Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
14641 | 1x32 RC | 6589 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 1H GLY 1 1HT GLY 1 -11.345 -2.647 7.766
2 2H GLY 1 2HT GLY 1 -11.440 -3.296 9.325
3 3H GLY 1 3HT GLY 1 -9.936 -3.133 8.566
4 1HA GLY 1 1HA GLY 1 -11.711 -0.894 9.375
5 2HA GLY 1 2HA GLY 1 -10.274 -1.411 10.243
6 H SER 2 H SER 2 -11.464 0.057 7.283
7 HA SER 2 HA SER 2 -10.487 1.419 5.743
8 1HB SER 2 2HB SER 2 -8.641 2.022 8.066
9 2HB SER 2 1HB SER 2 -8.760 2.981 6.590
10 HG SER 2 HG SER 2 -10.825 3.555 7.137
11 H GLY 3 H GLY 3 -9.830 -1.061 5.192
12 1HA GLY 3 2HA GLY 3 -7.302 -0.840 3.902
13 2HA GLY 3 1HA GLY 3 -7.196 -1.905 5.296
14 H GLU 4 H GLU 4 -6.982 -2.396 2.352
15 HA GLU 4 HA GLU 4 -7.536 -4.011 0.864
16 1HB GLU 4 2HB GLU 4 -7.047 -5.620 2.441
17 2HB GLU 4 1HB GLU 4 -8.391 -5.170 3.485
18 1HG GLU 4 2HG GLU 4 -9.960 -6.244 2.010
19 2HG GLU 4 1HG GLU 4 -8.687 -6.585 0.839
20 H VAL 5 H VAL 5 -9.593 -1.833 1.765
21 HA VAL 5 HA VAL 5 -12.123 -3.012 1.059
22 HB VAL 5 HB VAL 5 -11.402 -0.094 1.355
23 1HG1 VAL 5 1HG1 VAL 5 -13.426 -0.413 0.052
24 2HG1 VAL 5 2HG1 VAL 5 -13.823 0.227 1.647
25 3HG1 VAL 5 3HG1 VAL 5 -14.080 -1.481 1.293
26 1HG2 VAL 5 1HG2 VAL 5 -10.985 -1.284 3.420
27 2HG2 VAL 5 2HG2 VAL 5 -12.576 -2.040 3.339
28 3HG2 VAL 5 3HG2 VAL 5 -12.438 -0.299 3.586
29 H ASN 6 H ASN 6 -9.794 -0.856 -0.472
30 HA ASN 6 HA ASN 6 -9.241 -0.592 -2.668
31 1HB ASN 6 2HB ASN 6 -10.047 -2.902 -3.066
32 2HB ASN 6 1HB ASN 6 -11.657 -2.255 -3.381
33 1HD2 ASN 6 1HD2 ASN 6 -8.385 -2.487 -4.530
34 2HD2 ASN 6 2HD2 ASN 6 -8.703 -1.966 -6.146
35 H LYS 7 H LYS 7 -10.611 1.358 -1.268
36 HA LYS 7 HA LYS 7 -12.366 2.526 -3.301
37 1HB LYS 7 2HB LYS 7 -13.471 3.685 -1.447
38 2HB LYS 7 1HB LYS 7 -13.486 1.951 -1.155
39 1HG LYS 7 2HG LYS 7 -11.499 2.224 0.315
40 2HG LYS 7 1HG LYS 7 -11.640 3.969 0.098
41 1HD LYS 7 2HD LYS 7 -13.835 2.227 1.204
42 2HD LYS 7 1HD LYS 7 -12.682 3.121 2.197
43 1HE LYS 7 2HE LYS 7 -13.439 5.213 1.111
44 2HE LYS 7 1HE LYS 7 -14.653 4.284 0.232
45 1HZ LYS 7 1HZ LYS 7 -15.661 3.660 2.323
46 2HZ LYS 7 2HZ LYS 7 -15.564 5.346 2.215
47 3HZ LYS 7 3HZ LYS 7 -14.472 4.498 3.189
48 H ILE 8 H ILE 8 -12.136 5.045 -1.571
49 HA ILE 8 HA ILE 8 -10.278 6.514 -2.885
50 HB ILE 8 HB ILE 8 -11.984 7.254 -1.223
51 1HG1 ILE 8 2HG1 ILE 8 -10.847 9.275 -0.641
52 2HG1 ILE 8 1HG1 ILE 8 -9.284 8.466 -0.622
53 1HG2 ILE 8 1HG2 ILE 8 -9.878 6.446 0.758
54 2HG2 ILE 8 2HG2 ILE 8 -11.523 5.828 0.621
55 3HG2 ILE 8 3HG2 ILE 8 -11.248 7.489 1.140
56 1HD1 ILE 8 1HD1 ILE 8 -9.222 8.335 -2.969
57 2HD1 ILE 8 2HD1 ILE 8 -9.747 9.971 -2.581
58 3HD1 ILE 8 3HD1 ILE 8 -10.923 8.770 -3.115
59 H ILE 9 H ILE 9 -8.038 6.854 -2.760
60 HA ILE 9 HA ILE 9 -6.663 5.437 -0.629
61 HB ILE 9 HB ILE 9 -4.927 4.668 -2.131
62 1HG1 ILE 9 2HG1 ILE 9 -6.648 5.854 -4.321
63 2HG1 ILE 9 1HG1 ILE 9 -5.067 6.445 -3.816
64 1HG2 ILE 9 1HG2 ILE 9 -7.210 3.476 -1.729
65 2HG2 ILE 9 2HG2 ILE 9 -6.047 2.841 -2.894
66 3HG2 ILE 9 3HG2 ILE 9 -7.433 3.780 -3.452
67 1HD1 ILE 9 1HD1 ILE 9 -5.542 3.691 -4.918
68 2HD1 ILE 9 2HD1 ILE 9 -3.994 4.484 -4.623
69 3HD1 ILE 9 3HD1 ILE 9 -5.062 5.079 -5.896
70 H GLY 10 H GLY 10 -5.236 6.522 0.438
71 1HA GLY 10 2HA GLY 10 -4.059 8.968 -0.680
72 2HA GLY 10 1HA GLY 10 -4.111 8.532 1.036
73 H SER 11 H SER 11 -1.703 9.103 -0.736
74 HA SER 11 HA SER 11 -0.277 6.711 -0.025
75 1HB SER 11 2HB SER 11 -0.475 5.700 -2.006
76 2HB SER 11 1HB SER 11 -1.330 7.086 -2.663
77 HG SER 11 HG SER 11 0.590 7.968 -3.320
78 H ARG 12 H ARG 12 1.283 7.659 1.117
79 HA ARG 12 HA ARG 12 3.302 9.126 -0.335
80 1HB ARG 12 2HB ARG 12 1.716 10.428 1.868
81 2HB ARG 12 1HB ARG 12 3.341 10.955 1.456
82 1HG ARG 12 2HG ARG 12 2.502 11.261 -0.908
83 2HG ARG 12 1HG ARG 12 0.878 11.037 -0.255
84 1HD ARG 12 2HD ARG 12 1.140 12.942 1.189
85 2HD ARG 12 1HD ARG 12 2.832 13.112 0.723
86 HE ARG 12 HE ARG 12 1.318 13.280 -1.600
87 1HH1 ARG 12 1HH1 ARG 12 1.720 15.051 1.372
88 2HH1 ARG 12 2HH1 ARG 12 1.327 16.582 0.665
89 1HH2 ARG 12 1HH2 ARG 12 0.800 15.292 -2.542
90 2HH2 ARG 12 2HH2 ARG 12 0.803 16.719 -1.560
91 H THR 13 H THR 13 4.933 7.669 0.217
92 HA THR 13 HA THR 13 5.274 7.264 3.093
93 HB THR 13 HB THR 13 6.630 5.327 1.382
94 HG1 THR 13 1HG THR 13 4.661 4.136 1.148
95 1HG2 THR 13 1HG2 THR 13 5.657 3.809 3.153
96 2HG2 THR 13 2HG2 THR 13 5.090 5.277 3.951
97 3HG2 THR 13 3HG2 THR 13 6.817 5.017 3.705
98 H ALA 14 H ALA 14 7.583 6.635 0.459
99 HA ALA 14 HA ALA 14 9.301 8.757 1.483
100 1HB ALA 14 1HB ALA 14 9.779 6.841 2.948
101 2HB ALA 14 2HB ALA 14 11.176 7.331 1.988
102 3HB ALA 14 3HB ALA 14 10.249 5.902 1.532
103 H GLY 15 H GLY 15 9.505 5.839 -0.563
104 1HA GLY 15 2HA GLY 15 9.564 6.255 -3.015
105 2HA GLY 15 1HA GLY 15 10.685 7.564 -2.661
106 H GLU 16 H GLU 16 12.187 6.167 -0.668
107 HA GLU 16 HA GLU 16 14.134 4.922 -2.247
108 1HB GLU 16 2HB GLU 16 14.404 5.911 0.083
109 2HB GLU 16 1HB GLU 16 13.698 4.425 0.701
110 1HG GLU 16 2HG GLU 16 15.510 3.128 -0.242
111 2HG GLU 16 1HG GLU 16 16.209 4.585 -0.948
112 H GLY 17 H GLY 17 11.335 3.728 -0.581
113 1HA GLY 17 2HA GLY 17 11.590 1.161 -1.954
114 2HA GLY 17 1HA GLY 17 11.458 1.134 -0.198
115 H ALA 18 H ALA 18 9.646 2.777 0.537
116 HA ALA 18 HA ALA 18 7.203 2.018 -0.899
117 1HB ALA 18 1HB ALA 18 6.057 2.368 1.206
118 2HB ALA 18 2HB ALA 18 7.548 2.970 1.938
119 3HB ALA 18 3HB ALA 18 7.426 1.277 1.445
120 H MET 19 H MET 19 5.545 3.599 -1.254
121 HA MET 19 HA MET 19 5.972 6.313 -0.487
122 1HB MET 19 2HB MET 19 7.349 5.520 -2.770
123 2HB MET 19 1HB MET 19 5.932 6.359 -3.393
124 1HG MET 19 2HG MET 19 7.643 7.531 -1.249
125 2HG MET 19 1HG MET 19 8.036 7.725 -2.954
126 1HE MET 19 1HE MET 19 6.531 11.205 -1.707
127 2HE MET 19 2HE MET 19 7.969 10.411 -2.348
128 3HE MET 19 3HE MET 19 7.422 10.055 -0.710
129 H GLU 20 H GLU 20 3.843 4.242 -0.576
130 HA GLU 20 HA GLU 20 1.730 6.001 -1.455
131 1HB GLU 20 2HB GLU 20 1.905 3.155 -2.375
132 2HB GLU 20 1HB GLU 20 0.542 4.209 -2.670
133 1HG GLU 20 2HG GLU 20 2.607 5.632 -3.733
134 2HG GLU 20 1HG GLU 20 3.119 3.969 -4.052
135 H TYR 21 H TYR 21 -0.506 4.322 -0.877
136 HA TYR 21 HA TYR 21 0.128 3.148 1.582
137 1HB TYR 21 2HB TYR 21 0.191 5.035 2.695
138 2HB TYR 21 1HB TYR 21 -0.786 5.875 1.530
139 HD1 TYR 21 1HD TYR 21 -2.228 7.048 2.818
140 HD2 TYR 21 2HD TYR 21 -1.807 2.867 3.577
141 HE1 TYR 21 1HE TYR 21 -4.097 7.155 4.372
142 HE2 TYR 21 2HE TYR 21 -3.684 2.982 5.161
143 HH TYR 21 HH TYR 21 -5.777 5.649 5.364
144 H LEU 22 H LEU 22 -2.674 4.352 -0.053
145 HA LEU 22 HA LEU 22 -4.163 2.365 1.390
146 1HB LEU 22 2HB LEU 22 -4.939 4.759 -0.100
147 2HB LEU 22 1HB LEU 22 -6.114 3.468 -0.022
148 HG LEU 22 HG LEU 22 -4.951 5.048 2.270
149 1HD1 LEU 22 1HD1 LEU 22 -6.898 6.029 1.177
150 2HD1 LEU 22 2HD1 LEU 22 -7.305 5.463 2.792
151 3HD1 LEU 22 3HD1 LEU 22 -7.782 4.521 1.383
152 1HD2 LEU 22 1HD2 LEU 22 -4.891 2.826 3.090
153 2HD2 LEU 22 2HD2 LEU 22 -6.445 2.438 2.360
154 3HD2 LEU 22 3HD2 LEU 22 -6.366 3.549 3.725
155 H ILE 23 H ILE 23 -5.617 1.017 0.698
156 HA ILE 23 HA ILE 23 -5.289 -1.114 -0.490
157 HB ILE 23 HB ILE 23 -7.566 -1.060 -1.631
158 1HG1 ILE 23 2HG1 ILE 23 -7.291 1.562 -1.708
159 2HG1 ILE 23 1HG1 ILE 23 -8.861 0.835 -1.489
160 1HG2 ILE 23 1HG2 ILE 23 -6.765 -0.885 1.168
161 2HG2 ILE 23 2HG2 ILE 23 -7.784 -2.062 0.343
162 3HG2 ILE 23 3HG2 ILE 23 -8.467 -0.531 0.880
163 1HD1 ILE 23 1HD1 ILE 23 -7.389 1.435 0.985
164 2HD1 ILE 23 2HD1 ILE 23 -9.094 1.645 0.597
165 3HD1 ILE 23 3HD1 ILE 23 -7.914 2.824 0.034
166 H GLU 24 H GLU 24 -7.095 -0.119 -3.177
167 HA GLU 24 HA GLU 24 -6.639 -0.441 -5.383
168 1HB GLU 24 2HB GLU 24 -5.094 1.709 -4.360
169 2HB GLU 24 1HB GLU 24 -4.086 0.847 -5.514
170 1HG GLU 24 2HG GLU 24 -6.829 1.964 -6.046
171 2HG GLU 24 1HG GLU 24 -5.299 2.655 -6.585
172 H TRP 25 H TRP 25 -5.492 -2.432 -3.416
173 HA TRP 25 HA TRP 25 -3.676 -3.668 -5.312
174 1HB TRP 25 2HB TRP 25 -2.155 -4.302 -3.327
175 2HB TRP 25 1HB TRP 25 -1.990 -2.723 -4.069
176 HD1 TRP 25 HD TRP 25 -4.458 -3.759 -1.160
177 HE1 TRP 25 1HE TRP 25 -3.928 -2.185 0.835
178 HE3 TRP 25 3HE TRP 25 -0.545 -1.091 -3.117
179 HZ2 TRP 25 2HZ TRP 25 -2.169 -0.215 1.473
180 HZ3 TRP 25 3HZ TRP 25 0.537 0.620 -1.672
181 HH2 TRP 25 HH TRP 25 -0.282 1.075 0.534
182 H LYS 26 H LYS 26 -6.375 -4.266 -4.362
183 HA LYS 26 HA LYS 26 -7.638 -5.971 -3.461
184 1HB LYS 26 2HB LYS 26 -5.631 -7.318 -5.254
185 2HB LYS 26 1HB LYS 26 -6.994 -8.177 -4.551
186 1HG LYS 26 2HG LYS 26 -8.509 -6.533 -5.641
187 2HG LYS 26 1HG LYS 26 -7.098 -5.846 -6.450
188 1HD LYS 26 2HD LYS 26 -6.650 -7.972 -7.532
189 2HD LYS 26 1HD LYS 26 -7.992 -8.721 -6.666
190 1HE LYS 26 2HE LYS 26 -8.641 -8.177 -8.943
191 2HE LYS 26 1HE LYS 26 -9.554 -7.204 -7.790
192 1HZ LYS 26 1HZ LYS 26 -8.055 -5.358 -8.219
193 2HZ LYS 26 2HZ LYS 26 -8.786 -5.878 -9.654
194 3HZ LYS 26 3HZ LYS 26 -7.179 -6.293 -9.323
195 H ASP 27 H ASP 27 -5.569 -5.231 -1.642
196 HA ASP 27 HA ASP 27 -4.389 -5.957 0.171
197 1HB ASP 27 2HB ASP 27 -5.615 -7.425 1.611
198 2HB ASP 27 1HB ASP 27 -6.770 -6.424 0.742
199 H GLY 28 H GLY 28 -3.079 -6.876 -2.057
200 1HA GLY 28 2HA GLY 28 -2.666 -9.608 -2.311
201 2HA GLY 28 1HA GLY 28 -1.423 -8.403 -2.598
202 H HIS 29 H HIS 29 -0.769 -7.377 -0.252
203 HA HIS 29 HA HIS 29 -0.309 -9.638 1.557
204 1HB HIS 29 2HB HIS 29 1.809 -7.560 0.810
205 2HB HIS 29 1HB HIS 29 1.996 -8.913 1.930
206 HD1 HIS 29 1HD HIS 29 2.138 -11.315 0.891
207 HD2 HIS 29 2HD HIS 29 2.119 -8.208 -1.868
208 HE1 HIS 29 1HE HIS 29 2.895 -12.337 -1.279
209 HE2 HIS 29 2HE HIS 29 2.804 -10.454 -2.951
210 H SER 30 H SER 30 -1.835 -8.905 3.011
211 HA SER 30 HA SER 30 -2.818 -7.552 4.600
212 1HB SER 30 2HB SER 30 0.074 -6.871 5.146
213 2HB SER 30 1HB SER 30 -1.262 -6.877 6.310
214 HG SER 30 HG SER 30 -0.013 -8.782 6.467
215 HA PRO 31 HA PRO 31 -3.219 -3.437 2.435
216 1HB PRO 31 2HB PRO 31 -4.545 -2.726 4.940
217 2HB PRO 31 1HB PRO 31 -5.220 -2.791 3.312
218 1HG PRO 31 2HG PRO 31 -5.333 -4.792 5.446
219 2HG PRO 31 1HG PRO 31 -6.299 -4.678 3.968
220 1HD PRO 31 2HD PRO 31 -4.474 -6.630 4.333
221 2HD PRO 31 1HD PRO 31 -4.784 -5.926 2.728
222 H SER 32 H SER 32 -1.751 -1.756 2.638
223 HA SER 32 HA SER 32 -0.493 -1.309 5.206
224 1HB SER 32 2HB SER 32 1.073 -2.374 2.911
225 2HB SER 32 1HB SER 32 1.757 -1.762 4.422
226 HG SER 32 HG SER 32 1.351 -4.136 4.184
227 H TRP 33 H TRP 33 0.860 0.593 5.357
228 HA TRP 33 HA TRP 33 0.248 2.483 3.212
229 1HB TRP 33 2HB TRP 33 0.207 3.231 5.613
230 2HB TRP 33 1HB TRP 33 1.903 2.792 5.764
231 HD1 TRP 33 HD TRP 33 3.479 4.210 3.741
232 HE1 TRP 33 1HE TRP 33 3.395 6.745 3.330
233 HE3 TRP 33 3HE TRP 33 -1.064 5.256 5.868
234 HZ2 TRP 33 2HZ TRP 33 1.631 8.909 3.818
235 HZ3 TRP 33 3HZ TRP 33 -1.870 7.582 5.841
236 HH2 TRP 33 HH TRP 33 -0.549 9.366 4.822
237 H VAL 34 H VAL 34 1.324 1.653 1.506
238 HA VAL 34 HA VAL 34 4.201 1.832 1.496
239 HB VAL 34 HB VAL 34 3.382 -0.848 0.533
240 1HG1 VAL 34 1HG1 VAL 34 5.661 0.490 1.672
241 2HG1 VAL 34 2HG1 VAL 34 5.614 -1.102 0.940
242 3HG1 VAL 34 3HG1 VAL 34 5.304 -0.917 2.658
243 1HG2 VAL 34 1HG2 VAL 34 3.212 -0.309 3.472
244 2HG2 VAL 34 2HG2 VAL 34 3.140 -1.879 2.682
245 3HG2 VAL 34 3HG2 VAL 34 1.870 -0.694 2.399
246 HA PRO 35 HA PRO 35 3.665 2.608 -2.827
247 1HB PRO 35 2HB PRO 35 5.597 1.407 -4.130
248 2HB PRO 35 1HB PRO 35 5.982 2.489 -2.784
249 1HG PRO 35 2HG PRO 35 5.826 -0.499 -2.825
250 2HG PRO 35 1HG PRO 35 7.076 0.533 -2.116
251 1HD PRO 35 2HD PRO 35 4.973 -0.579 -0.734
252 2HD PRO 35 1HD PRO 35 5.861 0.856 -0.215
253 H SER 36 H SER 36 1.688 1.848 -3.600
254 HA SER 36 HA SER 36 0.209 0.563 -4.774
255 1HB SER 36 2HB SER 36 1.482 1.538 -6.594
256 2HB SER 36 1HB SER 36 2.713 0.285 -6.450
257 HG SER 36 HG SER 36 0.345 0.232 -7.769
258 H SER 37 H SER 37 1.672 -0.819 -2.668
259 HA SER 37 HA SER 37 0.871 -3.443 -3.281
260 1HB SER 37 2HB SER 37 3.847 -3.233 -2.857
261 2HB SER 37 1HB SER 37 2.914 -4.591 -3.477
262 HG SER 37 HG SER 37 3.273 -3.832 -5.385
263 H TYR 38 H TYR 38 3.303 -4.112 -1.298
264 HA TYR 38 HA TYR 38 2.637 -2.922 1.180
265 1HB TYR 38 2HB TYR 38 1.892 -5.597 1.687
266 2HB TYR 38 1HB TYR 38 0.865 -4.180 1.796
267 HD1 TYR 38 1HD TYR 38 -1.136 -4.341 0.652
268 HD2 TYR 38 2HD TYR 38 2.299 -6.252 -0.953
269 HE1 TYR 38 1HE TYR 38 -2.448 -5.034 -1.318
270 HE2 TYR 38 2HE TYR 38 0.997 -6.971 -2.919
271 HH TYR 38 HH TYR 38 -1.031 -7.033 -3.879
272 H ILE 39 H ILE 39 4.737 -2.799 1.534
273 HA ILE 39 HA ILE 39 6.375 -5.193 1.180
274 HB ILE 39 HB ILE 39 8.026 -4.002 0.163
275 1HG1 ILE 39 2HG1 ILE 39 7.182 -1.751 1.941
276 2HG1 ILE 39 1HG1 ILE 39 8.786 -2.392 1.642
277 1HG2 ILE 39 1HG2 ILE 39 6.080 -3.862 -1.240
278 2HG2 ILE 39 2HG2 ILE 39 7.005 -2.368 -1.404
279 3HG2 ILE 39 3HG2 ILE 39 5.539 -2.403 -0.422
280 1HD1 ILE 39 1HD1 ILE 39 8.912 -0.315 0.685
281 2HD1 ILE 39 2HD1 ILE 39 7.254 -0.362 0.110
282 3HD1 ILE 39 3HD1 ILE 39 8.486 -1.315 -0.704
283 H ALA 40 H ALA 40 5.001 -4.679 3.529
284 HA ALA 40 HA ALA 40 6.659 -3.345 5.421
285 1HB ALA 40 1HB ALA 40 4.194 -3.749 5.555
286 2HB ALA 40 2HB ALA 40 5.106 -4.090 7.029
287 3HB ALA 40 3HB ALA 40 4.569 -5.415 5.993
288 H ALA 41 H ALA 41 8.712 -4.175 5.214
289 HA ALA 41 HA ALA 41 9.801 -5.898 6.907
290 1HB ALA 41 1HB ALA 41 10.106 -8.062 5.612
291 2HB ALA 41 2HB ALA 41 8.771 -7.527 4.591
292 3HB ALA 41 3HB ALA 41 8.513 -7.793 6.315
293 H ASP 42 H ASP 42 10.557 -3.683 5.390
294 HA ASP 42 HA ASP 42 12.266 -2.799 4.171
295 1HB ASP 42 2HB ASP 42 13.593 -3.926 5.915
296 2HB ASP 42 1HB ASP 42 13.632 -5.389 4.934
297 H VAL 43 H VAL 43 11.208 -2.835 2.156
298 HA VAL 43 HA VAL 43 12.546 -4.311 0.130
299 HB VAL 43 HB VAL 43 11.339 -6.229 0.579
300 1HG1 VAL 43 1HG1 VAL 43 9.264 -4.390 1.584
301 2HG1 VAL 43 2HG1 VAL 43 9.900 -5.881 2.277
302 3HG1 VAL 43 3HG1 VAL 43 8.721 -5.949 0.967
303 1HG2 VAL 43 1HG2 VAL 43 10.966 -5.707 -1.750
304 2HG2 VAL 43 2HG2 VAL 43 9.540 -4.755 -1.337
305 3HG2 VAL 43 3HG2 VAL 43 9.541 -6.498 -1.077
306 H VAL 44 H VAL 44 11.366 -3.845 -2.112
307 HA VAL 44 HA VAL 44 10.027 -1.230 -1.881
308 HB VAL 44 HB VAL 44 12.316 -0.829 -2.502
309 1HG1 VAL 44 1HG1 VAL 44 13.279 -1.740 -4.561
310 2HG1 VAL 44 2HG1 VAL 44 11.816 -2.690 -4.824
311 3HG1 VAL 44 3HG1 VAL 44 12.844 -3.020 -3.428
312 1HG2 VAL 44 1HG2 VAL 44 10.609 0.597 -3.529
313 2HG2 VAL 44 2HG2 VAL 44 10.507 -0.506 -4.898
314 3HG2 VAL 44 3HG2 VAL 44 11.996 0.387 -4.594
315 H SER 45 H SER 45 8.283 -0.891 -3.008
316 HA SER 45 HA SER 45 6.571 -1.059 -4.463
317 1HB SER 45 2HB SER 45 8.418 -0.738 -6.091
318 2HB SER 45 1HB SER 45 8.527 -2.490 -6.257
319 HG SER 45 HG SER 45 6.127 -1.059 -6.702
320 H GLU 46 H GLU 46 7.519 -3.650 -2.824
321 HA GLU 46 HA GLU 46 5.163 -5.068 -3.208
322 1HB GLU 46 2HB GLU 46 6.827 -5.469 -5.377
323 2HB GLU 46 1HB GLU 46 7.110 -6.893 -4.385
324 1HG GLU 46 2HG GLU 46 4.706 -7.346 -4.354
325 2HG GLU 46 1HG GLU 46 4.430 -5.925 -5.359
326 H TYR 47 H TYR 47 5.654 -7.607 -2.688
327 HA TYR 47 HA TYR 47 7.680 -7.911 -0.643
328 1HB TYR 47 2HB TYR 47 5.973 -6.949 0.717
329 2HB TYR 47 1HB TYR 47 4.724 -7.957 0.007
330 HD1 TYR 47 1HD TYR 47 7.983 -8.356 1.806
331 HD2 TYR 47 2HD TYR 47 3.993 -9.735 1.288
332 HE1 TYR 47 1HE TYR 47 8.322 -9.990 3.611
333 HE2 TYR 47 2HE TYR 47 4.320 -11.375 3.091
334 HH TYR 47 HH TYR 47 6.185 -12.552 4.196
Start of MODEL 2
1 1H GLY 1 1HT GLY 1 -13.293 -1.016 9.724
2 2H GLY 1 2HT GLY 1 -13.973 -2.512 9.323
3 3H GLY 1 3HT GLY 1 -13.757 -1.333 8.128
4 1HA GLY 1 1HA GLY 1 -11.577 -2.698 9.612
5 2HA GLY 1 2HA GLY 1 -12.078 -3.081 7.972
6 H SER 2 H SER 2 -12.350 -0.747 6.729
7 HA SER 2 HA SER 2 -11.224 0.932 5.689
8 1HB SER 2 2HB SER 2 -11.259 2.029 7.874
9 2HB SER 2 1HB SER 2 -9.806 1.154 8.356
10 HG SER 2 HG SER 2 -8.618 2.467 7.195
11 H GLY 3 H GLY 3 -10.358 -1.605 5.107
12 1HA GLY 3 2HA GLY 3 -7.726 -1.086 4.128
13 2HA GLY 3 1HA GLY 3 -7.698 -2.251 5.442
14 H GLU 4 H GLU 4 -7.028 -2.529 2.560
15 HA GLU 4 HA GLU 4 -7.313 -4.021 0.872
16 1HB GLU 4 2HB GLU 4 -7.108 -6.030 1.791
17 2HB GLU 4 1HB GLU 4 -7.630 -5.366 3.321
18 1HG GLU 4 2HG GLU 4 -9.987 -5.878 2.649
19 2HG GLU 4 1HG GLU 4 -9.336 -6.718 1.243
20 H VAL 5 H VAL 5 -9.680 -2.136 1.712
21 HA VAL 5 HA VAL 5 -11.958 -3.432 0.509
22 HB VAL 5 HB VAL 5 -11.635 -0.583 1.405
23 1HG1 VAL 5 1HG1 VAL 5 -14.142 -0.809 1.741
24 2HG1 VAL 5 2HG1 VAL 5 -14.034 -2.314 0.829
25 3HG1 VAL 5 3HG1 VAL 5 -13.579 -0.789 0.071
26 1HG2 VAL 5 1HG2 VAL 5 -12.530 -2.990 2.996
27 2HG2 VAL 5 2HG2 VAL 5 -12.694 -1.317 3.532
28 3HG2 VAL 5 3HG2 VAL 5 -11.091 -2.009 3.273
29 H ASN 6 H ASN 6 -9.296 -1.882 -0.718
30 HA ASN 6 HA ASN 6 -8.850 -0.450 -2.460
31 1HB ASN 6 2HB ASN 6 -9.048 -2.672 -3.399
32 2HB ASN 6 1HB ASN 6 -10.777 -2.446 -3.649
33 1HD2 ASN 6 1HD2 ASN 6 -8.049 -2.636 -5.277
34 2HD2 ASN 6 2HD2 ASN 6 -8.346 -1.530 -6.570
35 H LYS 7 H LYS 7 -10.040 1.346 -1.356
36 HA LYS 7 HA LYS 7 -12.036 2.438 -3.137
37 1HB LYS 7 2HB LYS 7 -13.579 2.892 -1.251
38 2HB LYS 7 1HB LYS 7 -13.331 1.170 -1.492
39 1HG LYS 7 2HG LYS 7 -12.502 0.898 0.540
40 2HG LYS 7 1HG LYS 7 -11.390 2.264 0.365
41 1HD LYS 7 2HD LYS 7 -12.803 2.855 2.155
42 2HD LYS 7 1HD LYS 7 -13.460 3.731 0.773
43 1HE LYS 7 2HE LYS 7 -14.495 1.122 1.872
44 2HE LYS 7 1HE LYS 7 -15.234 2.706 2.102
45 1HZ LYS 7 1HZ LYS 7 -14.978 1.176 -0.422
46 2HZ LYS 7 2HZ LYS 7 -15.408 2.810 -0.385
47 3HZ LYS 7 3HZ LYS 7 -16.398 1.660 0.360
48 H ILE 8 H ILE 8 -12.593 4.403 -0.824
49 HA ILE 8 HA ILE 8 -10.834 6.408 -1.512
50 HB ILE 8 HB ILE 8 -13.085 6.477 -0.354
51 1HG1 ILE 8 2HG1 ILE 8 -11.788 8.485 -0.874
52 2HG1 ILE 8 1HG1 ILE 8 -12.610 8.670 0.671
53 1HG2 ILE 8 1HG2 ILE 8 -12.300 5.048 1.579
54 2HG2 ILE 8 2HG2 ILE 8 -13.257 6.474 1.983
55 3HG2 ILE 8 3HG2 ILE 8 -11.506 6.499 2.192
56 1HD1 ILE 8 1HD1 ILE 8 -10.495 8.075 1.808
57 2HD1 ILE 8 2HD1 ILE 8 -10.394 9.549 0.848
58 3HD1 ILE 8 3HD1 ILE 8 -9.700 8.051 0.235
59 H ILE 9 H ILE 9 -8.694 6.257 -1.310
60 HA ILE 9 HA ILE 9 -7.567 6.022 1.325
61 HB ILE 9 HB ILE 9 -7.848 3.687 0.488
62 1HG1 ILE 9 2HG1 ILE 9 -5.813 2.906 1.400
63 2HG1 ILE 9 1HG1 ILE 9 -4.945 4.354 0.924
64 1HG2 ILE 9 1HG2 ILE 9 -6.061 2.962 -1.149
65 2HG2 ILE 9 2HG2 ILE 9 -5.960 4.665 -1.580
66 3HG2 ILE 9 3HG2 ILE 9 -7.481 3.793 -1.766
67 1HD1 ILE 9 1HD1 ILE 9 -5.650 3.975 3.390
68 2HD1 ILE 9 2HD1 ILE 9 -7.221 4.549 2.834
69 3HD1 ILE 9 3HD1 ILE 9 -5.799 5.579 2.675
70 H GLY 10 H GLY 10 -4.961 6.159 1.042
71 1HA GLY 10 2HA GLY 10 -4.451 8.190 -1.010
72 2HA GLY 10 1HA GLY 10 -4.066 8.522 0.674
73 H SER 11 H SER 11 -2.007 8.723 -1.061
74 HA SER 11 HA SER 11 -0.390 6.457 -0.294
75 1HB SER 11 2HB SER 11 0.417 6.209 -2.713
76 2HB SER 11 1HB SER 11 -1.201 5.602 -2.366
77 HG SER 11 HG SER 11 -2.007 7.597 -3.185
78 H ARG 12 H ARG 12 1.126 7.621 0.803
79 HA ARG 12 HA ARG 12 3.015 9.094 -0.809
80 1HB ARG 12 2HB ARG 12 1.388 10.855 -0.322
81 2HB ARG 12 1HB ARG 12 1.546 10.537 1.401
82 1HG ARG 12 2HG ARG 12 3.701 11.423 1.488
83 2HG ARG 12 1HG ARG 12 3.915 11.314 -0.259
84 1HD ARG 12 2HD ARG 12 2.006 13.159 1.173
85 2HD ARG 12 1HD ARG 12 3.555 13.626 0.471
86 HE ARG 12 HE ARG 12 1.977 12.398 -1.504
87 1HH1 ARG 12 1HH1 ARG 12 2.124 15.321 0.380
88 2HH1 ARG 12 2HH1 ARG 12 1.332 16.288 -0.819
89 1HH2 ARG 12 1HH2 ARG 12 0.935 13.660 -3.090
90 2HH2 ARG 12 2HH2 ARG 12 0.658 15.344 -2.793
91 H THR 13 H THR 13 4.737 7.735 -0.108
92 HA THR 13 HA THR 13 5.180 7.822 2.782
93 HB THR 13 HB THR 13 6.580 5.726 1.283
94 HG1 THR 13 1HG THR 13 4.757 4.443 1.181
95 1HG2 THR 13 1HG2 THR 13 5.225 5.932 3.954
96 2HG2 THR 13 2HG2 THR 13 6.958 5.874 3.633
97 3HG2 THR 13 3HG2 THR 13 5.957 4.452 3.337
98 H ALA 14 H ALA 14 7.603 6.916 0.327
99 HA ALA 14 HA ALA 14 9.117 9.315 1.030
100 1HB ALA 14 1HB ALA 14 10.243 6.559 1.486
101 2HB ALA 14 2HB ALA 14 9.742 7.691 2.742
102 3HB ALA 14 3HB ALA 14 11.103 8.084 1.693
103 H GLY 15 H GLY 15 9.360 6.208 -0.710
104 1HA GLY 15 2HA GLY 15 9.436 6.341 -3.170
105 2HA GLY 15 1HA GLY 15 10.497 7.729 -2.978
106 H GLU 16 H GLU 16 12.066 6.602 -0.858
107 HA GLU 16 HA GLU 16 14.065 5.319 -2.334
108 1HB GLU 16 2HB GLU 16 15.211 5.049 -0.258
109 2HB GLU 16 1HB GLU 16 14.322 6.564 -0.157
110 1HG GLU 16 2HG GLU 16 12.574 5.452 1.137
111 2HG GLU 16 1HG GLU 16 13.480 3.941 1.056
112 H GLY 17 H GLY 17 11.558 4.065 -0.210
113 1HA GLY 17 2HA GLY 17 11.946 1.401 -1.407
114 2HA GLY 17 1HA GLY 17 11.818 1.571 0.339
115 H ALA 18 H ALA 18 9.840 3.559 0.431
116 HA ALA 18 HA ALA 18 7.515 2.305 -0.833
117 1HB ALA 18 1HB ALA 18 7.723 3.200 2.035
118 2HB ALA 18 2HB ALA 18 7.597 1.528 1.472
119 3HB ALA 18 3HB ALA 18 6.245 2.642 1.247
120 H MET 19 H MET 19 5.752 3.764 -1.247
121 HA MET 19 HA MET 19 6.061 6.536 -0.608
122 1HB MET 19 2HB MET 19 7.565 5.777 -2.728
123 2HB MET 19 1HB MET 19 6.068 6.218 -3.540
124 1HG MET 19 2HG MET 19 6.146 8.413 -2.487
125 2HG MET 19 1HG MET 19 7.639 7.961 -1.678
126 1HE MET 19 1HE MET 19 8.772 10.599 -4.376
127 2HE MET 19 2HE MET 19 8.754 10.200 -2.659
128 3HE MET 19 3HE MET 19 7.248 10.589 -3.490
129 H GLU 20 H GLU 20 4.017 4.352 -0.615
130 HA GLU 20 HA GLU 20 1.853 6.023 -1.520
131 1HB GLU 20 2HB GLU 20 2.045 3.191 -2.531
132 2HB GLU 20 1HB GLU 20 0.766 4.330 -2.874
133 1HG GLU 20 2HG GLU 20 2.668 5.751 -3.910
134 2HG GLU 20 1HG GLU 20 3.565 4.228 -3.914
135 H TYR 21 H TYR 21 -0.312 4.640 -0.978
136 HA TYR 21 HA TYR 21 0.019 2.940 1.286
137 1HB TYR 21 2HB TYR 21 0.311 4.785 2.577
138 2HB TYR 21 1HB TYR 21 -0.639 5.804 1.529
139 HD1 TYR 21 1HD TYR 21 -2.336 6.767 2.587
140 HD2 TYR 21 2HD TYR 21 -1.424 2.720 3.599
141 HE1 TYR 21 1HE TYR 21 -4.175 6.767 4.173
142 HE2 TYR 21 2HE TYR 21 -3.276 2.727 5.221
143 HH TYR 21 HH TYR 21 -4.591 4.354 6.530
144 H LEU 22 H LEU 22 -1.654 3.480 -1.362
145 HA LEU 22 HA LEU 22 -4.195 3.129 -0.249
146 1HB LEU 22 2HB LEU 22 -4.934 3.028 -2.679
147 2HB LEU 22 1HB LEU 22 -4.156 4.509 -2.158
148 HG LEU 22 HG LEU 22 -2.041 3.690 -3.210
149 1HD1 LEU 22 1HD1 LEU 22 -3.815 1.389 -3.850
150 2HD1 LEU 22 2HD1 LEU 22 -2.108 1.412 -3.402
151 3HD1 LEU 22 3HD1 LEU 22 -2.598 1.881 -5.028
152 1HD2 LEU 22 1HD2 LEU 22 -2.849 4.026 -5.549
153 2HD2 LEU 22 2HD2 LEU 22 -3.369 5.264 -4.405
154 3HD2 LEU 22 3HD2 LEU 22 -4.497 4.009 -4.919
155 H ILE 23 H ILE 23 -5.387 1.759 0.064
156 HA ILE 23 HA ILE 23 -4.783 -0.976 0.033
157 HB ILE 23 HB ILE 23 -6.868 0.909 0.953
158 1HG1 ILE 23 2HG1 ILE 23 -6.441 -0.126 3.077
159 2HG1 ILE 23 1HG1 ILE 23 -5.516 -1.398 2.298
160 1HG2 ILE 23 1HG2 ILE 23 -7.487 -1.970 0.533
161 2HG2 ILE 23 2HG2 ILE 23 -8.443 -0.531 0.154
162 3HG2 ILE 23 3HG2 ILE 23 -8.219 -1.022 1.828
163 1HD1 ILE 23 1HD1 ILE 23 -4.060 0.233 3.343
164 2HD1 ILE 23 2HD1 ILE 23 -4.787 1.516 2.377
165 3HD1 ILE 23 3HD1 ILE 23 -3.855 0.241 1.592
166 H GLU 24 H GLU 24 -5.462 0.817 -2.552
167 HA GLU 24 HA GLU 24 -7.512 -0.663 -3.821
168 1HB GLU 24 2HB GLU 24 -6.178 1.769 -4.203
169 2HB GLU 24 1HB GLU 24 -5.727 0.784 -5.593
170 1HG GLU 24 2HG GLU 24 -7.656 2.045 -6.174
171 2HG GLU 24 1HG GLU 24 -8.146 0.362 -5.996
172 H TRP 25 H TRP 25 -4.666 -1.812 -2.866
173 HA TRP 25 HA TRP 25 -3.781 -3.006 -5.338
174 1HB TRP 25 2HB TRP 25 -2.290 -4.303 -3.511
175 2HB TRP 25 1HB TRP 25 -1.867 -2.724 -4.151
176 HD1 TRP 25 HD TRP 25 -3.991 -3.964 -1.085
177 HE1 TRP 25 1HE TRP 25 -3.316 -2.477 0.951
178 HE3 TRP 25 3HE TRP 25 -0.538 -0.867 -3.303
179 HZ2 TRP 25 2HZ TRP 25 -1.722 -0.369 1.464
180 HZ3 TRP 25 3HZ TRP 25 0.550 0.849 -1.874
181 HH2 TRP 25 HH TRP 25 -0.033 1.096 0.432
182 H LYS 26 H LYS 26 -6.465 -3.660 -4.427
183 HA LYS 26 HA LYS 26 -7.858 -5.426 -4.148
184 1HB LYS 26 2HB LYS 26 -6.711 -5.900 -6.351
185 2HB LYS 26 1HB LYS 26 -5.645 -6.993 -5.478
186 1HG LYS 26 2HG LYS 26 -7.730 -8.220 -4.733
187 2HG LYS 26 1HG LYS 26 -8.608 -7.242 -5.907
188 1HD LYS 26 2HD LYS 26 -7.371 -8.150 -7.718
189 2HD LYS 26 1HD LYS 26 -6.207 -8.909 -6.629
190 1HE LYS 26 2HE LYS 26 -7.977 -10.373 -5.773
191 2HE LYS 26 1HE LYS 26 -9.127 -9.623 -6.879
192 1HZ LYS 26 1HZ LYS 26 -8.257 -11.735 -7.719
193 2HZ LYS 26 2HZ LYS 26 -6.688 -11.101 -7.709
194 3HZ LYS 26 3HZ LYS 26 -7.857 -10.444 -8.740
195 H ASP 27 H ASP 27 -6.125 -4.905 -1.890
196 HA ASP 27 HA ASP 27 -5.493 -5.898 0.067
197 1HB ASP 27 2HB ASP 27 -7.777 -6.746 0.078
198 2HB ASP 27 1HB ASP 27 -7.318 -8.075 -0.979
199 H GLY 28 H GLY 28 -4.045 -6.404 -2.540
200 1HA GLY 28 2HA GLY 28 -3.012 -8.898 -2.891
201 2HA GLY 28 1HA GLY 28 -2.037 -7.440 -3.034
202 H HIS 29 H HIS 29 -1.431 -6.503 -0.773
203 HA HIS 29 HA HIS 29 -0.851 -8.663 1.079
204 1HB HIS 29 2HB HIS 29 1.095 -7.341 -0.558
205 2HB HIS 29 1HB HIS 29 1.376 -6.907 1.124
206 HD1 HIS 29 1HD HIS 29 2.899 -8.455 2.281
207 HD2 HIS 29 2HD HIS 29 0.782 -10.362 -0.745
208 HE1 HIS 29 1HE HIS 29 3.741 -10.823 2.262
209 HE2 HIS 29 2HE HIS 29 2.404 -11.975 0.464
210 H SER 30 H SER 30 -2.244 -7.977 2.569
211 HA SER 30 HA SER 30 -3.269 -6.640 4.135
212 1HB SER 30 2HB SER 30 -0.343 -6.177 4.649
213 2HB SER 30 1HB SER 30 -1.643 -5.991 5.840
214 HG SER 30 HG SER 30 -0.415 -8.265 4.931
215 HA PRO 31 HA PRO 31 -3.897 -2.184 2.727
216 1HB PRO 31 2HB PRO 31 -4.651 -2.037 5.578
217 2HB PRO 31 1HB PRO 31 -5.662 -1.763 4.168
218 1HG PRO 31 2HG PRO 31 -5.401 -4.165 5.801
219 2HG PRO 31 1HG PRO 31 -6.630 -3.773 4.597
220 1HD PRO 31 2HD PRO 31 -4.842 -5.727 4.187
221 2HD PRO 31 1HD PRO 31 -5.388 -4.696 2.845
222 H SER 32 H SER 32 -2.153 -0.893 2.760
223 HA SER 32 HA SER 32 -0.562 -0.637 5.114
224 1HB SER 32 2HB SER 32 0.142 -2.739 4.093
225 2HB SER 32 1HB SER 32 0.788 -1.785 2.759
226 HG SER 32 HG SER 32 2.315 -2.288 4.474
227 H TRP 33 H TRP 33 0.971 1.009 5.155
228 HA TRP 33 HA TRP 33 0.510 2.922 3.005
229 1HB TRP 33 2HB TRP 33 0.509 3.551 5.470
230 2HB TRP 33 1HB TRP 33 2.230 3.184 5.511
231 HD1 TRP 33 HD TRP 33 3.713 4.745 3.642
232 HE1 TRP 33 1HE TRP 33 3.440 7.252 3.171
233 HE3 TRP 33 3HE TRP 33 -0.978 5.437 5.531
234 HZ2 TRP 33 2HZ TRP 33 1.491 9.268 3.524
235 HZ3 TRP 33 3HZ TRP 33 -1.982 7.680 5.415
236 HH2 TRP 33 HH TRP 33 -0.773 9.555 4.417
237 H VAL 34 H VAL 34 1.530 1.933 1.340
238 HA VAL 34 HA VAL 34 4.412 1.882 1.334
239 HB VAL 34 HB VAL 34 3.345 -0.697 0.424
240 1HG1 VAL 34 1HG1 VAL 34 5.236 -0.826 2.605
241 2HG1 VAL 34 2HG1 VAL 34 5.746 0.388 1.438
242 3HG1 VAL 34 3HG1 VAL 34 5.475 -1.269 0.922
243 1HG2 VAL 34 1HG2 VAL 34 2.852 -1.706 2.495
244 2HG2 VAL 34 2HG2 VAL 34 1.831 -0.277 2.320
245 3HG2 VAL 34 3HG2 VAL 34 3.244 -0.227 3.373
246 HA PRO 35 HA PRO 35 3.728 2.513 -3.020
247 1HB PRO 35 2HB PRO 35 5.896 1.681 -4.189
248 2HB PRO 35 1HB PRO 35 6.050 2.794 -2.823
249 1HG PRO 35 2HG PRO 35 6.317 -0.192 -2.859
250 2HG PRO 35 1HG PRO 35 7.413 0.997 -2.141
251 1HD PRO 35 2HD PRO 35 5.440 -0.348 -0.771
252 2HD PRO 35 1HD PRO 35 6.111 1.192 -0.253
253 H SER 36 H SER 36 2.242 1.629 -4.247
254 HA SER 36 HA SER 36 1.512 0.478 -6.092
255 1HB SER 36 2HB SER 36 3.804 -1.441 -5.658
256 2HB SER 36 1HB SER 36 2.793 -1.308 -7.094
257 HG SER 36 HG SER 36 5.005 -0.118 -6.809
258 H SER 37 H SER 37 2.657 -1.741 -3.546
259 HA SER 37 HA SER 37 -0.065 -2.785 -3.400
260 1HB SER 37 2HB SER 37 2.363 -4.542 -3.818
261 2HB SER 37 1HB SER 37 0.740 -5.124 -3.450
262 HG SER 37 HG SER 37 1.322 -3.495 -5.692
263 H TYR 38 H TYR 38 3.149 -3.615 -2.128
264 HA TYR 38 HA TYR 38 2.718 -2.647 0.483
265 1HB TYR 38 2HB TYR 38 0.954 -4.305 0.571
266 2HB TYR 38 1HB TYR 38 2.092 -5.559 0.061
267 HD1 TYR 38 1HD TYR 38 0.591 -3.904 2.835
268 HD2 TYR 38 2HD TYR 38 4.054 -5.905 1.519
269 HE1 TYR 38 1HE TYR 38 1.222 -4.319 5.176
270 HE2 TYR 38 2HE TYR 38 4.745 -6.354 3.799
271 HH TYR 38 HH TYR 38 4.330 -5.411 6.070
272 H ILE 39 H ILE 39 4.640 -2.866 1.628
273 HA ILE 39 HA ILE 39 6.483 -4.940 1.063
274 HB ILE 39 HB ILE 39 7.832 -4.131 -0.483
275 1HG1 ILE 39 2HG1 ILE 39 9.118 -2.755 1.074
276 2HG1 ILE 39 1HG1 ILE 39 8.981 -1.983 -0.488
277 1HG2 ILE 39 1HG2 ILE 39 7.077 -1.968 -1.707
278 2HG2 ILE 39 2HG2 ILE 39 5.651 -2.145 -0.689
279 3HG2 ILE 39 3HG2 ILE 39 6.112 -3.439 -1.765
280 1HD1 ILE 39 1HD1 ILE 39 7.246 -0.510 0.379
281 2HD1 ILE 39 2HD1 ILE 39 8.761 -0.359 1.262
282 3HD1 ILE 39 3HD1 ILE 39 7.418 -1.247 1.968
283 H ALA 40 H ALA 40 5.062 -3.887 3.236
284 HA ALA 40 HA ALA 40 6.738 -2.253 4.861
285 1HB ALA 40 1HB ALA 40 5.214 -2.714 6.627
286 2HB ALA 40 2HB ALA 40 4.631 -4.169 5.823
287 3HB ALA 40 3HB ALA 40 4.270 -2.585 5.141
288 H ALA 41 H ALA 41 8.785 -3.114 4.817
289 HA ALA 41 HA ALA 41 9.811 -4.543 6.827
290 1HB ALA 41 1HB ALA 41 10.173 -6.868 5.857
291 2HB ALA 41 2HB ALA 41 8.873 -6.488 4.727
292 3HB ALA 41 3HB ALA 41 8.556 -6.514 6.462
293 H ASP 42 H ASP 42 10.595 -2.559 5.020
294 HA ASP 42 HA ASP 42 12.369 -1.821 3.811
295 1HB ASP 42 2HB ASP 42 13.632 -4.299 4.997
296 2HB ASP 42 1HB ASP 42 14.524 -3.049 4.137
297 H VAL 43 H VAL 43 11.259 -2.141 1.817
298 HA VAL 43 HA VAL 43 12.666 -3.919 0.027
299 HB VAL 43 HB VAL 43 9.725 -4.248 -0.218
300 1HG1 VAL 43 1HG1 VAL 43 12.178 -5.574 -1.058
301 2HG1 VAL 43 2HG1 VAL 43 10.580 -5.566 -1.807
302 3HG1 VAL 43 3HG1 VAL 43 10.935 -6.692 -0.499
303 1HG2 VAL 43 1HG2 VAL 43 10.042 -4.601 2.191
304 2HG2 VAL 43 2HG2 VAL 43 11.295 -5.793 1.845
305 3HG2 VAL 43 3HG2 VAL 43 9.628 -6.101 1.361
306 H VAL 44 H VAL 44 10.466 -3.659 -2.031
307 HA VAL 44 HA VAL 44 9.875 -0.895 -2.273
308 HB VAL 44 HB VAL 44 12.243 -0.690 -2.699
309 1HG1 VAL 44 1HG1 VAL 44 11.818 -2.598 -4.997
310 2HG1 VAL 44 2HG1 VAL 44 12.649 -2.981 -3.490
311 3HG1 VAL 44 3HG1 VAL 44 13.322 -1.774 -4.586
312 1HG2 VAL 44 1HG2 VAL 44 12.147 0.407 -4.895
313 2HG2 VAL 44 2HG2 VAL 44 10.745 0.800 -3.900
314 3HG2 VAL 44 3HG2 VAL 44 10.597 -0.375 -5.208
315 H SER 45 H SER 45 8.084 -0.804 -3.315
316 HA SER 45 HA SER 45 6.449 -1.044 -4.837
317 1HB SER 45 2HB SER 45 8.229 -0.628 -6.474
318 2HB SER 45 1HB SER 45 8.569 -2.357 -6.541
319 HG SER 45 HG SER 45 6.812 -1.020 -7.964
320 H GLU 46 H GLU 46 7.521 -3.533 -3.140
321 HA GLU 46 HA GLU 46 5.227 -5.077 -3.506
322 1HB GLU 46 2HB GLU 46 6.966 -5.473 -5.614
323 2HB GLU 46 1HB GLU 46 7.293 -6.845 -4.564
324 1HG GLU 46 2HG GLU 46 5.034 -7.562 -4.655
325 2HG GLU 46 1HG GLU 46 4.526 -6.068 -5.443
326 H TYR 47 H TYR 47 5.020 -6.773 -2.076
327 HA TYR 47 HA TYR 47 6.533 -6.714 0.248
328 1HB TYR 47 2HB TYR 47 5.326 -8.882 0.783
329 2HB TYR 47 1HB TYR 47 4.285 -7.519 0.370
330 HD1 TYR 47 1HD TYR 47 5.515 -10.806 -0.692
331 HD2 TYR 47 2HD TYR 47 3.049 -7.496 -1.725
332 HE1 TYR 47 1HE TYR 47 4.430 -12.164 -2.430
333 HE2 TYR 47 2HE TYR 47 1.958 -8.846 -3.467
334 HH TYR 47 HH TYR 47 2.433 -10.823 -4.831
Start of MODEL 3
1 1H GLY 1 1HT GLY 1 -8.118 -6.550 9.427
2 2H GLY 1 2HT GLY 1 -6.746 -6.245 10.368
3 3H GLY 1 3HT GLY 1 -6.739 -7.513 9.248
4 1HA GLY 1 1HA GLY 1 -5.487 -5.647 8.391
5 2HA GLY 1 2HA GLY 1 -6.917 -5.955 7.418
6 H SER 2 H SER 2 -5.670 -3.524 7.287
7 HA SER 2 HA SER 2 -7.425 -1.742 8.839
8 1HB SER 2 2HB SER 2 -5.034 -1.354 9.230
9 2HB SER 2 1HB SER 2 -4.777 -1.133 7.501
10 HG SER 2 HG SER 2 -5.000 0.882 8.384
11 H GLY 3 H GLY 3 -6.355 -2.637 5.640
12 1HA GLY 3 2HA GLY 3 -8.409 -0.831 4.535
13 2HA GLY 3 1HA GLY 3 -6.856 -1.039 3.750
14 H GLU 4 H GLU 4 -6.831 -2.383 2.084
15 HA GLU 4 HA GLU 4 -7.439 -4.036 0.644
16 1HB GLU 4 2HB GLU 4 -6.818 -5.651 2.161
17 2HB GLU 4 1HB GLU 4 -8.029 -5.182 3.344
18 1HG GLU 4 2HG GLU 4 -8.956 -6.405 0.798
19 2HG GLU 4 1HG GLU 4 -8.172 -7.441 1.985
20 H VAL 5 H VAL 5 -9.203 -1.805 1.330
21 HA VAL 5 HA VAL 5 -11.839 -2.967 0.855
22 HB VAL 5 HB VAL 5 -11.171 -0.140 1.665
23 1HG1 VAL 5 1HG1 VAL 5 -13.553 0.040 2.168
24 2HG1 VAL 5 2HG1 VAL 5 -13.805 -1.610 1.599
25 3HG1 VAL 5 3HG1 VAL 5 -13.290 -0.357 0.469
26 1HG2 VAL 5 1HG2 VAL 5 -11.932 -0.768 3.897
27 2HG2 VAL 5 2HG2 VAL 5 -10.545 -1.743 3.408
28 3HG2 VAL 5 3HG2 VAL 5 -12.169 -2.430 3.359
29 H ASN 6 H ASN 6 -9.319 -1.166 -0.654
30 HA ASN 6 HA ASN 6 -9.165 -0.024 -2.639
31 1HB ASN 6 2HB ASN 6 -10.990 -2.335 -3.206
32 2HB ASN 6 1HB ASN 6 -10.681 -1.150 -4.470
33 1HD2 ASN 6 1HD2 ASN 6 -8.669 -1.023 -5.396
34 2HD2 ASN 6 2HD2 ASN 6 -7.451 -2.223 -5.159
35 H LYS 7 H LYS 7 -10.135 1.905 -1.687
36 HA LYS 7 HA LYS 7 -12.739 2.491 -2.892
37 1HB LYS 7 2HB LYS 7 -13.023 3.863 -0.596
38 2HB LYS 7 1HB LYS 7 -13.617 2.229 -0.833
39 1HG LYS 7 2HG LYS 7 -12.125 1.326 0.595
40 2HG LYS 7 1HG LYS 7 -10.824 2.439 0.148
41 1HD LYS 7 2HD LYS 7 -11.844 4.192 1.483
42 2HD LYS 7 1HD LYS 7 -13.225 3.156 1.846
43 1HE LYS 7 2HE LYS 7 -11.704 1.582 2.984
44 2HE LYS 7 1HE LYS 7 -10.364 2.686 2.677
45 1HZ LYS 7 1HZ LYS 7 -11.456 4.355 4.014
46 2HZ LYS 7 2HZ LYS 7 -11.275 2.936 4.915
47 3HZ LYS 7 3HZ LYS 7 -12.785 3.340 4.270
48 H ILE 8 H ILE 8 -11.306 4.721 -0.618
49 HA ILE 8 HA ILE 8 -10.260 6.370 -2.808
50 HB ILE 8 HB ILE 8 -12.478 7.242 -2.426
51 1HG1 ILE 8 2HG1 ILE 8 -11.972 9.525 -1.896
52 2HG1 ILE 8 1HG1 ILE 8 -10.585 9.055 -0.919
53 1HG2 ILE 8 1HG2 ILE 8 -13.333 7.862 -0.289
54 2HG2 ILE 8 2HG2 ILE 8 -11.777 7.569 0.484
55 3HG2 ILE 8 3HG2 ILE 8 -12.710 6.216 -0.155
56 1HD1 ILE 8 1HD1 ILE 8 -10.802 8.693 -3.897
57 2HD1 ILE 8 2HD1 ILE 8 -9.396 8.339 -2.891
58 3HD1 ILE 8 3HD1 ILE 8 -9.945 10.003 -3.085
59 H ILE 9 H ILE 9 -8.165 6.597 -2.298
60 HA ILE 9 HA ILE 9 -7.484 7.557 0.365
61 HB ILE 9 HB ILE 9 -7.478 5.180 0.584
62 1HG1 ILE 9 2HG1 ILE 9 -5.090 4.754 1.144
63 2HG1 ILE 9 1HG1 ILE 9 -4.674 6.295 0.429
64 1HG2 ILE 9 1HG2 ILE 9 -7.187 3.974 -1.240
65 2HG2 ILE 9 2HG2 ILE 9 -5.456 4.200 -1.020
66 3HG2 ILE 9 3HG2 ILE 9 -6.356 5.290 -2.066
67 1HD1 ILE 9 1HD1 ILE 9 -6.217 7.364 2.071
68 2HD1 ILE 9 2HD1 ILE 9 -4.813 6.566 2.784
69 3HD1 ILE 9 3HD1 ILE 9 -6.392 5.782 2.832
70 H GLY 10 H GLY 10 -5.182 8.186 0.549
71 1HA GLY 10 2HA GLY 10 -4.136 9.196 -2.036
72 2HA GLY 10 1HA GLY 10 -3.914 10.009 -0.488
73 H SER 11 H SER 11 -2.276 8.270 -2.725
74 HA SER 11 HA SER 11 -0.768 6.738 -0.750
75 1HB SER 11 2HB SER 11 0.185 5.996 -3.241
76 2HB SER 11 1HB SER 11 -0.934 5.071 -2.225
77 HG SER 11 HG SER 11 -1.949 5.366 -4.160
78 H ARG 12 H ARG 12 0.710 7.656 0.113
79 HA ARG 12 HA ARG 12 2.977 8.630 -1.402
80 1HB ARG 12 2HB ARG 12 3.031 10.858 -0.259
81 2HB ARG 12 1HB ARG 12 1.739 10.668 -1.438
82 1HG ARG 12 2HG ARG 12 0.137 10.288 0.339
83 2HG ARG 12 1HG ARG 12 1.421 10.388 1.544
84 1HD ARG 12 2HD ARG 12 0.592 12.603 -0.328
85 2HD ARG 12 1HD ARG 12 0.142 12.480 1.372
86 HE ARG 12 HE ARG 12 2.980 12.436 0.936
87 1HH1 ARG 12 1HH1 ARG 12 0.185 14.471 1.341
88 2HH1 ARG 12 2HH1 ARG 12 1.095 15.830 1.911
89 1HH2 ARG 12 1HH2 ARG 12 4.190 14.220 1.687
90 2HH2 ARG 12 2HH2 ARG 12 3.372 15.688 2.107
91 H THR 13 H THR 13 4.632 7.555 -0.360
92 HA THR 13 HA THR 13 4.613 7.679 2.578
93 HB THR 13 HB THR 13 6.232 5.580 1.209
94 HG1 THR 13 1HG THR 13 4.469 4.169 1.409
95 1HG2 THR 13 1HG2 THR 13 6.695 5.866 3.517
96 2HG2 THR 13 2HG2 THR 13 5.723 4.403 3.362
97 3HG2 THR 13 3HG2 THR 13 4.980 5.902 3.920
98 H ALA 14 H ALA 14 7.235 6.875 0.314
99 HA ALA 14 HA ALA 14 8.692 9.249 1.135
100 1HB ALA 14 1HB ALA 14 9.783 6.495 1.701
101 2HB ALA 14 2HB ALA 14 9.208 7.646 2.908
102 3HB ALA 14 3HB ALA 14 10.635 8.021 1.941
103 H GLY 15 H GLY 15 9.142 6.089 -0.481
104 1HA GLY 15 2HA GLY 15 9.353 6.119 -2.932
105 2HA GLY 15 1HA GLY 15 10.300 7.588 -2.756
106 H GLU 16 H GLU 16 11.869 6.657 -0.522
107 HA GLU 16 HA GLU 16 14.005 5.470 -1.885
108 1HB GLU 16 2HB GLU 16 14.325 6.753 0.163
109 2HB GLU 16 1HB GLU 16 13.423 5.556 1.083
110 1HG GLU 16 2HG GLU 16 15.771 5.261 1.469
111 2HG GLU 16 1HG GLU 16 15.155 3.887 0.552
112 H GLY 17 H GLY 17 11.261 4.110 -0.272
113 1HA GLY 17 2HA GLY 17 12.006 1.459 -1.233
114 2HA GLY 17 1HA GLY 17 11.771 1.629 0.503
115 H ALA 18 H ALA 18 9.657 3.404 0.566
116 HA ALA 18 HA ALA 18 7.503 2.032 -0.861
117 1HB ALA 18 1HB ALA 18 7.588 2.858 2.033
118 2HB ALA 18 2HB ALA 18 7.524 1.207 1.408
119 3HB ALA 18 3HB ALA 18 6.145 2.287 1.200
120 H MET 19 H MET 19 5.650 3.369 -1.321
121 HA MET 19 HA MET 19 5.725 6.118 -0.543
122 1HB MET 19 2HB MET 19 7.401 5.569 -2.574
123 2HB MET 19 1HB MET 19 5.935 5.941 -3.472
124 1HG MET 19 2HG MET 19 5.784 8.092 -2.343
125 2HG MET 19 1HG MET 19 7.240 7.710 -1.430
126 1HE MET 19 1HE MET 19 6.731 6.681 -5.181
127 2HE MET 19 2HE MET 19 7.256 8.138 -6.024
128 3HE MET 19 3HE MET 19 5.784 8.164 -5.052
129 H GLU 20 H GLU 20 3.517 4.475 -0.199
130 HA GLU 20 HA GLU 20 1.714 5.958 -1.835
131 1HB GLU 20 2HB GLU 20 2.029 3.082 -2.270
132 2HB GLU 20 1HB GLU 20 0.443 3.776 -2.479
133 1HG GLU 20 2HG GLU 20 1.966 5.522 -3.863
134 2HG GLU 20 1HG GLU 20 2.881 4.029 -4.100
135 H TYR 21 H TYR 21 -0.149 3.287 -0.762
136 HA TYR 21 HA TYR 21 -0.696 4.551 1.811
137 1HB TYR 21 2HB TYR 21 -2.942 5.269 1.127
138 2HB TYR 21 1HB TYR 21 -1.647 5.962 0.221
139 HD1 TYR 21 1HD TYR 21 -3.834 6.451 -1.362
140 HD2 TYR 21 2HD TYR 21 -1.903 2.690 -0.832
141 HE1 TYR 21 1HE TYR 21 -4.905 5.594 -3.371
142 HE2 TYR 21 2HE TYR 21 -2.979 1.844 -2.817
143 HH TYR 21 HH TYR 21 -4.941 2.299 -4.206
144 H LEU 22 H LEU 22 -3.677 3.647 1.114
145 HA LEU 22 HA LEU 22 -3.433 0.853 1.331
146 1HB LEU 22 2HB LEU 22 -5.179 1.228 3.406
147 2HB LEU 22 1HB LEU 22 -3.496 0.763 3.558
148 HG LEU 22 HG LEU 22 -3.022 3.304 3.636
149 1HD1 LEU 22 1HD1 LEU 22 -5.957 3.265 4.311
150 2HD1 LEU 22 2HD1 LEU 22 -5.204 4.074 2.939
151 3HD1 LEU 22 3HD1 LEU 22 -4.866 4.625 4.578
152 1HD2 LEU 22 1HD2 LEU 22 -2.711 1.812 5.525
153 2HD2 LEU 22 2HD2 LEU 22 -4.431 1.898 5.899
154 3HD2 LEU 22 3HD2 LEU 22 -3.422 3.335 6.057
155 H ILE 23 H ILE 23 -5.548 -0.193 1.435
156 HA ILE 23 HA ILE 23 -7.490 -0.726 0.460
157 HB ILE 23 HB ILE 23 -9.362 0.804 0.654
158 1HG1 ILE 23 2HG1 ILE 23 -7.798 2.890 0.175
159 2HG1 ILE 23 1HG1 ILE 23 -9.259 3.052 1.121
160 1HG2 ILE 23 1HG2 ILE 23 -9.144 1.242 3.124
161 2HG2 ILE 23 2HG2 ILE 23 -7.498 0.620 2.987
162 3HG2 ILE 23 3HG2 ILE 23 -8.869 -0.416 2.591
163 1HD1 ILE 23 1HD1 ILE 23 -8.140 3.628 2.972
164 2HD1 ILE 23 2HD1 ILE 23 -6.807 3.960 1.868
165 3HD1 ILE 23 3HD1 ILE 23 -6.884 2.417 2.711
166 H GLU 24 H GLU 24 -5.972 -0.727 -1.555
167 HA GLU 24 HA GLU 24 -7.539 0.001 -3.738
168 1HB GLU 24 2HB GLU 24 -6.792 2.310 -3.030
169 2HB GLU 24 1HB GLU 24 -5.166 1.838 -3.495
170 1HG GLU 24 2HG GLU 24 -5.615 1.947 -5.704
171 2HG GLU 24 1HG GLU 24 -7.285 1.418 -5.504
172 H TRP 25 H TRP 25 -5.970 -2.284 -2.956
173 HA TRP 25 HA TRP 25 -4.541 -2.632 -5.455
174 1HB TRP 25 2HB TRP 25 -2.611 -3.716 -3.938
175 2HB TRP 25 1HB TRP 25 -2.567 -2.060 -4.521
176 HD1 TRP 25 HD TRP 25 -4.528 -3.426 -1.429
177 HE1 TRP 25 1HE TRP 25 -3.750 -2.062 0.605
178 HE3 TRP 25 3HE TRP 25 -0.885 -0.576 -3.649
179 HZ2 TRP 25 2HZ TRP 25 -1.866 -0.102 1.186
180 HZ3 TRP 25 3HZ TRP 25 0.374 1.023 -2.239
181 HH2 TRP 25 HH TRP 25 -0.161 1.341 0.086
182 H LYS 26 H LYS 26 -6.896 -3.834 -4.250
183 HA LYS 26 HA LYS 26 -7.870 -5.877 -4.038
184 1HB LYS 26 2HB LYS 26 -5.406 -6.770 -5.542
185 2HB LYS 26 1HB LYS 26 -6.863 -7.730 -5.319
186 1HG LYS 26 2HG LYS 26 -8.148 -6.055 -6.559
187 2HG LYS 26 1HG LYS 26 -6.674 -5.115 -6.799
188 1HD LYS 26 2HD LYS 26 -7.120 -6.414 -8.782
189 2HD LYS 26 1HD LYS 26 -5.682 -7.052 -7.982
190 1HE LYS 26 2HE LYS 26 -7.100 -8.873 -8.718
191 2HE LYS 26 1HE LYS 26 -7.060 -8.812 -6.955
192 1HZ LYS 26 1HZ LYS 26 -9.301 -9.175 -7.811
193 2HZ LYS 26 2HZ LYS 26 -9.232 -7.712 -8.656
194 3HZ LYS 26 3HZ LYS 26 -9.198 -7.712 -6.966
195 H ASP 27 H ASP 27 -5.752 -4.935 -2.071
196 HA ASP 27 HA ASP 27 -4.646 -5.682 -0.228
197 1HB ASP 27 2HB ASP 27 -5.957 -7.081 1.163
198 2HB ASP 27 1HB ASP 27 -7.075 -6.158 0.166
199 H GLY 28 H GLY 28 -3.423 -6.721 -2.583
200 1HA GLY 28 2HA GLY 28 -2.957 -9.424 -2.693
201 2HA GLY 28 1HA GLY 28 -1.715 -8.235 -3.029
202 H HIS 29 H HIS 29 -1.062 -7.135 -0.652
203 HA HIS 29 HA HIS 29 -0.565 -9.413 1.136
204 1HB HIS 29 2HB HIS 29 1.461 -8.908 -0.300
205 2HB HIS 29 1HB HIS 29 1.554 -7.320 0.476
206 HD1 HIS 29 1HD HIS 29 1.617 -10.999 1.457
207 HD2 HIS 29 2HD HIS 29 2.995 -7.305 2.767
208 HE1 HIS 29 1HE HIS 29 3.073 -11.493 3.447
209 HE2 HIS 29 2HE HIS 29 3.970 -9.250 4.164
210 H SER 30 H SER 30 -2.031 -8.714 2.673
211 HA SER 30 HA SER 30 -2.976 -7.352 4.287
212 1HB SER 30 2HB SER 30 -0.054 -6.805 4.819
213 2HB SER 30 1HB SER 30 -1.375 -6.779 5.998
214 HG SER 30 HG SER 30 -1.508 -8.953 5.927
215 HA PRO 31 HA PRO 31 -3.295 -3.184 2.241
216 1HB PRO 31 2HB PRO 31 -4.508 -2.437 4.785
217 2HB PRO 31 1HB PRO 31 -5.245 -2.494 3.185
218 1HG PRO 31 2HG PRO 31 -5.333 -4.477 5.337
219 2HG PRO 31 1HG PRO 31 -6.353 -4.343 3.898
220 1HD PRO 31 2HD PRO 31 -4.564 -6.340 4.224
221 2HD PRO 31 1HD PRO 31 -4.938 -5.663 2.621
222 H SER 32 H SER 32 -1.662 -1.649 2.348
223 HA SER 32 HA SER 32 -0.409 -1.125 4.897
224 1HB SER 32 2HB SER 32 1.095 -2.506 2.721
225 2HB SER 32 1HB SER 32 1.831 -1.792 4.159
226 HG SER 32 HG SER 32 1.315 -4.128 4.213
227 H TRP 33 H TRP 33 0.705 0.830 5.002
228 HA TRP 33 HA TRP 33 0.347 2.498 2.680
229 1HB TRP 33 2HB TRP 33 0.229 3.284 5.128
230 2HB TRP 33 1HB TRP 33 1.981 3.106 5.158
231 HD1 TRP 33 HD TRP 33 3.406 4.804 3.602
232 HE1 TRP 33 1HE TRP 33 2.824 7.158 2.753
233 HE3 TRP 33 3HE TRP 33 -1.652 4.749 4.361
234 HZ2 TRP 33 2HZ TRP 33 0.546 8.783 2.426
235 HZ3 TRP 33 3HZ TRP 33 -2.960 6.741 3.746
236 HH2 TRP 33 HH TRP 33 -1.881 8.716 2.794
237 H VAL 34 H VAL 34 1.406 1.546 1.163
238 HA VAL 34 HA VAL 34 4.287 1.736 1.146
239 HB VAL 34 HB VAL 34 3.439 -0.930 0.200
240 1HG1 VAL 34 1HG1 VAL 34 5.738 0.383 1.247
241 2HG1 VAL 34 2HG1 VAL 34 5.641 -1.253 0.632
242 3HG1 VAL 34 3HG1 VAL 34 5.380 -0.942 2.339
243 1HG2 VAL 34 1HG2 VAL 34 3.321 -1.924 2.461
244 2HG2 VAL 34 2HG2 VAL 34 1.943 -0.947 2.002
245 3HG2 VAL 34 3HG2 VAL 34 3.140 -0.305 3.119
246 HA PRO 35 HA PRO 35 3.681 2.664 -3.055
247 1HB PRO 35 2HB PRO 35 5.589 1.471 -4.463
248 2HB PRO 35 1HB PRO 35 5.947 2.670 -3.213
249 1HG PRO 35 2HG PRO 35 6.096 -0.299 -3.097
250 2HG PRO 35 1HG PRO 35 7.212 0.901 -2.423
251 1HD PRO 35 2HD PRO 35 5.249 -0.438 -1.032
252 2HD PRO 35 1HD PRO 35 5.981 1.080 -0.509
253 H SER 36 H SER 36 1.780 2.041 -3.816
254 HA SER 36 HA SER 36 0.204 1.010 -5.054
255 1HB SER 36 2HB SER 36 1.616 1.918 -6.820
256 2HB SER 36 1HB SER 36 2.645 0.486 -6.764
257 HG SER 36 HG SER 36 1.320 -0.302 -8.180
258 H SER 37 H SER 37 1.520 -0.620 -3.032
259 HA SER 37 HA SER 37 0.350 -3.077 -3.733
260 1HB SER 37 2HB SER 37 3.370 -3.175 -3.496
261 2HB SER 37 1HB SER 37 2.284 -4.516 -3.840
262 HG SER 37 HG SER 37 3.473 -3.342 -5.643
263 H TYR 38 H TYR 38 2.958 -3.846 -1.790
264 HA TYR 38 HA TYR 38 2.292 -2.770 0.712
265 1HB TYR 38 2HB TYR 38 1.549 -5.430 1.163
266 2HB TYR 38 1HB TYR 38 0.514 -4.021 1.307
267 HD1 TYR 38 1HD TYR 38 -1.451 -4.109 0.183
268 HD2 TYR 38 2HD TYR 38 1.875 -6.195 -1.423
269 HE1 TYR 38 1HE TYR 38 -2.896 -5.005 -1.600
270 HE2 TYR 38 2HE TYR 38 0.448 -7.091 -3.231
271 HH TYR 38 HH TYR 38 -1.793 -7.481 -3.779
272 H ILE 39 H ILE 39 4.366 -2.712 1.100
273 HA ILE 39 HA ILE 39 5.934 -5.173 1.017
274 HB ILE 39 HB ILE 39 7.517 -4.289 -0.316
275 1HG1 ILE 39 2HG1 ILE 39 7.283 -1.839 1.388
276 2HG1 ILE 39 1HG1 ILE 39 8.692 -2.808 1.010
277 1HG2 ILE 39 1HG2 ILE 39 5.263 -2.341 -0.821
278 2HG2 ILE 39 2HG2 ILE 39 5.617 -3.842 -1.657
279 3HG2 ILE 39 3HG2 ILE 39 6.689 -2.461 -1.853
280 1HD1 ILE 39 1HD1 ILE 39 8.590 -1.815 -1.312
281 2HD1 ILE 39 2HD1 ILE 39 9.046 -0.725 -0.003
282 3HD1 ILE 39 3HD1 ILE 39 7.412 -0.676 -0.663
283 H ALA 40 H ALA 40 4.459 -4.095 3.140
284 HA ALA 40 HA ALA 40 5.893 -2.443 4.882
285 1HB ALA 40 1HB ALA 40 3.962 -4.602 5.670
286 2HB ALA 40 2HB ALA 40 3.486 -3.035 5.016
287 3HB ALA 40 3HB ALA 40 4.346 -3.124 6.555
288 H ALA 41 H ALA 41 8.005 -2.994 5.039
289 HA ALA 41 HA ALA 41 8.906 -4.522 7.115
290 1HB ALA 41 1HB ALA 41 9.928 -6.490 5.892
291 2HB ALA 41 2HB ALA 41 8.845 -6.108 4.554
292 3HB ALA 41 3HB ALA 41 8.182 -6.553 6.126
293 H ASP 42 H ASP 42 9.847 -4.297 3.701
294 HA ASP 42 HA ASP 42 11.574 -2.224 3.678
295 1HB ASP 42 2HB ASP 42 12.926 -3.121 5.460
296 2HB ASP 42 1HB ASP 42 13.011 -4.697 4.682
297 H VAL 43 H VAL 43 10.511 -2.481 1.596
298 HA VAL 43 HA VAL 43 12.198 -3.981 -0.251
299 HB VAL 43 HB VAL 43 9.353 -4.362 -0.896
300 1HG1 VAL 43 1HG1 VAL 43 11.341 -5.272 -2.133
301 2HG1 VAL 43 2HG1 VAL 43 10.107 -6.458 -1.712
302 3HG1 VAL 43 3HG1 VAL 43 11.596 -6.363 -0.771
303 1HG2 VAL 43 1HG2 VAL 43 9.212 -4.758 1.514
304 2HG2 VAL 43 2HG2 VAL 43 10.551 -5.902 1.412
305 3HG2 VAL 43 3HG2 VAL 43 9.019 -6.263 0.614
306 H VAL 44 H VAL 44 10.368 -3.652 -2.502
307 HA VAL 44 HA VAL 44 9.756 -0.838 -2.592
308 HB VAL 44 HB VAL 44 12.091 -0.680 -3.042
309 1HG1 VAL 44 1HG1 VAL 44 11.687 -2.699 -5.247
310 2HG1 VAL 44 2HG1 VAL 44 12.478 -3.011 -3.703
311 3HG1 VAL 44 3HG1 VAL 44 13.196 -1.878 -4.849
312 1HG2 VAL 44 1HG2 VAL 44 10.703 0.800 -4.353
313 2HG2 VAL 44 2HG2 VAL 44 10.494 -0.438 -5.590
314 3HG2 VAL 44 3HG2 VAL 44 12.083 0.278 -5.320
315 H SER 45 H SER 45 7.793 -1.020 -3.301
316 HA SER 45 HA SER 45 6.131 -1.053 -4.858
317 1HB SER 45 2HB SER 45 6.534 -1.408 -7.116
318 2HB SER 45 1HB SER 45 8.123 -0.921 -6.531
319 HG SER 45 HG SER 45 8.771 -2.743 -7.334
320 H GLU 46 H GLU 46 7.346 -3.580 -3.274
321 HA GLU 46 HA GLU 46 5.000 -5.087 -3.326
322 1HB GLU 46 2HB GLU 46 6.117 -5.519 -5.684
323 2HB GLU 46 1HB GLU 46 7.101 -6.649 -4.769
324 1HG GLU 46 2HG GLU 46 4.103 -6.667 -5.007
325 2HG GLU 46 1HG GLU 46 5.230 -7.793 -5.760
326 H TYR 47 H TYR 47 4.978 -6.608 -1.699
327 HA TYR 47 HA TYR 47 7.142 -6.586 0.137
328 1HB TYR 47 2HB TYR 47 5.119 -6.903 1.223
329 2HB TYR 47 1HB TYR 47 4.498 -8.012 0.007
330 HD1 TYR 47 1HD TYR 47 7.098 -7.755 2.681
331 HD2 TYR 47 2HD TYR 47 4.477 -10.287 0.486
332 HE1 TYR 47 1HE TYR 47 7.691 -9.635 4.153
333 HE2 TYR 47 2HE TYR 47 5.065 -12.175 1.950
334 HH TYR 47 HH TYR 47 6.726 -11.783 4.877
Start of MODEL 4
1 1H GLY 1 1HT GLY 1 -2.696 -3.275 11.097
2 2H GLY 1 2HT GLY 1 -4.047 -4.280 10.943
3 3H GLY 1 3HT GLY 1 -4.248 -2.656 11.371
4 1HA GLY 1 1HA GLY 1 -3.426 -1.943 9.220
5 2HA GLY 1 2HA GLY 1 -3.191 -3.626 8.772
6 H SER 2 H SER 2 -5.590 -1.167 9.520
7 HA SER 2 HA SER 2 -7.770 -2.880 8.649
8 1HB SER 2 2HB SER 2 -9.206 -0.939 9.199
9 2HB SER 2 1HB SER 2 -8.162 -1.391 10.547
10 HG SER 2 HG SER 2 -7.339 0.528 10.465
11 H GLY 3 H GLY 3 -7.488 -3.234 6.478
12 1HA GLY 3 2HA GLY 3 -8.126 -0.970 4.756
13 2HA GLY 3 1HA GLY 3 -6.602 -1.777 4.444
14 H GLU 4 H GLU 4 -7.095 -2.605 2.448
15 HA GLU 4 HA GLU 4 -7.889 -4.100 0.937
16 1HB GLU 4 2HB GLU 4 -7.360 -5.838 2.442
17 2HB GLU 4 1HB GLU 4 -8.717 -5.470 3.494
18 1HG GLU 4 2HG GLU 4 -9.514 -6.195 0.787
19 2HG GLU 4 1HG GLU 4 -8.600 -7.457 1.608
20 H VAL 5 H VAL 5 -9.289 -1.846 1.187
21 HA VAL 5 HA VAL 5 -12.085 -2.732 0.930
22 HB VAL 5 HB VAL 5 -11.217 0.076 1.596
23 1HG1 VAL 5 1HG1 VAL 5 -13.866 -1.357 1.805
24 2HG1 VAL 5 2HG1 VAL 5 -13.433 -0.120 0.625
25 3HG1 VAL 5 3HG1 VAL 5 -13.557 0.296 2.335
26 1HG2 VAL 5 1HG2 VAL 5 -11.816 -0.415 3.924
27 2HG2 VAL 5 2HG2 VAL 5 -10.457 -1.399 3.380
28 3HG2 VAL 5 3HG2 VAL 5 -12.068 -2.109 3.499
29 H ASN 6 H ASN 6 -9.384 -1.311 -0.653
30 HA ASN 6 HA ASN 6 -9.112 -0.276 -2.680
31 1HB ASN 6 2HB ASN 6 -9.960 -2.505 -3.360
32 2HB ASN 6 1HB ASN 6 -11.600 -1.862 -3.357
33 1HD2 ASN 6 1HD2 ASN 6 -8.533 -1.892 -4.977
34 2HD2 ASN 6 2HD2 ASN 6 -9.062 -1.121 -6.430
35 H LYS 7 H LYS 7 -10.416 1.192 -0.754
36 HA LYS 7 HA LYS 7 -12.732 2.446 -1.933
37 1HB LYS 7 2HB LYS 7 -12.954 3.493 0.308
38 2HB LYS 7 1HB LYS 7 -12.932 1.740 0.365
39 1HG LYS 7 2HG LYS 7 -10.525 1.826 1.035
40 2HG LYS 7 1HG LYS 7 -10.656 3.586 1.083
41 1HD LYS 7 2HD LYS 7 -12.483 3.364 2.749
42 2HD LYS 7 1HD LYS 7 -12.203 1.622 2.765
43 1HE LYS 7 2HE LYS 7 -11.060 2.626 4.631
44 2HE LYS 7 1HE LYS 7 -9.871 2.047 3.467
45 1HZ LYS 7 1HZ LYS 7 -9.240 4.211 4.231
46 2HZ LYS 7 2HZ LYS 7 -10.755 4.854 3.844
47 3HZ LYS 7 3HZ LYS 7 -9.718 4.339 2.612
48 H ILE 8 H ILE 8 -11.587 4.796 -0.016
49 HA ILE 8 HA ILE 8 -10.127 6.065 -2.214
50 HB ILE 8 HB ILE 8 -12.429 6.829 -1.643
51 1HG1 ILE 8 2HG1 ILE 8 -10.824 8.251 -2.871
52 2HG1 ILE 8 1HG1 ILE 8 -11.897 9.212 -1.860
53 1HG2 ILE 8 1HG2 ILE 8 -12.888 8.046 0.326
54 2HG2 ILE 8 2HG2 ILE 8 -11.182 8.114 0.770
55 3HG2 ILE 8 3HG2 ILE 8 -12.050 6.579 0.844
56 1HD1 ILE 8 1HD1 ILE 8 -10.047 9.218 -0.140
57 2HD1 ILE 8 2HD1 ILE 8 -9.757 10.140 -1.615
58 3HD1 ILE 8 3HD1 ILE 8 -9.005 8.560 -1.403
59 H ILE 9 H ILE 9 -8.048 6.353 -1.780
60 HA ILE 9 HA ILE 9 -7.242 7.420 0.806
61 HB ILE 9 HB ILE 9 -7.128 4.987 1.042
62 1HG1 ILE 9 2HG1 ILE 9 -4.784 4.798 1.754
63 2HG1 ILE 9 1HG1 ILE 9 -4.416 6.304 0.932
64 1HG2 ILE 9 1HG2 ILE 9 -6.737 4.519 -1.363
65 2HG2 ILE 9 2HG2 ILE 9 -5.666 3.627 -0.282
66 3HG2 ILE 9 3HG2 ILE 9 -5.075 5.046 -1.142
67 1HD1 ILE 9 1HD1 ILE 9 -4.751 6.482 3.392
68 2HD1 ILE 9 2HD1 ILE 9 -6.436 6.039 3.136
69 3HD1 ILE 9 3HD1 ILE 9 -5.800 7.528 2.437
70 H GLY 10 H GLY 10 -4.960 8.125 0.785
71 1HA GLY 10 2HA GLY 10 -4.200 9.014 -1.933
72 2HA GLY 10 1HA GLY 10 -3.858 9.916 -0.458
73 H SER 11 H SER 11 -2.256 8.336 -2.724
74 HA SER 11 HA SER 11 -0.657 6.794 -0.858
75 1HB SER 11 2HB SER 11 0.461 6.209 -3.255
76 2HB SER 11 1HB SER 11 -0.867 5.275 -2.519
77 HG SER 11 HG SER 11 -0.874 6.467 -4.827
78 H ARG 12 H ARG 12 0.785 7.780 0.047
79 HA ARG 12 HA ARG 12 3.010 8.962 -1.362
80 1HB ARG 12 2HB ARG 12 1.286 10.662 0.441
81 2HB ARG 12 1HB ARG 12 2.943 11.081 0.031
82 1HG ARG 12 2HG ARG 12 2.002 12.231 -1.636
83 2HG ARG 12 1HG ARG 12 1.891 10.662 -2.432
84 1HD ARG 12 2HD ARG 12 -0.253 11.672 -2.592
85 2HD ARG 12 1HD ARG 12 -0.373 10.403 -1.374
86 HE ARG 12 HE ARG 12 0.199 12.631 0.069
87 1HH1 ARG 12 1HH1 ARG 12 -2.242 11.828 -2.280
88 2HH1 ARG 12 2HH1 ARG 12 -3.428 12.894 -1.604
89 1HH2 ARG 12 1HH2 ARG 12 -1.349 14.042 0.964
90 2HH2 ARG 12 2HH2 ARG 12 -2.919 14.156 0.241
91 H THR 13 H THR 13 4.564 7.646 -0.366
92 HA THR 13 HA THR 13 4.484 7.598 2.571
93 HB THR 13 HB THR 13 6.187 5.621 1.135
94 HG1 THR 13 1HG THR 13 4.437 4.183 1.085
95 1HG2 THR 13 1HG2 THR 13 6.401 5.842 3.542
96 2HG2 THR 13 2HG2 THR 13 5.702 4.279 3.118
97 3HG2 THR 13 3HG2 THR 13 4.669 5.570 3.730
98 H ALA 14 H ALA 14 7.235 6.934 0.435
99 HA ALA 14 HA ALA 14 8.617 9.271 1.458
100 1HB ALA 14 1HB ALA 14 9.035 7.631 3.194
101 2HB ALA 14 2HB ALA 14 10.519 7.962 2.300
102 3HB ALA 14 3HB ALA 14 9.615 6.478 1.992
103 H GLY 15 H GLY 15 9.156 6.185 -0.271
104 1HA GLY 15 2HA GLY 15 9.531 6.363 -2.706
105 2HA GLY 15 1HA GLY 15 10.516 7.778 -2.368
106 H GLU 16 H GLU 16 11.747 6.444 -0.004
107 HA GLU 16 HA GLU 16 14.025 5.401 -1.258
108 1HB GLU 16 2HB GLU 16 13.000 5.177 1.570
109 2HB GLU 16 1HB GLU 16 14.535 4.480 1.072
110 1HG GLU 16 2HG GLU 16 14.880 6.632 2.109
111 2HG GLU 16 1HG GLU 16 15.322 6.696 0.403
112 H GLY 17 H GLY 17 11.112 3.922 -0.066
113 1HA GLY 17 2HA GLY 17 11.744 1.481 -1.521
114 2HA GLY 17 1HA GLY 17 11.467 1.311 0.210
115 H ALA 18 H ALA 18 9.482 3.081 0.668
116 HA ALA 18 HA ALA 18 7.243 2.081 -0.949
117 1HB ALA 18 1HB ALA 18 7.289 1.314 1.403
118 2HB ALA 18 2HB ALA 18 5.870 2.279 0.999
119 3HB ALA 18 3HB ALA 18 7.197 3.004 1.911
120 H MET 19 H MET 19 5.526 3.569 -1.390
121 HA MET 19 HA MET 19 5.772 6.297 -0.613
122 1HB MET 19 2HB MET 19 7.406 5.582 -2.698
123 2HB MET 19 1HB MET 19 5.993 6.225 -3.524
124 1HG MET 19 2HG MET 19 7.421 7.681 -1.333
125 2HG MET 19 1HG MET 19 7.828 7.863 -3.035
126 1HE MET 19 1HE MET 19 7.478 10.485 -2.627
127 2HE MET 19 2HE MET 19 6.903 10.261 -0.975
128 3HE MET 19 3HE MET 19 5.952 11.208 -2.119
129 H GLU 20 H GLU 20 3.534 4.610 -0.412
130 HA GLU 20 HA GLU 20 1.778 6.173 -2.007
131 1HB GLU 20 2HB GLU 20 2.002 3.253 -2.449
132 2HB GLU 20 1HB GLU 20 0.559 4.103 -2.891
133 1HG GLU 20 2HG GLU 20 2.201 5.660 -4.154
134 2HG GLU 20 1HG GLU 20 3.298 4.283 -4.026
135 H TYR 21 H TYR 21 -0.344 3.832 -1.355
136 HA TYR 21 HA TYR 21 -1.140 4.988 1.270
137 1HB TYR 21 2HB TYR 21 -3.485 4.367 0.230
138 2HB TYR 21 1HB TYR 21 -2.762 5.902 -0.193
139 HD1 TYR 21 1HD TYR 21 -3.479 6.339 -2.383
140 HD2 TYR 21 2HD TYR 21 -2.154 2.434 -1.288
141 HE1 TYR 21 1HE TYR 21 -3.743 5.579 -4.700
142 HE2 TYR 21 2HE TYR 21 -2.432 1.685 -3.570
143 HH TYR 21 HH TYR 21 -3.734 2.341 -5.614
144 H LEU 22 H LEU 22 -3.233 3.797 2.054
145 HA LEU 22 HA LEU 22 -2.887 1.036 1.401
146 1HB LEU 22 2HB LEU 22 -2.669 0.277 3.577
147 2HB LEU 22 1HB LEU 22 -1.808 1.799 3.611
148 HG LEU 22 HG LEU 22 -4.154 2.722 4.419
149 1HD1 LEU 22 1HD1 LEU 22 -5.132 0.392 4.171
150 2HD1 LEU 22 2HD1 LEU 22 -5.413 1.209 5.706
151 3HD1 LEU 22 3HD1 LEU 22 -4.178 -0.045 5.586
152 1HD2 LEU 22 1HD2 LEU 22 -2.193 1.251 6.173
153 2HD2 LEU 22 2HD2 LEU 22 -3.356 2.461 6.717
154 3HD2 LEU 22 3HD2 LEU 22 -2.049 2.921 5.625
155 H ILE 23 H ILE 23 -4.665 0.516 0.378
156 HA ILE 23 HA ILE 23 -6.833 -0.614 1.002
157 HB ILE 23 HB ILE 23 -8.768 0.883 1.175
158 1HG1 ILE 23 2HG1 ILE 23 -8.202 3.230 2.119
159 2HG1 ILE 23 1HG1 ILE 23 -6.661 2.991 1.299
160 1HG2 ILE 23 1HG2 ILE 23 -7.951 1.760 3.614
161 2HG2 ILE 23 2HG2 ILE 23 -6.852 0.415 3.297
162 3HG2 ILE 23 3HG2 ILE 23 -8.594 0.160 3.246
163 1HD1 ILE 23 1HD1 ILE 23 -8.537 4.188 0.040
164 2HD1 ILE 23 2HD1 ILE 23 -9.226 2.584 -0.155
165 3HD1 ILE 23 3HD1 ILE 23 -7.632 2.931 -0.791
166 H GLU 24 H GLU 24 -5.215 0.374 -1.374
167 HA GLU 24 HA GLU 24 -7.518 0.633 -3.183
168 1HB GLU 24 2HB GLU 24 -6.346 2.814 -2.899
169 2HB GLU 24 1HB GLU 24 -4.899 2.071 -3.559
170 1HG GLU 24 2HG GLU 24 -6.065 3.364 -5.244
171 2HG GLU 24 1HG GLU 24 -6.047 1.651 -5.661
172 H TRP 25 H TRP 25 -6.655 -1.813 -2.763
173 HA TRP 25 HA TRP 25 -5.535 -2.585 -5.319
174 1HB TRP 25 2HB TRP 25 -4.015 -4.241 -3.762
175 2HB TRP 25 1HB TRP 25 -3.418 -2.752 -4.485
176 HD1 TRP 25 HD TRP 25 -5.440 -3.499 -1.247
177 HE1 TRP 25 1HE TRP 25 -4.353 -2.191 0.670
178 HE3 TRP 25 3HE TRP 25 -1.498 -1.317 -3.781
179 HZ2 TRP 25 2HZ TRP 25 -2.183 -0.525 1.045
180 HZ3 TRP 25 3HZ TRP 25 0.045 0.139 -2.436
181 HH2 TRP 25 HH TRP 25 -0.357 0.581 -0.155
182 H LYS 26 H LYS 26 -5.152 -5.269 -4.874
183 HA LYS 26 HA LYS 26 -7.865 -6.114 -4.180
184 1HB LYS 26 2HB LYS 26 -7.319 -8.193 -5.392
185 2HB LYS 26 1HB LYS 26 -7.108 -6.770 -6.402
186 1HG LYS 26 2HG LYS 26 -4.701 -7.658 -4.968
187 2HG LYS 26 1HG LYS 26 -5.313 -8.770 -6.193
188 1HD LYS 26 2HD LYS 26 -4.788 -5.842 -6.686
189 2HD LYS 26 1HD LYS 26 -3.627 -7.125 -7.033
190 1HE LYS 26 2HE LYS 26 -5.215 -8.154 -8.573
191 2HE LYS 26 1HE LYS 26 -6.397 -6.898 -8.207
192 1HZ LYS 26 1HZ LYS 26 -3.738 -6.435 -9.446
193 2HZ LYS 26 2HZ LYS 26 -4.911 -5.254 -9.138
194 3HZ LYS 26 3HZ LYS 26 -5.211 -6.467 -10.279
195 H ASP 27 H ASP 27 -6.071 -5.437 -2.109
196 HA ASP 27 HA ASP 27 -5.186 -6.225 -0.155
197 1HB ASP 27 2HB ASP 27 -7.477 -7.030 0.110
198 2HB ASP 27 1HB ASP 27 -7.074 -8.509 -0.750
199 H GLY 28 H GLY 28 -3.525 -6.699 -2.305
200 1HA GLY 28 2HA GLY 28 -2.701 -9.309 -2.746
201 2HA GLY 28 1HA GLY 28 -1.637 -7.917 -2.828
202 H HIS 29 H HIS 29 -1.107 -7.051 -0.439
203 HA HIS 29 HA HIS 29 -0.599 -9.381 1.265
204 1HB HIS 29 2HB HIS 29 1.435 -8.860 -0.156
205 2HB HIS 29 1HB HIS 29 1.541 -7.307 0.678
206 HD1 HIS 29 1HD HIS 29 2.448 -7.317 3.067
207 HD2 HIS 29 2HD HIS 29 2.101 -11.113 1.414
208 HE1 HIS 29 1HE HIS 29 3.680 -8.849 4.636
209 HE2 HIS 29 2HE HIS 29 3.370 -11.153 3.667
210 H SER 30 H SER 30 -2.061 -8.704 2.818
211 HA SER 30 HA SER 30 -3.014 -7.337 4.431
212 1HB SER 30 2HB SER 30 -0.086 -6.816 4.972
213 2HB SER 30 1HB SER 30 -1.410 -6.727 6.142
214 HG SER 30 HG SER 30 -1.002 -8.752 6.491
215 HA PRO 31 HA PRO 31 -3.414 -3.335 2.105
216 1HB PRO 31 2HB PRO 31 -4.771 -3.085 4.782
217 2HB PRO 31 1HB PRO 31 -5.267 -2.425 3.215
218 1HG PRO 31 2HG PRO 31 -6.307 -4.721 4.187
219 2HG PRO 31 1HG PRO 31 -6.057 -4.442 2.457
220 1HD PRO 31 2HD PRO 31 -4.701 -6.330 4.211
221 2HD PRO 31 1HD PRO 31 -4.639 -6.200 2.439
222 H SER 32 H SER 32 -1.915 -1.679 2.216
223 HA SER 32 HA SER 32 -0.703 -1.105 4.759
224 1HB SER 32 2HB SER 32 0.344 -3.192 3.871
225 2HB SER 32 1HB SER 32 0.970 -2.210 2.546
226 HG SER 32 HG SER 32 2.501 -2.370 4.222
227 H TRP 33 H TRP 33 0.255 0.956 4.816
228 HA TRP 33 HA TRP 33 0.039 2.477 2.397
229 1HB TRP 33 2HB TRP 33 -0.427 3.448 4.680
230 2HB TRP 33 1HB TRP 33 1.271 3.215 5.077
231 HD1 TRP 33 HD TRP 33 3.015 4.627 3.294
232 HE1 TRP 33 1HE TRP 33 2.707 7.049 2.505
233 HE3 TRP 33 3HE TRP 33 -1.996 5.193 4.194
234 HZ2 TRP 33 2HZ TRP 33 0.640 8.959 2.271
235 HZ3 TRP 33 3HZ TRP 33 -3.053 7.349 3.658
236 HH2 TRP 33 HH TRP 33 -1.762 9.190 2.713
237 H VAL 34 H VAL 34 1.309 1.678 1.012
238 HA VAL 34 HA VAL 34 4.147 1.903 1.346
239 HB VAL 34 HB VAL 34 3.378 -0.769 0.277
240 1HG1 VAL 34 1HG1 VAL 34 5.568 0.500 1.779
241 2HG1 VAL 34 2HG1 VAL 34 5.640 -0.875 0.691
242 3HG1 VAL 34 3HG1 VAL 34 5.177 -1.104 2.364
243 1HG2 VAL 34 1HG2 VAL 34 1.780 -0.632 2.023
244 2HG2 VAL 34 2HG2 VAL 34 3.014 -0.164 3.186
245 3HG2 VAL 34 3HG2 VAL 34 3.047 -1.771 2.460
246 HA PRO 35 HA PRO 35 3.728 2.719 -2.988
247 1HB PRO 35 2HB PRO 35 5.626 1.514 -4.325
248 2HB PRO 35 1HB PRO 35 6.026 2.602 -2.999
249 1HG PRO 35 2HG PRO 35 5.984 -0.380 -3.067
250 2HG PRO 35 1HG PRO 35 7.144 0.703 -2.282
251 1HD PRO 35 2HD PRO 35 4.986 -0.563 -1.057
252 2HD PRO 35 1HD PRO 35 5.886 0.808 -0.399
253 H SER 36 H SER 36 1.750 2.025 -3.747
254 HA SER 36 HA SER 36 0.217 0.884 -4.959
255 1HB SER 36 2HB SER 36 1.654 1.762 -6.735
256 2HB SER 36 1HB SER 36 2.681 0.331 -6.624
257 HG SER 36 HG SER 36 1.342 -0.610 -7.922
258 H SER 37 H SER 37 1.697 -0.668 -2.862
259 HA SER 37 HA SER 37 0.560 -3.174 -3.508
260 1HB SER 37 2HB SER 37 3.569 -3.193 -3.224
261 2HB SER 37 1HB SER 37 2.516 -4.537 -3.650
262 HG SER 37 HG SER 37 2.680 -3.943 -5.644
263 H TYR 38 H TYR 38 3.141 -3.909 -1.541
264 HA TYR 38 HA TYR 38 2.449 -2.779 0.935
265 1HB TYR 38 2HB TYR 38 1.669 -5.480 1.376
266 2HB TYR 38 1HB TYR 38 0.729 -4.030 1.663
267 HD1 TYR 38 1HD TYR 38 -1.360 -4.032 0.691
268 HD2 TYR 38 2HD TYR 38 1.835 -5.981 -1.313
269 HE1 TYR 38 1HE TYR 38 -2.871 -4.571 -1.179
270 HE2 TYR 38 2HE TYR 38 0.333 -6.542 -3.187
271 HH TYR 38 HH TYR 38 -2.308 -5.106 -3.899
272 H ILE 39 H ILE 39 4.481 -2.727 1.437
273 HA ILE 39 HA ILE 39 6.071 -5.172 1.214
274 HB ILE 39 HB ILE 39 7.716 -4.137 0.045
275 1HG1 ILE 39 2HG1 ILE 39 7.119 -1.723 1.723
276 2HG1 ILE 39 1HG1 ILE 39 8.639 -2.563 1.490
277 1HG2 ILE 39 1HG2 ILE 39 6.787 -2.456 -1.547
278 2HG2 ILE 39 2HG2 ILE 39 5.362 -2.321 -0.512
279 3HG2 ILE 39 3HG2 ILE 39 5.724 -3.843 -1.303
280 1HD1 ILE 39 1HD1 ILE 39 8.889 -0.472 0.461
281 2HD1 ILE 39 2HD1 ILE 39 7.318 -0.582 -0.332
282 3HD1 ILE 39 3HD1 ILE 39 8.644 -1.618 -0.857
283 H ALA 40 H ALA 40 4.602 -4.320 3.418
284 HA ALA 40 HA ALA 40 6.037 -2.822 5.300
285 1HB ALA 40 1HB ALA 40 4.506 -3.710 6.909
286 2HB ALA 40 2HB ALA 40 4.106 -5.057 5.843
287 3HB ALA 40 3HB ALA 40 3.643 -3.415 5.397
288 H ALA 41 H ALA 41 8.165 -3.396 5.355
289 HA ALA 41 HA ALA 41 9.114 -5.083 7.270
290 1HB ALA 41 1HB ALA 41 8.327 -7.035 6.166
291 2HB ALA 41 2HB ALA 41 10.067 -6.977 5.893
292 3HB ALA 41 3HB ALA 41 8.956 -6.493 4.611
293 H ASP 42 H ASP 42 9.935 -4.604 3.843
294 HA ASP 42 HA ASP 42 11.684 -2.568 3.895
295 1HB ASP 42 2HB ASP 42 13.953 -3.730 4.046
296 2HB ASP 42 1HB ASP 42 13.106 -3.477 5.567
297 H VAL 43 H VAL 43 10.568 -2.747 1.813
298 HA VAL 43 HA VAL 43 12.289 -4.045 -0.144
299 HB VAL 43 HB VAL 43 9.432 -4.583 -0.685
300 1HG1 VAL 43 1HG1 VAL 43 10.564 -5.600 -2.322
301 2HG1 VAL 43 2HG1 VAL 43 10.850 -6.873 -1.137
302 3HG1 VAL 43 3HG1 VAL 43 12.065 -5.621 -1.395
303 1HG2 VAL 43 1HG2 VAL 43 10.935 -6.222 1.357
304 2HG2 VAL 43 2HG2 VAL 43 9.377 -6.640 0.644
305 3HG2 VAL 43 3HG2 VAL 43 9.522 -5.216 1.675
306 H VAL 44 H VAL 44 10.673 -3.675 -2.414
307 HA VAL 44 HA VAL 44 9.765 -0.919 -2.294
308 HB VAL 44 HB VAL 44 11.210 -0.034 -3.918
309 1HG1 VAL 44 1HG1 VAL 44 12.143 -0.393 -1.600
310 2HG1 VAL 44 2HG1 VAL 44 13.329 -0.131 -2.875
311 3HG1 VAL 44 3HG1 VAL 44 13.037 -1.758 -2.263
312 1HG2 VAL 44 1HG2 VAL 44 12.242 -2.837 -4.375
313 2HG2 VAL 44 2HG2 VAL 44 12.948 -1.380 -5.075
314 3HG2 VAL 44 3HG2 VAL 44 11.305 -1.856 -5.502
315 H SER 45 H SER 45 7.956 -0.742 -3.327
316 HA SER 45 HA SER 45 6.323 -0.878 -4.879
317 1HB SER 45 2HB SER 45 8.150 -0.545 -6.509
318 2HB SER 45 1HB SER 45 8.359 -2.293 -6.601
319 HG SER 45 HG SER 45 6.569 -2.468 -7.741
320 H GLU 46 H GLU 46 7.383 -3.390 -3.198
321 HA GLU 46 HA GLU 46 5.070 -4.918 -3.477
322 1HB GLU 46 2HB GLU 46 5.981 -5.453 -5.713
323 2HB GLU 46 1HB GLU 46 7.425 -6.108 -4.960
324 1HG GLU 46 2HG GLU 46 6.096 -7.834 -3.878
325 2HG GLU 46 1HG GLU 46 4.631 -7.165 -4.596
326 H TYR 47 H TYR 47 5.085 -6.906 -2.265
327 HA TYR 47 HA TYR 47 6.526 -6.723 0.130
328 1HB TYR 47 2HB TYR 47 5.581 -8.965 0.633
329 2HB TYR 47 1HB TYR 47 4.371 -7.824 0.058
330 HD1 TYR 47 1HD TYR 47 6.031 -10.982 -0.546
331 HD2 TYR 47 2HD TYR 47 3.512 -8.026 -2.286
332 HE1 TYR 47 1HE TYR 47 5.356 -12.586 -2.282
333 HE2 TYR 47 2HE TYR 47 2.828 -9.624 -4.024
334 HH TYR 47 HH TYR 47 3.474 -12.946 -3.824
Start of MODEL 5
1 1H GLY 1 1HT GLY 1 -15.931 -4.588 7.614
2 2H GLY 1 2HT GLY 1 -14.835 -4.806 6.343
3 3H GLY 1 3HT GLY 1 -16.037 -3.622 6.228
4 1HA GLY 1 1HA GLY 1 -15.049 -2.385 8.050
5 2HA GLY 1 2HA GLY 1 -13.805 -3.619 8.186
6 H SER 2 H SER 2 -12.383 -1.724 7.905
7 HA SER 2 HA SER 2 -12.237 -0.697 5.176
8 1HB SER 2 2HB SER 2 -10.530 0.846 6.079
9 2HB SER 2 1HB SER 2 -12.035 0.930 6.994
10 HG SER 2 HG SER 2 -10.441 0.789 8.493
11 H GLY 3 H GLY 3 -9.868 -0.404 4.373
12 1HA GLY 3 2HA GLY 3 -7.802 -1.325 3.855
13 2HA GLY 3 1HA GLY 3 -8.060 -2.538 5.095
14 H GLU 4 H GLU 4 -7.101 -2.713 2.254
15 HA GLU 4 HA GLU 4 -7.423 -3.978 0.382
16 1HB GLU 4 2HB GLU 4 -7.284 -6.140 1.012
17 2HB GLU 4 1HB GLU 4 -7.452 -5.536 2.645
18 1HG GLU 4 2HG GLU 4 -9.947 -5.863 2.378
19 2HG GLU 4 1HG GLU 4 -9.569 -6.747 0.898
20 H VAL 5 H VAL 5 -9.529 -2.064 1.081
21 HA VAL 5 HA VAL 5 -11.936 -3.285 -0.067
22 HB VAL 5 HB VAL 5 -11.709 -0.534 1.094
23 1HG1 VAL 5 1HG1 VAL 5 -14.128 -0.869 1.530
24 2HG1 VAL 5 2HG1 VAL 5 -14.028 -2.445 0.744
25 3HG1 VAL 5 3HG1 VAL 5 -13.722 -0.977 -0.183
26 1HG2 VAL 5 1HG2 VAL 5 -12.699 -1.653 3.196
27 2HG2 VAL 5 2HG2 VAL 5 -10.966 -1.791 2.909
28 3HG2 VAL 5 3HG2 VAL 5 -12.030 -3.147 2.538
29 H ASN 6 H ASN 6 -9.310 -1.424 -1.020
30 HA ASN 6 HA ASN 6 -8.928 0.193 -2.607
31 1HB ASN 6 2HB ASN 6 -9.996 -0.532 -4.838
32 2HB ASN 6 1HB ASN 6 -8.904 -1.638 -4.020
33 1HD2 ASN 6 1HD2 ASN 6 -9.569 -3.524 -3.307
34 2HD2 ASN 6 2HD2 ASN 6 -11.164 -4.154 -3.553
35 H LYS 7 H LYS 7 -10.136 1.845 -1.353
36 HA LYS 7 HA LYS 7 -12.235 2.998 -2.991
37 1HB LYS 7 2HB LYS 7 -13.623 3.323 -0.813
38 2HB LYS 7 1HB LYS 7 -13.693 1.783 -1.660
39 1HG LYS 7 2HG LYS 7 -12.711 0.669 0.005
40 2HG LYS 7 1HG LYS 7 -11.558 1.964 0.354
41 1HD LYS 7 2HD LYS 7 -13.391 3.196 1.496
42 2HD LYS 7 1HD LYS 7 -14.462 1.826 1.205
43 1HE LYS 7 2HE LYS 7 -13.535 1.789 3.472
44 2HE LYS 7 1HE LYS 7 -13.022 0.390 2.530
45 1HZ LYS 7 1HZ LYS 7 -10.904 1.471 2.130
46 2HZ LYS 7 2HZ LYS 7 -11.193 1.343 3.793
47 3HZ LYS 7 3HZ LYS 7 -11.398 2.829 3.011
48 H ILE 8 H ILE 8 -12.242 4.136 0.267
49 HA ILE 8 HA ILE 8 -11.053 6.635 -0.553
50 HB ILE 8 HB ILE 8 -13.079 6.553 0.874
51 1HG1 ILE 8 2HG1 ILE 8 -11.455 8.489 0.866
52 2HG1 ILE 8 1HG1 ILE 8 -12.475 8.368 2.295
53 1HG2 ILE 8 1HG2 ILE 8 -12.173 4.541 2.190
54 2HG2 ILE 8 2HG2 ILE 8 -13.114 5.757 3.053
55 3HG2 ILE 8 3HG2 ILE 8 -11.357 5.748 3.182
56 1HD1 ILE 8 1HD1 ILE 8 -10.479 7.113 3.333
57 2HD1 ILE 8 2HD1 ILE 8 -10.392 8.865 3.159
58 3HD1 ILE 8 3HD1 ILE 8 -9.551 7.825 2.011
59 H ILE 9 H ILE 9 -8.882 6.523 -0.719
60 HA ILE 9 HA ILE 9 -7.418 5.976 1.688
61 HB ILE 9 HB ILE 9 -7.897 3.818 0.544
62 1HG1 ILE 9 2HG1 ILE 9 -5.855 2.821 1.186
63 2HG1 ILE 9 1HG1 ILE 9 -4.949 4.290 0.883
64 1HG2 ILE 9 1HG2 ILE 9 -6.033 4.951 -1.467
65 2HG2 ILE 9 2HG2 ILE 9 -7.636 4.254 -1.698
66 3HG2 ILE 9 3HG2 ILE 9 -6.284 3.215 -1.269
67 1HD1 ILE 9 1HD1 ILE 9 -5.625 5.257 2.850
68 2HD1 ILE 9 2HD1 ILE 9 -5.546 3.554 3.307
69 3HD1 ILE 9 3HD1 ILE 9 -7.101 4.297 2.935
70 H GLY 10 H GLY 10 -4.913 6.084 1.137
71 1HA GLY 10 2HA GLY 10 -4.488 8.333 -0.683
72 2HA GLY 10 1HA GLY 10 -4.032 8.509 1.006
73 H SER 11 H SER 11 -2.053 8.863 -0.770
74 HA SER 11 HA SER 11 -0.405 6.543 -0.300
75 1HB SER 11 2HB SER 11 0.298 6.727 -2.830
76 2HB SER 11 1HB SER 11 -1.129 5.791 -2.383
77 HG SER 11 HG SER 11 -1.104 7.649 -4.112
78 H ARG 12 H ARG 12 1.146 7.589 0.831
79 HA ARG 12 HA ARG 12 2.960 9.271 -0.668
80 1HB ARG 12 2HB ARG 12 1.443 10.977 0.130
81 2HB ARG 12 1HB ARG 12 1.528 10.345 1.768
82 1HG ARG 12 2HG ARG 12 2.864 12.389 1.445
83 2HG ARG 12 1HG ARG 12 3.833 11.005 1.958
84 1HD ARG 12 2HD ARG 12 4.652 10.667 -0.260
85 2HD ARG 12 1HD ARG 12 3.530 11.857 -0.916
86 HE ARG 12 HE ARG 12 6.031 12.373 0.443
87 1HH1 ARG 12 1HH1 ARG 12 2.983 13.685 -0.630
88 2HH1 ARG 12 2HH1 ARG 12 3.551 15.321 -0.653
89 1HH2 ARG 12 1HH2 ARG 12 6.782 14.525 0.418
90 2HH2 ARG 12 2HH2 ARG 12 5.707 15.798 -0.059
91 H THR 13 H THR 13 4.735 7.887 -0.261
92 HA THR 13 HA THR 13 5.251 7.428 2.586
93 HB THR 13 HB THR 13 6.518 5.614 0.636
94 HG1 THR 13 1HG THR 13 4.657 4.298 0.683
95 1HG2 THR 13 1HG2 THR 13 5.452 5.345 3.431
96 2HG2 THR 13 2HG2 THR 13 7.143 5.399 2.938
97 3HG2 THR 13 3HG2 THR 13 6.141 4.016 2.499
98 H ALA 14 H ALA 14 7.510 6.936 -0.115
99 HA ALA 14 HA ALA 14 9.144 9.124 0.890
100 1HB ALA 14 1HB ALA 14 9.779 7.337 2.387
101 2HB ALA 14 2HB ALA 14 11.112 7.709 1.294
102 3HB ALA 14 3HB ALA 14 10.118 6.277 1.020
103 H GLY 15 H GLY 15 9.380 6.201 -1.164
104 1HA GLY 15 2HA GLY 15 9.370 6.636 -3.609
105 2HA GLY 15 1HA GLY 15 10.449 7.983 -3.279
106 H GLU 16 H GLU 16 11.960 6.426 -1.277
107 HA GLU 16 HA GLU 16 13.986 5.432 -2.930
108 1HB GLU 16 2HB GLU 16 14.088 6.131 -0.458
109 2HB GLU 16 1HB GLU 16 13.516 4.509 -0.098
110 1HG GLU 16 2HG GLU 16 15.903 4.579 0.118
111 2HG GLU 16 1HG GLU 16 15.471 3.583 -1.271
112 H GLY 17 H GLY 17 11.215 3.961 -1.439
113 1HA GLY 17 2HA GLY 17 11.473 1.642 -3.179
114 2HA GLY 17 1HA GLY 17 11.471 1.325 -1.449
115 H ALA 18 H ALA 18 9.652 3.159 -0.533
116 HA ALA 18 HA ALA 18 7.172 2.356 -1.863
117 1HB ALA 18 1HB ALA 18 6.079 2.435 0.314
118 2HB ALA 18 2HB ALA 18 7.607 2.914 1.059
119 3HB ALA 18 3HB ALA 18 7.440 1.308 0.339
120 H MET 19 H MET 19 5.454 3.905 -1.948
121 HA MET 19 HA MET 19 5.896 6.569 -0.970
122 1HB MET 19 2HB MET 19 7.066 5.996 -3.410
123 2HB MET 19 1HB MET 19 5.542 6.747 -3.863
124 1HG MET 19 2HG MET 19 6.113 8.623 -2.320
125 2HG MET 19 1HG MET 19 7.696 7.883 -2.134
126 1HE MET 19 1HE MET 19 6.054 9.656 -6.058
127 2HE MET 19 2HE MET 19 5.250 9.785 -4.493
128 3HE MET 19 3HE MET 19 5.365 8.221 -5.299
129 H GLU 20 H GLU 20 3.811 4.414 -1.043
130 HA GLU 20 HA GLU 20 1.601 6.196 -1.578
131 1HB GLU 20 2HB GLU 20 1.448 3.485 -2.809
132 2HB GLU 20 1HB GLU 20 0.534 4.901 -3.211
133 1HG GLU 20 2HG GLU 20 2.675 5.880 -4.108
134 2HG GLU 20 1HG GLU 20 3.390 4.272 -3.900
135 H TYR 21 H TYR 21 -0.565 4.739 -1.039
136 HA TYR 21 HA TYR 21 -0.055 2.843 1.032
137 1HB TYR 21 2HB TYR 21 0.203 4.447 2.541
138 2HB TYR 21 1HB TYR 21 -0.590 5.647 1.572
139 HD1 TYR 21 1HD TYR 21 -2.389 6.705 2.737
140 HD2 TYR 21 2HD TYR 21 -1.581 2.557 3.336
141 HE1 TYR 21 1HE TYR 21 -4.353 6.520 4.207
142 HE2 TYR 21 2HE TYR 21 -3.500 2.384 4.823
143 HH TYR 21 HH TYR 21 -5.891 4.779 5.044
144 H LEU 22 H LEU 22 -1.823 3.399 -1.473
145 HA LEU 22 HA LEU 22 -4.338 2.934 -0.293
146 1HB LEU 22 2HB LEU 22 -5.095 2.841 -2.735
147 2HB LEU 22 1HB LEU 22 -4.448 4.354 -2.138
148 HG LEU 22 HG LEU 22 -2.344 3.973 -3.251
149 1HD1 LEU 22 1HD1 LEU 22 -3.521 1.292 -3.898
150 2HD1 LEU 22 2HD1 LEU 22 -1.978 1.664 -3.127
151 3HD1 LEU 22 3HD1 LEU 22 -2.210 1.994 -4.844
152 1HD2 LEU 22 1HD2 LEU 22 -3.099 4.057 -5.567
153 2HD2 LEU 22 2HD2 LEU 22 -4.143 5.021 -4.522
154 3HD2 LEU 22 3HD2 LEU 22 -4.677 3.436 -5.082
155 H ILE 23 H ILE 23 -5.565 1.457 -0.094
156 HA ILE 23 HA ILE 23 -4.705 -1.210 -0.296
157 HB ILE 23 HB ILE 23 -6.830 -1.793 0.637
158 1HG1 ILE 23 2HG1 ILE 23 -8.050 -0.028 -0.848
159 2HG1 ILE 23 1HG1 ILE 23 -8.716 -0.435 0.719
160 1HG2 ILE 23 1HG2 ILE 23 -6.842 -0.231 2.626
161 2HG2 ILE 23 2HG2 ILE 23 -5.591 0.687 1.796
162 3HG2 ILE 23 3HG2 ILE 23 -5.298 -0.991 2.246
163 1HD1 ILE 23 1HD1 ILE 23 -7.372 2.050 -0.178
164 2HD1 ILE 23 2HD1 ILE 23 -7.402 1.634 1.533
165 3HD1 ILE 23 3HD1 ILE 23 -8.910 1.839 0.647
166 H GLU 24 H GLU 24 -5.280 0.573 -2.790
167 HA GLU 24 HA GLU 24 -7.264 -0.850 -4.199
168 1HB GLU 24 2HB GLU 24 -7.039 1.446 -4.652
169 2HB GLU 24 1HB GLU 24 -5.300 1.322 -4.863
170 1HG GLU 24 2HG GLU 24 -5.550 0.248 -6.971
171 2HG GLU 24 1HG GLU 24 -7.279 0.013 -6.718
172 H TRP 25 H TRP 25 -4.638 -2.148 -3.158
173 HA TRP 25 HA TRP 25 -3.556 -3.202 -5.627
174 1HB TRP 25 2HB TRP 25 -2.306 -4.640 -3.677
175 2HB TRP 25 1HB TRP 25 -1.709 -3.116 -4.311
176 HD1 TRP 25 HD TRP 25 -3.957 -4.285 -1.313
177 HE1 TRP 25 1HE TRP 25 -3.388 -2.715 0.706
178 HE3 TRP 25 3HE TRP 25 -0.605 -1.094 -3.524
179 HZ2 TRP 25 2HZ TRP 25 -1.911 -0.541 1.193
180 HZ3 TRP 25 3HZ TRP 25 0.374 0.672 -2.111
181 HH2 TRP 25 HH TRP 25 -0.281 0.982 0.171
182 H LYS 26 H LYS 26 -6.312 -3.746 -4.925
183 HA LYS 26 HA LYS 26 -7.823 -5.415 -4.697
184 1HB LYS 26 2HB LYS 26 -7.382 -7.386 -6.070
185 2HB LYS 26 1HB LYS 26 -6.903 -5.918 -6.910
186 1HG LYS 26 2HG LYS 26 -4.579 -6.344 -6.409
187 2HG LYS 26 1HG LYS 26 -5.019 -7.761 -5.452
188 1HD LYS 26 2HD LYS 26 -5.939 -8.826 -7.454
189 2HD LYS 26 1HD LYS 26 -5.511 -7.405 -8.410
190 1HE LYS 26 2HE LYS 26 -3.150 -7.769 -7.904
191 2HE LYS 26 1HE LYS 26 -3.570 -9.176 -6.927
192 1HZ LYS 26 1HZ LYS 26 -4.071 -8.894 -9.842
193 2HZ LYS 26 2HZ LYS 26 -4.447 -10.249 -8.902
194 3HZ LYS 26 3HZ LYS 26 -2.831 -9.809 -9.142
195 H ASP 27 H ASP 27 -6.074 -5.092 -2.437
196 HA ASP 27 HA ASP 27 -5.702 -6.153 -0.450
197 1HB ASP 27 2HB ASP 27 -7.049 -8.644 -1.436
198 2HB ASP 27 1HB ASP 27 -7.083 -7.924 0.169
199 H GLY 28 H GLY 28 -3.989 -6.516 -2.899
200 1HA GLY 28 2HA GLY 28 -2.894 -8.984 -3.256
201 2HA GLY 28 1HA GLY 28 -1.937 -7.508 -3.257
202 H HIS 29 H HIS 29 -1.392 -6.677 -0.987
203 HA HIS 29 HA HIS 29 -1.005 -8.895 0.854
204 1HB HIS 29 2HB HIS 29 1.037 -7.532 -0.641
205 2HB HIS 29 1HB HIS 29 1.276 -7.214 1.073
206 HD1 HIS 29 1HD HIS 29 2.261 -9.506 -1.423
207 HD2 HIS 29 2HD HIS 29 1.096 -9.898 2.546
208 HE1 HIS 29 1HE HIS 29 3.152 -11.736 -0.679
209 HE2 HIS 29 2HE HIS 29 2.327 -12.004 1.686
210 H SER 30 H SER 30 -2.456 -8.241 2.295
211 HA SER 30 HA SER 30 -3.553 -6.947 3.849
212 1HB SER 30 2HB SER 30 -1.572 -7.917 4.927
213 2HB SER 30 1HB SER 30 -0.666 -6.443 4.535
214 HG SER 30 HG SER 30 -2.452 -6.921 6.554
215 HA PRO 31 HA PRO 31 -4.126 -2.507 2.380
216 1HB PRO 31 2HB PRO 31 -5.083 -2.352 5.155
217 2HB PRO 31 1HB PRO 31 -5.983 -2.100 3.662
218 1HG PRO 31 2HG PRO 31 -5.765 -4.519 5.315
219 2HG PRO 31 1HG PRO 31 -6.952 -4.134 4.069
220 1HD PRO 31 2HD PRO 31 -5.151 -6.049 3.661
221 2HD PRO 31 1HD PRO 31 -5.583 -4.942 2.341
222 H SER 32 H SER 32 -2.356 -1.233 2.476
223 HA SER 32 HA SER 32 -1.034 -0.782 5.002
224 1HB SER 32 2HB SER 32 -0.014 -2.834 4.166
225 2HB SER 32 1HB SER 32 0.509 -1.962 2.714
226 HG SER 32 HG SER 32 2.089 -1.130 3.828
227 H TRP 33 H TRP 33 1.145 0.430 4.552
228 HA TRP 33 HA TRP 33 0.460 2.595 2.708
229 1HB TRP 33 2HB TRP 33 0.802 2.983 5.224
230 2HB TRP 33 1HB TRP 33 2.495 2.593 4.967
231 HD1 TRP 33 HD TRP 33 3.816 4.325 3.220
232 HE1 TRP 33 1HE TRP 33 3.518 6.860 2.987
233 HE3 TRP 33 3HE TRP 33 -0.749 4.851 5.464
234 HZ2 TRP 33 2HZ TRP 33 1.609 8.841 3.642
235 HZ3 TRP 33 3HZ TRP 33 -1.741 7.099 5.610
236 HH2 TRP 33 HH TRP 33 -0.585 9.051 4.703
237 H VAL 34 H VAL 34 1.312 1.676 0.817
238 HA VAL 34 HA VAL 34 4.126 1.940 0.437
239 HB VAL 34 HB VAL 34 3.233 -0.541 1.231
240 1HG1 VAL 34 1HG1 VAL 34 3.295 -0.616 -1.741
241 2HG1 VAL 34 2HG1 VAL 34 2.193 -1.361 -0.616
242 3HG1 VAL 34 3HG1 VAL 34 3.818 -1.986 -0.806
243 1HG2 VAL 34 1HG2 VAL 34 5.739 -0.411 -0.296
244 2HG2 VAL 34 2HG2 VAL 34 5.401 -1.006 1.317
245 3HG2 VAL 34 3HG2 VAL 34 5.520 0.722 1.028
246 HA PRO 35 HA PRO 35 2.677 2.479 -3.777
247 1HB PRO 35 2HB PRO 35 4.756 2.013 -5.258
248 2HB PRO 35 1HB PRO 35 4.916 3.158 -3.921
249 1HG PRO 35 2HG PRO 35 5.749 0.301 -4.079
250 2HG PRO 35 1HG PRO 35 6.637 1.679 -3.428
251 1HD PRO 35 2HD PRO 35 5.100 -0.133 -1.977
252 2HD PRO 35 1HD PRO 35 5.620 1.448 -1.381
253 H SER 36 H SER 36 1.117 1.259 -4.660
254 HA SER 36 HA SER 36 0.206 -0.128 -6.203
255 1HB SER 36 2HB SER 36 2.172 0.278 -7.561
256 2HB SER 36 1HB SER 36 3.046 -0.998 -6.714
257 HG SER 36 HG SER 36 2.204 -2.321 -8.093
258 H SER 37 H SER 37 1.828 -1.405 -3.469
259 HA SER 37 HA SER 37 0.086 -3.674 -3.623
260 1HB SER 37 2HB SER 37 3.055 -4.184 -3.800
261 2HB SER 37 1HB SER 37 1.826 -5.418 -3.538
262 HG SER 37 HG SER 37 0.892 -4.547 -5.579
263 H TYR 38 H TYR 38 3.178 -3.761 -1.954
264 HA TYR 38 HA TYR 38 2.410 -2.879 0.556
265 1HB TYR 38 2HB TYR 38 0.681 -4.490 0.562
266 2HB TYR 38 1HB TYR 38 1.811 -5.759 0.091
267 HD1 TYR 38 1HD TYR 38 0.291 -4.008 2.692
268 HD2 TYR 38 2HD TYR 38 3.674 -6.321 1.785
269 HE1 TYR 38 1HE TYR 38 0.571 -4.426 5.073
270 HE2 TYR 38 2HE TYR 38 4.033 -6.786 4.167
271 HH TYR 38 HH TYR 38 3.439 -5.775 6.354
272 H ILE 39 H ILE 39 4.129 -2.987 1.921
273 HA ILE 39 HA ILE 39 6.083 -5.013 1.801
274 HB ILE 39 HB ILE 39 7.460 -4.347 0.217
275 1HG1 ILE 39 2HG1 ILE 39 8.715 -3.101 1.941
276 2HG1 ILE 39 1HG1 ILE 39 8.886 -2.419 0.340
277 1HG2 ILE 39 1HG2 ILE 39 6.029 -3.490 -1.243
278 2HG2 ILE 39 2HG2 ILE 39 6.942 -2.017 -0.954
279 3HG2 ILE 39 3HG2 ILE 39 5.417 -2.287 -0.137
280 1HD1 ILE 39 1HD1 ILE 39 7.564 -0.561 0.860
281 2HD1 ILE 39 2HD1 ILE 39 8.633 -0.791 2.237
282 3HD1 ILE 39 3HD1 ILE 39 6.954 -1.295 2.338
283 H ALA 40 H ALA 40 4.350 -3.833 3.630
284 HA ALA 40 HA ALA 40 5.682 -1.931 5.280
285 1HB ALA 40 1HB ALA 40 3.483 -3.857 5.988
286 2HB ALA 40 2HB ALA 40 3.273 -2.236 5.329
287 3HB ALA 40 3HB ALA 40 3.975 -2.451 6.931
288 H ALA 41 H ALA 41 7.733 -2.604 5.693
289 HA ALA 41 HA ALA 41 8.431 -3.820 7.985
290 1HB ALA 41 1HB ALA 41 7.484 -5.920 7.509
291 2HB ALA 41 2HB ALA 41 9.207 -6.130 7.200
292 3HB ALA 41 3HB ALA 41 8.090 -5.915 5.853
293 H ASP 42 H ASP 42 9.149 -3.322 4.619
294 HA ASP 42 HA ASP 42 11.995 -3.100 5.322
295 1HB ASP 42 2HB ASP 42 10.771 -4.006 2.715
296 2HB ASP 42 1HB ASP 42 12.482 -3.651 2.929
297 H VAL 43 H VAL 43 10.541 -2.134 2.255
298 HA VAL 43 HA VAL 43 10.207 0.556 2.637
299 HB VAL 43 HB VAL 43 12.520 0.708 3.378
300 1HG1 VAL 43 1HG1 VAL 43 13.405 -1.231 2.181
301 2HG1 VAL 43 2HG1 VAL 43 14.378 0.209 1.884
302 3HG1 VAL 43 3HG1 VAL 43 13.249 -0.361 0.655
303 1HG2 VAL 43 1HG2 VAL 43 11.584 2.612 2.184
304 2HG2 VAL 43 2HG2 VAL 43 12.116 1.926 0.649
305 3HG2 VAL 43 3HG2 VAL 43 13.306 2.448 1.841
306 H VAL 44 H VAL 44 11.391 -1.949 0.484
307 HA VAL 44 HA VAL 44 11.393 -0.680 -1.957
308 HB VAL 44 HB VAL 44 11.097 -2.922 -2.932
309 1HG1 VAL 44 1HG1 VAL 44 12.981 -4.012 -1.839
310 2HG1 VAL 44 2HG1 VAL 44 12.823 -2.915 -0.467
311 3HG1 VAL 44 3HG1 VAL 44 13.274 -2.286 -2.051
312 1HG2 VAL 44 1HG2 VAL 44 10.693 -4.000 -0.165
313 2HG2 VAL 44 2HG2 VAL 44 10.442 -4.804 -1.714
314 3HG2 VAL 44 3HG2 VAL 44 9.325 -3.550 -1.178
315 H SER 45 H SER 45 9.675 -1.859 -3.705
316 HA SER 45 HA SER 45 7.110 -0.600 -3.024
317 1HB SER 45 2HB SER 45 8.085 0.477 -4.875
318 2HB SER 45 1HB SER 45 8.601 -1.040 -5.604
319 HG SER 45 HG SER 45 6.787 -1.040 -6.639
320 H GLU 46 H GLU 46 7.954 -3.546 -2.517
321 HA GLU 46 HA GLU 46 5.435 -4.678 -3.124
322 1HB GLU 46 2HB GLU 46 6.268 -4.764 -5.397
323 2HB GLU 46 1HB GLU 46 7.725 -5.592 -4.864
324 1HG GLU 46 2HG GLU 46 6.405 -7.517 -4.187
325 2HG GLU 46 1HG GLU 46 4.927 -6.686 -4.669
326 H TYR 47 H TYR 47 5.018 -6.468 -1.930
327 HA TYR 47 HA TYR 47 7.225 -7.545 -0.331
328 1HB TYR 47 2HB TYR 47 5.400 -6.604 0.965
329 2HB TYR 47 1HB TYR 47 4.218 -7.620 0.138
330 HD1 TYR 47 1HD TYR 47 7.510 -8.921 1.133
331 HD2 TYR 47 2HD TYR 47 3.407 -8.579 2.211
332 HE1 TYR 47 1HE TYR 47 7.824 -10.649 2.854
333 HE2 TYR 47 2HE TYR 47 3.711 -10.306 3.935
334 HH TYR 47 HH TYR 47 5.217 -12.160 4.441
Start of MODEL 6
1 1H GLY 1 1HT GLY 1 -13.377 -3.165 7.719
2 2H GLY 1 2HT GLY 1 -14.300 -1.982 8.500
3 3H GLY 1 3HT GLY 1 -14.272 -3.564 9.099
4 1HA GLY 1 1HA GLY 1 -12.894 -2.136 10.461
5 2HA GLY 1 2HA GLY 1 -11.935 -3.362 9.645
6 H SER 2 H SER 2 -10.227 -2.719 8.488
7 HA SER 2 HA SER 2 -10.142 -0.090 7.283
8 1HB SER 2 2HB SER 2 -8.175 -0.859 9.454
9 2HB SER 2 1HB SER 2 -8.051 0.569 8.428
10 HG SER 2 HG SER 2 -9.649 0.102 10.611
11 H GLY 3 H GLY 3 -8.658 0.070 5.619
12 1HA GLY 3 2HA GLY 3 -7.132 -0.628 4.044
13 2HA GLY 3 1HA GLY 3 -6.543 -1.791 5.221
14 H GLU 4 H GLU 4 -6.705 -2.390 2.514
15 HA GLU 4 HA GLU 4 -7.412 -4.006 1.094
16 1HB GLU 4 2HB GLU 4 -6.963 -5.636 2.646
17 2HB GLU 4 1HB GLU 4 -8.172 -5.054 3.783
18 1HG GLU 4 2HG GLU 4 -9.939 -6.028 2.468
19 2HG GLU 4 1HG GLU 4 -8.795 -6.505 1.216
20 H VAL 5 H VAL 5 -9.277 -1.692 2.012
21 HA VAL 5 HA VAL 5 -11.914 -2.718 1.483
22 HB VAL 5 HB VAL 5 -11.129 0.189 1.471
23 1HG1 VAL 5 1HG1 VAL 5 -13.675 -1.219 2.275
24 2HG1 VAL 5 2HG1 VAL 5 -13.399 -0.410 0.733
25 3HG1 VAL 5 3HG1 VAL 5 -13.412 0.524 2.229
26 1HG2 VAL 5 1HG2 VAL 5 -11.737 -1.535 3.874
27 2HG2 VAL 5 2HG2 VAL 5 -11.562 0.219 3.889
28 3HG2 VAL 5 3HG2 VAL 5 -10.182 -0.802 3.485
29 H ASN 6 H ASN 6 -9.426 -1.003 -0.305
30 HA ASN 6 HA ASN 6 -9.170 -0.484 -2.502
31 1HB ASN 6 2HB ASN 6 -9.512 -2.932 -2.737
32 2HB ASN 6 1HB ASN 6 -11.241 -2.651 -2.923
33 1HD2 ASN 6 1HD2 ASN 6 -9.150 -3.790 -4.717
34 2HD2 ASN 6 2HD2 ASN 6 -9.304 -2.903 -6.192
35 H LYS 7 H LYS 7 -10.023 1.605 -2.342
36 HA LYS 7 HA LYS 7 -12.510 1.977 -3.770
37 1HB LYS 7 2HB LYS 7 -13.227 3.660 -1.933
38 2HB LYS 7 1HB LYS 7 -13.530 1.947 -1.691
39 1HG LYS 7 2HG LYS 7 -11.177 2.047 -0.473
40 2HG LYS 7 1HG LYS 7 -11.615 3.750 -0.310
41 1HD LYS 7 2HD LYS 7 -13.522 1.570 0.458
42 2HD LYS 7 1HD LYS 7 -12.301 2.173 1.581
43 1HE LYS 7 2HE LYS 7 -14.444 3.812 0.226
44 2HE LYS 7 1HE LYS 7 -14.447 3.293 1.911
45 1HZ LYS 7 1HZ LYS 7 -12.378 4.582 2.214
46 2HZ LYS 7 2HZ LYS 7 -13.702 5.546 1.792
47 3HZ LYS 7 3HZ LYS 7 -12.531 5.168 0.633
48 H ILE 8 H ILE 8 -10.384 3.958 -1.729
49 HA ILE 8 HA ILE 8 -9.662 5.591 -4.045
50 HB ILE 8 HB ILE 8 -11.558 6.700 -2.899
51 1HG1 ILE 8 2HG1 ILE 8 -9.657 7.969 -4.015
52 2HG1 ILE 8 1HG1 ILE 8 -10.618 8.878 -2.856
53 1HG2 ILE 8 1HG2 ILE 8 -11.394 7.492 -0.652
54 2HG2 ILE 8 2HG2 ILE 8 -9.720 6.952 -0.529
55 3HG2 ILE 8 3HG2 ILE 8 -11.020 5.767 -0.650
56 1HD1 ILE 8 1HD1 ILE 8 -7.794 7.997 -2.707
57 2HD1 ILE 8 2HD1 ILE 8 -8.706 8.104 -1.205
58 3HD1 ILE 8 3HD1 ILE 8 -8.534 9.523 -2.234
59 H ILE 9 H ILE 9 -7.483 5.973 -4.048
60 HA ILE 9 HA ILE 9 -6.123 5.634 -1.483
61 HB ILE 9 HB ILE 9 -4.313 4.510 -2.488
62 1HG1 ILE 9 2HG1 ILE 9 -5.587 4.988 -5.194
63 2HG1 ILE 9 1HG1 ILE 9 -4.231 5.917 -4.562
64 1HG2 ILE 9 1HG2 ILE 9 -5.341 2.516 -3.247
65 2HG2 ILE 9 2HG2 ILE 9 -6.738 3.391 -3.869
66 3HG2 ILE 9 3HG2 ILE 9 -6.486 3.261 -2.132
67 1HD1 ILE 9 1HD1 ILE 9 -2.910 3.843 -4.447
68 2HD1 ILE 9 2HD1 ILE 9 -3.430 4.246 -6.083
69 3HD1 ILE 9 3HD1 ILE 9 -4.258 2.979 -5.181
70 H GLY 10 H GLY 10 -4.817 7.085 -0.783
71 1HA GLY 10 2HA GLY 10 -3.422 8.940 -2.550
72 2HA GLY 10 1HA GLY 10 -4.544 9.650 -1.387
73 H SER 11 H SER 11 -1.416 8.319 -1.837
74 HA SER 11 HA SER 11 -0.794 8.804 0.958
75 1HB SER 11 2HB SER 11 -0.050 6.282 -0.412
76 2HB SER 11 1HB SER 11 0.168 6.679 1.286
77 HG SER 11 HG SER 11 -2.279 6.253 -0.084
78 H ARG 12 H ARG 12 1.524 8.267 1.394
79 HA ARG 12 HA ARG 12 3.438 8.700 -0.638
80 1HB ARG 12 2HB ARG 12 4.257 10.922 0.283
81 2HB ARG 12 1HB ARG 12 2.784 10.983 -0.675
82 1HG ARG 12 2HG ARG 12 1.453 11.428 1.153
83 2HG ARG 12 1HG ARG 12 2.608 10.741 2.295
84 1HD ARG 12 2HD ARG 12 2.588 13.137 2.531
85 2HD ARG 12 1HD ARG 12 4.129 12.632 1.839
86 HE ARG 12 HE ARG 12 2.361 13.283 -0.243
87 1HH1 ARG 12 1HH1 ARG 12 4.149 14.794 2.336
88 2HH1 ARG 12 2HH1 ARG 12 4.299 16.314 1.518
89 1HH2 ARG 12 1HH2 ARG 12 2.552 15.284 -1.331
90 2HH2 ARG 12 2HH2 ARG 12 3.392 16.593 -0.566
91 H THR 13 H THR 13 4.680 7.063 0.292
92 HA THR 13 HA THR 13 5.197 7.156 3.100
93 HB THR 13 HB THR 13 6.820 5.284 1.599
94 HG1 THR 13 1HG THR 13 5.134 4.068 0.829
95 1HG2 THR 13 1HG2 THR 13 5.111 5.296 4.026
96 2HG2 THR 13 2HG2 THR 13 6.803 4.835 3.841
97 3HG2 THR 13 3HG2 THR 13 5.527 3.755 3.277
98 H ALA 14 H ALA 14 7.554 6.613 0.518
99 HA ALA 14 HA ALA 14 9.143 8.864 1.508
100 1HB ALA 14 1HB ALA 14 9.794 7.104 3.031
101 2HB ALA 14 2HB ALA 14 11.132 7.505 1.954
102 3HB ALA 14 3HB ALA 14 10.183 6.046 1.675
103 H GLY 15 H GLY 15 9.659 5.916 -0.417
104 1HA GLY 15 2HA GLY 15 9.687 6.289 -2.902
105 2HA GLY 15 1HA GLY 15 10.734 7.663 -2.558
106 H GLU 16 H GLU 16 12.331 6.571 -0.584
107 HA GLU 16 HA GLU 16 14.287 5.219 -2.058
108 1HB GLU 16 2HB GLU 16 15.511 5.096 -0.047
109 2HB GLU 16 1HB GLU 16 14.514 6.533 0.145
110 1HG GLU 16 2HG GLU 16 14.356 5.480 2.198
111 2HG GLU 16 1HG GLU 16 12.874 4.999 1.373
112 H GLY 17 H GLY 17 11.531 4.167 -0.249
113 1HA GLY 17 2HA GLY 17 11.949 1.433 -1.209
114 2HA GLY 17 1HA GLY 17 11.632 1.693 0.503
115 H ALA 18 H ALA 18 9.658 3.207 0.871
116 HA ALA 18 HA ALA 18 7.514 2.224 -0.827
117 1HB ALA 18 1HB ALA 18 7.069 3.255 1.933
118 2HB ALA 18 2HB ALA 18 7.568 1.591 1.646
119 3HB ALA 18 3HB ALA 18 6.032 2.170 0.992
120 H MET 19 H MET 19 5.699 3.663 -1.353
121 HA MET 19 HA MET 19 6.031 6.456 -0.651
122 1HB MET 19 2HB MET 19 7.277 5.556 -2.977
123 2HB MET 19 1HB MET 19 5.821 6.364 -3.542
124 1HG MET 19 2HG MET 19 6.590 8.223 -1.863
125 2HG MET 19 1HG MET 19 8.158 7.463 -2.091
126 1HE MET 19 1HE MET 19 7.845 6.407 -5.065
127 2HE MET 19 2HE MET 19 9.329 7.221 -4.572
128 3HE MET 19 3HE MET 19 8.492 7.726 -6.039
129 H GLU 20 H GLU 20 3.856 4.412 -0.511
130 HA GLU 20 HA GLU 20 1.685 6.056 -1.230
131 1HB GLU 20 2HB GLU 20 2.025 3.476 -2.713
132 2HB GLU 20 1HB GLU 20 0.511 4.341 -2.635
133 1HG GLU 20 2HG GLU 20 1.990 6.303 -3.547
134 2HG GLU 20 1HG GLU 20 3.037 4.976 -4.064
135 H TYR 21 H TYR 21 -0.508 4.584 -0.543
136 HA TYR 21 HA TYR 21 0.223 2.706 1.394
137 1HB TYR 21 2HB TYR 21 0.249 3.752 3.316
138 2HB TYR 21 1HB TYR 21 0.425 5.201 2.371
139 HD1 TYR 21 1HD TYR 21 -0.920 6.949 2.971
140 HD2 TYR 21 2HD TYR 21 -2.320 2.975 3.695
141 HE1 TYR 21 1HE TYR 21 -2.888 7.862 4.113
142 HE2 TYR 21 2HE TYR 21 -4.293 3.897 4.848
143 HH TYR 21 HH TYR 21 -5.177 7.169 4.687
144 H LEU 22 H LEU 22 -2.346 4.281 -0.203
145 HA LEU 22 HA LEU 22 -4.238 2.688 1.312
146 1HB LEU 22 2HB LEU 22 -4.474 4.948 -0.607
147 2HB LEU 22 1HB LEU 22 -5.836 3.869 -0.457
148 HG LEU 22 HG LEU 22 -6.321 5.633 0.979
149 1HD1 LEU 22 1HD1 LEU 22 -5.039 3.599 2.790
150 2HD1 LEU 22 2HD1 LEU 22 -6.598 3.386 1.998
151 3HD1 LEU 22 3HD1 LEU 22 -6.374 4.684 3.170
152 1HD2 LEU 22 1HD2 LEU 22 -4.033 6.588 0.906
153 2HD2 LEU 22 2HD2 LEU 22 -3.564 5.434 2.150
154 3HD2 LEU 22 3HD2 LEU 22 -4.788 6.653 2.498
155 H ILE 23 H ILE 23 -5.351 1.181 0.799
156 HA ILE 23 HA ILE 23 -5.142 -0.957 -0.358
157 HB ILE 23 HB ILE 23 -7.507 -1.049 -1.197
158 1HG1 ILE 23 2HG1 ILE 23 -7.471 1.487 -1.725
159 2HG1 ILE 23 1HG1 ILE 23 -8.921 0.801 -1.007
160 1HG2 ILE 23 1HG2 ILE 23 -8.115 -0.101 1.340
161 2HG2 ILE 23 2HG2 ILE 23 -6.437 -0.644 1.440
162 3HG2 ILE 23 3HG2 ILE 23 -7.691 -1.748 0.878
163 1HD1 ILE 23 1HD1 ILE 23 -8.787 2.165 0.728
164 2HD1 ILE 23 2HD1 ILE 23 -7.490 3.003 -0.117
165 3HD1 ILE 23 3HD1 ILE 23 -7.110 1.722 1.032
166 H GLU 24 H GLU 24 -7.262 -0.169 -2.857
167 HA GLU 24 HA GLU 24 -7.079 -0.609 -5.078
168 1HB GLU 24 2HB GLU 24 -6.263 1.762 -4.854
169 2HB GLU 24 1HB GLU 24 -4.622 1.130 -4.872
170 1HG GLU 24 2HG GLU 24 -4.910 0.298 -7.103
171 2HG GLU 24 1HG GLU 24 -6.623 0.714 -7.082
172 H TRP 25 H TRP 25 -5.612 -2.402 -3.192
173 HA TRP 25 HA TRP 25 -3.878 -3.579 -5.209
174 1HB TRP 25 2HB TRP 25 -2.270 -4.192 -3.296
175 2HB TRP 25 1HB TRP 25 -2.192 -2.594 -4.005
176 HD1 TRP 25 HD TRP 25 -4.436 -3.846 -1.002
177 HE1 TRP 25 1HE TRP 25 -3.902 -2.278 0.999
178 HE3 TRP 25 3HE TRP 25 -0.857 -0.849 -3.115
179 HZ2 TRP 25 2HZ TRP 25 -2.219 -0.168 1.601
180 HZ3 TRP 25 3HZ TRP 25 0.173 0.910 -1.725
181 HH2 TRP 25 HH TRP 25 -0.463 1.212 0.556
182 H LYS 26 H LYS 26 -6.525 -4.266 -4.248
183 HA LYS 26 HA LYS 26 -7.748 -6.048 -3.473
184 1HB LYS 26 2HB LYS 26 -6.767 -6.667 -5.737
185 2HB LYS 26 1HB LYS 26 -5.596 -7.640 -4.858
186 1HG LYS 26 2HG LYS 26 -7.272 -9.132 -5.519
187 2HG LYS 26 1HG LYS 26 -7.584 -8.822 -3.812
188 1HD LYS 26 2HD LYS 26 -9.327 -7.236 -4.389
189 2HD LYS 26 1HD LYS 26 -8.976 -7.447 -6.106
190 1HE LYS 26 2HE LYS 26 -9.572 -9.840 -5.889
191 2HE LYS 26 1HE LYS 26 -10.021 -9.546 -4.210
192 1HZ LYS 26 1HZ LYS 26 -11.275 -8.284 -6.588
193 2HZ LYS 26 2HZ LYS 26 -11.700 -7.978 -4.981
194 3HZ LYS 26 3HZ LYS 26 -11.954 -9.512 -5.644
195 H ASP 27 H ASP 27 -5.683 -5.210 -1.573
196 HA ASP 27 HA ASP 27 -4.535 -5.934 0.267
197 1HB ASP 27 2HB ASP 27 -5.859 -7.314 1.719
198 2HB ASP 27 1HB ASP 27 -6.940 -6.260 0.814
199 H GLY 28 H GLY 28 -3.528 -7.158 -2.156
200 1HA GLY 28 2HA GLY 28 -3.183 -9.881 -2.157
201 2HA GLY 28 1HA GLY 28 -1.917 -8.758 -2.629
202 H HIS 29 H HIS 29 -1.120 -7.578 -0.410
203 HA HIS 29 HA HIS 29 -0.555 -9.663 1.548
204 1HB HIS 29 2HB HIS 29 1.353 -9.156 -0.154
205 2HB HIS 29 1HB HIS 29 1.541 -7.643 0.740
206 HD1 HIS 29 1HD HIS 29 2.143 -11.312 0.976
207 HD2 HIS 29 2HD HIS 29 2.569 -7.930 3.353
208 HE1 HIS 29 1HE HIS 29 3.578 -12.028 2.913
209 HE2 HIS 29 2HE HIS 29 3.767 -9.984 4.373
210 H SER 30 H SER 30 -1.965 -8.798 3.004
211 HA SER 30 HA SER 30 -2.863 -7.350 4.541
212 1HB SER 30 2HB SER 30 -0.733 -8.238 5.502
213 2HB SER 30 1HB SER 30 0.062 -6.748 4.953
214 HG SER 30 HG SER 30 -0.570 -6.019 6.826
215 HA PRO 31 HA PRO 31 -3.350 -3.158 2.526
216 1HB PRO 31 2HB PRO 31 -4.308 -2.570 5.242
217 2HB PRO 31 1HB PRO 31 -5.163 -2.422 3.707
218 1HG PRO 31 2HG PRO 31 -5.293 -4.564 5.654
219 2HG PRO 31 1HG PRO 31 -6.272 -4.331 4.201
220 1HD PRO 31 2HD PRO 31 -4.478 -6.368 4.495
221 2HD PRO 31 1HD PRO 31 -4.908 -5.674 2.913
222 H SER 32 H SER 32 -1.636 -1.768 2.493
223 HA SER 32 HA SER 32 -0.106 -1.494 4.980
224 1HB SER 32 2HB SER 32 0.978 -2.624 2.426
225 2HB SER 32 1HB SER 32 2.020 -1.940 3.675
226 HG SER 32 HG SER 32 0.111 -3.903 4.330
227 H TRP 33 H TRP 33 1.826 -0.033 4.675
228 HA TRP 33 HA TRP 33 1.031 2.160 2.939
229 1HB TRP 33 2HB TRP 33 1.596 2.469 5.448
230 2HB TRP 33 1HB TRP 33 3.281 2.257 4.966
231 HD1 TRP 33 HD TRP 33 3.509 3.920 2.450
232 HE1 TRP 33 1HE TRP 33 3.191 6.473 2.431
233 HE3 TRP 33 3HE TRP 33 0.762 4.410 6.719
234 HZ2 TRP 33 2HZ TRP 33 1.927 8.432 4.012
235 HZ3 TRP 33 3HZ TRP 33 0.024 6.661 7.393
236 HH2 TRP 33 HH TRP 33 0.596 8.628 6.061
237 H VAL 34 H VAL 34 1.734 1.767 1.010
238 HA VAL 34 HA VAL 34 4.497 1.040 0.419
239 HB VAL 34 HB VAL 34 3.743 -1.205 0.567
240 1HG1 VAL 34 1HG1 VAL 34 1.237 -1.518 -0.357
241 2HG1 VAL 34 2HG1 VAL 34 1.181 0.105 0.263
242 3HG1 VAL 34 3HG1 VAL 34 1.650 -1.203 1.319
243 1HG2 VAL 34 1HG2 VAL 34 3.816 -2.027 -1.522
244 2HG2 VAL 34 2HG2 VAL 34 3.913 -0.375 -2.068
245 3HG2 VAL 34 3HG2 VAL 34 2.369 -1.155 -1.979
246 HA PRO 35 HA PRO 35 4.083 3.602 -3.191
247 1HB PRO 35 2HB PRO 35 5.396 1.401 -4.656
248 2HB PRO 35 1HB PRO 35 5.870 3.092 -4.504
249 1HG PRO 35 2HG PRO 35 7.131 1.117 -3.201
250 2HG PRO 35 1HG PRO 35 6.929 2.740 -2.511
251 1HD PRO 35 2HD PRO 35 5.568 0.201 -1.855
252 2HD PRO 35 1HD PRO 35 5.907 1.572 -0.814
253 H SER 36 H SER 36 2.647 0.435 -3.283
254 HA SER 36 HA SER 36 0.648 1.127 -5.066
255 1HB SER 36 2HB SER 36 2.245 1.375 -6.826
256 2HB SER 36 1HB SER 36 3.004 -0.170 -6.440
257 HG SER 36 HG SER 36 0.405 0.255 -7.496
258 H SER 37 H SER 37 2.646 -1.482 -3.813
259 HA SER 37 HA SER 37 0.282 -3.228 -3.986
260 1HB SER 37 2HB SER 37 3.189 -4.052 -3.794
261 2HB SER 37 1HB SER 37 1.816 -5.152 -3.842
262 HG SER 37 HG SER 37 2.994 -3.694 -5.870
263 H TYR 38 H TYR 38 3.075 -3.845 -1.935
264 HA TYR 38 HA TYR 38 2.267 -2.898 0.552
265 1HB TYR 38 2HB TYR 38 1.927 -5.625 1.064
266 2HB TYR 38 1HB TYR 38 0.773 -4.340 1.338
267 HD1 TYR 38 1HD TYR 38 -1.233 -4.635 0.482
268 HD2 TYR 38 2HD TYR 38 2.095 -6.280 -1.554
269 HE1 TYR 38 1HE TYR 38 -2.766 -5.611 -1.216
270 HE2 TYR 38 2HE TYR 38 0.615 -7.281 -3.249
271 HH TYR 38 HH TYR 38 -1.766 -7.973 -3.432
272 H ILE 39 H ILE 39 4.094 -2.797 1.619
273 HA ILE 39 HA ILE 39 6.110 -4.858 1.087
274 HB ILE 39 HB ILE 39 7.695 -3.400 0.259
275 1HG1 ILE 39 2HG1 ILE 39 6.367 -1.164 1.814
276 2HG1 ILE 39 1HG1 ILE 39 7.930 -1.897 2.147
277 1HG2 ILE 39 1HG2 ILE 39 5.327 -1.713 -0.386
278 2HG2 ILE 39 2HG2 ILE 39 5.541 -3.318 -1.088
279 3HG2 ILE 39 3HG2 ILE 39 6.736 -2.037 -1.385
280 1HD1 ILE 39 1HD1 ILE 39 7.174 0.064 0.055
281 2HD1 ILE 39 2HD1 ILE 39 8.498 -1.058 -0.259
282 3HD1 ILE 39 3HD1 ILE 39 8.574 0.031 1.127
283 H ALA 40 H ALA 40 4.316 -4.303 3.292
284 HA ALA 40 HA ALA 40 5.560 -2.959 5.408
285 1HB ALA 40 1HB ALA 40 3.934 -3.994 6.801
286 2HB ALA 40 2HB ALA 40 3.687 -5.296 5.633
287 3HB ALA 40 3HB ALA 40 3.175 -3.653 5.244
288 H ALA 41 H ALA 41 7.694 -3.475 5.566
289 HA ALA 41 HA ALA 41 8.622 -5.227 7.383
290 1HB ALA 41 1HB ALA 41 7.905 -7.183 6.285
291 2HB ALA 41 2HB ALA 41 9.628 -7.076 5.927
292 3HB ALA 41 3HB ALA 41 8.445 -6.598 4.711
293 H ASP 42 H ASP 42 9.503 -4.702 3.985
294 HA ASP 42 HA ASP 42 11.274 -2.671 4.126
295 1HB ASP 42 2HB ASP 42 12.637 -3.756 5.788
296 2HB ASP 42 1HB ASP 42 12.677 -5.253 4.863
297 H VAL 43 H VAL 43 10.199 -2.692 2.033
298 HA VAL 43 HA VAL 43 11.850 -4.038 0.042
299 HB VAL 43 HB VAL 43 9.065 -4.265 -0.768
300 1HG1 VAL 43 1HG1 VAL 43 11.280 -6.292 -0.546
301 2HG1 VAL 43 2HG1 VAL 43 10.975 -5.248 -1.935
302 3HG1 VAL 43 3HG1 VAL 43 9.790 -6.468 -1.472
303 1HG2 VAL 43 1HG2 VAL 43 8.503 -6.218 0.626
304 2HG2 VAL 43 2HG2 VAL 43 8.630 -4.739 1.576
305 3HG2 VAL 43 3HG2 VAL 43 9.940 -5.919 1.603
306 H VAL 44 H VAL 44 10.232 -3.435 -2.203
307 HA VAL 44 HA VAL 44 9.802 -0.563 -1.969
308 HB VAL 44 HB VAL 44 11.145 -0.004 -3.880
309 1HG1 VAL 44 1HG1 VAL 44 13.142 0.030 -2.786
310 2HG1 VAL 44 2HG1 VAL 44 13.051 -1.671 -2.335
311 3HG1 VAL 44 3HG1 VAL 44 12.105 -0.476 -1.451
312 1HG2 VAL 44 1HG2 VAL 44 11.096 -1.816 -5.333
313 2HG2 VAL 44 2HG2 VAL 44 11.540 -2.966 -4.072
314 3HG2 VAL 44 3HG2 VAL 44 12.748 -1.857 -4.720
315 H SER 45 H SER 45 7.708 -0.538 -2.413
316 HA SER 45 HA SER 45 5.810 -0.440 -3.659
317 1HB SER 45 2HB SER 45 7.189 0.622 -5.358
318 2HB SER 45 1HB SER 45 7.709 -0.953 -5.956
319 HG SER 45 HG SER 45 6.006 -0.907 -7.165
320 H GLU 46 H GLU 46 7.168 -3.142 -2.825
321 HA GLU 46 HA GLU 46 4.996 -4.772 -3.527
322 1HB GLU 46 2HB GLU 46 6.778 -4.399 -5.608
323 2HB GLU 46 1HB GLU 46 7.229 -5.974 -4.953
324 1HG GLU 46 2HG GLU 46 4.927 -6.749 -5.208
325 2HG GLU 46 1HG GLU 46 4.466 -5.173 -5.850
326 H TYR 47 H TYR 47 4.906 -6.472 -2.186
327 HA TYR 47 HA TYR 47 6.817 -6.820 -0.147
328 1HB TYR 47 2HB TYR 47 4.454 -7.384 0.158
329 2HB TYR 47 1HB TYR 47 4.596 -8.677 -1.026
330 HD1 TYR 47 1HD TYR 47 5.823 -7.554 2.296
331 HD2 TYR 47 2HD TYR 47 5.278 -10.826 -0.368
332 HE1 TYR 47 1HE TYR 47 6.441 -9.113 4.094
333 HE2 TYR 47 2HE TYR 47 5.895 -12.394 1.422
334 HH TYR 47 HH TYR 47 7.178 -12.369 3.531
Start of MODEL 7
1 1H GLY 1 1HT GLY 1 -5.961 3.409 8.199
2 2H GLY 1 2HT GLY 1 -6.440 4.150 9.641
3 3H GLY 1 3HT GLY 1 -7.328 4.406 8.224
4 1HA GLY 1 1HA GLY 1 -7.053 1.825 9.666
5 2HA GLY 1 2HA GLY 1 -8.474 2.857 9.681
6 H SER 2 H SER 2 -9.285 0.618 8.965
7 HA SER 2 HA SER 2 -10.130 -0.752 7.352
8 1HB SER 2 2HB SER 2 -11.007 0.393 5.350
9 2HB SER 2 1HB SER 2 -11.371 1.293 6.823
10 HG SER 2 HG SER 2 -10.424 2.422 4.860
11 H GLY 3 H GLY 3 -9.885 -1.085 4.714
12 1HA GLY 3 2HA GLY 3 -7.769 -0.785 3.182
13 2HA GLY 3 1HA GLY 3 -7.057 -1.787 4.439
14 H GLU 4 H GLU 4 -7.230 -2.514 1.704
15 HA GLU 4 HA GLU 4 -7.689 -4.344 0.450
16 1HB GLU 4 2HB GLU 4 -7.150 -5.870 2.060
17 2HB GLU 4 1HB GLU 4 -8.335 -5.253 3.203
18 1HG GLU 4 2HG GLU 4 -10.114 -6.411 2.095
19 2HG GLU 4 1HG GLU 4 -9.045 -6.909 0.789
20 H VAL 5 H VAL 5 -9.911 -2.221 1.366
21 HA VAL 5 HA VAL 5 -12.319 -3.625 0.594
22 HB VAL 5 HB VAL 5 -11.887 -0.665 1.030
23 1HG1 VAL 5 1HG1 VAL 5 -14.402 -2.316 0.840
24 2HG1 VAL 5 2HG1 VAL 5 -13.854 -1.085 -0.298
25 3HG1 VAL 5 3HG1 VAL 5 -14.343 -0.624 1.334
26 1HG2 VAL 5 1HG2 VAL 5 -12.935 -1.080 3.239
27 2HG2 VAL 5 2HG2 VAL 5 -11.369 -1.869 3.054
28 3HG2 VAL 5 3HG2 VAL 5 -12.853 -2.812 2.917
29 H ASN 6 H ASN 6 -10.210 -1.147 -0.711
30 HA ASN 6 HA ASN 6 -9.583 -0.696 -2.846
31 1HB ASN 6 2HB ASN 6 -9.967 -2.986 -3.514
32 2HB ASN 6 1HB ASN 6 -11.692 -2.665 -3.725
33 1HD2 ASN 6 1HD2 ASN 6 -8.502 -2.171 -4.991
34 2HD2 ASN 6 2HD2 ASN 6 -8.987 -1.582 -6.542
35 H LYS 7 H LYS 7 -10.343 1.228 -2.030
36 HA LYS 7 HA LYS 7 -12.353 2.453 -3.716
37 1HB LYS 7 2HB LYS 7 -13.586 3.381 -1.815
38 2HB LYS 7 1HB LYS 7 -13.590 1.625 -1.723
39 1HG LYS 7 2HG LYS 7 -11.478 1.992 -0.208
40 2HG LYS 7 1HG LYS 7 -12.170 3.607 -0.013
41 1HD LYS 7 2HD LYS 7 -14.242 2.672 0.809
42 2HD LYS 7 1HD LYS 7 -13.658 1.034 0.504
43 1HE LYS 7 2HE LYS 7 -11.888 1.349 2.152
44 2HE LYS 7 1HE LYS 7 -12.437 3.000 2.440
45 1HZ LYS 7 1HZ LYS 7 -14.052 0.555 2.935
46 2HZ LYS 7 2HZ LYS 7 -14.521 2.145 3.270
47 3HZ LYS 7 3HZ LYS 7 -13.242 1.444 4.125
48 H ILE 8 H ILE 8 -12.232 4.738 -1.618
49 HA ILE 8 HA ILE 8 -10.445 6.485 -2.582
50 HB ILE 8 HB ILE 8 -12.031 6.827 -0.680
51 1HG1 ILE 8 2HG1 ILE 8 -10.237 8.501 -1.247
52 2HG1 ILE 8 1HG1 ILE 8 -10.793 8.558 0.420
53 1HG2 ILE 8 1HG2 ILE 8 -10.089 6.136 1.384
54 2HG2 ILE 8 2HG2 ILE 8 -10.663 4.742 0.466
55 3HG2 ILE 8 3HG2 ILE 8 -11.818 5.795 1.291
56 1HD1 ILE 8 1HD1 ILE 8 -8.150 8.040 -0.641
57 2HD1 ILE 8 2HD1 ILE 8 -8.660 6.828 0.534
58 3HD1 ILE 8 3HD1 ILE 8 -8.649 8.535 0.976
59 H ILE 9 H ILE 9 -8.171 6.907 -2.400
60 HA ILE 9 HA ILE 9 -6.691 5.209 -0.607
61 HB ILE 9 HB ILE 9 -4.972 4.810 -2.496
62 1HG1 ILE 9 2HG1 ILE 9 -6.407 6.238 -4.090
63 2HG1 ILE 9 1HG1 ILE 9 -5.727 4.738 -4.705
64 1HG2 ILE 9 1HG2 ILE 9 -5.777 2.650 -2.819
65 2HG2 ILE 9 2HG2 ILE 9 -7.458 3.147 -2.606
66 3HG2 ILE 9 3HG2 ILE 9 -6.360 3.135 -1.227
67 1HD1 ILE 9 1HD1 ILE 9 -7.961 4.909 -5.482
68 2HD1 ILE 9 2HD1 ILE 9 -8.565 5.247 -3.863
69 3HD1 ILE 9 3HD1 ILE 9 -7.923 3.652 -4.246
70 H GLY 10 H GLY 10 -5.199 6.239 0.427
71 1HA GLY 10 2HA GLY 10 -4.035 8.698 -0.680
72 2HA GLY 10 1HA GLY 10 -4.013 8.218 1.022
73 H SER 11 H SER 11 -1.671 8.861 -0.732
74 HA SER 11 HA SER 11 -0.196 6.463 -0.218
75 1HB SER 11 2HB SER 11 -0.579 5.521 -2.225
76 2HB SER 11 1HB SER 11 -1.285 7.000 -2.856
77 HG SER 11 HG SER 11 0.548 6.559 -4.037
78 H ARG 12 H ARG 12 1.374 7.432 0.902
79 HA ARG 12 HA ARG 12 3.331 8.968 -0.549
80 1HB ARG 12 2HB ARG 12 3.365 10.848 1.076
81 2HB ARG 12 1HB ARG 12 1.890 10.792 0.122
82 1HG ARG 12 2HG ARG 12 0.867 9.538 2.095
83 2HG ARG 12 1HG ARG 12 2.281 10.076 3.004
84 1HD ARG 12 2HD ARG 12 1.741 12.392 2.526
85 2HD ARG 12 1HD ARG 12 0.369 11.890 1.539
86 HE ARG 12 HE ARG 12 0.040 10.798 4.085
87 1HH1 ARG 12 1HH1 ARG 12 0.109 13.922 2.548
88 2HH1 ARG 12 2HH1 ARG 12 -0.958 14.656 3.699
89 1HH2 ARG 12 1HH2 ARG 12 -1.364 11.754 5.608
90 2HH2 ARG 12 2HH2 ARG 12 -1.794 13.423 5.439
91 H THR 13 H THR 13 4.995 7.534 -0.031
92 HA THR 13 HA THR 13 5.275 6.979 2.838
93 HB THR 13 HB THR 13 6.608 5.198 0.886
94 HG1 THR 13 1HG THR 13 4.761 3.932 0.792
95 1HG2 THR 13 1HG2 THR 13 7.137 4.995 3.255
96 2HG2 THR 13 2HG2 THR 13 6.292 3.564 2.664
97 3HG2 THR 13 3HG2 THR 13 5.424 4.771 3.613
98 H ALA 14 H ALA 14 7.712 6.521 0.292
99 HA ALA 14 HA ALA 14 9.357 8.564 1.579
100 1HB ALA 14 1HB ALA 14 10.300 5.712 1.340
101 2HB ALA 14 2HB ALA 14 9.840 6.523 2.837
102 3HB ALA 14 3HB ALA 14 11.247 7.079 1.929
103 H GLY 15 H GLY 15 9.513 5.934 -0.850
104 1HA GLY 15 2HA GLY 15 9.639 6.671 -3.207
105 2HA GLY 15 1HA GLY 15 10.723 7.944 -2.667
106 H GLU 16 H GLU 16 12.309 6.317 -0.913
107 HA GLU 16 HA GLU 16 14.244 5.384 -2.704
108 1HB GLU 16 2HB GLU 16 14.873 5.958 -0.451
109 2HB GLU 16 1HB GLU 16 13.784 4.749 0.216
110 1HG GLU 16 2HG GLU 16 15.153 2.976 -0.743
111 2HG GLU 16 1HG GLU 16 16.240 4.183 -1.430
112 H GLY 17 H GLY 17 11.460 3.887 -1.304
113 1HA GLY 17 2HA GLY 17 11.804 1.585 -3.056
114 2HA GLY 17 1HA GLY 17 11.683 1.258 -1.331
115 H ALA 18 H ALA 18 9.803 2.861 -0.390
116 HA ALA 18 HA ALA 18 7.435 2.244 -1.995
117 1HB ALA 18 1HB ALA 18 7.412 0.888 -0.013
118 2HB ALA 18 2HB ALA 18 6.239 2.189 0.233
119 3HB ALA 18 3HB ALA 18 7.830 2.284 0.989
120 H MET 19 H MET 19 5.816 3.858 -2.184
121 HA MET 19 HA MET 19 6.122 6.314 -0.712
122 1HB MET 19 2HB MET 19 7.371 6.089 -3.184
123 2HB MET 19 1HB MET 19 5.877 6.949 -3.539
124 1HG MET 19 2HG MET 19 6.406 8.623 -1.894
125 2HG MET 19 1HG MET 19 7.847 7.729 -1.426
126 1HE MET 19 1HE MET 19 7.296 9.795 -5.515
127 2HE MET 19 2HE MET 19 6.094 9.821 -4.223
128 3HE MET 19 3HE MET 19 6.447 8.314 -5.070
129 H GLU 20 H GLU 20 4.073 4.261 -0.949
130 HA GLU 20 HA GLU 20 1.842 6.002 -1.527
131 1HB GLU 20 2HB GLU 20 1.834 3.276 -2.726
132 2HB GLU 20 1HB GLU 20 0.798 4.621 -3.126
133 1HG GLU 20 2HG GLU 20 2.889 5.783 -3.991
134 2HG GLU 20 1HG GLU 20 3.699 4.204 -3.852
135 H TYR 21 H TYR 21 -0.335 4.294 -1.063
136 HA TYR 21 HA TYR 21 0.383 2.902 1.271
137 1HB TYR 21 2HB TYR 21 0.468 4.667 2.492
138 2HB TYR 21 1HB TYR 21 -0.483 5.622 1.409
139 HD1 TYR 21 1HD TYR 21 -2.020 6.763 2.885
140 HD2 TYR 21 2HD TYR 21 -1.434 2.547 3.213
141 HE1 TYR 21 1HE TYR 21 -3.918 6.608 4.441
142 HE2 TYR 21 2HE TYR 21 -3.301 2.402 4.782
143 HH TYR 21 HH TYR 21 -5.516 4.936 5.259
144 H LEU 22 H LEU 22 -2.543 4.351 0.142
145 HA LEU 22 HA LEU 22 -3.913 2.231 1.501
146 1HB LEU 22 2HB LEU 22 -4.560 4.705 1.427
147 2HB LEU 22 1HB LEU 22 -5.280 4.307 -0.113
148 HG LEU 22 HG LEU 22 -6.838 2.798 0.910
149 1HD1 LEU 22 1HD1 LEU 22 -5.447 1.761 2.569
150 2HD1 LEU 22 2HD1 LEU 22 -6.842 2.473 3.377
151 3HD1 LEU 22 3HD1 LEU 22 -5.279 3.284 3.441
152 1HD2 LEU 22 1HD2 LEU 22 -7.879 4.362 2.658
153 2HD2 LEU 22 2HD2 LEU 22 -7.693 4.970 1.015
154 3HD2 LEU 22 3HD2 LEU 22 -6.553 5.457 2.268
155 H ILE 23 H ILE 23 -5.608 1.061 0.747
156 HA ILE 23 HA ILE 23 -5.326 -0.934 -0.696
157 HB ILE 23 HB ILE 23 -7.808 0.619 -1.300
158 1HG1 ILE 23 2HG1 ILE 23 -8.386 -1.189 0.682
159 2HG1 ILE 23 1HG1 ILE 23 -6.776 -0.654 1.150
160 1HG2 ILE 23 1HG2 ILE 23 -6.893 -2.212 -1.553
161 2HG2 ILE 23 2HG2 ILE 23 -7.795 -1.226 -2.698
162 3HG2 ILE 23 3HG2 ILE 23 -8.588 -1.867 -1.266
163 1HD1 ILE 23 1HD1 ILE 23 -9.251 0.628 1.569
164 2HD1 ILE 23 2HD1 ILE 23 -8.308 1.629 0.467
165 3HD1 ILE 23 3HD1 ILE 23 -7.638 1.168 2.031
166 H GLU 24 H GLU 24 -7.248 0.577 -3.117
167 HA GLU 24 HA GLU 24 -6.868 0.791 -5.357
168 1HB GLU 24 2HB GLU 24 -4.658 1.973 -4.257
169 2HB GLU 24 1HB GLU 24 -3.918 0.671 -5.176
170 1HG GLU 24 2HG GLU 24 -5.003 1.457 -7.200
171 2HG GLU 24 1HG GLU 24 -5.801 2.737 -6.288
172 H TRP 25 H TRP 25 -4.156 -1.075 -4.035
173 HA TRP 25 HA TRP 25 -4.091 -3.120 -5.862
174 1HB TRP 25 2HB TRP 25 -3.098 -4.419 -3.842
175 2HB TRP 25 1HB TRP 25 -2.256 -3.007 -4.446
176 HD1 TRP 25 HD TRP 25 -4.834 -3.724 -1.536
177 HE1 TRP 25 1HE TRP 25 -4.022 -2.362 0.519
178 HE3 TRP 25 3HE TRP 25 -0.856 -1.227 -3.608
179 HZ2 TRP 25 2HZ TRP 25 -2.048 -0.618 1.161
180 HZ3 TRP 25 3HZ TRP 25 0.419 0.295 -2.134
181 HH2 TRP 25 HH TRP 25 -0.168 0.642 0.150
182 H LYS 26 H LYS 26 -4.368 -5.531 -4.723
183 HA LYS 26 HA LYS 26 -7.231 -5.699 -4.061
184 1HB LYS 26 2HB LYS 26 -5.509 -7.627 -5.633
185 2HB LYS 26 1HB LYS 26 -7.158 -7.964 -5.124
186 1HG LYS 26 2HG LYS 26 -7.340 -7.291 -7.351
187 2HG LYS 26 1HG LYS 26 -7.812 -5.871 -6.416
188 1HD LYS 26 2HD LYS 26 -5.619 -4.894 -6.733
189 2HD LYS 26 1HD LYS 26 -5.064 -6.345 -7.568
190 1HE LYS 26 2HE LYS 26 -5.596 -4.633 -9.184
191 2HE LYS 26 1HE LYS 26 -6.761 -5.949 -9.313
192 1HZ LYS 26 1HZ LYS 26 -8.309 -4.625 -7.976
193 2HZ LYS 26 2HZ LYS 26 -7.881 -3.834 -9.409
194 3HZ LYS 26 3HZ LYS 26 -7.195 -3.351 -7.940
195 H ASP 27 H ASP 27 -5.812 -5.288 -1.950
196 HA ASP 27 HA ASP 27 -4.894 -6.076 -0.002
197 1HB ASP 27 2HB ASP 27 -6.272 -7.777 1.067
198 2HB ASP 27 1HB ASP 27 -7.270 -6.609 0.211
199 H GLY 28 H GLY 28 -3.457 -7.003 -2.329
200 1HA GLY 28 2HA GLY 28 -2.852 -9.680 -2.425
201 2HA GLY 28 1HA GLY 28 -1.675 -8.418 -2.723
202 H HIS 29 H HIS 29 -1.096 -7.298 -0.363
203 HA HIS 29 HA HIS 29 -0.568 -9.537 1.448
204 1HB HIS 29 2HB HIS 29 1.464 -9.110 0.059
205 2HB HIS 29 1HB HIS 29 1.525 -7.458 0.682
206 HD1 HIS 29 1HD HIS 29 2.571 -7.117 2.947
207 HD2 HIS 29 2HD HIS 29 2.027 -11.132 2.022
208 HE1 HIS 29 1HE HIS 29 3.789 -8.391 4.739
209 HE2 HIS 29 2HE HIS 29 3.453 -10.819 4.157
210 H SER 30 H SER 30 -2.022 -8.877 2.955
211 HA SER 30 HA SER 30 -2.987 -7.575 4.597
212 1HB SER 30 2HB SER 30 -0.839 -8.392 5.552
213 2HB SER 30 1HB SER 30 -0.076 -6.880 5.019
214 HG SER 30 HG SER 30 -1.532 -7.364 7.238
215 HA PRO 31 HA PRO 31 -3.578 -3.448 2.480
216 1HB PRO 31 2HB PRO 31 -4.900 -2.921 5.049
217 2HB PRO 31 1HB PRO 31 -5.576 -2.869 3.420
218 1HG PRO 31 2HG PRO 31 -5.699 -5.013 5.384
219 2HG PRO 31 1HG PRO 31 -6.580 -4.849 3.861
220 1HD PRO 31 2HD PRO 31 -4.686 -6.745 4.253
221 2HD PRO 31 1HD PRO 31 -4.983 -6.016 2.662
222 H SER 32 H SER 32 -1.863 -2.123 2.578
223 HA SER 32 HA SER 32 -0.646 -1.618 5.217
224 1HB SER 32 2HB SER 32 0.541 -3.443 3.921
225 2HB SER 32 1HB SER 32 0.942 -2.209 2.713
226 HG SER 32 HG SER 32 1.629 -2.090 5.473
227 H TRP 33 H TRP 33 1.509 -0.191 4.434
228 HA TRP 33 HA TRP 33 0.455 2.073 2.852
229 1HB TRP 33 2HB TRP 33 0.779 2.540 5.340
230 2HB TRP 33 1HB TRP 33 2.480 2.145 5.141
231 HD1 TRP 33 HD TRP 33 3.730 3.788 3.141
232 HE1 TRP 33 1HE TRP 33 3.470 6.327 2.869
233 HE3 TRP 33 3HE TRP 33 -0.582 4.492 5.826
234 HZ2 TRP 33 2HZ TRP 33 1.683 8.362 3.663
235 HZ3 TRP 33 3HZ TRP 33 -1.493 6.775 6.005
236 HH2 TRP 33 HH TRP 33 -0.381 8.668 4.918
237 H VAL 34 H VAL 34 1.279 1.302 0.973
238 HA VAL 34 HA VAL 34 4.075 1.643 0.549
239 HB VAL 34 HB VAL 34 3.017 -1.010 1.020
240 1HG1 VAL 34 1HG1 VAL 34 3.789 -2.278 -0.722
241 2HG1 VAL 34 2HG1 VAL 34 4.576 -0.952 -1.518
242 3HG1 VAL 34 3HG1 VAL 34 2.818 -1.028 -1.474
243 1HG2 VAL 34 1HG2 VAL 34 5.184 0.443 1.652
244 2HG2 VAL 34 2HG2 VAL 34 5.855 -0.613 0.415
245 3HG2 VAL 34 3HG2 VAL 34 5.072 -1.301 1.836
246 HA PRO 35 HA PRO 35 3.075 2.476 -3.726
247 1HB PRO 35 2HB PRO 35 5.013 1.180 -5.041
248 2HB PRO 35 1HB PRO 35 5.328 2.635 -4.071
249 1HG PRO 35 2HG PRO 35 5.477 -0.251 -3.215
250 2HG PRO 35 1HG PRO 35 6.772 0.973 -3.160
251 1HD PRO 35 2HD PRO 35 5.409 0.578 -0.995
252 2HD PRO 35 1HD PRO 35 5.566 2.237 -1.546
253 H SER 36 H SER 36 1.193 1.595 -4.383
254 HA SER 36 HA SER 36 -0.255 0.064 -5.318
255 1HB SER 36 2HB SER 36 0.819 0.962 -7.272
256 2HB SER 36 1HB SER 36 2.215 -0.098 -7.055
257 HG SER 36 HG SER 36 0.889 -0.987 -8.617
258 H SER 37 H SER 37 1.363 -1.076 -3.171
259 HA SER 37 HA SER 37 0.797 -3.809 -3.679
260 1HB SER 37 2HB SER 37 3.706 -3.326 -3.128
261 2HB SER 37 1HB SER 37 2.925 -4.735 -3.837
262 HG SER 37 HG SER 37 4.086 -2.785 -5.122
263 H TYR 38 H TYR 38 3.153 -4.267 -1.603
264 HA TYR 38 HA TYR 38 2.425 -3.022 0.809
265 1HB TYR 38 2HB TYR 38 1.593 -5.658 1.371
266 2HB TYR 38 1HB TYR 38 0.640 -4.193 1.496
267 HD1 TYR 38 1HD TYR 38 -1.395 -4.353 0.518
268 HD2 TYR 38 2HD TYR 38 1.889 -6.340 -1.302
269 HE1 TYR 38 1HE TYR 38 -2.900 -5.200 -1.250
270 HE2 TYR 38 2HE TYR 38 0.397 -7.178 -3.084
271 HH TYR 38 HH TYR 38 -3.038 -6.330 -3.186
272 H ILE 39 H ILE 39 4.468 -2.970 1.274
273 HA ILE 39 HA ILE 39 5.981 -5.458 1.366
274 HB ILE 39 HB ILE 39 7.349 -4.740 -0.239
275 1HG1 ILE 39 2HG1 ILE 39 8.758 -3.658 1.495
276 2HG1 ILE 39 1HG1 ILE 39 8.833 -2.844 -0.052
277 1HG2 ILE 39 1HG2 ILE 39 5.561 -3.721 -1.308
278 2HG2 ILE 39 2HG2 ILE 39 6.882 -2.541 -1.391
279 3HG2 ILE 39 3HG2 ILE 39 5.596 -2.351 -0.208
280 1HD1 ILE 39 1HD1 ILE 39 6.911 -1.843 1.981
281 2HD1 ILE 39 2HD1 ILE 39 7.756 -0.981 0.704
282 3HD1 ILE 39 3HD1 ILE 39 8.624 -1.481 2.153
283 H ALA 40 H ALA 40 4.472 -4.202 3.389
284 HA ALA 40 HA ALA 40 6.023 -2.584 5.103
285 1HB ALA 40 1HB ALA 40 3.704 -4.406 5.649
286 2HB ALA 40 2HB ALA 40 3.695 -2.654 5.446
287 3HB ALA 40 3HB ALA 40 4.437 -3.371 6.873
288 H ALA 41 H ALA 41 8.059 -3.351 5.348
289 HA ALA 41 HA ALA 41 8.788 -4.860 7.473
290 1HB ALA 41 1HB ALA 41 8.415 -6.620 5.060
291 2HB ALA 41 2HB ALA 41 7.798 -6.857 6.696
292 3HB ALA 41 3HB ALA 41 9.521 -7.036 6.369
293 H ASP 42 H ASP 42 9.427 -3.994 4.159
294 HA ASP 42 HA ASP 42 12.264 -3.702 4.856
295 1HB ASP 42 2HB ASP 42 12.052 -5.527 3.292
296 2HB ASP 42 1HB ASP 42 11.088 -4.537 2.202
297 H VAL 43 H VAL 43 10.745 -2.674 1.838
298 HA VAL 43 HA VAL 43 10.240 -0.037 2.372
299 HB VAL 43 HB VAL 43 12.594 0.162 3.073
300 1HG1 VAL 43 1HG1 VAL 43 14.313 0.151 1.202
301 2HG1 VAL 43 2HG1 VAL 43 13.121 -0.746 0.261
302 3HG1 VAL 43 3HG1 VAL 43 13.742 -1.417 1.770
303 1HG2 VAL 43 1HG2 VAL 43 13.130 2.148 1.775
304 2HG2 VAL 43 2HG2 VAL 43 11.408 2.097 2.155
305 3HG2 VAL 43 3HG2 VAL 43 11.967 1.668 0.539
306 H VAL 44 H VAL 44 11.514 -2.350 0.044
307 HA VAL 44 HA VAL 44 11.359 -0.888 -2.301
308 HB VAL 44 HB VAL 44 11.249 -3.002 -3.476
309 1HG1 VAL 44 1HG1 VAL 44 13.160 -4.117 -2.523
310 2HG1 VAL 44 2HG1 VAL 44 12.891 -3.313 -0.978
311 3HG1 VAL 44 3HG1 VAL 44 13.358 -2.369 -2.391
312 1HG2 VAL 44 1HG2 VAL 44 9.634 -4.332 -2.534
313 2HG2 VAL 44 2HG2 VAL 44 10.157 -3.984 -0.888
314 3HG2 VAL 44 3HG2 VAL 44 11.089 -5.092 -1.892
315 H SER 45 H SER 45 9.622 -2.104 -4.067
316 HA SER 45 HA SER 45 7.083 -1.021 -3.124
317 1HB SER 45 2HB SER 45 7.857 0.233 -4.983
318 2HB SER 45 1HB SER 45 8.246 -1.226 -5.894
319 HG SER 45 HG SER 45 5.602 -0.824 -5.068
320 H GLU 46 H GLU 46 7.802 -3.754 -2.547
321 HA GLU 46 HA GLU 46 5.399 -5.026 -3.203
322 1HB GLU 46 2HB GLU 46 6.435 -5.101 -5.476
323 2HB GLU 46 1HB GLU 46 7.746 -6.061 -4.807
324 1HG GLU 46 2HG GLU 46 6.126 -7.795 -4.171
325 2HG GLU 46 1HG GLU 46 4.841 -6.840 -4.908
326 H TYR 47 H TYR 47 5.171 -7.041 -2.190
327 HA TYR 47 HA TYR 47 6.895 -7.434 0.034
328 1HB TYR 47 2HB TYR 47 4.405 -7.932 -0.048
329 2HB TYR 47 1HB TYR 47 4.817 -9.384 -0.957
330 HD1 TYR 47 1HD TYR 47 6.475 -7.801 1.989
331 HD2 TYR 47 2HD TYR 47 4.422 -11.184 0.428
332 HE1 TYR 47 1HE TYR 47 6.871 -9.004 4.098
333 HE2 TYR 47 2HE TYR 47 4.814 -12.400 2.532
334 HH TYR 47 HH TYR 47 5.913 -10.866 5.362
Start of MODEL 8
1 1H GLY 1 1HT GLY 1 -6.279 -2.023 11.706
2 2H GLY 1 2HT GLY 1 -5.639 -0.497 12.058
3 3H GLY 1 3HT GLY 1 -5.274 -1.247 10.587
4 1HA GLY 1 1HA GLY 1 -7.956 -0.301 11.439
5 2HA GLY 1 2HA GLY 1 -6.913 0.500 10.274
6 H SER 2 H SER 2 -9.338 -0.026 9.382
7 HA SER 2 HA SER 2 -9.645 -2.618 8.231
8 1HB SER 2 2HB SER 2 -11.543 -1.625 7.021
9 2HB SER 2 1HB SER 2 -11.581 -1.185 8.729
10 HG SER 2 HG SER 2 -11.399 0.408 6.550
11 H GLY 3 H GLY 3 -10.241 -2.479 5.669
12 1HA GLY 3 2HA GLY 3 -9.095 -1.034 3.770
13 2HA GLY 3 1HA GLY 3 -7.682 -1.805 4.455
14 H GLU 4 H GLU 4 -7.329 -2.764 2.328
15 HA GLU 4 HA GLU 4 -7.410 -4.461 0.847
16 1HB GLU 4 2HB GLU 4 -7.169 -6.296 2.028
17 2HB GLU 4 1HB GLU 4 -7.963 -5.544 3.397
18 1HG GLU 4 2HG GLU 4 -9.334 -7.128 1.227
19 2HG GLU 4 1HG GLU 4 -8.951 -7.701 2.844
20 H VAL 5 H VAL 5 -9.975 -2.643 1.378
21 HA VAL 5 HA VAL 5 -12.009 -4.147 0.007
22 HB VAL 5 HB VAL 5 -11.991 -1.186 0.605
23 1HG1 VAL 5 1HG1 VAL 5 -13.754 -1.811 -0.875
24 2HG1 VAL 5 2HG1 VAL 5 -14.479 -1.610 0.721
25 3HG1 VAL 5 3HG1 VAL 5 -14.161 -3.227 0.092
26 1HG2 VAL 5 1HG2 VAL 5 -11.488 -2.429 2.663
27 2HG2 VAL 5 2HG2 VAL 5 -12.917 -3.432 2.412
28 3HG2 VAL 5 3HG2 VAL 5 -13.095 -1.705 2.726
29 H ASN 6 H ASN 6 -10.101 -1.253 -0.551
30 HA ASN 6 HA ASN 6 -9.050 -0.511 -2.477
31 1HB ASN 6 2HB ASN 6 -9.279 -2.696 -3.604
32 2HB ASN 6 1HB ASN 6 -10.949 -2.305 -4.018
33 1HD2 ASN 6 1HD2 ASN 6 -8.151 -2.648 -5.396
34 2HD2 ASN 6 2HD2 ASN 6 -8.191 -1.396 -6.588
35 H LYS 7 H LYS 7 -10.220 1.214 -1.357
36 HA LYS 7 HA LYS 7 -12.121 2.508 -3.123
37 1HB LYS 7 2HB LYS 7 -13.746 2.789 -1.333
38 2HB LYS 7 1HB LYS 7 -13.392 1.074 -1.512
39 1HG LYS 7 2HG LYS 7 -11.605 1.492 0.331
40 2HG LYS 7 1HG LYS 7 -12.555 2.947 0.657
41 1HD LYS 7 2HD LYS 7 -14.551 1.620 1.025
42 2HD LYS 7 1HD LYS 7 -13.665 0.150 0.625
43 1HE LYS 7 2HE LYS 7 -13.935 0.493 3.062
44 2HE LYS 7 1HE LYS 7 -12.249 0.414 2.552
45 1HZ LYS 7 1HZ LYS 7 -13.706 2.964 2.961
46 2HZ LYS 7 2HZ LYS 7 -12.042 2.752 2.743
47 3HZ LYS 7 3HZ LYS 7 -12.783 2.217 4.166
48 H ILE 8 H ILE 8 -12.727 4.287 -0.719
49 HA ILE 8 HA ILE 8 -11.063 6.389 -1.083
50 HB ILE 8 HB ILE 8 -13.203 6.233 0.189
51 1HG1 ILE 8 2HG1 ILE 8 -11.813 8.288 0.114
52 2HG1 ILE 8 1HG1 ILE 8 -12.726 8.145 1.613
53 1HG2 ILE 8 1HG2 ILE 8 -13.408 5.373 2.256
54 2HG2 ILE 8 2HG2 ILE 8 -11.788 5.872 2.740
55 3HG2 ILE 8 3HG2 ILE 8 -12.005 4.426 1.754
56 1HD1 ILE 8 1HD1 ILE 8 -10.621 7.168 2.628
57 2HD1 ILE 8 2HD1 ILE 8 -10.593 8.885 2.230
58 3HD1 ILE 8 3HD1 ILE 8 -9.789 7.725 1.175
59 H ILE 9 H ILE 9 -8.869 6.172 -1.095
60 HA ILE 9 HA ILE 9 -7.635 5.759 1.457
61 HB ILE 9 HB ILE 9 -7.973 3.493 0.567
62 1HG1 ILE 9 2HG1 ILE 9 -5.847 2.667 1.241
63 2HG1 ILE 9 1HG1 ILE 9 -5.061 4.179 0.866
64 1HG2 ILE 9 1HG2 ILE 9 -7.748 3.527 -1.684
65 2HG2 ILE 9 2HG2 ILE 9 -6.240 2.787 -1.173
66 3HG2 ILE 9 3HG2 ILE 9 -6.270 4.487 -1.641
67 1HD1 ILE 9 1HD1 ILE 9 -7.265 4.234 2.833
68 2HD1 ILE 9 2HD1 ILE 9 -5.766 5.161 2.787
69 3HD1 ILE 9 3HD1 ILE 9 -5.750 3.481 3.322
70 H GLY 10 H GLY 10 -5.072 5.929 1.161
71 1HA GLY 10 2HA GLY 10 -4.583 8.076 -0.770
72 2HA GLY 10 1HA GLY 10 -4.190 8.304 0.927
73 H SER 11 H SER 11 -2.161 8.657 -0.776
74 HA SER 11 HA SER 11 -0.479 6.382 -0.212
75 1HB SER 11 2HB SER 11 0.287 6.504 -2.713
76 2HB SER 11 1HB SER 11 -1.162 5.588 -2.301
77 HG SER 11 HG SER 11 -1.117 7.329 -4.089
78 H ARG 12 H ARG 12 1.034 7.485 0.941
79 HA ARG 12 HA ARG 12 2.838 9.179 -0.550
80 1HB ARG 12 2HB ARG 12 0.949 10.307 1.415
81 2HB ARG 12 1HB ARG 12 2.621 10.823 1.599
82 1HG ARG 12 2HG ARG 12 1.021 11.036 -0.944
83 2HG ARG 12 1HG ARG 12 1.289 12.349 0.202
84 1HD ARG 12 2HD ARG 12 3.705 12.164 -0.159
85 2HD ARG 12 1HD ARG 12 3.431 10.862 -1.315
86 HE ARG 12 HE ARG 12 1.947 13.002 -2.217
87 1HH1 ARG 12 1HH1 ARG 12 5.298 12.333 -1.553
88 2HH1 ARG 12 2HH1 ARG 12 5.891 13.424 -2.761
89 1HH2 ARG 12 1HH2 ARG 12 2.717 14.443 -3.813
90 2HH2 ARG 12 2HH2 ARG 12 4.423 14.627 -4.043
91 H THR 13 H THR 13 4.675 7.911 -0.060
92 HA THR 13 HA THR 13 5.203 7.699 2.817
93 HB THR 13 HB THR 13 6.429 5.594 1.180
94 HG1 THR 13 1HG THR 13 4.575 4.445 0.955
95 1HG2 THR 13 1HG2 THR 13 6.846 5.637 3.532
96 2HG2 THR 13 2HG2 THR 13 5.792 4.266 3.184
97 3HG2 THR 13 3HG2 THR 13 5.120 5.741 3.878
98 H ALA 14 H ALA 14 7.391 6.751 0.172
99 HA ALA 14 HA ALA 14 9.116 9.011 0.831
100 1HB ALA 14 1HB ALA 14 11.062 7.601 1.203
101 2HB ALA 14 2HB ALA 14 10.067 6.159 1.012
102 3HB ALA 14 3HB ALA 14 9.792 7.246 2.373
103 H GLY 15 H GLY 15 9.244 5.945 -1.025
104 1HA GLY 15 2HA GLY 15 9.012 6.248 -3.507
105 2HA GLY 15 1HA GLY 15 10.152 7.570 -3.331
106 H GLU 16 H GLU 16 12.043 6.502 -1.672
107 HA GLU 16 HA GLU 16 13.643 5.020 -3.421
108 1HB GLU 16 2HB GLU 16 14.670 6.310 -1.690
109 2HB GLU 16 1HB GLU 16 13.788 5.447 -0.435
110 1HG GLU 16 2HG GLU 16 15.040 3.405 -0.993
111 2HG GLU 16 1HG GLU 16 15.940 4.308 -2.211
112 H GLY 17 H GLY 17 11.240 4.041 -1.141
113 1HA GLY 17 2HA GLY 17 11.634 1.251 -1.940
114 2HA GLY 17 1HA GLY 17 11.555 1.637 -0.224
115 H ALA 18 H ALA 18 9.618 3.388 0.069
116 HA ALA 18 HA ALA 18 7.274 2.277 -1.261
117 1HB ALA 18 1HB ALA 18 6.009 2.402 0.843
118 2HB ALA 18 2HB ALA 18 7.493 2.875 1.675
119 3HB ALA 18 3HB ALA 18 7.361 1.268 0.950
120 H MET 19 H MET 19 5.488 3.775 -1.498
121 HA MET 19 HA MET 19 5.802 6.473 -0.574
122 1HB MET 19 2HB MET 19 7.250 5.924 -2.803
123 2HB MET 19 1HB MET 19 5.743 6.480 -3.514
124 1HG MET 19 2HG MET 19 7.087 8.058 -1.371
125 2HG MET 19 1HG MET 19 7.621 8.175 -3.043
126 1HE MET 19 1HE MET 19 5.180 7.979 -4.796
127 2HE MET 19 2HE MET 19 6.256 9.365 -4.963
128 3HE MET 19 3HE MET 19 4.513 9.609 -4.861
129 H GLU 20 H GLU 20 3.768 4.276 -0.801
130 HA GLU 20 HA GLU 20 1.577 6.040 -1.452
131 1HB GLU 20 2HB GLU 20 1.499 3.306 -2.624
132 2HB GLU 20 1HB GLU 20 0.540 4.679 -3.061
133 1HG GLU 20 2HG GLU 20 3.498 4.509 -3.548
134 2HG GLU 20 1HG GLU 20 2.296 3.956 -4.713
135 H TYR 21 H TYR 21 -0.578 4.580 -0.943
136 HA TYR 21 HA TYR 21 -0.108 2.718 1.166
137 1HB TYR 21 2HB TYR 21 0.109 4.358 2.649
138 2HB TYR 21 1HB TYR 21 -0.683 5.531 1.645
139 HD1 TYR 21 1HD TYR 21 -2.521 6.564 2.728
140 HD2 TYR 21 2HD TYR 21 -1.657 2.454 3.456
141 HE1 TYR 21 1HE TYR 21 -4.511 6.389 4.164
142 HE2 TYR 21 2HE TYR 21 -3.606 2.285 4.909
143 HH TYR 21 HH TYR 21 -5.047 3.775 6.255
144 H LEU 22 H LEU 22 -1.842 3.310 -1.387
145 HA LEU 22 HA LEU 22 -4.348 2.831 -0.246
146 1HB LEU 22 2HB LEU 22 -5.085 2.810 -2.701
147 2HB LEU 22 1HB LEU 22 -4.447 4.301 -2.034
148 HG LEU 22 HG LEU 22 -2.351 4.001 -3.143
149 1HD1 LEU 22 1HD1 LEU 22 -1.955 1.679 -2.961
150 2HD1 LEU 22 2HD1 LEU 22 -2.049 2.032 -4.687
151 3HD1 LEU 22 3HD1 LEU 22 -3.417 1.286 -3.864
152 1HD2 LEU 22 1HD2 LEU 22 -4.134 4.985 -4.467
153 2HD2 LEU 22 2HD2 LEU 22 -4.643 3.383 -5.003
154 3HD2 LEU 22 3HD2 LEU 22 -3.070 4.016 -5.488
155 H ILE 23 H ILE 23 -5.583 1.412 -0.064
156 HA ILE 23 HA ILE 23 -4.944 -1.285 -0.157
157 HB ILE 23 HB ILE 23 -7.354 0.404 0.326
158 1HG1 ILE 23 2HG1 ILE 23 -7.207 -0.848 2.537
159 2HG1 ILE 23 1HG1 ILE 23 -5.669 -1.473 1.959
160 1HG2 ILE 23 1HG2 ILE 23 -7.466 -2.586 0.368
161 2HG2 ILE 23 2HG2 ILE 23 -8.203 -1.560 -0.860
162 3HG2 ILE 23 3HG2 ILE 23 -8.740 -1.454 0.811
163 1HD1 ILE 23 1HD1 ILE 23 -6.405 1.371 2.544
164 2HD1 ILE 23 2HD1 ILE 23 -4.928 0.908 1.698
165 3HD1 ILE 23 3HD1 ILE 23 -5.205 0.367 3.353
166 H GLU 24 H GLU 24 -5.764 0.830 -2.637
167 HA GLU 24 HA GLU 24 -7.385 -0.411 -4.355
168 1HB GLU 24 2HB GLU 24 -6.175 1.790 -4.573
169 2HB GLU 24 1HB GLU 24 -4.790 0.878 -5.157
170 1HG GLU 24 2HG GLU 24 -6.135 0.025 -7.018
171 2HG GLU 24 1HG GLU 24 -7.511 0.965 -6.443
172 H TRP 25 H TRP 25 -4.401 -1.724 -3.249
173 HA TRP 25 HA TRP 25 -3.787 -3.321 -5.493
174 1HB TRP 25 2HB TRP 25 -2.600 -4.730 -3.557
175 2HB TRP 25 1HB TRP 25 -1.944 -3.230 -4.187
176 HD1 TRP 25 HD TRP 25 -4.224 -4.308 -1.166
177 HE1 TRP 25 1HE TRP 25 -3.580 -2.767 0.840
178 HE3 TRP 25 3HE TRP 25 -0.693 -1.280 -3.386
179 HZ2 TRP 25 2HZ TRP 25 -2.016 -0.636 1.333
180 HZ3 TRP 25 3HZ TRP 25 0.347 0.462 -1.971
181 HH2 TRP 25 HH TRP 25 -0.306 0.803 0.310
182 H LYS 26 H LYS 26 -6.640 -3.629 -4.605
183 HA LYS 26 HA LYS 26 -8.201 -5.241 -4.338
184 1HB LYS 26 2HB LYS 26 -6.170 -6.965 -5.753
185 2HB LYS 26 1HB LYS 26 -7.917 -7.166 -5.748
186 1HG LYS 26 2HG LYS 26 -8.216 -5.190 -7.057
187 2HG LYS 26 1HG LYS 26 -6.507 -4.776 -6.912
188 1HD LYS 26 2HD LYS 26 -5.954 -6.874 -8.125
189 2HD LYS 26 1HD LYS 26 -7.682 -7.151 -8.358
190 1HE LYS 26 2HE LYS 26 -6.151 -4.740 -9.331
191 2HE LYS 26 1HE LYS 26 -6.612 -6.122 -10.325
192 1HZ LYS 26 1HZ LYS 26 -8.148 -4.253 -10.563
193 2HZ LYS 26 2HZ LYS 26 -8.512 -4.328 -8.912
194 3HZ LYS 26 3HZ LYS 26 -8.926 -5.616 -9.928
195 H ASP 27 H ASP 27 -6.394 -4.990 -2.100
196 HA ASP 27 HA ASP 27 -5.940 -6.080 -0.147
197 1HB ASP 27 2HB ASP 27 -8.271 -6.865 -0.353
198 2HB ASP 27 1HB ASP 27 -7.719 -8.231 -1.313
199 H GLY 28 H GLY 28 -4.360 -6.514 -2.655
200 1HA GLY 28 2HA GLY 28 -3.437 -9.060 -3.044
201 2HA GLY 28 1HA GLY 28 -2.397 -7.643 -3.116
202 H HIS 29 H HIS 29 -1.815 -6.782 -0.839
203 HA HIS 29 HA HIS 29 -1.419 -9.007 1.004
204 1HB HIS 29 2HB HIS 29 0.950 -7.246 0.855
205 2HB HIS 29 1HB HIS 29 0.835 -8.988 1.034
206 HD1 HIS 29 1HD HIS 29 0.998 -6.320 -1.601
207 HD2 HIS 29 2HD HIS 29 1.088 -10.463 -1.294
208 HE1 HIS 29 1HE HIS 29 1.707 -7.148 -3.869
209 HE2 HIS 29 2HE HIS 29 1.748 -9.659 -3.661
210 H SER 30 H SER 30 -2.750 -8.263 2.521
211 HA SER 30 HA SER 30 -3.637 -6.910 4.155
212 1HB SER 30 2HB SER 30 -0.696 -6.463 4.589
213 2HB SER 30 1HB SER 30 -1.973 -6.321 5.808
214 HG SER 30 HG SER 30 -0.752 -8.568 4.789
215 HA PRO 31 HA PRO 31 -4.165 -2.551 2.544
216 1HB PRO 31 2HB PRO 31 -5.134 -2.209 5.271
217 2HB PRO 31 1HB PRO 31 -6.024 -2.106 3.758
218 1HG PRO 31 2HG PRO 31 -5.786 -4.365 5.622
219 2HG PRO 31 1HG PRO 31 -7.014 -4.064 4.389
220 1HD PRO 31 2HD PRO 31 -5.232 -6.019 4.083
221 2HD PRO 31 1HD PRO 31 -5.722 -5.030 2.687
222 H SER 32 H SER 32 -2.394 -1.309 2.622
223 HA SER 32 HA SER 32 -1.009 -0.969 5.125
224 1HB SER 32 2HB SER 32 -0.096 -3.021 4.151
225 2HB SER 32 1HB SER 32 0.450 -2.088 2.752
226 HG SER 32 HG SER 32 2.170 -1.763 3.921
227 H TRP 33 H TRP 33 1.080 0.392 4.761
228 HA TRP 33 HA TRP 33 0.354 2.501 2.864
229 1HB TRP 33 2HB TRP 33 0.603 2.976 5.357
230 2HB TRP 33 1HB TRP 33 2.310 2.597 5.197
231 HD1 TRP 33 HD TRP 33 3.685 4.314 3.445
232 HE1 TRP 33 1HE TRP 33 3.390 6.851 3.164
233 HE3 TRP 33 3HE TRP 33 -0.951 4.828 5.527
234 HZ2 TRP 33 2HZ TRP 33 1.424 8.822 3.738
235 HZ3 TRP 33 3HZ TRP 33 -1.971 7.065 5.612
236 HH2 TRP 33 HH TRP 33 -0.806 9.018 4.720
237 H VAL 34 H VAL 34 1.253 1.568 1.020
238 HA VAL 34 HA VAL 34 4.063 1.970 0.652
239 HB VAL 34 HB VAL 34 3.185 -0.589 1.389
240 1HG1 VAL 34 1HG1 VAL 34 3.871 -1.985 -0.547
241 2HG1 VAL 34 2HG1 VAL 34 3.698 -0.595 -1.555
242 3HG1 VAL 34 3HG1 VAL 34 2.313 -1.210 -0.680
243 1HG2 VAL 34 1HG2 VAL 34 5.387 0.717 1.559
244 2HG2 VAL 34 2HG2 VAL 34 5.795 -0.116 0.064
245 3HG2 VAL 34 3HG2 VAL 34 5.410 -1.041 1.512
246 HA PRO 35 HA PRO 35 2.631 2.330 -3.605
247 1HB PRO 35 2HB PRO 35 4.892 1.707 -4.982
248 2HB PRO 35 1HB PRO 35 4.643 3.245 -4.171
249 1HG PRO 35 2HG PRO 35 6.451 1.109 -3.504
250 2HG PRO 35 1HG PRO 35 6.356 2.734 -2.828
251 1HD PRO 35 2HD PRO 35 5.379 0.222 -1.741
252 2HD PRO 35 1HD PRO 35 5.504 1.795 -0.937
253 H SER 36 H SER 36 1.680 1.251 -5.152
254 HA SER 36 HA SER 36 1.129 -0.380 -6.633
255 1HB SER 36 2HB SER 36 3.544 -0.659 -7.021
256 2HB SER 36 1HB SER 36 3.615 -1.815 -5.692
257 HG SER 36 HG SER 36 2.068 -2.086 -8.056
258 H SER 37 H SER 37 2.405 -2.043 -3.676
259 HA SER 37 HA SER 37 -0.245 -3.203 -3.395
260 1HB SER 37 2HB SER 37 2.187 -4.946 -3.731
261 2HB SER 37 1HB SER 37 0.563 -5.509 -3.337
262 HG SER 37 HG SER 37 1.442 -4.255 -5.720
263 H TYR 38 H TYR 38 3.021 -3.758 -1.999
264 HA TYR 38 HA TYR 38 2.389 -2.898 0.567
265 1HB TYR 38 2HB TYR 38 0.687 -4.591 0.604
266 2HB TYR 38 1HB TYR 38 1.866 -5.820 0.125
267 HD1 TYR 38 1HD TYR 38 0.204 -4.252 2.681
268 HD2 TYR 38 2HD TYR 38 3.889 -6.103 1.817
269 HE1 TYR 38 1HE TYR 38 0.480 -4.647 5.048
270 HE2 TYR 38 2HE TYR 38 4.243 -6.539 4.217
271 HH TYR 38 HH TYR 38 1.756 -6.178 6.535
272 H ILE 39 H ILE 39 4.115 -3.237 2.005
273 HA ILE 39 HA ILE 39 6.073 -5.151 1.806
274 HB ILE 39 HB ILE 39 6.778 -4.487 -0.292
275 1HG1 ILE 39 2HG1 ILE 39 9.017 -3.730 -0.036
276 2HG1 ILE 39 1HG1 ILE 39 8.639 -2.863 1.441
277 1HG2 ILE 39 1HG2 ILE 39 6.783 -2.387 -1.170
278 2HG2 ILE 39 2HG2 ILE 39 7.037 -1.621 0.397
279 3HG2 ILE 39 3HG2 ILE 39 5.464 -2.284 -0.010
280 1HD1 ILE 39 1HD1 ILE 39 9.875 -4.876 1.928
281 2HD1 ILE 39 2HD1 ILE 39 8.672 -5.849 1.082
282 3HD1 ILE 39 3HD1 ILE 39 8.238 -5.007 2.568
283 H ALA 40 H ALA 40 5.388 -4.727 3.986
284 HA ALA 40 HA ALA 40 6.036 -2.351 5.323
285 1HB ALA 40 1HB ALA 40 5.791 -3.662 7.378
286 2HB ALA 40 2HB ALA 40 5.773 -5.140 6.414
287 3HB ALA 40 3HB ALA 40 4.479 -3.955 6.236
288 H ALA 41 H ALA 41 8.064 -1.663 4.852
289 HA ALA 41 HA ALA 41 10.178 -2.452 6.483
290 1HB ALA 41 1HB ALA 41 11.708 -3.499 4.875
291 2HB ALA 41 2HB ALA 41 10.419 -3.517 3.671
292 3HB ALA 41 3HB ALA 41 10.266 -4.478 5.142
293 H ASP 42 H ASP 42 9.144 -0.990 3.474
294 HA ASP 42 HA ASP 42 9.531 1.093 2.635
295 1HB ASP 42 2HB ASP 42 11.560 1.527 4.834
296 2HB ASP 42 1HB ASP 42 10.765 2.750 3.852
297 H VAL 43 H VAL 43 11.045 -1.394 2.079
298 HA VAL 43 HA VAL 43 13.430 -0.144 0.877
299 HB VAL 43 HB VAL 43 14.538 -2.341 0.973
300 1HG1 VAL 43 1HG1 VAL 43 14.995 -2.335 3.370
301 2HG1 VAL 43 2HG1 VAL 43 13.562 -1.345 3.647
302 3HG1 VAL 43 3HG1 VAL 43 14.922 -0.692 2.732
303 1HG2 VAL 43 1HG2 VAL 43 12.929 -3.982 1.017
304 2HG2 VAL 43 2HG2 VAL 43 11.933 -3.126 2.193
305 3HG2 VAL 43 3HG2 VAL 43 13.408 -3.939 2.714
306 H VAL 44 H VAL 44 10.453 -1.308 0.104
307 HA VAL 44 HA VAL 44 11.178 -1.626 -2.661
308 HB VAL 44 HB VAL 44 9.570 -3.952 -1.869
309 1HG1 VAL 44 1HG1 VAL 44 10.241 -3.724 -4.128
310 2HG1 VAL 44 2HG1 VAL 44 11.172 -5.059 -3.451
311 3HG1 VAL 44 3HG1 VAL 44 11.928 -3.481 -3.672
312 1HG2 VAL 44 1HG2 VAL 44 11.160 -3.941 0.012
313 2HG2 VAL 44 2HG2 VAL 44 12.498 -3.927 -1.136
314 3HG2 VAL 44 3HG2 VAL 44 11.413 -5.314 -1.064
315 H SER 45 H SER 45 9.197 -2.107 -4.002
316 HA SER 45 HA SER 45 6.877 -0.649 -2.905
317 1HB SER 45 2HB SER 45 7.905 0.318 -4.907
318 2HB SER 45 1HB SER 45 7.706 -1.208 -5.770
319 HG SER 45 HG SER 45 5.479 -0.950 -5.643
320 H GLU 46 H GLU 46 7.444 -3.620 -2.518
321 HA GLU 46 HA GLU 46 4.835 -4.581 -2.864
322 1HB GLU 46 2HB GLU 46 5.387 -4.536 -5.254
323 2HB GLU 46 1HB GLU 46 6.772 -5.579 -4.958
324 1HG GLU 46 2HG GLU 46 5.291 -7.366 -4.233
325 2HG GLU 46 1HG GLU 46 3.893 -6.323 -4.488
326 H TYR 47 H TYR 47 4.501 -6.634 -1.975
327 HA TYR 47 HA TYR 47 6.522 -7.523 -0.173
328 1HB TYR 47 2HB TYR 47 3.912 -7.573 0.091
329 2HB TYR 47 1HB TYR 47 4.039 -9.101 -0.779
330 HD1 TYR 47 1HD TYR 47 5.698 -7.375 2.095
331 HD2 TYR 47 2HD TYR 47 4.189 -11.017 0.493
332 HE1 TYR 47 1HE TYR 47 6.258 -8.523 4.195
333 HE2 TYR 47 2HE TYR 47 4.742 -12.175 2.591
334 HH TYR 47 HH TYR 47 6.354 -11.857 4.498
Start of MODEL 9
1 1H GLY 1 1HT GLY 1 -8.114 -8.625 8.749
2 2H GLY 1 2HT GLY 1 -9.379 -7.588 9.178
3 3H GLY 1 3HT GLY 1 -7.893 -7.486 9.981
4 1HA GLY 1 1HA GLY 1 -6.807 -6.776 7.938
5 2HA GLY 1 2HA GLY 1 -8.354 -6.872 7.112
6 H SER 2 H SER 2 -7.050 -4.537 6.972
7 HA SER 2 HA SER 2 -8.512 -2.803 8.853
8 1HB SER 2 2HB SER 2 -5.831 -2.265 7.551
9 2HB SER 2 1HB SER 2 -6.696 -1.158 8.619
10 HG SER 2 HG SER 2 -5.172 -3.349 9.226
11 H GLY 3 H GLY 3 -6.939 -2.728 5.648
12 1HA GLY 3 2HA GLY 3 -9.230 -1.117 4.706
13 2HA GLY 3 1HA GLY 3 -7.585 -0.849 4.153
14 H GLU 4 H GLU 4 -6.819 -1.982 2.459
15 HA GLU 4 HA GLU 4 -6.992 -3.111 0.479
16 1HB GLU 4 2HB GLU 4 -7.054 -5.461 0.718
17 2HB GLU 4 1HB GLU 4 -6.341 -4.855 2.201
18 1HG GLU 4 2HG GLU 4 -8.411 -5.174 3.387
19 2HG GLU 4 1HG GLU 4 -9.234 -5.626 1.895
20 H VAL 5 H VAL 5 -9.397 -1.631 1.303
21 HA VAL 5 HA VAL 5 -11.593 -3.275 0.358
22 HB VAL 5 HB VAL 5 -11.637 -0.383 1.215
23 1HG1 VAL 5 1HG1 VAL 5 -13.544 -0.868 -0.126
24 2HG1 VAL 5 2HG1 VAL 5 -14.072 -0.872 1.556
25 3HG1 VAL 5 3HG1 VAL 5 -13.817 -2.397 0.709
26 1HG2 VAL 5 1HG2 VAL 5 -12.625 -1.325 3.325
27 2HG2 VAL 5 2HG2 VAL 5 -10.910 -1.656 3.086
28 3HG2 VAL 5 3HG2 VAL 5 -12.103 -2.918 2.774
29 H ASN 6 H ASN 6 -9.267 -1.281 -1.049
30 HA ASN 6 HA ASN 6 -9.088 -0.210 -3.054
31 1HB ASN 6 2HB ASN 6 -9.321 -2.483 -3.876
32 2HB ASN 6 1HB ASN 6 -11.075 -2.373 -3.781
33 1HD2 ASN 6 1HD2 ASN 6 -8.957 0.176 -4.933
34 2HD2 ASN 6 2HD2 ASN 6 -9.493 0.135 -6.573
35 H LYS 7 H LYS 7 -10.237 1.676 -1.991
36 HA LYS 7 HA LYS 7 -12.664 2.313 -3.476
37 1HB LYS 7 2HB LYS 7 -13.374 3.410 -1.137
38 2HB LYS 7 1HB LYS 7 -13.826 1.778 -1.604
39 1HG LYS 7 2HG LYS 7 -12.278 0.797 -0.187
40 2HG LYS 7 1HG LYS 7 -11.286 2.254 -0.074
41 1HD LYS 7 2HD LYS 7 -14.085 2.024 1.038
42 2HD LYS 7 1HD LYS 7 -12.628 1.706 1.980
43 1HE LYS 7 2HE LYS 7 -13.239 4.306 0.580
44 2HE LYS 7 1HE LYS 7 -13.533 3.994 2.291
45 1HZ LYS 7 1HZ LYS 7 -11.432 5.160 1.890
46 2HZ LYS 7 2HZ LYS 7 -10.875 3.853 0.973
47 3HZ LYS 7 3HZ LYS 7 -11.186 3.656 2.625
48 H ILE 8 H ILE 8 -11.698 4.308 -0.764
49 HA ILE 8 HA ILE 8 -10.306 6.156 -2.557
50 HB ILE 8 HB ILE 8 -12.534 7.006 -2.599
51 1HG1 ILE 8 2HG1 ILE 8 -12.236 9.220 -1.756
52 2HG1 ILE 8 1HG1 ILE 8 -11.136 8.668 -0.499
53 1HG2 ILE 8 1HG2 ILE 8 -12.527 6.884 0.412
54 2HG2 ILE 8 2HG2 ILE 8 -13.399 5.793 -0.664
55 3HG2 ILE 8 3HG2 ILE 8 -13.831 7.501 -0.603
56 1HD1 ILE 8 1HD1 ILE 8 -10.555 8.580 -3.449
57 2HD1 ILE 8 2HD1 ILE 8 -9.446 8.172 -2.139
58 3HD1 ILE 8 3HD1 ILE 8 -10.001 9.834 -2.340
59 H ILE 9 H ILE 9 -8.365 6.193 -1.654
60 HA ILE 9 HA ILE 9 -8.083 7.219 1.023
61 HB ILE 9 HB ILE 9 -8.253 4.671 1.161
62 1HG1 ILE 9 2HG1 ILE 9 -5.686 5.550 2.382
63 2HG1 ILE 9 1HG1 ILE 9 -7.136 6.464 2.782
64 1HG2 ILE 9 1HG2 ILE 9 -5.373 4.477 0.617
65 2HG2 ILE 9 2HG2 ILE 9 -6.420 4.648 -0.794
66 3HG2 ILE 9 3HG2 ILE 9 -6.685 3.330 0.342
67 1HD1 ILE 9 1HD1 ILE 9 -8.199 4.485 3.637
68 2HD1 ILE 9 2HD1 ILE 9 -6.623 4.687 4.402
69 3HD1 ILE 9 3HD1 ILE 9 -6.837 3.492 3.125
70 H GLY 10 H GLY 10 -5.534 7.303 1.499
71 1HA GLY 10 2HA GLY 10 -4.469 8.706 -0.840
72 2HA GLY 10 1HA GLY 10 -4.042 9.048 0.827
73 H SER 11 H SER 11 -2.057 8.821 -0.884
74 HA SER 11 HA SER 11 -0.623 6.494 -0.072
75 1HB SER 11 2HB SER 11 -0.040 5.889 -2.465
76 2HB SER 11 1HB SER 11 -1.662 5.469 -1.938
77 HG SER 11 HG SER 11 -1.185 7.951 -3.171
78 H ARG 12 H ARG 12 1.018 7.555 0.797
79 HA ARG 12 HA ARG 12 2.910 8.847 -0.945
80 1HB ARG 12 2HB ARG 12 1.415 10.731 -0.453
81 2HB ARG 12 1HB ARG 12 1.598 10.438 1.270
82 1HG ARG 12 2HG ARG 12 3.988 10.961 1.093
83 2HG ARG 12 1HG ARG 12 3.774 11.292 -0.628
84 1HD ARG 12 2HD ARG 12 2.171 13.067 -0.072
85 2HD ARG 12 1HD ARG 12 2.426 12.749 1.644
86 HE ARG 12 HE ARG 12 4.922 13.253 0.592
87 1HH1 ARG 12 1HH1 ARG 12 1.894 14.950 0.869
88 2HH1 ARG 12 2HH1 ARG 12 2.629 16.518 0.929
89 1HH2 ARG 12 1HH2 ARG 12 5.902 15.312 0.671
90 2HH2 ARG 12 2HH2 ARG 12 4.909 16.724 0.816
91 H THR 13 H THR 13 4.607 7.491 -0.250
92 HA THR 13 HA THR 13 4.913 7.333 2.661
93 HB THR 13 HB THR 13 6.347 5.410 0.929
94 HG1 THR 13 1HG THR 13 4.564 4.078 0.920
95 1HG2 THR 13 1HG2 THR 13 6.106 3.972 2.867
96 2HG2 THR 13 2HG2 THR 13 5.141 5.210 3.672
97 3HG2 THR 13 3HG2 THR 13 6.845 5.507 3.323
98 H ALA 14 H ALA 14 7.457 6.682 0.261
99 HA ALA 14 HA ALA 14 8.941 8.985 1.264
100 1HB ALA 14 1HB ALA 14 9.486 7.173 2.817
101 2HB ALA 14 2HB ALA 14 10.890 7.685 1.881
102 3HB ALA 14 3HB ALA 14 10.048 6.192 1.463
103 H GLY 15 H GLY 15 9.302 6.049 -0.746
104 1HA GLY 15 2HA GLY 15 9.483 6.390 -3.176
105 2HA GLY 15 1HA GLY 15 10.455 7.813 -2.828
106 H GLU 16 H GLU 16 12.018 6.574 -0.736
107 HA GLU 16 HA GLU 16 14.136 5.532 -2.242
108 1HB GLU 16 2HB GLU 16 15.191 5.031 -0.143
109 2HB GLU 16 1HB GLU 16 14.288 6.527 0.065
110 1HG GLU 16 2HG GLU 16 12.508 5.338 1.188
111 2HG GLU 16 1HG GLU 16 13.332 3.803 0.917
112 H GLY 17 H GLY 17 11.433 4.066 -0.634
113 1HA GLY 17 2HA GLY 17 12.013 1.522 -1.974
114 2HA GLY 17 1HA GLY 17 11.692 1.520 -0.242
115 H ALA 18 H ALA 18 9.682 3.100 0.197
116 HA ALA 18 HA ALA 18 7.537 2.252 -1.618
117 1HB ALA 18 1HB ALA 18 7.529 2.525 1.381
118 2HB ALA 18 2HB ALA 18 7.295 1.048 0.441
119 3HB ALA 18 3HB ALA 18 6.060 2.310 0.428
120 H MET 19 H MET 19 5.836 3.775 -2.060
121 HA MET 19 HA MET 19 5.923 6.347 -0.764
122 1HB MET 19 2HB MET 19 7.363 5.965 -3.101
123 2HB MET 19 1HB MET 19 5.881 6.743 -3.642
124 1HG MET 19 2HG MET 19 7.377 7.830 -1.315
125 2HG MET 19 1HG MET 19 7.924 8.176 -2.952
126 1HE MET 19 1HE MET 19 6.160 11.511 -1.820
127 2HE MET 19 2HE MET 19 7.631 10.819 -2.502
128 3HE MET 19 3HE MET 19 7.148 10.416 -0.854
129 H GLU 20 H GLU 20 3.878 4.327 -0.836
130 HA GLU 20 HA GLU 20 1.698 5.980 -1.725
131 1HB GLU 20 2HB GLU 20 2.006 3.203 -2.801
132 2HB GLU 20 1HB GLU 20 0.582 4.190 -3.010
133 1HG GLU 20 2HG GLU 20 2.188 5.863 -4.128
134 2HG GLU 20 1HG GLU 20 3.315 4.503 -4.214
135 H TYR 21 H TYR 21 -0.454 4.130 -1.344
136 HA TYR 21 HA TYR 21 0.073 2.924 1.132
137 1HB TYR 21 2HB TYR 21 0.113 4.892 2.102
138 2HB TYR 21 1HB TYR 21 -1.138 5.579 1.129
139 HD1 TYR 21 1HD TYR 21 -2.361 6.621 2.672
140 HD2 TYR 21 2HD TYR 21 -1.498 2.494 3.250
141 HE1 TYR 21 1HE TYR 21 -3.944 6.575 4.511
142 HE2 TYR 21 2HE TYR 21 -3.070 2.438 5.143
143 HH TYR 21 HH TYR 21 -4.103 3.998 6.739
144 H LEU 22 H LEU 22 -3.157 3.780 1.436
145 HA LEU 22 HA LEU 22 -3.606 0.962 1.253
146 1HB LEU 22 2HB LEU 22 -4.761 3.195 2.689
147 2HB LEU 22 1HB LEU 22 -5.986 2.134 2.023
148 HG LEU 22 HG LEU 22 -3.711 1.208 3.779
149 1HD1 LEU 22 1HD1 LEU 22 -5.375 1.016 5.542
150 2HD1 LEU 22 2HD1 LEU 22 -6.606 1.690 4.473
151 3HD1 LEU 22 3HD1 LEU 22 -5.247 2.687 4.990
152 1HD2 LEU 22 1HD2 LEU 22 -6.197 -0.175 2.780
153 2HD2 LEU 22 2HD2 LEU 22 -5.057 -0.843 3.948
154 3HD2 LEU 22 3HD2 LEU 22 -4.538 -0.521 2.295
155 H ILE 23 H ILE 23 -5.668 0.187 0.595
156 HA ILE 23 HA ILE 23 -6.829 -0.513 -1.198
157 HB ILE 23 HB ILE 23 -8.628 0.823 -1.689
158 1HG1 ILE 23 2HG1 ILE 23 -8.230 3.466 -1.064
159 2HG1 ILE 23 1HG1 ILE 23 -6.703 3.018 -1.802
160 1HG2 ILE 23 1HG2 ILE 23 -8.967 2.264 0.463
161 2HG2 ILE 23 2HG2 ILE 23 -7.477 1.460 0.967
162 3HG2 ILE 23 3HG2 ILE 23 -8.892 0.505 0.539
163 1HD1 ILE 23 1HD1 ILE 23 -7.570 3.055 -3.830
164 2HD1 ILE 23 2HD1 ILE 23 -8.993 3.805 -3.108
165 3HD1 ILE 23 3HD1 ILE 23 -8.940 2.060 -3.345
166 H GLU 24 H GLU 24 -7.547 0.744 -3.605
167 HA GLU 24 HA GLU 24 -6.707 1.195 -5.675
168 1HB GLU 24 2HB GLU 24 -5.256 2.856 -4.089
169 2HB GLU 24 1HB GLU 24 -3.969 1.815 -4.692
170 1HG GLU 24 2HG GLU 24 -5.911 3.373 -6.378
171 2HG GLU 24 1HG GLU 24 -4.227 3.801 -6.069
172 H TRP 25 H TRP 25 -6.106 -1.269 -3.777
173 HA TRP 25 HA TRP 25 -4.698 -2.775 -5.791
174 1HB TRP 25 2HB TRP 25 -3.385 -3.964 -3.925
175 2HB TRP 25 1HB TRP 25 -2.807 -2.403 -4.471
176 HD1 TRP 25 HD TRP 25 -5.356 -3.292 -1.616
177 HE1 TRP 25 1HE TRP 25 -4.458 -2.163 0.553
178 HE3 TRP 25 3HE TRP 25 -1.133 -1.106 -3.447
179 HZ2 TRP 25 2HZ TRP 25 -2.292 -0.676 1.338
180 HZ3 TRP 25 3HZ TRP 25 0.315 0.169 -1.903
181 HH2 TRP 25 HH TRP 25 -0.274 0.440 0.441
182 H LYS 26 H LYS 26 -4.658 -5.253 -4.563
183 HA LYS 26 HA LYS 26 -7.495 -5.603 -3.852
184 1HB LYS 26 2HB LYS 26 -5.800 -7.276 -5.699
185 2HB LYS 26 1HB LYS 26 -7.329 -7.835 -5.038
186 1HG LYS 26 2HG LYS 26 -7.914 -7.028 -7.123
187 2HG LYS 26 1HG LYS 26 -8.313 -5.686 -6.049
188 1HD LYS 26 2HD LYS 26 -7.194 -4.795 -7.966
189 2HD LYS 26 1HD LYS 26 -6.091 -4.688 -6.597
190 1HE LYS 26 2HE LYS 26 -4.950 -6.710 -7.350
191 2HE LYS 26 1HE LYS 26 -6.063 -6.837 -8.711
192 1HZ LYS 26 1HZ LYS 26 -4.168 -4.600 -8.227
193 2HZ LYS 26 2HZ LYS 26 -5.239 -4.717 -9.532
194 3HZ LYS 26 3HZ LYS 26 -3.975 -5.829 -9.375
195 H ASP 27 H ASP 27 -6.305 -5.369 -1.680
196 HA ASP 27 HA ASP 27 -5.383 -6.319 0.216
197 1HB ASP 27 2HB ASP 27 -6.627 -8.259 0.978
198 2HB ASP 27 1HB ASP 27 -7.724 -7.156 0.151
199 H GLY 28 H GLY 28 -3.806 -6.872 -2.235
200 1HA GLY 28 2HA GLY 28 -2.932 -9.441 -2.561
201 2HA GLY 28 1HA GLY 28 -1.872 -8.057 -2.698
202 H HIS 29 H HIS 29 -1.299 -7.154 -0.287
203 HA HIS 29 HA HIS 29 -0.730 -9.525 1.355
204 1HB HIS 29 2HB HIS 29 1.310 -9.032 -0.022
205 2HB HIS 29 1HB HIS 29 1.439 -7.450 0.757
206 HD1 HIS 29 1HD HIS 29 1.558 -11.143 1.624
207 HD2 HIS 29 2HD HIS 29 2.721 -7.461 3.160
208 HE1 HIS 29 1HE HIS 29 2.958 -11.669 3.646
209 HE2 HIS 29 2HE HIS 29 3.704 -9.428 4.522
210 H SER 30 H SER 30 -2.141 -8.959 2.960
211 HA SER 30 HA SER 30 -3.043 -7.730 4.700
212 1HB SER 30 2HB SER 30 -0.133 -7.019 5.096
213 2HB SER 30 1HB SER 30 -1.387 -7.136 6.344
214 HG SER 30 HG SER 30 -0.109 -9.017 6.304
215 HA PRO 31 HA PRO 31 -3.699 -3.583 2.620
216 1HB PRO 31 2HB PRO 31 -4.882 -3.085 5.273
217 2HB PRO 31 1HB PRO 31 -5.631 -2.981 3.679
218 1HG PRO 31 2HG PRO 31 -5.693 -5.177 5.582
219 2HG PRO 31 1HG PRO 31 -6.623 -4.978 4.091
220 1HD PRO 31 2HD PRO 31 -4.714 -6.882 4.383
221 2HD PRO 31 1HD PRO 31 -5.052 -6.122 2.816
222 H SER 32 H SER 32 -2.174 -2.000 2.669
223 HA SER 32 HA SER 32 -0.852 -1.405 5.202
224 1HB SER 32 2HB SER 32 0.338 -3.356 4.132
225 2HB SER 32 1HB SER 32 0.793 -2.249 2.827
226 HG SER 32 HG SER 32 1.966 -2.581 5.193
227 H TRP 33 H TRP 33 1.274 -0.020 4.470
228 HA TRP 33 HA TRP 33 0.280 2.107 2.685
229 1HB TRP 33 2HB TRP 33 0.542 2.707 5.129
230 2HB TRP 33 1HB TRP 33 2.261 2.365 4.974
231 HD1 TRP 33 HD TRP 33 3.360 3.891 2.744
232 HE1 TRP 33 1HE TRP 33 3.076 6.415 2.388
233 HE3 TRP 33 3HE TRP 33 -0.748 4.683 5.689
234 HZ2 TRP 33 2HZ TRP 33 1.337 8.479 3.231
235 HZ3 TRP 33 3HZ TRP 33 -1.653 6.968 5.855
236 HH2 TRP 33 HH TRP 33 -0.630 8.823 4.633
237 H VAL 34 H VAL 34 1.200 1.398 0.800
238 HA VAL 34 HA VAL 34 4.017 1.656 0.531
239 HB VAL 34 HB VAL 34 2.902 -0.998 0.895
240 1HG1 VAL 34 1HG1 VAL 34 3.798 -2.248 -0.815
241 2HG1 VAL 34 2HG1 VAL 34 4.782 -0.954 -1.429
242 3HG1 VAL 34 3HG1 VAL 34 3.039 -0.920 -1.668
243 1HG2 VAL 34 1HG2 VAL 34 5.106 0.490 1.621
244 2HG2 VAL 34 2HG2 VAL 34 5.778 -0.736 0.556
245 3HG2 VAL 34 3HG2 VAL 34 4.854 -1.210 1.978
246 HA PRO 35 HA PRO 35 3.512 2.752 -3.689
247 1HB PRO 35 2HB PRO 35 5.223 0.968 -4.914
248 2HB PRO 35 1HB PRO 35 5.658 2.504 -4.162
249 1HG PRO 35 2HG PRO 35 5.727 -0.250 -2.995
250 2HG PRO 35 1HG PRO 35 6.960 1.023 -2.924
251 1HD PRO 35 2HD PRO 35 5.413 0.659 -0.855
252 2HD PRO 35 1HD PRO 35 5.661 2.286 -1.430
253 H SER 36 H SER 36 1.247 1.532 -3.378
254 HA SER 36 HA SER 36 -0.388 0.442 -4.541
255 1HB SER 36 2HB SER 36 1.743 0.425 -6.685
256 2HB SER 36 1HB SER 36 0.101 -0.165 -6.942
257 HG SER 36 HG SER 36 -0.661 1.912 -6.441
258 H SER 37 H SER 37 1.487 -0.928 -2.844
259 HA SER 37 HA SER 37 0.743 -3.612 -3.581
260 1HB SER 37 2HB SER 37 3.617 -3.125 -2.821
261 2HB SER 37 1HB SER 37 2.904 -4.537 -3.597
262 HG SER 37 HG SER 37 2.457 -3.049 -5.404
263 H TYR 38 H TYR 38 3.012 -4.109 -1.321
264 HA TYR 38 HA TYR 38 2.067 -2.918 1.034
265 1HB TYR 38 2HB TYR 38 1.314 -5.631 1.484
266 2HB TYR 38 1HB TYR 38 0.372 -4.184 1.749
267 HD1 TYR 38 1HD TYR 38 -1.698 -4.203 0.776
268 HD2 TYR 38 2HD TYR 38 1.516 -6.158 -1.204
269 HE1 TYR 38 1HE TYR 38 -3.244 -4.923 -1.007
270 HE2 TYR 38 2HE TYR 38 -0.011 -6.876 -2.995
271 HH TYR 38 HH TYR 38 -3.443 -5.979 -2.974
272 H ILE 39 H ILE 39 4.038 -2.773 1.626
273 HA ILE 39 HA ILE 39 5.565 -5.074 2.340
274 HB ILE 39 HB ILE 39 6.574 -5.201 0.312
275 1HG1 ILE 39 2HG1 ILE 39 8.209 -3.832 1.998
276 2HG1 ILE 39 1HG1 ILE 39 8.699 -4.407 0.419
277 1HG2 ILE 39 1HG2 ILE 39 5.488 -2.497 -0.015
278 2HG2 ILE 39 2HG2 ILE 39 5.225 -3.938 -0.997
279 3HG2 ILE 39 3HG2 ILE 39 6.734 -3.024 -1.142
280 1HD1 ILE 39 1HD1 ILE 39 8.868 -2.324 -0.431
281 2HD1 ILE 39 2HD1 ILE 39 9.027 -1.866 1.263
282 3HD1 ILE 39 3HD1 ILE 39 7.472 -1.726 0.461
283 H ALA 40 H ALA 40 5.153 -4.157 4.317
284 HA ALA 40 HA ALA 40 5.726 -1.520 4.999
285 1HB ALA 40 1HB ALA 40 4.397 -3.082 6.329
286 2HB ALA 40 2HB ALA 40 5.635 -2.262 7.283
287 3HB ALA 40 3HB ALA 40 5.874 -3.934 6.771
288 H ALA 41 H ALA 41 7.628 -0.858 4.114
289 HA ALA 41 HA ALA 41 9.873 -0.517 3.912
290 1HB ALA 41 1HB ALA 41 9.799 -1.178 6.846
291 2HB ALA 41 2HB ALA 41 9.362 0.379 6.142
292 3HB ALA 41 3HB ALA 41 11.018 -0.213 6.010
293 H ASP 42 H ASP 42 9.568 -2.806 2.795
294 HA ASP 42 HA ASP 42 11.600 -4.574 3.976
295 1HB ASP 42 2HB ASP 42 9.341 -5.573 4.028
296 2HB ASP 42 1HB ASP 42 9.255 -5.429 2.274
297 H VAL 43 H VAL 43 10.670 -2.795 1.135
298 HA VAL 43 HA VAL 43 13.126 -3.137 -0.112
299 HB VAL 43 HB VAL 43 12.065 -4.442 -2.194
300 1HG1 VAL 43 1HG1 VAL 43 13.020 -6.490 -0.500
301 2HG1 VAL 43 2HG1 VAL 43 13.906 -5.018 -0.100
302 3HG1 VAL 43 3HG1 VAL 43 13.891 -5.615 -1.760
303 1HG2 VAL 43 1HG2 VAL 43 10.749 -6.328 -1.519
304 2HG2 VAL 43 2HG2 VAL 43 9.939 -4.863 -0.972
305 3HG2 VAL 43 3HG2 VAL 43 10.840 -5.852 0.173
306 H VAL 44 H VAL 44 10.310 -3.457 -2.226
307 HA VAL 44 HA VAL 44 9.625 -0.755 -2.401
308 HB VAL 44 HB VAL 44 11.867 -0.312 -3.123
309 1HG1 VAL 44 1HG1 VAL 44 11.421 -2.400 -5.253
310 2HG1 VAL 44 2HG1 VAL 44 12.474 -2.556 -3.847
311 3HG1 VAL 44 3HG1 VAL 44 12.846 -1.372 -5.100
312 1HG2 VAL 44 1HG2 VAL 44 10.478 -0.264 -5.752
313 2HG2 VAL 44 2HG2 VAL 44 11.384 1.005 -4.929
314 3HG2 VAL 44 3HG2 VAL 44 9.745 0.613 -4.413
315 H SER 45 H SER 45 7.736 -0.710 -3.296
316 HA SER 45 HA SER 45 5.977 -1.011 -4.687
317 1HB SER 45 2HB SER 45 7.629 -0.592 -6.461
318 2HB SER 45 1HB SER 45 7.988 -2.317 -6.526
319 HG SER 45 HG SER 45 6.249 -1.177 -7.967
320 H GLU 46 H GLU 46 7.205 -3.396 -2.964
321 HA GLU 46 HA GLU 46 4.983 -5.047 -3.150
322 1HB GLU 46 2HB GLU 46 6.881 -5.530 -5.247
323 2HB GLU 46 1HB GLU 46 6.782 -6.946 -4.209
324 1HG GLU 46 2HG GLU 46 4.316 -6.905 -4.482
325 2HG GLU 46 1HG GLU 46 4.510 -5.591 -5.642
326 H TYR 47 H TYR 47 5.226 -7.172 -2.078
327 HA TYR 47 HA TYR 47 7.441 -7.173 -0.139
328 1HB TYR 47 2HB TYR 47 5.516 -6.569 1.107
329 2HB TYR 47 1HB TYR 47 4.502 -7.788 0.330
330 HD1 TYR 47 1HD TYR 47 7.017 -7.106 2.893
331 HD2 TYR 47 2HD TYR 47 4.689 -10.137 1.028
332 HE1 TYR 47 1HE TYR 47 7.543 -8.638 4.743
333 HE2 TYR 47 2HE TYR 47 5.207 -11.679 2.873
334 HH TYR 47 HH TYR 47 6.948 -11.970 4.597
Start of MODEL 10
1 1H GLY 1 1HT GLY 1 -11.531 -1.545 11.387
2 2H GLY 1 2HT GLY 1 -13.153 -1.855 11.745
3 3H GLY 1 3HT GLY 1 -12.715 -0.401 11.001
4 1HA GLY 1 1HA GLY 1 -12.504 -3.111 9.808
5 2HA GLY 1 2HA GLY 1 -13.699 -1.892 9.389
6 H SER 2 H SER 2 -13.167 -1.561 7.284
7 HA SER 2 HA SER 2 -12.047 -0.725 5.489
8 1HB SER 2 2HB SER 2 -10.347 0.596 7.620
9 2HB SER 2 1HB SER 2 -10.341 1.016 5.907
10 HG SER 2 HG SER 2 -11.739 2.277 7.429
11 H GLY 3 H GLY 3 -9.801 -0.639 4.427
12 1HA GLY 3 2HA GLY 3 -7.561 -1.528 4.365
13 2HA GLY 3 1HA GLY 3 -8.082 -2.797 5.463
14 H GLU 4 H GLU 4 -6.910 -2.567 2.595
15 HA GLU 4 HA GLU 4 -7.046 -3.663 0.612
16 1HB GLU 4 2HB GLU 4 -7.483 -5.980 0.727
17 2HB GLU 4 1HB GLU 4 -6.791 -5.542 2.281
18 1HG GLU 4 2HG GLU 4 -8.863 -5.712 3.370
19 2HG GLU 4 1HG GLU 4 -9.755 -5.731 1.848
20 H VAL 5 H VAL 5 -9.395 -1.974 1.498
21 HA VAL 5 HA VAL 5 -11.717 -3.085 0.291
22 HB VAL 5 HB VAL 5 -11.174 -0.188 0.954
23 1HG1 VAL 5 1HG1 VAL 5 -13.689 -1.820 0.592
24 2HG1 VAL 5 2HG1 VAL 5 -13.160 -0.415 -0.335
25 3HG1 VAL 5 3HG1 VAL 5 -13.671 -0.225 1.342
26 1HG2 VAL 5 1HG2 VAL 5 -10.669 -1.539 2.907
27 2HG2 VAL 5 2HG2 VAL 5 -12.203 -2.395 2.750
28 3HG2 VAL 5 3HG2 VAL 5 -12.189 -0.679 3.151
29 H ASN 6 H ASN 6 -8.953 -1.810 -1.149
30 HA ASN 6 HA ASN 6 -8.512 -0.570 -3.068
31 1HB ASN 6 2HB ASN 6 -8.937 -2.895 -3.819
32 2HB ASN 6 1HB ASN 6 -10.631 -2.496 -4.052
33 1HD2 ASN 6 1HD2 ASN 6 -7.407 -2.124 -5.252
34 2HD2 ASN 6 2HD2 ASN 6 -7.833 -1.436 -6.781
35 H LYS 7 H LYS 7 -9.351 1.531 -2.537
36 HA LYS 7 HA LYS 7 -11.688 2.249 -4.050
37 1HB LYS 7 2HB LYS 7 -12.841 3.246 -2.121
38 2HB LYS 7 1HB LYS 7 -12.620 1.517 -1.908
39 1HG LYS 7 2HG LYS 7 -10.604 2.025 -0.514
40 2HG LYS 7 1HG LYS 7 -11.053 3.725 -0.592
41 1HD LYS 7 2HD LYS 7 -13.199 3.227 0.451
42 2HD LYS 7 1HD LYS 7 -12.786 1.513 0.501
43 1HE LYS 7 2HE LYS 7 -12.400 2.499 2.670
44 2HE LYS 7 1HE LYS 7 -10.858 2.049 1.942
45 1HZ LYS 7 1HZ LYS 7 -10.526 4.350 1.298
46 2HZ LYS 7 2HZ LYS 7 -10.756 4.233 2.969
47 3HZ LYS 7 3HZ LYS 7 -12.012 4.785 1.980
48 H ILE 8 H ILE 8 -11.628 4.718 -2.078
49 HA ILE 8 HA ILE 8 -9.572 6.147 -3.574
50 HB ILE 8 HB ILE 8 -11.813 6.902 -3.809
51 1HG1 ILE 8 2HG1 ILE 8 -11.491 9.220 -3.421
52 2HG1 ILE 8 1HG1 ILE 8 -10.552 8.927 -1.962
53 1HG2 ILE 8 1HG2 ILE 8 -12.450 7.970 -1.270
54 2HG2 ILE 8 2HG2 ILE 8 -11.955 6.290 -1.032
55 3HG2 ILE 8 3HG2 ILE 8 -13.265 6.675 -2.149
56 1HD1 ILE 8 1HD1 ILE 8 -9.219 9.749 -3.877
57 2HD1 ILE 8 2HD1 ILE 8 -9.614 8.263 -4.743
58 3HD1 ILE 8 3HD1 ILE 8 -8.673 8.192 -3.251
59 H ILE 9 H ILE 9 -7.727 5.836 -2.326
60 HA ILE 9 HA ILE 9 -7.792 7.174 0.283
61 HB ILE 9 HB ILE 9 -7.766 4.655 0.242
62 1HG1 ILE 9 2HG1 ILE 9 -6.696 6.513 1.995
63 2HG1 ILE 9 1HG1 ILE 9 -7.071 4.838 2.354
64 1HG2 ILE 9 1HG2 ILE 9 -6.303 4.075 -1.433
65 2HG2 ILE 9 2HG2 ILE 9 -5.417 3.717 0.048
66 3HG2 ILE 9 3HG2 ILE 9 -5.038 5.169 -0.859
67 1HD1 ILE 9 1HD1 ILE 9 -4.444 6.122 1.840
68 2HD1 ILE 9 2HD1 ILE 9 -4.643 4.407 1.508
69 3HD1 ILE 9 3HD1 ILE 9 -4.935 5.027 3.127
70 H GLY 10 H GLY 10 -5.395 7.574 1.035
71 1HA GLY 10 2HA GLY 10 -4.072 8.970 -1.195
72 2HA GLY 10 1HA GLY 10 -3.882 9.366 0.513
73 H SER 11 H SER 11 -1.586 9.030 -0.942
74 HA SER 11 HA SER 11 -0.428 6.713 0.216
75 1HB SER 11 2HB SER 11 0.364 6.311 -2.434
76 2HB SER 11 1HB SER 11 -0.720 5.292 -1.479
77 HG SER 11 HG SER 11 -2.079 5.840 -2.999
78 H ARG 12 H ARG 12 1.344 7.535 1.094
79 HA ARG 12 HA ARG 12 3.354 8.776 -0.580
80 1HB ARG 12 2HB ARG 12 2.162 10.330 1.726
81 2HB ARG 12 1HB ARG 12 3.614 10.783 0.850
82 1HG ARG 12 2HG ARG 12 2.185 12.087 -0.281
83 2HG ARG 12 1HG ARG 12 1.879 10.611 -1.195
84 1HD ARG 12 2HD ARG 12 -0.104 10.165 -0.001
85 2HD ARG 12 1HD ARG 12 0.300 11.326 1.259
86 HE ARG 12 HE ARG 12 -0.909 11.880 -1.306
87 1HH1 ARG 12 1HH1 ARG 12 0.807 13.187 1.434
88 2HH1 ARG 12 2HH1 ARG 12 0.234 14.802 1.183
89 1HH2 ARG 12 1HH2 ARG 12 -1.665 14.005 -1.639
90 2HH2 ARG 12 2HH2 ARG 12 -1.167 15.266 -0.562
91 H THR 13 H THR 13 4.969 7.320 0.040
92 HA THR 13 HA THR 13 5.317 6.985 2.924
93 HB THR 13 HB THR 13 6.915 5.157 1.306
94 HG1 THR 13 1HG THR 13 5.189 3.827 0.780
95 1HG2 THR 13 1HG2 THR 13 5.809 3.586 3.027
96 2HG2 THR 13 2HG2 THR 13 5.290 5.085 3.799
97 3HG2 THR 13 3HG2 THR 13 7.006 4.759 3.574
98 H ALA 14 H ALA 14 7.777 6.527 0.397
99 HA ALA 14 HA ALA 14 9.327 8.711 1.560
100 1HB ALA 14 1HB ALA 14 9.909 6.767 2.930
101 2HB ALA 14 2HB ALA 14 11.285 7.344 1.990
102 3HB ALA 14 3HB ALA 14 10.409 5.901 1.478
103 H GLY 15 H GLY 15 9.568 5.962 -0.717
104 1HA GLY 15 2HA GLY 15 9.645 6.556 -3.113
105 2HA GLY 15 1HA GLY 15 10.698 7.888 -2.665
106 H GLU 16 H GLU 16 12.319 6.380 -0.813
107 HA GLU 16 HA GLU 16 14.292 5.422 -2.551
108 1HB GLU 16 2HB GLU 16 14.891 6.125 -0.329
109 2HB GLU 16 1HB GLU 16 13.833 4.921 0.395
110 1HG GLU 16 2HG GLU 16 15.262 3.141 -0.473
111 2HG GLU 16 1HG GLU 16 16.320 4.348 -1.203
112 H GLY 17 H GLY 17 11.584 3.887 -1.027
113 1HA GLY 17 2HA GLY 17 11.957 1.530 -2.688
114 2HA GLY 17 1HA GLY 17 11.911 1.271 -0.953
115 H ALA 18 H ALA 18 10.028 3.069 -0.131
116 HA ALA 18 HA ALA 18 7.667 2.224 -1.609
117 1HB ALA 18 1HB ALA 18 7.996 2.386 1.379
118 2HB ALA 18 2HB ALA 18 7.635 0.944 0.422
119 3HB ALA 18 3HB ALA 18 6.420 2.217 0.597
120 H MET 19 H MET 19 6.040 3.742 -2.003
121 HA MET 19 HA MET 19 6.179 6.273 -0.629
122 1HB MET 19 2HB MET 19 7.510 5.983 -3.035
123 2HB MET 19 1HB MET 19 5.981 6.719 -3.502
124 1HG MET 19 2HG MET 19 6.341 8.525 -1.937
125 2HG MET 19 1HG MET 19 7.832 7.764 -1.393
126 1HE MET 19 1HE MET 19 8.806 10.289 -1.822
127 2HE MET 19 2HE MET 19 7.332 10.847 -2.613
128 3HE MET 19 3HE MET 19 8.888 11.028 -3.421
129 H GLU 20 H GLU 20 4.114 4.277 -0.605
130 HA GLU 20 HA GLU 20 1.940 5.919 -1.496
131 1HB GLU 20 2HB GLU 20 2.256 3.117 -2.453
132 2HB GLU 20 1HB GLU 20 0.766 4.015 -2.600
133 1HG GLU 20 2HG GLU 20 2.215 5.747 -3.838
134 2HG GLU 20 1HG GLU 20 3.396 4.435 -3.980
135 H TYR 21 H TYR 21 -0.055 3.589 -0.914
136 HA TYR 21 HA TYR 21 0.441 3.450 1.929
137 1HB TYR 21 2HB TYR 21 -0.256 5.609 1.656
138 2HB TYR 21 1HB TYR 21 -1.617 5.044 0.724
139 HD1 TYR 21 1HD TYR 21 -2.446 6.964 2.727
140 HD2 TYR 21 2HD TYR 21 -1.430 2.832 3.216
141 HE1 TYR 21 1HE TYR 21 -3.846 6.823 4.752
142 HE2 TYR 21 2HE TYR 21 -2.784 2.716 5.243
143 HH TYR 21 HH TYR 21 -3.664 4.298 6.970
144 H LEU 22 H LEU 22 -2.860 3.549 0.976
145 HA LEU 22 HA LEU 22 -3.100 0.719 1.622
146 1HB LEU 22 2HB LEU 22 -3.832 2.326 3.412
147 2HB LEU 22 1HB LEU 22 -5.154 2.764 2.379
148 HG LEU 22 HG LEU 22 -6.066 0.530 2.550
149 1HD1 LEU 22 1HD1 LEU 22 -3.498 -0.055 3.990
150 2HD1 LEU 22 2HD1 LEU 22 -4.162 -0.856 2.564
151 3HD1 LEU 22 3HD1 LEU 22 -4.926 -1.078 4.138
152 1HD2 LEU 22 1HD2 LEU 22 -6.568 0.464 4.923
153 2HD2 LEU 22 2HD2 LEU 22 -6.605 2.123 4.327
154 3HD2 LEU 22 3HD2 LEU 22 -5.218 1.549 5.254
155 H ILE 23 H ILE 23 -5.249 -0.198 1.062
156 HA ILE 23 HA ILE 23 -6.312 -1.141 -0.686
157 HB ILE 23 HB ILE 23 -8.105 0.442 -1.562
158 1HG1 ILE 23 2HG1 ILE 23 -6.494 2.362 -0.782
159 2HG1 ILE 23 1HG1 ILE 23 -8.220 2.597 -0.879
160 1HG2 ILE 23 1HG2 ILE 23 -8.100 -1.176 0.410
161 2HG2 ILE 23 2HG2 ILE 23 -9.408 -0.001 0.250
162 3HG2 ILE 23 3HG2 ILE 23 -8.104 0.270 1.401
163 1HD1 ILE 23 1HD1 ILE 23 -8.367 2.998 1.312
164 2HD1 ILE 23 2HD1 ILE 23 -6.619 3.119 1.306
165 3HD1 ILE 23 3HD1 ILE 23 -7.380 1.605 1.723
166 H GLU 24 H GLU 24 -7.217 0.805 -3.041
167 HA GLU 24 HA GLU 24 -6.477 0.953 -5.195
168 1HB GLU 24 2HB GLU 24 -5.144 2.739 -3.960
169 2HB GLU 24 1HB GLU 24 -3.810 1.594 -3.929
170 1HG GLU 24 2HG GLU 24 -3.508 3.121 -5.751
171 2HG GLU 24 1HG GLU 24 -3.857 1.515 -6.389
172 H TRP 25 H TRP 25 -6.089 -1.604 -3.586
173 HA TRP 25 HA TRP 25 -4.594 -3.032 -5.548
174 1HB TRP 25 2HB TRP 25 -3.264 -4.229 -3.666
175 2HB TRP 25 1HB TRP 25 -2.669 -2.722 -4.321
176 HD1 TRP 25 HD TRP 25 -5.037 -3.496 -1.264
177 HE1 TRP 25 1HE TRP 25 -4.037 -2.203 0.784
178 HE3 TRP 25 3HE TRP 25 -1.014 -1.235 -3.482
179 HZ2 TRP 25 2HZ TRP 25 -1.889 -0.651 1.341
180 HZ3 TRP 25 3HZ TRP 25 0.455 0.155 -2.018
181 HH2 TRP 25 HH TRP 25 0.017 0.506 0.237
182 H LYS 26 H LYS 26 -4.466 -5.533 -4.381
183 HA LYS 26 HA LYS 26 -7.277 -5.967 -3.616
184 1HB LYS 26 2HB LYS 26 -5.591 -7.691 -5.433
185 2HB LYS 26 1HB LYS 26 -7.228 -8.063 -4.910
186 1HG LYS 26 2HG LYS 26 -8.028 -6.024 -6.027
187 2HG LYS 26 1HG LYS 26 -6.385 -5.713 -6.593
188 1HD LYS 26 2HD LYS 26 -6.407 -7.843 -7.807
189 2HD LYS 26 1HD LYS 26 -8.053 -8.144 -7.245
190 1HE LYS 26 2HE LYS 26 -8.806 -6.115 -8.404
191 2HE LYS 26 1HE LYS 26 -7.161 -5.840 -8.978
192 1HZ LYS 26 1HZ LYS 26 -7.272 -7.937 -10.177
193 2HZ LYS 26 2HZ LYS 26 -8.516 -6.901 -10.667
194 3HZ LYS 26 3HZ LYS 26 -8.852 -8.195 -9.628
195 H ASP 27 H ASP 27 -5.940 -5.752 -1.462
196 HA ASP 27 HA ASP 27 -5.118 -6.770 0.420
197 1HB ASP 27 2HB ASP 27 -7.438 -7.758 0.143
198 2HB ASP 27 1HB ASP 27 -6.666 -9.166 -0.567
199 H GLY 28 H GLY 28 -3.503 -7.202 -2.107
200 1HA GLY 28 2HA GLY 28 -2.510 -9.751 -2.369
201 2HA GLY 28 1HA GLY 28 -1.510 -8.325 -2.551
202 H HIS 29 H HIS 29 -1.044 -7.292 -0.168
203 HA HIS 29 HA HIS 29 -0.435 -9.550 1.609
204 1HB HIS 29 2HB HIS 29 1.624 -9.095 0.343
205 2HB HIS 29 1HB HIS 29 1.596 -7.411 0.864
206 HD1 HIS 29 1HD HIS 29 2.448 -6.888 3.198
207 HD2 HIS 29 2HD HIS 29 2.322 -10.958 2.373
208 HE1 HIS 29 1HE HIS 29 3.705 -7.992 5.076
209 HE2 HIS 29 2HE HIS 29 3.549 -10.462 4.595
210 H SER 30 H SER 30 -1.956 -8.972 3.113
211 HA SER 30 HA SER 30 -2.987 -7.723 4.769
212 1HB SER 30 2HB SER 30 -0.103 -7.012 5.310
213 2HB SER 30 1HB SER 30 -1.422 -7.099 6.494
214 HG SER 30 HG SER 30 -0.164 -8.993 6.547
215 HA PRO 31 HA PRO 31 -3.588 -3.499 2.865
216 1HB PRO 31 2HB PRO 31 -4.824 -3.124 5.521
217 2HB PRO 31 1HB PRO 31 -5.525 -2.895 3.919
218 1HG PRO 31 2HG PRO 31 -5.774 -5.170 5.668
219 2HG PRO 31 1HG PRO 31 -6.548 -4.899 4.101
220 1HD PRO 31 2HD PRO 31 -4.667 -6.840 4.568
221 2HD PRO 31 1HD PRO 31 -4.959 -6.114 2.974
222 H SER 32 H SER 32 -1.882 -2.143 2.952
223 HA SER 32 HA SER 32 -0.581 -1.672 5.563
224 1HB SER 32 2HB SER 32 0.513 -3.501 4.164
225 2HB SER 32 1HB SER 32 0.918 -2.235 2.989
226 HG SER 32 HG SER 32 1.687 -2.242 5.734
227 H TRP 33 H TRP 33 1.652 -0.335 4.365
228 HA TRP 33 HA TRP 33 0.583 1.965 2.890
229 1HB TRP 33 2HB TRP 33 0.883 2.514 5.357
230 2HB TRP 33 1HB TRP 33 2.592 2.125 5.164
231 HD1 TRP 33 HD TRP 33 3.805 3.659 3.087
232 HE1 TRP 33 1HE TRP 33 3.542 6.180 2.676
233 HE3 TRP 33 3HE TRP 33 -0.493 4.477 5.727
234 HZ2 TRP 33 2HZ TRP 33 1.735 8.250 3.369
235 HZ3 TRP 33 3HZ TRP 33 -1.410 6.760 5.806
236 HH2 TRP 33 HH TRP 33 -0.320 8.604 4.630
237 H VAL 34 H VAL 34 1.410 1.293 1.014
238 HA VAL 34 HA VAL 34 4.231 1.448 0.682
239 HB VAL 34 HB VAL 34 2.959 -1.208 0.778
240 1HG1 VAL 34 1HG1 VAL 34 5.220 -1.112 -1.133
241 2HG1 VAL 34 2HG1 VAL 34 3.607 -0.786 -1.754
242 3HG1 VAL 34 3HG1 VAL 34 3.941 -2.283 -0.952
243 1HG2 VAL 34 1HG2 VAL 34 5.648 0.007 1.224
244 2HG2 VAL 34 2HG2 VAL 34 5.390 -1.727 1.249
245 3HG2 VAL 34 3HG2 VAL 34 4.545 -0.707 2.399
246 HA PRO 35 HA PRO 35 3.781 2.768 -3.461
247 1HB PRO 35 2HB PRO 35 5.541 1.025 -4.666
248 2HB PRO 35 1HB PRO 35 5.998 2.499 -3.812
249 1HG PRO 35 2HG PRO 35 5.797 -0.306 -2.766
250 2HG PRO 35 1HG PRO 35 7.150 0.831 -2.616
251 1HD PRO 35 2HD PRO 35 5.571 0.643 -0.590
252 2HD PRO 35 1HD PRO 35 5.840 2.255 -1.213
253 H SER 36 H SER 36 1.500 1.590 -3.346
254 HA SER 36 HA SER 36 -0.064 0.579 -4.666
255 1HB SER 36 2HB SER 36 1.039 1.544 -6.588
256 2HB SER 36 1HB SER 36 2.272 0.282 -6.569
257 HG SER 36 HG SER 36 0.866 -1.129 -7.378
258 H SER 37 H SER 37 1.784 -0.902 -2.791
259 HA SER 37 HA SER 37 0.764 -3.512 -3.509
260 1HB SER 37 2HB SER 37 3.697 -3.184 -2.861
261 2HB SER 37 1HB SER 37 2.867 -4.650 -3.377
262 HG SER 37 HG SER 37 3.152 -4.048 -5.359
263 H TYR 38 H TYR 38 3.130 -4.020 -1.224
264 HA TYR 38 HA TYR 38 2.125 -2.937 1.142
265 1HB TYR 38 2HB TYR 38 1.448 -5.646 1.553
266 2HB TYR 38 1HB TYR 38 0.430 -4.240 1.764
267 HD1 TYR 38 1HD TYR 38 -1.599 -4.349 0.672
268 HD2 TYR 38 2HD TYR 38 1.808 -6.192 -1.095
269 HE1 TYR 38 1HE TYR 38 -2.976 -5.021 -1.255
270 HE2 TYR 38 2HE TYR 38 0.432 -6.888 -3.021
271 HH TYR 38 HH TYR 38 -2.084 -5.703 -4.008
272 H ILE 39 H ILE 39 3.991 -2.843 2.016
273 HA ILE 39 HA ILE 39 5.549 -5.006 2.774
274 HB ILE 39 HB ILE 39 6.142 -5.421 0.557
275 1HG1 ILE 39 2HG1 ILE 39 8.463 -5.094 0.409
276 2HG1 ILE 39 1HG1 ILE 39 8.406 -3.577 1.295
277 1HG2 ILE 39 1HG2 ILE 39 5.123 -3.336 -0.290
278 2HG2 ILE 39 2HG2 ILE 39 6.605 -3.814 -1.123
279 3HG2 ILE 39 3HG2 ILE 39 6.642 -2.503 0.053
280 1HD1 ILE 39 1HD1 ILE 39 7.860 -4.803 3.338
281 2HD1 ILE 39 2HD1 ILE 39 9.369 -5.373 2.627
282 3HD1 ILE 39 3HD1 ILE 39 7.892 -6.317 2.436
283 H ALA 40 H ALA 40 4.435 -2.794 3.871
284 HA ALA 40 HA ALA 40 6.424 -0.730 4.154
285 1HB ALA 40 1HB ALA 40 4.909 0.409 5.454
286 2HB ALA 40 2HB ALA 40 4.133 -1.066 6.031
287 3HB ALA 40 3HB ALA 40 3.869 -0.519 4.377
288 H ALA 41 H ALA 41 8.208 -1.747 4.841
289 HA ALA 41 HA ALA 41 8.721 -1.813 7.576
290 1HB ALA 41 1HB ALA 41 9.008 -4.199 8.002
291 2HB ALA 41 2HB ALA 41 8.398 -4.571 6.390
292 3HB ALA 41 3HB ALA 41 7.332 -3.838 7.589
293 H ASP 42 H ASP 42 9.498 -3.044 4.381
294 HA ASP 42 HA ASP 42 12.337 -2.946 5.043
295 1HB ASP 42 2HB ASP 42 11.625 -5.035 4.061
296 2HB ASP 42 1HB ASP 42 10.906 -4.190 2.693
297 H VAL 43 H VAL 43 11.243 -2.539 1.729
298 HA VAL 43 HA VAL 43 11.294 0.177 1.413
299 HB VAL 43 HB VAL 43 13.518 0.191 2.435
300 1HG1 VAL 43 1HG1 VAL 43 14.599 -1.391 0.136
301 2HG1 VAL 43 2HG1 VAL 43 14.025 -2.178 1.604
302 3HG1 VAL 43 3HG1 VAL 43 15.353 -1.022 1.687
303 1HG2 VAL 43 1HG2 VAL 43 13.748 0.735 -0.516
304 2HG2 VAL 43 2HG2 VAL 43 14.733 1.430 0.769
305 3HG2 VAL 43 3HG2 VAL 43 13.018 1.825 0.660
306 H VAL 44 H VAL 44 9.789 -1.207 -0.119
307 HA VAL 44 HA VAL 44 11.040 -1.190 -2.729
308 HB VAL 44 HB VAL 44 10.384 -3.516 -3.295
309 1HG1 VAL 44 1HG1 VAL 44 12.312 -4.563 -2.263
310 2HG1 VAL 44 2HG1 VAL 44 12.380 -3.290 -1.045
311 3HG1 VAL 44 3HG1 VAL 44 12.703 -2.909 -2.737
312 1HG2 VAL 44 1HG2 VAL 44 9.963 -5.106 -1.505
313 2HG2 VAL 44 2HG2 VAL 44 8.741 -3.833 -1.500
314 3HG2 VAL 44 3HG2 VAL 44 10.046 -3.809 -0.313
315 H SER 45 H SER 45 9.562 -1.922 -4.477
316 HA SER 45 HA SER 45 7.028 -0.575 -4.216
317 1HB SER 45 2HB SER 45 8.262 -0.124 -6.191
318 2HB SER 45 1HB SER 45 8.443 -1.841 -6.546
319 HG SER 45 HG SER 45 6.306 -1.958 -7.068
320 H GLU 46 H GLU 46 7.722 -3.488 -3.177
321 HA GLU 46 HA GLU 46 5.121 -4.475 -3.218
322 1HB GLU 46 2HB GLU 46 5.406 -4.825 -5.598
323 2HB GLU 46 1HB GLU 46 6.898 -5.713 -5.324
324 1HG GLU 46 2HG GLU 46 5.663 -7.477 -4.201
325 2HG GLU 46 1HG GLU 46 4.162 -6.578 -4.414
326 H TYR 47 H TYR 47 4.902 -6.659 -2.372
327 HA TYR 47 HA TYR 47 6.521 -7.156 -0.184
328 1HB TYR 47 2HB TYR 47 5.412 -9.347 -0.048
329 2HB TYR 47 1HB TYR 47 4.259 -8.062 -0.387
330 HD1 TYR 47 1HD TYR 47 5.675 -11.176 -1.523
331 HD2 TYR 47 2HD TYR 47 3.384 -7.802 -2.735
332 HE1 TYR 47 1HE TYR 47 4.863 -12.435 -3.474
333 HE2 TYR 47 2HE TYR 47 2.568 -9.051 -4.689
334 HH TYR 47 HH TYR 47 2.950 -12.401 -5.021
Start of MODEL 11
1 1H GLY 1 1HT GLY 1 -15.416 -2.005 7.729
2 2H GLY 1 2HT GLY 1 -15.409 -3.619 7.219
3 3H GLY 1 3HT GLY 1 -14.721 -2.420 6.243
4 1HA GLY 1 1HA GLY 1 -13.729 -3.275 8.907
5 2HA GLY 1 2HA GLY 1 -13.004 -3.699 7.364
6 H SER 2 H SER 2 -11.092 -2.681 7.373
7 HA SER 2 HA SER 2 -11.083 0.204 7.273
8 1HB SER 2 2HB SER 2 -9.383 0.486 9.029
9 2HB SER 2 1HB SER 2 -10.872 -0.188 9.690
10 HG SER 2 HG SER 2 -8.495 -1.595 9.044
11 H GLY 3 H GLY 3 -10.578 -1.073 5.124
12 1HA GLY 3 2HA GLY 3 -8.508 -0.462 3.801
13 2HA GLY 3 1HA GLY 3 -7.655 -1.460 4.969
14 H GLU 4 H GLU 4 -7.184 -2.199 2.533
15 HA GLU 4 HA GLU 4 -7.303 -3.847 0.989
16 1HB GLU 4 2HB GLU 4 -7.033 -5.776 2.067
17 2HB GLU 4 1HB GLU 4 -7.559 -4.980 3.533
18 1HG GLU 4 2HG GLU 4 -9.910 -5.642 2.933
19 2HG GLU 4 1HG GLU 4 -9.218 -6.629 1.646
20 H VAL 5 H VAL 5 -9.685 -1.977 1.412
21 HA VAL 5 HA VAL 5 -11.763 -3.606 0.121
22 HB VAL 5 HB VAL 5 -12.110 -0.852 1.264
23 1HG1 VAL 5 1HG1 VAL 5 -14.022 -3.028 0.455
24 2HG1 VAL 5 2HG1 VAL 5 -13.861 -1.414 -0.236
25 3HG1 VAL 5 3HG1 VAL 5 -14.503 -1.614 1.393
26 1HG2 VAL 5 1HG2 VAL 5 -13.243 -2.171 3.180
27 2HG2 VAL 5 2HG2 VAL 5 -11.488 -2.006 3.175
28 3HG2 VAL 5 3HG2 VAL 5 -12.232 -3.510 2.631
29 H ASN 6 H ASN 6 -9.312 -1.478 -0.657
30 HA ASN 6 HA ASN 6 -8.906 -0.032 -2.373
31 1HB ASN 6 2HB ASN 6 -9.552 -0.943 -4.577
32 2HB ASN 6 1HB ASN 6 -8.876 -2.161 -3.497
33 1HD2 ASN 6 1HD2 ASN 6 -10.028 -3.852 -2.890
34 2HD2 ASN 6 2HD2 ASN 6 -11.630 -4.196 -3.451
35 H LYS 7 H LYS 7 -10.070 1.676 -1.391
36 HA LYS 7 HA LYS 7 -12.330 2.579 -2.999
37 1HB LYS 7 2HB LYS 7 -13.368 3.354 -0.734
38 2HB LYS 7 1HB LYS 7 -13.581 1.686 -1.254
39 1HG LYS 7 2HG LYS 7 -12.268 0.855 0.390
40 2HG LYS 7 1HG LYS 7 -11.192 2.261 0.416
41 1HD LYS 7 2HD LYS 7 -12.963 3.545 1.559
42 2HD LYS 7 1HD LYS 7 -13.999 2.118 1.550
43 1HE LYS 7 2HE LYS 7 -13.006 2.243 3.704
44 2HE LYS 7 1HE LYS 7 -12.205 0.929 2.843
45 1HZ LYS 7 1HZ LYS 7 -10.362 2.406 2.363
46 2HZ LYS 7 2HZ LYS 7 -10.625 2.325 4.031
47 3HZ LYS 7 3HZ LYS 7 -11.135 3.682 3.160
48 H ILE 8 H ILE 8 -11.765 4.263 -0.020
49 HA ILE 8 HA ILE 8 -10.584 6.469 -1.477
50 HB ILE 8 HB ILE 8 -12.414 6.881 0.154
51 1HG1 ILE 8 2HG1 ILE 8 -10.655 8.604 -0.404
52 2HG1 ILE 8 1HG1 ILE 8 -11.478 8.847 1.132
53 1HG2 ILE 8 1HG2 ILE 8 -12.208 6.543 2.453
54 2HG2 ILE 8 2HG2 ILE 8 -10.464 6.311 2.357
55 3HG2 ILE 8 3HG2 ILE 8 -11.551 5.069 1.738
56 1HD1 ILE 8 1HD1 ILE 8 -8.674 7.969 0.611
57 2HD1 ILE 8 2HD1 ILE 8 -9.465 7.583 2.137
58 3HD1 ILE 8 3HD1 ILE 8 -9.270 9.265 1.647
59 H ILE 9 H ILE 9 -8.476 6.191 -1.841
60 HA ILE 9 HA ILE 9 -6.829 5.032 0.288
61 HB ILE 9 HB ILE 9 -5.101 4.789 -1.515
62 1HG1 ILE 9 2HG1 ILE 9 -7.444 5.463 -3.312
63 2HG1 ILE 9 1HG1 ILE 9 -6.049 6.500 -3.042
64 1HG2 ILE 9 1HG2 ILE 9 -5.844 2.728 -1.427
65 2HG2 ILE 9 2HG2 ILE 9 -6.970 3.114 -2.726
66 3HG2 ILE 9 3HG2 ILE 9 -7.475 3.276 -1.043
67 1HD1 ILE 9 1HD1 ILE 9 -5.974 5.246 -5.165
68 2HD1 ILE 9 2HD1 ILE 9 -5.917 3.745 -4.241
69 3HD1 ILE 9 3HD1 ILE 9 -4.604 4.916 -4.108
70 H GLY 10 H GLY 10 -4.620 5.768 0.415
71 1HA GLY 10 2HA GLY 10 -4.181 8.614 -0.164
72 2HA GLY 10 1HA GLY 10 -4.027 8.052 1.507
73 H SER 11 H SER 11 -1.931 8.988 -0.579
74 HA SER 11 HA SER 11 -0.223 6.704 -0.100
75 1HB SER 11 2HB SER 11 0.518 6.751 -2.556
76 2HB SER 11 1HB SER 11 -1.052 6.029 -2.212
77 HG SER 11 HG SER 11 -1.062 7.523 -3.988
78 H ARG 12 H ARG 12 1.260 7.628 1.027
79 HA ARG 12 HA ARG 12 3.113 9.397 -0.309
80 1HB ARG 12 2HB ARG 12 1.441 11.013 0.519
81 2HB ARG 12 1HB ARG 12 1.685 10.415 2.154
82 1HG ARG 12 2HG ARG 12 4.094 11.094 1.931
83 2HG ARG 12 1HG ARG 12 3.645 11.898 0.426
84 1HD ARG 12 2HD ARG 12 2.640 12.492 3.202
85 2HD ARG 12 1HD ARG 12 3.615 13.533 2.166
86 HE ARG 12 HE ARG 12 1.350 13.101 0.722
87 1HH1 ARG 12 1HH1 ARG 12 2.012 14.281 3.930
88 2HH1 ARG 12 2HH1 ARG 12 0.612 15.299 3.987
89 1HH2 ARG 12 1HH2 ARG 12 -0.499 14.438 0.786
90 2HH2 ARG 12 2HH2 ARG 12 -0.816 15.388 2.199
91 H THR 13 H THR 13 4.841 7.924 0.155
92 HA THR 13 HA THR 13 5.251 7.540 3.029
93 HB THR 13 HB THR 13 6.416 5.710 1.029
94 HG1 THR 13 1HG THR 13 4.638 4.497 1.060
95 1HG2 THR 13 1HG2 THR 13 6.504 4.164 2.906
96 2HG2 THR 13 2HG2 THR 13 5.746 5.380 3.932
97 3HG2 THR 13 3HG2 THR 13 7.361 5.659 3.282
98 H ALA 14 H ALA 14 7.695 6.918 0.541
99 HA ALA 14 HA ALA 14 9.217 9.195 1.535
100 1HB ALA 14 1HB ALA 14 11.168 7.811 2.126
101 2HB ALA 14 2HB ALA 14 10.191 6.366 1.864
102 3HB ALA 14 3HB ALA 14 9.768 7.495 3.151
103 H GLY 15 H GLY 15 9.740 6.179 -0.326
104 1HA GLY 15 2HA GLY 15 9.906 6.548 -2.806
105 2HA GLY 15 1HA GLY 15 10.988 7.877 -2.413
106 H GLU 16 H GLU 16 12.361 6.501 -0.285
107 HA GLU 16 HA GLU 16 14.431 5.284 -1.720
108 1HB GLU 16 2HB GLU 16 14.904 6.158 0.450
109 2HB GLU 16 1HB GLU 16 13.647 5.180 1.193
110 1HG GLU 16 2HG GLU 16 16.005 3.909 -0.143
111 2HG GLU 16 1HG GLU 16 16.103 4.502 1.515
112 H GLY 17 H GLY 17 11.510 4.052 -0.318
113 1HA GLY 17 2HA GLY 17 11.930 1.506 -1.685
114 2HA GLY 17 1HA GLY 17 11.611 1.462 0.047
115 H ALA 18 H ALA 18 9.753 3.415 0.371
116 HA ALA 18 HA ALA 18 7.554 2.619 -1.390
117 1HB ALA 18 1HB ALA 18 7.479 2.938 1.605
118 2HB ALA 18 2HB ALA 18 7.265 1.436 0.700
119 3HB ALA 18 3HB ALA 18 6.045 2.709 0.601
120 H MET 19 H MET 19 5.898 4.201 -1.764
121 HA MET 19 HA MET 19 6.194 6.833 -0.580
122 1HB MET 19 2HB MET 19 7.293 6.213 -3.115
123 2HB MET 19 1HB MET 19 5.855 7.173 -3.424
124 1HG MET 19 2HG MET 19 6.850 8.743 -1.606
125 2HG MET 19 1HG MET 19 8.352 7.907 -1.990
126 1HE MET 19 1HE MET 19 9.395 7.795 -4.412
127 2HE MET 19 2HE MET 19 8.763 8.669 -5.807
128 3HE MET 19 3HE MET 19 7.870 7.299 -5.146
129 H GLU 20 H GLU 20 4.123 4.574 -0.797
130 HA GLU 20 HA GLU 20 1.888 6.352 -1.315
131 1HB GLU 20 2HB GLU 20 2.062 3.690 -2.686
132 2HB GLU 20 1HB GLU 20 0.717 4.810 -2.799
133 1HG GLU 20 2HG GLU 20 2.540 6.424 -3.740
134 2HG GLU 20 1HG GLU 20 3.458 4.935 -4.018
135 H TYR 21 H TYR 21 -0.258 4.957 -0.934
136 HA TYR 21 HA TYR 21 -0.062 2.939 1.050
137 1HB TYR 21 2HB TYR 21 0.313 4.462 2.662
138 2HB TYR 21 1HB TYR 21 -0.424 5.768 1.777
139 HD1 TYR 21 1HD TYR 21 -2.081 6.750 2.885
140 HD2 TYR 21 2HD TYR 21 -1.687 2.522 3.264
141 HE1 TYR 21 1HE TYR 21 -4.054 6.712 4.305
142 HE2 TYR 21 2HE TYR 21 -3.670 2.480 4.722
143 HH TYR 21 HH TYR 21 -4.925 4.031 6.192
144 H LEU 22 H LEU 22 -1.323 2.711 -1.325
145 HA LEU 22 HA LEU 22 -4.122 3.049 -0.584
146 1HB LEU 22 2HB LEU 22 -4.668 2.973 -2.979
147 2HB LEU 22 1HB LEU 22 -3.569 4.279 -2.583
148 HG LEU 22 HG LEU 22 -1.867 2.224 -3.272
149 1HD1 LEU 22 1HD1 LEU 22 -4.066 2.229 -5.321
150 2HD1 LEU 22 2HD1 LEU 22 -3.965 1.012 -4.051
151 3HD1 LEU 22 3HD1 LEU 22 -2.657 1.172 -5.223
152 1HD2 LEU 22 1HD2 LEU 22 -2.996 4.374 -5.060
153 2HD2 LEU 22 2HD2 LEU 22 -1.458 3.535 -5.272
154 3HD2 LEU 22 3HD2 LEU 22 -1.700 4.596 -3.884
155 H ILE 23 H ILE 23 -5.201 1.614 0.132
156 HA ILE 23 HA ILE 23 -4.643 -1.034 0.163
157 HB ILE 23 HB ILE 23 -6.947 -1.380 0.847
158 1HG1 ILE 23 2HG1 ILE 23 -7.234 1.481 -0.071
159 2HG1 ILE 23 1HG1 ILE 23 -8.152 0.079 -0.610
160 1HG2 ILE 23 1HG2 ILE 23 -5.817 1.146 2.039
161 2HG2 ILE 23 2HG2 ILE 23 -5.154 -0.457 2.349
162 3HG2 ILE 23 3HG2 ILE 23 -6.804 -0.076 2.842
163 1HD1 ILE 23 1HD1 ILE 23 -9.412 1.555 0.904
164 2HD1 ILE 23 2HD1 ILE 23 -8.230 1.207 2.170
165 3HD1 ILE 23 3HD1 ILE 23 -9.237 -0.088 1.521
166 H GLU 24 H GLU 24 -5.877 0.775 -2.452
167 HA GLU 24 HA GLU 24 -7.309 -1.258 -3.751
168 1HB GLU 24 2HB GLU 24 -7.630 1.054 -4.352
169 2HB GLU 24 1HB GLU 24 -5.955 1.185 -4.873
170 1HG GLU 24 2HG GLU 24 -6.345 -0.243 -6.735
171 2HG GLU 24 1HG GLU 24 -7.944 -0.680 -6.139
172 H TRP 25 H TRP 25 -5.594 -2.889 -3.101
173 HA TRP 25 HA TRP 25 -4.053 -3.451 -5.502
174 1HB TRP 25 2HB TRP 25 -2.243 -4.356 -3.767
175 2HB TRP 25 1HB TRP 25 -2.192 -2.725 -4.414
176 HD1 TRP 25 HD TRP 25 -4.221 -4.128 -1.369
177 HE1 TRP 25 1HE TRP 25 -3.625 -2.644 0.665
178 HE3 TRP 25 3HE TRP 25 -0.841 -0.977 -3.531
179 HZ2 TRP 25 2HZ TRP 25 -2.010 -0.479 1.242
180 HZ3 TRP 25 3HZ TRP 25 0.256 0.763 -2.135
181 HH2 TRP 25 HH TRP 25 -0.336 1.035 0.192
182 H LYS 26 H LYS 26 -6.507 -4.427 -4.357
183 HA LYS 26 HA LYS 26 -7.625 -6.379 -4.135
184 1HB LYS 26 2HB LYS 26 -5.050 -7.538 -5.209
185 2HB LYS 26 1HB LYS 26 -6.563 -8.421 -5.056
186 1HG LYS 26 2HG LYS 26 -7.631 -6.939 -6.639
187 2HG LYS 26 1HG LYS 26 -6.169 -5.958 -6.742
188 1HD LYS 26 2HD LYS 26 -6.348 -8.871 -7.505
189 2HD LYS 26 1HD LYS 26 -6.430 -7.523 -8.643
190 1HE LYS 26 2HE LYS 26 -4.111 -8.157 -6.819
191 2HE LYS 26 1HE LYS 26 -4.184 -8.499 -8.547
192 1HZ LYS 26 1HZ LYS 26 -4.270 -5.806 -7.298
193 2HZ LYS 26 2HZ LYS 26 -4.388 -6.114 -8.957
194 3HZ LYS 26 3HZ LYS 26 -2.957 -6.476 -8.130
195 H ASP 27 H ASP 27 -6.167 -5.345 -1.849
196 HA ASP 27 HA ASP 27 -5.432 -5.967 0.227
197 1HB ASP 27 2HB ASP 27 -6.794 -7.694 1.297
198 2HB ASP 27 1HB ASP 27 -7.797 -6.634 0.314
199 H GLY 28 H GLY 28 -3.872 -7.022 -2.033
200 1HA GLY 28 2HA GLY 28 -3.093 -9.644 -1.860
201 2HA GLY 28 1HA GLY 28 -1.988 -8.333 -2.231
202 H HIS 29 H HIS 29 -1.489 -7.001 -0.056
203 HA HIS 29 HA HIS 29 -1.013 -8.900 2.084
204 1HB HIS 29 2HB HIS 29 1.055 -8.799 0.631
205 2HB HIS 29 1HB HIS 29 1.226 -7.100 1.072
206 HD1 HIS 29 1HD HIS 29 1.555 -10.561 2.459
207 HD2 HIS 29 2HD HIS 29 2.158 -6.630 3.659
208 HE1 HIS 29 1HE HIS 29 2.848 -10.706 4.611
209 HE2 HIS 29 2HE HIS 29 3.117 -8.318 5.367
210 H SER 30 H SER 30 -2.496 -7.915 3.304
211 HA SER 30 HA SER 30 -3.478 -6.382 4.673
212 1HB SER 30 2HB SER 30 -0.566 -5.826 5.198
213 2HB SER 30 1HB SER 30 -1.906 -5.484 6.307
214 HG SER 30 HG SER 30 -2.015 -7.538 6.822
215 HA PRO 31 HA PRO 31 -4.050 -2.216 2.491
216 1HB PRO 31 2HB PRO 31 -4.908 -1.583 5.237
217 2HB PRO 31 1HB PRO 31 -5.862 -1.579 3.763
218 1HG PRO 31 2HG PRO 31 -5.666 -3.639 5.816
219 2HG PRO 31 1HG PRO 31 -6.848 -3.479 4.514
220 1HD PRO 31 2HD PRO 31 -5.044 -5.463 4.536
221 2HD PRO 31 1HD PRO 31 -5.547 -4.702 3.010
222 H SER 32 H SER 32 -1.904 -1.792 2.326
223 HA SER 32 HA SER 32 -0.462 -1.097 4.804
224 1HB SER 32 2HB SER 32 0.444 -3.060 3.657
225 2HB SER 32 1HB SER 32 0.678 -2.093 2.197
226 HG SER 32 HG SER 32 2.294 -2.343 4.306
227 H TRP 33 H TRP 33 1.308 0.408 4.581
228 HA TRP 33 HA TRP 33 0.527 2.587 2.805
229 1HB TRP 33 2HB TRP 33 0.857 2.892 5.315
230 2HB TRP 33 1HB TRP 33 2.562 2.541 5.075
231 HD1 TRP 33 HD TRP 33 3.885 4.370 3.444
232 HE1 TRP 33 1HE TRP 33 3.550 6.906 3.298
233 HE3 TRP 33 3HE TRP 33 -0.730 4.746 5.619
234 HZ2 TRP 33 2HZ TRP 33 1.608 8.830 3.989
235 HZ3 TRP 33 3HZ TRP 33 -1.753 6.976 5.829
236 HH2 TRP 33 HH TRP 33 -0.607 8.973 5.009
237 H VAL 34 H VAL 34 1.299 1.765 0.891
238 HA VAL 34 HA VAL 34 4.135 1.950 0.521
239 HB VAL 34 HB VAL 34 2.797 -0.602 0.818
240 1HG1 VAL 34 1HG1 VAL 34 4.499 -0.482 -1.636
241 2HG1 VAL 34 2HG1 VAL 34 2.749 -0.553 -1.631
242 3HG1 VAL 34 3HG1 VAL 34 3.684 -1.847 -0.941
243 1HG2 VAL 34 1HG2 VAL 34 5.695 -0.437 0.437
244 2HG2 VAL 34 2HG2 VAL 34 4.761 -1.148 1.744
245 3HG2 VAL 34 3HG2 VAL 34 5.028 0.589 1.700
246 HA PRO 35 HA PRO 35 3.476 3.111 -3.674
247 1HB PRO 35 2HB PRO 35 5.446 1.725 -4.903
248 2HB PRO 35 1HB PRO 35 5.697 3.153 -3.895
249 1HG PRO 35 2HG PRO 35 5.870 0.260 -3.113
250 2HG PRO 35 1HG PRO 35 7.068 1.545 -2.857
251 1HD PRO 35 2HD PRO 35 5.453 0.897 -0.905
252 2HD PRO 35 1HD PRO 35 5.705 2.588 -1.263
253 H SER 36 H SER 36 1.376 1.727 -3.715
254 HA SER 36 HA SER 36 0.028 0.776 -5.313
255 1HB SER 36 2HB SER 36 2.520 -0.006 -6.829
256 2HB SER 36 1HB SER 36 0.868 0.038 -7.440
257 HG SER 36 HG SER 36 1.587 1.952 -8.068
258 H SER 37 H SER 37 1.676 -0.711 -3.120
259 HA SER 37 HA SER 37 0.233 -3.111 -3.518
260 1HB SER 37 2HB SER 37 3.203 -3.603 -3.447
261 2HB SER 37 1HB SER 37 1.907 -4.722 -3.830
262 HG SER 37 HG SER 37 3.297 -3.496 -5.555
263 H TYR 38 H TYR 38 3.111 -3.666 -1.723
264 HA TYR 38 HA TYR 38 2.404 -2.661 0.789
265 1HB TYR 38 2HB TYR 38 2.009 -5.354 1.340
266 2HB TYR 38 1HB TYR 38 0.776 -4.108 1.394
267 HD1 TYR 38 1HD TYR 38 -1.031 -4.181 -0.073
268 HD2 TYR 38 2HD TYR 38 2.424 -6.493 -0.933
269 HE1 TYR 38 1HE TYR 38 -2.182 -5.164 -2.009
270 HE2 TYR 38 2HE TYR 38 1.276 -7.511 -2.864
271 HH TYR 38 HH TYR 38 -1.652 -6.254 -4.110
272 H ILE 39 H ILE 39 4.281 -2.926 2.030
273 HA ILE 39 HA ILE 39 6.136 -5.002 1.256
274 HB ILE 39 HB ILE 39 7.739 -3.789 0.198
275 1HG1 ILE 39 2HG1 ILE 39 6.904 -1.378 1.830
276 2HG1 ILE 39 1HG1 ILE 39 8.424 -2.256 1.910
277 1HG2 ILE 39 1HG2 ILE 39 6.711 -2.011 -1.235
278 2HG2 ILE 39 2HG2 ILE 39 5.275 -2.167 -0.229
279 3HG2 ILE 39 3HG2 ILE 39 5.815 -3.531 -1.176
280 1HD1 ILE 39 1HD1 ILE 39 8.745 -1.481 -0.521
281 2HD1 ILE 39 2HD1 ILE 39 9.005 -0.336 0.792
282 3HD1 ILE 39 3HD1 ILE 39 7.508 -0.292 -0.133
283 H ALA 40 H ALA 40 4.662 -4.251 3.614
284 HA ALA 40 HA ALA 40 6.331 -2.940 5.468
285 1HB ALA 40 1HB ALA 40 4.866 -3.837 7.145
286 2HB ALA 40 2HB ALA 40 4.260 -5.048 6.013
287 3HB ALA 40 3HB ALA 40 3.923 -3.339 5.739
288 H ALA 41 H ALA 41 8.384 -3.680 5.220
289 HA ALA 41 HA ALA 41 9.602 -5.337 6.893
290 1HB ALA 41 1HB ALA 41 8.596 -7.017 4.604
291 2HB ALA 41 2HB ALA 41 8.396 -7.293 6.336
292 3HB ALA 41 3HB ALA 41 9.981 -7.486 5.589
293 H ASP 42 H ASP 42 10.140 -3.089 5.257
294 HA ASP 42 HA ASP 42 11.757 -2.105 4.015
295 1HB ASP 42 2HB ASP 42 13.316 -4.522 4.945
296 2HB ASP 42 1HB ASP 42 14.028 -3.084 4.215
297 H VAL 43 H VAL 43 10.702 -2.325 1.990
298 HA VAL 43 HA VAL 43 12.245 -3.920 0.110
299 HB VAL 43 HB VAL 43 9.412 -4.194 -0.534
300 1HG1 VAL 43 1HG1 VAL 43 11.712 -6.125 -0.362
301 2HG1 VAL 43 2HG1 VAL 43 11.149 -5.273 -1.801
302 3HG1 VAL 43 3HG1 VAL 43 10.127 -6.493 -1.041
303 1HG2 VAL 43 1HG2 VAL 43 9.172 -4.488 1.880
304 2HG2 VAL 43 2HG2 VAL 43 10.458 -5.695 1.869
305 3HG2 VAL 43 3HG2 VAL 43 8.937 -6.019 1.036
306 H VAL 44 H VAL 44 10.326 -3.487 -2.098
307 HA VAL 44 HA VAL 44 9.850 -0.648 -2.147
308 HB VAL 44 HB VAL 44 12.236 -0.658 -2.581
309 1HG1 VAL 44 1HG1 VAL 44 11.613 -2.370 -4.985
310 2HG1 VAL 44 2HG1 VAL 44 12.376 -2.942 -3.501
311 3HG1 VAL 44 3HG1 VAL 44 13.196 -1.752 -4.512
312 1HG2 VAL 44 1HG2 VAL 44 12.238 0.559 -4.712
313 2HG2 VAL 44 2HG2 VAL 44 10.887 1.038 -3.685
314 3HG2 VAL 44 3HG2 VAL 44 10.616 -0.043 -5.051
315 H SER 45 H SER 45 8.038 -0.356 -3.195
316 HA SER 45 HA SER 45 6.387 -0.422 -4.746
317 1HB SER 45 2HB SER 45 8.242 -0.019 -6.319
318 2HB SER 45 1HB SER 45 8.458 -1.761 -6.494
319 HG SER 45 HG SER 45 7.157 -1.193 -8.152
320 H GLU 46 H GLU 46 7.297 -3.017 -3.135
321 HA GLU 46 HA GLU 46 5.015 -4.529 -3.656
322 1HB GLU 46 2HB GLU 46 6.133 -4.965 -5.835
323 2HB GLU 46 1HB GLU 46 7.468 -5.710 -4.972
324 1HG GLU 46 2HG GLU 46 5.992 -7.430 -4.117
325 2HG GLU 46 1HG GLU 46 4.616 -6.665 -4.912
326 H TYR 47 H TYR 47 4.876 -6.491 -2.444
327 HA TYR 47 HA TYR 47 6.368 -6.421 -0.024
328 1HB TYR 47 2HB TYR 47 4.024 -7.168 -0.080
329 2HB TYR 47 1HB TYR 47 4.486 -8.549 -1.070
330 HD1 TYR 47 1HD TYR 47 5.807 -7.026 2.085
331 HD2 TYR 47 2HD TYR 47 4.385 -10.518 0.114
332 HE1 TYR 47 1HE TYR 47 6.219 -8.338 4.125
333 HE2 TYR 47 2HE TYR 47 4.791 -11.839 2.149
334 HH TYR 47 HH TYR 47 5.468 -10.407 5.167
Start of MODEL 12
1 1H GLY 1 1HT GLY 1 -12.688 -1.620 12.289
2 2H GLY 1 2HT GLY 1 -13.671 -0.915 11.105
3 3H GLY 1 3HT GLY 1 -12.091 -0.357 11.333
4 1HA GLY 1 1HA GLY 1 -11.200 -2.483 10.604
5 2HA GLY 1 2HA GLY 1 -12.841 -3.063 10.368
6 H SER 2 H SER 2 -10.246 -1.225 9.059
7 HA SER 2 HA SER 2 -11.725 -0.985 6.542
8 1HB SER 2 2HB SER 2 -11.894 1.212 7.610
9 2HB SER 2 1HB SER 2 -10.143 1.266 7.808
10 HG SER 2 HG SER 2 -11.025 2.402 5.931
11 H GLY 3 H GLY 3 -10.544 -1.453 4.763
12 1HA GLY 3 2HA GLY 3 -8.091 -1.100 3.941
13 2HA GLY 3 1HA GLY 3 -7.761 -2.258 5.221
14 H GLU 4 H GLU 4 -7.214 -2.571 2.402
15 HA GLU 4 HA GLU 4 -7.350 -4.169 0.799
16 1HB GLU 4 2HB GLU 4 -7.184 -6.138 1.789
17 2HB GLU 4 1HB GLU 4 -7.898 -5.474 3.248
18 1HG GLU 4 2HG GLU 4 -10.136 -6.064 2.396
19 2HG GLU 4 1HG GLU 4 -9.381 -6.783 0.973
20 H VAL 5 H VAL 5 -9.924 -2.376 1.647
21 HA VAL 5 HA VAL 5 -12.035 -3.649 0.195
22 HB VAL 5 HB VAL 5 -11.780 -0.771 1.025
23 1HG1 VAL 5 1HG1 VAL 5 -13.588 -1.163 -0.529
24 2HG1 VAL 5 2HG1 VAL 5 -14.257 -0.863 1.075
25 3HG1 VAL 5 3HG1 VAL 5 -14.181 -2.508 0.445
26 1HG2 VAL 5 1HG2 VAL 5 -11.397 -2.147 2.974
27 2HG2 VAL 5 2HG2 VAL 5 -12.830 -3.111 2.619
28 3HG2 VAL 5 3HG2 VAL 5 -12.999 -1.418 3.081
29 H ASN 6 H ASN 6 -9.815 -0.984 -0.297
30 HA ASN 6 HA ASN 6 -8.844 -0.140 -2.188
31 1HB ASN 6 2HB ASN 6 -10.735 -1.404 -4.107
32 2HB ASN 6 1HB ASN 6 -9.002 -1.155 -4.219
33 1HD2 ASN 6 1HD2 ASN 6 -7.802 -2.499 -2.433
34 2HD2 ASN 6 2HD2 ASN 6 -8.245 -4.166 -2.391
35 H LYS 7 H LYS 7 -9.952 1.637 -1.091
36 HA LYS 7 HA LYS 7 -11.870 2.919 -2.854
37 1HB LYS 7 2HB LYS 7 -13.340 3.324 -0.734
38 2HB LYS 7 1HB LYS 7 -13.453 1.790 -1.591
39 1HG LYS 7 2HG LYS 7 -12.625 0.622 0.111
40 2HG LYS 7 1HG LYS 7 -11.363 1.822 0.487
41 1HD LYS 7 2HD LYS 7 -12.989 1.524 2.332
42 2HD LYS 7 1HD LYS 7 -13.050 3.160 1.680
43 1HE LYS 7 2HE LYS 7 -15.041 2.636 0.427
44 2HE LYS 7 1HE LYS 7 -14.944 0.945 0.914
45 1HZ LYS 7 1HZ LYS 7 -16.572 2.130 2.231
46 2HZ LYS 7 2HZ LYS 7 -15.407 3.252 2.727
47 3HZ LYS 7 3HZ LYS 7 -15.284 1.637 3.213
48 H ILE 8 H ILE 8 -11.987 4.050 0.389
49 HA ILE 8 HA ILE 8 -10.747 6.539 -0.297
50 HB ILE 8 HB ILE 8 -12.778 6.404 1.069
51 1HG1 ILE 8 2HG1 ILE 8 -11.134 8.310 1.296
52 2HG1 ILE 8 1HG1 ILE 8 -12.213 8.081 2.665
53 1HG2 ILE 8 1HG2 ILE 8 -11.416 5.558 3.518
54 2HG2 ILE 8 2HG2 ILE 8 -11.606 4.298 2.298
55 3HG2 ILE 8 3HG2 ILE 8 -13.021 5.157 2.909
56 1HD1 ILE 8 1HD1 ILE 8 -10.178 8.472 3.668
57 2HD1 ILE 8 2HD1 ILE 8 -9.286 7.551 2.459
58 3HD1 ILE 8 3HD1 ILE 8 -10.263 6.710 3.662
59 H ILE 9 H ILE 9 -8.566 6.294 -0.489
60 HA ILE 9 HA ILE 9 -7.159 5.816 1.964
61 HB ILE 9 HB ILE 9 -7.641 3.607 0.944
62 1HG1 ILE 9 2HG1 ILE 9 -5.557 2.656 1.570
63 2HG1 ILE 9 1HG1 ILE 9 -4.680 4.123 1.180
64 1HG2 ILE 9 1HG2 ILE 9 -6.014 2.981 -0.923
65 2HG2 ILE 9 2HG2 ILE 9 -5.943 4.717 -1.210
66 3HG2 ILE 9 3HG2 ILE 9 -7.480 3.868 -1.309
67 1HD1 ILE 9 1HD1 ILE 9 -5.242 5.118 3.140
68 2HD1 ILE 9 2HD1 ILE 9 -5.304 3.429 3.651
69 3HD1 ILE 9 3HD1 ILE 9 -6.790 4.283 3.244
70 H GLY 10 H GLY 10 -4.626 5.926 1.447
71 1HA GLY 10 2HA GLY 10 -4.249 8.134 -0.447
72 2HA GLY 10 1HA GLY 10 -3.711 8.303 1.218
73 H SER 11 H SER 11 -1.818 8.635 -0.656
74 HA SER 11 HA SER 11 -0.181 6.294 -0.257
75 1HB SER 11 2HB SER 11 0.385 6.290 -2.755
76 2HB SER 11 1HB SER 11 -1.182 5.627 -2.304
77 HG SER 11 HG SER 11 -2.122 7.589 -2.909
78 H ARG 12 H ARG 12 1.410 7.407 0.809
79 HA ARG 12 HA ARG 12 3.240 8.850 -0.853
80 1HB ARG 12 2HB ARG 12 1.665 10.659 -0.287
81 2HB ARG 12 1HB ARG 12 1.936 10.352 1.423
82 1HG ARG 12 2HG ARG 12 4.264 10.995 1.194
83 2HG ARG 12 1HG ARG 12 4.041 11.242 -0.539
84 1HD ARG 12 2HD ARG 12 2.399 13.000 -0.068
85 2HD ARG 12 1HD ARG 12 2.641 12.758 1.662
86 HE ARG 12 HE ARG 12 5.124 13.291 0.489
87 1HH1 ARG 12 1HH1 ARG 12 2.099 14.887 1.143
88 2HH1 ARG 12 2HH1 ARG 12 2.805 16.463 1.255
89 1HH2 ARG 12 1HH2 ARG 12 6.066 15.362 0.633
90 2HH2 ARG 12 2HH2 ARG 12 5.063 16.735 0.964
91 H THR 13 H THR 13 4.825 7.235 -0.144
92 HA THR 13 HA THR 13 5.357 7.383 2.695
93 HB THR 13 HB THR 13 6.940 5.469 1.205
94 HG1 THR 13 1HG THR 13 5.295 4.294 0.467
95 1HG2 THR 13 1HG2 THR 13 6.017 4.037 3.119
96 2HG2 THR 13 2HG2 THR 13 5.418 5.566 3.766
97 3HG2 THR 13 3HG2 THR 13 7.146 5.332 3.507
98 H ALA 14 H ALA 14 7.719 6.783 0.121
99 HA ALA 14 HA ALA 14 9.166 9.178 0.961
100 1HB ALA 14 1HB ALA 14 11.208 7.991 1.563
101 2HB ALA 14 2HB ALA 14 10.383 6.449 1.330
102 3HB ALA 14 3HB ALA 14 9.866 7.541 2.616
103 H GLY 15 H GLY 15 9.652 6.130 -0.839
104 1HA GLY 15 2HA GLY 15 9.727 6.403 -3.322
105 2HA GLY 15 1HA GLY 15 10.778 7.784 -3.034
106 H GLU 16 H GLU 16 12.457 6.810 -1.100
107 HA GLU 16 HA GLU 16 14.352 5.370 -2.572
108 1HB GLU 16 2HB GLU 16 15.065 6.691 -0.701
109 2HB GLU 16 1HB GLU 16 14.009 5.811 0.396
110 1HG GLU 16 2HG GLU 16 15.371 3.811 0.116
111 2HG GLU 16 1HG GLU 16 16.417 4.673 -1.011
112 H GLY 17 H GLY 17 11.766 4.413 -0.458
113 1HA GLY 17 2HA GLY 17 12.224 1.604 -1.214
114 2HA GLY 17 1HA GLY 17 11.835 2.040 0.447
115 H ALA 18 H ALA 18 9.803 3.421 0.655
116 HA ALA 18 HA ALA 18 7.771 2.354 -1.136
117 1HB ALA 18 1HB ALA 18 7.617 1.643 1.283
118 2HB ALA 18 2HB ALA 18 6.149 2.374 0.623
119 3HB ALA 18 3HB ALA 18 7.236 3.325 1.648
120 H MET 19 H MET 19 5.916 3.736 -1.659
121 HA MET 19 HA MET 19 6.223 6.544 -1.052
122 1HB MET 19 2HB MET 19 7.386 5.530 -3.400
123 2HB MET 19 1HB MET 19 5.930 6.369 -3.922
124 1HG MET 19 2HG MET 19 7.939 7.598 -2.083
125 2HG MET 19 1HG MET 19 8.053 7.727 -3.835
126 1HE MET 19 1HE MET 19 6.251 8.985 -5.343
127 2HE MET 19 2HE MET 19 4.759 9.673 -4.698
128 3HE MET 19 3HE MET 19 5.008 7.926 -4.676
129 H GLU 20 H GLU 20 4.118 4.215 -1.066
130 HA GLU 20 HA GLU 20 1.911 5.996 -1.589
131 1HB GLU 20 2HB GLU 20 2.232 3.464 -3.160
132 2HB GLU 20 1HB GLU 20 0.715 4.322 -3.037
133 1HG GLU 20 2HG GLU 20 2.208 6.318 -3.881
134 2HG GLU 20 1HG GLU 20 3.223 4.998 -4.476
135 H TYR 21 H TYR 21 -0.279 4.526 -1.116
136 HA TYR 21 HA TYR 21 0.156 2.523 0.857
137 1HB TYR 21 2HB TYR 21 0.603 4.046 2.406
138 2HB TYR 21 1HB TYR 21 -0.207 5.332 1.572
139 HD1 TYR 21 1HD TYR 21 -1.844 6.328 2.705
140 HD2 TYR 21 2HD TYR 21 -1.235 2.168 3.402
141 HE1 TYR 21 1HE TYR 21 -3.600 6.367 4.399
142 HE2 TYR 21 2HE TYR 21 -2.996 2.204 5.116
143 HH TYR 21 HH TYR 21 -4.105 3.816 6.594
144 H LEU 22 H LEU 22 -1.704 3.395 -1.530
145 HA LEU 22 HA LEU 22 -4.194 3.063 -0.272
146 1HB LEU 22 2HB LEU 22 -5.027 3.229 -2.696
147 2HB LEU 22 1HB LEU 22 -4.264 4.626 -1.962
148 HG LEU 22 HG LEU 22 -2.240 4.276 -3.179
149 1HD1 LEU 22 1HD1 LEU 22 -3.486 1.687 -4.036
150 2HD1 LEU 22 2HD1 LEU 22 -1.962 1.938 -3.190
151 3HD1 LEU 22 3HD1 LEU 22 -2.124 2.419 -4.879
152 1HD2 LEU 22 1HD2 LEU 22 -4.605 3.911 -5.007
153 2HD2 LEU 22 2HD2 LEU 22 -3.024 4.543 -5.466
154 3HD2 LEU 22 3HD2 LEU 22 -4.042 5.444 -4.341
155 H ILE 23 H ILE 23 -5.303 1.570 0.155
156 HA ILE 23 HA ILE 23 -5.058 -1.059 -0.178
157 HB ILE 23 HB ILE 23 -7.636 0.473 -0.173
158 1HG1 ILE 23 2HG1 ILE 23 -6.668 -0.692 2.335
159 2HG1 ILE 23 1HG1 ILE 23 -5.669 0.626 1.744
160 1HG2 ILE 23 1HG2 ILE 23 -6.937 -2.351 0.510
161 2HG2 ILE 23 2HG2 ILE 23 -8.075 -1.769 -0.701
162 3HG2 ILE 23 3HG2 ILE 23 -8.431 -1.567 1.006
163 1HD1 ILE 23 1HD1 ILE 23 -8.463 0.637 2.730
164 2HD1 ILE 23 2HD1 ILE 23 -8.022 1.792 1.475
165 3HD1 ILE 23 3HD1 ILE 23 -7.156 1.787 3.011
166 H GLU 24 H GLU 24 -6.087 1.258 -2.512
167 HA GLU 24 HA GLU 24 -7.630 0.268 -4.352
168 1HB GLU 24 2HB GLU 24 -6.024 2.263 -4.438
169 2HB GLU 24 1HB GLU 24 -4.899 1.151 -5.208
170 1HG GLU 24 2HG GLU 24 -6.555 0.716 -6.976
171 2HG GLU 24 1HG GLU 24 -7.633 1.890 -6.224
172 H TRP 25 H TRP 25 -4.464 -1.123 -3.697
173 HA TRP 25 HA TRP 25 -4.250 -2.878 -5.834
174 1HB TRP 25 2HB TRP 25 -3.082 -4.368 -3.959
175 2HB TRP 25 1HB TRP 25 -2.340 -2.897 -4.550
176 HD1 TRP 25 HD TRP 25 -4.654 -3.909 -1.559
177 HE1 TRP 25 1HE TRP 25 -3.878 -2.522 0.477
178 HE3 TRP 25 3HE TRP 25 -0.981 -1.097 -3.746
179 HZ2 TRP 25 2HZ TRP 25 -2.032 -0.570 1.080
180 HZ3 TRP 25 3HZ TRP 25 0.305 0.459 -2.321
181 HH2 TRP 25 HH TRP 25 -0.215 0.765 0.017
182 H LYS 26 H LYS 26 -4.270 -5.529 -4.674
183 HA LYS 26 HA LYS 26 -7.174 -5.845 -4.362
184 1HB LYS 26 2HB LYS 26 -6.728 -8.183 -5.332
185 2HB LYS 26 1HB LYS 26 -6.683 -6.815 -6.434
186 1HG LYS 26 2HG LYS 26 -4.146 -7.734 -5.176
187 2HG LYS 26 1HG LYS 26 -4.837 -8.663 -6.507
188 1HD LYS 26 2HD LYS 26 -4.810 -6.703 -7.932
189 2HD LYS 26 1HD LYS 26 -4.226 -5.707 -6.598
190 1HE LYS 26 2HE LYS 26 -2.180 -7.064 -6.502
191 2HE LYS 26 1HE LYS 26 -2.765 -8.023 -7.861
192 1HZ LYS 26 1HZ LYS 26 -2.742 -6.033 -9.230
193 2HZ LYS 26 2HZ LYS 26 -1.207 -6.325 -8.581
194 3HZ LYS 26 3HZ LYS 26 -2.184 -5.111 -7.925
195 H ASP 27 H ASP 27 -6.027 -5.383 -2.074
196 HA ASP 27 HA ASP 27 -5.424 -6.163 -0.011
197 1HB ASP 27 2HB ASP 27 -6.870 -7.948 0.825
198 2HB ASP 27 1HB ASP 27 -7.793 -6.808 -0.149
199 H GLY 28 H GLY 28 -3.715 -7.072 -2.239
200 1HA GLY 28 2HA GLY 28 -2.974 -9.721 -2.152
201 2HA GLY 28 1HA GLY 28 -1.845 -8.406 -2.423
202 H HIS 29 H HIS 29 -1.318 -7.183 -0.234
203 HA HIS 29 HA HIS 29 -1.067 -9.143 1.901
204 1HB HIS 29 2HB HIS 29 1.320 -7.437 1.142
205 2HB HIS 29 1HB HIS 29 1.250 -8.805 2.246
206 HD1 HIS 29 1HD HIS 29 0.498 -11.154 0.930
207 HD2 HIS 29 2HD HIS 29 2.316 -8.138 -1.273
208 HE1 HIS 29 1HE HIS 29 1.384 -12.275 -1.139
209 HE2 HIS 29 2HE HIS 29 2.591 -10.454 -2.392
210 H SER 30 H SER 30 -2.513 -8.117 3.110
211 HA SER 30 HA SER 30 -3.436 -6.579 4.507
212 1HB SER 30 2HB SER 30 -1.483 -7.431 5.720
213 2HB SER 30 1HB SER 30 -0.517 -6.100 5.062
214 HG SER 30 HG SER 30 -2.085 -6.107 7.224
215 HA PRO 31 HA PRO 31 -3.852 -2.421 2.324
216 1HB PRO 31 2HB PRO 31 -4.786 -1.734 5.009
217 2HB PRO 31 1HB PRO 31 -5.706 -1.796 3.510
218 1HG PRO 31 2HG PRO 31 -5.439 -3.835 5.619
219 2HG PRO 31 1HG PRO 31 -6.695 -3.658 4.394
220 1HD PRO 31 2HD PRO 31 -4.978 -5.664 4.237
221 2HD PRO 31 1HD PRO 31 -5.430 -4.790 2.756
222 H SER 32 H SER 32 -1.741 -1.901 2.170
223 HA SER 32 HA SER 32 -0.322 -1.228 4.664
224 1HB SER 32 2HB SER 32 0.548 -3.288 3.632
225 2HB SER 32 1HB SER 32 0.859 -2.391 2.139
226 HG SER 32 HG SER 32 2.567 -1.508 3.021
227 H TRP 33 H TRP 33 1.709 -0.036 4.171
228 HA TRP 33 HA TRP 33 1.026 2.208 2.440
229 1HB TRP 33 2HB TRP 33 1.449 2.417 4.987
230 2HB TRP 33 1HB TRP 33 3.152 2.165 4.602
231 HD1 TRP 33 HD TRP 33 4.107 3.964 2.706
232 HE1 TRP 33 1HE TRP 33 3.666 6.480 2.556
233 HE3 TRP 33 3HE TRP 33 -0.105 4.253 5.577
234 HZ2 TRP 33 2HZ TRP 33 1.799 8.358 3.487
235 HZ3 TRP 33 3HZ TRP 33 -1.169 6.455 5.883
236 HH2 TRP 33 HH TRP 33 -0.238 8.464 4.841
237 H VAL 34 H VAL 34 1.813 1.681 0.499
238 HA VAL 34 HA VAL 34 4.679 1.170 0.107
239 HB VAL 34 HB VAL 34 3.595 -1.107 0.366
240 1HG1 VAL 34 1HG1 VAL 34 1.502 0.255 -0.745
241 2HG1 VAL 34 2HG1 VAL 34 1.543 -1.459 -0.423
242 3HG1 VAL 34 3HG1 VAL 34 1.970 -0.851 -2.013
243 1HG2 VAL 34 1HG2 VAL 34 5.361 -1.051 -1.275
244 2HG2 VAL 34 2HG2 VAL 34 4.264 -0.403 -2.490
245 3HG2 VAL 34 3HG2 VAL 34 4.043 -2.038 -1.891
246 HA PRO 35 HA PRO 35 4.295 3.623 -3.594
247 1HB PRO 35 2HB PRO 35 5.670 1.388 -4.952
248 2HB PRO 35 1HB PRO 35 6.076 3.108 -4.933
249 1HG PRO 35 2HG PRO 35 7.448 1.313 -3.527
250 2HG PRO 35 1HG PRO 35 7.132 2.938 -2.883
251 1HD PRO 35 2HD PRO 35 5.946 0.360 -2.194
252 2HD PRO 35 1HD PRO 35 6.163 1.738 -1.165
253 H SER 36 H SER 36 2.961 0.430 -3.571
254 HA SER 36 HA SER 36 0.897 0.973 -5.307
255 1HB SER 36 2HB SER 36 1.632 -0.314 -7.365
256 2HB SER 36 1HB SER 36 2.382 1.264 -7.142
257 HG SER 36 HG SER 36 4.240 0.275 -6.455
258 H SER 37 H SER 37 2.919 -1.436 -3.795
259 HA SER 37 HA SER 37 0.748 -3.362 -4.166
260 1HB SER 37 2HB SER 37 3.670 -3.619 -4.216
261 2HB SER 37 1HB SER 37 2.843 -4.865 -3.289
262 HG SER 37 HG SER 37 1.554 -5.265 -5.148
263 H TYR 38 H TYR 38 3.276 -3.777 -1.767
264 HA TYR 38 HA TYR 38 2.061 -2.752 0.546
265 1HB TYR 38 2HB TYR 38 1.707 -5.541 1.011
266 2HB TYR 38 1HB TYR 38 0.539 -4.249 1.218
267 HD1 TYR 38 1HD TYR 38 -1.372 -4.375 0.064
268 HD2 TYR 38 2HD TYR 38 2.072 -6.277 -1.519
269 HE1 TYR 38 1HE TYR 38 -2.742 -5.289 -1.782
270 HE2 TYR 38 2HE TYR 38 0.730 -7.199 -3.377
271 HH TYR 38 HH TYR 38 -2.479 -6.161 -4.015
272 H ILE 39 H ILE 39 3.719 -2.592 1.883
273 HA ILE 39 HA ILE 39 5.680 -4.746 1.915
274 HB ILE 39 HB ILE 39 7.518 -3.438 1.309
275 1HG1 ILE 39 2HG1 ILE 39 5.712 -1.011 1.500
276 2HG1 ILE 39 1HG1 ILE 39 7.077 -1.380 2.548
277 1HG2 ILE 39 1HG2 ILE 39 6.831 -2.478 -0.892
278 2HG2 ILE 39 2HG2 ILE 39 5.161 -2.743 -0.401
279 3HG2 ILE 39 3HG2 ILE 39 6.244 -4.111 -0.583
280 1HD1 ILE 39 1HD1 ILE 39 8.051 -1.366 -0.091
281 2HD1 ILE 39 2HD1 ILE 39 8.384 -0.220 1.208
282 3HD1 ILE 39 3HD1 ILE 39 7.038 0.064 0.104
283 H ALA 40 H ALA 40 3.748 -3.786 3.760
284 HA ALA 40 HA ALA 40 4.855 -2.072 5.685
285 1HB ALA 40 1HB ALA 40 2.494 -3.399 5.266
286 2HB ALA 40 2HB ALA 40 2.878 -2.359 6.638
287 3HB ALA 40 3HB ALA 40 3.104 -4.105 6.764
288 H ALA 41 H ALA 41 6.955 -2.593 6.045
289 HA ALA 41 HA ALA 41 7.739 -4.018 8.193
290 1HB ALA 41 1HB ALA 41 8.786 -6.091 7.155
291 2HB ALA 41 2HB ALA 41 7.733 -5.807 5.769
292 3HB ALA 41 3HB ALA 41 7.036 -6.118 7.359
293 H ASP 42 H ASP 42 8.854 -4.080 4.804
294 HA ASP 42 HA ASP 42 10.639 -2.035 4.787
295 1HB ASP 42 2HB ASP 42 11.862 -2.901 6.665
296 2HB ASP 42 1HB ASP 42 11.940 -4.508 5.952
297 H VAL 43 H VAL 43 9.750 -2.288 2.623
298 HA VAL 43 HA VAL 43 11.562 -3.854 0.957
299 HB VAL 43 HB VAL 43 8.758 -4.097 0.050
300 1HG1 VAL 43 1HG1 VAL 43 11.328 -5.434 -0.259
301 2HG1 VAL 43 2HG1 VAL 43 9.963 -5.329 -1.370
302 3HG1 VAL 43 3HG1 VAL 43 9.973 -6.547 -0.096
303 1HG2 VAL 43 1HG2 VAL 43 8.544 -4.599 2.472
304 2HG2 VAL 43 2HG2 VAL 43 9.777 -5.846 2.292
305 3HG2 VAL 43 3HG2 VAL 43 8.235 -6.002 1.450
306 H VAL 44 H VAL 44 10.050 -3.405 -1.499
307 HA VAL 44 HA VAL 44 9.781 -0.506 -1.570
308 HB VAL 44 HB VAL 44 11.390 -0.159 -3.319
309 1HG1 VAL 44 1HG1 VAL 44 12.820 -1.828 -1.276
310 2HG1 VAL 44 2HG1 VAL 44 12.074 -0.288 -0.856
311 3HG1 VAL 44 3HG1 VAL 44 13.358 -0.345 -2.065
312 1HG2 VAL 44 1HG2 VAL 44 11.367 -2.094 -4.628
313 2HG2 VAL 44 2HG2 VAL 44 11.671 -3.145 -3.245
314 3HG2 VAL 44 3HG2 VAL 44 12.960 -2.119 -3.870
315 H SER 45 H SER 45 7.846 -0.254 -2.445
316 HA SER 45 HA SER 45 6.093 -0.329 -3.906
317 1HB SER 45 2HB SER 45 7.751 0.630 -5.415
318 2HB SER 45 1HB SER 45 8.302 -0.986 -5.862
319 HG SER 45 HG SER 45 6.805 -0.076 -7.368
320 H GLU 46 H GLU 46 7.193 -2.993 -2.698
321 HA GLU 46 HA GLU 46 5.187 -4.661 -3.662
322 1HB GLU 46 2HB GLU 46 7.216 -4.374 -5.519
323 2HB GLU 46 1HB GLU 46 7.589 -5.911 -4.738
324 1HG GLU 46 2HG GLU 46 5.293 -6.679 -5.220
325 2HG GLU 46 1HG GLU 46 4.994 -5.167 -6.075
326 H TYR 47 H TYR 47 4.902 -6.292 -2.243
327 HA TYR 47 HA TYR 47 6.515 -6.547 0.031
328 1HB TYR 47 2HB TYR 47 4.165 -7.249 0.028
329 2HB TYR 47 1HB TYR 47 4.540 -8.541 -1.108
330 HD1 TYR 47 1HD TYR 47 5.257 -7.318 2.328
331 HD2 TYR 47 2HD TYR 47 5.238 -10.636 -0.335
332 HE1 TYR 47 1HE TYR 47 5.728 -8.826 4.213
333 HE2 TYR 47 2HE TYR 47 5.710 -12.154 1.543
334 HH TYR 47 HH TYR 47 6.709 -12.039 3.796
Start of MODEL 13
1 1H GLY 1 1HT GLY 1 -12.672 -4.196 9.480
2 2H GLY 1 2HT GLY 1 -12.432 -4.101 7.808
3 3H GLY 1 3HT GLY 1 -13.944 -3.728 8.466
4 1HA GLY 1 1HA GLY 1 -12.783 -1.709 7.861
5 2HA GLY 1 2HA GLY 1 -13.026 -1.809 9.597
6 H SER 2 H SER 2 -10.626 -3.205 7.361
7 HA SER 2 HA SER 2 -8.528 -1.972 9.023
8 1HB SER 2 2HB SER 2 -8.579 -4.391 9.390
9 2HB SER 2 1HB SER 2 -8.452 -4.673 7.655
10 HG SER 2 HG SER 2 -6.451 -4.732 9.022
11 H GLY 3 H GLY 3 -9.160 -3.365 5.801
12 1HA GLY 3 2HA GLY 3 -8.353 -1.119 4.356
13 2HA GLY 3 1HA GLY 3 -6.940 -2.143 4.549
14 H GLU 4 H GLU 4 -6.824 -2.516 2.321
15 HA GLU 4 HA GLU 4 -7.310 -3.458 0.310
16 1HB GLU 4 2HB GLU 4 -7.839 -5.840 0.417
17 2HB GLU 4 1HB GLU 4 -6.587 -5.403 1.567
18 1HG GLU 4 2HG GLU 4 -8.037 -6.952 2.624
19 2HG GLU 4 1HG GLU 4 -8.331 -5.381 3.349
20 H VAL 5 H VAL 5 -9.482 -1.855 1.504
21 HA VAL 5 HA VAL 5 -11.963 -3.074 0.762
22 HB VAL 5 HB VAL 5 -11.348 -0.170 1.303
23 1HG1 VAL 5 1HG1 VAL 5 -13.484 -0.384 0.276
24 2HG1 VAL 5 2HG1 VAL 5 -13.773 -0.166 2.002
25 3HG1 VAL 5 3HG1 VAL 5 -13.907 -1.770 1.281
26 1HG2 VAL 5 1HG2 VAL 5 -12.154 -2.365 3.221
27 2HG2 VAL 5 2HG2 VAL 5 -12.082 -0.648 3.616
28 3HG2 VAL 5 3HG2 VAL 5 -10.609 -1.514 3.180
29 H ASN 6 H ASN 6 -9.501 -1.554 -1.014
30 HA ASN 6 HA ASN 6 -9.408 -0.407 -3.031
31 1HB ASN 6 2HB ASN 6 -9.950 -2.870 -3.538
32 2HB ASN 6 1HB ASN 6 -11.599 -2.332 -3.833
33 1HD2 ASN 6 1HD2 ASN 6 -8.311 -2.238 -4.943
34 2HD2 ASN 6 2HD2 ASN 6 -8.645 -1.602 -6.514
35 H LYS 7 H LYS 7 -10.232 1.516 -2.252
36 HA LYS 7 HA LYS 7 -12.731 2.333 -3.427
37 1HB LYS 7 2HB LYS 7 -13.578 3.220 -1.279
38 2HB LYS 7 1HB LYS 7 -13.381 1.475 -1.224
39 1HG LYS 7 2HG LYS 7 -11.251 1.739 -0.026
40 2HG LYS 7 1HG LYS 7 -11.450 3.493 -0.084
41 1HD LYS 7 2HD LYS 7 -13.456 3.359 1.258
42 2HD LYS 7 1HD LYS 7 -13.383 1.597 1.244
43 1HE LYS 7 2HE LYS 7 -11.271 1.664 2.459
44 2HE LYS 7 1HE LYS 7 -11.304 3.426 2.441
45 1HZ LYS 7 1HZ LYS 7 -13.309 3.378 3.772
46 2HZ LYS 7 2HZ LYS 7 -12.076 2.524 4.552
47 3HZ LYS 7 3HZ LYS 7 -13.316 1.687 3.765
48 H ILE 8 H ILE 8 -12.353 4.675 -1.317
49 HA ILE 8 HA ILE 8 -10.512 6.199 -2.971
50 HB ILE 8 HB ILE 8 -12.775 6.970 -2.425
51 1HG1 ILE 8 2HG1 ILE 8 -10.943 8.545 -3.041
52 2HG1 ILE 8 1HG1 ILE 8 -12.189 9.285 -2.042
53 1HG2 ILE 8 1HG2 ILE 8 -13.539 7.450 -0.319
54 2HG2 ILE 8 2HG2 ILE 8 -11.913 7.708 0.315
55 3HG2 ILE 8 3HG2 ILE 8 -12.486 6.067 0.009
56 1HD1 ILE 8 1HD1 ILE 8 -10.651 8.785 -0.069
57 2HD1 ILE 8 2HD1 ILE 8 -10.178 10.074 -1.175
58 3HD1 ILE 8 3HD1 ILE 8 -9.403 8.494 -1.281
59 H ILE 9 H ILE 9 -8.424 6.142 -2.309
60 HA ILE 9 HA ILE 9 -7.924 6.781 0.464
61 HB ILE 9 HB ILE 9 -8.113 4.225 -0.401
62 1HG1 ILE 9 2HG1 ILE 9 -8.129 5.217 1.923
63 2HG1 ILE 9 1HG1 ILE 9 -7.429 3.613 1.775
64 1HG2 ILE 9 1HG2 ILE 9 -5.170 4.447 0.032
65 2HG2 ILE 9 2HG2 ILE 9 -5.838 4.730 -1.576
66 3HG2 ILE 9 3HG2 ILE 9 -6.112 3.208 -0.773
67 1HD1 ILE 9 1HD1 ILE 9 -5.890 4.574 3.126
68 2HD1 ILE 9 2HD1 ILE 9 -6.163 6.189 2.476
69 3HD1 ILE 9 3HD1 ILE 9 -5.198 5.025 1.568
70 H GLY 10 H GLY 10 -5.507 7.006 0.854
71 1HA GLY 10 2HA GLY 10 -4.369 8.552 -1.364
72 2HA GLY 10 1HA GLY 10 -4.040 8.834 0.339
73 H SER 11 H SER 11 -1.931 8.703 -1.277
74 HA SER 11 HA SER 11 -0.535 6.366 -0.404
75 1HB SER 11 2HB SER 11 0.262 6.090 -2.924
76 2HB SER 11 1HB SER 11 -1.156 5.242 -2.306
77 HG SER 11 HG SER 11 -2.423 6.962 -3.152
78 H ARG 12 H ARG 12 1.029 7.471 0.619
79 HA ARG 12 HA ARG 12 2.988 8.812 -1.033
80 1HB ARG 12 2HB ARG 12 1.241 10.563 -0.411
81 2HB ARG 12 1HB ARG 12 1.796 10.386 1.247
82 1HG ARG 12 2HG ARG 12 3.563 11.181 -1.057
83 2HG ARG 12 1HG ARG 12 2.783 12.316 0.045
84 1HD ARG 12 2HD ARG 12 3.954 11.091 1.924
85 2HD ARG 12 1HD ARG 12 4.890 10.263 0.680
86 HE ARG 12 HE ARG 12 5.142 12.947 0.133
87 1HH1 ARG 12 1HH1 ARG 12 5.853 10.842 2.813
88 2HH1 ARG 12 2HH1 ARG 12 7.196 11.784 3.366
89 1HH2 ARG 12 1HH2 ARG 12 6.911 14.198 0.852
90 2HH2 ARG 12 2HH2 ARG 12 7.798 13.693 2.251
91 H THR 13 H THR 13 4.659 7.446 -0.314
92 HA THR 13 HA THR 13 4.980 7.395 2.604
93 HB THR 13 HB THR 13 6.538 5.431 1.097
94 HG1 THR 13 1HG THR 13 4.691 4.070 0.913
95 1HG2 THR 13 1HG2 THR 13 5.655 4.016 3.001
96 2HG2 THR 13 2HG2 THR 13 4.975 5.510 3.648
97 3HG2 THR 13 3HG2 THR 13 6.717 5.353 3.437
98 H ALA 14 H ALA 14 7.483 6.723 0.154
99 HA ALA 14 HA ALA 14 8.944 9.080 1.036
100 1HB ALA 14 1HB ALA 14 9.523 7.364 2.694
101 2HB ALA 14 2HB ALA 14 10.915 7.872 1.738
102 3HB ALA 14 3HB ALA 14 10.124 6.333 1.396
103 H GLY 15 H GLY 15 9.436 6.021 -0.758
104 1HA GLY 15 2HA GLY 15 9.550 6.269 -3.232
105 2HA GLY 15 1HA GLY 15 10.568 7.673 -2.944
106 H GLU 16 H GLU 16 12.192 6.618 -0.904
107 HA GLU 16 HA GLU 16 14.191 5.350 -2.395
108 1HB GLU 16 2HB GLU 16 14.743 6.582 -0.397
109 2HB GLU 16 1HB GLU 16 13.756 5.514 0.592
110 1HG GLU 16 2HG GLU 16 15.281 3.663 0.107
111 2HG GLU 16 1HG GLU 16 16.270 4.742 -0.878
112 H GLY 17 H GLY 17 11.460 4.099 -0.690
113 1HA GLY 17 2HA GLY 17 12.089 1.421 -1.648
114 2HA GLY 17 1HA GLY 17 11.873 1.612 0.086
115 H ALA 18 H ALA 18 9.821 3.452 0.184
116 HA ALA 18 HA ALA 18 7.656 2.200 -1.301
117 1HB ALA 18 1HB ALA 18 6.204 2.278 0.720
118 2HB ALA 18 2HB ALA 18 7.630 2.720 1.662
119 3HB ALA 18 3HB ALA 18 7.549 1.139 0.868
120 H MET 19 H MET 19 5.755 3.593 -1.593
121 HA MET 19 HA MET 19 5.949 6.307 -0.780
122 1HB MET 19 2HB MET 19 7.536 5.763 -2.894
123 2HB MET 19 1HB MET 19 6.052 6.216 -3.723
124 1HG MET 19 2HG MET 19 6.015 8.330 -2.545
125 2HG MET 19 1HG MET 19 7.463 7.870 -1.657
126 1HE MET 19 1HE MET 19 8.600 10.736 -4.150
127 2HE MET 19 2HE MET 19 8.575 10.240 -2.459
128 3HE MET 19 3HE MET 19 7.062 10.574 -3.302
129 H GLU 20 H GLU 20 3.880 4.218 -0.835
130 HA GLU 20 HA GLU 20 1.764 5.920 -1.769
131 1HB GLU 20 2HB GLU 20 2.020 3.149 -2.873
132 2HB GLU 20 1HB GLU 20 0.629 4.180 -3.086
133 1HG GLU 20 2HG GLU 20 2.201 5.832 -4.178
134 2HG GLU 20 1HG GLU 20 3.411 4.538 -4.174
135 H TYR 21 H TYR 21 -0.401 3.787 -1.318
136 HA TYR 21 HA TYR 21 0.333 3.082 1.340
137 1HB TYR 21 2HB TYR 21 0.005 5.043 2.012
138 2HB TYR 21 1HB TYR 21 -1.189 5.442 0.841
139 HD1 TYR 21 1HD TYR 21 -2.718 6.643 2.439
140 HD2 TYR 21 2HD TYR 21 -1.433 2.615 3.070
141 HE1 TYR 21 1HE TYR 21 -4.478 6.323 4.132
142 HE2 TYR 21 2HE TYR 21 -3.154 2.313 4.761
143 HH TYR 21 HH TYR 21 -5.733 4.488 5.186
144 H LEU 22 H LEU 22 -2.889 3.728 0.311
145 HA LEU 22 HA LEU 22 -3.460 1.035 1.309
146 1HB LEU 22 2HB LEU 22 -4.397 3.360 2.345
147 2HB LEU 22 1HB LEU 22 -5.718 2.860 1.316
148 HG LEU 22 HG LEU 22 -5.986 0.796 2.493
149 1HD1 LEU 22 1HD1 LEU 22 -4.301 0.863 4.680
150 2HD1 LEU 22 2HD1 LEU 22 -3.262 1.314 3.329
151 3HD1 LEU 22 3HD1 LEU 22 -4.162 -0.201 3.281
152 1HD2 LEU 22 1HD2 LEU 22 -6.720 1.559 4.591
153 2HD2 LEU 22 2HD2 LEU 22 -6.881 2.936 3.501
154 3HD2 LEU 22 3HD2 LEU 22 -5.528 2.854 4.625
155 H ILE 23 H ILE 23 -5.492 0.167 0.778
156 HA ILE 23 HA ILE 23 -6.195 -1.251 -0.891
157 HB ILE 23 HB ILE 23 -8.313 -0.299 -1.644
158 1HG1 ILE 23 2HG1 ILE 23 -8.996 1.936 -0.953
159 2HG1 ILE 23 1HG1 ILE 23 -7.403 2.237 -0.320
160 1HG2 ILE 23 1HG2 ILE 23 -7.685 0.477 1.178
161 2HG2 ILE 23 2HG2 ILE 23 -7.900 -1.188 0.641
162 3HG2 ILE 23 3HG2 ILE 23 -9.244 -0.041 0.530
163 1HD1 ILE 23 1HD1 ILE 23 -7.863 3.340 -2.486
164 2HD1 ILE 23 2HD1 ILE 23 -8.003 1.748 -3.225
165 3HD1 ILE 23 3HD1 ILE 23 -6.468 2.267 -2.528
166 H GLU 24 H GLU 24 -7.559 -0.126 -3.332
167 HA GLU 24 HA GLU 24 -7.045 0.111 -5.530
168 1HB GLU 24 2HB GLU 24 -5.734 2.125 -4.318
169 2HB GLU 24 1HB GLU 24 -4.345 1.221 -4.907
170 1HG GLU 24 2HG GLU 24 -6.617 2.209 -6.618
171 2HG GLU 24 1HG GLU 24 -5.051 3.001 -6.444
172 H TRP 25 H TRP 25 -5.995 -2.143 -3.669
173 HA TRP 25 HA TRP 25 -4.513 -3.505 -5.726
174 1HB TRP 25 2HB TRP 25 -2.734 -4.199 -4.045
175 2HB TRP 25 1HB TRP 25 -2.628 -2.570 -4.690
176 HD1 TRP 25 HD TRP 25 -4.867 -3.633 -1.689
177 HE1 TRP 25 1HE TRP 25 -4.044 -2.307 0.396
178 HE3 TRP 25 3HE TRP 25 -0.830 -1.228 -3.702
179 HZ2 TRP 25 2HZ TRP 25 -2.021 -0.632 1.064
180 HZ3 TRP 25 3HZ TRP 25 0.522 0.225 -2.212
181 HH2 TRP 25 HH TRP 25 -0.079 0.592 0.088
182 H LYS 26 H LYS 26 -7.054 -3.719 -4.404
183 HA LYS 26 HA LYS 26 -8.324 -5.154 -3.072
184 1HB LYS 26 2HB LYS 26 -8.814 -7.099 -4.529
185 2HB LYS 26 1HB LYS 26 -8.816 -5.553 -5.367
186 1HG LYS 26 2HG LYS 26 -6.532 -6.026 -6.176
187 2HG LYS 26 1HG LYS 26 -6.622 -7.614 -5.409
188 1HD LYS 26 2HD LYS 26 -8.446 -6.585 -7.582
189 2HD LYS 26 1HD LYS 26 -7.144 -7.756 -7.791
190 1HE LYS 26 2HE LYS 26 -8.295 -9.281 -6.240
191 2HE LYS 26 1HE LYS 26 -9.610 -8.115 -6.090
192 1HZ LYS 26 1HZ LYS 26 -10.156 -9.840 -7.680
193 2HZ LYS 26 2HZ LYS 26 -8.779 -9.480 -8.595
194 3HZ LYS 26 3HZ LYS 26 -10.027 -8.347 -8.466
195 H ASP 27 H ASP 27 -6.773 -5.434 -1.226
196 HA ASP 27 HA ASP 27 -5.592 -6.756 0.231
197 1HB ASP 27 2HB ASP 27 -6.747 -9.116 0.383
198 2HB ASP 27 1HB ASP 27 -7.602 -7.672 0.891
199 H GLY 28 H GLY 28 -3.733 -6.741 -1.482
200 1HA GLY 28 2HA GLY 28 -3.276 -9.396 -2.602
201 2HA GLY 28 1HA GLY 28 -2.223 -8.007 -2.786
202 H HIS 29 H HIS 29 -1.381 -7.207 -0.492
203 HA HIS 29 HA HIS 29 -0.749 -9.542 1.156
204 1HB HIS 29 2HB HIS 29 1.218 -9.150 -0.301
205 2HB HIS 29 1HB HIS 29 1.349 -7.494 0.294
206 HD1 HIS 29 1HD HIS 29 2.771 -7.160 2.289
207 HD2 HIS 29 2HD HIS 29 1.628 -11.130 1.846
208 HE1 HIS 29 1HE HIS 29 4.027 -8.422 4.063
209 HE2 HIS 29 2HE HIS 29 3.251 -10.807 3.835
210 H SER 30 H SER 30 -2.111 -8.913 2.764
211 HA SER 30 HA SER 30 -3.004 -7.617 4.462
212 1HB SER 30 2HB SER 30 -0.856 -8.590 5.312
213 2HB SER 30 1HB SER 30 -0.072 -7.056 4.892
214 HG SER 30 HG SER 30 -2.340 -7.181 6.586
215 HA PRO 31 HA PRO 31 -3.480 -3.414 2.441
216 1HB PRO 31 2HB PRO 31 -4.729 -3.170 5.134
217 2HB PRO 31 1HB PRO 31 -5.369 -2.711 3.558
218 1HG PRO 31 2HG PRO 31 -5.888 -5.110 5.002
219 2HG PRO 31 1HG PRO 31 -6.436 -4.699 3.372
220 1HD PRO 31 2HD PRO 31 -4.669 -6.748 3.974
221 2HD PRO 31 1HD PRO 31 -4.811 -5.966 2.382
222 H SER 32 H SER 32 -1.567 -2.405 2.508
223 HA SER 32 HA SER 32 -0.355 -1.856 5.151
224 1HB SER 32 2HB SER 32 0.763 -3.633 3.711
225 2HB SER 32 1HB SER 32 1.143 -2.339 2.561
226 HG SER 32 HG SER 32 2.886 -2.343 3.823
227 H TRP 33 H TRP 33 1.857 -0.425 3.910
228 HA TRP 33 HA TRP 33 0.626 1.824 2.508
229 1HB TRP 33 2HB TRP 33 0.910 2.371 4.969
230 2HB TRP 33 1HB TRP 33 2.639 2.103 4.773
231 HD1 TRP 33 HD TRP 33 3.744 3.767 2.723
232 HE1 TRP 33 1HE TRP 33 3.297 6.272 2.355
233 HE3 TRP 33 3HE TRP 33 -0.606 4.221 5.374
234 HZ2 TRP 33 2HZ TRP 33 1.352 8.188 3.086
235 HZ3 TRP 33 3HZ TRP 33 -1.693 6.429 5.480
236 HH2 TRP 33 HH TRP 33 -0.732 8.369 4.338
237 H VAL 34 H VAL 34 1.553 1.209 0.581
238 HA VAL 34 HA VAL 34 4.411 1.472 0.291
239 HB VAL 34 HB VAL 34 3.082 -1.158 0.416
240 1HG1 VAL 34 1HG1 VAL 34 5.413 -1.325 -1.340
241 2HG1 VAL 34 2HG1 VAL 34 3.942 -0.756 -2.104
242 3HG1 VAL 34 3HG1 VAL 34 3.962 -2.281 -1.283
243 1HG2 VAL 34 1HG2 VAL 34 5.409 -1.765 1.105
244 2HG2 VAL 34 2HG2 VAL 34 4.644 -0.530 2.072
245 3HG2 VAL 34 3HG2 VAL 34 5.847 -0.084 0.866
246 HA PRO 35 HA PRO 35 3.535 2.777 -3.792
247 1HB PRO 35 2HB PRO 35 5.520 1.078 -5.014
248 2HB PRO 35 1HB PRO 35 5.441 2.837 -4.888
249 1HG PRO 35 2HG PRO 35 7.175 1.259 -3.512
250 2HG PRO 35 1HG PRO 35 6.660 2.864 -2.998
251 1HD PRO 35 2HD PRO 35 5.883 0.230 -1.989
252 2HD PRO 35 1HD PRO 35 5.873 1.755 -1.141
253 H SER 36 H SER 36 1.458 1.541 -3.760
254 HA SER 36 HA SER 36 -0.076 0.446 -5.046
255 1HB SER 36 2HB SER 36 0.953 1.467 -6.982
256 2HB SER 36 1HB SER 36 2.248 0.267 -6.977
257 HG SER 36 HG SER 36 0.846 -0.503 -8.441
258 H SER 37 H SER 37 1.718 -0.911 -3.144
259 HA SER 37 HA SER 37 0.915 -3.577 -3.878
260 1HB SER 37 2HB SER 37 3.266 -3.169 -4.804
261 2HB SER 37 1HB SER 37 3.796 -3.172 -3.122
262 HG SER 37 HG SER 37 2.294 -5.270 -4.287
263 H TYR 38 H TYR 38 3.229 -4.041 -1.555
264 HA TYR 38 HA TYR 38 2.074 -3.015 0.777
265 1HB TYR 38 2HB TYR 38 1.433 -5.754 1.090
266 2HB TYR 38 1HB TYR 38 0.359 -4.374 1.235
267 HD1 TYR 38 1HD TYR 38 -1.514 -4.372 -0.128
268 HD2 TYR 38 2HD TYR 38 2.009 -6.352 -1.444
269 HE1 TYR 38 1HE TYR 38 -2.659 -5.008 -2.214
270 HE2 TYR 38 2HE TYR 38 0.872 -7.015 -3.525
271 HH TYR 38 HH TYR 38 -1.683 -5.653 -4.735
272 H ILE 39 H ILE 39 3.963 -2.831 1.591
273 HA ILE 39 HA ILE 39 5.463 -5.070 2.370
274 HB ILE 39 HB ILE 39 6.550 -5.283 0.420
275 1HG1 ILE 39 2HG1 ILE 39 8.115 -4.173 2.322
276 2HG1 ILE 39 1HG1 ILE 39 8.720 -4.775 0.787
277 1HG2 ILE 39 1HG2 ILE 39 5.182 -3.437 -0.575
278 2HG2 ILE 39 2HG2 ILE 39 6.765 -3.730 -1.298
279 3HG2 ILE 39 3HG2 ILE 39 6.537 -2.367 -0.206
280 1HD1 ILE 39 1HD1 ILE 39 9.143 -2.686 -0.010
281 2HD1 ILE 39 2HD1 ILE 39 9.370 -2.399 1.712
282 3HD1 ILE 39 3HD1 ILE 39 7.858 -1.938 0.930
283 H ALA 40 H ALA 40 4.615 -3.986 4.156
284 HA ALA 40 HA ALA 40 5.391 -1.425 4.921
285 1HB ALA 40 1HB ALA 40 4.832 -3.785 6.679
286 2HB ALA 40 2HB ALA 40 3.623 -2.716 5.972
287 3HB ALA 40 3HB ALA 40 4.773 -2.089 7.155
288 H ALA 41 H ALA 41 7.478 -1.067 4.462
289 HA ALA 41 HA ALA 41 9.383 -1.696 6.487
290 1HB ALA 41 1HB ALA 41 11.013 -2.859 5.096
291 2HB ALA 41 2HB ALA 41 9.878 -2.853 3.746
292 3HB ALA 41 3HB ALA 41 9.511 -3.775 5.203
293 H ASP 42 H ASP 42 8.714 -0.401 3.281
294 HA ASP 42 HA ASP 42 9.163 1.667 2.423
295 1HB ASP 42 2HB ASP 42 9.304 2.472 4.830
296 2HB ASP 42 1HB ASP 42 11.038 2.179 4.739
297 H VAL 43 H VAL 43 10.593 -0.834 1.988
298 HA VAL 43 HA VAL 43 13.089 0.334 0.930
299 HB VAL 43 HB VAL 43 13.643 -1.099 2.812
300 1HG1 VAL 43 1HG1 VAL 43 12.835 -3.589 1.463
301 2HG1 VAL 43 2HG1 VAL 43 11.526 -2.619 2.134
302 3HG1 VAL 43 3HG1 VAL 43 12.837 -3.172 3.176
303 1HG2 VAL 43 1HG2 VAL 43 15.081 -0.969 0.740
304 2HG2 VAL 43 2HG2 VAL 43 14.409 -2.535 0.281
305 3HG2 VAL 43 3HG2 VAL 43 15.341 -2.376 1.771
306 H VAL 44 H VAL 44 10.194 -1.046 0.046
307 HA VAL 44 HA VAL 44 11.121 -1.483 -2.646
308 HB VAL 44 HB VAL 44 9.729 -3.842 -1.399
309 1HG1 VAL 44 1HG1 VAL 44 9.620 -3.615 -3.820
310 2HG1 VAL 44 2HG1 VAL 44 10.594 -5.010 -3.356
311 3HG1 VAL 44 3HG1 VAL 44 11.380 -3.529 -3.900
312 1HG2 VAL 44 1HG2 VAL 44 12.710 -3.500 -1.722
313 2HG2 VAL 44 2HG2 VAL 44 11.882 -4.979 -1.238
314 3HG2 VAL 44 3HG2 VAL 44 11.834 -3.561 -0.192
315 H SER 45 H SER 45 9.466 -1.681 -4.175
316 HA SER 45 HA SER 45 6.923 -0.502 -3.338
317 1HB SER 45 2HB SER 45 6.602 -0.271 -5.838
318 2HB SER 45 1HB SER 45 7.969 0.620 -5.170
319 HG SER 45 HG SER 45 8.262 -0.748 -7.161
320 H GLU 46 H GLU 46 7.694 -3.443 -2.991
321 HA GLU 46 HA GLU 46 5.180 -4.532 -3.524
322 1HB GLU 46 2HB GLU 46 6.329 -4.217 -5.868
323 2HB GLU 46 1HB GLU 46 7.140 -5.718 -5.434
324 1HG GLU 46 2HG GLU 46 4.932 -6.777 -5.106
325 2HG GLU 46 1HG GLU 46 4.169 -5.285 -5.652
326 H TYR 47 H TYR 47 4.883 -6.479 -2.564
327 HA TYR 47 HA TYR 47 7.232 -7.632 -1.232
328 1HB TYR 47 2HB TYR 47 5.551 -6.943 0.337
329 2HB TYR 47 1HB TYR 47 4.280 -7.780 -0.554
330 HD1 TYR 47 1HD TYR 47 7.464 -8.406 1.285
331 HD2 TYR 47 2HD TYR 47 3.688 -9.944 0.073
332 HE1 TYR 47 1HE TYR 47 7.837 -10.402 2.674
333 HE2 TYR 47 2HE TYR 47 4.049 -11.944 1.458
334 HH TYR 47 HH TYR 47 6.506 -12.146 3.787
Start of MODEL 14
1 1H GLY 1 1HT GLY 1 -9.528 -8.562 8.138
2 2H GLY 1 2HT GLY 1 -10.239 -7.230 7.376
3 3H GLY 1 3HT GLY 1 -10.448 -7.464 9.038
4 1HA GLY 1 1HA GLY 1 -8.089 -7.113 9.420
5 2HA GLY 1 2HA GLY 1 -7.865 -6.881 7.693
6 H SER 2 H SER 2 -7.439 -4.804 7.346
7 HA SER 2 HA SER 2 -9.133 -2.804 8.696
8 1HB SER 2 2HB SER 2 -6.840 -2.659 9.515
9 2HB SER 2 1HB SER 2 -6.234 -2.545 7.862
10 HG SER 2 HG SER 2 -7.987 -0.682 9.094
11 H GLY 3 H GLY 3 -7.029 -3.181 5.825
12 1HA GLY 3 2HA GLY 3 -8.865 -1.410 4.378
13 2HA GLY 3 1HA GLY 3 -7.214 -1.755 3.904
14 H GLU 4 H GLU 4 -7.174 -2.838 2.039
15 HA GLU 4 HA GLU 4 -7.599 -4.384 0.436
16 1HB GLU 4 2HB GLU 4 -7.153 -6.269 1.548
17 2HB GLU 4 1HB GLU 4 -7.958 -5.696 2.995
18 1HG GLU 4 2HG GLU 4 -10.111 -6.472 2.081
19 2HG GLU 4 1HG GLU 4 -9.261 -7.108 0.674
20 H VAL 5 H VAL 5 -9.699 -2.371 1.294
21 HA VAL 5 HA VAL 5 -12.094 -3.666 0.187
22 HB VAL 5 HB VAL 5 -11.941 -1.025 1.630
23 1HG1 VAL 5 1HG1 VAL 5 -13.883 -1.166 0.244
24 2HG1 VAL 5 2HG1 VAL 5 -14.394 -1.420 1.912
25 3HG1 VAL 5 3HG1 VAL 5 -14.242 -2.794 0.818
26 1HG2 VAL 5 1HG2 VAL 5 -12.546 -3.779 2.698
27 2HG2 VAL 5 2HG2 VAL 5 -12.960 -2.291 3.548
28 3HG2 VAL 5 3HG2 VAL 5 -11.272 -2.675 3.215
29 H ASN 6 H ASN 6 -9.579 -1.592 -0.673
30 HA ASN 6 HA ASN 6 -9.255 -0.051 -2.315
31 1HB ASN 6 2HB ASN 6 -9.799 -2.156 -3.563
32 2HB ASN 6 1HB ASN 6 -11.458 -1.582 -3.703
33 1HD2 ASN 6 1HD2 ASN 6 -9.385 -2.146 -5.732
34 2HD2 ASN 6 2HD2 ASN 6 -9.253 -0.699 -6.666
35 H LYS 7 H LYS 7 -9.972 1.785 -1.230
36 HA LYS 7 HA LYS 7 -12.546 2.835 -2.102
37 1HB LYS 7 2HB LYS 7 -13.034 3.577 0.156
38 2HB LYS 7 1HB LYS 7 -12.731 1.845 0.193
39 1HG LYS 7 2HG LYS 7 -10.303 2.470 0.800
40 2HG LYS 7 1HG LYS 7 -10.970 4.073 1.149
41 1HD LYS 7 2HD LYS 7 -12.088 1.553 2.356
42 2HD LYS 7 1HD LYS 7 -10.800 2.490 3.117
43 1HE LYS 7 2HE LYS 7 -12.902 3.145 4.076
44 2HE LYS 7 1HE LYS 7 -12.297 4.470 3.083
45 1HZ LYS 7 1HZ LYS 7 -14.781 3.500 2.939
46 2HZ LYS 7 2HZ LYS 7 -14.035 2.601 1.715
47 3HZ LYS 7 3HZ LYS 7 -14.004 4.292 1.662
48 H ILE 8 H ILE 8 -12.029 5.152 -0.282
49 HA ILE 8 HA ILE 8 -10.501 6.738 -2.020
50 HB ILE 8 HB ILE 8 -12.328 7.276 -0.249
51 1HG1 ILE 8 2HG1 ILE 8 -11.505 8.910 -1.816
52 2HG1 ILE 8 1HG1 ILE 8 -11.563 9.657 -0.224
53 1HG2 ILE 8 1HG2 ILE 8 -11.551 8.237 1.821
54 2HG2 ILE 8 2HG2 ILE 8 -9.879 7.882 1.392
55 3HG2 ILE 8 3HG2 ILE 8 -11.006 6.563 1.703
56 1HD1 ILE 8 1HD1 ILE 8 -9.160 9.317 0.021
57 2HD1 ILE 8 2HD1 ILE 8 -9.542 10.272 -1.410
58 3HD1 ILE 8 3HD1 ILE 8 -9.105 8.572 -1.576
59 H ILE 9 H ILE 9 -8.353 6.712 -2.252
60 HA ILE 9 HA ILE 9 -6.712 6.093 0.086
61 HB ILE 9 HB ILE 9 -5.205 4.811 -1.239
62 1HG1 ILE 9 2HG1 ILE 9 -5.475 6.059 -3.378
63 2HG1 ILE 9 1HG1 ILE 9 -5.532 4.312 -3.579
64 1HG2 ILE 9 1HG2 ILE 9 -7.543 3.944 -0.435
65 2HG2 ILE 9 2HG2 ILE 9 -6.364 2.920 -1.261
66 3HG2 ILE 9 3HG2 ILE 9 -7.715 3.623 -2.157
67 1HD1 ILE 9 1HD1 ILE 9 -8.125 4.750 -3.353
68 2HD1 ILE 9 2HD1 ILE 9 -7.268 4.873 -4.886
69 3HD1 ILE 9 3HD1 ILE 9 -7.644 6.330 -3.972
70 H GLY 10 H GLY 10 -5.019 7.286 0.473
71 1HA GLY 10 2HA GLY 10 -4.101 9.241 -1.549
72 2HA GLY 10 1HA GLY 10 -4.073 9.538 0.195
73 H SER 11 H SER 11 -2.281 8.336 -2.433
74 HA SER 11 HA SER 11 -0.643 6.712 -0.667
75 1HB SER 11 2HB SER 11 -0.866 5.254 -2.317
76 2HB SER 11 1HB SER 11 -1.439 6.531 -3.422
77 HG SER 11 HG SER 11 0.610 7.009 -4.026
78 H ARG 12 H ARG 12 0.858 7.625 0.251
79 HA ARG 12 HA ARG 12 3.043 8.828 -1.225
80 1HB ARG 12 2HB ARG 12 1.525 10.753 -0.920
81 2HB ARG 12 1HB ARG 12 1.602 10.521 0.822
82 1HG ARG 12 2HG ARG 12 4.050 10.918 0.714
83 2HG ARG 12 1HG ARG 12 3.872 11.285 -1.004
84 1HD ARG 12 2HD ARG 12 3.909 13.338 0.269
85 2HD ARG 12 1HD ARG 12 2.308 13.099 -0.429
86 HE ARG 12 HE ARG 12 2.266 12.014 2.130
87 1HH1 ARG 12 1HH1 ARG 12 2.680 15.128 0.630
88 2HH1 ARG 12 2HH1 ARG 12 2.019 16.006 1.968
89 1HH2 ARG 12 1HH2 ARG 12 1.390 13.161 3.899
90 2HH2 ARG 12 2HH2 ARG 12 1.286 14.889 3.826
91 H THR 13 H THR 13 4.595 7.414 -0.313
92 HA THR 13 HA THR 13 4.734 7.472 2.622
93 HB THR 13 HB THR 13 6.304 5.360 1.270
94 HG1 THR 13 1HG THR 13 4.536 4.023 1.054
95 1HG2 THR 13 1HG2 THR 13 6.413 5.569 3.657
96 2HG2 THR 13 2HG2 THR 13 5.541 4.091 3.251
97 3HG2 THR 13 3HG2 THR 13 4.655 5.522 3.779
98 H ALA 14 H ALA 14 7.288 6.553 0.326
99 HA ALA 14 HA ALA 14 8.883 8.830 1.245
100 1HB ALA 14 1HB ALA 14 10.804 7.432 1.753
101 2HB ALA 14 2HB ALA 14 9.870 5.985 1.371
102 3HB ALA 14 3HB ALA 14 9.425 6.981 2.756
103 H GLY 15 H GLY 15 8.923 5.923 -0.831
104 1HA GLY 15 2HA GLY 15 9.002 6.253 -3.249
105 2HA GLY 15 1HA GLY 15 10.031 7.649 -2.966
106 H GLU 16 H GLU 16 11.857 6.594 -1.165
107 HA GLU 16 HA GLU 16 13.686 5.340 -2.865
108 1HB GLU 16 2HB GLU 16 15.126 5.213 -1.000
109 2HB GLU 16 1HB GLU 16 14.124 6.628 -0.700
110 1HG GLU 16 2HG GLU 16 12.714 5.290 0.798
111 2HG GLU 16 1HG GLU 16 13.773 3.908 0.529
112 H GLY 17 H GLY 17 11.151 4.092 -0.892
113 1HA GLY 17 2HA GLY 17 11.660 1.397 -1.910
114 2HA GLY 17 1HA GLY 17 11.499 1.617 -0.172
115 H ALA 18 H ALA 18 9.519 2.859 0.521
116 HA ALA 18 HA ALA 18 7.224 1.908 -1.012
117 1HB ALA 18 1HB ALA 18 7.373 1.084 1.286
118 2HB ALA 18 2HB ALA 18 5.955 2.094 1.017
119 3HB ALA 18 3HB ALA 18 7.354 2.757 1.859
120 H MET 19 H MET 19 5.444 3.353 -1.385
121 HA MET 19 HA MET 19 5.718 6.067 -0.564
122 1HB MET 19 2HB MET 19 7.260 5.417 -2.701
123 2HB MET 19 1HB MET 19 5.802 6.007 -3.488
124 1HG MET 19 2HG MET 19 7.189 7.536 -1.330
125 2HG MET 19 1HG MET 19 7.635 7.688 -3.024
126 1HE MET 19 1HE MET 19 4.300 9.040 -4.595
127 2HE MET 19 2HE MET 19 4.723 7.339 -4.398
128 3HE MET 19 3HE MET 19 5.949 8.498 -4.911
129 H GLU 20 H GLU 20 3.471 4.288 -0.375
130 HA GLU 20 HA GLU 20 1.664 5.943 -1.855
131 1HB GLU 20 2HB GLU 20 1.636 2.955 -2.161
132 2HB GLU 20 1HB GLU 20 0.380 3.987 -2.771
133 1HG GLU 20 2HG GLU 20 2.387 5.197 -3.962
134 2HG GLU 20 1HG GLU 20 3.169 3.627 -3.741
135 H TYR 21 H TYR 21 -0.527 3.876 -1.213
136 HA TYR 21 HA TYR 21 -1.242 4.972 1.433
137 1HB TYR 21 2HB TYR 21 -3.596 4.235 0.387
138 2HB TYR 21 1HB TYR 21 -2.953 5.829 0.031
139 HD1 TYR 21 1HD TYR 21 -3.469 6.371 -2.166
140 HD2 TYR 21 2HD TYR 21 -2.327 2.387 -1.194
141 HE1 TYR 21 1HE TYR 21 -3.704 5.719 -4.524
142 HE2 TYR 21 2HE TYR 21 -2.588 1.732 -3.517
143 HH TYR 21 HH TYR 21 -2.882 3.980 -6.059
144 H LEU 22 H LEU 22 -3.259 3.696 2.230
145 HA LEU 22 HA LEU 22 -2.549 0.943 1.751
146 1HB LEU 22 2HB LEU 22 -3.577 0.684 4.206
147 2HB LEU 22 1HB LEU 22 -1.916 1.087 3.954
148 HG LEU 22 HG LEU 22 -2.514 3.494 4.193
149 1HD1 LEU 22 1HD1 LEU 22 -4.891 3.312 3.704
150 2HD1 LEU 22 2HD1 LEU 22 -4.620 4.035 5.289
151 3HD1 LEU 22 3HD1 LEU 22 -5.121 2.350 5.163
152 1HD2 LEU 22 1HD2 LEU 22 -3.043 1.667 6.526
153 2HD2 LEU 22 2HD2 LEU 22 -2.675 3.388 6.640
154 3HD2 LEU 22 3HD2 LEU 22 -1.471 2.269 6.002
155 H ILE 23 H ILE 23 -4.479 1.035 0.084
156 HA ILE 23 HA ILE 23 -6.290 -0.800 0.670
157 HB ILE 23 HB ILE 23 -7.165 0.326 2.553
158 1HG1 ILE 23 2HG1 ILE 23 -9.354 0.806 0.617
159 2HG1 ILE 23 1HG1 ILE 23 -8.674 -0.814 0.763
160 1HG2 ILE 23 1HG2 ILE 23 -7.756 2.489 2.738
161 2HG2 ILE 23 2HG2 ILE 23 -8.304 2.598 1.071
162 3HG2 ILE 23 3HG2 ILE 23 -6.578 2.656 1.437
163 1HD1 ILE 23 1HD1 ILE 23 -10.609 0.300 2.376
164 2HD1 ILE 23 2HD1 ILE 23 -9.126 0.371 3.335
165 3HD1 ILE 23 3HD1 ILE 23 -9.683 -1.165 2.688
166 H GLU 24 H GLU 24 -5.528 -0.777 -1.589
167 HA GLU 24 HA GLU 24 -7.664 -0.409 -3.334
168 1HB GLU 24 2HB GLU 24 -7.150 2.006 -3.047
169 2HB GLU 24 1HB GLU 24 -5.553 1.715 -3.726
170 1HG GLU 24 2HG GLU 24 -6.939 0.678 -5.701
171 2HG GLU 24 1HG GLU 24 -8.213 1.709 -5.056
172 H TRP 25 H TRP 25 -6.318 -2.594 -3.186
173 HA TRP 25 HA TRP 25 -4.953 -2.808 -5.740
174 1HB TRP 25 2HB TRP 25 -3.194 -4.275 -4.186
175 2HB TRP 25 1HB TRP 25 -2.873 -2.674 -4.851
176 HD1 TRP 25 HD TRP 25 -5.081 -3.625 -1.818
177 HE1 TRP 25 1HE TRP 25 -4.273 -2.276 0.203
178 HE3 TRP 25 3HE TRP 25 -0.983 -1.292 -3.906
179 HZ2 TRP 25 2HZ TRP 25 -2.243 -0.538 0.816
180 HZ3 TRP 25 3HZ TRP 25 0.348 0.219 -2.422
181 HH2 TRP 25 HH TRP 25 -0.319 0.640 -0.179
182 H LYS 26 H LYS 26 -7.393 -3.805 -4.428
183 HA LYS 26 HA LYS 26 -8.646 -5.696 -4.349
184 1HB LYS 26 2HB LYS 26 -6.483 -6.747 -6.183
185 2HB LYS 26 1HB LYS 26 -8.039 -7.516 -5.908
186 1HG LYS 26 2HG LYS 26 -8.140 -6.343 -7.978
187 2HG LYS 26 1HG LYS 26 -9.139 -5.475 -6.811
188 1HD LYS 26 2HD LYS 26 -7.550 -3.758 -6.569
189 2HD LYS 26 1HD LYS 26 -6.277 -4.716 -7.329
190 1HE LYS 26 2HE LYS 26 -7.484 -4.594 -9.463
191 2HE LYS 26 1HE LYS 26 -8.735 -3.618 -8.692
192 1HZ LYS 26 1HZ LYS 26 -7.118 -2.272 -9.914
193 2HZ LYS 26 2HZ LYS 26 -5.875 -2.847 -8.922
194 3HZ LYS 26 3HZ LYS 26 -7.113 -1.903 -8.263
195 H ASP 27 H ASP 27 -6.312 -5.280 -2.479
196 HA ASP 27 HA ASP 27 -5.318 -6.355 -0.759
197 1HB ASP 27 2HB ASP 27 -7.543 -7.058 -0.185
198 2HB ASP 27 1HB ASP 27 -7.468 -8.387 -1.334
199 H GLY 28 H GLY 28 -3.366 -6.940 -1.121
200 1HA GLY 28 2HA GLY 28 -2.828 -9.460 -2.556
201 2HA GLY 28 1HA GLY 28 -1.764 -8.060 -2.655
202 H HIS 29 H HIS 29 -1.226 -7.178 -0.321
203 HA HIS 29 HA HIS 29 -0.742 -9.442 1.469
204 1HB HIS 29 2HB HIS 29 1.459 -7.441 0.791
205 2HB HIS 29 1HB HIS 29 1.564 -8.837 1.862
206 HD1 HIS 29 1HD HIS 29 2.044 -7.837 -1.609
207 HD2 HIS 29 2HD HIS 29 1.366 -11.384 0.448
208 HE1 HIS 29 1HE HIS 29 2.684 -9.673 -3.203
209 HE2 HIS 29 2HE HIS 29 2.357 -11.806 -1.904
210 H SER 30 H SER 30 -2.251 -8.696 2.923
211 HA SER 30 HA SER 30 -3.236 -7.288 4.473
212 1HB SER 30 2HB SER 30 -0.340 -6.713 5.076
213 2HB SER 30 1HB SER 30 -1.699 -6.629 6.205
214 HG SER 30 HG SER 30 -0.183 -8.688 5.793
215 HA PRO 31 HA PRO 31 -3.684 -3.262 2.170
216 1HB PRO 31 2HB PRO 31 -4.875 -2.567 4.770
217 2HB PRO 31 1HB PRO 31 -5.624 -2.585 3.172
218 1HG PRO 31 2HG PRO 31 -5.628 -4.667 5.240
219 2HG PRO 31 1HG PRO 31 -6.657 -4.514 3.815
220 1HD PRO 31 2HD PRO 31 -4.849 -6.463 3.983
221 2HD PRO 31 1HD PRO 31 -5.151 -5.634 2.433
222 H SER 32 H SER 32 -2.149 -1.623 2.221
223 HA SER 32 HA SER 32 -0.752 -1.133 4.689
224 1HB SER 32 2HB SER 32 0.158 -3.286 3.671
225 2HB SER 32 1HB SER 32 0.910 -2.238 2.473
226 HG SER 32 HG SER 32 1.555 -2.673 5.116
227 H TRP 33 H TRP 33 0.168 0.897 4.745
228 HA TRP 33 HA TRP 33 0.193 2.431 2.328
229 1HB TRP 33 2HB TRP 33 -0.407 3.374 4.595
230 2HB TRP 33 1HB TRP 33 1.254 3.094 5.096
231 HD1 TRP 33 HD TRP 33 3.109 4.452 3.308
232 HE1 TRP 33 1HE TRP 33 2.926 6.918 2.633
233 HE3 TRP 33 3HE TRP 33 -1.861 5.244 4.265
234 HZ2 TRP 33 2HZ TRP 33 0.941 8.945 2.486
235 HZ3 TRP 33 3HZ TRP 33 -2.817 7.459 3.822
236 HH2 TRP 33 HH TRP 33 -1.440 9.273 2.949
237 H VAL 34 H VAL 34 1.573 1.598 1.012
238 HA VAL 34 HA VAL 34 4.369 1.721 1.636
239 HB VAL 34 HB VAL 34 3.605 -0.944 0.485
240 1HG1 VAL 34 1HG1 VAL 34 5.242 -1.221 2.759
241 2HG1 VAL 34 2HG1 VAL 34 5.772 0.275 2.006
242 3HG1 VAL 34 3HG1 VAL 34 5.777 -1.221 1.086
243 1HG2 VAL 34 1HG2 VAL 34 3.068 -0.311 3.371
244 2HG2 VAL 34 2HG2 VAL 34 3.044 -1.913 2.633
245 3HG2 VAL 34 3HG2 VAL 34 1.885 -0.693 2.130
246 HA PRO 35 HA PRO 35 4.308 2.427 -2.778
247 1HB PRO 35 2HB PRO 35 6.115 1.032 -4.064
248 2HB PRO 35 1HB PRO 35 6.572 2.093 -2.736
249 1HG PRO 35 2HG PRO 35 6.317 -0.877 -2.796
250 2HG PRO 35 1HG PRO 35 7.468 0.142 -1.916
251 1HD PRO 35 2HD PRO 35 5.126 -1.011 -0.867
252 2HD PRO 35 1HD PRO 35 6.132 0.240 -0.124
253 H SER 36 H SER 36 2.254 1.850 -3.516
254 HA SER 36 HA SER 36 0.751 1.003 -4.964
255 1HB SER 36 2HB SER 36 2.458 1.563 -6.616
256 2HB SER 36 1HB SER 36 3.246 0.008 -6.355
257 HG SER 36 HG SER 36 1.963 -0.256 -8.119
258 H SER 37 H SER 37 1.978 -0.756 -2.738
259 HA SER 37 HA SER 37 0.375 -2.998 -3.370
260 1HB SER 37 2HB SER 37 3.366 -3.448 -3.270
261 2HB SER 37 1HB SER 37 2.143 -4.715 -3.324
262 HG SER 37 HG SER 37 3.189 -3.263 -5.343
263 H TYR 38 H TYR 38 3.055 -3.863 -1.407
264 HA TYR 38 HA TYR 38 2.307 -2.842 1.095
265 1HB TYR 38 2HB TYR 38 1.569 -5.574 1.431
266 2HB TYR 38 1HB TYR 38 0.597 -4.147 1.764
267 HD1 TYR 38 1HD TYR 38 -1.470 -4.261 0.886
268 HD2 TYR 38 2HD TYR 38 1.750 -5.957 -1.287
269 HE1 TYR 38 1HE TYR 38 -3.046 -4.928 -0.905
270 HE2 TYR 38 2HE TYR 38 0.209 -6.629 -3.079
271 HH TYR 38 HH TYR 38 -3.241 -5.811 -2.966
272 H ILE 39 H ILE 39 4.370 -2.820 1.587
273 HA ILE 39 HA ILE 39 5.762 -5.274 1.989
274 HB ILE 39 HB ILE 39 6.298 -5.244 -0.241
275 1HG1 ILE 39 2HG1 ILE 39 8.586 -4.839 -0.475
276 2HG1 ILE 39 1HG1 ILE 39 8.563 -3.470 0.625
277 1HG2 ILE 39 1HG2 ILE 39 6.621 -2.262 -0.232
278 2HG2 ILE 39 2HG2 ILE 39 5.171 -3.134 -0.754
279 3HG2 ILE 39 3HG2 ILE 39 6.692 -3.329 -1.624
280 1HD1 ILE 39 1HD1 ILE 39 9.591 -5.717 1.379
281 2HD1 ILE 39 2HD1 ILE 39 7.914 -6.212 1.614
282 3HD1 ILE 39 3HD1 ILE 39 8.559 -4.830 2.497
283 H ALA 40 H ALA 40 5.377 -4.139 4.048
284 HA ALA 40 HA ALA 40 7.298 -1.973 4.526
285 1HB ALA 40 1HB ALA 40 4.997 -1.651 5.312
286 2HB ALA 40 2HB ALA 40 6.177 -1.608 6.622
287 3HB ALA 40 3HB ALA 40 5.182 -3.045 6.377
288 H ALA 41 H ALA 41 9.187 -3.056 4.529
289 HA ALA 41 HA ALA 41 9.803 -4.530 6.958
290 1HB ALA 41 1HB ALA 41 10.321 -5.655 4.206
291 2HB ALA 41 2HB ALA 41 9.235 -6.317 5.428
292 3HB ALA 41 3HB ALA 41 10.977 -6.310 5.706
293 H ASP 42 H ASP 42 10.965 -3.211 3.884
294 HA ASP 42 HA ASP 42 13.186 -1.980 5.317
295 1HB ASP 42 2HB ASP 42 13.495 -3.670 2.829
296 2HB ASP 42 1HB ASP 42 14.755 -2.633 3.492
297 H VAL 43 H VAL 43 12.293 -2.333 1.888
298 HA VAL 43 HA VAL 43 11.167 0.120 1.427
299 HB VAL 43 HB VAL 43 13.336 1.099 0.199
300 1HG1 VAL 43 1HG1 VAL 43 12.569 2.748 1.466
301 2HG1 VAL 43 2HG1 VAL 43 13.601 2.144 2.763
302 3HG1 VAL 43 3HG1 VAL 43 11.920 1.625 2.654
303 1HG2 VAL 43 1HG2 VAL 43 15.346 0.825 1.383
304 2HG2 VAL 43 2HG2 VAL 43 14.708 -0.808 1.190
305 3HG2 VAL 43 3HG2 VAL 43 14.543 0.027 2.734
306 H VAL 44 H VAL 44 10.183 -1.686 0.101
307 HA VAL 44 HA VAL 44 11.491 -1.747 -2.535
308 HB VAL 44 HB VAL 44 10.123 -4.146 -1.333
309 1HG1 VAL 44 1HG1 VAL 44 11.154 -5.320 -3.255
310 2HG1 VAL 44 2HG1 VAL 44 11.689 -3.758 -3.875
311 3HG1 VAL 44 3HG1 VAL 44 9.966 -4.106 -3.733
312 1HG2 VAL 44 1HG2 VAL 44 13.059 -3.543 -1.625
313 2HG2 VAL 44 2HG2 VAL 44 12.394 -5.120 -1.203
314 3HG2 VAL 44 3HG2 VAL 44 12.164 -3.749 -0.119
315 H SER 45 H SER 45 10.122 -1.959 -4.330
316 HA SER 45 HA SER 45 7.689 -0.533 -4.134
317 1HB SER 45 2HB SER 45 9.126 -0.334 -6.079
318 2HB SER 45 1HB SER 45 8.863 -2.034 -6.467
319 HG SER 45 HG SER 45 6.714 -1.579 -6.886
320 H GLU 46 H GLU 46 8.082 -3.644 -3.322
321 HA GLU 46 HA GLU 46 5.351 -4.215 -3.160
322 1HB GLU 46 2HB GLU 46 5.442 -4.422 -5.594
323 2HB GLU 46 1HB GLU 46 6.758 -5.581 -5.467
324 1HG GLU 46 2HG GLU 46 5.274 -7.141 -4.316
325 2HG GLU 46 1HG GLU 46 3.953 -5.981 -4.451
326 H TYR 47 H TYR 47 4.916 -6.330 -2.244
327 HA TYR 47 HA TYR 47 6.907 -7.154 -0.451
328 1HB TYR 47 2HB TYR 47 4.310 -7.538 -0.352
329 2HB TYR 47 1HB TYR 47 4.685 -9.013 -1.242
330 HD1 TYR 47 1HD TYR 47 7.534 -8.993 0.381
331 HD2 TYR 47 2HD TYR 47 3.406 -9.112 1.396
332 HE1 TYR 47 1HE TYR 47 8.090 -10.127 2.492
333 HE2 TYR 47 2HE TYR 47 3.950 -10.241 3.511
334 HH TYR 47 HH TYR 47 7.117 -10.456 4.718
Start of MODEL 15
1 1H GLY 1 1HT GLY 1 -6.728 3.813 9.311
2 2H GLY 1 2HT GLY 1 -6.162 2.268 8.922
3 3H GLY 1 3HT GLY 1 -7.073 2.505 10.327
4 1HA GLY 1 1HA GLY 1 -9.003 3.126 8.991
5 2HA GLY 1 2HA GLY 1 -8.053 2.831 7.543
6 H SER 2 H SER 2 -9.312 1.184 6.737
7 HA SER 2 HA SER 2 -9.670 -1.196 8.415
8 1HB SER 2 2HB SER 2 -10.931 -0.494 5.752
9 2HB SER 2 1HB SER 2 -11.304 -1.919 6.723
10 HG SER 2 HG SER 2 -12.801 -0.575 7.431
11 H GLY 3 H GLY 3 -8.926 -0.514 4.986
12 1HA GLY 3 2HA GLY 3 -7.022 -1.289 3.826
13 2HA GLY 3 1HA GLY 3 -6.714 -2.418 5.136
14 H GLU 4 H GLU 4 -6.681 -3.010 2.317
15 HA GLU 4 HA GLU 4 -7.549 -4.469 0.785
16 1HB GLU 4 2HB GLU 4 -6.893 -6.202 2.154
17 2HB GLU 4 1HB GLU 4 -7.990 -5.753 3.452
18 1HG GLU 4 2HG GLU 4 -9.312 -6.672 1.004
19 2HG GLU 4 1HG GLU 4 -8.294 -7.876 1.788
20 H VAL 5 H VAL 5 -9.025 -2.362 0.780
21 HA VAL 5 HA VAL 5 -11.772 -3.373 0.689
22 HB VAL 5 HB VAL 5 -11.095 -0.554 1.484
23 1HG1 VAL 5 1HG1 VAL 5 -13.645 -2.157 1.665
24 2HG1 VAL 5 2HG1 VAL 5 -13.310 -0.864 0.513
25 3HG1 VAL 5 3HG1 VAL 5 -13.427 -0.502 2.235
26 1HG2 VAL 5 1HG2 VAL 5 -10.218 -1.916 3.219
27 2HG2 VAL 5 2HG2 VAL 5 -11.643 -2.956 3.211
28 3HG2 VAL 5 3HG2 VAL 5 -11.767 -1.293 3.786
29 H ASN 6 H ASN 6 -9.283 -1.442 -0.827
30 HA ASN 6 HA ASN 6 -9.200 -0.301 -2.809
31 1HB ASN 6 2HB ASN 6 -9.738 -2.718 -3.491
32 2HB ASN 6 1HB ASN 6 -11.391 -2.159 -3.732
33 1HD2 ASN 6 1HD2 ASN 6 -8.100 -1.957 -4.837
34 2HD2 ASN 6 2HD2 ASN 6 -8.447 -1.223 -6.364
35 H LYS 7 H LYS 7 -10.115 1.568 -1.740
36 HA LYS 7 HA LYS 7 -12.753 2.242 -2.807
37 1HB LYS 7 2HB LYS 7 -12.913 3.419 -0.357
38 2HB LYS 7 1HB LYS 7 -13.620 1.871 -0.772
39 1HG LYS 7 2HG LYS 7 -12.093 0.677 0.411
40 2HG LYS 7 1HG LYS 7 -10.791 1.854 0.207
41 1HD LYS 7 2HD LYS 7 -13.225 2.211 1.979
42 2HD LYS 7 1HD LYS 7 -11.631 1.700 2.537
43 1HE LYS 7 2HE LYS 7 -10.696 3.825 1.679
44 2HE LYS 7 1HE LYS 7 -12.325 4.333 1.239
45 1HZ LYS 7 1HZ LYS 7 -12.952 4.158 3.581
46 2HZ LYS 7 2HZ LYS 7 -11.692 5.265 3.357
47 3HZ LYS 7 3HZ LYS 7 -11.366 3.729 3.983
48 H ILE 8 H ILE 8 -11.237 4.265 -0.391
49 HA ILE 8 HA ILE 8 -10.220 6.079 -2.446
50 HB ILE 8 HB ILE 8 -12.414 6.954 -2.046
51 1HG1 ILE 8 2HG1 ILE 8 -11.933 9.166 -1.218
52 2HG1 ILE 8 1HG1 ILE 8 -10.545 8.579 -0.308
53 1HG2 ILE 8 1HG2 ILE 8 -11.791 6.829 0.899
54 2HG2 ILE 8 2HG2 ILE 8 -12.877 5.750 0.025
55 3HG2 ILE 8 3HG2 ILE 8 -13.268 7.464 0.176
56 1HD1 ILE 8 1HD1 ILE 8 -9.420 8.034 -2.417
57 2HD1 ILE 8 2HD1 ILE 8 -9.823 9.746 -2.289
58 3HD1 ILE 8 3HD1 ILE 8 -10.799 8.684 -3.303
59 H ILE 9 H ILE 9 -8.149 6.354 -1.927
60 HA ILE 9 HA ILE 9 -7.450 7.032 0.816
61 HB ILE 9 HB ILE 9 -7.349 4.646 0.792
62 1HG1 ILE 9 2HG1 ILE 9 -4.940 4.232 1.244
63 2HG1 ILE 9 1HG1 ILE 9 -4.573 5.831 0.643
64 1HG2 ILE 9 1HG2 ILE 9 -6.358 5.055 -1.869
65 2HG2 ILE 9 2HG2 ILE 9 -7.076 3.627 -1.140
66 3HG2 ILE 9 3HG2 ILE 9 -5.351 3.919 -0.979
67 1HD1 ILE 9 1HD1 ILE 9 -6.187 5.102 3.064
68 2HD1 ILE 9 2HD1 ILE 9 -6.093 6.739 2.412
69 3HD1 ILE 9 3HD1 ILE 9 -4.639 5.942 3.007
70 H GLY 10 H GLY 10 -5.108 7.635 0.990
71 1HA GLY 10 2HA GLY 10 -4.212 9.043 -1.461
72 2HA GLY 10 1HA GLY 10 -3.961 9.659 0.173
73 H SER 11 H SER 11 -2.433 8.141 -2.340
74 HA SER 11 HA SER 11 -0.804 6.458 -0.602
75 1HB SER 11 2HB SER 11 -0.918 4.917 -2.208
76 2HB SER 11 1HB SER 11 -1.905 6.043 -3.157
77 HG SER 11 HG SER 11 -0.256 6.524 -4.367
78 H ARG 12 H ARG 12 0.689 7.309 0.264
79 HA ARG 12 HA ARG 12 2.871 8.453 -1.249
80 1HB ARG 12 2HB ARG 12 1.374 10.197 0.711
81 2HB ARG 12 1HB ARG 12 2.938 10.592 0.011
82 1HG ARG 12 2HG ARG 12 1.899 10.530 -2.234
83 2HG ARG 12 1HG ARG 12 0.334 10.264 -1.462
84 1HD ARG 12 2HD ARG 12 0.557 12.389 -0.275
85 2HD ARG 12 1HD ARG 12 2.127 12.652 -1.033
86 HE ARG 12 HE ARG 12 0.015 12.250 -2.928
87 1HH1 ARG 12 1HH1 ARG 12 1.610 14.598 -0.907
88 2HH1 ARG 12 2HH1 ARG 12 1.150 15.946 -1.891
89 1HH2 ARG 12 1HH2 ARG 12 -0.595 14.021 -4.229
90 2HH2 ARG 12 2HH2 ARG 12 -0.103 15.619 -3.778
91 H THR 13 H THR 13 4.489 7.213 -0.360
92 HA THR 13 HA THR 13 4.611 7.180 2.571
93 HB THR 13 HB THR 13 6.032 5.143 0.944
94 HG1 THR 13 1HG THR 13 4.303 3.840 1.007
95 1HG2 THR 13 1HG2 THR 13 5.267 5.439 3.809
96 2HG2 THR 13 2HG2 THR 13 6.863 5.157 3.114
97 3HG2 THR 13 3HG2 THR 13 5.663 3.864 3.123
98 H ALA 14 H ALA 14 7.168 6.390 0.217
99 HA ALA 14 HA ALA 14 8.686 8.704 1.171
100 1HB ALA 14 1HB ALA 14 9.228 6.942 2.768
101 2HB ALA 14 2HB ALA 14 10.632 7.385 1.796
102 3HB ALA 14 3HB ALA 14 9.749 5.899 1.444
103 H GLY 15 H GLY 15 9.198 5.700 -0.698
104 1HA GLY 15 2HA GLY 15 9.308 6.026 -3.174
105 2HA GLY 15 1HA GLY 15 10.351 7.396 -2.834
106 H GLU 16 H GLU 16 11.949 6.259 -0.829
107 HA GLU 16 HA GLU 16 13.917 4.971 -2.343
108 1HB GLU 16 2HB GLU 16 14.528 6.121 -0.327
109 2HB GLU 16 1HB GLU 16 13.466 5.108 0.642
110 1HG GLU 16 2HG GLU 16 15.754 4.453 0.981
111 2HG GLU 16 1HG GLU 16 14.889 3.169 0.136
112 H GLY 17 H GLY 17 11.162 3.758 -0.638
113 1HA GLY 17 2HA GLY 17 11.666 1.101 -1.699
114 2HA GLY 17 1HA GLY 17 11.538 1.230 0.050
115 H ALA 18 H ALA 18 9.537 3.025 0.420
116 HA ALA 18 HA ALA 18 7.261 1.763 -0.903
117 1HB ALA 18 1HB ALA 18 7.391 2.774 1.933
118 2HB ALA 18 2HB ALA 18 7.408 1.075 1.456
119 3HB ALA 18 3HB ALA 18 5.975 2.062 1.159
120 H MET 19 H MET 19 5.406 3.170 -1.297
121 HA MET 19 HA MET 19 5.649 5.930 -0.734
122 1HB MET 19 2HB MET 19 7.347 5.244 -2.681
123 2HB MET 19 1HB MET 19 5.922 5.610 -3.647
124 1HG MET 19 2HG MET 19 5.784 7.805 -2.541
125 2HG MET 19 1HG MET 19 7.270 7.422 -1.681
126 1HE MET 19 1HE MET 19 6.799 10.066 -3.565
127 2HE MET 19 2HE MET 19 8.412 10.138 -4.278
128 3HE MET 19 3HE MET 19 8.218 9.735 -2.572
129 H GLU 20 H GLU 20 3.439 3.967 -0.722
130 HA GLU 20 HA GLU 20 1.664 5.744 -2.117
131 1HB GLU 20 2HB GLU 20 1.788 2.879 -2.823
132 2HB GLU 20 1HB GLU 20 0.316 3.762 -3.037
133 1HG GLU 20 2HG GLU 20 2.111 5.418 -4.209
134 2HG GLU 20 1HG GLU 20 2.836 3.845 -4.556
135 H TYR 21 H TYR 21 -0.220 3.026 -1.173
136 HA TYR 21 HA TYR 21 -0.479 4.063 1.542
137 1HB TYR 21 2HB TYR 21 -2.815 4.693 1.199
138 2HB TYR 21 1HB TYR 21 -1.690 5.704 0.389
139 HD1 TYR 21 1HD TYR 21 -3.821 6.338 -1.045
140 HD2 TYR 21 2HD TYR 21 -2.014 2.492 -1.206
141 HE1 TYR 21 1HE TYR 21 -4.759 6.005 -3.247
142 HE2 TYR 21 2HE TYR 21 -2.986 2.146 -3.413
143 HH TYR 21 HH TYR 21 -4.336 4.643 -5.252
144 H LEU 22 H LEU 22 -3.586 3.059 0.674
145 HA LEU 22 HA LEU 22 -3.209 0.360 1.110
146 1HB LEU 22 2HB LEU 22 -5.113 0.974 3.114
147 2HB LEU 22 1HB LEU 22 -3.561 0.193 3.312
148 HG LEU 22 HG LEU 22 -2.661 2.673 3.354
149 1HD1 LEU 22 1HD1 LEU 22 -4.115 4.329 3.952
150 2HD1 LEU 22 2HD1 LEU 22 -5.283 3.205 4.645
151 3HD1 LEU 22 3HD1 LEU 22 -5.155 3.375 2.901
152 1HD2 LEU 22 1HD2 LEU 22 -4.131 1.921 5.823
153 2HD2 LEU 22 2HD2 LEU 22 -2.458 2.442 5.616
154 3HD2 LEU 22 3HD2 LEU 22 -2.927 0.794 5.202
155 H ILE 23 H ILE 23 -5.429 -0.713 1.334
156 HA ILE 23 HA ILE 23 -7.249 -1.330 0.138
157 HB ILE 23 HB ILE 23 -9.164 0.178 0.267
158 1HG1 ILE 23 2HG1 ILE 23 -7.667 2.279 -0.064
159 2HG1 ILE 23 1HG1 ILE 23 -9.101 2.401 0.924
160 1HG2 ILE 23 1HG2 ILE 23 -8.413 -1.193 2.200
161 2HG2 ILE 23 2HG2 ILE 23 -9.375 0.223 2.626
162 3HG2 ILE 23 3HG2 ILE 23 -7.625 0.250 2.838
163 1HD1 ILE 23 1HD1 ILE 23 -7.916 3.061 2.667
164 2HD1 ILE 23 2HD1 ILE 23 -6.515 3.144 1.602
165 3HD1 ILE 23 3HD1 ILE 23 -6.828 1.681 2.527
166 H GLU 24 H GLU 24 -5.508 -1.091 -1.696
167 HA GLU 24 HA GLU 24 -6.968 -0.179 -3.939
168 1HB GLU 24 2HB GLU 24 -5.161 1.703 -2.707
169 2HB GLU 24 1HB GLU 24 -4.665 1.355 -4.362
170 1HG GLU 24 2HG GLU 24 -7.522 1.963 -3.758
171 2HG GLU 24 1HG GLU 24 -6.353 3.273 -3.875
172 H TRP 25 H TRP 25 -5.537 -2.555 -2.950
173 HA TRP 25 HA TRP 25 -4.149 -3.142 -5.450
174 1HB TRP 25 2HB TRP 25 -2.575 -4.609 -3.829
175 2HB TRP 25 1HB TRP 25 -2.145 -3.001 -4.391
176 HD1 TRP 25 HD TRP 25 -3.997 -4.487 -1.255
177 HE1 TRP 25 1HE TRP 25 -3.198 -3.110 0.790
178 HE3 TRP 25 3HE TRP 25 -0.926 -1.132 -3.625
179 HZ2 TRP 25 2HZ TRP 25 -1.594 -0.894 1.277
180 HZ3 TRP 25 3HZ TRP 25 0.253 0.557 -2.246
181 HH2 TRP 25 HH TRP 25 -0.157 0.735 0.103
182 H LYS 26 H LYS 26 -6.745 -3.785 -4.329
183 HA LYS 26 HA LYS 26 -8.149 -5.548 -4.003
184 1HB LYS 26 2HB LYS 26 -6.118 -6.851 -5.827
185 2HB LYS 26 1HB LYS 26 -7.696 -7.527 -5.443
186 1HG LYS 26 2HG LYS 26 -8.775 -5.584 -6.459
187 2HG LYS 26 1HG LYS 26 -7.192 -4.914 -6.850
188 1HD LYS 26 2HD LYS 26 -8.195 -6.024 -8.785
189 2HD LYS 26 1HD LYS 26 -6.715 -6.838 -8.273
190 1HE LYS 26 2HE LYS 26 -9.238 -7.822 -7.090
191 2HE LYS 26 1HE LYS 26 -9.012 -8.125 -8.812
192 1HZ LYS 26 1HZ LYS 26 -7.109 -8.896 -6.664
193 2HZ LYS 26 2HZ LYS 26 -6.908 -9.198 -8.314
194 3HZ LYS 26 3HZ LYS 26 -8.166 -9.945 -7.465
195 H ASP 27 H ASP 27 -6.256 -5.164 -1.977
196 HA ASP 27 HA ASP 27 -5.348 -6.157 -0.163
197 1HB ASP 27 2HB ASP 27 -6.610 -7.868 0.833
198 2HB ASP 27 1HB ASP 27 -7.758 -6.991 -0.170
199 H GLY 28 H GLY 28 -3.881 -6.470 -2.538
200 1HA GLY 28 2HA GLY 28 -2.993 -8.930 -3.301
201 2HA GLY 28 1HA GLY 28 -1.914 -7.553 -3.107
202 H HIS 29 H HIS 29 -1.211 -7.134 -0.787
203 HA HIS 29 HA HIS 29 -1.015 -9.649 0.714
204 1HB HIS 29 2HB HIS 29 1.396 -7.882 0.767
205 2HB HIS 29 1HB HIS 29 1.265 -9.631 0.902
206 HD1 HIS 29 1HD HIS 29 1.931 -6.945 -1.519
207 HD2 HIS 29 2HD HIS 29 1.033 -11.001 -1.612
208 HE1 HIS 29 1HE HIS 29 2.524 -7.711 -3.839
209 HE2 HIS 29 2HE HIS 29 1.969 -10.169 -3.875
210 H SER 30 H SER 30 -2.350 -9.079 2.369
211 HA SER 30 HA SER 30 -3.167 -7.909 4.189
212 1HB SER 30 2HB SER 30 -0.196 -7.561 4.601
213 2HB SER 30 1HB SER 30 -1.442 -7.553 5.862
214 HG SER 30 HG SER 30 -1.804 -9.711 5.518
215 HA PRO 31 HA PRO 31 -3.581 -3.548 2.596
216 1HB PRO 31 2HB PRO 31 -4.463 -3.255 5.395
217 2HB PRO 31 1HB PRO 31 -5.305 -2.856 3.898
218 1HG PRO 31 2HG PRO 31 -5.524 -5.254 5.501
219 2HG PRO 31 1HG PRO 31 -6.463 -4.791 4.081
220 1HD PRO 31 2HD PRO 31 -4.740 -6.895 4.095
221 2HD PRO 31 1HD PRO 31 -5.083 -5.944 2.631
222 H SER 32 H SER 32 -2.212 -1.778 2.803
223 HA SER 32 HA SER 32 -0.462 -1.640 5.122
224 1HB SER 32 2HB SER 32 0.570 -3.261 3.753
225 2HB SER 32 1HB SER 32 0.479 -2.212 2.349
226 HG SER 32 HG SER 32 2.440 -2.412 4.103
227 H TRP 33 H TRP 33 1.506 -0.086 3.985
228 HA TRP 33 HA TRP 33 0.404 2.211 2.585
229 1HB TRP 33 2HB TRP 33 0.630 2.596 5.147
230 2HB TRP 33 1HB TRP 33 2.366 2.464 4.878
231 HD1 TRP 33 HD TRP 33 3.579 4.483 3.817
232 HE1 TRP 33 1HE TRP 33 2.861 6.872 3.207
233 HE3 TRP 33 3HE TRP 33 -1.469 3.952 4.271
234 HZ2 TRP 33 2HZ TRP 33 0.469 8.350 2.945
235 HZ3 TRP 33 3HZ TRP 33 -2.906 5.895 3.824
236 HH2 TRP 33 HH TRP 33 -1.959 8.049 3.171
237 H VAL 34 H VAL 34 1.335 1.580 0.783
238 HA VAL 34 HA VAL 34 4.216 1.281 0.571
239 HB VAL 34 HB VAL 34 3.958 -0.945 1.094
240 1HG1 VAL 34 1HG1 VAL 34 2.062 -1.917 1.513
241 2HG1 VAL 34 2HG1 VAL 34 1.499 -1.779 -0.146
242 3HG1 VAL 34 3HG1 VAL 34 1.241 -0.466 0.988
243 1HG2 VAL 34 1HG2 VAL 34 4.775 -1.253 -1.047
244 2HG2 VAL 34 2HG2 VAL 34 3.268 -0.859 -1.808
245 3HG2 VAL 34 3HG2 VAL 34 3.454 -2.355 -0.944
246 HA PRO 35 HA PRO 35 3.635 3.010 -3.391
247 1HB PRO 35 2HB PRO 35 5.167 0.977 -4.831
248 2HB PRO 35 1HB PRO 35 5.432 2.714 -4.673
249 1HG PRO 35 2HG PRO 35 6.949 0.952 -3.392
250 2HG PRO 35 1HG PRO 35 6.511 2.489 -2.656
251 1HD PRO 35 2HD PRO 35 5.326 -0.202 -2.243
252 2HD PRO 35 1HD PRO 35 5.712 0.990 -1.004
253 H SER 36 H SER 36 2.384 -0.183 -3.212
254 HA SER 36 HA SER 36 0.221 0.021 -4.748
255 1HB SER 36 2HB SER 36 2.565 -0.192 -6.563
256 2HB SER 36 1HB SER 36 1.125 -1.107 -7.001
257 HG SER 36 HG SER 36 1.452 1.285 -7.638
258 H SER 37 H SER 37 1.446 -1.785 -2.751
259 HA SER 37 HA SER 37 0.011 -4.117 -3.364
260 1HB SER 37 2HB SER 37 2.994 -4.327 -3.811
261 2HB SER 37 1HB SER 37 1.989 -5.724 -3.447
262 HG SER 37 HG SER 37 0.801 -5.287 -5.331
263 H TYR 38 H TYR 38 3.191 -4.208 -1.879
264 HA TYR 38 HA TYR 38 2.502 -3.524 0.716
265 1HB TYR 38 2HB TYR 38 1.069 -5.454 0.662
266 2HB TYR 38 1HB TYR 38 2.481 -6.474 0.287
267 HD1 TYR 38 1HD TYR 38 0.524 -4.914 2.863
268 HD2 TYR 38 2HD TYR 38 4.279 -6.526 1.878
269 HE1 TYR 38 1HE TYR 38 1.067 -5.084 5.263
270 HE2 TYR 38 2HE TYR 38 4.882 -6.744 4.211
271 HH TYR 38 HH TYR 38 4.210 -5.695 6.397
272 H ILE 39 H ILE 39 4.232 -3.794 2.196
273 HA ILE 39 HA ILE 39 6.560 -5.228 1.735
274 HB ILE 39 HB ILE 39 6.961 -4.040 -0.264
275 1HG1 ILE 39 2HG1 ILE 39 9.052 -3.000 0.093
276 2HG1 ILE 39 1HG1 ILE 39 8.609 -2.446 1.697
277 1HG2 ILE 39 1HG2 ILE 39 5.297 -2.205 0.611
278 2HG2 ILE 39 2HG2 ILE 39 6.448 -1.880 -0.675
279 3HG2 ILE 39 3HG2 ILE 39 6.799 -1.354 0.969
280 1HD1 ILE 39 1HD1 ILE 39 10.202 -4.278 1.788
281 2HD1 ILE 39 2HD1 ILE 39 9.086 -5.305 0.890
282 3HD1 ILE 39 3HD1 ILE 39 8.662 -4.744 2.508
283 H ALA 40 H ALA 40 5.817 -5.178 4.034
284 HA ALA 40 HA ALA 40 6.120 -2.808 5.556
285 1HB ALA 40 1HB ALA 40 6.320 -5.647 6.523
286 2HB ALA 40 2HB ALA 40 4.821 -4.742 6.313
287 3HB ALA 40 3HB ALA 40 6.010 -4.215 7.503
288 H ALA 41 H ALA 41 8.036 -1.828 5.088
289 HA ALA 41 HA ALA 41 10.253 -2.309 6.645
290 1HB ALA 41 1HB ALA 41 10.712 -4.345 5.512
291 2HB ALA 41 2HB ALA 41 11.884 -3.165 4.925
292 3HB ALA 41 3HB ALA 41 10.492 -3.594 3.932
293 H ASP 42 H ASP 42 9.007 -1.135 3.597
294 HA ASP 42 HA ASP 42 9.135 0.921 2.629
295 1HB ASP 42 2HB ASP 42 9.313 1.821 4.966
296 2HB ASP 42 1HB ASP 42 11.064 1.713 4.820
297 H VAL 43 H VAL 43 10.924 -1.347 2.114
298 HA VAL 43 HA VAL 43 13.176 0.140 0.915
299 HB VAL 43 HB VAL 43 13.166 -2.765 1.739
300 1HG1 VAL 43 1HG1 VAL 43 15.312 -0.988 0.591
301 2HG1 VAL 43 2HG1 VAL 43 14.630 -2.451 -0.122
302 3HG1 VAL 43 3HG1 VAL 43 15.626 -2.559 1.328
303 1HG2 VAL 43 1HG2 VAL 43 13.146 -1.341 3.695
304 2HG2 VAL 43 2HG2 VAL 43 14.457 -0.365 3.032
305 3HG2 VAL 43 3HG2 VAL 43 14.751 -2.042 3.489
306 H VAL 44 H VAL 44 10.372 -1.594 0.212
307 HA VAL 44 HA VAL 44 11.153 -1.785 -2.590
308 HB VAL 44 HB VAL 44 9.803 -4.127 -1.255
309 1HG1 VAL 44 1HG1 VAL 44 10.587 -5.279 -3.340
310 2HG1 VAL 44 2HG1 VAL 44 11.031 -3.690 -3.964
311 3HG1 VAL 44 3HG1 VAL 44 9.347 -4.048 -3.581
312 1HG2 VAL 44 1HG2 VAL 44 12.029 -3.895 -0.299
313 2HG2 VAL 44 2HG2 VAL 44 12.727 -3.808 -1.915
314 3HG2 VAL 44 3HG2 VAL 44 11.953 -5.295 -1.368
315 H SER 45 H SER 45 9.270 -2.154 -4.014
316 HA SER 45 HA SER 45 6.905 -0.736 -3.004
317 1HB SER 45 2HB SER 45 6.345 -0.460 -5.392
318 2HB SER 45 1HB SER 45 7.957 0.154 -5.022
319 HG SER 45 HG SER 45 7.954 -1.117 -6.917
320 H GLU 46 H GLU 46 7.585 -3.763 -2.701
321 HA GLU 46 HA GLU 46 4.977 -4.711 -2.750
322 1HB GLU 46 2HB GLU 46 4.602 -4.937 -4.944
323 2HB GLU 46 1HB GLU 46 6.297 -4.711 -5.336
324 1HG GLU 46 2HG GLU 46 6.682 -7.110 -4.881
325 2HG GLU 46 1HG GLU 46 4.962 -7.301 -4.544
326 H TYR 47 H TYR 47 4.794 -6.669 -1.735
327 HA TYR 47 HA TYR 47 6.874 -7.676 -0.239
328 1HB TYR 47 2HB TYR 47 4.336 -8.066 0.001
329 2HB TYR 47 1HB TYR 47 4.564 -9.389 -1.140
330 HD1 TYR 47 1HD TYR 47 6.584 -8.205 1.775
331 HD2 TYR 47 2HD TYR 47 4.409 -11.395 -0.013
332 HE1 TYR 47 1HE TYR 47 7.242 -9.684 3.626
333 HE2 TYR 47 2HE TYR 47 5.060 -12.882 1.833
334 HH TYR 47 HH TYR 47 6.843 -13.049 3.522
Start of MODEL 16
1 1H GLY 1 1HT GLY 1 -9.751 -2.654 11.132
2 2H GLY 1 2HT GLY 1 -11.204 -3.517 11.175
3 3H GLY 1 3HT GLY 1 -11.228 -1.828 11.094
4 1HA GLY 1 1HA GLY 1 -10.224 -3.658 8.982
5 2HA GLY 1 2HA GLY 1 -11.751 -2.791 8.942
6 H SER 2 H SER 2 -11.788 -0.847 8.008
7 HA SER 2 HA SER 2 -11.068 0.942 6.792
8 1HB SER 2 2HB SER 2 -9.415 2.381 7.917
9 2HB SER 2 1HB SER 2 -10.622 1.782 9.054
10 HG SER 2 HG SER 2 -9.068 0.890 10.129
11 H GLY 3 H GLY 3 -10.192 -1.397 5.689
12 1HA GLY 3 2HA GLY 3 -8.102 -0.558 4.025
13 2HA GLY 3 1HA GLY 3 -7.413 -1.586 5.272
14 H GLU 4 H GLU 4 -7.276 -2.265 2.586
15 HA GLU 4 HA GLU 4 -7.648 -3.966 1.166
16 1HB GLU 4 2HB GLU 4 -7.034 -5.649 2.463
17 2HB GLU 4 1HB GLU 4 -7.996 -5.091 3.826
18 1HG GLU 4 2HG GLU 4 -9.979 -6.153 2.811
19 2HG GLU 4 1HG GLU 4 -8.963 -6.744 1.498
20 H VAL 5 H VAL 5 -9.890 -2.011 1.931
21 HA VAL 5 HA VAL 5 -12.228 -3.505 1.052
22 HB VAL 5 HB VAL 5 -11.987 -0.567 1.710
23 1HG1 VAL 5 1HG1 VAL 5 -14.421 -0.665 1.953
24 2HG1 VAL 5 2HG1 VAL 5 -14.398 -2.360 1.467
25 3HG1 VAL 5 3HG1 VAL 5 -13.910 -1.108 0.324
26 1HG2 VAL 5 1HG2 VAL 5 -12.961 -2.797 3.492
27 2HG2 VAL 5 2HG2 VAL 5 -12.865 -1.085 3.900
28 3HG2 VAL 5 3HG2 VAL 5 -11.389 -2.012 3.628
29 H ASN 6 H ASN 6 -9.754 -1.427 -0.147
30 HA ASN 6 HA ASN 6 -9.285 -0.560 -2.185
31 1HB ASN 6 2HB ASN 6 -9.540 -2.890 -2.863
32 2HB ASN 6 1HB ASN 6 -11.277 -2.664 -3.066
33 1HD2 ASN 6 1HD2 ASN 6 -9.063 -3.435 -4.911
34 2HD2 ASN 6 2HD2 ASN 6 -9.225 -2.364 -6.260
35 H LYS 7 H LYS 7 -10.240 1.404 -1.486
36 HA LYS 7 HA LYS 7 -12.558 2.232 -3.030
37 1HB LYS 7 2HB LYS 7 -13.631 3.151 -1.031
38 2HB LYS 7 1HB LYS 7 -13.366 1.425 -0.809
39 1HG LYS 7 2HG LYS 7 -11.148 2.141 0.334
40 2HG LYS 7 1HG LYS 7 -11.928 3.725 0.450
41 1HD LYS 7 2HD LYS 7 -13.805 2.735 1.656
42 2HD LYS 7 1HD LYS 7 -13.059 1.142 1.524
43 1HE LYS 7 2HE LYS 7 -12.691 2.199 3.727
44 2HE LYS 7 1HE LYS 7 -11.190 1.855 2.869
45 1HZ LYS 7 1HZ LYS 7 -11.049 4.158 2.217
46 2HZ LYS 7 2HZ LYS 7 -11.193 4.058 3.900
47 3HZ LYS 7 3HZ LYS 7 -12.528 4.505 2.964
48 H ILE 8 H ILE 8 -12.485 4.690 -1.149
49 HA ILE 8 HA ILE 8 -10.588 6.217 -2.577
50 HB ILE 8 HB ILE 8 -12.747 6.900 -1.357
51 1HG1 ILE 8 2HG1 ILE 8 -11.267 8.458 -2.563
52 2HG1 ILE 8 1HG1 ILE 8 -11.987 9.210 -1.143
53 1HG2 ILE 8 1HG2 ILE 8 -10.812 7.139 0.932
54 2HG2 ILE 8 2HG2 ILE 8 -12.243 6.111 0.853
55 3HG2 ILE 8 3HG2 ILE 8 -12.419 7.866 0.891
56 1HD1 ILE 8 1HD1 ILE 8 -9.794 9.915 -1.055
57 2HD1 ILE 8 2HD1 ILE 8 -9.164 8.366 -1.607
58 3HD1 ILE 8 3HD1 ILE 8 -9.793 8.527 0.032
59 H ILE 9 H ILE 9 -8.443 6.639 -2.086
60 HA ILE 9 HA ILE 9 -7.485 5.936 0.557
61 HB ILE 9 HB ILE 9 -5.672 4.761 -1.314
62 1HG1 ILE 9 2HG1 ILE 9 -7.082 2.705 -1.715
63 2HG1 ILE 9 1HG1 ILE 9 -8.479 3.698 -1.322
64 1HG2 ILE 9 1HG2 ILE 9 -6.266 2.795 0.306
65 2HG2 ILE 9 2HG2 ILE 9 -6.958 4.113 1.243
66 3HG2 ILE 9 3HG2 ILE 9 -5.249 4.144 0.792
67 1HD1 ILE 9 1HD1 ILE 9 -7.964 3.427 -3.764
68 2HD1 ILE 9 2HD1 ILE 9 -6.518 4.399 -3.487
69 3HD1 ILE 9 3HD1 ILE 9 -8.116 5.089 -3.201
70 H GLY 10 H GLY 10 -5.032 6.054 0.619
71 1HA GLY 10 2HA GLY 10 -4.135 8.505 -0.755
72 2HA GLY 10 1HA GLY 10 -3.960 8.342 0.991
73 H SER 11 H SER 11 -1.721 8.720 -0.695
74 HA SER 11 HA SER 11 -0.279 6.303 -0.122
75 1HB SER 11 2HB SER 11 0.558 6.345 -2.607
76 2HB SER 11 1HB SER 11 -0.971 5.551 -2.227
77 HG SER 11 HG SER 11 -0.474 7.763 -3.740
78 H ARG 12 H ARG 12 1.325 7.366 1.077
79 HA ARG 12 HA ARG 12 3.271 8.742 -0.539
80 1HB ARG 12 2HB ARG 12 1.800 10.607 -0.133
81 2HB ARG 12 1HB ARG 12 1.809 10.287 1.597
82 1HG ARG 12 2HG ARG 12 4.143 10.879 1.735
83 2HG ARG 12 1HG ARG 12 4.224 11.082 -0.016
84 1HD ARG 12 2HD ARG 12 4.022 13.216 1.254
85 2HD ARG 12 1HD ARG 12 2.749 12.962 0.066
86 HE ARG 12 HE ARG 12 2.477 12.952 2.964
87 1HH1 ARG 12 1HH1 ARG 12 0.963 12.361 -0.136
88 2HH1 ARG 12 2HH1 ARG 12 -0.643 12.483 0.494
89 1HH2 ARG 12 1HH2 ARG 12 0.361 13.108 3.779
90 2HH2 ARG 12 2HH2 ARG 12 -0.986 12.903 2.710
91 H THR 13 H THR 13 4.859 7.155 0.235
92 HA THR 13 HA THR 13 5.419 7.518 3.059
93 HB THR 13 HB THR 13 6.915 5.405 1.785
94 HG1 THR 13 1HG THR 13 5.239 4.261 1.077
95 1HG2 THR 13 1HG2 THR 13 5.310 5.766 4.280
96 2HG2 THR 13 2HG2 THR 13 7.054 5.566 4.113
97 3HG2 THR 13 3HG2 THR 13 5.978 4.202 3.813
98 H ALA 14 H ALA 14 7.700 6.574 0.519
99 HA ALA 14 HA ALA 14 9.270 8.975 1.037
100 1HB ALA 14 1HB ALA 14 10.428 6.264 1.650
101 2HB ALA 14 2HB ALA 14 9.931 7.460 2.849
102 3HB ALA 14 3HB ALA 14 11.265 7.814 1.751
103 H GLY 15 H GLY 15 9.617 5.717 -0.381
104 1HA GLY 15 2HA GLY 15 9.586 5.688 -2.890
105 2HA GLY 15 1HA GLY 15 10.728 7.022 -2.800
106 H GLU 16 H GLU 16 12.335 6.102 -0.718
107 HA GLU 16 HA GLU 16 14.045 4.297 -2.115
108 1HB GLU 16 2HB GLU 16 14.128 5.457 0.671
109 2HB GLU 16 1HB GLU 16 15.405 4.441 0.005
110 1HG GLU 16 2HG GLU 16 15.780 6.071 -1.769
111 2HG GLU 16 1HG GLU 16 14.489 7.080 -1.118
112 H GLY 17 H GLY 17 11.334 3.781 -0.217
113 1HA GLY 17 2HA GLY 17 11.910 0.955 0.022
114 2HA GLY 17 1HA GLY 17 11.612 1.805 1.537
115 H ALA 18 H ALA 18 9.669 3.482 1.109
116 HA ALA 18 HA ALA 18 7.532 2.076 -0.235
117 1HB ALA 18 1HB ALA 18 5.955 2.301 1.507
118 2HB ALA 18 2HB ALA 18 7.045 3.370 2.408
119 3HB ALA 18 3HB ALA 18 7.424 1.653 2.252
120 H MET 19 H MET 19 5.797 3.496 -1.012
121 HA MET 19 HA MET 19 6.255 6.335 -0.625
122 1HB MET 19 2HB MET 19 7.610 5.194 -2.682
123 2HB MET 19 1HB MET 19 6.126 5.667 -3.499
124 1HG MET 19 2HG MET 19 6.426 7.954 -2.787
125 2HG MET 19 1HG MET 19 7.858 7.496 -1.874
126 1HE MET 19 1HE MET 19 7.788 9.880 -4.069
127 2HE MET 19 2HE MET 19 9.359 9.595 -4.819
128 3HE MET 19 3HE MET 19 9.176 9.448 -3.071
129 H GLU 20 H GLU 20 4.034 4.087 -0.661
130 HA GLU 20 HA GLU 20 1.946 5.957 -1.305
131 1HB GLU 20 2HB GLU 20 2.045 3.297 -2.737
132 2HB GLU 20 1HB GLU 20 0.699 4.415 -2.774
133 1HG GLU 20 2HG GLU 20 2.579 6.037 -3.678
134 2HG GLU 20 1HG GLU 20 3.362 4.504 -4.110
135 H TYR 21 H TYR 21 -0.283 4.528 -0.872
136 HA TYR 21 HA TYR 21 0.120 2.554 1.132
137 1HB TYR 21 2HB TYR 21 0.386 4.058 2.744
138 2HB TYR 21 1HB TYR 21 -0.333 5.346 1.826
139 HD1 TYR 21 1HD TYR 21 -2.203 6.356 2.871
140 HD2 TYR 21 2HD TYR 21 -1.412 2.204 3.464
141 HE1 TYR 21 1HE TYR 21 -4.205 6.162 4.288
142 HE2 TYR 21 2HE TYR 21 -3.372 2.020 4.895
143 HH TYR 21 HH TYR 21 -5.748 4.475 5.104
144 H LEU 22 H LEU 22 -1.582 3.352 -1.378
145 HA LEU 22 HA LEU 22 -4.162 2.930 -0.214
146 1HB LEU 22 2HB LEU 22 -5.019 3.347 -2.464
147 2HB LEU 22 1HB LEU 22 -3.889 4.598 -1.976
148 HG LEU 22 HG LEU 22 -2.201 2.948 -3.278
149 1HD1 LEU 22 1HD1 LEU 22 -3.270 2.169 -5.324
150 2HD1 LEU 22 2HD1 LEU 22 -4.840 2.690 -4.711
151 3HD1 LEU 22 3HD1 LEU 22 -3.967 1.386 -3.906
152 1HD2 LEU 22 1HD2 LEU 22 -3.935 5.133 -4.418
153 2HD2 LEU 22 2HD2 LEU 22 -2.522 4.463 -5.233
154 3HD2 LEU 22 3HD2 LEU 22 -2.336 5.299 -3.692
155 H ILE 23 H ILE 23 -5.181 1.293 0.075
156 HA ILE 23 HA ILE 23 -4.654 -1.214 -0.439
157 HB ILE 23 HB ILE 23 -6.511 -0.777 0.888
158 1HG1 ILE 23 2HG1 ILE 23 -8.104 -2.336 0.211
159 2HG1 ILE 23 1HG1 ILE 23 -7.907 -1.975 -1.492
160 1HG2 ILE 23 1HG2 ILE 23 -7.359 0.886 -1.356
161 2HG2 ILE 23 2HG2 ILE 23 -7.510 1.132 0.382
162 3HG2 ILE 23 3HG2 ILE 23 -8.645 0.087 -0.463
163 1HD1 ILE 23 1HD1 ILE 23 -5.727 -3.219 0.135
164 2HD1 ILE 23 2HD1 ILE 23 -5.920 -3.175 -1.605
165 3HD1 ILE 23 3HD1 ILE 23 -6.989 -4.170 -0.644
166 H GLU 24 H GLU 24 -7.357 -0.612 -2.544
167 HA GLU 24 HA GLU 24 -7.597 -1.364 -4.721
168 1HB GLU 24 2HB GLU 24 -6.878 1.123 -4.561
169 2HB GLU 24 1HB GLU 24 -5.341 0.560 -5.199
170 1HG GLU 24 2HG GLU 24 -6.734 1.406 -6.981
171 2HG GLU 24 1HG GLU 24 -6.474 -0.326 -7.177
172 H TRP 25 H TRP 25 -5.663 -3.032 -3.283
173 HA TRP 25 HA TRP 25 -4.080 -3.978 -5.526
174 1HB TRP 25 2HB TRP 25 -2.263 -4.588 -3.753
175 2HB TRP 25 1HB TRP 25 -2.309 -2.975 -4.433
176 HD1 TRP 25 HD TRP 25 -4.328 -4.306 -1.314
177 HE1 TRP 25 1HE TRP 25 -3.690 -2.788 0.678
178 HE3 TRP 25 3HE TRP 25 -0.798 -1.279 -3.526
179 HZ2 TRP 25 2HZ TRP 25 -2.023 -0.663 1.253
180 HZ3 TRP 25 3HZ TRP 25 0.333 0.430 -2.113
181 HH2 TRP 25 HH TRP 25 -0.297 0.759 0.203
182 H LYS 26 H LYS 26 -6.572 -4.855 -4.379
183 HA LYS 26 HA LYS 26 -7.647 -6.764 -3.779
184 1HB LYS 26 2HB LYS 26 -5.195 -8.212 -4.767
185 2HB LYS 26 1HB LYS 26 -6.858 -8.779 -4.769
186 1HG LYS 26 2HG LYS 26 -5.764 -6.528 -6.445
187 2HG LYS 26 1HG LYS 26 -6.116 -8.163 -7.006
188 1HD LYS 26 2HD LYS 26 -8.292 -6.643 -5.665
189 2HD LYS 26 1HD LYS 26 -7.843 -6.175 -7.306
190 1HE LYS 26 2HE LYS 26 -9.662 -7.799 -7.322
191 2HE LYS 26 1HE LYS 26 -8.211 -8.465 -8.067
192 1HZ LYS 26 1HZ LYS 26 -7.773 -9.763 -6.162
193 2HZ LYS 26 2HZ LYS 26 -9.415 -9.980 -6.506
194 3HZ LYS 26 3HZ LYS 26 -8.945 -8.962 -5.240
195 H ASP 27 H ASP 27 -5.893 -5.503 -1.807
196 HA ASP 27 HA ASP 27 -4.872 -5.906 0.206
197 1HB ASP 27 2HB ASP 27 -6.176 -7.378 1.664
198 2HB ASP 27 1HB ASP 27 -7.234 -6.374 0.678
199 H GLY 28 H GLY 28 -3.472 -7.202 -1.916
200 1HA GLY 28 2HA GLY 28 -2.885 -9.873 -1.645
201 2HA GLY 28 1HA GLY 28 -1.691 -8.669 -2.094
202 H HIS 29 H HIS 29 -1.169 -7.252 0.094
203 HA HIS 29 HA HIS 29 -0.733 -9.138 2.255
204 1HB HIS 29 2HB HIS 29 1.528 -7.459 1.026
205 2HB HIS 29 1HB HIS 29 1.611 -8.295 2.578
206 HD1 HIS 29 1HD HIS 29 1.159 -9.078 -1.098
207 HD2 HIS 29 2HD HIS 29 2.346 -10.909 2.438
208 HE1 HIS 29 1HE HIS 29 2.029 -11.340 -1.772
209 HE2 HIS 29 2HE HIS 29 2.834 -12.388 0.373
210 H SER 30 H SER 30 -2.267 -8.159 3.413
211 HA SER 30 HA SER 30 -3.334 -6.627 4.713
212 1HB SER 30 2HB SER 30 -1.390 -7.370 6.027
213 2HB SER 30 1HB SER 30 -0.479 -5.982 5.410
214 HG SER 30 HG SER 30 -1.327 -5.404 7.380
215 HA PRO 31 HA PRO 31 -3.850 -2.505 2.496
216 1HB PRO 31 2HB PRO 31 -4.849 -1.790 5.152
217 2HB PRO 31 1HB PRO 31 -5.731 -1.873 3.630
218 1HG PRO 31 2HG PRO 31 -5.550 -3.860 5.780
219 2HG PRO 31 1HG PRO 31 -6.716 -3.759 4.460
220 1HD PRO 31 2HD PRO 31 -4.901 -5.714 4.547
221 2HD PRO 31 1HD PRO 31 -5.357 -4.975 2.997
222 H SER 32 H SER 32 -1.746 -1.964 2.371
223 HA SER 32 HA SER 32 -0.410 -1.203 4.888
224 1HB SER 32 2HB SER 32 0.656 -2.603 2.461
225 2HB SER 32 1HB SER 32 1.728 -1.749 3.570
226 HG SER 32 HG SER 32 1.620 -3.437 4.797
227 H TRP 33 H TRP 33 1.514 0.095 4.549
228 HA TRP 33 HA TRP 33 0.927 2.284 2.721
229 1HB TRP 33 2HB TRP 33 1.091 2.591 5.264
230 2HB TRP 33 1HB TRP 33 2.819 2.285 5.102
231 HD1 TRP 33 HD TRP 33 4.085 4.058 3.369
232 HE1 TRP 33 1HE TRP 33 3.733 6.594 3.155
233 HE3 TRP 33 3HE TRP 33 -0.499 4.442 5.572
234 HZ2 TRP 33 2HZ TRP 33 1.769 8.512 3.805
235 HZ3 TRP 33 3HZ TRP 33 -1.556 6.661 5.724
236 HH2 TRP 33 HH TRP 33 -0.445 8.653 4.843
237 H VAL 34 H VAL 34 1.867 1.800 0.908
238 HA VAL 34 HA VAL 34 4.708 1.096 0.703
239 HB VAL 34 HB VAL 34 3.506 -1.101 0.914
240 1HG1 VAL 34 1HG1 VAL 34 1.901 -0.837 -1.431
241 2HG1 VAL 34 2HG1 VAL 34 1.497 0.358 -0.237
242 3HG1 VAL 34 3HG1 VAL 34 1.461 -1.339 0.195
243 1HG2 VAL 34 1HG2 VAL 34 4.146 -0.521 -1.949
244 2HG2 VAL 34 2HG2 VAL 34 3.932 -2.104 -1.250
245 3HG2 VAL 34 3HG2 VAL 34 5.263 -1.093 -0.727
246 HA PRO 35 HA PRO 35 4.644 3.513 -3.030
247 1HB PRO 35 2HB PRO 35 6.021 1.239 -4.312
248 2HB PRO 35 1HB PRO 35 6.523 2.933 -4.232
249 1HG PRO 35 2HG PRO 35 7.744 1.143 -2.721
250 2HG PRO 35 1HG PRO 35 7.244 2.680 -1.998
251 1HD PRO 35 2HD PRO 35 5.936 0.036 -1.987
252 2HD PRO 35 1HD PRO 35 6.233 1.065 -0.589
253 H SER 36 H SER 36 3.033 0.497 -3.057
254 HA SER 36 HA SER 36 1.229 1.112 -5.024
255 1HB SER 36 2HB SER 36 3.752 0.048 -6.148
256 2HB SER 36 1HB SER 36 2.257 -0.597 -6.823
257 HG SER 36 HG SER 36 2.555 2.177 -6.502
258 H SER 37 H SER 37 2.723 -1.346 -3.093
259 HA SER 37 HA SER 37 0.312 -2.955 -3.482
260 1HB SER 37 2HB SER 37 3.140 -4.002 -3.495
261 2HB SER 37 1HB SER 37 1.716 -5.025 -3.327
262 HG SER 37 HG SER 37 1.010 -4.194 -5.360
263 H TYR 38 H TYR 38 3.131 -3.837 -1.538
264 HA TYR 38 HA TYR 38 2.272 -2.859 0.967
265 1HB TYR 38 2HB TYR 38 1.871 -5.572 1.446
266 2HB TYR 38 1HB TYR 38 0.652 -4.314 1.514
267 HD1 TYR 38 1HD TYR 38 -1.144 -4.415 0.108
268 HD2 TYR 38 2HD TYR 38 2.322 -6.643 -0.843
269 HE1 TYR 38 1HE TYR 38 -2.380 -5.508 -1.726
270 HE2 TYR 38 2HE TYR 38 1.116 -7.741 -2.700
271 HH TYR 38 HH TYR 38 -1.235 -8.261 -3.306
272 H ILE 39 H ILE 39 4.351 -2.575 1.576
273 HA ILE 39 HA ILE 39 6.140 -4.878 1.417
274 HB ILE 39 HB ILE 39 7.893 -3.717 0.438
275 1HG1 ILE 39 2HG1 ILE 39 8.241 -1.722 1.578
276 2HG1 ILE 39 1HG1 ILE 39 7.681 -1.155 0.025
277 1HG2 ILE 39 1HG2 ILE 39 6.651 -4.037 -1.375
278 2HG2 ILE 39 2HG2 ILE 39 6.601 -2.275 -1.400
279 3HG2 ILE 39 3HG2 ILE 39 5.265 -3.188 -0.717
280 1HD1 ILE 39 1HD1 ILE 39 6.503 0.171 1.432
281 2HD1 ILE 39 2HD1 ILE 39 6.310 -1.082 2.649
282 3HD1 ILE 39 3HD1 ILE 39 5.371 -1.133 1.177
283 H ALA 40 H ALA 40 5.007 -4.728 3.572
284 HA ALA 40 HA ALA 40 5.674 -2.862 5.502
285 1HB ALA 40 1HB ALA 40 4.728 -4.339 6.963
286 2HB ALA 40 2HB ALA 40 5.422 -5.742 6.147
287 3HB ALA 40 3HB ALA 40 4.072 -4.875 5.413
288 H ALA 41 H ALA 41 7.733 -2.222 5.409
289 HA ALA 41 HA ALA 41 9.689 -3.179 7.010
290 1HB ALA 41 1HB ALA 41 11.319 -4.202 5.375
291 2HB ALA 41 2HB ALA 41 9.974 -4.351 4.244
292 3HB ALA 41 3HB ALA 41 9.931 -5.209 5.784
293 H ASP 42 H ASP 42 8.860 -1.693 3.973
294 HA ASP 42 HA ASP 42 9.290 0.393 3.171
295 1HB ASP 42 2HB ASP 42 11.229 0.766 5.458
296 2HB ASP 42 1HB ASP 42 10.520 2.019 4.446
297 H VAL 43 H VAL 43 10.438 -1.589 1.851
298 HA VAL 43 HA VAL 43 12.932 -0.378 0.975
299 HB VAL 43 HB VAL 43 13.024 -3.304 1.652
300 1HG1 VAL 43 1HG1 VAL 43 14.720 -2.713 0.128
301 2HG1 VAL 43 2HG1 VAL 43 15.503 -2.750 1.707
302 3HG1 VAL 43 3HG1 VAL 43 15.066 -1.206 0.975
303 1HG2 VAL 43 1HG2 VAL 43 13.906 -1.018 3.412
304 2HG2 VAL 43 2HG2 VAL 43 14.239 -2.726 3.700
305 3HG2 VAL 43 3HG2 VAL 43 12.579 -2.134 3.737
306 H VAL 44 H VAL 44 10.170 -1.096 -0.157
307 HA VAL 44 HA VAL 44 11.188 -2.089 -2.682
308 HB VAL 44 HB VAL 44 8.896 -3.656 -1.557
309 1HG1 VAL 44 1HG1 VAL 44 9.462 -5.245 -3.227
310 2HG1 VAL 44 2HG1 VAL 44 11.011 -4.463 -3.543
311 3HG1 VAL 44 3HG1 VAL 44 9.510 -3.662 -4.002
312 1HG2 VAL 44 1HG2 VAL 44 10.727 -3.910 0.061
313 2HG2 VAL 44 2HG2 VAL 44 11.801 -4.413 -1.243
314 3HG2 VAL 44 3HG2 VAL 44 10.409 -5.407 -0.815
315 H SER 45 H SER 45 9.805 -1.793 -4.435
316 HA SER 45 HA SER 45 7.723 0.162 -4.109
317 1HB SER 45 2HB SER 45 9.291 0.308 -5.996
318 2HB SER 45 1HB SER 45 8.695 -1.239 -6.594
319 HG SER 45 HG SER 45 7.688 1.206 -6.991
320 H GLU 46 H GLU 46 7.708 -3.075 -3.728
321 HA GLU 46 HA GLU 46 4.966 -3.363 -3.582
322 1HB GLU 46 2HB GLU 46 4.763 -3.022 -5.898
323 2HB GLU 46 1HB GLU 46 6.127 -4.067 -6.262
324 1HG GLU 46 2HG GLU 46 3.804 -5.312 -4.918
325 2HG GLU 46 1HG GLU 46 3.605 -4.831 -6.601
326 H TYR 47 H TYR 47 4.256 -5.512 -3.040
327 HA TYR 47 HA TYR 47 6.430 -7.476 -2.708
328 1HB TYR 47 2HB TYR 47 5.716 -6.361 -0.537
329 2HB TYR 47 1HB TYR 47 4.151 -7.169 -0.717
330 HD1 TYR 47 1HD TYR 47 7.742 -7.647 -0.065
331 HD2 TYR 47 2HD TYR 47 3.949 -9.549 -0.376
332 HE1 TYR 47 1HE TYR 47 8.667 -9.655 1.012
333 HE2 TYR 47 2HE TYR 47 4.862 -11.561 0.701
334 HH TYR 47 HH TYR 47 7.869 -11.596 2.281
Start of MODEL 17
1 1H GLY 1 1HT GLY 1 -10.813 -0.014 11.487
2 2H GLY 1 2HT GLY 1 -9.563 -1.154 11.455
3 3H GLY 1 3HT GLY 1 -10.578 -0.973 10.114
4 1HA GLY 1 1HA GLY 1 -9.745 1.244 9.714
5 2HA GLY 1 2HA GLY 1 -8.731 1.111 11.143
6 H SER 2 H SER 2 -9.326 -1.378 8.694
7 HA SER 2 HA SER 2 -6.434 -1.453 8.203
8 1HB SER 2 2HB SER 2 -6.851 -3.700 7.259
9 2HB SER 2 1HB SER 2 -7.435 -3.570 8.918
10 HG SER 2 HG SER 2 -9.106 -4.467 7.876
11 H GLY 3 H GLY 3 -9.151 -2.413 6.141
12 1HA GLY 3 2HA GLY 3 -9.681 -0.750 4.294
13 2HA GLY 3 1HA GLY 3 -7.959 -0.808 3.972
14 H GLU 4 H GLU 4 -7.344 -2.119 2.391
15 HA GLU 4 HA GLU 4 -7.473 -3.681 0.751
16 1HB GLU 4 2HB GLU 4 -7.008 -5.575 1.832
17 2HB GLU 4 1HB GLU 4 -7.731 -4.940 3.293
18 1HG GLU 4 2HG GLU 4 -9.919 -5.834 2.556
19 2HG GLU 4 1HG GLU 4 -9.118 -6.548 1.157
20 H VAL 5 H VAL 5 -9.793 -1.858 1.302
21 HA VAL 5 HA VAL 5 -12.016 -3.442 0.297
22 HB VAL 5 HB VAL 5 -12.079 -0.572 1.188
23 1HG1 VAL 5 1HG1 VAL 5 -13.948 -1.221 -0.207
24 2HG1 VAL 5 2HG1 VAL 5 -14.490 -1.009 1.458
25 3HG1 VAL 5 3HG1 VAL 5 -14.247 -2.632 0.808
26 1HG2 VAL 5 1HG2 VAL 5 -12.431 -3.094 2.780
27 2HG2 VAL 5 2HG2 VAL 5 -13.113 -1.550 3.294
28 3HG2 VAL 5 3HG2 VAL 5 -11.368 -1.725 3.109
29 H ASN 6 H ASN 6 -9.649 -1.148 -0.677
30 HA ASN 6 HA ASN 6 -9.237 -0.110 -2.657
31 1HB ASN 6 2HB ASN 6 -9.550 -2.346 -3.556
32 2HB ASN 6 1HB ASN 6 -11.293 -2.110 -3.632
33 1HD2 ASN 6 1HD2 ASN 6 -9.050 -2.650 -5.596
34 2HD2 ASN 6 2HD2 ASN 6 -9.347 -1.519 -6.877
35 H LYS 7 H LYS 7 -10.411 1.476 -1.210
36 HA LYS 7 HA LYS 7 -12.618 2.720 -2.688
37 1HB LYS 7 2HB LYS 7 -13.645 3.273 -0.503
38 2HB LYS 7 1HB LYS 7 -13.527 1.532 -0.736
39 1HG LYS 7 2HG LYS 7 -11.289 1.728 0.566
40 2HG LYS 7 1HG LYS 7 -11.927 3.295 1.075
41 1HD LYS 7 2HD LYS 7 -13.470 0.733 1.389
42 2HD LYS 7 1HD LYS 7 -12.417 1.392 2.643
43 1HE LYS 7 2HE LYS 7 -13.748 3.461 2.637
44 2HE LYS 7 1HE LYS 7 -14.812 2.758 1.418
45 1HZ LYS 7 1HZ LYS 7 -14.392 1.716 4.168
46 2HZ LYS 7 2HZ LYS 7 -15.395 1.016 2.999
47 3HZ LYS 7 3HZ LYS 7 -15.760 2.547 3.619
48 H ILE 8 H ILE 8 -12.385 4.678 -0.155
49 HA ILE 8 HA ILE 8 -10.912 6.695 -1.218
50 HB ILE 8 HB ILE 8 -12.261 6.816 0.873
51 1HG1 ILE 8 2HG1 ILE 8 -10.925 8.555 1.916
52 2HG1 ILE 8 1HG1 ILE 8 -9.458 7.904 1.194
53 1HG2 ILE 8 1HG2 ILE 8 -11.588 6.000 2.903
54 2HG2 ILE 8 2HG2 ILE 8 -9.880 6.019 2.465
55 3HG2 ILE 8 3HG2 ILE 8 -10.938 4.764 1.825
56 1HD1 ILE 8 1HD1 ILE 8 -10.264 9.911 0.049
57 2HD1 ILE 8 2HD1 ILE 8 -11.770 9.076 -0.335
58 3HD1 ILE 8 3HD1 ILE 8 -10.245 8.502 -1.011
59 H ILE 9 H ILE 9 -8.956 6.486 -2.096
60 HA ILE 9 HA ILE 9 -6.999 4.808 -0.716
61 HB ILE 9 HB ILE 9 -5.812 5.078 -3.061
62 1HG1 ILE 9 2HG1 ILE 9 -8.738 5.456 -3.724
63 2HG1 ILE 9 1HG1 ILE 9 -7.453 6.625 -4.020
64 1HG2 ILE 9 1HG2 ILE 9 -6.332 3.000 -2.142
65 2HG2 ILE 9 2HG2 ILE 9 -6.999 3.028 -3.773
66 3HG2 ILE 9 3HG2 ILE 9 -8.066 3.240 -2.381
67 1HD1 ILE 9 1HD1 ILE 9 -6.452 5.222 -5.653
68 2HD1 ILE 9 2HD1 ILE 9 -8.177 5.313 -6.012
69 3HD1 ILE 9 3HD1 ILE 9 -7.512 3.878 -5.230
70 H GLY 10 H GLY 10 -5.691 5.824 0.558
71 1HA GLY 10 2HA GLY 10 -4.585 8.458 -0.210
72 2HA GLY 10 1HA GLY 10 -4.699 7.855 1.447
73 H SER 11 H SER 11 -2.267 8.656 -0.292
74 HA SER 11 HA SER 11 -0.767 6.330 0.354
75 1HB SER 11 2HB SER 11 -0.630 5.356 -1.654
76 2HB SER 11 1HB SER 11 -1.907 6.443 -2.167
77 HG SER 11 HG SER 11 -0.462 7.711 -3.147
78 H ARG 12 H ARG 12 0.944 7.211 1.409
79 HA ARG 12 HA ARG 12 2.746 8.850 -0.139
80 1HB ARG 12 2HB ARG 12 1.219 10.574 0.640
81 2HB ARG 12 1HB ARG 12 1.432 10.043 2.302
82 1HG ARG 12 2HG ARG 12 2.718 12.060 1.813
83 2HG ARG 12 1HG ARG 12 3.766 10.704 2.241
84 1HD ARG 12 2HD ARG 12 4.358 10.346 -0.039
85 2HD ARG 12 1HD ARG 12 3.130 11.478 -0.600
86 HE ARG 12 HE ARG 12 5.742 12.115 0.465
87 1HH1 ARG 12 1HH1 ARG 12 2.550 13.294 -0.297
88 2HH1 ARG 12 2HH1 ARG 12 3.051 14.947 -0.414
89 1HH2 ARG 12 1HH2 ARG 12 6.404 14.291 0.317
90 2HH2 ARG 12 2HH2 ARG 12 5.237 15.513 -0.064
91 H THR 13 H THR 13 4.476 7.372 0.282
92 HA THR 13 HA THR 13 5.141 7.201 3.125
93 HB THR 13 HB THR 13 6.312 5.182 1.341
94 HG1 THR 13 1HG THR 13 4.504 4.094 1.087
95 1HG2 THR 13 1HG2 THR 13 5.860 3.793 3.414
96 2HG2 THR 13 2HG2 THR 13 5.421 5.312 4.196
97 3HG2 THR 13 3HG2 THR 13 7.051 5.084 3.566
98 H ALA 14 H ALA 14 7.171 6.494 0.289
99 HA ALA 14 HA ALA 14 8.905 8.705 1.032
100 1HB ALA 14 1HB ALA 14 9.932 5.873 1.074
101 2HB ALA 14 2HB ALA 14 9.649 6.885 2.489
102 3HB ALA 14 3HB ALA 14 10.887 7.335 1.317
103 H GLY 15 H GLY 15 8.980 5.709 -0.953
104 1HA GLY 15 2HA GLY 15 8.709 6.053 -3.403
105 2HA GLY 15 1HA GLY 15 9.732 7.468 -3.226
106 H GLU 16 H GLU 16 11.823 6.606 -1.756
107 HA GLU 16 HA GLU 16 13.408 5.241 -3.609
108 1HB GLU 16 2HB GLU 16 13.778 5.626 -0.633
109 2HB GLU 16 1HB GLU 16 15.015 4.968 -1.695
110 1HG GLU 16 2HG GLU 16 13.787 7.704 -1.946
111 2HG GLU 16 1HG GLU 16 15.349 7.348 -1.210
112 H GLY 17 H GLY 17 11.177 4.099 -1.260
113 1HA GLY 17 2HA GLY 17 11.791 1.346 -2.043
114 2HA GLY 17 1HA GLY 17 11.745 1.738 -0.331
115 H ALA 18 H ALA 18 9.630 3.239 0.098
116 HA ALA 18 HA ALA 18 7.347 1.927 -1.151
117 1HB ALA 18 1HB ALA 18 6.290 1.901 1.114
118 2HB ALA 18 2HB ALA 18 7.868 2.330 1.767
119 3HB ALA 18 3HB ALA 18 7.651 0.784 0.919
120 H MET 19 H MET 19 5.411 3.316 -1.309
121 HA MET 19 HA MET 19 5.563 5.984 -0.257
122 1HB MET 19 2HB MET 19 7.155 5.691 -2.356
123 2HB MET 19 1HB MET 19 5.669 6.084 -3.205
124 1HG MET 19 2HG MET 19 6.409 7.828 -0.945
125 2HG MET 19 1HG MET 19 7.419 7.913 -2.384
126 1HE MET 19 1HE MET 19 5.233 11.103 -2.814
127 2HE MET 19 2HE MET 19 6.867 10.441 -2.736
128 3HE MET 19 3HE MET 19 5.851 10.453 -1.294
129 H GLU 20 H GLU 20 3.445 3.810 -0.775
130 HA GLU 20 HA GLU 20 1.362 5.687 -1.322
131 1HB GLU 20 2HB GLU 20 1.165 3.284 -3.039
132 2HB GLU 20 1HB GLU 20 0.460 4.867 -3.273
133 1HG GLU 20 2HG GLU 20 2.746 5.714 -3.816
134 2HG GLU 20 1HG GLU 20 3.336 4.048 -3.724
135 H TYR 21 H TYR 21 0.447 5.227 0.563
136 HA TYR 21 HA TYR 21 0.029 2.669 1.618
137 1HB TYR 21 2HB TYR 21 0.336 4.303 3.193
138 2HB TYR 21 1HB TYR 21 -0.561 5.488 2.303
139 HD1 TYR 21 1HD TYR 21 -2.456 6.277 3.415
140 HD2 TYR 21 2HD TYR 21 -1.260 2.221 3.920
141 HE1 TYR 21 1HE TYR 21 -4.380 5.886 4.902
142 HE2 TYR 21 2HE TYR 21 -3.151 1.830 5.406
143 HH TYR 21 HH TYR 21 -5.753 3.969 5.688
144 H LEU 22 H LEU 22 -1.538 3.889 -0.882
145 HA LEU 22 HA LEU 22 -4.136 3.355 0.162
146 1HB LEU 22 2HB LEU 22 -4.995 4.418 -1.642
147 2HB LEU 22 1HB LEU 22 -3.523 5.276 -1.376
148 HG LEU 22 HG LEU 22 -3.628 5.137 -3.687
149 1HD1 LEU 22 1HD1 LEU 22 -1.966 3.365 -4.403
150 2HD1 LEU 22 2HD1 LEU 22 -1.874 2.923 -2.706
151 3HD1 LEU 22 3HD1 LEU 22 -1.441 4.549 -3.218
152 1HD2 LEU 22 1HD2 LEU 22 -3.921 2.710 -4.726
153 2HD2 LEU 22 2HD2 LEU 22 -5.272 3.796 -4.411
154 3HD2 LEU 22 3HD2 LEU 22 -4.895 2.512 -3.276
155 H ILE 23 H ILE 23 -5.266 1.801 0.104
156 HA ILE 23 HA ILE 23 -4.804 -0.616 -0.797
157 HB ILE 23 HB ILE 23 -7.200 -1.081 -0.695
158 1HG1 ILE 23 2HG1 ILE 23 -7.749 1.225 -1.746
159 2HG1 ILE 23 1HG1 ILE 23 -8.824 0.601 -0.503
160 1HG2 ILE 23 1HG2 ILE 23 -5.940 -1.072 1.342
161 2HG2 ILE 23 2HG2 ILE 23 -7.515 -0.333 1.639
162 3HG2 ILE 23 3HG2 ILE 23 -6.082 0.682 1.470
163 1HD1 ILE 23 1HD1 ILE 23 -7.454 2.017 1.131
164 2HD1 ILE 23 2HD1 ILE 23 -8.551 2.847 0.032
165 3HD1 ILE 23 3HD1 ILE 23 -6.824 2.820 -0.304
166 H GLU 24 H GLU 24 -7.437 -0.803 -2.527
167 HA GLU 24 HA GLU 24 -7.803 -1.126 -4.721
168 1HB GLU 24 2HB GLU 24 -7.461 1.379 -4.701
169 2HB GLU 24 1HB GLU 24 -5.799 1.077 -5.185
170 1HG GLU 24 2HG GLU 24 -6.589 0.000 -7.231
171 2HG GLU 24 1HG GLU 24 -8.256 0.299 -6.743
172 H TRP 25 H TRP 25 -5.352 -2.283 -3.229
173 HA TRP 25 HA TRP 25 -3.880 -3.074 -5.635
174 1HB TRP 25 2HB TRP 25 -2.132 -3.847 -3.806
175 2HB TRP 25 1HB TRP 25 -2.152 -2.208 -4.421
176 HD1 TRP 25 HD TRP 25 -4.571 -3.440 -1.641
177 HE1 TRP 25 1HE TRP 25 -3.991 -2.122 0.522
178 HE3 TRP 25 3HE TRP 25 -0.418 -0.901 -3.242
179 HZ2 TRP 25 2HZ TRP 25 -2.096 -0.264 1.393
180 HZ3 TRP 25 3HZ TRP 25 0.748 0.604 -1.647
181 HH2 TRP 25 HH TRP 25 -0.099 0.984 0.570
182 H LYS 26 H LYS 26 -6.364 -4.155 -4.658
183 HA LYS 26 HA LYS 26 -7.398 -6.157 -4.499
184 1HB LYS 26 2HB LYS 26 -4.722 -7.045 -5.559
185 2HB LYS 26 1HB LYS 26 -6.051 -8.164 -5.298
186 1HG LYS 26 2HG LYS 26 -5.851 -7.389 -7.636
187 2HG LYS 26 1HG LYS 26 -7.413 -7.020 -6.905
188 1HD LYS 26 2HD LYS 26 -6.753 -4.727 -6.545
189 2HD LYS 26 1HD LYS 26 -5.118 -5.072 -7.115
190 1HE LYS 26 2HE LYS 26 -7.637 -5.277 -8.760
191 2HE LYS 26 1HE LYS 26 -6.480 -3.950 -8.822
192 1HZ LYS 26 1HZ LYS 26 -4.785 -5.537 -9.540
193 2HZ LYS 26 2HZ LYS 26 -6.091 -5.494 -10.614
194 3HZ LYS 26 3HZ LYS 26 -5.933 -6.781 -9.529
195 H ASP 27 H ASP 27 -5.910 -5.072 -2.169
196 HA ASP 27 HA ASP 27 -5.214 -5.709 -0.085
197 1HB ASP 27 2HB ASP 27 -6.666 -7.343 0.992
198 2HB ASP 27 1HB ASP 27 -7.615 -6.280 -0.043
199 H GLY 28 H GLY 28 -3.613 -6.789 -2.257
200 1HA GLY 28 2HA GLY 28 -2.977 -9.455 -2.123
201 2HA GLY 28 1HA GLY 28 -1.789 -8.202 -2.416
202 H HIS 29 H HIS 29 -1.373 -6.919 -0.121
203 HA HIS 29 HA HIS 29 -1.098 -8.974 1.919
204 1HB HIS 29 2HB HIS 29 1.261 -7.269 0.977
205 2HB HIS 29 1HB HIS 29 1.246 -8.313 2.398
206 HD1 HIS 29 1HD HIS 29 0.845 -10.941 1.857
207 HD2 HIS 29 2HD HIS 29 2.004 -8.525 -1.320
208 HE1 HIS 29 1HE HIS 29 1.683 -12.516 0.086
209 HE2 HIS 29 2HE HIS 29 2.299 -11.037 -1.860
210 H SER 30 H SER 30 -2.668 -7.990 3.052
211 HA SER 30 HA SER 30 -3.703 -6.504 4.428
212 1HB SER 30 2HB SER 30 -1.814 -7.374 5.751
213 2HB SER 30 1HB SER 30 -0.840 -5.993 5.217
214 HG SER 30 HG SER 30 -2.982 -6.091 7.019
215 HA PRO 31 HA PRO 31 -3.881 -2.257 2.449
216 1HB PRO 31 2HB PRO 31 -5.060 -1.554 5.015
217 2HB PRO 31 1HB PRO 31 -5.844 -1.624 3.438
218 1HG PRO 31 2HG PRO 31 -5.800 -3.628 5.600
219 2HG PRO 31 1HG PRO 31 -6.948 -3.450 4.273
220 1HD PRO 31 2HD PRO 31 -5.235 -5.489 4.322
221 2HD PRO 31 1HD PRO 31 -5.607 -4.676 2.784
222 H SER 32 H SER 32 -1.823 -1.589 2.534
223 HA SER 32 HA SER 32 -0.620 -1.086 5.158
224 1HB SER 32 2HB SER 32 0.774 -2.347 2.846
225 2HB SER 32 1HB SER 32 1.535 -1.826 4.352
226 HG SER 32 HG SER 32 0.178 -4.100 3.833
227 H TRP 33 H TRP 33 0.949 0.496 5.330
228 HA TRP 33 HA TRP 33 0.579 2.514 3.296
229 1HB TRP 33 2HB TRP 33 0.477 3.012 5.769
230 2HB TRP 33 1HB TRP 33 2.184 2.593 5.887
231 HD1 TRP 33 HD TRP 33 3.794 4.254 4.149
232 HE1 TRP 33 1HE TRP 33 3.572 6.800 3.870
233 HE3 TRP 33 3HE TRP 33 -0.936 4.921 5.978
234 HZ2 TRP 33 2HZ TRP 33 1.668 8.828 4.328
235 HZ3 TRP 33 3HZ TRP 33 -1.888 7.189 6.003
236 HH2 TRP 33 HH TRP 33 -0.613 9.101 5.174
237 H VAL 34 H VAL 34 1.671 1.733 1.557
238 HA VAL 34 HA VAL 34 4.536 1.541 1.786
239 HB VAL 34 HB VAL 34 3.475 -0.956 0.629
240 1HG1 VAL 34 1HG1 VAL 34 5.164 -1.392 2.846
241 2HG1 VAL 34 2HG1 VAL 34 5.750 0.084 2.084
242 3HG1 VAL 34 3HG1 VAL 34 5.623 -1.394 1.157
243 1HG2 VAL 34 1HG2 VAL 34 1.818 -0.676 2.371
244 2HG2 VAL 34 2HG2 VAL 34 3.112 -0.540 3.565
245 3HG2 VAL 34 3HG2 VAL 34 2.897 -2.035 2.675
246 HA PRO 35 HA PRO 35 4.239 2.402 -2.605
247 1HB PRO 35 2HB PRO 35 5.995 0.978 -3.951
248 2HB PRO 35 1HB PRO 35 6.494 2.039 -2.635
249 1HG PRO 35 2HG PRO 35 6.221 -0.933 -2.686
250 2HG PRO 35 1HG PRO 35 7.392 0.060 -1.809
251 1HD PRO 35 2HD PRO 35 5.017 -1.072 -0.785
252 2HD PRO 35 1HD PRO 35 6.073 0.102 0.003
253 H SER 36 H SER 36 2.272 1.940 -3.487
254 HA SER 36 HA SER 36 0.635 0.852 -4.690
255 1HB SER 36 2HB SER 36 1.983 1.782 -6.460
256 2HB SER 36 1HB SER 36 3.121 0.438 -6.364
257 HG SER 36 HG SER 36 1.650 -0.886 -7.281
258 H SER 37 H SER 37 1.855 -0.775 -2.660
259 HA SER 37 HA SER 37 0.838 -3.284 -3.384
260 1HB SER 37 2HB SER 37 3.805 -3.411 -2.905
261 2HB SER 37 1HB SER 37 2.749 -4.614 -3.635
262 HG SER 37 HG SER 37 2.667 -3.413 -5.491
263 H TYR 38 H TYR 38 3.208 -4.233 -1.364
264 HA TYR 38 HA TYR 38 2.602 -2.950 1.077
265 1HB TYR 38 2HB TYR 38 1.523 -5.456 1.628
266 2HB TYR 38 1HB TYR 38 0.631 -3.948 1.542
267 HD1 TYR 38 1HD TYR 38 -1.216 -3.958 0.228
268 HD2 TYR 38 2HD TYR 38 2.033 -6.473 -0.850
269 HE1 TYR 38 1HE TYR 38 -2.548 -4.856 -1.639
270 HE2 TYR 38 2HE TYR 38 0.714 -7.371 -2.740
271 HH TYR 38 HH TYR 38 -1.785 -7.627 -3.274
272 H ILE 39 H ILE 39 4.688 -3.099 1.597
273 HA ILE 39 HA ILE 39 5.942 -5.709 1.448
274 HB ILE 39 HB ILE 39 7.601 -5.007 0.165
275 1HG1 ILE 39 2HG1 ILE 39 8.847 -3.875 1.854
276 2HG1 ILE 39 1HG1 ILE 39 8.827 -2.852 0.440
277 1HG2 ILE 39 1HG2 ILE 39 5.846 -2.590 -0.087
278 2HG2 ILE 39 2HG2 ILE 39 5.781 -4.040 -1.053
279 3HG2 ILE 39 3HG2 ILE 39 7.179 -2.954 -1.177
280 1HD1 ILE 39 1HD1 ILE 39 6.821 -2.375 2.583
281 2HD1 ILE 39 2HD1 ILE 39 7.544 -1.254 1.448
282 3HD1 ILE 39 3HD1 ILE 39 8.479 -1.853 2.814
283 H ALA 40 H ALA 40 4.628 -4.642 3.734
284 HA ALA 40 HA ALA 40 6.364 -3.330 5.482
285 1HB ALA 40 1HB ALA 40 3.937 -3.636 5.766
286 2HB ALA 40 2HB ALA 40 4.889 -3.949 7.220
287 3HB ALA 40 3HB ALA 40 4.250 -5.295 6.274
288 H ALA 41 H ALA 41 8.369 -4.071 5.446
289 HA ALA 41 HA ALA 41 9.396 -5.791 7.249
290 1HB ALA 41 1HB ALA 41 8.315 -7.701 6.323
291 2HB ALA 41 2HB ALA 41 10.011 -7.807 5.851
292 3HB ALA 41 3HB ALA 41 8.804 -7.265 4.685
293 H ASP 42 H ASP 42 9.554 -4.537 3.996
294 HA ASP 42 HA ASP 42 12.043 -3.296 4.347
295 1HB ASP 42 2HB ASP 42 13.408 -4.642 2.761
296 2HB ASP 42 1HB ASP 42 13.007 -5.512 4.237
297 H VAL 43 H VAL 43 11.322 -1.523 3.331
298 HA VAL 43 HA VAL 43 9.588 -1.257 1.231
299 HB VAL 43 HB VAL 43 10.454 0.957 0.871
300 1HG1 VAL 43 1HG1 VAL 43 10.582 0.216 3.787
301 2HG1 VAL 43 2HG1 VAL 43 9.110 0.547 2.875
302 3HG1 VAL 43 3HG1 VAL 43 10.295 1.828 3.131
303 1HG2 VAL 43 1HG2 VAL 43 12.506 1.698 2.055
304 2HG2 VAL 43 2HG2 VAL 43 12.818 0.503 0.796
305 3HG2 VAL 43 3HG2 VAL 43 12.817 0.019 2.491
306 H VAL 44 H VAL 44 9.544 -1.668 -0.874
307 HA VAL 44 HA VAL 44 11.753 -1.349 -2.550
308 HB VAL 44 HB VAL 44 12.391 -3.344 -1.205
309 1HG1 VAL 44 1HG1 VAL 44 10.430 -4.789 -2.971
310 2HG1 VAL 44 2HG1 VAL 44 10.170 -4.434 -1.264
311 3HG1 VAL 44 3HG1 VAL 44 11.489 -5.498 -1.752
312 1HG2 VAL 44 1HG2 VAL 44 13.536 -2.760 -3.260
313 2HG2 VAL 44 2HG2 VAL 44 12.315 -3.613 -4.205
314 3HG2 VAL 44 3HG2 VAL 44 13.387 -4.513 -3.131
315 H SER 45 H SER 45 8.974 -0.793 -2.576
316 HA SER 45 HA SER 45 7.367 -0.487 -4.163
317 1HB SER 45 2HB SER 45 9.072 -0.143 -5.780
318 2HB SER 45 1HB SER 45 9.368 -1.875 -5.923
319 HG SER 45 HG SER 45 6.950 -0.559 -6.611
320 H GLU 46 H GLU 46 7.967 -3.389 -2.858
321 HA GLU 46 HA GLU 46 5.402 -4.405 -3.331
322 1HB GLU 46 2HB GLU 46 6.079 -4.782 -5.615
323 2HB GLU 46 1HB GLU 46 7.533 -5.620 -5.093
324 1HG GLU 46 2HG GLU 46 6.198 -7.426 -4.187
325 2HG GLU 46 1HG GLU 46 4.717 -6.571 -4.615
326 H TYR 47 H TYR 47 4.940 -6.392 -2.356
327 HA TYR 47 HA TYR 47 6.278 -6.933 0.008
328 1HB TYR 47 2HB TYR 47 3.903 -7.608 -0.574
329 2HB TYR 47 1HB TYR 47 4.593 -8.936 -1.507
330 HD1 TYR 47 1HD TYR 47 5.386 -7.522 1.858
331 HD2 TYR 47 2HD TYR 47 4.220 -10.930 -0.405
332 HE1 TYR 47 1HE TYR 47 5.461 -8.895 3.898
333 HE2 TYR 47 2HE TYR 47 4.292 -12.313 1.629
334 HH TYR 47 HH TYR 47 5.379 -12.282 3.842
Start of MODEL 18
1 1H GLY 1 1HT GLY 1 -13.465 -4.671 7.364
2 2H GLY 1 2HT GLY 1 -12.891 -4.115 5.874
3 3H GLY 1 3HT GLY 1 -14.529 -4.488 6.062
4 1HA GLY 1 1HA GLY 1 -14.208 -2.100 6.078
5 2HA GLY 1 2HA GLY 1 -14.813 -2.679 7.624
6 H SER 2 H SER 2 -11.584 -2.513 6.122
7 HA SER 2 HA SER 2 -10.592 -0.468 7.759
8 1HB SER 2 2HB SER 2 -10.868 -2.069 9.591
9 2HB SER 2 1HB SER 2 -9.910 -3.261 8.712
10 HG SER 2 HG SER 2 -8.734 -2.044 10.324
11 H GLY 3 H GLY 3 -10.459 -1.209 5.060
12 1HA GLY 3 2HA GLY 3 -8.511 -0.608 3.716
13 2HA GLY 3 1HA GLY 3 -7.553 -1.643 4.764
14 H GLU 4 H GLU 4 -7.020 -2.330 2.377
15 HA GLU 4 HA GLU 4 -7.184 -3.865 0.710
16 1HB GLU 4 2HB GLU 4 -6.719 -5.716 1.869
17 2HB GLU 4 1HB GLU 4 -7.596 -5.126 3.263
18 1HG GLU 4 2HG GLU 4 -9.665 -6.083 2.352
19 2HG GLU 4 1HG GLU 4 -8.761 -6.700 0.972
20 H VAL 5 H VAL 5 -9.460 -1.992 1.183
21 HA VAL 5 HA VAL 5 -11.694 -3.521 0.048
22 HB VAL 5 HB VAL 5 -11.873 -0.676 0.991
23 1HG1 VAL 5 1HG1 VAL 5 -13.742 -1.552 -0.285
24 2HG1 VAL 5 2HG1 VAL 5 -14.223 -1.318 1.396
25 3HG1 VAL 5 3HG1 VAL 5 -13.869 -2.938 0.797
26 1HG2 VAL 5 1HG2 VAL 5 -11.902 -3.163 2.685
27 2HG2 VAL 5 2HG2 VAL 5 -12.726 -1.684 3.178
28 3HG2 VAL 5 3HG2 VAL 5 -10.982 -1.676 2.920
29 H ASN 6 H ASN 6 -9.258 -1.239 -0.719
30 HA ASN 6 HA ASN 6 -8.800 -0.032 -2.593
31 1HB ASN 6 2HB ASN 6 -9.196 -2.180 -3.702
32 2HB ASN 6 1HB ASN 6 -10.921 -1.847 -3.771
33 1HD2 ASN 6 1HD2 ASN 6 -8.606 -2.233 -5.735
34 2HD2 ASN 6 2HD2 ASN 6 -8.855 -0.967 -6.889
35 H LYS 7 H LYS 7 -9.973 1.604 -1.107
36 HA LYS 7 HA LYS 7 -12.019 2.949 -2.648
37 1HB LYS 7 2HB LYS 7 -13.564 3.048 -0.782
38 2HB LYS 7 1HB LYS 7 -13.165 1.361 -1.079
39 1HG LYS 7 2HG LYS 7 -11.386 1.607 0.725
40 2HG LYS 7 1HG LYS 7 -12.179 3.135 1.131
41 1HD LYS 7 2HD LYS 7 -14.229 2.035 1.652
42 2HD LYS 7 1HD LYS 7 -13.632 0.502 1.019
43 1HE LYS 7 2HE LYS 7 -13.592 0.548 3.468
44 2HE LYS 7 1HE LYS 7 -11.971 0.394 2.792
45 1HZ LYS 7 1HZ LYS 7 -12.065 1.994 4.617
46 2HZ LYS 7 2HZ LYS 7 -13.183 2.927 3.758
47 3HZ LYS 7 3HZ LYS 7 -11.610 2.738 3.167
48 H ILE 8 H ILE 8 -12.596 4.596 -0.221
49 HA ILE 8 HA ILE 8 -10.922 6.703 -0.508
50 HB ILE 8 HB ILE 8 -13.095 6.448 0.748
51 1HG1 ILE 8 2HG1 ILE 8 -11.868 8.571 0.580
52 2HG1 ILE 8 1HG1 ILE 8 -12.668 8.423 2.141
53 1HG2 ILE 8 1HG2 ILE 8 -12.157 4.703 2.323
54 2HG2 ILE 8 2HG2 ILE 8 -13.159 5.968 3.034
55 3HG2 ILE 8 3HG2 ILE 8 -11.405 6.045 3.185
56 1HD1 ILE 8 1HD1 ILE 8 -9.746 8.037 1.553
57 2HD1 ILE 8 2HD1 ILE 8 -10.503 7.688 3.107
58 3HD1 ILE 8 3HD1 ILE 8 -10.495 9.336 2.481
59 H ILE 9 H ILE 9 -8.767 6.378 -0.584
60 HA ILE 9 HA ILE 9 -7.431 5.928 1.925
61 HB ILE 9 HB ILE 9 -7.811 3.663 0.899
62 1HG1 ILE 9 2HG1 ILE 9 -5.726 2.797 1.591
63 2HG1 ILE 9 1HG1 ILE 9 -4.884 4.288 1.213
64 1HG2 ILE 9 1HG2 ILE 9 -7.545 4.097 -1.372
65 2HG2 ILE 9 2HG2 ILE 9 -6.228 3.027 -0.897
66 3HG2 ILE 9 3HG2 ILE 9 -5.926 4.752 -1.127
67 1HD1 ILE 9 1HD1 ILE 9 -5.586 5.304 3.137
68 2HD1 ILE 9 2HD1 ILE 9 -5.496 3.624 3.668
69 3HD1 ILE 9 3HD1 ILE 9 -7.051 4.331 3.241
70 H GLY 10 H GLY 10 -4.877 6.100 1.461
71 1HA GLY 10 2HA GLY 10 -4.514 8.230 -0.529
72 2HA GLY 10 1HA GLY 10 -4.026 8.502 1.137
73 H SER 11 H SER 11 -2.099 8.791 -0.751
74 HA SER 11 HA SER 11 -0.416 6.514 -0.147
75 1HB SER 11 2HB SER 11 0.267 6.316 -2.576
76 2HB SER 11 1HB SER 11 -1.378 5.792 -2.227
77 HG SER 11 HG SER 11 -2.014 7.228 -3.603
78 H ARG 12 H ARG 12 1.116 7.636 0.939
79 HA ARG 12 HA ARG 12 2.961 9.167 -0.666
80 1HB ARG 12 2HB ARG 12 1.328 10.904 -0.020
81 2HB ARG 12 1HB ARG 12 1.622 10.535 1.674
82 1HG ARG 12 2HG ARG 12 3.894 11.286 1.504
83 2HG ARG 12 1HG ARG 12 3.735 11.501 -0.240
84 1HD ARG 12 2HD ARG 12 3.559 13.649 0.810
85 2HD ARG 12 1HD ARG 12 1.972 13.199 0.189
86 HE ARG 12 HE ARG 12 2.019 12.357 2.810
87 1HH1 ARG 12 1HH1 ARG 12 2.367 15.377 1.112
88 2HH1 ARG 12 2HH1 ARG 12 1.728 16.331 2.410
89 1HH2 ARG 12 1HH2 ARG 12 1.173 13.603 4.526
90 2HH2 ARG 12 2HH2 ARG 12 1.047 15.321 4.349
91 H THR 13 H THR 13 4.706 7.786 -0.070
92 HA THR 13 HA THR 13 5.182 7.698 2.820
93 HB THR 13 HB THR 13 6.571 5.688 1.199
94 HG1 THR 13 1HG THR 13 4.710 4.379 1.132
95 1HG2 THR 13 1HG2 THR 13 5.891 4.293 3.171
96 2HG2 THR 13 2HG2 THR 13 5.214 5.763 3.873
97 3HG2 THR 13 3HG2 THR 13 6.942 5.660 3.540
98 H ALA 14 H ALA 14 7.538 6.929 0.260
99 HA ALA 14 HA ALA 14 9.070 9.287 0.998
100 1HB ALA 14 1HB ALA 14 9.691 7.695 2.731
101 2HB ALA 14 2HB ALA 14 11.056 8.038 1.666
102 3HB ALA 14 3HB ALA 14 10.163 6.525 1.499
103 H GLY 15 H GLY 15 9.439 6.135 -0.658
104 1HA GLY 15 2HA GLY 15 9.513 6.237 -3.133
105 2HA GLY 15 1HA GLY 15 10.541 7.650 -2.953
106 H GLU 16 H GLU 16 12.104 6.545 -0.777
107 HA GLU 16 HA GLU 16 14.158 5.317 -2.229
108 1HB GLU 16 2HB GLU 16 14.302 6.509 0.027
109 2HB GLU 16 1HB GLU 16 13.740 5.006 0.744
110 1HG GLU 16 2HG GLU 16 16.100 5.056 0.937
111 2HG GLU 16 1HG GLU 16 15.696 3.864 -0.296
112 H GLY 17 H GLY 17 11.400 4.048 -0.564
113 1HA GLY 17 2HA GLY 17 11.902 1.413 -1.702
114 2HA GLY 17 1HA GLY 17 11.778 1.499 0.051
115 H ALA 18 H ALA 18 9.784 3.465 0.254
116 HA ALA 18 HA ALA 18 7.451 2.247 -1.049
117 1HB ALA 18 1HB ALA 18 7.523 1.340 1.177
118 2HB ALA 18 2HB ALA 18 6.247 2.561 1.117
119 3HB ALA 18 3HB ALA 18 7.799 2.948 1.860
120 H MET 19 H MET 19 5.681 3.732 -1.388
121 HA MET 19 HA MET 19 5.966 6.459 -0.557
122 1HB MET 19 2HB MET 19 7.469 5.861 -2.724
123 2HB MET 19 1HB MET 19 5.969 6.357 -3.499
124 1HG MET 19 2HG MET 19 6.038 8.476 -2.357
125 2HG MET 19 1HG MET 19 7.469 7.970 -1.468
126 1HE MET 19 1HE MET 19 6.000 8.896 -4.989
127 2HE MET 19 2HE MET 19 6.645 7.274 -5.248
128 3HE MET 19 3HE MET 19 7.404 8.661 -6.031
129 H GLU 20 H GLU 20 3.893 4.345 -0.624
130 HA GLU 20 HA GLU 20 1.756 6.087 -1.459
131 1HB GLU 20 2HB GLU 20 1.909 3.296 -2.566
132 2HB GLU 20 1HB GLU 20 0.625 4.443 -2.852
133 1HG GLU 20 2HG GLU 20 2.499 5.901 -3.871
134 2HG GLU 20 1HG GLU 20 3.416 4.389 -3.924
135 H TYR 21 H TYR 21 -0.447 4.690 -0.959
136 HA TYR 21 HA TYR 21 -0.131 2.897 1.242
137 1HB TYR 21 2HB TYR 21 0.252 4.704 2.576
138 2HB TYR 21 1HB TYR 21 -0.720 5.771 1.600
139 HD1 TYR 21 1HD TYR 21 -2.328 6.738 2.770
140 HD2 TYR 21 2HD TYR 21 -1.490 2.636 3.570
141 HE1 TYR 21 1HE TYR 21 -4.083 6.727 4.446
142 HE2 TYR 21 2HE TYR 21 -3.259 2.621 5.282
143 HH TYR 21 HH TYR 21 -4.470 4.195 6.709
144 H LEU 22 H LEU 22 -1.800 3.567 -1.346
145 HA LEU 22 HA LEU 22 -4.390 3.243 -0.320
146 1HB LEU 22 2HB LEU 22 -5.181 3.709 -2.510
147 2HB LEU 22 1HB LEU 22 -3.763 4.706 -2.308
148 HG LEU 22 HG LEU 22 -3.813 2.075 -3.790
149 1HD1 LEU 22 1HD1 LEU 22 -3.815 4.819 -5.003
150 2HD1 LEU 22 2HD1 LEU 22 -5.285 3.882 -4.746
151 3HD1 LEU 22 3HD1 LEU 22 -4.022 3.267 -5.813
152 1HD2 LEU 22 1HD2 LEU 22 -1.750 3.128 -4.857
153 2HD2 LEU 22 2HD2 LEU 22 -1.578 2.496 -3.224
154 3HD2 LEU 22 3HD2 LEU 22 -1.750 4.236 -3.488
155 H ILE 23 H ILE 23 -5.387 1.674 0.177
156 HA ILE 23 HA ILE 23 -4.908 -0.952 -0.256
157 HB ILE 23 HB ILE 23 -7.236 -1.306 0.419
158 1HG1 ILE 23 2HG1 ILE 23 -7.353 1.687 0.005
159 2HG1 ILE 23 1HG1 ILE 23 -8.397 0.463 -0.708
160 1HG2 ILE 23 1HG2 ILE 23 -6.966 -0.375 2.599
161 2HG2 ILE 23 2HG2 ILE 23 -5.923 0.907 1.989
162 3HG2 ILE 23 3HG2 ILE 23 -5.355 -0.764 1.997
163 1HD1 ILE 23 1HD1 ILE 23 -8.279 1.114 2.222
164 2HD1 ILE 23 2HD1 ILE 23 -9.417 0.030 1.420
165 3HD1 ILE 23 3HD1 ILE 23 -9.473 1.764 1.095
166 H GLU 24 H GLU 24 -6.101 1.370 -2.452
167 HA GLU 24 HA GLU 24 -7.714 0.217 -4.215
168 1HB GLU 24 2HB GLU 24 -6.500 2.429 -4.397
169 2HB GLU 24 1HB GLU 24 -5.147 1.540 -5.084
170 1HG GLU 24 2HG GLU 24 -6.348 2.431 -6.900
171 2HG GLU 24 1HG GLU 24 -6.725 0.710 -6.853
172 H TRP 25 H TRP 25 -4.419 -0.796 -3.573
173 HA TRP 25 HA TRP 25 -4.012 -2.447 -5.771
174 1HB TRP 25 2HB TRP 25 -2.625 -3.828 -3.979
175 2HB TRP 25 1HB TRP 25 -2.093 -2.250 -4.516
176 HD1 TRP 25 HD TRP 25 -4.407 -3.479 -1.610
177 HE1 TRP 25 1HE TRP 25 -3.659 -2.217 0.529
178 HE3 TRP 25 3HE TRP 25 -0.654 -0.559 -3.553
179 HZ2 TRP 25 2HZ TRP 25 -1.859 -0.294 1.253
180 HZ3 TRP 25 3HZ TRP 25 0.543 0.969 -1.988
181 HH2 TRP 25 HH TRP 25 -0.057 1.106 0.320
182 H LYS 26 H LYS 26 -3.730 -5.118 -4.629
183 HA LYS 26 HA LYS 26 -6.590 -5.769 -4.533
184 1HB LYS 26 2HB LYS 26 -4.253 -7.403 -5.525
185 2HB LYS 26 1HB LYS 26 -5.894 -8.018 -5.377
186 1HG LYS 26 2HG LYS 26 -6.646 -6.265 -6.951
187 2HG LYS 26 1HG LYS 26 -4.964 -5.775 -7.157
188 1HD LYS 26 2HD LYS 26 -4.419 -8.019 -7.982
189 2HD LYS 26 1HD LYS 26 -6.106 -8.497 -7.783
190 1HE LYS 26 2HE LYS 26 -6.768 -6.758 -9.391
191 2HE LYS 26 1HE LYS 26 -5.070 -6.333 -9.612
192 1HZ LYS 26 1HZ LYS 26 -6.325 -8.945 -10.265
193 2HZ LYS 26 2HZ LYS 26 -4.676 -8.601 -10.413
194 3HZ LYS 26 3HZ LYS 26 -5.800 -7.780 -11.373
195 H ASP 27 H ASP 27 -5.461 -5.013 -2.161
196 HA ASP 27 HA ASP 27 -4.910 -5.699 -0.035
197 1HB ASP 27 2HB ASP 27 -6.489 -7.363 0.848
198 2HB ASP 27 1HB ASP 27 -7.301 -6.184 -0.176
199 H GLY 28 H GLY 28 -3.199 -6.867 -2.142
200 1HA GLY 28 2HA GLY 28 -2.710 -9.581 -1.808
201 2HA GLY 28 1HA GLY 28 -1.484 -8.413 -2.255
202 H HIS 29 H HIS 29 -1.100 -6.872 -0.064
203 HA HIS 29 HA HIS 29 -0.747 -8.768 2.124
204 1HB HIS 29 2HB HIS 29 1.492 -7.008 1.059
205 2HB HIS 29 1HB HIS 29 1.547 -7.933 2.556
206 HD1 HIS 29 1HD HIS 29 1.912 -8.280 -1.115
207 HD2 HIS 29 2HD HIS 29 1.716 -10.748 2.221
208 HE1 HIS 29 1HE HIS 29 2.703 -10.533 -1.899
209 HE2 HIS 29 2HE HIS 29 2.565 -12.016 0.133
210 H SER 30 H SER 30 -2.331 -7.809 3.225
211 HA SER 30 HA SER 30 -3.401 -6.320 4.562
212 1HB SER 30 2HB SER 30 -0.556 -5.621 5.245
213 2HB SER 30 1HB SER 30 -1.974 -5.415 6.287
214 HG SER 30 HG SER 30 -0.854 -7.854 5.361
215 HA PRO 31 HA PRO 31 -3.951 -2.129 2.490
216 1HB PRO 31 2HB PRO 31 -4.962 -1.606 5.206
217 2HB PRO 31 1HB PRO 31 -5.846 -1.589 3.690
218 1HG PRO 31 2HG PRO 31 -5.636 -3.726 5.680
219 2HG PRO 31 1HG PRO 31 -6.808 -3.540 4.376
220 1HD PRO 31 2HD PRO 31 -4.980 -5.476 4.293
221 2HD PRO 31 1HD PRO 31 -5.420 -4.608 2.803
222 H SER 32 H SER 32 -1.854 -1.488 2.445
223 HA SER 32 HA SER 32 -0.526 -0.804 4.969
224 1HB SER 32 2HB SER 32 0.786 -2.018 2.590
225 2HB SER 32 1HB SER 32 1.601 -1.434 4.043
226 HG SER 32 HG SER 32 0.769 -3.042 5.215
227 H TRP 33 H TRP 33 0.965 0.877 5.039
228 HA TRP 33 HA TRP 33 0.477 2.841 2.941
229 1HB TRP 33 2HB TRP 33 0.456 3.417 5.405
230 2HB TRP 33 1HB TRP 33 2.173 3.029 5.466
231 HD1 TRP 33 HD TRP 33 3.671 4.611 3.574
232 HE1 TRP 33 1HE TRP 33 3.441 7.141 3.215
233 HE3 TRP 33 3HE TRP 33 -0.955 5.328 5.616
234 HZ2 TRP 33 2HZ TRP 33 1.551 9.185 3.706
235 HZ3 TRP 33 3HZ TRP 33 -1.906 7.597 5.623
236 HH2 TRP 33 HH TRP 33 -0.679 9.484 4.675
237 H VAL 34 H VAL 34 1.518 1.934 1.238
238 HA VAL 34 HA VAL 34 4.400 1.914 1.270
239 HB VAL 34 HB VAL 34 3.387 -0.682 0.294
240 1HG1 VAL 34 1HG1 VAL 34 5.765 0.485 1.381
241 2HG1 VAL 34 2HG1 VAL 34 5.571 -1.142 0.747
242 3HG1 VAL 34 3HG1 VAL 34 5.296 -0.831 2.450
243 1HG2 VAL 34 1HG2 VAL 34 2.988 -1.697 2.417
244 2HG2 VAL 34 2HG2 VAL 34 1.865 -0.357 2.165
245 3HG2 VAL 34 3HG2 VAL 34 3.253 -0.164 3.238
246 HA PRO 35 HA PRO 35 3.879 2.754 -3.014
247 1HB PRO 35 2HB PRO 35 5.862 1.640 -4.321
248 2HB PRO 35 1HB PRO 35 6.194 2.718 -2.957
249 1HG PRO 35 2HG PRO 35 6.171 -0.273 -3.042
250 2HG PRO 35 1HG PRO 35 7.356 0.806 -2.296
251 1HD PRO 35 2HD PRO 35 5.269 -0.427 -0.972
252 2HD PRO 35 1HD PRO 35 6.109 1.015 -0.403
253 H SER 36 H SER 36 2.100 2.129 -3.993
254 HA SER 36 HA SER 36 0.679 1.070 -5.394
255 1HB SER 36 2HB SER 36 2.443 1.605 -6.985
256 2HB SER 36 1HB SER 36 3.284 0.107 -6.587
257 HG SER 36 HG SER 36 0.714 0.346 -7.769
258 H SER 37 H SER 37 1.756 -0.510 -2.983
259 HA SER 37 HA SER 37 0.208 -2.772 -3.471
260 1HB SER 37 2HB SER 37 2.160 -3.356 -4.928
261 2HB SER 37 1HB SER 37 3.163 -3.416 -3.484
262 HG SER 37 HG SER 37 2.105 -5.440 -4.323
263 H TYR 38 H TYR 38 3.011 -3.649 -1.691
264 HA TYR 38 HA TYR 38 2.457 -2.530 0.809
265 1HB TYR 38 2HB TYR 38 1.750 -5.118 1.433
266 2HB TYR 38 1HB TYR 38 0.663 -3.748 1.421
267 HD1 TYR 38 1HD TYR 38 -1.191 -3.779 0.031
268 HD2 TYR 38 2HD TYR 38 2.052 -6.383 -0.810
269 HE1 TYR 38 1HE TYR 38 -2.551 -4.897 -1.691
270 HE2 TYR 38 2HE TYR 38 0.703 -7.494 -2.555
271 HH TYR 38 HH TYR 38 -1.635 -7.857 -3.102
272 H ILE 39 H ILE 39 4.456 -2.660 1.630
273 HA ILE 39 HA ILE 39 5.999 -5.073 1.198
274 HB ILE 39 HB ILE 39 7.603 -4.222 -0.125
275 1HG1 ILE 39 2HG1 ILE 39 7.289 -1.649 1.405
276 2HG1 ILE 39 1HG1 ILE 39 8.713 -2.652 1.213
277 1HG2 ILE 39 1HG2 ILE 39 5.340 -2.311 -0.641
278 2HG2 ILE 39 2HG2 ILE 39 5.622 -3.861 -1.402
279 3HG2 ILE 39 3HG2 ILE 39 6.715 -2.516 -1.722
280 1HD1 ILE 39 1HD1 ILE 39 7.574 -0.631 -0.663
281 2HD1 ILE 39 2HD1 ILE 39 8.629 -1.912 -1.251
282 3HD1 ILE 39 3HD1 ILE 39 9.214 -0.779 -0.035
283 H ALA 40 H ALA 40 4.737 -3.925 3.468
284 HA ALA 40 HA ALA 40 6.509 -2.484 5.097
285 1HB ALA 40 1HB ALA 40 4.074 -2.818 5.451
286 2HB ALA 40 2HB ALA 40 5.060 -3.065 6.895
287 3HB ALA 40 3HB ALA 40 4.430 -4.453 6.006
288 H ALA 41 H ALA 41 8.546 -3.336 4.897
289 HA ALA 41 HA ALA 41 9.678 -4.859 6.780
290 1HB ALA 41 1HB ALA 41 8.633 -6.688 4.630
291 2HB ALA 41 2HB ALA 41 8.426 -6.816 6.377
292 3HB ALA 41 3HB ALA 41 10.002 -7.122 5.652
293 H ASP 42 H ASP 42 10.345 -2.777 5.011
294 HA ASP 42 HA ASP 42 12.037 -1.961 3.739
295 1HB ASP 42 2HB ASP 42 13.394 -2.854 5.567
296 2HB ASP 42 1HB ASP 42 13.461 -4.423 4.769
297 H VAL 43 H VAL 43 10.908 -2.268 1.751
298 HA VAL 43 HA VAL 43 12.343 -4.014 -0.069
299 HB VAL 43 HB VAL 43 9.434 -4.266 -0.452
300 1HG1 VAL 43 1HG1 VAL 43 11.887 -5.674 -1.105
301 2HG1 VAL 43 2HG1 VAL 43 10.336 -5.646 -1.947
302 3HG1 VAL 43 3HG1 VAL 43 10.587 -6.753 -0.598
303 1HG2 VAL 43 1HG2 VAL 43 9.520 -4.588 1.966
304 2HG2 VAL 43 2HG2 VAL 43 10.800 -5.784 1.768
305 3HG2 VAL 43 3HG2 VAL 43 9.183 -6.113 1.144
306 H VAL 44 H VAL 44 10.426 -3.730 -2.244
307 HA VAL 44 HA VAL 44 9.894 -0.909 -2.467
308 HB VAL 44 HB VAL 44 12.244 -0.867 -2.953
309 1HG1 VAL 44 1HG1 VAL 44 12.542 -3.189 -3.640
310 2HG1 VAL 44 2HG1 VAL 44 13.204 -2.086 -4.847
311 3HG1 VAL 44 3HG1 VAL 44 11.651 -2.873 -5.129
312 1HG2 VAL 44 1HG2 VAL 44 10.856 0.676 -4.201
313 2HG2 VAL 44 2HG2 VAL 44 10.574 -0.543 -5.445
314 3HG2 VAL 44 3HG2 VAL 44 12.192 0.120 -5.212
315 H SER 45 H SER 45 8.057 -0.744 -3.410
316 HA SER 45 HA SER 45 6.343 -0.867 -4.854
317 1HB SER 45 2HB SER 45 6.732 -1.409 -7.143
318 2HB SER 45 1HB SER 45 8.187 -0.617 -6.544
319 HG SER 45 HG SER 45 8.218 -2.787 -7.801
320 H GLU 46 H GLU 46 7.394 -3.435 -3.253
321 HA GLU 46 HA GLU 46 5.012 -4.866 -3.436
322 1HB GLU 46 2HB GLU 46 5.886 -5.404 -5.721
323 2HB GLU 46 1HB GLU 46 7.242 -6.221 -4.966
324 1HG GLU 46 2HG GLU 46 5.704 -7.781 -3.890
325 2HG GLU 46 1HG GLU 46 4.343 -6.961 -4.654
326 H TYR 47 H TYR 47 4.950 -6.755 -2.141
327 HA TYR 47 HA TYR 47 6.613 -6.638 0.119
328 1HB TYR 47 2HB TYR 47 4.301 -7.483 0.179
329 2HB TYR 47 1HB TYR 47 4.791 -8.879 -0.776
330 HD1 TYR 47 1HD TYR 47 5.942 -7.145 2.336
331 HD2 TYR 47 2HD TYR 47 5.052 -10.830 0.405
332 HE1 TYR 47 1HE TYR 47 6.503 -8.355 4.402
333 HE2 TYR 47 2HE TYR 47 5.610 -12.051 2.468
334 HH TYR 47 HH TYR 47 6.953 -11.714 4.503
Start of MODEL 19
1 1H GLY 1 1HT GLY 1 -12.201 -0.763 10.391
2 2H GLY 1 2HT GLY 1 -12.235 -2.166 11.333
3 3H GLY 1 3HT GLY 1 -12.972 -2.152 9.810
4 1HA GLY 1 1HA GLY 1 -10.063 -1.899 10.344
5 2HA GLY 1 2HA GLY 1 -10.869 -3.330 9.721
6 H SER 2 H SER 2 -9.496 -0.281 8.973
7 HA SER 2 HA SER 2 -10.604 -0.093 6.323
8 1HB SER 2 2HB SER 2 -9.039 1.797 6.050
9 2HB SER 2 1HB SER 2 -9.973 1.940 7.540
10 HG SER 2 HG SER 2 -7.701 2.354 7.800
11 H GLY 3 H GLY 3 -9.428 -0.301 4.360
12 1HA GLY 3 2HA GLY 3 -7.428 -0.909 3.163
13 2HA GLY 3 1HA GLY 3 -6.938 -1.862 4.557
14 H GLU 4 H GLU 4 -7.109 -2.693 1.780
15 HA GLU 4 HA GLU 4 -7.772 -4.509 0.586
16 1HB GLU 4 2HB GLU 4 -7.214 -5.924 2.302
17 2HB GLU 4 1HB GLU 4 -8.486 -5.327 3.363
18 1HG GLU 4 2HG GLU 4 -9.229 -6.803 0.880
19 2HG GLU 4 1HG GLU 4 -8.641 -7.697 2.280
20 H VAL 5 H VAL 5 -9.779 -2.205 1.459
21 HA VAL 5 HA VAL 5 -12.298 -3.463 0.690
22 HB VAL 5 HB VAL 5 -11.818 -0.531 1.146
23 1HG1 VAL 5 1HG1 VAL 5 -14.272 -2.267 1.405
24 2HG1 VAL 5 2HG1 VAL 5 -13.935 -1.101 0.125
25 3HG1 VAL 5 3HG1 VAL 5 -14.202 -0.544 1.777
26 1HG2 VAL 5 1HG2 VAL 5 -10.967 -1.748 3.101
27 2HG2 VAL 5 2HG2 VAL 5 -12.517 -2.576 3.258
28 3HG2 VAL 5 3HG2 VAL 5 -12.421 -0.831 3.492
29 H ASN 6 H ASN 6 -9.902 -1.224 -0.361
30 HA ASN 6 HA ASN 6 -9.227 -0.438 -2.343
31 1HB ASN 6 2HB ASN 6 -11.092 -1.896 -4.073
32 2HB ASN 6 1HB ASN 6 -9.339 -1.747 -4.116
33 1HD2 ASN 6 1HD2 ASN 6 -8.083 -3.298 -3.283
34 2HD2 ASN 6 2HD2 ASN 6 -8.680 -4.760 -2.584
35 H LYS 7 H LYS 7 -10.015 1.592 -1.872
36 HA LYS 7 HA LYS 7 -12.153 2.497 -3.590
37 1HB LYS 7 2HB LYS 7 -13.309 3.642 -1.747
38 2HB LYS 7 1HB LYS 7 -13.272 1.908 -1.467
39 1HG LYS 7 2HG LYS 7 -11.322 2.236 0.036
40 2HG LYS 7 1HG LYS 7 -11.518 3.981 -0.169
41 1HD LYS 7 2HD LYS 7 -13.613 2.108 0.931
42 2HD LYS 7 1HD LYS 7 -12.575 3.160 1.896
43 1HE LYS 7 2HE LYS 7 -13.524 5.119 0.805
44 2HE LYS 7 1HE LYS 7 -14.533 4.083 -0.203
45 1HZ LYS 7 1HZ LYS 7 -15.743 5.001 1.696
46 2HZ LYS 7 2HZ LYS 7 -14.674 4.235 2.760
47 3HZ LYS 7 3HZ LYS 7 -15.677 3.311 1.760
48 H ILE 8 H ILE 8 -12.057 5.069 -1.922
49 HA ILE 8 HA ILE 8 -10.107 6.434 -3.329
50 HB ILE 8 HB ILE 8 -12.080 7.275 -1.955
51 1HG1 ILE 8 2HG1 ILE 8 -10.497 8.724 -3.192
52 2HG1 ILE 8 1HG1 ILE 8 -11.106 9.496 -1.731
53 1HG2 ILE 8 1HG2 ILE 8 -11.406 6.294 0.188
54 2HG2 ILE 8 2HG2 ILE 8 -11.667 8.034 0.300
55 3HG2 ILE 8 3HG2 ILE 8 -10.027 7.391 0.240
56 1HD1 ILE 8 1HD1 ILE 8 -9.017 8.887 -0.579
57 2HD1 ILE 8 2HD1 ILE 8 -8.757 9.934 -1.974
58 3HD1 ILE 8 3HD1 ILE 8 -8.411 8.209 -2.090
59 H ILE 9 H ILE 9 -7.927 6.245 -3.241
60 HA ILE 9 HA ILE 9 -6.772 5.278 -0.741
61 HB ILE 9 HB ILE 9 -4.851 4.493 -2.065
62 1HG1 ILE 9 2HG1 ILE 9 -6.488 5.150 -4.509
63 2HG1 ILE 9 1HG1 ILE 9 -5.227 6.217 -3.899
64 1HG2 ILE 9 1HG2 ILE 9 -7.106 3.278 -3.508
65 2HG2 ILE 9 2HG2 ILE 9 -7.217 3.270 -1.749
66 3HG2 ILE 9 3HG2 ILE 9 -5.827 2.533 -2.549
67 1HD1 ILE 9 1HD1 ILE 9 -4.692 3.346 -4.568
68 2HD1 ILE 9 2HD1 ILE 9 -3.540 4.666 -4.367
69 3HD1 ILE 9 3HD1 ILE 9 -4.604 4.632 -5.773
70 H GLY 10 H GLY 10 -5.261 6.330 0.335
71 1HA GLY 10 2HA GLY 10 -4.145 8.806 -0.780
72 2HA GLY 10 1HA GLY 10 -4.180 8.361 0.935
73 H SER 11 H SER 11 -1.777 9.018 -0.762
74 HA SER 11 HA SER 11 -0.298 6.639 -0.131
75 1HB SER 11 2HB SER 11 0.559 6.750 -2.677
76 2HB SER 11 1HB SER 11 -0.797 5.743 -2.168
77 HG SER 11 HG SER 11 -0.788 8.180 -3.556
78 H ARG 12 H ARG 12 1.248 7.589 1.040
79 HA ARG 12 HA ARG 12 3.203 9.191 -0.368
80 1HB ARG 12 2HB ARG 12 1.751 10.320 2.031
81 2HB ARG 12 1HB ARG 12 3.199 11.015 1.316
82 1HG ARG 12 2HG ARG 12 1.974 11.359 -0.787
83 2HG ARG 12 1HG ARG 12 0.519 10.714 -0.024
84 1HD ARG 12 2HD ARG 12 0.480 13.141 -0.004
85 2HD ARG 12 1HD ARG 12 0.605 12.515 1.639
86 HE ARG 12 HE ARG 12 3.173 13.065 0.577
87 1HH1 ARG 12 1HH1 ARG 12 0.339 14.619 1.874
88 2HH1 ARG 12 2HH1 ARG 12 1.204 16.005 2.448
89 1HH2 ARG 12 1HH2 ARG 12 4.322 14.884 1.331
90 2HH2 ARG 12 2HH2 ARG 12 3.469 16.156 2.139
91 H THR 13 H THR 13 4.904 7.772 0.105
92 HA THR 13 HA THR 13 5.348 7.362 2.969
93 HB THR 13 HB THR 13 6.638 5.335 1.351
94 HG1 THR 13 1HG THR 13 4.660 4.212 0.973
95 1HG2 THR 13 1HG2 THR 13 6.638 5.070 3.689
96 2HG2 THR 13 2HG2 THR 13 5.462 3.902 3.085
97 3HG2 THR 13 3HG2 THR 13 4.914 5.416 3.802
98 H ALA 14 H ALA 14 7.497 6.620 0.236
99 HA ALA 14 HA ALA 14 9.281 8.752 1.103
100 1HB ALA 14 1HB ALA 14 9.888 6.944 2.601
101 2HB ALA 14 2HB ALA 14 11.191 7.263 1.457
102 3HB ALA 14 3HB ALA 14 10.139 5.867 1.228
103 H GLY 15 H GLY 15 9.309 5.783 -0.894
104 1HA GLY 15 2HA GLY 15 9.209 6.142 -3.350
105 2HA GLY 15 1HA GLY 15 10.338 7.465 -3.105
106 H GLU 16 H GLU 16 12.096 6.263 -1.315
107 HA GLU 16 HA GLU 16 13.843 4.914 -3.032
108 1HB GLU 16 2HB GLU 16 14.736 6.040 -1.132
109 2HB GLU 16 1HB GLU 16 13.708 5.137 -0.029
110 1HG GLU 16 2HG GLU 16 16.040 4.406 0.063
111 2HG GLU 16 1HG GLU 16 14.961 3.115 -0.464
112 H GLY 17 H GLY 17 11.403 3.773 -0.809
113 1HA GLY 17 2HA GLY 17 11.728 1.064 -1.909
114 2HA GLY 17 1HA GLY 17 11.632 1.291 -0.166
115 H ALA 18 H ALA 18 9.698 3.164 0.121
116 HA ALA 18 HA ALA 18 7.351 2.078 -1.247
117 1HB ALA 18 1HB ALA 18 7.580 2.659 1.700
118 2HB ALA 18 2HB ALA 18 7.467 1.056 0.967
119 3HB ALA 18 3HB ALA 18 6.102 2.172 0.871
120 H MET 19 H MET 19 5.604 3.604 -1.536
121 HA MET 19 HA MET 19 5.872 6.251 -0.489
122 1HB MET 19 2HB MET 19 7.438 5.820 -2.661
123 2HB MET 19 1HB MET 19 5.976 6.448 -3.411
124 1HG MET 19 2HG MET 19 6.856 7.941 -1.060
125 2HG MET 19 1HG MET 19 7.996 7.952 -2.399
126 1HE MET 19 1HE MET 19 5.880 9.473 -5.300
127 2HE MET 19 2HE MET 19 6.047 7.756 -4.932
128 3HE MET 19 3HE MET 19 7.445 8.825 -4.808
129 H GLU 20 H GLU 20 3.793 4.211 -0.737
130 HA GLU 20 HA GLU 20 1.723 6.045 -1.477
131 1HB GLU 20 2HB GLU 20 1.514 3.302 -2.626
132 2HB GLU 20 1HB GLU 20 0.568 4.701 -3.030
133 1HG GLU 20 2HG GLU 20 2.701 5.699 -3.961
134 2HG GLU 20 1HG GLU 20 3.401 4.085 -3.796
135 H TYR 21 H TYR 21 -0.549 4.330 -1.074
136 HA TYR 21 HA TYR 21 0.095 3.032 1.332
137 1HB TYR 21 2HB TYR 21 0.154 4.865 2.488
138 2HB TYR 21 1HB TYR 21 -0.838 5.741 1.370
139 HD1 TYR 21 1HD TYR 21 -2.221 6.877 2.765
140 HD2 TYR 21 2HD TYR 21 -1.880 2.649 3.280
141 HE1 TYR 21 1HE TYR 21 -4.070 6.933 4.343
142 HE2 TYR 21 2HE TYR 21 -3.735 2.715 4.892
143 HH TYR 21 HH TYR 21 -4.820 4.372 6.410
144 H LEU 22 H LEU 22 -2.780 4.293 -0.137
145 HA LEU 22 HA LEU 22 -4.174 2.293 1.360
146 1HB LEU 22 2HB LEU 22 -5.033 4.611 -0.186
147 2HB LEU 22 1HB LEU 22 -6.159 3.277 -0.148
148 HG LEU 22 HG LEU 22 -5.102 4.844 2.205
149 1HD1 LEU 22 1HD1 LEU 22 -6.952 5.916 1.102
150 2HD1 LEU 22 2HD1 LEU 22 -7.522 5.212 2.612
151 3HD1 LEU 22 3HD1 LEU 22 -7.863 4.410 1.080
152 1HD2 LEU 22 1HD2 LEU 22 -5.106 2.635 3.010
153 2HD2 LEU 22 2HD2 LEU 22 -6.577 2.228 2.129
154 3HD2 LEU 22 3HD2 LEU 22 -6.651 3.309 3.520
155 H ILE 23 H ILE 23 -5.521 0.861 0.776
156 HA ILE 23 HA ILE 23 -4.907 -1.286 -0.355
157 HB ILE 23 HB ILE 23 -6.965 -1.079 0.627
158 1HG1 ILE 23 2HG1 ILE 23 -8.461 -2.315 -0.780
159 2HG1 ILE 23 1HG1 ILE 23 -7.618 -1.812 -2.226
160 1HG2 ILE 23 1HG2 ILE 23 -7.371 1.222 0.006
161 2HG2 ILE 23 2HG2 ILE 23 -8.809 0.229 -0.140
162 3HG2 ILE 23 3HG2 ILE 23 -7.931 0.716 -1.578
163 1HD1 ILE 23 1HD1 ILE 23 -7.131 -4.115 -1.426
164 2HD1 ILE 23 2HD1 ILE 23 -6.347 -3.391 -0.025
165 3HD1 ILE 23 3HD1 ILE 23 -5.715 -3.095 -1.634
166 H GLU 24 H GLU 24 -7.097 -0.213 -2.835
167 HA GLU 24 HA GLU 24 -6.910 -0.624 -5.071
168 1HB GLU 24 2HB GLU 24 -4.915 1.420 -4.299
169 2HB GLU 24 1HB GLU 24 -4.773 0.760 -5.923
170 1HG GLU 24 2HG GLU 24 -7.337 1.857 -4.815
171 2HG GLU 24 1HG GLU 24 -6.169 2.838 -5.701
172 H TRP 25 H TRP 25 -5.528 -2.594 -3.352
173 HA TRP 25 HA TRP 25 -3.828 -3.697 -5.421
174 1HB TRP 25 2HB TRP 25 -2.340 -4.653 -3.504
175 2HB TRP 25 1HB TRP 25 -2.041 -3.061 -4.159
176 HD1 TRP 25 HD TRP 25 -4.119 -4.360 -1.017
177 HE1 TRP 25 1HE TRP 25 -3.397 -2.829 0.988
178 HE3 TRP 25 3HE TRP 25 -0.789 -1.203 -3.366
179 HZ2 TRP 25 2HZ TRP 25 -1.818 -0.715 1.458
180 HZ3 TRP 25 3HZ TRP 25 0.301 0.522 -1.975
181 HH2 TRP 25 HH TRP 25 -0.237 0.804 0.337
182 H LYS 26 H LYS 26 -6.539 -4.188 -4.486
183 HA LYS 26 HA LYS 26 -7.937 -5.904 -3.927
184 1HB LYS 26 2HB LYS 26 -5.837 -7.317 -5.566
185 2HB LYS 26 1HB LYS 26 -7.391 -8.021 -5.140
186 1HG LYS 26 2HG LYS 26 -6.965 -5.531 -6.780
187 2HG LYS 26 1HG LYS 26 -7.428 -7.120 -7.392
188 1HD LYS 26 2HD LYS 26 -9.500 -7.018 -6.102
189 2HD LYS 26 1HD LYS 26 -9.032 -5.442 -5.463
190 1HE LYS 26 2HE LYS 26 -9.052 -4.518 -7.726
191 2HE LYS 26 1HE LYS 26 -9.509 -6.095 -8.369
192 1HZ LYS 26 1HZ LYS 26 -11.415 -4.609 -8.116
193 2HZ LYS 26 2HZ LYS 26 -11.127 -4.502 -6.454
194 3HZ LYS 26 3HZ LYS 26 -11.568 -5.983 -7.141
195 H ASP 27 H ASP 27 -5.845 -5.390 -1.931
196 HA ASP 27 HA ASP 27 -5.143 -6.297 0.037
197 1HB ASP 27 2HB ASP 27 -7.448 -7.118 0.218
198 2HB ASP 27 1HB ASP 27 -7.026 -8.545 -0.720
199 H GLY 28 H GLY 28 -3.677 -6.752 -2.399
200 1HA GLY 28 2HA GLY 28 -2.753 -9.270 -2.928
201 2HA GLY 28 1HA GLY 28 -1.716 -7.848 -2.941
202 H HIS 29 H HIS 29 -1.149 -7.088 -0.604
203 HA HIS 29 HA HIS 29 -0.716 -9.436 1.091
204 1HB HIS 29 2HB HIS 29 1.566 -7.520 1.122
205 2HB HIS 29 1HB HIS 29 1.540 -9.278 1.208
206 HD1 HIS 29 1HD HIS 29 1.029 -6.624 -1.478
207 HD2 HIS 29 2HD HIS 29 2.454 -10.498 -1.010
208 HE1 HIS 29 1HE HIS 29 1.931 -7.283 -3.729
209 HE2 HIS 29 2HE HIS 29 2.863 -9.601 -3.400
210 H SER 30 H SER 30 -1.892 -8.991 2.790
211 HA SER 30 HA SER 30 -2.954 -7.771 4.463
212 1HB SER 30 2HB SER 30 -0.036 -7.070 4.756
213 2HB SER 30 1HB SER 30 -1.246 -7.003 6.056
214 HG SER 30 HG SER 30 -0.831 -9.035 6.369
215 HA PRO 31 HA PRO 31 -3.767 -3.531 2.644
216 1HB PRO 31 2HB PRO 31 -4.989 -3.209 5.287
217 2HB PRO 31 1HB PRO 31 -5.736 -3.102 3.692
218 1HG PRO 31 2HG PRO 31 -5.628 -5.377 5.529
219 2HG PRO 31 1HG PRO 31 -6.647 -5.143 4.100
220 1HD PRO 31 2HD PRO 31 -4.676 -6.982 4.149
221 2HD PRO 31 1HD PRO 31 -5.071 -6.077 2.663
222 H SER 32 H SER 32 -2.177 -2.025 2.747
223 HA SER 32 HA SER 32 -0.921 -1.460 5.335
224 1HB SER 32 2HB SER 32 0.322 -3.215 4.190
225 2HB SER 32 1HB SER 32 0.643 -2.105 2.855
226 HG SER 32 HG SER 32 2.384 -1.914 4.163
227 H TRP 33 H TRP 33 1.185 0.027 4.583
228 HA TRP 33 HA TRP 33 0.147 2.232 2.916
229 1HB TRP 33 2HB TRP 33 0.279 2.835 5.357
230 2HB TRP 33 1HB TRP 33 1.982 2.398 5.347
231 HD1 TRP 33 HD TRP 33 3.409 3.929 3.307
232 HE1 TRP 33 1HE TRP 33 3.269 6.477 2.985
233 HE3 TRP 33 3HE TRP 33 -0.992 4.842 5.772
234 HZ2 TRP 33 2HZ TRP 33 1.522 8.595 3.672
235 HZ3 TRP 33 3HZ TRP 33 -1.819 7.160 5.883
236 HH2 TRP 33 HH TRP 33 -0.586 8.993 4.836
237 H VAL 34 H VAL 34 1.149 1.513 1.088
238 HA VAL 34 HA VAL 34 3.970 1.875 0.837
239 HB VAL 34 HB VAL 34 3.018 -0.680 1.494
240 1HG1 VAL 34 1HG1 VAL 34 2.258 -1.400 -0.508
241 2HG1 VAL 34 2HG1 VAL 34 3.871 -2.049 -0.435
242 3HG1 VAL 34 3HG1 VAL 34 3.552 -0.670 -1.419
243 1HG2 VAL 34 1HG2 VAL 34 5.725 -0.093 0.400
244 2HG2 VAL 34 2HG2 VAL 34 5.259 -1.227 1.661
245 3HG2 VAL 34 3HG2 VAL 34 5.170 0.504 1.954
246 HA PRO 35 HA PRO 35 2.701 2.312 -3.486
247 1HB PRO 35 2HB PRO 35 4.896 1.958 -4.823
248 2HB PRO 35 1HB PRO 35 4.936 3.135 -3.501
249 1HG PRO 35 2HG PRO 35 5.816 0.284 -3.501
250 2HG PRO 35 1HG PRO 35 6.709 1.711 -2.947
251 1HD PRO 35 2HD PRO 35 5.251 0.063 -1.310
252 2HD PRO 35 1HD PRO 35 5.566 1.758 -0.933
253 H SER 36 H SER 36 1.656 1.163 -4.979
254 HA SER 36 HA SER 36 1.203 -0.450 -6.526
255 1HB SER 36 2HB SER 36 3.680 -0.793 -6.700
256 2HB SER 36 1HB SER 36 3.535 -2.045 -5.466
257 HG SER 36 HG SER 36 3.020 -3.332 -7.026
258 H SER 37 H SER 37 2.343 -2.208 -3.571
259 HA SER 37 HA SER 37 -0.373 -3.198 -3.273
260 1HB SER 37 2HB SER 37 0.562 -4.776 -4.847
261 2HB SER 37 1HB SER 37 1.930 -5.070 -3.774
262 HG SER 37 HG SER 37 0.052 -6.590 -3.727
263 H TYR 38 H TYR 38 2.924 -3.762 -2.020
264 HA TYR 38 HA TYR 38 2.417 -3.102 0.612
265 1HB TYR 38 2HB TYR 38 0.764 -4.865 0.641
266 2HB TYR 38 1HB TYR 38 1.981 -6.027 0.088
267 HD1 TYR 38 1HD TYR 38 0.413 -4.506 2.914
268 HD2 TYR 38 2HD TYR 38 3.933 -6.344 1.515
269 HE1 TYR 38 1HE TYR 38 1.138 -4.885 5.249
270 HE2 TYR 38 2HE TYR 38 4.697 -6.762 3.761
271 HH TYR 38 HH TYR 38 4.304 -5.836 6.055
272 H ILE 39 H ILE 39 4.207 -3.567 1.952
273 HA ILE 39 HA ILE 39 6.258 -5.340 1.448
274 HB ILE 39 HB ILE 39 6.789 -4.356 -0.603
275 1HG1 ILE 39 2HG1 ILE 39 8.990 -3.492 -0.366
276 2HG1 ILE 39 1HG1 ILE 39 8.661 -2.862 1.232
277 1HG2 ILE 39 1HG2 ILE 39 6.958 -1.588 0.406
278 2HG2 ILE 39 2HG2 ILE 39 5.382 -2.292 0.082
279 3HG2 ILE 39 3HG2 ILE 39 6.574 -2.188 -1.207
280 1HD1 ILE 39 1HD1 ILE 39 8.445 -5.162 2.069
281 2HD1 ILE 39 2HD1 ILE 39 10.032 -4.839 1.370
282 3HD1 ILE 39 3HD1 ILE 39 8.838 -5.761 0.457
283 H ALA 40 H ALA 40 5.452 -5.031 3.690
284 HA ALA 40 HA ALA 40 6.080 -2.758 5.187
285 1HB ALA 40 1HB ALA 40 4.585 -4.534 5.957
286 2HB ALA 40 2HB ALA 40 5.823 -4.136 7.148
287 3HB ALA 40 3HB ALA 40 5.975 -5.596 6.172
288 H ALA 41 H ALA 41 8.073 -1.967 4.758
289 HA ALA 41 HA ALA 41 10.224 -2.697 6.325
290 1HB ALA 41 1HB ALA 41 10.416 -3.843 3.543
291 2HB ALA 41 2HB ALA 41 10.458 -4.725 5.069
292 3HB ALA 41 3HB ALA 41 11.787 -3.654 4.635
293 H ASP 42 H ASP 42 9.108 -1.286 3.327
294 HA ASP 42 HA ASP 42 9.445 0.778 2.432
295 1HB ASP 42 2HB ASP 42 11.366 1.325 4.703
296 2HB ASP 42 1HB ASP 42 10.590 2.506 3.655
297 H VAL 43 H VAL 43 11.146 -1.652 2.018
298 HA VAL 43 HA VAL 43 13.567 -0.333 0.980
299 HB VAL 43 HB VAL 43 13.125 -3.277 1.496
300 1HG1 VAL 43 1HG1 VAL 43 15.603 -1.751 0.699
301 2HG1 VAL 43 2HG1 VAL 43 14.696 -2.875 -0.313
302 3HG1 VAL 43 3HG1 VAL 43 15.543 -3.464 1.117
303 1HG2 VAL 43 1HG2 VAL 43 14.643 -1.201 3.071
304 2HG2 VAL 43 2HG2 VAL 43 14.745 -2.939 3.347
305 3HG2 VAL 43 3HG2 VAL 43 13.215 -2.097 3.591
306 H VAL 44 H VAL 44 10.726 -2.126 0.124
307 HA VAL 44 HA VAL 44 11.466 -1.870 -2.707
308 HB VAL 44 HB VAL 44 10.004 -4.301 -1.716
309 1HG1 VAL 44 1HG1 VAL 44 11.020 -5.216 -3.864
310 2HG1 VAL 44 2HG1 VAL 44 11.393 -3.538 -4.262
311 3HG1 VAL 44 3HG1 VAL 44 9.718 -4.038 -4.022
312 1HG2 VAL 44 1HG2 VAL 44 12.139 -4.290 -0.563
313 2HG2 VAL 44 2HG2 VAL 44 12.982 -4.022 -2.088
314 3HG2 VAL 44 3HG2 VAL 44 12.122 -5.537 -1.810
315 H SER 45 H SER 45 9.560 -2.113 -4.152
316 HA SER 45 HA SER 45 7.270 -0.694 -3.006
317 1HB SER 45 2HB SER 45 8.243 0.333 -4.964
318 2HB SER 45 1HB SER 45 8.147 -1.180 -5.865
319 HG SER 45 HG SER 45 6.189 -0.666 -6.383
320 H GLU 46 H GLU 46 7.780 -3.638 -2.680
321 HA GLU 46 HA GLU 46 5.164 -4.580 -2.931
322 1HB GLU 46 2HB GLU 46 5.578 -4.557 -5.335
323 2HB GLU 46 1HB GLU 46 7.013 -5.546 -5.118
324 1HG GLU 46 2HG GLU 46 5.621 -7.375 -4.286
325 2HG GLU 46 1HG GLU 46 4.185 -6.380 -4.520
326 H TYR 47 H TYR 47 4.892 -6.655 -2.048
327 HA TYR 47 HA TYR 47 6.850 -7.437 -0.206
328 1HB TYR 47 2HB TYR 47 4.378 -7.862 0.005
329 2HB TYR 47 1HB TYR 47 4.560 -9.130 -1.206
330 HD1 TYR 47 1HD TYR 47 6.851 -8.299 1.601
331 HD2 TYR 47 2HD TYR 47 4.069 -11.083 -0.019
332 HE1 TYR 47 1HE TYR 47 7.434 -9.905 3.372
333 HE2 TYR 47 2HE TYR 47 4.644 -12.696 1.747
334 HH TYR 47 HH TYR 47 6.432 -11.849 4.501
Start of MODEL 20
1 1H GLY 1 1HT GLY 1 -5.111 -1.375 11.054
2 2H GLY 1 2HT GLY 1 -4.428 -2.888 11.374
3 3H GLY 1 3HT GLY 1 -6.078 -2.631 11.646
4 1HA GLY 1 1HA GLY 1 -4.722 -2.606 9.004
5 2HA GLY 1 2HA GLY 1 -5.746 -3.895 9.619
6 H SER 2 H SER 2 -5.654 -1.086 7.791
7 HA SER 2 HA SER 2 -8.577 -1.067 7.637
8 1HB SER 2 2HB SER 2 -8.000 0.766 9.158
9 2HB SER 2 1HB SER 2 -6.887 1.425 7.959
10 HG SER 2 HG SER 2 -8.600 2.511 7.377
11 H GLY 3 H GLY 3 -8.913 -1.688 5.601
12 1HA GLY 3 2HA GLY 3 -8.804 -0.302 3.369
13 2HA GLY 3 1HA GLY 3 -7.114 -0.765 3.486
14 H GLU 4 H GLU 4 -7.118 -2.025 1.613
15 HA GLU 4 HA GLU 4 -7.178 -4.043 0.553
16 1HB GLU 4 2HB GLU 4 -7.149 -5.762 1.975
17 2HB GLU 4 1HB GLU 4 -7.753 -4.697 3.219
18 1HG GLU 4 2HG GLU 4 -10.009 -5.336 2.802
19 2HG GLU 4 1HG GLU 4 -9.543 -6.247 1.368
20 H VAL 5 H VAL 5 -10.006 -2.279 1.291
21 HA VAL 5 HA VAL 5 -11.873 -3.907 -0.177
22 HB VAL 5 HB VAL 5 -12.185 -0.981 0.459
23 1HG1 VAL 5 1HG1 VAL 5 -14.164 -3.226 0.076
24 2HG1 VAL 5 2HG1 VAL 5 -13.855 -1.888 -1.031
25 3HG1 VAL 5 3HG1 VAL 5 -14.581 -1.578 0.546
26 1HG2 VAL 5 1HG2 VAL 5 -12.757 -3.332 2.268
27 2HG2 VAL 5 2HG2 VAL 5 -13.233 -1.664 2.582
28 3HG2 VAL 5 3HG2 VAL 5 -11.523 -2.095 2.516
29 H ASN 6 H ASN 6 -10.331 -0.805 -0.696
30 HA ASN 6 HA ASN 6 -9.314 -0.019 -2.630
31 1HB ASN 6 2HB ASN 6 -11.196 -1.679 -4.305
32 2HB ASN 6 1HB ASN 6 -9.794 -0.756 -4.817
33 1HD2 ASN 6 1HD2 ASN 6 -8.781 -2.396 -5.808
34 2HD2 ASN 6 2HD2 ASN 6 -8.082 -3.732 -4.969
35 H LYS 7 H LYS 7 -10.196 1.773 -1.753
36 HA LYS 7 HA LYS 7 -12.319 2.982 -3.311
37 1HB LYS 7 2HB LYS 7 -13.553 3.649 -1.250
38 2HB LYS 7 1HB LYS 7 -13.543 1.909 -1.501
39 1HG LYS 7 2HG LYS 7 -11.385 2.077 0.050
40 2HG LYS 7 1HG LYS 7 -12.230 3.526 0.605
41 1HD LYS 7 2HD LYS 7 -14.182 2.244 1.179
42 2HD LYS 7 1HD LYS 7 -13.486 0.788 0.465
43 1HE LYS 7 2HE LYS 7 -13.300 0.744 2.895
44 2HE LYS 7 1HE LYS 7 -11.707 0.814 2.140
45 1HZ LYS 7 1HZ LYS 7 -13.168 3.124 3.305
46 2HZ LYS 7 2HZ LYS 7 -11.635 3.185 2.592
47 3HZ LYS 7 3HZ LYS 7 -11.867 2.316 4.025
48 H ILE 8 H ILE 8 -12.235 4.934 -0.734
49 HA ILE 8 HA ILE 8 -10.667 6.935 -1.719
50 HB ILE 8 HB ILE 8 -12.191 7.069 0.257
51 1HG1 ILE 8 2HG1 ILE 8 -10.527 8.864 -0.305
52 2HG1 ILE 8 1HG1 ILE 8 -10.990 8.812 1.391
53 1HG2 ILE 8 1HG2 ILE 8 -9.898 6.071 1.916
54 2HG2 ILE 8 2HG2 ILE 8 -11.158 4.994 1.314
55 3HG2 ILE 8 3HG2 ILE 8 -11.577 6.327 2.394
56 1HD1 ILE 8 1HD1 ILE 8 -8.697 9.152 1.431
57 2HD1 ILE 8 2HD1 ILE 8 -8.404 8.008 0.124
58 3HD1 ILE 8 3HD1 ILE 8 -8.863 7.421 1.721
59 H ILE 9 H ILE 9 -8.532 6.842 -2.312
60 HA ILE 9 HA ILE 9 -6.767 5.377 -0.511
61 HB ILE 9 HB ILE 9 -5.320 4.985 -2.598
62 1HG1 ILE 9 2HG1 ILE 9 -8.025 5.507 -3.845
63 2HG1 ILE 9 1HG1 ILE 9 -6.527 6.378 -4.168
64 1HG2 ILE 9 1HG2 ILE 9 -6.212 2.861 -2.836
65 2HG2 ILE 9 2HG2 ILE 9 -7.861 3.410 -2.523
66 3HG2 ILE 9 3HG2 ILE 9 -6.687 3.347 -1.213
67 1HD1 ILE 9 1HD1 ILE 9 -5.562 4.414 -5.179
68 2HD1 ILE 9 2HD1 ILE 9 -7.112 4.780 -5.941
69 3HD1 ILE 9 3HD1 ILE 9 -6.991 3.467 -4.767
70 H GLY 10 H GLY 10 -5.455 6.635 0.503
71 1HA GLY 10 2HA GLY 10 -4.256 8.965 -0.807
72 2HA GLY 10 1HA GLY 10 -4.242 8.627 0.931
73 H SER 11 H SER 11 -1.895 9.070 -0.902
74 HA SER 11 HA SER 11 -0.449 6.709 -0.200
75 1HB SER 11 2HB SER 11 0.205 6.235 -2.614
76 2HB SER 11 1HB SER 11 -1.429 5.793 -2.145
77 HG SER 11 HG SER 11 -0.578 8.046 -3.631
78 H ARG 12 H ARG 12 1.185 7.752 0.764
79 HA ARG 12 HA ARG 12 3.148 8.990 -0.931
80 1HB ARG 12 2HB ARG 12 1.680 10.621 1.137
81 2HB ARG 12 1HB ARG 12 3.312 11.031 0.628
82 1HG ARG 12 2HG ARG 12 2.302 12.295 -0.903
83 2HG ARG 12 1HG ARG 12 2.032 10.781 -1.765
84 1HD ARG 12 2HD ARG 12 -0.037 12.028 -1.619
85 2HD ARG 12 1HD ARG 12 -0.152 10.565 -0.643
86 HE ARG 12 HE ARG 12 0.647 12.407 1.151
87 1HH1 ARG 12 1HH1 ARG 12 -1.930 12.355 -1.193
88 2HH1 ARG 12 2HH1 ARG 12 -2.972 13.377 -0.260
89 1HH2 ARG 12 1HH2 ARG 12 -0.718 13.752 2.386
90 2HH2 ARG 12 2HH2 ARG 12 -2.283 14.172 1.774
91 H THR 13 H THR 13 4.633 7.383 -0.197
92 HA THR 13 HA THR 13 5.009 7.330 2.681
93 HB THR 13 HB THR 13 6.550 5.399 1.111
94 HG1 THR 13 1HG THR 13 4.713 4.057 0.883
95 1HG2 THR 13 1HG2 THR 13 5.586 3.943 2.994
96 2HG2 THR 13 2HG2 THR 13 5.082 5.477 3.707
97 3HG2 THR 13 3HG2 THR 13 6.790 5.164 3.403
98 H ALA 14 H ALA 14 7.472 6.689 0.215
99 HA ALA 14 HA ALA 14 8.998 8.965 1.291
100 1HB ALA 14 1HB ALA 14 9.615 7.028 2.660
101 2HB ALA 14 2HB ALA 14 10.974 7.645 1.721
102 3HB ALA 14 3HB ALA 14 10.137 6.180 1.204
103 H GLY 15 H GLY 15 9.630 6.169 -0.819
104 1HA GLY 15 2HA GLY 15 9.614 6.689 -3.277
105 2HA GLY 15 1HA GLY 15 10.604 8.081 -2.855
106 H GLU 16 H GLU 16 12.139 6.740 -0.853
107 HA GLU 16 HA GLU 16 14.201 5.657 -2.459
108 1HB GLU 16 2HB GLU 16 15.424 5.418 -0.444
109 2HB GLU 16 1HB GLU 16 14.415 6.841 -0.211
110 1HG GLU 16 2HG GLU 16 12.859 5.572 1.124
111 2HG GLU 16 1HG GLU 16 13.767 4.091 0.826
112 H GLY 17 H GLY 17 11.553 4.318 -0.653
113 1HA GLY 17 2HA GLY 17 12.094 1.696 -1.828
114 2HA GLY 17 1HA GLY 17 11.934 1.791 -0.079
115 H ALA 18 H ALA 18 9.902 3.533 0.283
116 HA ALA 18 HA ALA 18 7.643 2.299 -1.124
117 1HB ALA 18 1HB ALA 18 7.818 3.203 1.748
118 2HB ALA 18 2HB ALA 18 7.609 1.551 1.162
119 3HB ALA 18 3HB ALA 18 6.307 2.729 0.959
120 H MET 19 H MET 19 5.797 3.673 -1.603
121 HA MET 19 HA MET 19 6.021 6.472 -0.956
122 1HB MET 19 2HB MET 19 7.393 5.650 -3.198
123 2HB MET 19 1HB MET 19 5.881 6.250 -3.868
124 1HG MET 19 2HG MET 19 6.249 8.345 -2.534
125 2HG MET 19 1HG MET 19 7.860 7.729 -2.173
126 1HE MET 19 1HE MET 19 8.436 10.606 -4.825
127 2HE MET 19 2HE MET 19 8.748 10.074 -3.173
128 3HE MET 19 3HE MET 19 7.122 10.563 -3.649
129 H GLU 20 H GLU 20 3.893 4.329 -0.832
130 HA GLU 20 HA GLU 20 1.775 6.053 -1.692
131 1HB GLU 20 2HB GLU 20 1.997 3.298 -2.858
132 2HB GLU 20 1HB GLU 20 0.517 4.231 -2.894
133 1HG GLU 20 2HG GLU 20 2.181 5.993 -3.998
134 2HG GLU 20 1HG GLU 20 3.033 4.504 -4.429
135 H TYR 21 H TYR 21 -0.507 4.477 -1.122
136 HA TYR 21 HA TYR 21 0.118 3.201 1.339
137 1HB TYR 21 2HB TYR 21 0.260 5.142 2.348
138 2HB TYR 21 1HB TYR 21 -0.878 5.912 1.292
139 HD1 TYR 21 1HD TYR 21 -2.007 7.073 2.896
140 HD2 TYR 21 2HD TYR 21 -1.738 2.816 3.252
141 HE1 TYR 21 1HE TYR 21 -3.692 7.136 4.640
142 HE2 TYR 21 2HE TYR 21 -3.433 2.888 5.039
143 HH TYR 21 HH TYR 21 -5.333 5.633 5.691
144 H LEU 22 H LEU 22 -2.827 4.680 0.304
145 HA LEU 22 HA LEU 22 -4.189 2.442 1.487
146 1HB LEU 22 2HB LEU 22 -5.099 4.981 0.288
147 2HB LEU 22 1HB LEU 22 -6.252 3.717 0.630
148 HG LEU 22 HG LEU 22 -4.449 5.016 2.656
149 1HD1 LEU 22 1HD1 LEU 22 -5.989 6.664 2.357
150 2HD1 LEU 22 2HD1 LEU 22 -6.873 5.657 3.502
151 3HD1 LEU 22 3HD1 LEU 22 -7.227 5.551 1.778
152 1HD2 LEU 22 1HD2 LEU 22 -6.606 2.936 2.931
153 2HD2 LEU 22 2HD2 LEU 22 -5.877 3.800 4.284
154 3HD2 LEU 22 3HD2 LEU 22 -4.887 2.743 3.277
155 H ILE 23 H ILE 23 -5.485 1.089 0.720
156 HA ILE 23 HA ILE 23 -5.515 -0.744 -0.725
157 HB ILE 23 HB ILE 23 -7.610 0.648 -2.175
158 1HG1 ILE 23 2HG1 ILE 23 -7.429 2.041 -0.052
159 2HG1 ILE 23 1HG1 ILE 23 -8.985 1.271 -0.325
160 1HG2 ILE 23 1HG2 ILE 23 -8.615 -1.230 -0.369
161 2HG2 ILE 23 2HG2 ILE 23 -7.041 -1.848 -0.837
162 3HG2 ILE 23 3HG2 ILE 23 -8.238 -1.491 -2.063
163 1HD1 ILE 23 1HD1 ILE 23 -6.905 -0.015 1.394
164 2HD1 ILE 23 2HD1 ILE 23 -8.649 -0.272 1.374
165 3HD1 ILE 23 3HD1 ILE 23 -7.985 1.226 2.026
166 H GLU 24 H GLU 24 -6.801 -0.419 -3.423
167 HA GLU 24 HA GLU 24 -6.211 -0.085 -5.592
168 1HB GLU 24 2HB GLU 24 -4.554 1.785 -4.343
169 2HB GLU 24 1HB GLU 24 -3.455 0.787 -5.290
170 1HG GLU 24 2HG GLU 24 -5.893 2.204 -6.339
171 2HG GLU 24 1HG GLU 24 -4.224 2.733 -6.539
172 H TRP 25 H TRP 25 -4.768 -1.996 -3.248
173 HA TRP 25 HA TRP 25 -3.534 -3.635 -5.342
174 1HB TRP 25 2HB TRP 25 -2.136 -4.602 -3.408
175 2HB TRP 25 1HB TRP 25 -1.686 -3.044 -4.073
176 HD1 TRP 25 HD TRP 25 -3.816 -4.261 -0.990
177 HE1 TRP 25 1HE TRP 25 -3.163 -2.699 1.009
178 HE3 TRP 25 3HE TRP 25 -0.584 -1.094 -3.339
179 HZ2 TRP 25 2HZ TRP 25 -1.622 -0.530 1.451
180 HZ3 TRP 25 3HZ TRP 25 0.487 0.679 -2.000
181 HH2 TRP 25 HH TRP 25 -0.021 0.992 0.318
182 H LYS 26 H LYS 26 -6.268 -3.586 -4.294
183 HA LYS 26 HA LYS 26 -7.871 -4.953 -3.359
184 1HB LYS 26 2HB LYS 26 -7.601 -5.560 -5.738
185 2HB LYS 26 1HB LYS 26 -6.481 -6.830 -5.267
186 1HG LYS 26 2HG LYS 26 -8.275 -7.911 -3.980
187 2HG LYS 26 1HG LYS 26 -9.392 -6.655 -4.517
188 1HD LYS 26 2HD LYS 26 -8.982 -7.316 -6.852
189 2HD LYS 26 1HD LYS 26 -7.908 -8.597 -6.287
190 1HE LYS 26 2HE LYS 26 -9.783 -9.605 -5.059
191 2HE LYS 26 1HE LYS 26 -10.850 -8.339 -5.666
192 1HZ LYS 26 1HZ LYS 26 -10.404 -9.106 -7.920
193 2HZ LYS 26 2HZ LYS 26 -11.055 -10.350 -6.975
194 3HZ LYS 26 3HZ LYS 26 -9.401 -10.332 -7.325
195 H ASP 27 H ASP 27 -6.418 -4.959 -1.268
196 HA ASP 27 HA ASP 27 -5.547 -6.107 0.506
197 1HB ASP 27 2HB ASP 27 -6.861 -7.999 1.216
198 2HB ASP 27 1HB ASP 27 -7.935 -6.813 0.485
199 H GLY 28 H GLY 28 -4.183 -6.530 -2.091
200 1HA GLY 28 2HA GLY 28 -3.381 -9.119 -2.595
201 2HA GLY 28 1HA GLY 28 -2.331 -7.718 -2.780
202 H HIS 29 H HIS 29 -1.500 -6.847 -0.594
203 HA HIS 29 HA HIS 29 -1.003 -9.065 1.239
204 1HB HIS 29 2HB HIS 29 1.362 -7.259 0.887
205 2HB HIS 29 1HB HIS 29 1.266 -8.992 1.173
206 HD1 HIS 29 1HD HIS 29 0.223 -6.821 -1.788
207 HD2 HIS 29 2HD HIS 29 2.344 -10.283 -0.904
208 HE1 HIS 29 1HE HIS 29 0.989 -7.728 -4.006
209 HE2 HIS 29 2HE HIS 29 2.195 -9.868 -3.451
210 H SER 30 H SER 30 -2.232 -8.366 2.831
211 HA SER 30 HA SER 30 -3.083 -7.023 4.498
212 1HB SER 30 2HB SER 30 -0.122 -6.568 4.649
213 2HB SER 30 1HB SER 30 -1.256 -6.218 5.963
214 HG SER 30 HG SER 30 -0.672 -8.744 4.809
215 HA PRO 31 HA PRO 31 -3.839 -2.785 2.751
216 1HB PRO 31 2HB PRO 31 -4.887 -2.324 5.421
217 2HB PRO 31 1HB PRO 31 -5.766 -2.377 3.891
218 1HG PRO 31 2HG PRO 31 -5.344 -4.512 5.892
219 2HG PRO 31 1HG PRO 31 -6.631 -4.339 4.691
220 1HD PRO 31 2HD PRO 31 -4.773 -6.208 4.373
221 2HD PRO 31 1HD PRO 31 -5.307 -5.256 2.967
222 H SER 32 H SER 32 -1.853 -1.905 2.675
223 HA SER 32 HA SER 32 -0.462 -1.276 5.187
224 1HB SER 32 2HB SER 32 0.641 -3.049 4.155
225 2HB SER 32 1HB SER 32 0.577 -2.263 2.579
226 HG SER 32 HG SER 32 2.355 -1.945 4.657
227 H TRP 33 H TRP 33 1.445 0.256 4.688
228 HA TRP 33 HA TRP 33 0.508 2.428 2.938
229 1HB TRP 33 2HB TRP 33 0.901 2.986 5.426
230 2HB TRP 33 1HB TRP 33 2.610 2.653 5.133
231 HD1 TRP 33 HD TRP 33 3.544 4.105 2.844
232 HE1 TRP 33 1HE TRP 33 3.212 6.594 2.390
233 HE3 TRP 33 3HE TRP 33 -0.421 5.008 5.956
234 HZ2 TRP 33 2HZ TRP 33 1.510 8.684 3.199
235 HZ3 TRP 33 3HZ TRP 33 -1.342 7.294 6.039
236 HH2 TRP 33 HH TRP 33 -0.397 9.090 4.666
237 H VAL 34 H VAL 34 1.363 1.947 1.044
238 HA VAL 34 HA VAL 34 4.171 1.454 0.782
239 HB VAL 34 HB VAL 34 3.918 -0.784 1.030
240 1HG1 VAL 34 1HG1 VAL 34 2.098 -1.701 1.725
241 2HG1 VAL 34 2HG1 VAL 34 1.258 -1.434 0.206
242 3HG1 VAL 34 3HG1 VAL 34 1.258 -0.187 1.440
243 1HG2 VAL 34 1HG2 VAL 34 3.902 -1.927 -0.927
244 2HG2 VAL 34 2HG2 VAL 34 3.807 -0.355 -1.663
245 3HG2 VAL 34 3HG2 VAL 34 2.352 -1.279 -1.410
246 HA PRO 35 HA PRO 35 4.090 3.490 -3.070
247 1HB PRO 35 2HB PRO 35 5.723 1.847 -4.556
248 2HB PRO 35 1HB PRO 35 6.281 3.032 -3.371
249 1HG PRO 35 2HG PRO 35 5.840 0.086 -3.054
250 2HG PRO 35 1HG PRO 35 7.197 1.082 -2.494
251 1HD PRO 35 2HD PRO 35 5.301 0.347 -0.801
252 2HD PRO 35 1HD PRO 35 5.932 1.972 -0.744
253 H SER 36 H SER 36 2.760 0.267 -3.159
254 HA SER 36 HA SER 36 1.067 0.878 -5.275
255 1HB SER 36 2HB SER 36 2.104 -0.551 -7.102
256 2HB SER 36 1HB SER 36 2.892 0.993 -6.789
257 HG SER 36 HG SER 36 4.286 -0.928 -6.970
258 H SER 37 H SER 37 2.633 -1.611 -3.403
259 HA SER 37 HA SER 37 0.196 -3.198 -3.698
260 1HB SER 37 2HB SER 37 1.788 -4.200 -5.258
261 2HB SER 37 1HB SER 37 2.988 -4.330 -3.975
262 HG SER 37 HG SER 37 1.384 -5.673 -2.873
263 H TYR 38 H TYR 38 3.322 -3.724 -2.157
264 HA TYR 38 HA TYR 38 2.679 -3.002 0.417
265 1HB TYR 38 2HB TYR 38 0.986 -4.687 0.440
266 2HB TYR 38 1HB TYR 38 2.154 -5.894 -0.111
267 HD1 TYR 38 1HD TYR 38 0.638 -4.339 2.705
268 HD2 TYR 38 2HD TYR 38 4.115 -6.338 1.390
269 HE1 TYR 38 1HE TYR 38 1.233 -4.787 5.028
270 HE2 TYR 38 2HE TYR 38 4.757 -6.815 3.669
271 HH TYR 38 HH TYR 38 4.329 -5.916 5.939
272 H ILE 39 H ILE 39 4.540 -2.927 1.552
273 HA ILE 39 HA ILE 39 6.568 -4.892 0.898
274 HB ILE 39 HB ILE 39 8.130 -3.560 -0.031
275 1HG1 ILE 39 2HG1 ILE 39 8.496 -1.909 1.707
276 2HG1 ILE 39 1HG1 ILE 39 8.238 -1.048 0.201
277 1HG2 ILE 39 1HG2 ILE 39 5.719 -1.920 -0.709
278 2HG2 ILE 39 2HG2 ILE 39 6.089 -3.490 -1.418
279 3HG2 ILE 39 3HG2 ILE 39 7.171 -2.121 -1.685
280 1HD1 ILE 39 1HD1 ILE 39 6.155 -0.286 0.832
281 2HD1 ILE 39 2HD1 ILE 39 7.080 -0.203 2.332
282 3HD1 ILE 39 3HD1 ILE 39 5.954 -1.532 2.062
283 H ALA 40 H ALA 40 4.912 -4.213 3.204
284 HA ALA 40 HA ALA 40 6.526 -2.820 5.085
285 1HB ALA 40 1HB ALA 40 3.977 -3.778 5.033
286 2HB ALA 40 2HB ALA 40 4.788 -3.090 6.442
287 3HB ALA 40 3HB ALA 40 4.759 -4.838 6.208
288 H ALA 41 H ALA 41 8.561 -3.598 4.892
289 HA ALA 41 HA ALA 41 9.751 -5.198 6.624
290 1HB ALA 41 1HB ALA 41 8.729 -6.978 4.418
291 2HB ALA 41 2HB ALA 41 8.499 -7.157 6.158
292 3HB ALA 41 3HB ALA 41 10.092 -7.418 5.449
293 H ASP 42 H ASP 42 10.315 -3.047 4.852
294 HA ASP 42 HA ASP 42 11.996 -2.159 3.625
295 1HB ASP 42 2HB ASP 42 13.410 -3.170 5.339
296 2HB ASP 42 1HB ASP 42 13.432 -4.690 4.449
297 H VAL 43 H VAL 43 10.886 -2.263 1.630
298 HA VAL 43 HA VAL 43 12.267 -3.785 -0.367
299 HB VAL 43 HB VAL 43 9.554 -4.416 -0.978
300 1HG1 VAL 43 1HG1 VAL 43 11.940 -6.131 -0.317
301 2HG1 VAL 43 2HG1 VAL 43 11.472 -5.536 -1.910
302 3HG1 VAL 43 3HG1 VAL 43 10.454 -6.708 -1.072
303 1HG2 VAL 43 1HG2 VAL 43 9.153 -4.374 1.455
304 2HG2 VAL 43 2HG2 VAL 43 10.438 -5.559 1.673
305 3HG2 VAL 43 3HG2 VAL 43 8.982 -5.990 0.775
306 H VAL 44 H VAL 44 10.530 -3.530 -2.520
307 HA VAL 44 HA VAL 44 9.661 -0.741 -2.487
308 HB VAL 44 HB VAL 44 10.938 -0.083 -4.402
309 1HG1 VAL 44 1HG1 VAL 44 11.949 -0.209 -2.002
310 2HG1 VAL 44 2HG1 VAL 44 12.979 0.204 -3.372
311 3HG1 VAL 44 3HG1 VAL 44 12.999 -1.433 -2.716
312 1HG2 VAL 44 1HG2 VAL 44 12.669 -1.595 -5.367
313 2HG2 VAL 44 2HG2 VAL 44 11.014 -2.129 -5.660
314 3HG2 VAL 44 3HG2 VAL 44 11.987 -2.913 -4.416
315 H SER 45 H SER 45 7.797 -0.519 -3.425
316 HA SER 45 HA SER 45 5.936 -0.849 -4.685
317 1HB SER 45 2HB SER 45 7.520 -0.126 -6.428
318 2HB SER 45 1HB SER 45 7.944 -1.811 -6.728
319 HG SER 45 HG SER 45 6.383 -1.223 -8.202
320 H GLU 46 H GLU 46 7.187 -3.309 -3.202
321 HA GLU 46 HA GLU 46 5.125 -5.107 -3.759
322 1HB GLU 46 2HB GLU 46 6.721 -5.164 -5.862
323 2HB GLU 46 1HB GLU 46 7.645 -6.263 -4.848
324 1HG GLU 46 2HG GLU 46 5.731 -7.725 -4.626
325 2HG GLU 46 1HG GLU 46 4.741 -6.606 -5.562
326 H TYR 47 H TYR 47 5.107 -6.898 -2.391
327 HA TYR 47 HA TYR 47 6.795 -6.715 -0.103
328 1HB TYR 47 2HB TYR 47 4.354 -7.305 -0.045
329 2HB TYR 47 1HB TYR 47 4.767 -8.848 -0.794
330 HD1 TYR 47 1HD TYR 47 6.498 -6.973 1.927
331 HD2 TYR 47 2HD TYR 47 4.358 -10.476 0.810
332 HE1 TYR 47 1HE TYR 47 6.927 -7.937 4.148
333 HE2 TYR 47 2HE TYR 47 4.782 -11.449 3.028
334 HH TYR 47 HH TYR 47 6.380 -11.214 4.868