6.080
214 HG1 THR 32 1HG THR 32 -0.369 -7.443 6.659
215 HG21 THR 32 3HG2 THR 32 1.880 -5.135 7.643
216 HG22 THR 32 1HG2 THR 32 0.120 -5.334 7.530
217 HG23 THR 32 2HG2 THR 32 1.116 -6.610 8.238
218 H ALA 33 H ALA 33 3.804 -5.752 4.541
219 HA ALA 33 HA ALA 33 4.624 -3.357 5.931
220 HB1 ALA 33 1HB ALA 33 6.103 -5.332 5.725
221 HB2 ALA 33 2HB ALA 33 6.191 -5.087 3.964
222 HB3 ALA 33 3HB ALA 33 6.855 -3.869 5.071
223 H CYS 34 H CYS 34 3.787 -4.057 2.539
224 HA CYS 34 HA CYS 34 4.842 -1.574 1.488
225 HB2 CYS 34 1HB CYS 34 4.078 -3.366 -0.006
226 HB3 CYS 34 2HB CYS 34 2.407 -3.117 0.518
227 H CYS 35 H CYS 35 1.622 -2.531 2.789
228 HA CYS 35 HA CYS 35 0.379 -0.036 2.450
229 HB2 CYS 35 1HB CYS 35 -0.111 -2.198 4.534
230 HB3 CYS 35 2HB CYS 35 -1.126 -0.773 4.346
231 H ASP 36 H ASP 36 2.058 -1.275 5.424
232 HA ASP 36 HA ASP 36 1.811 1.204 6.824
233 HB2 ASP 36 1HB ASP 36 3.310 -1.325 7.166
234 HB3 ASP 36 2HB ASP 36 4.106 0.095 7.851
235 H SER 37 H SER 37 4.256 0.162 4.444
236 HA SER 37 HA SER 37 5.875 2.541 4.878
237 HB2 SER 37 1HB SER 37 5.949 0.264 2.873
238 HB3 SER 37 2HB SER 37 7.056 1.635 2.808
239 HG SER 37 HG SER 37 7.834 -0.190 4.018
240 H CYS 38 H CYS 38 2.825 2.349 3.307
241 HA CYS 38 HA CYS 38 3.577 4.845 1.890
242 HB2 CYS 38 1HB CYS 38 2.224 2.385 0.808
243 HB3 CYS 38 2HB CYS 38 1.859 3.953 0.149
244 H PHE 39 H PHE 39 1.435 3.395 4.128
245 HA PHE 39 HA PHE 39 -0.471 5.608 3.857
246 HB2 PHE 39 1HB PHE 39 -1.086 2.626 3.724
247 HB3 PHE 39 2HB PHE 39 -2.274 3.847 4.001
248 HD1 PHE 39 1HD PHE 39 -2.042 5.919 2.099
249 HD2 PHE 39 2HD PHE 39 -0.982 1.781 1.555
250 HE1 PHE 39 1HE PHE 39 -2.458 6.117 -0.352
251 HE2 PHE 39 2HE PHE 39 -1.436 1.962 -0.856
252 HZ PHE 39 HZ PHE 39 -2.207 4.117 -1.800
253 H GLU 40 H GLU 40 -1.379 6.110 5.776
254 HA GLU 40 HA GLU 40 -0.741 4.448 8.143
255 HB2 GLU 40 1HB GLU 40 -0.929 7.468 8.360
256 HB3 GLU 40 2HB GLU 40 -0.420 6.369 9.546
257 HG2 GLU 40 1HG GLU 40 1.105 6.676 6.976
258 HG3 GLU 40 2HG GLU 40 1.415 7.624 8.391
259 H LEU 41 H LEU 41 -2.215 5.205 9.907
260 HA LEU 41 HA LEU 41 -3.890 5.730 10.839
261 HB2 LEU 41 1HB LEU 41 -5.212 7.566 9.099
262 HB3 LEU 41 2HB LEU 41 -5.470 7.352 10.804
263 HG LEU 41 HG LEU 41 -2.713 7.477 10.863
264 HD11 LEU 41 1HD1 LEU 41 -2.012 8.944 9.179
265 HD12 LEU 41 2HD1 LEU 41 -3.036 7.641 8.524
266 HD13 LEU 41 3HD1 LEU 41 -3.681 9.303 8.651
267 HD21 LEU 41 3HD2 LEU 41 -4.321 9.991 10.742
268 HD22 LEU 41 1HD2 LEU 41 -3.897 9.042 12.226
269 HD23 LEU 41 2HD2 LEU 41 -2.584 9.708 11.190
270 H THR 42 H THR 42 -6.709 6.327 9.464
271 HA THR 42 HA THR 42 -7.690 3.671 9.205
272 HB THR 42 HB THR 42 -8.688 6.421 8.486
273 HG1 THR 42 1HG THR 42 -9.751 4.544 10.281
274 HG21 THR 42 3HG2 THR 42 -10.969 5.528 8.148
275 HG22 THR 42 1HG2 THR 42 -9.879 5.085 6.837
276 HG23 THR 42 2HG2 THR 42 -10.293 3.884 8.079
277 H GLY 43 H GLY 43 -5.982 5.767 6.957
278 HA2 GLY 43 1HA GLY 43 -6.424 4.771 4.372
279 HA3 GLY 43 2HA GLY 43 -4.969 5.367 5.121
280 H ASN 44 H ASN 44 -4.105 3.775 6.862
281 HA ASN 44 HA ASN 44 -2.859 1.650 5.544
282 HB2 ASN 44 1HB ASN 44 -2.025 2.728 7.604
283 HB3 ASN 44 2HB ASN 44 -3.351 2.041 8.528
284 HD21 ASN 44 1HD2 ASN 44 -0.404 1.349 6.723
285 HD22 ASN 44 2HD2 ASN 44 -0.088 -0.173 7.566
286 H THR 45 H THR 45 -5.682 1.685 7.777
287 HA THR 45 HA THR 45 -6.247 -1.034 7.682
288 HB THR 45 HB THR 45 -8.410 1.075 7.828
289 HG1 THR 45 1HG THR 45 -6.291 0.665 9.643
290 HG21 THR 45 3HG2 THR 45 -9.079 -1.289 8.039
291 HG22 THR 45 1HG2 THR 45 -7.975 -1.480 9.419
292 HG23 THR 45 2HG2 THR 45 -9.365 -0.372 9.528
293 H MET 46 H MET 46 -7.350 1.596 5.442
294 HA MET 46 HA MET 46 -9.021 -0.155 3.882
295 HB2 MET 46 1HB MET 46 -7.840 2.565 3.056
296 HB3 MET 46 2HB MET 46 -8.954 1.573 2.134
297 HG2 MET 46 1HG MET 46 -10.420 1.561 4.258
298 HG3 MET 46 2HG MET 46 -9.427 2.929 4.772
299 HE1 MET 46 3HE MET 46 -12.687 1.899 3.055
300 HE2 MET 46 1HE MET 46 -12.636 2.755 1.492
301 HE3 MET 46 2HE MET 46 -11.477 1.464 1.839
302 H CYS 47 H CYS 47 -5.541 0.736 3.614
303 HA CYS 47 HA CYS 47 -5.091 -0.583 1.121
304 HB2 CYS 47 1HB CYS 47 -3.544 1.036 2.129
305 HB3 CYS 47 2HB CYS 47 -3.194 -0.084 3.444
306 H LEU 48 H LEU 48 -4.661 -1.749 4.523
307 HA LEU 48 HA LEU 48 -3.878 -4.367 3.881
308 HB2 LEU 48 1HB LEU 48 -5.421 -3.227 6.241
309 HB3 LEU 48 2HB LEU 48 -4.854 -4.888 6.168
310 HG LEU 48 HG LEU 48 -3.054 -2.429 6.080
311 HD11 LEU 48 1HD1 LEU 48 -2.413 -3.100 8.358
312 HD12 LEU 48 2HD1 LEU 48 -4.137 -2.735 8.272
313 HD13 LEU 48 3HD1 LEU 48 -3.581 -4.432 8.323
314 HD21 LEU 48 3HD2 LEU 48 -2.277 -5.362 6.316
315 HD22 LEU 48 1HD2 LEU 48 -2.006 -4.325 4.897
316 HD23 LEU 48 2HD2 LEU 48 -1.199 -3.945 6.409
317 H LEU 49 H LEU 49 -7.155 -3.071 4.424
318 HA LEU 49 HA LEU 49 -8.680 -5.367 3.993
319 HB2 LEU 49 1HB LEU 49 -9.092 -2.453 3.739
320 HB3 LEU 49 2HB LEU 49 -10.085 -3.343 2.609
321 HG LEU 49 HG LEU 49 -10.010 -4.081 5.557
322 HD11 LEU 49 1HD1 LEU 49 -10.632 -1.717 5.439
323 HD12 LEU 49 2HD1 LEU 49 -11.831 -2.062 4.176
324 HD13 LEU 49 3HD1 LEU 49 -12.063 -2.698 5.818
325 HD21 LEU 49 3HD2 LEU 49 -12.206 -5.069 5.049
326 HD22 LEU 49 1HD2 LEU 49 -12.132 -4.455 3.380
327 HD23 LEU 49 2HD2 LEU 49 -10.999 -5.701 3.913
328 H GLN 50 H GLN 50 -7.448 -3.118 1.440
329 HA GLN 50 HA GLN 50 -8.607 -4.703 -0.651
330 HB2 GLN 50 1HB GLN 50 -8.143 -2.247 -0.785
331 HB3 GLN 50 2HB GLN 50 -6.417 -2.594 -0.847
332 HG2 GLN 50 1HG GLN 50 -7.307 -2.203 -3.105
333 HG3 GLN 50 2HG GLN 50 -6.743 -3.857 -2.950
334 HE21 GLN 50 1HE2 GLN 50 -8.053 -5.384 -3.795
335 HE22 GLN 50 2HE2 GLN 50 -9.776 -5.219 -4.069
336 H ALA 51 H ALA 51 -5.194 -4.392 0.536
337 HA ALA 51 HA ALA 51 -4.061 -6.289 -1.255
338 HB1 ALA 51 1HB ALA 51 -3.240 -5.435 1.554
339 HB2 ALA 51 2HB ALA 51 -2.239 -6.424 0.479
340 HB3 ALA 51 3HB ALA 51 -2.654 -4.775 0.013
341 H GLY 52 H GLY 52 -6.297 -6.776 1.371
342 HA2 GLY 52 1HA GLY 52 -5.733 -9.667 1.622
343 HA3 GLY 52 2HA GLY 52 -6.706 -8.665 2.686
344 H ALA 53 H ALA 53 -7.530 -7.867 -0.573
345 HA ALA 53 HA ALA 53 -10.026 -9.412 -0.320
346 HB1 ALA 53 1HB ALA 53 -9.451 -6.786 -1.732
347 HB2 ALA 53 2HB ALA 53 -11.002 -7.643 -1.699
348 HB3 ALA 53 3HB ALA 53 -10.326 -6.988 -0.195
349 H ALA 54 H ALA 54 -9.605 -11.150 -1.363
350 HA ALA 54 HA ALA 54 -8.307 -12.046 -3.525
351 HB1 ALA 54 1HB ALA 54 -9.884 -13.420 -2.210
352 HB2 ALA 54 2HB ALA 54 -11.246 -12.580 -2.995
353 HB3 ALA 54 3HB ALA 54 -10.150 -13.591 -3.953
354 H GLY 55 H GLY 55 -7.907 -11.026 -5.180
355 HA2 GLY 55 1HA GLY 55 -9.030 -10.416 -7.567
356 HA3 GLY 55 2HA GLY 55 -9.675 -9.110 -6.548
357 H SER 56 H SER 56 -7.572 -8.732 -4.765
358 HA SER 56 HA SER 56 -5.556 -7.322 -6.196
359 HB2 SER 56 1HB SER 56 -6.175 -8.047 -3.326
360 HB3 SER 56 2HB SER 56 -4.629 -7.308 -3.730
361 HG SER 56 HG SER 56 -5.541 -5.575 -4.416
362 H GLY 57 H GLY 57 -4.486 -9.652 -3.695
363 HA2 GLY 57 1HA GLY 57 -2.935 -11.500 -4.116
364 HA3 GLY 57 2HA GLY 57 -2.574 -10.790 -5.690
365 H CYS 58 H CYS 58 -1.791 -10.780 -2.306
366 HA CYS 58 HA CYS 58 0.488 -9.099 -2.764
367 HB2 CYS 58 1HB CYS 58 -1.691 -8.240 -0.827
368 HB3 CYS 58 2HB CYS 58 -0.027 -7.698 -0.716
369 H ASP 59 H ASP 59 1.809 -9.006 -0.646
370 HA ASP 59 HA ASP 59 1.874 -11.707 0.510
371 HB2 ASP 59 1HB ASP 59 3.902 -10.749 -0.503
372 HB3 ASP 59 2HB ASP 59 3.871 -9.405 0.644
373 H MET 60 H MET 60 0.099 -11.566 1.927
374 HA MET 60 HA MET 60 -0.222 -9.455 3.886
375 HB2 MET 60 1HB MET 60 -1.358 -12.262 3.635
376 HB3 MET 60 2HB MET 60 -1.839 -11.126 4.896
377 HG2 MET 60 1HG MET 60 -3.010 -9.778 3.467
378 HG3 MET 60 2HG MET 60 -2.031 -10.157 2.055
379 HE1 MET 60 3HE MET 60 -2.699 -11.816 0.220
380 HE2 MET 60 1HE MET 60 -1.911 -12.926 1.359
381 HE3 MET 60 2HE MET 60 -3.458 -13.376 0.613
382 H GLU 61 H GLU 61 0.726 -9.239 5.819
383 HA GLU 61 HA GLU 61 1.812 -11.535 7.296
384 HB2 GLU 61 1HB GLU 61 3.342 -8.917 6.907
385 HB3 GLU 61 2HB GLU 61 3.763 -10.253 7.980
386 HG2 GLU 61 1HG GLU 61 3.719 -11.642 5.690
387 HG3 GLU 61 2HG GLU 61 4.051 -10.055 5.000
Start of MODEL 18
1 H1 TYR 1 H TYR 1 -14.136 8.793 0.645
2 HA TYR 1 HA TYR 1 -13.081 9.347 2.796
3 HB2 TYR 1 1HB TYR 1 -13.460 7.521 4.148
4 HB3 TYR 1 2HB TYR 1 -12.972 6.343 2.942
5 HD1 TYR 1 1HD TYR 1 -11.342 9.332 4.635
6 HD2 TYR 1 2HD TYR 1 -11.020 5.175 3.427
7 HE1 TYR 1 1HE TYR 1 -9.000 9.280 5.392
8 HE2 TYR 1 2HE TYR 1 -8.700 5.143 4.189
9 HH TYR 1 HH TYR 1 -7.019 8.050 5.473
10 H ASN 2 H ASN 2 -11.675 6.761 0.723
11 HA ASN 2 HA ASN 2 -10.055 6.736 -0.766
12 HB2 ASN 2 1HB ASN 2 -10.575 9.441 -1.045
13 HB3 ASN 2 2HB ASN 2 -8.955 9.488 -0.497
14 HD21 ASN 2 1HD2 ASN 2 -8.025 10.129 -2.417
15 HD22 ASN 2 2HD2 ASN 2 -7.770 9.059 -3.767
16 HA PRO 3 HA PRO 3 -7.094 6.112 2.626
17 HB2 PRO 3 1HB PRO 3 -5.261 4.522 1.282
18 HB3 PRO 3 2HB PRO 3 -6.794 3.922 1.973
19 HG2 PRO 3 1HG PRO 3 -6.201 4.629 -0.880
20 HG3 PRO 3 2HG PRO 3 -7.211 3.300 -0.230
21 HD2 PRO 3 1HD PRO 3 -8.318 5.544 -1.216
22 HD3 PRO 3 2HD PRO 3 -9.023 4.572 0.142
23 H GLU 4 H GLU 4 -6.409 7.477 -0.529
24 HA GLU 4 HA GLU 4 -3.813 8.498 -0.020
25 HB2 GLU 4 1HB GLU 4 -6.095 9.391 -1.781
26 HB3 GLU 4 2HB GLU 4 -4.519 10.157 -1.851
27 HG2 GLU 4 1HG GLU 4 -3.461 8.275 -2.787
28 HG3 GLU 4 2HG GLU 4 -4.645 7.149 -2.143
29 H ASP 5 H ASP 5 -6.931 9.499 1.400
30 HA ASP 5 HA ASP 5 -6.078 12.083 2.222
31 HB2 ASP 5 1HB ASP 5 -8.142 10.156 3.114
32 HB3 ASP 5 2HB ASP 5 -7.472 11.075 4.423
33 H ASP 6 H ASP 6 -4.793 8.987 3.131
34 HA ASP 6 HA ASP 6 -3.131 10.177 5.321
35 HB2 ASP 6 1HB ASP 6 -4.397 7.438 5.146
36 HB3 ASP 6 2HB ASP 6 -3.204 7.929 6.326
37 H TYR 7 H TYR 7 -2.576 9.834 2.346
38 HA TYR 7 HA TYR 7 -0.626 7.738 1.989
39 HB2 TYR 7 1HB TYR 7 -1.663 8.640 0.040
40 HB3 TYR 7 2HB TYR 7 -1.327 10.298 0.525
41 HD1 TYR 7 2HD TYR 7 0.613 7.142 -0.230
42 HD2 TYR 7 1HD TYR 7 0.328 11.416 -0.719
43 HE1 TYR 7 2HE TYR 7 2.645 7.128 -1.655
44 HE2 TYR 7 1HE TYR 7 2.253 11.372 -2.254
45 HH TYR 7 HH TYR 7 4.088 8.353 -2.990
46 H THR 8 H THR 8 1.560 7.758 2.468
47 HA THR 8 HA THR 8 2.662 10.237 3.651
48 HB THR 8 HB THR 8 4.167 8.534 4.865
49 HG1 THR 8 1HG THR 8 3.103 6.565 5.215
50 HG21 THR 8 3HG2 THR 8 2.516 8.407 6.647
51 HG22 THR 8 1HG2 THR 8 2.328 9.968 5.852
52 HG23 THR 8 2HG2 THR 8 1.190 8.662 5.491
53 HA PRO 9 HA PRO 9 5.036 9.522 -0.177
54 HB2 PRO 9 1HB PRO 9 5.803 12.170 -0.545
55 HB3 PRO 9 2HB PRO 9 4.364 11.404 -1.248
56 HG2 PRO 9 1HG PRO 9 4.581 13.171 1.174
57 HG3 PRO 9 2HG PRO 9 3.250 13.079 -0.017
58 HD2 PRO 9 1HD PRO 9 3.147 11.940 2.471
59 HD3 PRO 9 2HD PRO 9 2.309 11.231 1.066
60 H LEU 10 H LEU 10 6.077 11.143 2.863
61 HA LEU 10 HA LEU 10 8.732 11.618 2.235
62 HB2 LEU 10 1HB LEU 10 7.051 11.180 4.712
63 HB3 LEU 10 2HB LEU 10 8.776 11.350 4.886
64 HG LEU 10 HG LEU 10 7.220 13.395 5.077
65 HD11 LEU 10 1HD1 LEU 10 9.050 14.902 4.306
66 HD12 LEU 10 2HD1 LEU 10 9.694 13.503 5.169
67 HD13 LEU 10 3HD1 LEU 10 9.766 13.556 3.394
68 HD21 LEU 10 3HD2 LEU 10 7.512 13.520 2.067
69 HD22 LEU 10 1HD2 LEU 10 6.003 13.296 3.001
70 HD23 LEU 10 2HD2 LEU 10 6.915 14.799 3.131
71 H THR 11 H THR 11 7.320 8.488 2.751
72 HA THR 11 HA THR 11 10.086 7.437 2.551
73 HB THR 11 HB THR 11 9.464 5.517 4.004
74 HG1 THR 11 1HG THR 11 7.300 7.134 4.915
75 HG21 THR 11 3HG2 THR 11 9.345 8.179 5.472
76 HG22 THR 11 1HG2 THR 11 9.768 6.599 6.153
77 HG23 THR 11 2HG2 THR 11 10.822 7.352 4.931
78 H CYS 12 H CYS 12 6.976 7.562 1.135
79 HA CYS 12 HA CYS 12 6.681 4.795 0.612
80 HB2 CYS 12 1HB CYS 12 4.817 6.380 0.628
81 HB3 CYS 12 2HB CYS 12 5.460 7.160 -0.819
82 HA PRO 13 HA PRO 13 9.616 4.722 -2.864
83 HB2 PRO 13 1HB PRO 13 9.277 2.008 -3.541
84 HB3 PRO 13 2HB PRO 13 10.346 2.672 -2.238
85 HG2 PRO 13 1HG PRO 13 7.624 1.452 -2.073
86 HG3 PRO 13 2HG PRO 13 8.990 1.257 -0.958
87 HD2 PRO 13 1HD PRO 13 6.871 2.929 -0.509
88 HD3 PRO 13 2HD PRO 13 8.482 3.213 0.178
89 H HIS 14 H HIS 14 6.535 5.341 -3.180
90 HA HIS 14 HA HIS 14 6.359 4.914 -6.058
91 HB2 HIS 14 1HB HIS 14 4.018 3.992 -4.368
92 HB3 HIS 14 2HB HIS 14 4.344 3.723 -6.097
93 HD1 HIS 14 1HD HIS 14 5.675 1.712 -6.780
94 HD2 HIS 14 2HD HIS 14 4.984 2.218 -2.687
95 HE1 HIS 14 1HE HIS 14 6.321 -0.493 -5.691
96 HE2 HIS 14 2HE HIS 14 5.910 -0.195 -3.139
97 H THR 15 H THR 15 4.536 6.278 -6.991
98 HA THR 15 HA THR 15 4.344 8.741 -5.325
99 HB THR 15 HB THR 15 4.034 9.929 -7.384
100 HG1 THR 15 1HG THR 15 4.329 7.455 -8.748
101 HG21 THR 15 3HG2 THR 15 6.270 7.906 -7.730
102 HG22 THR 15 1HG2 THR 15 6.141 9.474 -8.541
103 HG23 THR 15 2HG2 THR 15 6.372 9.411 -6.770
104 H ILE 16 H ILE 16 2.251 9.959 -5.425
105 HA ILE 16 HA ILE 16 0.086 8.301 -4.955
106 HB ILE 16 HB ILE 16 0.545 10.592 -4.187
107 HG12 ILE 16 1HG1 ILE 16 -2.340 10.117 -5.095
108 HG13 ILE 16 2HG1 ILE 16 -1.571 9.151 -3.856
109 HG21 ILE 16 1HG2 ILE 16 -0.309 12.498 -5.371
110 HG22 ILE 16 2HG2 ILE 16 0.806 11.636 -6.437
111 HG23 ILE 16 3HG2 ILE 16 -0.952 11.489 -6.677
112 HD11 ILE 16 3HD1 ILE 16 -1.425 10.850 -2.314
113 HD12 ILE 16 1HD1 ILE 16 -1.564 12.145 -3.513
114 HD13 ILE 16 2HD1 ILE 16 -2.980 11.162 -3.099
115 H SER 17 H SER 17 1.348 8.744 -7.891
116 HA SER 17 HA SER 17 -0.918 8.898 -9.636
117 HB2 SER 17 1HB SER 17 1.892 8.231 -9.810
118 HB3 SER 17 2HB SER 17 0.945 7.295 -10.919
119 HG SER 17 HG SER 17 0.272 9.081 -11.897
120 H VAL 18 H VAL 18 1.086 6.201 -8.299
121 HA VAL 18 HA VAL 18 -1.256 4.384 -8.894
122 HB VAL 18 HB VAL 18 0.283 2.671 -9.688
123 HG11 VAL 18 1HG1 VAL 18 0.429 3.550 -11.942
124 HG12 VAL 18 2HG1 VAL 18 -1.089 4.024 -11.171
125 HG13 VAL 18 3HG1 VAL 18 0.220 5.210 -11.336
126 HG21 VAL 18 3HG2 VAL 18 2.469 2.839 -9.463
127 HG22 VAL 18 1HG2 VAL 18 2.461 3.930 -10.831
128 HG23 VAL 18 2HG2 VAL 18 2.509 4.568 -9.155
129 H VAL 19 H VAL 19 0.397 5.550 -6.357
130 HA VAL 19 HA VAL 19 1.464 3.491 -5.040
131 HB VAL 19 HB VAL 19 1.645 5.742 -4.299
132 HG11 VAL 19 1HG1 VAL 19 -0.066 7.005 -3.184
133 HG12 VAL 19 2HG1 VAL 19 -0.725 6.450 -4.727
134 HG13 VAL 19 3HG1 VAL 19 -1.198 5.649 -3.233
135 HG21 VAL 19 3HG2 VAL 19 0.466 3.975 -2.116
136 HG22 VAL 19 1HG2 VAL 19 2.165 4.225 -2.560
137 HG23 VAL 19 2HG2 VAL 19 1.245 5.503 -1.807
138 H TRP 20 H TRP 20 -2.057 4.164 -5.145
139 HA TRP 20 HA TRP 20 -2.819 2.165 -3.247
140 HB2 TRP 20 1HB TRP 20 -4.272 3.972 -4.028
141 HB3 TRP 20 2HB TRP 20 -4.307 3.287 -5.645
142 HD1 TRP 20 HD TRP 20 -6.345 1.895 -6.066
143 HE1 TRP 20 1HE TRP 20 -7.954 0.390 -4.748
144 HE3 TRP 20 3HE TRP 20 -4.300 2.523 -1.431
145 HZ2 TRP 20 2HZ TRP 20 -8.361 -0.321 -1.943
146 HZ3 TRP 20 3HZ TRP 20 -5.362 1.532 0.531
147 HH2 TRP 20 HH TRP 20 -7.421 0.114 0.277
148 H TYR 21 H TYR 21 -2.981 1.936 -6.869
149 HA TYR 21 HA TYR 21 -3.265 -0.774 -7.222
150 HB2 TYR 21 1HB TYR 21 -3.301 0.568 -9.136
151 HB3 TYR 21 2HB TYR 21 -1.777 1.347 -8.779
152 HD1 TYR 21 2HD TYR 21 -3.369 -1.700 -10.117
153 HD2 TYR 21 1HD TYR 21 0.431 0.233 -9.283
154 HE1 TYR 21 2HE TYR 21 -2.211 -3.290 -11.608
155 HE2 TYR 21 1HE TYR 21 1.571 -1.377 -10.759
156 HH TYR 21 HH TYR 21 1.323 -3.432 -11.847
157 H GLU 22 H GLU 22 0.081 0.866 -7.005
158 HA GLU 22 HA GLU 22 1.280 -1.554 -7.194
159 HB2 GLU 22 1HB GLU 22 3.173 -0.054 -7.004
160 HB3 GLU 22 2HB GLU 22 2.127 0.859 -7.840
161 HG2 GLU 22 1HG GLU 22 1.454 1.736 -5.687
162 HG3 GLU 22 2HG GLU 22 3.153 1.251 -5.308
163 H CYS 23 H CYS 23 -0.224 -0.228 -4.313
164 HA CYS 23 HA CYS 23 1.439 -1.927 -2.532
165 HB2 CYS 23 1HB CYS 23 -0.456 0.376 -2.049
166 HB3 CYS 23 2HB CYS 23 -0.416 -0.907 -0.890
167 H THR 24 H THR 24 -1.455 -2.109 -4.440
168 HA THR 24 HA THR 24 -2.567 -4.038 -2.482
169 HB THR 24 HB THR 24 -4.786 -3.264 -3.102
170 HG1 THR 24 1HG THR 24 -3.429 -1.158 -4.422
171 HG21 THR 24 3HG2 THR 24 -3.695 -2.303 -1.109
172 HG22 THR 24 1HG2 THR 24 -3.012 -0.996 -2.094
173 HG23 THR 24 2HG2 THR 24 -4.764 -1.132 -1.900
174 H GLU 25 H GLU 25 -1.537 -3.678 -5.709
175 HA GLU 25 HA GLU 25 -2.978 -6.148 -6.506
176 HB2 GLU 25 1HB GLU 25 -3.754 -3.717 -7.319
177 HB3 GLU 25 2HB GLU 25 -2.421 -3.870 -8.428
178 HG2 GLU 25 1HG GLU 25 -3.353 -5.972 -9.320
179 HG3 GLU 25 2HG GLU 25 -4.590 -5.999 -8.071
180 H ASN 26 H ASN 26 -0.179 -4.010 -7.204
181 HA ASN 26 HA ASN 26 1.153 -5.950 -8.874
182 HB2 ASN 26 1HB ASN 26 1.751 -3.623 -9.074
183 HB3 ASN 26 2HB ASN 26 2.224 -3.561 -7.360
184 HD21 ASN 26 1HD2 ASN 26 4.256 -2.758 -8.154
185 HD22 ASN 26 2HD2 ASN 26 5.514 -3.844 -8.685
186 H THR 27 H THR 27 1.129 -7.961 -7.727
187 HA THR 27 HA THR 27 1.851 -8.493 -5.165
188 HB THR 27 HB THR 27 2.384 -10.768 -5.965
189 HG1 THR 27 1HG THR 27 3.200 -10.743 -7.850
190 HG21 THR 27 3HG2 THR 27 -0.113 -9.571 -7.241
191 HG22 THR 27 1HG2 THR 27 0.164 -11.273 -6.809
192 HG23 THR 27 2HG2 THR 27 0.039 -10.047 -5.545
193 H ALA 28 H ALA 28 4.270 -7.448 -7.502
194 HA ALA 28 HA ALA 28 6.482 -8.817 -6.264
195 HB1 ALA 28 1HB ALA 28 6.461 -7.734 -8.557
196 HB2 ALA 28 2HB ALA 28 6.556 -6.160 -7.722
197 HB3 ALA 28 3HB ALA 28 7.858 -7.356 -7.544
198 H ASN 29 H ASN 29 4.572 -6.010 -5.294
199 HA ASN 29 HA ASN 29 6.289 -5.814 -2.894
200 HB2 ASN 29 1HB ASN 29 6.907 -3.624 -3.091
201 HB3 ASN 29 2HB ASN 29 6.898 -4.059 -4.813
202 HD21 ASN 29 1HD2 ASN 29 5.291 -3.363 -6.213
203 HD22 ASN 29 2HD2 ASN 29 3.941 -2.443 -5.524
204 H CYS 30 H CYS 30 3.073 -5.745 -4.225
205 HA CYS 30 HA CYS 30 1.915 -4.014 -2.350
206 HB2 CYS 30 1HB CYS 30 -0.183 -4.954 -2.978
207 HB3 CYS 30 2HB CYS 30 0.807 -4.770 -4.408
208 H GLY 31 H GLY 31 0.759 -4.383 -0.364
209 HA2 GLY 31 1HA GLY 31 0.161 -6.461 1.111
210 HA3 GLY 31 2HA GLY 31 1.922 -6.639 1.126
211 H THR 32 H THR 32 1.062 -6.565 3.467
212 HA THR 32 HA THR 32 0.257 -4.198 4.655
213 HB THR 32 HB THR 32 1.862 -6.474 5.898
214 HG1 THR 32 1HG THR 32 -0.329 -7.322 6.217
215 HG21 THR 32 3HG2 THR 32 1.073 -4.217 7.250
216 HG22 THR 32 1HG2 THR 32 -0.369 -5.238 7.442
217 HG23 THR 32 2HG2 THR 32 1.207 -5.810 7.969
218 H ALA 33 H ALA 33 3.603 -5.445 4.292
219 HA ALA 33 HA ALA 33 4.871 -3.268 5.576
220 HB1 ALA 33 1HB ALA 33 5.983 -5.412 5.047
221 HB2 ALA 33 2HB ALA 33 5.862 -5.059 3.305
222 HB3 ALA 33 3HB ALA 33 6.890 -4.061 4.347
223 H CYS 34 H CYS 34 3.696 -3.509 2.214
224 HA CYS 34 HA CYS 34 4.934 -1.018 1.355
225 HB2 CYS 34 1HB CYS 34 4.146 -2.691 -0.240
226 HB3 CYS 34 2HB CYS 34 2.474 -2.471 0.269
227 H CYS 35 H CYS 35 1.687 -1.968 2.512
228 HA CYS 35 HA CYS 35 0.473 0.556 2.446
229 HB2 CYS 35 1HB CYS 35 0.048 -1.724 4.416
230 HB3 CYS 35 2HB CYS 35 -1.032 -0.362 4.208
231 H ASP 36 H ASP 36 2.295 -0.981 5.133
232 HA ASP 36 HA ASP 36 2.096 1.136 6.989
233 HB2 ASP 36 1HB ASP 36 3.936 -1.243 6.624
234 HB3 ASP 36 2HB ASP 36 4.207 -0.093 7.902
235 H SER 37 H SER 37 4.004 1.114 4.131
236 HA SER 37 HA SER 37 5.515 3.451 5.192
237 HB2 SER 37 1HB SER 37 6.420 1.266 3.292
238 HB3 SER 37 2HB SER 37 7.238 2.843 3.412
239 HG SER 37 HG SER 37 7.161 2.413 5.770
240 H CYS 38 H CYS 38 2.874 2.870 3.338
241 HA CYS 38 HA CYS 38 3.430 5.352 1.793
242 HB2 CYS 38 1HB CYS 38 2.139 2.746 0.947
243 HB3 CYS 38 2HB CYS 38 1.922 4.239 0.072
244 H PHE 39 H PHE 39 1.321 3.759 4.066
245 HA PHE 39 HA PHE 39 -0.658 5.913 3.804
246 HB2 PHE 39 1HB PHE 39 -1.187 2.904 3.650
247 HB3 PHE 39 2HB PHE 39 -2.412 4.101 3.957
248 HD1 PHE 39 1HD PHE 39 -2.677 6.013 2.117
249 HD2 PHE 39 2HD PHE 39 -0.769 2.213 1.421
250 HE1 PHE 39 1HE PHE 39 -3.152 6.208 -0.305
251 HE2 PHE 39 2HE PHE 39 -1.257 2.401 -0.986
252 HZ PHE 39 HZ PHE 39 -2.469 4.393 -1.844
253 H GLU 40 H GLU 40 -1.756 6.216 5.840
254 HA GLU 40 HA GLU 40 -0.841 4.462 8.084
255 HB2 GLU 40 1HB GLU 40 -1.302 7.426 8.229
256 HB3 GLU 40 2HB GLU 40 -0.679 6.355 9.508
257 HG2 GLU 40 1HG GLU 40 1.208 5.867 7.729
258 HG3 GLU 40 2HG GLU 40 0.582 7.387 7.045
259 H LEU 41 H LEU 41 -2.245 4.586 9.946
260 HA LEU 41 HA LEU 41 -4.225 4.328 11.015
261 HB2 LEU 41 1HB LEU 41 -4.728 6.963 9.630
262 HB3 LEU 41 2HB LEU 41 -5.489 6.418 11.134
263 HG LEU 41 HG LEU 41 -2.520 7.018 10.716
264 HD11 LEU 41 1HD1 LEU 41 -4.012 9.000 10.634
265 HD12 LEU 41 2HD1 LEU 41 -4.607 8.596 12.227
266 HD13 LEU 41 3HD1 LEU 41 -2.893 9.016 12.011
267 HD21 LEU 41 3HD2 LEU 41 -4.042 6.274 13.245
268 HD22 LEU 41 1HD2 LEU 41 -2.766 5.324 12.457
269 HD23 LEU 41 2HD2 LEU 41 -2.377 6.885 13.194
270 H THR 42 H THR 42 -6.525 5.985 9.208
271 HA THR 42 HA THR 42 -7.951 3.548 8.688
272 HB THR 42 HB THR 42 -8.580 6.298 7.549
273 HG1 THR 42 1HG THR 42 -8.364 6.751 9.571
274 HG21 THR 42 3HG2 THR 42 -10.941 5.463 8.015
275 HG22 THR 42 1HG2 THR 42 -10.098 4.626 6.694
276 HG23 THR 42 2HG2 THR 42 -10.257 3.865 8.293
277 H GLY 43 H GLY 43 -5.751 5.530 6.726
278 HA2 GLY 43 1HA GLY 43 -6.608 4.494 4.171
279 HA3 GLY 43 2HA GLY 43 -5.161 5.464 4.505
280 H ASN 44 H ASN 44 -4.038 3.894 6.491
281 HA ASN 44 HA ASN 44 -2.668 1.759 5.189
282 HB2 ASN 44 1HB ASN 44 -1.858 2.813 7.266
283 HB3 ASN 44 2HB ASN 44 -3.181 2.084 8.177
284 HD21 ASN 44 1HD2 ASN 44 -0.213 1.551 6.392
285 HD22 ASN 44 2HD2 ASN 44 0.109 -0.005 7.166
286 H THR 45 H THR 45 -5.362 1.702 7.582
287 HA THR 45 HA THR 45 -5.768 -1.042 7.416
288 HB THR 45 HB THR 45 -7.888 1.030 8.018
289 HG1 THR 45 1HG THR 45 -6.142 1.474 9.362
290 HG21 THR 45 3HG2 THR 45 -7.501 -1.841 8.966
291 HG22 THR 45 1HG2 THR 45 -8.685 -0.710 9.639
292 HG23 THR 45 2HG2 THR 45 -8.821 -1.216 7.950
293 H MET 46 H MET 46 -7.317 1.521 5.316
294 HA MET 46 HA MET 46 -8.866 -0.415 3.872
295 HB2 MET 46 1HB MET 46 -7.986 2.393 3.108
296 HB3 MET 46 2HB MET 46 -8.699 1.272 1.951
297 HG2 MET 46 1HG MET 46 -10.534 0.902 3.747
298 HG3 MET 46 2HG MET 46 -9.966 2.437 4.414
299 HE1 MET 46 3HE MET 46 -12.785 1.110 2.714
300 HE2 MET 46 1HE MET 46 -12.832 2.483 3.846
301 HE3 MET 46 2HE MET 46 -13.434 2.675 2.184
302 H CYS 47 H CYS 47 -5.498 0.732 3.417
303 HA CYS 47 HA CYS 47 -4.979 -0.651 0.983
304 HB2 CYS 47 1HB CYS 47 -3.609 1.161 1.952
305 HB3 CYS 47 2HB CYS 47 -3.108 0.108 3.256
306 H LEU 48 H LEU 48 -4.500 -1.680 4.391
307 HA LEU 48 HA LEU 48 -3.684 -4.318 3.899
308 HB2 LEU 48 1HB LEU 48 -5.423 -3.221 6.165
309 HB3 LEU 48 2HB LEU 48 -4.640 -4.772 6.139
310 HG LEU 48 HG LEU 48 -3.314 -2.049 6.311
311 HD11 LEU 48 1HD1 LEU 48 -3.289 -4.425 8.192
312 HD12 LEU 48 2HD1 LEU 48 -2.473 -2.860 8.434
313 HD13 LEU 48 3HD1 LEU 48 -4.243 -2.925 8.394
314 HD21 LEU 48 3HD2 LEU 48 -1.971 -4.728 5.963
315 HD22 LEU 48 1HD2 LEU 48 -1.910 -3.358 4.841
316 HD23 LEU 48 2HD2 LEU 48 -1.155 -3.201 6.425
317 H LEU 49 H LEU 49 -6.982 -3.026 4.355
318 HA LEU 49 HA LEU 49 -8.428 -5.398 3.955
319 HB2 LEU 49 1HB LEU 49 -9.009 -2.510 3.804
320 HB3 LEU 49 2HB LEU 49 -9.954 -3.428 2.667
321 HG LEU 49 HG LEU 49 -10.652 -4.947 4.588
322 HD11 LEU 49 1HD1 LEU 49 -8.802 -4.253 6.176
323 HD12 LEU 49 2HD1 LEU 49 -9.563 -2.656 6.287
324 HD13 LEU 49 3HD1 LEU 49 -10.425 -4.093 6.866
325 HD21 LEU 49 3HD2 LEU 49 -12.141 -3.244 3.693
326 HD22 LEU 49 1HD2 LEU 49 -12.276 -3.260 5.463
327 HD23 LEU 49 2HD2 LEU 49 -11.353 -1.978 4.661
328 H GLN 50 H GLN 50 -7.150 -3.216 1.367
329 HA GLN 50 HA GLN 50 -8.394 -4.790 -0.716
330 HB2 GLN 50 1HB GLN 50 -7.908 -2.301 -0.720
331 HB3 GLN 50 2HB GLN 50 -6.209 -2.697 -0.936
332 HG2 GLN 50 1HG GLN 50 -7.074 -2.210 -3.113
333 HG3 GLN 50 2HG GLN 50 -6.889 -3.953 -3.060
334 HE21 GLN 50 1HE2 GLN 50 -8.699 -5.172 -3.614
335 HE22 GLN 50 2HE2 GLN 50 -10.370 -4.577 -3.537
336 H ALA 51 H ALA 51 -4.965 -4.373 0.362
337 HA ALA 51 HA ALA 51 -3.831 -6.197 -1.504
338 HB1 ALA 51 1HB ALA 51 -2.932 -5.334 1.284
339 HB2 ALA 51 2HB ALA 51 -1.918 -6.191 0.110
340 HB3 ALA 51 3HB ALA 51 -2.502 -4.550 -0.242
341 H GLY 52 H GLY 52 -4.956 -6.656 1.868
342 HA2 GLY 52 1HA GLY 52 -4.523 -9.538 1.841
343 HA3 GLY 52 2HA GLY 52 -5.156 -8.544 3.152
344 H ALA 53 H ALA 53 -6.892 -7.889 0.246
345 HA ALA 53 HA ALA 53 -9.340 -9.009 1.127
346 HB1 ALA 53 1HB ALA 53 -10.101 -8.550 -1.173
347 HB2 ALA 53 2HB ALA 53 -9.141 -7.197 -0.578
348 HB3 ALA 53 3HB ALA 53 -8.432 -8.362 -1.716
349 H ALA 54 H ALA 54 -6.640 -10.407 -0.502
350 HA ALA 54 HA ALA 54 -5.986 -12.314 -1.273
351 HB1 ALA 54 1HB ALA 54 -7.014 -13.352 0.718
352 HB2 ALA 54 2HB ALA 54 -8.503 -13.612 -0.221
353 HB3 ALA 54 3HB ALA 54 -6.986 -14.401 -0.727
354 H GLY 55 H GLY 55 -5.929 -13.030 -3.279
355 HA2 GLY 55 1HA GLY 55 -7.443 -13.768 -5.294
356 HA3 GLY 55 2HA GLY 55 -8.061 -12.114 -5.111
357 H SER 56 H SER 56 -6.038 -10.576 -4.492
358 HA SER 56 HA SER 56 -4.713 -10.373 -7.047
359 HB2 SER 56 1HB SER 56 -4.295 -8.736 -4.516
360 HB3 SER 56 2HB SER 56 -3.579 -8.386 -6.098
361 HG SER 56 HG SER 56 -6.373 -8.552 -5.508
362 H GLY 57 H GLY 57 -3.358 -11.012 -3.737
363 HA2 GLY 57 1HA GLY 57 -1.944 -13.063 -3.673
364 HA3 GLY 57 2HA GLY 57 -1.140 -12.501 -5.116
365 H CYS 58 H CYS 58 -1.841 -10.209 -2.462
366 HA CYS 58 HA CYS 58 0.865 -9.348 -2.572
367 HB2 CYS 58 1HB CYS 58 -1.389 -8.736 -0.622
368 HB3 CYS 58 2HB CYS 58 0.098 -7.820 -0.768
369 H ASP 59 H ASP 59 2.208 -8.967 -0.709
370 HA ASP 59 HA ASP 59 2.731 -11.247 1.074
371 HB2 ASP 59 1HB ASP 59 4.652 -10.208 0.257
372 HB3 ASP 59 2HB ASP 59 3.964 -8.589 0.363
373 H MET 60 H MET 60 2.443 -11.058 3.407
374 HA MET 60 HA MET 60 0.964 -8.784 4.509
375 HB2 MET 60 1HB MET 60 -0.024 -11.667 4.453
376 HB3 MET 60 2HB MET 60 -0.604 -10.491 5.603
377 HG2 MET 60 1HG MET 60 -0.785 -9.767 2.699
378 HG3 MET 60 2HG MET 60 -1.771 -11.071 3.252
379 HE1 MET 60 3HE MET 60 -4.153 -9.427 5.862
380 HE2 MET 60 1HE MET 60 -3.855 -10.861 4.851
381 HE3 MET 60 2HE MET 60 -2.706 -10.403 6.128
382 H GLU 61 H GLU 61 1.752 -8.424 6.580
383 HA GLU 61 HA GLU 61 3.036 -10.611 8.080
384 HB2 GLU 61 1HB GLU 61 4.174 -7.785 7.817
385 HB3 GLU 61 2HB GLU 61 4.730 -9.046 8.920
386 HG2 GLU 61 1HG GLU 61 5.061 -10.438 6.687
387 HG3 GLU 61 2HG GLU 61 5.084 -8.846 5.932
Start of MODEL 19
1 H1 TYR 1 H TYR 1 -13.634 5.215 2.726
2 HA TYR 1 HA TYR 1 -12.624 7.970 3.036
3 HB2 TYR 1 1HB TYR 1 -12.794 6.573 5.053
4 HB3 TYR 1 2HB TYR 1 -11.809 5.323 4.307
5 HD1 TYR 1 2HD TYR 1 -9.374 5.685 3.896
6 HD2 TYR 1 1HD TYR 1 -11.826 8.609 5.926
7 HE1 TYR 1 2HE TYR 1 -7.353 6.801 4.657
8 HE2 TYR 1 1HE TYR 1 -9.780 9.757 6.738
9 HH TYR 1 HH TYR 1 -6.613 8.450 6.509
10 H ASN 2 H ASN 2 -11.126 8.698 1.567
11 HA ASN 2 HA ASN 2 -10.026 6.831 -0.390
12 HB2 ASN 2 1HB ASN 2 -9.634 9.814 0.039
13 HB3 ASN 2 2HB ASN 2 -8.823 8.868 -1.166
14 HD21 ASN 2 1HD2 ASN 2 -9.873 10.468 -2.681
15 HD22 ASN 2 2HD2 ASN 2 -11.404 9.969 -3.322
16 HA PRO 3 HA PRO 3 -6.711 5.908 2.608
17 HB2 PRO 3 1HB PRO 3 -5.232 5.050 0.136
18 HB3 PRO 3 2HB PRO 3 -5.499 4.144 1.658
19 HG2 PRO 3 1HG PRO 3 -6.895 3.714 -0.712
20 HG3 PRO 3 2HG PRO 3 -7.581 3.393 0.920
21 HD2 PRO 3 1HD PRO 3 -8.150 5.550 -1.026
22 HD3 PRO 3 2HD PRO 3 -9.150 4.829 0.294
23 H GLU 4 H GLU 4 -6.348 7.624 -0.378
24 HA GLU 4 HA GLU 4 -3.774 8.672 -0.313
25 HB2 GLU 4 1HB GLU 4 -6.459 9.440 -1.523
26 HB3 GLU 4 2HB GLU 4 -5.004 10.378 -1.880
27 HG2 GLU 4 1HG GLU 4 -3.922 8.603 -2.994
28 HG3 GLU 4 2HG GLU 4 -4.886 7.373 -2.198
29 H ASP 5 H ASP 5 -6.207 9.382 1.981
30 HA ASP 5 HA ASP 5 -5.337 12.157 2.508
31 HB2 ASP 5 1HB ASP 5 -7.259 10.230 3.827
32 HB3 ASP 5 2HB ASP 5 -6.754 11.713 4.629
33 H ASP 6 H ASP 6 -4.496 8.877 3.553
34 HA ASP 6 HA ASP 6 -2.611 9.983 5.619
35 HB2 ASP 6 1HB ASP 6 -3.710 7.180 5.335
36 HB3 ASP 6 2HB ASP 6 -2.507 7.707 6.502
37 H TYR 7 H TYR 7 -2.417 9.807 2.557
38 HA TYR 7 HA TYR 7 -0.440 7.805 1.905
39 HB2 TYR 7 1HB TYR 7 -1.740 8.727 0.151
40 HB3 TYR 7 2HB TYR 7 -1.374 10.383 0.629
41 HD1 TYR 7 1HD TYR 7 0.654 7.296 -0.301
42 HD2 TYR 7 2HD TYR 7 -0.055 11.523 -0.890
43 HE1 TYR 7 1HE TYR 7 2.415 7.362 -2.042
44 HE2 TYR 7 2HE TYR 7 1.757 11.589 -2.584
45 HH TYR 7 HH TYR 7 3.584 8.658 -3.539
46 H THR 8 H THR 8 1.706 7.833 2.528
47 HA THR 8 HA THR 8 2.857 10.382 3.539
48 HB THR 8 HB THR 8 4.287 8.740 4.875
49 HG1 THR 8 1HG THR 8 2.905 6.792 5.273
50 HG21 THR 8 3HG2 THR 8 2.681 8.624 6.634
51 HG22 THR 8 1HG2 THR 8 2.383 10.135 5.786
52 HG23 THR 8 2HG2 THR 8 1.316 8.750 5.531
53 HA PRO 9 HA PRO 9 5.324 9.265 -0.264
54 HB2 PRO 9 1HB PRO 9 5.753 11.808 -1.176
55 HB3 PRO 9 2HB PRO 9 4.349 10.812 -1.591
56 HG2 PRO 9 1HG PRO 9 4.540 12.998 0.466
57 HG3 PRO 9 2HG PRO 9 3.207 12.633 -0.673
58 HD2 PRO 9 1HD PRO 9 3.163 11.887 1.961
59 HD3 PRO 9 2HD PRO 9 2.372 10.925 0.669
60 H LEU 10 H LEU 10 5.950 11.579 2.378
61 HA LEU 10 HA LEU 10 8.649 11.934 2.239
62 HB2 LEU 10 1HB LEU 10 6.671 11.454 4.520
63 HB3 LEU 10 2HB LEU 10 8.379 11.775 4.822
64 HG LEU 10 HG LEU 10 8.180 13.856 3.433
65 HD11 LEU 10 1HD1 LEU 10 6.261 13.588 2.073
66 HD12 LEU 10 2HD1 LEU 10 5.208 13.298 3.486
67 HD13 LEU 10 3HD1 LEU 10 5.933 14.889 3.179
68 HD21 LEU 10 3HD2 LEU 10 6.384 13.632 5.894
69 HD22 LEU 10 1HD2 LEU 10 8.128 13.965 5.880
70 HD23 LEU 10 2HD2 LEU 10 7.000 15.152 5.223
71 H THR 11 H THR 11 6.990 8.872 2.739
72 HA THR 11 HA THR 11 9.618 7.621 2.994
73 HB THR 11 HB THR 11 8.808 7.395 5.077
74 HG1 THR 11 1HG THR 11 9.175 5.321 5.271
75 HG21 THR 11 3HG2 THR 11 6.513 6.183 3.635
76 HG22 THR 11 1HG2 THR 11 6.736 6.068 5.419
77 HG23 THR 11 2HG2 THR 11 6.554 7.663 4.622
78 H CYS 12 H CYS 12 6.408 7.558 1.467
79 HA CYS 12 HA CYS 12 6.672 5.056 0.265
80 HB2 CYS 12 1HB CYS 12 4.595 6.426 0.723
81 HB3 CYS 12 2HB CYS 12 4.981 7.371 -0.691
82 HA PRO 13 HA PRO 13 9.349 6.425 -3.214
83 HB2 PRO 13 1HB PRO 13 9.583 3.764 -4.272
84 HB3 PRO 13 2HB PRO 13 10.735 4.646 -3.204
85 HG2 PRO 13 1HG PRO 13 8.707 2.578 -2.636
86 HG3 PRO 13 2HG PRO 13 10.201 2.941 -1.740
87 HD2 PRO 13 1HD PRO 13 7.611 3.579 -0.955
88 HD3 PRO 13 2HD PRO 13 9.099 4.365 -0.374
89 H HIS 14 H HIS 14 6.160 5.867 -3.317
90 HA HIS 14 HA HIS 14 6.008 5.586 -6.299
91 HB2 HIS 14 1HB HIS 14 4.002 4.301 -4.475
92 HB3 HIS 14 2HB HIS 14 4.329 3.928 -6.146
93 HD1 HIS 14 1HD HIS 14 6.213 1.929 -6.511
94 HD2 HIS 14 2HD HIS 14 5.399 3.146 -2.588
95 HE1 HIS 14 1HE HIS 14 7.094 0.156 -4.931
96 HE2 HIS 14 2HE HIS 14 6.650 0.889 -2.639
97 H THR 15 H THR 15 4.368 6.812 -7.312
98 HA THR 15 HA THR 15 3.766 9.242 -5.931
99 HB THR 15 HB THR 15 2.811 9.855 -8.099
100 HG1 THR 15 1HG THR 15 2.803 8.387 -9.780
101 HG21 THR 15 3HG2 THR 15 4.809 9.576 -9.498
102 HG22 THR 15 1HG2 THR 15 5.286 9.888 -7.827
103 HG23 THR 15 2HG2 THR 15 5.366 8.234 -8.473
104 H ILE 16 H ILE 16 1.555 10.258 -5.916
105 HA ILE 16 HA ILE 16 -0.289 8.533 -4.678
106 HB ILE 16 HB ILE 16 -0.009 11.033 -4.438
107 HG12 ILE 16 1HG1 ILE 16 -2.877 10.058 -4.728
108 HG13 ILE 16 2HG1 ILE 16 -1.804 9.686 -3.371
109 HG21 ILE 16 1HG2 ILE 16 -0.250 11.518 -6.939
110 HG22 ILE 16 2HG2 ILE 16 -1.997 11.284 -6.714
111 HG23 ILE 16 3HG2 ILE 16 -1.150 12.572 -5.838
112 HD11 ILE 16 3HD1 ILE 16 -2.820 12.443 -4.158
113 HD12 ILE 16 1HD1 ILE 16 -3.210 11.514 -2.704
114 HD13 ILE 16 2HD1 ILE 16 -1.574 12.152 -2.919
115 H SER 17 H SER 17 0.276 9.085 -8.026
116 HA SER 17 HA SER 17 -2.260 8.049 -9.009
117 HB2 SER 17 1HB SER 17 0.149 9.145 -10.156
118 HB3 SER 17 2HB SER 17 -0.347 7.682 -11.021
119 HG SER 17 HG SER 17 -2.480 8.608 -11.129
120 H VAL 18 H VAL 18 0.894 6.596 -8.024
121 HA VAL 18 HA VAL 18 -0.200 3.960 -8.855
122 HB VAL 18 HB VAL 18 1.675 3.244 -9.961
123 HG11 VAL 18 1HG1 VAL 18 0.261 4.768 -11.329
124 HG12 VAL 18 2HG1 VAL 18 1.408 6.089 -10.992
125 HG13 VAL 18 3HG1 VAL 18 1.931 4.655 -11.889
126 HG21 VAL 18 3HG2 VAL 18 3.719 4.994 -10.247
127 HG22 VAL 18 1HG2 VAL 18 3.112 5.465 -8.623
128 HG23 VAL 18 2HG2 VAL 18 3.606 3.809 -8.915
129 H VAL 19 H VAL 19 -0.205 5.253 -6.313
130 HA VAL 19 HA VAL 19 1.664 3.457 -4.894
131 HB VAL 19 HB VAL 19 1.579 5.697 -4.090
132 HG11 VAL 19 1HG1 VAL 19 -0.762 6.327 -4.714
133 HG12 VAL 19 2HG1 VAL 19 -1.363 5.376 -3.345
134 HG13 VAL 19 3HG1 VAL 19 -0.325 6.772 -3.066
135 HG21 VAL 19 3HG2 VAL 19 0.204 3.848 -2.089
136 HG22 VAL 19 1HG2 VAL 19 1.927 3.845 -2.477
137 HG23 VAL 19 2HG2 VAL 19 1.187 5.267 -1.712
138 H TRP 20 H TRP 20 -1.868 4.089 -5.103
139 HA TRP 20 HA TRP 20 -2.684 2.025 -3.457
140 HB2 TRP 20 1HB TRP 20 -4.126 3.811 -4.307
141 HB3 TRP 20 2HB TRP 20 -4.083 3.116 -5.924
142 HD1 TRP 20 HD TRP 20 -5.977 1.411 -6.432
143 HE1 TRP 20 1HE TRP 20 -7.735 0.146 -5.064
144 HE3 TRP 20 3HE TRP 20 -4.249 2.479 -1.740
145 HZ2 TRP 20 2HZ TRP 20 -8.488 -0.073 -2.246
146 HZ3 TRP 20 3HZ TRP 20 -5.470 1.726 0.251
147 HH2 TRP 20 HH TRP 20 -7.670 0.583 0.000
148 H TYR 21 H TYR 21 -2.881 1.743 -7.050
149 HA TYR 21 HA TYR 21 -3.176 -0.984 -7.358
150 HB2 TYR 21 1HB TYR 21 -3.182 0.407 -9.270
151 HB3 TYR 21 2HB TYR 21 -1.614 1.109 -8.906
152 HD1 TYR 21 2HD TYR 21 0.508 -0.133 -9.335
153 HD2 TYR 21 1HD TYR 21 -3.348 -1.739 -10.476
154 HE1 TYR 21 2HE TYR 21 1.631 -1.871 -10.716
155 HE2 TYR 21 1HE TYR 21 -2.213 -3.331 -11.991
156 HH TYR 21 HH TYR 21 1.334 -3.418 -12.477
157 H GLU 22 H GLU 22 -0.103 0.758 -6.698
158 HA GLU 22 HA GLU 22 1.567 -1.453 -7.356
159 HB2 GLU 22 1HB GLU 22 2.924 0.487 -7.489
160 HB3 GLU 22 2HB GLU 22 1.608 1.304 -6.757
161 HG2 GLU 22 1HG GLU 22 3.403 1.813 -5.454
162 HG3 GLU 22 2HG GLU 22 2.468 0.724 -4.459
163 H CYS 23 H CYS 23 -0.155 -0.433 -4.426
164 HA CYS 23 HA CYS 23 1.421 -2.246 -2.712
165 HB2 CYS 23 1HB CYS 23 0.835 0.390 -2.429
166 HB3 CYS 23 2HB CYS 23 -0.602 -0.273 -1.722
167 H THR 24 H THR 24 -1.351 -2.360 -4.592
168 HA THR 24 HA THR 24 -2.703 -4.149 -2.677
169 HB THR 24 HB THR 24 -4.881 -3.180 -3.165
170 HG1 THR 24 1HG THR 24 -3.441 -1.174 -4.524
171 HG21 THR 24 3HG2 THR 24 -2.933 -1.001 -2.249
172 HG22 THR 24 1HG2 THR 24 -4.694 -1.041 -1.998
173 HG23 THR 24 2HG2 THR 24 -3.664 -2.256 -1.229
174 H GLU 25 H GLU 25 -1.504 -3.876 -5.829
175 HA GLU 25 HA GLU 25 -3.123 -6.149 -6.787
176 HB2 GLU 25 1HB GLU 25 -3.697 -3.857 -7.774
177 HB3 GLU 25 2HB GLU 25 -2.097 -3.825 -8.480
178 HG2 GLU 25 1HG GLU 25 -4.139 -6.020 -8.908
179 HG3 GLU 25 2HG GLU 25 -3.971 -4.628 -9.986
180 H ASN 26 H ASN 26 -0.184 -4.191 -7.226
181 HA ASN 26 HA ASN 26 1.302 -6.138 -8.637
182 HB2 ASN 26 1HB ASN 26 1.779 -3.744 -8.759
183 HB3 ASN 26 2HB ASN 26 2.206 -3.753 -7.026
184 HD21 ASN 26 1HD2 ASN 26 4.252 -2.789 -7.755
185 HD22 ASN 26 2HD2 ASN 26 5.513 -3.826 -8.375
186 H THR 27 H THR 27 1.351 -8.163 -7.523
187 HA THR 27 HA THR 27 2.018 -8.382 -4.781
188 HB THR 27 HB THR 27 2.165 -10.870 -5.543
189 HG1 THR 27 1HG THR 27 0.991 -11.182 -7.468
190 HG21 THR 27 3HG2 THR 27 -0.319 -10.964 -5.607
191 HG22 THR 27 1HG2 THR 27 0.277 -9.894 -4.330
192 HG23 THR 27 2HG2 THR 27 -0.365 -9.196 -5.831
193 H ALA 28 H ALA 28 4.172 -7.540 -7.201
194 HA ALA 28 HA ALA 28 6.492 -8.892 -6.253
195 HB1 ALA 28 1HB ALA 28 7.732 -7.058 -7.238
196 HB2 ALA 28 2HB ALA 28 6.389 -7.473 -8.317
197 HB3 ALA 28 3HB ALA 28 6.283 -6.035 -7.278
198 H ASN 29 H ASN 29 4.617 -6.142 -4.904
199 HA ASN 29 HA ASN 29 6.365 -6.283 -2.479
200 HB2 ASN 29 1HB ASN 29 6.453 -3.792 -2.375
201 HB3 ASN 29 2HB ASN 29 6.903 -4.301 -3.970
202 HD21 ASN 29 1HD2 ASN 29 5.753 -3.391 -5.634
203 HD22 ASN 29 2HD2 ASN 29 4.379 -2.350 -5.223
204 H CYS 30 H CYS 30 3.050 -5.906 -3.737
205 HA CYS 30 HA CYS 30 2.066 -4.420 -1.707
206 HB2 CYS 30 1HB CYS 30 -0.150 -5.167 -2.319
207 HB3 CYS 30 2HB CYS 30 0.844 -4.857 -3.751
208 H GLY 31 H GLY 31 1.077 -4.659 0.280
209 HA2 GLY 31 1HA GLY 31 0.063 -6.796 1.596
210 HA3 GLY 31 2HA GLY 31 1.820 -6.990 1.804
211 H THR 32 H THR 32 0.636 -6.615 4.044
212 HA THR 32 HA THR 32 -0.290 -4.086 4.874
213 HB THR 32 HB THR 32 0.996 -6.389 6.369
214 HG1 THR 32 1HG THR 32 -0.968 -6.697 5.206
215 HG21 THR 32 3HG2 THR 32 1.214 -4.629 7.920
216 HG22 THR 32 1HG2 THR 32 -0.288 -3.860 7.438
217 HG23 THR 32 2HG2 THR 32 -0.336 -5.384 8.344
218 H ALA 33 H ALA 33 2.933 -5.335 4.846
219 HA ALA 33 HA ALA 33 4.236 -3.186 6.261
220 HB1 ALA 33 1HB ALA 33 5.367 -5.326 6.053
221 HB2 ALA 33 2HB ALA 33 5.437 -5.165 4.278
222 HB3 ALA 33 3HB ALA 33 6.356 -4.063 5.314
223 H CYS 34 H CYS 34 4.001 -3.811 2.681
224 HA CYS 34 HA CYS 34 5.093 -1.353 1.787
225 HB2 CYS 34 1HB CYS 34 4.471 -3.018 0.154
226 HB3 CYS 34 2HB CYS 34 2.795 -3.018 0.672
227 H CYS 35 H CYS 35 1.775 -2.178 2.749
228 HA CYS 35 HA CYS 35 0.672 0.372 2.311
229 HB2 CYS 35 1HB CYS 35 -0.167 -1.750 4.292
230 HB3 CYS 35 2HB CYS 35 -1.120 -0.350 3.868
231 H ASP 36 H ASP 36 2.309 -0.865 5.315
232 HA ASP 36 HA ASP 36 1.741 1.542 6.826
233 HB2 ASP 36 1HB ASP 36 2.442 -0.892 7.580
234 HB3 ASP 36 2HB ASP 36 4.076 -0.270 7.435
235 H SER 37 H SER 37 4.123 0.713 4.486
236 HA SER 37 HA SER 37 5.877 3.011 5.035
237 HB2 SER 37 1HB SER 37 5.971 0.806 2.952
238 HB3 SER 37 2HB SER 37 7.221 2.029 3.235
239 HG SER 37 HG SER 37 7.482 -0.106 4.186
240 H CYS 38 H CYS 38 2.902 2.823 3.492
241 HA CYS 38 HA CYS 38 3.636 5.154 1.843
242 HB2 CYS 38 1HB CYS 38 2.288 2.596 0.975
243 HB3 CYS 38 2HB CYS 38 1.861 4.104 0.215
244 H PHE 39 H PHE 39 1.415 3.649 4.003
245 HA PHE 39 HA PHE 39 -0.416 5.907 3.826
246 HB2 PHE 39 1HB PHE 39 -1.136 2.942 3.826
247 HB3 PHE 39 2HB PHE 39 -2.260 4.202 4.160
248 HD1 PHE 39 1HD PHE 39 -2.371 6.123 2.187
249 HD2 PHE 39 2HD PHE 39 -0.999 2.066 1.661
250 HE1 PHE 39 1HE PHE 39 -2.868 6.259 -0.221
251 HE2 PHE 39 2HE PHE 39 -1.534 2.190 -0.738
252 HZ PHE 39 HZ PHE 39 -2.479 4.282 -1.680
253 H GLU 40 H GLU 40 -1.572 6.048 5.954
254 HA GLU 40 HA GLU 40 -0.440 4.303 8.069
255 HB2 GLU 40 1HB GLU 40 -0.896 7.278 8.348
256 HB3 GLU 40 2HB GLU 40 -0.208 6.193 9.552
257 HG2 GLU 40 1HG GLU 40 1.725 5.745 8.064
258 HG3 GLU 40 2HG GLU 40 1.099 7.024 6.994
259 H LEU 41 H LEU 41 -1.794 4.405 10.019
260 HA LEU 41 HA LEU 41 -3.784 4.191 11.126
261 HB2 LEU 41 1HB LEU 41 -4.216 6.840 9.690
262 HB3 LEU 41 2HB LEU 41 -4.920 6.341 11.227
263 HG LEU 41 HG LEU 41 -1.937 6.778 10.764
264 HD11 LEU 41 1HD1 LEU 41 -4.130 8.584 11.734
265 HD12 LEU 41 2HD1 LEU 41 -2.425 8.863 12.154
266 HD13 LEU 41 3HD1 LEU 41 -2.939 8.863 10.463
267 HD21 LEU 41 3HD2 LEU 41 -1.844 6.795 13.234
268 HD22 LEU 41 1HD2 LEU 41 -3.549 6.279 13.285
269 HD23 LEU 41 2HD2 LEU 41 -2.304 5.225 12.579
270 H THR 42 H THR 42 -5.925 6.019 9.186
271 HA THR 42 HA THR 42 -7.624 3.683 8.868
272 HB THR 42 HB THR 42 -7.961 6.513 7.772
273 HG1 THR 42 1HG THR 42 -8.898 5.307 10.171
274 HG21 THR 42 3HG2 THR 42 -9.470 4.818 6.731
275 HG22 THR 42 1HG2 THR 42 -10.014 4.309 8.346
276 HG23 THR 42 2HG2 THR 42 -10.368 5.949 7.745
277 H GLY 43 H GLY 43 -5.700 5.807 6.646
278 HA2 GLY 43 1HA GLY 43 -6.490 4.527 4.229
279 HA3 GLY 43 2HA GLY 43 -5.015 5.474 4.491
280 H ASN 44 H ASN 44 -4.086 3.698 6.678
281 HA ASN 44 HA ASN 44 -2.570 1.785 5.207
282 HB2 ASN 44 1HB ASN 44 -1.716 2.651 7.277
283 HB3 ASN 44 2HB ASN 44 -3.103 2.045 8.193
284 HD21 ASN 44 1HD2 ASN 44 -0.430 0.998 6.077
285 HD22 ASN 44 2HD2 ASN 44 -0.138 -0.505 6.950
286 H THR 45 H THR 45 -5.267 1.284 7.624
287 HA THR 45 HA THR 45 -5.571 -1.415 6.921
288 HB THR 45 HB THR 45 -7.622 0.698 7.790
289 HG1 THR 45 1HG THR 45 -5.743 -0.694 9.195
290 HG21 THR 45 3HG2 THR 45 -8.045 -2.279 7.881
291 HG22 THR 45 1HG2 THR 45 -9.017 -1.093 8.776
292 HG23 THR 45 2HG2 THR 45 -8.996 -1.045 7.016
293 H MET 46 H MET 46 -7.156 1.496 5.304
294 HA MET 46 HA MET 46 -8.865 -0.036 3.733
295 HB2 MET 46 1HB MET 46 -7.626 2.660 3.046
296 HB3 MET 46 2HB MET 46 -8.974 1.850 2.250
297 HG2 MET 46 1HG MET 46 -8.918 3.312 4.797
298 HG3 MET 46 2HG MET 46 -10.176 2.990 3.644
299 HE1 MET 46 3HE MET 46 -11.403 3.467 6.134
300 HE2 MET 46 1HE MET 46 -12.264 2.711 4.773
301 HE3 MET 46 2HE MET 46 -12.434 2.039 6.400
302 H CYS 47 H CYS 47 -5.438 0.743 3.198
303 HA CYS 47 HA CYS 47 -5.038 -0.522 0.666
304 HB2 CYS 47 1HB CYS 47 -3.448 0.979 2.066
305 HB3 CYS 47 2HB CYS 47 -3.143 -0.480 3.034
306 H LEU 48 H LEU 48 -4.308 -1.906 4.005
307 HA LEU 48 HA LEU 48 -3.910 -4.434 3.432
308 HB2 LEU 48 1HB LEU 48 -5.428 -3.098 5.721
309 HB3 LEU 48 2HB LEU 48 -5.091 -4.805 5.675
310 HG LEU 48 HG LEU 48 -2.767 -4.189 5.209
311 HD11 LEU 48 1HD1 LEU 48 -1.488 -2.557 6.009
312 HD12 LEU 48 2HD1 LEU 48 -2.574 -1.974 4.766
313 HD13 LEU 48 3HD1 LEU 48 -2.931 -1.621 6.489
314 HD21 LEU 48 3HD2 LEU 48 -4.181 -3.851 7.867
315 HD22 LEU 48 1HD2 LEU 48 -3.170 -5.211 7.353
316 HD23 LEU 48 2HD2 LEU 48 -2.416 -3.682 7.861
317 H LEU 49 H LEU 49 -7.213 -3.076 3.757
318 HA LEU 49 HA LEU 49 -8.525 -5.540 3.353
319 HB2 LEU 49 1HB LEU 49 -9.347 -2.716 3.286
320 HB3 LEU 49 2HB LEU 49 -10.133 -3.629 2.000
321 HG LEU 49 HG LEU 49 -10.652 -5.417 3.840
322 HD11 LEU 49 1HD1 LEU 49 -10.280 -2.937 5.591
323 HD12 LEU 49 2HD1 LEU 49 -10.843 -4.554 6.112
324 HD13 LEU 49 3HD1 LEU 49 -9.187 -4.320 5.572
325 HD21 LEU 49 3HD2 LEU 49 -12.761 -4.340 4.312
326 HD22 LEU 49 1HD2 LEU 49 -12.102 -2.746 3.837
327 HD23 LEU 49 2HD2 LEU 49 -12.308 -4.054 2.654
328 H GLN 50 H GLN 50 -7.391 -3.267 0.801
329 HA GLN 50 HA GLN 50 -8.615 -4.933 -1.303
330 HB2 GLN 50 1HB GLN 50 -8.383 -2.341 -1.325
331 HB3 GLN 50 2HB GLN 50 -6.664 -2.578 -1.534
332 HG2 GLN 50 1HG GLN 50 -7.692 -2.184 -3.692
333 HG3 GLN 50 2HG GLN 50 -7.039 -3.798 -3.650
334 HE21 GLN 50 1HE2 GLN 50 -8.393 -5.388 -4.495
335 HE22 GLN 50 2HE2 GLN 50 -10.133 -5.248 -4.638
336 H ALA 51 H ALA 51 -5.391 -4.283 -0.019
337 HA ALA 51 HA ALA 51 -3.895 -5.865 -1.864
338 HB1 ALA 51 1HB ALA 51 -2.848 -4.246 -0.285
339 HB2 ALA 51 2HB ALA 51 -3.357 -5.231 1.080
340 HB3 ALA 51 3HB ALA 51 -2.179 -5.861 -0.075
341 H GLY 52 H GLY 52 -5.006 -6.663 1.486
342 HA2 GLY 52 1HA GLY 52 -4.132 -9.374 1.241
343 HA3 GLY 52 2HA GLY 52 -4.957 -8.599 2.586
344 H ALA 53 H ALA 53 -6.998 -8.030 0.142
345 HA ALA 53 HA ALA 53 -9.019 -9.254 -0.486
346 HB1 ALA 53 1HB ALA 53 -6.582 -9.651 -2.176
347 HB2 ALA 53 2HB ALA 53 -8.278 -9.867 -2.679
348 HB3 ALA 53 3HB ALA 53 -7.720 -8.259 -2.153
349 H ALA 54 H ALA 54 -9.620 -10.696 0.869
350 HA ALA 54 HA ALA 54 -9.912 -12.687 2.011
351 HB1 ALA 54 1HB ALA 54 -11.379 -12.736 -0.008
352 HB2 ALA 54 2HB ALA 54 -10.097 -13.601 -0.893
353 HB3 ALA 54 3HB ALA 54 -10.914 -14.369 0.495
354 H GLY 55 H GLY 55 -7.192 -12.282 1.758
355 HA2 GLY 55 1HA GLY 55 -5.131 -13.194 1.964
356 HA3 GLY 55 2HA GLY 55 -5.912 -14.614 2.674
357 H SER 56 H SER 56 -5.012 -13.049 -0.401
358 HA SER 56 HA SER 56 -4.295 -15.704 -1.472
359 HB2 SER 56 1HB SER 56 -6.039 -13.635 -2.797
360 HB3 SER 56 2HB SER 56 -5.014 -14.702 -3.776
361 HG SER 56 HG SER 56 -7.113 -15.373 -2.015
362 H GLY 57 H GLY 57 -3.878 -12.528 -3.142
363 HA2 GLY 57 1HA GLY 57 -1.294 -13.514 -3.907
364 HA3 GLY 57 2HA GLY 57 -2.047 -11.991 -4.390
365 H CYS 58 H CYS 58 -2.149 -10.354 -2.489
366 HA CYS 58 HA CYS 58 0.503 -9.711 -1.493
367 HB2 CYS 58 1HB CYS 58 -2.159 -8.597 -0.579
368 HB3 CYS 58 2HB CYS 58 -0.599 -7.815 -0.487
369 H ASP 59 H ASP 59 0.662 -9.223 1.024
370 HA ASP 59 HA ASP 59 -0.515 -11.517 2.535
371 HB2 ASP 59 1HB ASP 59 1.670 -12.133 1.693
372 HB3 ASP 59 2HB ASP 59 2.359 -10.607 2.284
373 H MET 60 H MET 60 -0.247 -11.323 4.883
374 HA MET 60 HA MET 60 -0.476 -8.544 5.842
375 HB2 MET 60 1HB MET 60 -2.370 -10.804 6.577
376 HB3 MET 60 2HB MET 60 -2.482 -9.096 7.035
377 HG2 MET 60 1HG MET 60 -2.570 -8.649 4.472
378 HG3 MET 60 2HG MET 60 -2.852 -10.366 4.304
379 HE1 MET 60 3HE MET 60 -5.827 -7.287 6.006
380 HE2 MET 60 1HE MET 60 -4.254 -7.552 6.791
381 HE3 MET 60 2HE MET 60 -4.323 -6.923 5.127
382 H GLU 61 H GLU 61 0.214 -8.143 7.893
383 HA GLU 61 HA GLU 61 2.410 -9.744 8.715
384 HB2 GLU 61 1HB GLU 61 2.791 -8.032 10.356
385 HB3 GLU 61 2HB GLU 61 2.270 -7.291 8.838
386 HG2 GLU 61 1HG GLU 61 -0.064 -7.116 9.834
387 HG3 GLU 61 2HG GLU 61 0.616 -7.629 11.379
Start of MODEL 20
1 H1 TYR 1 H TYR 1 -14.762 8.016 2.922
2 HA TYR 1 HA TYR 1 -12.669 9.203 2.703
3 HB2 TYR 1 1HB TYR 1 -12.932 8.004 4.800
4 HB3 TYR 1 2HB TYR 1 -12.432 6.487 4.064
5 HD1 TYR 1 2HD TYR 1 -11.235 10.003 4.680
6 HD2 TYR 1 1HD TYR 1 -10.099 5.848 4.077
7 HE1 TYR 1 2HE TYR 1 -8.843 10.586 4.950
8 HE2 TYR 1 1HE TYR 1 -7.756 6.457 4.406
9 HH TYR 1 HH TYR 1 -6.259 8.238 4.402
10 H ASN 2 H ASN 2 -10.946 9.509 1.386
11 HA ASN 2 HA ASN 2 -10.128 7.371 -0.501
12 HB2 ASN 2 1HB ASN 2 -9.718 9.277 -1.962
13 HB3 ASN 2 2HB ASN 2 -10.001 10.385 -0.505
14 HD21 ASN 2 1HD2 ASN 2 -8.140 11.330 -0.313
15 HD22 ASN 2 2HD2 ASN 2 -6.664 10.862 -1.150
16 HA PRO 3 HA PRO 3 -6.697 6.841 2.494
17 HB2 PRO 3 1HB PRO 3 -5.218 4.961 1.057
18 HB3 PRO 3 2HB PRO 3 -6.573 4.600 2.152
19 HG2 PRO 3 1HG PRO 3 -6.611 4.853 -0.855
20 HG3 PRO 3 2HG PRO 3 -7.491 3.694 0.197
21 HD2 PRO 3 1HD PRO 3 -8.703 5.849 -0.874
22 HD3 PRO 3 2HD PRO 3 -9.129 5.176 0.740
23 H GLU 4 H GLU 4 -6.357 7.780 -0.853
24 HA GLU 4 HA GLU 4 -3.679 8.678 -0.913
25 HB2 GLU 4 1HB GLU 4 -6.180 9.691 -2.528
26 HB3 GLU 4 2HB GLU 4 -4.467 10.014 -2.884
27 HG2 GLU 4 1HG GLU 4 -5.757 7.255 -2.811
28 HG3 GLU 4 2HG GLU 4 -5.541 8.240 -4.255
29 H ASP 5 H ASP 5 -6.052 9.735 1.234
30 HA ASP 5 HA ASP 5 -4.984 12.496 1.453
31 HB2 ASP 5 1HB ASP 5 -7.241 11.065 2.906
32 HB3 ASP 5 2HB ASP 5 -6.673 12.679 3.311
33 H ASP 6 H ASP 6 -4.493 9.305 2.796
34 HA ASP 6 HA ASP 6 -2.786 10.351 5.026
35 HB2 ASP 6 1HB ASP 6 -3.116 8.207 6.167
36 HB3 ASP 6 2HB ASP 6 -4.638 8.715 5.574
37 H TYR 7 H TYR 7 -2.588 9.527 1.895
38 HA TYR 7 HA TYR 7 -0.451 7.825 1.479
39 HB2 TYR 7 1HB TYR 7 -1.599 8.749 -0.366
40 HB3 TYR 7 2HB TYR 7 -1.295 10.404 0.157
41 HD1 TYR 7 1HD TYR 7 0.567 7.284 -0.826
42 HD2 TYR 7 2HD TYR 7 0.459 11.597 -0.870
43 HE1 TYR 7 1HE TYR 7 2.567 7.319 -2.273
44 HE2 TYR 7 2HE TYR 7 2.508 11.647 -2.256
45 HH TYR 7 HH TYR 7 4.023 8.598 -3.422
46 H THR 8 H THR 8 1.497 7.873 2.525
47 HA THR 8 HA THR 8 2.487 10.455 3.570
48 HB THR 8 HB THR 8 4.022 8.984 4.973
49 HG1 THR 8 1HG THR 8 2.002 7.089 4.373
50 HG21 THR 8 3HG2 THR 8 1.083 8.703 5.621
51 HG22 THR 8 1HG2 THR 8 2.438 8.762 6.746
52 HG23 THR 8 2HG2 THR 8 1.981 10.205 5.828
53 HA PRO 9 HA PRO 9 5.149 9.593 -0.095
54 HB2 PRO 9 1HB PRO 9 6.141 12.189 -0.279
55 HB3 PRO 9 2HB PRO 9 4.710 11.558 -1.160
56 HG2 PRO 9 1HG PRO 9 4.848 13.215 1.354
57 HG3 PRO 9 2HG PRO 9 3.642 13.292 0.034
58 HD2 PRO 9 1HD PRO 9 3.119 12.079 2.391
59 HD3 PRO 9 2HD PRO 9 2.471 11.447 0.855
60 H LEU 10 H LEU 10 5.900 10.680 3.121
61 HA LEU 10 HA LEU 10 8.521 11.542 2.833
62 HB2 LEU 10 1HB LEU 10 7.361 10.042 5.213
63 HB3 LEU 10 2HB LEU 10 8.836 10.984 5.186
64 HG LEU 10 HG LEU 10 5.974 11.944 5.094
65 HD11 LEU 10 1HD1 LEU 10 6.786 13.322 6.985
66 HD12 LEU 10 2HD1 LEU 10 7.144 11.627 7.248
67 HD13 LEU 10 3HD1 LEU 10 8.443 12.717 6.735
68 HD21 LEU 10 3HD2 LEU 10 6.784 14.257 4.645
69 HD22 LEU 10 1HD2 LEU 10 8.392 13.604 4.252
70 HD23 LEU 10 2HD2 LEU 10 6.971 13.202 3.252
71 H THR 11 H THR 11 7.414 8.144 3.441
72 HA THR 11 HA THR 11 10.137 7.357 2.498
73 HB THR 11 HB THR 11 10.067 5.473 3.889
74 HG1 THR 11 1HG THR 11 7.442 6.258 4.687
75 HG21 THR 11 3HG2 THR 11 9.089 7.832 5.573
76 HG22 THR 11 1HG2 THR 11 10.084 6.488 6.111
77 HG23 THR 11 2HG2 THR 11 10.744 7.645 4.944
78 H CYS 12 H CYS 12 6.914 7.500 1.436
79 HA CYS 12 HA CYS 12 6.640 4.832 0.540
80 HB2 CYS 12 1HB CYS 12 4.767 6.330 0.996
81 HB3 CYS 12 2HB CYS 12 5.182 7.297 -0.424
82 HA PRO 13 HA PRO 13 9.312 5.453 -3.076
83 HB2 PRO 13 1HB PRO 13 9.358 2.843 -3.994
84 HB3 PRO 13 2HB PRO 13 10.334 3.461 -2.639
85 HG2 PRO 13 1HG PRO 13 7.808 1.856 -2.541
86 HG3 PRO 13 2HG PRO 13 9.228 1.766 -1.479
87 HD2 PRO 13 1HD PRO 13 6.874 3.085 -0.851
88 HD3 PRO 13 2HD PRO 13 8.458 3.481 -0.157
89 H HIS 14 H HIS 14 6.148 5.642 -3.190
90 HA HIS 14 HA HIS 14 5.813 5.017 -6.077
91 HB2 HIS 14 1HB HIS 14 3.583 4.522 -4.156
92 HB3 HIS 14 2HB HIS 14 3.843 3.843 -5.767
93 HD1 HIS 14 1HD HIS 14 6.306 2.245 -5.776
94 HD2 HIS 14 2HD HIS 14 3.752 2.529 -2.420
95 HE1 HIS 14 1HE HIS 14 6.341 0.057 -4.574
96 HE2 HIS 14 2HE HIS 14 5.135 0.256 -2.398
97 H THR 15 H THR 15 4.689 6.499 -7.202
98 HA THR 15 HA THR 15 4.162 9.032 -5.870
99 HB THR 15 HB THR 15 3.720 9.764 -8.183
100 HG1 THR 15 1HG THR 15 4.663 7.325 -9.224
101 HG21 THR 15 3HG2 THR 15 6.008 9.808 -7.325
102 HG22 THR 15 1HG2 THR 15 6.270 8.128 -7.818
103 HG23 THR 15 2HG2 THR 15 6.014 9.380 -9.049
104 H ILE 16 H ILE 16 2.049 10.116 -5.947
105 HA ILE 16 HA ILE 16 0.075 8.387 -4.992
106 HB ILE 16 HB ILE 16 0.538 10.832 -4.495
107 HG12 ILE 16 1HG1 ILE 16 -2.359 9.927 -4.793
108 HG13 ILE 16 2HG1 ILE 16 -1.258 9.586 -3.459
109 HG21 ILE 16 1HG2 ILE 16 -1.414 11.404 -6.750
110 HG22 ILE 16 2HG2 ILE 16 -0.506 12.557 -5.748
111 HG23 ILE 16 3HG2 ILE 16 0.347 11.546 -6.923
112 HD11 ILE 16 3HD1 ILE 16 -2.346 12.304 -4.231
113 HD12 ILE 16 1HD1 ILE 16 -2.642 11.381 -2.750
114 HD13 ILE 16 2HD1 ILE 16 -1.036 12.064 -3.049
115 H SER 17 H SER 17 0.752 9.237 -8.267
116 HA SER 17 HA SER 17 -1.765 8.811 -9.479
117 HB2 SER 17 1HB SER 17 1.147 8.587 -10.359
118 HB3 SER 17 2HB SER 17 -0.224 8.457 -11.442
119 HG SER 17 HG SER 17 -0.497 10.502 -11.421
120 H VAL 18 H VAL 18 0.856 6.664 -8.315
121 HA VAL 18 HA VAL 18 -0.806 4.299 -8.942
122 HB VAL 18 HB VAL 18 1.072 3.141 -9.995
123 HG11 VAL 18 1HG1 VAL 18 -0.419 4.424 -11.521
124 HG12 VAL 18 2HG1 VAL 18 0.728 5.779 -11.482
125 HG13 VAL 18 3HG1 VAL 18 1.227 4.218 -12.146
126 HG21 VAL 18 3HG2 VAL 18 3.015 5.082 -10.631
127 HG22 VAL 18 1HG2 VAL 18 2.548 5.418 -8.922
128 HG23 VAL 18 2HG2 VAL 18 3.091 3.819 -9.352
129 H VAL 19 H VAL 19 -0.803 5.074 -6.621
130 HA VAL 19 HA VAL 19 1.231 3.413 -5.209
131 HB VAL 19 HB VAL 19 1.334 5.625 -4.425
132 HG11 VAL 19 1HG1 VAL 19 -0.471 6.718 -3.154
133 HG12 VAL 19 2HG1 VAL 19 -0.965 6.442 -4.814
134 HG13 VAL 19 3HG1 VAL 19 -1.583 5.413 -3.530
135 HG21 VAL 19 3HG2 VAL 19 0.096 3.844 -2.301
136 HG22 VAL 19 1HG2 VAL 19 1.775 3.776 -2.847
137 HG23 VAL 19 2HG2 VAL 19 1.163 5.224 -2.029
138 H TRP 20 H TRP 20 -2.351 4.014 -5.139
139 HA TRP 20 HA TRP 20 -2.945 1.945 -3.373
140 HB2 TRP 20 1HB TRP 20 -4.560 3.600 -4.071
141 HB3 TRP 20 2HB TRP 20 -4.604 2.958 -5.715
142 HD1 TRP 20 HD TRP 20 -6.101 0.834 -6.138
143 HE1 TRP 20 1HE TRP 20 -7.702 -0.552 -4.739
144 HE3 TRP 20 3HE TRP 20 -4.899 2.675 -1.508
145 HZ2 TRP 20 2HZ TRP 20 -8.647 -0.567 -1.940
146 HZ3 TRP 20 3HZ TRP 20 -6.111 1.915 0.489
147 HH2 TRP 20 HH TRP 20 -8.065 0.392 0.270
148 H TYR 21 H TYR 21 -3.292 1.623 -6.952
149 HA TYR 21 HA TYR 21 -3.505 -1.135 -7.199
150 HB2 TYR 21 1HB TYR 21 -3.707 0.071 -9.195
151 HB3 TYR 21 2HB TYR 21 -2.294 1.058 -8.874
152 HD1 TYR 21 2HD TYR 21 -3.421 -2.280 -10.093
153 HD2 TYR 21 1HD TYR 21 -0.064 0.388 -9.553
154 HE1 TYR 21 2HE TYR 21 -2.007 -3.755 -11.498
155 HE2 TYR 21 1HE TYR 21 1.345 -1.086 -10.907
156 HH TYR 21 HH TYR 21 1.342 -2.862 -12.403
157 H GLU 22 H GLU 22 -0.443 0.782 -6.729
158 HA GLU 22 HA GLU 22 1.242 -1.372 -7.562
159 HB2 GLU 22 1HB GLU 22 2.550 0.607 -7.655
160 HB3 GLU 22 2HB GLU 22 1.264 1.416 -6.867
161 HG2 GLU 22 1HG GLU 22 3.146 1.787 -5.686
162 HG3 GLU 22 2HG GLU 22 2.281 0.659 -4.648
163 H CYS 23 H CYS 23 -0.349 -0.420 -4.494
164 HA CYS 23 HA CYS 23 1.484 -1.961 -2.830
165 HB2 CYS 23 1HB CYS 23 0.565 0.553 -2.579
166 HB3 CYS 23 2HB CYS 23 -0.835 -0.244 -1.909
167 H THR 24 H THR 24 -1.431 -2.389 -4.511
168 HA THR 24 HA THR 24 -2.322 -4.401 -2.571
169 HB THR 24 HB THR 24 -4.653 -3.744 -2.950
170 HG1 THR 24 1HG THR 24 -3.619 -1.534 -4.388
171 HG21 THR 24 3HG2 THR 24 -2.954 -1.325 -2.159
172 HG22 THR 24 1HG2 THR 24 -4.674 -1.557 -1.825
173 HG23 THR 24 2HG2 THR 24 -3.472 -2.639 -1.080
174 H GLU 25 H GLU 25 -1.193 -4.020 -5.677
175 HA GLU 25 HA GLU 25 -2.659 -6.334 -6.791
176 HB2 GLU 25 1HB GLU 25 -3.352 -3.744 -7.278
177 HB3 GLU 25 2HB GLU 25 -2.068 -3.899 -8.439
178 HG2 GLU 25 1HG GLU 25 -3.481 -4.846 -9.894
179 HG3 GLU 25 2HG GLU 25 -3.685 -6.217 -8.793
180 H ASN 26 H ASN 26 0.208 -4.097 -7.015
181 HA ASN 26 HA ASN 26 1.497 -5.853 -8.927
182 HB2 ASN 26 1HB ASN 26 2.019 -3.459 -8.848
183 HB3 ASN 26 2HB ASN 26 2.764 -3.696 -7.250
184 HD21 ASN 26 1HD2 ASN 26 4.377 -2.747 -8.749
185 HD22 ASN 26 2HD2 ASN 26 5.589 -3.797 -9.515
186 H THR 27 H THR 27 1.706 -7.881 -8.233
187 HA THR 27 HA THR 27 2.057 -8.979 -5.766
188 HB THR 27 HB THR 27 3.185 -10.821 -7.203
189 HG1 THR 27 1HG THR 27 3.210 -10.454 -9.380
190 HG21 THR 27 3HG2 THR 27 0.492 -9.710 -8.137
191 HG22 THR 27 1HG2 THR 27 1.087 -11.375 -8.354
192 HG23 THR 27 2HG2 THR 27 0.747 -10.757 -6.730
193 H ALA 28 H ALA 28 4.584 -7.590 -7.855
194 HA ALA 28 HA ALA 28 6.807 -8.591 -6.449
195 HB1 ALA 28 1HB ALA 28 6.884 -7.658 -8.741
196 HB2 ALA 28 2HB ALA 28 6.573 -6.029 -8.084
197 HB3 ALA 28 3HB ALA 28 8.075 -6.884 -7.681
198 H ASN 29 H ASN 29 4.609 -6.191 -5.322
199 HA ASN 29 HA ASN 29 6.633 -5.184 -3.342
200 HB2 ASN 29 1HB ASN 29 4.587 -3.469 -4.777
201 HB3 ASN 29 2HB ASN 29 5.791 -2.920 -3.622
202 HD21 ASN 29 1HD2 ASN 29 5.268 -1.906 -6.193
203 HD22 ASN 29 2HD2 ASN 29 6.502 -2.390 -7.380
204 H CYS 30 H CYS 30 3.197 -5.705 -4.205
205 HA CYS 30 HA CYS 30 2.135 -4.271 -2.052
206 HB2 CYS 30 1HB CYS 30 0.041 -5.266 -2.648
207 HB3 CYS 30 2HB CYS 30 0.937 -4.831 -4.103
208 H GLY 31 H GLY 31 1.201 -4.850 -0.039
209 HA2 GLY 31 1HA GLY 31 0.743 -7.162 1.209
210 HA3 GLY 31 2HA GLY 31 2.513 -7.122 1.253
211 H THR 32 H THR 32 1.627 -7.188 3.604
212 HA THR 32 HA THR 32 0.334 -4.985 4.741
213 HB THR 32 HB THR 32 2.122 -6.986 6.134
214 HG1 THR 32 1HG THR 32 0.186 -7.630 5.007
215 HG21 THR 32 3HG2 THR 32 0.030 -5.137 7.372
216 HG22 THR 32 1HG2 THR 32 1.012 -6.354 8.193
217 HG23 THR 32 2HG2 THR 32 1.780 -4.900 7.531
218 H ALA 33 H ALA 33 3.883 -5.561 4.623
219 HA ALA 33 HA ALA 33 4.602 -3.136 5.873
220 HB1 ALA 33 1HB ALA 33 6.837 -3.506 4.851
221 HB2 ALA 33 2HB ALA 33 6.195 -4.941 5.658
222 HB3 ALA 33 3HB ALA 33 6.145 -4.815 3.878
223 H CYS 34 H CYS 34 3.623 -3.632 2.496
224 HA CYS 34 HA CYS 34 4.788 -1.172 1.495
225 HB2 CYS 34 1HB CYS 34 4.048 -2.881 -0.065
226 HB3 CYS 34 2HB CYS 34 2.386 -2.762 0.503
227 H CYS 35 H CYS 35 1.534 -2.088 2.697
228 HA CYS 35 HA CYS 35 0.420 0.535 2.603
229 HB2 CYS 35 1HB CYS 35 -0.197 -1.776 4.485
230 HB3 CYS 35 2HB CYS 35 -1.198 -0.347 4.279
231 H ASP 36 H ASP 36 2.095 -1.236 5.220
232 HA ASP 36 HA ASP 36 2.102 0.864 7.157
233 HB2 ASP 36 1HB ASP 36 2.348 -1.746 7.247
234 HB3 ASP 36 2HB ASP 36 4.065 -1.419 7.088
235 H SER 37 H SER 37 3.612 1.094 4.315
236 HA SER 37 HA SER 37 5.622 2.989 5.429
237 HB2 SER 37 1HB SER 37 6.027 1.046 3.125
238 HB3 SER 37 2HB SER 37 7.121 2.387 3.511
239 HG SER 37 HG SER 37 7.341 0.056 4.435
240 H CYS 38 H CYS 38 2.748 2.821 3.724
241 HA CYS 38 HA CYS 38 3.390 5.325 2.278
242 HB2 CYS 38 1HB CYS 38 1.991 2.830 1.292
243 HB3 CYS 38 2HB CYS 38 1.770 4.392 0.552
244 H PHE 39 H PHE 39 1.144 3.575 4.384
245 HA PHE 39 HA PHE 39 -0.767 5.817 4.199
246 HB2 PHE 39 1HB PHE 39 -1.323 2.839 3.861
247 HB3 PHE 39 2HB PHE 39 -2.573 3.992 4.212
248 HD1 PHE 39 1HD PHE 39 -2.728 6.183 2.467
249 HD2 PHE 39 2HD PHE 39 -0.905 2.302 1.664
250 HE1 PHE 39 1HE PHE 39 -2.907 6.526 0.040
251 HE2 PHE 39 2HE PHE 39 -1.216 2.645 -0.740
252 HZ PHE 39 HZ PHE 39 -2.228 4.780 -1.554
253 H GLU 40 H GLU 40 -2.049 5.981 6.046
254 HA GLU 40 HA GLU 40 -1.082 4.583 8.492
255 HB2 GLU 40 1HB GLU 40 -1.412 7.579 8.300
256 HB3 GLU 40 2HB GLU 40 -0.823 6.655 9.669
257 HG2 GLU 40 1HG GLU 40 1.033 5.902 7.841
258 HG3 GLU 40 2HG GLU 40 0.603 7.521 7.282
259 H LEU 41 H LEU 41 -2.404 4.993 10.344
260 HA LEU 41 HA LEU 41 -4.329 4.920 11.452
261 HB2 LEU 41 1HB LEU 41 -5.126 7.258 9.705
262 HB3 LEU 41 2HB LEU 41 -5.746 6.877 11.301
263 HG LEU 41 HG LEU 41 -2.848 7.668 10.656
264 HD11 LEU 41 1HD1 LEU 41 -3.364 9.843 11.565
265 HD12 LEU 41 2HD1 LEU 41 -4.383 9.475 10.169
266 HD13 LEU 41 3HD1 LEU 41 -5.068 9.367 11.814
267 HD21 LEU 41 3HD2 LEU 41 -4.275 7.450 13.343
268 HD22 LEU 41 1HD2 LEU 41 -3.025 6.347 12.718
269 HD23 LEU 41 2HD2 LEU 41 -2.611 8.027 13.061
270 H THR 42 H THR 42 -6.966 5.906 9.920
271 HA THR 42 HA THR 42 -7.758 3.273 9.252
272 HB THR 42 HB THR 42 -9.036 5.944 8.573
273 HG1 THR 42 1HG THR 42 -8.874 5.328 10.784
274 HG21 THR 42 3HG2 THR 42 -9.924 4.311 6.984
275 HG22 THR 42 1HG2 THR 42 -10.203 3.135 8.290
276 HG23 THR 42 2HG2 THR 42 -11.129 4.655 8.207
277 H GLY 43 H GLY 43 -5.982 5.646 7.291
278 HA2 GLY 43 1HA GLY 43 -6.222 4.965 4.668
279 HA3 GLY 43 2HA GLY 43 -4.842 5.275 5.669
280 H ASN 44 H ASN 44 -4.187 3.649 7.226
281 HA ASN 44 HA ASN 44 -2.820 1.662 5.756
282 HB2 ASN 44 1HB ASN 44 -2.138 2.703 7.969
283 HB3 ASN 44 2HB ASN 44 -3.305 1.651 8.764
284 HD21 ASN 44 1HD2 ASN 44 -0.357 1.726 6.721
285 HD22 ASN 44 2HD2 ASN 44 0.152 0.099 7.146
286 H THR 45 H THR 45 -5.651 1.446 8.024
287 HA THR 45 HA THR 45 -6.234 -1.238 7.667
288 HB THR 45 HB THR 45 -8.496 0.748 7.739
289 HG1 THR 45 1HG THR 45 -6.864 0.249 10.002
290 HG21 THR 45 3HG2 THR 45 -9.434 -0.802 9.384
291 HG22 THR 45 1HG2 THR 45 -8.964 -1.681 7.912
292 HG23 THR 45 2HG2 THR 45 -7.944 -1.768 9.359
293 H MET 46 H MET 46 -7.388 1.509 5.600
294 HA MET 46 HA MET 46 -8.968 -0.095 3.921
295 HB2 MET 46 1HB MET 46 -7.703 2.602 3.175
296 HB3 MET 46 2HB MET 46 -8.941 1.730 2.286
297 HG2 MET 46 1HG MET 46 -10.054 1.773 4.771
298 HG3 MET 46 2HG MET 46 -9.150 3.284 4.794
299 HE1 MET 46 3HE MET 46 -11.565 4.350 5.336
300 HE2 MET 46 1HE MET 46 -12.984 4.112 4.293
301 HE3 MET 46 2HE MET 46 -12.272 2.727 5.151
302 H CYS 47 H CYS 47 -5.595 0.958 3.442
303 HA CYS 47 HA CYS 47 -5.147 -0.286 0.915
304 HB2 CYS 47 1HB CYS 47 -3.675 1.374 1.909
305 HB3 CYS 47 2HB CYS 47 -3.286 0.315 3.259
306 H LEU 48 H LEU 48 -4.556 -1.537 4.242
307 HA LEU 48 HA LEU 48 -3.646 -4.109 3.505
308 HB2 LEU 48 1HB LEU 48 -5.129 -3.082 5.960
309 HB3 LEU 48 2HB LEU 48 -4.479 -4.697 5.832
310 HG LEU 48 HG LEU 48 -2.806 -2.143 5.667
311 HD11 LEU 48 1HD1 LEU 48 -1.986 -2.828 7.898
312 HD12 LEU 48 2HD1 LEU 48 -3.722 -2.488 7.916
313 HD13 LEU 48 3HD1 LEU 48 -3.146 -4.170 7.908
314 HD21 LEU 48 3HD2 LEU 48 -1.911 -5.029 5.814
315 HD22 LEU 48 1HD2 LEU 48 -1.732 -3.945 4.426
316 HD23 LEU 48 2HD2 LEU 48 -0.880 -3.576 5.921
317 H LEU 49 H LEU 49 -6.924 -2.957 4.185
318 HA LEU 49 HA LEU 49 -8.351 -5.299 3.998
319 HB2 LEU 49 1HB LEU 49 -9.107 -2.614 4.045
320 HB3 LEU 49 2HB LEU 49 -9.591 -3.076 2.430
321 HG LEU 49 HG LEU 49 -10.592 -5.221 3.734
322 HD11 LEU 49 1HD1 LEU 49 -10.730 -2.995 5.824
323 HD12 LEU 49 2HD1 LEU 49 -11.303 -4.681 5.973
324 HD13 LEU 49 3HD1 LEU 49 -9.578 -4.315 5.883
325 HD21 LEU 49 3HD2 LEU 49 -11.986 -2.518 3.719
326 HD22 LEU 49 1HD2 LEU 49 -11.938 -3.676 2.376
327 HD23 LEU 49 2HD2 LEU 49 -12.760 -4.104 3.888
328 H GLN 50 H GLN 50 -7.056 -3.401 1.247
329 HA GLN 50 HA GLN 50 -8.425 -5.144 -0.651
330 HB2 GLN 50 1HB GLN 50 -7.956 -2.591 -0.899
331 HB3 GLN 50 2HB GLN 50 -6.319 -3.061 -1.323
332 HG2 GLN 50 1HG GLN 50 -7.643 -2.841 -3.356
333 HG3 GLN 50 2HG GLN 50 -7.234 -4.532 -3.120
334 HE21 GLN 50 1HE2 GLN 50 -9.868 -2.283 -2.136
335 HE22 GLN 50 2HE2 GLN 50 -11.161 -3.437 -2.361
336 H ALA 51 H ALA 51 -5.053 -4.451 0.349
337 HA ALA 51 HA ALA 51 -3.701 -6.246 -1.340
338 HB1 ALA 51 1HB ALA 51 -2.551 -4.629 0.139
339 HB2 ALA 51 2HB ALA 51 -3.049 -5.565 1.569
340 HB3 ALA 51 3HB ALA 51 -1.934 -6.271 0.381
341 H GLY 52 H GLY 52 -5.155 -6.966 1.903
342 HA2 GLY 52 1HA GLY 52 -4.613 -9.828 1.544
343 HA3 GLY 52 2HA GLY 52 -5.283 -9.041 2.959
344 H ALA 53 H ALA 53 -7.025 -8.008 0.161
345 HA ALA 53 HA ALA 53 -9.439 -8.666 1.195
346 HB1 ALA 53 1HB ALA 53 -10.374 -8.396 -1.127
347 HB2 ALA 53 2HB ALA 53 -9.275 -7.107 -0.639
348 HB3 ALA 53 3HB ALA 53 -8.716 -8.368 -1.751
349 H ALA 54 H ALA 54 -7.939 -10.555 -1.450
350 HA ALA 54 HA ALA 54 -8.701 -13.004 -0.153
351 HB1 ALA 54 1HB ALA 54 -10.371 -12.768 -1.958
352 HB2 ALA 54 2HB ALA 54 -9.062 -12.520 -3.138
353 HB3 ALA 54 3HB ALA 54 -9.230 -14.082 -2.306
354 H GLY 55 H GLY 55 -6.478 -11.583 0.193
355 HA2 GLY 55 1HA GLY 55 -4.215 -11.814 0.338
356 HA3 GLY 55 2HA GLY 55 -4.340 -13.265 -0.655
357 H SER 56 H SER 56 -5.660 -11.387 -2.810
358 HA SER 56 HA SER 56 -5.013 -10.602 -4.776
359 HB2 SER 56 1HB SER 56 -5.154 -8.765 -2.935
360 HB3 SER 56 2HB SER 56 -3.440 -8.572 -3.246
361 HG SER 56 HG SER 56 -4.246 -7.247 -4.664
362 H GLY 57 H GLY 57 -2.610 -12.405 -3.482
363 HA2 GLY 57 1HA GLY 57 -0.704 -13.276 -4.465
364 HA3 GLY 57 2HA GLY 57 -0.736 -12.033 -5.714
365 H CYS 58 H CYS 58 -1.222 -10.757 -2.588
366 HA CYS 58 HA CYS 58 1.415 -9.502 -2.464
367 HB2 CYS 58 1HB CYS 58 -1.141 -9.166 -0.826
368 HB3 CYS 58 2HB CYS 58 0.272 -8.113 -0.776
369 H ASP 59 H ASP 59 1.549 -9.197 0.385
370 HA ASP 59 HA ASP 59 1.707 -11.926 1.476
371 HB2 ASP 59 1HB ASP 59 3.895 -10.220 0.606
372 HB3 ASP 59 2HB ASP 59 3.879 -10.239 2.351
373 H MET 60 H MET 60 0.732 -11.917 3.543
374 HA MET 60 HA MET 60 0.722 -9.371 4.989
375 HB2 MET 60 1HB MET 60 -1.670 -9.372 5.395
376 HB3 MET 60 2HB MET 60 -1.381 -9.329 3.655
377 HG2 MET 60 1HG MET 60 -2.069 -11.596 3.393
378 HG3 MET 60 2HG MET 60 -1.881 -11.946 5.095
379 HE1 MET 60 3HE MET 60 -5.188 -11.852 6.494
380 HE2 MET 60 1HE MET 60 -4.069 -13.023 5.763
381 HE3 MET 60 2HE MET 60 -3.463 -11.765 6.862
382 H GLU 61 H GLU 61 -0.286 -9.458 7.114
383 HA GLU 61 HA GLU 61 0.442 -11.981 8.521
384 HB2 GLU 61 1HB GLU 61 1.171 -10.731 10.354
385 HB3 GLU 61 2HB GLU 61 1.855 -9.920 8.942
386 HG2 GLU 61 1HG GLU 61 0.059 -8.187 9.106
387 HG3 GLU 61 2HG GLU 61 -0.584 -9.015 10.537