Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
11756 | 1ryv RC | 6066 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 1H GLU 1 1H GLU 1 11.026 6.099 -4.711
2 2H GLU 1 2H GLU 1 11.703 4.595 -4.307
3 3H GLU 1 3H GLU 1 12.608 6.019 -4.103
4 HA GLU 1 HA GLU 1 11.830 5.320 -1.950
5 1HB GLU 1 2HB GLU 1 11.513 7.783 -3.198
6 2HB GLU 1 1HB GLU 1 9.940 7.515 -2.448
7 1HG GLU 1 2HG GLU 1 12.483 7.056 -0.895
8 2HG GLU 1 1HG GLU 1 11.787 8.670 -1.032
9 H CYS 2 H CYS 2 10.388 3.941 -0.997
10 HA CYS 2 HA CYS 2 7.637 3.712 -2.182
11 1HB CYS 2 2HB CYS 2 7.769 1.363 -1.654
12 2HB CYS 2 1HB CYS 2 9.281 1.793 -2.452
13 H LEU 3 H LEU 3 6.122 2.628 -0.415
14 HA LEU 3 HA LEU 3 6.501 4.147 2.147
15 1HB LEU 3 2HB LEU 3 4.017 3.237 0.652
16 2HB LEU 3 1HB LEU 3 3.997 4.089 2.195
17 HG LEU 3 HG LEU 3 5.336 5.193 -0.290
18 1HD1 LEU 3 1HD1 LEU 3 2.619 5.934 0.829
19 2HD1 LEU 3 2HD1 LEU 3 2.846 4.864 -0.554
20 3HD1 LEU 3 3HD1 LEU 3 3.368 6.546 -0.645
21 1HD2 LEU 3 1HD2 LEU 3 4.432 6.500 2.298
22 2HD2 LEU 3 2HD2 LEU 3 5.266 7.300 0.967
23 3HD2 LEU 3 3HD2 LEU 3 6.099 6.068 1.914
24 H GLY 4 H GLY 4 6.697 2.911 3.976
25 1HA GLY 4 2HA GLY 4 6.638 0.013 3.820
26 2HA GLY 4 1HA GLY 4 6.903 0.962 5.282
27 H PHE 5 H PHE 5 5.400 -1.111 5.794
28 HA PHE 5 HA PHE 5 2.584 -0.954 5.232
29 1HB PHE 5 2HB PHE 5 3.713 -2.982 5.988
30 2HB PHE 5 1HB PHE 5 4.200 -2.193 7.487
31 HD1 PHE 5 HD1 PHE 5 1.132 -3.050 5.503
32 HD2 PHE 5 HD2 PHE 5 2.846 -2.383 9.383
33 HE1 PHE 5 HE1 PHE 5 -0.997 -3.749 6.564
34 HE2 PHE 5 HE2 PHE 5 0.717 -3.082 10.444
35 HZ PHE 5 HZ PHE 5 -1.203 -3.765 9.034
36 H GLY 6 H GLY 6 1.085 0.445 6.074
37 1HA GLY 6 2HA GLY 6 0.093 1.469 8.111
38 2HA GLY 6 1HA GLY 6 1.732 1.832 8.646
39 H LYS 7 H LYS 7 2.704 2.747 6.070
40 HA LYS 7 HA LYS 7 1.998 5.521 6.195
41 1HB LYS 7 2HB LYS 7 3.451 3.714 4.268
42 2HB LYS 7 1HB LYS 7 3.200 5.414 3.870
43 1HG LYS 7 2HG LYS 7 4.089 5.573 6.467
44 2HG LYS 7 1HG LYS 7 5.010 4.199 5.852
45 1HD LYS 7 2HD LYS 7 6.113 5.470 4.257
46 2HD LYS 7 1HD LYS 7 4.809 6.654 4.149
47 1HE LYS 7 2HE LYS 7 5.409 7.443 6.466
48 2HE LYS 7 1HE LYS 7 6.819 6.366 6.409
49 1HZ LYS 7 1HZ LYS 7 6.176 8.489 4.427
50 2HZ LYS 7 2HZ LYS 7 7.508 7.437 4.348
51 3HZ LYS 7 3HZ LYS 7 7.394 8.576 5.603
52 H GLY 8 H GLY 8 0.459 6.704 5.076
53 1HA GLY 8 2HA GLY 8 -1.573 5.196 3.554
54 2HA GLY 8 1HA GLY 8 -1.709 6.873 4.080
55 H CYS 9 H CYS 9 -2.020 5.548 1.355
56 HA CYS 9 HA CYS 9 -0.423 7.562 -0.136
57 1HB CYS 9 2HB CYS 9 0.920 6.031 -1.178
58 2HB CYS 9 1HB CYS 9 0.548 5.035 0.225
59 H ASN 10 H ASN 10 -1.061 7.222 -2.641
60 HA ASN 10 HA ASN 10 -3.997 7.409 -2.744
61 1HB ASN 10 2HB ASN 10 -1.736 7.742 -4.738
62 2HB ASN 10 1HB ASN 10 -3.431 7.978 -5.163
63 1HD2 ASN 10 1HD2 ASN 10 -0.673 9.490 -3.718
64 2HD2 ASN 10 2HD2 ASN 10 -1.456 10.895 -3.179
65 HA PRO 11 HA PRO 11 -4.570 3.205 -4.008
66 1HB PRO 11 2HB PRO 11 -7.084 3.450 -5.069
67 2HB PRO 11 1HB PRO 11 -6.764 3.429 -3.323
68 1HG PRO 11 2HG PRO 11 -7.286 5.742 -5.124
69 2HG PRO 11 1HG PRO 11 -7.838 5.453 -3.466
70 1HD PRO 11 2HD PRO 11 -5.775 7.117 -4.086
71 2HD PRO 11 1HD PRO 11 -5.900 6.248 -2.542
72 H SER 12 H SER 12 -5.283 5.844 -6.315
73 HA SER 12 HA SER 12 -5.287 4.269 -8.715
74 1HB SER 12 2HB SER 12 -4.910 6.485 -9.776
75 2HB SER 12 1HB SER 12 -6.137 6.578 -8.518
76 HG SER 12 HG SER 12 -4.839 7.771 -7.340
77 H ASN 13 H ASN 13 -2.678 5.678 -6.786
78 HA ASN 13 HA ASN 13 -0.694 4.347 -8.592
79 1HB ASN 13 2HB ASN 13 -0.942 6.937 -8.648
80 2HB ASN 13 1HB ASN 13 -0.192 6.902 -7.051
81 1HD2 ASN 13 1HD2 ASN 13 0.375 6.180 -10.494
82 2HD2 ASN 13 2HD2 ASN 13 2.062 6.053 -10.360
83 H ASP 14 H ASP 14 -1.081 2.586 -6.933
84 HA ASP 14 HA ASP 14 -0.568 2.755 -4.168
85 1HB ASP 14 2HB ASP 14 0.012 0.595 -6.218
86 2HB ASP 14 1HB ASP 14 0.073 0.324 -4.477
87 H GLN 15 H GLN 15 1.221 3.785 -3.326
88 HA GLN 15 HA GLN 15 3.880 3.417 -4.631
89 1HB GLN 15 2HB GLN 15 2.644 5.378 -2.695
90 2HB GLN 15 1HB GLN 15 4.390 5.323 -2.943
91 1HG GLN 15 2HG GLN 15 3.263 5.278 -5.526
92 2HG GLN 15 1HG GLN 15 2.349 6.493 -4.632
93 1HE2 GLN 15 1HE2 GLN 15 5.528 5.702 -5.939
94 2HE2 GLN 15 2HE2 GLN 15 6.248 7.198 -5.584
95 H CYS 16 H CYS 16 2.308 1.569 -2.541
96 HA CYS 16 HA CYS 16 3.985 1.541 -0.178
97 1HB CYS 16 2HB CYS 16 2.123 -0.486 -1.458
98 2HB CYS 16 1HB CYS 16 2.824 -0.671 0.149
99 H CYS 17 H CYS 17 5.710 0.103 0.307
100 HA CYS 17 HA CYS 17 7.480 -0.606 -1.836
101 1HB CYS 17 2HB CYS 17 7.511 -0.383 0.955
102 2HB CYS 17 1HB CYS 17 7.867 -2.084 0.653
103 H LYS 18 H LYS 18 7.653 -2.479 -3.015
104 HA LYS 18 HA LYS 18 5.589 -4.556 -2.711
105 1HB LYS 18 2HB LYS 18 7.351 -3.486 -4.729
106 2HB LYS 18 1HB LYS 18 7.530 -5.239 -4.664
107 1HG LYS 18 2HG LYS 18 5.403 -5.619 -5.400
108 2HG LYS 18 1HG LYS 18 4.744 -4.240 -4.522
109 1HD LYS 18 2HD LYS 18 4.663 -3.149 -6.494
110 2HD LYS 18 1HD LYS 18 6.425 -3.094 -6.442
111 1HE LYS 18 2HE LYS 18 5.529 -5.706 -7.347
112 2HE LYS 18 1HE LYS 18 4.860 -4.419 -8.370
113 1HZ LYS 18 1HZ LYS 18 7.048 -3.452 -8.571
114 2HZ LYS 18 2HZ LYS 18 7.109 -5.076 -9.067
115 3HZ LYS 18 3HZ LYS 18 7.709 -4.628 -7.542
116 H SER 19 H SER 19 8.602 -4.072 -1.264
117 HA SER 19 HA SER 19 9.848 -6.637 -1.396
118 1HB SER 19 2HB SER 19 10.746 -4.438 -0.502
119 2HB SER 19 1HB SER 19 9.772 -4.702 0.942
120 HG SER 19 HG SER 19 11.133 -6.185 1.578
121 H SER 20 H SER 20 7.394 -5.339 0.870
122 HA SER 20 HA SER 20 7.070 -8.075 2.040
123 1HB SER 20 2HB SER 20 7.542 -5.867 3.352
124 2HB SER 20 1HB SER 20 5.845 -5.507 3.045
125 HG SER 20 HG SER 20 7.006 -7.354 4.724
126 H ASN 21 H ASN 21 5.914 -6.970 -0.611
127 HA ASN 21 HA ASN 21 3.874 -7.023 -1.788
128 1HB ASN 21 2HB ASN 21 4.330 -9.361 -0.598
129 2HB ASN 21 1HB ASN 21 2.873 -8.930 0.298
130 1HD2 ASN 21 1HD2 ASN 21 4.118 -9.729 -2.926
131 2HD2 ASN 21 2HD2 ASN 21 2.598 -9.924 -3.656
132 H LEU 22 H LEU 22 3.652 -4.731 -0.636
133 HA LEU 22 HA LEU 22 1.193 -4.742 1.086
134 1HB LEU 22 2HB LEU 22 3.562 -2.874 0.819
135 2HB LEU 22 1HB LEU 22 2.106 -2.431 1.710
136 HG LEU 22 HG LEU 22 3.670 -4.961 2.276
137 1HD1 LEU 22 1HD1 LEU 22 5.121 -3.021 2.673
138 2HD1 LEU 22 2HD1 LEU 22 4.614 -3.725 4.209
139 3HD1 LEU 22 3HD1 LEU 22 3.850 -2.248 3.621
140 1HD2 LEU 22 1HD2 LEU 22 1.506 -5.172 3.187
141 2HD2 LEU 22 2HD2 LEU 22 1.409 -3.458 3.591
142 3HD2 LEU 22 3HD2 LEU 22 2.442 -4.530 4.536
143 H VAL 23 H VAL 23 -0.583 -3.568 0.380
144 HA VAL 23 HA VAL 23 -0.282 -1.939 -2.124
145 HB VAL 23 HB VAL 23 -2.543 -2.884 -2.750
146 1HG1 VAL 23 1HG1 VAL 23 -1.575 -5.262 -3.180
147 2HG1 VAL 23 2HG1 VAL 23 -0.106 -4.626 -2.441
148 3HG1 VAL 23 3HG1 VAL 23 -0.753 -3.877 -3.900
149 1HG2 VAL 23 1HG2 VAL 23 -3.383 -4.833 -1.585
150 2HG2 VAL 23 2HG2 VAL 23 -3.129 -3.564 -0.387
151 3HG2 VAL 23 3HG2 VAL 23 -1.965 -4.880 -0.538
152 H CYS 24 H CYS 24 -1.779 -0.155 -2.284
153 HA CYS 24 HA CYS 24 -2.537 1.004 0.290
154 1HB CYS 24 2HB CYS 24 -1.959 1.850 -2.354
155 2HB CYS 24 1HB CYS 24 -3.607 2.377 -2.012
156 H SER 25 H SER 25 -4.436 0.548 1.293
157 HA SER 25 HA SER 25 -6.586 -0.960 0.131
158 1HB SER 25 2HB SER 25 -5.956 -0.739 2.560
159 2HB SER 25 1HB SER 25 -6.596 0.900 2.531
160 HG SER 25 HG SER 25 -8.215 -0.455 3.230
161 H ARG 26 H ARG 26 -8.855 -0.127 -0.120
162 HA ARG 26 HA ARG 26 -8.859 2.463 -1.571
163 1HB ARG 26 2HB ARG 26 -10.778 0.138 -1.266
164 2HB ARG 26 1HB ARG 26 -11.196 1.600 -2.161
165 1HG ARG 26 2HG ARG 26 -8.826 1.114 -3.309
166 2HG ARG 26 1HG ARG 26 -9.224 -0.538 -2.835
167 1HD ARG 26 2HD ARG 26 -10.283 -0.478 -4.903
168 2HD ARG 26 1HD ARG 26 -11.600 0.161 -3.902
169 HE ARG 26 HE ARG 26 -10.135 2.419 -4.486
170 1HH1 ARG 26 2HH1 ARG 26 -12.805 2.151 -5.688
171 2HH1 ARG 26 1HH1 ARG 26 -12.473 2.104 -7.387
172 1HH2 ARG 26 1HH2 ARG 26 -9.102 1.359 -6.976
173 2HH2 ARG 26 2HH2 ARG 26 -10.369 1.654 -8.119
174 H ALA 27 H ALA 27 -10.384 0.931 1.266
175 HA ALA 27 HA ALA 27 -12.010 3.319 1.856
176 1HB ALA 27 1HB ALA 27 -12.785 1.922 3.724
177 2HB ALA 27 2HB ALA 27 -11.487 0.769 3.416
178 3HB ALA 27 3HB ALA 27 -12.777 0.980 2.233
179 H HIS 28 H HIS 28 -9.087 1.734 3.119
180 HA HIS 28 HA HIS 28 -8.782 3.826 5.208
181 1HB HIS 28 2HB HIS 28 -7.446 1.202 4.531
182 2HB HIS 28 1HB HIS 28 -6.772 2.288 5.746
183 HD1 HIS 28 HD1 HIS 28 -9.010 -0.478 5.483
184 HD2 HIS 28 HD2 HIS 28 -9.005 3.032 7.731
185 HE1 HIS 28 HE1 HIS 28 -10.607 -0.860 7.411
186 H ARG 29 H ARG 29 -7.469 2.924 2.077
187 HA ARG 29 HA ARG 29 -5.840 3.944 0.715
188 1HB ARG 29 2HB ARG 29 -7.424 5.863 1.832
189 2HB ARG 29 1HB ARG 29 -5.839 6.394 2.392
190 1HG ARG 29 2HG ARG 29 -5.340 7.188 0.351
191 2HG ARG 29 1HG ARG 29 -5.652 5.610 -0.372
192 1HD ARG 29 2HD ARG 29 -7.674 6.276 -1.170
193 2HD ARG 29 1HD ARG 29 -8.119 7.023 0.377
194 HE ARG 29 HE ARG 29 -6.252 8.357 -1.554
195 1HH1 ARG 29 1HH2 ARG 29 -6.762 9.377 1.298
196 2HH1 ARG 29 2HH2 ARG 29 -7.922 10.627 0.996
197 1HH2 ARG 29 2HH1 ARG 29 -8.660 9.526 -2.219
198 2HH2 ARG 29 1HH1 ARG 29 -9.000 10.712 -1.003
199 H TRP 30 H TRP 30 -4.652 2.251 2.449
200 HA TRP 30 HA TRP 30 -2.125 3.646 3.139
201 1HB TRP 30 2HB TRP 30 -2.205 3.016 5.430
202 2HB TRP 30 1HB TRP 30 -3.830 3.600 5.083
203 HD1 TRP 30 HD1 TRP 30 -5.344 1.304 3.921
204 HE1 TRP 30 HE1 TRP 30 -5.697 -0.936 5.143
205 HE3 TRP 30 HE3 TRP 30 -1.481 1.506 7.240
206 HZ2 TRP 30 HZ2 TRP 30 -4.494 -2.444 7.256
207 HZ3 TRP 30 HZ3 TRP 30 -1.103 -0.342 8.847
208 HH2 TRP 30 HH2 TRP 30 -2.605 -2.315 8.859
209 H CYS 31 H CYS 31 -0.375 2.049 3.634
210 HA CYS 31 HA CYS 31 -0.363 -0.148 1.756
211 1HB CYS 31 2HB CYS 31 1.457 0.638 4.056
212 2HB CYS 31 1HB CYS 31 1.858 -0.581 2.848
213 H LYS 32 H LYS 32 -1.341 -2.088 2.082
214 HA LYS 32 HA LYS 32 -1.395 -3.236 4.849
215 1HB LYS 32 2HB LYS 32 -3.720 -3.938 4.402
216 2HB LYS 32 1HB LYS 32 -3.563 -2.189 4.256
217 1HG LYS 32 2HG LYS 32 -4.198 -2.240 2.094
218 2HG LYS 32 1HG LYS 32 -3.010 -3.486 1.716
219 1HD LYS 32 2HD LYS 32 -5.024 -4.588 1.270
220 2HD LYS 32 1HD LYS 32 -4.692 -5.089 2.928
221 1HE LYS 32 2HE LYS 32 -6.225 -3.427 3.812
222 2HE LYS 32 1HE LYS 32 -6.449 -2.718 2.201
223 1HZ LYS 32 1HZ LYS 32 -7.075 -5.532 2.935
224 2HZ LYS 32 2HZ LYS 32 -7.312 -4.820 1.410
225 3HZ LYS 32 3HZ LYS 32 -8.223 -4.299 2.745
226 H TYR 33 H TYR 33 -1.798 -5.655 4.773
227 HA TYR 33 HA TYR 33 -0.152 -6.874 2.653
228 1HB TYR 33 2HB TYR 33 -1.462 -7.773 5.224
229 2HB TYR 33 1HB TYR 33 -0.689 -8.933 4.142
230 HD1 TYR 33 HD1 TYR 33 -0.169 -6.317 6.608
231 HD2 TYR 33 HD2 TYR 33 1.749 -8.652 3.553
232 HE1 TYR 33 HE1 TYR 33 2.050 -5.689 7.519
233 HE2 TYR 33 HE2 TYR 33 3.967 -8.024 4.467
234 HH TYR 33 HH TYR 33 4.627 -7.106 7.231
235 H GLU 34 H GLU 34 -1.023 -9.071 1.764
236 HA GLU 34 HA GLU 34 -3.468 -8.559 0.284
237 1HB GLU 34 2HB GLU 34 -1.351 -10.638 0.500
238 2HB GLU 34 1HB GLU 34 -2.900 -11.176 -0.150
239 1HG GLU 34 2HG GLU 34 -2.749 -9.063 -1.659
240 2HG GLU 34 1HG GLU 34 -1.038 -9.069 -1.230
241 H ILE 35 H ILE 35 -5.510 -9.494 0.576
242 HA ILE 35 HA ILE 35 -6.154 -10.493 3.264
243 HB ILE 35 HB ILE 35 -8.477 -10.414 2.322
244 1HG1 ILE 35 2HG1 ILE 35 -7.666 -9.022 -0.129
245 2HG1 ILE 35 1HG1 ILE 35 -7.191 -10.719 -0.122
246 1HG2 ILE 35 1HG2 ILE 35 -8.560 -7.994 2.082
247 2HG2 ILE 35 2HG2 ILE 35 -6.836 -7.941 1.716
248 3HG2 ILE 35 3HG2 ILE 35 -7.382 -8.411 3.326
249 1HD1 ILE 35 1HD1 ILE 35 -9.655 -9.878 -0.875
250 2HD1 ILE 35 2HD1 ILE 35 -9.937 -10.146 0.845
251 3HD1 ILE 35 3HD1 ILE 35 -9.353 -11.466 -0.169
252 1HN NH2 36 1HN NH2 36 -5.368 -13.609 1.251
253 2HN NH2 36 2HN NH2 36 -4.991 -12.104 0.602
Start of MODEL 2
1 1H GLU 1 1H GLU 1 12.434 5.365 -1.247
2 2H GLU 1 2H GLU 1 12.884 4.079 -0.232
3 3H GLU 1 3H GLU 1 13.632 5.594 -0.067
4 HA GLU 1 HA GLU 1 11.899 5.070 1.662
5 1HB GLU 1 2HB GLU 1 11.129 7.392 1.588
6 2HB GLU 1 1HB GLU 1 12.807 7.319 1.056
7 1HG GLU 1 2HG GLU 1 12.163 8.416 -0.807
8 2HG GLU 1 1HG GLU 1 11.309 6.950 -1.287
9 H CYS 2 H CYS 2 9.646 4.844 2.077
10 HA CYS 2 HA CYS 2 7.670 4.970 -0.086
11 1HB CYS 2 2HB CYS 2 7.186 2.477 0.139
12 2HB CYS 2 1HB CYS 2 8.705 2.873 -0.661
13 H LEU 3 H LEU 3 5.553 3.730 0.862
14 HA LEU 3 HA LEU 3 5.097 4.922 3.548
15 1HB LEU 3 2HB LEU 3 3.274 3.667 1.465
16 2HB LEU 3 1HB LEU 3 2.716 4.439 2.948
17 HG LEU 3 HG LEU 3 4.450 5.879 0.928
18 1HD1 LEU 3 1HD1 LEU 3 2.171 5.013 0.049
19 2HD1 LEU 3 2HD1 LEU 3 2.521 6.731 -0.141
20 3HD1 LEU 3 3HD1 LEU 3 1.456 6.186 1.155
21 1HD2 LEU 3 1HD2 LEU 3 4.427 6.908 3.118
22 2HD2 LEU 3 2HD2 LEU 3 2.675 6.739 3.234
23 3HD2 LEU 3 3HD2 LEU 3 3.377 7.866 2.073
24 H GLY 4 H GLY 4 5.491 3.580 5.270
25 1HA GLY 4 2HA GLY 4 5.691 0.712 5.035
26 2HA GLY 4 1HA GLY 4 5.687 1.617 6.547
27 H PHE 5 H PHE 5 4.348 -0.484 7.021
28 HA PHE 5 HA PHE 5 1.647 -0.706 6.038
29 1HB PHE 5 2HB PHE 5 3.277 -2.330 7.346
30 2HB PHE 5 1HB PHE 5 2.510 -1.622 8.767
31 HD1 PHE 5 HD1 PHE 5 1.946 -3.601 5.697
32 HD2 PHE 5 HD2 PHE 5 0.179 -2.041 9.288
33 HE1 PHE 5 HE1 PHE 5 -0.023 -5.071 5.366
34 HE2 PHE 5 HE2 PHE 5 -1.790 -3.512 8.957
35 HZ PHE 5 HZ PHE 5 -1.892 -5.027 6.996
36 H GLY 6 H GLY 6 -0.277 0.140 6.884
37 1HA GLY 6 2HA GLY 6 -1.680 1.408 8.307
38 2HA GLY 6 1HA GLY 6 -0.328 1.588 9.425
39 H LYS 7 H LYS 7 -0.206 2.423 5.984
40 HA LYS 7 HA LYS 7 -0.030 5.323 6.747
41 1HB LYS 7 2HB LYS 7 1.682 3.565 4.987
42 2HB LYS 7 1HB LYS 7 1.652 5.311 4.753
43 1HG LYS 7 2HG LYS 7 1.991 4.432 7.558
44 2HG LYS 7 1HG LYS 7 3.338 4.050 6.485
45 1HD LYS 7 2HD LYS 7 3.663 6.332 5.902
46 2HD LYS 7 1HD LYS 7 2.099 6.805 6.568
47 1HE LYS 7 2HE LYS 7 2.873 6.343 8.841
48 2HE LYS 7 1HE LYS 7 4.418 5.731 8.218
49 1HZ LYS 7 1HZ LYS 7 3.345 8.470 7.770
50 2HZ LYS 7 2HZ LYS 7 4.825 7.874 7.186
51 3HZ LYS 7 3HZ LYS 7 4.585 8.072 8.856
52 H GLY 8 H GLY 8 -1.505 6.548 5.630
53 1HA GLY 8 2HA GLY 8 -3.339 5.457 3.752
54 2HA GLY 8 1HA GLY 8 -3.074 7.181 4.004
55 H CYS 9 H CYS 9 -3.146 5.070 1.596
56 HA CYS 9 HA CYS 9 -0.888 6.366 0.105
57 1HB CYS 9 2HB CYS 9 -0.360 4.049 0.619
58 2HB CYS 9 1HB CYS 9 -1.940 3.520 0.038
59 H ASN 10 H ASN 10 -1.316 6.755 -2.150
60 HA ASN 10 HA ASN 10 -4.131 7.311 -2.768
61 1HB ASN 10 2HB ASN 10 -1.980 8.670 -3.304
62 2HB ASN 10 1HB ASN 10 -1.761 7.525 -4.629
63 1HD2 ASN 10 1HD2 ASN 10 -3.750 10.196 -3.461
64 2HD2 ASN 10 2HD2 ASN 10 -4.662 10.377 -4.881
65 HA PRO 11 HA PRO 11 -4.759 3.406 -4.795
66 1HB PRO 11 2HB PRO 11 -7.092 4.048 -6.086
67 2HB PRO 11 1HB PRO 11 -7.014 3.679 -4.351
68 1HG PRO 11 2HG PRO 11 -7.143 6.321 -5.719
69 2HG PRO 11 1HG PRO 11 -7.943 5.779 -4.236
70 1HD PRO 11 2HD PRO 11 -5.726 7.348 -4.236
71 2HD PRO 11 1HD PRO 11 -6.104 6.202 -2.930
72 H SER 12 H SER 12 -5.030 6.476 -6.605
73 HA SER 12 HA SER 12 -4.596 5.245 -9.220
74 1HB SER 12 2HB SER 12 -4.802 7.996 -8.040
75 2HB SER 12 1HB SER 12 -4.135 7.827 -9.660
76 HG SER 12 HG SER 12 -6.624 7.938 -9.086
77 H ASN 13 H ASN 13 -2.575 6.691 -6.708
78 HA ASN 13 HA ASN 13 -0.142 6.165 -8.386
79 1HB ASN 13 2HB ASN 13 -0.915 8.297 -6.394
80 2HB ASN 13 1HB ASN 13 0.788 7.942 -6.688
81 1HD2 ASN 13 1HD2 ASN 13 1.700 8.569 -8.743
82 2HD2 ASN 13 2HD2 ASN 13 0.834 9.488 -9.877
83 H ASP 14 H ASP 14 -0.573 3.904 -7.405
84 HA ASP 14 HA ASP 14 -0.289 3.389 -4.600
85 1HB ASP 14 2HB ASP 14 0.398 1.700 -7.029
86 2HB ASP 14 1HB ASP 14 0.151 1.082 -5.397
87 H GLN 15 H GLN 15 1.508 3.624 -3.346
88 HA GLN 15 HA GLN 15 4.197 3.088 -4.487
89 1HB GLN 15 2HB GLN 15 4.972 5.315 -3.623
90 2HB GLN 15 1HB GLN 15 3.781 5.457 -4.915
91 1HG GLN 15 2HG GLN 15 2.080 6.129 -3.455
92 2HG GLN 15 1HG GLN 15 2.866 5.409 -2.050
93 1HE2 GLN 15 1HE2 GLN 15 4.815 6.558 -1.182
94 2HE2 GLN 15 2HE2 GLN 15 5.006 8.219 -1.477
95 H CYS 16 H CYS 16 2.671 1.602 -2.541
96 HA CYS 16 HA CYS 16 3.425 2.283 0.172
97 1HB CYS 16 2HB CYS 16 2.387 -0.146 -1.287
98 2HB CYS 16 1HB CYS 16 2.827 -0.254 0.416
99 H CYS 17 H CYS 17 4.804 0.569 1.456
100 HA CYS 17 HA CYS 17 7.485 0.557 0.333
101 1HB CYS 17 2HB CYS 17 6.108 -0.378 2.831
102 2HB CYS 17 1HB CYS 17 7.753 -0.925 2.513
103 H LYS 18 H LYS 18 8.610 -1.156 -0.583
104 HA LYS 18 HA LYS 18 7.020 -3.489 -1.462
105 1HB LYS 18 2HB LYS 18 8.684 -1.949 -2.783
106 2HB LYS 18 1HB LYS 18 9.924 -2.976 -2.061
107 1HG LYS 18 2HG LYS 18 9.046 -4.937 -3.088
108 2HG LYS 18 1HG LYS 18 7.540 -4.125 -3.520
109 1HD LYS 18 2HD LYS 18 8.630 -2.782 -5.175
110 2HD LYS 18 1HD LYS 18 10.229 -3.253 -4.599
111 1HE LYS 18 2HE LYS 18 8.413 -5.468 -5.449
112 2HE LYS 18 1HE LYS 18 9.101 -4.448 -6.728
113 1HZ LYS 18 1HZ LYS 18 10.650 -5.724 -4.531
114 2HZ LYS 18 2HZ LYS 18 11.292 -4.765 -5.779
115 3HZ LYS 18 3HZ LYS 18 10.600 -6.275 -6.135
116 H SER 19 H SER 19 8.393 -2.996 1.411
117 HA SER 19 HA SER 19 10.330 -5.069 1.781
118 1HB SER 19 2HB SER 19 9.676 -4.785 4.177
119 2HB SER 19 1HB SER 19 9.918 -3.241 3.367
120 HG SER 19 HG SER 19 7.901 -2.800 3.733
121 H SER 20 H SER 20 6.771 -5.073 2.054
122 HA SER 20 HA SER 20 6.836 -8.071 1.987
123 1HB SER 20 2HB SER 20 6.361 -6.946 4.247
124 2HB SER 20 1HB SER 20 4.861 -6.365 3.529
125 HG SER 20 HG SER 20 4.096 -8.364 3.483
126 H ASN 21 H ASN 21 6.450 -6.062 -0.197
127 HA ASN 21 HA ASN 21 4.991 -5.624 -1.995
128 1HB ASN 21 2HB ASN 21 5.180 -8.300 -1.504
129 2HB ASN 21 1HB ASN 21 3.434 -8.078 -1.389
130 1HD2 ASN 21 1HD2 ASN 21 6.204 -7.872 -3.594
131 2HD2 ASN 21 2HD2 ASN 21 5.285 -7.695 -5.010
132 H LEU 22 H LEU 22 4.128 -3.917 -0.293
133 HA LEU 22 HA LEU 22 1.409 -4.506 0.719
134 1HB LEU 22 2HB LEU 22 3.273 -2.115 0.842
135 2HB LEU 22 1HB LEU 22 1.687 -2.152 1.612
136 HG LEU 22 HG LEU 22 3.883 -4.174 2.149
137 1HD1 LEU 22 1HD1 LEU 22 4.230 -2.986 4.260
138 2HD1 LEU 22 2HD1 LEU 22 2.980 -1.818 3.833
139 3HD1 LEU 22 3HD1 LEU 22 4.481 -1.878 2.910
140 1HD2 LEU 22 1HD2 LEU 22 1.607 -5.007 2.561
141 2HD2 LEU 22 2HD2 LEU 22 1.241 -3.576 3.524
142 3HD2 LEU 22 3HD2 LEU 22 2.437 -4.740 4.093
143 H VAL 23 H VAL 23 -0.465 -3.436 -0.006
144 HA VAL 23 HA VAL 23 -0.216 -1.909 -2.582
145 HB VAL 23 HB VAL 23 -2.385 -3.023 -3.180
146 1HG1 VAL 23 1HG1 VAL 23 -0.649 -5.329 -2.525
147 2HG1 VAL 23 2HG1 VAL 23 0.144 -4.015 -3.396
148 3HG1 VAL 23 3HG1 VAL 23 -1.279 -4.798 -4.085
149 1HG2 VAL 23 1HG2 VAL 23 -1.990 -5.062 -1.049
150 2HG2 VAL 23 2HG2 VAL 23 -3.484 -4.467 -1.772
151 3HG2 VAL 23 3HG2 VAL 23 -2.667 -3.518 -0.531
152 H CYS 24 H CYS 24 -1.885 -0.257 -2.895
153 HA CYS 24 HA CYS 24 -2.789 0.939 -0.341
154 1HB CYS 24 2HB CYS 24 -3.129 1.979 -3.167
155 2HB CYS 24 1HB CYS 24 -3.084 2.913 -1.672
156 H SER 25 H SER 25 -4.728 0.183 0.415
157 HA SER 25 HA SER 25 -6.715 -1.158 -1.158
158 1HB SER 25 2HB SER 25 -6.253 -1.206 1.362
159 2HB SER 25 1HB SER 25 -7.137 0.314 1.455
160 HG SER 25 HG SER 25 -8.039 -2.258 1.030
161 H ARG 26 H ARG 26 -9.043 -0.327 -1.298
162 HA ARG 26 HA ARG 26 -9.017 2.491 -2.301
163 1HB ARG 26 2HB ARG 26 -10.849 1.765 -3.713
164 2HB ARG 26 1HB ARG 26 -9.576 0.552 -3.812
165 1HG ARG 26 2HG ARG 26 -10.914 -0.550 -1.803
166 2HG ARG 26 1HG ARG 26 -12.252 0.387 -2.468
167 1HD ARG 26 2HD ARG 26 -10.570 -1.229 -4.361
168 2HD ARG 26 1HD ARG 26 -11.785 -2.062 -3.370
169 HE ARG 26 HE ARG 26 -12.860 0.352 -4.576
170 1HH1 ARG 26 2HH1 ARG 26 -14.497 -2.086 -4.261
171 2HH1 ARG 26 1HH1 ARG 26 -14.595 -2.699 -5.878
172 1HH2 ARG 26 1HH2 ARG 26 -11.924 -0.807 -7.042
173 2HH2 ARG 26 2HH2 ARG 26 -13.135 -1.974 -7.456
174 H ALA 27 H ALA 27 -10.581 0.345 0.029
175 HA ALA 27 HA ALA 27 -12.771 2.166 0.661
176 1HB ALA 27 1HB ALA 27 -13.072 0.538 2.543
177 2HB ALA 27 2HB ALA 27 -11.558 -0.233 2.069
178 3HB ALA 27 3HB ALA 27 -12.940 -0.253 0.972
179 H HIS 28 H HIS 28 -9.725 1.249 2.287
180 HA HIS 28 HA HIS 28 -10.024 3.586 4.123
181 1HB HIS 28 2HB HIS 28 -8.631 0.936 4.147
182 2HB HIS 28 1HB HIS 28 -7.933 2.240 5.106
183 HD1 HIS 28 HD1 HIS 28 -8.634 1.289 7.392
184 HD2 HIS 28 HD2 HIS 28 -11.849 1.845 4.796
185 HE1 HIS 28 HE1 HIS 28 -10.734 1.004 8.779
186 H ARG 29 H ARG 29 -8.347 2.658 1.271
187 HA ARG 29 HA ARG 29 -6.531 3.597 0.103
188 1HB ARG 29 2HB ARG 29 -7.758 5.826 1.716
189 2HB ARG 29 1HB ARG 29 -6.362 6.145 0.687
190 1HG ARG 29 2HG ARG 29 -7.583 5.989 -1.212
191 2HG ARG 29 1HG ARG 29 -8.432 4.550 -0.647
192 1HD ARG 29 2HD ARG 29 -10.261 5.819 -0.236
193 2HD ARG 29 1HD ARG 29 -9.326 6.762 0.941
194 HE ARG 29 HE ARG 29 -8.941 7.408 -1.931
195 1HH1 ARG 29 1HH2 ARG 29 -11.646 8.327 -1.097
196 2HH1 ARG 29 2HH2 ARG 29 -11.330 9.911 -0.472
197 1HH2 ARG 29 2HH1 ARG 29 -7.910 9.385 -0.143
198 2HH2 ARG 29 1HH1 ARG 29 -9.207 10.512 0.070
199 H TRP 30 H TRP 30 -5.321 2.049 1.769
200 HA TRP 30 HA TRP 30 -3.086 3.641 2.890
201 1HB TRP 30 2HB TRP 30 -3.333 2.736 5.102
202 2HB TRP 30 1HB TRP 30 -4.922 3.329 4.631
203 HD1 TRP 30 HD1 TRP 30 -6.312 1.192 3.169
204 HE1 TRP 30 HE1 TRP 30 -6.725 -1.180 4.093
205 HE3 TRP 30 HE3 TRP 30 -2.668 1.002 6.721
206 HZ2 TRP 30 HZ2 TRP 30 -5.641 -2.927 6.085
207 HZ3 TRP 30 HZ3 TRP 30 -2.372 -1.022 8.119
208 HH2 TRP 30 HH2 TRP 30 -3.853 -2.986 7.806
209 H CYS 31 H CYS 31 -1.334 2.057 3.719
210 HA CYS 31 HA CYS 31 -0.843 0.052 1.636
211 1HB CYS 31 2HB CYS 31 0.652 1.047 4.077
212 2HB CYS 31 1HB CYS 31 1.297 -0.201 3.012
213 H LYS 32 H LYS 32 -1.522 -2.031 1.800
214 HA LYS 32 HA LYS 32 -1.590 -3.341 4.482
215 1HB LYS 32 2HB LYS 32 -3.861 -4.145 4.027
216 2HB LYS 32 1HB LYS 32 -3.828 -2.387 3.921
217 1HG LYS 32 2HG LYS 32 -4.837 -2.685 1.909
218 2HG LYS 32 1HG LYS 32 -3.226 -3.115 1.336
219 1HD LYS 32 2HD LYS 32 -3.729 -5.332 1.184
220 2HD LYS 32 1HD LYS 32 -4.706 -5.313 2.653
221 1HE LYS 32 2HE LYS 32 -5.773 -3.862 0.253
222 2HE LYS 32 1HE LYS 32 -5.861 -5.634 0.272
223 1HZ LYS 32 1HZ LYS 32 -6.807 -3.829 2.441
224 2HZ LYS 32 2HZ LYS 32 -6.865 -5.528 2.473
225 3HZ LYS 32 3HZ LYS 32 -7.801 -4.664 1.350
226 H TYR 33 H TYR 33 -1.792 -5.763 4.237
227 HA TYR 33 HA TYR 33 -0.661 -6.709 1.622
228 1HB TYR 33 2HB TYR 33 0.954 -6.560 3.541
229 2HB TYR 33 1HB TYR 33 -0.054 -7.705 4.425
230 HD1 TYR 33 HD1 TYR 33 1.174 -9.707 4.534
231 HD2 TYR 33 HD2 TYR 33 0.880 -7.611 0.796
232 HE1 TYR 33 HE1 TYR 33 2.300 -11.594 3.385
233 HE2 TYR 33 HE2 TYR 33 2.006 -9.497 -0.352
234 HH TYR 33 HH TYR 33 3.797 -11.541 0.795
235 H GLU 34 H GLU 34 -1.987 -8.185 0.661
236 HA GLU 34 HA GLU 34 -3.650 -9.977 2.395
237 1HB GLU 34 2HB GLU 34 -4.426 -8.120 0.158
238 2HB GLU 34 1HB GLU 34 -5.372 -9.582 0.437
239 1HG GLU 34 2HG GLU 34 -4.741 -7.552 2.600
240 2HG GLU 34 1HG GLU 34 -6.236 -7.556 1.663
241 H ILE 35 H ILE 35 -3.674 -12.097 1.697
242 HA ILE 35 HA ILE 35 -2.826 -12.739 -1.083
243 HB ILE 35 HB ILE 35 -0.821 -12.600 0.423
244 1HG1 ILE 35 1HG1 ILE 35 -1.089 -15.505 -0.182
245 2HG1 ILE 35 2HG1 ILE 35 -1.334 -14.392 -1.527
246 1HG2 ILE 35 1HG2 ILE 35 -2.092 -13.415 2.465
247 2HG2 ILE 35 2HG2 ILE 35 -1.991 -15.039 1.784
248 3HG2 ILE 35 3HG2 ILE 35 -0.518 -14.170 2.214
249 1HD1 ILE 35 1HD1 ILE 35 0.999 -13.783 0.190
250 2HD1 ILE 35 2HD1 ILE 35 1.116 -15.284 -0.728
251 3HD1 ILE 35 3HD1 ILE 35 0.855 -13.756 -1.568
252 1HN NH2 36 1HN NH2 36 -5.325 -15.018 -1.085
253 2HN NH2 36 2HN NH2 36 -4.569 -13.527 -1.686
Start of MODEL 3
1 1H GLU 1 1H GLU 1 10.416 8.009 -1.934
2 2H GLU 1 2H GLU 1 11.470 6.749 -2.366
3 3H GLU 1 3H GLU 1 12.019 8.017 -1.380
4 HA GLU 1 HA GLU 1 11.622 6.083 -0.006
5 1HB GLU 1 2HB GLU 1 9.830 8.500 0.111
6 2HB GLU 1 1HB GLU 1 9.688 7.248 1.344
7 1HG GLU 1 2HG GLU 1 11.423 8.212 2.410
8 2HG GLU 1 1HG GLU 1 12.449 7.684 1.076
9 H CYS 2 H CYS 2 10.656 4.107 -0.176
10 HA CYS 2 HA CYS 2 8.096 3.827 -1.647
11 1HB CYS 2 2HB CYS 2 9.940 2.337 -2.189
12 2HB CYS 2 1HB CYS 2 10.132 1.891 -0.494
13 H LEU 3 H LEU 3 6.212 2.951 -0.691
14 HA LEU 3 HA LEU 3 6.040 3.238 2.263
15 1HB LEU 3 2HB LEU 3 3.991 2.874 0.049
16 2HB LEU 3 1HB LEU 3 3.588 3.129 1.747
17 HG LEU 3 HG LEU 3 5.398 5.060 0.306
18 1HD1 LEU 3 1HD1 LEU 3 3.299 6.428 -0.094
19 2HD1 LEU 3 2HD1 LEU 3 2.366 4.980 0.287
20 3HD1 LEU 3 3HD1 LEU 3 3.444 4.992 -1.108
21 1HD2 LEU 3 1HD2 LEU 3 3.555 5.142 2.713
22 2HD2 LEU 3 2HD2 LEU 3 4.264 6.596 2.010
23 3HD2 LEU 3 3HD2 LEU 3 5.307 5.346 2.689
24 H GLY 4 H GLY 4 6.148 1.423 3.527
25 1HA GLY 4 2HA GLY 4 5.754 -1.232 2.237
26 2HA GLY 4 1HA GLY 4 6.581 -0.957 3.771
27 H PHE 5 H PHE 5 4.982 -2.808 4.307
28 HA PHE 5 HA PHE 5 2.171 -2.385 4.536
29 1HB PHE 5 2HB PHE 5 3.291 -4.561 4.737
30 2HB PHE 5 1HB PHE 5 4.122 -4.022 6.195
31 HD1 PHE 5 HD1 PHE 5 0.681 -4.471 4.776
32 HD2 PHE 5 HD2 PHE 5 3.138 -4.355 8.298
33 HE1 PHE 5 HE1 PHE 5 -1.256 -5.182 6.150
34 HE2 PHE 5 HE2 PHE 5 1.201 -5.066 9.672
35 HZ PHE 5 HZ PHE 5 -0.996 -5.479 8.598
36 H GLY 6 H GLY 6 0.997 -1.142 5.961
37 1HA GLY 6 2HA GLY 6 0.566 -0.268 8.202
38 2HA GLY 6 1HA GLY 6 2.307 -0.221 8.479
39 H LYS 7 H LYS 7 3.144 1.040 6.100
40 HA LYS 7 HA LYS 7 2.739 3.812 6.711
41 1HB LYS 7 2HB LYS 7 3.993 2.156 4.566
42 2HB LYS 7 1HB LYS 7 3.700 3.854 4.197
43 1HG LYS 7 2HG LYS 7 4.925 3.250 6.844
44 2HG LYS 7 1HG LYS 7 5.945 3.023 5.423
45 1HD LYS 7 2HD LYS 7 5.744 5.287 4.769
46 2HD LYS 7 1HD LYS 7 4.339 5.550 5.803
47 1HE LYS 7 2HE LYS 7 6.294 4.727 7.605
48 2HE LYS 7 1HE LYS 7 7.183 5.761 6.471
49 1HZ LYS 7 1HZ LYS 7 4.620 6.451 7.813
50 2HZ LYS 7 2HZ LYS 7 5.432 7.428 6.685
51 3HZ LYS 7 3HZ LYS 7 6.142 7.098 8.193
52 H GLY 8 H GLY 8 1.579 5.424 5.474
53 1HA GLY 8 2HA GLY 8 -0.977 4.473 4.421
54 2HA GLY 8 1HA GLY 8 -0.486 6.158 4.579
55 H CYS 9 H CYS 9 -1.602 4.416 2.283
56 HA CYS 9 HA CYS 9 0.208 5.521 0.192
57 1HB CYS 9 2HB CYS 9 0.842 3.157 0.704
58 2HB CYS 9 1HB CYS 9 -0.805 2.658 0.314
59 H ASN 10 H ASN 10 -0.930 6.099 -1.704
60 HA ASN 10 HA ASN 10 -3.887 6.161 -1.453
61 1HB ASN 10 2HB ASN 10 -1.819 7.487 -3.221
62 2HB ASN 10 1HB ASN 10 -3.550 7.683 -3.494
63 1HD2 ASN 10 1HD2 ASN 10 -0.871 8.732 -1.538
64 2HD2 ASN 10 2HD2 ASN 10 -1.759 9.739 -0.499
65 HA PRO 11 HA PRO 11 -4.450 2.887 -4.364
66 1HB PRO 11 2HB PRO 11 -6.958 3.523 -5.264
67 2HB PRO 11 1HB PRO 11 -6.650 2.803 -3.672
68 1HG PRO 11 2HG PRO 11 -7.189 5.640 -4.391
69 2HG PRO 11 1HG PRO 11 -7.745 4.705 -2.996
70 1HD PRO 11 2HD PRO 11 -5.696 6.494 -2.876
71 2HD PRO 11 1HD PRO 11 -5.822 5.077 -1.810
72 H SER 12 H SER 12 -5.413 6.164 -5.486
73 HA SER 12 HA SER 12 -5.195 5.667 -8.300
74 1HB SER 12 2HB SER 12 -4.867 8.135 -6.564
75 2HB SER 12 1HB SER 12 -4.914 8.200 -8.323
76 HG SER 12 HG SER 12 -6.993 7.820 -8.276
77 H ASN 13 H ASN 13 -2.842 6.982 -5.946
78 HA ASN 13 HA ASN 13 -0.656 6.667 -7.959
79 1HB ASN 13 2HB ASN 13 -0.971 8.142 -5.325
80 2HB ASN 13 1HB ASN 13 0.571 8.033 -6.173
81 1HD2 ASN 13 1HD2 ASN 13 0.779 9.170 -8.235
82 2HD2 ASN 13 2HD2 ASN 13 -0.354 10.338 -8.718
83 H ASP 14 H ASP 14 -1.279 4.212 -7.351
84 HA ASP 14 HA ASP 14 -0.449 3.098 -4.851
85 1HB ASP 14 2HB ASP 14 -1.486 2.268 -7.370
86 2HB ASP 14 1HB ASP 14 -0.063 1.277 -7.045
87 H GLN 15 H GLN 15 1.594 3.296 -4.056
88 HA GLN 15 HA GLN 15 3.895 2.609 -5.840
89 1HB GLN 15 2HB GLN 15 3.317 5.153 -5.387
90 2HB GLN 15 1HB GLN 15 4.082 4.839 -3.830
91 1HG GLN 15 2HG GLN 15 6.164 4.400 -4.788
92 2HG GLN 15 1HG GLN 15 5.468 3.978 -6.352
93 1HE2 GLN 15 1HE2 GLN 15 5.753 5.577 -7.911
94 2HE2 GLN 15 2HE2 GLN 15 5.902 7.237 -7.590
95 H CYS 16 H CYS 16 2.640 0.890 -3.951
96 HA CYS 16 HA CYS 16 3.995 0.972 -1.370
97 1HB CYS 16 2HB CYS 16 1.716 -0.070 -2.166
98 2HB CYS 16 1HB CYS 16 2.712 -1.456 -2.607
99 H CYS 17 H CYS 17 5.400 -0.881 -0.645
100 HA CYS 17 HA CYS 17 7.623 -1.293 -2.484
101 1HB CYS 17 2HB CYS 17 6.885 -1.871 0.342
102 2HB CYS 17 1HB CYS 17 8.135 -2.895 -0.365
103 H LYS 18 H LYS 18 8.094 -3.113 -3.679
104 HA LYS 18 HA LYS 18 5.998 -5.196 -3.899
105 1HB LYS 18 2HB LYS 18 7.858 -3.881 -5.592
106 2HB LYS 18 1HB LYS 18 8.317 -5.583 -5.573
107 1HG LYS 18 2HG LYS 18 5.415 -4.904 -5.863
108 2HG LYS 18 1HG LYS 18 6.468 -4.687 -7.261
109 1HD LYS 18 2HD LYS 18 7.303 -7.078 -6.786
110 2HD LYS 18 1HD LYS 18 5.896 -7.229 -5.733
111 1HE LYS 18 2HE LYS 18 5.349 -6.123 -8.440
112 2HE LYS 18 1HE LYS 18 5.809 -7.835 -8.378
113 1HZ LYS 18 1HZ LYS 18 4.158 -8.195 -6.657
114 2HZ LYS 18 2HZ LYS 18 3.419 -7.542 -8.040
115 3HZ LYS 18 3HZ LYS 18 3.719 -6.556 -6.690
116 H SER 19 H SER 19 8.456 -4.868 -1.766
117 HA SER 19 HA SER 19 9.918 -7.353 -2.021
118 1HB SER 19 2HB SER 19 10.571 -6.767 0.336
119 2HB SER 19 1HB SER 19 10.778 -5.432 -0.792
120 HG SER 19 HG SER 19 9.454 -4.363 0.429
121 H SER 20 H SER 20 7.031 -6.365 -0.162
122 HA SER 20 HA SER 20 6.621 -9.231 0.624
123 1HB SER 20 2HB SER 20 6.372 -6.619 1.933
124 2HB SER 20 1HB SER 20 4.941 -7.623 2.148
125 HG SER 20 HG SER 20 6.188 -8.401 3.694
126 H ASN 21 H ASN 21 5.730 -7.498 -1.892
127 HA ASN 21 HA ASN 21 3.815 -7.311 -3.254
128 1HB ASN 21 2HB ASN 21 4.300 -9.851 -2.732
129 2HB ASN 21 1HB ASN 21 2.801 -9.749 -1.809
130 1HD2 ASN 21 1HD2 ASN 21 1.331 -10.832 -3.194
131 2HD2 ASN 21 2HD2 ASN 21 1.035 -10.371 -4.800
132 H LEU 22 H LEU 22 3.307 -5.391 -1.697
133 HA LEU 22 HA LEU 22 0.829 -5.924 -0.098
134 1HB LEU 22 2HB LEU 22 2.953 -3.763 -0.073
135 2HB LEU 22 1HB LEU 22 1.475 -3.661 0.885
136 HG LEU 22 HG LEU 22 3.089 -6.174 1.061
137 1HD1 LEU 22 1HD1 LEU 22 4.443 -5.111 2.889
138 2HD1 LEU 22 2HD1 LEU 22 3.810 -3.544 2.386
139 3HD1 LEU 22 3HD1 LEU 22 4.817 -4.482 1.284
140 1HD2 LEU 22 1HD2 LEU 22 1.043 -6.138 2.295
141 2HD2 LEU 22 2HD2 LEU 22 1.353 -4.510 2.899
142 3HD2 LEU 22 3HD2 LEU 22 2.316 -5.867 3.484
143 H VAL 23 H VAL 23 -0.849 -4.183 -0.209
144 HA VAL 23 HA VAL 23 -0.897 -2.755 -2.848
145 HB VAL 23 HB VAL 23 -3.354 -3.378 -2.890
146 1HG1 VAL 23 1HG1 VAL 23 -1.571 -4.620 -4.149
147 2HG1 VAL 23 2HG1 VAL 23 -2.961 -5.618 -3.723
148 3HG1 VAL 23 3HG1 VAL 23 -1.466 -5.746 -2.797
149 1HG2 VAL 23 1HG2 VAL 23 -3.293 -3.909 -0.344
150 2HG2 VAL 23 2HG2 VAL 23 -2.635 -5.469 -0.834
151 3HG2 VAL 23 3HG2 VAL 23 -4.235 -4.974 -1.386
152 H CYS 24 H CYS 24 -1.882 -0.700 -2.797
153 HA CYS 24 HA CYS 24 -2.139 0.558 -0.151
154 1HB CYS 24 2HB CYS 24 -2.630 1.645 -2.944
155 2HB CYS 24 1HB CYS 24 -2.334 2.594 -1.488
156 H SER 25 H SER 25 -4.064 0.863 0.912
157 HA SER 25 HA SER 25 -6.564 -0.116 -0.295
158 1HB SER 25 2HB SER 25 -5.843 1.075 2.399
159 2HB SER 25 1HB SER 25 -7.417 0.391 2.008
160 HG SER 25 HG SER 25 -6.501 -1.403 2.629
161 H ARG 26 H ARG 26 -8.586 1.338 0.237
162 HA ARG 26 HA ARG 26 -8.022 4.098 -0.792
163 1HB ARG 26 2HB ARG 26 -10.533 2.390 -0.891
164 2HB ARG 26 1HB ARG 26 -10.305 3.940 -1.699
165 1HG ARG 26 2HG ARG 26 -8.220 2.767 -2.776
166 2HG ARG 26 1HG ARG 26 -9.052 1.280 -2.327
167 1HD ARG 26 2HD ARG 26 -10.917 3.132 -3.561
168 2HD ARG 26 1HD ARG 26 -9.534 2.827 -4.630
169 HE ARG 26 HE ARG 26 -10.047 0.459 -4.564
170 1HH1 ARG 26 1HH2 ARG 26 -11.063 0.154 -1.807
171 2HH1 ARG 26 2HH2 ARG 26 -12.767 -0.049 -2.040
172 1HH2 ARG 26 2HH1 ARG 26 -12.737 1.189 -5.287
173 2HH2 ARG 26 1HH1 ARG 26 -13.717 0.538 -4.015
174 H ALA 27 H ALA 27 -10.236 2.312 1.403
175 HA ALA 27 HA ALA 27 -11.267 4.691 2.694
176 1HB ALA 27 1HB ALA 27 -12.116 2.943 4.323
177 2HB ALA 27 2HB ALA 27 -11.209 1.744 3.402
178 3HB ALA 27 3HB ALA 27 -12.529 2.629 2.638
179 H HIS 28 H HIS 28 -8.795 2.286 3.602
180 HA HIS 28 HA HIS 28 -8.085 3.816 6.034
181 1HB HIS 28 2HB HIS 28 -7.258 1.201 4.761
182 2HB HIS 28 1HB HIS 28 -6.401 1.852 6.158
183 HD1 HIS 28 HD1 HIS 28 -7.478 1.548 8.423
184 HD2 HIS 28 HD2 HIS 28 -10.104 0.677 5.304
185 HE1 HIS 28 HE1 HIS 28 -9.558 0.572 9.489
186 H ARG 29 H ARG 29 -7.091 3.624 2.720
187 HA ARG 29 HA ARG 29 -5.260 4.530 1.546
188 1HB ARG 29 2HB ARG 29 -5.721 6.342 3.919
189 2HB ARG 29 1HB ARG 29 -4.489 6.722 2.716
190 1HG ARG 29 2HG ARG 29 -6.765 6.028 1.224
191 2HG ARG 29 1HG ARG 29 -7.372 7.029 2.542
192 1HD ARG 29 2HD ARG 29 -4.968 8.253 1.601
193 2HD ARG 29 1HD ARG 29 -5.976 7.886 0.187
194 HE ARG 29 HE ARG 29 -6.903 9.471 2.551
195 1HH1 ARG 29 2HH1 ARG 29 -6.387 10.747 -0.145
196 2HH1 ARG 29 1HH1 ARG 29 -7.983 10.817 -0.812
197 1HH2 ARG 29 1HH2 ARG 29 -9.313 8.542 1.453
198 2HH2 ARG 29 2HH2 ARG 29 -9.644 9.565 0.096
199 H TRP 30 H TRP 30 -4.342 2.317 2.749
200 HA TRP 30 HA TRP 30 -1.611 3.084 3.601
201 1HB TRP 30 2HB TRP 30 -1.735 1.964 5.697
202 2HB TRP 30 1HB TRP 30 -3.225 2.895 5.600
203 HD1 TRP 30 HD1 TRP 30 -5.201 1.265 4.120
204 HE1 TRP 30 HE1 TRP 30 -5.948 -1.095 4.842
205 HE3 TRP 30 HE3 TRP 30 -1.227 -0.053 7.026
206 HZ2 TRP 30 HZ2 TRP 30 -4.978 -3.259 6.447
207 HZ3 TRP 30 HZ3 TRP 30 -1.157 -2.266 8.139
208 HH2 TRP 30 HH2 TRP 30 -3.027 -3.870 7.854
209 H CYS 31 H CYS 31 -0.190 1.090 3.727
210 HA CYS 31 HA CYS 31 -0.788 -0.682 1.444
211 1HB CYS 31 2HB CYS 31 1.539 0.116 3.128
212 2HB CYS 31 1HB CYS 31 1.620 -1.472 2.366
213 H LYS 32 H LYS 32 -1.747 -2.644 1.737
214 HA LYS 32 HA LYS 32 -1.383 -4.046 4.367
215 1HB LYS 32 2HB LYS 32 -3.741 -4.698 4.204
216 2HB LYS 32 1HB LYS 32 -3.604 -2.944 4.100
217 1HG LYS 32 2HG LYS 32 -3.959 -2.947 1.747
218 2HG LYS 32 1HG LYS 32 -3.687 -4.686 1.629
219 1HD LYS 32 2HD LYS 32 -5.737 -5.141 2.854
220 2HD LYS 32 1HD LYS 32 -5.986 -3.419 3.145
221 1HE LYS 32 2HE LYS 32 -6.080 -3.085 0.639
222 2HE LYS 32 1HE LYS 32 -6.072 -4.851 0.469
223 1HZ LYS 32 1HZ LYS 32 -8.010 -3.284 2.094
224 2HZ LYS 32 2HZ LYS 32 -7.993 -4.975 1.927
225 3HZ LYS 32 3HZ LYS 32 -8.340 -3.989 0.588
226 H TYR 33 H TYR 33 -2.042 -6.463 4.090
227 HA TYR 33 HA TYR 33 -0.567 -7.544 1.767
228 1HB TYR 33 2HB TYR 33 -1.154 -8.256 4.488
229 2HB TYR 33 1HB TYR 33 -1.704 -9.563 3.440
230 HD1 TYR 33 HD1 TYR 33 1.204 -7.657 4.630
231 HD2 TYR 33 HD2 TYR 33 -0.130 -10.767 1.981
232 HE1 TYR 33 HE1 TYR 33 3.549 -8.401 4.321
233 HE2 TYR 33 HE2 TYR 33 2.216 -11.508 1.673
234 HH TYR 33 HH TYR 33 4.615 -10.166 1.919
235 H GLU 34 H GLU 34 -1.716 -9.792 0.998
236 HA GLU 34 HA GLU 34 -4.583 -9.169 0.357
237 1HB GLU 34 2HB GLU 34 -4.025 -10.118 -1.928
238 2HB GLU 34 1HB GLU 34 -3.214 -8.599 -1.553
239 1HG GLU 34 2HG GLU 34 -1.138 -9.587 -1.379
240 2HG GLU 34 1HG GLU 34 -1.797 -11.118 -0.805
241 H ILE 35 H ILE 35 -4.628 -10.732 2.349
242 HA ILE 35 HA ILE 35 -4.820 -13.533 1.302
243 HB ILE 35 HB ILE 35 -2.708 -13.082 2.599
244 1HG1 ILE 35 2HG1 ILE 35 -4.051 -14.884 4.461
245 2HG1 ILE 35 1HG1 ILE 35 -4.491 -15.228 2.788
246 1HG2 ILE 35 1HG2 ILE 35 -3.853 -11.411 4.146
247 2HG2 ILE 35 2HG2 ILE 35 -2.797 -12.580 4.939
248 3HG2 ILE 35 3HG2 ILE 35 -4.546 -12.797 4.988
249 1HD1 ILE 35 1HD1 ILE 35 -2.217 -15.547 2.147
250 2HD1 ILE 35 2HD1 ILE 35 -2.398 -16.415 3.671
251 3HD1 ILE 35 3HD1 ILE 35 -1.618 -14.834 3.644
252 1HN NH2 36 1HN NH2 36 -7.294 -14.193 4.013
253 2HN NH2 36 2HN NH2 36 -5.605 -14.686 3.763
Start of MODEL 4
1 1H GLU 1 1H GLU 1 -11.242 2.891 -6.547
2 2H GLU 1 2H GLU 1 -10.915 4.350 -7.352
3 3H GLU 1 3H GLU 1 -11.037 4.320 -5.657
4 HA GLU 1 HA GLU 1 -8.913 2.990 -7.273
5 1HB GLU 1 2HB GLU 1 -9.235 5.573 -5.773
6 2HB GLU 1 1HB GLU 1 -7.646 4.810 -5.813
7 1HG GLU 1 2HG GLU 1 -7.932 4.671 -8.352
8 2HG GLU 1 1HG GLU 1 -9.308 5.757 -8.154
9 H CYS 2 H CYS 2 -8.673 1.033 -6.171
10 HA CYS 2 HA CYS 2 -7.976 1.190 -3.283
11 1HB CYS 2 2HB CYS 2 -10.485 0.293 -4.355
12 2HB CYS 2 1HB CYS 2 -9.647 -1.096 -3.665
13 H LEU 3 H LEU 3 -6.119 0.038 -3.022
14 HA LEU 3 HA LEU 3 -5.477 -2.138 -4.985
15 1HB LEU 3 2HB LEU 3 -3.676 -0.487 -3.175
16 2HB LEU 3 1HB LEU 3 -3.144 -1.599 -4.435
17 HG LEU 3 HG LEU 3 -4.944 0.758 -5.036
18 1HD1 LEU 3 1HD1 LEU 3 -3.065 2.117 -5.484
19 2HD1 LEU 3 2HD1 LEU 3 -1.954 0.747 -5.454
20 3HD1 LEU 3 3HD1 LEU 3 -2.661 1.344 -3.952
21 1HD2 LEU 3 1HD2 LEU 3 -4.538 -1.305 -6.602
22 2HD2 LEU 3 2HD2 LEU 3 -2.958 -0.570 -6.873
23 3HD2 LEU 3 3HD2 LEU 3 -4.426 0.317 -7.284
24 H GLY 4 H GLY 4 -4.984 -4.198 -4.180
25 1HA GLY 4 2HA GLY 4 -5.539 -4.638 -1.294
26 2HA GLY 4 1HA GLY 4 -5.541 -5.885 -2.540
27 H PHE 5 H PHE 5 -4.108 -7.183 -1.240
28 HA PHE 5 HA PHE 5 -1.475 -6.203 -0.440
29 1HB PHE 5 2HB PHE 5 -2.861 -7.997 0.681
30 2HB PHE 5 1HB PHE 5 -2.525 -9.040 -0.700
31 HD1 PHE 5 HD1 PHE 5 -0.514 -10.269 -0.822
32 HD2 PHE 5 HD2 PHE 5 -0.857 -7.026 1.975
33 HE1 PHE 5 HE1 PHE 5 1.659 -10.908 0.185
34 HE2 PHE 5 HE2 PHE 5 1.317 -7.667 2.981
35 HZ PHE 5 HZ PHE 5 2.574 -9.607 2.087
36 H GLY 6 H GLY 6 0.466 -6.471 -1.546
37 1HA GLY 6 2HA GLY 6 1.954 -7.211 -3.233
38 2HA GLY 6 1HA GLY 6 0.677 -8.253 -3.861
39 H LYS 7 H LYS 7 0.649 -4.723 -3.320
40 HA LYS 7 HA LYS 7 0.207 -4.363 -6.268
41 1HB LYS 7 2HB LYS 7 -1.244 -3.379 -3.831
42 2HB LYS 7 1HB LYS 7 -1.208 -2.345 -5.259
43 1HG LYS 7 2HG LYS 7 -1.880 -5.226 -5.664
44 2HG LYS 7 1HG LYS 7 -3.106 -4.199 -4.921
45 1HD LYS 7 2HD LYS 7 -3.545 -3.140 -6.868
46 2HD LYS 7 1HD LYS 7 -1.832 -2.917 -7.220
47 1HE LYS 7 2HE LYS 7 -2.885 -5.699 -7.476
48 2HE LYS 7 1HE LYS 7 -3.384 -4.533 -8.716
49 1HZ LYS 7 1HZ LYS 7 -0.612 -5.192 -7.877
50 2HZ LYS 7 2HZ LYS 7 -0.997 -3.856 -8.854
51 3HZ LYS 7 3HZ LYS 7 -1.308 -5.433 -9.404
52 H GLY 8 H GLY 8 1.982 -3.282 -7.038
53 1HA GLY 8 2HA GLY 8 3.852 -1.856 -5.431
54 2HA GLY 8 1HA GLY 8 3.738 -1.734 -7.184
55 H CYS 9 H CYS 9 3.791 0.166 -4.603
56 HA CYS 9 HA CYS 9 2.088 2.252 -5.883
57 1HB CYS 9 2HB CYS 9 1.203 2.775 -3.563
58 2HB CYS 9 1HB CYS 9 0.665 1.229 -4.214
59 H ASN 10 H ASN 10 2.495 4.409 -4.518
60 HA ASN 10 HA ASN 10 5.456 4.684 -4.225
61 1HB ASN 10 2HB ASN 10 3.148 6.379 -5.043
62 2HB ASN 10 1HB ASN 10 4.452 7.205 -4.190
63 1HD2 ASN 10 1HD2 ASN 10 3.493 5.956 -7.250
64 2HD2 ASN 10 2HD2 ASN 10 4.991 6.119 -8.033
65 HA PRO 11 HA PRO 11 5.000 5.109 0.150
66 1HB PRO 11 2HB PRO 11 7.240 6.593 0.697
67 2HB PRO 11 1HB PRO 11 7.291 4.860 0.315
68 1HG PRO 11 2HG PRO 11 7.842 7.201 -1.446
69 2HG PRO 11 1HG PRO 11 8.683 5.646 -1.342
70 1HD PRO 11 2HD PRO 11 6.902 6.229 -3.301
71 2HD PRO 11 1HD PRO 11 7.157 4.580 -2.688
72 H SER 12 H SER 12 5.786 8.065 -1.714
73 HA SER 12 HA SER 12 4.655 9.852 0.320
74 1HB SER 12 2HB SER 12 6.567 10.366 -1.244
75 2HB SER 12 1HB SER 12 5.414 10.363 -2.575
76 HG SER 12 HG SER 12 4.721 12.255 -1.953
77 H ASN 13 H ASN 13 3.656 8.619 -2.890
78 HA ASN 13 HA ASN 13 0.935 9.797 -2.442
79 1HB ASN 13 2HB ASN 13 2.511 10.293 -4.491
80 2HB ASN 13 1HB ASN 13 1.982 8.707 -5.052
81 1HD2 ASN 13 1HD2 ASN 13 -0.037 8.624 -6.104
82 2HD2 ASN 13 2HD2 ASN 13 -1.164 9.893 -6.113
83 H ASP 14 H ASP 14 1.012 7.672 -0.930
84 HA ASP 14 HA ASP 14 0.516 5.167 -2.403
85 1HB ASP 14 2HB ASP 14 0.384 4.221 -0.154
86 2HB ASP 14 1HB ASP 14 1.762 5.316 -0.235
87 H GLN 15 H GLN 15 -1.513 4.105 -2.501
88 HA GLN 15 HA GLN 15 -3.906 5.449 -1.368
89 1HB GLN 15 2HB GLN 15 -2.948 5.710 -4.088
90 2HB GLN 15 1HB GLN 15 -4.516 4.904 -4.085
91 1HG GLN 15 2HG GLN 15 -5.014 6.861 -2.281
92 2HG GLN 15 1HG GLN 15 -3.813 7.677 -3.281
93 1HE2 GLN 15 1HE2 GLN 15 -4.877 8.918 -4.844
94 2HE2 GLN 15 2HE2 GLN 15 -6.258 8.425 -5.700
95 H CYS 16 H CYS 16 -3.125 3.088 -0.398
96 HA CYS 16 HA CYS 16 -4.119 0.794 -1.929
97 1HB CYS 16 2HB CYS 16 -2.335 1.228 0.128
98 2HB CYS 16 1HB CYS 16 -3.713 0.533 0.982
99 H CYS 17 H CYS 17 -5.783 -0.693 -0.761
100 HA CYS 17 HA CYS 17 -8.231 0.857 -0.306
101 1HB CYS 17 2HB CYS 17 -7.712 -1.472 -1.506
102 2HB CYS 17 1HB CYS 17 -8.029 -2.103 0.111
103 H LYS 18 H LYS 18 -9.251 1.192 1.656
104 HA LYS 18 HA LYS 18 -7.741 0.700 4.120
105 1HB LYS 18 2HB LYS 18 -10.252 2.108 3.273
106 2HB LYS 18 1HB LYS 18 -10.011 1.772 4.987
107 1HG LYS 18 2HG LYS 18 -7.591 2.762 4.481
108 2HG LYS 18 1HG LYS 18 -8.453 3.570 3.172
109 1HD LYS 18 2HD LYS 18 -9.846 3.653 5.772
110 2HD LYS 18 1HD LYS 18 -8.306 4.511 5.747
111 1HE LYS 18 2HE LYS 18 -9.547 6.228 4.870
112 2HE LYS 18 1HE LYS 18 -9.422 5.311 3.356
113 1HZ LYS 18 1HZ LYS 18 -11.421 4.091 3.969
114 2HZ LYS 18 2HZ LYS 18 -11.739 5.759 3.911
115 3HZ LYS 18 3HZ LYS 18 -11.551 4.980 5.409
116 H SER 19 H SER 19 -10.223 -1.004 2.380
117 HA SER 19 HA SER 19 -11.672 -2.267 4.474
118 1HB SER 19 2HB SER 19 -12.069 -2.289 1.964
119 2HB SER 19 1HB SER 19 -10.788 -3.493 1.844
120 HG SER 19 HG SER 19 -12.611 -4.663 2.080
121 H SER 20 H SER 20 -8.600 -3.230 2.905
122 HA SER 20 HA SER 20 -8.276 -5.438 4.880
123 1HB SER 20 2HB SER 20 -7.710 -5.035 2.137
124 2HB SER 20 1HB SER 20 -6.148 -5.136 2.944
125 HG SER 20 HG SER 20 -8.121 -7.044 2.602
126 H ASN 21 H ASN 21 -7.593 -2.206 4.879
127 HA ASN 21 HA ASN 21 -6.010 -0.844 5.960
128 1HB ASN 21 2HB ASN 21 -6.649 -3.179 7.513
129 2HB ASN 21 1HB ASN 21 -4.965 -2.750 7.809
130 1HD2 ASN 21 1HD2 ASN 21 -8.298 -1.688 8.241
131 2HD2 ASN 21 2HD2 ASN 21 -7.934 -0.321 9.179
132 H LEU 22 H LEU 22 -4.748 -1.110 3.814
133 HA LEU 22 HA LEU 22 -2.159 -2.555 4.299
134 1HB LEU 22 2HB LEU 22 -3.829 -1.974 1.852
135 2HB LEU 22 1HB LEU 22 -2.125 -2.406 1.706
136 HG LEU 22 HG LEU 22 -3.915 -4.106 3.412
137 1HD1 LEU 22 1HD1 LEU 22 -3.741 -4.155 0.387
138 2HD1 LEU 22 2HD1 LEU 22 -5.192 -3.944 1.367
139 3HD1 LEU 22 3HD1 LEU 22 -4.356 -5.497 1.352
140 1HD2 LEU 22 1HD2 LEU 22 -1.474 -4.578 1.672
141 2HD2 LEU 22 2HD2 LEU 22 -2.333 -5.856 2.532
142 3HD2 LEU 22 3HD2 LEU 22 -1.531 -4.572 3.435
143 H VAL 23 H VAL 23 -0.231 -1.405 3.918
144 HA VAL 23 HA VAL 23 -0.509 1.504 3.225
145 HB VAL 23 HB VAL 23 1.336 1.855 4.908
146 1HG1 VAL 23 1HG1 VAL 23 -0.170 2.089 6.633
147 2HG1 VAL 23 2HG1 VAL 23 -0.855 0.480 6.397
148 3HG1 VAL 23 3HG1 VAL 23 -1.309 1.799 5.317
149 1HG2 VAL 23 1HG2 VAL 23 2.222 0.140 6.161
150 2HG2 VAL 23 2HG2 VAL 23 1.800 -0.795 4.728
151 3HG2 VAL 23 3HG2 VAL 23 0.728 -0.798 6.128
152 H CYS 24 H CYS 24 1.261 2.390 2.016
153 HA CYS 24 HA CYS 24 2.647 0.499 0.285
154 1HB CYS 24 2HB CYS 24 1.727 2.940 -0.089
155 2HB CYS 24 1HB CYS 24 3.310 3.423 0.519
156 H SER 25 H SER 25 4.840 -0.064 0.314
157 HA SER 25 HA SER 25 6.389 0.744 2.752
158 1HB SER 25 2HB SER 25 5.645 -1.679 2.234
159 2HB SER 25 1HB SER 25 6.862 -1.645 0.962
160 HG SER 25 HG SER 25 8.251 -2.037 2.477
161 H ARG 26 H ARG 26 8.802 0.815 2.399
162 HA ARG 26 HA ARG 26 9.433 2.191 -0.172
163 1HB ARG 26 2HB ARG 26 10.058 2.522 2.609
164 2HB ARG 26 1HB ARG 26 11.564 2.260 1.730
165 1HG ARG 26 2HG ARG 26 11.088 4.079 0.221
166 2HG ARG 26 1HG ARG 26 9.454 4.252 0.862
167 1HD ARG 26 2HD ARG 26 10.683 5.978 1.948
168 2HD ARG 26 1HD ARG 26 10.638 4.676 3.152
169 HE ARG 26 HE ARG 26 12.923 4.589 1.286
170 1HH1 ARG 26 2HH1 ARG 26 12.833 3.344 4.054
171 2HH1 ARG 26 1HH1 ARG 26 13.851 4.421 4.950
172 1HH2 ARG 26 1HH2 ARG 26 13.739 6.944 2.560
173 2HH2 ARG 26 2HH2 ARG 26 14.365 6.465 4.102
174 H ALA 27 H ALA 27 10.109 -0.764 1.578
175 HA ALA 27 HA ALA 27 12.655 -1.490 0.579
176 1HB ALA 27 1HB ALA 27 10.186 -3.131 1.215
177 2HB ALA 27 2HB ALA 27 11.475 -2.695 2.337
178 3HB ALA 27 3HB ALA 27 11.800 -3.813 1.013
179 H HIS 28 H HIS 28 9.451 -2.285 -0.804
180 HA HIS 28 HA HIS 28 10.779 -2.588 -3.480
181 1HB HIS 28 2HB HIS 28 8.874 -4.348 -1.954
182 2HB HIS 28 1HB HIS 28 8.870 -4.390 -3.717
183 HD1 HIS 28 HD1 HIS 28 11.544 -4.542 -4.694
184 HD2 HIS 28 HD2 HIS 28 10.674 -6.174 -0.956
185 HE1 HIS 28 HE1 HIS 28 13.406 -6.181 -4.176
186 H ARG 29 H ARG 29 8.945 -0.470 -1.982
187 HA ARG 29 HA ARG 29 7.151 0.952 -2.551
188 1HB ARG 29 2HB ARG 29 8.073 0.045 -5.302
189 2HB ARG 29 1HB ARG 29 7.139 1.500 -4.968
190 1HG ARG 29 2HG ARG 29 9.958 0.896 -4.024
191 2HG ARG 29 1HG ARG 29 9.475 2.122 -5.196
192 1HD ARG 29 2HD ARG 29 7.934 2.933 -3.154
193 2HD ARG 29 1HD ARG 29 9.223 2.155 -2.216
194 HE ARG 29 HE ARG 29 9.506 4.622 -3.669
195 1HH1 ARG 29 2HH1 ARG 29 11.251 3.089 -1.512
196 2HH1 ARG 29 1HH1 ARG 29 12.770 3.086 -2.343
197 1HH2 ARG 29 1HH2 ARG 29 11.400 3.999 -5.401
198 2HH2 ARG 29 2HH2 ARG 29 12.855 3.602 -4.549
199 H TRP 30 H TRP 30 5.860 -1.062 -1.621
200 HA TRP 30 HA TRP 30 3.712 -1.666 -3.580
201 1HB TRP 30 2HB TRP 30 3.923 -4.046 -3.307
202 2HB TRP 30 1HB TRP 30 5.541 -3.444 -3.653
203 HD1 TRP 30 HD1 TRP 30 6.809 -2.654 -1.131
204 HE1 TRP 30 HE1 TRP 30 7.085 -4.198 0.915
205 HE3 TRP 30 HE3 TRP 30 3.141 -6.059 -2.110
206 HZ2 TRP 30 HZ2 TRP 30 5.899 -6.572 1.992
207 HZ3 TRP 30 HZ3 TRP 30 2.733 -7.950 -0.562
208 HH2 TRP 30 HH2 TRP 30 4.107 -8.211 1.486
209 H CYS 31 H CYS 31 1.914 -2.968 -2.347
210 HA CYS 31 HA CYS 31 1.363 -1.513 0.168
211 1HB CYS 31 2HB CYS 31 -0.111 -2.964 -1.953
212 2HB CYS 31 1HB CYS 31 -0.805 -3.095 -0.338
213 H LYS 32 H LYS 32 1.974 -2.423 2.072
214 HA LYS 32 HA LYS 32 2.004 -5.417 2.302
215 1HB LYS 32 2HB LYS 32 3.791 -5.033 3.978
216 2HB LYS 32 1HB LYS 32 4.215 -4.326 2.421
217 1HG LYS 32 2HG LYS 32 3.953 -2.150 3.181
218 2HG LYS 32 1HG LYS 32 2.781 -2.609 4.415
219 1HD LYS 32 2HD LYS 32 5.121 -3.978 5.123
220 2HD LYS 32 1HD LYS 32 5.672 -2.378 4.627
221 1HE LYS 32 2HE LYS 32 4.321 -1.283 6.253
222 2HE LYS 32 1HE LYS 32 3.342 -2.737 6.531
223 1HZ LYS 32 1HZ LYS 32 6.248 -2.452 7.109
224 2HZ LYS 32 2HZ LYS 32 5.343 -3.875 7.318
225 3HZ LYS 32 3HZ LYS 32 5.009 -2.505 8.265
226 H TYR 33 H TYR 33 1.337 -6.275 4.416
227 HA TYR 33 HA TYR 33 -0.728 -4.559 5.725
228 1HB TYR 33 2HB TYR 33 -1.361 -6.744 4.717
229 2HB TYR 33 1HB TYR 33 -0.223 -7.555 5.792
230 HD1 TYR 33 HD1 TYR 33 -1.032 -8.407 7.809
231 HD2 TYR 33 HD2 TYR 33 -3.064 -5.102 5.964
232 HE1 TYR 33 HE1 TYR 33 -2.756 -8.472 9.588
233 HE2 TYR 33 HE2 TYR 33 -4.788 -5.167 7.745
234 HH TYR 33 HH TYR 33 -4.615 -6.197 10.432
235 H GLU 34 H GLU 34 0.744 -3.376 7.113
236 HA GLU 34 HA GLU 34 1.948 -2.997 9.107
237 1HB GLU 34 2HB GLU 34 -0.126 -4.856 9.527
238 2HB GLU 34 1HB GLU 34 1.269 -5.520 10.376
239 1HG GLU 34 2HG GLU 34 1.443 -3.693 11.807
240 2HG GLU 34 1HG GLU 34 0.638 -2.602 10.678
241 H ILE 35 H ILE 35 3.360 -4.598 10.810
242 HA ILE 35 HA ILE 35 5.670 -5.391 9.208
243 HB ILE 35 HB ILE 35 4.962 -5.509 12.160
244 1HG1 ILE 35 2HG1 ILE 35 7.091 -3.770 10.975
245 2HG1 ILE 35 1HG1 ILE 35 5.410 -3.310 10.707
246 1HG2 ILE 35 1HG2 ILE 35 7.487 -5.792 12.422
247 2HG2 ILE 35 2HG2 ILE 35 7.523 -6.212 10.710
248 3HG2 ILE 35 3HG2 ILE 35 6.612 -7.210 11.844
249 1HD1 ILE 35 1HD1 ILE 35 5.032 -2.854 12.929
250 2HD1 ILE 35 2HD1 ILE 35 6.766 -2.535 12.892
251 3HD1 ILE 35 3HD1 ILE 35 6.167 -4.085 13.483
252 1HN NH2 36 1HN NH2 36 3.121 -8.406 9.893
253 2HN NH2 36 2HN NH2 36 2.827 -6.655 9.825
Start of MODEL 5
1 1H GLU 1 1H GLU 1 11.078 6.901 3.028
2 2H GLU 1 2H GLU 1 11.305 8.339 2.153
3 3H GLU 1 3H GLU 1 11.561 6.835 1.403
4 HA GLU 1 HA GLU 1 8.937 7.866 2.372
5 1HB GLU 1 2HB GLU 1 10.405 7.735 -0.254
6 2HB GLU 1 1HB GLU 1 8.642 7.692 -0.240
7 1HG GLU 1 2HG GLU 1 8.454 9.849 0.597
8 2HG GLU 1 1HG GLU 1 10.035 9.796 1.377
9 H CYS 2 H CYS 2 8.935 5.691 3.542
10 HA CYS 2 HA CYS 2 8.002 3.543 1.675
11 1HB CYS 2 2HB CYS 2 10.458 3.438 2.613
12 2HB CYS 2 1HB CYS 2 9.672 2.947 4.113
13 H LEU 3 H LEU 3 6.068 2.699 2.341
14 HA LEU 3 HA LEU 3 5.125 3.337 5.115
15 1HB LEU 3 2HB LEU 3 3.615 2.621 2.577
16 2HB LEU 3 1HB LEU 3 2.883 3.111 4.103
17 HG LEU 3 HG LEU 3 4.779 4.815 2.456
18 1HD1 LEU 3 1HD1 LEU 3 2.532 4.474 1.417
19 2HD1 LEU 3 2HD1 LEU 3 2.795 6.144 1.919
20 3HD1 LEU 3 3HD1 LEU 3 1.785 5.078 2.896
21 1HD2 LEU 3 1HD2 LEU 3 3.797 6.588 4.075
22 2HD2 LEU 3 2HD2 LEU 3 5.013 5.484 4.718
23 3HD2 LEU 3 3HD2 LEU 3 3.305 5.214 5.065
24 H GLY 4 H GLY 4 5.519 1.574 6.416
25 1HA GLY 4 2HA GLY 4 5.722 -1.136 5.461
26 2HA GLY 4 1HA GLY 4 5.608 -0.652 7.153
27 H PHE 5 H PHE 5 4.271 -2.897 6.544
28 HA PHE 5 HA PHE 5 1.611 -2.675 5.539
29 1HB PHE 5 2HB PHE 5 2.843 -4.777 5.901
30 2HB PHE 5 1HB PHE 5 2.828 -4.501 7.641
31 HD1 PHE 5 HD1 PHE 5 1.403 -6.056 8.640
32 HD2 PHE 5 HD2 PHE 5 0.175 -4.118 5.007
33 HE1 PHE 5 HE1 PHE 5 -0.812 -7.159 8.798
34 HE2 PHE 5 HE2 PHE 5 -2.037 -5.222 5.167
35 HZ PHE 5 HZ PHE 5 -2.532 -6.742 7.061
36 H GLY 6 H GLY 6 0.069 -1.320 6.353
37 1HA GLY 6 2HA GLY 6 -1.554 -0.965 8.189
38 2HA GLY 6 1HA GLY 6 -0.215 -1.124 9.325
39 H LYS 7 H LYS 7 -0.539 0.794 6.318
40 HA LYS 7 HA LYS 7 -0.303 3.303 7.914
41 1HB LYS 7 2HB LYS 7 1.712 2.030 6.165
42 2HB LYS 7 1HB LYS 7 1.442 3.742 5.836
43 1HG LYS 7 2HG LYS 7 2.231 4.407 7.896
44 2HG LYS 7 1HG LYS 7 1.711 2.923 8.693
45 1HD LYS 7 2HD LYS 7 3.594 2.004 6.901
46 2HD LYS 7 1HD LYS 7 4.272 3.553 7.401
47 1HE LYS 7 2HE LYS 7 3.174 1.750 9.534
48 2HE LYS 7 1HE LYS 7 4.754 1.358 8.828
49 1HZ LYS 7 1HZ LYS 7 5.012 2.896 10.676
50 2HZ LYS 7 2HZ LYS 7 3.951 4.000 9.940
51 3HZ LYS 7 3HZ LYS 7 5.451 3.649 9.222
52 H GLY 8 H GLY 8 -1.615 4.874 7.052
53 1HA GLY 8 2HA GLY 8 -3.332 4.321 4.821
54 2HA GLY 8 1HA GLY 8 -3.173 5.884 5.619
55 H CYS 9 H CYS 9 -3.108 4.791 2.676
56 HA CYS 9 HA CYS 9 -0.924 6.628 1.795
57 1HB CYS 9 2HB CYS 9 -0.344 4.847 0.073
58 2HB CYS 9 1HB CYS 9 0.047 4.419 1.737
59 H ASN 10 H ASN 10 -1.177 6.557 -0.870
60 HA ASN 10 HA ASN 10 -4.057 7.228 -1.363
61 1HB ASN 10 2HB ASN 10 -1.828 8.768 -1.565
62 2HB ASN 10 1HB ASN 10 -1.896 8.116 -3.202
63 1HD2 ASN 10 1HD2 ASN 10 -3.876 9.885 -0.779
64 2HD2 ASN 10 2HD2 ASN 10 -4.882 10.632 -1.924
65 HA PRO 11 HA PRO 11 -4.206 3.846 -4.215
66 1HB PRO 11 2HB PRO 11 -6.310 4.685 -5.760
67 2HB PRO 11 1HB PRO 11 -6.509 4.018 -4.127
68 1HG PRO 11 2HG PRO 11 -6.501 6.859 -5.022
69 2HG PRO 11 1HG PRO 11 -7.526 6.057 -3.820
70 1HD PRO 11 2HD PRO 11 -5.410 7.614 -3.146
71 2HD PRO 11 1HD PRO 11 -5.953 6.240 -2.158
72 H SER 12 H SER 12 -4.236 7.185 -5.481
73 HA SER 12 HA SER 12 -3.303 6.380 -8.146
74 1HB SER 12 2HB SER 12 -3.271 8.818 -8.499
75 2HB SER 12 1HB SER 12 -4.763 8.346 -7.692
76 HG SER 12 HG SER 12 -2.613 9.830 -6.775
77 H ASN 13 H ASN 13 -1.871 7.463 -5.111
78 HA ASN 13 HA ASN 13 0.844 7.471 -6.380
79 1HB ASN 13 2HB ASN 13 -0.169 9.537 -5.214
80 2HB ASN 13 1HB ASN 13 0.015 8.639 -3.709
81 1HD2 ASN 13 1HD2 ASN 13 1.471 11.068 -4.189
82 2HD2 ASN 13 2HD2 ASN 13 3.121 10.684 -4.311
83 H ASP 14 H ASP 14 0.303 4.967 -6.088
84 HA ASP 14 HA ASP 14 0.361 3.782 -3.470
85 1HB ASP 14 2HB ASP 14 1.307 2.703 -6.151
86 2HB ASP 14 1HB ASP 14 0.877 1.734 -4.743
87 H GLN 15 H GLN 15 2.049 4.033 -2.061
88 HA GLN 15 HA GLN 15 4.830 3.725 -3.118
89 1HB GLN 15 2HB GLN 15 5.474 5.654 -1.662
90 2HB GLN 15 1HB GLN 15 4.332 6.113 -2.924
91 1HG GLN 15 2HG GLN 15 2.575 6.387 -1.430
92 2HG GLN 15 1HG GLN 15 3.253 5.252 -0.263
93 1HE2 GLN 15 1HE2 GLN 15 3.285 8.610 -1.326
94 2HE2 GLN 15 2HE2 GLN 15 4.282 9.188 -0.079
95 H CYS 16 H CYS 16 3.180 1.778 -1.705
96 HA CYS 16 HA CYS 16 3.839 1.712 1.117
97 1HB CYS 16 2HB CYS 16 3.033 -0.437 -0.873
98 2HB CYS 16 1HB CYS 16 3.048 -0.651 0.876
99 H CYS 17 H CYS 17 5.285 -0.037 2.060
100 HA CYS 17 HA CYS 17 7.943 0.106 0.954
101 1HB CYS 17 2HB CYS 17 6.549 -1.363 3.176
102 2HB CYS 17 1HB CYS 17 8.204 -1.806 2.761
103 H LYS 18 H LYS 18 8.924 -1.210 -0.516
104 HA LYS 18 HA LYS 18 7.410 -3.325 -1.849
105 1HB LYS 18 2HB LYS 18 9.387 -3.390 -3.294
106 2HB LYS 18 1HB LYS 18 8.951 -1.714 -2.967
107 1HG LYS 18 2HG LYS 18 11.016 -1.352 -2.149
108 2HG LYS 18 1HG LYS 18 10.711 -2.543 -0.886
109 1HD LYS 18 2HD LYS 18 12.433 -3.674 -1.853
110 2HD LYS 18 1HD LYS 18 11.213 -4.171 -3.026
111 1HE LYS 18 2HE LYS 18 12.678 -3.257 -4.543
112 2HE LYS 18 1HE LYS 18 11.947 -1.722 -4.034
113 1HZ LYS 18 1HZ LYS 18 14.349 -1.640 -3.777
114 2HZ LYS 18 2HZ LYS 18 14.318 -3.022 -2.790
115 3HZ LYS 18 3HZ LYS 18 13.597 -1.578 -2.258
116 H SER 19 H SER 19 9.433 -3.283 0.926
117 HA SER 19 HA SER 19 10.864 -5.729 0.741
118 1HB SER 19 2HB SER 19 10.359 -3.707 2.611
119 2HB SER 19 1HB SER 19 9.750 -5.167 3.385
120 HG SER 19 HG SER 19 11.728 -5.853 3.582
121 H SER 20 H SER 20 7.524 -5.106 1.879
122 HA SER 20 HA SER 20 7.061 -8.065 1.987
123 1HB SER 20 2HB SER 20 6.699 -6.558 3.997
124 2HB SER 20 1HB SER 20 5.388 -5.796 3.103
125 HG SER 20 HG SER 20 4.198 -7.541 3.350
126 H ASN 21 H ASN 21 6.857 -5.874 -0.355
127 HA ASN 21 HA ASN 21 5.457 -5.496 -2.212
128 1HB ASN 21 2HB ASN 21 6.029 -8.037 -2.084
129 2HB ASN 21 1HB ASN 21 4.352 -8.234 -1.580
130 1HD2 ASN 21 1HD2 ASN 21 4.633 -9.486 -3.872
131 2HD2 ASN 21 2HD2 ASN 21 4.159 -8.572 -5.221
132 H LEU 22 H LEU 22 4.327 -4.016 -0.410
133 HA LEU 22 HA LEU 22 1.557 -4.944 0.176
134 1HB LEU 22 2HB LEU 22 3.219 -2.555 1.038
135 2HB LEU 22 1HB LEU 22 1.571 -2.859 1.589
136 HG LEU 22 HG LEU 22 3.673 -4.997 1.869
137 1HD1 LEU 22 1HD1 LEU 22 4.121 -4.124 4.156
138 2HD1 LEU 22 2HD1 LEU 22 3.159 -2.696 3.777
139 3HD1 LEU 22 3HD1 LEU 22 4.657 -3.009 2.900
140 1HD2 LEU 22 1HD2 LEU 22 1.353 -5.624 2.283
141 2HD2 LEU 22 2HD2 LEU 22 1.143 -4.252 3.371
142 3HD2 LEU 22 3HD2 LEU 22 2.214 -5.578 3.822
143 H VAL 23 H VAL 23 -0.269 -3.624 -0.440
144 HA VAL 23 HA VAL 23 0.261 -1.665 -2.654
145 HB VAL 23 HB VAL 23 -1.809 -2.651 -3.719
146 1HG1 VAL 23 1HG1 VAL 23 0.549 -3.335 -4.310
147 2HG1 VAL 23 2HG1 VAL 23 -0.668 -4.570 -4.632
148 3HG1 VAL 23 3HG1 VAL 23 0.365 -4.699 -3.208
149 1HG2 VAL 23 1HG2 VAL 23 -2.650 -3.637 -1.528
150 2HG2 VAL 23 2HG2 VAL 23 -1.422 -4.889 -1.710
151 3HG2 VAL 23 3HG2 VAL 23 -2.706 -4.731 -2.909
152 H CYS 24 H CYS 24 -1.241 0.091 -2.762
153 HA CYS 24 HA CYS 24 -2.494 0.806 -0.219
154 1HB CYS 24 2HB CYS 24 -1.299 2.246 -2.066
155 2HB CYS 24 1HB CYS 24 -2.888 2.248 -2.831
156 H SER 25 H SER 25 -4.437 -0.114 0.315
157 HA SER 25 HA SER 25 -6.302 -1.174 -1.655
158 1HB SER 25 2HB SER 25 -5.820 -1.915 0.769
159 2HB SER 25 1HB SER 25 -6.823 -0.554 1.262
160 HG SER 25 HG SER 25 -8.079 -2.421 1.057
161 H ARG 26 H ARG 26 -8.389 -0.318 -2.167
162 HA ARG 26 HA ARG 26 -8.587 2.632 -1.987
163 1HB ARG 26 2HB ARG 26 -10.278 2.341 -3.699
164 2HB ARG 26 1HB ARG 26 -8.928 1.277 -4.091
165 1HG ARG 26 2HG ARG 26 -10.135 -0.612 -3.007
166 2HG ARG 26 1HG ARG 26 -11.501 0.461 -2.704
167 1HD ARG 26 2HD ARG 26 -10.514 0.383 -5.513
168 2HD ARG 26 1HD ARG 26 -11.341 -1.074 -4.927
169 HE ARG 26 HE ARG 26 -12.916 1.061 -4.034
170 1HH1 ARG 26 1HH2 ARG 26 -13.882 -1.038 -5.966
171 2HH1 ARG 26 2HH2 ARG 26 -14.287 -0.086 -7.354
172 1HH2 ARG 26 2HH1 ARG 26 -12.504 2.702 -6.289
173 2HH2 ARG 26 1HH1 ARG 26 -13.504 2.039 -7.538
174 H ALA 27 H ALA 27 -9.933 -0.160 -0.404
175 HA ALA 27 HA ALA 27 -12.457 0.999 0.419
176 1HB ALA 27 1HB ALA 27 -12.621 -0.994 1.727
177 2HB ALA 27 2HB ALA 27 -10.867 -1.165 1.811
178 3HB ALA 27 3HB ALA 27 -11.710 -1.457 0.289
179 H HIS 28 H HIS 28 -9.322 0.568 2.082
180 HA HIS 28 HA HIS 28 -10.221 2.561 4.138
181 1HB HIS 28 2HB HIS 28 -8.567 0.069 4.151
182 2HB HIS 28 1HB HIS 28 -8.173 1.325 5.325
183 HD1 HIS 28 HD1 HIS 28 -9.724 1.602 7.306
184 HD2 HIS 28 HD2 HIS 28 -11.317 -0.908 4.383
185 HE1 HIS 28 HE1 HIS 28 -11.828 0.596 8.294
186 H ARG 29 H ARG 29 -8.266 2.355 1.416
187 HA ARG 29 HA ARG 29 -6.462 3.641 0.615
188 1HB ARG 29 2HB ARG 29 -8.108 5.241 2.446
189 2HB ARG 29 1HB ARG 29 -6.466 5.861 2.289
190 1HG ARG 29 2HG ARG 29 -7.713 6.908 0.544
191 2HG ARG 29 1HG ARG 29 -6.771 5.640 -0.240
192 1HD ARG 29 2HD ARG 29 -8.918 5.289 -1.149
193 2HD ARG 29 1HD ARG 29 -8.920 4.164 0.223
194 HE ARG 29 HE ARG 29 -9.869 6.316 1.479
195 1HH1 ARG 29 2HH1 ARG 29 -10.387 7.793 -1.057
196 2HH1 ARG 29 1HH1 ARG 29 -12.021 7.351 -1.422
197 1HH2 ARG 29 1HH2 ARG 29 -12.047 4.626 0.734
198 2HH2 ARG 29 2HH2 ARG 29 -12.963 5.554 -0.406
199 H TRP 30 H TRP 30 -5.378 1.658 1.977
200 HA TRP 30 HA TRP 30 -3.146 2.913 3.477
201 1HB TRP 30 2HB TRP 30 -3.512 1.628 5.452
202 2HB TRP 30 1HB TRP 30 -5.102 2.252 5.019
203 HD1 TRP 30 HD1 TRP 30 -6.365 0.414 3.132
204 HE1 TRP 30 HE1 TRP 30 -6.714 -2.106 3.537
205 HE3 TRP 30 HE3 TRP 30 -2.803 -0.396 6.690
206 HZ2 TRP 30 HZ2 TRP 30 -5.621 -4.192 5.158
207 HZ3 TRP 30 HZ3 TRP 30 -2.475 -2.658 7.646
208 HH2 TRP 30 HH2 TRP 30 -3.878 -4.555 6.886
209 H CYS 31 H CYS 31 -1.407 1.233 3.914
210 HA CYS 31 HA CYS 31 -0.957 -0.379 1.509
211 1HB CYS 31 2HB CYS 31 0.579 0.168 4.066
212 2HB CYS 31 1HB CYS 31 1.205 -0.870 2.786
213 H LYS 32 H LYS 32 -2.198 -2.237 1.442
214 HA LYS 32 HA LYS 32 -2.343 -3.948 3.892
215 1HB LYS 32 2HB LYS 32 -4.327 -4.868 2.850
216 2HB LYS 32 1HB LYS 32 -4.422 -3.114 2.720
217 1HG LYS 32 2HG LYS 32 -3.841 -3.137 0.422
218 2HG LYS 32 1HG LYS 32 -3.242 -4.793 0.503
219 1HD LYS 32 2HD LYS 32 -6.126 -4.154 1.107
220 2HD LYS 32 1HD LYS 32 -5.578 -4.407 -0.550
221 1HE LYS 32 2HE LYS 32 -4.892 -6.655 -0.090
222 2HE LYS 32 1HE LYS 32 -5.026 -6.408 1.662
223 1HZ LYS 32 1HZ LYS 32 -6.995 -7.523 0.787
224 2HZ LYS 32 2HZ LYS 32 -7.271 -6.233 -0.283
225 3HZ LYS 32 3HZ LYS 32 -7.391 -5.991 1.395
226 H TYR 33 H TYR 33 -2.221 -6.353 3.440
227 HA TYR 33 HA TYR 33 -0.105 -6.911 1.393
228 1HB TYR 33 2HB TYR 33 0.434 -7.265 3.796
229 2HB TYR 33 1HB TYR 33 -0.913 -8.397 3.920
230 HD1 TYR 33 HD1 TYR 33 -0.285 -10.635 3.879
231 HD2 TYR 33 HD2 TYR 33 1.924 -7.804 1.522
232 HE1 TYR 33 HE1 TYR 33 1.165 -12.463 3.040
233 HE2 TYR 33 HE2 TYR 33 3.374 -9.632 0.684
234 HH TYR 33 HH TYR 33 2.751 -12.561 0.564
235 H GLU 34 H GLU 34 -0.376 -8.735 0.009
236 HA GLU 34 HA GLU 34 -3.140 -9.436 -0.627
237 1HB GLU 34 2HB GLU 34 -0.880 -9.148 -2.048
238 2HB GLU 34 1HB GLU 34 -0.794 -10.888 -1.769
239 1HG GLU 34 2HG GLU 34 -2.914 -11.258 -2.814
240 2HG GLU 34 1HG GLU 34 -3.285 -9.533 -2.825
241 H ILE 35 H ILE 35 -3.929 -11.674 -0.700
242 HA ILE 35 HA ILE 35 -3.345 -13.178 1.714
243 HB ILE 35 HB ILE 35 -4.980 -13.773 -0.779
244 1HG1 ILE 35 2HG1 ILE 35 -6.051 -13.014 1.933
245 2HG1 ILE 35 1HG1 ILE 35 -5.487 -11.759 0.831
246 1HG2 ILE 35 1HG2 ILE 35 -4.679 -15.218 1.852
247 2HG2 ILE 35 2HG2 ILE 35 -4.667 -15.885 0.219
248 3HG2 ILE 35 3HG2 ILE 35 -6.180 -15.325 0.931
249 1HD1 ILE 35 1HD1 ILE 35 -7.844 -13.572 0.592
250 2HD1 ILE 35 2HD1 ILE 35 -7.002 -13.138 -0.896
251 3HD1 ILE 35 3HD1 ILE 35 -7.679 -11.877 0.135
252 1HN NH2 36 1HN NH2 36 -1.181 -14.383 -1.501
253 2HN NH2 36 2HN NH2 36 -2.104 -12.877 -1.310
Start of MODEL 6
1 1H GLU 1 1H GLU 1 11.479 9.055 -0.761
2 2H GLU 1 2H GLU 1 9.784 9.171 -0.769
3 3H GLU 1 3H GLU 1 10.583 8.273 -1.970
4 HA GLU 1 HA GLU 1 11.363 6.689 -0.281
5 1HB GLU 1 2HB GLU 1 9.989 8.782 1.382
6 2HB GLU 1 1HB GLU 1 10.032 7.120 1.973
7 1HG GLU 1 2HG GLU 1 12.525 7.133 1.628
8 2HG GLU 1 1HG GLU 1 12.413 8.850 1.240
9 H CYS 2 H CYS 2 10.117 4.802 -0.216
10 HA CYS 2 HA CYS 2 7.290 5.045 -1.160
11 1HB CYS 2 2HB CYS 2 7.632 2.751 -1.931
12 2HB CYS 2 1HB CYS 2 8.988 3.742 -2.464
13 H LEU 3 H LEU 3 5.758 3.365 -0.225
14 HA LEU 3 HA LEU 3 6.171 3.152 2.729
15 1HB LEU 3 2HB LEU 3 3.733 3.014 0.922
16 2HB LEU 3 1HB LEU 3 3.671 2.826 2.674
17 HG LEU 3 HG LEU 3 4.872 5.259 1.327
18 1HD1 LEU 3 1HD1 LEU 3 2.773 6.408 1.727
19 2HD1 LEU 3 2HD1 LEU 3 2.088 4.975 2.494
20 3HD1 LEU 3 3HD1 LEU 3 2.439 4.968 0.765
21 1HD2 LEU 3 1HD2 LEU 3 5.584 4.876 3.641
22 2HD2 LEU 3 2HD2 LEU 3 3.906 4.680 4.147
23 3HD2 LEU 3 3HD2 LEU 3 4.479 6.250 3.584
24 H GLY 4 H GLY 4 5.548 1.113 3.784
25 1HA GLY 4 2HA GLY 4 5.671 -1.260 1.963
26 2HA GLY 4 1HA GLY 4 6.572 -1.203 3.477
27 H PHE 5 H PHE 5 5.438 -3.062 4.275
28 HA PHE 5 HA PHE 5 2.536 -3.131 4.485
29 1HB PHE 5 2HB PHE 5 3.972 -5.132 4.358
30 2HB PHE 5 1HB PHE 5 4.750 -4.680 5.874
31 HD1 PHE 5 HD1 PHE 5 3.863 -5.415 7.917
32 HD2 PHE 5 HD2 PHE 5 1.381 -5.429 4.410
33 HE1 PHE 5 HE1 PHE 5 2.074 -6.570 9.187
34 HE2 PHE 5 HE2 PHE 5 -0.407 -6.585 5.680
35 HZ PHE 5 HZ PHE 5 -0.061 -7.155 8.069
36 H GLY 6 H GLY 6 1.260 -2.476 6.213
37 1HA GLY 6 2HA GLY 6 0.695 -1.614 8.335
38 2HA GLY 6 1HA GLY 6 2.357 -1.903 8.848
39 H LYS 7 H LYS 7 1.332 0.053 6.057
40 HA LYS 7 HA LYS 7 2.303 2.505 7.488
41 1HB LYS 7 2HB LYS 7 3.045 1.337 4.803
42 2HB LYS 7 1HB LYS 7 3.248 3.059 5.125
43 1HG LYS 7 2HG LYS 7 4.359 1.956 7.374
44 2HG LYS 7 1HG LYS 7 4.789 0.761 6.150
45 1HD LYS 7 2HD LYS 7 6.397 2.121 5.361
46 2HD LYS 7 1HD LYS 7 5.198 3.376 5.047
47 1HE LYS 7 2HE LYS 7 5.366 3.888 7.593
48 2HE LYS 7 1HE LYS 7 6.880 2.965 7.521
49 1HZ LYS 7 1HZ LYS 7 6.152 5.287 5.810
50 2HZ LYS 7 2HZ LYS 7 7.561 4.353 5.632
51 3HZ LYS 7 3HZ LYS 7 7.322 5.276 7.037
52 H GLY 8 H GLY 8 0.798 4.129 7.370
53 1HA GLY 8 2HA GLY 8 -1.666 3.828 5.924
54 2HA GLY 8 1HA GLY 8 -1.130 5.303 6.726
55 H CYS 9 H CYS 9 -2.195 4.445 3.868
56 HA CYS 9 HA CYS 9 -0.451 6.376 2.416
57 1HB CYS 9 2HB CYS 9 -0.115 4.802 0.608
58 2HB CYS 9 1HB CYS 9 0.323 3.983 2.106
59 H ASN 10 H ASN 10 -1.533 6.615 0.058
60 HA ASN 10 HA ASN 10 -4.465 7.031 0.529
61 1HB ASN 10 2HB ASN 10 -2.259 8.582 -0.566
62 2HB ASN 10 1HB ASN 10 -3.588 8.476 -1.721
63 1HD2 ASN 10 1HD2 ASN 10 -4.762 10.398 -1.481
64 2HD2 ASN 10 2HD2 ASN 10 -5.275 11.034 0.007
65 HA PRO 11 HA PRO 11 -5.147 3.979 -2.617
66 1HB PRO 11 2HB PRO 11 -7.783 4.534 -3.120
67 2HB PRO 11 1HB PRO 11 -7.235 3.651 -1.682
68 1HG PRO 11 2HG PRO 11 -8.032 6.503 -1.962
69 2HG PRO 11 1HG PRO 11 -8.336 5.369 -0.637
70 1HD PRO 11 2HD PRO 11 -6.399 7.291 -0.561
71 2HD PRO 11 1HD PRO 11 -6.305 5.763 0.342
72 H SER 12 H SER 12 -6.287 7.338 -3.149
73 HA SER 12 HA SER 12 -6.483 7.186 -6.016
74 1HB SER 12 2HB SER 12 -7.331 8.933 -4.262
75 2HB SER 12 1HB SER 12 -5.741 9.664 -4.461
76 HG SER 12 HG SER 12 -6.320 10.349 -6.367
77 H ASN 13 H ASN 13 -3.889 8.565 -3.938
78 HA ASN 13 HA ASN 13 -2.016 8.361 -6.263
79 1HB ASN 13 2HB ASN 13 -2.586 10.494 -4.763
80 2HB ASN 13 1HB ASN 13 -1.382 9.775 -3.694
81 1HD2 ASN 13 1HD2 ASN 13 0.785 9.200 -4.820
82 2HD2 ASN 13 2HD2 ASN 13 1.319 10.240 -6.050
83 H ASP 14 H ASP 14 -2.287 5.908 -5.465
84 HA ASP 14 HA ASP 14 -0.961 5.033 -3.079
85 1HB ASP 14 2HB ASP 14 -1.013 2.837 -4.225
86 2HB ASP 14 1HB ASP 14 -2.543 3.687 -4.420
87 H GLN 15 H GLN 15 1.188 4.903 -2.615
88 HA GLN 15 HA GLN 15 3.166 4.856 -4.861
89 1HB GLN 15 2HB GLN 15 2.539 7.135 -3.584
90 2HB GLN 15 1HB GLN 15 3.715 6.508 -2.429
91 1HG GLN 15 2HG GLN 15 5.455 6.916 -3.818
92 2HG GLN 15 1HG GLN 15 4.604 6.252 -5.213
93 1HE2 GLN 15 1HE2 GLN 15 5.435 9.210 -3.540
94 2HE2 GLN 15 2HE2 GLN 15 4.661 10.268 -4.618
95 H CYS 16 H CYS 16 2.325 2.634 -3.272
96 HA CYS 16 HA CYS 16 4.178 2.207 -1.054
97 1HB CYS 16 2HB CYS 16 1.792 1.131 -2.021
98 2HB CYS 16 1HB CYS 16 2.968 -0.155 -2.287
99 H CYS 17 H CYS 17 5.952 0.703 -1.063
100 HA CYS 17 HA CYS 17 7.616 0.718 -3.414
101 1HB CYS 17 2HB CYS 17 7.751 0.058 -0.644
102 2HB CYS 17 1HB CYS 17 8.329 -1.347 -1.538
103 H LYS 18 H LYS 18 7.870 -0.840 -5.011
104 HA LYS 18 HA LYS 18 5.831 -2.957 -5.204
105 1HB LYS 18 2HB LYS 18 6.744 -3.199 -7.467
106 2HB LYS 18 1HB LYS 18 6.518 -1.491 -7.101
107 1HG LYS 18 2HG LYS 18 9.145 -2.308 -6.237
108 2HG LYS 18 1HG LYS 18 8.911 -2.780 -7.919
109 1HD LYS 18 2HD LYS 18 8.003 -0.048 -7.131
110 2HD LYS 18 1HD LYS 18 9.742 -0.320 -7.241
111 1HE LYS 18 2HE LYS 18 8.611 -1.555 -9.535
112 2HE LYS 18 1HE LYS 18 7.855 0.044 -9.394
113 1HZ LYS 18 1HZ LYS 18 10.048 1.016 -9.069
114 2HZ LYS 18 2HZ LYS 18 9.977 0.193 -10.553
115 3HZ LYS 18 3HZ LYS 18 10.773 -0.510 -9.228
116 H SER 19 H SER 19 8.745 -2.868 -3.589
117 HA SER 19 HA SER 19 10.139 -5.216 -4.395
118 1HB SER 19 2HB SER 19 10.836 -3.394 -2.771
119 2HB SER 19 1HB SER 19 9.771 -4.136 -1.581
120 HG SER 19 HG SER 19 11.396 -5.401 -1.188
121 H SER 20 H SER 20 7.557 -4.812 -1.937
122 HA SER 20 HA SER 20 7.253 -7.783 -1.808
123 1HB SER 20 2HB SER 20 7.625 -6.365 0.246
124 2HB SER 20 1HB SER 20 6.074 -5.595 -0.070
125 HG SER 20 HG SER 20 6.667 -8.217 0.730
126 H ASN 21 H ASN 21 5.986 -5.328 -3.629
127 HA ASN 21 HA ASN 21 3.992 -5.050 -4.842
128 1HB ASN 21 2HB ASN 21 4.702 -7.745 -4.725
129 2HB ASN 21 1HB ASN 21 2.993 -7.751 -4.295
130 1HD2 ASN 21 1HD2 ASN 21 1.447 -6.984 -5.912
131 2HD2 ASN 21 2HD2 ASN 21 1.899 -6.773 -7.535
132 H LEU 22 H LEU 22 3.531 -3.770 -2.640
133 HA LEU 22 HA LEU 22 1.294 -4.981 -1.094
134 1HB LEU 22 2HB LEU 22 3.012 -2.500 -0.852
135 2HB LEU 22 1HB LEU 22 1.640 -2.802 0.215
136 HG LEU 22 HG LEU 22 3.408 -5.127 -0.060
137 1HD1 LEU 22 1HD1 LEU 22 5.185 -4.124 1.403
138 2HD1 LEU 22 2HD1 LEU 22 4.465 -2.540 1.115
139 3HD1 LEU 22 3HD1 LEU 22 5.157 -3.451 -0.227
140 1HD2 LEU 22 1HD2 LEU 22 2.227 -3.504 2.210
141 2HD2 LEU 22 2HD2 LEU 22 3.256 -4.911 2.477
142 3HD2 LEU 22 3HD2 LEU 22 1.715 -5.092 1.640
143 H VAL 23 H VAL 23 -0.709 -3.708 -0.783
144 HA VAL 23 HA VAL 23 -1.311 -1.855 -3.066
145 HB VAL 23 HB VAL 23 -3.588 -2.937 -3.063
146 1HG1 VAL 23 1HG1 VAL 23 -2.882 -4.907 -4.282
147 2HG1 VAL 23 2HG1 VAL 23 -1.314 -4.899 -3.474
148 3HG1 VAL 23 3HG1 VAL 23 -1.727 -3.615 -4.610
149 1HG2 VAL 23 1HG2 VAL 23 -3.316 -3.816 -0.674
150 2HG2 VAL 23 2HG2 VAL 23 -2.289 -5.077 -1.355
151 3HG2 VAL 23 3HG2 VAL 23 -3.980 -4.959 -1.840
152 H CYS 24 H CYS 24 -2.565 -0.052 -2.540
153 HA CYS 24 HA CYS 24 -2.774 0.636 0.309
154 1HB CYS 24 2HB CYS 24 -3.094 1.956 -2.359
155 2HB CYS 24 1HB CYS 24 -3.863 2.721 -0.969
156 H SER 25 H SER 25 -4.525 -0.049 1.467
157 HA SER 25 HA SER 25 -7.069 -0.726 0.114
158 1HB SER 25 2HB SER 25 -5.940 -0.973 2.910
159 2HB SER 25 1HB SER 25 -7.611 -1.388 2.542
160 HG SER 25 HG SER 25 -6.624 -3.249 2.147
161 H ARG 26 H ARG 26 -9.018 0.399 0.458
162 HA ARG 26 HA ARG 26 -8.767 3.191 1.375
163 1HB ARG 26 2HB ARG 26 -9.990 2.328 -0.700
164 2HB ARG 26 1HB ARG 26 -11.221 1.707 0.400
165 1HG ARG 26 2HG ARG 26 -12.125 3.755 0.655
166 2HG ARG 26 1HG ARG 26 -10.556 4.454 1.056
167 1HD ARG 26 2HD ARG 26 -10.101 4.296 -1.523
168 2HD ARG 26 1HD ARG 26 -11.868 4.195 -1.644
169 HE ARG 26 HE ARG 26 -10.342 6.505 -0.577
170 1HH1 ARG 26 2HH1 ARG 26 -12.653 6.216 1.197
171 2HH1 ARG 26 1HH1 ARG 26 -13.913 7.061 0.360
172 1HH2 ARG 26 1HH2 ARG 26 -12.259 7.042 -2.697
173 2HH2 ARG 26 2HH2 ARG 26 -13.689 7.530 -1.851
174 H ALA 27 H ALA 27 -9.852 0.160 2.710
175 HA ALA 27 HA ALA 27 -11.866 1.017 4.526
176 1HB ALA 27 1HB ALA 27 -11.589 -1.296 4.261
177 2HB ALA 27 2HB ALA 27 -10.857 -1.022 5.842
178 3HB ALA 27 3HB ALA 27 -9.834 -1.198 4.416
179 H HIS 28 H HIS 28 -8.367 0.572 5.166
180 HA HIS 28 HA HIS 28 -8.638 2.488 7.463
181 1HB HIS 28 2HB HIS 28 -7.144 -0.064 6.991
182 2HB HIS 28 1HB HIS 28 -6.426 1.127 8.075
183 HD1 HIS 28 HD1 HIS 28 -7.240 -1.356 9.469
184 HD2 HIS 28 HD2 HIS 28 -9.979 1.712 8.783
185 HE1 HIS 28 HE1 HIS 28 -9.101 -1.664 11.158
186 H ARG 29 H ARG 29 -7.825 2.812 4.422
187 HA ARG 29 HA ARG 29 -6.192 3.989 3.178
188 1HB ARG 29 2HB ARG 29 -6.429 5.397 5.846
189 2HB ARG 29 1HB ARG 29 -5.493 6.074 4.514
190 1HG ARG 29 2HG ARG 29 -7.541 5.873 3.064
191 2HG ARG 29 1HG ARG 29 -8.447 5.402 4.503
192 1HD ARG 29 2HD ARG 29 -7.391 7.621 5.509
193 2HD ARG 29 1HD ARG 29 -7.279 8.073 3.797
194 HE ARG 29 HE ARG 29 -9.851 7.106 4.993
195 1HH1 ARG 29 2HH1 ARG 29 -9.551 10.024 5.205
196 2HH1 ARG 29 1HH1 ARG 29 -10.211 10.600 3.711
197 1HH2 ARG 29 1HH2 ARG 29 -10.024 7.509 2.132
198 2HH2 ARG 29 2HH2 ARG 29 -10.479 9.172 1.966
199 H TRP 30 H TRP 30 -4.929 1.748 3.871
200 HA TRP 30 HA TRP 30 -2.201 2.663 4.602
201 1HB TRP 30 2HB TRP 30 -1.987 1.106 6.397
202 2HB TRP 30 1HB TRP 30 -3.549 1.877 6.644
203 HD1 TRP 30 HD1 TRP 30 -5.580 0.401 5.119
204 HE1 TRP 30 HE1 TRP 30 -6.025 -2.128 5.349
205 HE3 TRP 30 HE3 TRP 30 -1.117 -1.097 7.086
206 HZ2 TRP 30 HZ2 TRP 30 -4.663 -4.478 6.251
207 HZ3 TRP 30 HZ3 TRP 30 -0.715 -3.483 7.621
208 HH2 TRP 30 HH2 TRP 30 -2.480 -5.174 7.207
209 H CYS 31 H CYS 31 -0.622 0.737 4.261
210 HA CYS 31 HA CYS 31 -1.395 -0.615 1.718
211 1HB CYS 31 2HB CYS 31 0.812 0.858 2.554
212 2HB CYS 31 1HB CYS 31 1.384 -0.809 2.615
213 H LYS 32 H LYS 32 -1.546 -2.824 1.605
214 HA LYS 32 HA LYS 32 -0.462 -4.479 3.845
215 1HB LYS 32 2HB LYS 32 -2.652 -5.639 3.953
216 2HB LYS 32 1HB LYS 32 -2.823 -3.921 4.304
217 1HG LYS 32 2HG LYS 32 -4.118 -3.565 2.481
218 2HG LYS 32 1HG LYS 32 -3.069 -4.529 1.443
219 1HD LYS 32 2HD LYS 32 -5.158 -5.689 1.514
220 2HD LYS 32 1HD LYS 32 -4.071 -6.590 2.571
221 1HE LYS 32 2HE LYS 32 -5.205 -5.976 4.487
222 2HE LYS 32 1HE LYS 32 -5.673 -4.397 3.827
223 1HZ LYS 32 1HZ LYS 32 -7.199 -5.492 2.323
224 2HZ LYS 32 2HZ LYS 32 -7.564 -5.935 3.922
225 3HZ LYS 32 3HZ LYS 32 -6.739 -7.017 2.906
226 H TYR 33 H TYR 33 -0.372 -6.823 3.226
227 HA TYR 33 HA TYR 33 0.103 -7.124 0.287
228 1HB TYR 33 2HB TYR 33 1.971 -7.474 1.927
229 2HB TYR 33 1HB TYR 33 1.050 -8.799 2.638
230 HD1 TYR 33 HD1 TYR 33 1.941 -10.865 2.011
231 HD2 TYR 33 HD2 TYR 33 1.720 -7.709 -0.895
232 HE1 TYR 33 HE1 TYR 33 2.807 -12.406 0.271
233 HE2 TYR 33 HE2 TYR 33 2.585 -9.249 -2.633
234 HH TYR 33 HH TYR 33 2.532 -11.940 -2.900
235 H GLU 34 H GLU 34 -1.969 -7.739 -0.457
236 HA GLU 34 HA GLU 34 -3.138 -10.214 0.776
237 1HB GLU 34 2HB GLU 34 -4.330 -7.870 0.744
238 2HB GLU 34 1HB GLU 34 -4.649 -8.259 -0.946
239 1HG GLU 34 2HG GLU 34 -6.542 -9.097 0.203
240 2HG GLU 34 1HG GLU 34 -5.537 -10.521 -0.063
241 H ILE 35 H ILE 35 -2.105 -11.760 -0.538
242 HA ILE 35 HA ILE 35 -2.759 -11.616 -3.461
243 HB ILE 35 HB ILE 35 -0.342 -11.130 -2.715
244 1HG1 ILE 35 2HG1 ILE 35 0.311 -13.213 -4.448
245 2HG1 ILE 35 1HG1 ILE 35 -1.369 -12.850 -4.841
246 1HG2 ILE 35 1HG2 ILE 35 -0.272 -14.136 -2.354
247 2HG2 ILE 35 2HG2 ILE 35 -0.349 -13.002 -1.005
248 3HG2 ILE 35 3HG2 ILE 35 1.042 -12.991 -2.088
249 1HD1 ILE 35 1HD1 ILE 35 -0.889 -10.695 -5.532
250 2HD1 ILE 35 2HD1 ILE 35 0.627 -11.487 -5.960
251 3HD1 ILE 35 3HD1 ILE 35 0.511 -10.553 -4.469
252 1HN NH2 36 1HN NH2 36 -2.610 -15.260 -3.616
253 2HN NH2 36 2HN NH2 36 -1.640 -13.877 -4.167
Start of MODEL 7
1 1H GLU 1 1H GLU 1 12.451 6.142 0.228
2 2H GLU 1 2H GLU 1 13.679 5.832 1.360
3 3H GLU 1 3H GLU 1 12.090 6.129 1.885
4 HA GLU 1 HA GLU 1 12.980 3.767 0.300
5 1HB GLU 1 2HB GLU 1 13.352 4.392 2.969
6 2HB GLU 1 1HB GLU 1 11.849 3.469 3.002
7 1HG GLU 1 2HG GLU 1 13.449 1.773 3.159
8 2HG GLU 1 1HG GLU 1 13.147 1.820 1.422
9 H CYS 2 H CYS 2 11.193 2.070 0.383
10 HA CYS 2 HA CYS 2 8.713 3.138 -0.627
11 1HB CYS 2 2HB CYS 2 8.062 0.730 -0.596
12 2HB CYS 2 1HB CYS 2 9.663 0.975 -1.290
13 H LEU 3 H LEU 3 6.539 2.459 0.360
14 HA LEU 3 HA LEU 3 6.507 3.213 3.238
15 1HB LEU 3 2HB LEU 3 4.365 2.914 1.102
16 2HB LEU 3 1HB LEU 3 4.057 3.477 2.744
17 HG LEU 3 HG LEU 3 6.123 4.819 0.998
18 1HD1 LEU 3 1HD1 LEU 3 3.321 5.874 1.266
19 2HD1 LEU 3 2HD1 LEU 3 3.684 4.678 0.021
20 3HD1 LEU 3 3HD1 LEU 3 4.530 6.225 0.030
21 1HD2 LEU 3 1HD2 LEU 3 6.102 5.277 3.440
22 2HD2 LEU 3 2HD2 LEU 3 4.414 5.776 3.321
23 3HD2 LEU 3 3HD2 LEU 3 5.670 6.710 2.507
24 H GLY 4 H GLY 4 6.497 1.543 4.700
25 1HA GLY 4 2HA GLY 4 5.781 -1.175 3.885
26 2HA GLY 4 1HA GLY 4 6.310 -0.682 5.492
27 H PHE 5 H PHE 5 4.488 -2.178 6.137
28 HA PHE 5 HA PHE 5 1.732 -1.485 5.615
29 1HB PHE 5 2HB PHE 5 2.590 -3.711 6.333
30 2HB PHE 5 1HB PHE 5 3.011 -3.025 7.902
31 HD1 PHE 5 HD1 PHE 5 1.507 -3.582 9.584
32 HD2 PHE 5 HD2 PHE 5 0.023 -2.862 5.617
33 HE1 PHE 5 HE1 PHE 5 -0.808 -3.968 10.380
34 HE2 PHE 5 HE2 PHE 5 -2.292 -3.248 6.414
35 HZ PHE 5 HZ PHE 5 -2.708 -3.800 8.794
36 H GLY 6 H GLY 6 0.424 -0.020 6.668
37 1HA GLY 6 2HA GLY 6 -0.226 1.127 8.774
38 2HA GLY 6 1HA GLY 6 1.493 1.300 9.134
39 H LYS 7 H LYS 7 2.393 2.123 6.566
40 HA LYS 7 HA LYS 7 1.740 4.955 6.636
41 1HB LYS 7 2HB LYS 7 3.373 3.112 4.882
42 2HB LYS 7 1HB LYS 7 3.202 4.823 4.490
43 1HG LYS 7 2HG LYS 7 3.920 4.200 7.306
44 2HG LYS 7 1HG LYS 7 5.161 3.869 6.097
45 1HD LYS 7 2HD LYS 7 5.541 6.069 5.721
46 2HD LYS 7 1HD LYS 7 3.818 6.448 5.691
47 1HE LYS 7 2HE LYS 7 4.974 5.743 8.353
48 2HE LYS 7 1HE LYS 7 5.420 7.320 7.673
49 1HZ LYS 7 1HZ LYS 7 3.070 7.751 7.242
50 2HZ LYS 7 2HZ LYS 7 3.344 7.485 8.897
51 3HZ LYS 7 3HZ LYS 7 2.653 6.262 7.943
52 H GLY 8 H GLY 8 1.148 6.043 4.411
53 1HA GLY 8 2HA GLY 8 -0.921 4.421 2.995
54 2HA GLY 8 1HA GLY 8 -1.303 6.043 3.567
55 H CYS 9 H CYS 9 -1.318 5.070 0.802
56 HA CYS 9 HA CYS 9 0.422 7.168 -0.371
57 1HB CYS 9 2HB CYS 9 1.806 5.712 -1.494
58 2HB CYS 9 1HB CYS 9 1.391 4.651 -0.151
59 H ASN 10 H ASN 10 -0.005 6.990 -2.966
60 HA ASN 10 HA ASN 10 -2.910 7.323 -3.287
61 1HB ASN 10 2HB ASN 10 -0.552 7.545 -5.191
62 2HB ASN 10 1HB ASN 10 -2.197 8.056 -5.567
63 1HD2 ASN 10 1HD2 ASN 10 0.640 9.430 -4.798
64 2HD2 ASN 10 2HD2 ASN 10 0.121 10.721 -3.826
65 HA PRO 11 HA PRO 11 -3.669 3.281 -4.906
66 1HB PRO 11 2HB PRO 11 -5.918 3.797 -6.381
67 2HB PRO 11 1HB PRO 11 -5.919 3.714 -4.609
68 1HG PRO 11 2HG PRO 11 -5.903 6.095 -6.392
69 2HG PRO 11 1HG PRO 11 -6.750 5.838 -4.858
70 1HD PRO 11 2HD PRO 11 -4.452 7.296 -5.093
71 2HD PRO 11 1HD PRO 11 -4.937 6.452 -3.606
72 H SER 12 H SER 12 -3.972 5.953 -7.293
73 HA SER 12 HA SER 12 -3.454 4.315 -9.613
74 1HB SER 12 2HB SER 12 -3.251 6.502 -10.718
75 2HB SER 12 1HB SER 12 -4.595 6.533 -9.580
76 HG SER 12 HG SER 12 -3.452 7.791 -8.247
77 H ASN 13 H ASN 13 -1.359 6.452 -7.646
78 HA ASN 13 HA ASN 13 1.036 5.223 -8.972
79 1HB ASN 13 2HB ASN 13 0.293 7.826 -8.884
80 2HB ASN 13 1HB ASN 13 1.201 7.739 -7.374
81 1HD2 ASN 13 1HD2 ASN 13 1.494 7.201 -10.905
82 2HD2 ASN 13 2HD2 ASN 13 3.187 7.329 -10.942
83 H ASP 14 H ASP 14 0.374 3.462 -7.240
84 HA ASP 14 HA ASP 14 1.000 4.099 -4.452
85 1HB ASP 14 2HB ASP 14 0.482 1.734 -4.109
86 2HB ASP 14 1HB ASP 14 -0.708 2.438 -5.202
87 H GLN 15 H GLN 15 2.803 3.353 -3.267
88 HA GLN 15 HA GLN 15 5.065 2.118 -4.769
89 1HB GLN 15 2HB GLN 15 6.546 3.910 -3.755
90 2HB GLN 15 1HB GLN 15 5.408 4.510 -4.959
91 1HG GLN 15 2HG GLN 15 3.913 5.327 -3.242
92 2HG GLN 15 1HG GLN 15 4.864 4.551 -1.975
93 1HE2 GLN 15 1HE2 GLN 15 6.981 5.504 -1.445
94 2HE2 GLN 15 2HE2 GLN 15 7.365 7.087 -1.923
95 H CYS 16 H CYS 16 3.359 0.898 -2.831
96 HA CYS 16 HA CYS 16 4.390 1.013 -0.146
97 1HB CYS 16 2HB CYS 16 2.224 -0.039 -1.363
98 2HB CYS 16 1HB CYS 16 3.206 -1.499 -1.235
99 H CYS 17 H CYS 17 5.525 -0.898 0.910
100 HA CYS 17 HA CYS 17 7.983 -1.535 -0.518
101 1HB CYS 17 2HB CYS 17 6.765 -2.383 2.127
102 2HB CYS 17 1HB CYS 17 8.390 -2.844 1.620
103 H LYS 18 H LYS 18 8.548 -3.479 -1.503
104 HA LYS 18 HA LYS 18 6.366 -5.391 -2.074
105 1HB LYS 18 2HB LYS 18 8.203 -4.307 -3.632
106 2HB LYS 18 1HB LYS 18 9.201 -5.634 -3.037
107 1HG LYS 18 2HG LYS 18 8.233 -6.661 -4.871
108 2HG LYS 18 1HG LYS 18 7.043 -7.068 -3.635
109 1HD LYS 18 2HD LYS 18 5.446 -5.816 -4.625
110 2HD LYS 18 1HD LYS 18 6.538 -4.444 -4.816
111 1HE LYS 18 2HE LYS 18 7.584 -6.072 -6.701
112 2HE LYS 18 1HE LYS 18 5.900 -6.629 -6.740
113 1HZ LYS 18 1HZ LYS 18 6.790 -3.794 -6.893
114 2HZ LYS 18 2HZ LYS 18 5.175 -4.326 -6.905
115 3HZ LYS 18 3HZ LYS 18 6.211 -4.715 -8.194
116 H SER 19 H SER 19 8.544 -5.137 0.443
117 HA SER 19 HA SER 19 9.682 -7.764 0.638
118 1HB SER 19 2HB SER 19 8.923 -5.618 2.634
119 2HB SER 19 1HB SER 19 9.776 -7.087 3.105
120 HG SER 19 HG SER 19 10.641 -4.882 1.667
121 H SER 20 H SER 20 6.638 -6.392 1.942
122 HA SER 20 HA SER 20 5.769 -9.163 2.683
123 1HB SER 20 2HB SER 20 5.827 -6.720 4.051
124 2HB SER 20 1HB SER 20 4.133 -6.942 3.626
125 HG SER 20 HG SER 20 5.804 -8.465 5.265
126 H ASN 21 H ASN 21 5.558 -7.537 -0.033
127 HA ASN 21 HA ASN 21 3.964 -7.295 -1.756
128 1HB ASN 21 2HB ASN 21 3.948 -9.806 -0.798
129 2HB ASN 21 1HB ASN 21 2.287 -9.368 -0.403
130 1HD2 ASN 21 1HD2 ASN 21 4.298 -10.501 -2.926
131 2HD2 ASN 21 2HD2 ASN 21 3.226 -10.239 -4.215
132 H LEU 22 H LEU 22 3.585 -5.285 0.036
133 HA LEU 22 HA LEU 22 0.796 -5.288 1.029
134 1HB LEU 22 2HB LEU 22 3.185 -3.441 1.158
135 2HB LEU 22 1HB LEU 22 1.601 -2.926 1.736
136 HG LEU 22 HG LEU 22 2.564 -5.585 2.670
137 1HD1 LEU 22 1HD1 LEU 22 3.683 -2.954 3.685
138 2HD1 LEU 22 2HD1 LEU 22 4.597 -4.230 2.881
139 3HD1 LEU 22 3HD1 LEU 22 3.897 -4.516 4.475
140 1HD2 LEU 22 1HD2 LEU 22 0.382 -4.647 3.349
141 2HD2 LEU 22 2HD2 LEU 22 1.195 -3.227 4.006
142 3HD2 LEU 22 3HD2 LEU 22 1.455 -4.809 4.740
143 H VAL 23 H VAL 23 -0.872 -4.096 0.097
144 HA VAL 23 HA VAL 23 -0.245 -2.649 -2.461
145 HB VAL 23 HB VAL 23 -2.557 -3.350 -3.123
146 1HG1 VAL 23 1HG1 VAL 23 -1.839 -5.399 -3.877
147 2HG1 VAL 23 2HG1 VAL 23 -1.221 -5.885 -2.298
148 3HG1 VAL 23 3HG1 VAL 23 -0.293 -4.773 -3.304
149 1HG2 VAL 23 1HG2 VAL 23 -3.874 -4.779 -1.780
150 2HG2 VAL 23 2HG2 VAL 23 -3.250 -3.596 -0.631
151 3HG2 VAL 23 3HG2 VAL 23 -2.517 -5.196 -0.735
152 H CYS 24 H CYS 24 -1.395 -0.674 -2.844
153 HA CYS 24 HA CYS 24 -2.281 0.715 -0.383
154 1HB CYS 24 2HB CYS 24 -1.052 1.350 -2.913
155 2HB CYS 24 1HB CYS 24 -2.486 2.352 -2.692
156 H SER 25 H SER 25 -4.399 1.279 0.029
157 HA SER 25 HA SER 25 -6.485 0.280 -1.853
158 1HB SER 25 2HB SER 25 -6.378 -0.354 0.594
159 2HB SER 25 1HB SER 25 -6.702 1.332 0.986
160 HG SER 25 HG SER 25 -8.722 0.935 0.616
161 H ARG 26 H ARG 26 -8.070 1.687 -2.704
162 HA ARG 26 HA ARG 26 -7.362 4.544 -2.802
163 1HB ARG 26 2HB ARG 26 -9.047 4.608 -4.539
164 2HB ARG 26 1HB ARG 26 -8.122 3.123 -4.748
165 1HG ARG 26 2HG ARG 26 -10.082 2.246 -3.070
166 2HG ARG 26 1HG ARG 26 -10.957 3.488 -3.967
167 1HD ARG 26 2HD ARG 26 -10.204 2.437 -6.105
168 2HD ARG 26 1HD ARG 26 -9.437 1.142 -5.164
169 HE ARG 26 HE ARG 26 -12.375 1.715 -5.152
170 1HH1 ARG 26 1HH1 ARG 26 -11.136 0.280 -2.756
171 2HH1 ARG 26 2HH1 ARG 26 -11.408 -1.377 -3.182
172 1HH2 ARG 26 1HH2 ARG 26 -12.089 -0.682 -6.518
173 2HH2 ARG 26 2HH2 ARG 26 -11.949 -1.923 -5.317
174 H ALA 27 H ALA 27 -9.522 2.544 -0.949
175 HA ALA 27 HA ALA 27 -11.569 4.502 -0.382
176 1HB ALA 27 1HB ALA 27 -10.608 2.092 1.189
177 2HB ALA 27 2HB ALA 27 -11.775 2.037 -0.132
178 3HB ALA 27 3HB ALA 27 -12.177 2.880 1.364
179 H HIS 28 H HIS 28 -8.716 3.403 1.479
180 HA HIS 28 HA HIS 28 -8.947 5.889 3.148
181 1HB HIS 28 2HB HIS 28 -8.987 3.228 3.873
182 2HB HIS 28 1HB HIS 28 -7.291 3.647 4.115
183 HD1 HIS 28 HD1 HIS 28 -6.754 4.812 6.254
184 HD2 HIS 28 HD2 HIS 28 -10.790 5.186 5.276
185 HE1 HIS 28 HE1 HIS 28 -7.854 6.008 8.196
186 H ARG 29 H ARG 29 -7.231 4.841 0.550
187 HA ARG 29 HA ARG 29 -5.068 5.254 -0.302
188 1HB ARG 29 2HB ARG 29 -5.773 7.539 1.528
189 2HB ARG 29 1HB ARG 29 -4.198 7.518 0.734
190 1HG ARG 29 2HG ARG 29 -5.848 6.884 -1.355
191 2HG ARG 29 1HG ARG 29 -6.883 7.961 -0.418
192 1HD ARG 29 2HD ARG 29 -5.142 9.700 -0.437
193 2HD ARG 29 1HD ARG 29 -4.055 8.616 -1.328
194 HE ARG 29 HE ARG 29 -6.401 8.633 -2.833
195 1HH1 ARG 29 1HH1 ARG 29 -6.574 11.477 -1.718
196 2HH1 ARG 29 2HH1 ARG 29 -5.776 12.372 -2.968
197 1HH2 ARG 29 1HH2 ARG 29 -4.338 9.565 -4.427
198 2HH2 ARG 29 2HH2 ARG 29 -4.507 11.287 -4.505
199 H TRP 30 H TRP 30 -5.106 3.340 1.818
200 HA TRP 30 HA TRP 30 -2.507 3.930 3.185
201 1HB TRP 30 2HB TRP 30 -3.377 3.037 5.180
202 2HB TRP 30 1HB TRP 30 -4.747 3.920 4.517
203 HD1 TRP 30 HD1 TRP 30 -6.186 2.130 2.656
204 HE1 TRP 30 HE1 TRP 30 -7.113 -0.186 3.299
205 HE3 TRP 30 HE3 TRP 30 -3.285 1.128 6.727
206 HZ2 TRP 30 HZ2 TRP 30 -6.678 -2.201 5.283
207 HZ3 TRP 30 HZ3 TRP 30 -3.558 -0.996 7.976
208 HH2 TRP 30 HH2 TRP 30 -5.250 -2.660 7.259
209 H CYS 31 H CYS 31 -1.247 1.963 3.718
210 HA CYS 31 HA CYS 31 -1.342 -0.003 1.508
211 1HB CYS 31 2HB CYS 31 0.583 1.035 3.509
212 2HB CYS 31 1HB CYS 31 0.784 -0.666 3.094
213 H LYS 32 H LYS 32 -1.905 -2.156 1.784
214 HA LYS 32 HA LYS 32 -2.254 -3.247 4.531
215 1HB LYS 32 2HB LYS 32 -4.579 -3.859 4.033
216 2HB LYS 32 1HB LYS 32 -4.366 -2.121 3.837
217 1HG LYS 32 2HG LYS 32 -4.151 -2.396 1.404
218 2HG LYS 32 1HG LYS 32 -4.301 -4.146 1.576
219 1HD LYS 32 2HD LYS 32 -6.558 -3.908 2.470
220 2HD LYS 32 1HD LYS 32 -6.416 -2.150 2.436
221 1HE LYS 32 2HE LYS 32 -6.077 -2.289 -0.062
222 2HE LYS 32 1HE LYS 32 -6.448 -4.021 0.042
223 1HZ LYS 32 1HZ LYS 32 -8.551 -3.520 1.057
224 2HZ LYS 32 2HZ LYS 32 -8.435 -2.642 -0.393
225 3HZ LYS 32 3HZ LYS 32 -8.199 -1.861 1.097
226 H TYR 33 H TYR 33 -2.363 -5.594 4.546
227 HA TYR 33 HA TYR 33 -1.305 -6.841 2.033
228 1HB TYR 33 2HB TYR 33 0.169 -6.872 4.006
229 2HB TYR 33 1HB TYR 33 -1.104 -7.631 4.961
230 HD1 TYR 33 HD1 TYR 33 -0.670 -9.881 5.360
231 HD2 TYR 33 HD2 TYR 33 0.314 -8.215 1.526
232 HE1 TYR 33 HE1 TYR 33 0.073 -12.114 4.580
233 HE2 TYR 33 HE2 TYR 33 1.058 -10.447 0.746
234 HH TYR 33 HH TYR 33 1.963 -12.757 2.379
235 H GLU 34 H GLU 34 -3.063 -7.712 0.963
236 HA GLU 34 HA GLU 34 -5.362 -8.835 2.402
237 1HB GLU 34 2HB GLU 34 -6.262 -9.086 0.177
238 2HB GLU 34 1HB GLU 34 -5.380 -7.560 0.202
239 1HG GLU 34 2HG GLU 34 -3.359 -8.996 -0.631
240 2HG GLU 34 1HG GLU 34 -4.596 -10.171 -1.079
241 H ILE 35 H ILE 35 -6.094 -11.120 1.889
242 HA ILE 35 HA ILE 35 -3.932 -13.016 2.389
243 HB ILE 35 HB ILE 35 -5.821 -14.635 2.418
244 1HG1 ILE 35 2HG1 ILE 35 -8.072 -12.963 2.268
245 2HG1 ILE 35 1HG1 ILE 35 -7.090 -12.524 0.870
246 1HG2 ILE 35 1HG2 ILE 35 -5.250 -13.034 4.345
247 2HG2 ILE 35 2HG2 ILE 35 -6.841 -13.794 4.381
248 3HG2 ILE 35 3HG2 ILE 35 -6.675 -12.121 3.848
249 1HD1 ILE 35 1HD1 ILE 35 -8.612 -14.366 0.296
250 2HD1 ILE 35 2HD1 ILE 35 -7.959 -15.333 1.618
251 3HD1 ILE 35 3HD1 ILE 35 -6.938 -14.917 0.241
252 1HN NH2 36 1HN NH2 36 -4.332 -15.189 -0.509
253 2HN NH2 36 2HN NH2 36 -4.764 -15.192 1.215
Start of MODEL 8
1 1H GLU 1 1H GLU 1 -10.620 8.971 -0.710
2 2H GLU 1 2H GLU 1 -11.346 9.564 -2.127
3 3H GLU 1 3H GLU 1 -9.655 9.579 -1.965
4 HA GLU 1 HA GLU 1 -11.366 7.146 -2.152
5 1HB GLU 1 2HB GLU 1 -10.400 8.979 -4.068
6 2HB GLU 1 1HB GLU 1 -9.325 7.585 -4.174
7 1HG GLU 1 2HG GLU 1 -12.298 7.159 -4.042
8 2HG GLU 1 1HG GLU 1 -11.546 7.604 -5.574
9 H CYS 2 H CYS 2 -10.295 5.239 -1.629
10 HA CYS 2 HA CYS 2 -7.695 5.443 -0.269
11 1HB CYS 2 2HB CYS 2 -8.175 3.163 0.369
12 2HB CYS 2 1HB CYS 2 -9.693 4.053 0.451
13 H LEU 3 H LEU 3 -5.989 3.717 -0.837
14 HA LEU 3 HA LEU 3 -5.521 3.784 -3.781
15 1HB LEU 3 2HB LEU 3 -3.725 3.080 -1.432
16 2HB LEU 3 1HB LEU 3 -3.196 3.285 -3.100
17 HG LEU 3 HG LEU 3 -4.612 5.471 -1.554
18 1HD1 LEU 3 1HD1 LEU 3 -2.605 6.274 -0.745
19 2HD1 LEU 3 2HD1 LEU 3 -1.666 5.548 -2.050
20 3HD1 LEU 3 3HD1 LEU 3 -2.247 4.548 -0.719
21 1HD2 LEU 3 1HD2 LEU 3 -4.573 6.494 -3.562
22 2HD2 LEU 3 2HD2 LEU 3 -3.749 5.108 -4.276
23 3HD2 LEU 3 3HD2 LEU 3 -2.812 6.412 -3.547
24 H GLY 4 H GLY 4 -5.385 1.888 -4.994
25 1HA GLY 4 2HA GLY 4 -6.041 -0.650 -3.563
26 2HA GLY 4 1HA GLY 4 -6.370 -0.341 -5.268
27 H PHE 5 H PHE 5 -5.191 -2.415 -5.612
28 HA PHE 5 HA PHE 5 -2.340 -2.585 -5.024
29 1HB PHE 5 2HB PHE 5 -3.867 -4.530 -5.240
30 2HB PHE 5 1HB PHE 5 -4.134 -4.126 -6.935
31 HD1 PHE 5 HD1 PHE 5 -2.666 -4.916 -8.600
32 HD2 PHE 5 HD2 PHE 5 -1.438 -4.981 -4.483
33 HE1 PHE 5 HE1 PHE 5 -0.633 -6.190 -9.226
34 HE2 PHE 5 HE2 PHE 5 0.594 -6.255 -5.111
35 HZ PHE 5 HZ PHE 5 0.997 -6.859 -7.481
36 H GLY 6 H GLY 6 -0.697 -1.742 -6.250
37 1HA GLY 6 2HA GLY 6 0.430 -1.169 -8.292
38 2HA GLY 6 1HA GLY 6 -1.118 -1.228 -9.136
39 H LYS 7 H LYS 7 -0.154 0.562 -6.193
40 HA LYS 7 HA LYS 7 -0.529 3.137 -7.652
41 1HB LYS 7 2HB LYS 7 -2.458 1.872 -5.993
42 2HB LYS 7 1HB LYS 7 -1.811 3.223 -5.064
43 1HG LYS 7 2HG LYS 7 -2.667 3.553 -7.941
44 2HG LYS 7 1HG LYS 7 -3.813 3.718 -6.611
45 1HD LYS 7 2HD LYS 7 -2.878 5.678 -5.863
46 2HD LYS 7 1HD LYS 7 -1.251 5.213 -6.354
47 1HE LYS 7 2HE LYS 7 -3.222 5.636 -8.554
48 2HE LYS 7 1HE LYS 7 -2.654 7.082 -7.696
49 1HZ LYS 7 1HZ LYS 7 -1.151 6.482 -9.511
50 2HZ LYS 7 2HZ LYS 7 -0.909 4.950 -8.819
51 3HZ LYS 7 3HZ LYS 7 -0.379 6.346 -8.007
52 H GLY 8 H GLY 8 1.035 4.579 -7.007
53 1HA GLY 8 2HA GLY 8 3.008 3.861 -5.035
54 2HA GLY 8 1HA GLY 8 2.879 5.432 -5.825
55 H CYS 9 H CYS 9 3.153 4.431 -2.883
56 HA CYS 9 HA CYS 9 1.252 6.438 -1.768
57 1HB CYS 9 2HB CYS 9 0.699 4.683 0.019
58 2HB CYS 9 1HB CYS 9 0.026 4.390 -1.582
59 H ASN 10 H ASN 10 1.756 6.385 0.830
60 HA ASN 10 HA ASN 10 4.731 6.674 1.053
61 1HB ASN 10 2HB ASN 10 2.322 8.087 2.099
62 2HB ASN 10 1HB ASN 10 3.722 8.018 3.169
63 1HD2 ASN 10 1HD2 ASN 10 5.267 9.631 2.823
64 2HD2 ASN 10 2HD2 ASN 10 5.436 10.521 1.387
65 HA PRO 11 HA PRO 11 4.623 3.256 3.878
66 1HB PRO 11 2HB PRO 11 7.092 3.618 5.010
67 2HB PRO 11 1HB PRO 11 6.858 2.942 3.385
68 1HG PRO 11 2HG PRO 11 7.624 5.703 4.192
69 2HG PRO 11 1HG PRO 11 8.205 4.718 2.839
70 1HD PRO 11 2HD PRO 11 6.375 6.717 2.559
71 2HD PRO 11 1HD PRO 11 6.451 5.300 1.488
72 H SER 12 H SER 12 5.706 6.458 5.067
73 HA SER 12 HA SER 12 5.171 5.918 7.865
74 1HB SER 12 2HB SER 12 6.677 7.684 6.755
75 2HB SER 12 1HB SER 12 5.201 8.598 6.455
76 HG SER 12 HG SER 12 6.581 8.152 8.794
77 H ASN 13 H ASN 13 3.351 7.591 5.282
78 HA ASN 13 HA ASN 13 0.949 7.679 7.064
79 1HB ASN 13 2HB ASN 13 2.109 9.706 5.829
80 2HB ASN 13 1HB ASN 13 1.248 9.091 4.419
81 1HD2 ASN 13 1HD2 ASN 13 0.914 11.055 7.209
82 2HD2 ASN 13 2HD2 ASN 13 -0.777 11.198 7.189
83 H ASP 14 H ASP 14 0.990 5.211 6.415
84 HA ASP 14 HA ASP 14 0.328 4.356 3.764
85 1HB ASP 14 2HB ASP 14 1.146 2.949 5.665
86 2HB ASP 14 1HB ASP 14 -0.422 3.141 6.446
87 H GLN 15 H GLN 15 -1.432 5.172 2.691
88 HA GLN 15 HA GLN 15 -4.047 5.294 4.163
89 1HB GLN 15 2HB GLN 15 -2.662 7.107 2.204
90 2HB GLN 15 1HB GLN 15 -4.426 7.088 2.248
91 1HG GLN 15 2HG GLN 15 -4.152 7.350 4.817
92 2HG GLN 15 1HG GLN 15 -2.502 7.844 4.442
93 1HE2 GLN 15 1HE2 GLN 15 -5.927 8.714 3.933
94 2HE2 GLN 15 2HE2 GLN 15 -5.620 10.320 3.479
95 H CYS 16 H CYS 16 -3.148 2.918 2.886
96 HA CYS 16 HA CYS 16 -4.379 2.796 0.204
97 1HB CYS 16 2HB CYS 16 -2.260 1.583 1.363
98 2HB CYS 16 1HB CYS 16 -3.498 0.370 1.690
99 H CYS 17 H CYS 17 -5.964 0.942 -0.197
100 HA CYS 17 HA CYS 17 -8.238 1.172 1.608
101 1HB CYS 17 2HB CYS 17 -7.696 0.439 -1.066
102 2HB CYS 17 1HB CYS 17 -8.390 -0.996 -0.315
103 H LYS 18 H LYS 18 -8.381 0.027 3.483
104 HA LYS 18 HA LYS 18 -6.700 -2.260 4.086
105 1HB LYS 18 2HB LYS 18 -8.815 -0.609 5.369
106 2HB LYS 18 1HB LYS 18 -8.597 -2.232 6.024
107 1HG LYS 18 2HG LYS 18 -6.667 -1.650 7.031
108 2HG LYS 18 1HG LYS 18 -6.030 -0.965 5.537
109 1HD LYS 18 2HD LYS 18 -8.133 0.581 6.997
110 2HD LYS 18 1HD LYS 18 -6.501 0.568 7.665
111 1HE LYS 18 2HE LYS 18 -5.607 1.326 5.466
112 2HE LYS 18 1HE LYS 18 -7.268 1.408 4.845
113 1HZ LYS 18 1HZ LYS 18 -6.573 3.556 5.724
114 2HZ LYS 18 2HZ LYS 18 -6.234 2.853 7.232
115 3HZ LYS 18 3HZ LYS 18 -7.833 2.912 6.658
116 H SER 19 H SER 19 -9.796 -1.936 2.529
117 HA SER 19 HA SER 19 -11.026 -4.423 3.231
118 1HB SER 19 2HB SER 19 -11.945 -2.368 1.993
119 2HB SER 19 1HB SER 19 -11.165 -3.016 0.553
120 HG SER 19 HG SER 19 -13.498 -3.696 1.622
121 H SER 20 H SER 20 -8.634 -3.593 0.719
122 HA SER 20 HA SER 20 -8.623 -6.355 -0.346
123 1HB SER 20 2HB SER 20 -7.238 -3.748 -0.995
124 2HB SER 20 1HB SER 20 -6.818 -5.250 -1.814
125 HG SER 20 HG SER 20 -8.557 -5.029 -2.958
126 H ASN 21 H ASN 21 -7.299 -5.035 2.380
127 HA ASN 21 HA ASN 21 -5.447 -5.554 3.737
128 1HB ASN 21 2HB ASN 21 -5.958 -8.002 2.047
129 2HB ASN 21 1HB ASN 21 -4.653 -7.995 3.232
130 1HD2 ASN 21 1HD2 ASN 21 -5.512 -9.257 4.929
131 2HD2 ASN 21 2HD2 ASN 21 -6.993 -8.935 5.695
132 H LEU 22 H LEU 22 -4.633 -3.805 1.833
133 HA LEU 22 HA LEU 22 -2.157 -4.975 0.609
134 1HB LEU 22 2HB LEU 22 -3.852 -2.533 -0.008
135 2HB LEU 22 1HB LEU 22 -2.327 -2.887 -0.819
136 HG LEU 22 HG LEU 22 -4.659 -4.820 -0.737
137 1HD1 LEU 22 1HD1 LEU 22 -3.831 -2.843 -2.883
138 2HD1 LEU 22 2HD1 LEU 22 -5.333 -2.815 -1.961
139 3HD1 LEU 22 3HD1 LEU 22 -5.026 -4.122 -3.104
140 1HD2 LEU 22 1HD2 LEU 22 -2.023 -4.699 -2.217
141 2HD2 LEU 22 2HD2 LEU 22 -3.352 -5.729 -2.749
142 3HD2 LEU 22 3HD2 LEU 22 -2.619 -5.982 -1.165
143 H VAL 23 H VAL 23 -0.155 -3.891 0.960
144 HA VAL 23 HA VAL 23 -0.171 -1.766 3.083
145 HB VAL 23 HB VAL 23 1.910 -2.887 3.928
146 1HG1 VAL 23 1HG1 VAL 23 -0.437 -3.383 4.781
147 2HG1 VAL 23 2HG1 VAL 23 0.763 -4.638 5.087
148 3HG1 VAL 23 3HG1 VAL 23 -0.402 -4.833 3.778
149 1HG2 VAL 23 1HG2 VAL 23 2.476 -4.001 1.745
150 2HG2 VAL 23 2HG2 VAL 23 1.130 -5.108 2.011
151 3HG2 VAL 23 3HG2 VAL 23 2.500 -5.104 3.120
152 H CYS 24 H CYS 24 1.451 -0.153 2.869
153 HA CYS 24 HA CYS 24 2.462 0.265 0.138
154 1HB CYS 24 2HB CYS 24 1.446 1.959 1.816
155 2HB CYS 24 1HB CYS 24 3.024 1.925 2.601
156 H SER 25 H SER 25 4.442 -0.479 -0.504
157 HA SER 25 HA SER 25 6.400 -1.437 1.495
158 1HB SER 25 2HB SER 25 7.510 -2.327 -0.523
159 2HB SER 25 1HB SER 25 5.797 -2.732 -0.533
160 HG SER 25 HG SER 25 7.252 -1.003 -2.147
161 H ARG 26 H ARG 26 8.789 -0.847 0.976
162 HA ARG 26 HA ARG 26 8.970 2.121 0.649
163 1HB ARG 26 2HB ARG 26 9.723 0.797 2.735
164 2HB ARG 26 1HB ARG 26 11.065 0.232 1.738
165 1HG ARG 26 2HG ARG 26 11.786 2.524 1.331
166 2HG ARG 26 1HG ARG 26 10.386 3.152 2.201
167 1HD ARG 26 2HD ARG 26 11.222 2.489 4.291
168 2HD ARG 26 1HD ARG 26 12.284 1.256 3.582
169 HE ARG 26 HE ARG 26 13.733 3.061 2.757
170 1HH1 ARG 26 2HH1 ARG 26 11.612 5.230 2.724
171 2HH1 ARG 26 1HH1 ARG 26 12.096 6.206 4.070
172 1HH2 ARG 26 1HH2 ARG 26 14.177 3.777 5.425
173 2HH2 ARG 26 2HH2 ARG 26 13.552 5.383 5.602
174 H ALA 27 H ALA 27 10.347 -0.944 -0.539
175 HA ALA 27 HA ALA 27 12.495 0.009 -2.098
176 1HB ALA 27 1HB ALA 27 12.399 -2.289 -2.023
177 2HB ALA 27 2HB ALA 27 11.572 -2.067 -3.565
178 3HB ALA 27 3HB ALA 27 10.636 -2.315 -2.090
179 H HIS 28 H HIS 28 9.158 -0.604 -3.235
180 HA HIS 28 HA HIS 28 9.684 1.126 -5.611
181 1HB HIS 28 2HB HIS 28 7.805 -1.095 -4.875
182 2HB HIS 28 1HB HIS 28 7.334 0.025 -6.153
183 HD1 HIS 28 HD1 HIS 28 7.611 -1.981 -7.870
184 HD2 HIS 28 HD2 HIS 28 11.136 -0.793 -5.988
185 HE1 HIS 28 HE1 HIS 28 9.512 -3.010 -9.190
186 H ARG 29 H ARG 29 8.239 1.316 -2.527
187 HA ARG 29 HA ARG 29 6.832 2.907 -1.521
188 1HB ARG 29 2HB ARG 29 8.484 4.140 -3.451
189 2HB ARG 29 1HB ARG 29 6.884 4.848 -3.673
190 1HG ARG 29 2HG ARG 29 6.882 5.035 -1.066
191 2HG ARG 29 1HG ARG 29 8.630 4.863 -1.225
192 1HD ARG 29 2HD ARG 29 8.016 6.744 -3.178
193 2HD ARG 29 1HD ARG 29 6.941 7.180 -1.836
194 HE ARG 29 HE ARG 29 9.800 7.485 -1.814
195 1HH1 ARG 29 2HH1 ARG 29 7.484 8.552 0.049
196 2HH1 ARG 29 1HH1 ARG 29 8.076 7.998 1.580
197 1HH2 ARG 29 1HH2 ARG 29 10.417 5.833 0.188
198 2HH2 ARG 29 2HH2 ARG 29 9.743 6.452 1.659
199 H TRP 30 H TRP 30 5.361 0.939 -2.670
200 HA TRP 30 HA TRP 30 2.973 2.399 -3.655
201 1HB TRP 30 2HB TRP 30 2.807 1.116 -5.665
202 2HB TRP 30 1HB TRP 30 4.490 1.628 -5.583
203 HD1 TRP 30 HD1 TRP 30 5.996 -0.330 -4.012
204 HE1 TRP 30 HE1 TRP 30 6.084 -2.856 -4.512
205 HE3 TRP 30 HE3 TRP 30 1.725 -0.823 -6.754
206 HZ2 TRP 30 HZ2 TRP 30 4.540 -4.827 -5.896
207 HZ3 TRP 30 HZ3 TRP 30 1.055 -3.034 -7.651
208 HH2 TRP 30 HH2 TRP 30 2.456 -5.034 -7.226
209 H CYS 31 H CYS 31 1.063 0.805 -3.765
210 HA CYS 31 HA CYS 31 1.080 -0.823 -1.304
211 1HB CYS 31 2HB CYS 31 -0.712 0.846 -2.488
212 2HB CYS 31 1HB CYS 31 -1.298 -0.712 -3.073
213 H LYS 32 H LYS 32 1.292 -3.015 -1.297
214 HA LYS 32 HA LYS 32 0.669 -4.552 -3.786
215 1HB LYS 32 2HB LYS 32 2.820 -5.751 -3.488
216 2HB LYS 32 1HB LYS 32 3.079 -4.024 -3.716
217 1HG LYS 32 2HG LYS 32 3.953 -3.764 -1.639
218 2HG LYS 32 1HG LYS 32 2.715 -4.779 -0.898
219 1HD LYS 32 2HD LYS 32 4.517 -6.170 -0.583
220 2HD LYS 32 1HD LYS 32 4.074 -6.690 -2.209
221 1HE LYS 32 2HE LYS 32 5.680 -4.527 -2.761
222 2HE LYS 32 1HE LYS 32 6.457 -5.192 -1.311
223 1HZ LYS 32 1HZ LYS 32 7.271 -6.332 -3.267
224 2HZ LYS 32 2HZ LYS 32 5.687 -6.718 -3.746
225 3HZ LYS 32 3HZ LYS 32 6.343 -7.402 -2.334
226 H TYR 33 H TYR 33 0.675 -6.993 -3.248
227 HA TYR 33 HA TYR 33 -0.508 -7.405 -0.521
228 1HB TYR 33 2HB TYR 33 -2.023 -7.646 -2.485
229 2HB TYR 33 1HB TYR 33 -0.957 -8.893 -3.134
230 HD1 TYR 33 HD1 TYR 33 -2.632 -8.065 0.131
231 HD2 TYR 33 HD2 TYR 33 -1.567 -11.101 -2.715
232 HE1 TYR 33 HE1 TYR 33 -3.765 -9.771 1.528
233 HE2 TYR 33 HE2 TYR 33 -2.702 -12.807 -1.319
234 HH TYR 33 HH TYR 33 -3.271 -12.772 1.522
235 H GLU 34 H GLU 34 0.315 -9.080 0.736
236 HA GLU 34 HA GLU 34 2.891 -10.253 -0.072
237 1HB GLU 34 2HB GLU 34 1.886 -9.357 2.255
238 2HB GLU 34 1HB GLU 34 1.420 -11.052 2.403
239 1HG GLU 34 2HG GLU 34 3.839 -11.621 1.792
240 2HG GLU 34 1HG GLU 34 4.200 -9.914 2.056
241 H ILE 35 H ILE 35 3.168 -12.351 -0.794
242 HA ILE 35 HA ILE 35 0.727 -14.061 -1.052
243 HB ILE 35 HB ILE 35 3.438 -14.128 -2.425
244 1HG1 ILE 35 2HG1 ILE 35 2.185 -12.139 -3.067
245 2HG1 ILE 35 1HG1 ILE 35 2.130 -13.295 -4.396
246 1HG2 ILE 35 1HG2 ILE 35 2.177 -15.624 -4.047
247 2HG2 ILE 35 2HG2 ILE 35 0.893 -15.715 -2.842
248 3HG2 ILE 35 3HG2 ILE 35 2.500 -16.337 -2.466
249 1HD1 ILE 35 1HD1 ILE 35 -0.091 -14.100 -3.249
250 2HD1 ILE 35 2HD1 ILE 35 -0.110 -12.640 -4.237
251 3HD1 ILE 35 3HD1 ILE 35 -0.052 -12.514 -2.479
252 1HN NH2 36 1HN NH2 36 2.063 -17.028 0.340
253 2HN NH2 36 2HN NH2 36 1.181 -16.386 -1.063
Start of MODEL 9
1 1H GLU 1 1H GLU 1 11.754 5.544 1.883
2 2H GLU 1 2H GLU 1 12.620 6.992 1.682
3 3H GLU 1 3H GLU 1 12.017 6.163 0.326
4 HA GLU 1 HA GLU 1 10.357 7.446 2.442
5 1HB GLU 1 2HB GLU 1 11.659 8.323 -0.047
6 2HB GLU 1 1HB GLU 1 9.931 8.675 -0.009
7 1HG GLU 1 2HG GLU 1 11.512 9.278 2.452
8 2HG GLU 1 1HG GLU 1 11.721 10.347 1.065
9 H CYS 2 H CYS 2 9.251 5.273 2.484
10 HA CYS 2 HA CYS 2 7.169 5.140 0.366
11 1HB CYS 2 2HB CYS 2 7.670 2.844 -0.155
12 2HB CYS 2 1HB CYS 2 9.200 3.715 -0.231
13 H LEU 3 H LEU 3 5.447 3.498 1.018
14 HA LEU 3 HA LEU 3 4.965 3.699 3.951
15 1HB LEU 3 2HB LEU 3 3.215 2.958 1.579
16 2HB LEU 3 1HB LEU 3 2.639 3.113 3.238
17 HG LEU 3 HG LEU 3 4.186 5.429 2.236
18 1HD1 LEU 3 1HD1 LEU 3 3.066 5.596 0.279
19 2HD1 LEU 3 2HD1 LEU 3 1.653 5.995 1.255
20 3HD1 LEU 3 3HD1 LEU 3 1.923 4.332 0.731
21 1HD2 LEU 3 1HD2 LEU 3 3.141 6.232 4.069
22 2HD2 LEU 3 2HD2 LEU 3 2.152 4.778 4.190
23 3HD2 LEU 3 3HD2 LEU 3 1.615 6.128 3.192
24 H GLY 4 H GLY 4 4.699 1.852 5.239
25 1HA GLY 4 2HA GLY 4 5.505 -0.731 3.991
26 2HA GLY 4 1HA GLY 4 5.613 -0.356 5.711
27 H PHE 5 H PHE 5 4.437 -2.498 5.862
28 HA PHE 5 HA PHE 5 1.632 -2.601 5.018
29 1HB PHE 5 2HB PHE 5 3.084 -4.587 5.136
30 2HB PHE 5 1HB PHE 5 3.323 -4.325 6.863
31 HD1 PHE 5 HD1 PHE 5 0.751 -5.090 4.274
32 HD2 PHE 5 HD2 PHE 5 1.721 -5.067 8.460
33 HE1 PHE 5 HE1 PHE 5 -1.312 -6.376 4.762
34 HE2 PHE 5 HE2 PHE 5 -0.342 -6.354 8.945
35 HZ PHE 5 HZ PHE 5 -1.858 -7.009 7.096
36 H GLY 6 H GLY 6 -0.154 -2.103 6.283
37 1HA GLY 6 2HA GLY 6 -1.389 -1.592 8.246
38 2HA GLY 6 1HA GLY 6 0.085 -1.797 9.192
39 H LYS 7 H LYS 7 -0.659 0.353 6.424
40 HA LYS 7 HA LYS 7 -0.244 2.719 8.198
41 1HB LYS 7 2HB LYS 7 1.627 1.590 6.339
42 2HB LYS 7 1HB LYS 7 1.102 3.154 5.714
43 1HG LYS 7 2HG LYS 7 1.989 4.322 7.493
44 2HG LYS 7 1HG LYS 7 1.760 2.985 8.621
45 1HD LYS 7 2HD LYS 7 3.584 1.754 7.322
46 2HD LYS 7 1HD LYS 7 3.920 3.293 6.527
47 1HE LYS 7 2HE LYS 7 3.742 3.346 9.507
48 2HE LYS 7 1HE LYS 7 5.178 2.583 8.796
49 1HZ LYS 7 1HZ LYS 7 5.481 4.984 9.039
50 2HZ LYS 7 2HZ LYS 7 4.115 5.265 8.069
51 3HZ LYS 7 3HZ LYS 7 5.496 4.529 7.406
52 H GLY 8 H GLY 8 -1.895 4.128 7.806
53 1HA GLY 8 2HA GLY 8 -3.745 3.793 5.626
54 2HA GLY 8 1HA GLY 8 -3.713 5.160 6.738
55 H CYS 9 H CYS 9 -3.409 4.396 3.549
56 HA CYS 9 HA CYS 9 -1.858 6.894 3.001
57 1HB CYS 9 2HB CYS 9 -0.197 5.717 2.010
58 2HB CYS 9 1HB CYS 9 -0.912 4.269 2.710
59 H ASN 10 H ASN 10 -2.225 7.621 0.680
60 HA ASN 10 HA ASN 10 -5.078 7.476 0.027
61 1HB ASN 10 2HB ASN 10 -2.778 9.149 -0.475
62 2HB ASN 10 1HB ASN 10 -3.575 8.779 -2.003
63 1HD2 ASN 10 1HD2 ASN 10 -3.601 11.049 0.408
64 2HD2 ASN 10 2HD2 ASN 10 -5.220 11.550 0.314
65 HA PRO 11 HA PRO 11 -4.660 4.089 -2.807
66 1HB PRO 11 2HB PRO 11 -7.019 4.440 -4.164
67 2HB PRO 11 1HB PRO 11 -6.925 3.727 -2.540
68 1HG PRO 11 2HG PRO 11 -7.631 6.509 -3.348
69 2HG PRO 11 1HG PRO 11 -8.354 5.479 -2.101
70 1HD PRO 11 2HD PRO 11 -6.602 7.461 -1.524
71 2HD PRO 11 1HD PRO 11 -6.724 5.975 -0.555
72 H SER 12 H SER 12 -5.647 7.304 -4.041
73 HA SER 12 HA SER 12 -4.876 6.830 -6.788
74 1HB SER 12 2HB SER 12 -5.025 9.341 -6.867
75 2HB SER 12 1HB SER 12 -6.434 8.587 -6.128
76 HG SER 12 HG SER 12 -5.964 9.588 -4.344
77 H ASN 13 H ASN 13 -3.214 8.369 -4.015
78 HA ASN 13 HA ASN 13 -0.669 8.368 -5.595
79 1HB ASN 13 2HB ASN 13 -1.762 10.475 -4.547
80 2HB ASN 13 1HB ASN 13 -1.238 9.813 -2.999
81 1HD2 ASN 13 1HD2 ASN 13 0.969 10.070 -2.432
82 2HD2 ASN 13 2HD2 ASN 13 2.134 10.748 -3.465
83 H ASP 14 H ASP 14 -1.120 5.866 -4.817
84 HA ASP 14 HA ASP 14 -0.240 5.322 -2.069
85 1HB ASP 14 2HB ASP 14 -1.827 3.817 -2.993
86 2HB ASP 14 1HB ASP 14 -0.953 3.700 -4.520
87 H GLN 15 H GLN 15 1.896 5.621 -1.596
88 HA GLN 15 HA GLN 15 3.942 4.865 -3.656
89 1HB GLN 15 2HB GLN 15 3.959 6.809 -1.319
90 2HB GLN 15 1HB GLN 15 5.379 6.449 -2.302
91 1HG GLN 15 2HG GLN 15 2.760 7.588 -3.336
92 2HG GLN 15 1HG GLN 15 4.254 8.496 -3.104
93 1HE2 GLN 15 1HE2 GLN 15 6.245 7.359 -4.320
94 2HE2 GLN 15 2HE2 GLN 15 5.908 6.822 -5.895
95 H CYS 16 H CYS 16 2.825 2.771 -2.207
96 HA CYS 16 HA CYS 16 4.228 2.176 0.259
97 1HB CYS 16 2HB CYS 16 2.078 1.185 -1.232
98 2HB CYS 16 1HB CYS 16 3.267 -0.115 -1.276
99 H CYS 17 H CYS 17 5.973 0.698 0.552
100 HA CYS 17 HA CYS 17 8.090 0.783 -1.375
101 1HB CYS 17 2HB CYS 17 7.550 -0.173 1.296
102 2HB CYS 17 1HB CYS 17 8.471 -1.388 0.413
103 H LYS 18 H LYS 18 8.259 -0.389 -3.239
104 HA LYS 18 HA LYS 18 6.494 -2.602 -3.879
105 1HB LYS 18 2HB LYS 18 7.775 -0.801 -5.337
106 2HB LYS 18 1HB LYS 18 9.055 -2.015 -5.336
107 1HG LYS 18 2HG LYS 18 7.049 -3.644 -5.955
108 2HG LYS 18 1HG LYS 18 6.315 -2.151 -6.539
109 1HD LYS 18 2HD LYS 18 7.511 -2.410 -8.432
110 2HD LYS 18 1HD LYS 18 8.956 -2.061 -7.482
111 1HE LYS 18 2HE LYS 18 9.306 -4.422 -7.023
112 2HE LYS 18 1HE LYS 18 7.759 -4.840 -7.786
113 1HZ LYS 18 1HZ LYS 18 10.023 -3.465 -9.142
114 2HZ LYS 18 2HZ LYS 18 8.546 -3.904 -9.861
115 3HZ LYS 18 3HZ LYS 18 9.626 -5.103 -9.331
116 H SER 19 H SER 19 9.588 -2.402 -2.284
117 HA SER 19 HA SER 19 10.741 -4.920 -2.945
118 1HB SER 19 2HB SER 19 11.913 -4.580 -0.755
119 2HB SER 19 1HB SER 19 11.916 -3.138 -1.765
120 HG SER 19 HG SER 19 10.628 -3.654 0.636
121 H SER 20 H SER 20 8.259 -4.074 -0.524
122 HA SER 20 HA SER 20 8.100 -6.935 0.315
123 1HB SER 20 2HB SER 20 8.326 -4.960 1.917
124 2HB SER 20 1HB SER 20 6.688 -4.511 1.452
125 HG SER 20 HG SER 20 5.919 -6.197 2.503
126 H ASN 21 H ASN 21 6.820 -5.284 -2.170
127 HA ASN 21 HA ASN 21 4.831 -5.420 -3.420
128 1HB ASN 21 2HB ASN 21 5.568 -7.945 -2.343
129 2HB ASN 21 1HB ASN 21 3.812 -7.845 -2.230
130 1HD2 ASN 21 1HD2 ASN 21 2.692 -8.351 -4.127
131 2HD2 ASN 21 2HD2 ASN 21 3.372 -8.350 -5.682
132 H LEU 22 H LEU 22 4.135 -3.535 -1.920
133 HA LEU 22 HA LEU 22 1.722 -4.360 -0.332
134 1HB LEU 22 2HB LEU 22 3.820 -2.220 0.097
135 2HB LEU 22 1HB LEU 22 2.287 -2.224 0.968
136 HG LEU 22 HG LEU 22 4.146 -4.612 0.926
137 1HD1 LEU 22 1HD1 LEU 22 4.014 -3.084 3.417
138 2HD1 LEU 22 2HD1 LEU 22 4.723 -2.156 2.096
139 3HD1 LEU 22 3HD1 LEU 22 5.422 -3.707 2.559
140 1HD2 LEU 22 1HD2 LEU 22 2.825 -5.070 3.071
141 2HD2 LEU 22 2HD2 LEU 22 1.920 -5.219 1.566
142 3HD2 LEU 22 3HD2 LEU 22 1.738 -3.777 2.564
143 H VAL 23 H VAL 23 -0.173 -3.258 -0.790
144 HA VAL 23 HA VAL 23 -0.047 -0.913 -2.652
145 HB VAL 23 HB VAL 23 -2.034 -1.972 -3.816
146 1HG1 VAL 23 1HG1 VAL 23 0.409 -3.757 -3.856
147 2HG1 VAL 23 2HG1 VAL 23 0.391 -2.149 -4.581
148 3HG1 VAL 23 3HG1 VAL 23 -0.694 -3.401 -5.185
149 1HG2 VAL 23 1HG2 VAL 23 -2.935 -3.921 -3.095
150 2HG2 VAL 23 2HG2 VAL 23 -2.015 -3.675 -1.612
151 3HG2 VAL 23 3HG2 VAL 23 -1.351 -4.672 -2.906
152 H CYS 24 H CYS 24 -1.783 0.598 -2.348
153 HA CYS 24 HA CYS 24 -3.018 0.503 0.318
154 1HB CYS 24 2HB CYS 24 -2.151 2.456 -1.509
155 2HB CYS 24 1HB CYS 24 -3.900 2.652 -1.424
156 H SER 25 H SER 25 -4.993 -0.392 0.678
157 HA SER 25 HA SER 25 -6.782 -0.985 -1.623
158 1HB SER 25 2HB SER 25 -5.978 -2.345 0.665
159 2HB SER 25 1HB SER 25 -7.604 -1.805 1.073
160 HG SER 25 HG SER 25 -8.413 -2.992 -0.523
161 H ARG 26 H ARG 26 -9.027 -0.341 -1.568
162 HA ARG 26 HA ARG 26 -9.483 2.285 -0.316
163 1HB ARG 26 2HB ARG 26 -10.881 0.478 -2.277
164 2HB ARG 26 1HB ARG 26 -11.728 1.870 -1.602
165 1HG ARG 26 2HG ARG 26 -10.380 3.393 -2.681
166 2HG ARG 26 1HG ARG 26 -8.970 2.334 -2.636
167 1HD ARG 26 2HD ARG 26 -9.454 2.096 -4.878
168 2HD ARG 26 1HD ARG 26 -10.601 0.886 -4.272
169 HE ARG 26 HE ARG 26 -11.800 3.494 -4.139
170 1HH1 ARG 26 2HH1 ARG 26 -10.663 3.620 -6.893
171 2HH1 ARG 26 1HH1 ARG 26 -11.910 2.889 -7.846
172 1HH2 ARG 26 1HH2 ARG 26 -13.497 1.424 -5.123
173 2HH2 ARG 26 2HH2 ARG 26 -13.519 1.642 -6.841
174 H ALA 27 H ALA 27 -10.070 -0.985 0.576
175 HA ALA 27 HA ALA 27 -12.583 -0.850 1.901
176 1HB ALA 27 1HB ALA 27 -11.705 -2.801 3.130
177 2HB ALA 27 2HB ALA 27 -10.067 -2.386 2.626
178 3HB ALA 27 3HB ALA 27 -11.256 -2.895 1.427
179 H HIS 28 H HIS 28 -9.304 -0.194 3.157
180 HA HIS 28 HA HIS 28 -10.554 1.394 5.373
181 1HB HIS 28 2HB HIS 28 -8.887 -1.006 5.414
182 2HB HIS 28 1HB HIS 28 -8.181 0.301 6.365
183 HD1 HIS 28 HD1 HIS 28 -10.022 1.515 8.051
184 HD2 HIS 28 HD2 HIS 28 -10.859 -2.368 6.785
185 HE1 HIS 28 HE1 HIS 28 -11.747 0.594 9.661
186 H ARG 29 H ARG 29 -9.010 1.938 2.672
187 HA ARG 29 HA ARG 29 -7.353 3.433 1.898
188 1HB ARG 29 2HB ARG 29 -8.582 4.589 4.385
189 2HB ARG 29 1HB ARG 29 -7.272 5.463 3.593
190 1HG ARG 29 2HG ARG 29 -8.645 5.106 1.414
191 2HG ARG 29 1HG ARG 29 -9.989 4.754 2.499
192 1HD ARG 29 2HD ARG 29 -10.326 7.007 2.554
193 2HD ARG 29 1HD ARG 29 -8.874 7.081 3.573
194 HE ARG 29 HE ARG 29 -8.773 7.271 0.581
195 1HH1 ARG 29 2HH1 ARG 29 -6.208 6.776 2.087
196 2HH1 ARG 29 1HH1 ARG 29 -5.597 8.385 2.289
197 1HH2 ARG 29 1HH2 ARG 29 -8.629 9.911 1.550
198 2HH2 ARG 29 2HH2 ARG 29 -6.971 10.163 1.984
199 H TRP 30 H TRP 30 -6.036 1.296 2.908
200 HA TRP 30 HA TRP 30 -3.694 2.525 4.273
201 1HB TRP 30 2HB TRP 30 -3.723 0.941 6.049
202 2HB TRP 30 1HB TRP 30 -5.397 1.465 5.894
203 HD1 TRP 30 HD1 TRP 30 -6.726 -0.202 3.880
204 HE1 TRP 30 HE1 TRP 30 -6.824 -2.778 3.943
205 HE3 TRP 30 HE3 TRP 30 -2.729 -1.157 6.904
206 HZ2 TRP 30 HZ2 TRP 30 -5.393 -4.954 5.122
207 HZ3 TRP 30 HZ3 TRP 30 -2.118 -3.489 7.481
208 HH2 TRP 30 HH2 TRP 30 -3.444 -5.387 6.594
209 H CYS 31 H CYS 31 -1.803 0.945 4.244
210 HA CYS 31 HA CYS 31 -1.643 -0.329 1.579
211 1HB CYS 31 2HB CYS 31 0.108 0.926 3.525
212 2HB CYS 31 1HB CYS 31 0.768 -0.625 3.008
213 H LYS 32 H LYS 32 -1.775 -2.509 1.276
214 HA LYS 32 HA LYS 32 -1.338 -4.335 3.615
215 1HB LYS 32 2HB LYS 32 -3.314 -5.611 2.832
216 2HB LYS 32 1HB LYS 32 -3.747 -3.947 3.220
217 1HG LYS 32 2HG LYS 32 -3.895 -3.328 0.940
218 2HG LYS 32 1HG LYS 32 -3.001 -4.752 0.407
219 1HD LYS 32 2HD LYS 32 -5.117 -5.901 1.721
220 2HD LYS 32 1HD LYS 32 -5.868 -4.460 1.034
221 1HE LYS 32 2HE LYS 32 -4.634 -5.164 -1.171
222 2HE LYS 32 1HE LYS 32 -4.546 -6.759 -0.398
223 1HZ LYS 32 1HZ LYS 32 -6.935 -6.627 0.036
224 2HZ LYS 32 2HZ LYS 32 -6.610 -6.538 -1.629
225 3HZ LYS 32 3HZ LYS 32 -7.010 -5.132 -0.764
226 H TYR 33 H TYR 33 -1.036 -6.666 2.803
227 HA TYR 33 HA TYR 33 0.822 -6.633 0.488
228 1HB TYR 33 2HB TYR 33 1.469 -7.628 2.663
229 2HB TYR 33 1HB TYR 33 0.117 -8.755 2.548
230 HD1 TYR 33 HD1 TYR 33 3.348 -7.755 1.020
231 HD2 TYR 33 HD2 TYR 33 0.213 -10.690 1.123
232 HE1 TYR 33 HE1 TYR 33 4.739 -9.289 -0.344
233 HE2 TYR 33 HE2 TYR 33 1.605 -12.225 -0.240
234 HH TYR 33 HH TYR 33 4.559 -12.248 -0.543
235 H GLU 34 H GLU 34 0.462 -7.849 -1.390
236 HA GLU 34 HA GLU 34 -2.296 -8.968 -1.717
237 1HB GLU 34 2HB GLU 34 -0.937 -7.074 -3.142
238 2HB GLU 34 1HB GLU 34 -0.523 -8.525 -4.056
239 1HG GLU 34 2HG GLU 34 -3.350 -7.710 -3.313
240 2HG GLU 34 1HG GLU 34 -2.609 -7.427 -4.887
241 H ILE 35 H ILE 35 -2.383 -11.174 -1.640
242 HA ILE 35 HA ILE 35 0.067 -12.776 -2.029
243 HB ILE 35 HB ILE 35 -1.652 -13.086 -0.189
244 1HG1 ILE 35 2HG1 ILE 35 -1.763 -15.698 -1.479
245 2HG1 ILE 35 1HG1 ILE 35 -0.168 -14.966 -1.641
246 1HG2 ILE 35 1HG2 ILE 35 -3.761 -14.083 -0.670
247 2HG2 ILE 35 2HG2 ILE 35 -3.308 -14.420 -2.340
248 3HG2 ILE 35 3HG2 ILE 35 -3.604 -12.759 -1.823
249 1HD1 ILE 35 1HD1 ILE 35 -0.570 -16.367 0.469
250 2HD1 ILE 35 2HD1 ILE 35 -1.622 -15.058 1.007
251 3HD1 ILE 35 3HD1 ILE 35 0.090 -14.749 0.714
252 1HN NH2 36 1HN NH2 36 -1.898 -12.340 -5.362
253 2HN NH2 36 2HN NH2 36 -1.522 -11.239 -4.019
Start of MODEL 10
1 1H GLU 1 1H GLU 1 9.778 9.495 2.884
2 2H GLU 1 2H GLU 1 10.847 9.620 4.198
3 3H GLU 1 3H GLU 1 9.267 9.041 4.437
4 HA GLU 1 HA GLU 1 11.439 7.679 2.920
5 1HB GLU 1 2HB GLU 1 11.083 7.911 5.597
6 2HB GLU 1 1HB GLU 1 10.030 6.532 5.278
7 1HG GLU 1 2HG GLU 1 11.803 5.228 4.408
8 2HG GLU 1 1HG GLU 1 12.840 6.637 4.183
9 H CYS 2 H CYS 2 10.635 5.248 2.702
10 HA CYS 2 HA CYS 2 8.318 5.225 0.973
11 1HB CYS 2 2HB CYS 2 10.140 3.704 0.595
12 2HB CYS 2 1HB CYS 2 10.079 3.114 2.254
13 H LEU 3 H LEU 3 6.255 4.322 1.355
14 HA LEU 3 HA LEU 3 5.311 4.423 4.138
15 1HB LEU 3 2HB LEU 3 3.976 3.822 1.475
16 2HB LEU 3 1HB LEU 3 3.113 4.053 2.995
17 HG LEU 3 HG LEU 3 5.031 6.143 1.961
18 1HD1 LEU 3 1HD1 LEU 3 3.548 6.923 0.434
19 2HD1 LEU 3 2HD1 LEU 3 2.175 6.659 1.510
20 3HD1 LEU 3 3HD1 LEU 3 2.799 5.329 0.535
21 1HD2 LEU 3 1HD2 LEU 3 3.785 7.598 3.430
22 2HD2 LEU 3 2HD2 LEU 3 4.157 6.138 4.346
23 3HD2 LEU 3 3HD2 LEU 3 2.542 6.373 3.681
24 H GLY 4 H GLY 4 5.889 2.609 5.330
25 1HA GLY 4 2HA GLY 4 5.925 -0.063 4.124
26 2HA GLY 4 1HA GLY 4 6.275 0.320 5.809
27 H PHE 5 H PHE 5 4.903 -1.284 6.674
28 HA PHE 5 HA PHE 5 2.108 -1.534 5.868
29 1HB PHE 5 2HB PHE 5 3.597 -3.354 6.766
30 2HB PHE 5 1HB PHE 5 3.563 -2.549 8.334
31 HD1 PHE 5 HD1 PHE 5 2.091 -3.498 9.857
32 HD2 PHE 5 HD2 PHE 5 1.035 -3.451 5.693
33 HE1 PHE 5 HE1 PHE 5 -0.055 -4.620 10.389
34 HE2 PHE 5 HE2 PHE 5 -1.112 -4.574 6.224
35 HZ PHE 5 HZ PHE 5 -1.657 -5.159 8.573
36 H GLY 6 H GLY 6 0.355 -0.495 6.765
37 1HA GLY 6 2HA GLY 6 -0.900 0.667 8.428
38 2HA GLY 6 1HA GLY 6 0.563 0.808 9.402
39 H LYS 7 H LYS 7 0.147 1.748 5.991
40 HA LYS 7 HA LYS 7 0.441 4.618 6.796
41 1HB LYS 7 2HB LYS 7 2.144 2.883 5.037
42 2HB LYS 7 1HB LYS 7 1.970 4.586 4.615
43 1HG LYS 7 2HG LYS 7 2.861 3.555 7.326
44 2HG LYS 7 1HG LYS 7 3.940 4.182 6.080
45 1HD LYS 7 2HD LYS 7 2.076 6.196 6.268
46 2HD LYS 7 1HD LYS 7 2.174 5.636 7.938
47 1HE LYS 7 2HE LYS 7 4.748 5.762 7.631
48 2HE LYS 7 1HE LYS 7 4.385 6.754 6.205
49 1HZ LYS 7 1HZ LYS 7 2.951 8.139 7.613
50 2HZ LYS 7 2HZ LYS 7 4.563 8.161 8.146
51 3HZ LYS 7 3HZ LYS 7 3.405 7.232 8.973
52 H GLY 8 H GLY 8 -1.083 5.855 5.779
53 1HA GLY 8 2HA GLY 8 -2.861 4.677 3.801
54 2HA GLY 8 1HA GLY 8 -2.931 6.335 4.395
55 H CYS 9 H CYS 9 -2.752 4.869 1.603
56 HA CYS 9 HA CYS 9 -0.965 6.935 0.399
57 1HB CYS 9 2HB CYS 9 0.508 5.380 -0.372
58 2HB CYS 9 1HB CYS 9 -0.210 4.302 0.820
59 H ASN 10 H ASN 10 -1.317 6.899 -2.103
60 HA ASN 10 HA ASN 10 -4.226 6.938 -2.599
61 1HB ASN 10 2HB ASN 10 -1.712 7.830 -3.998
62 2HB ASN 10 1HB ASN 10 -3.237 7.785 -4.881
63 1HD2 ASN 10 1HD2 ASN 10 -1.341 9.904 -3.200
64 2HD2 ASN 10 2HD2 ASN 10 -2.536 10.942 -2.587
65 HA PRO 11 HA PRO 11 -4.356 3.035 -4.671
66 1HB PRO 11 2HB PRO 11 -6.463 3.474 -6.368
67 2HB PRO 11 1HB PRO 11 -6.661 3.194 -4.627
68 1HG PRO 11 2HG PRO 11 -6.700 5.752 -6.149
69 2HG PRO 11 1HG PRO 11 -7.698 5.238 -4.780
70 1HD PRO 11 2HD PRO 11 -5.588 6.938 -4.529
71 2HD PRO 11 1HD PRO 11 -6.125 5.850 -3.229
72 H SER 12 H SER 12 -4.743 5.873 -6.850
73 HA SER 12 HA SER 12 -3.641 4.545 -9.180
74 1HB SER 12 2HB SER 12 -3.586 6.901 -10.034
75 2HB SER 12 1HB SER 12 -5.134 6.485 -9.307
76 HG SER 12 HG SER 12 -3.242 8.315 -8.533
77 H ASN 13 H ASN 13 -2.299 6.670 -6.652
78 HA ASN 13 HA ASN 13 0.444 6.317 -7.781
79 1HB ASN 13 2HB ASN 13 -1.021 8.302 -6.099
80 2HB ASN 13 1HB ASN 13 0.695 8.094 -5.750
81 1HD2 ASN 13 1HD2 ASN 13 1.955 9.542 -6.920
82 2HD2 ASN 13 2HD2 ASN 13 1.606 10.102 -8.484
83 H ASP 14 H ASP 14 -0.085 3.954 -6.859
84 HA ASP 14 HA ASP 14 -0.052 3.445 -4.045
85 1HB ASP 14 2HB ASP 14 -0.607 1.911 -6.019
86 2HB ASP 14 1HB ASP 14 1.132 1.716 -6.235
87 H GLN 15 H GLN 15 1.569 4.207 -2.730
88 HA GLN 15 HA GLN 15 4.404 3.987 -3.692
89 1HB GLN 15 2HB GLN 15 3.008 6.200 -2.946
90 2HB GLN 15 1HB GLN 15 3.681 5.720 -1.388
91 1HG GLN 15 2HG GLN 15 5.889 5.433 -2.899
92 2HG GLN 15 1HG GLN 15 5.073 6.681 -3.840
93 1HE2 GLN 15 1HE2 GLN 15 5.279 8.812 -3.077
94 2HE2 GLN 15 2HE2 GLN 15 5.849 9.226 -1.532
95 H CYS 16 H CYS 16 2.839 1.812 -2.400
96 HA CYS 16 HA CYS 16 3.654 1.631 0.396
97 1HB CYS 16 2HB CYS 16 2.539 -0.305 -1.655
98 2HB CYS 16 1HB CYS 16 2.846 -0.764 0.019
99 H CYS 17 H CYS 17 5.284 0.205 1.236
100 HA CYS 17 HA CYS 17 7.728 0.066 -0.306
101 1HB CYS 17 2HB CYS 17 6.744 -0.445 2.393
102 2HB CYS 17 1HB CYS 17 7.937 -1.645 1.901
103 H LYS 18 H LYS 18 8.562 -1.632 -1.490
104 HA LYS 18 HA LYS 18 6.802 -3.962 -1.997
105 1HB LYS 18 2HB LYS 18 9.186 -2.646 -3.258
106 2HB LYS 18 1HB LYS 18 8.806 -4.313 -3.692
107 1HG LYS 18 2HG LYS 18 6.346 -2.917 -3.724
108 2HG LYS 18 1HG LYS 18 7.507 -1.883 -4.557
109 1HD LYS 18 2HD LYS 18 8.162 -3.779 -5.999
110 2HD LYS 18 1HD LYS 18 6.996 -4.810 -5.171
111 1HE LYS 18 2HE LYS 18 5.965 -2.236 -6.291
112 2HE LYS 18 1HE LYS 18 6.351 -3.531 -7.440
113 1HZ LYS 18 1HZ LYS 18 4.080 -3.742 -6.594
114 2HZ LYS 18 2HZ LYS 18 4.670 -3.840 -5.003
115 3HZ LYS 18 3HZ LYS 18 5.033 -5.064 -6.126
116 H SER 19 H SER 19 8.716 -3.532 0.513
117 HA SER 19 HA SER 19 10.677 -5.663 0.353
118 1HB SER 19 2HB SER 19 10.541 -3.614 1.916
119 2HB SER 19 1HB SER 19 9.366 -4.543 2.843
120 HG SER 19 HG SER 19 11.688 -4.714 3.436
121 H SER 20 H SER 20 7.353 -5.430 1.632
122 HA SER 20 HA SER 20 7.316 -8.422 1.899
123 1HB SER 20 2HB SER 20 6.803 -6.286 3.741
124 2HB SER 20 1HB SER 20 5.288 -7.136 3.457
125 HG SER 20 HG SER 20 7.717 -8.067 4.513
126 H ASN 21 H ASN 21 6.583 -6.629 -0.455
127 HA ASN 21 HA ASN 21 4.867 -6.436 -2.059
128 1HB ASN 21 2HB ASN 21 5.241 -8.982 -1.509
129 2HB ASN 21 1HB ASN 21 3.643 -8.864 -0.771
130 1HD2 ASN 21 1HD2 ASN 21 5.388 -8.404 -3.863
131 2HD2 ASN 21 2HD2 ASN 21 4.012 -8.546 -4.846
132 H LEU 22 H LEU 22 4.111 -4.491 -0.736
133 HA LEU 22 HA LEU 22 1.510 -5.014 0.657
134 1HB LEU 22 2HB LEU 22 3.627 -2.862 0.808
135 2HB LEU 22 1HB LEU 22 2.033 -2.640 1.531
136 HG LEU 22 HG LEU 22 3.368 -5.214 2.151
137 1HD1 LEU 22 1HD1 LEU 22 4.497 -2.538 2.924
138 2HD1 LEU 22 2HD1 LEU 22 5.347 -4.014 2.466
139 3HD1 LEU 22 3HD1 LEU 22 4.597 -3.887 4.057
140 1HD2 LEU 22 1HD2 LEU 22 1.679 -5.114 3.641
141 2HD2 LEU 22 2HD2 LEU 22 1.346 -3.434 3.217
142 3HD2 LEU 22 3HD2 LEU 22 2.543 -3.812 4.457
143 H VAL 23 H VAL 23 -0.353 -4.055 -0.124
144 HA VAL 23 HA VAL 23 -0.098 -2.220 -2.491
145 HB VAL 23 HB VAL 23 -2.155 -3.363 -3.337
146 1HG1 VAL 23 1HG1 VAL 23 -1.041 -5.308 -4.141
147 2HG1 VAL 23 2HG1 VAL 23 -0.024 -5.411 -2.704
148 3HG1 VAL 23 3HG1 VAL 23 0.230 -4.115 -3.873
149 1HG2 VAL 23 1HG2 VAL 23 -1.684 -5.267 -1.016
150 2HG2 VAL 23 2HG2 VAL 23 -2.921 -5.427 -2.262
151 3HG2 VAL 23 3HG2 VAL 23 -3.002 -4.098 -1.107
152 H CYS 24 H CYS 24 -1.870 -0.667 -2.704
153 HA CYS 24 HA CYS 24 -2.939 0.189 -0.083
154 1HB CYS 24 2HB CYS 24 -2.048 1.395 -2.498
155 2HB CYS 24 1HB CYS 24 -3.750 1.816 -2.310
156 H SER 25 H SER 25 -4.969 -0.422 0.545
157 HA SER 25 HA SER 25 -6.784 -1.786 -1.292
158 1HB SER 25 2HB SER 25 -8.003 -2.235 0.676
159 2HB SER 25 1HB SER 25 -6.353 -2.078 1.270
160 HG SER 25 HG SER 25 -6.863 0.127 1.744
161 H ARG 26 H ARG 26 -9.032 -1.037 -1.679
162 HA ARG 26 HA ARG 26 -9.107 1.845 -2.326
163 1HB ARG 26 2HB ARG 26 -11.081 1.199 -3.609
164 2HB ARG 26 1HB ARG 26 -9.797 0.028 -3.901
165 1HG ARG 26 2HG ARG 26 -11.170 -1.618 -3.220
166 2HG ARG 26 1HG ARG 26 -11.240 -0.877 -1.622
167 1HD ARG 26 2HD ARG 26 -13.484 -0.709 -2.117
168 2HD ARG 26 1HD ARG 26 -12.963 0.744 -2.994
169 HE ARG 26 HE ARG 26 -13.390 -1.937 -4.247
170 1HH1 ARG 26 2HH1 ARG 26 -15.271 0.148 -5.037
171 2HH1 ARG 26 1HH1 ARG 26 -14.548 0.840 -6.451
172 1HH2 ARG 26 1HH2 ARG 26 -11.399 -0.485 -5.810
173 2HH2 ARG 26 2HH2 ARG 26 -12.351 0.477 -6.891
174 H ALA 27 H ALA 27 -10.229 -0.200 0.231
175 HA ALA 27 HA ALA 27 -12.489 1.556 0.968
176 1HB ALA 27 1HB ALA 27 -12.696 -0.861 1.194
177 2HB ALA 27 2HB ALA 27 -12.692 -0.146 2.807
178 3HB ALA 27 3HB ALA 27 -11.238 -0.924 2.184
179 H HIS 28 H HIS 28 -9.430 0.476 2.488
180 HA HIS 28 HA HIS 28 -9.603 2.716 4.439
181 1HB HIS 28 2HB HIS 28 -8.343 0.057 4.232
182 2HB HIS 28 1HB HIS 28 -7.315 1.277 4.984
183 HD1 HIS 28 HD1 HIS 28 -8.418 2.599 7.060
184 HD2 HIS 28 HD2 HIS 28 -10.389 -0.880 5.879
185 HE1 HIS 28 HE1 HIS 28 -9.969 1.974 8.961
186 H ARG 29 H ARG 29 -8.053 2.012 1.431
187 HA ARG 29 HA ARG 29 -6.337 3.102 0.234
188 1HB ARG 29 2HB ARG 29 -7.522 5.183 2.073
189 2HB ARG 29 1HB ARG 29 -6.220 5.607 0.962
190 1HG ARG 29 2HG ARG 29 -7.876 4.219 -0.705
191 2HG ARG 29 1HG ARG 29 -9.047 4.954 0.390
192 1HD ARG 29 2HD ARG 29 -7.044 6.918 -0.308
193 2HD ARG 29 1HD ARG 29 -7.731 6.212 -1.783
194 HE ARG 29 HE ARG 29 -10.000 6.723 -0.819
195 1HH1 ARG 29 2HH1 ARG 29 -8.587 9.314 -1.444
196 2HH1 ARG 29 1HH1 ARG 29 -8.832 10.213 0.016
197 1HH2 ARG 29 1HH2 ARG 29 -9.733 7.434 1.895
198 2HH2 ARG 29 2HH2 ARG 29 -9.481 9.147 1.909
199 H TRP 30 H TRP 30 -5.143 1.453 1.947
200 HA TRP 30 HA TRP 30 -2.813 3.002 2.940
201 1HB TRP 30 2HB TRP 30 -3.029 2.225 5.172
202 2HB TRP 30 1HB TRP 30 -4.673 2.666 4.720
203 HD1 TRP 30 HD1 TRP 30 -5.880 0.346 3.339
204 HE1 TRP 30 HE1 TRP 30 -6.084 -2.006 4.371
205 HE3 TRP 30 HE3 TRP 30 -2.239 0.636 6.891
206 HZ2 TRP 30 HZ2 TRP 30 -4.862 -3.558 6.440
207 HZ3 TRP 30 HZ3 TRP 30 -1.775 -1.290 8.381
208 HH2 TRP 30 HH2 TRP 30 -3.082 -3.385 8.160
209 H CYS 31 H CYS 31 -0.972 1.540 3.451
210 HA CYS 31 HA CYS 31 -0.672 -0.565 1.470
211 1HB CYS 31 2HB CYS 31 1.016 0.346 3.824
212 2HB CYS 31 1HB CYS 31 1.568 -0.770 2.576
213 H LYS 32 H LYS 32 -1.366 -2.632 1.729
214 HA LYS 32 HA LYS 32 -1.358 -3.830 4.474
215 1HB LYS 32 2HB LYS 32 -3.554 -4.829 3.937
216 2HB LYS 32 1HB LYS 32 -3.627 -3.072 3.829
217 1HG LYS 32 2HG LYS 32 -4.334 -3.236 1.700
218 2HG LYS 32 1HG LYS 32 -2.831 -4.052 1.269
219 1HD LYS 32 2HD LYS 32 -4.095 -5.874 0.835
220 2HD LYS 32 1HD LYS 32 -4.292 -6.027 2.580
221 1HE LYS 32 2HE LYS 32 -6.530 -5.907 2.005
222 2HE LYS 32 1HE LYS 32 -6.203 -4.164 2.077
223 1HZ LYS 32 1HZ LYS 32 -7.210 -4.823 -0.051
224 2HZ LYS 32 2HZ LYS 32 -5.896 -5.858 -0.351
225 3HZ LYS 32 3HZ LYS 32 -5.656 -4.178 -0.262
226 H TYR 33 H TYR 33 -1.300 -6.245 4.393
227 HA TYR 33 HA TYR 33 0.594 -7.213 2.411
228 1HB TYR 33 2HB TYR 33 -0.231 -7.875 4.978
229 2HB TYR 33 1HB TYR 33 -0.855 -9.209 4.006
230 HD1 TYR 33 HD1 TYR 33 0.631 -10.742 2.859
231 HD2 TYR 33 HD2 TYR 33 2.188 -7.380 5.032
232 HE1 TYR 33 HE1 TYR 33 2.913 -11.700 2.706
233 HE2 TYR 33 HE2 TYR 33 4.469 -8.338 4.880
234 HH TYR 33 HH TYR 33 5.528 -10.259 2.908
235 H GLU 34 H GLU 34 0.128 -9.288 1.166
236 HA GLU 34 HA GLU 34 -1.979 -8.964 -0.709
237 1HB GLU 34 2HB GLU 34 -0.217 -11.260 0.161
238 2HB GLU 34 1HB GLU 34 -1.392 -11.458 -1.140
239 1HG GLU 34 2HG GLU 34 -0.059 -9.038 -1.695
240 2HG GLU 34 1HG GLU 34 1.203 -10.171 -1.212
241 H ILE 35 H ILE 35 -4.135 -9.080 -0.231
242 HA ILE 35 HA ILE 35 -5.135 -10.686 2.022
243 HB ILE 35 HB ILE 35 -5.917 -8.375 1.302
244 1HG1 ILE 35 2HG1 ILE 35 -8.248 -10.269 1.210
245 2HG1 ILE 35 1HG1 ILE 35 -7.236 -10.218 2.654
246 1HG2 ILE 35 1HG2 ILE 35 -7.489 -9.861 -0.810
247 2HG2 ILE 35 2HG2 ILE 35 -5.951 -9.080 -1.174
248 3HG2 ILE 35 3HG2 ILE 35 -7.312 -8.118 -0.602
249 1HD1 ILE 35 1HD1 ILE 35 -8.330 -7.685 1.435
250 2HD1 ILE 35 2HD1 ILE 35 -7.744 -7.953 3.077
251 3HD1 ILE 35 3HD1 ILE 35 -9.287 -8.639 2.567
252 1HN NH2 36 1HN NH2 36 -4.813 -12.957 -1.022
253 2HN NH2 36 2HN NH2 36 -3.795 -11.727 -0.243
Start of MODEL 11
1 1H GLU 1 1H GLU 1 12.202 7.891 0.333
2 2H GLU 1 2H GLU 1 12.581 8.682 1.786
3 3H GLU 1 3H GLU 1 11.078 8.946 1.038
4 HA GLU 1 HA GLU 1 11.969 6.313 2.110
5 1HB GLU 1 2HB GLU 1 10.599 6.864 4.044
6 2HB GLU 1 1HB GLU 1 11.752 8.172 3.794
7 1HG GLU 1 2HG GLU 1 10.048 9.633 3.647
8 2HG GLU 1 1HG GLU 1 9.436 8.768 2.237
9 H CYS 2 H CYS 2 9.752 5.118 2.657
10 HA CYS 2 HA CYS 2 7.688 5.656 0.564
11 1HB CYS 2 2HB CYS 2 7.834 3.250 -0.092
12 2HB CYS 2 1HB CYS 2 9.338 4.117 -0.399
13 H LEU 3 H LEU 3 5.782 4.047 0.918
14 HA LEU 3 HA LEU 3 5.152 4.003 3.823
15 1HB LEU 3 2HB LEU 3 3.524 3.568 1.294
16 2HB LEU 3 1HB LEU 3 2.846 3.559 2.921
17 HG LEU 3 HG LEU 3 4.448 5.901 1.877
18 1HD1 LEU 3 1HD1 LEU 3 2.590 6.856 0.898
19 2HD1 LEU 3 2HD1 LEU 3 1.462 5.986 1.938
20 3HD1 LEU 3 3HD1 LEU 3 2.229 5.159 0.583
21 1HD2 LEU 3 1HD2 LEU 3 4.149 5.815 4.292
22 2HD2 LEU 3 2HD2 LEU 3 2.420 5.522 4.105
23 3HD2 LEU 3 3HD2 LEU 3 3.106 7.080 3.643
24 H GLY 4 H GLY 4 6.084 2.139 4.701
25 1HA GLY 4 2HA GLY 4 6.188 -0.396 3.298
26 2HA GLY 4 1HA GLY 4 6.561 -0.145 5.003
27 H PHE 5 H PHE 5 5.339 -2.302 5.065
28 HA PHE 5 HA PHE 5 2.482 -2.376 4.636
29 1HB PHE 5 2HB PHE 5 3.972 -4.346 4.682
30 2HB PHE 5 1HB PHE 5 4.338 -4.038 6.378
31 HD1 PHE 5 HD1 PHE 5 1.164 -4.085 4.350
32 HD2 PHE 5 HD2 PHE 5 3.296 -5.582 7.768
33 HE1 PHE 5 HE1 PHE 5 -0.829 -5.400 5.020
34 HE2 PHE 5 HE2 PHE 5 1.302 -6.894 8.436
35 HZ PHE 5 HZ PHE 5 -0.760 -6.802 7.063
36 H GLY 6 H GLY 6 1.018 -1.249 5.843
37 1HA GLY 6 2HA GLY 6 -0.011 -1.124 8.137
38 2HA GLY 6 1HA GLY 6 1.614 -0.811 8.746
39 H LYS 7 H LYS 7 2.426 0.986 6.635
40 HA LYS 7 HA LYS 7 1.502 3.490 7.663
41 1HB LYS 7 2HB LYS 7 3.375 2.444 5.757
42 2HB LYS 7 1HB LYS 7 2.493 3.765 4.993
43 1HG LYS 7 2HG LYS 7 3.765 5.228 6.134
44 2HG LYS 7 1HG LYS 7 3.079 4.612 7.635
45 1HD LYS 7 2HD LYS 7 5.354 3.191 6.253
46 2HD LYS 7 1HD LYS 7 5.648 4.515 7.380
47 1HE LYS 7 2HE LYS 7 4.773 3.318 9.214
48 2HE LYS 7 1HE LYS 7 3.877 2.197 8.171
49 1HZ LYS 7 1HZ LYS 7 5.921 1.185 9.015
50 2HZ LYS 7 2HZ LYS 7 6.840 2.424 8.305
51 3HZ LYS 7 3HZ LYS 7 5.966 1.343 7.328
52 H GLY 8 H GLY 8 0.079 5.057 6.711
53 1HA GLY 8 2HA GLY 8 -2.134 3.884 5.158
54 2HA GLY 8 1HA GLY 8 -2.110 5.494 5.876
55 H CYS 9 H CYS 9 -2.766 4.608 3.088
56 HA CYS 9 HA CYS 9 -1.073 6.604 1.680
57 1HB CYS 9 2HB CYS 9 -0.702 4.904 -0.154
58 2HB CYS 9 1HB CYS 9 0.108 4.508 1.359
59 H ASN 10 H ASN 10 -1.990 6.534 -0.810
60 HA ASN 10 HA ASN 10 -4.961 6.814 -0.547
61 1HB ASN 10 2HB ASN 10 -2.779 8.088 -2.184
62 2HB ASN 10 1HB ASN 10 -4.446 8.151 -2.760
63 1HD2 ASN 10 1HD2 ASN 10 -2.308 9.154 -0.083
64 2HD2 ASN 10 2HD2 ASN 10 -3.365 10.328 0.538
65 HA PRO 11 HA PRO 11 -5.437 3.341 -3.251
66 1HB PRO 11 2HB PRO 11 -7.962 3.879 -4.178
67 2HB PRO 11 1HB PRO 11 -7.638 3.230 -2.558
68 1HG PRO 11 2HG PRO 11 -8.224 6.029 -3.392
69 2HG PRO 11 1HG PRO 11 -8.779 5.137 -1.967
70 1HD PRO 11 2HD PRO 11 -6.771 6.959 -1.875
71 2HD PRO 11 1HD PRO 11 -6.853 5.555 -0.788
72 H SER 12 H SER 12 -6.482 6.532 -4.520
73 HA SER 12 HA SER 12 -6.056 5.815 -7.309
74 1HB SER 12 2HB SER 12 -7.606 7.589 -6.364
75 2HB SER 12 1HB SER 12 -6.176 8.552 -5.999
76 HG SER 12 HG SER 12 -7.381 8.757 -8.151
77 H ASN 13 H ASN 13 -4.161 7.442 -4.783
78 HA ASN 13 HA ASN 13 -1.833 7.633 -6.658
79 1HB ASN 13 2HB ASN 13 -2.844 9.158 -4.281
80 2HB ASN 13 1HB ASN 13 -1.104 9.134 -4.571
81 1HD2 ASN 13 1HD2 ASN 13 -0.308 10.546 -6.164
82 2HD2 ASN 13 2HD2 ASN 13 -1.287 11.411 -7.248
83 H ASP 14 H ASP 14 -1.855 5.152 -6.118
84 HA ASP 14 HA ASP 14 -1.188 4.078 -3.592
85 1HB ASP 14 2HB ASP 14 -1.653 3.124 -6.069
86 2HB ASP 14 1HB ASP 14 0.103 2.973 -6.046
87 H GLN 15 H GLN 15 0.548 4.517 -2.311
88 HA GLN 15 HA GLN 15 3.179 5.137 -3.620
89 1HB GLN 15 2HB GLN 15 1.570 6.522 -1.513
90 2HB GLN 15 1HB GLN 15 3.325 6.542 -1.337
91 1HG GLN 15 2HG GLN 15 3.631 7.619 -3.436
92 2HG GLN 15 1HG GLN 15 1.971 7.290 -3.933
93 1HE2 GLN 15 1HE2 GLN 15 0.709 9.150 -3.818
94 2HE2 GLN 15 2HE2 GLN 15 0.874 10.373 -2.654
95 H CYS 16 H CYS 16 2.209 2.527 -2.624
96 HA CYS 16 HA CYS 16 3.376 2.026 0.002
97 1HB CYS 16 2HB CYS 16 2.370 0.321 -2.290
98 2HB CYS 16 1HB CYS 16 2.981 -0.381 -0.793
99 H CYS 17 H CYS 17 5.315 0.760 0.398
100 HA CYS 17 HA CYS 17 7.548 1.408 -1.336
101 1HB CYS 17 2HB CYS 17 7.251 0.914 1.278
102 2HB CYS 17 1HB CYS 17 7.693 -0.715 0.765
103 H LYS 18 H LYS 18 8.299 0.241 -3.050
104 HA LYS 18 HA LYS 18 6.987 -2.192 -3.932
105 1HB LYS 18 2HB LYS 18 9.251 -0.429 -4.799
106 2HB LYS 18 1HB LYS 18 9.094 -2.020 -5.544
107 1HG LYS 18 2HG LYS 18 6.520 -1.201 -5.690
108 2HG LYS 18 1HG LYS 18 7.331 0.362 -5.778
109 1HD LYS 18 2HD LYS 18 7.275 -0.257 -8.026
110 2HD LYS 18 1HD LYS 18 8.864 -0.850 -7.538
111 1HE LYS 18 2HE LYS 18 8.062 -3.104 -7.329
112 2HE LYS 18 1HE LYS 18 6.372 -2.582 -7.468
113 1HZ LYS 18 1HZ LYS 18 6.817 -1.760 -9.680
114 2HZ LYS 18 2HZ LYS 18 7.254 -3.399 -9.593
115 3HZ LYS 18 3HZ LYS 18 8.452 -2.196 -9.558
116 H SER 19 H SER 19 9.895 -1.527 -2.056
117 HA SER 19 HA SER 19 11.355 -3.934 -2.426
118 1HB SER 19 2HB SER 19 10.982 -2.060 -0.074
119 2HB SER 19 1HB SER 19 12.168 -3.362 -0.075
120 HG SER 19 HG SER 19 12.193 -0.945 -1.358
121 H SER 20 H SER 20 8.695 -3.187 -0.156
122 HA SER 20 HA SER 20 8.683 -5.972 0.863
123 1HB SER 20 2HB SER 20 8.439 -3.920 2.297
124 2HB SER 20 1HB SER 20 6.907 -3.593 1.491
125 HG SER 20 HG SER 20 6.536 -4.759 3.380
126 H ASN 21 H ASN 21 7.375 -4.419 -1.819
127 HA ASN 21 HA ASN 21 5.613 -4.918 -3.292
128 1HB ASN 21 2HB ASN 21 6.879 -7.220 -2.494
129 2HB ASN 21 1HB ASN 21 5.201 -7.593 -2.101
130 1HD2 ASN 21 1HD2 ASN 21 7.477 -7.377 -4.686
131 2HD2 ASN 21 2HD2 ASN 21 6.375 -7.567 -5.962
132 H LEU 22 H LEU 22 4.244 -3.356 -2.058
133 HA LEU 22 HA LEU 22 2.002 -4.750 -0.623
134 1HB LEU 22 2HB LEU 22 3.436 -2.143 -0.043
135 2HB LEU 22 1HB LEU 22 1.911 -2.588 0.722
136 HG LEU 22 HG LEU 22 4.209 -4.525 0.781
137 1HD1 LEU 22 1HD1 LEU 22 4.882 -3.486 2.967
138 2HD1 LEU 22 2HD1 LEU 22 3.816 -2.129 2.599
139 3HD1 LEU 22 3HD1 LEU 22 5.212 -2.459 1.573
140 1HD2 LEU 22 1HD2 LEU 22 2.030 -5.284 1.568
141 2HD2 LEU 22 2HD2 LEU 22 1.880 -3.873 2.614
142 3HD2 LEU 22 3HD2 LEU 22 3.102 -5.098 2.956
143 H VAL 23 H VAL 23 -0.057 -3.479 -0.714
144 HA VAL 23 HA VAL 23 -0.249 -1.656 -3.082
145 HB VAL 23 HB VAL 23 -2.394 -2.918 -3.622
146 1HG1 VAL 23 1HG1 VAL 23 -1.232 -4.752 -4.741
147 2HG1 VAL 23 2HG1 VAL 23 0.155 -4.563 -3.667
148 3HG1 VAL 23 3HG1 VAL 23 -0.245 -3.294 -4.825
149 1HG2 VAL 23 1HG2 VAL 23 -1.243 -5.078 -1.841
150 2HG2 VAL 23 2HG2 VAL 23 -2.828 -5.031 -2.613
151 3HG2 VAL 23 3HG2 VAL 23 -2.472 -3.953 -1.264
152 H CYS 24 H CYS 24 -1.710 0.041 -2.792
153 HA CYS 24 HA CYS 24 -2.580 0.616 -0.072
154 1HB CYS 24 2HB CYS 24 -1.785 2.158 -2.043
155 2HB CYS 24 1HB CYS 24 -3.479 2.097 -2.532
156 H SER 25 H SER 25 -4.495 0.010 0.818
157 HA SER 25 HA SER 25 -6.529 -1.398 -0.732
158 1HB SER 25 2HB SER 25 -5.811 -1.813 1.668
159 2HB SER 25 1HB SER 25 -6.636 -0.318 2.102
160 HG SER 25 HG SER 25 -7.742 -2.596 2.044
161 H ARG 26 H ARG 26 -8.689 -0.661 -1.115
162 HA ARG 26 HA ARG 26 -8.948 2.281 -1.384
163 1HB ARG 26 2HB ARG 26 -10.335 -0.179 -2.424
164 2HB ARG 26 1HB ARG 26 -11.121 1.393 -2.561
165 1HG ARG 26 2HG ARG 26 -9.653 2.138 -4.140
166 2HG ARG 26 1HG ARG 26 -8.276 1.342 -3.378
167 1HD ARG 26 2HD ARG 26 -8.612 0.189 -5.456
168 2HD ARG 26 1HD ARG 26 -9.313 -0.874 -4.221
169 HE ARG 26 HE ARG 26 -11.085 1.119 -5.549
170 1HH1 ARG 26 2HH1 ARG 26 -11.905 -1.217 -3.707
171 2HH1 ARG 26 1HH1 ARG 26 -12.558 -2.323 -4.870
172 1HH2 ARG 26 1HH2 ARG 26 -11.147 -0.696 -7.599
173 2HH2 ARG 26 2HH2 ARG 26 -12.126 -2.027 -7.081
174 H ALA 27 H ALA 27 -9.611 0.126 1.074
175 HA ALA 27 HA ALA 27 -12.128 1.531 1.895
176 1HB ALA 27 1HB ALA 27 -10.933 -1.193 2.404
177 2HB ALA 27 2HB ALA 27 -12.510 -0.800 1.717
178 3HB ALA 27 3HB ALA 27 -12.213 -0.557 3.439
179 H HIS 28 H HIS 28 -9.106 0.168 3.236
180 HA HIS 28 HA HIS 28 -9.360 1.879 5.647
181 1HB HIS 28 2HB HIS 28 -7.571 -0.386 4.749
182 2HB HIS 28 1HB HIS 28 -7.242 0.521 6.225
183 HD1 HIS 28 HD1 HIS 28 -9.236 0.519 8.047
184 HD2 HIS 28 HD2 HIS 28 -9.556 -2.318 5.010
185 HE1 HIS 28 HE1 HIS 28 -10.940 -1.183 8.833
186 H ARG 29 H ARG 29 -7.925 2.100 2.553
187 HA ARG 29 HA ARG 29 -6.323 3.556 1.629
188 1HB ARG 29 2HB ARG 29 -7.202 5.013 4.143
189 2HB ARG 29 1HB ARG 29 -6.203 5.755 2.896
190 1HG ARG 29 2HG ARG 29 -7.917 5.744 1.320
191 2HG ARG 29 1HG ARG 29 -8.765 4.409 2.101
192 1HD ARG 29 2HD ARG 29 -8.469 6.986 3.618
193 2HD ARG 29 1HD ARG 29 -9.701 6.877 2.344
194 HE ARG 29 HE ARG 29 -9.557 4.702 4.378
195 1HH1 ARG 29 2HH1 ARG 29 -11.822 4.707 2.513
196 2HH1 ARG 29 1HH1 ARG 29 -13.067 5.524 3.398
197 1HH2 ARG 29 1HH2 ARG 29 -10.872 6.926 5.700
198 2HH2 ARG 29 2HH2 ARG 29 -12.527 6.785 5.208
199 H TRP 30 H TRP 30 -4.983 1.500 2.682
200 HA TRP 30 HA TRP 30 -2.570 2.760 3.858
201 1HB TRP 30 2HB TRP 30 -2.568 1.401 5.808
202 2HB TRP 30 1HB TRP 30 -4.236 1.948 5.661
203 HD1 TRP 30 HD1 TRP 30 -5.663 0.101 3.878
204 HE1 TRP 30 HE1 TRP 30 -5.834 -2.444 4.256
205 HE3 TRP 30 HE3 TRP 30 -1.607 -0.612 6.894
206 HZ2 TRP 30 HZ2 TRP 30 -4.432 -4.507 5.653
207 HZ3 TRP 30 HZ3 TRP 30 -1.046 -2.876 7.730
208 HH2 TRP 30 HH2 TRP 30 -2.452 -4.823 7.114
209 H CYS 31 H CYS 31 -0.717 1.190 3.845
210 HA CYS 31 HA CYS 31 -0.698 -0.346 1.348
211 1HB CYS 31 2HB CYS 31 1.276 0.361 3.522
212 2HB CYS 31 1HB CYS 31 1.711 -0.754 2.226
213 H LYS 32 H LYS 32 -1.440 -2.408 1.299
214 HA LYS 32 HA LYS 32 -0.971 -4.162 3.687
215 1HB LYS 32 2HB LYS 32 -3.168 -5.166 3.181
216 2HB LYS 32 1HB LYS 32 -3.329 -3.432 3.437
217 1HG LYS 32 2HG LYS 32 -4.045 -3.082 1.323
218 2HG LYS 32 1HG LYS 32 -2.767 -4.088 0.644
219 1HD LYS 32 2HD LYS 32 -4.824 -5.181 0.101
220 2HD LYS 32 1HD LYS 32 -4.114 -6.108 1.424
221 1HE LYS 32 2HE LYS 32 -5.678 -5.334 2.984
222 2HE LYS 32 1HE LYS 32 -6.021 -3.863 2.054
223 1HZ LYS 32 1HZ LYS 32 -6.660 -6.625 1.153
224 2HZ LYS 32 2HZ LYS 32 -7.047 -5.183 0.340
225 3HZ LYS 32 3HZ LYS 32 -7.785 -5.549 1.826
226 H TYR 33 H TYR 33 -0.966 -6.530 3.058
227 HA TYR 33 HA TYR 33 0.622 -6.900 0.587
228 1HB TYR 33 2HB TYR 33 0.899 -7.846 3.071
229 2HB TYR 33 1HB TYR 33 -0.156 -9.115 2.447
230 HD1 TYR 33 HD1 TYR 33 3.115 -7.443 2.072
231 HD2 TYR 33 HD2 TYR 33 0.594 -10.648 0.722
232 HE1 TYR 33 HE1 TYR 33 5.047 -8.473 0.909
233 HE2 TYR 33 HE2 TYR 33 2.527 -11.678 -0.441
234 HH TYR 33 HH TYR 33 5.063 -10.302 -1.353
235 H GLU 34 H GLU 34 -0.281 -7.673 -1.278
236 HA GLU 34 HA GLU 34 -3.109 -8.336 -1.440
237 1HB GLU 34 2HB GLU 34 -1.414 -7.279 -3.148
238 2HB GLU 34 1HB GLU 34 -1.045 -8.958 -3.544
239 1HG GLU 34 2HG GLU 34 -2.980 -9.210 -4.680
240 2HG GLU 34 1HG GLU 34 -3.920 -8.491 -3.372
241 H ILE 35 H ILE 35 -3.632 -10.217 -0.327
242 HA ILE 35 HA ILE 35 -3.730 -12.497 0.229
243 HB ILE 35 HB ILE 35 -2.606 -12.712 -2.589
244 1HG1 ILE 35 2HG1 ILE 35 -5.445 -13.158 -2.375
245 2HG1 ILE 35 1HG1 ILE 35 -5.057 -11.594 -1.659
246 1HG2 ILE 35 1HG2 ILE 35 -2.523 -14.894 -1.762
247 2HG2 ILE 35 2HG2 ILE 35 -4.160 -14.838 -2.415
248 3HG2 ILE 35 3HG2 ILE 35 -3.896 -14.644 -0.684
249 1HD1 ILE 35 1HD1 ILE 35 -3.940 -10.870 -3.679
250 2HD1 ILE 35 2HD1 ILE 35 -5.519 -11.508 -4.141
251 3HD1 ILE 35 3HD1 ILE 35 -4.068 -12.481 -4.383
252 1HN NH2 36 1HN NH2 36 -0.955 -13.767 1.612
253 2HN NH2 36 2HN NH2 36 -2.714 -13.560 1.471
Start of MODEL 12
1 1H GLU 1 1H GLU 1 10.880 8.105 -3.806
2 2H GLU 1 2H GLU 1 11.424 9.416 -2.873
3 3H GLU 1 3H GLU 1 9.767 9.234 -3.203
4 HA GLU 1 HA GLU 1 11.421 7.404 -1.531
5 1HB GLU 1 2HB GLU 1 10.834 9.758 -0.726
6 2HB GLU 1 1HB GLU 1 9.144 9.258 -0.782
7 1HG GLU 1 2HG GLU 1 9.478 7.577 0.871
8 2HG GLU 1 1HG GLU 1 11.233 7.682 0.731
9 H CYS 2 H CYS 2 10.456 5.428 -1.150
10 HA CYS 2 HA CYS 2 7.860 4.860 -2.485
11 1HB CYS 2 2HB CYS 2 9.723 3.385 -2.952
12 2HB CYS 2 1HB CYS 2 10.045 3.169 -1.232
13 H LEU 3 H LEU 3 6.097 3.906 -1.329
14 HA LEU 3 HA LEU 3 5.926 4.689 1.521
15 1HB LEU 3 2HB LEU 3 3.948 3.515 -0.466
16 2HB LEU 3 1HB LEU 3 3.527 4.088 1.148
17 HG LEU 3 HG LEU 3 4.950 5.888 -0.812
18 1HD1 LEU 3 1HD1 LEU 3 1.945 5.655 -0.486
19 2HD1 LEU 3 2HD1 LEU 3 2.839 4.969 -1.843
20 3HD1 LEU 3 3HD1 LEU 3 2.816 6.716 -1.594
21 1HD2 LEU 3 1HD2 LEU 3 4.918 6.707 1.444
22 2HD2 LEU 3 2HD2 LEU 3 3.223 6.264 1.649
23 3HD2 LEU 3 3HD2 LEU 3 3.664 7.596 0.580
24 H GLY 4 H GLY 4 6.632 3.203 3.019
25 1HA GLY 4 2HA GLY 4 6.658 0.327 2.363
26 2HA GLY 4 1HA GLY 4 7.331 1.063 3.817
27 H PHE 5 H PHE 5 6.104 -0.916 4.724
28 HA PHE 5 HA PHE 5 3.221 -0.936 4.827
29 1HB PHE 5 2HB PHE 5 4.633 -2.890 5.267
30 2HB PHE 5 1HB PHE 5 5.372 -2.078 6.645
31 HD1 PHE 5 HD1 PHE 5 4.400 -2.225 8.788
32 HD2 PHE 5 HD2 PHE 5 2.076 -3.266 5.328
33 HE1 PHE 5 HE1 PHE 5 2.584 -3.057 10.257
34 HE2 PHE 5 HE2 PHE 5 0.262 -4.099 6.797
35 HZ PHE 5 HZ PHE 5 0.516 -3.995 9.262
36 H GLY 6 H GLY 6 1.830 0.141 6.217
37 1HA GLY 6 2HA GLY 6 1.290 1.188 8.355
38 2HA GLY 6 1HA GLY 6 2.991 1.617 8.535
39 H LYS 7 H LYS 7 3.477 2.724 5.985
40 HA LYS 7 HA LYS 7 2.532 5.412 6.305
41 1HB LYS 7 2HB LYS 7 4.295 3.860 4.625
42 2HB LYS 7 1HB LYS 7 3.341 4.949 3.618
43 1HG LYS 7 2HG LYS 7 4.758 6.597 4.214
44 2HG LYS 7 1HG LYS 7 4.082 6.496 5.839
45 1HD LYS 7 2HD LYS 7 6.255 4.598 4.971
46 2HD LYS 7 1HD LYS 7 6.658 6.215 5.548
47 1HE LYS 7 2HE LYS 7 4.765 4.559 7.190
48 2HE LYS 7 1HE LYS 7 6.500 4.198 7.269
49 1HZ LYS 7 1HZ LYS 7 5.913 5.906 8.878
50 2HZ LYS 7 2HZ LYS 7 5.263 6.879 7.646
51 3HZ LYS 7 3HZ LYS 7 6.930 6.549 7.684
52 H GLY 8 H GLY 8 1.139 6.612 4.775
53 1HA GLY 8 2HA GLY 8 -1.331 5.218 4.193
54 2HA GLY 8 1HA GLY 8 -0.967 6.888 3.760
55 H CYS 9 H CYS 9 -2.321 5.369 1.920
56 HA CYS 9 HA CYS 9 -0.291 5.080 -0.253
57 1HB CYS 9 2HB CYS 9 -1.239 2.909 -0.853
58 2HB CYS 9 1HB CYS 9 -0.765 2.873 0.845
59 H ASN 10 H ASN 10 -1.701 4.527 -2.380
60 HA ASN 10 HA ASN 10 -4.122 6.297 -2.390
61 1HB ASN 10 2HB ASN 10 -1.584 6.341 -3.938
62 2HB ASN 10 1HB ASN 10 -3.054 6.634 -4.868
63 1HD2 ASN 10 1HD2 ASN 10 -4.018 8.695 -4.679
64 2HD2 ASN 10 2HD2 ASN 10 -3.509 9.881 -3.576
65 HA PRO 11 HA PRO 11 -5.778 2.551 -4.178
66 1HB PRO 11 2HB PRO 11 -8.279 3.540 -4.726
67 2HB PRO 11 1HB PRO 11 -7.764 3.050 -3.100
68 1HG PRO 11 2HG PRO 11 -7.935 5.776 -4.286
69 2HG PRO 11 1HG PRO 11 -8.351 5.228 -2.655
70 1HD PRO 11 2HD PRO 11 -6.041 6.534 -3.235
71 2HD PRO 11 1HD PRO 11 -6.184 5.351 -1.916
72 H SER 12 H SER 12 -6.253 5.742 -5.730
73 HA SER 12 HA SER 12 -6.644 4.630 -8.404
74 1HB SER 12 2HB SER 12 -6.530 7.043 -9.017
75 2HB SER 12 1HB SER 12 -7.613 6.768 -7.656
76 HG SER 12 HG SER 12 -6.334 7.921 -6.454
77 H ASN 13 H ASN 13 -3.924 5.983 -6.558
78 HA ASN 13 HA ASN 13 -2.079 5.170 -8.783
79 1HB ASN 13 2HB ASN 13 -2.528 7.682 -8.230
80 2HB ASN 13 1HB ASN 13 -1.556 7.381 -6.790
81 1HD2 ASN 13 1HD2 ASN 13 -1.278 8.492 -9.919
82 2HD2 ASN 13 2HD2 ASN 13 0.345 8.093 -10.213
83 H ASP 14 H ASP 14 -2.185 3.067 -7.438
84 HA ASP 14 HA ASP 14 -1.192 2.864 -4.774
85 1HB ASP 14 2HB ASP 14 -2.327 1.175 -6.453
86 2HB ASP 14 1HB ASP 14 -0.663 0.785 -6.885
87 H GLN 15 H GLN 15 0.816 3.418 -4.044
88 HA GLN 15 HA GLN 15 3.174 2.962 -5.841
89 1HB GLN 15 2HB GLN 15 2.020 5.409 -5.003
90 2HB GLN 15 1HB GLN 15 3.500 5.226 -4.063
91 1HG GLN 15 2HG GLN 15 4.217 4.424 -6.647
92 2HG GLN 15 1HG GLN 15 3.182 5.831 -6.893
93 1HE2 GLN 15 1HE2 GLN 15 3.837 7.876 -5.776
94 2HE2 GLN 15 2HE2 GLN 15 5.459 8.108 -5.335
95 H CYS 16 H CYS 16 2.218 1.208 -3.731
96 HA CYS 16 HA CYS 16 3.805 1.693 -1.314
97 1HB CYS 16 2HB CYS 16 1.546 0.433 -1.663
98 2HB CYS 16 1HB CYS 16 2.558 -0.921 -2.166
99 H CYS 17 H CYS 17 5.500 0.131 -0.606
100 HA CYS 17 HA CYS 17 7.491 -0.328 -2.663
101 1HB CYS 17 2HB CYS 17 7.157 -0.618 0.268
102 2HB CYS 17 1HB CYS 17 8.342 -1.702 -0.460
103 H LYS 18 H LYS 18 8.031 -2.234 -3.703
104 HA LYS 18 HA LYS 18 6.096 -4.469 -3.542
105 1HB LYS 18 2HB LYS 18 8.178 -3.424 -5.392
106 2HB LYS 18 1HB LYS 18 7.907 -5.165 -5.437
107 1HG LYS 18 2HG LYS 18 5.334 -4.244 -5.400
108 2HG LYS 18 1HG LYS 18 6.139 -2.961 -6.305
109 1HD LYS 18 2HD LYS 18 7.091 -5.545 -7.190
110 2HD LYS 18 1HD LYS 18 5.331 -5.482 -7.284
111 1HE LYS 18 2HE LYS 18 5.428 -3.433 -8.618
112 2HE LYS 18 1HE LYS 18 7.194 -3.378 -8.447
113 1HZ LYS 18 1HZ LYS 18 6.538 -4.459 -10.525
114 2HZ LYS 18 2HZ LYS 18 5.651 -5.617 -9.654
115 3HZ LYS 18 3HZ LYS 18 7.342 -5.544 -9.498
116 H SER 19 H SER 19 8.617 -3.780 -1.607
117 HA SER 19 HA SER 19 10.314 -6.103 -1.760
118 1HB SER 19 2HB SER 19 11.411 -4.855 -0.223
119 2HB SER 19 1HB SER 19 10.100 -3.686 -0.314
120 HG SER 19 HG SER 19 10.182 -4.290 1.787
121 H SER 20 H SER 20 7.351 -5.370 0.093
122 HA SER 20 HA SER 20 7.258 -8.245 0.956
123 1HB SER 20 2HB SER 20 7.446 -6.143 2.565
124 2HB SER 20 1HB SER 20 5.714 -6.031 2.269
125 HG SER 20 HG SER 20 7.185 -7.923 3.658
126 H ASN 21 H ASN 21 6.068 -6.501 -1.469
127 HA ASN 21 HA ASN 21 4.094 -6.515 -2.746
128 1HB ASN 21 2HB ASN 21 4.789 -9.050 -2.007
129 2HB ASN 21 1HB ASN 21 3.141 -8.970 -1.379
130 1HD2 ASN 21 1HD2 ASN 21 1.424 -8.253 -3.007
131 2HD2 ASN 21 2HD2 ASN 21 1.656 -8.647 -4.641
132 H LEU 22 H LEU 22 3.491 -4.625 -1.225
133 HA LEU 22 HA LEU 22 1.206 -5.317 0.582
134 1HB LEU 22 2HB LEU 22 3.056 -2.934 0.297
135 2HB LEU 22 1HB LEU 22 1.663 -2.939 1.378
136 HG LEU 22 HG LEU 22 3.581 -5.230 1.547
137 1HD1 LEU 22 1HD1 LEU 22 4.979 -3.145 1.476
138 2HD1 LEU 22 2HD1 LEU 22 5.064 -3.989 3.022
139 3HD1 LEU 22 3HD1 LEU 22 4.072 -2.540 2.862
140 1HD2 LEU 22 1HD2 LEU 22 2.968 -4.916 3.991
141 2HD2 LEU 22 2HD2 LEU 22 1.612 -5.310 2.936
142 3HD2 LEU 22 3HD2 LEU 22 1.856 -3.648 3.475
143 H VAL 23 H VAL 23 -0.819 -4.306 0.273
144 HA VAL 23 HA VAL 23 -1.181 -2.903 -2.357
145 HB VAL 23 HB VAL 23 -3.493 -3.801 -2.222
146 1HG1 VAL 23 1HG1 VAL 23 -1.520 -6.027 -1.677
147 2HG1 VAL 23 2HG1 VAL 23 -1.532 -5.120 -3.188
148 3HG1 VAL 23 3HG1 VAL 23 -2.942 -6.068 -2.718
149 1HG2 VAL 23 1HG2 VAL 23 -4.207 -5.224 -0.439
150 2HG2 VAL 23 2HG2 VAL 23 -3.481 -3.821 0.343
151 3HG2 VAL 23 3HG2 VAL 23 -2.578 -5.332 0.227
152 H CYS 24 H CYS 24 -3.049 -1.285 -2.332
153 HA CYS 24 HA CYS 24 -2.787 0.451 0.050
154 1HB CYS 24 2HB CYS 24 -2.547 1.298 -2.271
155 2HB CYS 24 1HB CYS 24 -4.207 0.808 -2.610
156 H SER 25 H SER 25 -4.339 0.544 1.622
157 HA SER 25 HA SER 25 -6.773 -1.081 1.416
158 1HB SER 25 2HB SER 25 -5.200 -0.611 3.437
159 2HB SER 25 1HB SER 25 -6.080 0.909 3.578
160 HG SER 25 HG SER 25 -7.786 -0.145 4.253
161 H ARG 26 H ARG 26 -8.925 -0.043 2.038
162 HA ARG 26 HA ARG 26 -9.245 2.566 0.598
163 1HB ARG 26 2HB ARG 26 -10.356 0.390 -0.168
164 2HB ARG 26 1HB ARG 26 -11.352 0.502 1.284
165 1HG ARG 26 2HG ARG 26 -11.760 2.976 0.409
166 2HG ARG 26 1HG ARG 26 -11.334 2.257 -1.144
167 1HD ARG 26 2HD ARG 26 -13.685 1.964 -1.034
168 2HD ARG 26 1HD ARG 26 -13.064 0.398 -0.477
169 HE ARG 26 HE ARG 26 -13.263 2.163 1.769
170 1HH1 ARG 26 1HH2 ARG 26 -15.884 2.807 0.544
171 2HH1 ARG 26 2HH2 ARG 26 -16.915 1.563 1.167
172 1HH2 ARG 26 2HH1 ARG 26 -14.287 -0.493 2.139
173 2HH2 ARG 26 1HH1 ARG 26 -16.007 -0.312 2.073
174 H ALA 27 H ALA 27 -10.154 0.811 3.574
175 HA ALA 27 HA ALA 27 -11.752 2.975 4.671
176 1HB ALA 27 1HB ALA 27 -12.009 0.580 5.250
177 2HB ALA 27 2HB ALA 27 -11.686 1.549 6.688
178 3HB ALA 27 3HB ALA 27 -10.397 0.588 5.966
179 H HIS 28 H HIS 28 -8.464 1.760 5.384
180 HA HIS 28 HA HIS 28 -7.912 4.201 7.000
181 1HB HIS 28 2HB HIS 28 -6.825 1.435 6.713
182 2HB HIS 28 1HB HIS 28 -5.701 2.689 7.234
183 HD1 HIS 28 HD1 HIS 28 -7.309 0.249 8.896
184 HD2 HIS 28 HD2 HIS 28 -7.720 4.384 9.229
185 HE1 HIS 28 HE1 HIS 28 -8.283 0.691 11.192
186 H ARG 29 H ARG 29 -7.390 3.011 3.809
187 HA ARG 29 HA ARG 29 -6.031 3.746 2.031
188 1HB ARG 29 2HB ARG 29 -6.519 6.127 3.806
189 2HB ARG 29 1HB ARG 29 -5.477 6.302 2.394
190 1HG ARG 29 2HG ARG 29 -7.462 5.066 1.160
191 2HG ARG 29 1HG ARG 29 -8.407 5.677 2.518
192 1HD ARG 29 2HD ARG 29 -6.584 7.664 1.277
193 2HD ARG 29 1HD ARG 29 -7.941 7.135 0.262
194 HE ARG 29 HE ARG 29 -9.461 7.755 2.141
195 1HH1 ARG 29 2HH1 ARG 29 -7.989 10.252 1.219
196 2HH1 ARG 29 1HH1 ARG 29 -7.510 10.944 2.733
197 1HH2 ARG 29 1HH2 ARG 29 -8.072 8.033 4.545
198 2HH2 ARG 29 2HH2 ARG 29 -7.557 9.686 4.619
199 H TRP 30 H TRP 30 -4.437 2.168 3.325
200 HA TRP 30 HA TRP 30 -1.845 3.597 3.500
201 1HB TRP 30 2HB TRP 30 -1.389 2.817 5.731
202 2HB TRP 30 1HB TRP 30 -2.995 3.539 5.773
203 HD1 TRP 30 HD1 TRP 30 -4.974 1.505 5.065
204 HE1 TRP 30 HE1 TRP 30 -5.222 -0.781 6.234
205 HE3 TRP 30 HE3 TRP 30 -0.330 1.073 7.117
206 HZ2 TRP 30 HZ2 TRP 30 -3.647 -2.557 7.836
207 HZ3 TRP 30 HZ3 TRP 30 0.274 -0.919 8.460
208 HH2 TRP 30 HH2 TRP 30 -1.376 -2.733 8.823
209 H CYS 31 H CYS 31 -0.060 1.823 3.934
210 HA CYS 31 HA CYS 31 -0.408 -0.251 1.887
211 1HB CYS 31 2HB CYS 31 1.778 0.884 3.592
212 2HB CYS 31 1HB CYS 31 2.034 -0.704 2.868
213 H LYS 32 H LYS 32 -1.313 -2.195 2.380
214 HA LYS 32 HA LYS 32 -0.757 -3.409 5.068
215 1HB LYS 32 2HB LYS 32 -3.132 -4.189 5.013
216 2HB LYS 32 1HB LYS 32 -3.007 -2.431 5.007
217 1HG LYS 32 2HG LYS 32 -3.555 -2.275 2.719
218 2HG LYS 32 1HG LYS 32 -3.180 -3.973 2.420
219 1HD LYS 32 2HD LYS 32 -5.117 -4.654 3.774
220 2HD LYS 32 1HD LYS 32 -5.487 -2.961 4.108
221 1HE LYS 32 2HE LYS 32 -5.571 -2.673 1.527
222 2HE LYS 32 1HE LYS 32 -5.697 -4.442 1.482
223 1HZ LYS 32 1HZ LYS 32 -7.429 -2.631 3.084
224 2HZ LYS 32 2HZ LYS 32 -7.543 -4.325 3.033
225 3HZ LYS 32 3HZ LYS 32 -7.888 -3.405 1.648
226 H TYR 33 H TYR 33 -0.994 -5.821 5.037
227 HA TYR 33 HA TYR 33 -0.358 -6.949 2.326
228 1HB TYR 33 2HB TYR 33 1.486 -7.014 3.939
229 2HB TYR 33 1HB TYR 33 0.447 -7.798 5.129
230 HD1 TYR 33 HD1 TYR 33 0.060 -10.151 5.079
231 HD2 TYR 33 HD2 TYR 33 2.019 -8.223 1.777
232 HE1 TYR 33 HE1 TYR 33 0.624 -12.367 4.121
233 HE2 TYR 33 HE2 TYR 33 2.584 -10.440 0.820
234 HH TYR 33 HH TYR 33 2.769 -13.082 2.290
235 H GLU 34 H GLU 34 -1.324 -8.953 1.750
236 HA GLU 34 HA GLU 34 -3.545 -9.919 3.522
237 1HB GLU 34 2HB GLU 34 -3.882 -8.489 1.236
238 2HB GLU 34 1HB GLU 34 -3.810 -10.118 0.563
239 1HG GLU 34 2HG GLU 34 -5.599 -9.398 2.896
240 2HG GLU 34 1HG GLU 34 -6.137 -9.295 1.220
241 H ILE 35 H ILE 35 -3.285 -12.069 3.986
242 HA ILE 35 HA ILE 35 -1.184 -13.658 2.761
243 HB ILE 35 HB ILE 35 -2.003 -13.764 5.138
244 1HG1 ILE 35 2HG1 ILE 35 -2.404 -16.489 3.950
245 2HG1 ILE 35 1HG1 ILE 35 -0.851 -15.686 3.716
246 1HG2 ILE 35 1HG2 ILE 35 -4.466 -13.677 4.399
247 2HG2 ILE 35 2HG2 ILE 35 -4.068 -14.812 5.688
248 3HG2 ILE 35 3HG2 ILE 35 -4.301 -15.395 4.041
249 1HD1 ILE 35 1HD1 ILE 35 -0.276 -15.867 5.919
250 2HD1 ILE 35 2HD1 ILE 35 -1.442 -17.191 5.900
251 3HD1 ILE 35 3HD1 ILE 35 -1.928 -15.596 6.476
252 1HN NH2 36 1HN NH2 36 -4.276 -13.833 0.412
253 2HN NH2 36 2HN NH2 36 -3.565 -12.526 1.383
Start of MODEL 13
1 1H GLU 1 1H GLU 1 10.696 9.075 -0.907
2 2H GLU 1 2H GLU 1 11.342 7.518 -1.120
3 3H GLU 1 3H GLU 1 12.180 8.666 -0.192
4 HA GLU 1 HA GLU 1 11.108 7.094 1.281
5 1HB GLU 1 2HB GLU 1 11.285 9.666 1.609
6 2HB GLU 1 1HB GLU 1 9.549 9.683 1.300
7 1HG GLU 1 2HG GLU 1 10.332 7.604 3.209
8 2HG GLU 1 1HG GLU 1 10.746 9.227 3.763
9 H CYS 2 H CYS 2 9.407 5.680 1.552
10 HA CYS 2 HA CYS 2 6.844 6.238 0.099
11 1HB CYS 2 2HB CYS 2 6.855 3.789 -0.490
12 2HB CYS 2 1HB CYS 2 8.167 4.696 -1.238
13 H LEU 3 H LEU 3 5.089 4.647 0.917
14 HA LEU 3 HA LEU 3 5.116 4.703 3.880
15 1HB LEU 3 2HB LEU 3 3.014 4.030 1.793
16 2HB LEU 3 1HB LEU 3 2.702 4.132 3.525
17 HG LEU 3 HG LEU 3 4.054 6.464 2.240
18 1HD1 LEU 3 1HD1 LEU 3 1.860 7.389 1.545
19 2HD1 LEU 3 2HD1 LEU 3 1.096 5.852 1.950
20 3HD1 LEU 3 3HD1 LEU 3 2.269 5.934 0.636
21 1HD2 LEU 3 1HD2 LEU 3 2.098 7.430 3.844
22 2HD2 LEU 3 2HD2 LEU 3 3.681 6.950 4.457
23 3HD2 LEU 3 3HD2 LEU 3 2.315 5.841 4.577
24 H GLY 4 H GLY 4 5.671 2.887 5.031
25 1HA GLY 4 2HA GLY 4 6.056 0.324 3.671
26 2HA GLY 4 1HA GLY 4 6.353 0.645 5.379
27 H PHE 5 H PHE 5 5.238 -1.437 5.769
28 HA PHE 5 HA PHE 5 2.423 -1.769 5.101
29 1HB PHE 5 2HB PHE 5 3.926 -3.663 5.423
30 2HB PHE 5 1HB PHE 5 4.308 -3.128 7.058
31 HD1 PHE 5 HD1 PHE 5 1.244 -3.852 4.989
32 HD2 PHE 5 HD2 PHE 5 3.209 -4.215 8.794
33 HE1 PHE 5 HE1 PHE 5 -0.691 -5.130 5.868
34 HE2 PHE 5 HE2 PHE 5 1.271 -5.492 9.671
35 HZ PHE 5 HZ PHE 5 -0.677 -5.949 8.206
36 H GLY 6 H GLY 6 0.630 -1.287 6.378
37 1HA GLY 6 2HA GLY 6 -0.591 -0.586 8.282
38 2HA GLY 6 1HA GLY 6 0.917 -0.545 9.197
39 H LYS 7 H LYS 7 0.046 1.126 6.162
40 HA LYS 7 HA LYS 7 0.168 3.747 7.578
41 1HB LYS 7 2HB LYS 7 2.155 2.550 5.762
42 2HB LYS 7 1HB LYS 7 1.662 4.178 5.294
43 1HG LYS 7 2HG LYS 7 2.174 5.004 7.550
44 2HG LYS 7 1HG LYS 7 2.628 3.376 8.055
45 1HD LYS 7 2HD LYS 7 4.568 3.369 6.754
46 2HD LYS 7 1HD LYS 7 3.963 4.618 5.665
47 1HE LYS 7 2HE LYS 7 5.313 6.001 6.903
48 2HE LYS 7 1HE LYS 7 3.979 5.957 8.073
49 1HZ LYS 7 1HZ LYS 7 6.058 5.282 9.117
50 2HZ LYS 7 2HZ LYS 7 6.257 4.045 7.969
51 3HZ LYS 7 3HZ LYS 7 4.967 3.985 9.073
52 H GLY 8 H GLY 8 -1.355 5.142 6.738
53 1HA GLY 8 2HA GLY 8 -3.302 4.306 4.863
54 2HA GLY 8 1HA GLY 8 -3.040 5.981 5.338
55 H CYS 9 H CYS 9 -3.425 4.387 2.664
56 HA CYS 9 HA CYS 9 -1.434 5.999 1.129
57 1HB CYS 9 2HB CYS 9 -0.561 3.696 1.514
58 2HB CYS 9 1HB CYS 9 -2.015 3.039 0.763
59 H ASN 10 H ASN 10 -2.146 6.418 -1.080
60 HA ASN 10 HA ASN 10 -5.102 6.290 -1.400
61 1HB ASN 10 2HB ASN 10 -2.847 7.792 -2.759
62 2HB ASN 10 1HB ASN 10 -4.525 7.901 -3.290
63 1HD2 ASN 10 1HD2 ASN 10 -2.237 9.213 -1.099
64 2HD2 ASN 10 2HD2 ASN 10 -3.325 10.074 -0.120
65 HA PRO 11 HA PRO 11 -4.702 2.999 -4.356
66 1HB PRO 11 2HB PRO 11 -7.175 3.213 -5.511
67 2HB PRO 11 1HB PRO 11 -6.913 2.496 -3.908
68 1HG PRO 11 2HG PRO 11 -7.868 5.223 -4.627
69 2HG PRO 11 1HG PRO 11 -8.399 4.149 -3.323
70 1HD PRO 11 2HD PRO 11 -6.727 6.263 -2.937
71 2HD PRO 11 1HD PRO 11 -6.711 4.805 -1.919
72 H SER 12 H SER 12 -5.860 6.221 -5.378
73 HA SER 12 HA SER 12 -5.498 5.880 -8.209
74 1HB SER 12 2HB SER 12 -5.536 8.238 -6.313
75 2HB SER 12 1HB SER 12 -5.377 8.449 -8.055
76 HG SER 12 HG SER 12 -7.571 8.497 -7.250
77 H ASN 13 H ASN 13 -3.324 7.141 -5.657
78 HA ASN 13 HA ASN 13 -1.054 6.958 -7.610
79 1HB ASN 13 2HB ASN 13 -1.848 9.228 -6.638
80 2HB ASN 13 1HB ASN 13 -1.154 8.667 -5.115
81 1HD2 ASN 13 1HD2 ASN 13 -0.363 9.716 -8.404
82 2HD2 ASN 13 2HD2 ASN 13 1.315 9.808 -8.161
83 H ASP 14 H ASP 14 -1.162 4.609 -6.816
84 HA ASP 14 HA ASP 14 -0.570 3.843 -4.129
85 1HB ASP 14 2HB ASP 14 -0.665 2.694 -6.824
86 2HB ASP 14 1HB ASP 14 0.553 1.925 -5.807
87 H GLN 15 H GLN 15 1.164 4.935 -3.171
88 HA GLN 15 HA GLN 15 3.835 4.688 -4.521
89 1HB GLN 15 2HB GLN 15 2.557 6.964 -3.986
90 2HB GLN 15 1HB GLN 15 3.226 6.696 -2.377
91 1HG GLN 15 2HG GLN 15 5.346 7.152 -3.051
92 2HG GLN 15 1HG GLN 15 5.153 6.267 -4.563
93 1HE2 GLN 15 1HE2 GLN 15 4.404 9.407 -3.002
94 2HE2 GLN 15 2HE2 GLN 15 4.262 10.272 -4.455
95 H CYS 16 H CYS 16 2.718 2.579 -2.902
96 HA CYS 16 HA CYS 16 3.744 2.749 -0.175
97 1HB CYS 16 2HB CYS 16 1.814 1.340 -1.305
98 2HB CYS 16 1HB CYS 16 3.115 0.197 -1.642
99 H CYS 17 H CYS 17 5.417 1.121 0.597
100 HA CYS 17 HA CYS 17 7.848 1.334 -0.994
101 1HB CYS 17 2HB CYS 17 7.126 -0.152 1.555
102 2HB CYS 17 1HB CYS 17 8.771 0.041 0.950
103 H LYS 18 H LYS 18 8.373 -0.051 -2.633
104 HA LYS 18 HA LYS 18 6.914 -2.549 -3.055
105 1HB LYS 18 2HB LYS 18 7.822 -0.862 -4.770
106 2HB LYS 18 1HB LYS 18 9.402 -1.591 -4.479
107 1HG LYS 18 2HG LYS 18 8.891 -3.405 -5.720
108 2HG LYS 18 1HG LYS 18 7.347 -3.616 -4.892
109 1HD LYS 18 2HD LYS 18 7.174 -1.284 -6.553
110 2HD LYS 18 1HD LYS 18 7.798 -2.619 -7.524
111 1HE LYS 18 2HE LYS 18 5.733 -3.751 -5.966
112 2HE LYS 18 1HE LYS 18 5.097 -2.203 -6.555
113 1HZ LYS 18 1HZ LYS 18 5.853 -2.769 -8.779
114 2HZ LYS 18 2HZ LYS 18 4.789 -3.959 -8.201
115 3HZ LYS 18 3HZ LYS 18 6.462 -4.254 -8.223
116 H SER 19 H SER 19 9.540 -1.811 -1.059
117 HA SER 19 HA SER 19 11.323 -4.006 -1.486
118 1HB SER 19 2HB SER 19 11.966 -3.476 0.887
119 2HB SER 19 1HB SER 19 11.879 -2.051 -0.144
120 HG SER 19 HG SER 19 10.712 -1.496 1.602
121 H SER 20 H SER 20 8.353 -3.705 0.469
122 HA SER 20 HA SER 20 8.538 -6.618 1.145
123 1HB SER 20 2HB SER 20 8.350 -4.606 2.844
124 2HB SER 20 1HB SER 20 6.646 -4.644 2.401
125 HG SER 20 HG SER 20 6.449 -6.605 3.275
126 H ASN 21 H ASN 21 7.370 -5.106 -1.369
127 HA ASN 21 HA ASN 21 5.501 -5.322 -2.790
128 1HB ASN 21 2HB ASN 21 5.544 -7.907 -1.207
129 2HB ASN 21 1HB ASN 21 4.498 -7.661 -2.603
130 1HD2 ASN 21 1HD2 ASN 21 7.562 -8.788 -1.710
131 2HD2 ASN 21 2HD2 ASN 21 8.321 -8.682 -3.225
132 H LEU 22 H LEU 22 4.596 -3.519 -1.223
133 HA LEU 22 HA LEU 22 2.166 -4.535 0.214
134 1HB LEU 22 2HB LEU 22 3.818 -2.001 0.433
135 2HB LEU 22 1HB LEU 22 2.330 -2.279 1.339
136 HG LEU 22 HG LEU 22 4.578 -4.287 1.429
137 1HD1 LEU 22 1HD1 LEU 22 4.258 -1.791 3.121
138 2HD1 LEU 22 2HD1 LEU 22 5.602 -2.164 2.043
139 3HD1 LEU 22 3HD1 LEU 22 5.352 -3.121 3.503
140 1HD2 LEU 22 1HD2 LEU 22 2.287 -4.824 2.318
141 2HD2 LEU 22 2HD2 LEU 22 2.461 -3.485 3.454
142 3HD2 LEU 22 3HD2 LEU 22 3.544 -4.874 3.553
143 H VAL 23 H VAL 23 0.136 -3.727 -0.377
144 HA VAL 23 HA VAL 23 0.077 -1.853 -2.725
145 HB VAL 23 HB VAL 23 -2.026 -3.092 -3.325
146 1HG1 VAL 23 1HG1 VAL 23 -0.897 -4.989 -4.254
147 2HG1 VAL 23 2HG1 VAL 23 0.322 -4.971 -2.979
148 3HG1 VAL 23 3HG1 VAL 23 0.291 -3.686 -4.187
149 1HG2 VAL 23 1HG2 VAL 23 -2.858 -4.831 -2.066
150 2HG2 VAL 23 2HG2 VAL 23 -2.091 -3.926 -0.761
151 3HG2 VAL 23 3HG2 VAL 23 -1.265 -5.308 -1.480
152 H CYS 24 H CYS 24 -1.547 -0.228 -2.709
153 HA CYS 24 HA CYS 24 -2.525 0.547 -0.032
154 1HB CYS 24 2HB CYS 24 -2.852 1.887 -2.737
155 2HB CYS 24 1HB CYS 24 -3.022 2.648 -1.156
156 H SER 25 H SER 25 -4.480 -0.219 0.648
157 HA SER 25 HA SER 25 -6.438 -1.372 -1.193
158 1HB SER 25 2HB SER 25 -6.045 -1.000 1.743
159 2HB SER 25 1HB SER 25 -7.686 -1.303 1.184
160 HG SER 25 HG SER 25 -7.065 -3.308 1.128
161 H ARG 26 H ARG 26 -8.768 -0.661 -1.092
162 HA ARG 26 HA ARG 26 -8.962 2.329 -1.162
163 1HB ARG 26 2HB ARG 26 -9.463 0.563 -3.100
164 2HB ARG 26 1HB ARG 26 -11.025 0.471 -2.288
165 1HG ARG 26 2HG ARG 26 -10.683 3.166 -2.363
166 2HG ARG 26 1HG ARG 26 -9.830 2.699 -3.834
167 1HD ARG 26 2HD ARG 26 -12.557 1.547 -3.259
168 2HD ARG 26 1HD ARG 26 -12.401 3.154 -3.996
169 HE ARG 26 HE ARG 26 -10.670 1.231 -5.303
170 1HH1 ARG 26 1HH2 ARG 26 -12.043 3.263 -6.891
171 2HH1 ARG 26 2HH2 ARG 26 -13.318 2.383 -7.665
172 1HH2 ARG 26 1HH1 ARG 26 -13.121 -0.324 -5.494
173 2HH2 ARG 26 2HH1 ARG 26 -13.930 0.345 -6.871
174 H ALA 27 H ALA 27 -10.285 -0.565 0.365
175 HA ALA 27 HA ALA 27 -12.672 0.661 1.456
176 1HB ALA 27 1HB ALA 27 -11.048 -1.747 2.338
177 2HB ALA 27 2HB ALA 27 -12.321 -1.773 1.117
178 3HB ALA 27 3HB ALA 27 -12.717 -1.411 2.797
179 H HIS 28 H HIS 28 -9.432 -0.024 2.782
180 HA HIS 28 HA HIS 28 -10.074 1.697 5.147
181 1HB HIS 28 2HB HIS 28 -8.146 -0.560 4.591
182 2HB HIS 28 1HB HIS 28 -7.955 0.478 6.003
183 HD1 HIS 28 HD1 HIS 28 -10.601 0.817 7.187
184 HD2 HIS 28 HD2 HIS 28 -9.579 -2.787 5.356
185 HE1 HIS 28 HE1 HIS 28 -12.178 -0.933 8.118
186 H ARG 29 H ARG 29 -8.485 1.865 2.169
187 HA ARG 29 HA ARG 29 -6.841 3.302 1.282
188 1HB ARG 29 2HB ARG 29 -8.476 4.676 3.288
189 2HB ARG 29 1HB ARG 29 -6.903 5.442 3.075
190 1HG ARG 29 2HG ARG 29 -8.170 6.493 1.417
191 2HG ARG 29 1HG ARG 29 -7.420 5.177 0.515
192 1HD ARG 29 2HD ARG 29 -9.407 4.054 0.244
193 2HD ARG 29 1HD ARG 29 -10.017 4.544 1.836
194 HE ARG 29 HE ARG 29 -10.245 6.108 -0.653
195 1HH1 ARG 29 1HH1 ARG 29 -12.317 5.638 1.603
196 2HH1 ARG 29 2HH1 ARG 29 -12.415 7.233 2.272
197 1HH2 ARG 29 1HH2 ARG 29 -9.519 8.353 0.718
198 2HH2 ARG 29 2HH2 ARG 29 -10.830 8.770 1.770
199 H TRP 30 H TRP 30 -5.458 1.376 2.503
200 HA TRP 30 HA TRP 30 -3.226 2.821 3.814
201 1HB TRP 30 2HB TRP 30 -3.278 1.492 5.797
202 2HB TRP 30 1HB TRP 30 -4.939 2.010 5.533
203 HD1 TRP 30 HD1 TRP 30 -6.259 0.104 3.764
204 HE1 TRP 30 HE1 TRP 30 -6.413 -2.437 4.190
205 HE3 TRP 30 HE3 TRP 30 -2.331 -0.480 6.961
206 HZ2 TRP 30 HZ2 TRP 30 -5.038 -4.451 5.695
207 HZ3 TRP 30 HZ3 TRP 30 -1.771 -2.712 7.876
208 HH2 TRP 30 HH2 TRP 30 -3.117 -4.698 7.249
209 H CYS 31 H CYS 31 -1.352 1.203 4.198
210 HA CYS 31 HA CYS 31 -1.010 -0.404 1.730
211 1HB CYS 31 2HB CYS 31 0.679 0.913 3.801
212 2HB CYS 31 1HB CYS 31 1.361 -0.516 3.024
213 H LYS 32 H LYS 32 -1.170 -2.606 1.754
214 HA LYS 32 HA LYS 32 -0.819 -4.053 4.354
215 1HB LYS 32 2HB LYS 32 -2.819 -5.407 3.700
216 2HB LYS 32 1HB LYS 32 -3.200 -3.703 3.936
217 1HG LYS 32 2HG LYS 32 -3.694 -3.370 1.735
218 2HG LYS 32 1HG LYS 32 -2.401 -4.431 1.181
219 1HD LYS 32 2HD LYS 32 -4.567 -5.420 0.625
220 2HD LYS 32 1HD LYS 32 -3.764 -6.401 1.852
221 1HE LYS 32 2HE LYS 32 -5.197 -5.657 3.570
222 2HE LYS 32 1HE LYS 32 -5.692 -4.217 2.658
223 1HZ LYS 32 1HZ LYS 32 -6.732 -5.650 1.015
224 2HZ LYS 32 2HZ LYS 32 -7.392 -5.945 2.551
225 3HZ LYS 32 3HZ LYS 32 -6.267 -7.031 1.884
226 H TYR 33 H TYR 33 -0.031 -6.231 4.116
227 HA TYR 33 HA TYR 33 1.514 -6.694 1.652
228 1HB TYR 33 2HB TYR 33 2.432 -7.099 3.915
229 2HB TYR 33 1HB TYR 33 1.178 -8.304 4.207
230 HD1 TYR 33 HD1 TYR 33 3.684 -7.480 1.528
231 HD2 TYR 33 HD2 TYR 33 1.793 -10.529 3.891
232 HE1 TYR 33 HE1 TYR 33 5.069 -9.205 0.409
233 HE2 TYR 33 HE2 TYR 33 3.181 -12.255 2.773
234 HH TYR 33 HH TYR 33 4.479 -12.149 0.152
235 H GLU 34 H GLU 34 1.132 -8.344 0.167
236 HA GLU 34 HA GLU 34 -1.369 -9.965 0.531
237 1HB GLU 34 2HB GLU 34 -1.790 -9.582 -1.863
238 2HB GLU 34 1HB GLU 34 -1.630 -8.041 -1.021
239 1HG GLU 34 2HG GLU 34 0.155 -7.461 -2.272
240 2HG GLU 34 1HG GLU 34 0.961 -8.993 -1.941
241 H ILE 35 H ILE 35 -1.342 -11.938 -0.971
242 HA ILE 35 HA ILE 35 1.391 -13.148 -0.936
243 HB ILE 35 HB ILE 35 -1.417 -14.291 -1.103
244 1HG1 ILE 35 2HG1 ILE 35 0.488 -14.885 1.118
245 2HG1 ILE 35 1HG1 ILE 35 -0.220 -13.270 1.084
246 1HG2 ILE 35 1HG2 ILE 35 0.046 -16.436 -0.517
247 2HG2 ILE 35 2HG2 ILE 35 1.294 -15.535 -1.377
248 3HG2 ILE 35 3HG2 ILE 35 -0.214 -15.948 -2.193
249 1HD1 ILE 35 1HD1 ILE 35 -1.792 -15.862 0.990
250 2HD1 ILE 35 2HD1 ILE 35 -2.477 -14.237 1.013
251 3HD1 ILE 35 3HD1 ILE 35 -1.598 -14.843 2.416
252 1HN NH2 36 1HN NH2 36 -0.663 -12.699 -4.479
253 2HN NH2 36 2HN NH2 36 -1.056 -11.902 -2.940
Start of MODEL 14
1 1H GLU 1 1H GLU 1 7.344 10.690 2.817
2 2H GLU 1 2H GLU 1 8.552 10.830 4.003
3 3H GLU 1 3H GLU 1 7.123 9.973 4.338
4 HA GLU 1 HA GLU 1 9.203 9.177 2.357
5 1HB GLU 1 2HB GLU 1 8.602 8.627 5.225
6 2HB GLU 1 1HB GLU 1 9.079 7.239 4.247
7 1HG GLU 1 2HG GLU 1 11.215 7.893 4.563
8 2HG GLU 1 1HG GLU 1 10.867 9.247 3.490
9 H CYS 2 H CYS 2 8.757 6.665 1.987
10 HA CYS 2 HA CYS 2 6.150 6.428 0.734
11 1HB CYS 2 2HB CYS 2 6.997 4.187 0.154
12 2HB CYS 2 1HB CYS 2 8.261 5.392 -0.080
13 H LEU 3 H LEU 3 4.598 4.647 1.260
14 HA LEU 3 HA LEU 3 4.171 4.452 4.189
15 1HB LEU 3 2HB LEU 3 2.517 3.664 1.764
16 2HB LEU 3 1HB LEU 3 1.948 3.588 3.431
17 HG LEU 3 HG LEU 3 3.030 6.149 2.251
18 1HD1 LEU 3 1HD1 LEU 3 1.081 5.188 0.911
19 2HD1 LEU 3 2HD1 LEU 3 0.820 6.791 1.596
20 3HD1 LEU 3 3HD1 LEU 3 0.106 5.375 2.368
21 1HD2 LEU 3 1HD2 LEU 3 1.433 7.049 4.046
22 2HD2 LEU 3 2HD2 LEU 3 2.871 6.214 4.634
23 3HD2 LEU 3 3HD2 LEU 3 1.313 5.387 4.625
24 H GLY 4 H GLY 4 4.839 2.652 5.284
25 1HA GLY 4 2HA GLY 4 5.679 0.259 3.769
26 2HA GLY 4 1HA GLY 4 5.967 0.554 5.483
27 H PHE 5 H PHE 5 5.182 -1.601 5.933
28 HA PHE 5 HA PHE 5 2.448 -2.394 5.261
29 1HB PHE 5 2HB PHE 5 4.733 -3.686 5.867
30 2HB PHE 5 1HB PHE 5 4.019 -3.645 7.476
31 HD1 PHE 5 HD1 PHE 5 1.081 -3.783 6.656
32 HD2 PHE 5 HD2 PHE 5 4.529 -5.998 5.357
33 HE1 PHE 5 HE1 PHE 5 -0.371 -5.699 6.054
34 HE2 PHE 5 HE2 PHE 5 3.073 -7.908 4.754
35 HZ PHE 5 HZ PHE 5 0.624 -7.760 5.102
36 H GLY 6 H GLY 6 0.648 -1.733 6.385
37 1HA GLY 6 2HA GLY 6 -0.484 -1.652 8.599
38 2HA GLY 6 1HA GLY 6 0.993 -0.951 9.254
39 H LYS 7 H LYS 7 1.498 0.931 7.144
40 HA LYS 7 HA LYS 7 -0.114 3.139 8.011
41 1HB LYS 7 2HB LYS 7 1.850 2.607 5.787
42 2HB LYS 7 1HB LYS 7 1.017 4.160 5.885
43 1HG LYS 7 2HG LYS 7 1.786 4.299 8.300
44 2HG LYS 7 1HG LYS 7 2.811 2.902 7.974
45 1HD LYS 7 2HD LYS 7 3.659 4.321 5.945
46 2HD LYS 7 1HD LYS 7 2.995 5.684 6.846
47 1HE LYS 7 2HE LYS 7 4.381 5.092 8.801
48 2HE LYS 7 1HE LYS 7 5.043 3.705 7.914
49 1HZ LYS 7 1HZ LYS 7 6.472 5.667 7.704
50 2HZ LYS 7 2HZ LYS 7 5.184 6.540 7.022
51 3HZ LYS 7 3HZ LYS 7 5.838 5.202 6.202
52 H GLY 8 H GLY 8 -1.947 4.070 7.122
53 1HA GLY 8 2HA GLY 8 -3.505 2.479 5.226
54 2HA GLY 8 1HA GLY 8 -4.027 3.972 6.001
55 H CYS 9 H CYS 9 -4.019 3.056 3.099
56 HA CYS 9 HA CYS 9 -2.877 5.575 1.988
57 1HB CYS 9 2HB CYS 9 -1.848 4.163 0.150
58 2HB CYS 9 1HB CYS 9 -1.115 3.929 1.735
59 H ASN 10 H ASN 10 -3.478 5.504 -0.554
60 HA ASN 10 HA ASN 10 -6.351 4.648 -0.734
61 1HB ASN 10 2HB ASN 10 -4.808 7.089 -1.547
62 2HB ASN 10 1HB ASN 10 -6.215 6.633 -2.506
63 1HD2 ASN 10 1HD2 ASN 10 -6.276 9.035 -1.011
64 2HD2 ASN 10 2HD2 ASN 10 -7.368 8.864 0.277
65 HA PRO 11 HA PRO 11 -5.153 2.181 -4.188
66 1HB PRO 11 2HB PRO 11 -7.523 2.120 -5.563
67 2HB PRO 11 1HB PRO 11 -7.239 1.199 -4.072
68 1HG PRO 11 2HG PRO 11 -8.669 3.785 -4.454
69 2HG PRO 11 1HG PRO 11 -9.079 2.414 -3.411
70 1HD PRO 11 2HD PRO 11 -7.911 4.683 -2.482
71 2HD PRO 11 1HD PRO 11 -7.653 3.087 -1.741
72 H SER 12 H SER 12 -7.000 5.161 -4.932
73 HA SER 12 HA SER 12 -6.062 5.378 -7.671
74 1HB SER 12 2HB SER 12 -7.353 7.228 -5.657
75 2HB SER 12 1HB SER 12 -6.940 7.772 -7.280
76 HG SER 12 HG SER 12 -8.990 7.007 -7.422
77 H ASN 13 H ASN 13 -5.090 6.914 -4.587
78 HA ASN 13 HA ASN 13 -2.653 8.009 -5.935
79 1HB ASN 13 2HB ASN 13 -4.470 9.309 -4.488
80 2HB ASN 13 1HB ASN 13 -3.522 8.684 -3.138
81 1HD2 ASN 13 1HD2 ASN 13 -3.531 10.997 -5.779
82 2HD2 ASN 13 2HD2 ASN 13 -2.021 11.691 -5.432
83 H ASP 14 H ASP 14 -2.075 5.534 -5.785
84 HA ASP 14 HA ASP 14 -1.386 4.375 -3.236
85 1HB ASP 14 2HB ASP 14 -1.319 3.759 -6.056
86 2HB ASP 14 1HB ASP 14 0.215 3.293 -5.322
87 H GLN 15 H GLN 15 0.205 5.146 -1.923
88 HA GLN 15 HA GLN 15 2.742 6.161 -3.171
89 1HB GLN 15 2HB GLN 15 0.981 7.801 -2.109
90 2HB GLN 15 1HB GLN 15 1.605 7.193 -0.575
91 1HG GLN 15 2HG GLN 15 3.091 8.921 -0.868
92 2HG GLN 15 1HG GLN 15 3.945 7.697 -1.806
93 1HE2 GLN 15 1HE2 GLN 15 4.480 8.343 -3.900
94 2HE2 GLN 15 2HE2 GLN 15 3.675 9.548 -4.783
95 H CYS 16 H CYS 16 2.389 3.468 -2.383
96 HA CYS 16 HA CYS 16 3.497 3.141 0.341
97 1HB CYS 16 2HB CYS 16 2.335 1.448 -1.832
98 2HB CYS 16 1HB CYS 16 3.393 0.663 -0.660
99 H CYS 17 H CYS 17 5.353 1.448 0.480
100 HA CYS 17 HA CYS 17 7.598 2.418 -1.183
101 1HB CYS 17 2HB CYS 17 7.193 1.574 1.463
102 2HB CYS 17 1HB CYS 17 8.156 0.291 0.733
103 H LYS 18 H LYS 18 8.439 1.249 -2.876
104 HA LYS 18 HA LYS 18 7.172 -1.288 -3.656
105 1HB LYS 18 2HB LYS 18 9.389 0.419 -4.835
106 2HB LYS 18 1HB LYS 18 8.680 -0.981 -5.639
107 1HG LYS 18 2HG LYS 18 7.032 1.377 -4.687
108 2HG LYS 18 1HG LYS 18 7.699 1.267 -6.315
109 1HD LYS 18 2HD LYS 18 6.259 -0.409 -6.945
110 2HD LYS 18 1HD LYS 18 6.189 -1.102 -5.325
111 1HE LYS 18 2HE LYS 18 4.855 0.977 -4.635
112 2HE LYS 18 1HE LYS 18 4.709 1.327 -6.369
113 1HZ LYS 18 1HZ LYS 18 2.861 -0.042 -5.645
114 2HZ LYS 18 2HZ LYS 18 3.927 -1.210 -5.025
115 3HZ LYS 18 3HZ LYS 18 3.852 -0.927 -6.699
116 H SER 19 H SER 19 10.037 -0.343 -1.915
117 HA SER 19 HA SER 19 11.779 -2.533 -2.511
118 1HB SER 19 2HB SER 19 12.288 -0.375 -1.298
119 2HB SER 19 1HB SER 19 11.439 -1.026 0.101
120 HG SER 19 HG SER 19 13.110 -2.232 0.517
121 H SER 20 H SER 20 9.188 -2.175 -0.074
122 HA SER 20 HA SER 20 9.640 -4.923 0.941
123 1HB SER 20 2HB SER 20 9.059 -2.770 2.261
124 2HB SER 20 1HB SER 20 7.419 -3.011 1.666
125 HG SER 20 HG SER 20 7.230 -4.771 2.867
126 H ASN 21 H ASN 21 8.152 -3.771 -1.773
127 HA ASN 21 HA ASN 21 6.441 -4.559 -3.181
128 1HB ASN 21 2HB ASN 21 7.321 -6.921 -1.525
129 2HB ASN 21 1HB ASN 21 6.035 -7.107 -2.717
130 1HD2 ASN 21 1HD2 ASN 21 9.473 -6.155 -2.368
131 2HD2 ASN 21 2HD2 ASN 21 9.874 -6.428 -3.994
132 H LEU 22 H LEU 22 5.286 -2.986 -1.369
133 HA LEU 22 HA LEU 22 2.995 -4.544 -0.214
134 1HB LEU 22 2HB LEU 22 4.357 -1.946 0.546
135 2HB LEU 22 1HB LEU 22 2.824 -2.456 1.252
136 HG LEU 22 HG LEU 22 5.273 -4.230 1.270
137 1HD1 LEU 22 1HD1 LEU 22 5.644 -3.462 3.585
138 2HD1 LEU 22 2HD1 LEU 22 4.334 -2.296 3.408
139 3HD1 LEU 22 3HD1 LEU 22 5.801 -2.126 2.446
140 1HD2 LEU 22 1HD2 LEU 22 2.716 -4.157 2.905
141 2HD2 LEU 22 2HD2 LEU 22 4.042 -5.295 3.147
142 3HD2 LEU 22 3HD2 LEU 22 3.111 -5.332 1.651
143 H VAL 23 H VAL 23 1.031 -4.161 -1.142
144 HA VAL 23 HA VAL 23 0.742 -1.771 -2.936
145 HB VAL 23 HB VAL 23 -0.962 -3.186 -4.082
146 1HG1 VAL 23 1HG1 VAL 23 1.437 -4.955 -3.847
147 2HG1 VAL 23 2HG1 VAL 23 1.684 -3.296 -4.395
148 3HG1 VAL 23 3HG1 VAL 23 0.609 -4.369 -5.291
149 1HG2 VAL 23 1HG2 VAL 23 -0.029 -5.424 -2.261
150 2HG2 VAL 23 2HG2 VAL 23 -1.344 -5.465 -3.434
151 3HG2 VAL 23 3HG2 VAL 23 -1.505 -4.508 -1.962
152 H CYS 24 H CYS 24 -1.325 -0.643 -2.867
153 HA CYS 24 HA CYS 24 -2.493 -0.534 -0.174
154 1HB CYS 24 2HB CYS 24 -1.936 1.360 -1.892
155 2HB CYS 24 1HB CYS 24 -3.488 0.933 -2.611
156 H SER 25 H SER 25 -4.150 -1.850 0.411
157 HA SER 25 HA SER 25 -5.691 -3.386 -1.547
158 1HB SER 25 2HB SER 25 -4.882 -4.049 0.804
159 2HB SER 25 1HB SER 25 -6.198 -3.052 1.418
160 HG SER 25 HG SER 25 -6.248 -5.479 0.054
161 H ARG 26 H ARG 26 -8.007 -3.230 -1.825
162 HA ARG 26 HA ARG 26 -9.074 -0.470 -1.432
163 1HB ARG 26 2HB ARG 26 -9.905 -2.837 -3.140
164 2HB ARG 26 1HB ARG 26 -10.743 -1.286 -3.129
165 1HG ARG 26 2HG ARG 26 -8.741 -0.141 -3.905
166 2HG ARG 26 1HG ARG 26 -7.803 -1.630 -3.789
167 1HD ARG 26 2HD ARG 26 -10.284 -1.588 -5.497
168 2HD ARG 26 1HD ARG 26 -8.767 -0.924 -6.132
169 HE ARG 26 HE ARG 26 -7.765 -3.109 -5.952
170 1HH1 ARG 26 2HH1 ARG 26 -10.653 -3.704 -6.935
171 2HH1 ARG 26 1HH1 ARG 26 -11.035 -5.079 -5.953
172 1HH2 ARG 26 1HH2 ARG 26 -8.400 -4.570 -3.747
173 2HH2 ARG 26 2HH2 ARG 26 -9.758 -5.570 -4.145
174 H ALA 27 H ALA 27 -9.003 -2.852 0.625
175 HA ALA 27 HA ALA 27 -11.941 -3.051 1.149
176 1HB ALA 27 1HB ALA 27 -10.808 -4.804 2.848
177 2HB ALA 27 2HB ALA 27 -9.513 -4.710 1.653
178 3HB ALA 27 3HB ALA 27 -11.131 -5.214 1.162
179 H HIS 28 H HIS 28 -8.851 -2.552 2.877
180 HA HIS 28 HA HIS 28 -10.353 -1.017 4.974
181 1HB HIS 28 2HB HIS 28 -7.831 -2.698 5.013
182 2HB HIS 28 1HB HIS 28 -8.318 -1.682 6.368
183 HD1 HIS 28 HD1 HIS 28 -8.241 -4.924 6.260
184 HD2 HIS 28 HD2 HIS 28 -11.625 -2.496 6.056
185 HE1 HIS 28 HE1 HIS 28 -10.197 -6.356 6.997
186 H ARG 29 H ARG 29 -8.760 -0.280 2.276
187 HA ARG 29 HA ARG 29 -7.387 1.493 1.546
188 1HB ARG 29 2HB ARG 29 -9.313 2.338 3.464
189 2HB ARG 29 1HB ARG 29 -7.833 3.235 3.801
190 1HG ARG 29 2HG ARG 29 -8.283 4.578 2.055
191 2HG ARG 29 1HG ARG 29 -8.121 3.189 0.979
192 1HD ARG 29 2HD ARG 29 -10.390 2.936 0.756
193 2HD ARG 29 1HD ARG 29 -10.704 3.381 2.444
194 HE ARG 29 HE ARG 29 -10.301 5.294 0.206
195 1HH1 ARG 29 1HH2 ARG 29 -12.721 5.277 2.011
196 2HH1 ARG 29 2HH2 ARG 29 -12.374 6.594 3.081
197 1HH2 ARG 29 2HH1 ARG 29 -9.001 6.721 2.253
198 2HH2 ARG 29 1HH1 ARG 29 -10.260 7.415 3.219
199 H TRP 30 H TRP 30 -5.699 -0.303 2.512
200 HA TRP 30 HA TRP 30 -3.701 1.302 4.003
201 1HB TRP 30 2HB TRP 30 -3.494 -0.292 5.775
202 2HB TRP 30 1HB TRP 30 -5.220 0.006 5.594
203 HD1 TRP 30 HD1 TRP 30 -6.188 -1.836 3.448
204 HE1 TRP 30 HE1 TRP 30 -5.974 -4.400 3.579
205 HE3 TRP 30 HE3 TRP 30 -2.385 -2.220 6.824
206 HZ2 TRP 30 HZ2 TRP 30 -4.392 -6.358 4.944
207 HZ3 TRP 30 HZ3 TRP 30 -1.544 -4.441 7.525
208 HH2 TRP 30 HH2 TRP 30 -2.541 -6.509 6.590
209 H CYS 31 H CYS 31 -1.566 0.064 4.104
210 HA CYS 31 HA CYS 31 -1.087 -1.192 1.461
211 1HB CYS 31 2HB CYS 31 0.206 0.727 2.824
212 2HB CYS 31 1HB CYS 31 1.075 -0.676 3.447
213 H LYS 32 H LYS 32 -0.620 -3.328 1.215
214 HA LYS 32 HA LYS 32 0.286 -4.957 3.525
215 1HB LYS 32 2HB LYS 32 -1.585 -6.533 3.209
216 2HB LYS 32 1HB LYS 32 -2.199 -4.921 3.573
217 1HG LYS 32 2HG LYS 32 -2.785 -4.519 1.295
218 2HG LYS 32 1HG LYS 32 -1.857 -5.910 0.734
219 1HD LYS 32 2HD LYS 32 -3.707 -6.865 2.674
220 2HD LYS 32 1HD LYS 32 -4.603 -5.821 1.571
221 1HE LYS 32 2HE LYS 32 -4.042 -7.130 -0.320
222 2HE LYS 32 1HE LYS 32 -2.694 -7.920 0.520
223 1HZ LYS 32 1HZ LYS 32 -5.565 -8.172 1.267
224 2HZ LYS 32 2HZ LYS 32 -4.260 -8.939 2.042
225 3HZ LYS 32 3HZ LYS 32 -4.665 -9.352 0.445
226 H TYR 33 H TYR 33 0.974 -7.152 2.783
227 HA TYR 33 HA TYR 33 2.405 -7.028 0.244
228 1HB TYR 33 2HB TYR 33 3.005 -8.138 2.531
229 2HB TYR 33 1HB TYR 33 1.994 -9.472 1.973
230 HD1 TYR 33 HD1 TYR 33 2.691 -10.913 0.162
231 HD2 TYR 33 HD2 TYR 33 5.053 -7.505 1.288
232 HE1 TYR 33 HE1 TYR 33 4.568 -11.755 -1.225
233 HE2 TYR 33 HE2 TYR 33 6.929 -8.348 -0.099
234 HH TYR 33 HH TYR 33 7.480 -11.108 -0.958
235 H GLU 34 H GLU 34 2.051 -8.424 -1.587
236 HA GLU 34 HA GLU 34 -0.766 -9.081 -2.101
237 1HB GLU 34 2HB GLU 34 1.843 -9.198 -3.626
238 2HB GLU 34 1HB GLU 34 0.361 -9.865 -4.310
239 1HG GLU 34 2HG GLU 34 -0.749 -7.651 -3.949
240 2HG GLU 34 1HG GLU 34 0.800 -7.003 -3.410
241 H ILE 35 H ILE 35 -1.582 -10.985 -1.315
242 HA ILE 35 HA ILE 35 -0.078 -13.497 -1.791
243 HB ILE 35 HB ILE 35 0.618 -12.562 0.433
244 1HG1 ILE 35 2HG1 ILE 35 -0.618 -14.770 1.625
245 2HG1 ILE 35 1HG1 ILE 35 -0.539 -15.192 -0.085
246 1HG2 ILE 35 1HG2 ILE 35 -0.946 -12.348 2.232
247 2HG2 ILE 35 2HG2 ILE 35 -2.230 -13.118 1.299
248 3HG2 ILE 35 3HG2 ILE 35 -1.665 -11.505 0.861
249 1HD1 ILE 35 1HD1 ILE 35 1.509 -15.894 1.125
250 2HD1 ILE 35 2HD1 ILE 35 1.803 -14.215 1.577
251 3HD1 ILE 35 3HD1 ILE 35 1.866 -14.696 -0.119
252 1HN NH2 36 1HN NH2 36 -3.904 -12.914 -2.208
253 2HN NH2 36 2HN NH2 36 -2.485 -11.862 -2.404
Start of MODEL 15
1 1H GLU 1 1H GLU 1 12.351 7.132 0.052
2 2H GLU 1 2H GLU 1 13.251 7.291 1.484
3 3H GLU 1 3H GLU 1 11.669 7.907 1.398
4 HA GLU 1 HA GLU 1 12.431 5.027 1.292
5 1HB GLU 1 2HB GLU 1 11.497 6.976 3.368
6 2HB GLU 1 1HB GLU 1 10.929 5.309 3.482
7 1HG GLU 1 2HG GLU 1 13.551 4.847 3.027
8 2HG GLU 1 1HG GLU 1 13.670 6.405 3.847
9 H CYS 2 H CYS 2 10.344 3.706 1.670
10 HA CYS 2 HA CYS 2 8.089 4.908 0.089
11 1HB CYS 2 2HB CYS 2 7.688 2.499 -0.577
12 2HB CYS 2 1HB CYS 2 9.224 3.156 -1.135
13 H LEU 3 H LEU 3 5.950 3.682 0.583
14 HA LEU 3 HA LEU 3 5.491 3.789 3.490
15 1HB LEU 3 2HB LEU 3 3.701 3.224 1.098
16 2HB LEU 3 1HB LEU 3 3.124 3.482 2.745
17 HG LEU 3 HG LEU 3 4.899 5.526 1.424
18 1HD1 LEU 3 1HD1 LEU 3 1.877 5.364 1.197
19 2HD1 LEU 3 2HD1 LEU 3 3.013 5.102 -0.126
20 3HD1 LEU 3 3HD1 LEU 3 2.886 6.693 0.626
21 1HD2 LEU 3 1HD2 LEU 3 2.665 5.765 3.464
22 2HD2 LEU 3 2HD2 LEU 3 3.813 7.021 3.005
23 3HD2 LEU 3 3HD2 LEU 3 4.370 5.597 3.883
24 H GLY 4 H GLY 4 6.212 1.959 4.567
25 1HA GLY 4 2HA GLY 4 6.159 -0.690 3.382
26 2HA GLY 4 1HA GLY 4 6.552 -0.318 5.059
27 H PHE 5 H PHE 5 5.197 -2.399 5.246
28 HA PHE 5 HA PHE 5 2.323 -2.268 4.871
29 1HB PHE 5 2HB PHE 5 3.685 -4.340 4.906
30 2HB PHE 5 1HB PHE 5 4.087 -4.042 6.596
31 HD1 PHE 5 HD1 PHE 5 2.607 -4.677 8.341
32 HD2 PHE 5 HD2 PHE 5 1.242 -4.679 4.267
33 HE1 PHE 5 HE1 PHE 5 0.524 -5.826 9.038
34 HE2 PHE 5 HE2 PHE 5 -0.840 -5.829 4.965
35 HZ PHE 5 HZ PHE 5 -1.198 -6.402 7.351
36 H GLY 6 H GLY 6 0.790 -1.464 6.270
37 1HA GLY 6 2HA GLY 6 -0.096 -1.055 8.498
38 2HA GLY 6 1HA GLY 6 1.555 -0.944 9.101
39 H LYS 7 H LYS 7 2.000 0.793 6.479
40 HA LYS 7 HA LYS 7 1.437 3.357 7.850
41 1HB LYS 7 2HB LYS 7 3.045 2.441 5.460
42 2HB LYS 7 1HB LYS 7 2.810 4.154 5.802
43 1HG LYS 7 2HG LYS 7 4.675 3.907 7.086
44 2HG LYS 7 1HG LYS 7 3.545 3.245 8.266
45 1HD LYS 7 2HD LYS 7 4.182 1.059 7.860
46 2HD LYS 7 1HD LYS 7 4.645 1.394 6.192
47 1HE LYS 7 2HE LYS 7 6.786 1.343 6.992
48 2HE LYS 7 1HE LYS 7 6.426 2.962 7.623
49 1HZ LYS 7 1HZ LYS 7 5.923 0.395 9.042
50 2HZ LYS 7 2HZ LYS 7 5.541 1.942 9.636
51 3HZ LYS 7 3HZ LYS 7 7.164 1.495 9.402
52 H GLY 8 H GLY 8 0.201 5.045 6.867
53 1HA GLY 8 2HA GLY 8 -2.091 4.212 5.334
54 2HA GLY 8 1HA GLY 8 -1.657 5.882 5.697
55 H CYS 9 H CYS 9 -2.631 4.826 3.143
56 HA CYS 9 HA CYS 9 -0.440 5.844 1.412
57 1HB CYS 9 2HB CYS 9 0.099 3.568 1.312
58 2HB CYS 9 1HB CYS 9 -1.579 3.062 1.490
59 H ASN 10 H ASN 10 -1.240 6.715 -0.566
60 HA ASN 10 HA ASN 10 -4.118 7.355 -0.600
61 1HB ASN 10 2HB ASN 10 -1.646 8.132 -2.145
62 2HB ASN 10 1HB ASN 10 -3.244 8.598 -2.729
63 1HD2 ASN 10 1HD2 ASN 10 -4.403 10.236 -1.549
64 2HD2 ASN 10 2HD2 ASN 10 -3.712 11.089 -0.256
65 HA PRO 11 HA PRO 11 -5.011 3.896 -3.271
66 1HB PRO 11 2HB PRO 11 -7.542 4.676 -4.002
67 2HB PRO 11 1HB PRO 11 -7.165 3.942 -2.430
68 1HG PRO 11 2HG PRO 11 -7.535 6.819 -3.132
69 2HG PRO 11 1HG PRO 11 -8.112 5.921 -1.718
70 1HD PRO 11 2HD PRO 11 -5.947 7.531 -1.618
71 2HD PRO 11 1HD PRO 11 -6.080 6.054 -0.636
72 H SER 12 H SER 12 -5.697 7.250 -4.329
73 HA SER 12 HA SER 12 -5.679 6.642 -7.171
74 1HB SER 12 2HB SER 12 -6.743 8.622 -6.001
75 2HB SER 12 1HB SER 12 -5.123 9.255 -5.722
76 HG SER 12 HG SER 12 -6.621 9.095 -8.050
77 H ASN 13 H ASN 13 -3.276 7.911 -4.858
78 HA ASN 13 HA ASN 13 -1.132 7.512 -6.919
79 1HB ASN 13 2HB ASN 13 -1.346 9.308 -4.474
80 2HB ASN 13 1HB ASN 13 0.087 9.194 -5.497
81 1HD2 ASN 13 1HD2 ASN 13 -3.061 10.651 -5.205
82 2HD2 ASN 13 2HD2 ASN 13 -3.058 11.450 -6.702
83 H ASP 14 H ASP 14 -1.547 5.145 -6.011
84 HA ASP 14 HA ASP 14 -0.689 4.448 -3.365
85 1HB ASP 14 2HB ASP 14 -0.649 2.177 -4.278
86 2HB ASP 14 1HB ASP 14 -2.046 3.040 -4.918
87 H GLN 15 H GLN 15 1.330 3.947 -2.552
88 HA GLN 15 HA GLN 15 3.672 3.719 -4.342
89 1HB GLN 15 2HB GLN 15 2.885 6.202 -3.571
90 2HB GLN 15 1HB GLN 15 3.914 5.777 -2.203
91 1HG GLN 15 2HG GLN 15 5.692 5.111 -3.892
92 2HG GLN 15 1HG GLN 15 4.678 5.852 -5.131
93 1HE2 GLN 15 1HE2 GLN 15 6.699 6.549 -2.296
94 2HE2 GLN 15 2HE2 GLN 15 6.749 8.229 -2.530
95 H CYS 16 H CYS 16 2.656 1.726 -2.730
96 HA CYS 16 HA CYS 16 3.854 1.718 -0.064
97 1HB CYS 16 2HB CYS 16 2.554 -0.359 -1.851
98 2HB CYS 16 1HB CYS 16 3.081 -0.703 -0.204
99 H CYS 17 H CYS 17 5.501 0.054 0.559
100 HA CYS 17 HA CYS 17 7.839 0.147 -1.117
101 1HB CYS 17 2HB CYS 17 7.054 -1.522 1.294
102 2HB CYS 17 1HB CYS 17 8.686 -1.477 0.628
103 H LYS 18 H LYS 18 8.498 -1.246 -2.710
104 HA LYS 18 HA LYS 18 6.719 -3.451 -3.520
105 1HB LYS 18 2HB LYS 18 9.284 -2.268 -4.630
106 2HB LYS 18 1HB LYS 18 8.341 -3.515 -5.445
107 1HG LYS 18 2HG LYS 18 7.231 -0.812 -4.627
108 2HG LYS 18 1HG LYS 18 7.824 -1.189 -6.244
109 1HD LYS 18 2HD LYS 18 6.143 -2.916 -6.522
110 2HD LYS 18 1HD LYS 18 5.615 -2.727 -4.850
111 1HE LYS 18 2HE LYS 18 5.503 -0.135 -6.005
112 2HE LYS 18 1HE LYS 18 4.753 -1.242 -7.170
113 1HZ LYS 18 1HZ LYS 18 3.143 -0.543 -5.506
114 2HZ LYS 18 2HZ LYS 18 4.148 -1.109 -4.259
115 3HZ LYS 18 3HZ LYS 18 3.455 -2.204 -5.359
116 H SER 19 H SER 19 9.302 -3.211 -1.352
117 HA SER 19 HA SER 19 10.874 -5.532 -1.908
118 1HB SER 19 2HB SER 19 10.150 -3.962 0.571
119 2HB SER 19 1HB SER 19 11.241 -5.344 0.649
120 HG SER 19 HG SER 19 12.023 -3.015 0.184
121 H SER 20 H SER 20 7.855 -5.120 -0.044
122 HA SER 20 HA SER 20 7.691 -8.098 0.270
123 1HB SER 20 2HB SER 20 6.647 -5.718 1.806
124 2HB SER 20 1HB SER 20 5.955 -7.320 2.043
125 HG SER 20 HG SER 20 8.450 -6.312 2.727
126 H ASN 21 H ASN 21 6.794 -6.190 -2.064
127 HA ASN 21 HA ASN 21 4.964 -6.013 -3.536
128 1HB ASN 21 2HB ASN 21 5.521 -8.611 -2.974
129 2HB ASN 21 1HB ASN 21 3.833 -8.546 -2.466
130 1HD2 ASN 21 1HD2 ASN 21 2.253 -7.668 -4.147
131 2HD2 ASN 21 2HD2 ASN 21 2.604 -7.920 -5.788
132 H LEU 22 H LEU 22 4.108 -4.203 -2.153
133 HA LEU 22 HA LEU 22 1.590 -4.997 -0.717
134 1HB LEU 22 2HB LEU 22 3.672 -2.860 -0.210
135 2HB LEU 22 1HB LEU 22 2.085 -2.822 0.559
136 HG LEU 22 HG LEU 22 3.788 -5.306 0.687
137 1HD1 LEU 22 1HD1 LEU 22 5.201 -3.479 1.516
138 2HD1 LEU 22 2HD1 LEU 22 4.650 -4.472 2.865
139 3HD1 LEU 22 3HD1 LEU 22 3.890 -2.912 2.550
140 1HD2 LEU 22 1HD2 LEU 22 1.477 -5.541 1.391
141 2HD2 LEU 22 2HD2 LEU 22 1.590 -4.093 2.393
142 3HD2 LEU 22 3HD2 LEU 22 2.490 -5.545 2.835
143 H VAL 23 H VAL 23 -0.255 -3.766 -1.150
144 HA VAL 23 HA VAL 23 -0.033 -1.700 -3.320
145 HB VAL 23 HB VAL 23 -2.287 -2.561 -4.026
146 1HG1 VAL 23 1HG1 VAL 23 -0.151 -4.708 -3.880
147 2HG1 VAL 23 2HG1 VAL 23 -0.163 -3.388 -5.048
148 3HG1 VAL 23 3HG1 VAL 23 -1.448 -4.597 -5.070
149 1HG2 VAL 23 1HG2 VAL 23 -2.764 -3.524 -1.690
150 2HG2 VAL 23 2HG2 VAL 23 -1.743 -4.882 -2.161
151 3HG2 VAL 23 3HG2 VAL 23 -3.217 -4.534 -3.063
152 H CYS 24 H CYS 24 -2.181 -0.293 -3.273
153 HA CYS 24 HA CYS 24 -2.453 0.718 -0.506
154 1HB CYS 24 2HB CYS 24 -2.155 1.928 -2.883
155 2HB CYS 24 1HB CYS 24 -3.917 1.877 -2.833
156 H SER 25 H SER 25 -4.571 1.087 0.456
157 HA SER 25 HA SER 25 -6.691 -0.795 -0.542
158 1HB SER 25 2HB SER 25 -5.270 -0.913 1.779
159 2HB SER 25 1HB SER 25 -6.632 0.075 2.297
160 HG SER 25 HG SER 25 -6.797 -2.349 2.367
161 H ARG 26 H ARG 26 -8.939 -0.077 0.376
162 HA ARG 26 HA ARG 26 -9.204 2.896 0.044
163 1HB ARG 26 2HB ARG 26 -10.110 1.251 -1.704
164 2HB ARG 26 1HB ARG 26 -11.295 0.774 -0.488
165 1HG ARG 26 2HG ARG 26 -12.291 2.915 -0.443
166 2HG ARG 26 1HG ARG 26 -10.898 3.676 -1.213
167 1HD ARG 26 2HD ARG 26 -12.284 3.531 -3.065
168 2HD ARG 26 1HD ARG 26 -11.556 1.916 -3.162
169 HE ARG 26 HE ARG 26 -13.670 1.561 -1.410
170 1HH1 ARG 26 2HH1 ARG 26 -13.803 0.191 -3.990
171 2HH1 ARG 26 1HH1 ARG 26 -15.162 0.926 -4.772
172 1HH2 ARG 26 1HH2 ARG 26 -15.221 3.685 -2.659
173 2HH2 ARG 26 2HH2 ARG 26 -15.967 2.908 -4.016
174 H ALA 27 H ALA 27 -10.580 0.055 1.750
175 HA ALA 27 HA ALA 27 -12.403 1.440 3.442
176 1HB ALA 27 1HB ALA 27 -12.238 -0.622 4.801
177 2HB ALA 27 2HB ALA 27 -10.764 -1.067 3.940
178 3HB ALA 27 3HB ALA 27 -12.303 -1.007 3.081
179 H HIS 28 H HIS 28 -8.977 0.592 3.970
180 HA HIS 28 HA HIS 28 -8.961 2.369 6.384
181 1HB HIS 28 2HB HIS 28 -7.787 -0.215 5.640
182 2HB HIS 28 1HB HIS 28 -6.608 0.893 6.341
183 HD1 HIS 28 HD1 HIS 28 -6.450 -0.171 8.655
184 HD2 HIS 28 HD2 HIS 28 -10.368 0.760 7.574
185 HE1 HIS 28 HE1 HIS 28 -7.862 -0.489 10.734
186 H ARG 29 H ARG 29 -7.859 2.169 3.121
187 HA ARG 29 HA ARG 29 -6.378 3.500 1.865
188 1HB ARG 29 2HB ARG 29 -7.941 5.100 3.268
189 2HB ARG 29 1HB ARG 29 -6.454 5.466 4.142
190 1HG ARG 29 2HG ARG 29 -5.384 6.301 2.200
191 2HG ARG 29 1HG ARG 29 -6.575 5.564 1.127
192 1HD ARG 29 2HD ARG 29 -7.806 7.393 3.065
193 2HD ARG 29 1HD ARG 29 -6.639 8.200 1.999
194 HE ARG 29 HE ARG 29 -8.007 7.642 0.127
195 1HH1 ARG 29 1HH2 ARG 29 -10.243 8.009 2.175
196 2HH1 ARG 29 2HH2 ARG 29 -11.193 6.589 1.890
197 1HH2 ARG 29 2HH1 ARG 29 -8.699 4.953 0.110
198 2HH2 ARG 29 1HH1 ARG 29 -10.317 4.856 0.718
199 H TRP 30 H TRP 30 -4.877 1.618 2.821
200 HA TRP 30 HA TRP 30 -2.413 2.951 3.794
201 1HB TRP 30 2HB TRP 30 -2.210 1.467 5.700
202 2HB TRP 30 1HB TRP 30 -3.809 2.202 5.763
203 HD1 TRP 30 HD1 TRP 30 -5.694 0.571 4.247
204 HE1 TRP 30 HE1 TRP 30 -6.077 -1.953 4.594
205 HE3 TRP 30 HE3 TRP 30 -1.307 -0.673 6.537
206 HZ2 TRP 30 HZ2 TRP 30 -4.704 -4.202 5.697
207 HZ3 TRP 30 HZ3 TRP 30 -0.872 -3.014 7.228
208 HH2 TRP 30 HH2 TRP 30 -2.564 -4.777 6.811
209 H CYS 31 H CYS 31 -0.688 0.969 4.048
210 HA CYS 31 HA CYS 31 -0.613 -0.290 1.377
211 1HB CYS 31 2HB CYS 31 1.274 0.072 3.704
212 2HB CYS 31 1HB CYS 31 1.687 -1.003 2.369
213 H LYS 32 H LYS 32 -1.853 -2.138 1.265
214 HA LYS 32 HA LYS 32 -1.559 -4.171 3.456
215 1HB LYS 32 2HB LYS 32 -3.808 -4.916 2.733
216 2HB LYS 32 1HB LYS 32 -3.819 -3.207 3.157
217 1HG LYS 32 2HG LYS 32 -4.305 -2.561 1.035
218 2HG LYS 32 1HG LYS 32 -3.177 -3.716 0.329
219 1HD LYS 32 2HD LYS 32 -4.956 -5.495 1.097
220 2HD LYS 32 1HD LYS 32 -6.052 -4.112 1.102
221 1HE LYS 32 2HE LYS 32 -5.244 -3.613 -1.271
222 2HE LYS 32 1HE LYS 32 -4.472 -5.210 -1.241
223 1HZ LYS 32 1HZ LYS 32 -6.712 -5.401 -2.100
224 2HZ LYS 32 2HZ LYS 32 -7.345 -4.639 -0.720
225 3HZ LYS 32 3HZ LYS 32 -6.617 -6.170 -0.591
226 H TYR 33 H TYR 33 -1.891 -6.491 2.528
227 HA TYR 33 HA TYR 33 -0.001 -6.857 0.298
228 1HB TYR 33 2HB TYR 33 -0.672 -8.203 2.620
229 2HB TYR 33 1HB TYR 33 -1.432 -9.193 1.374
230 HD1 TYR 33 HD1 TYR 33 -0.020 -9.960 -0.609
231 HD2 TYR 33 HD2 TYR 33 1.676 -8.236 2.942
232 HE1 TYR 33 HE1 TYR 33 2.192 -10.907 -1.207
233 HE2 TYR 33 HE2 TYR 33 3.889 -9.183 2.344
234 HH TYR 33 HH TYR 33 4.492 -11.496 0.608
235 H GLU 34 H GLU 34 -0.536 -7.877 -1.704
236 HA GLU 34 HA GLU 34 -3.407 -7.644 -2.477
237 1HB GLU 34 2HB GLU 34 -1.356 -6.562 -3.657
238 2HB GLU 34 1HB GLU 34 -1.049 -8.181 -4.285
239 1HG GLU 34 2HG GLU 34 -3.816 -7.054 -4.520
240 2HG GLU 34 1HG GLU 34 -2.574 -6.483 -5.635
241 H ILE 35 H ILE 35 -4.616 -9.462 -2.829
242 HA ILE 35 HA ILE 35 -3.237 -12.039 -3.440
243 HB ILE 35 HB ILE 35 -3.634 -11.759 -0.973
244 1HG1 ILE 35 2HG1 ILE 35 -5.486 -13.916 -1.354
245 2HG1 ILE 35 1HG1 ILE 35 -4.309 -13.956 -2.667
246 1HG2 ILE 35 1HG2 ILE 35 -5.823 -11.625 -0.073
247 2HG2 ILE 35 2HG2 ILE 35 -6.573 -12.022 -1.619
248 3HG2 ILE 35 3HG2 ILE 35 -5.812 -10.448 -1.387
249 1HD1 ILE 35 1HD1 ILE 35 -3.948 -14.722 0.081
250 2HD1 ILE 35 2HD1 ILE 35 -2.864 -13.383 -0.289
251 3HD1 ILE 35 3HD1 ILE 35 -2.807 -14.855 -1.256
252 1HN NH2 36 1HN NH2 36 -6.585 -10.762 -5.200
253 2HN NH2 36 2HN NH2 36 -5.212 -9.837 -4.555
Start of MODEL 16
1 1H GLU 1 1H GLU 1 11.385 7.433 5.027
2 2H GLU 1 2H GLU 1 9.710 7.206 5.209
3 3H GLU 1 3H GLU 1 10.363 7.554 3.679
4 HA GLU 1 HA GLU 1 11.556 5.422 3.691
5 1HB GLU 1 2HB GLU 1 10.285 5.456 6.423
6 2HB GLU 1 1HB GLU 1 10.676 3.916 5.658
7 1HG GLU 1 2HG GLU 1 12.839 4.159 6.232
8 2HG GLU 1 1HG GLU 1 12.917 5.683 5.345
9 H CYS 2 H CYS 2 10.363 3.320 3.202
10 HA CYS 2 HA CYS 2 7.888 3.852 1.788
11 1HB CYS 2 2HB CYS 2 8.103 1.547 1.130
12 2HB CYS 2 1HB CYS 2 9.743 2.182 1.243
13 H LEU 3 H LEU 3 5.849 2.564 2.214
14 HA LEU 3 HA LEU 3 5.308 2.453 5.153
15 1HB LEU 3 2HB LEU 3 3.443 2.576 2.757
16 2HB LEU 3 1HB LEU 3 2.963 2.723 4.445
17 HG LEU 3 HG LEU 3 4.728 4.632 2.885
18 1HD1 LEU 3 1HD1 LEU 3 1.914 4.660 3.926
19 2HD1 LEU 3 2HD1 LEU 3 2.537 5.230 2.377
20 3HD1 LEU 3 3HD1 LEU 3 2.808 6.179 3.840
21 1HD2 LEU 3 1HD2 LEU 3 4.306 4.227 5.812
22 2HD2 LEU 3 2HD2 LEU 3 4.326 5.892 5.229
23 3HD2 LEU 3 3HD2 LEU 3 5.719 4.845 4.955
24 H GLY 4 H GLY 4 5.353 0.427 6.012
25 1HA GLY 4 2HA GLY 4 5.178 -1.955 4.332
26 2HA GLY 4 1HA GLY 4 5.375 -1.935 6.084
27 H PHE 5 H PHE 5 3.724 -3.329 6.694
28 HA PHE 5 HA PHE 5 1.012 -3.026 5.549
29 1HB PHE 5 2HB PHE 5 2.598 -5.094 6.598
30 2HB PHE 5 1HB PHE 5 1.322 -4.860 7.792
31 HD1 PHE 5 HD1 PHE 5 2.157 -6.477 4.771
32 HD2 PHE 5 HD2 PHE 5 -1.113 -4.526 6.761
33 HE1 PHE 5 HE1 PHE 5 0.553 -7.653 3.292
34 HE2 PHE 5 HE2 PHE 5 -2.714 -5.705 5.280
35 HZ PHE 5 HZ PHE 5 -1.882 -7.265 3.546
36 H GLY 6 H GLY 6 -0.505 -1.730 6.504
37 1HA GLY 6 2HA GLY 6 -1.822 -1.026 8.408
38 2HA GLY 6 1HA GLY 6 -0.440 -1.354 9.453
39 H LYS 7 H LYS 7 -0.906 0.652 6.513
40 HA LYS 7 HA LYS 7 -0.267 3.096 8.059
41 1HB LYS 7 2HB LYS 7 1.655 1.571 6.516
42 2HB LYS 7 1HB LYS 7 1.455 3.177 5.817
43 1HG LYS 7 2HG LYS 7 2.100 2.562 8.717
44 2HG LYS 7 1HG LYS 7 3.217 3.220 7.524
45 1HD LYS 7 2HD LYS 7 0.690 4.561 8.539
46 2HD LYS 7 1HD LYS 7 2.345 5.030 8.924
47 1HE LYS 7 2HE LYS 7 2.537 5.144 6.250
48 2HE LYS 7 1HE LYS 7 0.798 5.458 6.403
49 1HZ LYS 7 1HZ LYS 7 2.109 7.506 6.595
50 2HZ LYS 7 2HZ LYS 7 2.933 6.857 7.933
51 3HZ LYS 7 3HZ LYS 7 1.264 7.171 8.028
52 H GLY 8 H GLY 8 -1.350 4.825 7.176
53 1HA GLY 8 2HA GLY 8 -3.250 4.511 5.094
54 2HA GLY 8 1HA GLY 8 -2.673 6.067 5.690
55 H CYS 9 H CYS 9 -3.204 5.005 2.893
56 HA CYS 9 HA CYS 9 -0.690 6.034 1.682
57 1HB CYS 9 2HB CYS 9 -0.156 3.764 1.617
58 2HB CYS 9 1HB CYS 9 -1.843 3.268 1.502
59 H ASN 10 H ASN 10 -1.038 6.781 -0.524
60 HA ASN 10 HA ASN 10 -3.911 7.345 -1.136
61 1HB ASN 10 2HB ASN 10 -1.254 8.640 -1.646
62 2HB ASN 10 1HB ASN 10 -2.575 8.975 -2.765
63 1HD2 ASN 10 1HD2 ASN 10 -3.719 10.816 -2.172
64 2HD2 ASN 10 2HD2 ASN 10 -3.985 11.331 -0.576
65 HA PRO 11 HA PRO 11 -3.707 4.616 -4.611
66 1HB PRO 11 2HB PRO 11 -5.670 5.737 -6.168
67 2HB PRO 11 1HB PRO 11 -6.015 4.769 -4.721
68 1HG PRO 11 2HG PRO 11 -5.986 7.729 -5.053
69 2HG PRO 11 1HG PRO 11 -7.098 6.708 -4.127
70 1HD PRO 11 2HD PRO 11 -5.077 8.123 -2.984
71 2HD PRO 11 1HD PRO 11 -5.696 6.596 -2.314
72 H SER 12 H SER 12 -3.845 8.135 -5.301
73 HA SER 12 HA SER 12 -2.539 7.884 -7.905
74 1HB SER 12 2HB SER 12 -4.169 9.688 -7.066
75 2HB SER 12 1HB SER 12 -2.814 10.338 -6.146
76 HG SER 12 HG SER 12 -2.266 11.276 -7.938
77 H ASN 13 H ASN 13 -1.551 8.768 -4.598
78 HA ASN 13 HA ASN 13 1.305 8.847 -5.496
79 1HB ASN 13 2HB ASN 13 0.030 10.783 -4.275
80 2HB ASN 13 1HB ASN 13 0.218 9.779 -2.837
81 1HD2 ASN 13 1HD2 ASN 13 1.811 12.096 -4.817
82 2HD2 ASN 13 2HD2 ASN 13 3.367 11.918 -4.162
83 H ASP 14 H ASP 14 0.809 6.341 -5.481
84 HA ASP 14 HA ASP 14 0.454 4.864 -3.080
85 1HB ASP 14 2HB ASP 14 1.243 4.460 -5.844
86 2HB ASP 14 1HB ASP 14 2.178 3.416 -4.774
87 H GLN 15 H GLN 15 1.763 4.829 -1.295
88 HA GLN 15 HA GLN 15 4.716 5.241 -1.685
89 1HB GLN 15 2HB GLN 15 2.707 6.261 0.310
90 2HB GLN 15 1HB GLN 15 4.402 6.125 0.776
91 1HG GLN 15 2HG GLN 15 4.721 7.347 -1.601
92 2HG GLN 15 1HG GLN 15 3.118 7.957 -1.190
93 1HE2 GLN 15 1HE2 GLN 15 6.441 7.662 0.174
94 2HE2 GLN 15 2HE2 GLN 15 6.318 9.040 1.158
95 H CYS 16 H CYS 16 3.053 2.676 -1.525
96 HA CYS 16 HA CYS 16 3.622 1.479 1.075
97 1HB CYS 16 2HB CYS 16 2.793 0.400 -1.636
98 2HB CYS 16 1HB CYS 16 2.888 -0.592 -0.182
99 H CYS 17 H CYS 17 5.078 -0.429 1.311
100 HA CYS 17 HA CYS 17 7.701 0.081 0.108
101 1HB CYS 17 2HB CYS 17 6.816 -0.840 2.500
102 2HB CYS 17 1HB CYS 17 7.153 -2.374 1.697
103 H LYS 18 H LYS 18 8.331 -0.798 -1.806
104 HA LYS 18 HA LYS 18 6.765 -2.827 -3.185
105 1HB LYS 18 2HB LYS 18 8.149 -0.861 -4.107
106 2HB LYS 18 1HB LYS 18 9.562 -1.882 -3.838
107 1HG LYS 18 2HG LYS 18 8.810 -3.522 -5.375
108 2HG LYS 18 1HG LYS 18 7.172 -2.868 -5.397
109 1HD LYS 18 2HD LYS 18 8.300 -0.703 -6.315
110 2HD LYS 18 1HD LYS 18 9.662 -1.762 -6.683
111 1HE LYS 18 2HE LYS 18 8.463 -1.969 -8.665
112 2HE LYS 18 1HE LYS 18 7.702 -3.273 -7.733
113 1HZ LYS 18 1HZ LYS 18 6.757 -0.455 -7.879
114 2HZ LYS 18 2HZ LYS 18 6.051 -1.681 -6.936
115 3HZ LYS 18 3HZ LYS 18 6.023 -1.786 -8.631
116 H SER 19 H SER 19 9.473 -2.930 -0.980
117 HA SER 19 HA SER 19 10.787 -5.323 -1.769
118 1HB SER 19 2HB SER 19 11.439 -3.626 -0.004
119 2HB SER 19 1HB SER 19 10.229 -4.351 1.051
120 HG SER 19 HG SER 19 11.612 -5.869 1.460
121 H SER 20 H SER 20 7.852 -4.855 0.217
122 HA SER 20 HA SER 20 7.520 -7.826 0.371
123 1HB SER 20 2HB SER 20 7.535 -6.222 2.394
124 2HB SER 20 1HB SER 20 5.957 -5.686 1.829
125 HG SER 20 HG SER 20 6.759 -8.145 2.896
126 H ASN 21 H ASN 21 6.841 -5.940 -1.997
127 HA ASN 21 HA ASN 21 5.085 -5.635 -3.542
128 1HB ASN 21 2HB ASN 21 4.966 -8.368 -2.377
129 2HB ASN 21 1HB ASN 21 3.554 -7.868 -3.306
130 1HD2 ASN 21 1HD2 ASN 21 6.934 -8.780 -3.540
131 2HD2 ASN 21 2HD2 ASN 21 7.042 -8.672 -5.230
132 H LEU 22 H LEU 22 4.432 -3.920 -1.696
133 HA LEU 22 HA LEU 22 1.742 -4.595 -0.577
134 1HB LEU 22 2HB LEU 22 3.903 -2.573 -0.005
135 2HB LEU 22 1HB LEU 22 2.267 -2.319 0.600
136 HG LEU 22 HG LEU 22 3.596 -4.976 1.039
137 1HD1 LEU 22 1HD1 LEU 22 5.289 -3.465 1.833
138 2HD1 LEU 22 2HD1 LEU 22 4.404 -4.028 3.250
139 3HD1 LEU 22 3HD1 LEU 22 4.085 -2.422 2.592
140 1HD2 LEU 22 1HD2 LEU 22 1.374 -5.010 1.768
141 2HD2 LEU 22 2HD2 LEU 22 1.409 -3.320 2.273
142 3HD2 LEU 22 3HD2 LEU 22 2.221 -4.548 3.245
143 H VAL 23 H VAL 23 -0.079 -3.538 -1.330
144 HA VAL 23 HA VAL 23 0.316 -1.373 -3.376
145 HB VAL 23 HB VAL 23 -1.713 -2.348 -4.465
146 1HG1 VAL 23 1HG1 VAL 23 0.654 -3.047 -5.041
147 2HG1 VAL 23 2HG1 VAL 23 -0.588 -4.233 -5.441
148 3HG1 VAL 23 3HG1 VAL 23 0.413 -4.455 -4.006
149 1HG2 VAL 23 1HG2 VAL 23 -2.496 -3.398 -2.233
150 2HG2 VAL 23 2HG2 VAL 23 -1.372 -4.706 -2.602
151 3HG2 VAL 23 3HG2 VAL 23 -2.711 -4.359 -3.695
152 H CYS 24 H CYS 24 -1.430 0.245 -3.445
153 HA CYS 24 HA CYS 24 -2.439 0.934 -0.793
154 1HB CYS 24 2HB CYS 24 -1.685 2.308 -2.993
155 2HB CYS 24 1HB CYS 24 -3.428 2.291 -3.250
156 H SER 25 H SER 25 -4.608 0.902 -0.102
157 HA SER 25 HA SER 25 -6.449 -0.812 -1.716
158 1HB SER 25 2HB SER 25 -7.159 -1.621 0.313
159 2HB SER 25 1HB SER 25 -5.601 -1.008 0.855
160 HG SER 25 HG SER 25 -8.139 -0.136 1.401
161 H ARG 26 H ARG 26 -8.866 -0.168 -1.315
162 HA ARG 26 HA ARG 26 -9.117 2.790 -1.739
163 1HB ARG 26 2HB ARG 26 -10.022 0.426 -3.113
164 2HB ARG 26 1HB ARG 26 -11.424 1.353 -2.582
165 1HG ARG 26 2HG ARG 26 -10.758 2.143 -4.785
166 2HG ARG 26 1HG ARG 26 -10.402 3.399 -3.600
167 1HD ARG 26 2HD ARG 26 -8.503 3.083 -5.184
168 2HD ARG 26 1HD ARG 26 -8.029 2.650 -3.531
169 HE ARG 26 HE ARG 26 -7.842 0.404 -4.243
170 1HH1 ARG 26 2HH1 ARG 26 -7.850 1.856 -7.062
171 2HH1 ARG 26 1HH1 ARG 26 -8.879 0.763 -7.928
172 1HH2 ARG 26 1HH2 ARG 26 -10.020 -0.848 -5.067
173 2HH2 ARG 26 2HH2 ARG 26 -10.112 -0.771 -6.795
174 H ALA 27 H ALA 27 -10.386 0.020 0.078
175 HA ALA 27 HA ALA 27 -12.684 1.288 1.229
176 1HB ALA 27 1HB ALA 27 -10.857 -0.952 2.140
177 2HB ALA 27 2HB ALA 27 -12.363 -1.112 1.237
178 3HB ALA 27 3HB ALA 27 -12.396 -0.571 2.915
179 H HIS 28 H HIS 28 -9.520 0.637 2.774
180 HA HIS 28 HA HIS 28 -10.056 2.860 4.697
181 1HB HIS 28 2HB HIS 28 -8.247 0.437 4.649
182 2HB HIS 28 1HB HIS 28 -8.103 1.690 5.882
183 HD1 HIS 28 HD1 HIS 28 -10.461 2.220 7.195
184 HD2 HIS 28 HD2 HIS 28 -10.185 -1.451 5.239
185 HE1 HIS 28 HE1 HIS 28 -12.282 0.754 8.167
186 H ARG 29 H ARG 29 -8.331 2.308 1.825
187 HA ARG 29 HA ARG 29 -6.607 3.486 0.743
188 1HB ARG 29 2HB ARG 29 -8.262 5.248 2.201
189 2HB ARG 29 1HB ARG 29 -6.614 5.788 2.516
190 1HG ARG 29 2HG ARG 29 -6.888 6.897 0.538
191 2HG ARG 29 1HG ARG 29 -6.456 5.334 -0.154
192 1HD ARG 29 2HD ARG 29 -8.595 4.920 -0.885
193 2HD ARG 29 1HD ARG 29 -9.334 5.702 0.527
194 HE ARG 29 HE ARG 29 -8.513 7.055 -1.950
195 1HH1 ARG 29 2HH1 ARG 29 -10.945 7.496 -0.040
196 2HH1 ARG 29 1HH1 ARG 29 -10.585 9.088 0.538
197 1HH2 ARG 29 1HH2 ARG 29 -7.297 9.041 -0.586
198 2HH2 ARG 29 2HH2 ARG 29 -8.515 9.965 0.228
199 H TRP 30 H TRP 30 -5.270 1.714 1.926
200 HA TRP 30 HA TRP 30 -3.037 3.060 3.332
201 1HB TRP 30 2HB TRP 30 -3.140 1.504 5.219
202 2HB TRP 30 1HB TRP 30 -4.687 2.328 5.063
203 HD1 TRP 30 HD1 TRP 30 -6.419 0.835 3.280
204 HE1 TRP 30 HE1 TRP 30 -6.990 -1.669 3.509
205 HE3 TRP 30 HE3 TRP 30 -2.481 -0.693 6.126
206 HZ2 TRP 30 HZ2 TRP 30 -5.910 -4.014 4.749
207 HZ3 TRP 30 HZ3 TRP 30 -2.273 -3.061 6.824
208 HH2 TRP 30 HH2 TRP 30 -3.983 -4.723 6.140
209 H CYS 31 H CYS 31 -1.407 1.018 3.907
210 HA CYS 31 HA CYS 31 -0.864 -0.183 1.254
211 1HB CYS 31 2HB CYS 31 0.635 0.217 3.839
212 2HB CYS 31 1HB CYS 31 1.278 -0.837 2.582
213 H LYS 32 H LYS 32 -1.752 -2.151 0.852
214 HA LYS 32 HA LYS 32 -1.756 -4.197 3.047
215 1HB LYS 32 2HB LYS 32 -3.951 -4.921 2.188
216 2HB LYS 32 1HB LYS 32 -4.001 -3.215 2.623
217 1HG LYS 32 2HG LYS 32 -4.616 -2.683 0.528
218 2HG LYS 32 1HG LYS 32 -3.143 -3.416 -0.104
219 1HD LYS 32 2HD LYS 32 -4.461 -4.975 -1.066
220 2HD LYS 32 1HD LYS 32 -4.758 -5.597 0.557
221 1HE LYS 32 2HE LYS 32 -6.384 -3.288 -0.526
222 2HE LYS 32 1HE LYS 32 -6.839 -4.969 -0.862
223 1HZ LYS 32 1HZ LYS 32 -6.690 -5.417 1.540
224 2HZ LYS 32 2HZ LYS 32 -7.879 -4.257 1.179
225 3HZ LYS 32 3HZ LYS 32 -6.384 -3.771 1.824
226 H TYR 33 H TYR 33 -2.475 -6.424 1.673
227 HA TYR 33 HA TYR 33 -0.313 -6.696 -0.378
228 1HB TYR 33 2HB TYR 33 -0.797 -8.093 1.894
229 2HB TYR 33 1HB TYR 33 -1.744 -9.049 0.755
230 HD1 TYR 33 HD1 TYR 33 -0.642 -10.031 -1.274
231 HD2 TYR 33 HD2 TYR 33 1.601 -8.101 1.841
232 HE1 TYR 33 HE1 TYR 33 1.437 -11.088 -2.116
233 HE2 TYR 33 HE2 TYR 33 3.678 -9.158 0.998
234 HH TYR 33 HH TYR 33 4.194 -10.234 -1.791
235 H GLU 34 H GLU 34 -0.805 -7.722 -2.400
236 HA GLU 34 HA GLU 34 -3.445 -7.215 -3.475
237 1HB GLU 34 2HB GLU 34 -1.024 -7.349 -4.531
238 2HB GLU 34 1HB GLU 34 -1.430 -9.052 -4.742
239 1HG GLU 34 2HG GLU 34 -2.462 -8.408 -6.653
240 2HG GLU 34 1HG GLU 34 -3.724 -7.761 -5.604
241 H ILE 35 H ILE 35 -5.194 -8.491 -3.011
242 HA ILE 35 HA ILE 35 -4.757 -11.408 -2.477
243 HB ILE 35 HB ILE 35 -6.988 -9.469 -1.761
244 1HG1 ILE 35 2HG1 ILE 35 -5.605 -10.839 0.412
245 2HG1 ILE 35 1HG1 ILE 35 -4.481 -9.910 -0.579
246 1HG2 ILE 35 1HG2 ILE 35 -6.649 -12.436 -1.272
247 2HG2 ILE 35 2HG2 ILE 35 -8.017 -11.606 -2.016
248 3HG2 ILE 35 3HG2 ILE 35 -7.716 -11.434 -0.287
249 1HD1 ILE 35 1HD1 ILE 35 -6.060 -7.949 -0.381
250 2HD1 ILE 35 2HD1 ILE 35 -5.312 -8.437 1.140
251 3HD1 ILE 35 3HD1 ILE 35 -6.980 -8.891 0.793
252 1HN NH2 36 1HN NH2 36 -7.267 -12.625 -4.676
253 2HN NH2 36 2HN NH2 36 -6.663 -12.747 -3.009
Start of MODEL 17
1 1H GLU 1 1H GLU 1 11.422 7.015 2.590
2 2H GLU 1 2H GLU 1 10.563 6.847 4.046
3 3H GLU 1 3H GLU 1 11.303 8.327 3.661
4 HA GLU 1 HA GLU 1 8.912 8.468 3.282
5 1HB GLU 1 2HB GLU 1 10.960 8.560 1.084
6 2HB GLU 1 1HB GLU 1 9.280 8.923 0.694
7 1HG GLU 1 2HG GLU 1 9.302 10.897 1.836
8 2HG GLU 1 1HG GLU 1 10.320 10.254 3.125
9 H CYS 2 H CYS 2 8.292 6.072 3.790
10 HA CYS 2 HA CYS 2 7.116 4.896 1.327
11 1HB CYS 2 2HB CYS 2 9.402 3.925 1.666
12 2HB CYS 2 1HB CYS 2 8.892 3.358 3.256
13 H LEU 3 H LEU 3 5.199 3.756 1.773
14 HA LEU 3 HA LEU 3 4.168 4.006 4.553
15 1HB LEU 3 2HB LEU 3 2.860 3.366 1.886
16 2HB LEU 3 1HB LEU 3 1.989 3.576 3.404
17 HG LEU 3 HG LEU 3 3.789 5.694 2.192
18 1HD1 LEU 3 1HD1 LEU 3 1.983 6.624 1.104
19 2HD1 LEU 3 2HD1 LEU 3 0.819 5.986 2.266
20 3HD1 LEU 3 3HD1 LEU 3 1.495 4.931 1.025
21 1HD2 LEU 3 1HD2 LEU 3 1.812 5.653 4.492
22 2HD2 LEU 3 2HD2 LEU 3 2.466 7.140 3.807
23 3HD2 LEU 3 3HD2 LEU 3 3.544 5.975 4.575
24 H GLY 4 H GLY 4 4.749 2.215 5.761
25 1HA GLY 4 2HA GLY 4 4.981 -0.441 4.559
26 2HA GLY 4 1HA GLY 4 5.194 -0.054 6.266
27 H PHE 5 H PHE 5 3.882 -1.965 6.739
28 HA PHE 5 HA PHE 5 1.120 -2.167 5.858
29 1HB PHE 5 2HB PHE 5 2.692 -4.014 6.613
30 2HB PHE 5 1HB PHE 5 2.474 -3.428 8.262
31 HD1 PHE 5 HD1 PHE 5 0.543 -4.584 5.268
32 HD2 PHE 5 HD2 PHE 5 0.641 -4.150 9.541
33 HE1 PHE 5 HE1 PHE 5 -1.573 -5.862 5.448
34 HE2 PHE 5 HE2 PHE 5 -1.475 -5.430 9.718
35 HZ PHE 5 HZ PHE 5 -2.582 -6.286 7.671
36 H GLY 6 H GLY 6 -0.580 -1.012 6.659
37 1HA GLY 6 2HA GLY 6 -1.968 -0.205 8.469
38 2HA GLY 6 1HA GLY 6 -0.536 -0.124 9.496
39 H LYS 7 H LYS 7 -0.967 1.175 6.199
40 HA LYS 7 HA LYS 7 -0.851 3.954 7.286
41 1HB LYS 7 2HB LYS 7 1.253 2.438 5.935
42 2HB LYS 7 1HB LYS 7 0.869 3.929 5.076
43 1HG LYS 7 2HG LYS 7 1.461 5.285 6.881
44 2HG LYS 7 1HG LYS 7 1.215 3.996 8.060
45 1HD LYS 7 2HD LYS 7 3.193 2.803 7.080
46 2HD LYS 7 1HD LYS 7 3.475 4.211 6.057
47 1HE LYS 7 2HE LYS 7 3.369 5.507 8.384
48 2HE LYS 7 1HE LYS 7 3.853 3.920 9.013
49 1HZ LYS 7 1HZ LYS 7 5.790 5.231 8.359
50 2HZ LYS 7 2HZ LYS 7 5.181 5.368 6.778
51 3HZ LYS 7 3HZ LYS 7 5.639 3.848 7.389
52 H GLY 8 H GLY 8 -2.243 5.270 6.148
53 1HA GLY 8 2HA GLY 8 -3.913 4.209 4.069
54 2HA GLY 8 1HA GLY 8 -3.851 5.899 4.560
55 H CYS 9 H CYS 9 -3.814 4.439 1.846
56 HA CYS 9 HA CYS 9 -1.701 6.153 0.637
57 1HB CYS 9 2HB CYS 9 -0.940 4.155 -0.696
58 2HB CYS 9 1HB CYS 9 -0.623 4.006 1.031
59 H ASN 10 H ASN 10 -1.929 5.742 -1.948
60 HA ASN 10 HA ASN 10 -4.859 5.962 -2.550
61 1HB ASN 10 2HB ASN 10 -2.362 7.297 -3.427
62 2HB ASN 10 1HB ASN 10 -3.536 6.990 -4.707
63 1HD2 ASN 10 1HD2 ASN 10 -2.886 8.909 -1.847
64 2HD2 ASN 10 2HD2 ASN 10 -4.302 9.841 -1.915
65 HA PRO 11 HA PRO 11 -4.530 2.257 -4.939
66 1HB PRO 11 2HB PRO 11 -6.672 2.626 -6.611
67 2HB PRO 11 1HB PRO 11 -6.840 2.164 -4.905
68 1HG PRO 11 2HG PRO 11 -7.157 4.834 -6.181
69 2HG PRO 11 1HG PRO 11 -8.092 4.087 -4.877
70 1HD PRO 11 2HD PRO 11 -6.177 5.975 -4.451
71 2HD PRO 11 1HD PRO 11 -6.600 4.724 -3.261
72 H SER 12 H SER 12 -5.157 5.271 -6.801
73 HA SER 12 HA SER 12 -4.030 4.309 -9.280
74 1HB SER 12 2HB SER 12 -4.056 6.767 -9.815
75 2HB SER 12 1HB SER 12 -5.585 6.189 -9.162
76 HG SER 12 HG SER 12 -5.291 7.397 -7.458
77 H ASN 13 H ASN 13 -2.704 6.221 -6.569
78 HA ASN 13 HA ASN 13 0.043 5.827 -7.707
79 1HB ASN 13 2HB ASN 13 -1.064 8.170 -7.364
80 2HB ASN 13 1HB ASN 13 -0.771 7.884 -5.648
81 1HD2 ASN 13 1HD2 ASN 13 0.746 8.765 -8.667
82 2HD2 ASN 13 2HD2 ASN 13 2.328 8.892 -8.065
83 H ASP 14 H ASP 14 -0.350 3.612 -6.569
84 HA ASP 14 HA ASP 14 -0.531 3.371 -3.734
85 1HB ASP 14 2HB ASP 14 0.230 1.089 -4.144
86 2HB ASP 14 1HB ASP 14 -0.848 1.571 -5.452
87 H GLN 15 H GLN 15 0.967 3.605 -2.125
88 HA GLN 15 HA GLN 15 3.839 4.028 -2.900
89 1HB GLN 15 2HB GLN 15 2.247 6.027 -2.237
90 2HB GLN 15 1HB GLN 15 2.505 5.433 -0.598
91 1HG GLN 15 2HG GLN 15 4.999 5.524 -1.070
92 2HG GLN 15 1HG GLN 15 4.606 6.380 -2.562
93 1HE2 GLN 15 1HE2 GLN 15 3.584 8.539 -2.355
94 2HE2 GLN 15 2HE2 GLN 15 3.712 9.412 -0.906
95 H CYS 16 H CYS 16 2.511 1.562 -1.937
96 HA CYS 16 HA CYS 16 3.130 1.232 0.896
97 1HB CYS 16 2HB CYS 16 2.481 -0.684 -1.367
98 2HB CYS 16 1HB CYS 16 2.587 -1.159 0.327
99 H CYS 17 H CYS 17 4.824 -0.181 1.725
100 HA CYS 17 HA CYS 17 7.379 0.142 0.368
101 1HB CYS 17 2HB CYS 17 6.407 -1.262 2.868
102 2HB CYS 17 1HB CYS 17 8.102 -1.282 2.385
103 H LYS 18 H LYS 18 8.501 -1.354 -0.836
104 HA LYS 18 HA LYS 18 7.075 -3.801 -1.677
105 1HB LYS 18 2HB LYS 18 8.857 -3.871 -3.373
106 2HB LYS 18 1HB LYS 18 8.167 -2.253 -3.279
107 1HG LYS 18 2HG LYS 18 10.067 -1.344 -2.328
108 2HG LYS 18 1HG LYS 18 10.527 -2.854 -1.543
109 1HD LYS 18 2HD LYS 18 12.116 -2.636 -3.269
110 2HD LYS 18 1HD LYS 18 10.921 -3.737 -3.955
111 1HE LYS 18 2HE LYS 18 10.076 -2.126 -5.416
112 2HE LYS 18 1HE LYS 18 10.575 -0.777 -4.377
113 1HZ LYS 18 1HZ LYS 18 12.038 -1.065 -6.327
114 2HZ LYS 18 2HZ LYS 18 12.453 -2.615 -5.772
115 3HZ LYS 18 3HZ LYS 18 12.869 -1.241 -4.860
116 H SER 19 H SER 19 9.010 -3.163 0.939
117 HA SER 19 HA SER 19 11.000 -5.222 0.894
118 1HB SER 19 2HB SER 19 9.485 -3.742 3.051
119 2HB SER 19 1HB SER 19 10.736 -4.917 3.444
120 HG SER 19 HG SER 19 11.644 -2.863 3.286
121 H SER 20 H SER 20 7.664 -5.213 2.222
122 HA SER 20 HA SER 20 7.816 -8.202 2.422
123 1HB SER 20 2HB SER 20 6.043 -7.911 4.119
124 2HB SER 20 1HB SER 20 7.448 -6.930 4.513
125 HG SER 20 HG SER 20 6.187 -5.264 4.407
126 H ASN 21 H ASN 21 7.089 -6.441 -0.003
127 HA ASN 21 HA ASN 21 5.525 -6.487 -1.760
128 1HB ASN 21 2HB ASN 21 5.916 -9.042 -0.756
129 2HB ASN 21 1HB ASN 21 4.161 -8.895 -0.757
130 1HD2 ASN 21 1HD2 ASN 21 5.480 -10.679 -2.562
131 2HD2 ASN 21 2HD2 ASN 21 5.284 -10.093 -4.142
132 H LEU 22 H LEU 22 4.549 -4.571 -0.493
133 HA LEU 22 HA LEU 22 1.871 -5.246 0.670
134 1HB LEU 22 2HB LEU 22 3.743 -2.872 0.877
135 2HB LEU 22 1HB LEU 22 2.104 -2.845 1.523
136 HG LEU 22 HG LEU 22 4.191 -4.914 2.276
137 1HD1 LEU 22 1HD1 LEU 22 4.260 -3.656 4.445
138 2HD1 LEU 22 2HD1 LEU 22 3.287 -2.391 3.695
139 3HD1 LEU 22 3HD1 LEU 22 4.906 -2.736 3.086
140 1HD2 LEU 22 1HD2 LEU 22 1.962 -5.765 2.612
141 2HD2 LEU 22 2HD2 LEU 22 1.420 -4.236 3.305
142 3HD2 LEU 22 3HD2 LEU 22 2.553 -5.254 4.193
143 H VAL 23 H VAL 23 0.006 -4.275 -0.192
144 HA VAL 23 HA VAL 23 0.352 -2.617 -2.671
145 HB VAL 23 HB VAL 23 -1.717 -3.883 -3.475
146 1HG1 VAL 23 1HG1 VAL 23 0.739 -5.576 -2.942
147 2HG1 VAL 23 2HG1 VAL 23 0.624 -4.366 -4.220
148 3HG1 VAL 23 3HG1 VAL 23 -0.424 -5.784 -4.251
149 1HG2 VAL 23 1HG2 VAL 23 -2.331 -5.932 -2.396
150 2HG2 VAL 23 2HG2 VAL 23 -2.261 -4.718 -1.119
151 3HG2 VAL 23 3HG2 VAL 23 -0.936 -5.864 -1.319
152 H CYS 24 H CYS 24 -1.253 -0.988 -2.970
153 HA CYS 24 HA CYS 24 -2.546 -0.045 -0.519
154 1HB CYS 24 2HB CYS 24 -1.413 1.296 -2.403
155 2HB CYS 24 1HB CYS 24 -2.881 1.006 -3.337
156 H SER 25 H SER 25 -4.693 -0.275 0.016
157 HA SER 25 HA SER 25 -6.427 -1.879 -1.811
158 1HB SER 25 2HB SER 25 -5.871 -2.498 0.610
159 2HB SER 25 1HB SER 25 -6.853 -1.118 1.093
160 HG SER 25 HG SER 25 -7.589 -3.548 -0.071
161 H ARG 26 H ARG 26 -8.764 -1.217 -1.904
162 HA ARG 26 HA ARG 26 -9.022 1.761 -2.032
163 1HB ARG 26 2HB ARG 26 -9.750 -0.477 -3.689
164 2HB ARG 26 1HB ARG 26 -11.216 0.391 -3.231
165 1HG ARG 26 2HG ARG 26 -9.242 2.347 -3.854
166 2HG ARG 26 1HG ARG 26 -9.222 1.152 -5.152
167 1HD ARG 26 2HD ARG 26 -11.244 1.834 -5.938
168 2HD ARG 26 1HD ARG 26 -11.948 1.872 -4.310
169 HE ARG 26 HE ARG 26 -10.035 4.030 -5.036
170 1HH1 ARG 26 2HH1 ARG 26 -11.891 4.045 -2.621
171 2HH1 ARG 26 1HH1 ARG 26 -13.126 5.138 -3.150
172 1HH2 ARG 26 1HH2 ARG 26 -12.212 4.974 -6.497
173 2HH2 ARG 26 2HH2 ARG 26 -13.308 5.665 -5.348
174 H ALA 27 H ALA 27 -10.537 -1.158 -0.676
175 HA ALA 27 HA ALA 27 -12.939 -0.051 0.348
176 1HB ALA 27 1HB ALA 27 -11.108 -2.216 1.434
177 2HB ALA 27 2HB ALA 27 -12.407 -2.447 0.264
178 3HB ALA 27 3HB ALA 27 -12.787 -1.985 1.923
179 H HIS 28 H HIS 28 -9.760 -0.372 1.952
180 HA HIS 28 HA HIS 28 -10.680 1.556 4.052
181 1HB HIS 28 2HB HIS 28 -8.663 -0.678 3.906
182 2HB HIS 28 1HB HIS 28 -8.548 0.544 5.172
183 HD1 HIS 28 HD1 HIS 28 -11.246 0.991 6.188
184 HD2 HIS 28 HD2 HIS 28 -10.099 -2.804 4.898
185 HE1 HIS 28 HE1 HIS 28 -12.841 -0.647 7.276
186 H ARG 29 H ARG 29 -8.740 1.412 1.249
187 HA ARG 29 HA ARG 29 -7.148 2.887 0.337
188 1HB ARG 29 2HB ARG 29 -9.110 4.353 1.287
189 2HB ARG 29 1HB ARG 29 -7.929 4.819 2.512
190 1HG ARG 29 2HG ARG 29 -6.381 5.580 0.784
191 2HG ARG 29 1HG ARG 29 -7.482 5.031 -0.480
192 1HD ARG 29 2HD ARG 29 -9.224 6.615 0.520
193 2HD ARG 29 1HD ARG 29 -7.902 7.302 1.483
194 HE ARG 29 HE ARG 29 -6.762 7.405 -0.942
195 1HH1 ARG 29 2HH1 ARG 29 -9.393 6.969 -2.304
196 2HH1 ARG 29 1HH1 ARG 29 -9.953 8.589 -2.551
197 1HH2 ARG 29 1HH2 ARG 29 -7.740 9.984 -0.264
198 2HH2 ARG 29 2HH2 ARG 29 -9.015 10.301 -1.393
199 H TRP 30 H TRP 30 -5.861 1.069 1.840
200 HA TRP 30 HA TRP 30 -3.704 2.643 3.128
201 1HB TRP 30 2HB TRP 30 -3.894 1.532 5.229
202 2HB TRP 30 1HB TRP 30 -5.540 1.989 4.803
203 HD1 TRP 30 HD1 TRP 30 -6.711 -0.132 3.149
204 HE1 TRP 30 HE1 TRP 30 -6.848 -2.614 3.832
205 HE3 TRP 30 HE3 TRP 30 -3.004 -0.282 6.655
206 HZ2 TRP 30 HZ2 TRP 30 -5.555 -4.422 5.632
207 HZ3 TRP 30 HZ3 TRP 30 -2.479 -2.395 7.839
208 HH2 TRP 30 HH2 TRP 30 -3.749 -4.462 7.331
209 H CYS 31 H CYS 31 -1.866 1.048 3.796
210 HA CYS 31 HA CYS 31 -1.325 -0.696 1.485
211 1HB CYS 31 2HB CYS 31 0.192 0.337 3.880
212 2HB CYS 31 1HB CYS 31 0.881 -0.922 2.854
213 H LYS 32 H LYS 32 -1.814 -2.826 1.502
214 HA LYS 32 HA LYS 32 -1.926 -4.277 4.128
215 1HB LYS 32 2HB LYS 32 -3.792 -5.576 3.066
216 2HB LYS 32 1HB LYS 32 -4.162 -3.861 3.229
217 1HG LYS 32 2HG LYS 32 -3.879 -3.449 0.932
218 2HG LYS 32 1HG LYS 32 -2.923 -4.911 0.692
219 1HD LYS 32 2HD LYS 32 -5.586 -5.507 1.732
220 2HD LYS 32 1HD LYS 32 -5.653 -4.640 0.198
221 1HE LYS 32 2HE LYS 32 -3.595 -6.720 0.173
222 2HE LYS 32 1HE LYS 32 -5.213 -7.377 0.481
223 1HZ LYS 32 1HZ LYS 32 -4.554 -5.440 -1.678
224 2HZ LYS 32 2HZ LYS 32 -6.065 -6.167 -1.400
225 3HZ LYS 32 3HZ LYS 32 -4.747 -7.109 -1.910
226 H TYR 33 H TYR 33 -1.736 -6.760 3.684
227 HA TYR 33 HA TYR 33 0.724 -7.221 2.179
228 1HB TYR 33 2HB TYR 33 -1.091 -8.672 4.031
229 2HB TYR 33 1HB TYR 33 -0.157 -9.682 2.928
230 HD1 TYR 33 HD1 TYR 33 -0.088 -7.915 6.012
231 HD2 TYR 33 HD2 TYR 33 2.397 -9.090 2.709
232 HE1 TYR 33 HE1 TYR 33 1.932 -7.580 7.410
233 HE2 TYR 33 HE2 TYR 33 4.415 -8.755 4.108
234 HH TYR 33 HH TYR 33 4.707 -7.042 6.524
235 H GLU 34 H GLU 34 0.964 -8.429 0.271
236 HA GLU 34 HA GLU 34 -1.235 -8.392 -1.620
237 1HB GLU 34 2HB GLU 34 1.509 -8.430 -1.702
238 2HB GLU 34 1HB GLU 34 1.125 -10.087 -2.169
239 1HG GLU 34 2HG GLU 34 -0.198 -9.367 -4.019
240 2HG GLU 34 1HG GLU 34 -0.232 -7.701 -3.438
241 H ILE 35 H ILE 35 -2.770 -9.952 -1.903
242 HA ILE 35 HA ILE 35 -2.352 -12.631 -0.629
243 HB ILE 35 HB ILE 35 -4.817 -11.067 -1.474
244 1HG1 ILE 35 2HG1 ILE 35 -4.397 -11.925 1.333
245 2HG1 ILE 35 1HG1 ILE 35 -3.260 -10.712 0.745
246 1HG2 ILE 35 1HG2 ILE 35 -5.884 -12.987 -0.004
247 2HG2 ILE 35 2HG2 ILE 35 -4.446 -13.881 -0.497
248 3HG2 ILE 35 3HG2 ILE 35 -5.559 -13.259 -1.716
249 1HD1 ILE 35 1HD1 ILE 35 -5.179 -9.569 1.700
250 2HD1 ILE 35 2HD1 ILE 35 -6.285 -10.522 0.710
251 3HD1 ILE 35 3HD1 ILE 35 -5.209 -9.349 -0.050
252 1HN NH2 36 1HN NH2 36 -2.633 -12.252 -4.653
253 2HN NH2 36 2HN NH2 36 -2.171 -11.014 -3.465
Start of MODEL 18
1 1H GLU 1 1H GLU 1 12.706 8.227 1.732
2 2H GLU 1 2H GLU 1 11.191 8.712 1.139
3 3H GLU 1 3H GLU 1 11.954 7.334 0.502
4 HA GLU 1 HA GLU 1 11.749 6.210 2.661
5 1HB GLU 1 2HB GLU 1 11.021 8.992 3.296
6 2HB GLU 1 1HB GLU 1 9.937 7.802 4.018
7 1HG GLU 1 2HG GLU 1 12.903 7.366 4.185
8 2HG GLU 1 1HG GLU 1 12.137 8.510 5.287
9 H CYS 2 H CYS 2 10.140 4.688 2.477
10 HA CYS 2 HA CYS 2 7.603 5.488 1.081
11 1HB CYS 2 2HB CYS 2 7.672 3.183 0.135
12 2HB CYS 2 1HB CYS 2 9.092 4.123 -0.309
13 H LEU 3 H LEU 3 5.806 3.803 1.575
14 HA LEU 3 HA LEU 3 5.722 3.390 4.526
15 1HB LEU 3 2HB LEU 3 3.642 3.382 2.312
16 2HB LEU 3 1HB LEU 3 3.266 3.109 4.012
17 HG LEU 3 HG LEU 3 4.814 5.559 3.200
18 1HD1 LEU 3 1HD1 LEU 3 2.069 6.238 3.505
19 2HD1 LEU 3 2HD1 LEU 3 2.146 4.922 2.333
20 3HD1 LEU 3 3HD1 LEU 3 3.067 6.401 2.061
21 1HD2 LEU 3 1HD2 LEU 3 3.587 6.448 5.214
22 2HD2 LEU 3 2HD2 LEU 3 4.654 5.090 5.575
23 3HD2 LEU 3 3HD2 LEU 3 2.913 4.835 5.451
24 H GLY 4 H GLY 4 6.312 1.352 5.203
25 1HA GLY 4 2HA GLY 4 6.267 -0.930 3.370
26 2HA GLY 4 1HA GLY 4 6.783 -0.967 5.055
27 H PHE 5 H PHE 5 5.501 -2.973 5.229
28 HA PHE 5 HA PHE 5 2.644 -3.018 4.808
29 1HB PHE 5 2HB PHE 5 4.388 -4.923 5.033
30 2HB PHE 5 1HB PHE 5 4.199 -4.711 6.773
31 HD1 PHE 5 HD1 PHE 5 1.878 -4.768 3.806
32 HD2 PHE 5 HD2 PHE 5 2.755 -6.255 7.740
33 HE1 PHE 5 HE1 PHE 5 -0.186 -6.139 3.749
34 HE2 PHE 5 HE2 PHE 5 0.688 -7.624 7.681
35 HZ PHE 5 HZ PHE 5 -0.781 -7.567 5.685
36 H GLY 6 H GLY 6 0.968 -2.631 6.269
37 1HA GLY 6 2HA GLY 6 -0.094 -1.979 8.276
38 2HA GLY 6 1HA GLY 6 1.460 -2.117 9.102
39 H LYS 7 H LYS 7 0.775 -0.163 6.216
40 HA LYS 7 HA LYS 7 1.052 2.330 7.847
41 1HB LYS 7 2HB LYS 7 2.733 1.307 5.563
42 2HB LYS 7 1HB LYS 7 2.582 3.041 5.835
43 1HG LYS 7 2HG LYS 7 3.265 1.254 8.148
44 2HG LYS 7 1HG LYS 7 4.528 1.699 7.002
45 1HD LYS 7 2HD LYS 7 4.369 3.979 7.511
46 2HD LYS 7 1HD LYS 7 2.738 3.820 8.165
47 1HE LYS 7 2HE LYS 7 3.634 2.553 10.098
48 2HE LYS 7 1HE LYS 7 5.275 2.740 9.450
49 1HZ LYS 7 1HZ LYS 7 4.991 5.137 9.483
50 2HZ LYS 7 2HZ LYS 7 4.743 4.502 11.039
51 3HZ LYS 7 3HZ LYS 7 3.415 4.972 10.089
52 H GLY 8 H GLY 8 -0.497 3.796 7.234
53 1HA GLY 8 2HA GLY 8 -2.440 3.240 5.229
54 2HA GLY 8 1HA GLY 8 -2.199 4.815 5.986
55 H CYS 9 H CYS 9 -2.715 4.094 3.125
56 HA CYS 9 HA CYS 9 -0.434 5.629 1.952
57 1HB CYS 9 2HB CYS 9 -0.437 3.999 0.055
58 2HB CYS 9 1HB CYS 9 -0.002 3.245 1.588
59 H ASN 10 H ASN 10 -1.138 6.024 -0.541
60 HA ASN 10 HA ASN 10 -3.986 6.975 -0.481
61 1HB ASN 10 2HB ASN 10 -1.591 8.386 -0.683
62 2HB ASN 10 1HB ASN 10 -2.149 8.288 -2.353
63 1HD2 ASN 10 1HD2 ASN 10 -4.304 9.233 -2.848
64 2HD2 ASN 10 2HD2 ASN 10 -4.997 10.375 -1.802
65 HA PRO 11 HA PRO 11 -4.465 4.254 -3.955
66 1HB PRO 11 2HB PRO 11 -6.908 5.171 -4.795
67 2HB PRO 11 1HB PRO 11 -6.702 4.114 -3.384
68 1HG PRO 11 2HG PRO 11 -7.111 7.060 -3.495
69 2HG PRO 11 1HG PRO 11 -7.764 5.870 -2.359
70 1HD PRO 11 2HD PRO 11 -5.665 7.504 -1.773
71 2HD PRO 11 1HD PRO 11 -5.886 5.897 -1.047
72 H SER 12 H SER 12 -5.262 7.732 -4.367
73 HA SER 12 HA SER 12 -4.723 7.721 -7.232
74 1HB SER 12 2HB SER 12 -6.219 9.276 -5.818
75 2HB SER 12 1HB SER 12 -4.728 10.084 -5.341
76 HG SER 12 HG SER 12 -5.792 10.978 -7.226
77 H ASN 13 H ASN 13 -2.925 8.722 -4.309
78 HA ASN 13 HA ASN 13 -0.476 9.106 -5.990
79 1HB ASN 13 2HB ASN 13 -1.622 10.870 -4.351
80 2HB ASN 13 1HB ASN 13 -0.721 9.975 -3.128
81 1HD2 ASN 13 1HD2 ASN 13 -0.407 12.164 -5.872
82 2HD2 ASN 13 2HD2 ASN 13 1.267 12.403 -5.727
83 H ASP 14 H ASP 14 -0.613 6.561 -5.844
84 HA ASP 14 HA ASP 14 -0.084 5.145 -3.431
85 1HB ASP 14 2HB ASP 14 -0.730 4.327 -5.776
86 2HB ASP 14 1HB ASP 14 0.979 4.470 -6.186
87 H GLN 15 H GLN 15 1.683 5.246 -2.123
88 HA GLN 15 HA GLN 15 4.373 5.698 -3.331
89 1HB GLN 15 2HB GLN 15 2.895 7.725 -2.224
90 2HB GLN 15 1HB GLN 15 3.805 7.162 -0.821
91 1HG GLN 15 2HG GLN 15 5.764 7.966 -1.628
92 2HG GLN 15 1HG GLN 15 5.435 7.370 -3.254
93 1HE2 GLN 15 1HE2 GLN 15 4.359 8.813 -4.760
94 2HE2 GLN 15 2HE2 GLN 15 4.113 10.456 -4.409
95 H CYS 16 H CYS 16 3.345 3.238 -2.366
96 HA CYS 16 HA CYS 16 4.281 2.857 0.412
97 1HB CYS 16 2HB CYS 16 2.534 1.595 -1.503
98 2HB CYS 16 1HB CYS 16 3.697 0.407 -0.914
99 H CYS 17 H CYS 17 5.749 0.825 0.739
100 HA CYS 17 HA CYS 17 8.264 1.258 -0.655
101 1HB CYS 17 2HB CYS 17 7.246 -0.810 1.317
102 2HB CYS 17 1HB CYS 17 8.924 -0.725 0.784
103 H LYS 18 H LYS 18 9.003 0.219 -2.460
104 HA LYS 18 HA LYS 18 7.311 -1.853 -3.730
105 1HB LYS 18 2HB LYS 18 9.378 0.120 -4.476
106 2HB LYS 18 1HB LYS 18 9.488 -1.405 -5.356
107 1HG LYS 18 2HG LYS 18 6.895 0.129 -5.056
108 2HG LYS 18 1HG LYS 18 7.989 0.360 -6.420
109 1HD LYS 18 2HD LYS 18 7.560 -2.461 -6.011
110 2HD LYS 18 1HD LYS 18 6.003 -1.641 -6.120
111 1HE LYS 18 2HE LYS 18 7.369 -0.414 -8.154
112 2HE LYS 18 1HE LYS 18 8.049 -2.052 -8.214
113 1HZ LYS 18 1HZ LYS 18 6.005 -1.944 -9.493
114 2HZ LYS 18 2HZ LYS 18 5.155 -1.365 -8.141
115 3HZ LYS 18 3HZ LYS 18 5.789 -2.943 -8.139
116 H SER 19 H SER 19 9.470 -2.135 -1.333
117 HA SER 19 HA SER 19 11.452 -3.986 -2.303
118 1HB SER 19 2HB SER 19 11.418 -2.612 -0.160
119 2HB SER 19 1HB SER 19 10.251 -3.768 0.475
120 HG SER 19 HG SER 19 11.832 -5.111 0.803
121 H SER 20 H SER 20 8.230 -4.444 -0.808
122 HA SER 20 HA SER 20 8.407 -7.371 -1.446
123 1HB SER 20 2HB SER 20 6.988 -5.706 0.624
124 2HB SER 20 1HB SER 20 6.415 -7.327 0.246
125 HG SER 20 HG SER 20 8.096 -7.004 1.974
126 H ASN 21 H ASN 21 7.459 -4.867 -3.130
127 HA ASN 21 HA ASN 21 5.774 -4.408 -4.702
128 1HB ASN 21 2HB ASN 21 6.630 -6.814 -5.158
129 2HB ASN 21 1HB ASN 21 5.105 -7.341 -4.444
130 1HD2 ASN 21 1HD2 ASN 21 6.325 -5.082 -6.988
131 2HD2 ASN 21 2HD2 ASN 21 4.992 -5.297 -8.017
132 H LEU 22 H LEU 22 4.791 -3.426 -2.514
133 HA LEU 22 HA LEU 22 2.258 -4.797 -1.748
134 1HB LEU 22 2HB LEU 22 3.919 -2.506 -0.689
135 2HB LEU 22 1HB LEU 22 2.289 -2.808 -0.087
136 HG LEU 22 HG LEU 22 4.058 -5.184 -0.230
137 1HD1 LEU 22 1HD1 LEU 22 4.489 -2.966 1.797
138 2HD1 LEU 22 2HD1 LEU 22 5.645 -3.486 0.570
139 3HD1 LEU 22 3HD1 LEU 22 5.202 -4.577 1.883
140 1HD2 LEU 22 1HD2 LEU 22 2.041 -4.008 1.695
141 2HD2 LEU 22 2HD2 LEU 22 2.995 -5.436 2.095
142 3HD2 LEU 22 3HD2 LEU 22 1.888 -5.470 0.722
143 H VAL 23 H VAL 23 0.238 -3.551 -1.782
144 HA VAL 23 HA VAL 23 0.238 -1.282 -3.747
145 HB VAL 23 HB VAL 23 -1.893 -2.275 -4.611
146 1HG1 VAL 23 1HG1 VAL 23 0.270 -4.373 -4.686
147 2HG1 VAL 23 2HG1 VAL 23 0.483 -2.814 -5.482
148 3HG1 VAL 23 3HG1 VAL 23 -0.833 -3.882 -5.971
149 1HG2 VAL 23 1HG2 VAL 23 -2.383 -3.528 -2.455
150 2HG2 VAL 23 2HG2 VAL 23 -1.147 -4.690 -2.934
151 3HG2 VAL 23 3HG2 VAL 23 -2.590 -4.478 -3.926
152 H CYS 24 H CYS 24 -1.640 0.176 -3.491
153 HA CYS 24 HA CYS 24 -2.350 0.533 -0.643
154 1HB CYS 24 2HB CYS 24 -1.541 2.307 -2.340
155 2HB CYS 24 1HB CYS 24 -3.173 2.232 -3.004
156 H SER 25 H SER 25 -4.309 -0.079 0.182
157 HA SER 25 HA SER 25 -6.356 -1.214 -1.633
158 1HB SER 25 2HB SER 25 -7.252 -2.116 0.413
159 2HB SER 25 1HB SER 25 -5.501 -2.255 0.519
160 HG SER 25 HG SER 25 -6.836 -1.266 2.343
161 H ARG 26 H ARG 26 -8.736 -0.671 -0.570
162 HA ARG 26 HA ARG 26 -8.952 2.325 -0.593
163 1HB ARG 26 2HB ARG 26 -10.318 0.103 -1.996
164 2HB ARG 26 1HB ARG 26 -11.392 1.369 -1.395
165 1HG ARG 26 2HG ARG 26 -8.946 2.378 -2.699
166 2HG ARG 26 1HG ARG 26 -10.027 1.489 -3.774
167 1HD ARG 26 2HD ARG 26 -11.138 3.597 -1.918
168 2HD ARG 26 1HD ARG 26 -10.439 4.048 -3.487
169 HE ARG 26 HE ARG 26 -12.176 1.834 -3.919
170 1HH1 ARG 26 2HH1 ARG 26 -14.030 3.134 -2.081
171 2HH1 ARG 26 1HH1 ARG 26 -14.846 4.293 -3.076
172 1HH2 ARG 26 1HH2 ARG 26 -12.457 4.194 -5.601
173 2HH2 ARG 26 2HH2 ARG 26 -13.951 4.896 -5.076
174 H ALA 27 H ALA 27 -10.482 -0.668 0.670
175 HA ALA 27 HA ALA 27 -12.311 0.596 2.469
176 1HB ALA 27 1HB ALA 27 -12.444 -1.747 1.770
177 2HB ALA 27 2HB ALA 27 -12.316 -1.664 3.526
178 3HB ALA 27 3HB ALA 27 -10.903 -2.089 2.558
179 H HIS 28 H HIS 28 -9.022 -0.678 3.020
180 HA HIS 28 HA HIS 28 -8.980 0.620 5.708
181 1HB HIS 28 2HB HIS 28 -7.224 -1.431 4.323
182 2HB HIS 28 1HB HIS 28 -6.927 -0.822 5.952
183 HD1 HIS 28 HD1 HIS 28 -9.753 -0.776 7.103
184 HD2 HIS 28 HD2 HIS 28 -8.298 -3.944 4.814
185 HE1 HIS 28 HE1 HIS 28 -11.165 -2.793 7.694
186 H ARG 29 H ARG 29 -7.725 0.989 2.483
187 HA ARG 29 HA ARG 29 -6.206 2.518 1.538
188 1HB ARG 29 2HB ARG 29 -7.929 3.769 3.323
189 2HB ARG 29 1HB ARG 29 -6.344 4.370 3.810
190 1HG ARG 29 2HG ARG 29 -5.934 5.368 1.743
191 2HG ARG 29 1HG ARG 29 -7.053 4.301 0.893
192 1HD ARG 29 2HD ARG 29 -8.947 5.422 2.150
193 2HD ARG 29 1HD ARG 29 -7.761 6.606 2.735
194 HE ARG 29 HE ARG 29 -7.996 6.109 -0.201
195 1HH1 ARG 29 1HH2 ARG 29 -10.170 7.900 0.616
196 2HH1 ARG 29 2HH2 ARG 29 -9.439 9.469 0.565
197 1HH2 ARG 29 2HH1 ARG 29 -6.187 8.242 0.583
198 2HH2 ARG 29 1HH1 ARG 29 -7.175 9.664 0.546
199 H TRP 30 H TRP 30 -4.701 0.586 2.494
200 HA TRP 30 HA TRP 30 -2.390 1.972 3.738
201 1HB TRP 30 2HB TRP 30 -2.271 0.446 5.589
202 2HB TRP 30 1HB TRP 30 -3.946 0.986 5.515
203 HD1 TRP 30 HD1 TRP 30 -5.449 -0.746 3.716
204 HE1 TRP 30 HE1 TRP 30 -5.555 -3.317 3.876
205 HE3 TRP 30 HE3 TRP 30 -1.215 -1.629 6.418
206 HZ2 TRP 30 HZ2 TRP 30 -4.043 -5.464 5.006
207 HZ3 TRP 30 HZ3 TRP 30 -0.570 -3.945 7.024
208 HH2 TRP 30 HH2 TRP 30 -1.979 -5.859 6.323
209 H CYS 31 H CYS 31 -0.533 0.192 3.936
210 HA CYS 31 HA CYS 31 -0.109 -0.880 1.255
211 1HB CYS 31 2HB CYS 31 1.420 -0.005 3.405
212 2HB CYS 31 1HB CYS 31 1.700 -1.746 3.395
213 H LYS 32 H LYS 32 -1.143 -2.752 0.677
214 HA LYS 32 HA LYS 32 -1.214 -5.004 2.664
215 1HB LYS 32 2HB LYS 32 -3.380 -5.604 1.615
216 2HB LYS 32 1HB LYS 32 -3.420 -3.967 2.266
217 1HG LYS 32 2HG LYS 32 -3.757 -3.061 0.224
218 2HG LYS 32 1HG LYS 32 -2.465 -4.019 -0.496
219 1HD LYS 32 2HD LYS 32 -3.886 -5.753 -1.081
220 2HD LYS 32 1HD LYS 32 -5.022 -5.401 0.221
221 1HE LYS 32 2HE LYS 32 -6.090 -3.713 -0.981
222 2HE LYS 32 1HE LYS 32 -4.658 -3.373 -1.971
223 1HZ LYS 32 1HZ LYS 32 -6.209 -5.907 -2.068
224 2HZ LYS 32 2HZ LYS 32 -4.906 -5.477 -3.071
225 3HZ LYS 32 3HZ LYS 32 -6.381 -4.640 -3.181
226 H TYR 33 H TYR 33 -1.387 -7.183 1.515
227 HA TYR 33 HA TYR 33 0.576 -7.279 -0.706
228 1HB TYR 33 2HB TYR 33 -0.555 -9.084 1.374
229 2HB TYR 33 1HB TYR 33 -0.038 -9.854 -0.127
230 HD1 TYR 33 HD1 TYR 33 1.081 -7.601 2.624
231 HD2 TYR 33 HD2 TYR 33 2.269 -10.143 -0.631
232 HE1 TYR 33 HE1 TYR 33 3.444 -7.426 3.349
233 HE2 TYR 33 HE2 TYR 33 4.633 -9.968 0.096
234 HH TYR 33 HH TYR 33 5.723 -7.655 2.269
235 H GLU 34 H GLU 34 0.074 -8.849 -2.533
236 HA GLU 34 HA GLU 34 -2.769 -8.500 -3.418
237 1HB GLU 34 2HB GLU 34 -0.646 -7.530 -4.607
238 2HB GLU 34 1HB GLU 34 -0.413 -9.185 -5.170
239 1HG GLU 34 2HG GLU 34 -2.361 -9.172 -6.447
240 2HG GLU 34 1HG GLU 34 -3.115 -7.913 -5.468
241 H ILE 35 H ILE 35 -3.956 -10.323 -3.978
242 HA ILE 35 HA ILE 35 -2.883 -12.957 -3.226
243 HB ILE 35 HB ILE 35 -5.552 -12.023 -4.351
244 1HG1 ILE 35 2HG1 ILE 35 -5.000 -12.909 -1.523
245 2HG1 ILE 35 1HG1 ILE 35 -4.672 -11.246 -2.010
246 1HG2 ILE 35 1HG2 ILE 35 -6.406 -14.201 -3.573
247 2HG2 ILE 35 2HG2 ILE 35 -4.782 -14.666 -3.065
248 3HG2 ILE 35 3HG2 ILE 35 -5.135 -14.428 -4.777
249 1HD1 ILE 35 1HD1 ILE 35 -7.273 -12.645 -1.689
250 2HD1 ILE 35 2HD1 ILE 35 -7.148 -11.536 -3.056
251 3HD1 ILE 35 3HD1 ILE 35 -6.864 -10.951 -1.416
252 1HN NH2 36 1HN NH2 36 -2.801 -12.147 -7.212
253 2HN NH2 36 2HN NH2 36 -2.901 -10.981 -5.874
Start of MODEL 19
1 1H GLU 1 1H GLU 1 12.381 8.427 -0.166
2 2H GLU 1 2H GLU 1 10.758 8.809 -0.493
3 3H GLU 1 3H GLU 1 11.600 7.732 -1.502
4 HA GLU 1 HA GLU 1 11.779 6.128 0.317
5 1HB GLU 1 2HB GLU 1 10.985 8.563 1.706
6 2HB GLU 1 1HB GLU 1 9.966 7.201 2.172
7 1HG GLU 1 2HG GLU 1 11.991 5.854 2.640
8 2HG GLU 1 1HG GLU 1 12.999 7.234 2.206
9 H CYS 2 H CYS 2 9.934 4.671 0.856
10 HA CYS 2 HA CYS 2 7.466 5.276 -0.749
11 1HB CYS 2 2HB CYS 2 7.529 2.909 -1.424
12 2HB CYS 2 1HB CYS 2 9.051 3.697 -1.837
13 H LEU 3 H LEU 3 5.550 3.967 -0.011
14 HA LEU 3 HA LEU 3 5.477 3.821 2.957
15 1HB LEU 3 2HB LEU 3 3.357 3.677 0.785
16 2HB LEU 3 1HB LEU 3 3.012 3.675 2.514
17 HG LEU 3 HG LEU 3 4.590 5.874 1.156
18 1HD1 LEU 3 1HD1 LEU 3 1.650 5.890 1.896
19 2HD1 LEU 3 2HD1 LEU 3 2.251 5.670 0.253
20 3HD1 LEU 3 3HD1 LEU 3 2.550 7.184 1.107
21 1HD2 LEU 3 1HD2 LEU 3 3.610 5.282 3.897
22 2HD2 LEU 3 2HD2 LEU 3 3.413 6.949 3.357
23 3HD2 LEU 3 3HD2 LEU 3 5.016 6.214 3.383
24 H GLY 4 H GLY 4 5.845 1.855 3.903
25 1HA GLY 4 2HA GLY 4 5.299 -0.615 2.318
26 2HA GLY 4 1HA GLY 4 6.401 -0.520 3.690
27 H PHE 5 H PHE 5 5.229 -2.339 4.625
28 HA PHE 5 HA PHE 5 2.439 -2.384 5.219
29 1HB PHE 5 2HB PHE 5 4.331 -4.177 5.347
30 2HB PHE 5 1HB PHE 5 4.587 -3.563 6.980
31 HD1 PHE 5 HD1 PHE 5 2.968 -3.943 8.739
32 HD2 PHE 5 HD2 PHE 5 2.176 -5.225 4.716
33 HE1 PHE 5 HE1 PHE 5 1.052 -5.293 9.546
34 HE2 PHE 5 HE2 PHE 5 0.260 -6.574 5.524
35 HZ PHE 5 HZ PHE 5 -0.301 -6.609 7.938
36 H GLY 6 H GLY 6 1.244 -1.464 6.871
37 1HA GLY 6 2HA GLY 6 1.005 -0.605 9.146
38 2HA GLY 6 1HA GLY 6 2.695 -0.102 9.095
39 H LYS 7 H LYS 7 2.866 1.292 6.737
40 HA LYS 7 HA LYS 7 1.511 3.789 7.393
41 1HB LYS 7 2HB LYS 7 3.286 2.835 5.125
42 2HB LYS 7 1HB LYS 7 2.732 4.503 5.279
43 1HG LYS 7 2HG LYS 7 3.683 3.949 7.816
44 2HG LYS 7 1HG LYS 7 4.820 3.086 6.781
45 1HD LYS 7 2HD LYS 7 5.532 5.031 5.710
46 2HD LYS 7 1HD LYS 7 4.044 5.901 6.082
47 1HE LYS 7 2HE LYS 7 4.941 6.722 7.994
48 2HE LYS 7 1HE LYS 7 5.395 5.094 8.531
49 1HZ LYS 7 1HZ LYS 7 6.877 6.721 6.529
50 2HZ LYS 7 2HZ LYS 7 7.307 5.166 7.064
51 3HZ LYS 7 3HZ LYS 7 7.354 6.481 8.138
52 H GLY 8 H GLY 8 0.284 5.001 5.598
53 1HA GLY 8 2HA GLY 8 -1.322 3.138 3.903
54 2HA GLY 8 1HA GLY 8 -2.138 4.315 4.929
55 H CYS 9 H CYS 9 -2.420 4.241 2.104
56 HA CYS 9 HA CYS 9 -1.480 6.977 1.438
57 1HB CYS 9 2HB CYS 9 -0.204 6.304 -0.409
58 2HB CYS 9 1HB CYS 9 0.141 5.019 0.745
59 H ASN 10 H ASN 10 -2.332 7.280 -1.080
60 HA ASN 10 HA ASN 10 -5.223 7.192 -0.915
61 1HB ASN 10 2HB ASN 10 -3.108 8.009 -2.878
62 2HB ASN 10 1HB ASN 10 -4.768 7.862 -3.456
63 1HD2 ASN 10 1HD2 ASN 10 -6.182 9.587 -2.981
64 2HD2 ASN 10 2HD2 ASN 10 -5.805 10.865 -1.931
65 HA PRO 11 HA PRO 11 -5.850 3.164 -2.636
66 1HB PRO 11 2HB PRO 11 -8.447 3.456 -3.458
67 2HB PRO 11 1HB PRO 11 -7.985 3.253 -1.756
68 1HG PRO 11 2HG PRO 11 -8.724 5.722 -3.236
69 2HG PRO 11 1HG PRO 11 -9.091 5.249 -1.570
70 1HD PRO 11 2HD PRO 11 -7.129 7.031 -2.253
71 2HD PRO 11 1HD PRO 11 -7.110 6.054 -0.769
72 H SER 12 H SER 12 -7.074 5.918 -4.597
73 HA SER 12 HA SER 12 -6.835 4.477 -7.122
74 1HB SER 12 2HB SER 12 -7.358 6.758 -8.027
75 2HB SER 12 1HB SER 12 -8.478 6.252 -6.768
76 HG SER 12 HG SER 12 -7.837 7.894 -5.636
77 H ASN 13 H ASN 13 -4.981 7.123 -5.567
78 HA ASN 13 HA ASN 13 -2.753 6.650 -7.510
79 1HB ASN 13 2HB ASN 13 -3.525 8.950 -5.683
80 2HB ASN 13 1HB ASN 13 -2.046 8.927 -6.643
81 1HD2 ASN 13 1HD2 ASN 13 -2.380 8.661 -9.086
82 2HD2 ASN 13 2HD2 ASN 13 -3.782 9.326 -9.772
83 H ASP 14 H ASP 14 -2.532 4.625 -5.947
84 HA ASP 14 HA ASP 14 -1.361 5.151 -3.321
85 1HB ASP 14 2HB ASP 14 -1.228 2.726 -3.222
86 2HB ASP 14 1HB ASP 14 -2.766 3.167 -3.958
87 H GLN 15 H GLN 15 0.803 5.067 -2.755
88 HA GLN 15 HA GLN 15 2.806 4.630 -4.945
89 1HB GLN 15 2HB GLN 15 2.209 7.056 -4.197
90 2HB GLN 15 1HB GLN 15 3.099 6.661 -2.726
91 1HG GLN 15 2HG GLN 15 5.123 6.297 -3.917
92 2HG GLN 15 1HG GLN 15 4.288 6.219 -5.468
93 1HE2 GLN 15 1HE2 GLN 15 4.761 8.080 -6.651
94 2HE2 GLN 15 2HE2 GLN 15 4.849 9.647 -6.006
95 H CYS 16 H CYS 16 2.028 2.598 -3.157
96 HA CYS 16 HA CYS 16 3.750 2.495 -0.804
97 1HB CYS 16 2HB CYS 16 1.720 0.863 -2.201
98 2HB CYS 16 1HB CYS 16 2.943 -0.078 -1.349
99 H CYS 17 H CYS 17 5.342 0.594 -0.581
100 HA CYS 17 HA CYS 17 7.302 0.721 -2.749
101 1HB CYS 17 2HB CYS 17 7.239 0.205 0.019
102 2HB CYS 17 1HB CYS 17 7.776 -1.304 -0.719
103 H LYS 18 H LYS 18 7.425 -0.686 -4.441
104 HA LYS 18 HA LYS 18 5.599 -2.980 -4.617
105 1HB LYS 18 2HB LYS 18 6.380 -3.058 -6.900
106 2HB LYS 18 1HB LYS 18 6.211 -1.358 -6.468
107 1HG LYS 18 2HG LYS 18 8.761 -1.669 -5.734
108 2HG LYS 18 1HG LYS 18 8.692 -2.960 -6.932
109 1HD LYS 18 2HD LYS 18 9.190 -1.261 -8.380
110 2HD LYS 18 1HD LYS 18 7.449 -0.988 -8.312
111 1HE LYS 18 2HE LYS 18 8.597 0.342 -6.057
112 2HE LYS 18 1HE LYS 18 9.541 0.796 -7.489
113 1HZ LYS 18 1HZ LYS 18 7.582 2.203 -7.272
114 2HZ LYS 18 2HZ LYS 18 6.572 0.836 -7.283
115 3HZ LYS 18 3HZ LYS 18 7.472 1.245 -8.666
116 H SER 19 H SER 19 8.753 -2.526 -3.375
117 HA SER 19 HA SER 19 10.090 -4.931 -4.146
118 1HB SER 19 2HB SER 19 10.712 -2.700 -2.769
119 2HB SER 19 1HB SER 19 10.449 -3.790 -1.410
120 HG SER 19 HG SER 19 12.478 -3.704 -3.240
121 H SER 20 H SER 20 7.883 -4.240 -1.414
122 HA SER 20 HA SER 20 7.988 -7.114 -0.609
123 1HB SER 20 2HB SER 20 7.391 -4.490 0.651
124 2HB SER 20 1HB SER 20 6.454 -5.858 1.245
125 HG SER 20 HG SER 20 8.200 -6.657 2.122
126 H ASN 21 H ASN 21 6.387 -5.747 -2.963
127 HA ASN 21 HA ASN 21 4.246 -5.939 -3.932
128 1HB ASN 21 2HB ASN 21 4.675 -8.421 -2.267
129 2HB ASN 21 1HB ASN 21 3.215 -8.230 -3.236
130 1HD2 ASN 21 1HD2 ASN 21 3.492 -9.378 -5.160
131 2HD2 ASN 21 2HD2 ASN 21 4.911 -9.384 -6.092
132 H LEU 22 H LEU 22 3.979 -4.052 -2.058
133 HA LEU 22 HA LEU 22 1.657 -4.854 -0.335
134 1HB LEU 22 2HB LEU 22 3.660 -2.579 -0.148
135 2HB LEU 22 1HB LEU 22 2.335 -2.843 0.984
136 HG LEU 22 HG LEU 22 4.436 -4.943 0.409
137 1HD1 LEU 22 1HD1 LEU 22 4.336 -2.955 2.697
138 2HD1 LEU 22 2HD1 LEU 22 5.472 -2.883 1.350
139 3HD1 LEU 22 3HD1 LEU 22 5.530 -4.234 2.483
140 1HD2 LEU 22 1HD2 LEU 22 2.582 -5.988 1.406
141 2HD2 LEU 22 2HD2 LEU 22 2.195 -4.577 2.390
142 3HD2 LEU 22 3HD2 LEU 22 3.582 -5.586 2.802
143 H VAL 23 H VAL 23 -0.286 -3.763 -0.608
144 HA VAL 23 HA VAL 23 -0.340 -1.452 -2.520
145 HB VAL 23 HB VAL 23 -2.389 -2.471 -3.491
146 1HG1 VAL 23 1HG1 VAL 23 -1.283 -4.165 -4.770
147 2HG1 VAL 23 2HG1 VAL 23 -0.146 -4.502 -3.465
148 3HG1 VAL 23 3HG1 VAL 23 -0.046 -2.980 -4.350
149 1HG2 VAL 23 1HG2 VAL 23 -1.717 -4.796 -1.656
150 2HG2 VAL 23 2HG2 VAL 23 -2.976 -4.794 -2.889
151 3HG2 VAL 23 3HG2 VAL 23 -3.112 -3.730 -1.490
152 H CYS 24 H CYS 24 -1.931 0.128 -2.041
153 HA CYS 24 HA CYS 24 -2.813 0.264 0.733
154 1HB CYS 24 2HB CYS 24 -2.999 1.933 -1.757
155 2HB CYS 24 1HB CYS 24 -4.002 2.353 -0.368
156 H SER 25 H SER 25 -4.944 0.026 1.520
157 HA SER 25 HA SER 25 -6.765 -1.566 -0.167
158 1HB SER 25 2HB SER 25 -7.866 -2.018 1.911
159 2HB SER 25 1HB SER 25 -6.146 -1.980 2.280
160 HG SER 25 HG SER 25 -7.730 -0.719 3.637
161 H ARG 26 H ARG 26 -9.271 -0.830 0.573
162 HA ARG 26 HA ARG 26 -9.522 1.939 -0.545
163 1HB ARG 26 2HB ARG 26 -10.641 -0.583 -1.177
164 2HB ARG 26 1HB ARG 26 -11.955 0.372 -0.492
165 1HG ARG 26 2HG ARG 26 -10.602 2.159 -2.168
166 2HG ARG 26 1HG ARG 26 -10.630 0.645 -3.072
167 1HD ARG 26 2HD ARG 26 -12.844 0.875 -3.507
168 2HD ARG 26 1HD ARG 26 -13.204 1.147 -1.791
169 HE ARG 26 HE ARG 26 -12.426 3.269 -3.736
170 1HH1 ARG 26 2HH1 ARG 26 -11.369 3.966 -1.073
171 2HH1 ARG 26 1HH1 ARG 26 -12.698 4.788 -0.325
172 1HH2 ARG 26 1HH2 ARG 26 -15.054 3.588 -2.580
173 2HH2 ARG 26 2HH2 ARG 26 -14.790 4.573 -1.180
174 H ALA 27 H ALA 27 -10.723 -0.204 2.045
175 HA ALA 27 HA ALA 27 -12.494 1.799 3.204
176 1HB ALA 27 1HB ALA 27 -12.977 -0.530 3.511
177 2HB ALA 27 2HB ALA 27 -12.474 0.071 5.091
178 3HB ALA 27 3HB ALA 27 -11.346 -0.854 4.100
179 H HIS 28 H HIS 28 -9.443 0.334 4.365
180 HA HIS 28 HA HIS 28 -9.060 2.572 6.271
181 1HB HIS 28 2HB HIS 28 -7.636 -0.045 5.704
182 2HB HIS 28 1HB HIS 28 -7.112 1.089 6.949
183 HD1 HIS 28 HD1 HIS 28 -9.369 -1.705 6.413
184 HD2 HIS 28 HD2 HIS 28 -9.328 1.634 8.909
185 HE1 HIS 28 HE1 HIS 28 -11.035 -2.171 8.263
186 H ARG 29 H ARG 29 -8.070 1.738 3.073
187 HA ARG 29 HA ARG 29 -6.456 2.645 1.617
188 1HB ARG 29 2HB ARG 29 -6.894 4.862 3.641
189 2HB ARG 29 1HB ARG 29 -5.990 5.086 2.145
190 1HG ARG 29 2HG ARG 29 -7.923 5.427 1.047
191 2HG ARG 29 1HG ARG 29 -8.425 3.787 1.455
192 1HD ARG 29 2HD ARG 29 -10.128 5.254 2.331
193 2HD ARG 29 1HD ARG 29 -9.164 4.738 3.729
194 HE ARG 29 HE ARG 29 -8.414 7.257 2.318
195 1HH1 ARG 29 2HH1 ARG 29 -7.133 6.398 4.905
196 2HH1 ARG 29 1HH1 ARG 29 -7.993 7.354 6.065
197 1HH2 ARG 29 1HH2 ARG 29 -10.585 8.143 3.892
198 2HH2 ARG 29 2HH2 ARG 29 -9.950 8.343 5.490
199 H TRP 30 H TRP 30 -5.428 0.920 3.664
200 HA TRP 30 HA TRP 30 -2.822 2.229 4.345
201 1HB TRP 30 2HB TRP 30 -2.845 0.999 6.330
202 2HB TRP 30 1HB TRP 30 -4.565 1.279 6.086
203 HD1 TRP 30 HD1 TRP 30 -5.631 -0.832 4.345
204 HE1 TRP 30 HE1 TRP 30 -5.404 -3.358 4.798
205 HE3 TRP 30 HE3 TRP 30 -1.616 -0.793 7.485
206 HZ2 TRP 30 HZ2 TRP 30 -3.730 -5.130 6.299
207 HZ3 TRP 30 HZ3 TRP 30 -0.722 -2.911 8.413
208 HH2 TRP 30 HH2 TRP 30 -1.775 -5.077 7.824
209 H CYS 31 H CYS 31 -0.897 0.908 4.089
210 HA CYS 31 HA CYS 31 -0.911 -0.719 1.671
211 1HB CYS 31 2HB CYS 31 0.870 0.890 2.910
212 2HB CYS 31 1HB CYS 31 1.419 -0.667 3.529
213 H LYS 32 H LYS 32 -1.171 -2.906 1.572
214 HA LYS 32 HA LYS 32 -0.636 -4.552 4.018
215 1HB LYS 32 2HB LYS 32 -2.771 -5.731 3.552
216 2HB LYS 32 1HB LYS 32 -3.038 -4.015 3.850
217 1HG LYS 32 2HG LYS 32 -3.751 -3.628 1.724
218 2HG LYS 32 1HG LYS 32 -2.534 -4.690 1.020
219 1HD LYS 32 2HD LYS 32 -4.370 -5.993 0.586
220 2HD LYS 32 1HD LYS 32 -4.067 -6.545 2.234
221 1HE LYS 32 2HE LYS 32 -6.299 -5.964 2.469
222 2HE LYS 32 1HE LYS 32 -5.585 -4.369 2.779
223 1HZ LYS 32 1HZ LYS 32 -5.738 -3.866 0.425
224 2HZ LYS 32 2HZ LYS 32 -7.275 -4.264 1.031
225 3HZ LYS 32 3HZ LYS 32 -6.405 -5.394 0.108
226 H TYR 33 H TYR 33 -0.282 -6.862 3.491
227 HA TYR 33 HA TYR 33 1.200 -7.202 0.977
228 1HB TYR 33 2HB TYR 33 1.355 -8.186 3.552
229 2HB TYR 33 1HB TYR 33 0.665 -9.553 2.679
230 HD1 TYR 33 HD1 TYR 33 3.672 -7.903 3.541
231 HD2 TYR 33 HD2 TYR 33 1.812 -10.087 0.343
232 HE1 TYR 33 HE1 TYR 33 5.905 -8.423 2.599
233 HE2 TYR 33 HE2 TYR 33 4.047 -10.608 -0.599
234 HH TYR 33 HH TYR 33 6.681 -10.645 0.826
235 H GLU 34 H GLU 34 -0.337 -7.209 -0.718
236 HA GLU 34 HA GLU 34 -2.623 -9.113 -0.573
237 1HB GLU 34 2HB GLU 34 -2.685 -6.646 -1.348
238 2HB GLU 34 1HB GLU 34 -1.886 -7.217 -2.813
239 1HG GLU 34 2HG GLU 34 -3.747 -8.336 -3.559
240 2HG GLU 34 1HG GLU 34 -4.280 -8.751 -1.930
241 H ILE 35 H ILE 35 -2.902 -10.729 -2.260
242 HA ILE 35 HA ILE 35 -0.400 -11.967 -3.142
243 HB ILE 35 HB ILE 35 -3.344 -12.577 -3.591
244 1HG1 ILE 35 2HG1 ILE 35 -1.479 -14.225 -1.921
245 2HG1 ILE 35 1HG1 ILE 35 -2.067 -12.704 -1.251
246 1HG2 ILE 35 1HG2 ILE 35 -2.310 -14.919 -4.097
247 2HG2 ILE 35 2HG2 ILE 35 -0.831 -14.016 -4.427
248 3HG2 ILE 35 3HG2 ILE 35 -2.287 -13.697 -5.370
249 1HD1 ILE 35 1HD1 ILE 35 -3.765 -14.995 -2.281
250 2HD1 ILE 35 2HD1 ILE 35 -4.405 -13.438 -1.754
251 3HD1 ILE 35 3HD1 ILE 35 -3.587 -14.492 -0.600
252 1HN NH2 36 1HN NH2 36 -0.465 -11.419 -6.722
253 2HN NH2 36 2HN NH2 36 -0.299 -12.761 -5.568
Start of MODEL 20
1 1H GLU 1 1H GLU 1 13.308 4.222 0.420
2 2H GLU 1 2H GLU 1 13.577 2.574 0.732
3 3H GLU 1 3H GLU 1 14.544 3.751 1.482
4 HA GLU 1 HA GLU 1 12.963 2.952 3.093
5 1HB GLU 1 2HB GLU 1 12.680 5.694 1.875
6 2HB GLU 1 1HB GLU 1 11.720 5.257 3.289
7 1HG GLU 1 2HG GLU 1 13.495 5.636 4.617
8 2HG GLU 1 1HG GLU 1 14.404 4.394 3.757
9 H CYS 2 H CYS 2 10.964 2.004 3.421
10 HA CYS 2 HA CYS 2 8.801 2.515 1.415
11 1HB CYS 2 2HB CYS 2 8.456 0.139 1.188
12 2HB CYS 2 1HB CYS 2 10.182 0.428 0.974
13 H LEU 3 H LEU 3 6.647 1.777 2.232
14 HA LEU 3 HA LEU 3 6.389 2.310 5.156
15 1HB LEU 3 2HB LEU 3 4.481 2.353 2.794
16 2HB LEU 3 1HB LEU 3 3.980 2.675 4.453
17 HG LEU 3 HG LEU 3 6.238 4.205 3.151
18 1HD1 LEU 3 1HD1 LEU 3 3.290 4.928 3.209
19 2HD1 LEU 3 2HD1 LEU 3 4.202 4.474 1.770
20 3HD1 LEU 3 3HD1 LEU 3 4.593 5.965 2.627
21 1HD2 LEU 3 1HD2 LEU 3 6.188 4.451 5.532
22 2HD2 LEU 3 2HD2 LEU 3 4.431 4.593 5.551
23 3HD2 LEU 3 3HD2 LEU 3 5.415 5.900 4.890
24 H GLY 4 H GLY 4 4.819 0.973 6.380
25 1HA GLY 4 2HA GLY 4 4.739 -1.842 5.368
26 2HA GLY 4 1HA GLY 4 4.792 -1.403 7.075
27 H PHE 5 H PHE 5 2.833 -2.678 7.379
28 HA PHE 5 HA PHE 5 0.353 -1.834 6.035
29 1HB PHE 5 2HB PHE 5 0.757 -4.178 6.578
30 2HB PHE 5 1HB PHE 5 1.014 -3.778 8.275
31 HD1 PHE 5 HD1 PHE 5 -1.547 -3.623 5.551
32 HD2 PHE 5 HD2 PHE 5 -0.794 -3.708 9.780
33 HE1 PHE 5 HE1 PHE 5 -3.980 -3.842 5.981
34 HE2 PHE 5 HE2 PHE 5 -3.226 -3.925 10.209
35 HZ PHE 5 HZ PHE 5 -4.819 -3.992 8.310
36 H GLY 6 H GLY 6 -1.207 -0.487 6.930
37 1HA GLY 6 2HA GLY 6 -2.344 0.468 8.898
38 2HA GLY 6 1HA GLY 6 -0.794 0.448 9.739
39 H LYS 7 H LYS 7 0.861 1.547 7.748
40 HA LYS 7 HA LYS 7 0.390 4.367 8.081
41 1HB LYS 7 2HB LYS 7 2.428 2.592 7.192
42 2HB LYS 7 1HB LYS 7 2.169 3.757 5.894
43 1HG LYS 7 2HG LYS 7 2.425 4.663 8.759
44 2HG LYS 7 1HG LYS 7 3.854 4.385 7.764
45 1HD LYS 7 2HD LYS 7 3.575 6.499 7.009
46 2HD LYS 7 1HD LYS 7 2.192 5.881 6.105
47 1HE LYS 7 2HE LYS 7 1.131 7.558 7.319
48 2HE LYS 7 1HE LYS 7 0.986 6.234 8.490
49 1HZ LYS 7 1HZ LYS 7 1.977 8.177 9.531
50 2HZ LYS 7 2HZ LYS 7 3.208 8.208 8.361
51 3HZ LYS 7 3HZ LYS 7 3.107 6.914 9.458
52 H GLY 8 H GLY 8 -0.506 5.869 6.657
53 1HA GLY 8 2HA GLY 8 -2.181 4.805 4.491
54 2HA GLY 8 1HA GLY 8 -2.152 6.476 5.049
55 H CYS 9 H CYS 9 -1.863 5.167 2.295
56 HA CYS 9 HA CYS 9 0.374 6.891 1.390
57 1HB CYS 9 2HB CYS 9 1.390 4.984 0.166
58 2HB CYS 9 1HB CYS 9 1.368 4.687 1.904
59 H ASN 10 H ASN 10 0.144 7.483 -0.837
60 HA ASN 10 HA ASN 10 -2.587 7.182 -1.900
61 1HB ASN 10 2HB ASN 10 -1.892 8.929 -3.415
62 2HB ASN 10 1HB ASN 10 -1.239 9.320 -1.828
63 1HD2 ASN 10 1HD2 ASN 10 -0.253 9.939 -4.691
64 2HD2 ASN 10 2HD2 ASN 10 1.369 9.441 -4.679
65 HA PRO 11 HA PRO 11 -1.672 3.940 -4.727
66 1HB PRO 11 2HB PRO 11 -3.496 4.482 -6.694
67 2HB PRO 11 1HB PRO 11 -3.944 3.803 -5.116
68 1HG PRO 11 2HG PRO 11 -4.142 6.606 -6.098
69 2HG PRO 11 1HG PRO 11 -5.259 5.684 -5.079
70 1HD PRO 11 2HD PRO 11 -3.516 7.543 -4.107
71 2HD PRO 11 1HD PRO 11 -4.107 6.160 -3.161
72 H SER 12 H SER 12 -1.801 7.260 -6.037
73 HA SER 12 HA SER 12 -0.639 6.819 -8.593
74 1HB SER 12 2HB SER 12 -0.617 9.102 -6.614
75 2HB SER 12 1HB SER 12 0.159 9.247 -8.188
76 HG SER 12 HG SER 12 -1.740 9.398 -9.077
77 H ASN 13 H ASN 13 0.913 7.286 -5.419
78 HA ASN 13 HA ASN 13 3.487 6.330 -6.618
79 1HB ASN 13 2HB ASN 13 3.244 8.867 -6.205
80 2HB ASN 13 1HB ASN 13 3.257 8.468 -4.487
81 1HD2 ASN 13 1HD2 ASN 13 5.242 8.539 -7.420
82 2HD2 ASN 13 2HD2 ASN 13 6.719 8.238 -6.640
83 H ASP 14 H ASP 14 2.327 4.316 -5.596
84 HA ASP 14 HA ASP 14 2.079 4.035 -2.759
85 1HB ASP 14 2HB ASP 14 2.015 1.636 -3.290
86 2HB ASP 14 1HB ASP 14 1.107 2.535 -4.503
87 H GLN 15 H GLN 15 3.642 3.836 -1.205
88 HA GLN 15 HA GLN 15 6.456 3.290 -2.106
89 1HB GLN 15 2HB GLN 15 5.206 5.121 -0.065
90 2HB GLN 15 1HB GLN 15 6.891 4.628 0.104
91 1HG GLN 15 2HG GLN 15 7.509 5.623 -1.957
92 2HG GLN 15 1HG GLN 15 5.832 5.764 -2.487
93 1HE2 GLN 15 1HE2 GLN 15 8.150 7.051 -0.064
94 2HE2 GLN 15 2HE2 GLN 15 7.340 8.528 0.152
95 H CYS 16 H CYS 16 4.118 1.500 -0.929
96 HA CYS 16 HA CYS 16 5.109 0.588 1.646
97 1HB CYS 16 2HB CYS 16 2.989 -0.019 -0.305
98 2HB CYS 16 1HB CYS 16 3.561 -1.432 0.582
99 H CYS 17 H CYS 17 6.211 -1.420 2.061
100 HA CYS 17 HA CYS 17 8.279 -2.110 0.152
101 1HB CYS 17 2HB CYS 17 7.537 -2.601 2.909
102 2HB CYS 17 1HB CYS 17 8.054 -4.104 2.146
103 H LYS 18 H LYS 18 8.324 -3.777 -1.321
104 HA LYS 18 HA LYS 18 5.860 -5.157 -2.027
105 1HB LYS 18 2HB LYS 18 8.358 -4.484 -3.175
106 2HB LYS 18 1HB LYS 18 8.265 -6.244 -3.220
107 1HG LYS 18 2HG LYS 18 5.889 -4.607 -4.066
108 2HG LYS 18 1HG LYS 18 7.228 -4.851 -5.188
109 1HD LYS 18 2HD LYS 18 6.875 -7.395 -4.273
110 2HD LYS 18 1HD LYS 18 5.220 -6.789 -4.195
111 1HE LYS 18 2HE LYS 18 5.044 -7.093 -6.432
112 2HE LYS 18 1HE LYS 18 6.328 -5.893 -6.672
113 1HZ LYS 18 1HZ LYS 18 6.751 -8.770 -6.045
114 2HZ LYS 18 2HZ LYS 18 7.975 -7.613 -6.269
115 3HZ LYS 18 3HZ LYS 18 6.972 -8.056 -7.567
116 H SER 19 H SER 19 8.515 -5.897 0.101
117 HA SER 19 HA SER 19 8.540 -8.753 -0.017
118 1HB SER 19 2HB SER 19 10.172 -7.186 1.107
119 2HB SER 19 1HB SER 19 8.980 -6.944 2.380
120 HG SER 19 HG SER 19 9.487 -8.826 3.168
121 H SER 20 H SER 20 6.447 -6.489 1.773
122 HA SER 20 HA SER 20 5.030 -8.742 3.096
123 1HB SER 20 2HB SER 20 5.036 -5.731 3.298
124 2HB SER 20 1HB SER 20 3.810 -6.698 4.113
125 HG SER 20 HG SER 20 5.664 -6.282 5.422
126 H ASN 21 H ASN 21 4.845 -7.628 0.060
127 HA ASN 21 HA ASN 21 3.143 -7.403 -1.557
128 1HB ASN 21 2HB ASN 21 2.940 -9.738 -0.202
129 2HB ASN 21 1HB ASN 21 1.350 -9.060 0.152
130 1HD2 ASN 21 1HD2 ASN 21 3.444 -10.237 -2.462
131 2HD2 ASN 21 2HD2 ASN 21 2.231 -10.281 -3.648
132 H LEU 22 H LEU 22 3.150 -5.197 0.155
133 HA LEU 22 HA LEU 22 0.367 -4.752 1.088
134 1HB LEU 22 2HB LEU 22 3.061 -3.475 1.382
135 2HB LEU 22 1HB LEU 22 1.636 -2.469 1.639
136 HG LEU 22 HG LEU 22 1.772 -5.159 2.963
137 1HD1 LEU 22 1HD1 LEU 22 2.930 -4.171 4.885
138 2HD1 LEU 22 2HD1 LEU 22 3.067 -2.633 4.034
139 3HD1 LEU 22 3HD1 LEU 22 3.942 -4.046 3.446
140 1HD2 LEU 22 1HD2 LEU 22 -0.239 -3.528 2.931
141 2HD2 LEU 22 2HD2 LEU 22 0.719 -2.533 4.027
142 3HD2 LEU 22 3HD2 LEU 22 0.258 -4.169 4.497
143 H VAL 23 H VAL 23 -1.063 -3.375 0.040
144 HA VAL 23 HA VAL 23 -0.079 -1.995 -2.441
145 HB VAL 23 HB VAL 23 -2.400 -2.521 -3.325
146 1HG1 VAL 23 1HG1 VAL 23 -1.856 -4.826 -3.885
147 2HG1 VAL 23 2HG1 VAL 23 -0.749 -4.932 -2.515
148 3HG1 VAL 23 3HG1 VAL 23 -0.373 -3.872 -3.874
149 1HG2 VAL 23 1HG2 VAL 23 -2.555 -4.565 -1.111
150 2HG2 VAL 23 2HG2 VAL 23 -3.835 -3.999 -2.183
151 3HG2 VAL 23 3HG2 VAL 23 -3.240 -2.955 -0.893
152 H CYS 24 H CYS 24 -0.769 0.127 -2.714
153 HA CYS 24 HA CYS 24 -2.006 1.461 -0.402
154 1HB CYS 24 2HB CYS 24 -0.841 2.299 -3.065
155 2HB CYS 24 1HB CYS 24 -1.617 3.464 -1.991
156 H SER 25 H SER 25 -4.215 1.201 -0.257
157 HA SER 25 HA SER 25 -5.949 0.858 -2.564
158 1HB SER 25 2HB SER 25 -6.304 -0.055 -0.251
159 2HB SER 25 1HB SER 25 -6.588 1.589 0.314
160 HG SER 25 HG SER 25 -8.502 0.340 -0.282
161 H ARG 26 H ARG 26 -7.224 2.402 -3.590
162 HA ARG 26 HA ARG 26 -6.535 5.238 -3.140
163 1HB ARG 26 2HB ARG 26 -7.719 5.548 -5.250
164 2HB ARG 26 1HB ARG 26 -6.670 4.139 -5.390
165 1HG ARG 26 2HG ARG 26 -8.527 3.070 -6.136
166 2HG ARG 26 1HG ARG 26 -9.001 3.018 -4.439
167 1HD ARG 26 2HD ARG 26 -10.094 5.299 -4.793
168 2HD ARG 26 1HD ARG 26 -9.840 5.047 -6.531
169 HE ARG 26 HE ARG 26 -11.000 2.671 -5.612
170 1HH1 ARG 26 1HH2 ARG 26 -12.274 4.505 -7.645
171 2HH1 ARG 26 2HH2 ARG 26 -13.760 4.922 -6.859
172 1HH2 ARG 26 2HH1 ARG 26 -12.711 3.859 -3.724
173 2HH2 ARG 26 1HH1 ARG 26 -14.009 4.555 -4.635
174 H ALA 27 H ALA 27 -9.193 3.048 -2.450
175 HA ALA 27 HA ALA 27 -11.265 5.024 -2.072
176 1HB ALA 27 1HB ALA 27 -12.438 3.145 -1.060
177 2HB ALA 27 2HB ALA 27 -10.918 2.287 -0.810
178 3HB ALA 27 3HB ALA 27 -11.526 2.547 -2.445
179 H HIS 28 H HIS 28 -9.016 3.396 0.169
180 HA HIS 28 HA HIS 28 -9.853 5.288 2.333
181 1HB HIS 28 2HB HIS 28 -8.371 2.637 2.372
182 2HB HIS 28 1HB HIS 28 -8.813 3.566 3.805
183 HD1 HIS 28 HD1 HIS 28 -11.586 4.235 3.707
184 HD2 HIS 28 HD2 HIS 28 -10.302 0.748 1.818
185 HE1 HIS 28 HE1 HIS 28 -13.641 2.788 3.402
186 H ARG 29 H ARG 29 -7.473 5.058 0.000
187 HA ARG 29 HA ARG 29 -5.310 5.959 -0.239
188 1HB ARG 29 2HB ARG 29 -6.940 7.653 1.544
189 2HB ARG 29 1HB ARG 29 -5.205 7.944 1.665
190 1HG ARG 29 2HG ARG 29 -5.332 9.157 -0.225
191 2HG ARG 29 1HG ARG 29 -5.746 7.679 -1.093
192 1HD ARG 29 2HD ARG 29 -7.944 8.263 -1.267
193 2HD ARG 29 1HD ARG 29 -8.005 8.869 0.400
194 HE ARG 29 HE ARG 29 -6.655 10.870 -0.537
195 1HH1 ARG 29 2HH1 ARG 29 -9.534 11.219 -1.066
196 2HH1 ARG 29 1HH1 ARG 29 -9.593 11.466 -2.779
197 1HH2 ARG 29 1HH2 ARG 29 -6.403 10.203 -3.336
198 2HH2 ARG 29 2HH2 ARG 29 -7.814 10.889 -4.068
199 H TRP 30 H TRP 30 -5.438 3.627 1.504
200 HA TRP 30 HA TRP 30 -3.061 4.211 3.212
201 1HB TRP 30 2HB TRP 30 -4.083 3.360 5.128
202 2HB TRP 30 1HB TRP 30 -5.448 4.145 4.340
203 HD1 TRP 30 HD1 TRP 30 -6.544 2.228 2.357
204 HE1 TRP 30 HE1 TRP 30 -7.396 -0.128 2.966
205 HE3 TRP 30 HE3 TRP 30 -4.078 1.518 6.764
206 HZ2 TRP 30 HZ2 TRP 30 -7.070 -2.060 5.054
207 HZ3 TRP 30 HZ3 TRP 30 -4.362 -0.586 8.045
208 HH2 TRP 30 HH2 TRP 30 -5.855 -2.373 7.194
209 H CYS 31 H CYS 31 -2.019 2.052 3.931
210 HA CYS 31 HA CYS 31 -1.932 0.259 1.563
211 1HB CYS 31 2HB CYS 31 -0.031 1.410 3.202
212 2HB CYS 31 1HB CYS 31 -0.114 -0.240 3.820
213 H LYS 32 H LYS 32 -2.593 -1.862 1.633
214 HA LYS 32 HA LYS 32 -3.301 -3.095 4.260
215 1HB LYS 32 2HB LYS 32 -5.508 -3.723 3.310
216 2HB LYS 32 1HB LYS 32 -5.304 -1.973 3.352
217 1HG LYS 32 2HG LYS 32 -5.258 -1.788 1.075
218 2HG LYS 32 1HG LYS 32 -4.373 -3.299 0.868
219 1HD LYS 32 2HD LYS 32 -6.501 -3.788 -0.020
220 2HD LYS 32 1HD LYS 32 -6.577 -4.448 1.615
221 1HE LYS 32 2HE LYS 32 -7.481 -2.033 2.225
222 2HE LYS 32 1HE LYS 32 -7.909 -1.994 0.504
223 1HZ LYS 32 1HZ LYS 32 -8.608 -4.169 2.410
224 2HZ LYS 32 2HZ LYS 32 -9.005 -4.134 0.757
225 3HZ LYS 32 3HZ LYS 32 -9.683 -2.996 1.822
226 H TYR 33 H TYR 33 -3.977 -5.500 3.800
227 HA TYR 33 HA TYR 33 -1.903 -6.674 2.030
228 1HB TYR 33 2HB TYR 33 -2.951 -7.237 4.553
229 2HB TYR 33 1HB TYR 33 -3.656 -8.485 3.525
230 HD1 TYR 33 HD1 TYR 33 -2.195 -10.005 2.208
231 HD2 TYR 33 HD2 TYR 33 -0.587 -7.174 5.009
232 HE1 TYR 33 HE1 TYR 33 -0.033 -11.216 2.189
233 HE2 TYR 33 HE2 TYR 33 1.576 -8.385 4.992
234 HH TYR 33 HH TYR 33 2.104 -11.194 4.293
235 H GLU 34 H GLU 34 -2.407 -7.683 0.107
236 HA GLU 34 HA GLU 34 -5.227 -8.477 -0.442
237 1HB GLU 34 2HB GLU 34 -4.308 -6.024 -1.163
238 2HB GLU 34 1HB GLU 34 -3.821 -6.958 -2.577
239 1HG GLU 34 2HG GLU 34 -6.445 -7.806 -1.947
240 2HG GLU 34 1HG GLU 34 -6.458 -6.045 -1.835
241 H ILE 35 H ILE 35 -5.383 -9.930 -2.311
242 HA ILE 35 HA ILE 35 -2.768 -11.120 -3.174
243 HB ILE 35 HB ILE 35 -3.925 -12.398 -1.349
244 1HG1 ILE 35 2HG1 ILE 35 -4.152 -14.063 -3.836
245 2HG1 ILE 35 1HG1 ILE 35 -2.580 -13.388 -3.405
246 1HG2 ILE 35 1HG2 ILE 35 -6.254 -11.762 -2.168
247 2HG2 ILE 35 2HG2 ILE 35 -6.041 -13.455 -1.724
248 3HG2 ILE 35 3HG2 ILE 35 -6.051 -12.984 -3.424
249 1HD1 ILE 35 1HD1 ILE 35 -4.284 -14.947 -1.448
250 2HD1 ILE 35 2HD1 ILE 35 -2.587 -14.496 -1.280
251 3HD1 ILE 35 3HD1 ILE 35 -3.063 -15.708 -2.470
252 1HN NH2 36 1HN NH2 36 -5.869 -10.144 -5.524
253 2HN NH2 36 2HN NH2 36 -5.345 -9.485 -3.960