Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
608952 | 5ji4 RC | 30069 | cing | 1-original | 5 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 ALA 1 1H ALA 1 5.357 -12.467 8.885
2 H2 ALA 1 2H ALA 1 4.439 -12.587 10.297
3 H3 ALA 1 3H ALA 1 6.126 -12.616 10.385
4 HA ALA 1 HA ALA 1 5.277 -10.483 11.082
5 HB1 ALA 1 1HB ALA 1 6.701 -10.408 8.413
6 HB2 ALA 1 2HB ALA 1 7.466 -10.581 9.992
7 HB3 ALA 1 3HB ALA 1 6.632 -9.083 9.576
8 HA PRO 2 HA PRO 2 1.728 -8.684 9.078
9 HB2 PRO 2 2HB PRO 2 2.370 -6.014 8.936
10 HB3 PRO 2 1HB PRO 2 1.826 -6.816 10.414
11 HG2 PRO 2 2HG PRO 2 4.621 -6.179 9.523
12 HG3 PRO 2 1HG PRO 2 3.884 -5.973 11.124
13 HD2 PRO 2 2HD PRO 2 5.484 -8.058 10.591
14 HD3 PRO 2 1HD PRO 2 4.058 -8.240 11.635
15 H CYS 3 H CYS 3 1.159 -7.113 7.187
16 HA CYS 3 HA CYS 3 2.805 -7.997 4.940
17 HB2 CYS 3 2HB CYS 3 0.301 -8.379 4.997
18 HB3 CYS 3 1HB CYS 3 0.104 -6.637 4.834
19 H GLU 4 H GLU 4 3.514 -6.539 3.329
20 HA GLU 4 HA GLU 4 3.880 -3.791 4.321
21 HB2 GLU 4 1HB GLU 4 5.721 -5.445 2.574
22 HB3 GLU 4 2HB GLU 4 6.021 -3.792 3.103
23 HG2 GLU 4 1HG GLU 4 6.138 -4.516 5.415
24 HG3 GLU 4 2HG GLU 4 5.722 -6.164 4.946
25 H CYS 5 H CYS 5 3.720 -2.103 2.884
26 HA CYS 5 HA CYS 5 2.589 -2.691 0.227
27 HB2 CYS 5 2HB CYS 5 0.791 -2.148 1.873
28 HB3 CYS 5 1HB CYS 5 1.574 -0.605 2.187
29 H ASP 6 H ASP 6 3.510 -1.485 -1.375
30 HA ASP 6 HA ASP 6 5.405 0.618 -0.535
31 HB2 ASP 6 1HB ASP 6 6.443 -1.450 -1.480
32 HB3 ASP 6 2HB ASP 6 5.589 -1.158 -2.983
33 H VAL 7 H VAL 7 4.442 2.494 -0.912
34 HA VAL 7 HA VAL 7 2.861 2.881 -3.357
35 HB VAL 7 HB VAL 7 2.667 4.552 -0.843
36 HG11 VAL 7 1HG1 VAL 7 0.752 4.135 -3.140
37 HG12 VAL 7 2HG1 VAL 7 1.760 5.557 -2.869
38 HG13 VAL 7 3HG1 VAL 7 0.469 5.163 -1.733
39 HG21 VAL 7 1HG2 VAL 7 1.052 2.090 -1.519
40 HG22 VAL 7 2HG2 VAL 7 0.677 3.221 -0.218
41 HG23 VAL 7 3HG2 VAL 7 2.169 2.283 -0.166
42 H ASN 8 H ASN 8 3.730 4.213 -4.799
43 HA ASN 8 HA ASN 8 4.817 5.962 -5.765
44 HB2 ASN 8 1HB ASN 8 3.685 7.314 -4.001
45 HB3 ASN 8 2HB ASN 8 5.073 7.063 -2.949
46 HD21 ASN 8 1HD2 ASN 8 7.039 9.527 -4.441
47 HD22 ASN 8 2HD2 ASN 8 6.963 8.205 -3.332
48 H GLY 9 H GLY 9 6.196 3.710 -3.918
49 HA2 GLY 9 1HA GLY 9 8.440 2.976 -4.427
50 HA3 GLY 9 2HA GLY 9 8.938 4.662 -4.465
51 H GLU 10 H GLU 10 6.961 4.758 -1.993
52 HA GLU 10 HA GLU 10 9.052 4.226 -0.015
53 HB2 GLU 10 1HB GLU 10 6.414 5.702 0.188
54 HB3 GLU 10 2HB GLU 10 7.545 5.497 1.522
55 HG2 GLU 10 1HG GLU 10 9.228 6.769 0.347
56 HG3 GLU 10 2HG GLU 10 8.190 6.889 -1.071
57 H THR 11 H THR 11 8.574 3.002 1.897
58 HA THR 11 HA THR 11 6.607 0.879 1.316
59 HB THR 11 HB THR 11 9.171 0.592 2.904
60 HG1 THR 11 1HG THR 11 8.675 0.531 0.166
61 HG21 THR 11 1HG2 THR 11 7.270 -1.458 1.738
62 HG22 THR 11 2HG2 THR 11 7.483 -1.090 3.451
63 HG23 THR 11 3HG2 THR 11 8.800 -1.823 2.535
64 H TYR 12 H TYR 12 5.092 0.516 2.730
65 HA TYR 12 HA TYR 12 5.306 1.521 5.492
66 HB2 TYR 12 2HB TYR 12 2.846 1.513 3.708
67 HB3 TYR 12 1HB TYR 12 2.881 2.029 5.387
68 HD1 TYR 12 1HD TYR 12 3.892 4.165 6.018
69 HD2 TYR 12 2HD TYR 12 3.765 2.923 1.944
70 HE1 TYR 12 1HE TYR 12 4.429 6.455 5.306
71 HE2 TYR 12 2HE TYR 12 4.305 5.211 1.224
72 HH TYR 12 HH TYR 12 4.179 7.483 2.046
73 H THR 13 H THR 13 3.700 0.351 6.944
74 HA THR 13 HA THR 13 3.440 -2.470 6.109
75 HB THR 13 HB THR 13 3.373 -2.954 8.607
76 HG1 THR 13 1HG THR 13 3.228 -0.397 8.853
77 HG21 THR 13 1HG2 THR 13 5.808 -2.864 8.872
78 HG22 THR 13 2HG2 THR 13 5.920 -1.757 7.502
79 HG23 THR 13 3HG2 THR 13 5.362 -3.413 7.256
80 H VAL 14 H VAL 14 1.505 -3.469 6.321
81 HA VAL 14 HA VAL 14 -0.755 -2.020 7.504
82 HB VAL 14 HB VAL 14 -2.188 -2.651 5.568
83 HG11 VAL 14 1HG1 VAL 14 -1.410 -0.906 4.031
84 HG12 VAL 14 2HG1 VAL 14 0.160 -0.891 4.837
85 HG13 VAL 14 3HG1 VAL 14 -1.285 -0.382 5.712
86 HG21 VAL 14 1HG2 VAL 14 -1.153 -3.320 3.446
87 HG22 VAL 14 2HG2 VAL 14 -0.845 -4.513 4.708
88 HG23 VAL 14 3HG2 VAL 14 0.425 -3.385 4.230
89 H SER 15 H SER 15 -2.520 -3.393 8.074
90 HA SER 15 HA SER 15 -1.746 -5.918 9.078
91 HB2 SER 15 1HB SER 15 -3.485 -4.511 10.132
92 HB3 SER 15 2HB SER 15 -4.534 -4.769 8.738
93 HG SER 15 HG SER 15 -3.505 -6.897 10.313
94 H SER 16 H SER 16 -3.559 -4.944 6.188
95 HA SER 16 HA SER 16 -3.379 -7.695 5.197
96 HB2 SER 16 1HB SER 16 -5.954 -6.091 5.207
97 HB3 SER 16 2HB SER 16 -5.732 -7.692 4.498
98 HG SER 16 HG SER 16 -5.192 -8.431 6.635
99 H SER 17 H SER 17 -3.686 -7.897 2.890
100 HA SER 17 HA SER 17 -2.294 -5.963 1.400
101 HB2 SER 17 1HB SER 17 -4.135 -8.128 0.339
102 HB3 SER 17 2HB SER 17 -2.805 -7.353 -0.525
103 HG SER 17 HG SER 17 -1.358 -8.310 0.904
104 H GLU 18 H GLU 18 -5.712 -6.558 1.887
105 HA GLU 18 HA GLU 18 -6.658 -4.694 -0.037
106 HB2 GLU 18 1HB GLU 18 -8.750 -4.785 1.662
107 HB3 GLU 18 2HB GLU 18 -8.431 -6.031 0.468
108 HG2 GLU 18 1HG GLU 18 -7.385 -6.236 3.279
109 HG3 GLU 18 2HG GLU 18 -9.013 -6.755 2.850
110 H GLU 19 H GLU 19 -5.668 -4.454 3.313
111 HA GLU 19 HA GLU 19 -6.557 -1.792 3.744
112 HB2 GLU 19 1HB GLU 19 -4.239 -3.247 5.048
113 HB3 GLU 19 2HB GLU 19 -4.994 -1.774 5.640
114 HG2 GLU 19 1HG GLU 19 -6.271 -4.499 5.438
115 HG3 GLU 19 2HG GLU 19 -5.776 -3.670 6.913
116 H CYS 20 H CYS 20 -3.541 -3.219 2.550
117 HA CYS 20 HA CYS 20 -2.071 -0.900 2.056
118 HB2 CYS 20 2HB CYS 20 -0.943 -2.931 1.659
119 HB3 CYS 20 1HB CYS 20 -2.225 -3.555 0.630
120 H GLU 21 H GLU 21 -4.233 -2.603 -0.214
121 HA GLU 21 HA GLU 21 -4.279 -0.866 -2.308
122 HB2 GLU 21 1HB GLU 21 -5.736 -3.106 -1.419
123 HB3 GLU 21 2HB GLU 21 -6.950 -1.879 -1.737
124 HG2 GLU 21 1HG GLU 21 -4.830 -2.478 -3.764
125 HG3 GLU 21 2HG GLU 21 -6.243 -3.508 -3.603
126 H ARG 22 H ARG 22 -6.462 -0.786 0.514
127 HA ARG 22 HA ARG 22 -7.921 1.472 -0.252
128 HB2 ARG 22 1HB ARG 22 -7.538 -0.091 2.240
129 HB3 ARG 22 2HB ARG 22 -8.107 1.551 2.452
130 HG2 ARG 22 1HG ARG 22 -9.975 0.025 2.374
131 HG3 ARG 22 2HG ARG 22 -10.007 1.094 0.974
132 HD2 ARG 22 1HD ARG 22 -8.869 -1.700 0.908
133 HD3 ARG 22 2HD ARG 22 -10.548 -1.331 0.521
134 HE ARG 22 HE ARG 22 -8.188 -0.673 -1.076
135 HH11 ARG 22 1HH1 ARG 22 -11.644 -0.382 -0.638
136 HH12 ARG 22 2HH1 ARG 22 -11.953 0.020 -2.295
137 HH21 ARG 22 1HH2 ARG 22 -8.586 -0.149 -3.271
138 HH22 ARG 22 2HH2 ARG 22 -10.216 0.130 -3.798
139 H LEU 23 H LEU 23 -4.982 1.166 1.710
140 HA LEU 23 HA LEU 23 -4.749 3.830 2.534
141 HB2 LEU 23 1HB LEU 23 -3.369 2.042 3.452
142 HB3 LEU 23 2HB LEU 23 -2.589 1.810 1.899
143 HG LEU 23 HG LEU 23 -1.611 4.087 2.077
144 HD11 LEU 23 1HD1 LEU 23 -2.783 4.068 4.862
145 HD12 LEU 23 2HD1 LEU 23 -3.301 5.098 3.526
146 HD13 LEU 23 3HD1 LEU 23 -1.683 5.281 4.202
147 HD21 LEU 23 1HD2 LEU 23 -0.336 2.120 2.795
148 HD22 LEU 23 2HD2 LEU 23 -0.996 2.285 4.422
149 HD23 LEU 23 3HD2 LEU 23 0.058 3.538 3.766
150 H CYS 24 H CYS 24 -3.449 2.194 -0.327
151 HA CYS 24 HA CYS 24 -2.192 4.418 -1.482
152 HB2 CYS 24 2HB CYS 24 -3.378 1.984 -2.849
153 HB3 CYS 24 1HB CYS 24 -2.165 3.070 -3.532
154 H ARG 25 H ARG 25 -5.503 3.222 -1.714
155 HA ARG 25 HA ARG 25 -6.419 5.056 -3.680
156 HB2 ARG 25 1HB ARG 25 -7.979 3.685 -1.475
157 HB3 ARG 25 2HB ARG 25 -8.688 4.500 -2.862
158 HG2 ARG 25 1HG ARG 25 -6.884 2.090 -3.021
159 HG3 ARG 25 2HG ARG 25 -8.645 2.040 -3.070
160 HD2 ARG 25 1HD ARG 25 -8.629 3.393 -5.113
161 HD3 ARG 25 2HD ARG 25 -6.865 3.460 -5.056
162 HE ARG 25 HE ARG 25 -7.049 0.911 -5.175
163 HH11 ARG 25 1HH1 ARG 25 -9.309 3.085 -6.750
164 HH12 ARG 25 2HH1 ARG 25 -9.722 1.942 -7.991
165 HH21 ARG 25 1HH2 ARG 25 -7.616 -0.587 -6.762
166 HH22 ARG 25 2HH2 ARG 25 -8.777 -0.156 -7.986
167 H LYS 26 H LYS 26 -6.183 5.204 -0.156
168 HA LYS 26 HA LYS 26 -7.627 7.575 0.221
169 HB2 LYS 26 1HB LYS 26 -5.565 6.054 1.810
170 HB3 LYS 26 2HB LYS 26 -6.272 7.529 2.388
171 HG2 LYS 26 1HG LYS 26 -8.000 5.226 1.591
172 HG3 LYS 26 2HG LYS 26 -7.252 5.295 3.185
173 HD2 LYS 26 1HD LYS 26 -9.399 6.187 3.501
174 HD3 LYS 26 2HD LYS 26 -8.347 7.599 3.417
175 HE2 LYS 26 1HE LYS 26 -10.351 8.014 2.139
176 HE3 LYS 26 2HE LYS 26 -8.983 7.881 1.035
177 HZ1 LYS 26 1HZ LYS 26 -10.941 5.718 1.609
178 HZ2 LYS 26 2HZ LYS 26 -9.654 5.624 0.522
179 HZ3 LYS 26 3HZ LYS 26 -10.933 6.690 0.226
180 H LEU 27 H LEU 27 -4.211 6.846 -0.289
181 HA LEU 27 HA LEU 27 -3.347 9.573 -0.160
182 HB2 LEU 27 1HB LEU 27 -1.990 7.175 -1.419
183 HB3 LEU 27 2HB LEU 27 -1.228 8.712 -1.049
184 HG LEU 27 HG LEU 27 -2.317 6.739 0.974
185 HD11 LEU 27 1HD1 LEU 27 0.527 7.511 0.316
186 HD12 LEU 27 2HD1 LEU 27 -0.254 5.978 -0.077
187 HD13 LEU 27 3HD1 LEU 27 0.018 6.421 1.608
188 HD21 LEU 27 1HD2 LEU 27 -1.292 8.232 2.653
189 HD22 LEU 27 2HD2 LEU 27 -2.613 9.002 1.778
190 HD23 LEU 27 3HD2 LEU 27 -0.943 9.402 1.378
191 H GLY 28 H GLY 28 -4.654 7.475 -2.594
192 HA2 GLY 28 1HA GLY 28 -5.525 8.014 -4.663
193 HA3 GLY 28 2HA GLY 28 -5.033 9.682 -4.404
194 H VAL 29 H VAL 29 -3.071 6.745 -4.356
195 HA VAL 29 HA VAL 29 -1.531 7.797 -6.653
196 HB VAL 29 HB VAL 29 -0.408 6.270 -4.283
197 HG11 VAL 29 1HG1 VAL 29 0.986 7.588 -6.620
198 HG12 VAL 29 2HG1 VAL 29 0.814 5.851 -6.361
199 HG13 VAL 29 3HG1 VAL 29 1.785 6.817 -5.247
200 HG21 VAL 29 1HG2 VAL 29 0.670 8.371 -3.639
201 HG22 VAL 29 2HG2 VAL 29 -1.086 8.538 -3.642
202 HG23 VAL 29 3HG2 VAL 29 -0.135 9.203 -4.971
203 H THR 30 H THR 30 -1.339 6.434 -8.321
204 HA THR 30 HA THR 30 -2.519 3.815 -8.204
205 HB THR 30 HB THR 30 -1.646 3.718 -10.632
206 HG1 THR 30 1HG THR 30 -0.178 5.258 -10.911
207 HG21 THR 30 1HG2 THR 30 -3.425 5.205 -11.436
208 HG22 THR 30 2HG2 THR 30 -3.536 5.947 -9.840
209 HG23 THR 30 3HG2 THR 30 -3.977 4.253 -10.057
210 H ASN 31 H ASN 31 0.752 5.134 -8.291
211 HA ASN 31 HA ASN 31 2.113 2.661 -8.559
212 HB2 ASN 31 1HB ASN 31 3.188 4.878 -8.916
213 HB3 ASN 31 2HB ASN 31 3.061 5.200 -7.191
214 HD21 ASN 31 1HD2 ASN 31 6.429 3.816 -8.251
215 HD22 ASN 31 2HD2 ASN 31 5.403 5.021 -8.945
216 H CYS 32 H CYS 32 1.429 1.089 -7.223
217 HA CYS 32 HA CYS 32 1.919 1.296 -4.356
218 HB2 CYS 32 2HB CYS 32 -0.317 2.219 -4.457
219 HB3 CYS 32 1HB CYS 32 -0.865 0.952 -5.545
220 H ARG 33 H ARG 33 2.643 -0.640 -3.667
221 HA ARG 33 HA ARG 33 2.039 -3.073 -5.231
222 HB2 ARG 33 1HB ARG 33 4.734 -2.350 -4.043
223 HB3 ARG 33 2HB ARG 33 4.363 -3.769 -5.007
224 HG2 ARG 33 1HG ARG 33 4.270 -2.576 -6.985
225 HG3 ARG 33 2HG ARG 33 3.943 -1.046 -6.171
226 HD2 ARG 33 1HD ARG 33 6.201 -1.083 -7.084
227 HD3 ARG 33 2HD ARG 33 6.234 -0.994 -5.323
228 HE ARG 33 HE ARG 33 6.516 -3.613 -6.610
229 HH11 ARG 33 1HH1 ARG 33 7.904 -1.010 -4.712
230 HH12 ARG 33 2HH1 ARG 33 9.347 -1.896 -4.339
231 HH21 ARG 33 1HH2 ARG 33 8.420 -4.764 -6.119
232 HH22 ARG 33 2HH2 ARG 33 9.642 -4.024 -5.134
233 H VAL 34 H VAL 34 2.543 -5.083 -3.890
234 HA VAL 34 HA VAL 34 2.413 -4.665 -1.017
235 HB VAL 34 HB VAL 34 0.061 -4.466 -1.708
236 HG11 VAL 34 1HG1 VAL 34 -1.143 -6.379 -2.653
237 HG12 VAL 34 2HG1 VAL 34 0.372 -7.273 -2.784
238 HG13 VAL 34 3HG1 VAL 34 0.126 -5.812 -3.741
239 HG21 VAL 34 1HG2 VAL 34 0.593 -5.430 0.485
240 HG22 VAL 34 2HG2 VAL 34 0.619 -7.044 -0.229
241 HG23 VAL 34 3HG2 VAL 34 -0.885 -6.122 -0.183
242 H HIS 35 H HIS 35 3.138 -6.337 0.155
243 HA HIS 35 HA HIS 35 3.171 -9.046 -0.807
244 HB2 HIS 35 1HB HIS 35 5.583 -9.406 -0.657
245 HB3 HIS 35 2HB HIS 35 5.250 -8.169 -1.861
246 HD1 HIS 35 HD1 HIS 35 6.211 -5.835 -1.445
247 HD2 HIS 35 HD2 HIS 35 6.890 -8.478 1.693
248 HE1 HIS 35 HE1 HIS 35 7.881 -4.696 0.050
249 HE2 HIS 35 HE2 HIS 35 8.185 -6.261 2.002
250 H CYS 36 H CYS 36 3.168 -10.454 0.941
251 HA CYS 36 HA CYS 36 3.180 -9.106 3.573
252 HB2 CYS 36 2HB CYS 36 1.585 -11.565 2.804
253 HB3 CYS 36 1HB CYS 36 1.437 -10.619 4.279
254 H GLY 37 H GLY 37 4.742 -9.736 4.912
255 HA2 GLY 37 1HA GLY 37 6.332 -12.096 4.216
256 HA3 GLY 37 2HA GLY 37 6.818 -10.790 5.285
Start of MODEL 2
1 H1 ALA 1 1H ALA 1 -1.694 -12.778 9.416
2 H2 ALA 1 2H ALA 1 -0.809 -14.211 9.535
3 H3 ALA 1 3H ALA 1 -0.969 -13.439 8.040
4 HA ALA 1 HA ALA 1 0.438 -12.347 10.402
5 HB1 ALA 1 1HB ALA 1 2.488 -12.725 9.123
6 HB2 ALA 1 2HB ALA 1 1.550 -13.432 7.807
7 HB3 ALA 1 3HB ALA 1 1.623 -14.243 9.372
8 HA PRO 2 HA PRO 2 -0.130 -8.422 8.416
9 HB2 PRO 2 2HB PRO 2 2.112 -7.087 9.195
10 HB3 PRO 2 1HB PRO 2 0.777 -7.437 10.300
11 HG2 PRO 2 2HG PRO 2 3.368 -8.908 9.934
12 HG3 PRO 2 1HG PRO 2 2.558 -8.437 11.441
13 HD2 PRO 2 2HD PRO 2 2.388 -10.946 10.459
14 HD3 PRO 2 1HD PRO 2 1.031 -10.183 11.315
15 H CYS 3 H CYS 3 0.836 -6.977 6.809
16 HA CYS 3 HA CYS 3 2.905 -8.262 5.154
17 HB2 CYS 3 2HB CYS 3 0.372 -7.036 4.030
18 HB3 CYS 3 1HB CYS 3 1.609 -7.928 3.149
19 H GLU 4 H GLU 4 3.489 -6.613 3.299
20 HA GLU 4 HA GLU 4 3.843 -3.987 4.582
21 HB2 GLU 4 1HB GLU 4 5.969 -3.803 3.415
22 HB3 GLU 4 2HB GLU 4 5.934 -5.289 4.347
23 HG2 GLU 4 1HG GLU 4 5.311 -6.495 2.239
24 HG3 GLU 4 2HG GLU 4 5.623 -4.993 1.372
25 H CYS 5 H CYS 5 4.114 -2.184 3.017
26 HA CYS 5 HA CYS 5 2.513 -2.540 0.590
27 HB2 CYS 5 2HB CYS 5 0.990 -1.905 2.466
28 HB3 CYS 5 1HB CYS 5 1.930 -0.435 2.692
29 H ASP 6 H ASP 6 3.185 -1.305 -1.062
30 HA ASP 6 HA ASP 6 5.302 0.664 -0.574
31 HB2 ASP 6 1HB ASP 6 4.876 -1.380 -2.734
32 HB3 ASP 6 2HB ASP 6 5.736 0.095 -3.113
33 H VAL 7 H VAL 7 5.013 2.649 -1.384
34 HA VAL 7 HA VAL 7 2.630 3.275 -2.970
35 HB VAL 7 HB VAL 7 3.461 4.881 -0.532
36 HG11 VAL 7 1HG1 VAL 7 1.268 5.942 -0.786
37 HG12 VAL 7 2HG1 VAL 7 0.953 4.953 -2.211
38 HG13 VAL 7 3HG1 VAL 7 2.256 6.143 -2.234
39 HG21 VAL 7 1HG2 VAL 7 1.243 2.834 -0.716
40 HG22 VAL 7 2HG2 VAL 7 1.502 3.940 0.634
41 HG23 VAL 7 3HG2 VAL 7 2.707 2.708 0.262
42 H ASN 8 H ASN 8 3.592 4.032 -4.767
43 HA ASN 8 HA ASN 8 4.748 5.327 -6.215
44 HB2 ASN 8 1HB ASN 8 4.013 7.267 -4.900
45 HB3 ASN 8 2HB ASN 8 5.333 7.025 -3.765
46 HD21 ASN 8 1HD2 ASN 8 6.010 9.659 -6.429
47 HD22 ASN 8 2HD2 ASN 8 4.593 9.306 -5.508
48 H GLY 9 H GLY 9 6.680 5.574 -3.279
49 HA2 GLY 9 1HA GLY 9 8.578 3.588 -4.198
50 HA3 GLY 9 2HA GLY 9 9.205 5.231 -4.157
51 H GLU 10 H GLU 10 6.834 4.595 -1.793
52 HA GLU 10 HA GLU 10 8.937 4.481 0.269
53 HB2 GLU 10 1HB GLU 10 7.494 6.552 0.176
54 HB3 GLU 10 2HB GLU 10 6.108 5.535 0.545
55 HG2 GLU 10 1HG GLU 10 6.917 6.663 2.533
56 HG3 GLU 10 2HG GLU 10 7.109 4.917 2.679
57 H THR 11 H THR 11 8.673 3.016 1.990
58 HA THR 11 HA THR 11 6.685 0.897 1.466
59 HB THR 11 HB THR 11 9.394 0.577 2.785
60 HG1 THR 11 1HG THR 11 8.513 -0.066 0.140
61 HG21 THR 11 1HG2 THR 11 7.724 -1.097 3.489
62 HG22 THR 11 2HG2 THR 11 8.988 -1.822 2.497
63 HG23 THR 11 3HG2 THR 11 7.406 -1.483 1.797
64 H TYR 12 H TYR 12 5.363 0.286 3.044
65 HA TYR 12 HA TYR 12 5.816 1.143 5.810
66 HB2 TYR 12 2HB TYR 12 3.372 1.688 4.116
67 HB3 TYR 12 1HB TYR 12 3.283 1.648 5.868
68 HD1 TYR 12 1HD TYR 12 5.109 3.160 7.086
69 HD2 TYR 12 2HD TYR 12 3.728 3.761 3.097
70 HE1 TYR 12 1HE TYR 12 5.806 5.511 7.203
71 HE2 TYR 12 2HE TYR 12 4.422 6.118 3.214
72 HH TYR 12 HH TYR 12 6.410 7.324 5.733
73 H THR 13 H THR 13 4.008 0.081 7.211
74 HA THR 13 HA THR 13 3.629 -2.699 6.306
75 HB THR 13 HB THR 13 3.398 -3.106 8.872
76 HG1 THR 13 1HG THR 13 3.681 -1.369 10.031
77 HG21 THR 13 1HG2 THR 13 5.823 -3.407 9.116
78 HG22 THR 13 2HG2 THR 13 6.095 -2.417 7.681
79 HG23 THR 13 3HG2 THR 13 5.266 -3.968 7.539
80 H VAL 14 H VAL 14 1.639 -3.625 6.498
81 HA VAL 14 HA VAL 14 -0.572 -2.059 7.625
82 HB VAL 14 HB VAL 14 -1.992 -2.578 5.647
83 HG11 VAL 14 1HG1 VAL 14 0.472 -0.962 4.969
84 HG12 VAL 14 2HG1 VAL 14 -0.941 -0.372 5.845
85 HG13 VAL 14 3HG1 VAL 14 -1.093 -0.863 4.157
86 HG21 VAL 14 1HG2 VAL 14 -0.953 -3.287 3.549
87 HG22 VAL 14 2HG2 VAL 14 -0.737 -4.505 4.801
88 HG23 VAL 14 3HG2 VAL 14 0.605 -3.446 4.360
89 H SER 15 H SER 15 -2.588 -3.434 7.741
90 HA SER 15 HA SER 15 -2.024 -5.880 9.022
91 HB2 SER 15 1HB SER 15 -4.697 -4.988 7.908
92 HB3 SER 15 2HB SER 15 -4.423 -6.159 9.199
93 HG SER 15 HG SER 15 -4.996 -4.032 9.941
94 H SER 16 H SER 16 -3.348 -5.147 5.794
95 HA SER 16 HA SER 16 -2.220 -7.524 4.689
96 HB2 SER 16 1HB SER 16 -4.224 -8.441 5.875
97 HB3 SER 16 2HB SER 16 -5.247 -7.410 4.878
98 HG SER 16 HG SER 16 -3.599 -9.570 4.066
99 H SER 17 H SER 17 -3.568 -7.893 2.463
100 HA SER 17 HA SER 17 -2.717 -5.933 0.726
101 HB2 SER 17 1HB SER 17 -3.280 -8.282 0.117
102 HB3 SER 17 2HB SER 17 -4.991 -7.891 0.280
103 HG SER 17 HG SER 17 -3.325 -7.468 -1.803
104 H GLU 18 H GLU 18 -6.012 -6.448 1.985
105 HA GLU 18 HA GLU 18 -7.300 -4.478 0.488
106 HB2 GLU 18 1HB GLU 18 -7.985 -5.410 3.287
107 HB3 GLU 18 2HB GLU 18 -9.077 -4.588 2.178
108 HG2 GLU 18 1HG GLU 18 -7.883 -7.335 1.844
109 HG3 GLU 18 2HG GLU 18 -9.564 -6.944 2.199
110 H GLU 19 H GLU 19 -5.650 -4.275 3.610
111 HA GLU 19 HA GLU 19 -6.279 -1.577 4.162
112 HB2 GLU 19 1HB GLU 19 -4.011 -3.349 5.075
113 HB3 GLU 19 2HB GLU 19 -4.175 -1.686 5.618
114 HG2 GLU 19 1HG GLU 19 -5.071 -3.260 7.244
115 HG3 GLU 19 2HG GLU 19 -6.325 -2.192 6.619
116 H CYS 20 H CYS 20 -3.416 -3.070 2.632
117 HA CYS 20 HA CYS 20 -1.993 -0.720 2.094
118 HB2 CYS 20 2HB CYS 20 -1.026 -2.937 1.758
119 HB3 CYS 20 1HB CYS 20 -2.153 -3.258 0.450
120 H GLU 21 H GLU 21 -4.309 -2.424 0.000
121 HA GLU 21 HA GLU 21 -4.377 -0.718 -2.165
122 HB2 GLU 21 1HB GLU 21 -6.607 -2.334 -0.909
123 HB3 GLU 21 2HB GLU 21 -6.742 -1.545 -2.473
124 HG2 GLU 21 1HG GLU 21 -4.653 -3.620 -1.825
125 HG3 GLU 21 2HG GLU 21 -6.216 -3.990 -2.552
126 H ARG 22 H ARG 22 -6.418 -0.619 0.748
127 HA ARG 22 HA ARG 22 -7.968 1.593 0.035
128 HB2 ARG 22 1HB ARG 22 -8.347 -0.064 1.940
129 HB3 ARG 22 2HB ARG 22 -7.187 0.871 2.869
130 HG2 ARG 22 1HG ARG 22 -9.635 2.146 1.673
131 HG3 ARG 22 2HG ARG 22 -9.688 1.319 3.227
132 HD2 ARG 22 1HD ARG 22 -8.001 2.845 4.114
133 HD3 ARG 22 2HD ARG 22 -7.882 3.647 2.548
134 HE ARG 22 HE ARG 22 -10.334 4.186 2.905
135 HH11 ARG 22 1HH1 ARG 22 -8.055 3.865 5.541
136 HH12 ARG 22 2HH1 ARG 22 -8.970 4.865 6.624
137 HH21 ARG 22 1HH2 ARG 22 -11.523 5.542 4.312
138 HH22 ARG 22 2HH2 ARG 22 -10.931 5.831 5.921
139 H LEU 23 H LEU 23 -4.903 1.401 1.808
140 HA LEU 23 HA LEU 23 -4.732 4.103 2.557
141 HB2 LEU 23 1HB LEU 23 -3.335 2.341 3.538
142 HB3 LEU 23 2HB LEU 23 -2.513 2.122 2.005
143 HG LEU 23 HG LEU 23 -1.592 4.416 2.181
144 HD11 LEU 23 1HD1 LEU 23 -1.760 5.640 4.296
145 HD12 LEU 23 2HD1 LEU 23 -2.896 4.436 4.902
146 HD13 LEU 23 3HD1 LEU 23 -3.335 5.449 3.527
147 HD21 LEU 23 1HD2 LEU 23 -0.277 2.524 2.989
148 HD22 LEU 23 2HD2 LEU 23 -1.025 2.670 4.581
149 HD23 LEU 23 3HD2 LEU 23 0.014 3.960 3.971
150 H CYS 24 H CYS 24 -3.133 2.426 -0.161
151 HA CYS 24 HA CYS 24 -1.961 4.699 -1.292
152 HB2 CYS 24 2HB CYS 24 -2.834 2.148 -2.674
153 HB3 CYS 24 1HB CYS 24 -1.693 3.327 -3.321
154 H ARG 25 H ARG 25 -5.106 3.185 -1.912
155 HA ARG 25 HA ARG 25 -5.773 4.907 -4.092
156 HB2 ARG 25 1HB ARG 25 -7.526 3.121 -2.386
157 HB3 ARG 25 2HB ARG 25 -8.051 3.931 -3.859
158 HG2 ARG 25 1HG ARG 25 -6.410 2.677 -5.156
159 HG3 ARG 25 2HG ARG 25 -5.827 1.896 -3.686
160 HD2 ARG 25 1HD ARG 25 -8.075 0.913 -3.364
161 HD3 ARG 25 2HD ARG 25 -8.585 1.631 -4.894
162 HE ARG 25 HE ARG 25 -6.389 -0.345 -4.704
163 HH11 ARG 25 1HH1 ARG 25 -9.328 0.812 -6.208
164 HH12 ARG 25 2HH1 ARG 25 -9.291 -0.375 -7.471
165 HH21 ARG 25 1HH2 ARG 25 -6.331 -1.892 -6.369
166 HH22 ARG 25 2HH2 ARG 25 -7.593 -1.910 -7.564
167 H LYS 26 H LYS 26 -6.166 5.085 -0.624
168 HA LYS 26 HA LYS 26 -8.008 7.265 -0.595
169 HB2 LYS 26 1HB LYS 26 -7.647 5.852 1.389
170 HB3 LYS 26 2HB LYS 26 -5.978 6.400 1.488
171 HG2 LYS 26 1HG LYS 26 -6.782 8.701 1.881
172 HG3 LYS 26 2HG LYS 26 -8.443 8.101 1.852
173 HD2 LYS 26 1HD LYS 26 -7.963 6.671 3.785
174 HD3 LYS 26 2HD LYS 26 -6.294 7.247 3.805
175 HE2 LYS 26 1HE LYS 26 -7.116 9.540 4.210
176 HE3 LYS 26 2HE LYS 26 -8.769 8.928 4.236
177 HZ1 LYS 26 1HZ LYS 26 -6.617 8.129 6.123
178 HZ2 LYS 26 2HZ LYS 26 -8.222 7.594 6.159
179 HZ3 LYS 26 3HZ LYS 26 -7.867 9.219 6.461
180 H LEU 27 H LEU 27 -4.494 6.965 -0.555
181 HA LEU 27 HA LEU 27 -3.956 9.772 -0.503
182 HB2 LEU 27 1HB LEU 27 -2.222 7.471 -1.448
183 HB3 LEU 27 2HB LEU 27 -1.660 9.106 -1.145
184 HG LEU 27 HG LEU 27 -2.767 7.212 0.942
185 HD11 LEU 27 1HD1 LEU 27 -0.489 7.138 1.795
186 HD12 LEU 27 2HD1 LEU 27 0.057 8.171 0.474
187 HD13 LEU 27 3HD1 LEU 27 -0.555 6.551 0.132
188 HD21 LEU 27 1HD2 LEU 27 -2.049 8.912 2.559
189 HD22 LEU 27 2HD2 LEU 27 -3.295 9.530 1.476
190 HD23 LEU 27 3HD2 LEU 27 -1.609 9.988 1.231
191 H GLY 28 H GLY 28 -4.759 7.459 -2.945
192 HA2 GLY 28 1HA GLY 28 -5.607 7.969 -5.067
193 HA3 GLY 28 2HA GLY 28 -4.936 9.589 -4.933
194 H VAL 29 H VAL 29 -2.787 7.116 -4.053
195 HA VAL 29 HA VAL 29 -1.185 7.623 -6.439
196 HB VAL 29 HB VAL 29 -0.478 6.021 -3.964
197 HG11 VAL 29 1HG1 VAL 29 1.268 7.101 -6.183
198 HG12 VAL 29 2HG1 VAL 29 0.865 5.406 -5.908
199 HG13 VAL 29 3HG1 VAL 29 1.843 6.283 -4.730
200 HG21 VAL 29 1HG2 VAL 29 -0.909 8.347 -3.376
201 HG22 VAL 29 2HG2 VAL 29 0.172 8.892 -4.656
202 HG23 VAL 29 3HG2 VAL 29 0.817 8.003 -3.276
203 H THR 30 H THR 30 -1.302 6.305 -8.122
204 HA THR 30 HA THR 30 -2.682 3.780 -7.966
205 HB THR 30 HB THR 30 -1.205 4.987 -10.320
206 HG1 THR 30 1HG THR 30 -3.297 5.947 -9.075
207 HG21 THR 30 1HG2 THR 30 -1.734 2.607 -10.606
208 HG22 THR 30 2HG2 THR 30 -2.733 3.602 -11.666
209 HG23 THR 30 3HG2 THR 30 -3.420 2.924 -10.190
210 H ASN 31 H ASN 31 0.633 4.906 -8.343
211 HA ASN 31 HA ASN 31 1.826 2.340 -8.694
212 HB2 ASN 31 1HB ASN 31 2.994 4.941 -7.645
213 HB3 ASN 31 2HB ASN 31 3.943 3.505 -8.011
214 HD21 ASN 31 1HD2 ASN 31 4.487 5.081 -11.089
215 HD22 ASN 31 2HD2 ASN 31 5.144 4.680 -9.539
216 H CYS 32 H CYS 32 1.270 0.843 -7.198
217 HA CYS 32 HA CYS 32 2.197 1.134 -4.470
218 HB2 CYS 32 2HB CYS 32 0.068 2.299 -4.269
219 HB3 CYS 32 1HB CYS 32 -0.780 1.001 -5.102
220 H ARG 33 H ARG 33 2.521 -0.864 -3.539
221 HA ARG 33 HA ARG 33 1.384 -3.256 -4.798
222 HB2 ARG 33 1HB ARG 33 4.324 -2.603 -4.686
223 HB3 ARG 33 2HB ARG 33 3.787 -4.275 -4.653
224 HG2 ARG 33 1HG ARG 33 3.189 -2.286 -6.841
225 HG3 ARG 33 2HG ARG 33 4.406 -3.564 -6.906
226 HD2 ARG 33 1HD ARG 33 2.564 -5.221 -6.529
227 HD3 ARG 33 2HD ARG 33 1.412 -3.896 -6.698
228 HE ARG 33 HE ARG 33 3.079 -3.908 -8.945
229 HH11 ARG 33 1HH1 ARG 33 0.598 -5.879 -7.464
230 HH12 ARG 33 2HH1 ARG 33 0.088 -6.595 -8.958
231 HH21 ARG 33 1HH2 ARG 33 2.405 -4.839 -10.926
232 HH22 ARG 33 2HH2 ARG 33 1.111 -5.996 -10.934
233 H VAL 34 H VAL 34 1.018 -4.889 -3.363
234 HA VAL 34 HA VAL 34 1.981 -4.452 -0.604
235 HB VAL 34 HB VAL 34 -0.417 -4.227 -0.671
236 HG11 VAL 34 1HG1 VAL 34 -0.904 -5.397 -2.745
237 HG12 VAL 34 2HG1 VAL 34 -1.901 -6.034 -1.437
238 HG13 VAL 34 3HG1 VAL 34 -0.495 -6.940 -1.995
239 HG21 VAL 34 1HG2 VAL 34 0.532 -5.371 1.277
240 HG22 VAL 34 2HG2 VAL 34 0.328 -6.927 0.471
241 HG23 VAL 34 3HG2 VAL 34 -1.086 -5.971 0.912
242 H HIS 35 H HIS 35 3.442 -5.852 0.061
243 HA HIS 35 HA HIS 35 3.527 -8.528 -1.195
244 HB2 HIS 35 1HB HIS 35 5.505 -7.177 -1.736
245 HB3 HIS 35 2HB HIS 35 5.792 -6.875 -0.026
246 HD1 HIS 35 HD1 HIS 35 7.037 -8.648 1.286
247 HD2 HIS 35 HD2 HIS 35 6.081 -9.843 -2.582
248 HE1 HIS 35 HE1 HIS 35 8.265 -10.812 0.920
249 HE2 HIS 35 HE2 HIS 35 7.574 -11.573 -1.376
250 H CYS 36 H CYS 36 3.715 -10.318 0.143
251 HA CYS 36 HA CYS 36 3.862 -9.857 3.035
252 HB2 CYS 36 2HB CYS 36 1.429 -10.118 1.957
253 HB3 CYS 36 1HB CYS 36 1.835 -11.828 2.054
254 H GLY 37 H GLY 37 5.639 -10.950 3.562
255 HA2 GLY 37 1HA GLY 37 6.417 -13.324 2.054
256 HA3 GLY 37 2HA GLY 37 7.397 -12.460 3.229
Start of MODEL 3
1 H1 ALA 1 1H ALA 1 -2.745 -10.293 10.313
2 H2 ALA 1 2H ALA 1 -1.623 -9.871 11.504
3 H3 ALA 1 3H ALA 1 -2.119 -11.476 11.345
4 HA ALA 1 HA ALA 1 0.069 -11.189 10.423
5 HB1 ALA 1 1HB ALA 1 -1.418 -12.845 9.404
6 HB2 ALA 1 2HB ALA 1 -0.356 -12.120 8.196
7 HB3 ALA 1 3HB ALA 1 -2.043 -11.616 8.303
8 HA PRO 2 HA PRO 2 0.209 -6.955 8.788
9 HB2 PRO 2 2HB PRO 2 2.698 -6.348 9.548
10 HB3 PRO 2 1HB PRO 2 1.389 -6.456 10.735
11 HG2 PRO 2 2HG PRO 2 3.473 -8.496 10.034
12 HG3 PRO 2 1HG PRO 2 2.936 -7.962 11.638
13 HD2 PRO 2 2HD PRO 2 2.015 -10.245 10.431
14 HD3 PRO 2 1HD PRO 2 1.057 -9.302 11.592
15 H CYS 3 H CYS 3 1.056 -6.117 6.952
16 HA CYS 3 HA CYS 3 2.987 -7.712 5.422
17 HB2 CYS 3 2HB CYS 3 0.333 -6.634 4.434
18 HB3 CYS 3 1HB CYS 3 1.614 -7.189 3.363
19 H GLU 4 H GLU 4 3.800 -6.403 3.500
20 HA GLU 4 HA GLU 4 4.198 -3.615 4.359
21 HB2 GLU 4 1HB GLU 4 6.037 -5.478 2.829
22 HB3 GLU 4 2HB GLU 4 6.346 -3.763 3.043
23 HG2 GLU 4 1HG GLU 4 7.663 -4.923 4.633
24 HG3 GLU 4 2HG GLU 4 6.352 -4.146 5.515
25 H CYS 5 H CYS 5 3.625 -2.061 3.016
26 HA CYS 5 HA CYS 5 2.739 -2.770 0.292
27 HB2 CYS 5 2HB CYS 5 0.849 -2.257 1.780
28 HB3 CYS 5 1HB CYS 5 1.591 -0.727 2.225
29 H ASP 6 H ASP 6 3.638 -1.598 -1.324
30 HA ASP 6 HA ASP 6 5.457 0.590 -0.598
31 HB2 ASP 6 1HB ASP 6 5.593 -1.614 -2.637
32 HB3 ASP 6 2HB ASP 6 6.444 -0.112 -2.931
33 H VAL 7 H VAL 7 4.625 2.468 -1.137
34 HA VAL 7 HA VAL 7 2.808 2.678 -3.439
35 HB VAL 7 HB VAL 7 2.914 4.479 -1.002
36 HG11 VAL 7 1HG1 VAL 7 0.764 5.332 -1.815
37 HG12 VAL 7 2HG1 VAL 7 0.881 4.283 -3.229
38 HG13 VAL 7 3HG1 VAL 7 2.049 5.584 -2.997
39 HG21 VAL 7 1HG2 VAL 7 0.968 2.249 -1.617
40 HG22 VAL 7 2HG2 VAL 7 0.841 3.384 -0.272
41 HG23 VAL 7 3HG2 VAL 7 2.186 2.247 -0.340
42 H ASN 8 H ASN 8 3.905 3.479 -5.087
43 HA ASN 8 HA ASN 8 4.943 4.981 -6.427
44 HB2 ASN 8 1HB ASN 8 3.664 6.692 -5.200
45 HB3 ASN 8 2HB ASN 8 4.942 6.789 -3.995
46 HD21 ASN 8 1HD2 ASN 8 7.028 8.841 -5.921
47 HD22 ASN 8 2HD2 ASN 8 6.888 7.824 -4.531
48 H GLY 9 H GLY 9 6.403 4.026 -3.463
49 HA2 GLY 9 1HA GLY 9 8.857 3.342 -4.183
50 HA3 GLY 9 2HA GLY 9 9.025 5.095 -4.130
51 H GLU 10 H GLU 10 6.859 4.966 -1.939
52 HA GLU 10 HA GLU 10 8.718 4.686 0.290
53 HB2 GLU 10 1HB GLU 10 7.299 6.661 0.261
54 HB3 GLU 10 2HB GLU 10 5.855 5.670 0.128
55 HG2 GLU 10 1HG GLU 10 6.013 6.476 2.362
56 HG3 GLU 10 2HG GLU 10 6.332 4.745 2.380
57 H THR 11 H THR 11 8.354 3.293 2.067
58 HA THR 11 HA THR 11 6.638 0.973 1.443
59 HB THR 11 HB THR 11 9.120 0.972 3.184
60 HG1 THR 11 1HG THR 11 8.811 0.181 0.451
61 HG21 THR 11 1HG2 THR 11 7.530 -0.842 3.658
62 HG22 THR 11 2HG2 THR 11 8.996 -1.468 2.900
63 HG23 THR 11 3HG2 THR 11 7.521 -1.286 1.952
64 H TYR 12 H TYR 12 4.936 0.812 2.696
65 HA TYR 12 HA TYR 12 5.022 1.755 5.488
66 HB2 TYR 12 2HB TYR 12 2.647 1.443 3.622
67 HB3 TYR 12 1HB TYR 12 2.536 1.907 5.310
68 HD1 TYR 12 1HD TYR 12 3.667 4.095 6.022
69 HD2 TYR 12 2HD TYR 12 2.938 3.071 1.953
70 HE1 TYR 12 1HE TYR 12 3.856 6.465 5.398
71 HE2 TYR 12 2HE TYR 12 3.132 5.440 1.316
72 HH TYR 12 HH TYR 12 4.422 7.795 3.367
73 H THR 13 H THR 13 3.557 0.483 6.956
74 HA THR 13 HA THR 13 3.363 -2.347 6.141
75 HB THR 13 HB THR 13 3.166 -2.754 8.691
76 HG1 THR 13 1HG THR 13 3.493 -0.115 8.712
77 HG21 THR 13 1HG2 THR 13 5.605 -2.906 8.946
78 HG22 THR 13 2HG2 THR 13 5.813 -1.921 7.496
79 HG23 THR 13 3HG2 THR 13 5.070 -3.518 7.382
80 H VAL 14 H VAL 14 1.422 -3.290 6.166
81 HA VAL 14 HA VAL 14 -0.887 -1.755 7.165
82 HB VAL 14 HB VAL 14 -2.178 -2.453 5.166
83 HG11 VAL 14 1HG1 VAL 14 0.308 -0.867 4.499
84 HG12 VAL 14 2HG1 VAL 14 -1.162 -0.226 5.230
85 HG13 VAL 14 3HG1 VAL 14 -1.202 -0.860 3.585
86 HG21 VAL 14 1HG2 VAL 14 -0.905 -4.432 4.537
87 HG22 VAL 14 2HG2 VAL 14 0.493 -3.434 4.136
88 HG23 VAL 14 3HG2 VAL 14 -0.983 -3.308 3.179
89 H SER 15 H SER 15 -2.889 -3.170 7.237
90 HA SER 15 HA SER 15 -2.205 -5.505 8.771
91 HB2 SER 15 1HB SER 15 -4.019 -3.881 9.396
92 HB3 SER 15 2HB SER 15 -4.961 -4.476 8.032
93 HG SER 15 HG SER 15 -4.081 -6.531 9.552
94 H SER 16 H SER 16 -3.325 -4.874 5.531
95 HA SER 16 HA SER 16 -3.141 -7.621 4.767
96 HB2 SER 16 1HB SER 16 -5.893 -6.343 4.829
97 HB3 SER 16 2HB SER 16 -5.512 -7.905 4.109
98 HG SER 16 HG SER 16 -4.627 -8.294 6.399
99 H SER 17 H SER 17 -3.974 -7.873 2.397
100 HA SER 17 HA SER 17 -2.606 -6.008 0.794
101 HB2 SER 17 1HB SER 17 -3.691 -7.216 -1.124
102 HB3 SER 17 2HB SER 17 -2.896 -8.286 0.029
103 HG SER 17 HG SER 17 -4.744 -9.213 0.335
104 H GLU 18 H GLU 18 -6.094 -6.547 1.255
105 HA GLU 18 HA GLU 18 -7.060 -4.427 -0.250
106 HB2 GLU 18 1HB GLU 18 -8.993 -4.410 1.462
107 HB3 GLU 18 2HB GLU 18 -8.728 -5.868 0.524
108 HG2 GLU 18 1HG GLU 18 -7.450 -5.645 3.212
109 HG3 GLU 18 2HG GLU 18 -9.182 -5.959 3.112
110 H GLU 19 H GLU 19 -5.640 -4.425 2.952
111 HA GLU 19 HA GLU 19 -6.330 -1.734 3.588
112 HB2 GLU 19 1HB GLU 19 -4.131 -3.505 4.674
113 HB3 GLU 19 2HB GLU 19 -4.599 -1.957 5.363
114 HG2 GLU 19 1HG GLU 19 -6.448 -4.323 5.095
115 HG3 GLU 19 2HG GLU 19 -5.524 -3.940 6.545
116 H CYS 20 H CYS 20 -3.577 -3.290 2.015
117 HA CYS 20 HA CYS 20 -1.901 -1.048 1.763
118 HB2 CYS 20 2HB CYS 20 -1.022 -3.204 1.221
119 HB3 CYS 20 1HB CYS 20 -2.259 -3.480 0.003
120 H GLU 21 H GLU 21 -4.214 -2.333 -0.672
121 HA GLU 21 HA GLU 21 -3.986 -0.175 -2.454
122 HB2 GLU 21 1HB GLU 21 -6.057 -0.966 -3.458
123 HB3 GLU 21 2HB GLU 21 -5.029 -2.331 -3.057
124 HG2 GLU 21 1HG GLU 21 -6.373 -2.836 -1.124
125 HG3 GLU 21 2HG GLU 21 -7.342 -1.388 -1.373
126 H ARG 22 H ARG 22 -6.148 -0.761 0.226
127 HA ARG 22 HA ARG 22 -7.848 1.418 0.113
128 HB2 ARG 22 1HB ARG 22 -7.933 -0.530 1.692
129 HB3 ARG 22 2HB ARG 22 -6.628 0.209 2.604
130 HG2 ARG 22 1HG ARG 22 -8.053 2.099 3.156
131 HG3 ARG 22 2HG ARG 22 -9.362 1.409 2.186
132 HD2 ARG 22 1HD ARG 22 -9.216 -0.639 3.652
133 HD3 ARG 22 2HD ARG 22 -8.123 0.273 4.690
134 HE ARG 22 HE ARG 22 -10.558 1.673 4.262
135 HH11 ARG 22 1HH1 ARG 22 -9.137 -0.977 6.068
136 HH12 ARG 22 2HH1 ARG 22 -10.301 -0.883 7.358
137 HH21 ARG 22 1HH2 ARG 22 -12.101 1.781 5.950
138 HH22 ARG 22 2HH2 ARG 22 -11.968 0.695 7.298
139 H LEU 23 H LEU 23 -4.682 1.168 1.706
140 HA LEU 23 HA LEU 23 -4.498 3.799 2.645
141 HB2 LEU 23 1HB LEU 23 -3.029 1.906 3.315
142 HB3 LEU 23 2HB LEU 23 -2.258 1.964 1.746
143 HG LEU 23 HG LEU 23 -2.203 4.386 3.539
144 HD11 LEU 23 1HD1 LEU 23 -0.281 2.056 3.658
145 HD12 LEU 23 2HD1 LEU 23 -1.422 2.525 4.919
146 HD13 LEU 23 3HD1 LEU 23 -0.092 3.601 4.494
147 HD21 LEU 23 1HD2 LEU 23 -0.113 4.834 2.349
148 HD22 LEU 23 2HD2 LEU 23 -1.447 4.628 1.216
149 HD23 LEU 23 3HD2 LEU 23 -0.286 3.324 1.456
150 H CYS 24 H CYS 24 -3.428 2.330 -0.401
151 HA CYS 24 HA CYS 24 -2.355 4.605 -1.619
152 HB2 CYS 24 2HB CYS 24 -3.785 2.270 -2.913
153 HB3 CYS 24 1HB CYS 24 -2.739 3.417 -3.746
154 H ARG 25 H ARG 25 -5.694 3.476 -1.384
155 HA ARG 25 HA ARG 25 -6.741 5.403 -3.224
156 HB2 ARG 25 1HB ARG 25 -8.095 3.677 -1.135
157 HB3 ARG 25 2HB ARG 25 -8.970 4.741 -2.230
158 HG2 ARG 25 1HG ARG 25 -7.259 2.379 -3.002
159 HG3 ARG 25 2HG ARG 25 -9.020 2.479 -3.071
160 HD2 ARG 25 1HD ARG 25 -7.078 4.148 -4.681
161 HD3 ARG 25 2HD ARG 25 -8.019 2.786 -5.286
162 HE ARG 25 HE ARG 25 -10.025 4.103 -4.920
163 HH11 ARG 25 1HH1 ARG 25 -6.989 5.867 -4.881
164 HH12 ARG 25 2HH1 ARG 25 -7.727 7.389 -5.263
165 HH21 ARG 25 1HH2 ARG 25 -10.974 6.112 -5.457
166 HH22 ARG 25 2HH2 ARG 25 -9.972 7.523 -5.611
167 H LYS 26 H LYS 26 -6.132 5.315 0.215
168 HA LYS 26 HA LYS 26 -7.591 7.667 0.880
169 HB2 LYS 26 1HB LYS 26 -6.873 5.982 2.561
170 HB3 LYS 26 2HB LYS 26 -5.198 6.443 2.289
171 HG2 LYS 26 1HG LYS 26 -6.074 7.459 4.324
172 HG3 LYS 26 2HG LYS 26 -5.664 8.692 3.129
173 HD2 LYS 26 1HD LYS 26 -8.029 8.869 2.494
174 HD3 LYS 26 2HD LYS 26 -8.445 7.627 3.678
175 HE2 LYS 26 1HE LYS 26 -7.190 10.304 4.314
176 HE3 LYS 26 2HE LYS 26 -8.902 9.913 4.489
177 HZ1 LYS 26 1HZ LYS 26 -6.645 8.679 5.974
178 HZ2 LYS 26 2HZ LYS 26 -8.251 8.164 6.078
179 HZ3 LYS 26 3HZ LYS 26 -7.827 9.713 6.603
180 H LEU 27 H LEU 27 -4.197 7.061 0.028
181 HA LEU 27 HA LEU 27 -3.434 9.822 0.214
182 HB2 LEU 27 1HB LEU 27 -2.049 7.490 -1.125
183 HB3 LEU 27 2HB LEU 27 -1.337 9.077 -0.890
184 HG LEU 27 HG LEU 27 -2.124 7.120 1.279
185 HD11 LEU 27 1HD1 LEU 27 -0.089 6.503 0.089
186 HD12 LEU 27 2HD1 LEU 27 0.275 7.029 1.732
187 HD13 LEU 27 3HD1 LEU 27 0.579 8.110 0.370
188 HD21 LEU 27 1HD2 LEU 27 -0.903 9.876 1.535
189 HD22 LEU 27 2HD2 LEU 27 -1.139 8.724 2.849
190 HD23 LEU 27 3HD2 LEU 27 -2.535 9.411 2.021
191 H GLY 28 H GLY 28 -4.567 7.705 -2.328
192 HA2 GLY 28 1HA GLY 28 -5.582 8.386 -4.330
193 HA3 GLY 28 2HA GLY 28 -4.906 9.994 -4.107
194 H VAL 29 H VAL 29 -3.278 6.849 -4.087
195 HA VAL 29 HA VAL 29 -1.735 7.677 -6.466
196 HB VAL 29 HB VAL 29 -0.672 6.105 -4.096
197 HG11 VAL 29 1HG1 VAL 29 0.404 5.454 -6.179
198 HG12 VAL 29 2HG1 VAL 29 1.524 6.375 -5.177
199 HG13 VAL 29 3HG1 VAL 29 0.743 7.143 -6.560
200 HG21 VAL 29 1HG2 VAL 29 -0.111 8.964 -4.909
201 HG22 VAL 29 2HG2 VAL 29 0.680 8.091 -3.595
202 HG23 VAL 29 3HG2 VAL 29 -1.045 8.446 -3.504
203 H THR 30 H THR 30 -1.305 6.077 -7.980
204 HA THR 30 HA THR 30 -2.962 3.673 -7.763
205 HB THR 30 HB THR 30 -1.497 4.750 -10.188
206 HG1 THR 30 1HG THR 30 -4.183 5.081 -10.241
207 HG21 THR 30 1HG2 THR 30 -3.085 3.375 -11.459
208 HG22 THR 30 2HG2 THR 30 -3.796 2.793 -9.954
209 HG23 THR 30 3HG2 THR 30 -2.129 2.379 -10.361
210 H ASN 31 H ASN 31 0.384 4.674 -8.034
211 HA ASN 31 HA ASN 31 1.397 2.063 -8.699
212 HB2 ASN 31 1HB ASN 31 2.825 4.577 -7.782
213 HB3 ASN 31 2HB ASN 31 3.636 3.107 -8.315
214 HD21 ASN 31 1HD2 ASN 31 3.246 5.671 -11.058
215 HD22 ASN 31 2HD2 ASN 31 3.732 5.807 -9.407
216 H CYS 32 H CYS 32 1.152 0.507 -7.227
217 HA CYS 32 HA CYS 32 2.372 0.847 -4.593
218 HB2 CYS 32 2HB CYS 32 -0.482 -0.132 -4.945
219 HB3 CYS 32 1HB CYS 32 0.417 -0.077 -3.432
220 H ARG 33 H ARG 33 2.740 -1.217 -3.531
221 HA ARG 33 HA ARG 33 2.334 -3.652 -5.106
222 HB2 ARG 33 1HB ARG 33 4.591 -2.701 -5.713
223 HB3 ARG 33 2HB ARG 33 5.059 -2.863 -4.026
224 HG2 ARG 33 1HG ARG 33 5.938 -4.705 -5.331
225 HG3 ARG 33 2HG ARG 33 4.744 -5.295 -4.175
226 HD2 ARG 33 1HD ARG 33 4.494 -6.349 -6.382
227 HD3 ARG 33 2HD ARG 33 3.065 -5.419 -5.929
228 HE ARG 33 HE ARG 33 5.126 -4.441 -7.809
229 HH11 ARG 33 1HH1 ARG 33 1.782 -4.790 -6.853
230 HH12 ARG 33 2HH1 ARG 33 1.166 -3.885 -8.199
231 HH21 ARG 33 1HH2 ARG 33 4.327 -3.248 -9.587
232 HH22 ARG 33 2HH2 ARG 33 2.617 -2.995 -9.751
233 H VAL 34 H VAL 34 2.339 -5.562 -3.790
234 HA VAL 34 HA VAL 34 2.172 -4.975 -0.899
235 HB VAL 34 HB VAL 34 0.582 -6.795 -0.675
236 HG11 VAL 34 1HG1 VAL 34 -0.213 -4.934 -2.919
237 HG12 VAL 34 2HG1 VAL 34 -0.301 -4.575 -1.194
238 HG13 VAL 34 3HG1 VAL 34 -1.317 -5.841 -1.882
239 HG21 VAL 34 1HG2 VAL 34 1.376 -8.311 -2.393
240 HG22 VAL 34 2HG2 VAL 34 0.898 -7.179 -3.657
241 HG23 VAL 34 3HG2 VAL 34 -0.331 -7.959 -2.662
242 H HIS 35 H HIS 35 3.054 -6.407 0.572
243 HA HIS 35 HA HIS 35 4.535 -8.748 -0.419
244 HB2 HIS 35 1HB HIS 35 5.716 -6.809 1.594
245 HB3 HIS 35 2HB HIS 35 6.504 -8.203 0.871
246 HD1 HIS 35 HD1 HIS 35 7.711 -7.834 -1.327
247 HD2 HIS 35 HD2 HIS 35 5.462 -4.560 -0.119
248 HE1 HIS 35 HE1 HIS 35 8.407 -5.945 -2.830
249 HE2 HIS 35 HE2 HIS 35 7.226 -3.925 -1.887
250 H CYS 36 H CYS 36 4.006 -10.488 0.831
251 HA CYS 36 HA CYS 36 3.447 -10.016 3.681
252 HB2 CYS 36 2HB CYS 36 1.761 -11.743 1.841
253 HB3 CYS 36 1HB CYS 36 1.604 -11.693 3.595
254 H GLY 37 H GLY 37 5.247 -10.888 4.479
255 HA2 GLY 37 1HA GLY 37 6.788 -12.474 5.080
256 HA3 GLY 37 2HA GLY 37 5.701 -13.691 4.418
Start of MODEL 4
1 H1 ALA 1 1H ALA 1 -0.276 -8.400 11.932
2 H2 ALA 1 2H ALA 1 -0.742 -9.998 11.636
3 H3 ALA 1 3H ALA 1 -0.976 -8.814 10.450
4 HA ALA 1 HA ALA 1 1.631 -9.786 11.459
5 HB1 ALA 1 1HB ALA 1 0.474 -11.406 10.023
6 HB2 ALA 1 2HB ALA 1 1.913 -10.758 9.242
7 HB3 ALA 1 3HB ALA 1 0.316 -10.179 8.765
8 HA PRO 2 HA PRO 2 3.147 -5.926 9.876
9 HB2 PRO 2 2HB PRO 2 5.762 -6.444 9.684
10 HB3 PRO 2 1HB PRO 2 4.953 -6.451 11.256
11 HG2 PRO 2 2HG PRO 2 5.690 -8.772 9.502
12 HG3 PRO 2 1HG PRO 2 5.912 -8.582 11.252
13 HD2 PRO 2 2HD PRO 2 3.818 -9.963 10.132
14 HD3 PRO 2 1HD PRO 2 3.732 -9.164 11.715
15 H CYS 3 H CYS 3 1.879 -7.358 7.843
16 HA CYS 3 HA CYS 3 3.489 -7.815 5.576
17 HB2 CYS 3 2HB CYS 3 0.562 -7.080 5.818
18 HB3 CYS 3 1HB CYS 3 1.339 -7.527 4.300
19 H GLU 4 H GLU 4 3.685 -6.458 3.662
20 HA GLU 4 HA GLU 4 4.108 -3.684 4.559
21 HB2 GLU 4 1HB GLU 4 5.765 -5.471 2.781
22 HB3 GLU 4 2HB GLU 4 6.062 -3.746 2.962
23 HG2 GLU 4 1HG GLU 4 6.602 -3.986 5.259
24 HG3 GLU 4 2HG GLU 4 6.002 -5.643 5.297
25 H CYS 5 H CYS 5 3.471 -2.056 3.369
26 HA CYS 5 HA CYS 5 2.354 -2.556 0.684
27 HB2 CYS 5 2HB CYS 5 0.681 -1.788 2.351
28 HB3 CYS 5 1HB CYS 5 1.660 -0.361 2.665
29 H ASP 6 H ASP 6 3.079 -1.257 -0.973
30 HA ASP 6 HA ASP 6 5.334 0.541 -0.323
31 HB2 ASP 6 1HB ASP 6 6.023 -1.492 -1.555
32 HB3 ASP 6 2HB ASP 6 4.882 -1.093 -2.832
33 H VAL 7 H VAL 7 5.412 2.503 -1.356
34 HA VAL 7 HA VAL 7 3.203 3.254 -3.136
35 HB VAL 7 HB VAL 7 4.099 4.953 -0.785
36 HG11 VAL 7 1HG1 VAL 7 2.184 6.377 -1.395
37 HG12 VAL 7 2HG1 VAL 7 1.876 5.351 -2.797
38 HG13 VAL 7 3HG1 VAL 7 3.375 6.276 -2.693
39 HG21 VAL 7 1HG2 VAL 7 2.833 3.047 0.048
40 HG22 VAL 7 2HG2 VAL 7 1.548 3.360 -1.121
41 HG23 VAL 7 3HG2 VAL 7 1.864 4.516 0.174
42 H ASN 8 H ASN 8 4.461 3.476 -4.920
43 HA ASN 8 HA ASN 8 5.865 4.425 -6.423
44 HB2 ASN 8 1HB ASN 8 4.834 6.523 -5.625
45 HB3 ASN 8 2HB ASN 8 6.060 6.647 -4.369
46 HD21 ASN 8 1HD2 ASN 8 6.863 7.752 -8.197
47 HD22 ASN 8 2HD2 ASN 8 5.413 6.906 -7.783
48 H GLY 9 H GLY 9 6.895 3.058 -3.701
49 HA2 GLY 9 1HA GLY 9 9.244 2.131 -3.979
50 HA3 GLY 9 2HA GLY 9 9.735 3.817 -4.031
51 H GLU 10 H GLU 10 7.702 4.553 -1.983
52 HA GLU 10 HA GLU 10 9.336 4.054 0.330
53 HB2 GLU 10 1HB GLU 10 6.615 5.376 0.121
54 HB3 GLU 10 2HB GLU 10 7.632 5.366 1.556
55 HG2 GLU 10 1HG GLU 10 9.395 6.533 0.151
56 HG3 GLU 10 2HG GLU 10 8.135 6.759 -1.063
57 H THR 11 H THR 11 8.806 2.822 2.153
58 HA THR 11 HA THR 11 6.780 0.743 1.625
59 HB THR 11 HB THR 11 9.303 0.466 3.283
60 HG1 THR 11 1HG THR 11 8.976 0.486 0.617
61 HG21 THR 11 1HG2 THR 11 8.838 -1.951 3.110
62 HG22 THR 11 2HG2 THR 11 7.342 -1.596 2.247
63 HG23 THR 11 3HG2 THR 11 7.526 -1.100 3.930
64 H TYR 12 H TYR 12 5.268 0.370 3.086
65 HA TYR 12 HA TYR 12 5.421 1.572 5.768
66 HB2 TYR 12 2HB TYR 12 3.037 1.561 3.880
67 HB3 TYR 12 1HB TYR 12 2.960 2.042 5.571
68 HD1 TYR 12 1HD TYR 12 3.789 4.208 6.282
69 HD2 TYR 12 2HD TYR 12 4.171 2.982 2.219
70 HE1 TYR 12 1HE TYR 12 4.324 6.520 5.638
71 HE2 TYR 12 2HE TYR 12 4.711 5.290 1.569
72 HH TYR 12 HH TYR 12 4.461 7.529 2.341
73 H THR 13 H THR 13 3.564 0.538 7.148
74 HA THR 13 HA THR 13 3.508 -2.354 6.564
75 HB THR 13 HB THR 13 3.119 -2.573 9.092
76 HG1 THR 13 1HG THR 13 3.845 -0.800 10.333
77 HG21 THR 13 1HG2 THR 13 5.509 -2.465 9.607
78 HG22 THR 13 2HG2 THR 13 5.791 -1.494 8.162
79 HG23 THR 13 3HG2 THR 13 5.251 -3.168 8.009
80 H VAL 14 H VAL 14 1.626 -3.380 6.510
81 HA VAL 14 HA VAL 14 -0.830 -2.099 7.449
82 HB VAL 14 HB VAL 14 -2.012 -2.756 5.349
83 HG11 VAL 14 1HG1 VAL 14 0.250 -0.797 4.927
84 HG12 VAL 14 2HG1 VAL 14 -1.315 -0.437 5.656
85 HG13 VAL 14 3HG1 VAL 14 -1.222 -0.902 3.958
86 HG21 VAL 14 1HG2 VAL 14 -0.468 -4.472 4.566
87 HG22 VAL 14 2HG2 VAL 14 0.779 -3.253 4.292
88 HG23 VAL 14 3HG2 VAL 14 -0.695 -3.240 3.325
89 H SER 15 H SER 15 -2.535 -3.621 7.818
90 HA SER 15 HA SER 15 -1.666 -6.089 8.834
91 HB2 SER 15 1HB SER 15 -3.708 -4.793 9.577
92 HB3 SER 15 2HB SER 15 -4.528 -5.382 8.131
93 HG SER 15 HG SER 15 -3.263 -7.218 9.848
94 H SER 16 H SER 16 -2.927 -5.186 5.690
95 HA SER 16 HA SER 16 -1.996 -7.580 4.496
96 HB2 SER 16 1HB SER 16 -4.016 -8.542 5.499
97 HB3 SER 16 2HB SER 16 -5.006 -7.296 4.741
98 HG SER 16 HG SER 16 -5.141 -9.010 3.391
99 H SER 17 H SER 17 -3.011 -7.745 2.167
100 HA SER 17 HA SER 17 -2.152 -5.445 0.803
101 HB2 SER 17 1HB SER 17 -3.781 -7.785 -0.225
102 HB3 SER 17 2HB SER 17 -2.892 -6.632 -1.222
103 HG SER 17 HG SER 17 -1.981 -8.840 -0.031
104 H GLU 18 H GLU 18 -5.363 -6.571 1.714
105 HA GLU 18 HA GLU 18 -6.928 -4.784 0.236
106 HB2 GLU 18 1HB GLU 18 -7.451 -5.825 3.042
107 HB3 GLU 18 2HB GLU 18 -8.645 -5.066 2.003
108 HG2 GLU 18 1HG GLU 18 -9.047 -7.378 1.873
109 HG3 GLU 18 2HG GLU 18 -8.250 -6.942 0.360
110 H GLU 19 H GLU 19 -5.416 -4.464 3.404
111 HA GLU 19 HA GLU 19 -6.310 -1.851 3.991
112 HB2 GLU 19 1HB GLU 19 -5.306 -3.593 5.579
113 HB3 GLU 19 2HB GLU 19 -3.733 -3.108 4.965
114 HG2 GLU 19 1HG GLU 19 -4.126 -1.976 7.033
115 HG3 GLU 19 2HG GLU 19 -4.206 -0.791 5.730
116 H CYS 20 H CYS 20 -3.408 -3.136 2.412
117 HA CYS 20 HA CYS 20 -2.011 -0.743 2.019
118 HB2 CYS 20 2HB CYS 20 -0.963 -2.875 1.557
119 HB3 CYS 20 1HB CYS 20 -2.121 -3.217 0.277
120 H GLU 21 H GLU 21 -4.283 -2.359 -0.222
121 HA GLU 21 HA GLU 21 -4.263 -0.351 -2.182
122 HB2 GLU 21 1HB GLU 21 -6.353 -2.422 -1.495
123 HB3 GLU 21 2HB GLU 21 -6.473 -1.352 -2.886
124 HG2 GLU 21 1HG GLU 21 -4.197 -2.269 -3.582
125 HG3 GLU 21 2HG GLU 21 -4.466 -3.525 -2.372
126 H ARG 22 H ARG 22 -6.179 -0.764 0.720
127 HA ARG 22 HA ARG 22 -8.043 1.290 0.370
128 HB2 ARG 22 1HB ARG 22 -8.109 -0.386 2.187
129 HB3 ARG 22 2HB ARG 22 -6.699 0.358 2.922
130 HG2 ARG 22 1HG ARG 22 -8.004 2.426 3.274
131 HG3 ARG 22 2HG ARG 22 -9.424 1.615 2.600
132 HD2 ARG 22 1HD ARG 22 -9.253 -0.097 4.361
133 HD3 ARG 22 2HD ARG 22 -7.872 0.758 5.044
134 HE ARG 22 HE ARG 22 -10.331 2.292 4.814
135 HH11 ARG 22 1HH1 ARG 22 -8.203 0.379 6.825
136 HH12 ARG 22 2HH1 ARG 22 -8.964 0.856 8.311
137 HH21 ARG 22 1HH2 ARG 22 -11.309 2.962 6.769
138 HH22 ARG 22 2HH2 ARG 22 -10.728 2.339 8.284
139 H LEU 23 H LEU 23 -4.789 1.330 1.785
140 HA LEU 23 HA LEU 23 -4.660 4.078 2.359
141 HB2 LEU 23 1HB LEU 23 -3.086 2.439 3.278
142 HB3 LEU 23 2HB LEU 23 -2.431 2.149 1.676
143 HG LEU 23 HG LEU 23 -1.638 4.510 1.609
144 HD11 LEU 23 1HD1 LEU 23 -1.585 5.824 3.664
145 HD12 LEU 23 2HD1 LEU 23 -2.520 4.581 4.496
146 HD13 LEU 23 3HD1 LEU 23 -3.242 5.490 3.167
147 HD21 LEU 23 1HD2 LEU 23 0.225 4.206 3.162
148 HD22 LEU 23 2HD2 LEU 23 -0.121 2.721 2.280
149 HD23 LEU 23 3HD2 LEU 23 -0.642 2.891 3.956
150 H CYS 24 H CYS 24 -3.637 2.242 -0.507
151 HA CYS 24 HA CYS 24 -2.503 4.266 -2.015
152 HB2 CYS 24 2HB CYS 24 -4.191 1.951 -3.008
153 HB3 CYS 24 1HB CYS 24 -3.128 2.932 -4.012
154 H ARG 25 H ARG 25 -5.889 3.189 -2.085
155 HA ARG 25 HA ARG 25 -6.725 5.173 -3.935
156 HB2 ARG 25 1HB ARG 25 -8.256 3.327 -2.097
157 HB3 ARG 25 2HB ARG 25 -9.046 4.419 -3.230
158 HG2 ARG 25 1HG ARG 25 -8.056 3.298 -5.107
159 HG3 ARG 25 2HG ARG 25 -7.048 2.312 -4.047
160 HD2 ARG 25 1HD ARG 25 -8.969 1.149 -3.194
161 HD3 ARG 25 2HD ARG 25 -10.063 2.246 -4.037
162 HE ARG 25 HE ARG 25 -9.770 1.035 -5.953
163 HH11 ARG 25 1HH1 ARG 25 -7.218 0.141 -3.723
164 HH12 ARG 25 2HH1 ARG 25 -6.715 -1.232 -4.660
165 HH21 ARG 25 1HH2 ARG 25 -9.088 -0.756 -7.183
166 HH22 ARG 25 2HH2 ARG 25 -7.752 -1.721 -6.632
167 H LYS 26 H LYS 26 -6.630 5.015 -0.429
168 HA LYS 26 HA LYS 26 -8.245 7.261 0.109
169 HB2 LYS 26 1HB LYS 26 -7.599 5.672 1.859
170 HB3 LYS 26 2HB LYS 26 -5.912 6.136 1.685
171 HG2 LYS 26 1HG LYS 26 -6.901 7.158 3.658
172 HG3 LYS 26 2HG LYS 26 -6.436 8.389 2.483
173 HD2 LYS 26 1HD LYS 26 -8.781 8.543 1.735
174 HD3 LYS 26 2HD LYS 26 -9.237 7.319 2.923
175 HE2 LYS 26 1HE LYS 26 -8.532 8.794 4.735
176 HE3 LYS 26 2HE LYS 26 -8.015 10.008 3.564
177 HZ1 LYS 26 1HZ LYS 26 -10.799 9.045 3.929
178 HZ2 LYS 26 2HZ LYS 26 -10.300 10.221 2.822
179 HZ3 LYS 26 3HZ LYS 26 -10.187 10.521 4.483
180 H LEU 27 H LEU 27 -4.746 6.948 -0.403
181 HA LEU 27 HA LEU 27 -4.253 9.769 -0.205
182 HB2 LEU 27 1HB LEU 27 -2.539 7.554 -1.356
183 HB3 LEU 27 2HB LEU 27 -1.998 9.196 -1.053
184 HG LEU 27 HG LEU 27 -2.887 7.216 1.058
185 HD11 LEU 27 1HD1 LEU 27 -0.722 6.635 0.071
186 HD12 LEU 27 2HD1 LEU 27 -0.537 7.194 1.733
187 HD13 LEU 27 3HD1 LEU 27 -0.130 8.267 0.393
188 HD21 LEU 27 1HD2 LEU 27 -2.087 8.895 2.666
189 HD22 LEU 27 2HD2 LEU 27 -3.434 9.500 1.703
190 HD23 LEU 27 3HD2 LEU 27 -1.788 10.018 1.338
191 H GLY 28 H GLY 28 -5.162 7.556 -2.702
192 HA2 GLY 28 1HA GLY 28 -6.110 8.177 -4.768
193 HA3 GLY 28 2HA GLY 28 -5.360 9.761 -4.619
194 H VAL 29 H VAL 29 -3.310 7.137 -3.909
195 HA VAL 29 HA VAL 29 -1.807 7.666 -6.368
196 HB VAL 29 HB VAL 29 -0.552 7.890 -4.286
197 HG11 VAL 29 1HG1 VAL 29 -0.117 5.996 -2.811
198 HG12 VAL 29 2HG1 VAL 29 -1.167 4.972 -3.788
199 HG13 VAL 29 3HG1 VAL 29 -1.845 6.334 -2.894
200 HG21 VAL 29 1HG2 VAL 29 1.334 6.383 -4.798
201 HG22 VAL 29 2HG2 VAL 29 0.670 7.136 -6.248
202 HG23 VAL 29 3HG2 VAL 29 0.287 5.455 -5.875
203 H THR 30 H THR 30 -1.569 6.198 -7.944
204 HA THR 30 HA THR 30 -2.900 3.608 -7.657
205 HB THR 30 HB THR 30 -2.639 3.422 -10.102
206 HG1 THR 30 1HG THR 30 -1.034 4.528 -10.916
207 HG21 THR 30 1HG2 THR 30 -4.620 4.580 -9.224
208 HG22 THR 30 2HG2 THR 30 -4.106 5.277 -10.761
209 HG23 THR 30 3HG2 THR 30 -3.741 6.110 -9.250
210 H ASN 31 H ASN 31 0.261 5.018 -8.372
211 HA ASN 31 HA ASN 31 1.562 2.512 -8.803
212 HB2 ASN 31 1HB ASN 31 2.629 5.296 -8.310
213 HB3 ASN 31 2HB ASN 31 3.686 3.905 -8.524
214 HD21 ASN 31 1HD2 ASN 31 3.243 3.680 -11.980
215 HD22 ASN 31 2HD2 ASN 31 3.812 2.911 -10.537
216 H CYS 32 H CYS 32 1.001 1.263 -7.054
217 HA CYS 32 HA CYS 32 2.776 1.542 -4.773
218 HB2 CYS 32 2HB CYS 32 0.987 1.299 -3.111
219 HB3 CYS 32 1HB CYS 32 0.769 2.773 -4.043
220 H ARG 33 H ARG 33 3.094 -0.477 -3.704
221 HA ARG 33 HA ARG 33 2.167 -2.782 -5.310
222 HB2 ARG 33 1HB ARG 33 4.916 -2.377 -4.107
223 HB3 ARG 33 2HB ARG 33 4.385 -3.794 -4.998
224 HG2 ARG 33 1HG ARG 33 4.405 -2.692 -7.032
225 HG3 ARG 33 2HG ARG 33 4.274 -1.097 -6.289
226 HD2 ARG 33 1HD ARG 33 6.523 -1.613 -7.257
227 HD3 ARG 33 2HD ARG 33 6.543 -1.166 -5.551
228 HE ARG 33 HE ARG 33 6.411 -4.001 -5.969
229 HH11 ARG 33 1HH1 ARG 33 8.575 -1.257 -5.817
230 HH12 ARG 33 2HH1 ARG 33 9.954 -2.206 -5.377
231 HH21 ARG 33 1HH2 ARG 33 8.210 -5.258 -5.352
232 HH22 ARG 33 2HH2 ARG 33 9.747 -4.490 -5.100
233 H VAL 34 H VAL 34 1.841 -4.740 -4.229
234 HA VAL 34 HA VAL 34 1.657 -4.500 -1.292
235 HB VAL 34 HB VAL 34 -0.151 -6.173 -1.373
236 HG11 VAL 34 1HG1 VAL 34 -1.893 -4.751 -2.339
237 HG12 VAL 34 2HG1 VAL 34 -0.661 -3.805 -3.177
238 HG13 VAL 34 3HG1 VAL 34 -0.728 -3.800 -1.415
239 HG21 VAL 34 1HG2 VAL 34 -1.184 -6.795 -3.524
240 HG22 VAL 34 2HG2 VAL 34 0.476 -7.376 -3.395
241 HG23 VAL 34 3HG2 VAL 34 0.113 -5.956 -4.377
242 H HIS 35 H HIS 35 2.749 -5.914 -0.068
243 HA HIS 35 HA HIS 35 3.183 -8.605 -1.041
244 HB2 HIS 35 1HB HIS 35 5.626 -8.544 -0.269
245 HB3 HIS 35 2HB HIS 35 5.251 -7.798 -1.810
246 HD1 HIS 35 HD1 HIS 35 7.275 -7.233 1.002
247 HD2 HIS 35 HD2 HIS 35 4.832 -4.790 -1.311
248 HE1 HIS 35 HE1 HIS 35 8.151 -4.900 1.323
249 HE2 HIS 35 HE2 HIS 35 6.805 -3.485 -0.265
250 H CYS 36 H CYS 36 2.496 -9.891 0.474
251 HA CYS 36 HA CYS 36 2.730 -9.123 3.301
252 HB2 CYS 36 2HB CYS 36 0.532 -8.355 2.673
253 HB3 CYS 36 1HB CYS 36 0.179 -9.863 1.841
254 H GLY 37 H GLY 37 4.092 -10.713 3.870
255 HA2 GLY 37 1HA GLY 37 3.557 -13.116 4.749
256 HA3 GLY 37 2HA GLY 37 3.554 -13.465 3.022
Start of MODEL 5
1 H1 ALA 1 1H ALA 1 -1.863 -11.674 10.271
2 H2 ALA 1 2H ALA 1 -1.269 -13.230 9.994
3 H3 ALA 1 3H ALA 1 -1.751 -12.265 8.694
4 HA ALA 1 HA ALA 1 0.494 -11.632 10.510
5 HB1 ALA 1 1HB ALA 1 0.540 -12.769 7.707
6 HB2 ALA 1 2HB ALA 1 0.993 -13.620 9.185
7 HB3 ALA 1 3HB ALA 1 1.951 -12.249 8.629
8 HA PRO 2 HA PRO 2 -0.047 -7.581 8.705
9 HB2 PRO 2 2HB PRO 2 2.389 -6.514 9.243
10 HB3 PRO 2 1HB PRO 2 1.169 -6.775 10.497
11 HG2 PRO 2 2HG PRO 2 3.530 -8.486 9.769
12 HG3 PRO 2 1HG PRO 2 2.970 -7.980 11.377
13 HD2 PRO 2 2HD PRO 2 2.408 -10.425 10.368
14 HD3 PRO 2 1HD PRO 2 1.271 -9.555 11.419
15 H CYS 3 H CYS 3 0.620 -6.372 6.905
16 HA CYS 3 HA CYS 3 2.295 -7.869 5.001
17 HB2 CYS 3 2HB CYS 3 -0.126 -6.124 4.572
18 HB3 CYS 3 1HB CYS 3 0.970 -6.532 3.259
19 H GLU 4 H GLU 4 3.412 -6.596 3.407
20 HA GLU 4 HA GLU 4 4.350 -3.982 4.401
21 HB2 GLU 4 1HB GLU 4 5.990 -5.959 4.247
22 HB3 GLU 4 2HB GLU 4 5.804 -5.847 2.513
23 HG2 GLU 4 1HG GLU 4 6.685 -3.576 2.545
24 HG3 GLU 4 2HG GLU 4 6.861 -3.667 4.301
25 H CYS 5 H CYS 5 4.394 -2.292 2.856
26 HA CYS 5 HA CYS 5 3.313 -2.904 0.209
27 HB2 CYS 5 2HB CYS 5 2.174 -0.909 2.174
28 HB3 CYS 5 1HB CYS 5 1.748 -0.962 0.472
29 H ASP 6 H ASP 6 3.915 -1.540 -1.392
30 HA ASP 6 HA ASP 6 5.773 0.651 -0.702
31 HB2 ASP 6 1HB ASP 6 6.930 -1.015 -2.010
32 HB3 ASP 6 2HB ASP 6 5.602 -1.113 -3.164
33 H VAL 7 H VAL 7 5.322 2.651 -1.542
34 HA VAL 7 HA VAL 7 3.009 2.974 -3.306
35 HB VAL 7 HB VAL 7 3.322 4.517 -0.710
36 HG11 VAL 7 1HG1 VAL 7 1.136 5.497 -1.280
37 HG12 VAL 7 2HG1 VAL 7 1.154 4.631 -2.816
38 HG13 VAL 7 3HG1 VAL 7 2.361 5.875 -2.491
39 HG21 VAL 7 1HG2 VAL 7 2.557 2.243 -0.252
40 HG22 VAL 7 2HG2 VAL 7 1.270 2.419 -1.447
41 HG23 VAL 7 3HG2 VAL 7 1.254 3.400 0.018
42 H ASN 8 H ASN 8 4.046 3.865 -4.976
43 HA ASN 8 HA ASN 8 5.075 5.421 -6.258
44 HB2 ASN 8 1HB ASN 8 3.881 7.156 -5.124
45 HB3 ASN 8 2HB ASN 8 4.930 7.050 -3.715
46 HD21 ASN 8 1HD2 ASN 8 7.372 9.180 -4.972
47 HD22 ASN 8 2HD2 ASN 8 6.888 8.086 -3.721
48 H GLY 9 H GLY 9 6.577 4.445 -3.297
49 HA2 GLY 9 1HA GLY 9 9.036 3.787 -4.060
50 HA3 GLY 9 2HA GLY 9 9.175 5.538 -3.950
51 H GLU 10 H GLU 10 7.003 5.264 -1.751
52 HA GLU 10 HA GLU 10 8.870 4.872 0.465
53 HB2 GLU 10 1HB GLU 10 6.010 5.879 0.380
54 HB3 GLU 10 2HB GLU 10 6.948 5.709 1.855
55 HG2 GLU 10 1HG GLU 10 6.948 8.007 1.169
56 HG3 GLU 10 2HG GLU 10 8.571 7.347 0.990
57 H THR 11 H THR 11 8.506 3.327 2.127
58 HA THR 11 HA THR 11 6.625 1.172 1.385
59 HB THR 11 HB THR 11 9.211 0.916 2.955
60 HG1 THR 11 1HG THR 11 8.713 0.990 0.303
61 HG21 THR 11 1HG2 THR 11 7.516 -0.758 3.619
62 HG22 THR 11 2HG2 THR 11 8.852 -1.507 2.747
63 HG23 THR 11 3HG2 THR 11 7.320 -1.222 1.925
64 H TYR 12 H TYR 12 5.216 0.434 2.871
65 HA TYR 12 HA TYR 12 5.276 1.515 5.608
66 HB2 TYR 12 2HB TYR 12 2.798 1.335 3.857
67 HB3 TYR 12 1HB TYR 12 2.872 1.951 5.508
68 HD1 TYR 12 1HD TYR 12 3.813 4.171 5.965
69 HD2 TYR 12 2HD TYR 12 3.535 2.685 1.981
70 HE1 TYR 12 1HE TYR 12 4.190 6.439 5.096
71 HE2 TYR 12 2HE TYR 12 3.911 4.951 1.108
72 HH TYR 12 HH TYR 12 3.759 7.228 1.758
73 H THR 13 H THR 13 3.970 0.206 7.112
74 HA THR 13 HA THR 13 3.502 -2.541 6.135
75 HB THR 13 HB THR 13 3.623 -3.198 8.577
76 HG1 THR 13 1HG THR 13 3.377 -1.159 9.526
77 HG21 THR 13 1HG2 THR 13 5.491 -3.629 7.057
78 HG22 THR 13 2HG2 THR 13 6.080 -3.198 8.664
79 HG23 THR 13 3HG2 THR 13 6.126 -2.010 7.360
80 H VAL 14 H VAL 14 1.500 -3.368 6.306
81 HA VAL 14 HA VAL 14 -0.568 -1.776 7.679
82 HB VAL 14 HB VAL 14 -2.104 -2.101 5.782
83 HG11 VAL 14 1HG1 VAL 14 -1.098 -0.505 4.213
84 HG12 VAL 14 2HG1 VAL 14 0.478 -0.766 4.960
85 HG13 VAL 14 3HG1 VAL 14 -0.826 -0.024 5.888
86 HG21 VAL 14 1HG2 VAL 14 -1.157 -4.151 4.865
87 HG22 VAL 14 2HG2 VAL 14 0.287 -3.277 4.352
88 HG23 VAL 14 3HG2 VAL 14 -1.274 -2.913 3.613
89 H SER 15 H SER 15 -2.729 -3.114 7.504
90 HA SER 15 HA SER 15 -2.387 -5.549 8.864
91 HB2 SER 15 1HB SER 15 -4.428 -4.262 9.147
92 HB3 SER 15 2HB SER 15 -4.811 -4.416 7.434
93 HG SER 15 HG SER 15 -5.250 -6.555 7.714
94 H SER 16 H SER 16 -4.093 -5.247 5.754
95 HA SER 16 HA SER 16 -2.617 -7.547 4.699
96 HB2 SER 16 1HB SER 16 -5.646 -7.441 4.687
97 HB3 SER 16 2HB SER 16 -4.613 -8.792 4.218
98 HG SER 16 HG SER 16 -5.411 -9.165 6.276
99 H SER 17 H SER 17 -3.822 -7.990 2.376
100 HA SER 17 HA SER 17 -3.062 -5.984 0.652
101 HB2 SER 17 1HB SER 17 -5.286 -7.986 0.158
102 HB3 SER 17 2HB SER 17 -4.299 -7.179 -1.065
103 HG SER 17 HG SER 17 -2.461 -8.233 -0.018
104 H GLU 18 H GLU 18 -6.186 -6.508 2.168
105 HA GLU 18 HA GLU 18 -7.800 -4.671 0.877
106 HB2 GLU 18 1HB GLU 18 -7.775 -5.094 3.872
107 HB3 GLU 18 2HB GLU 18 -9.143 -4.628 2.873
108 HG2 GLU 18 1HG GLU 18 -9.343 -6.793 1.959
109 HG3 GLU 18 2HG GLU 18 -7.766 -7.285 2.579
110 H GLU 19 H GLU 19 -6.044 -4.124 3.908
111 HA GLU 19 HA GLU 19 -6.454 -1.373 4.077
112 HB2 GLU 19 1HB GLU 19 -5.615 -2.974 5.877
113 HB3 GLU 19 2HB GLU 19 -4.026 -2.831 5.139
114 HG2 GLU 19 1HG GLU 19 -4.155 -1.349 7.016
115 HG3 GLU 19 2HG GLU 19 -4.101 -0.389 5.537
116 H CYS 20 H CYS 20 -4.022 -3.260 2.418
117 HA CYS 20 HA CYS 20 -2.157 -1.227 1.904
118 HB2 CYS 20 2HB CYS 20 -1.928 -3.772 1.593
119 HB3 CYS 20 1HB CYS 20 -2.685 -3.521 0.024
120 H GLU 21 H GLU 21 -4.627 -2.567 -0.341
121 HA GLU 21 HA GLU 21 -4.233 -0.643 -2.348
122 HB2 GLU 21 1HB GLU 21 -6.396 -1.349 -3.243
123 HB3 GLU 21 2HB GLU 21 -5.414 -2.729 -2.792
124 HG2 GLU 21 1HG GLU 21 -6.726 -3.074 -0.806
125 HG3 GLU 21 2HG GLU 21 -7.640 -1.597 -1.109
126 H ARG 22 H ARG 22 -6.453 -0.763 0.374
127 HA ARG 22 HA ARG 22 -7.889 1.553 -0.017
128 HB2 ARG 22 1HB ARG 22 -6.955 0.062 2.420
129 HB3 ARG 22 2HB ARG 22 -7.889 1.525 2.566
130 HG2 ARG 22 1HG ARG 22 -8.770 -0.942 1.095
131 HG3 ARG 22 2HG ARG 22 -9.283 -0.483 2.719
132 HD2 ARG 22 1HD ARG 22 -10.305 1.548 1.837
133 HD3 ARG 22 2HD ARG 22 -9.756 1.139 0.212
134 HE ARG 22 HE ARG 22 -11.195 -0.985 0.670
135 HH11 ARG 22 1HH1 ARG 22 -11.946 2.274 1.697
136 HH12 ARG 22 2HH1 ARG 22 -13.660 2.060 1.564
137 HH21 ARG 22 1HH2 ARG 22 -13.436 -1.287 0.520
138 HH22 ARG 22 2HH2 ARG 22 -14.516 0.016 0.915
139 H LEU 23 H LEU 23 -4.697 1.111 1.480
140 HA LEU 23 HA LEU 23 -4.325 3.802 2.255
141 HB2 LEU 23 1HB LEU 23 -3.009 1.792 3.033
142 HB3 LEU 23 2HB LEU 23 -2.177 1.810 1.493
143 HG LEU 23 HG LEU 23 -2.109 4.195 3.351
144 HD11 LEU 23 1HD1 LEU 23 -1.290 2.275 4.617
145 HD12 LEU 23 2HD1 LEU 23 0.031 3.367 4.203
146 HD13 LEU 23 3HD1 LEU 23 -0.187 1.866 3.303
147 HD21 LEU 23 1HD2 LEU 23 -0.276 3.256 1.138
148 HD22 LEU 23 2HD2 LEU 23 0.003 4.662 2.166
149 HD23 LEU 23 3HD2 LEU 23 -1.380 4.631 1.073
150 H CYS 24 H CYS 24 -3.420 2.003 -0.671
151 HA CYS 24 HA CYS 24 -2.123 3.999 -2.099
152 HB2 CYS 24 2HB CYS 24 -4.061 1.995 -3.291
153 HB3 CYS 24 1HB CYS 24 -2.700 2.764 -4.101
154 H ARG 25 H ARG 25 -5.580 3.206 -2.082
155 HA ARG 25 HA ARG 25 -6.332 5.373 -3.788
156 HB2 ARG 25 1HB ARG 25 -7.989 3.521 -2.052
157 HB3 ARG 25 2HB ARG 25 -8.653 4.639 -3.239
158 HG2 ARG 25 1HG ARG 25 -7.701 3.443 -5.049
159 HG3 ARG 25 2HG ARG 25 -6.658 2.509 -3.978
160 HD2 ARG 25 1HD ARG 25 -8.471 1.123 -4.753
161 HD3 ARG 25 2HD ARG 25 -8.650 1.414 -3.025
162 HE ARG 25 HE ARG 25 -10.207 3.336 -4.113
163 HH11 ARG 25 1HH1 ARG 25 -9.996 -0.113 -4.686
164 HH12 ARG 25 2HH1 ARG 25 -11.687 -0.293 -5.029
165 HH21 ARG 25 1HH2 ARG 25 -12.453 3.095 -4.545
166 HH22 ARG 25 2HH2 ARG 25 -13.088 1.529 -4.938
167 H LYS 26 H LYS 26 -5.780 5.061 -0.424
168 HA LYS 26 HA LYS 26 -7.403 7.240 0.470
169 HB2 LYS 26 1HB LYS 26 -6.527 5.397 1.941
170 HB3 LYS 26 2HB LYS 26 -4.918 6.085 1.772
171 HG2 LYS 26 1HG LYS 26 -5.715 8.165 2.823
172 HG3 LYS 26 2HG LYS 26 -7.310 7.432 3.027
173 HD2 LYS 26 1HD LYS 26 -6.201 5.610 4.360
174 HD3 LYS 26 2HD LYS 26 -4.710 6.551 4.291
175 HE2 LYS 26 1HE LYS 26 -5.878 6.943 6.391
176 HE3 LYS 26 2HE LYS 26 -5.846 8.415 5.419
177 HZ1 LYS 26 1HZ LYS 26 -8.143 6.541 5.574
178 HZ2 LYS 26 2HZ LYS 26 -8.110 8.022 4.755
179 HZ3 LYS 26 3HZ LYS 26 -8.016 7.985 6.439
180 H LEU 27 H LEU 27 -3.953 6.857 -0.312
181 HA LEU 27 HA LEU 27 -3.424 9.684 -0.111
182 HB2 LEU 27 1HB LEU 27 -1.778 7.450 -1.317
183 HB3 LEU 27 2HB LEU 27 -1.213 9.092 -1.069
184 HG LEU 27 HG LEU 27 -1.972 7.119 1.099
185 HD11 LEU 27 1HD1 LEU 27 0.708 8.265 0.311
186 HD12 LEU 27 2HD1 LEU 27 0.160 6.613 0.023
187 HD13 LEU 27 3HD1 LEU 27 0.398 7.188 1.673
188 HD21 LEU 27 1HD2 LEU 27 -2.573 9.364 1.791
189 HD22 LEU 27 2HD2 LEU 27 -0.987 9.970 1.313
190 HD23 LEU 27 3HD2 LEU 27 -1.132 8.839 2.658
191 H GLY 28 H GLY 28 -4.590 7.519 -2.498
192 HA2 GLY 28 1HA GLY 28 -5.684 8.173 -4.467
193 HA3 GLY 28 2HA GLY 28 -4.868 9.728 -4.390
194 H VAL 29 H VAL 29 -2.811 7.083 -3.860
195 HA VAL 29 HA VAL 29 -1.670 7.449 -6.557
196 HB VAL 29 HB VAL 29 -0.290 6.316 -4.119
197 HG11 VAL 29 1HG1 VAL 29 1.770 6.727 -5.392
198 HG12 VAL 29 2HG1 VAL 29 0.806 7.296 -6.755
199 HG13 VAL 29 3HG1 VAL 29 0.689 5.616 -6.234
200 HG21 VAL 29 1HG2 VAL 29 -0.907 8.634 -3.671
201 HG22 VAL 29 2HG2 VAL 29 -0.177 9.141 -5.195
202 HG23 VAL 29 3HG2 VAL 29 0.836 8.498 -3.902
203 H THR 30 H THR 30 -2.215 5.865 -7.893
204 HA THR 30 HA THR 30 -3.048 3.265 -7.004
205 HB THR 30 HB THR 30 -2.438 4.180 -9.830
206 HG1 THR 30 1HG THR 30 -4.810 4.355 -8.250
207 HG21 THR 30 1HG2 THR 30 -4.201 1.944 -8.793
208 HG22 THR 30 2HG2 THR 30 -2.645 1.740 -9.598
209 HG23 THR 30 3HG2 THR 30 -4.016 2.407 -10.485
210 H ASN 31 H ASN 31 -0.097 4.727 -8.055
211 HA ASN 31 HA ASN 31 1.362 2.371 -8.682
212 HB2 ASN 31 1HB ASN 31 2.095 4.617 -9.400
213 HB3 ASN 31 2HB ASN 31 2.359 5.076 -7.722
214 HD21 ASN 31 1HD2 ASN 31 5.522 3.994 -9.461
215 HD22 ASN 31 2HD2 ASN 31 4.229 5.041 -9.927
216 H CYS 32 H CYS 32 0.952 0.867 -7.043
217 HA CYS 32 HA CYS 32 2.716 1.131 -4.768
218 HB2 CYS 32 2HB CYS 32 0.991 0.596 -3.095
219 HB3 CYS 32 1HB CYS 32 0.682 2.141 -3.876
220 H ARG 33 H ARG 33 2.920 -0.916 -3.579
221 HA ARG 33 HA ARG 33 2.173 -3.289 -5.150
222 HB2 ARG 33 1HB ARG 33 4.925 -2.565 -4.112
223 HB3 ARG 33 2HB ARG 33 4.485 -4.200 -4.585
224 HG2 ARG 33 1HG ARG 33 4.454 -1.781 -6.390
225 HG3 ARG 33 2HG ARG 33 5.689 -3.042 -6.365
226 HD2 ARG 33 1HD ARG 33 3.938 -4.704 -6.939
227 HD3 ARG 33 2HD ARG 33 2.773 -3.387 -7.068
228 HE ARG 33 HE ARG 33 4.654 -2.589 -8.787
229 HH11 ARG 33 1HH1 ARG 33 3.117 -5.699 -8.350
230 HH12 ARG 33 2HH1 ARG 33 3.275 -6.157 -10.015
231 HH21 ARG 33 1HH2 ARG 33 4.851 -3.185 -10.990
232 HH22 ARG 33 2HH2 ARG 33 4.238 -4.721 -11.521
233 H VAL 34 H VAL 34 2.024 -5.213 -3.959
234 HA VAL 34 HA VAL 34 1.794 -4.858 -1.037
235 HB VAL 34 HB VAL 34 0.324 -6.865 -2.775
236 HG11 VAL 34 1HG1 VAL 34 -0.030 -6.138 0.136
237 HG12 VAL 34 2HG1 VAL 34 0.668 -7.634 -0.481
238 HG13 VAL 34 3HG1 VAL 34 -1.032 -7.270 -0.772
239 HG21 VAL 34 1HG2 VAL 34 -0.695 -4.296 -1.549
240 HG22 VAL 34 2HG2 VAL 34 -1.679 -5.494 -2.391
241 HG23 VAL 34 3HG2 VAL 34 -0.437 -4.598 -3.268
242 H HIS 35 H HIS 35 3.030 -6.117 0.227
243 HA HIS 35 HA HIS 35 4.239 -8.563 -0.866
244 HB2 HIS 35 1HB HIS 35 5.905 -6.763 -1.102
245 HB3 HIS 35 2HB HIS 35 5.715 -6.340 0.592
246 HD1 HIS 35 HD1 HIS 35 7.902 -6.936 1.610
247 HD2 HIS 35 HD2 HIS 35 6.487 -9.929 -0.909
248 HE1 HIS 35 HE1 HIS 35 9.519 -8.844 1.849
249 HE2 HIS 35 HE2 HIS 35 8.689 -10.614 0.262
250 H CYS 36 H CYS 36 3.147 -9.991 0.407
251 HA CYS 36 HA CYS 36 3.008 -9.456 3.311
252 HB2 CYS 36 2HB CYS 36 1.164 -11.162 1.608
253 HB3 CYS 36 1HB CYS 36 1.011 -10.902 3.342
254 H GLY 37 H GLY 37 3.808 -10.941 4.696
255 HA2 GLY 37 1HA GLY 37 4.245 -13.406 5.024
256 HA3 GLY 37 2HA GLY 37 5.119 -13.304 3.498
Start of MODEL 6
1 H1 ALA 1 1H ALA 1 3.079 -11.247 11.982
2 H2 ALA 1 2H ALA 1 2.890 -12.918 11.830
3 H3 ALA 1 3H ALA 1 1.532 -11.916 11.881
4 HA ALA 1 HA ALA 1 3.583 -11.947 9.755
5 HB1 ALA 1 1HB ALA 1 1.855 -12.919 8.335
6 HB2 ALA 1 2HB ALA 1 0.728 -12.932 9.694
7 HB3 ALA 1 3HB ALA 1 2.169 -13.947 9.734
8 HA PRO 2 HA PRO 2 1.589 -7.902 9.202
9 HB2 PRO 2 2HB PRO 2 3.780 -6.505 8.641
10 HB3 PRO 2 1HB PRO 2 3.477 -7.051 10.295
11 HG2 PRO 2 2HG PRO 2 5.342 -8.172 8.241
12 HG3 PRO 2 1HG PRO 2 5.578 -7.995 9.990
13 HD2 PRO 2 2HD PRO 2 4.765 -10.339 8.660
14 HD3 PRO 2 1HD PRO 2 4.649 -10.039 10.405
15 H CYS 3 H CYS 3 2.041 -6.281 7.255
16 HA CYS 3 HA CYS 3 2.754 -7.718 4.808
17 HB2 CYS 3 2HB CYS 3 0.310 -7.858 4.936
18 HB3 CYS 3 1HB CYS 3 0.207 -6.108 5.142
19 H GLU 4 H GLU 4 3.306 -6.320 3.047
20 HA GLU 4 HA GLU 4 4.307 -3.712 3.988
21 HB2 GLU 4 1HB GLU 4 5.478 -5.479 1.825
22 HB3 GLU 4 2HB GLU 4 6.164 -3.982 2.440
23 HG2 GLU 4 1HG GLU 4 6.476 -5.032 4.630
24 HG3 GLU 4 2HG GLU 4 5.800 -6.534 4.003
25 H CYS 5 H CYS 5 3.862 -1.962 2.818
26 HA CYS 5 HA CYS 5 2.430 -2.256 0.262
27 HB2 CYS 5 2HB CYS 5 1.102 -1.579 2.443
28 HB3 CYS 5 1HB CYS 5 1.850 -0.012 2.186
29 H ASP 6 H ASP 6 3.541 -1.238 -1.335
30 HA ASP 6 HA ASP 6 5.702 0.580 -0.538
31 HB2 ASP 6 1HB ASP 6 5.485 -1.569 -2.638
32 HB3 ASP 6 2HB ASP 6 6.660 -0.285 -2.789
33 H VAL 7 H VAL 7 5.194 2.577 -1.011
34 HA VAL 7 HA VAL 7 3.640 3.178 -3.448
35 HB VAL 7 HB VAL 7 3.781 4.807 -0.894
36 HG11 VAL 7 1HG1 VAL 7 2.014 5.119 -3.327
37 HG12 VAL 7 2HG1 VAL 7 3.363 6.166 -2.881
38 HG13 VAL 7 3HG1 VAL 7 1.929 6.092 -1.856
39 HG21 VAL 7 1HG2 VAL 7 2.600 2.710 -0.497
40 HG22 VAL 7 2HG2 VAL 7 1.557 3.018 -1.885
41 HG23 VAL 7 3HG2 VAL 7 1.480 4.072 -0.474
42 H ASN 8 H ASN 8 4.748 4.218 -4.954
43 HA ASN 8 HA ASN 8 6.153 5.632 -6.033
44 HB2 ASN 8 1HB ASN 8 5.147 7.322 -4.519
45 HB3 ASN 8 2HB ASN 8 6.413 7.005 -3.341
46 HD21 ASN 8 1HD2 ASN 8 8.793 9.019 -4.881
47 HD22 ASN 8 2HD2 ASN 8 8.428 7.873 -3.636
48 H GLY 9 H GLY 9 7.171 3.491 -3.812
49 HA2 GLY 9 1HA GLY 9 9.387 2.490 -4.256
50 HA3 GLY 9 2HA GLY 9 10.034 4.124 -4.209
51 H GLU 10 H GLU 10 8.113 4.737 -1.963
52 HA GLU 10 HA GLU 10 9.887 3.890 0.168
53 HB2 GLU 10 1HB GLU 10 7.473 5.718 0.148
54 HB3 GLU 10 2HB GLU 10 8.384 5.328 1.601
55 HG2 GLU 10 1HG GLU 10 9.137 7.441 0.816
56 HG3 GLU 10 2HG GLU 10 10.414 6.266 0.514
57 H THR 11 H THR 11 9.029 2.955 2.171
58 HA THR 11 HA THR 11 6.984 0.931 1.520
59 HB THR 11 HB THR 11 9.336 0.668 3.415
60 HG1 THR 11 1HG THR 11 8.929 -0.025 0.700
61 HG21 THR 11 1HG2 THR 11 7.411 -0.736 4.051
62 HG22 THR 11 2HG2 THR 11 8.750 -1.720 3.455
63 HG23 THR 11 3HG2 THR 11 7.357 -1.405 2.421
64 H TYR 12 H TYR 12 5.206 1.036 2.640
65 HA TYR 12 HA TYR 12 5.260 1.931 5.453
66 HB2 TYR 12 2HB TYR 12 2.880 2.101 3.570
67 HB3 TYR 12 1HB TYR 12 3.016 2.796 5.184
68 HD1 TYR 12 1HD TYR 12 4.501 4.789 5.548
69 HD2 TYR 12 2HD TYR 12 3.725 3.252 1.649
70 HE1 TYR 12 1HE TYR 12 5.311 6.891 4.561
71 HE2 TYR 12 2HE TYR 12 4.525 5.353 0.657
72 HH TYR 12 HH TYR 12 4.820 7.698 1.281
73 H THR 13 H THR 13 4.040 0.570 6.899
74 HA THR 13 HA THR 13 3.496 -2.065 5.695
75 HB THR 13 HB THR 13 3.995 -2.906 8.104
76 HG1 THR 13 1HG THR 13 5.432 -0.433 8.127
77 HG21 THR 13 1HG2 THR 13 6.205 -1.858 6.324
78 HG22 THR 13 2HG2 THR 13 5.408 -3.425 6.184
79 HG23 THR 13 3HG2 THR 13 6.403 -3.064 7.595
80 H VAL 14 H VAL 14 1.712 -3.148 6.156
81 HA VAL 14 HA VAL 14 -0.261 -2.003 8.026
82 HB VAL 14 HB VAL 14 -2.071 -2.419 6.420
83 HG11 VAL 14 1HG1 VAL 14 -1.088 -0.184 6.468
84 HG12 VAL 14 2HG1 VAL 14 -1.608 -0.597 4.834
85 HG13 VAL 14 3HG1 VAL 14 0.103 -0.666 5.259
86 HG21 VAL 14 1HG2 VAL 14 -1.582 -2.960 4.071
87 HG22 VAL 14 2HG2 VAL 14 -1.051 -4.245 5.156
88 HG23 VAL 14 3HG2 VAL 14 0.128 -3.127 4.468
89 H SER 15 H SER 15 -2.207 -3.736 8.066
90 HA SER 15 HA SER 15 -0.907 -6.262 8.738
91 HB2 SER 15 1HB SER 15 -2.473 -5.113 10.352
92 HB3 SER 15 2HB SER 15 -3.789 -5.470 9.236
93 HG SER 15 HG SER 15 -3.165 -7.003 11.098
94 H SER 16 H SER 16 -3.684 -5.126 6.763
95 HA SER 16 HA SER 16 -3.738 -7.795 5.494
96 HB2 SER 16 1HB SER 16 -5.988 -5.769 5.564
97 HB3 SER 16 2HB SER 16 -6.083 -7.468 5.096
98 HG SER 16 HG SER 16 -5.723 -6.340 7.661
99 H SER 17 H SER 17 -3.815 -8.013 3.288
100 HA SER 17 HA SER 17 -2.656 -6.126 1.588
101 HB2 SER 17 1HB SER 17 -2.788 -8.514 1.009
102 HB3 SER 17 2HB SER 17 -4.544 -8.412 0.909
103 HG SER 17 HG SER 17 -3.966 -8.160 -1.142
104 H GLU 18 H GLU 18 -6.007 -6.771 2.425
105 HA GLU 18 HA GLU 18 -7.342 -5.054 0.701
106 HB2 GLU 18 1HB GLU 18 -8.299 -6.696 2.424
107 HB3 GLU 18 2HB GLU 18 -8.027 -5.451 3.628
108 HG2 GLU 18 1HG GLU 18 -9.773 -5.073 1.201
109 HG3 GLU 18 2HG GLU 18 -10.367 -5.636 2.759
110 H GLU 19 H GLU 19 -5.854 -4.429 3.842
111 HA GLU 19 HA GLU 19 -6.584 -1.711 4.020
112 HB2 GLU 19 1HB GLU 19 -4.421 -3.298 5.413
113 HB3 GLU 19 2HB GLU 19 -4.860 -1.656 5.851
114 HG2 GLU 19 1HG GLU 19 -7.140 -2.409 6.365
115 HG3 GLU 19 2HG GLU 19 -6.680 -4.057 5.940
116 H CYS 20 H CYS 20 -3.664 -3.317 2.780
117 HA CYS 20 HA CYS 20 -2.106 -1.018 2.343
118 HB2 CYS 20 2HB CYS 20 -1.044 -3.135 2.097
119 HB3 CYS 20 1HB CYS 20 -2.218 -3.670 0.900
120 H GLU 21 H GLU 21 -4.007 -2.772 -0.130
121 HA GLU 21 HA GLU 21 -3.897 -0.862 -2.136
122 HB2 GLU 21 1HB GLU 21 -6.086 -2.847 -1.470
123 HB3 GLU 21 2HB GLU 21 -6.038 -1.913 -2.961
124 HG2 GLU 21 1HG GLU 21 -3.794 -3.737 -2.111
125 HG3 GLU 21 2HG GLU 21 -5.165 -4.288 -3.070
126 H ARG 22 H ARG 22 -6.253 -1.240 0.456
127 HA ARG 22 HA ARG 22 -8.051 0.777 -0.169
128 HB2 ARG 22 1HB ARG 22 -8.435 -0.876 1.585
129 HB3 ARG 22 2HB ARG 22 -7.123 -0.204 2.541
130 HG2 ARG 22 1HG ARG 22 -8.393 1.887 2.792
131 HG3 ARG 22 2HG ARG 22 -9.716 1.177 1.859
132 HD2 ARG 22 1HD ARG 22 -9.995 -0.570 3.531
133 HD3 ARG 22 2HD ARG 22 -8.622 0.057 4.443
134 HE ARG 22 HE ARG 22 -10.490 2.119 4.150
135 HH11 ARG 22 1HH1 ARG 22 -10.185 -0.965 5.773
136 HH12 ARG 22 2HH1 ARG 22 -11.243 -0.527 7.075
137 HH21 ARG 22 1HH2 ARG 22 -11.891 2.696 5.845
138 HH22 ARG 22 2HH2 ARG 22 -12.226 1.556 7.114
139 H LEU 23 H LEU 23 -5.096 0.946 1.803
140 HA LEU 23 HA LEU 23 -5.290 3.648 2.530
141 HB2 LEU 23 1HB LEU 23 -3.757 2.136 3.656
142 HB3 LEU 23 2HB LEU 23 -2.858 1.885 2.172
143 HG LEU 23 HG LEU 23 -2.147 4.261 2.216
144 HD11 LEU 23 1HD1 LEU 23 -3.559 4.332 4.886
145 HD12 LEU 23 2HD1 LEU 23 -3.995 5.236 3.436
146 HD13 LEU 23 3HD1 LEU 23 -2.479 5.582 4.265
147 HD21 LEU 23 1HD2 LEU 23 -1.501 2.699 4.723
148 HD22 LEU 23 2HD2 LEU 23 -0.558 4.045 4.075
149 HD23 LEU 23 3HD2 LEU 23 -0.698 2.546 3.157
150 H CYS 24 H CYS 24 -3.393 2.123 -0.070
151 HA CYS 24 HA CYS 24 -2.349 4.493 -1.119
152 HB2 CYS 24 2HB CYS 24 -2.873 1.864 -2.520
153 HB3 CYS 24 1HB CYS 24 -1.825 3.147 -3.119
154 H ARG 25 H ARG 25 -5.388 2.829 -1.842
155 HA ARG 25 HA ARG 25 -6.020 4.585 -4.046
156 HB2 ARG 25 1HB ARG 25 -7.845 2.684 -2.547
157 HB3 ARG 25 2HB ARG 25 -8.219 3.489 -4.067
158 HG2 ARG 25 1HG ARG 25 -6.205 1.309 -3.563
159 HG3 ARG 25 2HG ARG 25 -7.629 1.264 -4.602
160 HD2 ARG 25 1HD ARG 25 -6.567 2.958 -6.062
161 HD3 ARG 25 2HD ARG 25 -5.128 2.904 -5.047
162 HE ARG 25 HE ARG 25 -5.775 1.127 -7.128
163 HH11 ARG 25 1HH1 ARG 25 -4.479 1.024 -3.867
164 HH12 ARG 25 2HH1 ARG 25 -3.518 -0.392 -4.163
165 HH21 ARG 25 1HH2 ARG 25 -4.507 -0.730 -7.507
166 HH22 ARG 25 2HH2 ARG 25 -3.540 -1.388 -6.220
167 H LYS 26 H LYS 26 -6.515 4.556 -0.611
168 HA LYS 26 HA LYS 26 -8.524 6.621 -0.609
169 HB2 LYS 26 1HB LYS 26 -8.219 4.904 1.222
170 HB3 LYS 26 2HB LYS 26 -6.749 5.748 1.689
171 HG2 LYS 26 1HG LYS 26 -8.022 7.747 2.217
172 HG3 LYS 26 2HG LYS 26 -9.506 6.978 1.651
173 HD2 LYS 26 1HD LYS 26 -9.454 6.877 4.057
174 HD3 LYS 26 2HD LYS 26 -9.219 5.247 3.423
175 HE2 LYS 26 1HE LYS 26 -7.683 5.614 5.244
176 HE3 LYS 26 2HE LYS 26 -6.774 5.522 3.738
177 HZ1 LYS 26 1HZ LYS 26 -6.652 7.936 3.704
178 HZ2 LYS 26 2HZ LYS 26 -6.000 7.333 5.141
179 HZ3 LYS 26 3HZ LYS 26 -7.539 8.026 5.140
180 H LEU 27 H LEU 27 -5.059 6.422 -0.595
181 HA LEU 27 HA LEU 27 -4.630 9.242 -0.155
182 HB2 LEU 27 1HB LEU 27 -2.797 7.134 -1.337
183 HB3 LEU 27 2HB LEU 27 -2.316 8.762 -0.898
184 HG LEU 27 HG LEU 27 -3.293 6.662 1.051
185 HD11 LEU 27 1HD1 LEU 27 -1.109 6.100 0.079
186 HD12 LEU 27 2HD1 LEU 27 -0.989 6.514 1.788
187 HD13 LEU 27 3HD1 LEU 27 -0.496 7.682 0.562
188 HD21 LEU 27 1HD2 LEU 27 -2.520 8.217 2.769
189 HD22 LEU 27 2HD2 LEU 27 -3.793 8.935 1.783
190 HD23 LEU 27 3HD2 LEU 27 -2.111 9.397 1.524
191 H GLY 28 H GLY 28 -5.081 7.048 -2.826
192 HA2 GLY 28 1HA GLY 28 -5.941 7.596 -4.932
193 HA3 GLY 28 2HA GLY 28 -5.559 9.285 -4.636
194 H VAL 29 H VAL 29 -3.204 6.802 -4.060
195 HA VAL 29 HA VAL 29 -1.571 7.900 -6.243
196 HB VAL 29 HB VAL 29 -0.646 6.180 -3.928
197 HG11 VAL 29 1HG1 VAL 29 1.583 7.032 -4.529
198 HG12 VAL 29 2HG1 VAL 29 0.877 7.895 -5.896
199 HG13 VAL 29 3HG1 VAL 29 0.844 6.131 -5.853
200 HG21 VAL 29 1HG2 VAL 29 0.180 8.248 -2.895
201 HG22 VAL 29 2HG2 VAL 29 -1.576 8.271 -3.069
202 HG23 VAL 29 3HG2 VAL 29 -0.568 9.191 -4.185
203 H THR 30 H THR 30 -0.804 6.622 -7.865
204 HA THR 30 HA THR 30 -2.139 4.047 -8.181
205 HB THR 30 HB THR 30 -0.499 5.596 -10.203
206 HG1 THR 30 1HG THR 30 -2.803 6.280 -9.168
207 HG21 THR 30 1HG2 THR 30 -1.717 4.238 -11.858
208 HG22 THR 30 2HG2 THR 30 -2.512 3.357 -10.552
209 HG23 THR 30 3HG2 THR 30 -0.765 3.226 -10.771
210 H ASN 31 H ASN 31 1.119 5.357 -7.854
211 HA ASN 31 HA ASN 31 2.402 2.921 -8.738
212 HB2 ASN 31 1HB ASN 31 4.517 4.085 -8.189
213 HB3 ASN 31 2HB ASN 31 3.477 5.043 -9.233
214 HD21 ASN 31 1HD2 ASN 31 4.264 7.688 -7.105
215 HD22 ASN 31 2HD2 ASN 31 4.479 6.959 -8.657
216 H CYS 32 H CYS 32 0.772 2.181 -6.764
217 HA CYS 32 HA CYS 32 2.503 1.723 -4.413
218 HB2 CYS 32 2HB CYS 32 0.540 2.890 -3.704
219 HB3 CYS 32 1HB CYS 32 -0.509 1.866 -4.681
220 H ARG 33 H ARG 33 2.726 -0.379 -3.673
221 HA ARG 33 HA ARG 33 1.560 -2.543 -5.305
222 HB2 ARG 33 1HB ARG 33 4.454 -2.295 -4.429
223 HB3 ARG 33 2HB ARG 33 3.755 -3.709 -5.205
224 HG2 ARG 33 1HG ARG 33 3.748 -1.005 -6.526
225 HG3 ARG 33 2HG ARG 33 5.114 -2.112 -6.656
226 HD2 ARG 33 1HD ARG 33 3.710 -2.382 -8.583
227 HD3 ARG 33 2HD ARG 33 3.586 -3.826 -7.582
228 HE ARG 33 HE ARG 33 1.526 -1.819 -7.186
229 HH11 ARG 33 1HH1 ARG 33 2.472 -4.772 -8.802
230 HH12 ARG 33 2HH1 ARG 33 0.843 -5.242 -9.176
231 HH21 ARG 33 1HH2 ARG 33 -0.629 -2.423 -7.677
232 HH22 ARG 33 2HH2 ARG 33 -0.927 -3.907 -8.531
233 H VAL 34 H VAL 34 1.193 -4.491 -4.156
234 HA VAL 34 HA VAL 34 1.381 -4.200 -1.225
235 HB VAL 34 HB VAL 34 -0.936 -4.186 -1.995
236 HG11 VAL 34 1HG1 VAL 34 -1.936 -6.159 -3.078
237 HG12 VAL 34 2HG1 VAL 34 -0.334 -6.885 -3.211
238 HG13 VAL 34 3HG1 VAL 34 -0.705 -5.400 -4.087
239 HG21 VAL 34 1HG2 VAL 34 -1.813 -6.005 -0.615
240 HG22 VAL 34 2HG2 VAL 34 -0.438 -5.226 0.167
241 HG23 VAL 34 3HG2 VAL 34 -0.233 -6.789 -0.627
242 H HIS 35 H HIS 35 2.254 -5.806 -0.037
243 HA HIS 35 HA HIS 35 2.830 -8.410 -1.240
244 HB2 HIS 35 1HB HIS 35 4.855 -7.105 -1.690
245 HB3 HIS 35 2HB HIS 35 4.944 -6.612 -0.006
246 HD1 HIS 35 HD1 HIS 35 6.026 -9.237 -2.322
247 HD2 HIS 35 HD2 HIS 35 5.675 -8.777 1.794
248 HE1 HIS 35 HE1 HIS 35 7.409 -11.075 -1.317
249 HE2 HIS 35 HE2 HIS 35 7.116 -10.837 1.172
250 H CYS 36 H CYS 36 1.536 -9.512 0.171
251 HA CYS 36 HA CYS 36 2.040 -9.140 3.059
252 HB2 CYS 36 2HB CYS 36 -0.422 -10.328 1.743
253 HB3 CYS 36 1HB CYS 36 -0.200 -10.037 3.462
254 H GLY 37 H GLY 37 3.602 -10.592 3.503
255 HA2 GLY 37 1HA GLY 37 4.360 -12.729 4.051
256 HA3 GLY 37 2HA GLY 37 3.037 -13.421 3.120
Start of MODEL 7
1 H1 ALA 1 1H ALA 1 -1.578 -10.270 12.162
2 H2 ALA 1 2H ALA 1 -1.226 -11.897 12.448
3 H3 ALA 1 3H ALA 1 -2.247 -11.465 11.174
4 HA ALA 1 HA ALA 1 0.628 -10.823 11.392
5 HB1 ALA 1 1HB ALA 1 0.934 -12.377 9.540
6 HB2 ALA 1 2HB ALA 1 -0.795 -12.729 9.528
7 HB3 ALA 1 3HB ALA 1 0.188 -13.195 10.916
8 HA PRO 2 HA PRO 2 -0.979 -7.621 8.622
9 HB2 PRO 2 2HB PRO 2 0.953 -5.815 9.025
10 HB3 PRO 2 1HB PRO 2 -0.247 -6.155 10.280
11 HG2 PRO 2 2HG PRO 2 2.580 -7.126 10.049
12 HG3 PRO 2 1HG PRO 2 1.705 -6.558 11.484
13 HD2 PRO 2 2HD PRO 2 2.071 -9.221 10.809
14 HD3 PRO 2 1HD PRO 2 0.781 -8.617 11.868
15 H CYS 3 H CYS 3 0.264 -6.230 6.897
16 HA CYS 3 HA CYS 3 2.306 -7.865 5.544
17 HB2 CYS 3 2HB CYS 3 -0.182 -6.643 4.334
18 HB3 CYS 3 1HB CYS 3 1.194 -7.156 3.364
19 H GLU 4 H GLU 4 3.126 -6.470 3.569
20 HA GLU 4 HA GLU 4 3.698 -3.754 4.563
21 HB2 GLU 4 1HB GLU 4 5.354 -5.570 2.788
22 HB3 GLU 4 2HB GLU 4 5.764 -3.902 3.166
23 HG2 GLU 4 1HG GLU 4 6.047 -4.440 5.492
24 HG3 GLU 4 2HG GLU 4 5.469 -6.085 5.221
25 H CYS 5 H CYS 5 4.049 -2.155 2.862
26 HA CYS 5 HA CYS 5 2.603 -2.642 0.371
27 HB2 CYS 5 2HB CYS 5 0.990 -1.834 2.157
28 HB3 CYS 5 1HB CYS 5 1.911 -0.337 2.217
29 H ASP 6 H ASP 6 3.341 -1.386 -1.284
30 HA ASP 6 HA ASP 6 5.597 0.426 -0.680
31 HB2 ASP 6 1HB ASP 6 6.140 -1.715 -1.951
32 HB3 ASP 6 2HB ASP 6 5.137 -1.109 -3.262
33 H VAL 7 H VAL 7 5.527 2.428 -1.582
34 HA VAL 7 HA VAL 7 3.294 3.182 -3.310
35 HB VAL 7 HB VAL 7 3.949 4.664 -0.739
36 HG11 VAL 7 1HG1 VAL 7 1.924 5.963 -1.241
37 HG12 VAL 7 2HG1 VAL 7 1.735 5.075 -2.753
38 HG13 VAL 7 3HG1 VAL 7 3.136 6.120 -2.514
39 HG21 VAL 7 1HG2 VAL 7 1.563 2.902 -1.332
40 HG22 VAL 7 2HG2 VAL 7 1.778 3.892 0.113
41 HG23 VAL 7 3HG2 VAL 7 2.867 2.542 -0.198
42 H ASN 8 H ASN 8 4.546 3.821 -4.997
43 HA ASN 8 HA ASN 8 5.904 5.134 -6.263
44 HB2 ASN 8 1HB ASN 8 4.600 6.939 -5.145
45 HB3 ASN 8 2HB ASN 8 5.809 7.006 -3.871
46 HD21 ASN 8 1HD2 ASN 8 6.484 8.747 -7.486
47 HD22 ASN 8 2HD2 ASN 8 5.163 7.659 -7.243
48 H GLY 9 H GLY 9 6.981 3.331 -3.924
49 HA2 GLY 9 1HA GLY 9 9.350 2.642 -4.199
50 HA3 GLY 9 2HA GLY 9 9.764 4.342 -4.039
51 H GLU 10 H GLU 10 7.683 4.693 -1.915
52 HA GLU 10 HA GLU 10 9.417 3.981 0.297
53 HB2 GLU 10 1HB GLU 10 8.350 6.201 0.209
54 HB3 GLU 10 2HB GLU 10 6.762 5.447 0.268
55 HG2 GLU 10 1HG GLU 10 7.409 6.353 2.440
56 HG3 GLU 10 2HG GLU 10 7.220 4.603 2.507
57 H THR 11 H THR 11 8.864 2.620 2.028
58 HA THR 11 HA THR 11 6.729 0.684 1.385
59 HB THR 11 HB THR 11 9.287 0.139 2.916
60 HG1 THR 11 1HG THR 11 9.086 0.560 0.376
61 HG21 THR 11 1HG2 THR 11 7.437 -1.377 3.484
62 HG22 THR 11 2HG2 THR 11 8.692 -2.221 2.579
63 HG23 THR 11 3HG2 THR 11 7.200 -1.736 1.774
64 H TYR 12 H TYR 12 5.078 0.807 2.731
65 HA TYR 12 HA TYR 12 5.537 1.462 5.574
66 HB2 TYR 12 2HB TYR 12 3.101 1.886 3.819
67 HB3 TYR 12 1HB TYR 12 3.066 2.053 5.567
68 HD1 TYR 12 1HD TYR 12 4.759 3.761 6.596
69 HD2 TYR 12 2HD TYR 12 3.590 3.750 2.497
70 HE1 TYR 12 1HE TYR 12 5.431 6.120 6.398
71 HE2 TYR 12 2HE TYR 12 4.267 6.104 2.293
72 HH TYR 12 HH TYR 12 6.175 7.679 4.527
73 H THR 13 H THR 13 3.886 0.382 7.048
74 HA THR 13 HA THR 13 3.336 -2.355 6.102
75 HB THR 13 HB THR 13 3.269 -2.854 8.648
76 HG1 THR 13 1HG THR 13 5.165 -1.097 9.290
77 HG21 THR 13 1HG2 THR 13 5.690 -3.260 8.713
78 HG22 THR 13 2HG2 THR 13 5.904 -2.216 7.308
79 HG23 THR 13 3HG2 THR 13 5.006 -3.725 7.157
80 H VAL 14 H VAL 14 1.312 -3.131 6.243
81 HA VAL 14 HA VAL 14 -0.771 -1.303 7.269
82 HB VAL 14 HB VAL 14 -2.184 -1.962 5.322
83 HG11 VAL 14 1HG1 VAL 14 -0.993 0.164 5.287
84 HG12 VAL 14 2HG1 VAL 14 -1.044 -0.535 3.669
85 HG13 VAL 14 3HG1 VAL 14 0.436 -0.627 4.622
86 HG21 VAL 14 1HG2 VAL 14 -1.085 -4.064 4.752
87 HG22 VAL 14 2HG2 VAL 14 0.380 -3.194 4.289
88 HG23 VAL 14 3HG2 VAL 14 -1.107 -2.982 3.359
89 H SER 15 H SER 15 -2.892 -2.376 7.547
90 HA SER 15 HA SER 15 -2.649 -4.568 9.277
91 HB2 SER 15 1HB SER 15 -4.447 -2.856 9.381
92 HB3 SER 15 2HB SER 15 -5.154 -3.537 7.919
93 HG SER 15 HG SER 15 -5.576 -5.433 9.028
94 H SER 16 H SER 16 -3.275 -4.437 5.829
95 HA SER 16 HA SER 16 -2.976 -7.254 5.540
96 HB2 SER 16 1HB SER 16 -5.288 -7.673 4.634
97 HB3 SER 16 2HB SER 16 -5.243 -7.352 6.369
98 HG SER 16 HG SER 16 -6.648 -5.869 5.914
99 H SER 17 H SER 17 -3.489 -7.965 3.269
100 HA SER 17 HA SER 17 -2.097 -6.468 1.393
101 HB2 SER 17 1HB SER 17 -4.249 -8.494 0.732
102 HB3 SER 17 2HB SER 17 -2.808 -8.103 -0.209
103 HG SER 17 HG SER 17 -1.542 -9.052 1.376
104 H GLU 18 H GLU 18 -5.601 -6.743 1.937
105 HA GLU 18 HA GLU 18 -6.364 -5.034 -0.186
106 HB2 GLU 18 1HB GLU 18 -8.553 -4.999 0.799
107 HB3 GLU 18 2HB GLU 18 -7.908 -6.622 1.001
108 HG2 GLU 18 1HG GLU 18 -7.400 -6.182 3.323
109 HG3 GLU 18 2HG GLU 18 -7.896 -4.501 3.147
110 H GLU 19 H GLU 19 -5.513 -4.501 3.186
111 HA GLU 19 HA GLU 19 -6.365 -1.824 3.373
112 HB2 GLU 19 1HB GLU 19 -5.795 -3.363 5.295
113 HB3 GLU 19 2HB GLU 19 -4.100 -3.093 4.922
114 HG2 GLU 19 1HG GLU 19 -4.753 -1.674 6.743
115 HG3 GLU 19 2HG GLU 19 -4.418 -0.682 5.325
116 H CYS 20 H CYS 20 -3.390 -3.308 2.221
117 HA CYS 20 HA CYS 20 -1.761 -1.056 1.958
118 HB2 CYS 20 2HB CYS 20 -0.819 -3.189 1.479
119 HB3 CYS 20 1HB CYS 20 -2.021 -3.527 0.241
120 H GLU 21 H GLU 21 -3.694 -2.430 -0.723
121 HA GLU 21 HA GLU 21 -3.420 -0.195 -2.396
122 HB2 GLU 21 1HB GLU 21 -5.379 -1.179 -3.634
123 HB3 GLU 21 2HB GLU 21 -4.039 -2.282 -3.374
124 HG2 GLU 21 1HG GLU 21 -5.535 -3.740 -2.606
125 HG3 GLU 21 2HG GLU 21 -5.666 -2.720 -1.178
126 H ARG 22 H ARG 22 -5.892 -1.083 -0.088
127 HA ARG 22 HA ARG 22 -7.747 0.939 -0.432
128 HB2 ARG 22 1HB ARG 22 -7.930 -1.058 1.063
129 HB3 ARG 22 2HB ARG 22 -6.850 -0.264 2.196
130 HG2 ARG 22 1HG ARG 22 -8.505 1.519 2.515
131 HG3 ARG 22 2HG ARG 22 -9.589 0.707 1.377
132 HD2 ARG 22 1HD ARG 22 -9.561 -1.292 2.843
133 HD3 ARG 22 2HD ARG 22 -8.567 -0.401 3.995
134 HE ARG 22 HE ARG 22 -11.194 0.680 3.268
135 HH11 ARG 22 1HH1 ARG 22 -9.072 -0.756 5.669
136 HH12 ARG 22 2HH1 ARG 22 -10.198 -0.536 6.972
137 HH21 ARG 22 1HH2 ARG 22 -12.664 0.974 4.983
138 HH22 ARG 22 2HH2 ARG 22 -12.242 0.450 6.581
139 H LEU 23 H LEU 23 -4.745 0.956 1.450
140 HA LEU 23 HA LEU 23 -5.048 3.559 2.533
141 HB2 LEU 23 1HB LEU 23 -3.483 1.933 3.489
142 HB3 LEU 23 2HB LEU 23 -2.543 1.945 2.009
143 HG LEU 23 HG LEU 23 -1.944 4.303 2.396
144 HD11 LEU 23 1HD1 LEU 23 -2.460 5.384 4.521
145 HD12 LEU 23 2HD1 LEU 23 -3.444 4.000 5.002
146 HD13 LEU 23 3HD1 LEU 23 -3.931 4.999 3.630
147 HD21 LEU 23 1HD2 LEU 23 -0.455 2.564 3.220
148 HD22 LEU 23 2HD2 LEU 23 -1.355 2.483 4.734
149 HD23 LEU 23 3HD2 LEU 23 -0.456 3.944 4.319
150 H CYS 24 H CYS 24 -3.251 2.320 -0.286
151 HA CYS 24 HA CYS 24 -2.325 4.774 -1.244
152 HB2 CYS 24 2HB CYS 24 -3.090 2.247 -2.716
153 HB3 CYS 24 1HB CYS 24 -2.326 3.626 -3.504
154 H ARG 25 H ARG 25 -5.442 3.192 -1.691
155 HA ARG 25 HA ARG 25 -6.516 5.068 -3.530
156 HB2 ARG 25 1HB ARG 25 -7.825 3.120 -1.619
157 HB3 ARG 25 2HB ARG 25 -8.730 4.086 -2.778
158 HG2 ARG 25 1HG ARG 25 -7.810 2.960 -4.616
159 HG3 ARG 25 2HG ARG 25 -6.492 2.288 -3.657
160 HD2 ARG 25 1HD ARG 25 -8.142 0.578 -4.191
161 HD3 ARG 25 2HD ARG 25 -8.072 0.872 -2.455
162 HE ARG 25 HE ARG 25 -10.104 2.450 -3.650
163 HH11 ARG 25 1HH1 ARG 25 -9.361 -0.833 -2.644
164 HH12 ARG 25 2HH1 ARG 25 -11.030 -1.284 -2.463
165 HH21 ARG 25 1HH2 ARG 25 -12.304 1.852 -3.374
166 HH22 ARG 25 2HH2 ARG 25 -12.691 0.235 -2.869
167 H LYS 26 H LYS 26 -6.376 4.878 -0.030
168 HA LYS 26 HA LYS 26 -8.061 7.082 0.553
169 HB2 LYS 26 1HB LYS 26 -7.176 5.294 2.171
170 HB3 LYS 26 2HB LYS 26 -5.676 6.204 2.202
171 HG2 LYS 26 1HG LYS 26 -7.763 8.050 2.726
172 HG3 LYS 26 2HG LYS 26 -8.079 6.624 3.709
173 HD2 LYS 26 1HD LYS 26 -6.743 7.960 5.086
174 HD3 LYS 26 2HD LYS 26 -5.601 6.801 4.405
175 HE2 LYS 26 1HE LYS 26 -4.612 8.995 4.341
176 HE3 LYS 26 2HE LYS 26 -4.985 8.497 2.692
177 HZ1 LYS 26 1HZ LYS 26 -5.615 10.791 3.075
178 HZ2 LYS 26 2HZ LYS 26 -6.611 10.341 4.363
179 HZ3 LYS 26 3HZ LYS 26 -6.996 9.856 2.790
180 H LEU 27 H LEU 27 -4.676 6.751 -0.294
181 HA LEU 27 HA LEU 27 -4.031 9.533 0.151
182 HB2 LEU 27 1HB LEU 27 -2.491 7.396 -1.339
183 HB3 LEU 27 2HB LEU 27 -1.862 8.958 -0.847
184 HG LEU 27 HG LEU 27 -2.745 6.754 1.030
185 HD11 LEU 27 1HD1 LEU 27 -0.686 6.197 -0.159
186 HD12 LEU 27 2HD1 LEU 27 -0.369 6.518 1.547
187 HD13 LEU 27 3HD1 LEU 27 0.024 7.736 0.331
188 HD21 LEU 27 1HD2 LEU 27 -3.099 8.978 1.992
189 HD22 LEU 27 2HD2 LEU 27 -1.427 9.405 1.632
190 HD23 LEU 27 3HD2 LEU 27 -1.780 8.132 2.799
191 H GLY 28 H GLY 28 -5.192 7.577 -2.471
192 HA2 GLY 28 1HA GLY 28 -6.217 8.421 -4.421
193 HA3 GLY 28 2HA GLY 28 -5.372 9.944 -4.190
194 H VAL 29 H VAL 29 -3.444 7.165 -3.799
195 HA VAL 29 HA VAL 29 -2.219 7.617 -6.444
196 HB VAL 29 HB VAL 29 -0.931 6.492 -3.940
197 HG11 VAL 29 1HG1 VAL 29 0.103 5.601 -5.945
198 HG12 VAL 29 2HG1 VAL 29 1.188 6.763 -5.182
199 HG13 VAL 29 3HG1 VAL 29 0.271 7.223 -6.616
200 HG21 VAL 29 1HG2 VAL 29 -0.640 9.231 -5.192
201 HG22 VAL 29 2HG2 VAL 29 0.293 8.621 -3.824
202 HG23 VAL 29 3HG2 VAL 29 -1.446 8.859 -3.666
203 H THR 30 H THR 30 -1.906 5.907 -7.793
204 HA THR 30 HA THR 30 -2.940 3.292 -6.924
205 HB THR 30 HB THR 30 -3.148 2.853 -9.415
206 HG1 THR 30 1HG THR 30 -2.303 4.315 -10.681
207 HG21 THR 30 1HG2 THR 30 -5.099 3.459 -8.055
208 HG22 THR 30 2HG2 THR 30 -5.208 4.173 -9.663
209 HG23 THR 30 3HG2 THR 30 -4.739 5.172 -8.288
210 H ASN 31 H ASN 31 -0.108 4.956 -7.844
211 HA ASN 31 HA ASN 31 1.321 2.674 -8.870
212 HB2 ASN 31 1HB ASN 31 2.303 5.411 -8.011
213 HB3 ASN 31 2HB ASN 31 3.323 4.174 -8.740
214 HD21 ASN 31 1HD2 ASN 31 2.014 6.624 -11.279
215 HD22 ASN 31 2HD2 ASN 31 2.736 6.828 -9.721
216 H CYS 32 H CYS 32 0.902 1.226 -7.184
217 HA CYS 32 HA CYS 32 2.737 1.458 -4.888
218 HB2 CYS 32 2HB CYS 32 -0.200 0.693 -4.764
219 HB3 CYS 32 1HB CYS 32 0.940 0.493 -3.438
220 H ARG 33 H ARG 33 2.590 -0.801 -3.680
221 HA ARG 33 HA ARG 33 2.037 -3.062 -5.410
222 HB2 ARG 33 1HB ARG 33 4.384 -2.354 -5.992
223 HB3 ARG 33 2HB ARG 33 4.845 -2.660 -4.323
224 HG2 ARG 33 1HG ARG 33 4.334 -5.011 -4.564
225 HG3 ARG 33 2HG ARG 33 3.708 -4.741 -6.192
226 HD2 ARG 33 1HD ARG 33 5.979 -3.948 -6.866
227 HD3 ARG 33 2HD ARG 33 6.566 -4.404 -5.264
228 HE ARG 33 HE ARG 33 5.453 -6.695 -6.107
229 HH11 ARG 33 1HH1 ARG 33 7.698 -4.501 -7.671
230 HH12 ARG 33 2HH1 ARG 33 8.424 -5.743 -8.637
231 HH21 ARG 33 1HH2 ARG 33 6.403 -8.313 -7.390
232 HH22 ARG 33 2HH2 ARG 33 7.694 -7.905 -8.481
233 H VAL 34 H VAL 34 1.960 -5.067 -4.209
234 HA VAL 34 HA VAL 34 1.663 -4.607 -1.302
235 HB VAL 34 HB VAL 34 0.236 -6.665 -3.018
236 HG11 VAL 34 1HG1 VAL 34 0.524 -7.391 -0.700
237 HG12 VAL 34 2HG1 VAL 34 -1.169 -7.034 -1.041
238 HG13 VAL 34 3HG1 VAL 34 -0.193 -5.883 -0.130
239 HG21 VAL 34 1HG2 VAL 34 -0.806 -4.065 -1.875
240 HG22 VAL 34 2HG2 VAL 34 -1.778 -5.286 -2.698
241 HG23 VAL 34 3HG2 VAL 34 -0.521 -4.418 -3.580
242 H HIS 35 H HIS 35 2.604 -6.054 0.126
243 HA HIS 35 HA HIS 35 3.957 -8.419 -0.946
244 HB2 HIS 35 1HB HIS 35 5.651 -6.651 -1.081
245 HB3 HIS 35 2HB HIS 35 5.394 -6.252 0.615
246 HD1 HIS 35 HD1 HIS 35 6.848 -7.463 2.266
247 HD2 HIS 35 HD2 HIS 35 6.783 -9.324 -1.454
248 HE1 HIS 35 HE1 HIS 35 8.542 -9.312 2.405
249 HE2 HIS 35 HE2 HIS 35 8.384 -10.510 0.197
250 H CYS 36 H CYS 36 3.035 -9.952 0.243
251 HA CYS 36 HA CYS 36 3.112 -9.671 3.181
252 HB2 CYS 36 2HB CYS 36 1.365 -11.509 1.507
253 HB3 CYS 36 1HB CYS 36 1.367 -11.413 3.266
254 H GLY 37 H GLY 37 5.032 -10.538 3.780
255 HA2 GLY 37 1HA GLY 37 5.801 -13.135 2.579
256 HA3 GLY 37 2HA GLY 37 6.966 -11.899 3.035
Start of MODEL 8
1 H1 ALA 1 1H ALA 1 1.516 -13.611 10.437
2 H2 ALA 1 2H ALA 1 2.463 -12.827 11.594
3 H3 ALA 1 3H ALA 1 2.887 -14.376 11.067
4 HA ALA 1 HA ALA 1 4.302 -12.689 10.092
5 HB1 ALA 1 1HB ALA 1 4.057 -13.397 7.759
6 HB2 ALA 1 2HB ALA 1 2.449 -14.033 8.118
7 HB3 ALA 1 3HB ALA 1 3.873 -14.759 8.865
8 HA PRO 2 HA PRO 2 1.859 -8.945 9.374
9 HB2 PRO 2 2HB PRO 2 3.923 -7.205 9.449
10 HB3 PRO 2 1HB PRO 2 3.254 -7.925 10.921
11 HG2 PRO 2 2HG PRO 2 5.699 -8.714 9.370
12 HG3 PRO 2 1HG PRO 2 5.495 -8.548 11.125
13 HD2 PRO 2 2HD PRO 2 5.407 -10.950 9.849
14 HD3 PRO 2 1HD PRO 2 4.494 -10.613 11.333
15 H CYS 3 H CYS 3 1.686 -7.448 7.620
16 HA CYS 3 HA CYS 3 3.186 -8.273 5.220
17 HB2 CYS 3 2HB CYS 3 0.342 -7.238 5.385
18 HB3 CYS 3 1HB CYS 3 1.192 -7.675 3.905
19 H GLU 4 H GLU 4 3.633 -6.646 3.666
20 HA GLU 4 HA GLU 4 3.808 -3.924 4.784
21 HB2 GLU 4 1HB GLU 4 5.603 -5.297 2.761
22 HB3 GLU 4 2HB GLU 4 5.774 -3.630 3.296
23 HG2 GLU 4 1HG GLU 4 6.356 -4.314 5.506
24 HG3 GLU 4 2HG GLU 4 5.928 -5.989 5.159
25 H CYS 5 H CYS 5 3.853 -2.216 3.107
26 HA CYS 5 HA CYS 5 2.424 -2.858 0.640
27 HB2 CYS 5 2HB CYS 5 0.686 -2.204 2.267
28 HB3 CYS 5 1HB CYS 5 1.546 -0.703 2.588
29 H ASP 6 H ASP 6 3.113 -1.638 -1.051
30 HA ASP 6 HA ASP 6 5.110 0.445 -0.468
31 HB2 ASP 6 1HB ASP 6 5.941 -1.679 -1.604
32 HB3 ASP 6 2HB ASP 6 4.962 -1.222 -2.995
33 H VAL 7 H VAL 7 4.879 2.376 -1.457
34 HA VAL 7 HA VAL 7 2.622 2.847 -3.257
35 HB VAL 7 HB VAL 7 3.093 4.459 -0.723
36 HG11 VAL 7 1HG1 VAL 7 0.848 4.587 -2.736
37 HG12 VAL 7 2HG1 VAL 7 2.154 5.760 -2.563
38 HG13 VAL 7 3HG1 VAL 7 0.979 5.552 -1.264
39 HG21 VAL 7 1HG2 VAL 7 0.993 3.498 0.127
40 HG22 VAL 7 2HG2 VAL 7 2.225 2.263 -0.123
41 HG23 VAL 7 3HG2 VAL 7 0.911 2.442 -1.284
42 H ASN 8 H ASN 8 3.800 3.600 -4.971
43 HA ASN 8 HA ASN 8 4.980 5.088 -6.238
44 HB2 ASN 8 1HB ASN 8 3.828 6.870 -5.057
45 HB3 ASN 8 2HB ASN 8 4.917 6.728 -3.684
46 HD21 ASN 8 1HD2 ASN 8 7.416 8.749 -5.051
47 HD22 ASN 8 2HD2 ASN 8 6.945 7.663 -3.792
48 H GLY 9 H GLY 9 6.203 3.238 -3.907
49 HA2 GLY 9 1HA GLY 9 8.515 2.481 -4.120
50 HA3 GLY 9 2HA GLY 9 8.988 4.166 -4.293
51 H GLU 10 H GLU 10 6.823 4.664 -2.138
52 HA GLU 10 HA GLU 10 8.585 4.498 0.145
53 HB2 GLU 10 1HB GLU 10 5.663 5.299 0.106
54 HB3 GLU 10 2HB GLU 10 6.872 5.724 1.311
55 HG2 GLU 10 1HG GLU 10 6.801 6.675 -1.550
56 HG3 GLU 10 2HG GLU 10 6.354 7.615 -0.129
57 H THR 11 H THR 11 8.379 3.045 1.873
58 HA THR 11 HA THR 11 6.439 0.873 1.405
59 HB THR 11 HB THR 11 9.176 0.679 2.687
60 HG1 THR 11 1HG THR 11 8.197 0.314 0.088
61 HG21 THR 11 1HG2 THR 11 7.141 -1.476 2.047
62 HG22 THR 11 2HG2 THR 11 7.595 -0.928 3.661
63 HG23 THR 11 3HG2 THR 11 8.777 -1.754 2.646
64 H TYR 12 H TYR 12 4.869 0.846 2.783
65 HA TYR 12 HA TYR 12 5.302 1.605 5.603
66 HB2 TYR 12 2HB TYR 12 2.861 1.785 3.824
67 HB3 TYR 12 1HB TYR 12 2.743 1.880 5.575
68 HD1 TYR 12 1HD TYR 12 3.061 3.925 6.669
69 HD2 TYR 12 2HD TYR 12 4.362 3.519 2.636
70 HE1 TYR 12 1HE TYR 12 3.537 6.331 6.585
71 HE2 TYR 12 2HE TYR 12 4.838 5.929 2.541
72 HH TYR 12 HH TYR 12 4.784 7.921 5.383
73 H THR 13 H THR 13 3.621 0.412 7.049
74 HA THR 13 HA THR 13 3.554 -2.427 6.257
75 HB THR 13 HB THR 13 3.430 -2.792 8.815
76 HG1 THR 13 1HG THR 13 4.695 -0.942 9.825
77 HG21 THR 13 1HG2 THR 13 5.396 -3.390 7.497
78 HG22 THR 13 2HG2 THR 13 5.884 -2.681 9.037
79 HG23 THR 13 3HG2 THR 13 5.966 -1.720 7.559
80 H VAL 14 H VAL 14 1.682 -3.578 6.504
81 HA VAL 14 HA VAL 14 -0.693 -2.269 7.617
82 HB VAL 14 HB VAL 14 -2.053 -2.904 5.625
83 HG11 VAL 14 1HG1 VAL 14 -1.308 -0.598 5.854
84 HG12 VAL 14 2HG1 VAL 14 -1.317 -1.070 4.157
85 HG13 VAL 14 3HG1 VAL 14 0.208 -0.984 5.039
86 HG21 VAL 14 1HG2 VAL 14 -0.902 -3.397 3.493
87 HG22 VAL 14 2HG2 VAL 14 -0.641 -4.653 4.704
88 HG23 VAL 14 3HG2 VAL 14 0.633 -3.483 4.359
89 H SER 15 H SER 15 -2.437 -3.787 8.039
90 HA SER 15 HA SER 15 -1.390 -6.395 8.746
91 HB2 SER 15 1HB SER 15 -4.124 -5.182 9.242
92 HB3 SER 15 2HB SER 15 -3.529 -6.693 9.933
93 HG SER 15 HG SER 15 -2.547 -5.576 11.400
94 H SER 16 H SER 16 -3.069 -5.066 6.092
95 HA SER 16 HA SER 16 -3.360 -7.710 4.946
96 HB2 SER 16 1HB SER 16 -5.765 -7.418 4.402
97 HB3 SER 16 2HB SER 16 -5.485 -7.483 6.142
98 HG SER 16 HG SER 16 -6.092 -5.467 6.333
99 H SER 17 H SER 17 -3.745 -7.711 2.684
100 HA SER 17 HA SER 17 -2.623 -5.630 1.175
101 HB2 SER 17 1HB SER 17 -3.745 -6.857 -0.769
102 HB3 SER 17 2HB SER 17 -2.669 -7.832 0.236
103 HG SER 17 HG SER 17 -5.491 -7.805 0.149
104 H GLU 18 H GLU 18 -5.865 -6.310 2.248
105 HA GLU 18 HA GLU 18 -7.338 -4.541 0.657
106 HB2 GLU 18 1HB GLU 18 -7.927 -5.057 3.575
107 HB3 GLU 18 2HB GLU 18 -9.069 -4.770 2.270
108 HG2 GLU 18 1HG GLU 18 -7.399 -7.245 2.696
109 HG3 GLU 18 2HG GLU 18 -9.138 -7.083 2.934
110 H GLU 19 H GLU 19 -5.752 -4.105 3.791
111 HA GLU 19 HA GLU 19 -6.281 -1.358 4.103
112 HB2 GLU 19 1HB GLU 19 -4.168 -3.201 5.207
113 HB3 GLU 19 2HB GLU 19 -4.217 -1.497 5.643
114 HG2 GLU 19 1HG GLU 19 -6.332 -1.723 6.680
115 HG3 GLU 19 2HG GLU 19 -6.583 -3.326 5.988
116 H CYS 20 H CYS 20 -3.586 -3.091 2.580
117 HA CYS 20 HA CYS 20 -1.959 -0.913 1.945
118 HB2 CYS 20 2HB CYS 20 -1.251 -3.229 1.591
119 HB3 CYS 20 1HB CYS 20 -2.450 -3.421 0.315
120 H GLU 21 H GLU 21 -4.439 -2.418 -0.145
121 HA GLU 21 HA GLU 21 -4.452 -0.528 -2.191
122 HB2 GLU 21 1HB GLU 21 -6.665 -2.295 -1.115
123 HB3 GLU 21 2HB GLU 21 -6.822 -1.345 -2.588
124 HG2 GLU 21 1HG GLU 21 -4.671 -3.414 -2.171
125 HG3 GLU 21 2HG GLU 21 -6.237 -3.765 -2.903
126 H ARG 22 H ARG 22 -6.373 -0.697 0.763
127 HA ARG 22 HA ARG 22 -7.993 1.517 0.457
128 HB2 ARG 22 1HB ARG 22 -8.438 0.047 2.247
129 HB3 ARG 22 2HB ARG 22 -6.801 0.148 2.861
130 HG2 ARG 22 1HG ARG 22 -8.473 2.617 2.904
131 HG3 ARG 22 2HG ARG 22 -8.824 1.340 4.070
132 HD2 ARG 22 1HD ARG 22 -6.348 1.395 4.659
133 HD3 ARG 22 2HD ARG 22 -6.255 2.881 3.715
134 HE ARG 22 HE ARG 22 -8.325 3.240 5.508
135 HH11 ARG 22 1HH1 ARG 22 -4.877 2.657 5.666
136 HH12 ARG 22 2HH1 ARG 22 -4.688 3.414 7.211
137 HH21 ARG 22 1HH2 ARG 22 -8.079 4.249 7.543
138 HH22 ARG 22 2HH2 ARG 22 -6.506 4.329 8.276
139 H LEU 23 H LEU 23 -4.691 1.350 1.753
140 HA LEU 23 HA LEU 23 -4.506 4.069 2.500
141 HB2 LEU 23 1HB LEU 23 -3.015 2.295 3.363
142 HB3 LEU 23 2HB LEU 23 -2.296 2.130 1.771
143 HG LEU 23 HG LEU 23 -1.444 4.454 1.930
144 HD11 LEU 23 1HD1 LEU 23 -1.508 5.621 4.088
145 HD12 LEU 23 2HD1 LEU 23 -2.561 4.363 4.737
146 HD13 LEU 23 3HD1 LEU 23 -3.121 5.392 3.417
147 HD21 LEU 23 1HD2 LEU 23 -0.644 2.681 4.245
148 HD22 LEU 23 2HD2 LEU 23 0.310 4.004 3.571
149 HD23 LEU 23 3HD2 LEU 23 -0.026 2.575 2.595
150 H CYS 24 H CYS 24 -3.106 2.351 -0.302
151 HA CYS 24 HA CYS 24 -2.013 4.546 -1.608
152 HB2 CYS 24 2HB CYS 24 -1.498 2.279 -2.274
153 HB3 CYS 24 1HB CYS 24 -3.163 1.991 -2.753
154 H ARG 25 H ARG 25 -5.209 3.087 -2.102
155 HA ARG 25 HA ARG 25 -5.961 4.891 -4.157
156 HB2 ARG 25 1HB ARG 25 -7.679 3.038 -2.493
157 HB3 ARG 25 2HB ARG 25 -8.191 3.854 -3.967
158 HG2 ARG 25 1HG ARG 25 -6.466 2.655 -5.233
159 HG3 ARG 25 2HG ARG 25 -5.957 1.828 -3.760
160 HD2 ARG 25 1HD ARG 25 -8.205 0.827 -3.584
161 HD3 ARG 25 2HD ARG 25 -8.662 1.618 -5.094
162 HE ARG 25 HE ARG 25 -6.763 -0.603 -4.782
163 HH11 ARG 25 1HH1 ARG 25 -8.512 1.578 -6.887
164 HH12 ARG 25 2HH1 ARG 25 -8.226 0.627 -8.310
165 HH21 ARG 25 1HH2 ARG 25 -6.360 -1.837 -6.632
166 HH22 ARG 25 2HH2 ARG 25 -6.985 -1.318 -8.170
167 H LYS 26 H LYS 26 -6.510 4.854 -0.654
168 HA LYS 26 HA LYS 26 -8.360 7.002 -0.614
169 HB2 LYS 26 1HB LYS 26 -8.036 5.528 1.330
170 HB3 LYS 26 2HB LYS 26 -6.397 6.125 1.526
171 HG2 LYS 26 1HG LYS 26 -8.709 8.027 1.634
172 HG3 LYS 26 2HG LYS 26 -8.306 7.043 3.040
173 HD2 LYS 26 1HD LYS 26 -6.131 8.022 3.199
174 HD3 LYS 26 2HD LYS 26 -6.300 8.818 1.636
175 HE2 LYS 26 1HE LYS 26 -6.593 10.410 3.455
176 HE3 LYS 26 2HE LYS 26 -8.092 10.224 2.545
177 HZ1 LYS 26 1HZ LYS 26 -8.500 10.252 4.915
178 HZ2 LYS 26 2HZ LYS 26 -7.469 8.932 5.142
179 HZ3 LYS 26 3HZ LYS 26 -8.903 8.742 4.273
180 H LEU 27 H LEU 27 -4.831 6.890 -0.220
181 HA LEU 27 HA LEU 27 -4.429 9.657 0.070
182 HB2 LEU 27 1HB LEU 27 -2.569 7.557 -1.067
183 HB3 LEU 27 2HB LEU 27 -2.085 9.180 -0.616
184 HG LEU 27 HG LEU 27 -3.077 7.022 1.256
185 HD11 LEU 27 1HD1 LEU 27 -0.800 6.649 0.491
186 HD12 LEU 27 2HD1 LEU 27 -0.803 7.136 2.186
187 HD13 LEU 27 3HD1 LEU 27 -0.354 8.298 0.934
188 HD21 LEU 27 1HD2 LEU 27 -2.228 9.856 1.874
189 HD22 LEU 27 2HD2 LEU 27 -2.616 8.610 3.062
190 HD23 LEU 27 3HD2 LEU 27 -3.870 9.216 1.979
191 H GLY 28 H GLY 28 -4.818 7.599 -2.739
192 HA2 GLY 28 1HA GLY 28 -5.666 8.361 -4.812
193 HA3 GLY 28 2HA GLY 28 -5.198 10.004 -4.386
194 H VAL 29 H VAL 29 -3.204 7.162 -4.115
195 HA VAL 29 HA VAL 29 -1.275 8.373 -5.982
196 HB VAL 29 HB VAL 29 -0.790 6.301 -3.819
197 HG11 VAL 29 1HG1 VAL 29 1.169 7.915 -5.461
198 HG12 VAL 29 2HG1 VAL 29 0.847 6.190 -5.625
199 HG13 VAL 29 3HG1 VAL 29 1.587 6.812 -4.149
200 HG21 VAL 29 1HG2 VAL 29 -1.471 8.432 -2.832
201 HG22 VAL 29 2HG2 VAL 29 -0.227 9.271 -3.759
202 HG23 VAL 29 3HG2 VAL 29 0.233 8.107 -2.517
203 H THR 30 H THR 30 -0.224 7.017 -7.498
204 HA THR 30 HA THR 30 -1.399 4.344 -7.878
205 HB THR 30 HB THR 30 -1.964 5.904 -9.729
206 HG1 THR 30 1HG THR 30 -1.922 3.920 -10.556
207 HG21 THR 30 1HG2 THR 30 0.027 7.297 -9.631
208 HG22 THR 30 2HG2 THR 30 -0.177 6.624 -11.248
209 HG23 THR 30 3HG2 THR 30 1.019 5.938 -10.148
210 H ASN 31 H ASN 31 0.280 3.026 -9.330
211 HA ASN 31 HA ASN 31 2.252 1.895 -9.366
212 HB2 ASN 31 1HB ASN 31 3.133 4.191 -10.016
213 HB3 ASN 31 2HB ASN 31 3.551 4.436 -8.325
214 HD21 ASN 31 1HD2 ASN 31 6.386 2.371 -8.408
215 HD22 ASN 31 2HD2 ASN 31 5.206 3.142 -7.411
216 H CYS 32 H CYS 32 0.640 1.463 -7.242
217 HA CYS 32 HA CYS 32 2.533 1.149 -4.996
218 HB2 CYS 32 2HB CYS 32 0.391 0.787 -3.621
219 HB3 CYS 32 1HB CYS 32 0.746 2.427 -4.147
220 H ARG 33 H ARG 33 2.535 -0.861 -3.891
221 HA ARG 33 HA ARG 33 1.460 -3.171 -5.326
222 HB2 ARG 33 1HB ARG 33 3.581 -2.750 -6.420
223 HB3 ARG 33 2HB ARG 33 4.401 -2.599 -4.875
224 HG2 ARG 33 1HG ARG 33 4.087 -4.961 -4.435
225 HG3 ARG 33 2HG ARG 33 3.149 -5.141 -5.920
226 HD2 ARG 33 1HD ARG 33 5.064 -4.616 -7.268
227 HD3 ARG 33 2HD ARG 33 6.011 -4.184 -5.846
228 HE ARG 33 HE ARG 33 5.939 -6.545 -5.213
229 HH11 ARG 33 1HH1 ARG 33 5.139 -5.774 -8.547
230 HH12 ARG 33 2HH1 ARG 33 5.679 -7.313 -9.150
231 HH21 ARG 33 1HH2 ARG 33 6.650 -8.558 -6.025
232 HH22 ARG 33 2HH2 ARG 33 6.533 -8.880 -7.731
233 H VAL 34 H VAL 34 1.639 -5.160 -4.035
234 HA VAL 34 HA VAL 34 1.866 -4.546 -1.156
235 HB VAL 34 HB VAL 34 -0.432 -5.077 -1.798
236 HG11 VAL 34 1HG1 VAL 34 0.017 -6.432 -3.784
237 HG12 VAL 34 2HG1 VAL 34 -1.054 -7.280 -2.669
238 HG13 VAL 34 3HG1 VAL 34 0.648 -7.730 -2.770
239 HG21 VAL 34 1HG2 VAL 34 -0.861 -6.887 -0.201
240 HG22 VAL 34 2HG2 VAL 34 0.342 -5.760 0.423
241 HG23 VAL 34 3HG2 VAL 34 0.848 -7.321 -0.224
242 H HIS 35 H HIS 35 3.082 -5.851 0.136
243 HA HIS 35 HA HIS 35 4.307 -8.253 -1.031
244 HB2 HIS 35 1HB HIS 35 5.963 -6.509 -1.379
245 HB3 HIS 35 2HB HIS 35 5.815 -5.979 0.293
246 HD1 HIS 35 HD1 HIS 35 7.468 -6.967 1.891
247 HD2 HIS 35 HD2 HIS 35 7.086 -9.231 -1.580
248 HE1 HIS 35 HE1 HIS 35 9.168 -8.802 2.091
249 HE2 HIS 35 HE2 HIS 35 8.781 -10.269 0.077
250 H CYS 36 H CYS 36 3.892 -9.889 0.305
251 HA CYS 36 HA CYS 36 4.316 -9.496 3.178
252 HB2 CYS 36 2HB CYS 36 1.827 -9.322 2.629
253 HB3 CYS 36 1HB CYS 36 1.900 -11.010 2.140
254 H GLY 37 H GLY 37 6.078 -10.741 3.356
255 HA2 GLY 37 1HA GLY 37 7.185 -12.822 3.489
256 HA3 GLY 37 2HA GLY 37 5.977 -13.512 2.410
Start of MODEL 9
1 H1 ALA 1 1H ALA 1 5.588 -12.746 12.090
2 H2 ALA 1 2H ALA 1 4.023 -12.959 11.485
3 H3 ALA 1 3H ALA 1 4.393 -11.597 12.416
4 HA ALA 1 HA ALA 1 5.874 -10.776 10.740
5 HB1 ALA 1 1HB ALA 1 6.611 -12.951 9.880
6 HB2 ALA 1 2HB ALA 1 6.061 -11.896 8.577
7 HB3 ALA 1 3HB ALA 1 5.023 -13.202 9.153
8 HA PRO 2 HA PRO 2 1.899 -9.077 9.443
9 HB2 PRO 2 2HB PRO 2 2.664 -6.537 9.195
10 HB3 PRO 2 1HB PRO 2 2.584 -7.294 10.792
11 HG2 PRO 2 2HG PRO 2 4.975 -6.761 9.069
12 HG3 PRO 2 1HG PRO 2 4.796 -6.578 10.823
13 HD2 PRO 2 2HD PRO 2 5.953 -8.769 9.545
14 HD3 PRO 2 1HD PRO 2 5.334 -8.766 11.208
15 H CYS 3 H CYS 3 1.696 -7.050 7.624
16 HA CYS 3 HA CYS 3 2.977 -8.125 5.196
17 HB2 CYS 3 2HB CYS 3 0.497 -8.523 5.349
18 HB3 CYS 3 1HB CYS 3 0.266 -6.777 5.345
19 H GLU 4 H GLU 4 3.134 -6.446 3.419
20 HA GLU 4 HA GLU 4 3.652 -3.765 4.516
21 HB2 GLU 4 1HB GLU 4 5.792 -3.634 3.450
22 HB3 GLU 4 2HB GLU 4 5.763 -5.117 4.390
23 HG2 GLU 4 1HG GLU 4 5.250 -6.374 2.318
24 HG3 GLU 4 2HG GLU 4 5.425 -4.877 1.408
25 H CYS 5 H CYS 5 3.944 -2.143 2.801
26 HA CYS 5 HA CYS 5 2.779 -2.739 0.215
27 HB2 CYS 5 2HB CYS 5 0.804 -2.321 1.635
28 HB3 CYS 5 1HB CYS 5 1.485 -0.782 2.145
29 H ASP 6 H ASP 6 3.717 -1.474 -1.300
30 HA ASP 6 HA ASP 6 5.393 0.768 -0.364
31 HB2 ASP 6 1HB ASP 6 6.799 -0.992 -1.246
32 HB3 ASP 6 2HB ASP 6 5.803 -1.132 -2.682
33 H VAL 7 H VAL 7 4.251 2.494 -0.722
34 HA VAL 7 HA VAL 7 2.664 2.811 -3.163
35 HB VAL 7 HB VAL 7 1.318 2.689 -1.100
36 HG11 VAL 7 1HG1 VAL 7 2.869 3.420 0.545
37 HG12 VAL 7 2HG1 VAL 7 1.453 4.471 0.589
38 HG13 VAL 7 3HG1 VAL 7 2.941 5.031 -0.178
39 HG21 VAL 7 1HG2 VAL 7 0.040 4.758 -1.356
40 HG22 VAL 7 2HG2 VAL 7 0.500 4.090 -2.923
41 HG23 VAL 7 3HG2 VAL 7 1.375 5.471 -2.261
42 H ASN 8 H ASN 8 3.132 4.486 -4.443
43 HA ASN 8 HA ASN 8 4.025 6.399 -5.283
44 HB2 ASN 8 1HB ASN 8 2.935 7.434 -3.257
45 HB3 ASN 8 2HB ASN 8 4.468 7.264 -2.408
46 HD21 ASN 8 1HD2 ASN 8 5.188 10.510 -3.434
47 HD22 ASN 8 2HD2 ASN 8 4.891 9.415 -2.133
48 H GLY 9 H GLY 9 5.727 4.078 -3.837
49 HA2 GLY 9 1HA GLY 9 7.973 3.637 -4.614
50 HA3 GLY 9 2HA GLY 9 8.319 5.354 -4.456
51 H GLU 10 H GLU 10 6.612 4.948 -1.807
52 HA GLU 10 HA GLU 10 8.946 4.253 -0.157
53 HB2 GLU 10 1HB GLU 10 6.414 5.777 0.511
54 HB3 GLU 10 2HB GLU 10 7.659 5.366 1.685
55 HG2 GLU 10 1HG GLU 10 9.289 6.690 0.436
56 HG3 GLU 10 2HG GLU 10 8.053 7.097 -0.754
57 H THR 11 H THR 11 8.692 2.803 1.626
58 HA THR 11 HA THR 11 6.516 0.866 1.162
59 HB THR 11 HB THR 11 9.271 0.289 2.288
60 HG1 THR 11 1HG THR 11 8.555 0.728 -0.231
61 HG21 THR 11 1HG2 THR 11 7.543 -1.291 3.032
62 HG22 THR 11 2HG2 THR 11 8.663 -2.062 1.909
63 HG23 THR 11 3HG2 THR 11 7.063 -1.561 1.356
64 H TYR 12 H TYR 12 5.084 0.845 2.686
65 HA TYR 12 HA TYR 12 5.833 1.319 5.496
66 HB2 TYR 12 2HB TYR 12 3.080 1.583 4.233
67 HB3 TYR 12 1HB TYR 12 3.558 2.091 5.857
68 HD1 TYR 12 1HD TYR 12 5.561 3.891 5.859
69 HD2 TYR 12 2HD TYR 12 2.924 3.154 2.606
70 HE1 TYR 12 1HE TYR 12 6.062 6.124 4.952
71 HE2 TYR 12 2HE TYR 12 3.406 5.369 1.687
72 HH TYR 12 HH TYR 12 5.987 7.279 2.721
73 H THR 13 H THR 13 4.077 0.131 6.962
74 HA THR 13 HA THR 13 3.760 -2.608 5.916
75 HB THR 13 HB THR 13 3.740 -3.323 8.317
76 HG1 THR 13 1HG THR 13 3.819 -1.865 9.845
77 HG21 THR 13 1HG2 THR 13 5.791 -3.491 6.961
78 HG22 THR 13 2HG2 THR 13 6.158 -3.153 8.653
79 HG23 THR 13 3HG2 THR 13 6.248 -1.860 7.457
80 H VAL 14 H VAL 14 1.772 -3.520 5.957
81 HA VAL 14 HA VAL 14 -0.445 -1.928 7.089
82 HB VAL 14 HB VAL 14 -1.842 -2.538 5.142
83 HG11 VAL 14 1HG1 VAL 14 -0.736 -0.366 5.173
84 HG12 VAL 14 2HG1 VAL 14 -0.831 -0.989 3.526
85 HG13 VAL 14 3HG1 VAL 14 0.695 -1.065 4.411
86 HG21 VAL 14 1HG2 VAL 14 0.728 -3.622 3.965
87 HG22 VAL 14 2HG2 VAL 14 -0.800 -3.438 3.103
88 HG23 VAL 14 3HG2 VAL 14 -0.678 -4.573 4.446
89 H SER 15 H SER 15 -2.387 -3.140 7.511
90 HA SER 15 HA SER 15 -1.904 -5.564 8.862
91 HB2 SER 15 1HB SER 15 -4.407 -5.609 9.105
92 HB3 SER 15 2HB SER 15 -3.670 -4.085 9.597
93 HG SER 15 HG SER 15 -5.179 -3.337 8.301
94 H SER 16 H SER 16 -3.410 -4.833 5.739
95 HA SER 16 HA SER 16 -2.984 -7.564 4.856
96 HB2 SER 16 1HB SER 16 -5.777 -6.384 4.991
97 HB3 SER 16 2HB SER 16 -5.346 -7.929 4.258
98 HG SER 16 HG SER 16 -4.353 -8.065 6.647
99 H SER 17 H SER 17 -3.786 -7.848 2.558
100 HA SER 17 HA SER 17 -2.514 -6.001 0.886
101 HB2 SER 17 1HB SER 17 -2.945 -8.425 0.371
102 HB3 SER 17 2HB SER 17 -4.638 -8.021 0.093
103 HG SER 17 HG SER 17 -2.430 -7.611 -1.494
104 H GLU 18 H GLU 18 -5.925 -6.464 1.700
105 HA GLU 18 HA GLU 18 -6.997 -4.504 -0.018
106 HB2 GLU 18 1HB GLU 18 -8.054 -5.466 2.651
107 HB3 GLU 18 2HB GLU 18 -8.971 -4.556 1.458
108 HG2 GLU 18 1HG GLU 18 -8.692 -6.406 -0.144
109 HG3 GLU 18 2HG GLU 18 -7.828 -7.321 1.091
110 H GLU 19 H GLU 19 -5.499 -4.315 3.136
111 HA GLU 19 HA GLU 19 -6.238 -1.619 3.691
112 HB2 GLU 19 1HB GLU 19 -5.465 -3.262 5.421
113 HB3 GLU 19 2HB GLU 19 -3.848 -3.167 4.736
114 HG2 GLU 19 1HG GLU 19 -3.963 -1.785 6.694
115 HG3 GLU 19 2HG GLU 19 -3.799 -0.753 5.273
116 H CYS 20 H CYS 20 -3.490 -3.202 2.132
117 HA CYS 20 HA CYS 20 -1.883 -0.966 1.641
118 HB2 CYS 20 2HB CYS 20 -1.030 -3.164 1.178
119 HB3 CYS 20 1HB CYS 20 -2.296 -3.472 -0.003
120 H GLU 21 H GLU 21 -4.259 -2.411 -0.649
121 HA GLU 21 HA GLU 21 -4.099 -0.342 -2.539
122 HB2 GLU 21 1HB GLU 21 -6.317 -1.197 -3.353
123 HB3 GLU 21 2HB GLU 21 -5.064 -2.415 -3.219
124 HG2 GLU 21 1HG GLU 21 -6.046 -3.175 -1.107
125 HG3 GLU 21 2HG GLU 21 -7.308 -1.956 -1.263
126 H ARG 22 H ARG 22 -6.268 -0.785 0.207
127 HA ARG 22 HA ARG 22 -7.919 1.423 -0.059
128 HB2 ARG 22 1HB ARG 22 -8.226 -0.268 1.689
129 HB3 ARG 22 2HB ARG 22 -6.740 0.244 2.474
130 HG2 ARG 22 1HG ARG 22 -8.636 1.110 3.678
131 HG3 ARG 22 2HG ARG 22 -7.758 2.443 2.925
132 HD2 ARG 22 1HD ARG 22 -10.153 2.754 2.672
133 HD3 ARG 22 2HD ARG 22 -9.404 2.482 1.100
134 HE ARG 22 HE ARG 22 -10.206 -0.004 1.860
135 HH11 ARG 22 1HH1 ARG 22 -11.853 3.076 1.623
136 HH12 ARG 22 2HH1 ARG 22 -13.385 2.367 1.220
137 HH21 ARG 22 1HH2 ARG 22 -12.221 -0.936 1.328
138 HH22 ARG 22 2HH2 ARG 22 -13.599 0.092 1.073
139 H LEU 23 H LEU 23 -4.749 1.229 1.532
140 HA LEU 23 HA LEU 23 -4.581 3.902 2.357
141 HB2 LEU 23 1HB LEU 23 -3.125 2.090 3.188
142 HB3 LEU 23 2HB LEU 23 -2.352 1.995 1.617
143 HG LEU 23 HG LEU 23 -1.495 4.304 1.921
144 HD11 LEU 23 1HD1 LEU 23 -3.208 5.178 3.401
145 HD12 LEU 23 2HD1 LEU 23 -1.617 5.353 4.141
146 HD13 LEU 23 3HD1 LEU 23 -2.704 4.069 4.676
147 HD21 LEU 23 1HD2 LEU 23 -0.081 2.419 2.517
148 HD22 LEU 23 2HD2 LEU 23 -0.784 2.376 4.135
149 HD23 LEU 23 3HD2 LEU 23 0.187 3.761 3.631
150 H CYS 24 H CYS 24 -3.474 2.302 -0.606
151 HA CYS 24 HA CYS 24 -2.210 4.453 -1.842
152 HB2 CYS 24 2HB CYS 24 -3.854 2.296 -3.188
153 HB3 CYS 24 1HB CYS 24 -2.591 3.266 -3.941
154 H ARG 25 H ARG 25 -5.581 3.375 -2.259
155 HA ARG 25 HA ARG 25 -6.365 5.456 -3.980
156 HB2 ARG 25 1HB ARG 25 -8.075 3.828 -2.084
157 HB3 ARG 25 2HB ARG 25 -8.667 4.757 -3.458
158 HG2 ARG 25 1HG ARG 25 -7.439 3.310 -4.988
159 HG3 ARG 25 2HG ARG 25 -6.781 2.408 -3.622
160 HD2 ARG 25 1HD ARG 25 -9.127 1.821 -2.978
161 HD3 ARG 25 2HD ARG 25 -9.670 2.572 -4.482
162 HE ARG 25 HE ARG 25 -7.753 0.773 -5.255
163 HH11 ARG 25 1HH1 ARG 25 -10.791 0.560 -3.513
164 HH12 ARG 25 2HH1 ARG 25 -11.074 -1.088 -3.976
165 HH21 ARG 25 1HH2 ARG 25 -8.147 -1.376 -5.866
166 HH22 ARG 25 2HH2 ARG 25 -9.580 -2.184 -5.315
167 H LYS 26 H LYS 26 -6.233 5.203 -0.498
168 HA LYS 26 HA LYS 26 -7.716 7.540 0.112
169 HB2 LYS 26 1HB LYS 26 -7.213 5.752 1.753
170 HB3 LYS 26 2HB LYS 26 -5.515 6.204 1.713
171 HG2 LYS 26 1HG LYS 26 -6.051 8.392 2.630
172 HG3 LYS 26 2HG LYS 26 -7.769 7.993 2.615
173 HD2 LYS 26 1HD LYS 26 -7.272 6.100 4.174
174 HD3 LYS 26 2HD LYS 26 -5.606 6.681 4.270
175 HE2 LYS 26 1HE LYS 26 -6.939 7.476 6.165
176 HE3 LYS 26 2HE LYS 26 -6.391 8.818 5.158
177 HZ1 LYS 26 1HZ LYS 26 -9.098 7.593 5.090
178 HZ2 LYS 26 2HZ LYS 26 -8.577 8.872 4.118
179 HZ3 LYS 26 3HZ LYS 26 -8.706 9.083 5.788
180 H LEU 27 H LEU 27 -4.230 6.938 -0.236
181 HA LEU 27 HA LEU 27 -3.513 9.687 0.190
182 HB2 LEU 27 1HB LEU 27 -1.889 7.396 -0.940
183 HB3 LEU 27 2HB LEU 27 -1.245 8.955 -0.463
184 HG LEU 27 HG LEU 27 -2.494 6.912 1.387
185 HD11 LEU 27 1HD1 LEU 27 0.374 7.810 1.081
186 HD12 LEU 27 2HD1 LEU 27 -0.286 6.244 0.607
187 HD13 LEU 27 3HD1 LEU 27 -0.236 6.698 2.310
188 HD21 LEU 27 1HD2 LEU 27 -2.971 9.184 2.135
189 HD22 LEU 27 2HD2 LEU 27 -1.260 9.597 2.015
190 HD23 LEU 27 3HD2 LEU 27 -1.799 8.406 3.199
191 H GLY 28 H GLY 28 -4.680 7.913 -2.451
192 HA2 GLY 28 1HA GLY 28 -5.328 8.750 -4.522
193 HA3 GLY 28 2HA GLY 28 -4.437 10.227 -4.185
194 H VAL 29 H VAL 29 -3.010 7.074 -3.863
195 HA VAL 29 HA VAL 29 -1.253 7.650 -6.159
196 HB VAL 29 HB VAL 29 -0.747 5.762 -3.840
197 HG11 VAL 29 1HG1 VAL 29 1.566 5.732 -4.653
198 HG12 VAL 29 2HG1 VAL 29 1.102 6.756 -6.015
199 HG13 VAL 29 3HG1 VAL 29 0.441 5.126 -5.872
200 HG21 VAL 29 1HG2 VAL 29 -0.820 8.078 -3.061
201 HG22 VAL 29 2HG2 VAL 29 0.348 8.542 -4.300
202 HG23 VAL 29 3HG2 VAL 29 0.825 7.445 -3.003
203 H THR 30 H THR 30 -1.006 6.130 -7.773
204 HA THR 30 HA THR 30 -3.112 4.091 -7.862
205 HB THR 30 HB THR 30 -2.592 4.030 -10.314
206 HG1 THR 30 1HG THR 30 -1.311 6.222 -10.734
207 HG21 THR 30 1HG2 THR 30 -3.240 6.760 -9.173
208 HG22 THR 30 2HG2 THR 30 -4.393 5.462 -9.487
209 HG23 THR 30 3HG2 THR 30 -3.555 6.241 -10.829
210 H ASN 31 H ASN 31 0.354 4.434 -7.813
211 HA ASN 31 HA ASN 31 0.692 1.585 -8.479
212 HB2 ASN 31 1HB ASN 31 2.633 3.902 -8.593
213 HB3 ASN 31 2HB ASN 31 3.127 2.223 -8.790
214 HD21 ASN 31 1HD2 ASN 31 1.188 4.183 -11.771
215 HD22 ASN 31 2HD2 ASN 31 1.296 4.851 -10.180
216 H CYS 32 H CYS 32 0.980 0.248 -6.903
217 HA CYS 32 HA CYS 32 2.618 0.945 -4.556
218 HB2 CYS 32 2HB CYS 32 -0.126 -0.356 -4.383
219 HB3 CYS 32 1HB CYS 32 0.966 -0.027 -3.038
220 H ARG 33 H ARG 33 3.255 -1.068 -3.389
221 HA ARG 33 HA ARG 33 2.994 -3.536 -4.992
222 HB2 ARG 33 1HB ARG 33 5.262 -2.440 -5.246
223 HB3 ARG 33 2HB ARG 33 5.509 -2.709 -3.530
224 HG2 ARG 33 1HG ARG 33 5.291 -5.132 -3.889
225 HG3 ARG 33 2HG ARG 33 5.117 -4.841 -5.621
226 HD2 ARG 33 1HD ARG 33 7.517 -4.303 -3.878
227 HD3 ARG 33 2HD ARG 33 7.396 -5.411 -5.247
228 HE ARG 33 HE ARG 33 7.147 -2.491 -5.601
229 HH11 ARG 33 1HH1 ARG 33 8.653 -5.540 -6.437
230 HH12 ARG 33 2HH1 ARG 33 9.570 -4.860 -7.744
231 HH21 ARG 33 1HH2 ARG 33 8.322 -1.605 -7.309
232 HH22 ARG 33 2HH2 ARG 33 9.378 -2.616 -8.250
233 H VAL 34 H VAL 34 2.316 -5.260 -3.813
234 HA VAL 34 HA VAL 34 2.227 -4.892 -0.884
235 HB VAL 34 HB VAL 34 -0.001 -4.802 -1.866
236 HG11 VAL 34 1HG1 VAL 34 0.393 -6.100 -3.893
237 HG12 VAL 34 2HG1 VAL 34 -0.994 -6.731 -3.005
238 HG13 VAL 34 3HG1 VAL 34 0.554 -7.573 -2.935
239 HG21 VAL 34 1HG2 VAL 34 -1.085 -6.535 -0.516
240 HG22 VAL 34 2HG2 VAL 34 0.246 -5.782 0.363
241 HG23 VAL 34 3HG2 VAL 34 0.456 -7.381 -0.352
242 H HIS 35 H HIS 35 3.048 -6.408 0.405
243 HA HIS 35 HA HIS 35 3.460 -9.133 -0.528
244 HB2 HIS 35 1HB HIS 35 5.571 -8.206 -1.202
245 HB3 HIS 35 2HB HIS 35 5.722 -7.292 0.296
246 HD1 HIS 35 HD1 HIS 35 6.967 -8.396 2.175
247 HD2 HIS 35 HD2 HIS 35 5.909 -11.091 -0.811
248 HE1 HIS 35 HE1 HIS 35 8.098 -10.553 2.780
249 HE2 HIS 35 HE2 HIS 35 7.344 -12.202 1.034
250 H CYS 36 H CYS 36 2.852 -10.456 1.093
251 HA CYS 36 HA CYS 36 2.913 -9.377 3.844
252 HB2 CYS 36 2HB CYS 36 1.087 -11.530 2.741
253 HB3 CYS 36 1HB CYS 36 1.018 -10.820 4.349
254 H GLY 37 H GLY 37 3.941 -10.531 5.410
255 HA2 GLY 37 1HA GLY 37 5.815 -12.524 4.634
256 HA3 GLY 37 2HA GLY 37 5.454 -12.021 6.280
Start of MODEL 10
1 H1 ALA 1 1H ALA 1 6.739 -10.582 11.843
2 H2 ALA 1 2H ALA 1 5.926 -11.145 10.476
3 H3 ALA 1 3H ALA 1 5.114 -11.041 11.953
4 HA ALA 1 HA ALA 1 5.270 -8.659 11.937
5 HB1 ALA 1 1HB ALA 1 6.697 -9.068 9.300
6 HB2 ALA 1 2HB ALA 1 7.410 -8.454 10.792
7 HB3 ALA 1 3HB ALA 1 6.184 -7.510 9.947
8 HA PRO 2 HA PRO 2 1.493 -8.735 9.485
9 HB2 PRO 2 2HB PRO 2 1.106 -6.103 8.952
10 HB3 PRO 2 1HB PRO 2 0.872 -6.778 10.570
11 HG2 PRO 2 2HG PRO 2 3.244 -5.321 9.452
12 HG3 PRO 2 1HG PRO 2 2.433 -5.093 11.014
13 HD2 PRO 2 2HD PRO 2 4.715 -6.530 10.770
14 HD3 PRO 2 1HD PRO 2 3.462 -6.941 11.960
15 H CYS 3 H CYS 3 0.874 -6.949 7.360
16 HA CYS 3 HA CYS 3 2.637 -8.027 5.302
17 HB2 CYS 3 2HB CYS 3 0.163 -8.166 5.024
18 HB3 CYS 3 1HB CYS 3 0.094 -6.407 4.984
19 H GLU 4 H GLU 4 3.502 -6.653 3.640
20 HA GLU 4 HA GLU 4 4.171 -3.948 4.594
21 HB2 GLU 4 1HB GLU 4 5.795 -5.766 2.789
22 HB3 GLU 4 2HB GLU 4 6.275 -4.170 3.343
23 HG2 GLU 4 1HG GLU 4 6.250 -5.023 5.672
24 HG3 GLU 4 2HG GLU 4 5.887 -6.630 5.042
25 H CYS 5 H CYS 5 4.523 -2.350 2.885
26 HA CYS 5 HA CYS 5 3.234 -2.866 0.337
27 HB2 CYS 5 2HB CYS 5 2.263 -0.867 2.385
28 HB3 CYS 5 1HB CYS 5 1.785 -0.851 0.698
29 H ASP 6 H ASP 6 3.401 -0.953 -1.098
30 HA ASP 6 HA ASP 6 5.483 0.969 -0.376
31 HB2 ASP 6 1HB ASP 6 6.524 -0.995 -1.625
32 HB3 ASP 6 2HB ASP 6 5.556 -0.512 -3.012
33 H VAL 7 H VAL 7 5.419 2.856 -1.664
34 HA VAL 7 HA VAL 7 3.077 3.285 -3.348
35 HB VAL 7 HB VAL 7 3.749 5.071 -0.983
36 HG11 VAL 7 1HG1 VAL 7 1.648 6.232 -1.572
37 HG12 VAL 7 2HG1 VAL 7 1.508 5.210 -3.005
38 HG13 VAL 7 3HG1 VAL 7 2.863 6.330 -2.848
39 HG21 VAL 7 1HG2 VAL 7 1.587 4.336 -0.034
40 HG22 VAL 7 2HG2 VAL 7 2.747 3.015 -0.170
41 HG23 VAL 7 3HG2 VAL 7 1.432 3.158 -1.338
42 H ASN 8 H ASN 8 4.317 3.657 -5.123
43 HA ASN 8 HA ASN 8 5.613 4.752 -6.612
44 HB2 ASN 8 1HB ASN 8 4.033 6.565 -5.997
45 HB3 ASN 8 2HB ASN 8 5.164 7.118 -4.770
46 HD21 ASN 8 1HD2 ASN 8 5.804 7.908 -8.720
47 HD22 ASN 8 2HD2 ASN 8 4.672 6.703 -8.218
48 H GLY 9 H GLY 9 6.851 3.767 -3.859
49 HA2 GLY 9 1HA GLY 9 9.387 3.512 -4.200
50 HA3 GLY 9 2HA GLY 9 9.388 5.264 -4.064
51 H GLU 10 H GLU 10 7.273 5.271 -2.013
52 HA GLU 10 HA GLU 10 9.032 4.861 0.270
53 HB2 GLU 10 1HB GLU 10 6.232 6.004 0.066
54 HB3 GLU 10 2HB GLU 10 7.181 5.947 1.546
55 HG2 GLU 10 1HG GLU 10 8.844 7.412 0.591
56 HG3 GLU 10 2HG GLU 10 8.008 7.400 -0.960
57 H THR 11 H THR 11 8.614 3.438 2.009
58 HA THR 11 HA THR 11 6.800 1.230 1.254
59 HB THR 11 HB THR 11 9.373 1.062 2.845
60 HG1 THR 11 1HG THR 11 8.777 0.840 0.106
61 HG21 THR 11 1HG2 THR 11 9.146 -1.368 2.510
62 HG22 THR 11 2HG2 THR 11 7.589 -1.114 1.719
63 HG23 THR 11 3HG2 THR 11 7.788 -0.717 3.428
64 H TYR 12 H TYR 12 5.335 0.536 2.669
65 HA TYR 12 HA TYR 12 5.371 1.539 5.448
66 HB2 TYR 12 2HB TYR 12 2.969 1.350 3.596
67 HB3 TYR 12 1HB TYR 12 2.903 1.790 5.299
68 HD1 TYR 12 1HD TYR 12 3.839 3.975 6.043
69 HD2 TYR 12 2HD TYR 12 3.595 2.940 1.917
70 HE1 TYR 12 1HE TYR 12 4.129 6.337 5.434
71 HE2 TYR 12 2HE TYR 12 3.894 5.303 1.303
72 HH TYR 12 HH TYR 12 4.964 7.643 3.460
73 H THR 13 H THR 13 3.546 0.245 6.708
74 HA THR 13 HA THR 13 3.399 -2.547 5.782
75 HB THR 13 HB THR 13 3.593 -3.243 8.233
76 HG1 THR 13 1HG THR 13 3.652 -0.662 8.621
77 HG21 THR 13 1HG2 THR 13 6.043 -3.256 8.209
78 HG22 THR 13 2HG2 THR 13 6.043 -2.048 6.924
79 HG23 THR 13 3HG2 THR 13 5.389 -3.658 6.619
80 H VAL 14 H VAL 14 1.453 -3.520 6.082
81 HA VAL 14 HA VAL 14 -0.645 -2.031 7.520
82 HB VAL 14 HB VAL 14 -2.231 -2.527 5.680
83 HG11 VAL 14 1HG1 VAL 14 0.191 -0.944 4.790
84 HG12 VAL 14 2HG1 VAL 14 -1.145 -0.331 5.767
85 HG13 VAL 14 3HG1 VAL 14 -1.430 -0.831 4.099
86 HG21 VAL 14 1HG2 VAL 14 -1.093 -4.474 4.730
87 HG22 VAL 14 2HG2 VAL 14 0.230 -3.440 4.178
88 HG23 VAL 14 3HG2 VAL 14 -1.383 -3.248 3.493
89 H SER 15 H SER 15 -2.681 -3.413 7.695
90 HA SER 15 HA SER 15 -2.065 -5.841 9.000
91 HB2 SER 15 1HB SER 15 -4.009 -4.446 9.610
92 HB3 SER 15 2HB SER 15 -4.754 -4.799 8.052
93 HG SER 15 HG SER 15 -5.642 -6.325 9.246
94 H SER 16 H SER 16 -3.601 -5.157 5.858
95 HA SER 16 HA SER 16 -2.747 -7.730 4.828
96 HB2 SER 16 1HB SER 16 -5.066 -8.367 4.140
97 HB3 SER 16 2HB SER 16 -4.854 -8.349 5.892
98 HG SER 16 HG SER 16 -6.762 -7.297 5.374
99 H SER 17 H SER 17 -3.553 -7.964 2.489
100 HA SER 17 HA SER 17 -2.709 -5.830 0.921
101 HB2 SER 17 1HB SER 17 -4.022 -7.148 -0.909
102 HB3 SER 17 2HB SER 17 -2.668 -7.941 -0.103
103 HG SER 17 HG SER 17 -5.245 -8.684 -0.168
104 H GLU 18 H GLU 18 -5.896 -6.681 2.100
105 HA GLU 18 HA GLU 18 -7.506 -4.936 0.640
106 HB2 GLU 18 1HB GLU 18 -7.769 -5.703 3.561
107 HB3 GLU 18 2HB GLU 18 -9.063 -5.101 2.530
108 HG2 GLU 18 1HG GLU 18 -9.076 -7.086 1.231
109 HG3 GLU 18 2HG GLU 18 -7.569 -7.651 1.952
110 H GLU 19 H GLU 19 -6.109 -4.422 3.872
111 HA GLU 19 HA GLU 19 -6.679 -1.702 4.137
112 HB2 GLU 19 1HB GLU 19 -4.449 -3.382 5.306
113 HB3 GLU 19 2HB GLU 19 -4.774 -1.726 5.801
114 HG2 GLU 19 1HG GLU 19 -6.767 -3.980 5.996
115 HG3 GLU 19 2HG GLU 19 -5.723 -3.450 7.315
116 H CYS 20 H CYS 20 -4.059 -3.359 2.529
117 HA CYS 20 HA CYS 20 -2.279 -1.205 2.197
118 HB2 CYS 20 2HB CYS 20 -1.869 -3.703 1.787
119 HB3 CYS 20 1HB CYS 20 -2.639 -3.466 0.221
120 H GLU 21 H GLU 21 -4.621 -2.600 -0.098
121 HA GLU 21 HA GLU 21 -4.434 -0.680 -2.090
122 HB2 GLU 21 1HB GLU 21 -6.837 -2.304 -1.212
123 HB3 GLU 21 2HB GLU 21 -6.769 -1.366 -2.698
124 HG2 GLU 21 1HG GLU 21 -4.934 -3.658 -2.010
125 HG3 GLU 21 2HG GLU 21 -6.357 -3.770 -3.045
126 H ARG 22 H ARG 22 -6.683 -0.800 0.686
127 HA ARG 22 HA ARG 22 -8.103 1.499 0.250
128 HB2 ARG 22 1HB ARG 22 -7.191 0.070 2.734
129 HB3 ARG 22 2HB ARG 22 -8.174 1.505 2.825
130 HG2 ARG 22 1HG ARG 22 -8.964 -0.973 1.323
131 HG3 ARG 22 2HG ARG 22 -9.464 -0.607 2.976
132 HD2 ARG 22 1HD ARG 22 -10.051 1.115 0.560
133 HD3 ARG 22 2HD ARG 22 -11.185 -0.013 1.301
134 HE ARG 22 HE ARG 22 -10.130 1.941 3.137
135 HH11 ARG 22 1HH1 ARG 22 -12.637 1.302 0.771
136 HH12 ARG 22 2HH1 ARG 22 -13.746 2.443 1.464
137 HH21 ARG 22 1HH2 ARG 22 -11.570 3.440 4.034
138 HH22 ARG 22 2HH2 ARG 22 -13.133 3.679 3.308
139 H LEU 23 H LEU 23 -4.971 1.117 1.880
140 HA LEU 23 HA LEU 23 -4.659 3.786 2.694
141 HB2 LEU 23 1HB LEU 23 -3.301 1.952 3.582
142 HB3 LEU 23 2HB LEU 23 -2.557 1.719 2.012
143 HG LEU 23 HG LEU 23 -1.527 3.969 2.182
144 HD11 LEU 23 1HD1 LEU 23 -2.729 3.984 4.951
145 HD12 LEU 23 2HD1 LEU 23 -3.153 5.055 3.616
146 HD13 LEU 23 3HD1 LEU 23 -1.548 5.143 4.340
147 HD21 LEU 23 1HD2 LEU 23 -0.294 1.971 2.909
148 HD22 LEU 23 2HD2 LEU 23 -0.926 2.182 4.543
149 HD23 LEU 23 3HD2 LEU 23 0.150 3.396 3.849
150 H CYS 24 H CYS 24 -3.148 2.128 -0.100
151 HA CYS 24 HA CYS 24 -1.925 4.443 -1.119
152 HB2 CYS 24 2HB CYS 24 -2.672 1.871 -2.534
153 HB3 CYS 24 1HB CYS 24 -1.599 3.105 -3.194
154 H ARG 25 H ARG 25 -5.045 2.953 -1.936
155 HA ARG 25 HA ARG 25 -5.626 4.688 -4.110
156 HB2 ARG 25 1HB ARG 25 -7.642 3.231 -2.378
157 HB3 ARG 25 2HB ARG 25 -7.901 3.843 -4.005
158 HG2 ARG 25 1HG ARG 25 -6.071 1.583 -3.212
159 HG3 ARG 25 2HG ARG 25 -7.629 1.439 -4.017
160 HD2 ARG 25 1HD ARG 25 -6.786 2.404 -6.014
161 HD3 ARG 25 2HD ARG 25 -5.310 2.949 -5.213
162 HE ARG 25 HE ARG 25 -5.262 0.248 -4.885
163 HH11 ARG 25 1HH1 ARG 25 -5.654 2.259 -7.731
164 HH12 ARG 25 2HH1 ARG 25 -4.802 1.163 -8.769
165 HH21 ARG 25 1HH2 ARG 25 -4.173 -1.186 -6.228
166 HH22 ARG 25 2HH2 ARG 25 -3.937 -0.801 -7.910
167 H LYS 26 H LYS 26 -6.417 4.771 -0.645
168 HA LYS 26 HA LYS 26 -8.057 7.071 -0.742
169 HB2 LYS 26 1HB LYS 26 -7.997 5.554 1.196
170 HB3 LYS 26 2HB LYS 26 -6.346 6.056 1.541
171 HG2 LYS 26 1HG LYS 26 -7.113 8.333 1.972
172 HG3 LYS 26 2HG LYS 26 -8.769 7.854 1.594
173 HD2 LYS 26 1HD LYS 26 -8.460 7.926 3.996
174 HD3 LYS 26 2HD LYS 26 -8.715 6.259 3.481
175 HE2 LYS 26 1HE LYS 26 -6.318 5.832 3.622
176 HE3 LYS 26 2HE LYS 26 -6.028 7.516 4.063
177 HZ1 LYS 26 1HZ LYS 26 -7.333 7.169 6.072
178 HZ2 LYS 26 2HZ LYS 26 -6.032 6.097 6.004
179 HZ3 LYS 26 3HZ LYS 26 -7.592 5.552 5.649
180 H LEU 27 H LEU 27 -4.573 6.655 -0.228
181 HA LEU 27 HA LEU 27 -3.924 9.374 0.105
182 HB2 LEU 27 1HB LEU 27 -2.283 7.149 -1.138
183 HB3 LEU 27 2HB LEU 27 -1.649 8.721 -0.683
184 HG LEU 27 HG LEU 27 -2.785 6.656 1.218
185 HD11 LEU 27 1HD1 LEU 27 0.059 7.569 0.780
186 HD12 LEU 27 2HD1 LEU 27 -0.616 6.004 0.327
187 HD13 LEU 27 3HD1 LEU 27 -0.489 6.448 2.027
188 HD21 LEU 27 1HD2 LEU 27 -2.018 8.144 3.001
189 HD22 LEU 27 2HD2 LEU 27 -3.229 8.933 1.993
190 HD23 LEU 27 3HD2 LEU 27 -1.523 9.339 1.799
191 H GLY 28 H GLY 28 -4.447 7.371 -2.729
192 HA2 GLY 28 1HA GLY 28 -5.485 8.288 -4.677
193 HA3 GLY 28 2HA GLY 28 -4.726 9.834 -4.326
194 H VAL 29 H VAL 29 -2.879 6.926 -4.037
195 HA VAL 29 HA VAL 29 -1.435 7.619 -6.521
196 HB VAL 29 HB VAL 29 -0.297 6.233 -4.078
197 HG11 VAL 29 1HG1 VAL 29 0.816 5.587 -6.151
198 HG12 VAL 29 2HG1 VAL 29 1.874 6.596 -5.168
199 HG13 VAL 29 3HG1 VAL 29 1.054 7.286 -6.570
200 HG21 VAL 29 1HG2 VAL 29 0.922 8.317 -3.649
201 HG22 VAL 29 2HG2 VAL 29 -0.822 8.572 -3.576
202 HG23 VAL 29 3HG2 VAL 29 0.087 9.087 -4.997
203 H THR 30 H THR 30 -1.771 6.203 -8.070
204 HA THR 30 HA THR 30 -2.885 3.609 -7.593
205 HB THR 30 HB THR 30 -1.779 4.804 -10.150
206 HG1 THR 30 1HG THR 30 -4.144 5.157 -8.746
207 HG21 THR 30 1HG2 THR 30 -1.970 2.364 -10.279
208 HG22 THR 30 2HG2 THR 30 -3.202 3.135 -11.278
209 HG23 THR 30 3HG2 THR 30 -3.638 2.454 -9.711
210 H ASN 31 H ASN 31 0.283 4.908 -8.454
211 HA ASN 31 HA ASN 31 1.502 2.364 -8.880
212 HB2 ASN 31 1HB ASN 31 2.379 4.510 -9.835
213 HB3 ASN 31 2HB ASN 31 2.866 4.990 -8.213
214 HD21 ASN 31 1HD2 ASN 31 5.014 2.239 -10.309
215 HD22 ASN 31 2HD2 ASN 31 3.440 2.735 -10.829
216 H CYS 32 H CYS 32 0.882 1.181 -7.133
217 HA CYS 32 HA CYS 32 2.377 1.613 -4.629
218 HB2 CYS 32 2HB CYS 32 0.149 2.407 -4.139
219 HB3 CYS 32 1HB CYS 32 -0.591 1.034 -4.950
220 H ARG 33 H ARG 33 2.459 -0.485 -3.364
221 HA ARG 33 HA ARG 33 2.236 -2.877 -5.043
222 HB2 ARG 33 1HB ARG 33 4.480 -1.869 -5.455
223 HB3 ARG 33 2HB ARG 33 4.831 -2.022 -3.743
224 HG2 ARG 33 1HG ARG 33 4.680 -4.452 -3.907
225 HG3 ARG 33 2HG ARG 33 4.290 -4.313 -5.625
226 HD2 ARG 33 1HD ARG 33 6.859 -3.473 -4.273
227 HD3 ARG 33 2HD ARG 33 6.642 -4.826 -5.385
228 HE ARG 33 HE ARG 33 5.887 -2.876 -6.970
229 HH11 ARG 33 1HH1 ARG 33 8.580 -2.870 -4.716
230 HH12 ARG 33 2HH1 ARG 33 9.508 -1.741 -5.647
231 HH21 ARG 33 1HH2 ARG 33 7.114 -1.383 -8.176
232 HH22 ARG 33 2HH2 ARG 33 8.683 -0.899 -7.613
233 H VAL 34 H VAL 34 2.037 -4.778 -3.877
234 HA VAL 34 HA VAL 34 1.790 -4.450 -0.952
235 HB VAL 34 HB VAL 34 0.214 -6.350 -2.716
236 HG11 VAL 34 1HG1 VAL 34 -0.082 -5.662 0.212
237 HG12 VAL 34 2HG1 VAL 34 0.529 -7.183 -0.441
238 HG13 VAL 34 3HG1 VAL 34 -1.152 -6.719 -0.709
239 HG21 VAL 34 1HG2 VAL 34 -1.719 -4.886 -2.275
240 HG22 VAL 34 2HG2 VAL 34 -0.450 -4.048 -3.169
241 HG23 VAL 34 3HG2 VAL 34 -0.658 -3.747 -1.444
242 H HIS 35 H HIS 35 2.718 -5.971 0.354
243 HA HIS 35 HA HIS 35 3.816 -8.415 -0.841
244 HB2 HIS 35 1HB HIS 35 5.668 -6.772 -0.814
245 HB3 HIS 35 2HB HIS 35 5.417 -6.510 0.909
246 HD1 HIS 35 HD1 HIS 35 7.681 -8.141 -1.179
247 HD2 HIS 35 HD2 HIS 35 5.660 -9.311 2.256
248 HE1 HIS 35 HE1 HIS 35 8.944 -10.121 -0.291
249 HE2 HIS 35 HE2 HIS 35 7.569 -10.937 1.657
250 H CYS 36 H CYS 36 2.425 -9.759 0.261
251 HA CYS 36 HA CYS 36 2.451 -9.555 3.208
252 HB2 CYS 36 2HB CYS 36 0.375 -10.851 1.413
253 HB3 CYS 36 1HB CYS 36 0.332 -10.842 3.170
254 H GLY 37 H GLY 37 4.101 -10.830 3.819
255 HA2 GLY 37 1HA GLY 37 4.551 -13.210 4.365
256 HA3 GLY 37 2HA GLY 37 4.266 -13.550 2.662
Start of MODEL 11
1 H1 ALA 1 1H ALA 1 -1.298 -11.926 9.885
2 H2 ALA 1 2H ALA 1 -1.453 -10.629 8.811
3 H3 ALA 1 3H ALA 1 -1.462 -10.351 10.476
4 HA ALA 1 HA ALA 1 0.815 -11.069 10.662
5 HB1 ALA 1 1HB ALA 1 0.749 -12.686 8.799
6 HB2 ALA 1 2HB ALA 1 2.119 -11.583 8.665
7 HB3 ALA 1 3HB ALA 1 0.695 -11.348 7.652
8 HA PRO 2 HA PRO 2 1.718 -6.757 9.882
9 HB2 PRO 2 2HB PRO 2 4.365 -6.640 10.201
10 HB3 PRO 2 1HB PRO 2 3.324 -7.104 11.558
11 HG2 PRO 2 2HG PRO 2 4.798 -8.878 9.631
12 HG3 PRO 2 1HG PRO 2 4.851 -8.913 11.409
13 HD2 PRO 2 2HD PRO 2 3.254 -10.577 10.014
14 HD3 PRO 2 1HD PRO 2 2.731 -9.885 11.566
15 H CYS 3 H CYS 3 1.011 -7.413 7.604
16 HA CYS 3 HA CYS 3 2.924 -7.707 5.541
17 HB2 CYS 3 2HB CYS 3 0.014 -6.997 5.627
18 HB3 CYS 3 1HB CYS 3 0.909 -6.713 4.139
19 H GLU 4 H GLU 4 2.929 -6.029 3.720
20 HA GLU 4 HA GLU 4 3.360 -3.338 4.803
21 HB2 GLU 4 1HB GLU 4 5.280 -4.853 3.009
22 HB3 GLU 4 2HB GLU 4 5.480 -3.191 3.560
23 HG2 GLU 4 1HG GLU 4 5.687 -3.937 5.854
24 HG3 GLU 4 2HG GLU 4 5.376 -5.601 5.368
25 H CYS 5 H CYS 5 3.888 -1.848 2.839
26 HA CYS 5 HA CYS 5 2.373 -2.520 0.448
27 HB2 CYS 5 2HB CYS 5 0.783 -1.593 2.256
28 HB3 CYS 5 1HB CYS 5 1.619 -0.060 2.045
29 H ASP 6 H ASP 6 3.225 -1.437 -1.320
30 HA ASP 6 HA ASP 6 5.491 0.333 -0.721
31 HB2 ASP 6 1HB ASP 6 5.073 -1.851 -2.734
32 HB3 ASP 6 2HB ASP 6 6.217 -0.573 -3.061
33 H VAL 7 H VAL 7 4.857 2.330 -1.108
34 HA VAL 7 HA VAL 7 3.177 2.968 -3.429
35 HB VAL 7 HB VAL 7 3.528 4.538 -0.856
36 HG11 VAL 7 1HG1 VAL 7 2.991 5.979 -2.718
37 HG12 VAL 7 2HG1 VAL 7 1.588 5.837 -1.658
38 HG13 VAL 7 3HG1 VAL 7 1.640 4.942 -3.178
39 HG21 VAL 7 1HG2 VAL 7 1.243 2.753 -1.714
40 HG22 VAL 7 2HG2 VAL 7 1.221 3.826 -0.315
41 HG23 VAL 7 3HG2 VAL 7 2.355 2.477 -0.370
42 H ASN 8 H ASN 8 4.441 3.740 -5.021
43 HA ASN 8 HA ASN 8 5.980 4.968 -6.170
44 HB2 ASN 8 1HB ASN 8 4.728 6.840 -5.149
45 HB3 ASN 8 2HB ASN 8 5.790 6.793 -3.749
46 HD21 ASN 8 1HD2 ASN 8 7.526 9.376 -5.316
47 HD22 ASN 8 2HD2 ASN 8 6.473 8.896 -4.032
48 H GLY 9 H GLY 9 6.822 2.963 -4.055
49 HA2 GLY 9 1HA GLY 9 9.036 2.058 -3.997
50 HA3 GLY 9 2HA GLY 9 9.676 3.692 -4.091
51 H GLU 10 H GLU 10 7.533 4.443 -2.030
52 HA GLU 10 HA GLU 10 9.153 4.020 0.307
53 HB2 GLU 10 1HB GLU 10 6.327 5.104 0.193
54 HB3 GLU 10 2HB GLU 10 7.517 5.359 1.463
55 HG2 GLU 10 1HG GLU 10 7.655 6.427 -1.354
56 HG3 GLU 10 2HG GLU 10 7.252 7.346 0.095
57 H THR 11 H THR 11 8.656 2.711 2.099
58 HA THR 11 HA THR 11 6.675 0.600 1.529
59 HB THR 11 HB THR 11 9.160 0.319 3.247
60 HG1 THR 11 1HG THR 11 8.679 -0.326 0.508
61 HG21 THR 11 1HG2 THR 11 7.278 -1.755 2.086
62 HG22 THR 11 2HG2 THR 11 7.341 -1.259 3.778
63 HG23 THR 11 3HG2 THR 11 8.718 -2.085 3.050
64 H TYR 12 H TYR 12 4.981 0.623 2.786
65 HA TYR 12 HA TYR 12 5.145 1.684 5.536
66 HB2 TYR 12 2HB TYR 12 2.788 1.531 3.622
67 HB3 TYR 12 1HB TYR 12 2.680 2.088 5.285
68 HD1 TYR 12 1HD TYR 12 3.746 4.241 5.942
69 HD2 TYR 12 2HD TYR 12 3.617 2.956 1.884
70 HE1 TYR 12 1HE TYR 12 4.242 6.529 5.204
71 HE2 TYR 12 2HE TYR 12 4.118 5.246 1.139
72 HH TYR 12 HH TYR 12 3.882 7.564 2.010
73 H THR 13 H THR 13 3.479 0.583 7.027
74 HA THR 13 HA THR 13 3.345 -2.300 6.387
75 HB THR 13 HB THR 13 3.057 -2.458 9.001
76 HG1 THR 13 1HG THR 13 3.320 -0.611 9.965
77 HG21 THR 13 1HG2 THR 13 4.901 -3.492 7.818
78 HG22 THR 13 2HG2 THR 13 5.504 -2.687 9.268
79 HG23 THR 13 3HG2 THR 13 5.726 -1.936 7.686
80 H VAL 14 H VAL 14 1.444 -3.334 6.510
81 HA VAL 14 HA VAL 14 -0.922 -1.907 7.499
82 HB VAL 14 HB VAL 14 -2.218 -2.541 5.491
83 HG11 VAL 14 1HG1 VAL 14 -1.286 -0.290 5.619
84 HG12 VAL 14 2HG1 VAL 14 -1.297 -0.864 3.950
85 HG13 VAL 14 3HG1 VAL 14 0.210 -0.850 4.868
86 HG21 VAL 14 1HG2 VAL 14 -1.069 -3.295 3.460
87 HG22 VAL 14 2HG2 VAL 14 -0.867 -4.453 4.774
88 HG23 VAL 14 3HG2 VAL 14 0.456 -3.368 4.341
89 H SER 15 H SER 15 -2.836 -3.381 7.553
90 HA SER 15 HA SER 15 -2.275 -5.755 8.936
91 HB2 SER 15 1HB SER 15 -4.857 -4.896 7.591
92 HB3 SER 15 2HB SER 15 -4.706 -6.147 8.827
93 HG SER 15 HG SER 15 -4.354 -3.349 9.072
94 H SER 16 H SER 16 -3.333 -5.200 5.587
95 HA SER 16 HA SER 16 -2.099 -7.561 4.612
96 HB2 SER 16 1HB SER 16 -4.239 -8.719 3.925
97 HB3 SER 16 2HB SER 16 -3.930 -8.734 5.661
98 HG SER 16 HG SER 16 -5.772 -7.776 5.890
99 H SER 17 H SER 17 -3.308 -8.051 2.306
100 HA SER 17 HA SER 17 -2.676 -6.014 0.581
101 HB2 SER 17 1HB SER 17 -4.872 -8.041 0.085
102 HB3 SER 17 2HB SER 17 -3.815 -7.287 -1.111
103 HG SER 17 HG SER 17 -2.486 -8.864 -0.764
104 H GLU 18 H GLU 18 -5.769 -6.718 2.091
105 HA GLU 18 HA GLU 18 -7.481 -4.986 0.822
106 HB2 GLU 18 1HB GLU 18 -7.393 -5.529 3.802
107 HB3 GLU 18 2HB GLU 18 -8.793 -4.990 2.884
108 HG2 GLU 18 1HG GLU 18 -7.392 -7.634 2.516
109 HG3 GLU 18 2HG GLU 18 -8.866 -7.384 3.449
110 H GLU 19 H GLU 19 -5.499 -4.301 3.687
111 HA GLU 19 HA GLU 19 -6.345 -1.567 3.791
112 HB2 GLU 19 1HB GLU 19 -5.833 -2.857 5.825
113 HB3 GLU 19 2HB GLU 19 -4.149 -2.970 5.327
114 HG2 GLU 19 1HG GLU 19 -3.787 -0.662 5.638
115 HG3 GLU 19 2HG GLU 19 -5.514 -0.323 5.725
116 H CYS 20 H CYS 20 -3.600 -3.285 2.456
117 HA CYS 20 HA CYS 20 -1.878 -1.104 2.002
118 HB2 CYS 20 2HB CYS 20 -1.091 -3.362 1.636
119 HB3 CYS 20 1HB CYS 20 -2.311 -3.641 0.402
120 H GLU 21 H GLU 21 -4.192 -2.619 -0.246
121 HA GLU 21 HA GLU 21 -4.071 -0.660 -2.230
122 HB2 GLU 21 1HB GLU 21 -6.355 -2.503 -1.486
123 HB3 GLU 21 2HB GLU 21 -6.282 -1.556 -2.969
124 HG2 GLU 21 1HG GLU 21 -4.247 -2.755 -3.633
125 HG3 GLU 21 2HG GLU 21 -4.334 -3.710 -2.153
126 H ARG 22 H ARG 22 -6.217 -0.958 0.582
127 HA ARG 22 HA ARG 22 -7.849 1.257 0.060
128 HB2 ARG 22 1HB ARG 22 -8.410 -0.363 1.795
129 HB3 ARG 22 2HB ARG 22 -6.996 0.110 2.730
130 HG2 ARG 22 1HG ARG 22 -7.925 2.303 3.130
131 HG3 ARG 22 2HG ARG 22 -9.287 1.960 2.061
132 HD2 ARG 22 1HD ARG 22 -9.993 1.742 4.354
133 HD3 ARG 22 2HD ARG 22 -9.993 0.155 3.591
134 HE ARG 22 HE ARG 22 -7.755 1.035 5.309
135 HH11 ARG 22 1HH1 ARG 22 -10.176 -1.319 4.407
136 HH12 ARG 22 2HH1 ARG 22 -9.774 -2.417 5.693
137 HH21 ARG 22 1HH2 ARG 22 -7.208 -0.424 7.003
138 HH22 ARG 22 2HH2 ARG 22 -8.103 -1.903 7.168
139 H LEU 23 H LEU 23 -4.723 1.053 1.707
140 HA LEU 23 HA LEU 23 -4.651 3.719 2.637
141 HB2 LEU 23 1HB LEU 23 -3.183 1.939 3.506
142 HB3 LEU 23 2HB LEU 23 -2.357 1.864 1.963
143 HG LEU 23 HG LEU 23 -1.554 4.184 2.291
144 HD11 LEU 23 1HD1 LEU 23 -3.350 5.009 3.719
145 HD12 LEU 23 2HD1 LEU 23 -1.776 5.257 4.472
146 HD13 LEU 23 3HD1 LEU 23 -2.819 3.946 5.023
147 HD21 LEU 23 1HD2 LEU 23 -0.870 2.320 4.571
148 HD22 LEU 23 2HD2 LEU 23 0.107 3.672 3.996
149 HD23 LEU 23 3HD2 LEU 23 -0.162 2.275 2.956
150 H CYS 24 H CYS 24 -3.289 2.175 -0.247
151 HA CYS 24 HA CYS 24 -2.152 4.506 -1.366
152 HB2 CYS 24 2HB CYS 24 -3.132 2.011 -2.785
153 HB3 CYS 24 1HB CYS 24 -1.946 3.168 -3.391
154 H ARG 25 H ARG 25 -5.371 3.038 -1.750
155 HA ARG 25 HA ARG 25 -6.311 4.861 -3.704
156 HB2 ARG 25 1HB ARG 25 -7.826 3.255 -1.631
157 HB3 ARG 25 2HB ARG 25 -8.593 4.164 -2.927
158 HG2 ARG 25 1HG ARG 25 -7.462 2.768 -4.585
159 HG3 ARG 25 2HG ARG 25 -6.675 1.860 -3.291
160 HD2 ARG 25 1HD ARG 25 -8.563 0.595 -4.049
161 HD3 ARG 25 2HD ARG 25 -8.938 1.233 -2.448
162 HE ARG 25 HE ARG 25 -9.857 2.927 -4.575
163 HH11 ARG 25 1HH1 ARG 25 -10.654 0.158 -2.578
164 HH12 ARG 25 2HH1 ARG 25 -12.351 0.240 -2.922
165 HH21 ARG 25 1HH2 ARG 25 -12.074 3.042 -5.029
166 HH22 ARG 25 2HH2 ARG 25 -13.170 1.892 -4.319
167 H LYS 26 H LYS 26 -6.320 4.865 -0.181
168 HA LYS 26 HA LYS 26 -7.741 7.237 0.276
169 HB2 LYS 26 1HB LYS 26 -7.164 5.694 2.076
170 HB3 LYS 26 2HB LYS 26 -5.449 5.991 1.819
171 HG2 LYS 26 1HG LYS 26 -5.807 8.356 2.488
172 HG3 LYS 26 2HG LYS 26 -7.489 7.958 2.853
173 HD2 LYS 26 1HD LYS 26 -6.708 6.284 4.495
174 HD3 LYS 26 2HD LYS 26 -5.039 6.745 4.151
175 HE2 LYS 26 1HE LYS 26 -5.783 7.850 6.168
176 HE3 LYS 26 2HE LYS 26 -5.561 9.047 4.892
177 HZ1 LYS 26 1HZ LYS 26 -7.595 9.463 6.076
178 HZ2 LYS 26 2HZ LYS 26 -8.152 7.898 5.785
179 HZ3 LYS 26 3HZ LYS 26 -7.966 8.985 4.501
180 H LEU 27 H LEU 27 -4.282 6.651 -0.205
181 HA LEU 27 HA LEU 27 -3.497 9.380 -0.124
182 HB2 LEU 27 1HB LEU 27 -2.113 7.017 -1.416
183 HB3 LEU 27 2HB LEU 27 -1.374 8.575 -1.090
184 HG LEU 27 HG LEU 27 -2.359 6.605 0.985
185 HD11 LEU 27 1HD1 LEU 27 -0.318 5.874 -0.122
186 HD12 LEU 27 2HD1 LEU 27 0.004 6.343 1.547
187 HD13 LEU 27 3HD1 LEU 27 0.446 7.427 0.228
188 HD21 LEU 27 1HD2 LEU 27 -2.677 8.867 1.788
189 HD22 LEU 27 2HD2 LEU 27 -1.027 9.295 1.337
190 HD23 LEU 27 3HD2 LEU 27 -1.314 8.125 2.625
191 H GLY 28 H GLY 28 -4.911 7.361 -2.538
192 HA2 GLY 28 1HA GLY 28 -5.840 7.960 -4.570
193 HA3 GLY 28 2HA GLY 28 -5.275 9.608 -4.312
194 H VAL 29 H VAL 29 -3.538 6.535 -4.431
195 HA VAL 29 HA VAL 29 -1.927 7.576 -6.665
196 HB VAL 29 HB VAL 29 -0.722 7.886 -4.521
197 HG11 VAL 29 1HG1 VAL 29 0.038 5.999 -3.214
198 HG12 VAL 29 2HG1 VAL 29 -0.827 4.888 -4.275
199 HG13 VAL 29 3HG1 VAL 29 -1.723 6.039 -3.283
200 HG21 VAL 29 1HG2 VAL 29 0.551 7.511 -6.579
201 HG22 VAL 29 2HG2 VAL 29 0.505 5.770 -6.297
202 HG23 VAL 29 3HG2 VAL 29 1.383 6.820 -5.184
203 H THR 30 H THR 30 -1.669 6.158 -8.290
204 HA THR 30 HA THR 30 -2.642 3.435 -7.990
205 HB THR 30 HB THR 30 -2.181 3.239 -10.423
206 HG1 THR 30 1HG THR 30 -0.854 4.624 -11.292
207 HG21 THR 30 1HG2 THR 30 -4.362 4.057 -9.681
208 HG22 THR 30 2HG2 THR 30 -3.876 4.855 -11.177
209 HG23 THR 30 3HG2 THR 30 -3.743 5.707 -9.638
210 H ASN 31 H ASN 31 0.372 5.165 -8.270
211 HA ASN 31 HA ASN 31 2.047 2.913 -8.724
212 HB2 ASN 31 1HB ASN 31 2.701 5.622 -7.529
213 HB3 ASN 31 2HB ASN 31 3.894 4.418 -8.005
214 HD21 ASN 31 1HD2 ASN 31 2.625 4.868 -11.530
215 HD22 ASN 31 2HD2 ASN 31 2.449 3.584 -10.390
216 H CYS 32 H CYS 32 1.135 1.449 -7.287
217 HA CYS 32 HA CYS 32 2.196 1.492 -4.567
218 HB2 CYS 32 2HB CYS 32 0.077 2.546 -4.173
219 HB3 CYS 32 1HB CYS 32 -0.761 1.460 -5.273
220 H ARG 33 H ARG 33 2.293 -0.588 -3.715
221 HA ARG 33 HA ARG 33 1.526 -2.851 -5.414
222 HB2 ARG 33 1HB ARG 33 4.310 -2.351 -4.312
223 HB3 ARG 33 2HB ARG 33 3.791 -3.842 -5.073
224 HG2 ARG 33 1HG ARG 33 3.768 -2.921 -7.188
225 HG3 ARG 33 2HG ARG 33 3.542 -1.279 -6.586
226 HD2 ARG 33 1HD ARG 33 5.788 -1.583 -7.500
227 HD3 ARG 33 2HD ARG 33 5.840 -1.242 -5.771
228 HE ARG 33 HE ARG 33 6.122 -3.971 -6.868
229 HH11 ARG 33 1HH1 ARG 33 7.152 -1.413 -4.717
230 HH12 ARG 33 2HH1 ARG 33 8.426 -2.343 -4.001
231 HH21 ARG 33 1HH2 ARG 33 7.817 -5.203 -5.924
232 HH22 ARG 33 2HH2 ARG 33 8.801 -4.496 -4.684
233 H VAL 34 H VAL 34 1.747 -4.918 -4.146
234 HA VAL 34 HA VAL 34 1.047 -4.374 -1.325
235 HB VAL 34 HB VAL 34 0.114 -6.652 -3.098
236 HG11 VAL 34 1HG1 VAL 34 0.311 -7.353 -0.775
237 HG12 VAL 34 2HG1 VAL 34 -1.388 -7.214 -1.227
238 HG13 VAL 34 3HG1 VAL 34 -0.631 -5.955 -0.252
239 HG21 VAL 34 1HG2 VAL 34 -2.119 -5.581 -2.908
240 HG22 VAL 34 2HG2 VAL 34 -0.946 -4.575 -3.758
241 HG23 VAL 34 3HG2 VAL 34 -1.363 -4.216 -2.084
242 H HIS 35 H HIS 35 2.468 -5.114 0.092
243 HA HIS 35 HA HIS 35 4.438 -7.110 -0.840
244 HB2 HIS 35 1HB HIS 35 5.181 -4.700 -0.454
245 HB3 HIS 35 2HB HIS 35 4.858 -4.964 1.253
246 HD1 HIS 35 HD1 HIS 35 7.626 -4.609 -0.647
247 HD2 HIS 35 HD2 HIS 35 6.394 -7.737 1.798
248 HE1 HIS 35 HE1 HIS 35 9.719 -5.877 -0.058
249 HE2 HIS 35 HE2 HIS 35 8.966 -7.624 1.597
250 H CYS 36 H CYS 36 3.472 -8.957 0.010
251 HA CYS 36 HA CYS 36 3.643 -9.110 2.951
252 HB2 CYS 36 2HB CYS 36 1.747 -10.618 1.127
253 HB3 CYS 36 1HB CYS 36 1.987 -10.992 2.830
254 H GLY 37 H GLY 37 5.616 -9.899 3.199
255 HA2 GLY 37 1HA GLY 37 6.792 -12.130 3.176
256 HA3 GLY 37 2HA GLY 37 6.526 -12.088 1.437
Start of MODEL 12
1 H1 ALA 1 1H ALA 1 0.071 -13.513 9.245
2 H2 ALA 1 2H ALA 1 0.389 -12.736 10.714
3 H3 ALA 1 3H ALA 1 1.337 -14.047 10.230
4 HA ALA 1 HA ALA 1 2.502 -11.972 9.915
5 HB1 ALA 1 1HB ALA 1 3.153 -12.315 7.587
6 HB2 ALA 1 2HB ALA 1 1.715 -13.300 7.315
7 HB3 ALA 1 3HB ALA 1 2.972 -13.860 8.419
8 HA PRO 2 HA PRO 2 -0.039 -8.575 8.374
9 HB2 PRO 2 2HB PRO 2 1.774 -6.615 8.609
10 HB3 PRO 2 1HB PRO 2 1.053 -7.355 10.043
11 HG2 PRO 2 2HG PRO 2 3.733 -7.859 8.802
12 HG3 PRO 2 1HG PRO 2 3.307 -7.693 10.516
13 HD2 PRO 2 2HD PRO 2 3.655 -10.110 9.223
14 HD3 PRO 2 1HD PRO 2 2.680 -9.891 10.690
15 H CYS 3 H CYS 3 0.968 -6.532 6.822
16 HA CYS 3 HA CYS 3 2.179 -7.920 4.521
17 HB2 CYS 3 2HB CYS 3 -0.027 -5.870 4.269
18 HB3 CYS 3 1HB CYS 3 0.633 -6.903 3.007
19 H GLU 4 H GLU 4 3.496 -6.688 3.203
20 HA GLU 4 HA GLU 4 4.276 -4.040 4.238
21 HB2 GLU 4 1HB GLU 4 5.932 -5.991 2.600
22 HB3 GLU 4 2HB GLU 4 6.476 -4.442 3.217
23 HG2 GLU 4 1HG GLU 4 7.405 -6.053 4.649
24 HG3 GLU 4 2HG GLU 4 6.052 -5.364 5.542
25 H CYS 5 H CYS 5 4.241 -2.338 2.831
26 HA CYS 5 HA CYS 5 3.526 -2.877 0.032
27 HB2 CYS 5 2HB CYS 5 2.110 -1.002 1.935
28 HB3 CYS 5 1HB CYS 5 1.847 -1.029 0.194
29 H ASP 6 H ASP 6 4.216 -1.389 -1.445
30 HA ASP 6 HA ASP 6 5.840 0.857 -0.454
31 HB2 ASP 6 1HB ASP 6 7.138 -0.809 -1.756
32 HB3 ASP 6 2HB ASP 6 6.042 -0.586 -3.117
33 H VAL 7 H VAL 7 5.654 2.813 -1.603
34 HA VAL 7 HA VAL 7 3.318 3.231 -3.295
35 HB VAL 7 HB VAL 7 3.795 4.826 -0.749
36 HG11 VAL 7 1HG1 VAL 7 2.837 6.153 -2.557
37 HG12 VAL 7 2HG1 VAL 7 1.664 5.907 -1.264
38 HG13 VAL 7 3HG1 VAL 7 1.543 4.971 -2.755
39 HG21 VAL 7 1HG2 VAL 7 1.622 2.803 -1.332
40 HG22 VAL 7 2HG2 VAL 7 1.703 3.837 0.096
41 HG23 VAL 7 3HG2 VAL 7 2.941 2.611 -0.178
42 H ASN 8 H ASN 8 4.535 3.912 -5.001
43 HA ASN 8 HA ASN 8 5.835 5.225 -6.319
44 HB2 ASN 8 1HB ASN 8 5.075 7.210 -4.175
45 HB3 ASN 8 2HB ASN 8 6.057 7.672 -5.560
46 HD21 ASN 8 1HD2 ASN 8 3.155 6.679 -7.736
47 HD22 ASN 8 2HD2 ASN 8 4.722 5.996 -7.475
48 H GLY 9 H GLY 9 7.090 3.735 -3.949
49 HA2 GLY 9 1HA GLY 9 9.470 3.375 -3.902
50 HA3 GLY 9 2HA GLY 9 9.702 5.096 -4.172
51 H GLU 10 H GLU 10 7.250 4.680 -1.943
52 HA GLU 10 HA GLU 10 9.129 4.836 0.330
53 HB2 GLU 10 1HB GLU 10 6.298 5.909 0.164
54 HB3 GLU 10 2HB GLU 10 7.395 6.085 1.529
55 HG2 GLU 10 1HG GLU 10 8.948 7.332 -0.006
56 HG3 GLU 10 2HG GLU 10 7.660 7.308 -1.211
57 H THR 11 H THR 11 8.724 3.530 2.151
58 HA THR 11 HA THR 11 6.992 1.234 1.485
59 HB THR 11 HB THR 11 9.567 1.209 3.078
60 HG1 THR 11 1HG THR 11 9.043 1.099 0.373
61 HG21 THR 11 1HG2 THR 11 7.883 -1.065 1.996
62 HG22 THR 11 2HG2 THR 11 8.005 -0.596 3.692
63 HG23 THR 11 3HG2 THR 11 9.419 -1.228 2.849
64 H TYR 12 H TYR 12 5.405 0.800 2.804
65 HA TYR 12 HA TYR 12 5.572 1.491 5.662
66 HB2 TYR 12 2HB TYR 12 3.204 2.016 3.830
67 HB3 TYR 12 1HB TYR 12 3.178 2.201 5.578
68 HD1 TYR 12 1HD TYR 12 4.672 3.952 6.635
69 HD2 TYR 12 2HD TYR 12 3.990 3.773 2.434
70 HE1 TYR 12 1HE TYR 12 5.442 6.278 6.416
71 HE2 TYR 12 2HE TYR 12 4.756 6.099 2.206
72 HH TYR 12 HH TYR 12 4.969 8.114 3.588
73 H THR 13 H THR 13 3.972 0.230 6.957
74 HA THR 13 HA THR 13 3.429 -2.386 5.696
75 HB THR 13 HB THR 13 3.478 -3.305 8.051
76 HG1 THR 13 1HG THR 13 3.487 -0.827 8.758
77 HG21 THR 13 1HG2 THR 13 6.045 -2.034 7.077
78 HG22 THR 13 2HG2 THR 13 5.387 -3.575 6.526
79 HG23 THR 13 3HG2 THR 13 5.916 -3.390 8.197
80 H VAL 14 H VAL 14 1.432 -3.296 5.926
81 HA VAL 14 HA VAL 14 -0.638 -1.695 7.288
82 HB VAL 14 HB VAL 14 -2.221 -2.293 5.476
83 HG11 VAL 14 1HG1 VAL 14 0.243 -0.843 4.490
84 HG12 VAL 14 2HG1 VAL 14 -1.084 -0.128 5.405
85 HG13 VAL 14 3HG1 VAL 14 -1.369 -0.746 3.777
86 HG21 VAL 14 1HG2 VAL 14 -1.388 -3.210 3.364
87 HG22 VAL 14 2HG2 VAL 14 -1.114 -4.333 4.694
88 HG23 VAL 14 3HG2 VAL 14 0.225 -3.373 4.060
89 H SER 15 H SER 15 -2.592 -2.964 7.836
90 HA SER 15 HA SER 15 -1.809 -5.327 9.204
91 HB2 SER 15 1HB SER 15 -3.545 -3.698 10.004
92 HB3 SER 15 2HB SER 15 -4.632 -4.320 8.765
93 HG SER 15 HG SER 15 -4.263 -6.439 9.773
94 H SER 16 H SER 16 -3.221 -4.779 6.068
95 HA SER 16 HA SER 16 -2.930 -7.525 5.363
96 HB2 SER 16 1HB SER 16 -5.072 -7.608 6.660
97 HB3 SER 16 2HB SER 16 -5.777 -6.492 5.493
98 HG SER 16 HG SER 16 -4.822 -9.127 5.014
99 H SER 17 H SER 17 -3.893 -7.922 3.108
100 HA SER 17 HA SER 17 -2.747 -6.026 1.359
101 HB2 SER 17 1HB SER 17 -2.947 -8.480 0.882
102 HB3 SER 17 2HB SER 17 -4.679 -8.253 0.641
103 HG SER 17 HG SER 17 -4.013 -6.645 -1.005
104 H GLU 18 H GLU 18 -6.084 -6.704 2.296
105 HA GLU 18 HA GLU 18 -7.394 -4.944 0.562
106 HB2 GLU 18 1HB GLU 18 -8.566 -6.580 2.007
107 HB3 GLU 18 2HB GLU 18 -8.129 -5.637 3.425
108 HG2 GLU 18 1HG GLU 18 -10.440 -5.239 2.770
109 HG3 GLU 18 2HG GLU 18 -9.477 -3.769 2.632
110 H GLU 19 H GLU 19 -6.156 -4.409 3.850
111 HA GLU 19 HA GLU 19 -6.691 -1.689 4.078
112 HB2 GLU 19 1HB GLU 19 -4.528 -3.415 5.285
113 HB3 GLU 19 2HB GLU 19 -4.687 -1.709 5.684
114 HG2 GLU 19 1HG GLU 19 -6.796 -3.823 6.101
115 HG3 GLU 19 2HG GLU 19 -5.759 -3.128 7.348
116 H CYS 20 H CYS 20 -3.991 -3.358 2.553
117 HA CYS 20 HA CYS 20 -2.350 -1.151 2.031
118 HB2 CYS 20 2HB CYS 20 -1.826 -3.620 1.641
119 HB3 CYS 20 1HB CYS 20 -2.719 -3.473 0.130
120 H GLU 21 H GLU 21 -4.914 -2.611 0.039
121 HA GLU 21 HA GLU 21 -4.952 -0.755 -2.039
122 HB2 GLU 21 1HB GLU 21 -7.137 -2.445 -0.815
123 HB3 GLU 21 2HB GLU 21 -7.438 -1.394 -2.192
124 HG2 GLU 21 1HG GLU 21 -5.416 -3.629 -2.135
125 HG3 GLU 21 2HG GLU 21 -7.034 -3.735 -2.830
126 H ARG 22 H ARG 22 -6.784 -0.757 1.021
127 HA ARG 22 HA ARG 22 -8.336 1.458 0.674
128 HB2 ARG 22 1HB ARG 22 -6.964 0.490 3.193
129 HB3 ARG 22 2HB ARG 22 -8.345 1.548 3.119
130 HG2 ARG 22 1HG ARG 22 -8.331 -1.268 2.091
131 HG3 ARG 22 2HG ARG 22 -8.931 -0.784 3.676
132 HD2 ARG 22 1HD ARG 22 -10.633 0.611 2.627
133 HD3 ARG 22 2HD ARG 22 -10.002 0.203 1.029
134 HE ARG 22 HE ARG 22 -11.044 -1.844 1.149
135 HH11 ARG 22 1HH1 ARG 22 -11.069 -0.379 4.335
136 HH12 ARG 22 2HH1 ARG 22 -12.227 -1.499 4.978
137 HH21 ARG 22 1HH2 ARG 22 -12.586 -3.301 1.984
138 HH22 ARG 22 2HH2 ARG 22 -13.087 -3.169 3.642
139 H LEU 23 H LEU 23 -5.131 1.334 2.237
140 HA LEU 23 HA LEU 23 -4.858 4.075 2.686
141 HB2 LEU 23 1HB LEU 23 -3.467 2.347 3.749
142 HB3 LEU 23 2HB LEU 23 -2.699 2.014 2.207
143 HG LEU 23 HG LEU 23 -1.753 4.302 2.193
144 HD11 LEU 23 1HD1 LEU 23 -3.435 5.451 3.513
145 HD12 LEU 23 2HD1 LEU 23 -1.842 5.661 4.239
146 HD13 LEU 23 3HD1 LEU 23 -2.986 4.518 4.942
147 HD21 LEU 23 1HD2 LEU 23 -1.122 2.707 4.684
148 HD22 LEU 23 2HD2 LEU 23 -0.094 3.950 3.967
149 HD23 LEU 23 3HD2 LEU 23 -0.424 2.462 3.082
150 H CYS 24 H CYS 24 -3.638 2.100 -0.016
151 HA CYS 24 HA CYS 24 -2.267 4.140 -1.359
152 HB2 CYS 24 2HB CYS 24 -2.003 1.730 -1.843
153 HB3 CYS 24 1HB CYS 24 -3.613 1.696 -2.546
154 H ARG 25 H ARG 25 -5.602 2.962 -1.839
155 HA ARG 25 HA ARG 25 -6.171 4.793 -3.964
156 HB2 ARG 25 1HB ARG 25 -8.228 3.392 -2.241
157 HB3 ARG 25 2HB ARG 25 -8.429 3.985 -3.883
158 HG2 ARG 25 1HG ARG 25 -6.749 1.649 -2.999
159 HG3 ARG 25 2HG ARG 25 -8.268 1.582 -3.883
160 HD2 ARG 25 1HD ARG 25 -7.236 2.606 -5.813
161 HD3 ARG 25 2HD ARG 25 -5.731 2.851 -4.922
162 HE ARG 25 HE ARG 25 -6.293 0.136 -4.810
163 HH11 ARG 25 1HH1 ARG 25 -5.596 2.485 -7.322
164 HH12 ARG 25 2HH1 ARG 25 -4.862 1.313 -8.375
165 HH21 ARG 25 1HH2 ARG 25 -5.310 -1.378 -6.157
166 HH22 ARG 25 2HH2 ARG 25 -4.687 -0.889 -7.707
167 H LYS 26 H LYS 26 -6.426 4.890 -0.493
168 HA LYS 26 HA LYS 26 -8.239 7.072 -0.278
169 HB2 LYS 26 1HB LYS 26 -7.293 5.309 1.506
170 HB3 LYS 26 2HB LYS 26 -6.155 6.604 1.825
171 HG2 LYS 26 1HG LYS 26 -9.147 6.961 1.914
172 HG3 LYS 26 2HG LYS 26 -8.178 6.510 3.313
173 HD2 LYS 26 1HD LYS 26 -6.885 8.611 3.052
174 HD3 LYS 26 2HD LYS 26 -7.937 9.060 1.705
175 HE2 LYS 26 1HE LYS 26 -9.870 9.060 3.179
176 HE3 LYS 26 2HE LYS 26 -8.873 8.519 4.529
177 HZ1 LYS 26 1HZ LYS 26 -8.615 11.110 3.100
178 HZ2 LYS 26 2HZ LYS 26 -7.636 10.596 4.378
179 HZ3 LYS 26 3HZ LYS 26 -9.279 10.884 4.639
180 H LEU 27 H LEU 27 -4.698 6.815 -0.205
181 HA LEU 27 HA LEU 27 -4.223 9.619 -0.069
182 HB2 LEU 27 1HB LEU 27 -2.432 7.391 -1.072
183 HB3 LEU 27 2HB LEU 27 -1.909 9.031 -0.731
184 HG LEU 27 HG LEU 27 -2.975 7.068 1.315
185 HD11 LEU 27 1HD1 LEU 27 -0.750 6.465 0.500
186 HD12 LEU 27 2HD1 LEU 27 -0.692 7.025 2.171
187 HD13 LEU 27 3HD1 LEU 27 -0.169 8.091 0.865
188 HD21 LEU 27 1HD2 LEU 27 -3.543 9.375 1.879
189 HD22 LEU 27 2HD2 LEU 27 -1.858 9.852 1.671
190 HD23 LEU 27 3HD2 LEU 27 -2.308 8.744 2.968
191 H GLY 28 H GLY 28 -4.757 7.324 -2.648
192 HA2 GLY 28 1HA GLY 28 -5.703 7.938 -4.731
193 HA3 GLY 28 2HA GLY 28 -5.069 9.565 -4.521
194 H VAL 29 H VAL 29 -3.195 6.665 -4.017
195 HA VAL 29 HA VAL 29 -1.395 7.488 -6.183
196 HB VAL 29 HB VAL 29 -0.948 5.507 -3.930
197 HG11 VAL 29 1HG1 VAL 29 0.992 6.646 -5.946
198 HG12 VAL 29 2HG1 VAL 29 0.417 4.981 -5.879
199 HG13 VAL 29 3HG1 VAL 29 1.421 5.620 -4.579
200 HG21 VAL 29 1HG2 VAL 29 0.032 8.352 -4.241
201 HG22 VAL 29 2HG2 VAL 29 0.492 7.242 -2.950
202 HG23 VAL 29 3HG2 VAL 29 -1.179 7.788 -3.090
203 H THR 30 H THR 30 -0.851 6.108 -7.852
204 HA THR 30 HA THR 30 -2.581 3.762 -8.199
205 HB THR 30 HB THR 30 -0.879 5.209 -10.255
206 HG1 THR 30 1HG THR 30 -3.113 6.011 -9.123
207 HG21 THR 30 1HG2 THR 30 -2.223 3.995 -11.905
208 HG22 THR 30 2HG2 THR 30 -3.084 3.163 -10.609
209 HG23 THR 30 3HG2 THR 30 -1.362 2.870 -10.854
210 H ASN 31 H ASN 31 0.778 4.763 -7.979
211 HA ASN 31 HA ASN 31 1.727 2.081 -8.649
212 HB2 ASN 31 1HB ASN 31 2.870 4.076 -9.615
213 HB3 ASN 31 2HB ASN 31 3.345 4.556 -7.991
214 HD21 ASN 31 1HD2 ASN 31 5.340 1.637 -9.968
215 HD22 ASN 31 2HD2 ASN 31 3.878 2.318 -10.586
216 H CYS 32 H CYS 32 0.837 1.074 -6.803
217 HA CYS 32 HA CYS 32 2.584 1.311 -4.422
218 HB2 CYS 32 2HB CYS 32 -0.356 0.508 -4.471
219 HB3 CYS 32 1HB CYS 32 0.673 0.564 -3.046
220 H ARG 33 H ARG 33 3.503 -0.612 -3.776
221 HA ARG 33 HA ARG 33 2.778 -3.011 -5.340
222 HB2 ARG 33 1HB ARG 33 5.095 -1.978 -5.693
223 HB3 ARG 33 2HB ARG 33 5.470 -2.510 -4.058
224 HG2 ARG 33 1HG ARG 33 6.295 -4.101 -5.705
225 HG3 ARG 33 2HG ARG 33 5.033 -4.831 -4.707
226 HD2 ARG 33 1HD ARG 33 4.787 -5.391 -7.101
227 HD3 ARG 33 2HD ARG 33 3.398 -4.505 -6.473
228 HE ARG 33 HE ARG 33 5.542 -3.140 -7.973
229 HH11 ARG 33 1HH1 ARG 33 2.150 -3.891 -7.509
230 HH12 ARG 33 2HH1 ARG 33 1.614 -2.817 -8.762
231 HH21 ARG 33 1HH2 ARG 33 4.831 -1.704 -9.604
232 HH22 ARG 33 2HH2 ARG 33 3.133 -1.564 -9.947
233 H VAL 34 H VAL 34 2.240 -4.839 -4.240
234 HA VAL 34 HA VAL 34 2.242 -4.639 -1.291
235 HB VAL 34 HB VAL 34 0.306 -6.194 -3.025
236 HG11 VAL 34 1HG1 VAL 34 0.253 -5.557 -0.072
237 HG12 VAL 34 2HG1 VAL 34 0.572 -7.136 -0.792
238 HG13 VAL 34 3HG1 VAL 34 -1.018 -6.393 -0.968
239 HG21 VAL 34 1HG2 VAL 34 -0.068 -3.522 -1.665
240 HG22 VAL 34 2HG2 VAL 34 -1.338 -4.450 -2.458
241 HG23 VAL 34 3HG2 VAL 34 0.004 -3.810 -3.404
242 H HIS 35 H HIS 35 3.231 -6.154 -0.156
243 HA HIS 35 HA HIS 35 3.518 -8.868 -1.252
244 HB2 HIS 35 1HB HIS 35 5.732 -7.911 -1.489
245 HB3 HIS 35 2HB HIS 35 5.679 -7.265 0.150
246 HD1 HIS 35 HD1 HIS 35 6.021 -8.947 2.112
247 HD2 HIS 35 HD2 HIS 35 6.409 -10.622 -1.681
248 HE1 HIS 35 HE1 HIS 35 7.028 -11.221 2.471
249 HE2 HIS 35 HE2 HIS 35 7.125 -12.265 0.183
250 H CYS 36 H CYS 36 2.485 -10.223 0.094
251 HA CYS 36 HA CYS 36 2.657 -9.783 2.979
252 HB2 CYS 36 2HB CYS 36 0.578 -8.640 2.071
253 HB3 CYS 36 1HB CYS 36 -0.017 -10.238 1.640
254 H GLY 37 H GLY 37 3.367 -11.640 3.786
255 HA2 GLY 37 1HA GLY 37 2.236 -14.040 3.947
256 HA3 GLY 37 2HA GLY 37 2.959 -14.135 2.346
Start of MODEL 13
1 H1 ALA 1 1H ALA 1 -1.382 -12.874 11.242
2 H2 ALA 1 2H ALA 1 -1.673 -12.240 9.704
3 H3 ALA 1 3H ALA 1 -2.081 -11.345 11.075
4 HA ALA 1 HA ALA 1 0.226 -11.154 11.696
5 HB1 ALA 1 1HB ALA 1 1.970 -11.895 10.127
6 HB2 ALA 1 2HB ALA 1 0.730 -12.616 9.097
7 HB3 ALA 1 3HB ALA 1 1.008 -13.250 10.719
8 HA PRO 2 HA PRO 2 -0.137 -7.427 9.307
9 HB2 PRO 2 2HB PRO 2 2.186 -6.197 9.900
10 HB3 PRO 2 1HB PRO 2 0.919 -6.420 11.113
11 HG2 PRO 2 2HG PRO 2 3.419 -8.018 10.675
12 HG3 PRO 2 1HG PRO 2 2.712 -7.444 12.198
13 HD2 PRO 2 2HD PRO 2 2.401 -9.993 11.262
14 HD3 PRO 2 1HD PRO 2 1.208 -9.181 12.296
15 H CYS 3 H CYS 3 0.626 -6.420 7.411
16 HA CYS 3 HA CYS 3 2.787 -7.809 5.959
17 HB2 CYS 3 2HB CYS 3 0.184 -6.827 4.742
18 HB3 CYS 3 1HB CYS 3 1.486 -7.657 3.898
19 H GLU 4 H GLU 4 3.222 -6.315 3.853
20 HA GLU 4 HA GLU 4 3.519 -3.567 4.878
21 HB2 GLU 4 1HB GLU 4 5.257 -5.008 2.862
22 HB3 GLU 4 2HB GLU 4 5.497 -3.368 3.442
23 HG2 GLU 4 1HG GLU 4 6.921 -4.304 4.894
24 HG3 GLU 4 2HG GLU 4 5.471 -4.764 5.787
25 H CYS 5 H CYS 5 3.878 -1.988 3.022
26 HA CYS 5 HA CYS 5 2.236 -2.544 0.676
27 HB2 CYS 5 2HB CYS 5 0.704 -1.599 2.405
28 HB3 CYS 5 1HB CYS 5 1.731 -0.173 2.500
29 H ASP 6 H ASP 6 2.876 -1.377 -1.091
30 HA ASP 6 HA ASP 6 5.225 0.366 -0.732
31 HB2 ASP 6 1HB ASP 6 5.610 -1.835 -1.927
32 HB3 ASP 6 2HB ASP 6 4.527 -1.267 -3.185
33 H VAL 7 H VAL 7 5.137 2.350 -1.622
34 HA VAL 7 HA VAL 7 2.870 3.128 -3.299
35 HB VAL 7 HB VAL 7 3.684 4.641 -0.795
36 HG11 VAL 7 1HG1 VAL 7 2.900 6.118 -2.554
37 HG12 VAL 7 2HG1 VAL 7 1.706 6.029 -1.259
38 HG13 VAL 7 3HG1 VAL 7 1.446 5.140 -2.760
39 HG21 VAL 7 1HG2 VAL 7 1.462 4.015 0.099
40 HG22 VAL 7 2HG2 VAL 7 2.515 2.620 -0.143
41 HG23 VAL 7 3HG2 VAL 7 1.219 2.959 -1.295
42 H ASN 8 H ASN 8 4.012 3.691 -5.055
43 HA ASN 8 HA ASN 8 5.436 4.758 -6.459
44 HB2 ASN 8 1HB ASN 8 5.736 6.745 -4.187
45 HB3 ASN 8 2HB ASN 8 6.240 7.011 -5.851
46 HD21 ASN 8 1HD2 ASN 8 3.020 7.727 -7.041
47 HD22 ASN 8 2HD2 ASN 8 4.632 7.261 -7.462
48 H GLY 9 H GLY 9 6.434 2.878 -4.222
49 HA2 GLY 9 1HA GLY 9 8.625 1.880 -4.403
50 HA3 GLY 9 2HA GLY 9 9.298 3.487 -4.619
51 H GLU 10 H GLU 10 7.101 3.952 -2.283
52 HA GLU 10 HA GLU 10 9.091 3.674 -0.157
53 HB2 GLU 10 1HB GLU 10 7.904 5.837 -0.447
54 HB3 GLU 10 2HB GLU 10 6.375 5.028 -0.132
55 HG2 GLU 10 1HG GLU 10 7.195 6.241 1.827
56 HG3 GLU 10 2HG GLU 10 7.077 4.508 2.130
57 H THR 11 H THR 11 8.628 2.556 1.825
58 HA THR 11 HA THR 11 6.545 0.486 1.515
59 HB THR 11 HB THR 11 9.186 0.277 2.982
60 HG1 THR 11 1HG THR 11 9.376 0.181 0.692
61 HG21 THR 11 1HG2 THR 11 6.998 -1.771 2.544
62 HG22 THR 11 2HG2 THR 11 7.480 -1.071 4.090
63 HG23 THR 11 3HG2 THR 11 8.591 -2.123 3.212
64 H TYR 12 H TYR 12 4.897 0.798 2.802
65 HA TYR 12 HA TYR 12 5.348 1.652 5.593
66 HB2 TYR 12 2HB TYR 12 2.839 1.847 3.891
67 HB3 TYR 12 1HB TYR 12 2.938 2.294 5.588
68 HD1 TYR 12 1HD TYR 12 4.542 4.187 6.238
69 HD2 TYR 12 2HD TYR 12 3.377 3.418 2.212
70 HE1 TYR 12 1HE TYR 12 5.219 6.465 5.614
71 HE2 TYR 12 2HE TYR 12 4.051 5.698 1.577
72 HH TYR 12 HH TYR 12 5.937 7.683 3.560
73 H THR 13 H THR 13 3.467 0.661 7.023
74 HA THR 13 HA THR 13 3.279 -2.206 6.335
75 HB THR 13 HB THR 13 2.989 -2.487 8.888
76 HG1 THR 13 1HG THR 13 2.772 -0.174 9.254
77 HG21 THR 13 1HG2 THR 13 5.674 -1.605 7.787
78 HG22 THR 13 2HG2 THR 13 4.990 -3.230 7.677
79 HG23 THR 13 3HG2 THR 13 5.418 -2.560 9.251
80 H VAL 14 H VAL 14 1.336 -3.217 6.444
81 HA VAL 14 HA VAL 14 -1.019 -1.678 7.293
82 HB VAL 14 HB VAL 14 -2.232 -2.400 5.236
83 HG11 VAL 14 1HG1 VAL 14 -1.351 -0.134 5.388
84 HG12 VAL 14 2HG1 VAL 14 -1.255 -0.728 3.731
85 HG13 VAL 14 3HG1 VAL 14 0.197 -0.675 4.733
86 HG21 VAL 14 1HG2 VAL 14 -0.817 -4.292 4.603
87 HG22 VAL 14 2HG2 VAL 14 0.517 -3.191 4.251
88 HG23 VAL 14 3HG2 VAL 14 -0.952 -3.138 3.276
89 H SER 15 H SER 15 -3.008 -3.087 7.263
90 HA SER 15 HA SER 15 -2.637 -5.364 8.852
91 HB2 SER 15 1HB SER 15 -5.109 -4.770 7.210
92 HB3 SER 15 2HB SER 15 -5.013 -5.598 8.766
93 HG SER 15 HG SER 15 -5.542 -3.121 8.463
94 H SER 16 H SER 16 -3.157 -4.978 5.392
95 HA SER 16 HA SER 16 -2.057 -7.474 4.680
96 HB2 SER 16 1HB SER 16 -4.153 -8.396 5.576
97 HB3 SER 16 2HB SER 16 -5.093 -7.296 4.569
98 HG SER 16 HG SER 16 -5.054 -9.150 3.435
99 H SER 17 H SER 17 -2.764 -7.937 2.236
100 HA SER 17 HA SER 17 -1.909 -5.798 0.684
101 HB2 SER 17 1HB SER 17 -3.651 -8.105 -0.225
102 HB3 SER 17 2HB SER 17 -2.570 -7.141 -1.234
103 HG SER 17 HG SER 17 -1.379 -8.884 -0.747
104 H GLU 18 H GLU 18 -5.186 -6.871 1.448
105 HA GLU 18 HA GLU 18 -6.682 -5.119 -0.115
106 HB2 GLU 18 1HB GLU 18 -7.295 -6.079 2.703
107 HB3 GLU 18 2HB GLU 18 -8.461 -5.363 1.600
108 HG2 GLU 18 1HG GLU 18 -8.831 -7.690 1.544
109 HG3 GLU 18 2HG GLU 18 -8.010 -7.288 0.039
110 H GLU 19 H GLU 19 -5.370 -4.695 3.140
111 HA GLU 19 HA GLU 19 -6.355 -2.103 3.613
112 HB2 GLU 19 1HB GLU 19 -5.397 -3.717 5.324
113 HB3 GLU 19 2HB GLU 19 -3.799 -3.275 4.738
114 HG2 GLU 19 1HG GLU 19 -4.225 -2.005 6.698
115 HG3 GLU 19 2HG GLU 19 -4.320 -0.902 5.323
116 H CYS 20 H CYS 20 -3.412 -3.310 2.102
117 HA CYS 20 HA CYS 20 -2.022 -0.880 1.853
118 HB2 CYS 20 2HB CYS 20 -0.891 -2.978 1.441
119 HB3 CYS 20 1HB CYS 20 -1.979 -3.355 0.109
120 H GLU 21 H GLU 21 -4.355 -2.471 -0.303
121 HA GLU 21 HA GLU 21 -4.115 -0.564 -2.384
122 HB2 GLU 21 1HB GLU 21 -5.607 -1.862 -3.520
123 HB3 GLU 21 2HB GLU 21 -5.184 -3.013 -2.273
124 HG2 GLU 21 1HG GLU 21 -7.450 -3.226 -2.254
125 HG3 GLU 21 2HG GLU 21 -7.261 -1.963 -1.039
126 H ARG 22 H ARG 22 -6.393 -0.918 0.325
127 HA ARG 22 HA ARG 22 -7.992 1.276 -0.227
128 HB2 ARG 22 1HB ARG 22 -7.208 -0.020 2.387
129 HB3 ARG 22 2HB ARG 22 -8.465 1.168 2.212
130 HG2 ARG 22 1HG ARG 22 -9.530 -0.419 0.521
131 HG3 ARG 22 2HG ARG 22 -8.402 -1.620 1.153
132 HD2 ARG 22 1HD ARG 22 -10.496 -0.112 2.724
133 HD3 ARG 22 2HD ARG 22 -10.558 -1.810 2.260
134 HE ARG 22 HE ARG 22 -8.394 -0.840 4.013
135 HH11 ARG 22 1HH1 ARG 22 -11.208 -2.880 3.505
136 HH12 ARG 22 2HH1 ARG 22 -10.984 -3.765 4.981
137 HH21 ARG 22 1HH2 ARG 22 -8.159 -1.976 5.987
138 HH22 ARG 22 2HH2 ARG 22 -9.270 -3.254 6.384
139 H LEU 23 H LEU 23 -5.001 1.027 1.674
140 HA LEU 23 HA LEU 23 -4.900 3.694 2.563
141 HB2 LEU 23 1HB LEU 23 -3.523 1.892 3.520
142 HB3 LEU 23 2HB LEU 23 -2.628 1.773 2.017
143 HG LEU 23 HG LEU 23 -1.781 4.080 2.353
144 HD11 LEU 23 1HD1 LEU 23 -2.059 5.146 4.553
145 HD12 LEU 23 2HD1 LEU 23 -3.215 3.889 5.002
146 HD13 LEU 23 3HD1 LEU 23 -3.585 4.996 3.680
147 HD21 LEU 23 1HD2 LEU 23 -0.233 3.549 4.179
148 HD22 LEU 23 2HD2 LEU 23 -0.444 2.175 3.094
149 HD23 LEU 23 3HD2 LEU 23 -1.259 2.194 4.660
150 H CYS 24 H CYS 24 -3.550 2.106 -0.290
151 HA CYS 24 HA CYS 24 -2.168 4.242 -1.422
152 HB2 CYS 24 2HB CYS 24 -2.003 1.933 -2.242
153 HB3 CYS 24 1HB CYS 24 -3.670 1.992 -2.800
154 H ARG 25 H ARG 25 -5.549 3.238 -1.847
155 HA ARG 25 HA ARG 25 -6.261 5.347 -3.607
156 HB2 ARG 25 1HB ARG 25 -7.939 3.558 -1.840
157 HB3 ARG 25 2HB ARG 25 -8.617 4.692 -3.001
158 HG2 ARG 25 1HG ARG 25 -6.686 2.520 -3.781
159 HG3 ARG 25 2HG ARG 25 -8.431 2.279 -3.740
160 HD2 ARG 25 1HD ARG 25 -7.781 2.791 -5.995
161 HD3 ARG 25 2HD ARG 25 -8.681 4.161 -5.350
162 HE ARG 25 HE ARG 25 -5.752 4.267 -5.259
163 HH11 ARG 25 1HH1 ARG 25 -8.741 5.342 -6.726
164 HH12 ARG 25 2HH1 ARG 25 -8.016 6.697 -7.529
165 HH21 ARG 25 1HH2 ARG 25 -4.793 6.057 -6.315
166 HH22 ARG 25 2HH2 ARG 25 -5.769 7.110 -7.291
167 H LYS 26 H LYS 26 -6.150 5.093 -0.096
168 HA LYS 26 HA LYS 26 -7.637 7.409 0.483
169 HB2 LYS 26 1HB LYS 26 -5.682 5.665 1.928
170 HB3 LYS 26 2HB LYS 26 -6.111 7.204 2.621
171 HG2 LYS 26 1HG LYS 26 -8.026 4.991 1.929
172 HG3 LYS 26 2HG LYS 26 -7.483 5.431 3.550
173 HD2 LYS 26 1HD LYS 26 -8.535 7.628 3.330
174 HD3 LYS 26 2HD LYS 26 -9.035 7.238 1.682
175 HE2 LYS 26 1HE LYS 26 -10.414 5.390 2.569
176 HE3 LYS 26 2HE LYS 26 -9.942 5.844 4.209
177 HZ1 LYS 26 1HZ LYS 26 -12.113 6.738 3.571
178 HZ2 LYS 26 2HZ LYS 26 -11.399 7.599 2.303
179 HZ3 LYS 26 3HZ LYS 26 -11.007 7.973 3.905
180 H LEU 27 H LEU 27 -4.157 6.796 0.140
181 HA LEU 27 HA LEU 27 -3.328 9.477 0.476
182 HB2 LEU 27 1HB LEU 27 -1.993 7.252 -1.088
183 HB3 LEU 27 2HB LEU 27 -1.228 8.752 -0.597
184 HG LEU 27 HG LEU 27 -2.238 6.600 1.275
185 HD11 LEU 27 1HD1 LEU 27 -0.241 5.911 0.063
186 HD12 LEU 27 2HD1 LEU 27 0.125 6.209 1.761
187 HD13 LEU 27 3HD1 LEU 27 0.578 7.396 0.539
188 HD21 LEU 27 1HD2 LEU 27 -1.136 7.908 3.038
189 HD22 LEU 27 2HD2 LEU 27 -2.451 8.803 2.281
190 HD23 LEU 27 3HD2 LEU 27 -0.777 9.178 1.868
191 H GLY 28 H GLY 28 -4.569 7.644 -2.213
192 HA2 GLY 28 1HA GLY 28 -5.708 8.639 -4.040
193 HA3 GLY 28 2HA GLY 28 -4.805 10.124 -3.778
194 H VAL 29 H VAL 29 -3.085 7.180 -3.676
195 HA VAL 29 HA VAL 29 -1.629 7.928 -6.098
196 HB VAL 29 HB VAL 29 -0.943 5.870 -3.979
197 HG11 VAL 29 1HG1 VAL 29 0.155 5.414 -6.107
198 HG12 VAL 29 2HG1 VAL 29 1.327 5.977 -4.914
199 HG13 VAL 29 3HG1 VAL 29 0.755 7.076 -6.171
200 HG21 VAL 29 1HG2 VAL 29 0.612 7.522 -3.084
201 HG22 VAL 29 2HG2 VAL 29 -1.039 8.141 -3.050
202 HG23 VAL 29 3HG2 VAL 29 0.086 8.697 -4.291
203 H THR 30 H THR 30 -1.153 6.383 -7.723
204 HA THR 30 HA THR 30 -2.920 4.020 -7.797
205 HB THR 30 HB THR 30 -2.522 4.080 -10.284
206 HG1 THR 30 1HG THR 30 -1.475 5.798 -11.175
207 HG21 THR 30 1HG2 THR 30 -4.578 5.024 -9.333
208 HG22 THR 30 2HG2 THR 30 -4.045 5.960 -10.729
209 HG23 THR 30 3HG2 THR 30 -3.768 6.574 -9.099
210 H ASN 31 H ASN 31 0.346 5.227 -8.180
211 HA ASN 31 HA ASN 31 1.526 2.727 -8.921
212 HB2 ASN 31 1HB ASN 31 2.764 5.274 -7.832
213 HB3 ASN 31 2HB ASN 31 3.686 3.890 -8.407
214 HD21 ASN 31 1HD2 ASN 31 3.836 5.642 -11.421
215 HD22 ASN 31 2HD2 ASN 31 4.676 5.142 -9.995
216 H CYS 32 H CYS 32 0.865 1.221 -7.400
217 HA CYS 32 HA CYS 32 2.242 1.349 -4.820
218 HB2 CYS 32 2HB CYS 32 -0.744 0.849 -5.102
219 HB3 CYS 32 1HB CYS 32 0.180 0.683 -3.612
220 H ARG 33 H ARG 33 2.295 -0.752 -3.762
221 HA ARG 33 HA ARG 33 1.781 -3.099 -5.402
222 HB2 ARG 33 1HB ARG 33 3.867 -2.603 -6.348
223 HB3 ARG 33 2HB ARG 33 4.513 -1.964 -4.853
224 HG2 ARG 33 1HG ARG 33 4.720 -4.225 -3.956
225 HG3 ARG 33 2HG ARG 33 4.026 -4.884 -5.441
226 HD2 ARG 33 1HD ARG 33 6.553 -4.944 -5.291
227 HD3 ARG 33 2HD ARG 33 5.893 -4.174 -6.736
228 HE ARG 33 HE ARG 33 6.723 -2.557 -4.416
229 HH11 ARG 33 1HH1 ARG 33 7.060 -3.375 -7.801
230 HH12 ARG 33 2HH1 ARG 33 8.034 -1.988 -8.175
231 HH21 ARG 33 1HH2 ARG 33 7.973 -0.712 -4.898
232 HH22 ARG 33 2HH2 ARG 33 8.566 -0.470 -6.514
233 H VAL 34 H VAL 34 2.193 -5.119 -4.135
234 HA VAL 34 HA VAL 34 1.720 -4.545 -1.271
235 HB VAL 34 HB VAL 34 0.340 -6.593 -1.207
236 HG11 VAL 34 1HG1 VAL 34 -1.587 -5.716 -2.478
237 HG12 VAL 34 2HG1 VAL 34 -0.512 -4.582 -3.296
238 HG13 VAL 34 3HG1 VAL 34 -0.762 -4.457 -1.555
239 HG21 VAL 34 1HG2 VAL 34 1.369 -7.846 -3.023
240 HG22 VAL 34 2HG2 VAL 34 0.800 -6.660 -4.196
241 HG23 VAL 34 3HG2 VAL 34 -0.356 -7.663 -3.322
242 H HIS 35 H HIS 35 2.580 -5.903 0.290
243 HA HIS 35 HA HIS 35 4.184 -8.205 -0.473
244 HB2 HIS 35 1HB HIS 35 5.777 -6.281 -0.591
245 HB3 HIS 35 2HB HIS 35 5.397 -5.893 1.084
246 HD1 HIS 35 HD1 HIS 35 6.110 -7.793 2.878
247 HD2 HIS 35 HD2 HIS 35 7.777 -8.116 -0.916
248 HE1 HIS 35 HE1 HIS 35 8.050 -9.363 3.126
249 HE2 HIS 35 HE2 HIS 35 8.918 -9.689 0.789
250 H CYS 36 H CYS 36 4.584 -9.600 1.328
251 HA CYS 36 HA CYS 36 3.757 -8.838 3.981
252 HB2 CYS 36 2HB CYS 36 1.606 -9.459 2.777
253 HB3 CYS 36 1HB CYS 36 2.241 -11.097 2.650
254 H GLY 37 H GLY 37 3.850 -10.979 5.417
255 HA2 GLY 37 1HA GLY 37 5.771 -12.918 4.436
256 HA3 GLY 37 2HA GLY 37 6.404 -11.807 5.645
Start of MODEL 14
1 H1 ALA 1 1H ALA 1 3.696 -11.023 12.488
2 H2 ALA 1 2H ALA 1 4.364 -9.472 12.419
3 H3 ALA 1 3H ALA 1 5.370 -10.828 12.377
4 HA ALA 1 HA ALA 1 5.160 -9.861 10.198
5 HB1 ALA 1 1HB ALA 1 5.486 -12.286 10.399
6 HB2 ALA 1 2HB ALA 1 4.524 -11.874 8.979
7 HB3 ALA 1 3HB ALA 1 3.737 -12.520 10.421
8 HA PRO 2 HA PRO 2 0.903 -8.388 9.570
9 HB2 PRO 2 2HB PRO 2 1.482 -5.832 9.020
10 HB3 PRO 2 1HB PRO 2 1.496 -6.431 10.683
11 HG2 PRO 2 2HG PRO 2 3.776 -5.777 8.892
12 HG3 PRO 2 1HG PRO 2 3.664 -5.673 10.657
13 HD2 PRO 2 2HD PRO 2 4.834 -7.769 9.123
14 HD3 PRO 2 1HD PRO 2 4.583 -7.737 10.878
15 H CYS 3 H CYS 3 2.130 -6.069 7.495
16 HA CYS 3 HA CYS 3 2.890 -7.710 5.286
17 HB2 CYS 3 2HB CYS 3 0.381 -7.886 5.239
18 HB3 CYS 3 1HB CYS 3 0.311 -6.140 5.012
19 H GLU 4 H GLU 4 3.487 -6.350 3.394
20 HA GLU 4 HA GLU 4 4.248 -3.628 4.260
21 HB2 GLU 4 1HB GLU 4 5.955 -5.667 2.811
22 HB3 GLU 4 2HB GLU 4 6.427 -4.003 3.132
23 HG2 GLU 4 1HG GLU 4 6.459 -4.397 5.496
24 HG3 GLU 4 2HG GLU 4 5.744 -5.996 5.290
25 H CYS 5 H CYS 5 4.398 -2.065 2.619
26 HA CYS 5 HA CYS 5 3.484 -2.822 -0.048
27 HB2 CYS 5 2HB CYS 5 2.153 -0.805 1.768
28 HB3 CYS 5 1HB CYS 5 1.857 -0.903 0.039
29 H ASP 6 H ASP 6 4.174 -1.521 -1.678
30 HA ASP 6 HA ASP 6 5.922 0.756 -0.999
31 HB2 ASP 6 1HB ASP 6 7.106 -1.090 -2.143
32 HB3 ASP 6 2HB ASP 6 5.951 -1.015 -3.465
33 H VAL 7 H VAL 7 4.794 2.560 -1.261
34 HA VAL 7 HA VAL 7 2.915 2.815 -3.484
35 HB VAL 7 HB VAL 7 1.980 4.699 -2.033
36 HG11 VAL 7 1HG1 VAL 7 0.795 2.596 -2.314
37 HG12 VAL 7 2HG1 VAL 7 0.633 3.163 -0.653
38 HG13 VAL 7 3HG1 VAL 7 1.759 1.862 -1.035
39 HG21 VAL 7 1HG2 VAL 7 2.378 4.543 0.379
40 HG22 VAL 7 2HG2 VAL 7 3.859 4.931 -0.498
41 HG23 VAL 7 3HG2 VAL 7 3.589 3.292 0.091
42 H ASN 8 H ASN 8 4.134 3.682 -5.063
43 HA ASN 8 HA ASN 8 5.155 5.277 -6.307
44 HB2 ASN 8 1HB ASN 8 3.398 6.722 -5.222
45 HB3 ASN 8 2HB ASN 8 4.588 7.165 -4.004
46 HD21 ASN 8 1HD2 ASN 8 5.215 9.940 -6.031
47 HD22 ASN 8 2HD2 ASN 8 4.555 9.333 -4.552
48 H GLY 9 H GLY 9 6.565 3.725 -4.102
49 HA2 GLY 9 1HA GLY 9 8.970 3.564 -4.092
50 HA3 GLY 9 2HA GLY 9 9.050 5.320 -4.145
51 H GLU 10 H GLU 10 6.708 5.149 -2.096
52 HA GLU 10 HA GLU 10 8.379 5.173 0.273
53 HB2 GLU 10 1HB GLU 10 5.376 5.493 0.013
54 HB3 GLU 10 2HB GLU 10 6.331 5.836 1.448
55 HG2 GLU 10 1HG GLU 10 6.521 7.287 -1.184
56 HG3 GLU 10 2HG GLU 10 5.695 7.870 0.259
57 H THR 11 H THR 11 8.353 3.624 1.902
58 HA THR 11 HA THR 11 6.846 1.158 1.297
59 HB THR 11 HB THR 11 9.457 1.420 2.823
60 HG1 THR 11 1HG THR 11 8.912 1.236 0.157
61 HG21 THR 11 1HG2 THR 11 8.130 -0.491 3.576
62 HG22 THR 11 2HG2 THR 11 9.527 -1.039 2.649
63 HG23 THR 11 3HG2 THR 11 7.925 -1.025 1.909
64 H TYR 12 H TYR 12 5.113 1.066 2.560
65 HA TYR 12 HA TYR 12 5.415 1.713 5.431
66 HB2 TYR 12 2HB TYR 12 2.891 1.958 3.763
67 HB3 TYR 12 1HB TYR 12 3.042 2.336 5.474
68 HD1 TYR 12 1HD TYR 12 5.276 4.012 5.812
69 HD2 TYR 12 2HD TYR 12 2.647 3.850 2.468
70 HE1 TYR 12 1HE TYR 12 5.854 6.335 5.250
71 HE2 TYR 12 2HE TYR 12 3.222 6.168 1.894
72 HH TYR 12 HH TYR 12 5.857 7.773 3.132
73 H THR 13 H THR 13 3.780 0.509 6.787
74 HA THR 13 HA THR 13 3.509 -2.244 5.769
75 HB THR 13 HB THR 13 3.502 -2.888 8.230
76 HG1 THR 13 1HG THR 13 4.609 -0.265 8.519
77 HG21 THR 13 1HG2 THR 13 5.957 -2.783 8.439
78 HG22 THR 13 2HG2 THR 13 6.019 -1.618 7.118
79 HG23 THR 13 3HG2 THR 13 5.468 -3.267 6.815
80 H VAL 14 H VAL 14 1.564 -3.193 5.811
81 HA VAL 14 HA VAL 14 -0.698 -1.667 6.941
82 HB VAL 14 HB VAL 14 -2.086 -2.513 5.056
83 HG11 VAL 14 1HG1 VAL 14 -1.187 -0.991 3.341
84 HG12 VAL 14 2HG1 VAL 14 0.325 -0.881 4.244
85 HG13 VAL 14 3HG1 VAL 14 -1.170 -0.264 4.949
86 HG21 VAL 14 1HG2 VAL 14 -0.727 -4.481 4.489
87 HG22 VAL 14 2HG2 VAL 14 0.554 -3.424 3.893
88 HG23 VAL 14 3HG2 VAL 14 -1.013 -3.461 3.080
89 H SER 15 H SER 15 -2.725 -3.130 7.056
90 HA SER 15 HA SER 15 -1.963 -5.379 8.727
91 HB2 SER 15 1HB SER 15 -4.699 -4.200 8.171
92 HB3 SER 15 2HB SER 15 -4.296 -5.348 9.451
93 HG SER 15 HG SER 15 -2.763 -3.039 9.382
94 H SER 16 H SER 16 -3.230 -4.863 5.542
95 HA SER 16 HA SER 16 -3.104 -7.644 4.915
96 HB2 SER 16 1HB SER 16 -5.502 -7.938 4.338
97 HB3 SER 16 2HB SER 16 -5.278 -7.657 6.066
98 HG SER 16 HG SER 16 -6.798 -6.223 5.651
99 H SER 17 H SER 17 -3.936 -8.014 2.619
100 HA SER 17 HA SER 17 -2.900 -6.167 0.787
101 HB2 SER 17 1HB SER 17 -4.252 -7.516 -0.896
102 HB3 SER 17 2HB SER 17 -3.179 -8.465 0.134
103 HG SER 17 HG SER 17 -4.926 -9.548 0.565
104 H GLU 18 H GLU 18 -6.214 -6.781 1.856
105 HA GLU 18 HA GLU 18 -7.567 -4.853 0.378
106 HB2 GLU 18 1HB GLU 18 -8.740 -6.521 1.708
107 HB3 GLU 18 2HB GLU 18 -8.092 -5.838 3.195
108 HG2 GLU 18 1HG GLU 18 -9.325 -3.743 2.723
109 HG3 GLU 18 2HG GLU 18 -10.034 -4.516 1.306
110 H GLU 19 H GLU 19 -6.018 -4.578 3.560
111 HA GLU 19 HA GLU 19 -6.624 -1.871 4.019
112 HB2 GLU 19 1HB GLU 19 -5.781 -3.532 5.717
113 HB3 GLU 19 2HB GLU 19 -4.182 -3.371 5.006
114 HG2 GLU 19 1HG GLU 19 -4.391 -2.019 7.011
115 HG3 GLU 19 2HG GLU 19 -4.147 -1.004 5.589
116 H CYS 20 H CYS 20 -4.058 -3.439 2.215
117 HA CYS 20 HA CYS 20 -2.422 -1.151 1.839
118 HB2 CYS 20 2HB CYS 20 -1.790 -3.598 1.443
119 HB3 CYS 20 1HB CYS 20 -2.653 -3.468 -0.088
120 H GLU 21 H GLU 21 -4.929 -2.682 -0.165
121 HA GLU 21 HA GLU 21 -5.009 -0.837 -2.265
122 HB2 GLU 21 1HB GLU 21 -7.165 -2.558 -1.015
123 HB3 GLU 21 2HB GLU 21 -7.440 -1.595 -2.461
124 HG2 GLU 21 1HG GLU 21 -5.271 -3.674 -2.266
125 HG3 GLU 21 2HG GLU 21 -6.907 -4.027 -2.824
126 H ARG 22 H ARG 22 -6.619 -0.887 0.861
127 HA ARG 22 HA ARG 22 -8.292 1.337 0.522
128 HB2 ARG 22 1HB ARG 22 -8.201 -0.479 2.401
129 HB3 ARG 22 2HB ARG 22 -7.057 0.610 3.171
130 HG2 ARG 22 1HG ARG 22 -9.237 1.002 4.084
131 HG3 ARG 22 2HG ARG 22 -8.784 2.399 3.101
132 HD2 ARG 22 1HD ARG 22 -10.186 1.665 1.300
133 HD3 ARG 22 2HD ARG 22 -10.491 0.120 2.094
134 HE ARG 22 HE ARG 22 -11.336 2.271 3.736
135 HH11 ARG 22 1HH1 ARG 22 -12.236 0.465 0.865
136 HH12 ARG 22 2HH1 ARG 22 -13.937 0.764 1.057
137 HH21 ARG 22 1HH2 ARG 22 -13.578 2.648 3.998
138 HH22 ARG 22 2HH2 ARG 22 -14.696 2.022 2.826
139 H LEU 23 H LEU 23 -5.049 1.035 1.921
140 HA LEU 23 HA LEU 23 -4.672 3.757 2.547
141 HB2 LEU 23 1HB LEU 23 -3.317 1.920 3.482
142 HB3 LEU 23 2HB LEU 23 -2.613 1.632 1.902
143 HG LEU 23 HG LEU 23 -1.604 3.906 1.968
144 HD11 LEU 23 1HD1 LEU 23 -3.203 4.982 3.463
145 HD12 LEU 23 2HD1 LEU 23 -1.560 5.147 4.073
146 HD13 LEU 23 3HD1 LEU 23 -2.654 3.969 4.798
147 HD21 LEU 23 1HD2 LEU 23 -0.291 1.965 2.657
148 HD22 LEU 23 2HD2 LEU 23 -0.894 2.125 4.306
149 HD23 LEU 23 3HD2 LEU 23 0.133 3.382 3.618
150 H CYS 24 H CYS 24 -3.977 1.863 -0.351
151 HA CYS 24 HA CYS 24 -2.464 3.792 -1.722
152 HB2 CYS 24 2HB CYS 24 -2.636 1.373 -2.360
153 HB3 CYS 24 1HB CYS 24 -4.255 1.688 -2.972
154 H ARG 25 H ARG 25 -5.964 3.067 -1.862
155 HA ARG 25 HA ARG 25 -6.632 5.225 -3.566
156 HB2 ARG 25 1HB ARG 25 -8.175 3.451 -1.709
157 HB3 ARG 25 2HB ARG 25 -8.951 4.908 -2.307
158 HG2 ARG 25 1HG ARG 25 -9.598 3.085 -3.689
159 HG3 ARG 25 2HG ARG 25 -8.531 4.125 -4.627
160 HD2 ARG 25 1HD ARG 25 -7.422 1.755 -3.173
161 HD3 ARG 25 2HD ARG 25 -8.263 1.531 -4.702
162 HE ARG 25 HE ARG 25 -6.250 3.541 -4.910
163 HH11 ARG 25 1HH1 ARG 25 -6.711 0.070 -4.776
164 HH12 ARG 25 2HH1 ARG 25 -5.308 -0.289 -5.731
165 HH21 ARG 25 1HH2 ARG 25 -4.416 3.079 -6.176
166 HH22 ARG 25 2HH2 ARG 25 -3.988 1.434 -6.527
167 H LYS 26 H LYS 26 -6.409 4.910 -0.059
168 HA LYS 26 HA LYS 26 -7.577 7.308 0.738
169 HB2 LYS 26 1HB LYS 26 -7.000 5.587 2.341
170 HB3 LYS 26 2HB LYS 26 -5.292 5.739 1.953
171 HG2 LYS 26 1HG LYS 26 -5.314 8.033 2.866
172 HG3 LYS 26 2HG LYS 26 -7.004 7.811 3.323
173 HD2 LYS 26 1HD LYS 26 -6.383 5.979 4.811
174 HD3 LYS 26 2HD LYS 26 -4.698 6.114 4.305
175 HE2 LYS 26 1HE LYS 26 -4.995 7.198 6.447
176 HE3 LYS 26 2HE LYS 26 -4.638 8.408 5.217
177 HZ1 LYS 26 1HZ LYS 26 -7.043 8.856 5.083
178 HZ2 LYS 26 2HZ LYS 26 -6.400 9.185 6.611
179 HZ3 LYS 26 3HZ LYS 26 -7.302 7.777 6.360
180 H LEU 27 H LEU 27 -4.181 6.627 -0.052
181 HA LEU 27 HA LEU 27 -3.448 9.416 0.205
182 HB2 LEU 27 1HB LEU 27 -1.836 7.073 -0.825
183 HB3 LEU 27 2HB LEU 27 -1.204 8.662 -0.436
184 HG LEU 27 HG LEU 27 -2.390 6.698 1.534
185 HD11 LEU 27 1HD1 LEU 27 0.465 7.589 1.129
186 HD12 LEU 27 2HD1 LEU 27 -0.203 6.009 0.716
187 HD13 LEU 27 3HD1 LEU 27 -0.117 6.515 2.402
188 HD21 LEU 27 1HD2 LEU 27 -2.870 8.980 2.224
189 HD22 LEU 27 2HD2 LEU 27 -1.178 9.428 2.004
190 HD23 LEU 27 3HD2 LEU 27 -1.630 8.278 3.264
191 H GLY 28 H GLY 28 -4.541 7.281 -2.260
192 HA2 GLY 28 1HA GLY 28 -5.069 7.670 -4.466
193 HA3 GLY 28 2HA GLY 28 -4.615 9.354 -4.239
194 H VAL 29 H VAL 29 -2.869 6.284 -3.959
195 HA VAL 29 HA VAL 29 -0.561 7.466 -5.274
196 HB VAL 29 HB VAL 29 -0.897 4.701 -4.078
197 HG11 VAL 29 1HG1 VAL 29 0.889 4.765 -5.734
198 HG12 VAL 29 2HG1 VAL 29 1.560 4.620 -4.110
199 HG13 VAL 29 3HG1 VAL 29 1.598 6.175 -4.941
200 HG21 VAL 29 1HG2 VAL 29 0.367 5.581 -2.162
201 HG22 VAL 29 2HG2 VAL 29 -1.161 6.433 -2.382
202 HG23 VAL 29 3HG2 VAL 29 0.350 7.189 -2.890
203 H THR 30 H THR 30 0.314 6.766 -7.186
204 HA THR 30 HA THR 30 -1.399 5.508 -9.099
205 HB THR 30 HB THR 30 0.655 5.692 -10.569
206 HG1 THR 30 1HG THR 30 2.441 6.799 -9.682
207 HG21 THR 30 1HG2 THR 30 -1.002 7.498 -10.500
208 HG22 THR 30 2HG2 THR 30 0.626 8.149 -10.675
209 HG23 THR 30 3HG2 THR 30 -0.184 8.208 -9.109
210 H ASN 31 H ASN 31 1.853 4.683 -7.924
211 HA ASN 31 HA ASN 31 1.376 1.863 -8.611
212 HB2 ASN 31 1HB ASN 31 3.327 2.894 -9.678
213 HB3 ASN 31 2HB ASN 31 3.962 3.369 -8.106
214 HD21 ASN 31 1HD2 ASN 31 5.255 0.207 -7.312
215 HD22 ASN 31 2HD2 ASN 31 4.795 1.764 -6.720
216 H CYS 32 H CYS 32 0.507 0.871 -6.866
217 HA CYS 32 HA CYS 32 2.101 0.951 -4.379
218 HB2 CYS 32 2HB CYS 32 -0.131 0.285 -3.251
219 HB3 CYS 32 1HB CYS 32 0.094 1.966 -3.718
220 H ARG 33 H ARG 33 3.066 -0.909 -4.006
221 HA ARG 33 HA ARG 33 1.943 -3.398 -5.132
222 HB2 ARG 33 1HB ARG 33 4.088 -2.808 -6.128
223 HB3 ARG 33 2HB ARG 33 4.808 -2.599 -4.541
224 HG2 ARG 33 1HG ARG 33 5.530 -4.675 -5.579
225 HG3 ARG 33 2HG ARG 33 4.608 -4.988 -4.110
226 HD2 ARG 33 1HD ARG 33 2.761 -5.789 -5.290
227 HD3 ARG 33 2HD ARG 33 3.257 -4.999 -6.789
228 HE ARG 33 HE ARG 33 4.860 -6.694 -7.140
229 HH11 ARG 33 1HH1 ARG 33 2.911 -7.324 -4.289
230 HH12 ARG 33 2HH1 ARG 33 3.300 -9.013 -4.246
231 HH21 ARG 33 1HH2 ARG 33 5.350 -8.915 -7.087
232 HH22 ARG 33 2HH2 ARG 33 4.666 -9.921 -5.847
233 H VAL 34 H VAL 34 1.440 -4.999 -3.722
234 HA VAL 34 HA VAL 34 2.125 -4.551 -0.884
235 HB VAL 34 HB VAL 34 -0.278 -4.332 -1.286
236 HG11 VAL 34 1HG1 VAL 34 -0.141 -7.137 -2.400
237 HG12 VAL 34 2HG1 VAL 34 -0.488 -5.665 -3.307
238 HG13 VAL 34 3HG1 VAL 34 -1.626 -6.235 -2.085
239 HG21 VAL 34 1HG2 VAL 34 -1.096 -5.989 0.333
240 HG22 VAL 34 2HG2 VAL 34 0.448 -5.303 0.842
241 HG23 VAL 34 3HG2 VAL 34 0.390 -6.918 0.135
242 H HIS 35 H HIS 35 2.975 -6.202 0.285
243 HA HIS 35 HA HIS 35 2.959 -8.923 -0.706
244 HB2 HIS 35 1HB HIS 35 5.444 -9.160 -0.533
245 HB3 HIS 35 2HB HIS 35 4.936 -8.121 -1.859
246 HD1 HIS 35 HD1 HIS 35 7.099 -8.194 1.087
247 HD2 HIS 35 HD2 HIS 35 5.309 -5.279 -1.281
248 HE1 HIS 35 HE1 HIS 35 8.367 -6.073 1.549
249 HE2 HIS 35 HE2 HIS 35 7.369 -4.369 -0.015
250 H CYS 36 H CYS 36 2.655 -10.219 0.975
251 HA CYS 36 HA CYS 36 3.244 -9.174 3.673
252 HB2 CYS 36 2HB CYS 36 1.143 -11.255 3.052
253 HB3 CYS 36 1HB CYS 36 1.296 -10.251 4.489
254 H GLY 37 H GLY 37 4.768 -10.274 4.767
255 HA2 GLY 37 1HA GLY 37 4.959 -13.137 4.679
256 HA3 GLY 37 2HA GLY 37 6.277 -12.346 3.822
Start of MODEL 15
1 H1 ALA 1 1H ALA 1 0.246 -13.340 9.525
2 H2 ALA 1 2H ALA 1 1.235 -12.383 10.509
3 H3 ALA 1 3H ALA 1 1.712 -13.950 10.101
4 HA ALA 1 HA ALA 1 2.919 -12.276 8.848
5 HB1 ALA 1 1HB ALA 1 2.581 -13.287 6.642
6 HB2 ALA 1 2HB ALA 1 1.055 -13.983 7.189
7 HB3 ALA 1 3HB ALA 1 2.575 -14.514 7.908
8 HA PRO 2 HA PRO 2 -0.003 -8.920 7.880
9 HB2 PRO 2 2HB PRO 2 1.724 -6.890 8.152
10 HB3 PRO 2 1HB PRO 2 1.094 -7.743 9.568
11 HG2 PRO 2 2HG PRO 2 3.741 -8.061 8.193
12 HG3 PRO 2 1HG PRO 2 3.386 -7.985 9.929
13 HD2 PRO 2 2HD PRO 2 3.784 -10.329 8.545
14 HD3 PRO 2 1HD PRO 2 2.832 -10.206 10.037
15 H CYS 3 H CYS 3 0.981 -6.701 6.494
16 HA CYS 3 HA CYS 3 2.110 -7.836 4.024
17 HB2 CYS 3 2HB CYS 3 -0.223 -5.919 4.229
18 HB3 CYS 3 1HB CYS 3 0.588 -6.344 2.730
19 H GLU 4 H GLU 4 3.634 -6.635 3.062
20 HA GLU 4 HA GLU 4 4.365 -4.055 4.291
21 HB2 GLU 4 1HB GLU 4 6.143 -6.092 2.909
22 HB3 GLU 4 2HB GLU 4 6.681 -4.613 3.701
23 HG2 GLU 4 1HG GLU 4 6.090 -5.446 5.850
24 HG3 GLU 4 2HG GLU 4 5.218 -6.810 5.155
25 H CYS 5 H CYS 5 4.352 -2.312 2.951
26 HA CYS 5 HA CYS 5 3.674 -2.875 0.138
27 HB2 CYS 5 2HB CYS 5 2.456 -0.875 2.045
28 HB3 CYS 5 1HB CYS 5 2.130 -0.899 0.316
29 H ASP 6 H ASP 6 4.410 -1.609 -1.434
30 HA ASP 6 HA ASP 6 6.143 0.688 -0.783
31 HB2 ASP 6 1HB ASP 6 7.368 -1.081 -1.958
32 HB3 ASP 6 2HB ASP 6 6.133 -1.150 -3.207
33 H VAL 7 H VAL 7 4.785 2.391 -0.883
34 HA VAL 7 HA VAL 7 2.864 2.611 -3.102
35 HB VAL 7 HB VAL 7 2.730 3.973 -0.396
36 HG11 VAL 7 1HG1 VAL 7 0.695 3.765 -2.620
37 HG12 VAL 7 2HG1 VAL 7 1.589 5.212 -2.155
38 HG13 VAL 7 3HG1 VAL 7 0.418 4.506 -1.043
39 HG21 VAL 7 1HG2 VAL 7 2.455 1.563 -0.117
40 HG22 VAL 7 2HG2 VAL 7 1.205 1.546 -1.364
41 HG23 VAL 7 3HG2 VAL 7 0.927 2.400 0.155
42 H ASN 8 H ASN 8 3.694 3.923 -4.614
43 HA ASN 8 HA ASN 8 4.527 5.760 -5.653
44 HB2 ASN 8 1HB ASN 8 2.826 6.913 -4.202
45 HB3 ASN 8 2HB ASN 8 4.091 7.187 -3.010
46 HD21 ASN 8 1HD2 ASN 8 5.490 9.914 -4.666
47 HD22 ASN 8 2HD2 ASN 8 5.605 8.777 -3.370
48 H GLY 9 H GLY 9 6.208 3.922 -3.990
49 HA2 GLY 9 1HA GLY 9 8.575 3.806 -4.039
50 HA3 GLY 9 2HA GLY 9 8.645 5.565 -3.991
51 H GLU 10 H GLU 10 6.469 5.293 -1.805
52 HA GLU 10 HA GLU 10 8.298 5.361 0.418
53 HB2 GLU 10 1HB GLU 10 5.269 5.450 0.424
54 HB3 GLU 10 2HB GLU 10 6.330 5.911 1.750
55 HG2 GLU 10 1HG GLU 10 6.182 7.294 -0.925
56 HG3 GLU 10 2HG GLU 10 5.391 7.837 0.554
57 H THR 11 H THR 11 8.345 3.903 2.165
58 HA THR 11 HA THR 11 7.178 1.256 1.574
59 HB THR 11 HB THR 11 9.698 1.866 3.153
60 HG1 THR 11 1HG THR 11 9.711 2.210 0.774
61 HG21 THR 11 1HG2 THR 11 8.603 -0.207 3.872
62 HG22 THR 11 2HG2 THR 11 10.089 -0.563 2.990
63 HG23 THR 11 3HG2 THR 11 8.525 -0.757 2.198
64 H TYR 12 H TYR 12 5.520 0.814 2.853
65 HA TYR 12 HA TYR 12 5.647 1.557 5.706
66 HB2 TYR 12 2HB TYR 12 3.249 1.883 3.876
67 HB3 TYR 12 1HB TYR 12 3.187 2.044 5.623
68 HD1 TYR 12 1HD TYR 12 5.100 3.745 6.556
69 HD2 TYR 12 2HD TYR 12 3.323 3.871 2.683
70 HE1 TYR 12 1HE TYR 12 5.677 6.128 6.371
71 HE2 TYR 12 2HE TYR 12 3.898 6.252 2.492
72 HH TYR 12 HH TYR 12 6.071 7.793 4.568
73 H THR 13 H THR 13 4.208 0.255 7.056
74 HA THR 13 HA THR 13 3.733 -2.418 5.916
75 HB THR 13 HB THR 13 3.858 -3.170 8.359
76 HG1 THR 13 1HG THR 13 4.801 -1.793 9.809
77 HG21 THR 13 1HG2 THR 13 6.323 -3.255 8.343
78 HG22 THR 13 2HG2 THR 13 6.349 -2.057 7.050
79 HG23 THR 13 3HG2 THR 13 5.642 -3.649 6.765
80 H VAL 14 H VAL 14 1.745 -3.288 6.082
81 HA VAL 14 HA VAL 14 -0.343 -1.713 7.447
82 HB VAL 14 HB VAL 14 -1.878 -2.199 5.570
83 HG11 VAL 14 1HG1 VAL 14 0.651 -0.776 4.713
84 HG12 VAL 14 2HG1 VAL 14 -0.695 -0.059 5.603
85 HG13 VAL 14 3HG1 VAL 14 -0.932 -0.618 3.948
86 HG21 VAL 14 1HG2 VAL 14 -0.986 -3.036 3.443
87 HG22 VAL 14 2HG2 VAL 14 -0.821 -4.230 4.728
88 HG23 VAL 14 3HG2 VAL 14 0.582 -3.297 4.200
89 H SER 15 H SER 15 -2.392 -2.981 7.681
90 HA SER 15 HA SER 15 -1.758 -5.369 9.121
91 HB2 SER 15 1HB SER 15 -4.515 -4.268 8.533
92 HB3 SER 15 2HB SER 15 -4.023 -5.271 9.899
93 HG SER 15 HG SER 15 -3.479 -2.548 9.391
94 H SER 16 H SER 16 -3.399 -4.643 6.077
95 HA SER 16 HA SER 16 -3.397 -7.476 5.379
96 HB2 SER 16 1HB SER 16 -5.944 -5.831 5.219
97 HB3 SER 16 2HB SER 16 -5.755 -7.544 4.839
98 HG SER 16 HG SER 16 -6.198 -6.342 7.228
99 H SER 17 H SER 17 -3.781 -7.859 3.107
100 HA SER 17 HA SER 17 -2.507 -6.127 1.345
101 HB2 SER 17 1HB SER 17 -3.695 -7.562 -0.426
102 HB3 SER 17 2HB SER 17 -2.694 -8.423 0.746
103 HG SER 17 HG SER 17 -5.153 -8.951 0.230
104 H GLU 18 H GLU 18 -5.988 -6.703 1.779
105 HA GLU 18 HA GLU 18 -6.952 -4.842 -0.047
106 HB2 GLU 18 1HB GLU 18 -8.162 -5.777 2.567
107 HB3 GLU 18 2HB GLU 18 -9.039 -4.893 1.322
108 HG2 GLU 18 1HG GLU 18 -8.778 -6.691 -0.236
109 HG3 GLU 18 2HG GLU 18 -7.695 -7.547 0.860
110 H GLU 19 H GLU 19 -6.092 -4.429 3.364
111 HA GLU 19 HA GLU 19 -6.872 -1.747 3.633
112 HB2 GLU 19 1HB GLU 19 -6.290 -3.212 5.546
113 HB3 GLU 19 2HB GLU 19 -4.603 -3.171 5.049
114 HG2 GLU 19 1HG GLU 19 -4.539 -0.757 5.431
115 HG3 GLU 19 2HG GLU 19 -6.235 -0.783 5.908
116 H CYS 20 H CYS 20 -3.897 -3.237 2.468
117 HA CYS 20 HA CYS 20 -2.298 -0.971 2.153
118 HB2 CYS 20 2HB CYS 20 -1.615 -3.381 1.773
119 HB3 CYS 20 1HB CYS 20 -2.442 -3.305 0.224
120 H GLU 21 H GLU 21 -4.661 -2.426 -0.052
121 HA GLU 21 HA GLU 21 -4.361 -0.597 -2.176
122 HB2 GLU 21 1HB GLU 21 -6.800 -2.225 -1.409
123 HB3 GLU 21 2HB GLU 21 -6.501 -1.493 -2.980
124 HG2 GLU 21 1HG GLU 21 -4.572 -2.934 -3.311
125 HG3 GLU 21 2HG GLU 21 -4.811 -3.639 -1.712
126 H ARG 22 H ARG 22 -6.487 -0.644 0.657
127 HA ARG 22 HA ARG 22 -8.072 1.555 0.012
128 HB2 ARG 22 1HB ARG 22 -7.219 0.335 2.644
129 HB3 ARG 22 2HB ARG 22 -8.413 1.592 2.506
130 HG2 ARG 22 1HG ARG 22 -8.639 -1.113 1.224
131 HG3 ARG 22 2HG ARG 22 -9.401 -0.650 2.747
132 HD2 ARG 22 1HD ARG 22 -10.613 1.153 1.526
133 HD3 ARG 22 2HD ARG 22 -9.928 0.543 0.019
134 HE ARG 22 HE ARG 22 -11.111 -1.609 0.607
135 HH11 ARG 22 1HH1 ARG 22 -12.295 1.505 1.705
136 HH12 ARG 22 2HH1 ARG 22 -13.946 0.987 1.778
137 HH21 ARG 22 1HH2 ARG 22 -13.288 -2.285 0.733
138 HH22 ARG 22 2HH2 ARG 22 -14.511 -1.158 1.231
139 H LEU 23 H LEU 23 -5.058 1.293 1.889
140 HA LEU 23 HA LEU 23 -4.820 4.018 2.555
141 HB2 LEU 23 1HB LEU 23 -3.539 2.250 3.675
142 HB3 LEU 23 2HB LEU 23 -2.673 1.917 2.189
143 HG LEU 23 HG LEU 23 -1.643 4.159 2.284
144 HD11 LEU 23 1HD1 LEU 23 -1.867 5.532 4.300
145 HD12 LEU 23 2HD1 LEU 23 -3.074 4.411 4.934
146 HD13 LEU 23 3HD1 LEU 23 -3.415 5.343 3.474
147 HD21 LEU 23 1HD2 LEU 23 -0.475 2.257 3.275
148 HD22 LEU 23 2HD2 LEU 23 -1.288 2.545 4.814
149 HD23 LEU 23 3HD2 LEU 23 -0.153 3.738 4.177
150 H CYS 24 H CYS 24 -3.628 2.119 -0.175
151 HA CYS 24 HA CYS 24 -2.139 4.110 -1.465
152 HB2 CYS 24 2HB CYS 24 -2.051 1.708 -2.050
153 HB3 CYS 24 1HB CYS 24 -3.686 1.806 -2.693
154 H ARG 25 H ARG 25 -5.553 3.170 -1.831
155 HA ARG 25 HA ARG 25 -6.115 5.153 -3.803
156 HB2 ARG 25 1HB ARG 25 -8.240 4.279 -3.877
157 HB3 ARG 25 2HB ARG 25 -7.372 2.913 -3.199
158 HG2 ARG 25 1HG ARG 25 -8.187 3.386 -1.002
159 HG3 ARG 25 2HG ARG 25 -8.878 4.922 -1.534
160 HD2 ARG 25 1HD ARG 25 -9.760 2.141 -2.308
161 HD3 ARG 25 2HD ARG 25 -10.670 3.344 -1.393
162 HE ARG 25 HE ARG 25 -10.056 3.464 -4.275
163 HH11 ARG 25 1HH1 ARG 25 -12.012 4.460 -1.547
164 HH12 ARG 25 2HH1 ARG 25 -13.029 5.500 -2.494
165 HH21 ARG 25 1HH2 ARG 25 -11.385 4.815 -5.528
166 HH22 ARG 25 2HH2 ARG 25 -12.665 5.714 -4.768
167 H LYS 26 H LYS 26 -6.113 5.053 -0.354
168 HA LYS 26 HA LYS 26 -7.646 7.378 0.176
169 HB2 LYS 26 1HB LYS 26 -7.056 5.611 1.849
170 HB3 LYS 26 2HB LYS 26 -5.392 6.161 1.809
171 HG2 LYS 26 1HG LYS 26 -7.624 8.019 2.579
172 HG3 LYS 26 2HG LYS 26 -6.917 6.905 3.746
173 HD2 LYS 26 1HD LYS 26 -4.686 7.905 3.272
174 HD3 LYS 26 2HD LYS 26 -5.475 9.078 2.216
175 HE2 LYS 26 1HE LYS 26 -5.944 8.730 5.181
176 HE3 LYS 26 2HE LYS 26 -5.078 10.054 4.402
177 HZ1 LYS 26 1HZ LYS 26 -7.387 10.611 5.011
178 HZ2 LYS 26 2HZ LYS 26 -7.944 9.438 3.932
179 HZ3 LYS 26 3HZ LYS 26 -7.087 10.775 3.356
180 H LEU 27 H LEU 27 -4.182 6.783 -0.255
181 HA LEU 27 HA LEU 27 -3.448 9.550 -0.055
182 HB2 LEU 27 1HB LEU 27 -1.911 7.197 -1.181
183 HB3 LEU 27 2HB LEU 27 -1.236 8.782 -0.844
184 HG LEU 27 HG LEU 27 -2.351 6.869 1.220
185 HD11 LEU 27 1HD1 LEU 27 0.495 7.676 0.613
186 HD12 LEU 27 2HD1 LEU 27 -0.234 6.099 0.307
187 HD13 LEU 27 3HD1 LEU 27 -0.022 6.665 1.963
188 HD21 LEU 27 1HD2 LEU 27 -1.028 9.567 1.568
189 HD22 LEU 27 2HD2 LEU 27 -1.464 8.460 2.869
190 HD23 LEU 27 3HD2 LEU 27 -2.724 9.189 1.874
191 H GLY 28 H GLY 28 -4.525 7.436 -2.568
192 HA2 GLY 28 1HA GLY 28 -5.415 8.095 -4.622
193 HA3 GLY 28 2HA GLY 28 -4.718 9.693 -4.396
194 H VAL 29 H VAL 29 -3.182 6.513 -4.302
195 HA VAL 29 HA VAL 29 -1.362 7.375 -6.463
196 HB VAL 29 HB VAL 29 -0.825 5.303 -4.312
197 HG11 VAL 29 1HG1 VAL 29 1.042 6.616 -6.297
198 HG12 VAL 29 2HG1 VAL 29 0.453 4.953 -6.372
199 HG13 VAL 29 3HG1 VAL 29 1.505 5.459 -5.049
200 HG21 VAL 29 1HG2 VAL 29 -1.032 7.504 -3.284
201 HG22 VAL 29 2HG2 VAL 29 0.108 8.179 -4.449
202 HG23 VAL 29 3HG2 VAL 29 0.650 6.978 -3.276
203 H THR 30 H THR 30 -0.831 5.868 -8.086
204 HA THR 30 HA THR 30 -2.636 3.563 -8.341
205 HB THR 30 HB THR 30 -1.800 3.566 -10.740
206 HG1 THR 30 1HG THR 30 -0.533 5.207 -11.408
207 HG21 THR 30 1HG2 THR 30 -3.191 5.478 -11.419
208 HG22 THR 30 2HG2 THR 30 -3.187 6.076 -9.760
209 HG23 THR 30 3HG2 THR 30 -3.971 4.543 -10.145
210 H ASN 31 H ASN 31 0.742 4.506 -8.233
211 HA ASN 31 HA ASN 31 1.666 1.776 -8.618
212 HB2 ASN 31 1HB ASN 31 3.155 4.369 -8.145
213 HB3 ASN 31 2HB ASN 31 3.951 2.805 -8.293
214 HD21 ASN 31 1HD2 ASN 31 3.773 4.686 -11.564
215 HD22 ASN 31 2HD2 ASN 31 4.211 5.169 -9.962
216 H CYS 32 H CYS 32 1.019 0.621 -6.890
217 HA CYS 32 HA CYS 32 2.555 0.993 -4.450
218 HB2 CYS 32 2HB CYS 32 0.407 0.545 -3.093
219 HB3 CYS 32 1HB CYS 32 0.645 2.171 -3.722
220 H ARG 33 H ARG 33 3.433 -0.937 -4.039
221 HA ARG 33 HA ARG 33 2.091 -3.345 -5.103
222 HB2 ARG 33 1HB ARG 33 4.394 -2.534 -6.042
223 HB3 ARG 33 2HB ARG 33 5.047 -3.170 -4.539
224 HG2 ARG 33 1HG ARG 33 5.286 -4.844 -6.225
225 HG3 ARG 33 2HG ARG 33 4.029 -5.380 -5.105
226 HD2 ARG 33 1HD ARG 33 3.388 -5.778 -7.442
227 HD3 ARG 33 2HD ARG 33 2.302 -4.628 -6.660
228 HE ARG 33 HE ARG 33 4.503 -3.797 -8.453
229 HH11 ARG 33 1HH1 ARG 33 1.171 -3.529 -7.369
230 HH12 ARG 33 2HH1 ARG 33 0.798 -2.235 -8.465
231 HH21 ARG 33 1HH2 ARG 33 4.002 -2.091 -9.871
232 HH22 ARG 33 2HH2 ARG 33 2.399 -1.417 -9.880
233 H VAL 34 H VAL 34 1.781 -5.058 -3.732
234 HA VAL 34 HA VAL 34 2.500 -4.578 -0.910
235 HB VAL 34 HB VAL 34 0.102 -4.336 -1.277
236 HG11 VAL 34 1HG1 VAL 34 0.160 -7.174 -2.321
237 HG12 VAL 34 2HG1 VAL 34 -0.151 -5.720 -3.270
238 HG13 VAL 34 3HG1 VAL 34 -1.290 -6.214 -2.020
239 HG21 VAL 34 1HG2 VAL 34 -0.710 -5.957 0.379
240 HG22 VAL 34 2HG2 VAL 34 0.838 -5.262 0.855
241 HG23 VAL 34 3HG2 VAL 34 0.771 -6.893 0.188
242 H HIS 35 H HIS 35 3.502 -6.131 0.195
243 HA HIS 35 HA HIS 35 3.751 -8.825 -0.995
244 HB2 HIS 35 1HB HIS 35 5.664 -7.297 0.799
245 HB3 HIS 35 2HB HIS 35 5.833 -9.010 0.440
246 HD1 HIS 35 HD1 HIS 35 6.899 -9.642 -1.770
247 HD2 HIS 35 HD2 HIS 35 6.170 -5.562 -1.413
248 HE1 HIS 35 HE1 HIS 35 8.123 -8.563 -3.685
249 HE2 HIS 35 HE2 HIS 35 7.814 -6.086 -3.338
250 H CYS 36 H CYS 36 2.357 -10.151 0.047
251 HA CYS 36 HA CYS 36 1.990 -9.773 2.951
252 HB2 CYS 36 2HB CYS 36 0.075 -10.958 0.924
253 HB3 CYS 36 1HB CYS 36 -0.215 -10.874 2.659
254 H GLY 37 H GLY 37 3.212 -11.194 3.996
255 HA2 GLY 37 1HA GLY 37 2.816 -13.918 4.024
256 HA3 GLY 37 2HA GLY 37 4.103 -13.653 2.852
Start of MODEL 16
1 H1 ALA 1 1H ALA 1 2.354 -12.073 10.803
2 H2 ALA 1 2H ALA 1 3.803 -12.941 10.824
3 H3 ALA 1 3H ALA 1 2.794 -13.010 9.471
4 HA ALA 1 HA ALA 1 4.218 -10.615 10.447
5 HB1 ALA 1 1HB ALA 1 5.726 -12.258 9.447
6 HB2 ALA 1 2HB ALA 1 5.570 -10.838 8.413
7 HB3 ALA 1 3HB ALA 1 4.714 -12.326 8.005
8 HA PRO 2 HA PRO 2 0.847 -8.605 8.276
9 HB2 PRO 2 2HB PRO 2 2.489 -6.165 8.546
10 HB3 PRO 2 1HB PRO 2 0.884 -6.514 9.194
11 HG2 PRO 2 2HG PRO 2 3.038 -6.382 10.789
12 HG3 PRO 2 1HG PRO 2 1.722 -7.533 11.092
13 HD2 PRO 2 2HD PRO 2 4.400 -8.014 9.813
14 HD3 PRO 2 1HD PRO 2 3.534 -8.997 11.015
15 H CYS 3 H CYS 3 0.894 -6.641 6.560
16 HA CYS 3 HA CYS 3 2.606 -7.620 4.381
17 HB2 CYS 3 2HB CYS 3 -0.034 -6.141 4.324
18 HB3 CYS 3 1HB CYS 3 0.919 -6.509 2.889
19 H GLU 4 H GLU 4 3.744 -6.194 3.081
20 HA GLU 4 HA GLU 4 4.115 -3.467 4.151
21 HB2 GLU 4 1HB GLU 4 6.103 -5.222 2.680
22 HB3 GLU 4 2HB GLU 4 6.416 -3.599 3.283
23 HG2 GLU 4 1HG GLU 4 6.172 -4.344 5.561
24 HG3 GLU 4 2HG GLU 4 5.693 -5.953 5.020
25 H CYS 5 H CYS 5 3.628 -1.847 2.771
26 HA CYS 5 HA CYS 5 3.086 -2.572 -0.033
27 HB2 CYS 5 2HB CYS 5 1.755 -0.483 1.706
28 HB3 CYS 5 1HB CYS 5 1.363 -0.807 0.013
29 H ASP 6 H ASP 6 3.870 -1.344 -1.641
30 HA ASP 6 HA ASP 6 5.669 0.876 -0.907
31 HB2 ASP 6 1HB ASP 6 6.879 -1.049 -1.832
32 HB3 ASP 6 2HB ASP 6 5.838 -1.048 -3.248
33 H VAL 7 H VAL 7 4.645 2.694 -1.310
34 HA VAL 7 HA VAL 7 3.012 3.015 -3.707
35 HB VAL 7 HB VAL 7 2.060 4.982 -2.365
36 HG11 VAL 7 1HG1 VAL 7 0.840 2.877 -2.738
37 HG12 VAL 7 2HG1 VAL 7 0.489 3.566 -1.153
38 HG13 VAL 7 3HG1 VAL 7 1.595 2.198 -1.294
39 HG21 VAL 7 1HG2 VAL 7 3.832 5.117 -0.683
40 HG22 VAL 7 2HG2 VAL 7 3.385 3.519 -0.085
41 HG23 VAL 7 3HG2 VAL 7 2.255 4.865 0.065
42 H ASN 8 H ASN 8 4.301 3.871 -5.227
43 HA ASN 8 HA ASN 8 5.410 5.472 -6.401
44 HB2 ASN 8 1HB ASN 8 3.805 7.014 -5.292
45 HB3 ASN 8 2HB ASN 8 4.943 7.228 -3.969
46 HD21 ASN 8 1HD2 ASN 8 5.406 9.208 -7.481
47 HD22 ASN 8 2HD2 ASN 8 4.254 7.931 -7.306
48 H GLY 9 H GLY 9 6.622 3.978 -3.780
49 HA2 GLY 9 1HA GLY 9 9.085 3.598 -3.934
50 HA3 GLY 9 2HA GLY 9 9.240 5.349 -3.944
51 H GLU 10 H GLU 10 6.841 5.236 -1.966
52 HA GLU 10 HA GLU 10 8.440 5.013 0.458
53 HB2 GLU 10 1HB GLU 10 5.543 5.795 0.025
54 HB3 GLU 10 2HB GLU 10 6.365 5.830 1.576
55 HG2 GLU 10 1HG GLU 10 7.032 7.499 -0.842
56 HG3 GLU 10 2HG GLU 10 6.228 8.052 0.626
57 H THR 11 H THR 11 8.284 3.343 1.905
58 HA THR 11 HA THR 11 6.345 1.222 1.255
59 HB THR 11 HB THR 11 9.083 0.943 2.525
60 HG1 THR 11 1HG THR 11 8.312 1.045 -0.022
61 HG21 THR 11 1HG2 THR 11 7.512 -0.692 3.463
62 HG22 THR 11 2HG2 THR 11 8.671 -1.485 2.397
63 HG23 THR 11 3HG2 THR 11 7.029 -1.171 1.836
64 H TYR 12 H TYR 12 4.744 1.134 2.619
65 HA TYR 12 HA TYR 12 5.173 1.770 5.474
66 HB2 TYR 12 2HB TYR 12 2.609 1.928 3.849
67 HB3 TYR 12 1HB TYR 12 2.768 2.319 5.559
68 HD1 TYR 12 1HD TYR 12 4.404 4.226 6.176
69 HD2 TYR 12 2HD TYR 12 2.899 3.626 2.226
70 HE1 TYR 12 1HE TYR 12 4.942 6.555 5.619
71 HE2 TYR 12 2HE TYR 12 3.439 5.959 1.672
72 HH TYR 12 HH TYR 12 5.436 7.886 3.589
73 H THR 13 H THR 13 3.468 0.538 6.879
74 HA THR 13 HA THR 13 3.273 -2.234 5.870
75 HB THR 13 HB THR 13 3.296 -2.911 8.302
76 HG1 THR 13 1HG THR 13 2.996 -0.445 8.829
77 HG21 THR 13 1HG2 THR 13 5.747 -2.704 8.536
78 HG22 THR 13 2HG2 THR 13 5.764 -1.518 7.230
79 HG23 THR 13 3HG2 THR 13 5.283 -3.183 6.904
80 H VAL 14 H VAL 14 1.355 -3.200 5.885
81 HA VAL 14 HA VAL 14 -0.937 -1.838 7.143
82 HB VAL 14 HB VAL 14 -2.325 -2.625 5.211
83 HG11 VAL 14 1HG1 VAL 14 -0.050 -0.756 4.514
84 HG12 VAL 14 2HG1 VAL 14 -1.563 -0.312 5.305
85 HG13 VAL 14 3HG1 VAL 14 -1.574 -0.886 3.638
86 HG21 VAL 14 1HG2 VAL 14 -0.806 -4.424 4.460
87 HG22 VAL 14 2HG2 VAL 14 0.348 -3.201 3.921
88 HG23 VAL 14 3HG2 VAL 14 -1.233 -3.322 3.152
89 H SER 15 H SER 15 -2.827 -3.312 7.413
90 HA SER 15 HA SER 15 -1.877 -5.679 8.771
91 HB2 SER 15 1HB SER 15 -3.499 -4.129 9.838
92 HB3 SER 15 2HB SER 15 -4.688 -4.554 8.609
93 HG SER 15 HG SER 15 -3.967 -6.849 9.509
94 H SER 16 H SER 16 -3.135 -5.036 5.682
95 HA SER 16 HA SER 16 -3.170 -7.749 4.921
96 HB2 SER 16 1HB SER 16 -5.273 -7.847 6.192
97 HB3 SER 16 2HB SER 16 -5.908 -6.483 5.274
98 HG SER 16 HG SER 16 -6.079 -9.034 4.673
99 H SER 17 H SER 17 -4.251 -8.002 2.701
100 HA SER 17 HA SER 17 -3.162 -6.132 0.905
101 HB2 SER 17 1HB SER 17 -3.541 -8.466 0.273
102 HB3 SER 17 2HB SER 17 -5.282 -8.252 0.443
103 HG SER 17 HG SER 17 -5.067 -6.599 -1.239
104 H GLU 18 H GLU 18 -6.499 -6.650 2.031
105 HA GLU 18 HA GLU 18 -7.714 -4.672 0.452
106 HB2 GLU 18 1HB GLU 18 -9.554 -4.721 2.051
107 HB3 GLU 18 2HB GLU 18 -9.001 -6.354 1.718
108 HG2 GLU 18 1HG GLU 18 -7.826 -6.434 3.827
109 HG3 GLU 18 2HG GLU 18 -8.224 -4.748 4.150
110 H GLU 19 H GLU 19 -6.231 -4.549 3.646
111 HA GLU 19 HA GLU 19 -6.716 -1.849 4.248
112 HB2 GLU 19 1HB GLU 19 -5.897 -3.653 5.830
113 HB3 GLU 19 2HB GLU 19 -4.309 -3.491 5.092
114 HG2 GLU 19 1HG GLU 19 -4.403 -2.261 7.166
115 HG3 GLU 19 2HG GLU 19 -4.224 -1.146 5.811
116 H CYS 20 H CYS 20 -4.244 -3.482 2.403
117 HA CYS 20 HA CYS 20 -2.429 -1.358 2.067
118 HB2 CYS 20 2HB CYS 20 -2.029 -3.817 1.567
119 HB3 CYS 20 1HB CYS 20 -2.956 -3.591 0.088
120 H GLU 21 H GLU 21 -4.896 -2.632 -0.151
121 HA GLU 21 HA GLU 21 -4.588 -0.696 -2.140
122 HB2 GLU 21 1HB GLU 21 -7.023 -2.360 -1.438
123 HB3 GLU 21 2HB GLU 21 -6.779 -1.511 -2.963
124 HG2 GLU 21 1HG GLU 21 -4.908 -2.901 -3.523
125 HG3 GLU 21 2HG GLU 21 -4.918 -3.646 -1.928
126 H ARG 22 H ARG 22 -6.654 -0.772 0.739
127 HA ARG 22 HA ARG 22 -8.141 1.530 0.296
128 HB2 ARG 22 1HB ARG 22 -7.162 0.106 2.761
129 HB3 ARG 22 2HB ARG 22 -8.103 1.567 2.869
130 HG2 ARG 22 1HG ARG 22 -8.978 -1.010 1.597
131 HG3 ARG 22 2HG ARG 22 -9.523 -0.372 3.148
132 HD2 ARG 22 1HD ARG 22 -10.317 1.670 1.818
133 HD3 ARG 22 2HD ARG 22 -10.089 0.668 0.383
134 HE ARG 22 HE ARG 22 -11.842 -0.174 2.601
135 HH11 ARG 22 1HH1 ARG 22 -11.326 0.381 -0.826
136 HH12 ARG 22 2HH1 ARG 22 -12.910 -0.175 -1.270
137 HH21 ARG 22 1HH2 ARG 22 -13.896 -0.917 2.004
138 HH22 ARG 22 2HH2 ARG 22 -14.361 -0.913 0.330
139 H LEU 23 H LEU 23 -5.072 1.118 2.080
140 HA LEU 23 HA LEU 23 -4.715 3.830 2.726
141 HB2 LEU 23 1HB LEU 23 -3.518 2.015 3.861
142 HB3 LEU 23 2HB LEU 23 -2.647 1.647 2.385
143 HG LEU 23 HG LEU 23 -1.561 3.882 2.491
144 HD11 LEU 23 1HD1 LEU 23 -3.263 5.096 3.735
145 HD12 LEU 23 2HD1 LEU 23 -1.708 5.194 4.560
146 HD13 LEU 23 3HD1 LEU 23 -2.956 4.103 5.161
147 HD21 LEU 23 1HD2 LEU 23 -0.059 3.373 4.359
148 HD22 LEU 23 2HD2 LEU 23 -0.418 1.933 3.407
149 HD23 LEU 23 3HD2 LEU 23 -1.207 2.180 4.966
150 H CYS 24 H CYS 24 -3.434 1.904 0.033
151 HA CYS 24 HA CYS 24 -1.850 3.889 -1.130
152 HB2 CYS 24 2HB CYS 24 -3.270 1.552 -2.448
153 HB3 CYS 24 1HB CYS 24 -1.988 2.504 -3.196
154 H ARG 25 H ARG 25 -5.275 3.061 -1.704
155 HA ARG 25 HA ARG 25 -5.610 5.161 -3.641
156 HB2 ARG 25 1HB ARG 25 -7.649 3.476 -2.169
157 HB3 ARG 25 2HB ARG 25 -8.051 4.640 -3.427
158 HG2 ARG 25 1HG ARG 25 -6.564 3.349 -4.978
159 HG3 ARG 25 2HG ARG 25 -6.422 2.121 -3.718
160 HD2 ARG 25 1HD ARG 25 -8.140 1.517 -5.340
161 HD3 ARG 25 2HD ARG 25 -8.848 1.806 -3.750
162 HE ARG 25 HE ARG 25 -9.443 4.077 -4.641
163 HH11 ARG 25 1HH1 ARG 25 -8.976 1.385 -6.828
164 HH12 ARG 25 2HH1 ARG 25 -10.073 1.998 -8.026
165 HH21 ARG 25 1HH2 ARG 25 -10.869 4.909 -6.212
166 HH22 ARG 25 2HH2 ARG 25 -11.145 4.019 -7.679
167 H LYS 26 H LYS 26 -5.754 4.952 -0.198
168 HA LYS 26 HA LYS 26 -7.329 7.268 0.299
169 HB2 LYS 26 1HB LYS 26 -6.592 5.376 1.933
170 HB3 LYS 26 2HB LYS 26 -5.114 6.305 2.115
171 HG2 LYS 26 1HG LYS 26 -7.866 7.411 2.665
172 HG3 LYS 26 2HG LYS 26 -6.852 6.656 3.889
173 HD2 LYS 26 1HD LYS 26 -5.122 8.368 3.501
174 HD3 LYS 26 2HD LYS 26 -6.157 9.127 2.289
175 HE2 LYS 26 1HE LYS 26 -6.777 8.812 5.229
176 HE3 LYS 26 2HE LYS 26 -6.313 10.305 4.414
177 HZ1 LYS 26 1HZ LYS 26 -8.675 10.264 4.700
178 HZ2 LYS 26 2HZ LYS 26 -8.802 8.746 3.968
179 HZ3 LYS 26 3HZ LYS 26 -8.342 10.090 3.048
180 H LEU 27 H LEU 27 -3.834 6.690 0.047
181 HA LEU 27 HA LEU 27 -3.094 9.438 0.180
182 HB2 LEU 27 1HB LEU 27 -1.617 7.096 -1.046
183 HB3 LEU 27 2HB LEU 27 -0.918 8.671 -0.712
184 HG LEU 27 HG LEU 27 -1.936 6.704 1.352
185 HD11 LEU 27 1HD1 LEU 27 0.159 5.996 0.339
186 HD12 LEU 27 2HD1 LEU 27 0.424 6.525 2.001
187 HD13 LEU 27 3HD1 LEU 27 0.870 7.579 0.658
188 HD21 LEU 27 1HD2 LEU 27 -1.020 8.258 3.014
189 HD22 LEU 27 2HD2 LEU 27 -2.314 9.005 2.080
190 HD23 LEU 27 3HD2 LEU 27 -0.633 9.407 1.731
191 H GLY 28 H GLY 28 -4.028 7.237 -2.374
192 HA2 GLY 28 1HA GLY 28 -5.099 7.945 -4.363
193 HA3 GLY 28 2HA GLY 28 -4.339 9.521 -4.194
194 H VAL 29 H VAL 29 -2.464 6.647 -3.756
195 HA VAL 29 HA VAL 29 -0.989 7.263 -6.226
196 HB VAL 29 HB VAL 29 -0.098 5.643 -3.826
197 HG11 VAL 29 1HG1 VAL 29 2.139 5.768 -4.822
198 HG12 VAL 29 2HG1 VAL 29 1.473 6.617 -6.218
199 HG13 VAL 29 3HG1 VAL 29 1.005 4.947 -5.894
200 HG21 VAL 29 1HG2 VAL 29 1.330 7.559 -3.274
201 HG22 VAL 29 2HG2 VAL 29 -0.376 8.009 -3.260
202 HG23 VAL 29 3HG2 VAL 29 0.645 8.463 -4.624
203 H THR 30 H THR 30 -1.295 5.946 -7.896
204 HA THR 30 HA THR 30 -2.616 3.398 -7.591
205 HB THR 30 HB THR 30 -2.265 3.264 -10.113
206 HG1 THR 30 1HG THR 30 -0.816 4.633 -10.831
207 HG21 THR 30 1HG2 THR 30 -3.974 4.957 -10.603
208 HG22 THR 30 2HG2 THR 30 -3.699 5.697 -9.027
209 HG23 THR 30 3HG2 THR 30 -4.364 4.066 -9.130
210 H ASN 31 H ASN 31 0.623 4.598 -8.059
211 HA ASN 31 HA ASN 31 1.828 2.071 -8.665
212 HB2 ASN 31 1HB ASN 31 3.025 4.655 -7.611
213 HB3 ASN 31 2HB ASN 31 3.975 3.248 -8.072
214 HD21 ASN 31 1HD2 ASN 31 4.306 4.859 -11.151
215 HD22 ASN 31 2HD2 ASN 31 5.062 4.426 -9.657
216 H CYS 32 H CYS 32 0.647 0.892 -7.034
217 HA CYS 32 HA CYS 32 1.874 1.044 -4.342
218 HB2 CYS 32 2HB CYS 32 -0.401 1.777 -4.141
219 HB3 CYS 32 1HB CYS 32 -0.989 0.493 -5.185
220 H ARG 33 H ARG 33 2.950 -0.752 -3.817
221 HA ARG 33 HA ARG 33 2.451 -3.237 -5.339
222 HB2 ARG 33 1HB ARG 33 4.709 -1.952 -5.548
223 HB3 ARG 33 2HB ARG 33 5.031 -2.549 -3.929
224 HG2 ARG 33 1HG ARG 33 6.098 -4.023 -5.430
225 HG3 ARG 33 2HG ARG 33 4.677 -4.873 -4.819
226 HD2 ARG 33 1HD ARG 33 4.978 -5.172 -7.245
227 HD3 ARG 33 2HD ARG 33 3.460 -4.365 -6.853
228 HE ARG 33 HE ARG 33 5.179 -2.304 -7.312
229 HH11 ARG 33 1HH1 ARG 33 4.278 -5.142 -9.160
230 HH12 ARG 33 2HH1 ARG 33 4.488 -4.367 -10.698
231 HH21 ARG 33 1HH2 ARG 33 5.454 -1.275 -9.333
232 HH22 ARG 33 2HH2 ARG 33 5.139 -2.158 -10.797
233 H VAL 34 H VAL 34 2.352 -5.193 -4.151
234 HA VAL 34 HA VAL 34 1.890 -4.769 -1.263
235 HB VAL 34 HB VAL 34 0.578 -6.810 -3.076
236 HG11 VAL 34 1HG1 VAL 34 -0.905 -7.232 -1.151
237 HG12 VAL 34 2HG1 VAL 34 0.066 -6.128 -0.175
238 HG13 VAL 34 3HG1 VAL 34 0.778 -7.621 -0.788
239 HG21 VAL 34 1HG2 VAL 34 -0.177 -4.540 -3.583
240 HG22 VAL 34 2HG2 VAL 34 -0.545 -4.269 -1.879
241 HG23 VAL 34 3HG2 VAL 34 -1.460 -5.465 -2.800
242 H HIS 35 H HIS 35 3.298 -5.695 0.015
243 HA HIS 35 HA HIS 35 4.445 -8.334 -0.688
244 HB2 HIS 35 1HB HIS 35 5.485 -6.339 1.359
245 HB3 HIS 35 2HB HIS 35 6.238 -7.863 0.918
246 HD1 HIS 35 HD1 HIS 35 8.357 -7.251 -0.181
247 HD2 HIS 35 HD2 HIS 35 5.212 -4.850 -1.467
248 HE1 HIS 35 HE1 HIS 35 9.336 -5.727 -1.925
249 HE2 HIS 35 HE2 HIS 35 7.460 -4.172 -2.558
250 H CYS 36 H CYS 36 4.152 -9.992 0.868
251 HA CYS 36 HA CYS 36 2.908 -9.297 3.412
252 HB2 CYS 36 2HB CYS 36 1.600 -11.138 1.398
253 HB3 CYS 36 1HB CYS 36 1.155 -11.088 3.100
254 H GLY 37 H GLY 37 4.329 -10.127 4.762
255 HA2 GLY 37 1HA GLY 37 5.310 -11.860 5.974
256 HA3 GLY 37 2HA GLY 37 4.925 -12.975 4.670
Start of MODEL 17
1 H1 ALA 1 1H ALA 1 -1.687 -12.158 11.928
2 H2 ALA 1 2H ALA 1 -2.543 -11.336 10.725
3 H3 ALA 1 3H ALA 1 -1.650 -10.468 11.868
4 HA ALA 1 HA ALA 1 0.399 -11.319 11.022
5 HB1 ALA 1 1HB ALA 1 -1.324 -12.826 9.050
6 HB2 ALA 1 2HB ALA 1 -0.423 -13.534 10.390
7 HB3 ALA 1 3HB ALA 1 0.440 -12.774 9.051
8 HA PRO 2 HA PRO 2 -0.534 -7.756 8.405
9 HB2 PRO 2 2HB PRO 2 1.523 -6.239 9.116
10 HB3 PRO 2 1HB PRO 2 0.237 -6.594 10.278
11 HG2 PRO 2 2HG PRO 2 2.976 -7.783 10.058
12 HG3 PRO 2 1HG PRO 2 2.052 -7.356 11.511
13 HD2 PRO 2 2HD PRO 2 2.250 -9.920 10.368
14 HD3 PRO 2 1HD PRO 2 1.064 -9.407 11.583
15 H CYS 3 H CYS 3 0.635 -6.547 6.729
16 HA CYS 3 HA CYS 3 2.955 -7.898 5.559
17 HB2 CYS 3 2HB CYS 3 0.375 -7.255 4.101
18 HB3 CYS 3 1HB CYS 3 1.885 -7.638 3.285
19 H GLU 4 H GLU 4 3.424 -6.387 3.401
20 HA GLU 4 HA GLU 4 3.540 -3.636 4.454
21 HB2 GLU 4 1HB GLU 4 5.629 -3.346 3.278
22 HB3 GLU 4 2HB GLU 4 5.735 -4.794 4.267
23 HG2 GLU 4 1HG GLU 4 5.233 -6.144 2.253
24 HG3 GLU 4 2HG GLU 4 5.300 -4.669 1.295
25 H CYS 5 H CYS 5 3.763 -1.986 2.701
26 HA CYS 5 HA CYS 5 2.333 -2.616 0.235
27 HB2 CYS 5 2HB CYS 5 0.574 -1.999 1.860
28 HB3 CYS 5 1HB CYS 5 1.422 -0.500 2.220
29 H ASP 6 H ASP 6 3.158 -1.447 -1.439
30 HA ASP 6 HA ASP 6 5.170 0.603 -0.758
31 HB2 ASP 6 1HB ASP 6 6.197 -1.395 -1.720
32 HB3 ASP 6 2HB ASP 6 5.110 -1.313 -3.106
33 H VAL 7 H VAL 7 4.310 2.487 -1.096
34 HA VAL 7 HA VAL 7 2.638 3.002 -3.444
35 HB VAL 7 HB VAL 7 1.867 4.987 -1.991
36 HG11 VAL 7 1HG1 VAL 7 1.158 2.179 -1.147
37 HG12 VAL 7 2HG1 VAL 7 0.430 3.081 -2.476
38 HG13 VAL 7 3HG1 VAL 7 0.198 3.624 -0.814
39 HG21 VAL 7 1HG2 VAL 7 3.630 4.880 -0.313
40 HG22 VAL 7 2HG2 VAL 7 3.073 3.281 0.182
41 HG23 VAL 7 3HG2 VAL 7 2.044 4.693 0.427
42 H ASN 8 H ASN 8 3.921 3.884 -4.965
43 HA ASN 8 HA ASN 8 5.168 5.437 -6.074
44 HB2 ASN 8 1HB ASN 8 3.607 7.021 -4.904
45 HB3 ASN 8 2HB ASN 8 4.784 7.173 -3.608
46 HD21 ASN 8 1HD2 ASN 8 5.278 9.154 -7.122
47 HD22 ASN 8 2HD2 ASN 8 4.058 7.945 -6.928
48 H GLY 9 H GLY 9 6.417 3.493 -4.158
49 HA2 GLY 9 1HA GLY 9 8.739 3.013 -4.057
50 HA3 GLY 9 2HA GLY 9 9.082 4.737 -4.145
51 H GLU 10 H GLU 10 6.757 4.912 -2.072
52 HA GLU 10 HA GLU 10 8.406 4.674 0.305
53 HB2 GLU 10 1HB GLU 10 5.534 5.561 -0.105
54 HB3 GLU 10 2HB GLU 10 6.357 5.566 1.448
55 HG2 GLU 10 1HG GLU 10 7.302 7.133 -0.943
56 HG3 GLU 10 2HG GLU 10 6.232 7.783 0.300
57 H THR 11 H THR 11 8.351 2.931 1.649
58 HA THR 11 HA THR 11 6.262 0.915 1.123
59 HB THR 11 HB THR 11 9.048 0.436 2.213
60 HG1 THR 11 1HG THR 11 8.040 0.609 -0.366
61 HG21 THR 11 1HG2 THR 11 7.415 -1.233 2.970
62 HG22 THR 11 2HG2 THR 11 8.535 -1.939 1.805
63 HG23 THR 11 3HG2 THR 11 6.904 -1.498 1.303
64 H TYR 12 H TYR 12 4.786 0.949 2.629
65 HA TYR 12 HA TYR 12 5.532 1.430 5.443
66 HB2 TYR 12 2HB TYR 12 2.843 1.889 4.109
67 HB3 TYR 12 1HB TYR 12 3.247 2.260 5.782
68 HD1 TYR 12 1HD TYR 12 5.364 3.877 6.035
69 HD2 TYR 12 2HD TYR 12 2.872 3.655 2.577
70 HE1 TYR 12 1HE TYR 12 6.060 6.146 5.389
71 HE2 TYR 12 2HE TYR 12 3.571 5.916 1.928
72 HH TYR 12 HH TYR 12 6.203 7.474 3.184
73 H THR 13 H THR 13 3.786 0.358 6.939
74 HA THR 13 HA THR 13 3.380 -2.396 5.955
75 HB THR 13 HB THR 13 3.355 -2.932 8.499
76 HG1 THR 13 1HG THR 13 3.628 -0.393 8.749
77 HG21 THR 13 1HG2 THR 13 5.095 -3.704 6.961
78 HG22 THR 13 2HG2 THR 13 5.792 -3.232 8.509
79 HG23 THR 13 3HG2 THR 13 5.932 -2.160 7.115
80 H VAL 14 H VAL 14 1.435 -3.303 6.090
81 HA VAL 14 HA VAL 14 -0.768 -1.808 7.344
82 HB VAL 14 HB VAL 14 -2.205 -2.372 5.392
83 HG11 VAL 14 1HG1 VAL 14 -1.325 -0.662 3.866
84 HG12 VAL 14 2HG1 VAL 14 0.228 -0.722 4.698
85 HG13 VAL 14 3HG1 VAL 14 -1.205 -0.147 5.550
86 HG21 VAL 14 1HG2 VAL 14 -0.953 -4.291 4.543
87 HG22 VAL 14 2HG2 VAL 14 0.390 -3.238 4.095
88 HG23 VAL 14 3HG2 VAL 14 -1.166 -3.080 3.279
89 H SER 15 H SER 15 -2.778 -3.210 7.484
90 HA SER 15 HA SER 15 -2.127 -5.574 8.894
91 HB2 SER 15 1HB SER 15 -4.106 -4.177 9.408
92 HB3 SER 15 2HB SER 15 -4.836 -4.663 7.876
93 HG SER 15 HG SER 15 -4.007 -6.553 9.818
94 H SER 16 H SER 16 -3.378 -5.000 5.635
95 HA SER 16 HA SER 16 -2.582 -7.615 4.770
96 HB2 SER 16 1HB SER 16 -4.750 -8.099 5.927
97 HB3 SER 16 2HB SER 16 -5.557 -6.994 4.816
98 HG SER 16 HG SER 16 -5.379 -9.450 4.405
99 H SER 17 H SER 17 -3.568 -7.958 2.432
100 HA SER 17 HA SER 17 -2.515 -5.968 0.792
101 HB2 SER 17 1HB SER 17 -3.730 -7.189 -1.057
102 HB3 SER 17 2HB SER 17 -2.739 -8.225 -0.026
103 HG SER 17 HG SER 17 -5.435 -8.244 -0.438
104 H GLU 18 H GLU 18 -5.857 -6.595 1.759
105 HA GLU 18 HA GLU 18 -7.089 -4.633 0.164
106 HB2 GLU 18 1HB GLU 18 -8.007 -5.649 2.864
107 HB3 GLU 18 2HB GLU 18 -9.011 -4.901 1.627
108 HG2 GLU 18 1HG GLU 18 -8.474 -6.808 0.119
109 HG3 GLU 18 2HG GLU 18 -7.619 -7.572 1.458
110 H GLU 19 H GLU 19 -5.701 -4.531 3.403
111 HA GLU 19 HA GLU 19 -6.391 -1.895 4.077
112 HB2 GLU 19 1HB GLU 19 -5.363 -3.685 5.587
113 HB3 GLU 19 2HB GLU 19 -3.813 -3.278 4.863
114 HG2 GLU 19 1HG GLU 19 -3.923 -2.100 6.901
115 HG3 GLU 19 2HG GLU 19 -4.207 -0.906 5.636
116 H CYS 20 H CYS 20 -3.631 -3.251 2.311
117 HA CYS 20 HA CYS 20 -2.259 -0.838 1.818
118 HB2 CYS 20 2HB CYS 20 -1.153 -2.929 1.382
119 HB3 CYS 20 1HB CYS 20 -2.386 -3.404 0.223
120 H GLU 21 H GLU 21 -4.907 -2.432 0.064
121 HA GLU 21 HA GLU 21 -5.068 -0.700 -2.128
122 HB2 GLU 21 1HB GLU 21 -7.309 -2.132 -0.676
123 HB3 GLU 21 2HB GLU 21 -7.474 -1.355 -2.244
124 HG2 GLU 21 1HG GLU 21 -5.758 -2.912 -3.140
125 HG3 GLU 21 2HG GLU 21 -5.756 -3.739 -1.581
126 H ARG 22 H ARG 22 -6.681 -0.539 1.036
127 HA ARG 22 HA ARG 22 -8.118 1.788 0.689
128 HB2 ARG 22 1HB ARG 22 -6.832 0.627 3.166
129 HB3 ARG 22 2HB ARG 22 -8.063 1.860 3.151
130 HG2 ARG 22 1HG ARG 22 -9.651 0.328 2.140
131 HG3 ARG 22 2HG ARG 22 -8.407 -0.924 2.090
132 HD2 ARG 22 1HD ARG 22 -8.257 -0.844 4.549
133 HD3 ARG 22 2HD ARG 22 -9.538 0.370 4.574
134 HE ARG 22 HE ARG 22 -10.319 -2.008 3.194
135 HH11 ARG 22 1HH1 ARG 22 -9.970 -0.585 6.382
136 HH12 ARG 22 2HH1 ARG 22 -11.193 -1.590 7.095
137 HH21 ARG 22 1HH2 ARG 22 -11.893 -3.357 4.144
138 HH22 ARG 22 2HH2 ARG 22 -12.256 -3.190 5.835
139 H LEU 23 H LEU 23 -4.830 1.306 1.942
140 HA LEU 23 HA LEU 23 -4.219 3.985 2.507
141 HB2 LEU 23 1HB LEU 23 -2.876 2.031 3.242
142 HB3 LEU 23 2HB LEU 23 -2.357 1.776 1.586
143 HG LEU 23 HG LEU 23 -1.255 4.020 1.638
144 HD11 LEU 23 1HD1 LEU 23 -0.874 5.096 3.803
145 HD12 LEU 23 2HD1 LEU 23 -1.950 3.929 4.572
146 HD13 LEU 23 3HD1 LEU 23 -2.586 5.065 3.383
147 HD21 LEU 23 1HD2 LEU 23 0.038 1.986 2.031
148 HD22 LEU 23 2HD2 LEU 23 -0.338 2.061 3.752
149 HD23 LEU 23 3HD2 LEU 23 0.649 3.320 3.010
150 H CYS 24 H CYS 24 -3.714 2.053 -0.418
151 HA CYS 24 HA CYS 24 -2.398 3.922 -2.003
152 HB2 CYS 24 2HB CYS 24 -2.636 1.539 -2.590
153 HB3 CYS 24 1HB CYS 24 -4.353 1.774 -2.873
154 H ARG 25 H ARG 25 -5.866 3.313 -1.650
155 HA ARG 25 HA ARG 25 -6.723 5.279 -3.515
156 HB2 ARG 25 1HB ARG 25 -8.249 4.079 -1.184
157 HB3 ARG 25 2HB ARG 25 -8.958 4.949 -2.535
158 HG2 ARG 25 1HG ARG 25 -7.484 2.323 -2.723
159 HG3 ARG 25 2HG ARG 25 -9.236 2.526 -2.754
160 HD2 ARG 25 1HD ARG 25 -9.058 3.826 -4.816
161 HD3 ARG 25 2HD ARG 25 -7.300 3.680 -4.768
162 HE ARG 25 HE ARG 25 -8.350 1.098 -4.710
163 HH11 ARG 25 1HH1 ARG 25 -8.272 3.814 -6.936
164 HH12 ARG 25 2HH1 ARG 25 -8.322 2.806 -8.347
165 HH21 ARG 25 1HH2 ARG 25 -8.428 -0.207 -6.560
166 HH22 ARG 25 2HH2 ARG 25 -8.414 0.524 -8.139
167 H LYS 26 H LYS 26 -6.458 5.245 0.008
168 HA LYS 26 HA LYS 26 -7.556 7.742 0.568
169 HB2 LYS 26 1HB LYS 26 -7.111 5.980 2.243
170 HB3 LYS 26 2HB LYS 26 -5.384 6.250 2.071
171 HG2 LYS 26 1HG LYS 26 -5.623 8.501 2.975
172 HG3 LYS 26 2HG LYS 26 -7.372 8.279 3.096
173 HD2 LYS 26 1HD LYS 26 -7.016 6.414 4.668
174 HD3 LYS 26 2HD LYS 26 -5.272 6.666 4.559
175 HE2 LYS 26 1HE LYS 26 -5.525 8.905 5.503
176 HE3 LYS 26 2HE LYS 26 -7.276 8.690 5.572
177 HZ1 LYS 26 1HZ LYS 26 -5.283 7.051 7.053
178 HZ2 LYS 26 2HZ LYS 26 -6.964 6.883 7.137
179 HZ3 LYS 26 3HZ LYS 26 -6.228 8.289 7.719
180 H LEU 27 H LEU 27 -4.296 6.819 -0.355
181 HA LEU 27 HA LEU 27 -3.321 9.552 -0.085
182 HB2 LEU 27 1HB LEU 27 -1.914 7.055 -1.052
183 HB3 LEU 27 2HB LEU 27 -1.151 8.605 -0.745
184 HG LEU 27 HG LEU 27 -2.422 6.798 1.322
185 HD11 LEU 27 1HD1 LEU 27 0.462 7.554 0.851
186 HD12 LEU 27 2HD1 LEU 27 -0.272 5.984 0.529
187 HD13 LEU 27 3HD1 LEU 27 -0.144 6.572 2.186
188 HD21 LEU 27 1HD2 LEU 27 -1.578 8.405 2.979
189 HD22 LEU 27 2HD2 LEU 27 -2.793 9.124 1.925
190 HD23 LEU 27 3HD2 LEU 27 -1.084 9.484 1.674
191 H GLY 28 H GLY 28 -4.552 7.427 -2.520
192 HA2 GLY 28 1HA GLY 28 -5.129 7.872 -4.707
193 HA3 GLY 28 2HA GLY 28 -4.578 9.525 -4.470
194 H VAL 29 H VAL 29 -2.749 6.533 -4.054
195 HA VAL 29 HA VAL 29 -0.584 7.641 -5.643
196 HB VAL 29 HB VAL 29 -0.767 4.981 -4.204
197 HG11 VAL 29 1HG1 VAL 29 0.924 4.974 -5.978
198 HG12 VAL 29 2HG1 VAL 29 1.675 4.936 -4.384
199 HG13 VAL 29 3HG1 VAL 29 1.642 6.437 -5.306
200 HG21 VAL 29 1HG2 VAL 29 -0.982 6.851 -2.658
201 HG22 VAL 29 2HG2 VAL 29 0.475 7.591 -3.321
202 HG23 VAL 29 3HG2 VAL 29 0.579 6.058 -2.453
203 H THR 30 H THR 30 0.270 6.733 -7.522
204 HA THR 30 HA THR 30 -1.570 5.296 -9.208
205 HB THR 30 HB THR 30 0.348 5.447 -10.869
206 HG1 THR 30 1HG THR 30 2.006 7.006 -10.169
207 HG21 THR 30 1HG2 THR 30 -0.585 8.031 -9.595
208 HG22 THR 30 2HG2 THR 30 -1.445 7.120 -10.836
209 HG23 THR 30 3HG2 THR 30 0.105 7.874 -11.209
210 H ASN 31 H ASN 31 1.743 4.686 -8.050
211 HA ASN 31 HA ASN 31 1.422 1.827 -8.616
212 HB2 ASN 31 1HB ASN 31 3.450 2.835 -9.511
213 HB3 ASN 31 2HB ASN 31 3.886 3.454 -7.921
214 HD21 ASN 31 1HD2 ASN 31 5.960 0.637 -7.699
215 HD22 ASN 31 2HD2 ASN 31 5.860 2.353 -7.894
216 H CYS 32 H CYS 32 0.396 0.861 -6.972
217 HA CYS 32 HA CYS 32 1.707 0.972 -4.336
218 HB2 CYS 32 2HB CYS 32 -0.627 0.536 -3.370
219 HB3 CYS 32 1HB CYS 32 -0.294 2.168 -3.939
220 H ARG 33 H ARG 33 2.496 -0.972 -3.841
221 HA ARG 33 HA ARG 33 1.230 -3.371 -5.020
222 HB2 ARG 33 1HB ARG 33 3.660 -2.410 -5.775
223 HB3 ARG 33 2HB ARG 33 4.148 -3.454 -4.449
224 HG2 ARG 33 1HG ARG 33 4.292 -4.687 -6.497
225 HG3 ARG 33 2HG ARG 33 2.949 -5.335 -5.553
226 HD2 ARG 33 1HD ARG 33 2.413 -5.076 -7.961
227 HD3 ARG 33 2HD ARG 33 1.351 -4.139 -6.911
228 HE ARG 33 HE ARG 33 3.399 -2.430 -7.632
229 HH11 ARG 33 1HH1 ARG 33 0.952 -4.271 -9.338
230 HH12 ARG 33 2HH1 ARG 33 0.789 -3.105 -10.615
231 HH21 ARG 33 1HH2 ARG 33 3.181 -0.901 -9.323
232 HH22 ARG 33 2HH2 ARG 33 2.063 -1.208 -10.616
233 H VAL 34 H VAL 34 1.960 -5.425 -3.805
234 HA VAL 34 HA VAL 34 2.095 -4.873 -0.905
235 HB VAL 34 HB VAL 34 0.593 -6.760 -0.482
236 HG11 VAL 34 1HG1 VAL 34 -0.393 -4.535 -0.692
237 HG12 VAL 34 2HG1 VAL 34 -1.503 -5.767 -1.295
238 HG13 VAL 34 3HG1 VAL 34 -0.588 -4.772 -2.429
239 HG21 VAL 34 1HG2 VAL 34 -0.617 -7.871 -2.308
240 HG22 VAL 34 2HG2 VAL 34 1.124 -8.119 -2.451
241 HG23 VAL 34 3HG2 VAL 34 0.313 -6.947 -3.490
242 H HIS 35 H HIS 35 3.077 -6.489 0.399
243 HA HIS 35 HA HIS 35 4.203 -8.876 -0.763
244 HB2 HIS 35 1HB HIS 35 5.897 -7.226 -1.445
245 HB3 HIS 35 2HB HIS 35 6.042 -6.661 0.211
246 HD1 HIS 35 HD1 HIS 35 7.934 -7.638 1.475
247 HD2 HIS 35 HD2 HIS 35 6.727 -10.097 -1.656
248 HE1 HIS 35 HE1 HIS 35 9.568 -9.544 1.443
249 HE2 HIS 35 HE2 HIS 35 8.801 -11.038 -0.431
250 H CYS 36 H CYS 36 4.912 -10.353 0.904
251 HA CYS 36 HA CYS 36 4.420 -9.466 3.673
252 HB2 CYS 36 2HB CYS 36 3.355 -12.045 2.495
253 HB3 CYS 36 1HB CYS 36 3.099 -11.456 4.134
254 H GLY 37 H GLY 37 6.255 -9.817 4.770
255 HA2 GLY 37 1HA GLY 37 7.994 -12.059 3.975
256 HA3 GLY 37 2HA GLY 37 8.487 -10.655 4.912
Start of MODEL 18
1 H1 ALA 1 1H ALA 1 -1.094 -12.183 9.591
2 H2 ALA 1 2H ALA 1 -1.410 -10.852 8.601
3 H3 ALA 1 3H ALA 1 -1.187 -10.635 10.266
4 HA ALA 1 HA ALA 1 1.096 -11.332 10.102
5 HB1 ALA 1 1HB ALA 1 2.116 -11.739 7.920
6 HB2 ALA 1 2HB ALA 1 0.556 -11.503 7.133
7 HB3 ALA 1 3HB ALA 1 0.798 -12.876 8.213
8 HA PRO 2 HA PRO 2 1.684 -6.938 9.454
9 HB2 PRO 2 2HB PRO 2 4.263 -6.724 10.123
10 HB3 PRO 2 1HB PRO 2 3.066 -7.207 11.336
11 HG2 PRO 2 2HG PRO 2 4.885 -8.949 9.690
12 HG3 PRO 2 1HG PRO 2 4.631 -8.969 11.447
13 HD2 PRO 2 2HD PRO 2 3.357 -10.684 9.779
14 HD3 PRO 2 1HD PRO 2 2.599 -10.070 11.266
15 H CYS 3 H CYS 3 1.334 -7.807 7.117
16 HA CYS 3 HA CYS 3 3.488 -8.284 5.373
17 HB2 CYS 3 2HB CYS 3 0.688 -7.311 4.747
18 HB3 CYS 3 1HB CYS 3 1.808 -8.045 3.600
19 H GLU 4 H GLU 4 3.708 -6.839 3.294
20 HA GLU 4 HA GLU 4 4.427 -4.169 4.339
21 HB2 GLU 4 1HB GLU 4 6.282 -4.252 2.620
22 HB3 GLU 4 2HB GLU 4 6.429 -5.367 3.959
23 HG2 GLU 4 1HG GLU 4 5.121 -6.393 1.510
24 HG3 GLU 4 2HG GLU 4 6.853 -6.089 1.435
25 H CYS 5 H CYS 5 4.322 -2.395 3.019
26 HA CYS 5 HA CYS 5 2.730 -2.620 0.549
27 HB2 CYS 5 2HB CYS 5 1.319 -1.880 2.466
28 HB3 CYS 5 1HB CYS 5 2.416 -0.533 2.735
29 H ASP 6 H ASP 6 3.220 -1.004 -1.028
30 HA ASP 6 HA ASP 6 5.730 0.480 -0.618
31 HB2 ASP 6 1HB ASP 6 6.407 -1.670 -1.533
32 HB3 ASP 6 2HB ASP 6 5.205 -1.550 -2.806
33 H VAL 7 H VAL 7 4.922 2.481 -0.919
34 HA VAL 7 HA VAL 7 3.232 3.009 -3.276
35 HB VAL 7 HB VAL 7 3.357 4.623 -0.711
36 HG11 VAL 7 1HG1 VAL 7 2.718 5.945 -2.649
37 HG12 VAL 7 2HG1 VAL 7 1.333 5.711 -1.583
38 HG13 VAL 7 3HG1 VAL 7 1.472 4.767 -3.066
39 HG21 VAL 7 1HG2 VAL 7 1.138 3.676 -0.203
40 HG22 VAL 7 2HG2 VAL 7 2.392 2.437 -0.250
41 HG23 VAL 7 3HG2 VAL 7 1.279 2.617 -1.607
42 H ASN 8 H ASN 8 4.314 3.993 -4.838
43 HA ASN 8 HA ASN 8 5.767 5.303 -5.994
44 HB2 ASN 8 1HB ASN 8 5.493 6.970 -3.486
45 HB3 ASN 8 2HB ASN 8 6.437 7.503 -4.871
46 HD21 ASN 8 1HD2 ASN 8 2.863 8.736 -4.909
47 HD22 ASN 8 2HD2 ASN 8 4.039 8.639 -3.644
48 H GLY 9 H GLY 9 6.765 3.191 -4.088
49 HA2 GLY 9 1HA GLY 9 8.954 2.316 -3.998
50 HA3 GLY 9 2HA GLY 9 9.596 3.929 -4.271
51 H GLU 10 H GLU 10 7.468 4.687 -2.099
52 HA GLU 10 HA GLU 10 9.276 4.476 0.148
53 HB2 GLU 10 1HB GLU 10 6.472 5.630 0.021
54 HB3 GLU 10 2HB GLU 10 7.623 5.842 1.335
55 HG2 GLU 10 1HG GLU 10 7.890 6.891 -1.479
56 HG3 GLU 10 2HG GLU 10 7.545 7.831 -0.029
57 H THR 11 H THR 11 8.530 3.596 2.248
58 HA THR 11 HA THR 11 7.088 1.076 1.704
59 HB THR 11 HB THR 11 9.263 1.513 3.769
60 HG1 THR 11 1HG THR 11 9.366 0.822 1.044
61 HG21 THR 11 1HG2 THR 11 8.043 -1.025 2.647
62 HG22 THR 11 2HG2 THR 11 7.747 -0.363 4.255
63 HG23 THR 11 3HG2 THR 11 9.354 -0.940 3.820
64 H TYR 12 H TYR 12 5.299 0.754 2.762
65 HA TYR 12 HA TYR 12 4.954 1.848 5.485
66 HB2 TYR 12 2HB TYR 12 2.823 1.424 3.360
67 HB3 TYR 12 1HB TYR 12 2.502 1.895 5.022
68 HD1 TYR 12 1HD TYR 12 2.816 4.169 5.751
69 HD2 TYR 12 2HD TYR 12 3.882 3.019 1.790
70 HE1 TYR 12 1HE TYR 12 2.993 6.537 5.117
71 HE2 TYR 12 2HE TYR 12 4.065 5.385 1.148
72 HH TYR 12 HH TYR 12 4.076 7.919 3.451
73 H THR 13 H THR 13 3.850 0.419 6.951
74 HA THR 13 HA THR 13 3.765 -2.382 6.038
75 HB THR 13 HB THR 13 3.835 -2.575 8.772
76 HG1 THR 13 1HG THR 13 4.783 -0.882 9.610
77 HG21 THR 13 1HG2 THR 13 6.203 -3.200 8.504
78 HG22 THR 13 2HG2 THR 13 6.210 -2.470 6.898
79 HG23 THR 13 3HG2 THR 13 5.200 -3.882 7.224
80 H VAL 14 H VAL 14 2.000 -3.603 6.476
81 HA VAL 14 HA VAL 14 -0.299 -2.392 7.834
82 HB VAL 14 HB VAL 14 -1.808 -3.045 5.948
83 HG11 VAL 14 1HG1 VAL 14 -1.290 -1.121 4.506
84 HG12 VAL 14 2HG1 VAL 14 0.311 -1.004 5.238
85 HG13 VAL 14 3HG1 VAL 14 -1.129 -0.715 6.214
86 HG21 VAL 14 1HG2 VAL 14 -0.841 -3.444 3.722
87 HG22 VAL 14 2HG2 VAL 14 -0.352 -4.692 4.870
88 HG23 VAL 14 3HG2 VAL 14 0.780 -3.415 4.417
89 H SER 15 H SER 15 -2.092 -4.013 8.067
90 HA SER 15 HA SER 15 -0.947 -6.603 8.747
91 HB2 SER 15 1HB SER 15 -2.402 -5.333 10.361
92 HB3 SER 15 2HB SER 15 -3.752 -5.567 9.253
93 HG SER 15 HG SER 15 -2.770 -7.947 9.574
94 H SER 16 H SER 16 -2.841 -5.130 6.270
95 HA SER 16 HA SER 16 -3.220 -7.739 5.013
96 HB2 SER 16 1HB SER 16 -5.537 -5.809 5.324
97 HB3 SER 16 2HB SER 16 -5.583 -7.423 4.613
98 HG SER 16 HG SER 16 -5.372 -6.651 7.305
99 H SER 17 H SER 17 -3.362 -7.729 2.825
100 HA SER 17 HA SER 17 -2.133 -5.788 1.296
101 HB2 SER 17 1HB SER 17 -3.359 -6.965 -0.632
102 HB3 SER 17 2HB SER 17 -2.371 -7.991 0.412
103 HG SER 17 HG SER 17 -4.469 -8.868 0.027
104 H GLU 18 H GLU 18 -5.608 -6.434 1.602
105 HA GLU 18 HA GLU 18 -6.573 -4.323 0.096
106 HB2 GLU 18 1HB GLU 18 -8.658 -4.556 1.476
107 HB3 GLU 18 2HB GLU 18 -8.060 -6.050 0.767
108 HG2 GLU 18 1HG GLU 18 -7.010 -6.610 2.944
109 HG3 GLU 18 2HG GLU 18 -7.761 -5.168 3.631
110 H GLU 19 H GLU 19 -5.485 -4.315 3.454
111 HA GLU 19 HA GLU 19 -6.357 -1.722 4.138
112 HB2 GLU 19 1HB GLU 19 -3.957 -3.300 5.092
113 HB3 GLU 19 2HB GLU 19 -4.455 -1.767 5.791
114 HG2 GLU 19 1HG GLU 19 -6.540 -2.724 6.526
115 HG3 GLU 19 2HG GLU 19 -6.173 -4.240 5.700
116 H CYS 20 H CYS 20 -3.212 -2.893 2.925
117 HA CYS 20 HA CYS 20 -1.986 -0.418 2.493
118 HB2 CYS 20 2HB CYS 20 -0.625 -2.324 2.201
119 HB3 CYS 20 1HB CYS 20 -1.738 -3.058 1.057
120 H GLU 21 H GLU 21 -3.966 -2.288 0.205
121 HA GLU 21 HA GLU 21 -3.848 -0.492 -1.936
122 HB2 GLU 21 1HB GLU 21 -6.095 -2.411 -1.263
123 HB3 GLU 21 2HB GLU 21 -5.767 -1.704 -2.843
124 HG2 GLU 21 1HG GLU 21 -3.627 -2.885 -2.935
125 HG3 GLU 21 2HG GLU 21 -3.942 -3.586 -1.350
126 H ARG 22 H ARG 22 -6.049 -0.688 0.803
127 HA ARG 22 HA ARG 22 -7.959 1.174 -0.123
128 HB2 ARG 22 1HB ARG 22 -8.378 -0.413 1.735
129 HB3 ARG 22 2HB ARG 22 -7.223 0.457 2.732
130 HG2 ARG 22 1HG ARG 22 -9.506 1.037 3.331
131 HG3 ARG 22 2HG ARG 22 -8.656 2.440 2.681
132 HD2 ARG 22 1HD ARG 22 -10.997 2.190 1.857
133 HD3 ARG 22 2HD ARG 22 -9.789 2.231 0.575
134 HE ARG 22 HE ARG 22 -10.149 -0.430 1.108
135 HH11 ARG 22 1HH1 ARG 22 -12.324 2.189 0.254
136 HH12 ARG 22 2HH1 ARG 22 -13.366 1.176 -0.696
137 HH21 ARG 22 1HH2 ARG 22 -11.512 -1.762 -0.116
138 HH22 ARG 22 2HH2 ARG 22 -12.903 -1.088 -0.906
139 H LEU 23 H LEU 23 -5.117 1.498 1.964
140 HA LEU 23 HA LEU 23 -5.290 4.241 2.489
141 HB2 LEU 23 1HB LEU 23 -3.746 2.738 3.665
142 HB3 LEU 23 2HB LEU 23 -2.833 2.497 2.188
143 HG LEU 23 HG LEU 23 -2.220 4.912 2.207
144 HD11 LEU 23 1HD1 LEU 23 -4.123 5.755 3.483
145 HD12 LEU 23 2HD1 LEU 23 -2.597 6.231 4.218
146 HD13 LEU 23 3HD1 LEU 23 -3.541 4.920 4.926
147 HD21 LEU 23 1HD2 LEU 23 -0.686 3.263 3.122
148 HD22 LEU 23 2HD2 LEU 23 -1.483 3.354 4.692
149 HD23 LEU 23 3HD2 LEU 23 -0.611 4.751 4.060
150 H CYS 24 H CYS 24 -3.546 2.508 -0.079
151 HA CYS 24 HA CYS 24 -2.492 4.746 -1.380
152 HB2 CYS 24 2HB CYS 24 -3.238 2.064 -2.570
153 HB3 CYS 24 1HB CYS 24 -2.131 3.238 -3.280
154 H ARG 25 H ARG 25 -5.562 3.017 -1.913
155 HA ARG 25 HA ARG 25 -6.288 4.564 -4.192
156 HB2 ARG 25 1HB ARG 25 -8.246 3.314 -4.271
157 HB3 ARG 25 2HB ARG 25 -7.159 2.222 -3.434
158 HG2 ARG 25 1HG ARG 25 -9.075 1.992 -2.199
159 HG3 ARG 25 2HG ARG 25 -8.224 3.232 -1.279
160 HD2 ARG 25 1HD ARG 25 -10.626 3.743 -1.582
161 HD3 ARG 25 2HD ARG 25 -9.580 4.972 -2.289
162 HE ARG 25 HE ARG 25 -10.994 2.891 -3.848
163 HH11 ARG 25 1HH1 ARG 25 -9.651 6.116 -3.572
164 HH12 ARG 25 2HH1 ARG 25 -10.292 6.656 -5.084
165 HH21 ARG 25 1HH2 ARG 25 -11.832 3.602 -5.856
166 HH22 ARG 25 2HH2 ARG 25 -11.543 5.231 -6.382
167 H LYS 26 H LYS 26 -6.742 4.888 -0.751
168 HA LYS 26 HA LYS 26 -8.655 6.980 -0.807
169 HB2 LYS 26 1HB LYS 26 -8.244 5.772 1.255
170 HB3 LYS 26 2HB LYS 26 -6.558 6.269 1.261
171 HG2 LYS 26 1HG LYS 26 -7.860 7.545 2.876
172 HG3 LYS 26 2HG LYS 26 -7.216 8.590 1.607
173 HD2 LYS 26 1HD LYS 26 -9.447 8.417 0.457
174 HD3 LYS 26 2HD LYS 26 -10.049 7.570 1.884
175 HE2 LYS 26 1HE LYS 26 -8.913 10.368 1.827
176 HE3 LYS 26 2HE LYS 26 -10.620 9.947 1.950
177 HZ1 LYS 26 1HZ LYS 26 -8.531 9.260 3.942
178 HZ2 LYS 26 2HZ LYS 26 -10.173 8.887 4.066
179 HZ3 LYS 26 3HZ LYS 26 -9.668 10.496 4.102
180 H LEU 27 H LEU 27 -5.112 7.030 -0.471
181 HA LEU 27 HA LEU 27 -4.783 9.820 -0.586
182 HB2 LEU 27 1HB LEU 27 -2.869 7.675 -1.540
183 HB3 LEU 27 2HB LEU 27 -2.448 9.334 -1.165
184 HG LEU 27 HG LEU 27 -3.406 7.260 0.819
185 HD11 LEU 27 1HD1 LEU 27 -0.680 8.493 0.408
186 HD12 LEU 27 2HD1 LEU 27 -1.138 6.824 0.064
187 HD13 LEU 27 3HD1 LEU 27 -1.131 7.411 1.726
188 HD21 LEU 27 1HD2 LEU 27 -4.167 9.489 1.439
189 HD22 LEU 27 2HD2 LEU 27 -2.527 10.115 1.257
190 HD23 LEU 27 3HD2 LEU 27 -2.890 8.942 2.524
191 H GLY 28 H GLY 28 -5.193 7.381 -3.050
192 HA2 GLY 28 1HA GLY 28 -5.933 7.711 -5.236
193 HA3 GLY 28 2HA GLY 28 -5.605 9.433 -5.075
194 H VAL 29 H VAL 29 -3.386 6.790 -4.371
195 HA VAL 29 HA VAL 29 -1.553 7.864 -6.413
196 HB VAL 29 HB VAL 29 -0.909 6.153 -3.993
197 HG11 VAL 29 1HG1 VAL 29 0.654 5.757 -5.815
198 HG12 VAL 29 2HG1 VAL 29 1.439 6.662 -4.521
199 HG13 VAL 29 3HG1 VAL 29 0.924 7.491 -5.989
200 HG21 VAL 29 1HG2 VAL 29 -0.452 9.105 -4.472
201 HG22 VAL 29 2HG2 VAL 29 0.133 8.190 -3.081
202 HG23 VAL 29 3HG2 VAL 29 -1.600 8.396 -3.335
203 H THR 30 H THR 30 -1.204 6.681 -8.175
204 HA THR 30 HA THR 30 -2.364 4.089 -8.504
205 HB THR 30 HB THR 30 -0.427 5.543 -10.326
206 HG1 THR 30 1HG THR 30 -3.278 5.596 -10.151
207 HG21 THR 30 1HG2 THR 30 -0.675 3.154 -10.870
208 HG22 THR 30 2HG2 THR 30 -1.420 4.167 -12.106
209 HG23 THR 30 3HG2 THR 30 -2.429 3.345 -10.916
210 H ASN 31 H ASN 31 0.919 5.312 -7.992
211 HA ASN 31 HA ASN 31 2.145 2.734 -8.371
212 HB2 ASN 31 1HB ASN 31 3.288 5.273 -7.177
213 HB3 ASN 31 2HB ASN 31 4.217 3.832 -7.577
214 HD21 ASN 31 1HD2 ASN 31 4.353 6.441 -10.278
215 HD22 ASN 31 2HD2 ASN 31 4.535 6.520 -8.561
216 H CYS 32 H CYS 32 1.206 1.340 -6.960
217 HA CYS 32 HA CYS 32 2.123 1.455 -4.203
218 HB2 CYS 32 2HB CYS 32 0.000 2.613 -3.986
219 HB3 CYS 32 1HB CYS 32 -0.825 1.394 -4.949
220 H ARG 33 H ARG 33 2.592 -0.531 -3.522
221 HA ARG 33 HA ARG 33 1.535 -2.893 -4.922
222 HB2 ARG 33 1HB ARG 33 4.447 -2.337 -4.255
223 HB3 ARG 33 2HB ARG 33 3.830 -3.872 -4.855
224 HG2 ARG 33 1HG ARG 33 3.397 -3.007 -6.983
225 HG3 ARG 33 2HG ARG 33 3.442 -1.336 -6.417
226 HD2 ARG 33 1HD ARG 33 5.435 -1.931 -7.727
227 HD3 ARG 33 2HD ARG 33 5.839 -1.485 -6.070
228 HE ARG 33 HE ARG 33 5.682 -4.290 -6.999
229 HH11 ARG 33 1HH1 ARG 33 7.218 -1.753 -5.126
230 HH12 ARG 33 2HH1 ARG 33 8.520 -2.770 -4.582
231 HH21 ARG 33 1HH2 ARG 33 7.383 -5.638 -6.256
232 HH22 ARG 33 2HH2 ARG 33 8.613 -4.974 -5.223
233 H VAL 34 H VAL 34 1.903 -4.889 -3.581
234 HA VAL 34 HA VAL 34 2.483 -4.455 -0.781
235 HB VAL 34 HB VAL 34 0.147 -3.770 -0.825
236 HG11 VAL 34 1HG1 VAL 34 -0.454 -6.478 -2.021
237 HG12 VAL 34 2HG1 VAL 34 -0.559 -4.932 -2.859
238 HG13 VAL 34 3HG1 VAL 34 -1.646 -5.279 -1.517
239 HG21 VAL 34 1HG2 VAL 34 -0.769 -5.338 0.821
240 HG22 VAL 34 2HG2 VAL 34 0.930 -4.998 1.139
241 HG23 VAL 34 3HG2 VAL 34 0.465 -6.523 0.385
242 H HIS 35 H HIS 35 3.429 -6.196 0.052
243 HA HIS 35 HA HIS 35 2.945 -8.796 -1.269
244 HB2 HIS 35 1HB HIS 35 5.292 -8.022 -1.482
245 HB3 HIS 35 2HB HIS 35 5.405 -7.902 0.268
246 HD1 HIS 35 HD1 HIS 35 5.319 -10.398 -2.524
247 HD2 HIS 35 HD2 HIS 35 5.786 -10.337 1.606
248 HE1 HIS 35 HE1 HIS 35 6.120 -12.695 -1.902
249 HE2 HIS 35 HE2 HIS 35 6.534 -12.593 0.584
250 H CYS 36 H CYS 36 1.891 -10.233 -0.059
251 HA CYS 36 HA CYS 36 2.038 -10.033 2.864
252 HB2 CYS 36 2HB CYS 36 0.030 -8.744 1.928
253 HB3 CYS 36 1HB CYS 36 -0.623 -10.306 1.447
254 H GLY 37 H GLY 37 3.038 -11.936 3.174
255 HA2 GLY 37 1HA GLY 37 2.283 -14.314 3.607
256 HA3 GLY 37 2HA GLY 37 1.900 -14.345 1.889
Start of MODEL 19
1 H1 ALA 1 1H ALA 1 -0.202 -13.424 9.270
2 H2 ALA 1 2H ALA 1 1.186 -14.369 9.487
3 H3 ALA 1 3H ALA 1 0.738 -13.865 7.940
4 HA ALA 1 HA ALA 1 1.537 -12.058 10.138
5 HB1 ALA 1 1HB ALA 1 3.630 -11.758 8.934
6 HB2 ALA 1 2HB ALA 1 3.110 -12.905 7.699
7 HB3 ALA 1 3HB ALA 1 3.405 -13.457 9.347
8 HA PRO 2 HA PRO 2 -0.379 -8.886 7.649
9 HB2 PRO 2 2HB PRO 2 1.206 -6.751 8.339
10 HB3 PRO 2 1HB PRO 2 -0.074 -7.398 9.374
11 HG2 PRO 2 2HG PRO 2 2.882 -7.905 9.474
12 HG3 PRO 2 1HG PRO 2 1.752 -7.599 10.809
13 HD2 PRO 2 2HD PRO 2 2.590 -10.082 10.213
14 HD3 PRO 2 1HD PRO 2 0.941 -9.769 10.791
15 H CYS 3 H CYS 3 0.676 -6.801 6.322
16 HA CYS 3 HA CYS 3 2.689 -7.999 4.536
17 HB2 CYS 3 2HB CYS 3 0.112 -6.654 3.684
18 HB3 CYS 3 1HB CYS 3 1.395 -7.162 2.590
19 H GLU 4 H GLU 4 3.685 -6.464 3.087
20 HA GLU 4 HA GLU 4 3.899 -3.739 4.194
21 HB2 GLU 4 1HB GLU 4 5.965 -5.236 2.550
22 HB3 GLU 4 2HB GLU 4 6.180 -3.699 3.380
23 HG2 GLU 4 1HG GLU 4 5.900 -4.853 5.541
24 HG3 GLU 4 2HG GLU 4 5.754 -6.386 4.683
25 H CYS 5 H CYS 5 4.255 -2.063 2.550
26 HA CYS 5 HA CYS 5 3.316 -2.756 -0.123
27 HB2 CYS 5 2HB CYS 5 2.073 -0.683 1.699
28 HB3 CYS 5 1HB CYS 5 1.692 -0.872 -0.004
29 H ASP 6 H ASP 6 4.000 -1.367 -1.741
30 HA ASP 6 HA ASP 6 6.055 0.577 -0.996
31 HB2 ASP 6 1HB ASP 6 5.655 -1.131 -3.459
32 HB3 ASP 6 2HB ASP 6 6.844 0.127 -3.333
33 H VAL 7 H VAL 7 5.151 2.522 -1.077
34 HA VAL 7 HA VAL 7 3.294 3.229 -3.235
35 HB VAL 7 HB VAL 7 3.615 4.469 -0.484
36 HG11 VAL 7 1HG1 VAL 7 1.617 5.108 -2.658
37 HG12 VAL 7 2HG1 VAL 7 2.954 6.134 -2.137
38 HG13 VAL 7 3HG1 VAL 7 1.628 5.788 -1.028
39 HG21 VAL 7 1HG2 VAL 7 1.370 2.778 -1.597
40 HG22 VAL 7 2HG2 VAL 7 1.412 3.529 0.001
41 HG23 VAL 7 3HG2 VAL 7 2.565 2.257 -0.407
42 H ASN 8 H ASN 8 4.280 4.352 -4.772
43 HA ASN 8 HA ASN 8 5.725 5.677 -5.908
44 HB2 ASN 8 1HB ASN 8 5.353 7.303 -3.392
45 HB3 ASN 8 2HB ASN 8 6.321 7.886 -4.741
46 HD21 ASN 8 1HD2 ASN 8 2.768 9.082 -4.937
47 HD22 ASN 8 2HD2 ASN 8 3.945 9.067 -3.670
48 H GLY 9 H GLY 9 6.819 3.560 -4.133
49 HA2 GLY 9 1HA GLY 9 9.077 2.816 -4.362
50 HA3 GLY 9 2HA GLY 9 9.608 4.489 -4.285
51 H GLU 10 H GLU 10 7.555 4.672 -1.913
52 HA GLU 10 HA GLU 10 9.558 3.960 0.090
53 HB2 GLU 10 1HB GLU 10 8.486 6.223 0.109
54 HB3 GLU 10 2HB GLU 10 6.942 5.453 0.457
55 HG2 GLU 10 1HG GLU 10 8.050 6.397 2.459
56 HG3 GLU 10 2HG GLU 10 7.738 4.667 2.582
57 H THR 11 H THR 11 9.015 2.685 1.954
58 HA THR 11 HA THR 11 6.966 0.668 1.283
59 HB THR 11 HB THR 11 9.542 0.244 2.825
60 HG1 THR 11 1HG THR 11 8.883 -0.562 0.164
61 HG21 THR 11 1HG2 THR 11 7.524 -1.733 1.724
62 HG22 THR 11 2HG2 THR 11 7.765 -1.351 3.427
63 HG23 THR 11 3HG2 THR 11 9.046 -2.147 2.515
64 H TYR 12 H TYR 12 5.311 0.642 2.596
65 HA TYR 12 HA TYR 12 5.649 1.386 5.440
66 HB2 TYR 12 2HB TYR 12 3.222 1.627 3.638
67 HB3 TYR 12 1HB TYR 12 3.201 1.924 5.371
68 HD1 TYR 12 1HD TYR 12 4.267 3.904 6.313
69 HD2 TYR 12 2HD TYR 12 4.236 3.228 2.111
70 HE1 TYR 12 1HE TYR 12 4.896 6.250 5.942
71 HE2 TYR 12 2HE TYR 12 4.875 5.574 1.724
72 HH TYR 12 HH TYR 12 4.769 7.726 2.869
73 H THR 13 H THR 13 4.133 0.235 6.911
74 HA THR 13 HA THR 13 3.548 -2.493 5.954
75 HB THR 13 HB THR 13 3.542 -3.056 8.466
76 HG1 THR 13 1HG THR 13 3.630 -1.099 9.461
77 HG21 THR 13 1HG2 THR 13 6.147 -2.271 7.131
78 HG22 THR 13 2HG2 THR 13 5.303 -3.810 6.943
79 HG23 THR 13 3HG2 THR 13 5.980 -3.362 8.508
80 H VAL 14 H VAL 14 1.540 -3.242 6.086
81 HA VAL 14 HA VAL 14 -0.526 -1.466 7.228
82 HB VAL 14 HB VAL 14 -2.011 -2.291 5.342
83 HG11 VAL 14 1HG1 VAL 14 0.421 -0.670 4.563
84 HG12 VAL 14 2HG1 VAL 14 -1.042 -0.044 5.327
85 HG13 VAL 14 3HG1 VAL 14 -1.115 -0.709 3.696
86 HG21 VAL 14 1HG2 VAL 14 -0.905 -3.154 3.329
87 HG22 VAL 14 2HG2 VAL 14 -0.678 -4.246 4.694
88 HG23 VAL 14 3HG2 VAL 14 0.636 -3.187 4.181
89 H SER 15 H SER 15 -2.565 -2.571 7.728
90 HA SER 15 HA SER 15 -2.125 -4.815 9.372
91 HB2 SER 15 1HB SER 15 -3.879 -3.128 9.804
92 HB3 SER 15 2HB SER 15 -4.755 -3.670 8.373
93 HG SER 15 HG SER 15 -4.314 -5.022 10.818
94 H SER 16 H SER 16 -3.715 -4.511 6.188
95 HA SER 16 HA SER 16 -3.253 -7.323 5.664
96 HB2 SER 16 1HB SER 16 -6.094 -6.255 5.680
97 HB3 SER 16 2HB SER 16 -5.587 -7.903 5.300
98 HG SER 16 HG SER 16 -4.593 -7.649 7.592
99 H SER 17 H SER 17 -4.291 -7.893 3.457
100 HA SER 17 HA SER 17 -3.167 -6.330 1.448
101 HB2 SER 17 1HB SER 17 -4.647 -7.737 -0.072
102 HB3 SER 17 2HB SER 17 -3.644 -8.653 1.055
103 HG SER 17 HG SER 17 -5.597 -9.531 1.357
104 H GLU 18 H GLU 18 -6.626 -6.747 2.171
105 HA GLU 18 HA GLU 18 -7.733 -4.818 0.559
106 HB2 GLU 18 1HB GLU 18 -8.566 -5.503 3.393
107 HB3 GLU 18 2HB GLU 18 -9.575 -4.698 2.197
108 HG2 GLU 18 1HG GLU 18 -9.571 -6.678 0.804
109 HG3 GLU 18 2HG GLU 18 -8.456 -7.485 1.905
110 H GLU 19 H GLU 19 -6.373 -4.401 3.796
111 HA GLU 19 HA GLU 19 -6.956 -1.697 4.167
112 HB2 GLU 19 1HB GLU 19 -6.151 -3.236 5.939
113 HB3 GLU 19 2HB GLU 19 -4.562 -3.240 5.191
114 HG2 GLU 19 1HG GLU 19 -4.556 -1.759 7.079
115 HG3 GLU 19 2HG GLU 19 -4.381 -0.822 5.597
116 H CYS 20 H CYS 20 -4.165 -3.281 2.659
117 HA CYS 20 HA CYS 20 -2.579 -1.025 2.180
118 HB2 CYS 20 2HB CYS 20 -1.896 -3.427 1.835
119 HB3 CYS 20 1HB CYS 20 -2.840 -3.429 0.355
120 H GLU 21 H GLU 21 -4.907 -2.618 0.015
121 HA GLU 21 HA GLU 21 -4.745 -0.849 -2.122
122 HB2 GLU 21 1HB GLU 21 -7.143 -2.444 -1.177
123 HB3 GLU 21 2HB GLU 21 -6.987 -1.698 -2.763
124 HG2 GLU 21 1HG GLU 21 -5.218 -3.875 -1.658
125 HG3 GLU 21 2HG GLU 21 -6.517 -4.092 -2.831
126 H ARG 22 H ARG 22 -6.827 -0.742 0.754
127 HA ARG 22 HA ARG 22 -8.364 1.469 0.004
128 HB2 ARG 22 1HB ARG 22 -7.629 0.237 2.662
129 HB3 ARG 22 2HB ARG 22 -8.743 1.569 2.512
130 HG2 ARG 22 1HG ARG 22 -10.243 0.221 1.159
131 HG3 ARG 22 2HG ARG 22 -9.098 -1.123 1.232
132 HD2 ARG 22 1HD ARG 22 -10.938 -1.395 2.840
133 HD3 ARG 22 2HD ARG 22 -9.375 -1.260 3.645
134 HE ARG 22 HE ARG 22 -11.248 1.017 3.412
135 HH11 ARG 22 1HH1 ARG 22 -9.063 -0.956 5.311
136 HH12 ARG 22 2HH1 ARG 22 -9.241 0.004 6.741
137 HH21 ARG 22 1HH2 ARG 22 -11.476 2.276 5.310
138 HH22 ARG 22 2HH2 ARG 22 -10.604 1.823 6.743
139 H LEU 23 H LEU 23 -5.349 1.175 1.857
140 HA LEU 23 HA LEU 23 -5.124 3.854 2.664
141 HB2 LEU 23 1HB LEU 23 -3.744 2.022 3.573
142 HB3 LEU 23 2HB LEU 23 -2.928 1.870 2.029
143 HG LEU 23 HG LEU 23 -2.011 4.166 2.310
144 HD11 LEU 23 1HD1 LEU 23 -3.280 4.015 5.045
145 HD12 LEU 23 2HD1 LEU 23 -3.736 5.110 3.739
146 HD13 LEU 23 3HD1 LEU 23 -2.153 5.257 4.499
147 HD21 LEU 23 1HD2 LEU 23 -0.383 3.599 4.056
148 HD22 LEU 23 2HD2 LEU 23 -0.677 2.238 2.973
149 HD23 LEU 23 3HD2 LEU 23 -1.412 2.261 4.580
150 H CYS 24 H CYS 24 -3.748 2.175 -0.147
151 HA CYS 24 HA CYS 24 -2.524 4.472 -1.249
152 HB2 CYS 24 2HB CYS 24 -3.308 1.871 -2.588
153 HB3 CYS 24 1HB CYS 24 -2.194 3.067 -3.248
154 H ARG 25 H ARG 25 -5.698 2.963 -1.780
155 HA ARG 25 HA ARG 25 -6.391 4.607 -3.994
156 HB2 ARG 25 1HB ARG 25 -8.564 3.681 -3.886
157 HB3 ARG 25 2HB ARG 25 -7.489 2.398 -3.373
158 HG2 ARG 25 1HG ARG 25 -9.249 2.184 -1.919
159 HG3 ARG 25 2HG ARG 25 -8.099 3.128 -0.983
160 HD2 ARG 25 1HD ARG 25 -10.488 3.898 -0.842
161 HD3 ARG 25 2HD ARG 25 -9.329 5.134 -1.321
162 HE ARG 25 HE ARG 25 -10.273 5.202 -3.433
163 HH11 ARG 25 1HH1 ARG 25 -11.711 2.564 -1.612
164 HH12 ARG 25 2HH1 ARG 25 -13.080 2.437 -2.672
165 HH21 ARG 25 1HH2 ARG 25 -12.091 5.053 -4.774
166 HH22 ARG 25 2HH2 ARG 25 -13.304 3.850 -4.453
167 H LYS 26 H LYS 26 -6.687 4.914 -0.536
168 HA LYS 26 HA LYS 26 -8.365 7.214 -0.533
169 HB2 LYS 26 1HB LYS 26 -8.032 5.686 1.424
170 HB3 LYS 26 2HB LYS 26 -6.405 6.324 1.599
171 HG2 LYS 26 1HG LYS 26 -7.921 7.360 3.189
172 HG3 LYS 26 2HG LYS 26 -7.311 8.552 2.041
173 HD2 LYS 26 1HD LYS 26 -9.719 8.834 2.474
174 HD3 LYS 26 2HD LYS 26 -9.395 8.447 0.783
175 HE2 LYS 26 1HE LYS 26 -11.338 7.211 1.675
176 HE3 LYS 26 2HE LYS 26 -10.043 6.133 1.155
177 HZ1 LYS 26 1HZ LYS 26 -10.624 6.932 3.956
178 HZ2 LYS 26 2HZ LYS 26 -9.360 5.923 3.471
179 HZ3 LYS 26 3HZ LYS 26 -10.961 5.429 3.260
180 H LEU 27 H LEU 27 -4.858 6.741 -0.272
181 HA LEU 27 HA LEU 27 -4.205 9.509 -0.246
182 HB2 LEU 27 1HB LEU 27 -2.535 7.114 -1.042
183 HB3 LEU 27 2HB LEU 27 -1.908 8.731 -0.776
184 HG LEU 27 HG LEU 27 -3.197 6.972 1.324
185 HD11 LEU 27 1HD1 LEU 27 -0.956 6.853 2.294
186 HD12 LEU 27 2HD1 LEU 27 -0.314 7.776 0.933
187 HD13 LEU 27 3HD1 LEU 27 -0.995 6.170 0.668
188 HD21 LEU 27 1HD2 LEU 27 -2.495 8.693 2.922
189 HD22 LEU 27 2HD2 LEU 27 -3.641 9.336 1.748
190 HD23 LEU 27 3HD2 LEU 27 -1.922 9.701 1.591
191 H GLY 28 H GLY 28 -5.068 7.269 -2.712
192 HA2 GLY 28 1HA GLY 28 -5.693 7.730 -4.898
193 HA3 GLY 28 2HA GLY 28 -5.168 9.393 -4.665
194 H VAL 29 H VAL 29 -3.042 6.776 -3.889
195 HA VAL 29 HA VAL 29 -1.256 7.668 -6.044
196 HB VAL 29 HB VAL 29 -0.587 5.980 -3.628
197 HG11 VAL 29 1HG1 VAL 29 1.750 6.474 -4.229
198 HG12 VAL 29 2HG1 VAL 29 1.190 7.327 -5.667
199 HG13 VAL 29 3HG1 VAL 29 0.914 5.593 -5.508
200 HG21 VAL 29 1HG2 VAL 29 0.489 8.006 -2.731
201 HG22 VAL 29 2HG2 VAL 29 -1.249 8.233 -2.949
202 HG23 VAL 29 3HG2 VAL 29 -0.116 8.930 -4.110
203 H THR 30 H THR 30 -1.235 6.493 -7.803
204 HA THR 30 HA THR 30 -2.321 3.850 -7.927
205 HB THR 30 HB THR 30 -0.782 5.385 -10.039
206 HG1 THR 30 1HG THR 30 -3.486 5.397 -9.212
207 HG21 THR 30 1HG2 THR 30 -2.021 3.931 -11.618
208 HG22 THR 30 2HG2 THR 30 -2.667 3.026 -10.249
209 HG23 THR 30 3HG2 THR 30 -0.934 3.015 -10.574
210 H ASN 31 H ASN 31 0.897 5.244 -7.748
211 HA ASN 31 HA ASN 31 2.305 2.801 -8.261
212 HB2 ASN 31 1HB ASN 31 3.245 5.319 -6.851
213 HB3 ASN 31 2HB ASN 31 4.284 4.003 -7.384
214 HD21 ASN 31 1HD2 ASN 31 4.092 6.899 -9.826
215 HD22 ASN 31 2HD2 ASN 31 4.208 6.863 -8.100
216 H CYS 32 H CYS 32 1.310 1.291 -6.913
217 HA CYS 32 HA CYS 32 2.141 1.340 -4.109
218 HB2 CYS 32 2HB CYS 32 -0.003 2.438 -3.956
219 HB3 CYS 32 1HB CYS 32 -0.761 1.258 -5.015
220 H ARG 33 H ARG 33 3.135 -0.554 -3.946
221 HA ARG 33 HA ARG 33 2.013 -2.929 -5.298
222 HB2 ARG 33 1HB ARG 33 4.886 -2.411 -4.476
223 HB3 ARG 33 2HB ARG 33 4.297 -3.842 -5.303
224 HG2 ARG 33 1HG ARG 33 4.226 -1.048 -6.439
225 HG3 ARG 33 2HG ARG 33 5.455 -2.263 -6.798
226 HD2 ARG 33 1HD ARG 33 2.496 -2.502 -7.371
227 HD3 ARG 33 2HD ARG 33 3.762 -2.190 -8.558
228 HE ARG 33 HE ARG 33 4.618 -4.482 -7.520
229 HH11 ARG 33 1HH1 ARG 33 1.434 -3.548 -8.645
230 HH12 ARG 33 2HH1 ARG 33 0.953 -5.181 -8.998
231 HH21 ARG 33 1HH2 ARG 33 4.004 -6.604 -8.021
232 HH22 ARG 33 2HH2 ARG 33 2.410 -6.914 -8.642
233 H VAL 34 H VAL 34 2.553 -5.016 -4.096
234 HA VAL 34 HA VAL 34 2.355 -4.594 -1.177
235 HB VAL 34 HB VAL 34 0.771 -6.626 -2.780
236 HG11 VAL 34 1HG1 VAL 34 -0.386 -7.104 -0.678
237 HG12 VAL 34 2HG1 VAL 34 0.645 -5.950 0.165
238 HG13 VAL 34 3HG1 VAL 34 1.343 -7.411 -0.527
239 HG21 VAL 34 1HG2 VAL 34 -0.044 -4.343 -3.152
240 HG22 VAL 34 2HG2 VAL 34 -0.193 -4.106 -1.409
241 HG23 VAL 34 3HG2 VAL 34 -1.205 -5.297 -2.228
242 H HIS 35 H HIS 35 3.313 -6.141 0.124
243 HA HIS 35 HA HIS 35 4.592 -8.473 -1.101
244 HB2 HIS 35 1HB HIS 35 6.402 -6.890 -1.134
245 HB3 HIS 35 2HB HIS 35 6.031 -6.340 0.495
246 HD1 HIS 35 HD1 HIS 35 8.032 -6.994 1.834
247 HD2 HIS 35 HD2 HIS 35 6.746 -10.065 -0.655
248 HE1 HIS 35 HE1 HIS 35 9.469 -8.972 2.401
249 HE2 HIS 35 HE2 HIS 35 8.453 -10.875 1.109
250 H CYS 36 H CYS 36 3.708 -10.105 0.016
251 HA CYS 36 HA CYS 36 3.364 -9.808 2.938
252 HB2 CYS 36 2HB CYS 36 1.884 -11.658 1.042
253 HB3 CYS 36 1HB CYS 36 1.591 -11.496 2.771
254 H GLY 37 H GLY 37 4.480 -11.161 4.235
255 HA2 GLY 37 1HA GLY 37 5.805 -12.913 4.917
256 HA3 GLY 37 2HA GLY 37 5.379 -13.753 3.431
Start of MODEL 20
1 H1 ALA 1 1H ALA 1 7.675 -13.329 9.349
2 H2 ALA 1 2H ALA 1 6.293 -13.119 10.303
3 H3 ALA 1 3H ALA 1 7.273 -11.795 9.931
4 HA ALA 1 HA ALA 1 6.715 -11.922 7.631
5 HB1 ALA 1 1HB ALA 1 6.487 -14.372 7.536
6 HB2 ALA 1 2HB ALA 1 5.115 -13.547 6.799
7 HB3 ALA 1 3HB ALA 1 4.959 -14.254 8.407
8 HA PRO 2 HA PRO 2 3.313 -9.596 9.668
9 HB2 PRO 2 2HB PRO 2 4.510 -7.160 8.697
10 HB3 PRO 2 1HB PRO 2 4.388 -7.717 10.365
11 HG2 PRO 2 2HG PRO 2 6.760 -7.485 8.982
12 HG3 PRO 2 1HG PRO 2 6.513 -8.568 10.365
13 HD2 PRO 2 2HD PRO 2 6.447 -9.199 7.426
14 HD3 PRO 2 1HD PRO 2 7.174 -10.121 8.762
15 H CYS 3 H CYS 3 3.771 -7.108 7.496
16 HA CYS 3 HA CYS 3 2.893 -8.105 5.050
17 HB2 CYS 3 2HB CYS 3 0.828 -8.484 6.653
18 HB3 CYS 3 1HB CYS 3 0.592 -6.754 6.434
19 H GLU 4 H GLU 4 3.996 -6.592 3.960
20 HA GLU 4 HA GLU 4 3.822 -3.781 4.834
21 HB2 GLU 4 1HB GLU 4 6.054 -5.107 3.265
22 HB3 GLU 4 2HB GLU 4 6.028 -3.442 3.825
23 HG2 GLU 4 1HG GLU 4 7.432 -4.547 5.319
24 HG3 GLU 4 2HG GLU 4 5.902 -4.402 6.180
25 H CYS 5 H CYS 5 4.346 -2.251 2.960
26 HA CYS 5 HA CYS 5 3.293 -3.123 0.390
27 HB2 CYS 5 2HB CYS 5 2.051 -1.000 2.143
28 HB3 CYS 5 1HB CYS 5 1.784 -1.065 0.408
29 H ASP 6 H ASP 6 3.330 -1.170 -1.143
30 HA ASP 6 HA ASP 6 5.701 0.491 -0.692
31 HB2 ASP 6 1HB ASP 6 6.381 -1.527 -1.987
32 HB3 ASP 6 2HB ASP 6 5.178 -1.130 -3.210
33 H VAL 7 H VAL 7 5.670 2.424 -1.803
34 HA VAL 7 HA VAL 7 3.354 3.152 -3.417
35 HB VAL 7 HB VAL 7 4.209 4.650 -0.912
36 HG11 VAL 7 1HG1 VAL 7 3.696 6.232 -2.686
37 HG12 VAL 7 2HG1 VAL 7 2.427 6.259 -1.462
38 HG13 VAL 7 3HG1 VAL 7 2.160 5.424 -2.991
39 HG21 VAL 7 1HG2 VAL 7 1.587 3.301 -1.595
40 HG22 VAL 7 2HG2 VAL 7 1.906 4.247 -0.140
41 HG23 VAL 7 3HG2 VAL 7 2.775 2.737 -0.418
42 H ASN 8 H ASN 8 4.592 3.509 -5.218
43 HA ASN 8 HA ASN 8 5.913 4.658 -6.674
44 HB2 ASN 8 1HB ASN 8 6.198 6.688 -4.441
45 HB3 ASN 8 2HB ASN 8 6.592 6.953 -6.135
46 HD21 ASN 8 1HD2 ASN 8 3.183 8.264 -5.180
47 HD22 ASN 8 2HD2 ASN 8 4.725 8.368 -4.403
48 H GLY 9 H GLY 9 7.084 3.215 -3.955
49 HA2 GLY 9 1HA GLY 9 9.433 2.348 -4.363
50 HA3 GLY 9 2HA GLY 9 9.880 4.045 -4.449
51 H GLU 10 H GLU 10 7.742 4.441 -2.203
52 HA GLU 10 HA GLU 10 9.604 3.898 -0.014
53 HB2 GLU 10 1HB GLU 10 8.235 5.417 1.315
54 HB3 GLU 10 2HB GLU 10 8.690 6.172 -0.204
55 HG2 GLU 10 1HG GLU 10 6.427 5.518 -1.082
56 HG3 GLU 10 2HG GLU 10 6.011 5.043 0.561
57 H THR 11 H THR 11 8.736 3.027 2.049
58 HA THR 11 HA THR 11 6.895 0.803 1.423
59 HB THR 11 HB THR 11 9.138 0.808 3.460
60 HG1 THR 11 1HG THR 11 9.096 0.279 0.721
61 HG21 THR 11 1HG2 THR 11 7.464 -1.439 2.313
62 HG22 THR 11 2HG2 THR 11 7.366 -0.807 3.957
63 HG23 THR 11 3HG2 THR 11 8.824 -1.643 3.417
64 H TYR 12 H TYR 12 5.316 0.232 2.861
65 HA TYR 12 HA TYR 12 5.157 1.608 5.456
66 HB2 TYR 12 2HB TYR 12 2.946 1.469 3.386
67 HB3 TYR 12 1HB TYR 12 2.630 1.788 5.088
68 HD1 TYR 12 1HD TYR 12 3.361 3.895 6.119
69 HD2 TYR 12 2HD TYR 12 3.923 3.162 1.961
70 HE1 TYR 12 1HE TYR 12 3.768 6.291 5.759
71 HE2 TYR 12 2HE TYR 12 4.332 5.559 1.592
72 HH TYR 12 HH TYR 12 4.142 7.628 2.530
73 H THR 13 H THR 13 3.489 0.509 6.877
74 HA THR 13 HA THR 13 3.458 -2.397 6.354
75 HB THR 13 HB THR 13 3.234 -2.564 8.902
76 HG1 THR 13 1HG THR 13 2.926 -0.072 8.881
77 HG21 THR 13 1HG2 THR 13 5.302 -3.153 7.723
78 HG22 THR 13 2HG2 THR 13 5.657 -2.371 9.262
79 HG23 THR 13 3HG2 THR 13 5.811 -1.462 7.757
80 H VAL 14 H VAL 14 1.562 -3.468 6.459
81 HA VAL 14 HA VAL 14 -0.871 -2.005 7.251
82 HB VAL 14 HB VAL 14 -2.048 -2.959 5.278
83 HG11 VAL 14 1HG1 VAL 14 -1.232 -0.658 5.193
84 HG12 VAL 14 2HG1 VAL 14 -1.136 -1.413 3.603
85 HG13 VAL 14 3HG1 VAL 14 0.322 -1.216 4.576
86 HG21 VAL 14 1HG2 VAL 14 -0.752 -3.882 3.407
87 HG22 VAL 14 2HG2 VAL 14 -0.551 -4.864 4.861
88 HG23 VAL 14 3HG2 VAL 14 0.729 -3.756 4.360
89 H SER 15 H SER 15 -2.787 -3.590 7.283
90 HA SER 15 HA SER 15 -2.003 -5.972 8.744
91 HB2 SER 15 1HB SER 15 -3.866 -4.536 9.552
92 HB3 SER 15 2HB SER 15 -4.778 -4.926 8.096
93 HG SER 15 HG SER 15 -4.213 -6.483 10.333
94 H SER 16 H SER 16 -3.461 -5.109 5.658
95 HA SER 16 HA SER 16 -3.025 -7.763 4.611
96 HB2 SER 16 1HB SER 16 -5.423 -8.087 3.989
97 HB3 SER 16 2HB SER 16 -5.165 -8.097 5.735
98 HG SER 16 HG SER 16 -6.522 -6.516 5.841
99 H SER 17 H SER 17 -3.961 -7.873 2.288
100 HA SER 17 HA SER 17 -3.004 -5.701 0.748
101 HB2 SER 17 1HB SER 17 -3.158 -8.071 -0.062
102 HB3 SER 17 2HB SER 17 -4.911 -7.906 -0.113
103 HG SER 17 HG SER 17 -2.983 -6.943 -1.832
104 H GLU 18 H GLU 18 -6.097 -6.570 2.086
105 HA GLU 18 HA GLU 18 -7.812 -4.796 0.775
106 HB2 GLU 18 1HB GLU 18 -8.576 -6.536 2.341
107 HB3 GLU 18 2HB GLU 18 -7.814 -5.681 3.673
108 HG2 GLU 18 1HG GLU 18 -10.159 -5.262 3.746
109 HG3 GLU 18 2HG GLU 18 -9.342 -3.773 3.270
110 H GLU 19 H GLU 19 -6.125 -4.357 3.867
111 HA GLU 19 HA GLU 19 -6.685 -1.643 4.230
112 HB2 GLU 19 1HB GLU 19 -4.207 -3.131 5.143
113 HB3 GLU 19 2HB GLU 19 -4.827 -1.631 5.822
114 HG2 GLU 19 1HG GLU 19 -6.222 -4.303 5.892
115 HG3 GLU 19 2HG GLU 19 -5.338 -3.565 7.225
116 H CYS 20 H CYS 20 -4.121 -3.268 2.484
117 HA CYS 20 HA CYS 20 -2.412 -1.104 2.014
118 HB2 CYS 20 2HB CYS 20 -2.032 -3.616 1.601
119 HB3 CYS 20 1HB CYS 20 -2.844 -3.367 0.060
120 H GLU 21 H GLU 21 -4.876 -2.511 -0.144
121 HA GLU 21 HA GLU 21 -4.823 -0.554 -2.129
122 HB2 GLU 21 1HB GLU 21 -6.985 -2.429 -1.172
123 HB3 GLU 21 2HB GLU 21 -7.280 -1.290 -2.480
124 HG2 GLU 21 1HG GLU 21 -5.092 -3.362 -2.488
125 HG3 GLU 21 2HG GLU 21 -6.679 -3.575 -3.228
126 H ARG 22 H ARG 22 -6.904 -0.825 0.731
127 HA ARG 22 HA ARG 22 -8.539 1.360 0.374
128 HB2 ARG 22 1HB ARG 22 -8.733 -0.351 2.167
129 HB3 ARG 22 2HB ARG 22 -7.373 0.397 2.993
130 HG2 ARG 22 1HG ARG 22 -8.663 2.451 3.280
131 HG3 ARG 22 2HG ARG 22 -10.027 1.718 2.428
132 HD2 ARG 22 1HD ARG 22 -10.061 -0.069 4.170
133 HD3 ARG 22 2HD ARG 22 -8.821 0.824 5.047
134 HE ARG 22 HE ARG 22 -10.661 2.698 4.871
135 HH11 ARG 22 1HH1 ARG 22 -11.068 -0.703 5.613
136 HH12 ARG 22 2HH1 ARG 22 -12.497 -0.447 6.564
137 HH21 ARG 22 1HH2 ARG 22 -12.523 3.031 6.110
138 HH22 ARG 22 2HH2 ARG 22 -13.338 1.679 6.832
139 H LEU 23 H LEU 23 -5.466 1.297 2.175
140 HA LEU 23 HA LEU 23 -5.330 4.023 2.778
141 HB2 LEU 23 1HB LEU 23 -3.932 2.316 3.851
142 HB3 LEU 23 2HB LEU 23 -3.083 2.043 2.340
143 HG LEU 23 HG LEU 23 -2.234 4.389 2.439
144 HD11 LEU 23 1HD1 LEU 23 -3.480 4.392 5.187
145 HD12 LEU 23 2HD1 LEU 23 -3.977 5.377 3.810
146 HD13 LEU 23 3HD1 LEU 23 -2.393 5.624 4.544
147 HD21 LEU 23 1HD2 LEU 23 -1.569 2.662 4.827
148 HD22 LEU 23 2HD2 LEU 23 -0.583 3.988 4.206
149 HD23 LEU 23 3HD2 LEU 23 -0.844 2.549 3.222
150 H CYS 24 H CYS 24 -3.918 2.206 0.075
151 HA CYS 24 HA CYS 24 -2.520 4.298 -1.133
152 HB2 CYS 24 2HB CYS 24 -2.186 1.943 -1.716
153 HB3 CYS 24 1HB CYS 24 -3.792 1.875 -2.425
154 H ARG 25 H ARG 25 -5.805 3.122 -1.779
155 HA ARG 25 HA ARG 25 -6.281 4.930 -3.925
156 HB2 ARG 25 1HB ARG 25 -8.367 3.485 -2.272
157 HB3 ARG 25 2HB ARG 25 -8.566 4.138 -3.895
158 HG2 ARG 25 1HG ARG 25 -6.900 1.777 -3.053
159 HG3 ARG 25 2HG ARG 25 -8.329 1.777 -4.083
160 HD2 ARG 25 1HD ARG 25 -7.173 2.751 -5.879
161 HD3 ARG 25 2HD ARG 25 -5.842 3.283 -4.851
162 HE ARG 25 HE ARG 25 -6.248 0.407 -5.065
163 HH11 ARG 25 1HH1 ARG 25 -4.484 3.219 -6.186
164 HH12 ARG 25 2HH1 ARG 25 -3.134 2.298 -6.760
165 HH21 ARG 25 1HH2 ARG 25 -4.458 -0.809 -5.797
166 HH22 ARG 25 2HH2 ARG 25 -3.111 0.016 -6.540
167 H LYS 26 H LYS 26 -6.949 4.992 -0.462
168 HA LYS 26 HA LYS 26 -8.497 7.349 -0.419
169 HB2 LYS 26 1HB LYS 26 -8.349 5.904 1.539
170 HB3 LYS 26 2HB LYS 26 -6.622 6.210 1.674
171 HG2 LYS 26 1HG LYS 26 -7.814 7.503 3.325
172 HG3 LYS 26 2HG LYS 26 -7.091 8.586 2.134
173 HD2 LYS 26 1HD LYS 26 -9.330 8.637 0.973
174 HD3 LYS 26 2HD LYS 26 -9.990 7.758 2.352
175 HE2 LYS 26 1HE LYS 26 -8.704 10.489 2.397
176 HE3 LYS 26 2HE LYS 26 -10.416 10.128 2.600
177 HZ1 LYS 26 1HZ LYS 26 -9.348 10.535 4.719
178 HZ2 LYS 26 2HZ LYS 26 -8.240 9.289 4.442
179 HZ3 LYS 26 3HZ LYS 26 -9.883 8.932 4.634
180 H LEU 27 H LEU 27 -4.994 6.827 -0.180
181 HA LEU 27 HA LEU 27 -4.332 9.593 0.026
182 HB2 LEU 27 1HB LEU 27 -2.622 7.262 -0.866
183 HB3 LEU 27 2HB LEU 27 -2.024 8.858 -0.450
184 HG LEU 27 HG LEU 27 -3.326 6.876 1.432
185 HD11 LEU 27 1HD1 LEU 27 -0.500 7.931 1.327
186 HD12 LEU 27 2HD1 LEU 27 -1.020 6.327 0.809
187 HD13 LEU 27 3HD1 LEU 27 -1.151 6.789 2.506
188 HD21 LEU 27 1HD2 LEU 27 -3.989 9.117 2.062
189 HD22 LEU 27 2HD2 LEU 27 -2.317 9.673 1.969
190 HD23 LEU 27 3HD2 LEU 27 -2.792 8.509 3.207
191 H GLY 28 H GLY 28 -5.028 7.440 -2.584
192 HA2 GLY 28 1HA GLY 28 -5.626 8.022 -4.753
193 HA3 GLY 28 2HA GLY 28 -5.065 9.660 -4.449
194 H VAL 29 H VAL 29 -3.200 6.732 -3.911
195 HA VAL 29 HA VAL 29 -1.054 7.770 -5.561
196 HB VAL 29 HB VAL 29 -1.229 5.153 -4.043
197 HG11 VAL 29 1HG1 VAL 29 1.159 6.586 -5.218
198 HG12 VAL 29 2HG1 VAL 29 0.446 5.089 -5.817
199 HG13 VAL 29 3HG1 VAL 29 1.217 5.122 -4.233
200 HG21 VAL 29 1HG2 VAL 29 0.041 7.771 -3.227
201 HG22 VAL 29 2HG2 VAL 29 0.092 6.262 -2.313
202 HG23 VAL 29 3HG2 VAL 29 -1.444 7.093 -2.561
203 H THR 30 H THR 30 -0.370 6.975 -7.506
204 HA THR 30 HA THR 30 -2.264 5.405 -9.019
205 HB THR 30 HB THR 30 0.435 6.479 -9.891
206 HG1 THR 30 1HG THR 30 -1.833 7.773 -9.283
207 HG21 THR 30 1HG2 THR 30 -0.453 4.729 -11.371
208 HG22 THR 30 2HG2 THR 30 -0.496 6.308 -12.156
209 HG23 THR 30 3HG2 THR 30 -1.977 5.610 -11.501
210 H ASN 31 H ASN 31 1.204 5.056 -8.183
211 HA ASN 31 HA ASN 31 0.969 2.181 -8.816
212 HB2 ASN 31 1HB ASN 31 2.497 3.415 -10.313
213 HB3 ASN 31 2HB ASN 31 3.446 3.925 -8.919
214 HD21 ASN 31 1HD2 ASN 31 5.498 1.217 -9.756
215 HD22 ASN 31 2HD2 ASN 31 5.281 2.931 -9.797
216 H CYS 32 H CYS 32 0.483 1.321 -6.904
217 HA CYS 32 HA CYS 32 2.530 1.437 -4.773
218 HB2 CYS 32 2HB CYS 32 0.722 1.389 -3.087
219 HB3 CYS 32 1HB CYS 32 0.622 2.846 -4.071
220 H ARG 33 H ARG 33 2.943 -0.591 -3.893
221 HA ARG 33 HA ARG 33 1.340 -2.840 -4.926
222 HB2 ARG 33 1HB ARG 33 4.355 -2.624 -4.903
223 HB3 ARG 33 2HB ARG 33 3.489 -4.130 -5.166
224 HG2 ARG 33 1HG ARG 33 3.134 -1.695 -6.908
225 HG3 ARG 33 2HG ARG 33 4.314 -2.960 -7.234
226 HD2 ARG 33 1HD ARG 33 2.336 -3.353 -8.566
227 HD3 ARG 33 2HD ARG 33 2.473 -4.612 -7.343
228 HE ARG 33 HE ARG 33 0.770 -3.192 -6.079
229 HH11 ARG 33 1HH1 ARG 33 0.885 -3.334 -9.577
230 HH12 ARG 33 2HH1 ARG 33 -0.811 -3.022 -9.756
231 HH21 ARG 33 1HH2 ARG 33 -1.448 -2.795 -6.324
232 HH22 ARG 33 2HH2 ARG 33 -2.134 -2.731 -7.918
233 H VAL 34 H VAL 34 2.238 -4.965 -3.752
234 HA VAL 34 HA VAL 34 2.293 -4.331 -0.871
235 HB VAL 34 HB VAL 34 0.021 -4.998 -1.534
236 HG11 VAL 34 1HG1 VAL 34 1.273 -7.604 -2.428
237 HG12 VAL 34 2HG1 VAL 34 0.541 -6.385 -3.470
238 HG13 VAL 34 3HG1 VAL 34 -0.458 -7.271 -2.323
239 HG21 VAL 34 1HG2 VAL 34 1.424 -7.098 0.129
240 HG22 VAL 34 2HG2 VAL 34 -0.312 -6.787 0.113
241 HG23 VAL 34 3HG2 VAL 34 0.800 -5.556 0.711
242 H HIS 35 H HIS 35 3.598 -5.524 0.378
243 HA HIS 35 HA HIS 35 4.860 -7.946 -0.741
244 HB2 HIS 35 1HB HIS 35 6.189 -5.792 0.944
245 HB3 HIS 35 2HB HIS 35 6.915 -7.349 0.572
246 HD1 HIS 35 HD1 HIS 35 8.129 -7.561 -1.622
247 HD2 HIS 35 HD2 HIS 35 5.935 -4.040 -1.326
248 HE1 HIS 35 HE1 HIS 35 8.818 -6.163 -3.595
249 HE2 HIS 35 HE2 HIS 35 7.655 -3.958 -3.253
250 H CYS 36 H CYS 36 3.709 -9.461 0.381
251 HA CYS 36 HA CYS 36 3.521 -9.135 3.304
252 HB2 CYS 36 2HB CYS 36 1.390 -8.548 1.998
253 HB3 CYS 36 1HB CYS 36 1.278 -10.260 1.616
254 H GLY 37 H GLY 37 4.859 -10.687 4.011
255 HA2 GLY 37 1HA GLY 37 4.360 -13.311 4.220
256 HA3 GLY 37 2HA GLY 37 5.090 -13.225 2.621