Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
20463 | 2frw RC | 7035 | cing | 1-original | 7 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 1H ILE 1 1HT ILE 1 10.219 -2.311 8.738
2 2H ILE 1 2HT ILE 1 10.733 -2.301 10.375
3 3H ILE 1 3HT ILE 1 10.624 -0.829 9.499
4 HA ILE 1 HA ILE 1 8.524 -2.514 10.608
5 HB ILE 1 HB ILE 1 8.750 0.486 10.428
6 1HG1 ILE 1 2HG1 ILE 1 9.668 -1.343 12.659
7 2HG1 ILE 1 1HG1 ILE 1 10.713 -0.388 11.613
8 1HG2 ILE 1 1HG2 ILE 1 7.200 -1.245 12.347
9 2HG2 ILE 1 2HG2 ILE 1 6.523 -0.529 10.884
10 3HG2 ILE 1 3HG2 ILE 1 7.116 0.509 12.180
11 1HD1 ILE 1 1HD1 ILE 1 10.647 1.040 13.344
12 2HD1 ILE 1 2HD1 ILE 1 9.106 0.422 13.938
13 3HD1 ILE 1 3HD1 ILE 1 9.141 1.554 12.587
14 HA PRO 2 HA PRO 2 6.229 -1.949 6.836
15 1HB PRO 2 2HB PRO 2 3.957 -3.151 7.561
16 2HB PRO 2 1HB PRO 2 5.452 -4.072 7.358
17 1HG PRO 2 2HG PRO 2 4.120 -3.144 9.862
18 2HG PRO 2 1HG PRO 2 4.958 -4.670 9.537
19 1HD PRO 2 2HD PRO 2 6.051 -2.475 10.854
20 2HD PRO 2 1HD PRO 2 6.976 -3.799 10.122
21 H ALA 3 H ALA 3 3.575 -1.494 6.595
22 HA ALA 3 HA ALA 3 3.221 1.092 7.914
23 1HB ALA 3 1HB ALA 3 2.418 0.136 5.192
24 2HB ALA 3 2HB ALA 3 3.414 1.525 5.628
25 3HB ALA 3 3HB ALA 3 1.677 1.554 5.934
26 H PHE 4 H PHE 4 0.923 1.774 8.209
27 HA PHE 4 HA PHE 4 -0.706 -0.502 9.048
28 1HB PHE 4 2HB PHE 4 0.166 1.111 10.813
29 2HB PHE 4 1HB PHE 4 -0.953 2.275 10.117
30 HD1 PHE 4 1HD PHE 4 -3.340 2.035 10.379
31 HD2 PHE 4 2HD PHE 4 -0.645 -0.802 12.051
32 HE1 PHE 4 1HE PHE 4 -5.158 1.133 11.771
33 HE2 PHE 4 2HE PHE 4 -2.458 -1.710 13.444
34 HZ PHE 4 HZ PHE 4 -4.718 -0.742 13.305
35 H VAL 5 H VAL 5 -2.407 -0.877 7.789
36 HA VAL 5 HA VAL 5 -3.411 1.169 6.008
37 HB VAL 5 HB VAL 5 -4.478 -1.624 6.423
38 1HG1 VAL 5 1HG1 VAL 5 -5.570 0.464 5.017
39 2HG1 VAL 5 2HG1 VAL 5 -5.890 -1.246 4.730
40 3HG1 VAL 5 3HG1 VAL 5 -4.666 -0.406 3.778
41 1HG2 VAL 5 1HG2 VAL 5 -3.117 -1.972 4.226
42 2HG2 VAL 5 2HG2 VAL 5 -2.308 -2.071 5.790
43 3HG2 VAL 5 3HG2 VAL 5 -2.176 -0.604 4.820
44 H LYS 6 H LYS 6 -5.418 2.136 6.071
45 HA LYS 6 HA LYS 6 -6.882 1.837 8.602
46 1HB LYS 6 2HB LYS 6 -7.181 4.194 6.775
47 2HB LYS 6 1HB LYS 6 -7.504 4.087 8.498
48 1HG LYS 6 2HG LYS 6 -5.383 4.566 9.058
49 2HG LYS 6 1HG LYS 6 -4.705 3.625 7.729
50 1HD LYS 6 2HD LYS 6 -5.315 5.426 6.168
51 2HD LYS 6 1HD LYS 6 -5.941 6.371 7.520
52 1HE LYS 6 2HE LYS 6 -3.699 6.350 8.538
53 2HE LYS 6 1HE LYS 6 -3.089 5.463 7.143
54 1HZ LYS 6 1HZ LYS 6 -3.771 7.351 5.745
55 2HZ LYS 6 2HZ LYS 6 -2.607 7.784 6.892
56 3HZ LYS 6 3HZ LYS 6 -4.226 8.205 7.133
57 H PHE 7 H PHE 7 -7.699 2.998 5.363
58 HA PHE 7 HA PHE 7 -10.317 1.782 5.588
59 1HB PHE 7 2HB PHE 7 -9.169 4.015 4.137
60 2HB PHE 7 1HB PHE 7 -10.130 2.985 3.076
61 HD1 PHE 7 1HD PHE 7 -12.478 3.016 3.158
62 HD2 PHE 7 2HD PHE 7 -10.225 4.967 6.196
63 HE1 PHE 7 1HE PHE 7 -14.536 4.070 4.002
64 HE2 PHE 7 2HE PHE 7 -12.279 6.023 7.046
65 HZ PHE 7 HZ PHE 7 -14.438 5.574 5.949
66 H ALA 8 H ALA 8 -11.229 0.493 3.873
67 HA ALA 8 HA ALA 8 -9.216 -1.155 2.529
68 1HB ALA 8 1HB ALA 8 -11.832 -2.380 2.781
69 2HB ALA 8 2HB ALA 8 -11.134 -1.944 4.339
70 3HB ALA 8 3HB ALA 8 -10.245 -2.998 3.239
71 H TYR 9 H TYR 9 -9.404 -1.570 0.367
72 HA TYR 9 HA TYR 9 -11.800 -0.599 -1.023
73 1HB TYR 9 2HB TYR 9 -9.910 1.097 -1.104
74 2HB TYR 9 1HB TYR 9 -9.009 -0.083 -2.056
75 HD1 TYR 9 1HD TYR 9 -8.865 0.849 -4.185
76 HD2 TYR 9 2HD TYR 9 -12.625 0.807 -2.195
77 HE1 TYR 9 1HE TYR 9 -9.952 1.670 -6.233
78 HE2 TYR 9 2HE TYR 9 -13.722 1.626 -4.238
79 HH TYR 9 HH TYR 9 -12.016 2.896 -6.858
80 H VAL 10 H VAL 10 -12.550 -2.006 -2.497
81 HA VAL 10 HA VAL 10 -10.910 -4.343 -3.092
82 HB VAL 10 HB VAL 10 -13.105 -5.303 -3.943
83 1HG1 VAL 10 1HG1 VAL 10 -12.607 -6.279 -1.967
84 2HG1 VAL 10 2HG1 VAL 10 -13.979 -5.324 -1.403
85 3HG1 VAL 10 3HG1 VAL 10 -12.335 -4.739 -1.151
86 1HG2 VAL 10 1HG2 VAL 10 -14.003 -2.748 -3.765
87 2HG2 VAL 10 2HG2 VAL 10 -14.608 -3.427 -2.254
88 3HG2 VAL 10 3HG2 VAL 10 -15.043 -4.171 -3.793
89 H ALA 11 H ALA 11 -9.759 -4.123 -4.903
90 HA ALA 11 HA ALA 11 -10.926 -4.002 -7.435
91 1HB ALA 11 1HB ALA 11 -9.585 -1.399 -6.738
92 2HB ALA 11 2HB ALA 11 -11.334 -1.623 -6.737
93 3HB ALA 11 3HB ALA 11 -10.422 -1.818 -8.232
94 H GLU 12 H GLU 12 -9.537 -5.302 -8.458
95 HA GLU 12 HA GLU 12 -6.659 -4.776 -8.097
96 1HB GLU 12 2HB GLU 12 -7.887 -7.455 -8.743
97 2HB GLU 12 1HB GLU 12 -6.209 -7.123 -8.342
98 1HG GLU 12 2HG GLU 12 -6.604 -7.295 -6.168
99 2HG GLU 12 1HG GLU 12 -7.987 -6.206 -6.261
100 H ARG 13 H ARG 13 -5.769 -3.983 -9.828
101 HA ARG 13 HA ARG 13 -6.167 -5.139 -12.420
102 1HB ARG 13 2HB ARG 13 -7.876 -3.706 -12.884
103 2HB ARG 13 1HB ARG 13 -7.376 -2.554 -11.655
104 1HG ARG 13 2HG ARG 13 -5.584 -2.697 -13.981
105 2HG ARG 13 1HG ARG 13 -7.221 -2.150 -14.336
106 1HD ARG 13 2HD ARG 13 -6.457 -0.850 -11.981
107 2HD ARG 13 1HD ARG 13 -5.068 -0.751 -13.057
108 HE ARG 13 HE ARG 13 -7.524 -0.067 -14.356
109 1HH1 ARG 13 1HH1 ARG 13 -4.971 1.158 -12.315
110 2HH1 ARG 13 2HH1 ARG 13 -5.206 2.805 -12.797
111 1HH2 ARG 13 1HH2 ARG 13 -7.833 2.099 -14.990
112 2HH2 ARG 13 2HH2 ARG 13 -6.832 3.339 -14.314
113 H GLU 14 H GLU 14 -4.539 -4.309 -13.984
114 HA GLU 14 HA GLU 14 -2.009 -4.071 -12.849
115 1HB GLU 14 2HB GLU 14 -1.262 -3.290 -15.082
116 2HB GLU 14 1HB GLU 14 -2.288 -4.714 -15.175
117 1HG GLU 14 2HG GLU 14 -4.025 -2.537 -15.364
118 2HG GLU 14 1HG GLU 14 -2.635 -2.124 -16.366
119 H ASP 15 H ASP 15 -1.510 -2.539 -11.437
120 HA ASP 15 HA ASP 15 -0.699 -0.415 -10.901
121 1HB ASP 15 2HB ASP 15 -1.437 0.176 -13.436
122 2HB ASP 15 1HB ASP 15 -2.653 1.089 -12.542
123 H GLU 16 H GLU 16 -3.378 -1.991 -10.340
124 HA GLU 16 HA GLU 16 -4.477 0.044 -8.534
125 1HB GLU 16 2HB GLU 16 -6.211 -0.141 -10.078
126 2HB GLU 16 1HB GLU 16 -5.872 -1.831 -10.402
127 1HG GLU 16 2HG GLU 16 -7.338 -2.510 -8.902
128 2HG GLU 16 1HG GLU 16 -6.686 -1.427 -7.675
129 H LEU 17 H LEU 17 -4.808 -0.612 -6.459
130 HA LEU 17 HA LEU 17 -4.396 -3.461 -5.851
131 1HB LEU 17 2HB LEU 17 -2.849 -3.035 -4.199
132 2HB LEU 17 1HB LEU 17 -2.414 -1.841 -5.414
133 HG LEU 17 HG LEU 17 -4.121 -0.370 -3.951
134 1HD1 LEU 17 1HD1 LEU 17 -4.469 -2.303 -2.404
135 2HD1 LEU 17 2HD1 LEU 17 -3.919 -0.822 -1.623
136 3HD1 LEU 17 3HD1 LEU 17 -2.784 -2.139 -1.917
137 1HD2 LEU 17 1HD2 LEU 17 -2.296 0.851 -3.500
138 2HD2 LEU 17 2HD2 LEU 17 -1.457 -0.346 -4.483
139 3HD2 LEU 17 3HD2 LEU 17 -1.461 -0.496 -2.728
140 H SER 18 H SER 18 -5.441 -4.244 -3.973
141 HA SER 18 HA SER 18 -7.775 -2.683 -3.217
142 1HB SER 18 2HB SER 18 -8.878 -4.654 -2.897
143 2HB SER 18 1HB SER 18 -7.593 -5.291 -3.926
144 HG SER 18 HG SER 18 -6.437 -5.738 -1.936
145 H LEU 19 H LEU 19 -8.097 -1.897 -1.176
146 HA LEU 19 HA LEU 19 -5.837 -2.127 0.659
147 1HB LEU 19 2HB LEU 19 -8.197 -0.342 1.123
148 2HB LEU 19 1HB LEU 19 -6.536 -0.142 1.655
149 HG LEU 19 HG LEU 19 -7.207 -0.020 -1.264
150 1HD1 LEU 19 1HD1 LEU 19 -8.052 2.063 -1.183
151 2HD1 LEU 19 2HD1 LEU 19 -7.050 2.530 0.191
152 3HD1 LEU 19 3HD1 LEU 19 -8.523 1.596 0.452
153 1HD2 LEU 19 1HD2 LEU 19 -5.189 1.695 0.042
154 2HD2 LEU 19 2HD2 LEU 19 -5.135 0.849 -1.505
155 3HD2 LEU 19 3HD2 LEU 19 -4.846 -0.034 -0.007
156 H VAL 20 H VAL 20 -6.065 -2.604 2.859
157 HA VAL 20 HA VAL 20 -8.168 -4.530 3.421
158 HB VAL 20 HB VAL 20 -5.992 -3.779 5.345
159 1HG1 VAL 20 1HG1 VAL 20 -6.306 -6.472 5.452
160 2HG1 VAL 20 2HG1 VAL 20 -7.934 -5.952 5.016
161 3HG1 VAL 20 3HG1 VAL 20 -7.166 -5.323 6.474
162 1HG2 VAL 20 1HG2 VAL 20 -5.689 -5.108 2.735
163 2HG2 VAL 20 2HG2 VAL 20 -4.926 -5.927 4.099
164 3HG2 VAL 20 3HG2 VAL 20 -4.500 -4.257 3.724
165 H LYS 21 H LYS 21 -9.187 -4.514 5.612
166 HA LYS 21 HA LYS 21 -10.358 -1.934 6.103
167 1HB LYS 21 2HB LYS 21 -10.752 -4.496 7.651
168 2HB LYS 21 1HB LYS 21 -11.802 -3.088 7.659
169 1HG LYS 21 2HG LYS 21 -12.990 -4.249 6.164
170 2HG LYS 21 1HG LYS 21 -11.774 -3.683 5.021
171 1HD LYS 21 2HD LYS 21 -12.144 -6.092 4.809
172 2HD LYS 21 1HD LYS 21 -10.501 -5.742 5.336
173 1HE LYS 21 2HE LYS 21 -11.758 -7.638 6.512
174 2HE LYS 21 1HE LYS 21 -10.915 -6.459 7.515
175 1HZ LYS 21 1HZ LYS 21 -13.378 -7.161 8.013
176 2HZ LYS 21 2HZ LYS 21 -13.729 -5.963 6.871
177 3HZ LYS 21 3HZ LYS 21 -12.857 -5.571 8.266
178 H GLY 22 H GLY 22 -8.054 -4.046 7.719
179 1HA GLY 22 2HA GLY 22 -6.952 -1.894 9.203
180 2HA GLY 22 1HA GLY 22 -7.964 -2.891 10.230
181 H SER 23 H SER 23 -5.377 -3.199 7.853
182 HA SER 23 HA SER 23 -4.068 -5.120 9.615
183 1HB SER 23 2HB SER 23 -5.209 -5.732 7.096
184 2HB SER 23 1HB SER 23 -3.455 -5.797 6.911
185 HG SER 23 HG SER 23 -5.143 -7.338 8.528
186 H ARG 24 H ARG 24 -1.790 -5.607 8.211
187 HA ARG 24 HA ARG 24 -0.627 -2.929 7.876
188 1HB ARG 24 2HB ARG 24 0.618 -5.357 9.105
189 2HB ARG 24 1HB ARG 24 1.479 -3.867 8.777
190 1HG ARG 24 2HG ARG 24 -0.982 -3.559 10.345
191 2HG ARG 24 1HG ARG 24 0.303 -4.481 11.136
192 1HD ARG 24 2HD ARG 24 1.724 -2.410 10.142
193 2HD ARG 24 1HD ARG 24 0.174 -1.621 10.428
194 HE ARG 24 HE ARG 24 0.880 -3.110 12.702
195 1HH1 ARG 24 1HH1 ARG 24 1.860 -0.248 10.962
196 2HH1 ARG 24 2HH1 ARG 24 2.489 0.543 12.368
197 1HH2 ARG 24 1HH2 ARG 24 1.707 -2.070 14.553
198 2HH2 ARG 24 2HH2 ARG 24 2.401 -0.490 14.407
199 H VAL 25 H VAL 25 0.749 -2.564 6.219
200 HA VAL 25 HA VAL 25 1.438 -4.802 4.441
201 HB VAL 25 HB VAL 25 0.403 -2.142 3.458
202 1HG1 VAL 25 1HG1 VAL 25 1.330 -4.648 2.128
203 2HG1 VAL 25 2HG1 VAL 25 1.757 -2.975 1.779
204 3HG1 VAL 25 3HG1 VAL 25 0.167 -3.593 1.330
205 1HG2 VAL 25 1HG2 VAL 25 -1.041 -4.789 3.509
206 2HG2 VAL 25 2HG2 VAL 25 -1.651 -3.272 2.849
207 3HG2 VAL 25 3HG2 VAL 25 -1.372 -3.430 4.583
208 H THR 26 H THR 26 3.283 -4.293 2.988
209 HA THR 26 HA THR 26 5.071 -2.391 4.313
210 HB THR 26 HB THR 26 6.880 -3.538 3.233
211 HG1 THR 26 1HG THR 26 5.465 -3.909 1.305
212 1HG2 THR 26 1HG2 THR 26 6.559 -4.882 5.014
213 2HG2 THR 26 2HG2 THR 26 6.136 -6.038 3.752
214 3HG2 THR 26 3HG2 THR 26 4.866 -5.179 4.623
215 H VAL 27 H VAL 27 4.497 -0.431 3.526
216 HA VAL 27 HA VAL 27 4.520 -0.057 0.617
217 HB VAL 27 HB VAL 27 2.496 0.720 1.746
218 1HG1 VAL 27 1HG1 VAL 27 4.171 1.496 3.774
219 2HG1 VAL 27 2HG1 VAL 27 2.467 1.921 3.626
220 3HG1 VAL 27 3HG1 VAL 27 3.707 3.031 3.042
221 1HG2 VAL 27 1HG2 VAL 27 3.584 3.336 1.078
222 2HG2 VAL 27 2HG2 VAL 27 2.302 2.409 0.298
223 3HG2 VAL 27 3HG2 VAL 27 3.988 2.100 -0.113
224 H MET 28 H MET 28 6.608 0.318 0.000
225 HA MET 28 HA MET 28 7.740 2.831 0.661
226 1HB MET 28 2HB MET 28 9.918 1.828 1.567
227 2HB MET 28 1HB MET 28 8.542 1.932 2.665
228 1HG MET 28 2HG MET 28 8.380 -0.549 1.341
229 2HG MET 28 1HG MET 28 10.045 -0.352 1.879
230 1HE MET 28 1HE MET 28 10.848 -0.103 4.109
231 2HE MET 28 2HE MET 28 10.453 -1.821 4.173
232 3HE MET 28 3HE MET 28 10.046 -0.772 5.530
233 H GLU 29 H GLU 29 8.039 3.287 -1.420
234 HA GLU 29 HA GLU 29 10.122 1.806 -2.833
235 1HB GLU 29 2HB GLU 29 8.027 0.895 -3.702
236 2HB GLU 29 1HB GLU 29 7.446 2.517 -4.054
237 1HG GLU 29 2HG GLU 29 8.213 1.438 -6.072
238 2HG GLU 29 1HG GLU 29 9.253 2.803 -5.681
239 H LYS 30 H LYS 30 11.018 3.084 -4.670
240 HA LYS 30 HA LYS 30 10.483 5.942 -4.431
241 1HB LYS 30 2HB LYS 30 13.174 4.599 -4.291
242 2HB LYS 30 1HB LYS 30 12.999 6.292 -4.734
243 1HG LYS 30 2HG LYS 30 12.530 6.937 -2.626
244 2HG LYS 30 1HG LYS 30 11.624 5.464 -2.263
245 1HD LYS 30 2HD LYS 30 13.975 4.334 -2.373
246 2HD LYS 30 1HD LYS 30 14.566 5.975 -2.101
247 1HE LYS 30 2HE LYS 30 12.417 5.406 -0.292
248 2HE LYS 30 1HE LYS 30 13.627 4.129 -0.193
249 1HZ LYS 30 1HZ LYS 30 13.826 6.936 0.547
250 2HZ LYS 30 2HZ LYS 30 15.197 6.258 -0.174
251 3HZ LYS 30 3HZ LYS 30 14.561 5.577 1.239
252 H CYS 31 H CYS 31 9.420 6.056 -6.341
253 HA CYS 31 HA CYS 31 10.845 5.185 -8.759
254 1HB CYS 31 2HB CYS 31 8.504 4.305 -8.264
255 2HB CYS 31 1HB CYS 31 7.929 5.937 -8.585
256 HG CYS 31 HG CYS 31 7.893 4.248 -10.715
257 H SER 32 H SER 32 10.733 6.575 -10.648
258 HA SER 32 HA SER 32 11.146 9.344 -9.930
259 1HB SER 32 2HB SER 32 12.415 7.832 -11.713
260 2HB SER 32 1HB SER 32 11.151 8.450 -12.777
261 HG SER 32 HG SER 32 13.354 9.663 -12.128
262 H ASP 33 H ASP 33 8.485 7.516 -10.717
263 HA ASP 33 HA ASP 33 7.096 9.803 -11.934
264 1HB ASP 33 2HB ASP 33 7.043 6.957 -12.475
265 2HB ASP 33 1HB ASP 33 5.425 7.559 -12.109
266 H GLY 34 H GLY 34 4.661 9.749 -11.372
267 1HA GLY 34 2HA GLY 34 4.417 10.283 -8.613
268 2HA GLY 34 1HA GLY 34 3.089 10.202 -9.764
269 H TRP 35 H TRP 35 3.735 7.404 -10.494
270 HA TRP 35 HA TRP 35 2.213 6.162 -8.387
271 1HB TRP 35 2HB TRP 35 2.056 4.256 -9.828
272 2HB TRP 35 1HB TRP 35 1.860 5.690 -10.829
273 HD1 TRP 35 HD TRP 35 3.936 6.322 -12.469
274 HE1 TRP 35 1HE TRP 35 5.759 4.832 -13.512
275 HE3 TRP 35 3HE TRP 35 3.482 2.237 -9.429
276 HZ2 TRP 35 2HZ TRP 35 6.856 2.262 -13.100
277 HZ3 TRP 35 3HZ TRP 35 4.953 0.305 -9.821
278 HH2 TRP 35 HH TRP 35 6.605 0.318 -11.619
279 H TRP 36 H TRP 36 2.957 4.997 -6.746
280 HA TRP 36 HA TRP 36 5.798 4.295 -6.718
281 1HB TRP 36 2HB TRP 36 3.936 5.320 -4.673
282 2HB TRP 36 1HB TRP 36 5.044 4.072 -4.121
283 HD1 TRP 36 HD TRP 36 7.034 5.757 -6.585
284 HE1 TRP 36 1HE TRP 36 8.505 7.598 -5.549
285 HE3 TRP 36 3HE TRP 36 4.693 6.226 -2.062
286 HZ2 TRP 36 2HZ TRP 36 8.652 9.058 -3.140
287 HZ3 TRP 36 3HZ TRP 36 5.563 7.867 -0.449
288 HH2 TRP 36 HH TRP 36 7.501 9.253 -0.978
289 H ARG 37 H ARG 37 6.460 2.287 -5.915
290 HA ARG 37 HA ARG 37 4.470 0.179 -6.231
291 1HB ARG 37 2HB ARG 37 6.850 0.198 -7.306
292 2HB ARG 37 1HB ARG 37 7.366 -0.346 -5.714
293 1HG ARG 37 2HG ARG 37 7.000 -2.384 -6.559
294 2HG ARG 37 1HG ARG 37 5.328 -2.038 -6.147
295 1HD ARG 37 2HD ARG 37 4.700 -2.012 -8.284
296 2HD ARG 37 1HD ARG 37 6.044 -0.964 -8.741
297 HE ARG 37 HE ARG 37 7.193 -2.809 -9.454
298 1HH1 ARG 37 1HH1 ARG 37 4.543 -3.850 -7.436
299 2HH1 ARG 37 2HH1 ARG 37 4.766 -5.529 -7.793
300 1HH2 ARG 37 1HH2 ARG 37 7.488 -5.018 -9.925
301 2HH2 ARG 37 2HH2 ARG 37 6.438 -6.193 -9.205
302 H GLY 38 H GLY 38 4.197 -1.478 -4.703
303 1HA GLY 38 2HA GLY 38 5.314 -1.011 -2.034
304 2HA GLY 38 1HA GLY 38 3.563 -0.964 -2.201
305 H SER 39 H SER 39 5.006 -2.766 -0.550
306 HA SER 39 HA SER 39 4.373 -5.297 -1.900
307 1HB SER 39 2HB SER 39 6.639 -4.624 -0.037
308 2HB SER 39 1HB SER 39 6.070 -6.288 -0.219
309 HG SER 39 HG SER 39 7.209 -4.588 -2.167
310 H TYR 40 H TYR 40 3.477 -6.970 -0.627
311 HA TYR 40 HA TYR 40 2.435 -6.132 1.977
312 1HB TYR 40 2HB TYR 40 0.459 -7.705 0.573
313 2HB TYR 40 1HB TYR 40 0.290 -6.138 1.348
314 HD1 TYR 40 1HD TYR 40 -0.222 -7.763 -1.620
315 HD2 TYR 40 2HD TYR 40 1.559 -4.191 -0.159
316 HE1 TYR 40 1HE TYR 40 -0.526 -6.720 -3.821
317 HE2 TYR 40 2HE TYR 40 1.262 -3.138 -2.357
318 HH TYR 40 HH TYR 40 -0.715 -3.941 -4.529
319 H ASN 41 H ASN 41 2.354 -7.684 3.494
320 HA ASN 41 HA ASN 41 3.844 -10.038 3.168
321 1HB ASN 41 2HB ASN 41 2.378 -10.666 5.353
322 2HB ASN 41 1HB ASN 41 3.777 -9.597 5.399
323 1HD2 ASN 41 1HD2 ASN 41 0.573 -8.899 4.103
324 2HD2 ASN 41 2HD2 ASN 41 0.205 -7.631 5.217
325 H GLY 42 H GLY 42 3.036 -11.092 1.345
326 1HA GLY 42 2HA GLY 42 1.783 -13.297 1.234
327 2HA GLY 42 1HA GLY 42 0.384 -12.307 1.628
328 H GLN 43 H GLN 43 1.830 -10.157 -0.083
329 HA GLN 43 HA GLN 43 1.800 -11.105 -2.749
330 1HB GLN 43 2HB GLN 43 -0.261 -9.381 -3.167
331 2HB GLN 43 1HB GLN 43 -0.438 -11.130 -3.045
332 1HG GLN 43 2HG GLN 43 -1.109 -10.987 -0.783
333 2HG GLN 43 1HG GLN 43 -0.670 -9.281 -0.690
334 1HE2 GLN 43 1HE2 GLN 43 -3.043 -11.581 -1.575
335 2HE2 GLN 43 2HE2 GLN 43 -4.275 -10.462 -2.054
336 H ILE 44 H ILE 44 2.183 -9.387 -4.292
337 HA ILE 44 HA ILE 44 3.008 -6.844 -3.083
338 HB ILE 44 HB ILE 44 4.666 -8.782 -4.622
339 1HG1 ILE 44 2HG1 ILE 44 6.395 -7.815 -3.037
340 2HG1 ILE 44 1HG1 ILE 44 5.073 -6.900 -2.317
341 1HG2 ILE 44 1HG2 ILE 44 5.062 -5.794 -4.751
342 2HG2 ILE 44 2HG2 ILE 44 4.733 -6.875 -6.105
343 3HG2 ILE 44 3HG2 ILE 44 6.262 -6.990 -5.236
344 1HD1 ILE 44 1HD1 ILE 44 4.420 -9.700 -2.517
345 2HD1 ILE 44 2HD1 ILE 44 4.420 -8.634 -1.111
346 3HD1 ILE 44 3HD1 ILE 44 5.910 -9.436 -1.611
347 H GLY 45 H GLY 45 3.240 -5.073 -4.627
348 1HA GLY 45 2HA GLY 45 2.660 -5.137 -7.325
349 2HA GLY 45 1HA GLY 45 1.096 -5.067 -6.524
350 H TRP 46 H TRP 46 0.299 -3.126 -6.131
351 HA TRP 46 HA TRP 46 2.033 -0.788 -6.463
352 1HB TRP 46 2HB TRP 46 -0.162 -1.192 -7.763
353 2HB TRP 46 1HB TRP 46 -0.972 -0.751 -6.263
354 HD1 TRP 46 HD TRP 46 2.181 1.037 -7.564
355 HE1 TRP 46 1HE TRP 46 1.568 3.487 -8.066
356 HE3 TRP 46 3HE TRP 46 -2.866 0.788 -6.784
357 HZ2 TRP 46 2HZ TRP 46 -0.750 5.098 -8.127
358 HZ3 TRP 46 3HZ TRP 46 -4.209 2.828 -7.087
359 HH2 TRP 46 HH TRP 46 -3.172 4.938 -7.743
360 H PHE 47 H PHE 47 2.153 0.861 -4.958
361 HA PHE 47 HA PHE 47 1.982 0.115 -2.251
362 1HB PHE 47 2HB PHE 47 2.838 2.255 -1.734
363 2HB PHE 47 1HB PHE 47 3.545 1.826 -3.288
364 HD1 PHE 47 1HD PHE 47 2.960 4.572 -1.793
365 HD2 PHE 47 2HD PHE 47 1.186 2.489 -5.053
366 HE1 PHE 47 1HE PHE 47 2.166 6.707 -2.721
367 HE2 PHE 47 2HE PHE 47 0.391 4.621 -5.984
368 HZ PHE 47 HZ PHE 47 0.879 6.733 -4.820
369 HA PRO 48 HA PRO 48 -2.279 1.237 -1.560
370 1HB PRO 48 2HB PRO 48 -2.535 0.205 0.877
371 2HB PRO 48 1HB PRO 48 -2.269 -0.845 -0.518
372 1HG PRO 48 2HG PRO 48 -0.340 0.041 1.575
373 2HG PRO 48 1HG PRO 48 -0.487 -1.535 0.780
374 1HD PRO 48 2HD PRO 48 1.330 0.481 0.101
375 2HD PRO 48 1HD PRO 48 0.896 -0.910 -0.910
376 H SER 49 H SER 49 0.244 2.925 -0.557
377 HA SER 49 HA SER 49 -0.180 4.153 1.814
378 1HB SER 49 2HB SER 49 1.236 4.727 -0.577
379 2HB SER 49 1HB SER 49 0.498 6.222 0.007
380 HG SER 49 HG SER 49 1.452 5.725 2.071
381 H ASN 50 H ASN 50 -2.370 4.332 -0.840
382 HA ASN 50 HA ASN 50 -3.499 6.763 -0.817
383 1HB ASN 50 2HB ASN 50 -4.544 4.032 -1.135
384 2HB ASN 50 1HB ASN 50 -5.746 5.287 -0.867
385 1HD2 ASN 50 1HD2 ASN 50 -6.318 6.546 -2.509
386 2HD2 ASN 50 2HD2 ASN 50 -5.568 6.547 -4.062
387 H TYR 51 H TYR 51 -3.738 4.377 1.729
388 HA TYR 51 HA TYR 51 -4.505 6.418 3.591
389 1HB TYR 51 2HB TYR 51 -6.407 4.095 3.192
390 2HB TYR 51 1HB TYR 51 -6.568 5.396 4.370
391 HD1 TYR 51 1HD TYR 51 -7.083 7.707 3.581
392 HD2 TYR 51 2HD TYR 51 -7.149 4.363 0.952
393 HE1 TYR 51 1HE TYR 51 -8.395 9.013 1.961
394 HE2 TYR 51 2HE TYR 51 -8.459 5.661 -0.675
395 HH TYR 51 HH TYR 51 -8.660 8.750 -0.831
396 H VAL 52 H VAL 52 -2.243 5.378 3.854
397 HA VAL 52 HA VAL 52 -2.519 3.395 5.976
398 HB VAL 52 HB VAL 52 -0.997 1.883 5.170
399 1HG1 VAL 52 1HG1 VAL 52 -1.420 1.665 2.652
400 2HG1 VAL 52 2HG1 VAL 52 -2.445 3.086 2.844
401 3HG1 VAL 52 3HG1 VAL 52 -2.809 1.610 3.736
402 1HG2 VAL 52 1HG2 VAL 52 0.196 4.209 3.752
403 2HG2 VAL 52 2HG2 VAL 52 0.462 2.600 3.079
404 3HG2 VAL 52 3HG2 VAL 52 0.970 2.962 4.729
405 H LEU 53 H LEU 53 -0.554 3.176 7.316
406 HA LEU 53 HA LEU 53 0.731 5.781 7.667
407 1HB LEU 53 2HB LEU 53 -0.512 4.857 9.574
408 2HB LEU 53 1HB LEU 53 0.513 3.444 9.533
409 HG LEU 53 HG LEU 53 2.427 4.784 10.129
410 1HD1 LEU 53 1HD1 LEU 53 1.936 7.183 10.857
411 2HD1 LEU 53 2HD1 LEU 53 0.478 7.038 9.878
412 3HD1 LEU 53 3HD1 LEU 53 2.065 6.857 9.129
413 1HD2 LEU 53 1HD2 LEU 53 1.940 4.956 12.365
414 2HD2 LEU 53 2HD2 LEU 53 0.627 3.914 11.813
415 3HD2 LEU 53 3HD2 LEU 53 0.340 5.636 12.070
416 H GLU 54 H GLU 54 2.748 5.935 6.856
417 HA GLU 54 HA GLU 54 4.299 3.462 6.560
418 1HB GLU 54 2HB GLU 54 3.820 4.777 4.517
419 2HB GLU 54 1HB GLU 54 4.733 6.116 5.198
420 1HG GLU 54 2HG GLU 54 6.304 3.721 5.279
421 2HG GLU 54 1HG GLU 54 5.686 3.990 3.646
422 H GLU 55 H GLU 55 6.233 3.177 7.466
423 HA GLU 55 HA GLU 55 7.433 5.397 8.944
424 1HB GLU 55 2HB GLU 55 7.714 2.625 9.980
425 2HB GLU 55 1HB GLU 55 7.695 4.143 10.861
426 1HG GLU 55 2HG GLU 55 5.180 4.067 9.909
427 2HG GLU 55 1HG GLU 55 5.517 2.352 10.117
428 H VAL 56 H VAL 56 9.369 5.826 8.080
429 HA VAL 56 HA VAL 56 10.736 3.842 6.501
430 HB VAL 56 HB VAL 56 11.831 6.560 7.170
431 1HG1 VAL 56 1HG1 VAL 56 12.856 6.334 4.939
432 2HG1 VAL 56 2HG1 VAL 56 12.138 4.729 4.791
433 3HG1 VAL 56 3HG1 VAL 56 13.345 5.044 6.038
434 1HG2 VAL 56 1HG2 VAL 56 9.629 7.047 6.426
435 2HG2 VAL 56 2HG2 VAL 56 9.725 5.846 5.139
436 3HG2 VAL 56 3HG2 VAL 56 10.696 7.316 5.048
437 H ASP 57 H ASP 57 11.144 2.355 8.270
438 HA ASP 57 HA ASP 57 12.757 3.014 10.485
439 1HB ASP 57 2HB ASP 57 11.298 0.978 10.283
440 2HB ASP 57 1HB ASP 57 12.494 0.299 9.184
Start of MODEL 2
1 1H ILE 1 1HT ILE 1 10.049 -2.785 7.744
2 2H ILE 1 2HT ILE 1 9.355 -4.085 8.622
3 3H ILE 1 3HT ILE 1 10.579 -3.119 9.340
4 HA ILE 1 HA ILE 1 8.365 -2.636 10.145
5 HB ILE 1 HB ILE 1 8.526 -0.086 9.342
6 1HG1 ILE 1 2HG1 ILE 1 11.024 0.355 9.008
7 2HG1 ILE 1 1HG1 ILE 1 11.162 -1.352 8.603
8 1HG2 ILE 1 1HG2 ILE 1 10.724 -1.056 11.103
9 2HG2 ILE 1 2HG2 ILE 1 9.048 -1.323 11.584
10 3HG2 ILE 1 3HG2 ILE 1 9.636 0.317 11.307
11 1HD1 ILE 1 1HD1 ILE 1 9.219 0.420 7.181
12 2HD1 ILE 1 2HD1 ILE 1 9.918 -1.112 6.657
13 3HD1 ILE 1 3HD1 ILE 1 10.915 0.342 6.703
14 HA PRO 2 HA PRO 2 5.412 -2.637 6.751
15 1HB PRO 2 2HB PRO 2 3.268 -3.355 8.161
16 2HB PRO 2 1HB PRO 2 4.571 -4.505 7.847
17 1HG PRO 2 2HG PRO 2 3.965 -2.959 10.328
18 2HG PRO 2 1HG PRO 2 4.525 -4.632 10.158
19 1HD PRO 2 2HD PRO 2 6.140 -2.439 10.737
20 2HD PRO 2 1HD PRO 2 6.710 -3.999 10.115
21 H ALA 3 H ALA 3 2.856 -1.857 6.987
22 HA ALA 3 HA ALA 3 2.917 0.843 8.104
23 1HB ALA 3 1HB ALA 3 1.277 0.977 5.844
24 2HB ALA 3 2HB ALA 3 2.717 0.096 5.336
25 3HB ALA 3 3HB ALA 3 2.873 1.698 6.053
26 H PHE 4 H PHE 4 0.782 1.744 8.580
27 HA PHE 4 HA PHE 4 -1.154 -0.350 9.208
28 1HB PHE 4 2HB PHE 4 -0.007 1.419 10.906
29 2HB PHE 4 1HB PHE 4 -1.484 2.273 10.470
30 HD1 PHE 4 1HD PHE 4 -3.284 -0.111 10.121
31 HD2 PHE 4 2HD PHE 4 -0.458 0.888 13.143
32 HE1 PHE 4 1HE PHE 4 -4.549 -1.459 11.745
33 HE2 PHE 4 2HE PHE 4 -1.717 -0.459 14.771
34 HZ PHE 4 HZ PHE 4 -3.765 -1.635 14.073
35 H VAL 5 H VAL 5 -2.856 -0.455 7.915
36 HA VAL 5 HA VAL 5 -3.608 1.781 6.254
37 HB VAL 5 HB VAL 5 -4.952 -0.906 6.540
38 1HG1 VAL 5 1HG1 VAL 5 -5.515 -0.146 4.045
39 2HG1 VAL 5 2HG1 VAL 5 -5.389 1.446 4.793
40 3HG1 VAL 5 3HG1 VAL 5 -6.542 0.266 5.418
41 1HG2 VAL 5 1HG2 VAL 5 -2.456 -0.729 5.775
42 2HG2 VAL 5 2HG2 VAL 5 -3.172 -0.182 4.260
43 3HG2 VAL 5 3HG2 VAL 5 -3.584 -1.771 4.906
44 H LYS 6 H LYS 6 -5.611 2.831 6.240
45 HA LYS 6 HA LYS 6 -7.006 2.780 8.823
46 1HB LYS 6 2HB LYS 6 -7.125 4.968 6.755
47 2HB LYS 6 1HB LYS 6 -7.653 5.047 8.429
48 1HG LYS 6 2HG LYS 6 -5.603 5.528 9.179
49 2HG LYS 6 1HG LYS 6 -4.831 4.357 8.109
50 1HD LYS 6 2HD LYS 6 -4.123 6.633 7.576
51 2HD LYS 6 1HD LYS 6 -5.037 5.927 6.241
52 1HE LYS 6 2HE LYS 6 -7.067 7.096 7.140
53 2HE LYS 6 1HE LYS 6 -6.006 7.927 8.277
54 1HZ LYS 6 1HZ LYS 6 -4.956 9.080 6.574
55 2HZ LYS 6 2HZ LYS 6 -6.580 9.094 6.100
56 3HZ LYS 6 3HZ LYS 6 -5.496 8.019 5.370
57 H PHE 7 H PHE 7 -7.529 2.869 5.352
58 HA PHE 7 HA PHE 7 -10.245 1.871 5.792
59 1HB PHE 7 2HB PHE 7 -9.523 4.276 4.538
60 2HB PHE 7 1HB PHE 7 -9.992 3.177 3.242
61 HD1 PHE 7 1HD PHE 7 -11.194 4.170 6.636
62 HD2 PHE 7 2HD PHE 7 -12.191 3.195 2.614
63 HE1 PHE 7 1HE PHE 7 -13.566 4.606 7.122
64 HE2 PHE 7 2HE PHE 7 -14.565 3.631 3.093
65 HZ PHE 7 HZ PHE 7 -15.255 4.337 5.349
66 H ALA 8 H ALA 8 -11.094 0.485 4.105
67 HA ALA 8 HA ALA 8 -8.959 -1.022 2.794
68 1HB ALA 8 1HB ALA 8 -10.051 -2.961 3.222
69 2HB ALA 8 2HB ALA 8 -11.645 -2.216 3.113
70 3HB ALA 8 3HB ALA 8 -10.667 -1.999 4.563
71 H TYR 9 H TYR 9 -9.100 -1.596 0.652
72 HA TYR 9 HA TYR 9 -11.376 -0.534 -0.876
73 1HB TYR 9 2HB TYR 9 -8.984 0.682 -0.952
74 2HB TYR 9 1HB TYR 9 -8.694 -0.565 -2.166
75 HD1 TYR 9 1HD TYR 9 -10.170 2.622 -1.498
76 HD2 TYR 9 2HD TYR 9 -10.334 -0.726 -4.118
77 HE1 TYR 9 1HE TYR 9 -11.332 3.998 -3.173
78 HE2 TYR 9 2HE TYR 9 -11.495 0.642 -5.802
79 HH TYR 9 HH TYR 9 -12.962 2.750 -5.769
80 H VAL 10 H VAL 10 -12.373 -2.122 -1.947
81 HA VAL 10 HA VAL 10 -11.026 -4.655 -2.323
82 HB VAL 10 HB VAL 10 -13.221 -5.488 -3.080
83 1HG1 VAL 10 1HG1 VAL 10 -13.158 -5.904 -0.864
84 2HG1 VAL 10 2HG1 VAL 10 -14.419 -4.672 -0.807
85 3HG1 VAL 10 3HG1 VAL 10 -12.745 -4.240 -0.454
86 1HG2 VAL 10 1HG2 VAL 10 -13.772 -2.648 -3.263
87 2HG2 VAL 10 2HG2 VAL 10 -15.000 -3.497 -2.323
88 3HG2 VAL 10 3HG2 VAL 10 -14.637 -4.013 -3.970
89 H ALA 11 H ALA 11 -9.752 -4.808 -4.043
90 HA ALA 11 HA ALA 11 -10.505 -5.053 -6.628
91 1HB ALA 11 1HB ALA 11 -9.674 -2.756 -7.544
92 2HB ALA 11 2HB ALA 11 -10.149 -2.172 -5.949
93 3HB ALA 11 3HB ALA 11 -11.341 -2.942 -6.997
94 H GLU 12 H GLU 12 -8.809 -6.341 -7.130
95 HA GLU 12 HA GLU 12 -6.130 -5.165 -6.753
96 1HB GLU 12 2HB GLU 12 -6.699 -8.126 -6.677
97 2HB GLU 12 1HB GLU 12 -5.211 -7.301 -6.236
98 1HG GLU 12 2HG GLU 12 -5.900 -6.935 -4.154
99 2HG GLU 12 1HG GLU 12 -7.493 -6.398 -4.684
100 H ARG 13 H ARG 13 -5.344 -4.657 -8.620
101 HA ARG 13 HA ARG 13 -5.115 -6.512 -10.771
102 1HB ARG 13 2HB ARG 13 -7.178 -5.824 -11.576
103 2HB ARG 13 1HB ARG 13 -7.026 -4.223 -10.868
104 1HG ARG 13 2HG ARG 13 -5.123 -4.785 -13.026
105 2HG ARG 13 1HG ARG 13 -6.820 -4.769 -13.506
106 1HD ARG 13 2HD ARG 13 -6.157 -2.576 -11.724
107 2HD ARG 13 1HD ARG 13 -5.176 -2.566 -13.187
108 HE ARG 13 HE ARG 13 -7.637 -2.913 -14.181
109 1HH1 ARG 13 1HH1 ARG 13 -6.397 -0.648 -11.831
110 2HH1 ARG 13 2HH1 ARG 13 -7.542 0.587 -12.235
111 1HH2 ARG 13 1HH2 ARG 13 -9.139 -1.288 -14.713
112 2HH2 ARG 13 2HH2 ARG 13 -9.097 0.225 -13.871
113 H GLU 14 H GLU 14 -3.536 -5.702 -12.373
114 HA GLU 14 HA GLU 14 -1.499 -4.147 -11.177
115 1HB GLU 14 2HB GLU 14 -0.578 -4.064 -13.546
116 2HB GLU 14 1HB GLU 14 -0.853 -5.673 -12.887
117 1HG GLU 14 2HG GLU 14 -3.245 -5.000 -14.136
118 2HG GLU 14 1HG GLU 14 -1.984 -4.417 -15.222
119 H ASP 15 H ASP 15 -1.917 -2.079 -10.614
120 HA ASP 15 HA ASP 15 -1.737 0.160 -11.763
121 1HB ASP 15 2HB ASP 15 -2.932 -0.330 -13.774
122 2HB ASP 15 1HB ASP 15 -4.363 -0.826 -12.872
123 H GLU 16 H GLU 16 -4.524 -1.432 -10.275
124 HA GLU 16 HA GLU 16 -5.003 0.945 -8.660
125 1HB GLU 16 2HB GLU 16 -7.166 0.393 -8.847
126 2HB GLU 16 1HB GLU 16 -6.693 -0.931 -9.892
127 1HG GLU 16 2HG GLU 16 -6.780 -1.219 -6.912
128 2HG GLU 16 1HG GLU 16 -8.206 -1.412 -7.926
129 H LEU 17 H LEU 17 -5.113 0.844 -6.381
130 HA LEU 17 HA LEU 17 -3.539 -1.370 -5.263
131 1HB LEU 17 2HB LEU 17 -2.974 0.257 -3.427
132 2HB LEU 17 1HB LEU 17 -2.309 0.632 -5.008
133 HG LEU 17 HG LEU 17 -4.603 2.081 -5.088
134 1HD1 LEU 17 1HD1 LEU 17 -4.650 1.275 -2.512
135 2HD1 LEU 17 2HD1 LEU 17 -5.355 2.782 -3.093
136 3HD1 LEU 17 3HD1 LEU 17 -3.748 2.783 -2.368
137 1HD2 LEU 17 1HD2 LEU 17 -3.164 3.774 -5.328
138 2HD2 LEU 17 2HD2 LEU 17 -1.901 2.564 -5.105
139 3HD2 LEU 17 3HD2 LEU 17 -2.460 3.519 -3.731
140 H SER 18 H SER 18 -4.576 -2.722 -3.963
141 HA SER 18 HA SER 18 -7.192 -2.051 -2.943
142 1HB SER 18 2HB SER 18 -7.539 -4.316 -2.660
143 2HB SER 18 1HB SER 18 -6.330 -4.342 -3.949
144 HG SER 18 HG SER 18 -5.354 -5.620 -2.568
145 H LEU 19 H LEU 19 -7.780 -2.026 -0.751
146 HA LEU 19 HA LEU 19 -5.531 -1.872 1.146
147 1HB LEU 19 2HB LEU 19 -7.976 -0.159 1.419
148 2HB LEU 19 1HB LEU 19 -6.400 0.043 2.169
149 HG LEU 19 HG LEU 19 -7.005 0.440 -0.756
150 1HD1 LEU 19 1HD1 LEU 19 -7.019 2.238 1.581
151 2HD1 LEU 19 2HD1 LEU 19 -7.904 2.345 0.060
152 3HD1 LEU 19 3HD1 LEU 19 -6.214 2.844 0.134
153 1HD2 LEU 19 1HD2 LEU 19 -4.519 0.326 0.820
154 2HD2 LEU 19 2HD2 LEU 19 -4.647 1.648 -0.341
155 3HD2 LEU 19 3HD2 LEU 19 -4.802 -0.021 -0.886
156 H VAL 20 H VAL 20 -5.955 -2.442 3.298
157 HA VAL 20 HA VAL 20 -8.154 -4.355 3.577
158 HB VAL 20 HB VAL 20 -6.031 -3.955 5.651
159 1HG1 VAL 20 1HG1 VAL 20 -7.284 -5.575 6.548
160 2HG1 VAL 20 2HG1 VAL 20 -6.526 -6.638 5.362
161 3HG1 VAL 20 3HG1 VAL 20 -8.098 -5.916 5.020
162 1HG2 VAL 20 1HG2 VAL 20 -4.710 -5.734 4.461
163 2HG2 VAL 20 2HG2 VAL 20 -4.713 -4.151 3.681
164 3HG2 VAL 20 3HG2 VAL 20 -5.731 -5.447 3.052
165 H LYS 21 H LYS 21 -9.296 -4.462 5.674
166 HA LYS 21 HA LYS 21 -10.247 -1.843 6.412
167 1HB LYS 21 2HB LYS 21 -11.022 -4.586 7.415
168 2HB LYS 21 1HB LYS 21 -11.849 -3.092 7.829
169 1HG LYS 21 2HG LYS 21 -13.149 -4.063 6.151
170 2HG LYS 21 1HG LYS 21 -12.241 -2.791 5.338
171 1HD LYS 21 2HD LYS 21 -12.334 -4.920 4.063
172 2HD LYS 21 1HD LYS 21 -10.696 -4.400 4.432
173 1HE LYS 21 2HE LYS 21 -10.290 -6.193 5.729
174 2HE LYS 21 1HE LYS 21 -11.899 -6.154 6.449
175 1HZ LYS 21 1HZ LYS 21 -11.094 -8.047 4.774
176 2HZ LYS 21 2HZ LYS 21 -11.768 -6.965 3.662
177 3HZ LYS 21 3HZ LYS 21 -12.712 -7.577 4.925
178 H GLY 22 H GLY 22 -8.253 -4.344 7.859
179 1HA GLY 22 2HA GLY 22 -7.288 -2.475 9.812
180 2HA GLY 22 1HA GLY 22 -8.263 -3.754 10.504
181 H SER 23 H SER 23 -5.622 -3.390 8.190
182 HA SER 23 HA SER 23 -4.120 -5.412 9.637
183 1HB SER 23 2HB SER 23 -5.200 -5.708 6.945
184 2HB SER 23 1HB SER 23 -3.472 -6.042 7.047
185 HG SER 23 HG SER 23 -4.132 -7.398 8.935
186 H ARG 24 H ARG 24 -1.847 -5.599 8.334
187 HA ARG 24 HA ARG 24 -0.960 -2.827 7.930
188 1HB ARG 24 2HB ARG 24 0.578 -5.070 9.180
189 2HB ARG 24 1HB ARG 24 1.193 -3.453 8.907
190 1HG ARG 24 2HG ARG 24 -1.297 -3.469 10.405
191 2HG ARG 24 1HG ARG 24 -0.008 -4.378 11.203
192 1HD ARG 24 2HD ARG 24 1.372 -2.198 10.472
193 2HD ARG 24 1HD ARG 24 -0.230 -1.482 10.642
194 HE ARG 24 HE ARG 24 -0.067 -1.739 12.911
195 1HH1 ARG 24 1HH1 ARG 24 2.393 -3.680 11.376
196 2HH1 ARG 24 2HH1 ARG 24 3.181 -4.081 12.865
197 1HH2 ARG 24 1HH2 ARG 24 0.970 -2.265 14.870
198 2HH2 ARG 24 2HH2 ARG 24 2.375 -3.278 14.847
199 H VAL 25 H VAL 25 -0.044 -2.376 6.054
200 HA VAL 25 HA VAL 25 0.860 -4.616 4.354
201 HB VAL 25 HB VAL 25 -0.049 -1.869 3.475
202 1HG1 VAL 25 1HG1 VAL 25 0.808 -4.322 1.979
203 2HG1 VAL 25 2HG1 VAL 25 1.415 -2.673 1.835
204 3HG1 VAL 25 3HG1 VAL 25 -0.194 -3.076 1.237
205 1HG2 VAL 25 1HG2 VAL 25 -2.026 -2.815 4.177
206 2HG2 VAL 25 2HG2 VAL 25 -1.505 -4.454 3.786
207 3HG2 VAL 25 3HG2 VAL 25 -1.964 -3.343 2.495
208 H THR 26 H THR 26 2.730 -4.067 2.866
209 HA THR 26 HA THR 26 4.580 -2.297 4.321
210 HB THR 26 HB THR 26 5.973 -4.049 4.218
211 HG1 THR 26 1HG THR 26 5.905 -3.304 1.545
212 1HG2 THR 26 1HG2 THR 26 4.064 -5.296 2.290
213 2HG2 THR 26 2HG2 THR 26 4.350 -5.715 3.976
214 3HG2 THR 26 3HG2 THR 26 5.582 -6.053 2.761
215 H VAL 27 H VAL 27 4.184 -0.322 3.418
216 HA VAL 27 HA VAL 27 4.405 -0.109 0.497
217 HB VAL 27 HB VAL 27 2.368 0.860 1.518
218 1HG1 VAL 27 1HG1 VAL 27 2.424 2.738 2.949
219 2HG1 VAL 27 2HG1 VAL 27 4.155 2.956 2.724
220 3HG1 VAL 27 3HG1 VAL 27 3.552 1.573 3.637
221 1HG2 VAL 27 1HG2 VAL 27 3.778 3.258 0.553
222 2HG2 VAL 27 2HG2 VAL 27 2.292 2.502 -0.024
223 3HG2 VAL 27 3HG2 VAL 27 3.860 1.846 -0.499
224 H MET 28 H MET 28 6.419 0.391 -0.225
225 HA MET 28 HA MET 28 7.707 2.733 0.724
226 1HB MET 28 2HB MET 28 9.751 1.722 1.615
227 2HB MET 28 1HB MET 28 8.335 1.290 2.573
228 1HG MET 28 2HG MET 28 8.638 -0.668 0.570
229 2HG MET 28 1HG MET 28 10.223 -0.409 1.297
230 1HE MET 28 1HE MET 28 10.002 -3.037 1.912
231 2HE MET 28 2HE MET 28 8.321 -3.149 1.391
232 3HE MET 28 3HE MET 28 8.781 -3.683 3.007
233 H GLU 29 H GLU 29 7.988 3.443 -1.271
234 HA GLU 29 HA GLU 29 10.014 2.127 -2.903
235 1HB GLU 29 2HB GLU 29 7.856 1.421 -3.869
236 2HB GLU 29 1HB GLU 29 7.382 3.107 -4.034
237 1HG GLU 29 2HG GLU 29 8.160 2.140 -6.145
238 2HG GLU 29 1HG GLU 29 9.159 3.493 -5.619
239 H LYS 30 H LYS 30 10.942 3.697 -4.532
240 HA LYS 30 HA LYS 30 10.359 6.464 -3.853
241 1HB LYS 30 2HB LYS 30 12.860 5.051 -3.258
242 2HB LYS 30 1HB LYS 30 13.074 6.592 -4.077
243 1HG LYS 30 2HG LYS 30 12.090 7.793 -2.342
244 2HG LYS 30 1HG LYS 30 11.313 6.357 -1.667
245 1HD LYS 30 2HD LYS 30 14.223 6.150 -1.778
246 2HD LYS 30 1HD LYS 30 13.659 7.492 -0.781
247 1HE LYS 30 2HE LYS 30 13.618 5.846 0.788
248 2HE LYS 30 1HE LYS 30 12.002 5.626 0.119
249 1HZ LYS 30 1HZ LYS 30 14.423 4.004 -0.348
250 2HZ LYS 30 2HZ LYS 30 13.135 3.975 -1.444
251 3HZ LYS 30 3HZ LYS 30 12.892 3.499 0.161
252 H CYS 31 H CYS 31 9.489 6.884 -5.791
253 HA CYS 31 HA CYS 31 11.194 6.581 -8.169
254 1HB CYS 31 2HB CYS 31 8.273 6.413 -7.720
255 2HB CYS 31 1HB CYS 31 8.762 7.283 -9.170
256 HG CYS 31 HG CYS 31 9.211 4.266 -8.667
257 H SER 32 H SER 32 11.210 8.443 -9.684
258 HA SER 32 HA SER 32 11.123 10.933 -8.155
259 1HB SER 32 2HB SER 32 13.173 10.690 -9.324
260 2HB SER 32 1HB SER 32 12.357 10.178 -10.803
261 HG SER 32 HG SER 32 11.973 12.742 -9.673
262 H ASP 33 H ASP 33 9.888 9.582 -11.204
263 HA ASP 33 HA ASP 33 7.533 11.262 -10.942
264 1HB ASP 33 2HB ASP 33 9.623 11.685 -12.978
265 2HB ASP 33 1HB ASP 33 7.975 11.619 -13.609
266 H GLY 34 H GLY 34 6.173 9.450 -10.765
267 1HA GLY 34 2HA GLY 34 5.062 8.331 -12.941
268 2HA GLY 34 1HA GLY 34 6.453 7.300 -12.649
269 H TRP 35 H TRP 35 5.296 5.536 -12.241
270 HA TRP 35 HA TRP 35 3.176 5.398 -10.321
271 1HB TRP 35 2HB TRP 35 3.196 2.998 -10.845
272 2HB TRP 35 1HB TRP 35 3.199 3.976 -12.307
273 HD1 TRP 35 HD TRP 35 6.578 4.403 -11.603
274 HE1 TRP 35 1HE TRP 35 8.077 2.564 -12.589
275 HE3 TRP 35 3HE TRP 35 3.031 0.817 -12.474
276 HZ2 TRP 35 2HZ TRP 35 7.808 -0.059 -13.596
277 HZ3 TRP 35 3HZ TRP 35 3.737 -1.328 -13.450
278 HH2 TRP 35 HH TRP 35 6.078 -1.756 -14.000
279 H TRP 36 H TRP 36 3.226 4.776 -8.243
280 HA TRP 36 HA TRP 36 5.819 4.201 -7.050
281 1HB TRP 36 2HB TRP 36 3.515 5.674 -6.202
282 2HB TRP 36 1HB TRP 36 3.812 4.371 -5.056
283 HD1 TRP 36 HD TRP 36 6.400 6.606 -6.887
284 HE1 TRP 36 1HE TRP 36 7.894 7.706 -5.094
285 HE3 TRP 36 3HE TRP 36 4.079 4.833 -2.693
286 HZ2 TRP 36 2HZ TRP 36 8.060 7.807 -2.281
287 HZ3 TRP 36 3HZ TRP 36 4.966 5.477 -0.490
288 HH2 TRP 36 HH TRP 36 6.916 6.934 -0.290
289 H ARG 37 H ARG 37 6.331 2.242 -6.260
290 HA ARG 37 HA ARG 37 4.308 0.138 -6.461
291 1HB ARG 37 2HB ARG 37 6.674 0.039 -7.559
292 2HB ARG 37 1HB ARG 37 7.191 -0.426 -5.942
293 1HG ARG 37 2HG ARG 37 6.768 -2.494 -6.705
294 2HG ARG 37 1HG ARG 37 5.124 -2.092 -6.236
295 1HD ARG 37 2HD ARG 37 4.399 -2.100 -8.347
296 2HD ARG 37 1HD ARG 37 5.786 -1.170 -8.914
297 HE ARG 37 HE ARG 37 5.431 -3.986 -9.097
298 1HH1 ARG 37 1HH1 ARG 37 7.860 -1.518 -8.662
299 2HH1 ARG 37 2HH1 ARG 37 9.136 -2.479 -9.330
300 1HH2 ARG 37 1HH2 ARG 37 7.107 -5.252 -9.976
301 2HH2 ARG 37 2HH2 ARG 37 8.708 -4.598 -10.078
302 H GLY 38 H GLY 38 4.021 -1.409 -4.839
303 1HA GLY 38 2HA GLY 38 5.125 -0.757 -2.196
304 2HA GLY 38 1HA GLY 38 3.375 -0.799 -2.386
305 H SER 39 H SER 39 4.611 -2.411 -0.552
306 HA SER 39 HA SER 39 4.414 -5.084 -1.770
307 1HB SER 39 2HB SER 39 5.688 -4.995 0.861
308 2HB SER 39 1HB SER 39 6.233 -5.776 -0.617
309 HG SER 39 HG SER 39 7.631 -4.221 -0.713
310 H TYR 40 H TYR 40 3.448 -6.744 -0.451
311 HA TYR 40 HA TYR 40 1.882 -5.870 1.831
312 1HB TYR 40 2HB TYR 40 0.462 -5.366 -0.130
313 2HB TYR 40 1HB TYR 40 0.568 -7.053 -0.617
314 HD1 TYR 40 1HD TYR 40 -0.208 -8.782 1.241
315 HD2 TYR 40 2HD TYR 40 -1.364 -4.690 1.097
316 HE1 TYR 40 1HE TYR 40 -2.183 -9.297 2.612
317 HE2 TYR 40 2HE TYR 40 -3.340 -5.194 2.467
318 HH TYR 40 HH TYR 40 -4.775 -7.221 2.954
319 H ASN 41 H ASN 41 1.284 -7.515 3.192
320 HA ASN 41 HA ASN 41 2.890 -9.801 3.252
321 1HB ASN 41 2HB ASN 41 1.148 -10.595 4.987
322 2HB ASN 41 1HB ASN 41 2.044 -9.114 5.331
323 1HD2 ASN 41 1HD2 ASN 41 0.995 -7.114 5.096
324 2HD2 ASN 41 2HD2 ASN 41 -0.726 -6.989 5.125
325 H GLY 42 H GLY 42 2.691 -10.820 1.227
326 1HA GLY 42 2HA GLY 42 1.488 -13.090 0.867
327 2HA GLY 42 1HA GLY 42 0.111 -12.033 0.606
328 H GLN 43 H GLN 43 1.628 -9.963 -0.688
329 HA GLN 43 HA GLN 43 3.031 -10.983 -2.921
330 1HB GLN 43 2HB GLN 43 1.244 -10.264 -4.619
331 2HB GLN 43 1HB GLN 43 1.028 -11.812 -3.806
332 1HG GLN 43 2HG GLN 43 -0.415 -10.467 -2.138
333 2HG GLN 43 1HG GLN 43 -0.460 -9.250 -3.418
334 1HE2 GLN 43 1HE2 GLN 43 -1.791 -12.095 -2.215
335 2HE2 GLN 43 2HE2 GLN 43 -2.804 -12.489 -3.562
336 H ILE 44 H ILE 44 3.306 -9.256 -4.646
337 HA ILE 44 HA ILE 44 3.393 -6.625 -3.329
338 HB ILE 44 HB ILE 44 5.289 -8.015 -5.164
339 1HG1 ILE 44 2HG1 ILE 44 6.912 -6.830 -3.635
340 2HG1 ILE 44 1HG1 ILE 44 5.513 -6.241 -2.736
341 1HG2 ILE 44 1HG2 ILE 44 4.881 -6.095 -6.500
342 2HG2 ILE 44 2HG2 ILE 44 6.385 -5.793 -5.629
343 3HG2 ILE 44 3HG2 ILE 44 4.888 -5.031 -5.093
344 1HD1 ILE 44 1HD1 ILE 44 5.141 -8.233 -1.758
345 2HD1 ILE 44 2HD1 ILE 44 6.853 -8.471 -2.108
346 3HD1 ILE 44 3HD1 ILE 44 5.631 -9.149 -3.183
347 H GLY 45 H GLY 45 2.970 -4.749 -4.590
348 1HA GLY 45 2HA GLY 45 1.999 -4.972 -7.282
349 2HA GLY 45 1HA GLY 45 0.688 -4.801 -6.122
350 H TRP 46 H TRP 46 -0.035 -2.796 -6.073
351 HA TRP 46 HA TRP 46 1.772 -0.582 -6.653
352 1HB TRP 46 2HB TRP 46 -0.664 -1.135 -7.664
353 2HB TRP 46 1HB TRP 46 -1.141 -0.145 -6.287
354 HD1 TRP 46 HD TRP 46 -0.150 2.373 -6.231
355 HE1 TRP 46 1HE TRP 46 0.441 3.975 -8.169
356 HE3 TRP 46 3HE TRP 46 0.191 -1.041 -9.998
357 HZ2 TRP 46 2HZ TRP 46 0.969 3.793 -10.941
358 HZ3 TRP 46 3HZ TRP 46 0.741 -0.258 -12.264
359 HH2 TRP 46 HH TRP 46 1.121 2.110 -12.725
360 H PHE 47 H PHE 47 2.009 1.175 -5.256
361 HA PHE 47 HA PHE 47 2.003 0.626 -2.525
362 1HB PHE 47 2HB PHE 47 2.793 2.804 -2.184
363 2HB PHE 47 1HB PHE 47 3.338 2.404 -3.811
364 HD1 PHE 47 1HD PHE 47 1.567 3.090 -5.696
365 HD2 PHE 47 2HD PHE 47 1.904 4.884 -1.859
366 HE1 PHE 47 1HE PHE 47 0.480 5.122 -6.558
367 HE2 PHE 47 2HE PHE 47 0.818 6.920 -2.708
368 HZ PHE 47 HZ PHE 47 0.104 7.041 -5.062
369 HA PRO 48 HA PRO 48 -2.346 1.513 -1.823
370 1HB PRO 48 2HB PRO 48 -2.642 0.017 0.367
371 2HB PRO 48 1HB PRO 48 -2.455 -0.726 -1.225
372 1HG PRO 48 2HG PRO 48 -0.477 -0.450 0.983
373 2HG PRO 48 1HG PRO 48 -0.686 -1.767 -0.182
374 1HD PRO 48 2HD PRO 48 1.202 0.312 -0.333
375 2HD PRO 48 1HD PRO 48 0.771 -0.814 -1.634
376 H SER 49 H SER 49 0.176 2.948 -0.608
377 HA SER 49 HA SER 49 -0.341 3.705 2.000
378 1HB SER 49 2HB SER 49 1.440 4.425 -0.066
379 2HB SER 49 1HB SER 49 0.762 5.920 0.587
380 HG SER 49 HG SER 49 2.415 5.510 1.922
381 H ASN 50 H ASN 50 -2.336 4.314 -0.641
382 HA ASN 50 HA ASN 50 -3.214 6.854 -0.536
383 1HB ASN 50 2HB ASN 50 -4.459 4.259 -1.077
384 2HB ASN 50 1HB ASN 50 -5.592 5.540 -0.665
385 1HD2 ASN 50 1HD2 ASN 50 -5.710 7.368 -1.971
386 2HD2 ASN 50 2HD2 ASN 50 -5.133 7.348 -3.594
387 H TYR 51 H TYR 51 -3.645 4.396 1.896
388 HA TYR 51 HA TYR 51 -4.350 6.420 3.814
389 1HB TYR 51 2HB TYR 51 -6.309 4.164 3.325
390 2HB TYR 51 1HB TYR 51 -6.444 5.422 4.555
391 HD1 TYR 51 1HD TYR 51 -6.680 7.841 3.747
392 HD2 TYR 51 2HD TYR 51 -7.230 4.480 1.200
393 HE1 TYR 51 1HE TYR 51 -7.936 9.250 2.168
394 HE2 TYR 51 2HE TYR 51 -8.486 5.877 -0.386
395 HH TYR 51 HH TYR 51 -8.720 8.225 -0.988
396 H VAL 52 H VAL 52 -2.125 5.333 4.064
397 HA VAL 52 HA VAL 52 -2.438 3.310 6.132
398 HB VAL 52 HB VAL 52 -1.011 1.757 5.271
399 1HG1 VAL 52 1HG1 VAL 52 -2.112 3.143 2.839
400 2HG1 VAL 52 2HG1 VAL 52 -2.841 1.815 3.741
401 3HG1 VAL 52 3HG1 VAL 52 -1.367 1.545 2.812
402 1HG2 VAL 52 1HG2 VAL 52 0.598 2.470 3.313
403 2HG2 VAL 52 2HG2 VAL 52 1.027 2.767 4.998
404 3HG2 VAL 52 3HG2 VAL 52 0.371 4.073 4.011
405 H LEU 53 H LEU 53 -0.449 3.045 7.478
406 HA LEU 53 HA LEU 53 0.868 5.643 7.815
407 1HB LEU 53 2HB LEU 53 -0.248 3.694 9.617
408 2HB LEU 53 1HB LEU 53 1.436 3.980 10.004
409 HG LEU 53 HG LEU 53 0.353 5.511 11.352
410 1HD1 LEU 53 1HD1 LEU 53 1.851 6.520 9.292
411 2HD1 LEU 53 2HD1 LEU 53 1.320 7.420 10.713
412 3HD1 LEU 53 3HD1 LEU 53 0.386 7.501 9.218
413 1HD2 LEU 53 1HD2 LEU 53 -1.471 6.601 9.291
414 2HD2 LEU 53 2HD2 LEU 53 -1.718 6.372 11.023
415 3HD2 LEU 53 3HD2 LEU 53 -1.829 4.993 9.926
416 H GLU 54 H GLU 54 2.897 5.738 7.039
417 HA GLU 54 HA GLU 54 4.396 3.224 6.829
418 1HB GLU 54 2HB GLU 54 3.969 4.475 4.744
419 2HB GLU 54 1HB GLU 54 4.904 5.822 5.386
420 1HG GLU 54 2HG GLU 54 6.434 3.426 5.607
421 2HG GLU 54 1HG GLU 54 5.815 3.577 3.960
422 H GLU 55 H GLU 55 6.328 2.924 7.752
423 HA GLU 55 HA GLU 55 7.434 5.127 9.332
424 1HB GLU 55 2HB GLU 55 7.982 2.279 10.029
425 2HB GLU 55 1HB GLU 55 7.929 3.688 11.079
426 1HG GLU 55 2HG GLU 55 5.358 3.493 10.161
427 2HG GLU 55 1HG GLU 55 5.852 1.814 10.349
428 H VAL 56 H VAL 56 9.290 5.848 8.500
429 HA VAL 56 HA VAL 56 10.837 4.157 6.734
430 HB VAL 56 HB VAL 56 11.548 6.975 7.505
431 1HG1 VAL 56 1HG1 VAL 56 12.163 6.663 4.882
432 2HG1 VAL 56 2HG1 VAL 56 12.412 5.024 5.486
433 3HG1 VAL 56 3HG1 VAL 56 13.287 6.373 6.211
434 1HG2 VAL 56 1HG2 VAL 56 10.194 7.820 5.717
435 2HG2 VAL 56 2HG2 VAL 56 9.166 6.853 6.776
436 3HG2 VAL 56 3HG2 VAL 56 9.722 6.190 5.239
437 H ASP 57 H ASP 57 11.400 2.704 8.561
438 HA ASP 57 HA ASP 57 13.139 3.608 10.619
439 1HB ASP 57 2HB ASP 57 11.651 1.470 10.516
440 2HB ASP 57 1HB ASP 57 13.037 0.754 9.698
Start of MODEL 3
1 1H ILE 1 1HT ILE 1 10.668 -2.842 9.001
2 2H ILE 1 2HT ILE 1 11.334 -2.214 10.452
3 3H ILE 1 3HT ILE 1 11.103 -1.187 9.096
4 HA ILE 1 HA ILE 1 9.050 -2.472 10.760
5 HB ILE 1 HB ILE 1 9.498 0.454 10.198
6 1HG1 ILE 1 2HG1 ILE 1 10.385 -1.145 12.612
7 2HG1 ILE 1 1HG1 ILE 1 11.453 -0.459 11.391
8 1HG2 ILE 1 1HG2 ILE 1 7.251 -0.071 10.858
9 2HG2 ILE 1 2HG2 ILE 1 8.067 0.720 12.207
10 3HG2 ILE 1 3HG2 ILE 1 7.829 -1.028 12.221
11 1HD1 ILE 1 1HD1 ILE 1 11.163 1.683 12.151
12 2HD1 ILE 1 2HD1 ILE 1 11.067 0.765 13.654
13 3HD1 ILE 1 3HD1 ILE 1 9.592 1.332 12.871
14 HA PRO 2 HA PRO 2 6.586 -2.192 7.067
15 1HB PRO 2 2HB PRO 2 4.277 -3.097 8.054
16 2HB PRO 2 1HB PRO 2 5.687 -4.154 7.925
17 1HG PRO 2 2HG PRO 2 4.577 -2.760 10.319
18 2HG PRO 2 1HG PRO 2 5.248 -4.393 10.187
19 1HD PRO 2 2HD PRO 2 6.614 -2.166 11.128
20 2HD PRO 2 1HD PRO 2 7.374 -3.653 10.529
21 H ALA 3 H ALA 3 3.951 -1.591 6.910
22 HA ALA 3 HA ALA 3 3.745 1.132 7.964
23 1HB ALA 3 1HB ALA 3 4.013 1.661 5.778
24 2HB ALA 3 2HB ALA 3 2.278 1.344 5.743
25 3HB ALA 3 3HB ALA 3 3.411 0.099 5.215
26 H PHE 4 H PHE 4 1.617 1.918 8.399
27 HA PHE 4 HA PHE 4 -0.300 -0.206 8.982
28 1HB PHE 4 2HB PHE 4 0.685 1.276 10.831
29 2HB PHE 4 1HB PHE 4 -0.350 2.531 10.171
30 HD1 PHE 4 1HD PHE 4 -2.848 2.068 10.029
31 HD2 PHE 4 2HD PHE 4 -0.163 -0.267 12.362
32 HE1 PHE 4 1HE PHE 4 -4.739 1.236 11.366
33 HE2 PHE 4 2HE PHE 4 -2.047 -1.105 13.701
34 HZ PHE 4 HZ PHE 4 -4.340 -0.354 13.205
35 H VAL 5 H VAL 5 -2.063 -0.303 7.743
36 HA VAL 5 HA VAL 5 -2.722 1.823 5.920
37 HB VAL 5 HB VAL 5 -4.206 -0.734 6.539
38 1HG1 VAL 5 1HG1 VAL 5 -4.558 1.314 4.363
39 2HG1 VAL 5 2HG1 VAL 5 -5.751 0.756 5.535
40 3HG1 VAL 5 3HG1 VAL 5 -5.202 -0.324 4.253
41 1HG2 VAL 5 1HG2 VAL 5 -3.144 -1.070 4.072
42 2HG2 VAL 5 2HG2 VAL 5 -2.397 -1.640 5.564
43 3HG2 VAL 5 3HG2 VAL 5 -1.886 -0.110 4.851
44 H LYS 6 H LYS 6 -4.715 2.978 5.859
45 HA LYS 6 HA LYS 6 -5.878 3.361 8.522
46 1HB LYS 6 2HB LYS 6 -5.805 5.179 6.119
47 2HB LYS 6 1HB LYS 6 -6.680 5.544 7.600
48 1HG LYS 6 2HG LYS 6 -4.628 5.579 8.860
49 2HG LYS 6 1HG LYS 6 -3.712 5.061 7.443
50 1HD LYS 6 2HD LYS 6 -3.396 7.403 7.629
51 2HD LYS 6 1HD LYS 6 -4.530 7.157 6.299
52 1HE LYS 6 2HE LYS 6 -6.238 7.383 8.386
53 2HE LYS 6 1HE LYS 6 -4.928 8.435 8.921
54 1HZ LYS 6 1HZ LYS 6 -6.801 8.774 6.728
55 2HZ LYS 6 2HZ LYS 6 -5.207 9.237 6.402
56 3HZ LYS 6 3HZ LYS 6 -6.042 9.937 7.695
57 H PHE 7 H PHE 7 -6.813 3.080 5.131
58 HA PHE 7 HA PHE 7 -9.367 1.983 5.990
59 1HB PHE 7 2HB PHE 7 -9.096 4.578 4.970
60 2HB PHE 7 1HB PHE 7 -9.765 3.613 3.657
61 HD1 PHE 7 1HD PHE 7 -10.281 4.558 7.200
62 HD2 PHE 7 2HD PHE 7 -12.019 3.003 3.640
63 HE1 PHE 7 1HE PHE 7 -12.512 4.714 8.226
64 HE2 PHE 7 2HE PHE 7 -14.254 3.157 4.659
65 HZ PHE 7 HZ PHE 7 -14.502 4.015 6.954
66 H ALA 8 H ALA 8 -10.405 0.622 4.487
67 HA ALA 8 HA ALA 8 -8.575 -0.628 2.614
68 1HB ALA 8 1HB ALA 8 -9.544 -2.453 3.421
69 2HB ALA 8 2HB ALA 8 -11.003 -2.000 2.544
70 3HB ALA 8 3HB ALA 8 -10.794 -1.505 4.224
71 H TYR 9 H TYR 9 -8.873 -0.713 0.420
72 HA TYR 9 HA TYR 9 -11.279 0.569 -0.674
73 1HB TYR 9 2HB TYR 9 -9.125 2.057 -0.560
74 2HB TYR 9 1HB TYR 9 -8.618 1.097 -1.949
75 HD1 TYR 9 1HD TYR 9 -9.063 1.985 -4.021
76 HD2 TYR 9 2HD TYR 9 -11.673 2.933 -0.798
77 HE1 TYR 9 1HE TYR 9 -10.364 3.444 -5.511
78 HE2 TYR 9 2HE TYR 9 -12.983 4.393 -2.279
79 HH TYR 9 HH TYR 9 -12.571 4.409 -5.679
80 H VAL 10 H VAL 10 -11.917 -0.148 -2.723
81 HA VAL 10 HA VAL 10 -10.936 -2.784 -3.413
82 HB VAL 10 HB VAL 10 -12.819 -2.737 -5.095
83 1HG1 VAL 10 1HG1 VAL 10 -14.005 -2.158 -2.430
84 2HG1 VAL 10 2HG1 VAL 10 -12.860 -3.491 -2.565
85 3HG1 VAL 10 3HG1 VAL 10 -14.324 -3.485 -3.546
86 1HG2 VAL 10 1HG2 VAL 10 -12.895 -0.226 -5.197
87 2HG2 VAL 10 2HG2 VAL 10 -13.689 -0.257 -3.622
88 3HG2 VAL 10 3HG2 VAL 10 -14.460 -1.017 -5.014
89 H ALA 11 H ALA 11 -9.573 -3.174 -5.072
90 HA ALA 11 HA ALA 11 -9.073 -0.940 -6.920
91 1HB ALA 11 1HB ALA 11 -6.774 -1.429 -6.928
92 2HB ALA 11 2HB ALA 11 -7.023 -2.980 -6.129
93 3HB ALA 11 3HB ALA 11 -7.276 -1.479 -5.239
94 H GLU 12 H GLU 12 -7.427 -2.020 -8.666
95 HA GLU 12 HA GLU 12 -9.144 -3.577 -10.358
96 1HB GLU 12 2HB GLU 12 -6.395 -2.413 -10.812
97 2HB GLU 12 1HB GLU 12 -7.328 -3.257 -12.038
98 1HG GLU 12 2HG GLU 12 -9.115 -1.557 -11.769
99 2HG GLU 12 1HG GLU 12 -8.054 -0.680 -10.667
100 H ARG 13 H ARG 13 -7.898 -5.233 -11.788
101 HA ARG 13 HA ARG 13 -7.134 -7.364 -10.022
102 1HB ARG 13 2HB ARG 13 -7.461 -8.817 -11.838
103 2HB ARG 13 1HB ARG 13 -8.667 -7.561 -12.050
104 1HG ARG 13 2HG ARG 13 -6.114 -7.931 -13.586
105 2HG ARG 13 1HG ARG 13 -7.766 -8.024 -14.185
106 1HD ARG 13 2HD ARG 13 -8.055 -5.632 -13.714
107 2HD ARG 13 1HD ARG 13 -6.386 -5.550 -13.153
108 HE ARG 13 HE ARG 13 -6.544 -6.594 -15.793
109 1HH1 ARG 13 1HH1 ARG 13 -6.683 -3.622 -13.969
110 2HH1 ARG 13 2HH1 ARG 13 -6.152 -2.640 -15.291
111 1HH2 ARG 13 1HH2 ARG 13 -5.847 -5.302 -17.535
112 2HH2 ARG 13 2HH2 ARG 13 -5.678 -3.592 -17.316
113 H GLU 14 H GLU 14 -5.414 -8.733 -11.971
114 HA GLU 14 HA GLU 14 -2.961 -8.104 -10.949
115 1HB GLU 14 2HB GLU 14 -3.499 -9.224 -13.706
116 2HB GLU 14 1HB GLU 14 -1.983 -9.349 -12.823
117 1HG GLU 14 2HG GLU 14 -4.536 -10.428 -11.691
118 2HG GLU 14 1HG GLU 14 -3.563 -11.363 -12.829
119 H ASP 15 H ASP 15 -2.186 -6.218 -10.887
120 HA ASP 15 HA ASP 15 -0.685 -4.876 -12.604
121 1HB ASP 15 2HB ASP 15 -2.428 -4.605 -14.261
122 2HB ASP 15 1HB ASP 15 -3.556 -4.007 -13.042
123 H GLU 16 H GLU 16 -3.564 -4.119 -10.743
124 HA GLU 16 HA GLU 16 -1.922 -2.649 -8.808
125 1HB GLU 16 2HB GLU 16 -3.096 -0.742 -9.009
126 2HB GLU 16 1HB GLU 16 -3.708 -1.404 -10.509
127 1HG GLU 16 2HG GLU 16 -5.564 -2.428 -9.122
128 2HG GLU 16 1HG GLU 16 -5.009 -1.361 -7.839
129 H LEU 17 H LEU 17 -2.686 -2.772 -6.621
130 HA LEU 17 HA LEU 17 -4.619 -4.958 -6.253
131 1HB LEU 17 2HB LEU 17 -2.960 -4.927 -3.989
132 2HB LEU 17 1HB LEU 17 -3.072 -6.143 -5.247
133 HG LEU 17 HG LEU 17 -0.767 -5.507 -4.888
134 1HD1 LEU 17 1HD1 LEU 17 -1.035 -4.196 -7.456
135 2HD1 LEU 17 2HD1 LEU 17 -2.045 -5.636 -7.327
136 3HD1 LEU 17 3HD1 LEU 17 -0.308 -5.747 -7.045
137 1HD2 LEU 17 1HD2 LEU 17 -0.103 -3.427 -4.501
138 2HD2 LEU 17 2HD2 LEU 17 -1.795 -2.934 -4.549
139 3HD2 LEU 17 3HD2 LEU 17 -0.813 -2.860 -6.011
140 H SER 18 H SER 18 -5.906 -5.008 -4.456
141 HA SER 18 HA SER 18 -6.939 -2.510 -3.604
142 1HB SER 18 2HB SER 18 -8.707 -3.703 -2.733
143 2HB SER 18 1HB SER 18 -8.102 -4.854 -3.928
144 HG SER 18 HG SER 18 -8.016 -4.953 -1.154
145 H LEU 19 H LEU 19 -7.075 -1.656 -1.500
146 HA LEU 19 HA LEU 19 -4.715 -2.242 0.113
147 1HB LEU 19 2HB LEU 19 -6.041 -0.123 1.326
148 2HB LEU 19 1HB LEU 19 -4.654 -0.025 0.261
149 HG LEU 19 HG LEU 19 -7.504 0.096 -0.709
150 1HD1 LEU 19 1HD1 LEU 19 -6.955 2.552 -1.009
151 2HD1 LEU 19 2HD1 LEU 19 -5.603 2.280 0.091
152 3HD1 LEU 19 3HD1 LEU 19 -7.256 2.008 0.641
153 1HD2 LEU 19 1HD2 LEU 19 -5.519 1.373 -2.347
154 2HD2 LEU 19 2HD2 LEU 19 -6.649 0.086 -2.759
155 3HD2 LEU 19 3HD2 LEU 19 -5.082 -0.309 -2.053
156 H VAL 20 H VAL 20 -4.785 -2.579 2.351
157 HA VAL 20 HA VAL 20 -6.844 -4.313 3.237
158 HB VAL 20 HB VAL 20 -4.870 -3.008 5.081
159 1HG1 VAL 20 1HG1 VAL 20 -6.610 -5.375 5.100
160 2HG1 VAL 20 2HG1 VAL 20 -6.023 -4.383 6.435
161 3HG1 VAL 20 3HG1 VAL 20 -4.985 -5.627 5.736
162 1HG2 VAL 20 1HG2 VAL 20 -3.369 -4.986 4.471
163 2HG2 VAL 20 2HG2 VAL 20 -3.439 -3.641 3.334
164 3HG2 VAL 20 3HG2 VAL 20 -4.346 -5.118 3.008
165 H LYS 21 H LYS 21 -8.067 -4.082 5.243
166 HA LYS 21 HA LYS 21 -9.239 -1.411 5.439
167 1HB LYS 21 2HB LYS 21 -10.443 -3.574 7.033
168 2HB LYS 21 1HB LYS 21 -11.205 -2.395 5.980
169 1HG LYS 21 2HG LYS 21 -11.597 -4.070 4.584
170 2HG LYS 21 1HG LYS 21 -9.871 -4.077 4.230
171 1HD LYS 21 2HD LYS 21 -10.187 -5.502 6.634
172 2HD LYS 21 1HD LYS 21 -11.463 -6.065 5.552
173 1HE LYS 21 2HE LYS 21 -8.728 -5.781 4.434
174 2HE LYS 21 1HE LYS 21 -9.023 -7.119 5.543
175 1HZ LYS 21 1HZ LYS 21 -10.292 -8.184 4.052
176 2HZ LYS 21 2HZ LYS 21 -9.491 -7.221 2.915
177 3HZ LYS 21 3HZ LYS 21 -11.022 -6.770 3.476
178 H GLY 22 H GLY 22 -7.697 -3.878 7.447
179 1HA GLY 22 2HA GLY 22 -6.915 -1.851 9.336
180 2HA GLY 22 1HA GLY 22 -8.063 -3.009 9.970
181 H SER 23 H SER 23 -5.080 -3.014 8.083
182 HA SER 23 HA SER 23 -3.845 -4.800 9.988
183 1HB SER 23 2HB SER 23 -5.032 -5.855 7.682
184 2HB SER 23 1HB SER 23 -3.298 -5.828 7.353
185 HG SER 23 HG SER 23 -3.136 -7.484 8.613
186 H ARG 24 H ARG 24 -1.505 -5.334 9.119
187 HA ARG 24 HA ARG 24 -0.365 -2.751 8.392
188 1HB ARG 24 2HB ARG 24 0.620 -5.127 9.850
189 2HB ARG 24 1HB ARG 24 1.797 -4.089 9.070
190 1HG ARG 24 2HG ARG 24 -0.154 -2.600 10.620
191 2HG ARG 24 1HG ARG 24 0.739 -3.773 11.596
192 1HD ARG 24 2HD ARG 24 2.834 -2.836 10.899
193 2HD ARG 24 1HD ARG 24 2.027 -1.778 9.748
194 HE ARG 24 HE ARG 24 1.623 -0.317 11.450
195 1HH1 ARG 24 1HH1 ARG 24 2.336 -3.443 12.826
196 2HH1 ARG 24 2HH1 ARG 24 2.347 -2.861 14.457
197 1HH2 ARG 24 1HH2 ARG 24 1.639 0.451 13.595
198 2HH2 ARG 24 2HH2 ARG 24 1.952 -0.650 14.895
199 H VAL 25 H VAL 25 1.167 -2.496 6.792
200 HA VAL 25 HA VAL 25 1.401 -4.679 4.826
201 HB VAL 25 HB VAL 25 1.182 -1.750 4.117
202 1HG1 VAL 25 1HG1 VAL 25 0.554 -2.902 1.869
203 2HG1 VAL 25 2HG1 VAL 25 1.394 -4.291 2.561
204 3HG1 VAL 25 3HG1 VAL 25 2.249 -2.763 2.339
205 1HG2 VAL 25 1HG2 VAL 25 -0.896 -2.817 5.176
206 2HG2 VAL 25 2HG2 VAL 25 -0.997 -3.768 3.694
207 3HG2 VAL 25 3HG2 VAL 25 -1.087 -2.008 3.619
208 H THR 26 H THR 26 3.302 -4.296 3.292
209 HA THR 26 HA THR 26 5.615 -3.682 4.893
210 HB THR 26 HB THR 26 6.906 -4.631 3.174
211 HG1 THR 26 1HG THR 26 4.847 -3.699 1.598
212 1HG2 THR 26 1HG2 THR 26 4.346 -6.103 2.698
213 2HG2 THR 26 2HG2 THR 26 5.200 -6.217 4.237
214 3HG2 THR 26 3HG2 THR 26 5.996 -6.725 2.748
215 H VAL 27 H VAL 27 6.993 -1.959 4.688
216 HA VAL 27 HA VAL 27 5.982 0.484 3.898
217 HB VAL 27 HB VAL 27 7.887 0.288 5.406
218 1HG1 VAL 27 1HG1 VAL 27 9.856 -0.104 3.248
219 2HG1 VAL 27 2HG1 VAL 27 8.900 -1.519 3.689
220 3HG1 VAL 27 3HG1 VAL 27 9.860 -0.687 4.912
221 1HG2 VAL 27 1HG2 VAL 27 8.434 2.381 4.890
222 2HG2 VAL 27 2HG2 VAL 27 7.600 2.180 3.349
223 3HG2 VAL 27 3HG2 VAL 27 9.327 1.843 3.468
224 H MET 28 H MET 28 5.729 1.498 2.074
225 HA MET 28 HA MET 28 6.142 0.291 -0.424
226 1HB MET 28 2HB MET 28 5.708 3.240 0.009
227 2HB MET 28 1HB MET 28 5.226 2.264 -1.375
228 1HG MET 28 2HG MET 28 4.108 1.849 1.380
229 2HG MET 28 1HG MET 28 3.394 2.954 0.212
230 1HE MET 28 1HE MET 28 3.948 1.406 -2.495
231 2HE MET 28 2HE MET 28 2.368 2.117 -2.166
232 3HE MET 28 3HE MET 28 2.489 0.440 -2.699
233 H GLU 29 H GLU 29 7.072 1.936 -2.207
234 HA GLU 29 HA GLU 29 9.916 2.237 -1.536
235 1HB GLU 29 2HB GLU 29 10.424 1.597 -3.687
236 2HB GLU 29 1HB GLU 29 8.915 0.736 -3.476
237 1HG GLU 29 2HG GLU 29 8.293 1.668 -5.389
238 2HG GLU 29 1HG GLU 29 8.072 3.146 -4.461
239 H LYS 30 H LYS 30 11.069 4.063 -2.550
240 HA LYS 30 HA LYS 30 9.476 6.471 -2.386
241 1HB LYS 30 2HB LYS 30 12.309 5.791 -2.133
242 2HB LYS 30 1HB LYS 30 12.038 7.261 -3.059
243 1HG LYS 30 2HG LYS 30 11.238 8.412 -1.272
244 2HG LYS 30 1HG LYS 30 10.567 6.970 -0.504
245 1HD LYS 30 2HD LYS 30 12.691 6.296 0.295
246 2HD LYS 30 1HD LYS 30 13.528 7.464 -0.731
247 1HE LYS 30 2HE LYS 30 11.877 7.974 1.727
248 2HE LYS 30 1HE LYS 30 13.566 8.389 1.434
249 1HZ LYS 30 1HZ LYS 30 12.467 10.388 1.163
250 2HZ LYS 30 2HZ LYS 30 11.136 9.691 0.387
251 3HZ LYS 30 3HZ LYS 30 12.608 9.845 -0.433
252 H CYS 31 H CYS 31 8.255 6.609 -4.208
253 HA CYS 31 HA CYS 31 9.632 6.462 -6.795
254 1HB CYS 31 2HB CYS 31 7.342 5.213 -6.000
255 2HB CYS 31 1HB CYS 31 6.692 6.645 -6.790
256 HG CYS 31 HG CYS 31 8.134 5.848 -8.935
257 H SER 32 H SER 32 9.049 8.014 -8.449
258 HA SER 32 HA SER 32 8.834 10.690 -7.354
259 1HB SER 32 2HB SER 32 10.514 10.442 -9.027
260 2HB SER 32 1HB SER 32 9.399 9.627 -10.124
261 HG SER 32 HG SER 32 9.478 12.354 -9.393
262 H ASP 33 H ASP 33 6.885 8.404 -9.097
263 HA ASP 33 HA ASP 33 4.839 10.423 -9.641
264 1HB ASP 33 2HB ASP 33 5.209 7.570 -10.550
265 2HB ASP 33 1HB ASP 33 3.708 8.455 -10.821
266 H GLY 34 H GLY 34 2.548 9.792 -9.191
267 1HA GLY 34 2HA GLY 34 2.158 9.348 -6.456
268 2HA GLY 34 1HA GLY 34 0.899 9.264 -7.684
269 H TRP 35 H TRP 35 2.613 7.072 -9.001
270 HA TRP 35 HA TRP 35 1.295 4.889 -7.662
271 1HB TRP 35 2HB TRP 35 3.304 4.555 -9.872
272 2HB TRP 35 1HB TRP 35 1.895 3.567 -9.504
273 HD1 TRP 35 HD TRP 35 -0.371 5.738 -9.504
274 HE1 TRP 35 1HE TRP 35 -1.045 6.912 -11.693
275 HE3 TRP 35 3HE TRP 35 3.894 4.931 -12.203
276 HZ2 TRP 35 2HZ TRP 35 0.084 7.429 -14.228
277 HZ3 TRP 35 3HZ TRP 35 4.018 5.798 -14.503
278 HH2 TRP 35 HH TRP 35 2.150 7.021 -15.494
279 H TRP 36 H TRP 36 2.263 4.681 -5.647
280 HA TRP 36 HA TRP 36 5.129 4.307 -5.487
281 1HB TRP 36 2HB TRP 36 2.933 4.607 -3.470
282 2HB TRP 36 1HB TRP 36 4.496 3.953 -2.985
283 HD1 TRP 36 HD TRP 36 6.642 5.679 -3.907
284 HE1 TRP 36 1HE TRP 36 6.776 8.223 -3.534
285 HE3 TRP 36 3HE TRP 36 1.691 6.635 -3.073
286 HZ2 TRP 36 2HZ TRP 36 5.011 10.353 -2.965
287 HZ3 TRP 36 3HZ TRP 36 0.996 8.951 -2.622
288 HH2 TRP 36 HH TRP 36 2.623 10.771 -2.568
289 H ARG 37 H ARG 37 6.125 2.401 -5.397
290 HA ARG 37 HA ARG 37 4.562 -0.018 -5.577
291 1HB ARG 37 2HB ARG 37 6.910 0.663 -6.690
292 2HB ARG 37 1HB ARG 37 7.506 -0.170 -5.261
293 1HG ARG 37 2HG ARG 37 7.237 -2.090 -6.320
294 2HG ARG 37 1HG ARG 37 5.496 -1.810 -6.310
295 1HD ARG 37 2HD ARG 37 5.460 -1.427 -8.504
296 2HD ARG 37 1HD ARG 37 6.807 -0.293 -8.399
297 HE ARG 37 HE ARG 37 8.133 -1.937 -9.236
298 1HH1 ARG 37 1HH1 ARG 37 5.434 -3.452 -7.625
299 2HH1 ARG 37 2HH1 ARG 37 5.925 -5.059 -8.044
300 1HH2 ARG 37 1HH2 ARG 37 8.779 -4.048 -9.789
301 2HH2 ARG 37 2HH2 ARG 37 7.823 -5.398 -9.274
302 H GLY 38 H GLY 38 4.686 -1.780 -4.149
303 1HA GLY 38 2HA GLY 38 6.111 -1.643 -1.673
304 2HA GLY 38 1HA GLY 38 4.414 -1.237 -1.468
305 H SER 39 H SER 39 5.124 -3.302 -0.059
306 HA SER 39 HA SER 39 4.141 -5.616 -1.578
307 1HB SER 39 2HB SER 39 5.772 -6.300 0.755
308 2HB SER 39 1HB SER 39 5.821 -6.947 -0.888
309 HG SER 39 HG SER 39 7.062 -5.169 -1.502
310 H TYR 40 H TYR 40 2.980 -7.202 -0.393
311 HA TYR 40 HA TYR 40 1.966 -6.467 2.225
312 1HB TYR 40 2HB TYR 40 0.249 -5.349 1.204
313 2HB TYR 40 1HB TYR 40 0.404 -6.265 -0.293
314 HD1 TYR 40 1HD TYR 40 -1.295 -5.995 2.896
315 HD2 TYR 40 2HD TYR 40 -0.647 -8.513 -0.471
316 HE1 TYR 40 1HE TYR 40 -3.264 -7.329 3.522
317 HE2 TYR 40 2HE TYR 40 -2.615 -9.853 0.145
318 HH TYR 40 HH TYR 40 -3.977 -10.350 2.067
319 H ASN 41 H ASN 41 1.126 -8.224 3.368
320 HA ASN 41 HA ASN 41 2.151 -10.744 2.739
321 1HB ASN 41 2HB ASN 41 -0.209 -10.331 4.529
322 2HB ASN 41 1HB ASN 41 1.043 -11.559 4.653
323 1HD2 ASN 41 1HD2 ASN 41 0.161 -8.282 5.310
324 2HD2 ASN 41 2HD2 ASN 41 1.528 -7.888 6.290
325 H GLY 42 H GLY 42 1.528 -11.212 0.610
326 1HA GLY 42 2HA GLY 42 -0.335 -13.030 0.087
327 2HA GLY 42 1HA GLY 42 -1.283 -11.554 0.009
328 H GLN 43 H GLN 43 0.691 -9.891 -1.105
329 HA GLN 43 HA GLN 43 1.811 -10.980 -3.465
330 1HB GLN 43 2HB GLN 43 0.342 -9.956 -5.126
331 2HB GLN 43 1HB GLN 43 -0.546 -11.112 -4.137
332 1HG GLN 43 2HG GLN 43 -0.854 -8.694 -2.814
333 2HG GLN 43 1HG GLN 43 -0.985 -8.283 -4.527
334 1HE2 GLN 43 1HE2 GLN 43 -2.627 -9.321 -1.848
335 2HE2 GLN 43 2HE2 GLN 43 -4.038 -9.967 -2.620
336 H ILE 44 H ILE 44 2.279 -9.059 -5.088
337 HA ILE 44 HA ILE 44 3.035 -6.695 -3.502
338 HB ILE 44 HB ILE 44 4.694 -8.401 -5.294
339 1HG1 ILE 44 2HG1 ILE 44 6.429 -7.513 -3.596
340 2HG1 ILE 44 1HG1 ILE 44 5.027 -6.894 -2.720
341 1HG2 ILE 44 1HG2 ILE 44 4.756 -6.325 -6.526
342 2HG2 ILE 44 2HG2 ILE 44 6.288 -6.548 -5.681
343 3HG2 ILE 44 3HG2 ILE 44 5.088 -5.420 -5.049
344 1HD1 ILE 44 1HD1 ILE 44 4.234 -9.024 -2.250
345 2HD1 ILE 44 2HD1 ILE 44 5.980 -9.180 -2.063
346 3HD1 ILE 44 3HD1 ILE 44 5.194 -9.769 -3.527
347 H GLY 45 H GLY 45 3.273 -4.707 -4.727
348 1HA GLY 45 2HA GLY 45 2.805 -4.240 -7.371
349 2HA GLY 45 1HA GLY 45 1.190 -4.449 -6.706
350 H TRP 46 H TRP 46 0.682 -2.301 -7.264
351 HA TRP 46 HA TRP 46 2.108 -0.183 -5.831
352 1HB TRP 46 2HB TRP 46 0.216 -0.218 -8.168
353 2HB TRP 46 1HB TRP 46 0.508 1.273 -7.272
354 HD1 TRP 46 HD TRP 46 3.183 2.065 -7.199
355 HE1 TRP 46 1HE TRP 46 4.949 1.915 -9.066
356 HE3 TRP 46 3HE TRP 46 0.964 -1.494 -10.118
357 HZ2 TRP 46 2HZ TRP 46 5.345 0.473 -11.461
358 HZ3 TRP 46 3HZ TRP 46 2.102 -2.204 -12.181
359 HH2 TRP 46 HH TRP 46 4.247 -1.239 -12.838
360 H PHE 47 H PHE 47 1.260 0.828 -4.113
361 HA PHE 47 HA PHE 47 -1.593 0.403 -3.523
362 1HB PHE 47 2HB PHE 47 0.663 0.511 -1.511
363 2HB PHE 47 1HB PHE 47 -1.048 0.324 -1.133
364 HD1 PHE 47 1HD PHE 47 1.999 -1.343 -1.956
365 HD2 PHE 47 2HD PHE 47 -2.237 -1.749 -1.989
366 HE1 PHE 47 1HE PHE 47 2.239 -3.786 -2.114
367 HE2 PHE 47 2HE PHE 47 -2.006 -4.194 -2.147
368 HZ PHE 47 HZ PHE 47 0.236 -5.216 -2.209
369 HA PRO 48 HA PRO 48 -1.650 4.853 -3.455
370 1HB PRO 48 2HB PRO 48 -4.247 4.686 -2.163
371 2HB PRO 48 1HB PRO 48 -3.844 5.262 -3.778
372 1HG PRO 48 2HG PRO 48 -5.199 2.960 -3.349
373 2HG PRO 48 1HG PRO 48 -4.110 3.191 -4.729
374 1HD PRO 48 2HD PRO 48 -3.621 1.742 -2.152
375 2HD PRO 48 1HD PRO 48 -3.157 1.292 -3.807
376 H SER 49 H SER 49 -0.242 5.615 -1.972
377 HA SER 49 HA SER 49 -0.305 5.134 0.781
378 1HB SER 49 2HB SER 49 1.737 5.927 0.085
379 2HB SER 49 1HB SER 49 1.010 7.146 -0.959
380 HG SER 49 HG SER 49 1.610 7.251 1.745
381 H ASN 50 H ASN 50 -2.474 6.894 -1.064
382 HA ASN 50 HA ASN 50 -3.118 9.176 0.197
383 1HB ASN 50 2HB ASN 50 -4.639 7.110 -1.228
384 2HB ASN 50 1HB ASN 50 -5.596 8.211 -0.247
385 1HD2 ASN 50 1HD2 ASN 50 -5.694 10.365 -0.783
386 2HD2 ASN 50 2HD2 ASN 50 -5.167 10.959 -2.315
387 H TYR 51 H TYR 51 -3.522 5.944 1.478
388 HA TYR 51 HA TYR 51 -4.188 7.146 4.041
389 1HB TYR 51 2HB TYR 51 -5.873 4.799 3.315
390 2HB TYR 51 1HB TYR 51 -6.228 6.149 4.392
391 HD1 TYR 51 1HD TYR 51 -6.122 5.072 0.863
392 HD2 TYR 51 2HD TYR 51 -7.335 8.108 3.585
393 HE1 TYR 51 1HE TYR 51 -7.470 6.115 -0.910
394 HE2 TYR 51 2HE TYR 51 -8.687 9.159 1.820
395 HH TYR 51 HH TYR 51 -8.400 8.333 -1.451
396 H VAL 52 H VAL 52 -1.866 6.317 3.838
397 HA VAL 52 HA VAL 52 -1.773 3.730 5.167
398 HB VAL 52 HB VAL 52 -0.142 2.798 3.829
399 1HG1 VAL 52 1HG1 VAL 52 -0.832 3.119 1.476
400 2HG1 VAL 52 2HG1 VAL 52 -1.777 4.523 1.975
401 3HG1 VAL 52 3HG1 VAL 52 -2.198 2.919 2.575
402 1HG2 VAL 52 1HG2 VAL 52 1.214 4.107 2.181
403 2HG2 VAL 52 2HG2 VAL 52 1.498 4.550 3.865
404 3HG2 VAL 52 3HG2 VAL 52 0.497 5.578 2.838
405 H LEU 53 H LEU 53 0.053 3.437 6.560
406 HA LEU 53 HA LEU 53 1.395 5.960 7.256
407 1HB LEU 53 2HB LEU 53 -0.243 4.930 8.925
408 2HB LEU 53 1HB LEU 53 0.956 3.674 9.129
409 HG LEU 53 HG LEU 53 2.493 5.154 10.092
410 1HD1 LEU 53 1HD1 LEU 53 2.398 7.026 8.651
411 2HD1 LEU 53 2HD1 LEU 53 1.995 7.612 10.265
412 3HD1 LEU 53 3HD1 LEU 53 0.717 7.350 9.078
413 1HD2 LEU 53 1HD2 LEU 53 0.260 4.554 11.340
414 2HD2 LEU 53 2HD2 LEU 53 0.020 6.300 11.265
415 3HD2 LEU 53 3HD2 LEU 53 1.447 5.640 12.063
416 H GLU 54 H GLU 54 3.472 5.944 6.702
417 HA GLU 54 HA GLU 54 4.862 3.366 6.556
418 1HB GLU 54 2HB GLU 54 4.789 4.597 4.466
419 2HB GLU 54 1HB GLU 54 5.504 6.004 5.241
420 1HG GLU 54 2HG GLU 54 7.172 3.717 5.659
421 2HG GLU 54 1HG GLU 54 6.809 3.895 3.940
422 H GLU 55 H GLU 55 6.660 2.948 7.684
423 HA GLU 55 HA GLU 55 7.647 5.029 9.491
424 1HB GLU 55 2HB GLU 55 7.996 2.088 9.958
425 2HB GLU 55 1HB GLU 55 8.072 3.396 11.129
426 1HG GLU 55 2HG GLU 55 5.522 3.577 10.167
427 2HG GLU 55 1HG GLU 55 5.818 1.843 10.191
428 H VAL 56 H VAL 56 9.594 5.778 8.928
429 HA VAL 56 HA VAL 56 11.236 4.354 7.057
430 HB VAL 56 HB VAL 56 12.194 6.784 8.521
431 1HG1 VAL 56 1HG1 VAL 56 12.458 6.523 5.604
432 2HG1 VAL 56 2HG1 VAL 56 13.291 5.287 6.547
433 3HG1 VAL 56 3HG1 VAL 56 13.650 6.992 6.818
434 1HG2 VAL 56 1HG2 VAL 56 10.988 7.906 6.391
435 2HG2 VAL 56 2HG2 VAL 56 10.243 7.793 7.986
436 3HG2 VAL 56 3HG2 VAL 56 9.845 6.608 6.743
437 H ASP 57 H ASP 57 11.756 2.462 8.238
438 HA ASP 57 HA ASP 57 13.037 2.469 10.749
439 1HB ASP 57 2HB ASP 57 11.920 0.489 9.745
440 2HB ASP 57 1HB ASP 57 13.226 0.380 8.569
Start of MODEL 4
1 1H ILE 1 1HT ILE 1 11.163 -1.905 10.475
2 2H ILE 1 2HT ILE 1 10.775 -1.980 8.805
3 3H ILE 1 3HT ILE 1 10.112 -3.128 9.894
4 HA ILE 1 HA ILE 1 8.833 -1.511 10.957
5 HB ILE 1 HB ILE 1 8.874 0.822 9.636
6 1HG1 ILE 1 2HG1 ILE 1 11.328 1.461 9.443
7 2HG1 ILE 1 1HG1 ILE 1 11.687 -0.261 9.487
8 1HG2 ILE 1 1HG2 ILE 1 10.700 1.399 11.527
9 2HG2 ILE 1 2HG2 ILE 1 10.150 -0.178 12.095
10 3HG2 ILE 1 3HG2 ILE 1 8.990 1.130 11.864
11 1HD1 ILE 1 1HD1 ILE 1 10.861 -0.624 7.397
12 2HD1 ILE 1 2HD1 ILE 1 11.421 1.038 7.220
13 3HD1 ILE 1 3HD1 ILE 1 9.710 0.707 7.499
14 HA PRO 2 HA PRO 2 6.299 -2.439 7.361
15 1HB PRO 2 2HB PRO 2 4.114 -3.217 8.688
16 2HB PRO 2 1HB PRO 2 5.565 -4.225 8.642
17 1HG PRO 2 2HG PRO 2 4.496 -2.549 10.846
18 2HG PRO 2 1HG PRO 2 5.419 -4.057 10.925
19 1HD PRO 2 2HD PRO 2 6.414 -1.425 11.239
20 2HD PRO 2 1HD PRO 2 7.366 -2.917 11.110
21 H ALA 3 H ALA 3 3.814 -1.881 6.961
22 HA ALA 3 HA ALA 3 3.495 0.949 7.632
23 1HB ALA 3 1HB ALA 3 1.922 0.772 5.512
24 2HB ALA 3 2HB ALA 3 2.993 -0.580 5.144
25 3HB ALA 3 3HB ALA 3 3.658 1.037 5.364
26 H PHE 4 H PHE 4 1.361 1.750 8.017
27 HA PHE 4 HA PHE 4 -0.426 -0.280 9.101
28 1HB PHE 4 2HB PHE 4 -0.555 2.624 9.758
29 2HB PHE 4 1HB PHE 4 -1.149 1.265 10.692
30 HD1 PHE 4 1HD PHE 4 1.536 -0.328 10.272
31 HD2 PHE 4 2HD PHE 4 0.588 3.579 11.663
32 HE1 PHE 4 1HE PHE 4 3.600 -0.308 11.607
33 HE2 PHE 4 2HE PHE 4 2.654 3.607 12.998
34 HZ PHE 4 HZ PHE 4 4.163 1.662 12.972
35 H VAL 5 H VAL 5 -2.162 -0.713 7.897
36 HA VAL 5 HA VAL 5 -3.055 1.140 5.869
37 HB VAL 5 HB VAL 5 -4.274 -1.501 6.673
38 1HG1 VAL 5 1HG1 VAL 5 -4.581 0.135 4.157
39 2HG1 VAL 5 2HG1 VAL 5 -5.794 -0.056 5.423
40 3HG1 VAL 5 3HG1 VAL 5 -5.302 -1.447 4.457
41 1HG2 VAL 5 1HG2 VAL 5 -1.774 -1.226 5.707
42 2HG2 VAL 5 2HG2 VAL 5 -2.686 -1.295 4.199
43 3HG2 VAL 5 3HG2 VAL 5 -2.810 -2.613 5.364
44 H LYS 6 H LYS 6 -4.970 2.265 5.828
45 HA LYS 6 HA LYS 6 -6.235 2.648 8.421
46 1HB LYS 6 2HB LYS 6 -6.545 4.210 5.856
47 2HB LYS 6 1HB LYS 6 -7.239 4.650 7.410
48 1HG LYS 6 2HG LYS 6 -5.216 5.291 8.283
49 2HG LYS 6 1HG LYS 6 -4.295 4.249 7.196
50 1HD LYS 6 2HD LYS 6 -3.933 6.505 6.506
51 2HD LYS 6 1HD LYS 6 -4.991 5.748 5.312
52 1HE LYS 6 2HE LYS 6 -6.929 6.739 6.602
53 2HE LYS 6 1HE LYS 6 -5.736 7.682 7.494
54 1HZ LYS 6 1HZ LYS 6 -6.108 9.150 5.852
55 2HZ LYS 6 2HZ LYS 6 -6.670 7.983 4.764
56 3HZ LYS 6 3HZ LYS 6 -5.008 8.198 4.987
57 H PHE 7 H PHE 7 -8.057 3.247 5.515
58 HA PHE 7 HA PHE 7 -10.010 1.278 6.407
59 1HB PHE 7 2HB PHE 7 -10.185 3.934 5.258
60 2HB PHE 7 1HB PHE 7 -11.170 2.779 4.361
61 HD1 PHE 7 1HD PHE 7 -12.097 0.976 6.454
62 HD2 PHE 7 2HD PHE 7 -11.659 5.209 6.494
63 HE1 PHE 7 1HE PHE 7 -13.851 1.137 8.171
64 HE2 PHE 7 2HE PHE 7 -13.412 5.378 8.211
65 HZ PHE 7 HZ PHE 7 -14.511 3.341 9.052
66 H ALA 8 H ALA 8 -10.962 -0.190 4.972
67 HA ALA 8 HA ALA 8 -9.216 -1.038 2.834
68 1HB ALA 8 1HB ALA 8 -11.787 -2.378 3.587
69 2HB ALA 8 2HB ALA 8 -10.337 -2.549 4.573
70 3HB ALA 8 3HB ALA 8 -10.327 -3.087 2.894
71 H TYR 9 H TYR 9 -9.715 -1.095 0.670
72 HA TYR 9 HA TYR 9 -12.334 -0.065 -0.157
73 1HB TYR 9 2HB TYR 9 -10.793 1.834 -0.227
74 2HB TYR 9 1HB TYR 9 -9.669 0.903 -1.216
75 HD1 TYR 9 1HD TYR 9 -9.592 1.789 -3.342
76 HD2 TYR 9 2HD TYR 9 -13.364 1.454 -1.406
77 HE1 TYR 9 1HE TYR 9 -10.702 2.603 -5.380
78 HE2 TYR 9 2HE TYR 9 -14.487 2.267 -3.438
79 HH TYR 9 HH TYR 9 -12.761 3.639 -6.066
80 H VAL 10 H VAL 10 -13.163 -0.985 -1.979
81 HA VAL 10 HA VAL 10 -11.796 -3.339 -2.957
82 HB VAL 10 HB VAL 10 -13.949 -3.706 -4.230
83 1HG1 VAL 10 1HG1 VAL 10 -13.604 -4.915 -2.218
84 2HG1 VAL 10 2HG1 VAL 10 -15.244 -4.269 -2.147
85 3HG1 VAL 10 3HG1 VAL 10 -13.952 -3.496 -1.228
86 1HG2 VAL 10 1HG2 VAL 10 -14.414 -1.065 -3.685
87 2HG2 VAL 10 2HG2 VAL 10 -15.422 -1.877 -2.486
88 3HG2 VAL 10 3HG2 VAL 10 -15.634 -2.229 -4.202
89 H ALA 11 H ALA 11 -10.433 -3.150 -4.611
90 HA ALA 11 HA ALA 11 -11.233 -2.090 -7.107
91 1HB ALA 11 1HB ALA 11 -8.953 -0.475 -6.167
92 2HB ALA 11 2HB ALA 11 -10.527 -0.075 -5.477
93 3HB ALA 11 3HB ALA 11 -10.295 -0.041 -7.225
94 H GLU 12 H GLU 12 -10.484 -3.967 -7.999
95 HA GLU 12 HA GLU 12 -7.562 -4.321 -7.943
96 1HB GLU 12 2HB GLU 12 -9.551 -6.584 -8.113
97 2HB GLU 12 1HB GLU 12 -7.807 -6.707 -7.933
98 1HG GLU 12 2HG GLU 12 -7.936 -5.762 -5.712
99 2HG GLU 12 1HG GLU 12 -9.674 -5.526 -5.889
100 H ARG 13 H ARG 13 -6.732 -4.000 -9.867
101 HA ARG 13 HA ARG 13 -7.836 -5.227 -12.204
102 1HB ARG 13 2HB ARG 13 -8.921 -3.469 -13.039
103 2HB ARG 13 1HB ARG 13 -8.505 -2.542 -11.606
104 1HG ARG 13 2HG ARG 13 -6.403 -2.681 -13.676
105 2HG ARG 13 1HG ARG 13 -7.871 -1.818 -14.117
106 1HD ARG 13 2HD ARG 13 -7.289 -0.994 -11.529
107 2HD ARG 13 1HD ARG 13 -5.732 -1.028 -12.358
108 HE ARG 13 HE ARG 13 -6.402 0.764 -13.618
109 1HH1 ARG 13 1HH1 ARG 13 -9.198 -0.631 -12.062
110 2HH1 ARG 13 2HH1 ARG 13 -10.260 0.649 -12.543
111 1HH2 ARG 13 1HH2 ARG 13 -7.797 2.449 -14.249
112 2HH2 ARG 13 2HH2 ARG 13 -9.464 2.397 -13.786
113 H GLU 14 H GLU 14 -6.340 -4.589 -14.174
114 HA GLU 14 HA GLU 14 -3.778 -5.470 -13.598
115 1HB GLU 14 2HB GLU 14 -3.180 -4.400 -15.850
116 2HB GLU 14 1HB GLU 14 -4.448 -5.619 -15.845
117 1HG GLU 14 2HG GLU 14 -5.415 -2.886 -15.471
118 2HG GLU 14 1HG GLU 14 -4.620 -3.172 -17.018
119 H ASP 15 H ASP 15 -2.459 -4.525 -12.193
120 HA ASP 15 HA ASP 15 -0.855 -3.025 -11.507
121 1HB ASP 15 2HB ASP 15 -1.441 -1.955 -13.958
122 2HB ASP 15 1HB ASP 15 -1.901 -0.640 -12.876
123 H GLU 16 H GLU 16 -3.833 -3.316 -10.681
124 HA GLU 16 HA GLU 16 -3.830 -1.021 -8.850
125 1HB GLU 16 2HB GLU 16 -5.612 -0.493 -10.255
126 2HB GLU 16 1HB GLU 16 -6.035 -2.177 -10.509
127 1HG GLU 16 2HG GLU 16 -7.496 -2.161 -8.861
128 2HG GLU 16 1HG GLU 16 -6.349 -1.409 -7.756
129 H LEU 17 H LEU 17 -4.423 -1.439 -6.738
130 HA LEU 17 HA LEU 17 -5.008 -4.236 -6.064
131 1HB LEU 17 2HB LEU 17 -3.621 -3.970 -4.005
132 2HB LEU 17 1HB LEU 17 -2.729 -4.039 -5.512
133 HG LEU 17 HG LEU 17 -1.915 -1.914 -5.291
134 1HD1 LEU 17 1HD1 LEU 17 -4.245 -1.124 -3.550
135 2HD1 LEU 17 2HD1 LEU 17 -4.109 -0.789 -5.274
136 3HD1 LEU 17 3HD1 LEU 17 -2.967 -0.068 -4.149
137 1HD2 LEU 17 1HD2 LEU 17 -1.283 -1.503 -2.995
138 2HD2 LEU 17 2HD2 LEU 17 -1.219 -3.230 -3.340
139 3HD2 LEU 17 3HD2 LEU 17 -2.569 -2.563 -2.424
140 H SER 18 H SER 18 -6.188 -4.611 -4.163
141 HA SER 18 HA SER 18 -7.983 -2.443 -3.487
142 1HB SER 18 2HB SER 18 -9.499 -4.044 -2.805
143 2HB SER 18 1HB SER 18 -8.570 -4.984 -3.976
144 HG SER 18 HG SER 18 -8.589 -5.121 -1.184
145 H LEU 19 H LEU 19 -8.317 -1.701 -1.329
146 HA LEU 19 HA LEU 19 -5.915 -1.981 0.304
147 1HB LEU 19 2HB LEU 19 -8.113 -0.155 1.114
148 2HB LEU 19 1HB LEU 19 -6.373 0.059 1.226
149 HG LEU 19 HG LEU 19 -7.911 0.202 -1.359
150 1HD1 LEU 19 1HD1 LEU 19 -8.385 1.977 0.482
151 2HD1 LEU 19 2HD1 LEU 19 -8.069 2.492 -1.174
152 3HD1 LEU 19 3HD1 LEU 19 -6.791 2.587 0.039
153 1HD2 LEU 19 1HD2 LEU 19 -5.204 1.346 -0.830
154 2HD2 LEU 19 2HD2 LEU 19 -5.951 0.898 -2.364
155 3HD2 LEU 19 3HD2 LEU 19 -5.391 -0.355 -1.257
156 H VAL 20 H VAL 20 -5.941 -2.422 2.494
157 HA VAL 20 HA VAL 20 -8.083 -4.238 3.316
158 HB VAL 20 HB VAL 20 -5.728 -3.912 5.061
159 1HG1 VAL 20 1HG1 VAL 20 -7.454 -6.132 4.043
160 2HG1 VAL 20 2HG1 VAL 20 -7.119 -5.640 5.704
161 3HG1 VAL 20 3HG1 VAL 20 -5.888 -6.493 4.772
162 1HG2 VAL 20 1HG2 VAL 20 -4.492 -5.555 3.446
163 2HG2 VAL 20 2HG2 VAL 20 -4.386 -3.813 3.184
164 3HG2 VAL 20 3HG2 VAL 20 -5.489 -4.785 2.212
165 H LYS 21 H LYS 21 -8.659 -4.257 5.657
166 HA LYS 21 HA LYS 21 -9.014 -1.497 6.585
167 1HB LYS 21 2HB LYS 21 -10.790 -2.493 8.047
168 2HB LYS 21 1HB LYS 21 -11.122 -2.543 6.322
169 1HG LYS 21 2HG LYS 21 -9.856 -4.896 7.650
170 2HG LYS 21 1HG LYS 21 -11.592 -4.627 7.806
171 1HD LYS 21 2HD LYS 21 -11.993 -5.171 5.653
172 2HD LYS 21 1HD LYS 21 -10.524 -4.393 5.074
173 1HE LYS 21 2HE LYS 21 -10.393 -6.779 4.699
174 2HE LYS 21 1HE LYS 21 -9.208 -6.293 5.913
175 1HZ LYS 21 1HZ LYS 21 -10.082 -8.003 7.046
176 2HZ LYS 21 2HZ LYS 21 -11.532 -8.002 6.175
177 3HZ LYS 21 3HZ LYS 21 -11.309 -6.907 7.445
178 H GLY 22 H GLY 22 -7.328 -1.025 7.820
179 1HA GLY 22 2HA GLY 22 -6.122 -0.904 9.775
180 2HA GLY 22 1HA GLY 22 -7.160 -2.159 10.422
181 H SER 23 H SER 23 -5.623 -2.992 7.485
182 HA SER 23 HA SER 23 -3.978 -4.908 8.887
183 1HB SER 23 2HB SER 23 -5.376 -5.056 6.560
184 2HB SER 23 1HB SER 23 -3.737 -4.779 5.974
185 HG SER 23 HG SER 23 -3.218 -6.728 6.560
186 H ARG 24 H ARG 24 -1.725 -5.297 7.734
187 HA ARG 24 HA ARG 24 -0.404 -2.677 7.554
188 1HB ARG 24 2HB ARG 24 0.757 -5.176 8.717
189 2HB ARG 24 1HB ARG 24 1.528 -3.604 8.665
190 1HG ARG 24 2HG ARG 24 -1.084 -3.548 9.942
191 2HG ARG 24 1HG ARG 24 0.061 -4.624 10.753
192 1HD ARG 24 2HD ARG 24 1.682 -2.572 10.442
193 2HD ARG 24 1HD ARG 24 0.168 -1.675 10.348
194 HE ARG 24 HE ARG 24 1.323 -2.893 12.683
195 1HH1 ARG 24 1HH1 ARG 24 -1.630 -1.757 11.209
196 2HH1 ARG 24 2HH1 ARG 24 -2.437 -1.510 12.721
197 1HH2 ARG 24 1HH2 ARG 24 0.266 -2.567 14.670
198 2HH2 ARG 24 2HH2 ARG 24 -1.360 -1.969 14.687
199 H VAL 25 H VAL 25 1.330 -2.436 6.144
200 HA VAL 25 HA VAL 25 1.660 -4.585 4.153
201 HB VAL 25 HB VAL 25 1.834 -1.657 3.480
202 1HG1 VAL 25 1HG1 VAL 25 2.821 -2.800 1.752
203 2HG1 VAL 25 2HG1 VAL 25 1.145 -2.762 1.205
204 3HG1 VAL 25 3HG1 VAL 25 1.793 -4.219 1.958
205 1HG2 VAL 25 1HG2 VAL 25 -0.566 -3.337 3.845
206 2HG2 VAL 25 2HG2 VAL 25 -0.517 -2.351 2.384
207 3HG2 VAL 25 3HG2 VAL 25 -0.374 -1.587 3.967
208 H THR 26 H THR 26 3.721 -4.353 2.867
209 HA THR 26 HA THR 26 5.908 -3.903 4.691
210 HB THR 26 HB THR 26 7.268 -5.045 3.193
211 HG1 THR 26 1HG THR 26 5.656 -3.862 1.312
212 1HG2 THR 26 1HG2 THR 26 5.227 -6.551 1.957
213 2HG2 THR 26 2HG2 THR 26 4.685 -6.145 3.584
214 3HG2 THR 26 3HG2 THR 26 6.222 -6.976 3.348
215 H VAL 27 H VAL 27 7.449 -2.304 4.589
216 HA VAL 27 HA VAL 27 6.719 0.183 3.628
217 HB VAL 27 HB VAL 27 8.457 -0.126 5.329
218 1HG1 VAL 27 1HG1 VAL 27 10.479 -1.131 4.991
219 2HG1 VAL 27 2HG1 VAL 27 10.512 -0.742 3.271
220 3HG1 VAL 27 3HG1 VAL 27 9.495 -2.058 3.858
221 1HG2 VAL 27 1HG2 VAL 27 8.731 1.608 2.999
222 2HG2 VAL 27 2HG2 VAL 27 10.244 1.364 3.872
223 3HG2 VAL 27 3HG2 VAL 27 8.828 1.992 4.716
224 H MET 28 H MET 28 6.153 0.437 1.606
225 HA MET 28 HA MET 28 7.004 -0.780 -0.678
226 1HB MET 28 2HB MET 28 6.185 2.118 -0.525
227 2HB MET 28 1HB MET 28 5.997 1.022 -1.893
228 1HG MET 28 2HG MET 28 3.976 0.520 -1.163
229 2HG MET 28 1HG MET 28 4.700 -0.205 0.267
230 1HE MET 28 1HE MET 28 2.634 1.609 2.727
231 2HE MET 28 2HE MET 28 3.863 0.369 2.473
232 3HE MET 28 3HE MET 28 2.359 0.321 1.554
233 H GLU 29 H GLU 29 7.875 0.785 -2.573
234 HA GLU 29 HA GLU 29 10.663 1.255 -1.859
235 1HB GLU 29 2HB GLU 29 11.175 0.839 -4.085
236 2HB GLU 29 1HB GLU 29 9.766 -0.174 -3.856
237 1HG GLU 29 2HG GLU 29 8.358 1.488 -4.920
238 2HG GLU 29 1HG GLU 29 9.739 2.569 -5.095
239 H LYS 30 H LYS 30 11.616 3.232 -1.904
240 HA LYS 30 HA LYS 30 9.998 5.548 -1.912
241 1HB LYS 30 2HB LYS 30 12.480 4.974 -0.969
242 2HB LYS 30 1HB LYS 30 12.885 5.920 -2.395
243 1HG LYS 30 2HG LYS 30 11.962 7.839 -1.561
244 2HG LYS 30 1HG LYS 30 10.824 6.969 -0.524
245 1HD LYS 30 2HD LYS 30 12.733 6.271 0.898
246 2HD LYS 30 1HD LYS 30 13.796 7.270 -0.095
247 1HE LYS 30 2HE LYS 30 11.410 8.645 0.923
248 2HE LYS 30 1HE LYS 30 12.538 8.109 2.168
249 1HZ LYS 30 1HZ LYS 30 14.077 9.593 1.532
250 2HZ LYS 30 2HZ LYS 30 12.766 10.413 0.848
251 3HZ LYS 30 3HZ LYS 30 13.741 9.423 -0.117
252 H CYS 31 H CYS 31 8.920 5.881 -3.794
253 HA CYS 31 HA CYS 31 10.438 5.981 -6.290
254 1HB CYS 31 2HB CYS 31 7.696 5.352 -5.572
255 2HB CYS 31 1HB CYS 31 7.764 6.543 -6.865
256 HG CYS 31 HG CYS 31 9.510 4.120 -7.422
257 H SER 32 H SER 32 10.411 7.813 -7.646
258 HA SER 32 HA SER 32 10.086 10.322 -6.194
259 1HB SER 32 2HB SER 32 12.165 9.623 -7.608
260 2HB SER 32 1HB SER 32 11.181 10.129 -8.981
261 HG SER 32 HG SER 32 10.902 12.153 -7.750
262 H ASP 33 H ASP 33 8.697 8.553 -8.848
263 HA ASP 33 HA ASP 33 7.073 10.852 -9.628
264 1HB ASP 33 2HB ASP 33 8.015 8.441 -10.951
265 2HB ASP 33 1HB ASP 33 6.279 8.670 -11.174
266 H GLY 34 H GLY 34 4.726 10.309 -10.147
267 1HA GLY 34 2HA GLY 34 3.317 9.804 -7.826
268 2HA GLY 34 1HA GLY 34 2.631 9.686 -9.442
269 H TRP 35 H TRP 35 4.676 7.494 -10.017
270 HA TRP 35 HA TRP 35 2.977 5.325 -9.185
271 1HB TRP 35 2HB TRP 35 4.253 3.956 -10.645
272 2HB TRP 35 1HB TRP 35 4.126 5.515 -11.447
273 HD1 TRP 35 HD TRP 35 6.517 7.008 -9.933
274 HE1 TRP 35 1HE TRP 35 8.944 6.341 -10.462
275 HE3 TRP 35 3HE TRP 35 5.676 2.343 -11.848
276 HZ2 TRP 35 2HZ TRP 35 10.322 4.129 -11.546
277 HZ3 TRP 35 3HZ TRP 35 7.604 1.015 -12.608
278 HH2 TRP 35 HH TRP 35 9.878 1.893 -12.460
279 H TRP 36 H TRP 36 3.318 3.895 -7.571
280 HA TRP 36 HA TRP 36 5.913 3.916 -6.229
281 1HB TRP 36 2HB TRP 36 3.540 5.024 -5.201
282 2HB TRP 36 1HB TRP 36 3.802 3.524 -4.319
283 HD1 TRP 36 HD TRP 36 6.428 3.314 -3.274
284 HE1 TRP 36 1HE TRP 36 7.761 5.152 -2.053
285 HE3 TRP 36 3HE TRP 36 3.888 7.411 -4.964
286 HZ2 TRP 36 2HZ TRP 36 7.732 7.967 -1.837
287 HZ3 TRP 36 3HZ TRP 36 4.601 9.640 -4.205
288 HH2 TRP 36 HH TRP 36 6.484 9.911 -2.674
289 H ARG 37 H ARG 37 6.724 1.962 -5.958
290 HA ARG 37 HA ARG 37 4.926 -0.353 -6.155
291 1HB ARG 37 2HB ARG 37 7.042 0.100 -7.716
292 2HB ARG 37 1HB ARG 37 7.868 -0.691 -6.379
293 1HG ARG 37 2HG ARG 37 7.353 -2.602 -7.387
294 2HG ARG 37 1HG ARG 37 5.719 -2.328 -6.800
295 1HD ARG 37 2HD ARG 37 4.948 -1.616 -8.839
296 2HD ARG 37 1HD ARG 37 6.536 -1.047 -9.358
297 HE ARG 37 HE ARG 37 6.870 -3.719 -9.238
298 1HH1 ARG 37 1HH1 ARG 37 4.453 -1.712 -10.756
299 2HH1 ARG 37 2HH1 ARG 37 4.157 -2.828 -12.047
300 1HH2 ARG 37 1HH2 ARG 37 6.481 -5.189 -10.936
301 2HH2 ARG 37 2HH2 ARG 37 5.307 -4.802 -12.149
302 H GLY 38 H GLY 38 5.196 -2.111 -4.740
303 1HA GLY 38 2HA GLY 38 7.052 -2.057 -2.576
304 2HA GLY 38 1HA GLY 38 5.467 -1.495 -2.060
305 H SER 39 H SER 39 5.838 -3.427 -0.628
306 HA SER 39 HA SER 39 4.698 -5.799 -1.928
307 1HB SER 39 2HB SER 39 6.408 -6.346 0.404
308 2HB SER 39 1HB SER 39 6.293 -7.198 -1.135
309 HG SER 39 HG SER 39 7.656 -5.701 -2.051
310 H TYR 40 H TYR 40 3.489 -7.199 -0.568
311 HA TYR 40 HA TYR 40 2.557 -6.062 1.961
312 1HB TYR 40 2HB TYR 40 0.933 -5.263 0.359
313 2HB TYR 40 1HB TYR 40 0.783 -6.868 -0.353
314 HD1 TYR 40 1HD TYR 40 -0.002 -4.817 2.611
315 HD2 TYR 40 2HD TYR 40 -0.646 -8.518 0.617
316 HE1 TYR 40 1HE TYR 40 -1.860 -5.313 4.145
317 HE2 TYR 40 2HE TYR 40 -2.505 -9.026 2.144
318 HH TYR 40 HH TYR 40 -2.990 -7.883 4.896
319 H ASN 41 H ASN 41 1.835 -7.613 3.450
320 HA ASN 41 HA ASN 41 2.993 -10.147 3.274
321 1HB ASN 41 2HB ASN 41 0.699 -9.311 5.019
322 2HB ASN 41 1HB ASN 41 1.742 -10.701 5.287
323 1HD2 ASN 41 1HD2 ASN 41 1.161 -7.604 6.186
324 2HD2 ASN 41 2HD2 ASN 41 2.718 -7.179 6.800
325 H GLY 42 H GLY 42 2.362 -11.039 1.279
326 1HA GLY 42 2HA GLY 42 0.659 -13.033 1.108
327 2HA GLY 42 1HA GLY 42 -0.447 -11.683 0.905
328 H GLN 43 H GLN 43 1.489 -10.064 -0.535
329 HA GLN 43 HA GLN 43 2.385 -11.438 -2.843
330 1HB GLN 43 2HB GLN 43 0.743 -10.330 -4.432
331 2HB GLN 43 1HB GLN 43 0.124 -11.680 -3.484
332 1HG GLN 43 2HG GLN 43 -0.532 -9.664 -1.851
333 2HG GLN 43 1HG GLN 43 -0.577 -8.814 -3.399
334 1HE2 GLN 43 1HE2 GLN 43 -2.295 -10.667 -1.249
335 2HE2 GLN 43 2HE2 GLN 43 -3.596 -11.152 -2.285
336 H ILE 44 H ILE 44 2.916 -9.840 -4.656
337 HA ILE 44 HA ILE 44 3.772 -7.276 -3.480
338 HB ILE 44 HB ILE 44 5.239 -9.270 -5.132
339 1HG1 ILE 44 2HG1 ILE 44 7.134 -8.282 -3.742
340 2HG1 ILE 44 1HG1 ILE 44 5.887 -7.358 -2.904
341 1HG2 ILE 44 1HG2 ILE 44 5.701 -6.301 -5.394
342 2HG2 ILE 44 2HG2 ILE 44 5.251 -7.423 -6.677
343 3HG2 ILE 44 3HG2 ILE 44 6.837 -7.543 -5.917
344 1HD1 ILE 44 1HD1 ILE 44 5.891 -10.356 -3.099
345 2HD1 ILE 44 2HD1 ILE 44 4.868 -9.341 -2.082
346 3HD1 ILE 44 3HD1 ILE 44 6.598 -9.452 -1.759
347 H GLY 45 H GLY 45 3.979 -5.469 -5.017
348 1HA GLY 45 2HA GLY 45 3.310 -5.350 -7.640
349 2HA GLY 45 1HA GLY 45 1.740 -5.462 -6.853
350 H TRP 46 H TRP 46 0.811 -3.548 -6.774
351 HA TRP 46 HA TRP 46 2.457 -1.142 -6.511
352 1HB TRP 46 2HB TRP 46 0.397 -1.645 -8.211
353 2HB TRP 46 1HB TRP 46 -0.460 -0.854 -6.889
354 HD1 TRP 46 HD TRP 46 3.065 0.056 -8.192
355 HE1 TRP 46 1HE TRP 46 3.028 2.517 -8.939
356 HE3 TRP 46 3HE TRP 46 -1.910 1.026 -7.529
357 HZ2 TRP 46 2HZ TRP 46 1.133 4.595 -9.220
358 HZ3 TRP 46 3HZ TRP 46 -2.756 3.275 -8.061
359 HH2 TRP 46 HH TRP 46 -1.263 5.020 -8.888
360 H PHE 47 H PHE 47 2.084 0.409 -4.925
361 HA PHE 47 HA PHE 47 1.225 -0.624 -2.414
362 1HB PHE 47 2HB PHE 47 2.030 1.387 -1.470
363 2HB PHE 47 1HB PHE 47 3.107 1.034 -2.817
364 HD1 PHE 47 1HD PHE 47 2.630 3.701 -1.383
365 HD2 PHE 47 2HD PHE 47 1.023 2.020 -4.947
366 HE1 PHE 47 1HE PHE 47 2.244 5.961 -2.272
367 HE2 PHE 47 2HE PHE 47 0.631 4.276 -5.839
368 HZ PHE 47 HZ PHE 47 1.243 6.252 -4.503
369 HA PRO 48 HA PRO 48 -2.941 0.966 -2.544
370 1HB PRO 48 2HB PRO 48 -3.734 0.105 -0.146
371 2HB PRO 48 1HB PRO 48 -3.322 -1.035 -1.432
372 1HG PRO 48 2HG PRO 48 -1.815 -0.323 1.015
373 2HG PRO 48 1HG PRO 48 -1.802 -1.827 0.083
374 1HD PRO 48 2HD PRO 48 0.079 0.329 -0.034
375 2HD PRO 48 1HD PRO 48 0.060 -1.154 -1.007
376 H SER 49 H SER 49 -0.807 2.836 -1.725
377 HA SER 49 HA SER 49 -0.912 4.229 0.521
378 1HB SER 49 2HB SER 49 -0.339 4.862 -2.194
379 2HB SER 49 1HB SER 49 -1.152 6.239 -1.450
380 HG SER 49 HG SER 49 1.070 4.891 -0.310
381 H ASN 50 H ASN 50 -3.631 4.085 -1.694
382 HA ASN 50 HA ASN 50 -5.120 6.255 -1.167
383 1HB ASN 50 2HB ASN 50 -5.715 3.443 -1.729
384 2HB ASN 50 1HB ASN 50 -7.048 4.350 -1.029
385 1HD2 ASN 50 1HD2 ASN 50 -8.222 4.198 -2.927
386 2HD2 ASN 50 2HD2 ASN 50 -7.829 5.140 -4.315
387 H TYR 51 H TYR 51 -4.384 3.702 1.082
388 HA TYR 51 HA TYR 51 -5.237 5.343 3.263
389 1HB TYR 51 2HB TYR 51 -6.840 2.955 2.432
390 2HB TYR 51 1HB TYR 51 -6.669 3.313 4.150
391 HD1 TYR 51 1HD TYR 51 -8.573 3.929 1.250
392 HD2 TYR 51 2HD TYR 51 -7.228 5.792 4.831
393 HE1 TYR 51 1HE TYR 51 -10.401 5.564 1.079
394 HE2 TYR 51 2HE TYR 51 -9.053 7.432 4.669
395 HH TYR 51 HH TYR 51 -10.851 7.917 1.899
396 H VAL 52 H VAL 52 -2.788 4.834 3.087
397 HA VAL 52 HA VAL 52 -2.282 2.643 4.949
398 HB VAL 52 HB VAL 52 -0.596 1.639 3.749
399 1HG1 VAL 52 1HG1 VAL 52 -2.663 2.659 1.845
400 2HG1 VAL 52 2HG1 VAL 52 -2.504 1.055 2.557
401 3HG1 VAL 52 3HG1 VAL 52 -1.380 1.581 1.304
402 1HG2 VAL 52 1HG2 VAL 52 0.967 3.198 3.171
403 2HG2 VAL 52 2HG2 VAL 52 -0.229 4.318 2.516
404 3HG2 VAL 52 3HG2 VAL 52 0.265 2.907 1.580
405 H LEU 53 H LEU 53 -0.138 2.746 5.981
406 HA LEU 53 HA LEU 53 0.908 5.477 6.173
407 1HB LEU 53 2HB LEU 53 -0.594 4.726 8.098
408 2HB LEU 53 1HB LEU 53 0.697 3.621 8.503
409 HG LEU 53 HG LEU 53 2.154 5.365 9.063
410 1HD1 LEU 53 1HD1 LEU 53 1.862 6.868 7.253
411 2HD1 LEU 53 2HD1 LEU 53 1.501 7.764 8.729
412 3HD1 LEU 53 3HD1 LEU 53 0.187 7.184 7.705
413 1HD2 LEU 53 1HD2 LEU 53 1.154 6.033 10.968
414 2HD2 LEU 53 2HD2 LEU 53 -0.124 4.943 10.428
415 3HD2 LEU 53 3HD2 LEU 53 -0.254 6.677 10.124
416 H GLU 54 H GLU 54 2.973 5.464 5.539
417 HA GLU 54 HA GLU 54 4.529 3.000 5.881
418 1HB GLU 54 2HB GLU 54 4.300 3.790 3.580
419 2HB GLU 54 1HB GLU 54 4.993 5.342 4.030
420 1HG GLU 54 2HG GLU 54 6.777 3.280 4.840
421 2HG GLU 54 1HG GLU 54 6.311 3.002 3.161
422 H GLU 55 H GLU 55 6.349 2.940 7.066
423 HA GLU 55 HA GLU 55 7.127 5.391 8.453
424 1HB GLU 55 2HB GLU 55 8.004 2.620 9.210
425 2HB GLU 55 1HB GLU 55 7.934 4.057 10.221
426 1HG GLU 55 2HG GLU 55 5.326 3.649 9.374
427 2HG GLU 55 1HG GLU 55 5.950 2.041 9.734
428 H VAL 56 H VAL 56 8.853 6.401 7.668
429 HA VAL 56 HA VAL 56 10.731 4.993 5.986
430 HB VAL 56 HB VAL 56 10.783 7.900 6.788
431 1HG1 VAL 56 1HG1 VAL 56 12.369 6.208 4.967
432 2HG1 VAL 56 2HG1 VAL 56 12.817 7.678 5.833
433 3HG1 VAL 56 3HG1 VAL 56 11.889 7.784 4.337
434 1HG2 VAL 56 1HG2 VAL 56 9.183 8.381 5.300
435 2HG2 VAL 56 2HG2 VAL 56 8.778 6.666 5.363
436 3HG2 VAL 56 3HG2 VAL 56 9.847 7.273 4.099
437 H ASP 57 H ASP 57 11.734 3.630 7.516
438 HA ASP 57 HA ASP 57 12.875 4.339 9.928
439 1HB ASP 57 2HB ASP 57 12.837 2.071 8.320
440 2HB ASP 57 1HB ASP 57 14.549 2.461 8.459
Start of MODEL 5
1 1H ILE 1 1HT ILE 1 10.953 -1.374 9.998
2 2H ILE 1 2HT ILE 1 10.369 -2.867 9.385
3 3H ILE 1 3HT ILE 1 10.819 -2.730 11.036
4 HA ILE 1 HA ILE 1 8.584 -2.627 11.144
5 HB ILE 1 HB ILE 1 9.291 0.278 10.752
6 1HG1 ILE 1 2HG1 ILE 1 9.599 -1.257 13.327
7 2HG1 ILE 1 1HG1 ILE 1 10.928 -1.099 12.182
8 1HG2 ILE 1 1HG2 ILE 1 7.669 0.410 12.757
9 2HG2 ILE 1 2HG2 ILE 1 7.169 -1.204 12.253
10 3HG2 ILE 1 3HG2 ILE 1 7.008 0.156 11.142
11 1HD1 ILE 1 1HD1 ILE 1 9.645 1.434 12.855
12 2HD1 ILE 1 2HD1 ILE 1 11.353 0.999 12.802
13 3HD1 ILE 1 3HD1 ILE 1 10.389 0.613 14.227
14 HA PRO 2 HA PRO 2 6.632 -2.009 7.177
15 1HB PRO 2 2HB PRO 2 4.308 -3.195 7.730
16 2HB PRO 2 1HB PRO 2 5.805 -4.128 7.636
17 1HG PRO 2 2HG PRO 2 4.257 -3.265 10.022
18 2HG PRO 2 1HG PRO 2 5.215 -4.733 9.772
19 1HD PRO 2 2HD PRO 2 6.023 -2.388 11.127
20 2HD PRO 2 1HD PRO 2 7.052 -3.757 10.665
21 H ALA 3 H ALA 3 4.227 -1.368 6.537
22 HA ALA 3 HA ALA 3 3.727 1.179 7.844
23 1HB ALA 3 1HB ALA 3 3.127 0.109 5.123
24 2HB ALA 3 2HB ALA 3 3.961 1.592 5.589
25 3HB ALA 3 3HB ALA 3 2.209 1.474 5.758
26 H PHE 4 H PHE 4 1.317 1.861 7.794
27 HA PHE 4 HA PHE 4 -0.358 -0.383 8.629
28 1HB PHE 4 2HB PHE 4 0.067 0.507 10.689
29 2HB PHE 4 1HB PHE 4 0.284 2.128 10.051
30 HD1 PHE 4 1HD PHE 4 -1.242 3.649 10.821
31 HD2 PHE 4 2HD PHE 4 -2.487 -0.370 10.186
32 HE1 PHE 4 1HE PHE 4 -3.511 4.239 11.566
33 HE2 PHE 4 2HE PHE 4 -4.760 0.212 10.930
34 HZ PHE 4 HZ PHE 4 -5.274 2.519 11.621
35 H VAL 5 H VAL 5 -2.122 -0.566 7.411
36 HA VAL 5 HA VAL 5 -2.945 1.523 5.635
37 HB VAL 5 HB VAL 5 -4.439 -1.012 6.321
38 1HG1 VAL 5 1HG1 VAL 5 -4.605 0.904 4.002
39 2HG1 VAL 5 2HG1 VAL 5 -5.863 0.521 5.178
40 3HG1 VAL 5 3HG1 VAL 5 -5.351 -0.694 4.009
41 1HG2 VAL 5 1HG2 VAL 5 -3.246 -2.168 4.706
42 2HG2 VAL 5 2HG2 VAL 5 -1.996 -1.196 5.483
43 3HG2 VAL 5 3HG2 VAL 5 -2.668 -0.693 3.932
44 H LYS 6 H LYS 6 -4.583 2.954 5.826
45 HA LYS 6 HA LYS 6 -5.756 3.299 8.441
46 1HB LYS 6 2HB LYS 6 -6.049 4.914 5.909
47 2HB LYS 6 1HB LYS 6 -6.715 5.368 7.471
48 1HG LYS 6 2HG LYS 6 -4.655 5.880 8.357
49 2HG LYS 6 1HG LYS 6 -3.791 4.841 7.222
50 1HD LYS 6 2HD LYS 6 -3.775 6.419 5.576
51 2HD LYS 6 1HD LYS 6 -5.299 7.138 6.100
52 1HE LYS 6 2HE LYS 6 -2.605 7.457 7.414
53 2HE LYS 6 1HE LYS 6 -3.483 8.683 6.500
54 1HZ LYS 6 1HZ LYS 6 -3.950 7.694 9.210
55 2HZ LYS 6 2HZ LYS 6 -5.306 8.136 8.300
56 3HZ LYS 6 3HZ LYS 6 -4.081 9.265 8.594
57 H PHE 7 H PHE 7 -7.273 3.510 5.259
58 HA PHE 7 HA PHE 7 -9.588 2.087 6.342
59 1HB PHE 7 2HB PHE 7 -9.575 4.614 5.388
60 2HB PHE 7 1HB PHE 7 -9.963 3.710 3.927
61 HD1 PHE 7 1HD PHE 7 -10.948 3.109 7.462
62 HD2 PHE 7 2HD PHE 7 -12.202 4.073 3.511
63 HE1 PHE 7 1HE PHE 7 -13.299 2.964 8.176
64 HE2 PHE 7 2HE PHE 7 -14.554 3.930 4.217
65 HZ PHE 7 HZ PHE 7 -15.105 3.376 6.552
66 H ALA 8 H ALA 8 -10.690 0.591 5.032
67 HA ALA 8 HA ALA 8 -8.989 -0.744 3.108
68 1HB ALA 8 1HB ALA 8 -11.045 -1.546 4.925
69 2HB ALA 8 2HB ALA 8 -9.916 -2.546 4.011
70 3HB ALA 8 3HB ALA 8 -11.458 -2.080 3.296
71 H TYR 9 H TYR 9 -9.275 -0.742 0.950
72 HA TYR 9 HA TYR 9 -11.810 0.289 -0.112
73 1HB TYR 9 2HB TYR 9 -10.101 2.108 -0.087
74 2HB TYR 9 1HB TYR 9 -9.087 1.117 -1.132
75 HD1 TYR 9 1HD TYR 9 -9.185 1.507 -3.403
76 HD2 TYR 9 2HD TYR 9 -12.580 2.443 -1.016
77 HE1 TYR 9 1HE TYR 9 -10.320 2.416 -5.385
78 HE2 TYR 9 2HE TYR 9 -13.725 3.356 -2.992
79 HH TYR 9 HH TYR 9 -12.102 3.937 -5.953
80 H VAL 10 H VAL 10 -12.404 -0.496 -2.144
81 HA VAL 10 HA VAL 10 -11.178 -3.024 -2.854
82 HB VAL 10 HB VAL 10 -13.086 -3.170 -4.495
83 1HG1 VAL 10 1HG1 VAL 10 -13.662 -4.406 -2.698
84 2HG1 VAL 10 2HG1 VAL 10 -14.825 -3.106 -2.441
85 3HG1 VAL 10 3HG1 VAL 10 -13.299 -3.112 -1.557
86 1HG2 VAL 10 1HG2 VAL 10 -13.379 -0.659 -4.583
87 2HG2 VAL 10 2HG2 VAL 10 -14.190 -0.789 -3.021
88 3HG2 VAL 10 3HG2 VAL 10 -14.860 -1.605 -4.434
89 H ALA 11 H ALA 11 -10.137 -3.430 -4.822
90 HA ALA 11 HA ALA 11 -9.889 -1.141 -6.637
91 1HB ALA 11 1HB ALA 11 -7.565 -1.108 -6.610
92 2HB ALA 11 2HB ALA 11 -7.456 -2.694 -5.850
93 3HB ALA 11 3HB ALA 11 -8.007 -1.303 -4.914
94 H GLU 12 H GLU 12 -8.030 -2.026 -8.313
95 HA GLU 12 HA GLU 12 -9.433 -3.939 -9.922
96 1HB GLU 12 2HB GLU 12 -7.195 -2.028 -10.316
97 2HB GLU 12 1HB GLU 12 -7.252 -3.423 -11.384
98 1HG GLU 12 2HG GLU 12 -8.838 -2.488 -12.607
99 2HG GLU 12 1HG GLU 12 -9.856 -2.252 -11.187
100 H ARG 13 H ARG 13 -7.903 -5.440 -11.243
101 HA ARG 13 HA ARG 13 -6.859 -7.344 -9.370
102 1HB ARG 13 2HB ARG 13 -6.909 -8.900 -11.128
103 2HB ARG 13 1HB ARG 13 -8.291 -7.858 -11.413
104 1HG ARG 13 2HG ARG 13 -5.684 -7.922 -12.897
105 2HG ARG 13 1HG ARG 13 -7.307 -8.221 -13.515
106 1HD ARG 13 2HD ARG 13 -7.886 -5.886 -13.182
107 2HD ARG 13 1HD ARG 13 -6.297 -5.572 -12.486
108 HE ARG 13 HE ARG 13 -6.207 -6.665 -15.143
109 1HH1 ARG 13 1HH1 ARG 13 -6.452 -3.740 -13.257
110 2HH1 ARG 13 2HH1 ARG 13 -5.821 -2.729 -14.513
111 1HH2 ARG 13 1HH2 ARG 13 -5.376 -5.339 -16.796
112 2HH2 ARG 13 2HH2 ARG 13 -5.211 -3.637 -16.524
113 H GLU 14 H GLU 14 -4.910 -8.524 -11.227
114 HA GLU 14 HA GLU 14 -2.595 -7.501 -10.195
115 1HB GLU 14 2HB GLU 14 -2.866 -8.763 -12.929
116 2HB GLU 14 1HB GLU 14 -1.397 -8.669 -11.968
117 1HG GLU 14 2HG GLU 14 -3.787 -10.011 -10.811
118 2HG GLU 14 1HG GLU 14 -2.840 -10.852 -12.037
119 H ASP 15 H ASP 15 -2.106 -5.522 -10.198
120 HA ASP 15 HA ASP 15 -0.771 -4.020 -11.902
121 1HB ASP 15 2HB ASP 15 -2.488 -4.130 -13.636
122 2HB ASP 15 1HB ASP 15 -3.716 -3.580 -12.495
123 H GLU 16 H GLU 16 -3.844 -3.637 -10.261
124 HA GLU 16 HA GLU 16 -2.595 -1.882 -8.277
125 1HB GLU 16 2HB GLU 16 -3.945 -0.170 -8.805
126 2HB GLU 16 1HB GLU 16 -4.564 -1.099 -10.153
127 1HG GLU 16 2HG GLU 16 -6.258 -2.075 -8.674
128 2HG GLU 16 1HG GLU 16 -5.661 -1.043 -7.383
129 H LEU 17 H LEU 17 -3.520 -2.148 -6.124
130 HA LEU 17 HA LEU 17 -5.267 -4.504 -5.926
131 1HB LEU 17 2HB LEU 17 -3.841 -4.832 -3.687
132 2HB LEU 17 1HB LEU 17 -3.455 -5.603 -5.215
133 HG LEU 17 HG LEU 17 -1.472 -4.688 -4.117
134 1HD1 LEU 17 1HD1 LEU 17 -1.717 -2.875 -6.421
135 2HD1 LEU 17 2HD1 LEU 17 -2.038 -4.581 -6.731
136 3HD1 LEU 17 3HD1 LEU 17 -0.491 -4.085 -6.044
137 1HD2 LEU 17 1HD2 LEU 17 -1.150 -2.414 -3.660
138 2HD2 LEU 17 2HD2 LEU 17 -2.768 -2.771 -3.059
139 3HD2 LEU 17 3HD2 LEU 17 -2.563 -1.935 -4.597
140 H SER 18 H SER 18 -6.569 -4.726 -4.157
141 HA SER 18 HA SER 18 -7.761 -2.364 -3.183
142 1HB SER 18 2HB SER 18 -9.407 -3.729 -2.361
143 2HB SER 18 1HB SER 18 -8.670 -4.853 -3.507
144 HG SER 18 HG SER 18 -7.434 -5.677 -1.746
145 H LEU 19 H LEU 19 -7.881 -1.562 -1.048
146 HA LEU 19 HA LEU 19 -5.418 -1.985 0.458
147 1HB LEU 19 2HB LEU 19 -7.462 0.004 1.305
148 2HB LEU 19 1HB LEU 19 -5.710 0.110 1.353
149 HG LEU 19 HG LEU 19 -7.397 0.339 -1.128
150 1HD1 LEU 19 1HD1 LEU 19 -7.326 2.598 -0.961
151 2HD1 LEU 19 2HD1 LEU 19 -5.779 2.596 -0.113
152 3HD1 LEU 19 3HD1 LEU 19 -7.265 2.217 0.760
153 1HD2 LEU 19 1HD2 LEU 19 -4.512 1.062 -0.919
154 2HD2 LEU 19 2HD2 LEU 19 -5.471 0.673 -2.346
155 3HD2 LEU 19 3HD2 LEU 19 -4.996 -0.605 -1.230
156 H VAL 20 H VAL 20 -5.365 -2.379 2.667
157 HA VAL 20 HA VAL 20 -7.331 -4.249 3.580
158 HB VAL 20 HB VAL 20 -5.192 -3.129 5.355
159 1HG1 VAL 20 1HG1 VAL 20 -6.922 -5.495 5.261
160 2HG1 VAL 20 2HG1 VAL 20 -6.185 -4.679 6.638
161 3HG1 VAL 20 3HG1 VAL 20 -5.242 -5.824 5.684
162 1HG2 VAL 20 1HG2 VAL 20 -3.923 -3.528 3.417
163 2HG2 VAL 20 2HG2 VAL 20 -4.828 -4.990 3.024
164 3HG2 VAL 20 3HG2 VAL 20 -3.723 -4.979 4.399
165 H LYS 21 H LYS 21 -8.321 -4.161 5.721
166 HA LYS 21 HA LYS 21 -9.556 -1.565 6.156
167 1HB LYS 21 2HB LYS 21 -10.228 -4.049 7.700
168 2HB LYS 21 1HB LYS 21 -11.264 -2.690 7.294
169 1HG LYS 21 2HG LYS 21 -11.869 -3.578 5.328
170 2HG LYS 21 1HG LYS 21 -10.247 -4.174 4.978
171 1HD LYS 21 2HD LYS 21 -10.982 -5.777 7.052
172 2HD LYS 21 1HD LYS 21 -12.525 -5.527 6.233
173 1HE LYS 21 2HE LYS 21 -11.181 -6.083 4.085
174 2HE LYS 21 1HE LYS 21 -10.015 -6.791 5.203
175 1HZ LYS 21 1HZ LYS 21 -11.790 -8.194 6.081
176 2HZ LYS 21 2HZ LYS 21 -11.569 -8.449 4.424
177 3HZ LYS 21 3HZ LYS 21 -12.882 -7.533 4.970
178 H GLY 22 H GLY 22 -7.657 -3.956 7.958
179 1HA GLY 22 2HA GLY 22 -6.629 -1.883 9.662
180 2HA GLY 22 1HA GLY 22 -7.695 -2.998 10.487
181 H SER 23 H SER 23 -4.990 -3.129 8.221
182 HA SER 23 HA SER 23 -3.669 -5.040 9.978
183 1HB SER 23 2HB SER 23 -4.882 -5.840 7.639
184 2HB SER 23 1HB SER 23 -3.197 -5.616 7.167
185 HG SER 23 HG SER 23 -2.575 -7.125 8.616
186 H ARG 24 H ARG 24 -1.380 -5.505 8.569
187 HA ARG 24 HA ARG 24 -0.275 -2.804 8.215
188 1HB ARG 24 2HB ARG 24 0.865 -5.177 9.606
189 2HB ARG 24 1HB ARG 24 1.900 -3.887 9.025
190 1HG ARG 24 2HG ARG 24 -0.432 -3.120 10.679
191 2HG ARG 24 1HG ARG 24 0.910 -3.940 11.490
192 1HD ARG 24 2HD ARG 24 2.354 -2.187 10.175
193 2HD ARG 24 1HD ARG 24 0.839 -1.289 10.124
194 HE ARG 24 HE ARG 24 1.136 -0.775 12.322
195 1HH1 ARG 24 1HH1 ARG 24 3.059 -3.594 11.592
196 2HH1 ARG 24 2HH1 ARG 24 3.801 -3.647 13.155
197 1HH2 ARG 24 1HH2 ARG 24 2.111 -0.844 14.379
198 2HH2 ARG 24 2HH2 ARG 24 3.262 -2.087 14.738
199 H VAL 25 H VAL 25 0.826 -2.377 6.451
200 HA VAL 25 HA VAL 25 1.407 -4.568 4.569
201 HB VAL 25 HB VAL 25 1.056 -1.642 3.894
202 1HG1 VAL 25 1HG1 VAL 25 2.277 -2.624 2.168
203 2HG1 VAL 25 2HG1 VAL 25 0.609 -2.714 1.600
204 3HG1 VAL 25 3HG1 VAL 25 1.389 -4.144 2.277
205 1HG2 VAL 25 1HG2 VAL 25 -0.992 -2.794 4.864
206 2HG2 VAL 25 2HG2 VAL 25 -0.982 -3.796 3.413
207 3HG2 VAL 25 3HG2 VAL 25 -1.177 -2.049 3.276
208 H THR 26 H THR 26 3.339 -4.076 3.096
209 HA THR 26 HA THR 26 5.566 -3.392 4.786
210 HB THR 26 HB THR 26 6.953 -4.220 3.065
211 HG1 THR 26 1HG THR 26 4.880 -3.368 1.482
212 1HG2 THR 26 1HG2 THR 26 6.286 -6.360 2.919
213 2HG2 THR 26 2HG2 THR 26 4.677 -5.933 2.334
214 3HG2 THR 26 3HG2 THR 26 5.047 -5.825 4.055
215 H VAL 27 H VAL 27 6.874 -1.616 4.676
216 HA VAL 27 HA VAL 27 5.809 0.808 3.893
217 HB VAL 27 HB VAL 27 7.665 0.604 5.486
218 1HG1 VAL 27 1HG1 VAL 27 9.439 0.144 3.095
219 2HG1 VAL 27 2HG1 VAL 27 8.911 -1.127 4.197
220 3HG1 VAL 27 3HG1 VAL 27 9.919 0.193 4.791
221 1HG2 VAL 27 1HG2 VAL 27 8.391 2.702 5.093
222 2HG2 VAL 27 2HG2 VAL 27 7.195 2.656 3.797
223 3HG2 VAL 27 3HG2 VAL 27 8.893 2.334 3.444
224 H MET 28 H MET 28 5.476 1.726 2.049
225 HA MET 28 HA MET 28 5.993 0.657 -0.438
226 1HB MET 28 2HB MET 28 5.595 3.579 0.209
227 2HB MET 28 1HB MET 28 5.309 2.805 -1.347
228 1HG MET 28 2HG MET 28 3.849 2.015 1.154
229 2HG MET 28 1HG MET 28 3.277 3.279 0.069
230 1HE MET 28 1HE MET 28 3.014 3.049 -2.294
231 2HE MET 28 2HE MET 28 2.157 1.692 -3.020
232 3HE MET 28 3HE MET 28 3.918 1.737 -3.049
233 H GLU 29 H GLU 29 7.035 2.288 -2.170
234 HA GLU 29 HA GLU 29 9.859 2.549 -1.387
235 1HB GLU 29 2HB GLU 29 10.479 1.955 -3.581
236 2HB GLU 29 1HB GLU 29 9.166 0.866 -3.192
237 1HG GLU 29 2HG GLU 29 7.667 1.965 -4.595
238 2HG GLU 29 1HG GLU 29 8.668 3.413 -4.681
239 H LYS 30 H LYS 30 10.942 4.461 -1.809
240 HA LYS 30 HA LYS 30 9.353 6.794 -2.145
241 1HB LYS 30 2HB LYS 30 12.323 6.309 -2.021
242 2HB LYS 30 1HB LYS 30 11.670 7.908 -2.348
243 1HG LYS 30 2HG LYS 30 10.803 8.142 -0.228
244 2HG LYS 30 1HG LYS 30 10.720 6.398 0.042
245 1HD LYS 30 2HD LYS 30 12.856 6.281 0.766
246 2HD LYS 30 1HD LYS 30 13.422 7.486 -0.393
247 1HE LYS 30 2HE LYS 30 13.523 8.122 2.065
248 2HE LYS 30 1HE LYS 30 12.750 9.273 0.977
249 1HZ LYS 30 1HZ LYS 30 10.618 8.590 1.707
250 2HZ LYS 30 2HZ LYS 30 11.541 8.849 3.100
251 3HZ LYS 30 3HZ LYS 30 11.244 7.273 2.565
252 H CYS 31 H CYS 31 8.320 6.826 -4.098
253 HA CYS 31 HA CYS 31 9.973 6.606 -6.513
254 1HB CYS 31 2HB CYS 31 7.767 5.227 -6.032
255 2HB CYS 31 1HB CYS 31 6.991 6.687 -6.638
256 HG CYS 31 HG CYS 31 7.965 6.269 -8.938
257 H SER 32 H SER 32 9.668 8.115 -8.237
258 HA SER 32 HA SER 32 9.056 10.800 -7.269
259 1HB SER 32 2HB SER 32 11.148 10.746 -8.359
260 2HB SER 32 1HB SER 32 10.534 9.737 -9.670
261 HG SER 32 HG SER 32 10.714 12.353 -9.627
262 H ASP 33 H ASP 33 7.906 8.392 -9.499
263 HA ASP 33 HA ASP 33 6.010 10.232 -10.719
264 1HB ASP 33 2HB ASP 33 7.137 7.615 -11.383
265 2HB ASP 33 1HB ASP 33 5.398 7.708 -11.667
266 H GLY 34 H GLY 34 3.712 9.426 -10.947
267 1HA GLY 34 2HA GLY 34 2.535 9.225 -8.403
268 2HA GLY 34 1HA GLY 34 1.702 8.985 -9.935
269 H TRP 35 H TRP 35 3.858 6.772 -10.393
270 HA TRP 35 HA TRP 35 2.191 4.652 -9.357
271 1HB TRP 35 2HB TRP 35 4.752 3.871 -10.584
272 2HB TRP 35 1HB TRP 35 3.118 3.330 -10.946
273 HD1 TRP 35 HD TRP 35 1.638 5.337 -12.402
274 HE1 TRP 35 1HE TRP 35 2.477 6.652 -14.450
275 HE3 TRP 35 3HE TRP 35 6.673 4.730 -11.751
276 HZ2 TRP 35 2HZ TRP 35 4.946 7.338 -15.634
277 HZ3 TRP 35 3HZ TRP 35 8.205 5.745 -13.387
278 HH2 TRP 35 HH TRP 35 7.357 7.022 -15.288
279 H TRP 36 H TRP 36 2.414 4.529 -7.156
280 HA TRP 36 HA TRP 36 5.065 4.426 -5.992
281 1HB TRP 36 2HB TRP 36 2.499 5.219 -5.080
282 2HB TRP 36 1HB TRP 36 3.018 3.866 -4.079
283 HD1 TRP 36 HD TRP 36 6.195 4.738 -4.249
284 HE1 TRP 36 1HE TRP 36 6.958 6.675 -2.731
285 HE3 TRP 36 3HE TRP 36 1.656 6.919 -3.367
286 HZ2 TRP 36 2HZ TRP 36 5.790 8.841 -1.349
287 HZ3 TRP 36 3HZ TRP 36 1.566 8.920 -1.937
288 HH2 TRP 36 HH TRP 36 3.592 9.859 -0.950
289 H ARG 37 H ARG 37 6.118 2.616 -5.560
290 HA ARG 37 HA ARG 37 4.736 0.063 -5.875
291 1HB ARG 37 2HB ARG 37 7.100 0.870 -6.881
292 2HB ARG 37 1HB ARG 37 7.654 0.121 -5.389
293 1HG ARG 37 2HG ARG 37 7.557 -1.850 -6.381
294 2HG ARG 37 1HG ARG 37 5.808 -1.665 -6.523
295 1HD ARG 37 2HD ARG 37 5.918 -1.243 -8.721
296 2HD ARG 37 1HD ARG 37 7.314 -0.183 -8.539
297 HE ARG 37 HE ARG 37 7.333 -2.965 -9.233
298 1HH1 ARG 37 1HH1 ARG 37 9.182 -0.374 -7.802
299 2HH1 ARG 37 2HH1 ARG 37 10.713 -1.111 -8.141
300 1HH2 ARG 37 1HH2 ARG 37 9.344 -3.937 -9.679
301 2HH2 ARG 37 2HH2 ARG 37 10.805 -3.134 -9.207
302 H GLY 38 H GLY 38 4.893 -1.606 -4.382
303 1HA GLY 38 2HA GLY 38 6.164 -1.293 -1.839
304 2HA GLY 38 1HA GLY 38 4.426 -1.026 -1.740
305 H SER 39 H SER 39 4.868 -2.961 -0.239
306 HA SER 39 HA SER 39 4.291 -5.378 -1.782
307 1HB SER 39 2HB SER 39 5.803 -5.956 0.645
308 2HB SER 39 1HB SER 39 6.035 -6.561 -0.996
309 HG SER 39 HG SER 39 7.108 -4.588 -1.473
310 H TYR 40 H TYR 40 2.879 -6.816 -0.884
311 HA TYR 40 HA TYR 40 1.789 -6.223 1.761
312 1HB TYR 40 2HB TYR 40 -0.076 -5.299 0.928
313 2HB TYR 40 1HB TYR 40 0.474 -5.597 -0.719
314 HD1 TYR 40 1HD TYR 40 -0.691 -7.094 -2.072
315 HD2 TYR 40 2HD TYR 40 -1.240 -7.267 2.144
316 HE1 TYR 40 1HE TYR 40 -2.500 -8.729 -2.380
317 HE2 TYR 40 2HE TYR 40 -3.052 -8.905 1.846
318 HH TYR 40 HH TYR 40 -4.415 -9.599 -1.230
319 H ASN 41 H ASN 41 0.893 -8.011 2.811
320 HA ASN 41 HA ASN 41 1.966 -10.506 2.165
321 1HB ASN 41 2HB ASN 41 -0.486 -10.140 3.843
322 2HB ASN 41 1HB ASN 41 0.745 -11.388 3.988
323 1HD2 ASN 41 1HD2 ASN 41 -0.112 -8.104 4.675
324 2HD2 ASN 41 2HD2 ASN 41 1.202 -7.765 5.745
325 H GLY 42 H GLY 42 1.465 -10.903 -0.004
326 1HA GLY 42 2HA GLY 42 -0.407 -12.698 -0.663
327 2HA GLY 42 1HA GLY 42 -1.288 -11.186 -0.820
328 H GLN 43 H GLN 43 0.791 -9.584 -1.772
329 HA GLN 43 HA GLN 43 2.109 -10.713 -4.000
330 1HB GLN 43 2HB GLN 43 0.825 -9.771 -5.819
331 2HB GLN 43 1HB GLN 43 -0.210 -10.821 -4.854
332 1HG GLN 43 2HG GLN 43 -0.981 -8.716 -3.665
333 2HG GLN 43 1HG GLN 43 -0.176 -7.821 -4.957
334 1HE2 GLN 43 1HE2 GLN 43 -2.827 -9.854 -4.085
335 2HE2 GLN 43 2HE2 GLN 43 -3.726 -9.669 -5.552
336 H ILE 44 H ILE 44 3.156 -9.074 -5.375
337 HA ILE 44 HA ILE 44 3.651 -6.609 -3.847
338 HB ILE 44 HB ILE 44 5.446 -8.410 -5.402
339 1HG1 ILE 44 2HG1 ILE 44 6.987 -7.785 -3.531
340 2HG1 ILE 44 1HG1 ILE 44 5.695 -6.778 -2.876
341 1HG2 ILE 44 1HG2 ILE 44 5.909 -5.441 -5.146
342 2HG2 ILE 44 2HG2 ILE 44 5.761 -6.371 -6.637
343 3HG2 ILE 44 3HG2 ILE 44 7.152 -6.614 -5.582
344 1HD1 ILE 44 1HD1 ILE 44 5.330 -9.710 -3.379
345 2HD1 ILE 44 2HD1 ILE 44 4.361 -8.635 -2.371
346 3HD1 ILE 44 3HD1 ILE 44 5.992 -9.082 -1.871
347 H GLY 45 H GLY 45 4.095 -4.665 -5.048
348 1HA GLY 45 2HA GLY 45 4.074 -4.089 -7.658
349 2HA GLY 45 1HA GLY 45 2.371 -4.444 -7.381
350 H TRP 46 H TRP 46 1.447 -2.486 -7.573
351 HA TRP 46 HA TRP 46 2.594 -0.230 -6.108
352 1HB TRP 46 2HB TRP 46 0.464 -0.367 -8.251
353 2HB TRP 46 1HB TRP 46 0.937 1.121 -7.427
354 HD1 TRP 46 HD TRP 46 3.289 2.181 -8.065
355 HE1 TRP 46 1HE TRP 46 4.883 1.809 -10.050
356 HE3 TRP 46 3HE TRP 46 1.329 -2.183 -9.856
357 HZ2 TRP 46 2HZ TRP 46 5.256 -0.093 -12.109
358 HZ3 TRP 46 3HZ TRP 46 2.362 -3.216 -11.836
359 HH2 TRP 46 HH TRP 46 4.284 -2.192 -12.939
360 H PHE 47 H PHE 47 1.413 0.935 -4.576
361 HA PHE 47 HA PHE 47 -1.210 -0.137 -3.812
362 1HB PHE 47 2HB PHE 47 0.913 -1.064 -2.504
363 2HB PHE 47 1HB PHE 47 0.679 0.421 -1.591
364 HD1 PHE 47 1HD PHE 47 -0.080 -2.949 -1.691
365 HD2 PHE 47 2HD PHE 47 -1.893 0.826 -0.934
366 HE1 PHE 47 1HE PHE 47 -1.814 -4.057 -0.345
367 HE2 PHE 47 2HE PHE 47 -3.632 -0.277 0.415
368 HZ PHE 47 HZ PHE 47 -3.593 -2.721 0.711
369 HA PRO 48 HA PRO 48 -2.137 4.253 -3.743
370 1HB PRO 48 2HB PRO 48 -4.316 3.132 -2.074
371 2HB PRO 48 1HB PRO 48 -4.416 4.307 -3.386
372 1HG PRO 48 2HG PRO 48 -5.134 1.814 -3.834
373 2HG PRO 48 1HG PRO 48 -4.132 2.661 -5.029
374 1HD PRO 48 2HD PRO 48 -3.337 0.600 -3.010
375 2HD PRO 48 1HD PRO 48 -2.781 0.814 -4.684
376 H SER 49 H SER 49 -0.319 4.773 -2.356
377 HA SER 49 HA SER 49 -0.274 4.380 0.416
378 1HB SER 49 2HB SER 49 1.318 5.716 -1.519
379 2HB SER 49 1HB SER 49 1.028 6.837 -0.185
380 HG SER 49 HG SER 49 2.239 5.650 1.066
381 H ASN 50 H ASN 50 -2.303 6.336 -1.437
382 HA ASN 50 HA ASN 50 -2.731 8.652 -0.145
383 1HB ASN 50 2HB ASN 50 -4.425 6.775 -1.632
384 2HB ASN 50 1HB ASN 50 -5.286 7.949 -0.643
385 1HD2 ASN 50 1HD2 ASN 50 -5.061 10.142 -1.086
386 2HD2 ASN 50 2HD2 ASN 50 -4.489 10.698 -2.615
387 H TYR 51 H TYR 51 -3.348 5.490 1.172
388 HA TYR 51 HA TYR 51 -4.123 6.785 3.662
389 1HB TYR 51 2HB TYR 51 -5.744 4.409 2.832
390 2HB TYR 51 1HB TYR 51 -6.150 5.700 3.963
391 HD1 TYR 51 1HD TYR 51 -5.855 4.843 0.379
392 HD2 TYR 51 2HD TYR 51 -7.297 7.652 3.231
393 HE1 TYR 51 1HE TYR 51 -7.144 5.964 -1.389
394 HE2 TYR 51 2HE TYR 51 -8.591 8.781 1.470
395 HH TYR 51 HH TYR 51 -9.141 7.418 -1.572
396 H VAL 52 H VAL 52 -1.785 5.969 3.616
397 HA VAL 52 HA VAL 52 -1.759 3.421 5.026
398 HB VAL 52 HB VAL 52 -0.004 2.495 3.833
399 1HG1 VAL 52 1HG1 VAL 52 -1.978 2.429 2.484
400 2HG1 VAL 52 2HG1 VAL 52 -0.604 2.738 1.421
401 3HG1 VAL 52 3HG1 VAL 52 -1.680 4.058 1.877
402 1HG2 VAL 52 1HG2 VAL 52 0.559 5.248 2.727
403 2HG2 VAL 52 2HG2 VAL 52 1.373 3.780 2.189
404 3HG2 VAL 52 3HG2 VAL 52 1.554 4.328 3.855
405 H LEU 53 H LEU 53 -0.072 3.186 6.572
406 HA LEU 53 HA LEU 53 1.098 5.752 7.397
407 1HB LEU 53 2HB LEU 53 -0.203 3.607 8.804
408 2HB LEU 53 1HB LEU 53 1.417 3.827 9.429
409 HG LEU 53 HG LEU 53 0.199 5.200 10.815
410 1HD1 LEU 53 1HD1 LEU 53 1.127 7.216 10.493
411 2HD1 LEU 53 2HD1 LEU 53 0.400 7.407 8.897
412 3HD1 LEU 53 3HD1 LEU 53 1.879 6.462 9.086
413 1HD2 LEU 53 1HD2 LEU 53 -1.844 4.809 9.204
414 2HD2 LEU 53 2HD2 LEU 53 -1.455 6.452 8.688
415 3HD2 LEU 53 3HD2 LEU 53 -1.839 6.126 10.379
416 H GLU 54 H GLU 54 3.207 5.965 6.933
417 HA GLU 54 HA GLU 54 4.818 3.534 6.637
418 1HB GLU 54 2HB GLU 54 4.716 4.979 4.676
419 2HB GLU 54 1HB GLU 54 5.327 6.328 5.625
420 1HG GLU 54 2HG GLU 54 7.050 4.002 5.775
421 2HG GLU 54 1HG GLU 54 6.816 4.571 4.121
422 H GLU 55 H GLU 55 6.511 3.123 7.884
423 HA GLU 55 HA GLU 55 7.350 5.156 9.816
424 1HB GLU 55 2HB GLU 55 7.592 2.223 10.344
425 2HB GLU 55 1HB GLU 55 7.510 3.544 11.500
426 1HG GLU 55 2HG GLU 55 5.107 3.715 10.237
427 2HG GLU 55 1HG GLU 55 5.399 1.981 10.267
428 H VAL 56 H VAL 56 9.368 5.830 9.434
429 HA VAL 56 HA VAL 56 11.131 4.324 7.744
430 HB VAL 56 HB VAL 56 11.950 6.772 9.281
431 1HG1 VAL 56 1HG1 VAL 56 13.685 6.891 7.849
432 2HG1 VAL 56 2HG1 VAL 56 12.717 6.367 6.470
433 3HG1 VAL 56 3HG1 VAL 56 13.350 5.176 7.607
434 1HG2 VAL 56 1HG2 VAL 56 11.168 7.841 6.952
435 2HG2 VAL 56 2HG2 VAL 56 10.123 7.761 8.372
436 3HG2 VAL 56 3HG2 VAL 56 9.969 6.554 7.096
437 H ASP 57 H ASP 57 11.418 2.427 9.033
438 HA ASP 57 HA ASP 57 12.457 2.442 11.647
439 1HB ASP 57 2HB ASP 57 11.387 0.472 10.609
440 2HB ASP 57 1HB ASP 57 12.759 0.314 9.516
Start of MODEL 6
1 1H ILE 1 1HT ILE 1 10.685 -1.763 7.687
2 2H ILE 1 2HT ILE 1 10.149 -3.181 8.492
3 3H ILE 1 3HT ILE 1 11.194 -2.081 9.293
4 HA ILE 1 HA ILE 1 8.904 -1.946 10.013
5 HB ILE 1 HB ILE 1 8.733 0.630 9.308
6 1HG1 ILE 1 2HG1 ILE 1 11.153 1.434 9.101
7 2HG1 ILE 1 1HG1 ILE 1 11.550 -0.219 8.646
8 1HG2 ILE 1 1HG2 ILE 1 10.238 -0.854 11.346
9 2HG2 ILE 1 2HG2 ILE 1 9.046 0.433 11.522
10 3HG2 ILE 1 3HG2 ILE 1 10.720 0.828 11.129
11 1HD1 ILE 1 1HD1 ILE 1 10.593 -0.030 6.607
12 2HD1 ILE 1 2HD1 ILE 1 10.984 1.669 6.869
13 3HD1 ILE 1 3HD1 ILE 1 9.347 1.083 7.170
14 HA PRO 2 HA PRO 2 6.118 -2.220 6.493
15 1HB PRO 2 2HB PRO 2 4.028 -3.258 7.787
16 2HB PRO 2 1HB PRO 2 5.481 -4.220 7.489
17 1HG PRO 2 2HG PRO 2 4.584 -2.864 9.994
18 2HG PRO 2 1HG PRO 2 5.370 -4.440 9.790
19 1HD PRO 2 2HD PRO 2 6.651 -2.075 10.512
20 2HD PRO 2 1HD PRO 2 7.450 -3.521 9.868
21 H ALA 3 H ALA 3 3.461 -1.772 6.653
22 HA ALA 3 HA ALA 3 3.227 0.925 7.766
23 1HB ALA 3 1HB ALA 3 3.406 1.162 5.401
24 2HB ALA 3 2HB ALA 3 1.720 1.440 5.838
25 3HB ALA 3 3HB ALA 3 2.205 -0.101 5.129
26 H PHE 4 H PHE 4 1.018 1.606 8.272
27 HA PHE 4 HA PHE 4 -0.644 -0.660 9.075
28 1HB PHE 4 2HB PHE 4 -0.207 0.246 11.108
29 2HB PHE 4 1HB PHE 4 0.123 1.835 10.432
30 HD1 PHE 4 1HD PHE 4 -1.384 3.542 10.805
31 HD2 PHE 4 2HD PHE 4 -2.712 -0.491 11.078
32 HE1 PHE 4 1HE PHE 4 -3.583 4.324 11.585
33 HE2 PHE 4 2HE PHE 4 -4.913 0.282 11.858
34 HZ PHE 4 HZ PHE 4 -5.351 2.693 12.112
35 H VAL 5 H VAL 5 -2.445 -0.895 7.922
36 HA VAL 5 HA VAL 5 -3.458 1.310 6.327
37 HB VAL 5 HB VAL 5 -4.566 -1.490 6.519
38 1HG1 VAL 5 1HG1 VAL 5 -5.270 0.884 5.010
39 2HG1 VAL 5 2HG1 VAL 5 -6.164 -0.618 5.234
40 3HG1 VAL 5 3HG1 VAL 5 -4.946 -0.497 3.965
41 1HG2 VAL 5 1HG2 VAL 5 -2.029 -0.840 5.653
42 2HG2 VAL 5 2HG2 VAL 5 -2.970 -0.886 4.162
43 3HG2 VAL 5 3HG2 VAL 5 -2.932 -2.293 5.226
44 H LYS 6 H LYS 6 -5.573 2.137 6.442
45 HA LYS 6 HA LYS 6 -6.835 1.795 9.068
46 1HB LYS 6 2HB LYS 6 -7.401 4.067 7.189
47 2HB LYS 6 1HB LYS 6 -7.658 3.990 8.925
48 1HG LYS 6 2HG LYS 6 -5.623 4.770 9.351
49 2HG LYS 6 1HG LYS 6 -4.868 3.632 8.235
50 1HD LYS 6 2HD LYS 6 -4.840 5.121 6.528
51 2HD LYS 6 1HD LYS 6 -6.367 5.862 7.009
52 1HE LYS 6 2HE LYS 6 -5.039 6.812 8.990
53 2HE LYS 6 1HE LYS 6 -3.606 6.379 8.061
54 1HZ LYS 6 1HZ LYS 6 -5.526 8.506 7.621
55 2HZ LYS 6 2HZ LYS 6 -5.029 7.689 6.226
56 3HZ LYS 6 3HZ LYS 6 -3.883 8.429 7.226
57 H PHE 7 H PHE 7 -8.136 2.930 5.986
58 HA PHE 7 HA PHE 7 -10.482 1.268 6.419
59 1HB PHE 7 2HB PHE 7 -10.021 3.874 5.278
60 2HB PHE 7 1HB PHE 7 -10.879 2.848 4.128
61 HD1 PHE 7 1HD PHE 7 -12.549 1.207 5.870
62 HD2 PHE 7 2HD PHE 7 -11.594 5.347 6.107
63 HE1 PHE 7 1HE PHE 7 -14.655 1.619 7.072
64 HE2 PHE 7 2HE PHE 7 -13.699 5.767 7.311
65 HZ PHE 7 HZ PHE 7 -15.233 3.902 7.794
66 H ALA 8 H ALA 8 -11.433 0.078 4.650
67 HA ALA 8 HA ALA 8 -9.395 -1.044 2.881
68 1HB ALA 8 1HB ALA 8 -11.387 -2.227 4.535
69 2HB ALA 8 2HB ALA 8 -10.143 -3.017 3.567
70 3HB ALA 8 3HB ALA 8 -11.715 -2.656 2.857
71 H TYR 9 H TYR 9 -9.811 -1.385 0.689
72 HA TYR 9 HA TYR 9 -12.259 -0.192 -0.405
73 1HB TYR 9 2HB TYR 9 -10.271 1.414 -0.472
74 2HB TYR 9 1HB TYR 9 -9.554 0.308 -1.645
75 HD1 TYR 9 1HD TYR 9 -9.580 1.472 -3.665
76 HD2 TYR 9 2HD TYR 9 -13.099 1.399 -1.275
77 HE1 TYR 9 1HE TYR 9 -10.824 2.582 -5.473
78 HE2 TYR 9 2HE TYR 9 -14.352 2.508 -3.075
79 HH TYR 9 HH TYR 9 -13.317 4.185 -5.275
80 H VAL 10 H VAL 10 -13.129 -1.298 -2.089
81 HA VAL 10 HA VAL 10 -11.876 -3.809 -2.792
82 HB VAL 10 HB VAL 10 -13.996 -4.317 -3.946
83 1HG1 VAL 10 1HG1 VAL 10 -13.771 -3.651 -1.092
84 2HG1 VAL 10 2HG1 VAL 10 -14.261 -5.153 -1.874
85 3HG1 VAL 10 3HG1 VAL 10 -15.417 -3.833 -1.693
86 1HG2 VAL 10 1HG2 VAL 10 -14.366 -1.464 -3.657
87 2HG2 VAL 10 2HG2 VAL 10 -15.738 -2.358 -3.002
88 3HG2 VAL 10 3HG2 VAL 10 -15.236 -2.614 -4.673
89 H ALA 11 H ALA 11 -10.401 -3.739 -4.352
90 HA ALA 11 HA ALA 11 -10.838 -3.461 -7.002
91 1HB ALA 11 1HB ALA 11 -9.692 -1.074 -7.286
92 2HB ALA 11 2HB ALA 11 -10.518 -0.789 -5.754
93 3HB ALA 11 3HB ALA 11 -11.441 -1.272 -7.177
94 H GLU 12 H GLU 12 -9.251 -5.085 -6.858
95 HA GLU 12 HA GLU 12 -6.511 -4.049 -6.617
96 1HB GLU 12 2HB GLU 12 -6.080 -6.580 -5.894
97 2HB GLU 12 1HB GLU 12 -6.462 -5.325 -4.726
98 1HG GLU 12 2HG GLU 12 -8.434 -6.241 -4.197
99 2HG GLU 12 1HG GLU 12 -8.800 -6.667 -5.868
100 H ARG 13 H ARG 13 -5.534 -4.168 -8.482
101 HA ARG 13 HA ARG 13 -5.491 -6.577 -10.023
102 1HB ARG 13 2HB ARG 13 -7.409 -5.815 -11.105
103 2HB ARG 13 1HB ARG 13 -6.930 -4.129 -10.963
104 1HG ARG 13 2HG ARG 13 -5.105 -5.686 -12.616
105 2HG ARG 13 1HG ARG 13 -6.761 -5.679 -13.222
106 1HD ARG 13 2HD ARG 13 -6.059 -3.051 -12.361
107 2HD ARG 13 1HD ARG 13 -4.809 -3.659 -13.440
108 HE ARG 13 HE ARG 13 -7.636 -3.775 -14.230
109 1HH1 ARG 13 1HH1 ARG 13 -4.384 -2.620 -14.802
110 2HH1 ARG 13 2HH1 ARG 13 -4.745 -2.030 -16.387
111 1HH2 ARG 13 1HH2 ARG 13 -8.100 -2.998 -16.312
112 2HH2 ARG 13 2HH2 ARG 13 -6.849 -2.243 -17.244
113 H GLU 14 H GLU 14 -3.697 -6.606 -11.501
114 HA GLU 14 HA GLU 14 -1.461 -5.157 -10.694
115 1HB GLU 14 2HB GLU 14 -0.469 -5.843 -12.896
116 2HB GLU 14 1HB GLU 14 -1.173 -7.170 -11.981
117 1HG GLU 14 2HG GLU 14 -3.292 -6.488 -13.467
118 2HG GLU 14 1HG GLU 14 -1.995 -5.990 -14.553
119 H ASP 15 H ASP 15 -1.448 -3.012 -10.644
120 HA ASP 15 HA ASP 15 -0.846 -1.088 -12.074
121 1HB ASP 15 2HB ASP 15 -1.960 -2.022 -14.102
122 2HB ASP 15 1HB ASP 15 -3.522 -1.662 -13.366
123 H GLU 16 H GLU 16 -3.793 -2.159 -10.562
124 HA GLU 16 HA GLU 16 -4.239 0.553 -9.517
125 1HB GLU 16 2HB GLU 16 -6.524 0.051 -9.215
126 2HB GLU 16 1HB GLU 16 -6.119 -0.615 -10.778
127 1HG GLU 16 2HG GLU 16 -5.874 -2.830 -9.730
128 2HG GLU 16 1HG GLU 16 -6.456 -2.116 -8.229
129 H LEU 17 H LEU 17 -4.633 0.854 -7.296
130 HA LEU 17 HA LEU 17 -3.472 -1.269 -5.627
131 1HB LEU 17 2HB LEU 17 -3.007 0.562 -4.004
132 2HB LEU 17 1HB LEU 17 -2.168 0.719 -5.540
133 HG LEU 17 HG LEU 17 -4.324 2.229 -6.078
134 1HD1 LEU 17 1HD1 LEU 17 -4.672 1.714 -3.377
135 2HD1 LEU 17 2HD1 LEU 17 -5.453 2.982 -4.321
136 3HD1 LEU 17 3HD1 LEU 17 -3.973 3.333 -3.429
137 1HD2 LEU 17 1HD2 LEU 17 -1.635 2.631 -5.680
138 2HD2 LEU 17 2HD2 LEU 17 -2.376 3.746 -4.533
139 3HD2 LEU 17 3HD2 LEU 17 -2.788 3.840 -6.245
140 H SER 18 H SER 18 -4.605 -2.181 -4.032
141 HA SER 18 HA SER 18 -7.287 -1.151 -3.488
142 1HB SER 18 2HB SER 18 -7.958 -3.372 -2.916
143 2HB SER 18 1HB SER 18 -7.033 -3.500 -4.414
144 HG SER 18 HG SER 18 -6.578 -4.722 -2.115
145 H LEU 19 H LEU 19 -8.022 -0.946 -1.352
146 HA LEU 19 HA LEU 19 -5.867 -0.609 0.591
147 1HB LEU 19 2HB LEU 19 -8.704 0.370 0.456
148 2HB LEU 19 1HB LEU 19 -7.761 0.485 1.932
149 HG LEU 19 HG LEU 19 -7.810 2.573 0.563
150 1HD1 LEU 19 1HD1 LEU 19 -6.048 2.211 2.176
151 2HD1 LEU 19 2HD1 LEU 19 -5.396 3.004 0.742
152 3HD1 LEU 19 3HD1 LEU 19 -5.123 1.280 0.998
153 1HD2 LEU 19 1HD2 LEU 19 -7.605 1.133 -1.608
154 2HD2 LEU 19 2HD2 LEU 19 -5.874 1.291 -1.312
155 3HD2 LEU 19 3HD2 LEU 19 -6.868 2.733 -1.529
156 H VAL 20 H VAL 20 -5.945 -1.462 2.679
157 HA VAL 20 HA VAL 20 -7.372 -4.004 2.863
158 HB VAL 20 HB VAL 20 -5.435 -3.083 4.947
159 1HG1 VAL 20 1HG1 VAL 20 -6.377 -5.690 3.823
160 2HG1 VAL 20 2HG1 VAL 20 -6.358 -5.133 5.496
161 3HG1 VAL 20 3HG1 VAL 20 -4.852 -5.591 4.703
162 1HG2 VAL 20 1HG2 VAL 20 -3.559 -3.954 3.636
163 2HG2 VAL 20 2HG2 VAL 20 -4.308 -2.567 2.846
164 3HG2 VAL 20 3HG2 VAL 20 -4.634 -4.197 2.258
165 H LYS 21 H LYS 21 -8.234 -4.639 5.021
166 HA LYS 21 HA LYS 21 -10.096 -2.674 5.932
167 1HB LYS 21 2HB LYS 21 -9.461 -5.475 6.855
168 2HB LYS 21 1HB LYS 21 -10.703 -4.483 7.606
169 1HG LYS 21 2HG LYS 21 -12.157 -5.119 6.069
170 2HG LYS 21 1HG LYS 21 -11.133 -4.443 4.802
171 1HD LYS 21 2HD LYS 21 -9.860 -6.800 5.433
172 2HD LYS 21 1HD LYS 21 -11.568 -7.222 5.578
173 1HE LYS 21 2HE LYS 21 -11.769 -5.973 3.293
174 2HE LYS 21 1HE LYS 21 -10.036 -6.286 3.190
175 1HZ LYS 21 1HZ LYS 21 -10.361 -8.551 3.109
176 2HZ LYS 21 2HZ LYS 21 -11.688 -7.990 2.220
177 3HZ LYS 21 3HZ LYS 21 -11.893 -8.481 3.826
178 H GLY 22 H GLY 22 -7.393 -4.383 7.505
179 1HA GLY 22 2HA GLY 22 -6.629 -2.063 8.971
180 2HA GLY 22 1HA GLY 22 -7.490 -3.203 9.987
181 H SER 23 H SER 23 -5.498 -4.296 7.362
182 HA SER 23 HA SER 23 -3.737 -5.578 9.283
183 1HB SER 23 2HB SER 23 -4.845 -6.355 6.783
184 2HB SER 23 1HB SER 23 -3.088 -6.338 6.622
185 HG SER 23 HG SER 23 -3.436 -8.287 7.456
186 H ARG 24 H ARG 24 -1.388 -5.821 8.488
187 HA ARG 24 HA ARG 24 -0.426 -3.139 7.824
188 1HB ARG 24 2HB ARG 24 0.977 -5.449 9.109
189 2HB ARG 24 1HB ARG 24 1.735 -3.912 8.751
190 1HG ARG 24 2HG ARG 24 -0.713 -3.598 10.270
191 2HG ARG 24 1HG ARG 24 0.465 -4.624 11.100
192 1HD ARG 24 2HD ARG 24 2.158 -2.772 10.516
193 2HD ARG 24 1HD ARG 24 0.738 -1.772 10.211
194 HE ARG 24 HE ARG 24 0.499 -1.554 12.461
195 1HH1 ARG 24 1HH1 ARG 24 2.338 -4.456 11.846
196 2HH1 ARG 24 2HH1 ARG 24 2.615 -4.786 13.523
197 1HH2 ARG 24 1HH2 ARG 24 0.862 -1.987 14.668
198 2HH2 ARG 24 2HH2 ARG 24 1.777 -3.384 15.126
199 H VAL 25 H VAL 25 1.176 -2.797 6.276
200 HA VAL 25 HA VAL 25 1.579 -5.007 4.363
201 HB VAL 25 HB VAL 25 1.262 -2.091 3.653
202 1HG1 VAL 25 1HG1 VAL 25 2.565 -3.164 2.002
203 2HG1 VAL 25 2HG1 VAL 25 0.931 -3.056 1.354
204 3HG1 VAL 25 3HG1 VAL 25 1.522 -4.587 2.001
205 1HG2 VAL 25 1HG2 VAL 25 -0.728 -4.342 3.581
206 2HG2 VAL 25 2HG2 VAL 25 -0.935 -2.829 2.698
207 3HG2 VAL 25 3HG2 VAL 25 -0.849 -2.818 4.459
208 H THR 26 H THR 26 3.505 -4.643 2.901
209 HA THR 26 HA THR 26 5.759 -3.873 4.532
210 HB THR 26 HB THR 26 7.114 -4.975 3.022
211 HG1 THR 26 1HG THR 26 5.350 -3.964 1.174
212 1HG2 THR 26 1HG2 THR 26 4.589 -6.254 3.434
213 2HG2 THR 26 2HG2 THR 26 6.199 -6.959 3.310
214 3HG2 THR 26 3HG2 THR 26 5.244 -6.686 1.855
215 H VAL 27 H VAL 27 7.096 -2.129 4.269
216 HA VAL 27 HA VAL 27 6.050 0.229 3.269
217 HB VAL 27 HB VAL 27 7.895 0.161 4.885
218 1HG1 VAL 27 1HG1 VAL 27 10.131 -0.378 4.289
219 2HG1 VAL 27 2HG1 VAL 27 9.715 -0.507 2.581
220 3HG1 VAL 27 3HG1 VAL 27 9.116 -1.707 3.726
221 1HG2 VAL 27 1HG2 VAL 27 8.658 1.670 2.386
222 2HG2 VAL 27 2HG2 VAL 27 9.154 2.044 4.037
223 3HG2 VAL 27 3HG2 VAL 27 7.462 2.203 3.568
224 H MET 28 H MET 28 5.642 0.857 1.309
225 HA MET 28 HA MET 28 6.392 -0.477 -1.020
226 1HB MET 28 2HB MET 28 5.535 2.408 -0.908
227 2HB MET 28 1HB MET 28 5.277 1.249 -2.210
228 1HG MET 28 2HG MET 28 3.282 0.834 -1.355
229 2HG MET 28 1HG MET 28 4.084 0.100 0.030
230 1HE MET 28 1HE MET 28 3.722 0.466 1.988
231 2HE MET 28 2HE MET 28 2.376 1.460 2.546
232 3HE MET 28 3HE MET 28 4.036 2.014 2.771
233 H GLU 29 H GLU 29 7.214 1.113 -2.927
234 HA GLU 29 HA GLU 29 9.986 1.647 -2.235
235 1HB GLU 29 2HB GLU 29 9.093 1.904 -5.036
236 2HB GLU 29 1HB GLU 29 10.499 1.103 -4.371
237 1HG GLU 29 2HG GLU 29 8.197 -0.366 -3.606
238 2HG GLU 29 1HG GLU 29 8.109 -0.028 -5.331
239 H LYS 30 H LYS 30 11.051 3.525 -3.228
240 HA LYS 30 HA LYS 30 9.260 5.817 -3.515
241 1HB LYS 30 2HB LYS 30 10.184 6.094 -1.359
242 2HB LYS 30 1HB LYS 30 11.784 5.598 -1.896
243 1HG LYS 30 2HG LYS 30 11.499 8.044 -1.447
244 2HG LYS 30 1HG LYS 30 12.136 7.633 -3.039
245 1HD LYS 30 2HD LYS 30 9.877 7.909 -3.981
246 2HD LYS 30 1HD LYS 30 9.282 8.371 -2.386
247 1HE LYS 30 2HE LYS 30 9.795 10.277 -3.949
248 2HE LYS 30 1HE LYS 30 10.584 10.350 -2.374
249 1HZ LYS 30 1HZ LYS 30 12.626 9.938 -3.273
250 2HZ LYS 30 2HZ LYS 30 11.918 10.774 -4.562
251 3HZ LYS 30 3HZ LYS 30 12.014 9.085 -4.600
252 H CYS 31 H CYS 31 9.354 6.089 -5.651
253 HA CYS 31 HA CYS 31 11.978 6.283 -6.951
254 1HB CYS 31 2HB CYS 31 9.874 4.772 -7.728
255 2HB CYS 31 1HB CYS 31 9.523 6.255 -8.609
256 HG CYS 31 HG CYS 31 11.030 4.584 -10.021
257 H SER 32 H SER 32 12.272 7.989 -8.545
258 HA SER 32 HA SER 32 11.594 10.524 -7.566
259 1HB SER 32 2HB SER 32 13.521 9.842 -9.144
260 2HB SER 32 1HB SER 32 12.341 10.037 -10.441
261 HG SER 32 HG SER 32 12.938 12.041 -8.525
262 H ASP 33 H ASP 33 9.929 8.400 -9.748
263 HA ASP 33 HA ASP 33 8.175 10.475 -10.748
264 1HB ASP 33 2HB ASP 33 8.712 7.654 -11.365
265 2HB ASP 33 1HB ASP 33 7.009 8.100 -11.483
266 H GLY 34 H GLY 34 5.755 10.031 -10.651
267 1HA GLY 34 2HA GLY 34 4.983 10.002 -7.906
268 2HA GLY 34 1HA GLY 34 3.909 10.171 -9.288
269 H TRP 35 H TRP 35 5.488 7.471 -10.064
270 HA TRP 35 HA TRP 35 3.355 5.795 -9.042
271 1HB TRP 35 2HB TRP 35 3.960 4.224 -10.667
272 2HB TRP 35 1HB TRP 35 4.306 5.763 -11.445
273 HD1 TRP 35 HD TRP 35 7.155 6.422 -10.437
274 HE1 TRP 35 1HE TRP 35 9.169 4.945 -11.061
275 HE3 TRP 35 3HE TRP 35 4.670 2.105 -11.588
276 HZ2 TRP 35 2HZ TRP 35 9.642 2.299 -11.925
277 HZ3 TRP 35 3HZ TRP 35 5.976 0.147 -12.304
278 HH2 TRP 35 HH TRP 35 8.411 0.244 -12.470
279 H TRP 36 H TRP 36 3.528 4.302 -7.465
280 HA TRP 36 HA TRP 36 6.171 3.529 -6.519
281 1HB TRP 36 2HB TRP 36 3.996 4.631 -4.736
282 2HB TRP 36 1HB TRP 36 5.481 3.872 -4.163
283 HD1 TRP 36 HD TRP 36 7.809 5.191 -4.938
284 HE1 TRP 36 1HE TRP 36 8.242 7.727 -5.075
285 HE3 TRP 36 3HE TRP 36 2.977 6.818 -5.152
286 HZ2 TRP 36 2HZ TRP 36 6.725 10.102 -5.251
287 HZ3 TRP 36 3HZ TRP 36 2.547 9.235 -5.303
288 HH2 TRP 36 HH TRP 36 4.385 10.844 -5.351
289 H ARG 37 H ARG 37 6.301 1.413 -6.207
290 HA ARG 37 HA ARG 37 3.803 -0.106 -6.031
291 1HB ARG 37 2HB ARG 37 6.140 -0.493 -7.540
292 2HB ARG 37 1HB ARG 37 6.162 -1.748 -6.309
293 1HG ARG 37 2HG ARG 37 3.567 -1.829 -7.173
294 2HG ARG 37 1HG ARG 37 4.447 -1.439 -8.650
295 1HD ARG 37 2HD ARG 37 4.076 -3.911 -8.073
296 2HD ARG 37 1HD ARG 37 5.690 -3.407 -8.574
297 HE ARG 37 HE ARG 37 5.250 -3.415 -5.719
298 1HH1 ARG 37 1HH1 ARG 37 6.304 -5.258 -8.489
299 2HH1 ARG 37 2HH1 ARG 37 7.257 -6.358 -7.550
300 1HH2 ARG 37 1HH2 ARG 37 6.503 -4.859 -4.485
301 2HH2 ARG 37 2HH2 ARG 37 7.370 -6.132 -5.278
302 H GLY 38 H GLY 38 3.524 -1.710 -4.443
303 1HA GLY 38 2HA GLY 38 5.431 -1.587 -2.201
304 2HA GLY 38 1HA GLY 38 3.708 -1.364 -1.916
305 H SER 39 H SER 39 5.303 -3.341 -0.694
306 HA SER 39 HA SER 39 4.290 -5.792 -1.952
307 1HB SER 39 2HB SER 39 6.160 -6.429 0.096
308 2HB SER 39 1HB SER 39 6.343 -6.644 -1.647
309 HG SER 39 HG SER 39 7.646 -4.974 -0.077
310 H TYR 40 H TYR 40 3.409 -7.408 -0.625
311 HA TYR 40 HA TYR 40 2.344 -6.448 1.954
312 1HB TYR 40 2HB TYR 40 1.040 -7.753 -0.372
313 2HB TYR 40 1HB TYR 40 0.496 -8.247 1.224
314 HD1 TYR 40 1HD TYR 40 -1.184 -7.057 2.257
315 HD2 TYR 40 2HD TYR 40 1.043 -5.187 -0.847
316 HE1 TYR 40 1HE TYR 40 -2.728 -5.149 2.310
317 HE2 TYR 40 2HE TYR 40 -0.494 -3.265 -0.798
318 HH TYR 40 HH TYR 40 -2.634 -2.686 1.687
319 H ASN 41 H ASN 41 2.278 -7.982 3.636
320 HA ASN 41 HA ASN 41 4.213 -10.036 3.549
321 1HB ASN 41 2HB ASN 41 3.002 -10.810 5.705
322 2HB ASN 41 1HB ASN 41 3.781 -9.227 5.706
323 1HD2 ASN 41 1HD2 ASN 41 2.540 -7.391 5.782
324 2HD2 ASN 41 2HD2 ASN 41 0.850 -7.413 6.136
325 H GLY 42 H GLY 42 3.699 -11.289 1.717
326 1HA GLY 42 2HA GLY 42 2.884 -13.650 1.569
327 2HA GLY 42 1HA GLY 42 1.320 -12.984 2.016
328 H GLN 43 H GLN 43 2.216 -10.576 0.235
329 HA GLN 43 HA GLN 43 2.145 -11.669 -2.412
330 1HB GLN 43 2HB GLN 43 -0.006 -10.317 -2.929
331 2HB GLN 43 1HB GLN 43 -0.158 -11.907 -2.189
332 1HG GLN 43 2HG GLN 43 -0.402 -10.836 0.010
333 2HG GLN 43 1HG GLN 43 -0.314 -9.254 -0.772
334 1HE2 GLN 43 1HE2 GLN 43 -2.251 -11.982 -0.041
335 2HE2 GLN 43 2HE2 GLN 43 -3.731 -11.391 -0.720
336 H ILE 44 H ILE 44 1.759 -9.757 -4.042
337 HA ILE 44 HA ILE 44 2.919 -7.282 -2.988
338 HB ILE 44 HB ILE 44 4.088 -9.073 -5.064
339 1HG1 ILE 44 2HG1 ILE 44 6.180 -8.040 -3.998
340 2HG1 ILE 44 1HG1 ILE 44 5.067 -7.329 -2.828
341 1HG2 ILE 44 1HG2 ILE 44 5.391 -7.184 -6.003
342 2HG2 ILE 44 2HG2 ILE 44 4.341 -6.068 -5.130
343 3HG2 ILE 44 3HG2 ILE 44 3.673 -7.103 -6.392
344 1HD1 ILE 44 1HD1 ILE 44 6.239 -9.868 -2.765
345 2HD1 ILE 44 2HD1 ILE 44 4.523 -10.118 -3.084
346 3HD1 ILE 44 3HD1 ILE 44 5.032 -9.201 -1.665
347 H GLY 45 H GLY 45 2.648 -5.425 -4.371
348 1HA GLY 45 2HA GLY 45 1.138 -5.474 -6.761
349 2HA GLY 45 1HA GLY 45 0.067 -5.148 -5.403
350 H TRP 46 H TRP 46 -0.431 -3.065 -5.999
351 HA TRP 46 HA TRP 46 1.765 -1.148 -6.256
352 1HB TRP 46 2HB TRP 46 -0.246 -1.322 -7.904
353 2HB TRP 46 1HB TRP 46 -1.125 -0.440 -6.654
354 HD1 TRP 46 HD TRP 46 2.553 0.294 -7.477
355 HE1 TRP 46 1HE TRP 46 2.722 2.691 -8.401
356 HE3 TRP 46 3HE TRP 46 -2.431 1.379 -7.830
357 HZ2 TRP 46 2HZ TRP 46 0.972 4.762 -9.187
358 HZ3 TRP 46 3HZ TRP 46 -3.099 3.589 -8.679
359 HH2 TRP 46 HH TRP 46 -1.432 5.244 -9.343
360 H PHE 47 H PHE 47 1.927 0.686 -4.977
361 HA PHE 47 HA PHE 47 1.386 0.394 -2.283
362 1HB PHE 47 2HB PHE 47 2.366 2.468 -1.971
363 2HB PHE 47 1HB PHE 47 3.039 1.968 -3.521
364 HD1 PHE 47 1HD PHE 47 1.978 4.707 -1.870
365 HD2 PHE 47 2HD PHE 47 1.192 2.660 -5.518
366 HE1 PHE 47 1HE PHE 47 1.168 6.805 -2.868
367 HE2 PHE 47 2HE PHE 47 0.384 4.757 -6.523
368 HZ PHE 47 HZ PHE 47 0.370 6.831 -5.198
369 HA PRO 48 HA PRO 48 -2.882 1.820 -2.300
370 1HB PRO 48 2HB PRO 48 -3.669 0.362 -0.183
371 2HB PRO 48 1HB PRO 48 -3.412 -0.364 -1.771
372 1HG PRO 48 2HG PRO 48 -1.811 -0.619 0.678
373 2HG PRO 48 1HG PRO 48 -1.858 -1.666 -0.748
374 1HD PRO 48 2HD PRO 48 0.059 0.398 -0.085
375 2HD PRO 48 1HD PRO 48 0.079 -0.737 -1.449
376 H SER 49 H SER 49 -0.696 3.341 -1.117
377 HA SER 49 HA SER 49 -0.965 3.987 1.542
378 1HB SER 49 2HB SER 49 0.373 5.052 -0.723
379 2HB SER 49 1HB SER 49 -0.390 6.389 0.142
380 HG SER 49 HG SER 49 0.658 5.669 2.032
381 H ASN 50 H ASN 50 -3.359 4.451 -0.807
382 HA ASN 50 HA ASN 50 -4.536 6.834 -0.395
383 1HB ASN 50 2HB ASN 50 -5.505 4.131 -0.978
384 2HB ASN 50 1HB ASN 50 -6.729 5.235 -0.367
385 1HD2 ASN 50 1HD2 ASN 50 -7.790 5.217 -2.342
386 2HD2 ASN 50 2HD2 ASN 50 -7.177 6.075 -3.705
387 H TYR 51 H TYR 51 -4.345 4.205 1.883
388 HA TYR 51 HA TYR 51 -5.061 5.983 4.023
389 1HB TYR 51 2HB TYR 51 -6.808 3.568 3.470
390 2HB TYR 51 1HB TYR 51 -6.883 4.571 4.920
391 HD1 TYR 51 1HD TYR 51 -7.667 4.382 1.347
392 HD2 TYR 51 2HD TYR 51 -7.868 6.790 4.847
393 HE1 TYR 51 1HE TYR 51 -9.276 5.864 0.226
394 HE2 TYR 51 2HE TYR 51 -9.480 8.280 3.736
395 HH TYR 51 HH TYR 51 -11.096 7.472 0.926
396 H VAL 52 H VAL 52 -2.711 5.182 3.942
397 HA VAL 52 HA VAL 52 -2.526 2.982 5.847
398 HB VAL 52 HB VAL 52 -1.007 1.723 4.703
399 1HG1 VAL 52 1HG1 VAL 52 -2.582 3.115 2.550
400 2HG1 VAL 52 2HG1 VAL 52 -2.985 1.614 3.384
401 3HG1 VAL 52 3HG1 VAL 52 -1.614 1.667 2.275
402 1HG2 VAL 52 1HG2 VAL 52 0.298 2.757 2.697
403 2HG2 VAL 52 2HG2 VAL 52 0.813 3.107 4.347
404 3HG2 VAL 52 3HG2 VAL 52 -0.132 4.294 3.449
405 H LEU 53 H LEU 53 -0.393 2.905 6.958
406 HA LEU 53 HA LEU 53 0.717 5.602 7.260
407 1HB LEU 53 2HB LEU 53 -0.412 4.966 9.254
408 2HB LEU 53 1HB LEU 53 0.325 3.383 9.228
409 HG LEU 53 HG LEU 53 2.448 4.302 9.813
410 1HD1 LEU 53 1HD1 LEU 53 1.115 6.842 9.118
411 2HD1 LEU 53 2HD1 LEU 53 2.772 6.313 8.824
412 3HD1 LEU 53 3HD1 LEU 53 2.298 6.880 10.426
413 1HD2 LEU 53 1HD2 LEU 53 0.444 5.653 11.591
414 2HD2 LEU 53 2HD2 LEU 53 2.006 4.962 12.032
415 3HD2 LEU 53 3HD2 LEU 53 0.671 3.904 11.572
416 H GLU 54 H GLU 54 2.713 5.753 6.417
417 HA GLU 54 HA GLU 54 4.358 3.322 6.302
418 1HB GLU 54 2HB GLU 54 3.850 4.386 4.149
419 2HB GLU 54 1HB GLU 54 4.617 5.869 4.704
420 1HG GLU 54 2HG GLU 54 6.401 3.644 5.028
421 2HG GLU 54 1HG GLU 54 5.804 3.720 3.368
422 H GLU 55 H GLU 55 6.328 3.207 7.217
423 HA GLU 55 HA GLU 55 7.283 5.576 8.653
424 1HB GLU 55 2HB GLU 55 8.020 2.804 9.486
425 2HB GLU 55 1HB GLU 55 7.932 4.263 10.461
426 1HG GLU 55 2HG GLU 55 5.349 3.908 9.641
427 2HG GLU 55 1HG GLU 55 5.922 2.262 9.889
428 H VAL 56 H VAL 56 9.072 6.385 7.756
429 HA VAL 56 HA VAL 56 10.791 4.640 6.186
430 HB VAL 56 HB VAL 56 10.844 7.651 6.416
431 1HG1 VAL 56 1HG1 VAL 56 12.455 5.679 4.859
432 2HG1 VAL 56 2HG1 VAL 56 12.975 7.134 5.710
433 3HG1 VAL 56 3HG1 VAL 56 12.127 7.270 4.170
434 1HG2 VAL 56 1HG2 VAL 56 10.077 7.090 3.866
435 2HG2 VAL 56 2HG2 VAL 56 8.971 7.492 5.181
436 3HG2 VAL 56 3HG2 VAL 56 9.271 5.805 4.765
437 H ASP 57 H ASP 57 11.712 3.578 8.042
438 HA ASP 57 HA ASP 57 13.096 4.938 10.082
439 1HB ASP 57 2HB ASP 57 12.382 2.574 10.245
440 2HB ASP 57 1HB ASP 57 13.580 2.143 9.029
Start of MODEL 7
1 1H ILE 1 1HT ILE 1 10.471 -2.703 11.596
2 2H ILE 1 2HT ILE 1 10.743 -1.516 10.387
3 3H ILE 1 3HT ILE 1 10.120 -3.056 9.956
4 HA ILE 1 HA ILE 1 8.238 -2.494 11.519
5 HB ILE 1 HB ILE 1 9.116 0.301 10.812
6 1HG1 ILE 1 2HG1 ILE 1 9.332 -1.093 13.490
7 2HG1 ILE 1 1HG1 ILE 1 10.689 -0.718 12.433
8 1HG2 ILE 1 1HG2 ILE 1 6.738 0.070 11.068
9 2HG2 ILE 1 2HG2 ILE 1 7.382 0.914 12.476
10 3HG2 ILE 1 3HG2 ILE 1 6.944 -0.790 12.594
11 1HD1 ILE 1 1HD1 ILE 1 10.660 1.489 12.956
12 2HD1 ILE 1 2HD1 ILE 1 10.006 0.832 14.455
13 3HD1 ILE 1 3HD1 ILE 1 8.921 1.514 13.244
14 HA PRO 2 HA PRO 2 6.667 -2.343 7.331
15 1HB PRO 2 2HB PRO 2 4.291 -3.470 7.807
16 2HB PRO 2 1HB PRO 2 5.784 -4.409 7.897
17 1HG PRO 2 2HG PRO 2 4.080 -3.341 10.088
18 2HG PRO 2 1HG PRO 2 5.026 -4.837 10.025
19 1HD PRO 2 2HD PRO 2 5.781 -2.423 11.263
20 2HD PRO 2 1HD PRO 2 6.832 -3.815 10.937
21 H ALA 3 H ALA 3 4.197 -1.835 6.536
22 HA ALA 3 HA ALA 3 3.712 0.870 7.489
23 1HB ALA 3 1HB ALA 3 3.959 1.023 5.212
24 2HB ALA 3 2HB ALA 3 2.207 0.879 5.355
25 3HB ALA 3 3HB ALA 3 3.174 -0.529 4.915
26 H PHE 4 H PHE 4 1.302 1.557 7.336
27 HA PHE 4 HA PHE 4 -0.411 -0.568 8.369
28 1HB PHE 4 2HB PHE 4 0.393 0.664 10.277
29 2HB PHE 4 1HB PHE 4 -0.090 2.176 9.522
30 HD1 PHE 4 1HD PHE 4 -1.288 -0.871 11.166
31 HD2 PHE 4 2HD PHE 4 -2.365 2.913 9.547
32 HE1 PHE 4 1HE PHE 4 -3.494 -1.043 12.244
33 HE2 PHE 4 2HE PHE 4 -4.573 2.750 10.621
34 HZ PHE 4 HZ PHE 4 -5.139 0.770 11.971
35 H VAL 5 H VAL 5 -2.383 -0.676 7.480
36 HA VAL 5 HA VAL 5 -3.112 1.305 5.491
37 HB VAL 5 HB VAL 5 -4.648 -1.159 6.325
38 1HG1 VAL 5 1HG1 VAL 5 -6.054 0.359 5.137
39 2HG1 VAL 5 2HG1 VAL 5 -5.602 -0.930 4.021
40 3HG1 VAL 5 3HG1 VAL 5 -4.813 0.644 3.918
41 1HG2 VAL 5 1HG2 VAL 5 -2.610 -0.823 4.126
42 2HG2 VAL 5 2HG2 VAL 5 -3.625 -2.245 4.370
43 3HG2 VAL 5 3HG2 VAL 5 -2.427 -1.799 5.585
44 H LYS 6 H LYS 6 -4.709 2.791 5.665
45 HA LYS 6 HA LYS 6 -5.822 3.223 8.302
46 1HB LYS 6 2HB LYS 6 -6.009 4.862 5.776
47 2HB LYS 6 1HB LYS 6 -6.664 5.349 7.333
48 1HG LYS 6 2HG LYS 6 -4.563 5.674 8.259
49 2HG LYS 6 1HG LYS 6 -3.766 4.667 7.049
50 1HD LYS 6 2HD LYS 6 -3.698 6.340 5.502
51 2HD LYS 6 1HD LYS 6 -5.184 7.089 6.088
52 1HE LYS 6 2HE LYS 6 -3.121 7.208 8.096
53 2HE LYS 6 1HE LYS 6 -2.553 7.907 6.581
54 1HZ LYS 6 1HZ LYS 6 -3.560 9.701 7.535
55 2HZ LYS 6 2HZ LYS 6 -4.738 8.783 8.330
56 3HZ LYS 6 3HZ LYS 6 -4.873 9.077 6.670
57 H PHE 7 H PHE 7 -7.059 2.752 5.028
58 HA PHE 7 HA PHE 7 -9.518 1.695 6.171
59 1HB PHE 7 2HB PHE 7 -9.285 4.210 4.824
60 2HB PHE 7 1HB PHE 7 -10.270 3.121 3.850
61 HD1 PHE 7 1HD PHE 7 -11.784 1.587 5.715
62 HD2 PHE 7 2HD PHE 7 -10.640 5.678 5.943
63 HE1 PHE 7 1HE PHE 7 -13.717 2.041 7.166
64 HE2 PHE 7 2HE PHE 7 -12.571 6.141 7.394
65 HZ PHE 7 HZ PHE 7 -14.113 4.321 8.008
66 H ALA 8 H ALA 8 -10.660 0.238 4.838
67 HA ALA 8 HA ALA 8 -8.980 -1.184 2.984
68 1HB ALA 8 1HB ALA 8 -11.247 -1.801 4.624
69 2HB ALA 8 2HB ALA 8 -10.121 -2.895 3.822
70 3HB ALA 8 3HB ALA 8 -11.549 -2.318 2.966
71 H TYR 9 H TYR 9 -9.246 -1.385 0.806
72 HA TYR 9 HA TYR 9 -11.487 0.032 -0.451
73 1HB TYR 9 2HB TYR 9 -9.468 1.509 -0.430
74 2HB TYR 9 1HB TYR 9 -8.615 0.287 -1.372
75 HD1 TYR 9 1HD TYR 9 -8.174 1.645 -3.281
76 HD2 TYR 9 2HD TYR 9 -12.166 1.170 -1.885
77 HE1 TYR 9 1HE TYR 9 -9.016 2.653 -5.359
78 HE2 TYR 9 2HE TYR 9 -13.017 2.175 -3.960
79 HH TYR 9 HH TYR 9 -11.210 3.937 -6.026
80 H VAL 10 H VAL 10 -12.479 -1.202 -1.910
81 HA VAL 10 HA VAL 10 -11.247 -3.691 -2.722
82 HB VAL 10 HB VAL 10 -13.488 -4.112 -3.814
83 1HG1 VAL 10 1HG1 VAL 10 -12.982 -5.079 -1.674
84 2HG1 VAL 10 2HG1 VAL 10 -14.645 -4.494 -1.652
85 3HG1 VAL 10 3HG1 VAL 10 -13.374 -3.570 -0.852
86 1HG2 VAL 10 1HG2 VAL 10 -14.786 -2.060 -2.178
87 2HG2 VAL 10 2HG2 VAL 10 -15.135 -2.589 -3.822
88 3HG2 VAL 10 3HG2 VAL 10 -13.849 -1.420 -3.527
89 H ALA 11 H ALA 11 -9.901 -3.586 -4.408
90 HA ALA 11 HA ALA 11 -10.784 -2.985 -6.992
91 1HB ALA 11 1HB ALA 11 -8.790 -0.910 -6.350
92 2HB ALA 11 2HB ALA 11 -10.416 -0.650 -5.717
93 3HB ALA 11 3HB ALA 11 -10.168 -0.861 -7.451
94 H GLU 12 H GLU 12 -9.725 -4.682 -7.821
95 HA GLU 12 HA GLU 12 -6.794 -4.685 -7.551
96 1HB GLU 12 2HB GLU 12 -8.486 -7.176 -7.751
97 2HB GLU 12 1HB GLU 12 -6.759 -7.077 -7.431
98 1HG GLU 12 2HG GLU 12 -7.049 -6.640 -5.247
99 2HG GLU 12 1HG GLU 12 -8.486 -5.655 -5.523
100 H ARG 13 H ARG 13 -5.876 -4.337 -9.426
101 HA ARG 13 HA ARG 13 -6.651 -5.782 -11.770
102 1HB ARG 13 2HB ARG 13 -7.873 -4.206 -12.762
103 2HB ARG 13 1HB ARG 13 -7.689 -3.186 -11.344
104 1HG ARG 13 2HG ARG 13 -5.429 -3.118 -13.237
105 2HG ARG 13 1HG ARG 13 -6.954 -2.484 -13.839
106 1HD ARG 13 2HD ARG 13 -6.675 -1.493 -11.241
107 2HD ARG 13 1HD ARG 13 -5.092 -1.314 -12.000
108 HE ARG 13 HE ARG 13 -6.729 -0.348 -13.892
109 1HH1 ARG 13 1HH1 ARG 13 -6.510 0.316 -10.473
110 2HH1 ARG 13 2HH1 ARG 13 -7.071 1.945 -10.627
111 1HH2 ARG 13 1HH2 ARG 13 -7.467 1.791 -14.095
112 2HH2 ARG 13 2HH2 ARG 13 -7.616 2.783 -12.683
113 H GLU 14 H GLU 14 -5.110 -4.979 -13.674
114 HA GLU 14 HA GLU 14 -2.506 -5.529 -12.897
115 1HB GLU 14 2HB GLU 14 -1.837 -4.601 -15.114
116 2HB GLU 14 1HB GLU 14 -3.162 -5.751 -15.203
117 1HG GLU 14 2HG GLU 14 -4.721 -3.769 -15.218
118 2HG GLU 14 1HG GLU 14 -3.291 -2.763 -15.445
119 H ASP 15 H ASP 15 -1.400 -4.407 -11.446
120 HA ASP 15 HA ASP 15 -0.033 -2.698 -10.718
121 1HB ASP 15 2HB ASP 15 -0.620 -1.712 -13.179
122 2HB ASP 15 1HB ASP 15 -1.399 -0.505 -12.153
123 H GLU 16 H GLU 16 -3.059 -3.359 -10.112
124 HA GLU 16 HA GLU 16 -3.373 -1.176 -8.172
125 1HB GLU 16 2HB GLU 16 -5.116 -0.687 -9.602
126 2HB GLU 16 1HB GLU 16 -5.344 -2.360 -10.071
127 1HG GLU 16 2HG GLU 16 -6.944 -2.646 -8.580
128 2HG GLU 16 1HG GLU 16 -5.947 -1.980 -7.289
129 H LEU 17 H LEU 17 -3.854 -1.759 -6.120
130 HA LEU 17 HA LEU 17 -4.439 -4.590 -5.601
131 1HB LEU 17 2HB LEU 17 -3.015 -4.247 -3.477
132 2HB LEU 17 1HB LEU 17 -2.211 -4.544 -5.010
133 HG LEU 17 HG LEU 17 -1.674 -2.185 -5.231
134 1HD1 LEU 17 1HD1 LEU 17 -3.417 -1.942 -2.824
135 2HD1 LEU 17 2HD1 LEU 17 -3.368 -0.953 -4.282
136 3HD1 LEU 17 3HD1 LEU 17 -2.099 -0.798 -3.069
137 1HD2 LEU 17 1HD2 LEU 17 0.100 -3.121 -4.169
138 2HD2 LEU 17 2HD2 LEU 17 -0.875 -3.723 -2.830
139 3HD2 LEU 17 3HD2 LEU 17 -0.414 -2.022 -2.889
140 H SER 18 H SER 18 -5.825 -5.015 -3.900
141 HA SER 18 HA SER 18 -7.543 -2.855 -3.147
142 1HB SER 18 2HB SER 18 -9.047 -4.458 -2.500
143 2HB SER 18 1HB SER 18 -8.043 -5.445 -3.564
144 HG SER 18 HG SER 18 -8.189 -5.411 -0.769
145 H LEU 19 H LEU 19 -7.929 -2.051 -1.060
146 HA LEU 19 HA LEU 19 -5.605 -2.240 0.696
147 1HB LEU 19 2HB LEU 19 -7.786 -0.261 0.282
148 2HB LEU 19 1HB LEU 19 -7.046 -0.342 1.874
149 HG LEU 19 HG LEU 19 -5.960 1.378 0.604
150 1HD1 LEU 19 1HD1 LEU 19 -3.894 0.841 1.285
151 2HD1 LEU 19 2HD1 LEU 19 -3.851 -0.637 0.324
152 3HD1 LEU 19 3HD1 LEU 19 -4.656 -0.628 1.893
153 1HD2 LEU 19 1HD2 LEU 19 -4.698 -0.218 -1.441
154 2HD2 LEU 19 2HD2 LEU 19 -5.624 1.276 -1.591
155 3HD2 LEU 19 3HD2 LEU 19 -6.455 -0.279 -1.584
156 H VAL 20 H VAL 20 -5.758 -2.606 2.918
157 HA VAL 20 HA VAL 20 -7.933 -4.397 3.670
158 HB VAL 20 HB VAL 20 -5.716 -3.805 5.565
159 1HG1 VAL 20 1HG1 VAL 20 -7.469 -6.085 4.835
160 2HG1 VAL 20 2HG1 VAL 20 -7.023 -5.461 6.423
161 3HG1 VAL 20 3HG1 VAL 20 -5.881 -6.447 5.510
162 1HG2 VAL 20 1HG2 VAL 20 -4.399 -3.905 3.597
163 2HG2 VAL 20 2HG2 VAL 20 -5.328 -5.259 2.957
164 3HG2 VAL 20 3HG2 VAL 20 -4.277 -5.492 4.354
165 H LYS 21 H LYS 21 -9.106 -4.144 5.664
166 HA LYS 21 HA LYS 21 -10.021 -1.535 6.126
167 1HB LYS 21 2HB LYS 21 -10.882 -2.674 8.357
168 2HB LYS 21 1HB LYS 21 -11.604 -3.038 6.797
169 1HG LYS 21 2HG LYS 21 -9.336 -4.735 7.637
170 2HG LYS 21 1HG LYS 21 -10.848 -4.915 8.531
171 1HD LYS 21 2HD LYS 21 -11.731 -6.093 6.867
172 2HD LYS 21 1HD LYS 21 -11.422 -4.784 5.731
173 1HE LYS 21 2HE LYS 21 -8.942 -5.991 6.182
174 2HE LYS 21 1HE LYS 21 -10.084 -7.313 6.022
175 1HZ LYS 21 1HZ LYS 21 -9.791 -5.096 4.075
176 2HZ LYS 21 2HZ LYS 21 -10.803 -6.442 3.915
177 3HZ LYS 21 3HZ LYS 21 -9.124 -6.640 3.890
178 H GLY 22 H GLY 22 -7.677 -3.497 7.930
179 1HA GLY 22 2HA GLY 22 -6.441 -1.110 8.936
180 2HA GLY 22 1HA GLY 22 -7.284 -2.019 10.174
181 H SER 23 H SER 23 -5.793 -3.700 7.540
182 HA SER 23 HA SER 23 -4.090 -5.114 9.350
183 1HB SER 23 2HB SER 23 -5.231 -6.179 7.395
184 2HB SER 23 1HB SER 23 -4.116 -5.292 6.358
185 HG SER 23 HG SER 23 -3.293 -7.056 8.413
186 H ARG 24 H ARG 24 -1.785 -5.603 8.049
187 HA ARG 24 HA ARG 24 -0.520 -2.957 7.841
188 1HB ARG 24 2HB ARG 24 0.459 -5.470 9.116
189 2HB ARG 24 1HB ARG 24 1.559 -4.181 8.668
190 1HG ARG 24 2HG ARG 24 -0.789 -3.395 10.270
191 2HG ARG 24 1HG ARG 24 0.419 -4.396 11.086
192 1HD ARG 24 2HD ARG 24 2.096 -2.684 10.024
193 2HD ARG 24 1HD ARG 24 0.669 -1.650 9.947
194 HE ARG 24 HE ARG 24 0.826 -1.353 12.202
195 1HH1 ARG 24 1HH1 ARG 24 2.636 -4.211 11.341
196 2HH1 ARG 24 2HH1 ARG 24 3.282 -4.434 12.933
197 1HH2 ARG 24 1HH2 ARG 24 1.674 -1.644 14.294
198 2HH2 ARG 24 2HH2 ARG 24 2.736 -2.976 14.610
199 H VAL 25 H VAL 25 1.141 -2.676 6.364
200 HA VAL 25 HA VAL 25 1.364 -4.757 4.285
201 HB VAL 25 HB VAL 25 1.477 -1.765 3.871
202 1HG1 VAL 25 1HG1 VAL 25 2.776 -2.814 2.197
203 2HG1 VAL 25 2HG1 VAL 25 1.219 -2.449 1.456
204 3HG1 VAL 25 3HG1 VAL 25 1.583 -4.095 1.973
205 1HG2 VAL 25 1HG2 VAL 25 -0.770 -2.409 4.478
206 2HG2 VAL 25 2HG2 VAL 25 -0.746 -3.717 3.295
207 3HG2 VAL 25 3HG2 VAL 25 -0.708 -2.040 2.754
208 H THR 26 H THR 26 3.422 -4.535 2.952
209 HA THR 26 HA THR 26 5.644 -4.227 4.771
210 HB THR 26 HB THR 26 6.951 -5.330 3.215
211 HG1 THR 26 1HG THR 26 5.397 -3.954 1.401
212 1HG2 THR 26 1HG2 THR 26 4.207 -6.250 2.409
213 2HG2 THR 26 2HG2 THR 26 5.102 -6.820 3.816
214 3HG2 THR 26 3HG2 THR 26 5.718 -7.130 2.193
215 H VAL 27 H VAL 27 7.204 -2.622 4.726
216 HA VAL 27 HA VAL 27 6.434 -0.085 3.954
217 HB VAL 27 HB VAL 27 8.245 -0.488 5.557
218 1HG1 VAL 27 1HG1 VAL 27 9.229 -2.274 3.797
219 2HG1 VAL 27 2HG1 VAL 27 10.176 -1.563 5.105
220 3HG1 VAL 27 3HG1 VAL 27 10.288 -0.901 3.475
221 1HG2 VAL 27 1HG2 VAL 27 8.964 1.200 3.168
222 2HG2 VAL 27 2HG2 VAL 27 9.850 1.237 4.693
223 3HG2 VAL 27 3HG2 VAL 27 8.152 1.710 4.648
224 H MET 28 H MET 28 5.650 -0.054 1.929
225 HA MET 28 HA MET 28 6.780 -0.998 -0.415
226 1HB MET 28 2HB MET 28 5.037 1.448 -0.122
227 2HB MET 28 1HB MET 28 5.217 0.439 -1.556
228 1HG MET 28 2HG MET 28 3.372 -0.575 -0.839
229 2HG MET 28 1HG MET 28 4.435 -1.383 0.309
230 1HE MET 28 1HE MET 28 2.259 2.263 0.321
231 2HE MET 28 2HE MET 28 0.983 1.291 1.054
232 3HE MET 28 3HE MET 28 1.700 0.794 -0.479
233 H GLU 29 H GLU 29 7.070 0.819 -2.262
234 HA GLU 29 HA GLU 29 9.489 2.249 -1.462
235 1HB GLU 29 2HB GLU 29 9.222 2.575 -4.192
236 2HB GLU 29 1HB GLU 29 10.248 1.413 -3.397
237 1HG GLU 29 2HG GLU 29 8.133 -0.102 -3.463
238 2HG GLU 29 1HG GLU 29 7.588 1.032 -4.695
239 H LYS 30 H LYS 30 9.833 4.441 -2.371
240 HA LYS 30 HA LYS 30 7.342 5.905 -2.795
241 1HB LYS 30 2HB LYS 30 8.275 7.728 -1.322
242 2HB LYS 30 1HB LYS 30 7.779 6.261 -0.486
243 1HG LYS 30 2HG LYS 30 10.190 5.532 -0.598
244 2HG LYS 30 1HG LYS 30 10.566 7.177 -1.121
245 1HD LYS 30 2HD LYS 30 9.887 8.103 0.920
246 2HD LYS 30 1HD LYS 30 8.986 6.655 1.377
247 1HE LYS 30 2HE LYS 30 11.977 6.703 1.047
248 2HE LYS 30 1HE LYS 30 11.173 7.019 2.584
249 1HZ LYS 30 1HZ LYS 30 11.955 4.613 1.872
250 2HZ LYS 30 2HZ LYS 30 10.421 4.585 1.160
251 3HZ LYS 30 3HZ LYS 30 10.577 4.862 2.821
252 H CYS 31 H CYS 31 7.717 6.331 -4.920
253 HA CYS 31 HA CYS 31 10.199 7.751 -5.587
254 1HB CYS 31 2HB CYS 31 9.947 5.815 -6.962
255 2HB CYS 31 1HB CYS 31 8.271 6.203 -7.325
256 HG CYS 31 HG CYS 31 10.330 6.864 -9.148
257 H SER 32 H SER 32 10.015 9.603 -7.058
258 HA SER 32 HA SER 32 8.165 11.499 -6.204
259 1HB SER 32 2HB SER 32 10.420 11.765 -7.505
260 2HB SER 32 1HB SER 32 9.392 11.690 -8.935
261 HG SER 32 HG SER 32 8.147 13.415 -7.868
262 H ASP 33 H ASP 33 8.128 9.464 -9.105
263 HA ASP 33 HA ASP 33 5.708 10.570 -10.129
264 1HB ASP 33 2HB ASP 33 7.166 8.002 -10.778
265 2HB ASP 33 1HB ASP 33 5.761 8.595 -11.665
266 H GLY 34 H GLY 34 3.784 9.130 -10.576
267 1HA GLY 34 2HA GLY 34 2.830 8.119 -8.056
268 2HA GLY 34 1HA GLY 34 1.899 8.275 -9.540
269 H TRP 35 H TRP 35 4.164 6.739 -10.924
270 HA TRP 35 HA TRP 35 2.982 4.133 -10.512
271 1HB TRP 35 2HB TRP 35 5.362 4.319 -12.250
272 2HB TRP 35 1HB TRP 35 3.794 3.584 -12.561
273 HD1 TRP 35 HD TRP 35 1.901 6.067 -12.431
274 HE1 TRP 35 1HE TRP 35 2.054 7.926 -14.205
275 HE3 TRP 35 3HE TRP 35 6.667 5.225 -14.080
276 HZ2 TRP 35 2HZ TRP 35 3.945 8.906 -16.058
277 HZ3 TRP 35 3HZ TRP 35 7.573 6.668 -15.856
278 HH2 TRP 35 HH TRP 35 6.239 8.470 -16.823
279 H TRP 36 H TRP 36 3.616 3.092 -8.719
280 HA TRP 36 HA TRP 36 6.331 2.238 -8.481
281 1HB TRP 36 2HB TRP 36 5.698 4.614 -7.217
282 2HB TRP 36 1HB TRP 36 5.567 3.416 -5.936
283 HD1 TRP 36 HD TRP 36 7.655 4.318 -4.699
284 HE1 TRP 36 1HE TRP 36 10.189 4.128 -5.113
285 HE3 TRP 36 3HE TRP 36 7.572 2.716 -9.560
286 HZ2 TRP 36 2HZ TRP 36 11.915 3.391 -7.212
287 HZ3 TRP 36 3HZ TRP 36 9.709 2.292 -10.691
288 HH2 TRP 36 HH TRP 36 11.836 2.622 -9.542
289 H ARG 37 H ARG 37 6.439 0.267 -7.530
290 HA ARG 37 HA ARG 37 3.950 -0.664 -6.290
291 1HB ARG 37 2HB ARG 37 5.809 -1.913 -8.197
292 2HB ARG 37 1HB ARG 37 5.173 -2.975 -6.944
293 1HG ARG 37 2HG ARG 37 2.923 -1.695 -7.725
294 2HG ARG 37 1HG ARG 37 3.825 -1.749 -9.242
295 1HD ARG 37 2HD ARG 37 3.918 -4.094 -9.214
296 2HD ARG 37 1HD ARG 37 3.467 -4.181 -7.516
297 HE ARG 37 HE ARG 37 1.302 -3.047 -8.632
298 1HH1 ARG 37 1HH1 ARG 37 3.151 -5.882 -9.491
299 2HH1 ARG 37 2HH1 ARG 37 1.790 -6.721 -10.155
300 1HH2 ARG 37 1HH2 ARG 37 -0.490 -4.156 -9.498
301 2HH2 ARG 37 2HH2 ARG 37 -0.276 -5.741 -10.162
302 H GLY 38 H GLY 38 3.850 -1.387 -4.364
303 1HA GLY 38 2HA GLY 38 6.325 -1.668 -2.791
304 2HA GLY 38 1HA GLY 38 4.724 -1.338 -2.139
305 H SER 39 H SER 39 5.195 -3.144 -0.660
306 HA SER 39 HA SER 39 4.442 -5.671 -1.936
307 1HB SER 39 2HB SER 39 6.105 -6.400 0.207
308 2HB SER 39 1HB SER 39 6.448 -6.568 -1.516
309 HG SER 39 HG SER 39 7.933 -5.125 -1.237
310 H TYR 40 H TYR 40 3.388 -7.177 -0.645
311 HA TYR 40 HA TYR 40 2.320 -6.182 1.909
312 1HB TYR 40 2HB TYR 40 0.818 -7.287 -0.451
313 2HB TYR 40 1HB TYR 40 0.145 -7.347 1.170
314 HD1 TYR 40 1HD TYR 40 1.749 -4.854 -1.114
315 HD2 TYR 40 2HD TYR 40 -1.307 -5.650 1.737
316 HE1 TYR 40 1HE TYR 40 0.871 -2.580 -1.428
317 HE2 TYR 40 2HE TYR 40 -2.193 -3.378 1.430
318 HH TYR 40 HH TYR 40 -1.481 -1.214 0.656
319 H ASN 41 H ASN 41 1.932 -7.790 3.459
320 HA ASN 41 HA ASN 41 3.516 -10.104 3.309
321 1HB ASN 41 2HB ASN 41 2.082 -10.834 5.334
322 2HB ASN 41 1HB ASN 41 3.060 -9.374 5.488
323 1HD2 ASN 41 1HD2 ASN 41 2.072 -7.401 5.650
324 2HD2 ASN 41 2HD2 ASN 41 0.372 -7.214 5.899
325 H GLY 42 H GLY 42 2.961 -11.162 1.372
326 1HA GLY 42 2HA GLY 42 1.771 -13.394 1.133
327 2HA GLY 42 1HA GLY 42 0.318 -12.430 1.340
328 H GLN 43 H GLN 43 1.763 -10.233 -0.233
329 HA GLN 43 HA GLN 43 2.177 -11.232 -2.850
330 1HB GLN 43 2HB GLN 43 0.149 -10.199 -3.894
331 2HB GLN 43 1HB GLN 43 -0.185 -11.619 -2.905
332 1HG GLN 43 2HG GLN 43 -0.456 -9.586 -1.101
333 2HG GLN 43 1HG GLN 43 -1.065 -8.854 -2.589
334 1HE2 GLN 43 1HE2 GLN 43 -1.855 -10.666 0.058
335 2HE2 GLN 43 2HE2 GLN 43 -3.334 -11.364 -0.512
336 H ILE 44 H ILE 44 2.309 -9.441 -4.474
337 HA ILE 44 HA ILE 44 3.147 -6.938 -3.180
338 HB ILE 44 HB ILE 44 4.404 -8.604 -5.305
339 1HG1 ILE 44 2HG1 ILE 44 6.429 -7.997 -4.085
340 2HG1 ILE 44 1HG1 ILE 44 5.502 -6.849 -3.120
341 1HG2 ILE 44 1HG2 ILE 44 5.757 -6.695 -6.089
342 2HG2 ILE 44 2HG2 ILE 44 4.712 -5.607 -5.180
343 3HG2 ILE 44 3HG2 ILE 44 4.054 -6.542 -6.521
344 1HD1 ILE 44 1HD1 ILE 44 4.507 -8.485 -1.865
345 2HD1 ILE 44 2HD1 ILE 44 6.094 -9.198 -2.168
346 3HD1 ILE 44 3HD1 ILE 44 4.700 -9.712 -3.118
347 H GLY 45 H GLY 45 2.977 -4.978 -4.521
348 1HA GLY 45 2HA GLY 45 1.493 -4.959 -6.938
349 2HA GLY 45 1HA GLY 45 0.415 -4.648 -5.587
350 H TRP 46 H TRP 46 -0.039 -2.575 -6.351
351 HA TRP 46 HA TRP 46 2.132 -0.631 -6.461
352 1HB TRP 46 2HB TRP 46 0.510 -0.627 -8.307
353 2HB TRP 46 1HB TRP 46 -0.802 -0.366 -7.158
354 HD1 TRP 46 HD TRP 46 2.358 1.424 -8.442
355 HE1 TRP 46 1HE TRP 46 1.987 3.970 -8.254
356 HE3 TRP 46 3HE TRP 46 -2.215 1.394 -6.176
357 HZ2 TRP 46 2HZ TRP 46 -0.009 5.726 -7.292
358 HZ3 TRP 46 3HZ TRP 46 -3.293 3.545 -5.659
359 HH2 TRP 46 HH TRP 46 -2.211 5.665 -6.206
360 H PHE 47 H PHE 47 2.505 0.807 -4.903
361 HA PHE 47 HA PHE 47 1.275 0.577 -2.401
362 1HB PHE 47 2HB PHE 47 2.732 2.212 -1.652
363 2HB PHE 47 1HB PHE 47 3.590 1.552 -3.040
364 HD1 PHE 47 1HD PHE 47 3.020 4.458 -1.414
365 HD2 PHE 47 2HD PHE 47 2.665 2.845 -5.335
366 HE1 PHE 47 1HE PHE 47 3.206 6.722 -2.357
367 HE2 PHE 47 2HE PHE 47 2.852 5.107 -6.286
368 HZ PHE 47 HZ PHE 47 3.123 7.049 -4.796
369 HA PRO 48 HA PRO 48 -2.257 3.209 -3.282
370 1HB PRO 48 2HB PRO 48 -3.884 2.187 -1.441
371 2HB PRO 48 1HB PRO 48 -3.448 1.249 -2.874
372 1HG PRO 48 2HG PRO 48 -2.467 1.002 -0.073
373 2HG PRO 48 1HG PRO 48 -2.742 -0.262 -1.283
374 1HD PRO 48 2HD PRO 48 -0.276 0.930 -0.625
375 2HD PRO 48 1HD PRO 48 -0.603 -0.117 -2.018
376 H SER 49 H SER 49 -0.146 4.384 -1.936
377 HA SER 49 HA SER 49 -0.174 5.157 0.612
378 1HB SER 49 2HB SER 49 0.761 6.289 -1.818
379 2HB SER 49 1HB SER 49 0.091 7.589 -0.829
380 HG SER 49 HG SER 49 1.428 6.830 0.888
381 H ASN 50 H ASN 50 -2.692 6.011 -1.654
382 HA ASN 50 HA ASN 50 -3.849 8.233 -0.678
383 1HB ASN 50 2HB ASN 50 -4.835 5.784 -1.945
384 2HB ASN 50 1HB ASN 50 -6.060 6.713 -1.088
385 1HD2 ASN 50 1HD2 ASN 50 -6.484 8.832 -1.734
386 2HD2 ASN 50 2HD2 ASN 50 -6.074 9.382 -3.315
387 H TYR 51 H TYR 51 -3.694 5.147 0.926
388 HA TYR 51 HA TYR 51 -4.548 6.379 3.377
389 1HB TYR 51 2HB TYR 51 -6.135 4.024 2.328
390 2HB TYR 51 1HB TYR 51 -6.386 4.868 3.855
391 HD1 TYR 51 1HD TYR 51 -7.089 4.826 0.311
392 HD2 TYR 51 2HD TYR 51 -7.239 7.221 3.824
393 HE1 TYR 51 1HE TYR 51 -8.673 6.345 -0.799
394 HE2 TYR 51 2HE TYR 51 -8.824 8.746 2.726
395 HH TYR 51 HH TYR 51 -10.354 7.980 -0.244
396 H VAL 52 H VAL 52 -2.162 5.694 3.241
397 HA VAL 52 HA VAL 52 -1.949 3.130 4.615
398 HB VAL 52 HB VAL 52 -0.320 2.228 3.293
399 1HG1 VAL 52 1HG1 VAL 52 -2.258 2.358 1.900
400 2HG1 VAL 52 2HG1 VAL 52 -0.840 2.670 0.897
401 3HG1 VAL 52 3HG1 VAL 52 -1.861 4.008 1.423
402 1HG2 VAL 52 1HG2 VAL 52 0.994 3.750 1.631
403 2HG2 VAL 52 2HG2 VAL 52 1.434 3.737 3.338
404 3HG2 VAL 52 3HG2 VAL 52 0.455 5.054 2.690
405 H LEU 53 H LEU 53 0.136 2.879 5.794
406 HA LEU 53 HA LEU 53 1.259 5.473 6.597
407 1HB LEU 53 2HB LEU 53 -0.166 3.538 8.153
408 2HB LEU 53 1HB LEU 53 1.482 3.632 8.729
409 HG LEU 53 HG LEU 53 0.569 5.217 10.069
410 1HD1 LEU 53 1HD1 LEU 53 1.305 7.274 9.446
411 2HD1 LEU 53 2HD1 LEU 53 0.592 7.167 7.836
412 3HD1 LEU 53 3HD1 LEU 53 2.093 6.312 8.194
413 1HD2 LEU 53 1HD2 LEU 53 -1.669 4.727 8.785
414 2HD2 LEU 53 2HD2 LEU 53 -1.346 6.313 8.080
415 3HD2 LEU 53 3HD2 LEU 53 -1.502 6.140 9.829
416 H GLU 54 H GLU 54 3.359 5.504 6.043
417 HA GLU 54 HA GLU 54 4.823 2.964 5.969
418 1HB GLU 54 2HB GLU 54 4.701 4.246 3.865
419 2HB GLU 54 1HB GLU 54 5.525 5.587 4.651
420 1HG GLU 54 2HG GLU 54 7.103 3.315 5.093
421 2HG GLU 54 1HG GLU 54 6.611 3.262 3.400
422 H GLU 55 H GLU 55 6.376 2.569 7.394
423 HA GLU 55 HA GLU 55 7.367 4.795 9.019
424 1HB GLU 55 2HB GLU 55 7.520 1.895 9.780
425 2HB GLU 55 1HB GLU 55 7.640 3.301 10.829
426 1HG GLU 55 2HG GLU 55 5.152 3.551 9.705
427 2HG GLU 55 1HG GLU 55 5.325 1.816 9.943
428 H VAL 56 H VAL 56 9.361 5.426 8.503
429 HA VAL 56 HA VAL 56 11.106 3.743 6.967
430 HB VAL 56 HB VAL 56 11.750 6.431 8.174
431 1HG1 VAL 56 1HG1 VAL 56 13.102 4.592 6.310
432 2HG1 VAL 56 2HG1 VAL 56 13.777 5.791 7.414
433 3HG1 VAL 56 3HG1 VAL 56 13.118 6.297 5.858
434 1HG2 VAL 56 1HG2 VAL 56 10.724 5.941 5.390
435 2HG2 VAL 56 2HG2 VAL 56 10.940 7.482 6.219
436 3HG2 VAL 56 3HG2 VAL 56 9.668 6.374 6.734
437 H ASP 57 H ASP 57 11.388 2.023 8.521
438 HA ASP 57 HA ASP 57 12.570 2.450 11.056
439 1HB ASP 57 2HB ASP 57 11.294 0.394 10.326
440 2HB ASP 57 1HB ASP 57 12.725 -0.081 9.417
Start of MODEL 8
1 1H ILE 1 1HT ILE 1 11.062 -1.205 8.423
2 2H ILE 1 2HT ILE 1 10.477 -2.813 8.541
3 3H ILE 1 3HT ILE 1 11.321 -2.106 9.858
4 HA ILE 1 HA ILE 1 9.152 -2.006 10.487
5 HB ILE 1 HB ILE 1 9.511 0.657 9.124
6 1HG1 ILE 1 2HG1 ILE 1 10.735 -0.162 11.765
7 2HG1 ILE 1 1HG1 ILE 1 11.630 -0.145 10.247
8 1HG2 ILE 1 1HG2 ILE 1 8.359 1.518 11.077
9 2HG2 ILE 1 2HG2 ILE 1 8.304 -0.097 11.783
10 3HG2 ILE 1 3HG2 ILE 1 7.398 0.253 10.310
11 1HD1 ILE 1 1HD1 ILE 1 10.901 2.310 10.090
12 2HD1 ILE 1 2HD1 ILE 1 12.169 1.878 11.236
13 3HD1 ILE 1 3HD1 ILE 1 10.522 2.154 11.804
14 HA PRO 2 HA PRO 2 6.211 -2.553 7.189
15 1HB PRO 2 2HB PRO 2 4.053 -3.099 8.665
16 2HB PRO 2 1HB PRO 2 5.424 -4.214 8.604
17 1HG PRO 2 2HG PRO 2 4.638 -2.289 10.740
18 2HG PRO 2 1HG PRO 2 5.347 -3.905 10.888
19 1HD PRO 2 2HD PRO 2 6.733 -1.479 11.056
20 2HD PRO 2 1HD PRO 2 7.460 -3.077 10.817
21 H ALA 3 H ALA 3 3.614 -1.886 7.153
22 HA ALA 3 HA ALA 3 3.575 1.007 7.607
23 1HB ALA 3 1HB ALA 3 3.575 1.053 5.345
24 2HB ALA 3 2HB ALA 3 1.846 0.797 5.580
25 3HB ALA 3 3HB ALA 3 2.895 -0.569 5.205
26 H PHE 4 H PHE 4 1.434 1.952 7.946
27 HA PHE 4 HA PHE 4 -0.357 0.080 9.285
28 1HB PHE 4 2HB PHE 4 0.338 2.921 9.812
29 2HB PHE 4 1HB PHE 4 -1.182 2.265 10.407
30 HD1 PHE 4 1HD PHE 4 2.344 1.037 10.240
31 HD2 PHE 4 2HD PHE 4 -1.088 1.784 12.641
32 HE1 PHE 4 1HE PHE 4 3.526 0.138 12.200
33 HE2 PHE 4 2HE PHE 4 0.086 0.887 14.607
34 HZ PHE 4 HZ PHE 4 2.397 0.063 14.389
35 H VAL 5 H VAL 5 -2.166 -0.382 8.217
36 HA VAL 5 HA VAL 5 -3.126 1.382 6.129
37 HB VAL 5 HB VAL 5 -4.347 -1.199 7.106
38 1HG1 VAL 5 1HG1 VAL 5 -4.783 0.514 4.678
39 2HG1 VAL 5 2HG1 VAL 5 -5.969 -0.038 5.862
40 3HG1 VAL 5 3HG1 VAL 5 -5.255 -1.185 4.728
41 1HG2 VAL 5 1HG2 VAL 5 -2.862 -1.189 4.572
42 2HG2 VAL 5 2HG2 VAL 5 -2.916 -2.400 5.853
43 3HG2 VAL 5 3HG2 VAL 5 -1.870 -0.989 6.017
44 H LYS 6 H LYS 6 -5.252 2.266 6.052
45 HA LYS 6 HA LYS 6 -6.379 2.735 8.728
46 1HB LYS 6 2HB LYS 6 -6.841 4.523 6.363
47 2HB LYS 6 1HB LYS 6 -7.044 4.893 8.068
48 1HG LYS 6 2HG LYS 6 -4.831 5.311 8.387
49 2HG LYS 6 1HG LYS 6 -4.321 4.178 7.134
50 1HD LYS 6 2HD LYS 6 -3.835 6.270 6.223
51 2HD LYS 6 1HD LYS 6 -5.380 5.843 5.486
52 1HE LYS 6 2HE LYS 6 -6.562 7.358 6.785
53 2HE LYS 6 1HE LYS 6 -5.306 7.431 8.019
54 1HZ LYS 6 1HZ LYS 6 -4.156 8.981 6.882
55 2HZ LYS 6 2HZ LYS 6 -5.665 9.321 6.197
56 3HZ LYS 6 3HZ LYS 6 -4.557 8.351 5.364
57 H PHE 7 H PHE 7 -7.341 2.378 5.343
58 HA PHE 7 HA PHE 7 -9.799 1.102 6.241
59 1HB PHE 7 2HB PHE 7 -9.728 3.715 5.232
60 2HB PHE 7 1HB PHE 7 -10.348 2.713 3.923
61 HD1 PHE 7 1HD PHE 7 -10.809 2.511 7.616
62 HD2 PHE 7 2HD PHE 7 -12.623 3.034 3.802
63 HE1 PHE 7 1HE PHE 7 -13.028 2.504 8.674
64 HE2 PHE 7 2HE PHE 7 -14.846 3.028 4.853
65 HZ PHE 7 HZ PHE 7 -15.051 2.763 7.294
66 H ALA 8 H ALA 8 -10.868 -0.189 4.620
67 HA ALA 8 HA ALA 8 -8.962 -1.312 2.722
68 1HB ALA 8 1HB ALA 8 -11.030 -3.047 2.672
69 2HB ALA 8 2HB ALA 8 -11.192 -2.394 4.302
70 3HB ALA 8 3HB ALA 8 -9.682 -3.154 3.802
71 H TYR 9 H TYR 9 -9.431 -1.574 0.545
72 HA TYR 9 HA TYR 9 -11.971 -0.481 -0.436
73 1HB TYR 9 2HB TYR 9 -10.004 1.196 -0.546
74 2HB TYR 9 1HB TYR 9 -9.394 0.171 -1.845
75 HD1 TYR 9 1HD TYR 9 -9.807 1.035 -3.934
76 HD2 TYR 9 2HD TYR 9 -12.744 1.553 -0.901
77 HE1 TYR 9 1HE TYR 9 -11.255 2.200 -5.544
78 HE2 TYR 9 2HE TYR 9 -14.200 2.718 -2.500
79 HH TYR 9 HH TYR 9 -13.094 3.739 -5.588
80 H VAL 10 H VAL 10 -12.844 -1.591 -2.105
81 HA VAL 10 HA VAL 10 -11.515 -4.035 -2.896
82 HB VAL 10 HB VAL 10 -13.699 -4.486 -4.095
83 1HG1 VAL 10 1HG1 VAL 10 -13.026 -5.227 -1.743
84 2HG1 VAL 10 2HG1 VAL 10 -14.740 -5.277 -2.153
85 3HG1 VAL 10 3HG1 VAL 10 -14.106 -3.957 -1.169
86 1HG2 VAL 10 1HG2 VAL 10 -14.128 -1.798 -3.712
87 2HG2 VAL 10 2HG2 VAL 10 -15.140 -2.539 -2.471
88 3HG2 VAL 10 3HG2 VAL 10 -15.354 -2.984 -4.164
89 H ALA 11 H ALA 11 -10.107 -3.889 -4.527
90 HA ALA 11 HA ALA 11 -10.906 -3.253 -7.140
91 1HB ALA 11 1HB ALA 11 -10.853 -0.943 -6.232
92 2HB ALA 11 2HB ALA 11 -9.740 -1.201 -7.575
93 3HB ALA 11 3HB ALA 11 -9.128 -1.149 -5.923
94 H GLU 12 H GLU 12 -9.806 -4.894 -8.035
95 HA GLU 12 HA GLU 12 -6.897 -4.960 -7.586
96 1HB GLU 12 2HB GLU 12 -7.036 -7.451 -7.885
97 2HB GLU 12 1HB GLU 12 -7.752 -6.841 -6.400
98 1HG GLU 12 2HG GLU 12 -9.565 -8.001 -6.912
99 2HG GLU 12 1HG GLU 12 -9.848 -6.846 -8.213
100 H ARG 13 H ARG 13 -5.868 -4.506 -9.365
101 HA ARG 13 HA ARG 13 -6.478 -5.785 -11.859
102 1HB ARG 13 2HB ARG 13 -7.910 -4.078 -12.402
103 2HB ARG 13 1HB ARG 13 -7.103 -2.926 -11.350
104 1HG ARG 13 2HG ARG 13 -5.451 -3.691 -13.623
105 2HG ARG 13 1HG ARG 13 -6.996 -2.997 -14.104
106 1HD ARG 13 2HD ARG 13 -5.812 -1.532 -11.926
107 2HD ARG 13 1HD ARG 13 -4.709 -1.633 -13.296
108 HE ARG 13 HE ARG 13 -7.390 -0.875 -14.012
109 1HH1 ARG 13 1HH1 ARG 13 -4.276 0.283 -12.941
110 2HH1 ARG 13 2HH1 ARG 13 -4.512 1.877 -13.572
111 1HH2 ARG 13 1HH2 ARG 13 -7.701 1.221 -14.842
112 2HH2 ARG 13 2HH2 ARG 13 -6.458 2.411 -14.650
113 H GLU 14 H GLU 14 -4.718 -5.378 -13.469
114 HA GLU 14 HA GLU 14 -2.189 -5.538 -12.317
115 1HB GLU 14 2HB GLU 14 -1.295 -5.128 -14.565
116 2HB GLU 14 1HB GLU 14 -2.650 -6.247 -14.626
117 1HG GLU 14 2HG GLU 14 -4.065 -4.155 -15.136
118 2HG GLU 14 1HG GLU 14 -2.520 -3.396 -15.514
119 H ASP 15 H ASP 15 -1.421 -4.022 -10.997
120 HA ASP 15 HA ASP 15 -0.229 -2.038 -10.619
121 1HB ASP 15 2HB ASP 15 -0.897 -1.478 -13.171
122 2HB ASP 15 1HB ASP 15 -1.961 -0.345 -12.337
123 H GLU 16 H GLU 16 -3.299 -2.994 -10.155
124 HA GLU 16 HA GLU 16 -3.874 -0.831 -8.270
125 1HB GLU 16 2HB GLU 16 -5.525 -0.496 -9.900
126 2HB GLU 16 1HB GLU 16 -5.664 -2.212 -10.237
127 1HG GLU 16 2HG GLU 16 -7.305 -2.456 -8.794
128 2HG GLU 16 1HG GLU 16 -6.400 -1.630 -7.527
129 H LEU 17 H LEU 17 -4.146 -1.521 -6.240
130 HA LEU 17 HA LEU 17 -4.697 -4.382 -5.792
131 1HB LEU 17 2HB LEU 17 -3.178 -4.343 -3.895
132 2HB LEU 17 1HB LEU 17 -2.338 -3.883 -5.370
133 HG LEU 17 HG LEU 17 -3.442 -1.781 -3.554
134 1HD1 LEU 17 1HD1 LEU 17 -2.166 -2.822 -1.951
135 2HD1 LEU 17 2HD1 LEU 17 -0.966 -1.766 -2.696
136 3HD1 LEU 17 3HD1 LEU 17 -1.028 -3.473 -3.128
137 1HD2 LEU 17 1HD2 LEU 17 -1.534 -1.957 -5.801
138 2HD2 LEU 17 2HD2 LEU 17 -1.185 -0.787 -4.530
139 3HD2 LEU 17 3HD2 LEU 17 -2.709 -0.704 -5.404
140 H SER 18 H SER 18 -6.067 -4.893 -4.115
141 HA SER 18 HA SER 18 -7.836 -2.839 -3.231
142 1HB SER 18 2HB SER 18 -9.214 -4.536 -2.579
143 2HB SER 18 1HB SER 18 -8.142 -5.498 -3.600
144 HG SER 18 HG SER 18 -8.579 -5.710 -0.972
145 H LEU 19 H LEU 19 -8.132 -2.047 -1.115
146 HA LEU 19 HA LEU 19 -5.692 -2.125 0.484
147 1HB LEU 19 2HB LEU 19 -8.016 -0.370 1.147
148 2HB LEU 19 1HB LEU 19 -6.298 -0.087 1.390
149 HG LEU 19 HG LEU 19 -7.641 -0.086 -1.307
150 1HD1 LEU 19 1HD1 LEU 19 -8.349 1.737 0.343
151 2HD1 LEU 19 2HD1 LEU 19 -7.751 2.248 -1.235
152 3HD1 LEU 19 3HD1 LEU 19 -6.701 2.342 0.179
153 1HD2 LEU 19 1HD2 LEU 19 -5.151 -0.602 -1.085
154 2HD2 LEU 19 2HD2 LEU 19 -4.977 1.079 -0.584
155 3HD2 LEU 19 3HD2 LEU 19 -5.621 0.698 -2.180
156 H VAL 20 H VAL 20 -5.680 -2.465 2.707
157 HA VAL 20 HA VAL 20 -7.704 -4.365 3.617
158 HB VAL 20 HB VAL 20 -5.516 -3.771 5.472
159 1HG1 VAL 20 1HG1 VAL 20 -6.901 -5.643 5.892
160 2HG1 VAL 20 2HG1 VAL 20 -5.348 -6.293 5.365
161 3HG1 VAL 20 3HG1 VAL 20 -6.711 -6.249 4.246
162 1HG2 VAL 20 1HG2 VAL 20 -4.086 -3.480 3.646
163 2HG2 VAL 20 2HG2 VAL 20 -4.915 -4.698 2.679
164 3HG2 VAL 20 3HG2 VAL 20 -3.909 -5.189 4.041
165 H LYS 21 H LYS 21 -8.356 -4.258 5.943
166 HA LYS 21 HA LYS 21 -8.830 -1.458 6.686
167 1HB LYS 21 2HB LYS 21 -10.906 -1.978 7.537
168 2HB LYS 21 1HB LYS 21 -10.814 -2.995 6.110
169 1HG LYS 21 2HG LYS 21 -10.423 -3.861 8.969
170 2HG LYS 21 1HG LYS 21 -11.805 -4.213 7.935
171 1HD LYS 21 2HD LYS 21 -8.973 -5.139 7.450
172 2HD LYS 21 1HD LYS 21 -10.277 -6.127 8.108
173 1HE LYS 21 2HE LYS 21 -11.181 -4.915 5.692
174 2HE LYS 21 1HE LYS 21 -9.615 -5.665 5.392
175 1HZ LYS 21 1HZ LYS 21 -12.147 -6.912 6.194
176 2HZ LYS 21 2HZ LYS 21 -10.698 -7.638 6.676
177 3HZ LYS 21 3HZ LYS 21 -11.023 -7.410 5.033
178 H GLY 22 H GLY 22 -7.397 -0.873 8.100
179 1HA GLY 22 2HA GLY 22 -6.329 -0.692 10.129
180 2HA GLY 22 1HA GLY 22 -7.401 -1.944 10.727
181 H SER 23 H SER 23 -5.558 -2.739 7.946
182 HA SER 23 HA SER 23 -3.945 -4.537 9.567
183 1HB SER 23 2HB SER 23 -5.288 -4.832 7.108
184 2HB SER 23 1HB SER 23 -3.562 -4.941 6.760
185 HG SER 23 HG SER 23 -3.538 -6.468 8.607
186 H ARG 24 H ARG 24 -1.733 -5.024 8.258
187 HA ARG 24 HA ARG 24 -0.453 -2.407 7.866
188 1HB ARG 24 2HB ARG 24 0.760 -4.847 9.106
189 2HB ARG 24 1HB ARG 24 1.584 -3.323 8.849
190 1HG ARG 24 2HG ARG 24 -0.901 -3.058 10.348
191 2HG ARG 24 1HG ARG 24 0.297 -4.087 11.142
192 1HD ARG 24 2HD ARG 24 1.846 -2.013 10.329
193 2HD ARG 24 1HD ARG 24 0.319 -1.188 10.639
194 HE ARG 24 HE ARG 24 2.128 -2.143 12.579
195 1HH1 ARG 24 1HH1 ARG 24 -1.295 -1.924 11.939
196 2HH1 ARG 24 2HH1 ARG 24 -1.735 -1.910 13.613
197 1HH2 ARG 24 1HH2 ARG 24 1.552 -2.126 14.783
198 2HH2 ARG 24 2HH2 ARG 24 -0.119 -2.024 15.228
199 H VAL 25 H VAL 25 1.167 -2.230 6.335
200 HA VAL 25 HA VAL 25 1.329 -4.444 4.394
201 HB VAL 25 HB VAL 25 1.610 -1.543 3.644
202 1HG1 VAL 25 1HG1 VAL 25 2.378 -2.683 1.839
203 2HG1 VAL 25 2HG1 VAL 25 0.655 -2.757 1.468
204 3HG1 VAL 25 3HG1 VAL 25 1.456 -4.136 2.224
205 1HG2 VAL 25 1HG2 VAL 25 -0.556 -1.344 4.263
206 2HG2 VAL 25 2HG2 VAL 25 -0.847 -3.082 4.198
207 3HG2 VAL 25 3HG2 VAL 25 -0.838 -2.133 2.711
208 H THR 26 H THR 26 3.333 -4.294 2.971
209 HA THR 26 HA THR 26 5.617 -3.999 4.699
210 HB THR 26 HB THR 26 6.863 -5.096 3.049
211 HG1 THR 26 1HG THR 26 5.077 -3.855 1.361
212 1HG2 THR 26 1HG2 THR 26 5.771 -6.996 3.310
213 2HG2 THR 26 2HG2 THR 26 4.752 -6.560 1.939
214 3HG2 THR 26 3HG2 THR 26 4.254 -6.138 3.578
215 H VAL 27 H VAL 27 7.218 -2.476 4.595
216 HA VAL 27 HA VAL 27 6.583 0.089 3.806
217 HB VAL 27 HB VAL 27 8.358 -0.402 5.408
218 1HG1 VAL 27 1HG1 VAL 27 10.341 -1.451 4.920
219 2HG1 VAL 27 2HG1 VAL 27 10.266 -1.035 3.208
220 3HG1 VAL 27 3HG1 VAL 27 9.236 -2.314 3.851
221 1HG2 VAL 27 1HG2 VAL 27 9.916 1.037 3.368
222 2HG2 VAL 27 2HG2 VAL 27 9.453 1.523 4.999
223 3HG2 VAL 27 3HG2 VAL 27 8.298 1.668 3.674
224 H MET 28 H MET 28 5.876 0.345 1.800
225 HA MET 28 HA MET 28 6.787 -0.680 -0.579
226 1HB MET 28 2HB MET 28 5.863 1.596 -1.518
227 2HB MET 28 1HB MET 28 4.774 0.405 -0.816
228 1HG MET 28 2HG MET 28 5.755 2.122 1.232
229 2HG MET 28 1HG MET 28 5.136 3.099 -0.094
230 1HE MET 28 1HE MET 28 2.590 -0.398 0.803
231 2HE MET 28 2HE MET 28 3.384 -0.097 2.348
232 3HE MET 28 3HE MET 28 4.348 -0.356 0.898
233 H GLU 29 H GLU 29 7.490 1.106 -2.380
234 HA GLU 29 HA GLU 29 10.212 1.819 -1.606
235 1HB GLU 29 2HB GLU 29 10.784 1.360 -3.748
236 2HB GLU 29 1HB GLU 29 9.226 0.573 -3.827
237 1HG GLU 29 2HG GLU 29 8.235 2.606 -4.747
238 2HG GLU 29 1HG GLU 29 9.807 3.394 -4.690
239 H LYS 30 H LYS 30 11.091 3.895 -2.087
240 HA LYS 30 HA LYS 30 9.113 6.005 -1.874
241 1HB LYS 30 2HB LYS 30 11.511 5.620 -0.610
242 2HB LYS 30 1HB LYS 30 11.945 6.775 -1.862
243 1HG LYS 30 2HG LYS 30 9.806 8.029 -1.000
244 2HG LYS 30 1HG LYS 30 10.121 7.092 0.464
245 1HD LYS 30 2HD LYS 30 12.535 8.309 -0.606
246 2HD LYS 30 1HD LYS 30 11.292 9.506 -0.236
247 1HE LYS 30 2HE LYS 30 11.264 7.754 1.931
248 2HE LYS 30 1HE LYS 30 12.972 7.973 1.550
249 1HZ LYS 30 1HZ LYS 30 12.763 10.309 1.797
250 2HZ LYS 30 2HZ LYS 30 12.034 9.610 3.154
251 3HZ LYS 30 3HZ LYS 30 11.075 10.226 1.904
252 H CYS 31 H CYS 31 8.311 6.341 -3.893
253 HA CYS 31 HA CYS 31 10.201 6.837 -6.071
254 1HB CYS 31 2HB CYS 31 8.491 5.318 -6.729
255 2HB CYS 31 1HB CYS 31 7.225 6.326 -6.043
256 HG CYS 31 HG CYS 31 7.114 7.618 -8.134
257 H SER 32 H SER 32 10.275 8.821 -7.147
258 HA SER 32 HA SER 32 9.163 11.047 -5.628
259 1HB SER 32 2HB SER 32 11.583 10.616 -7.057
260 2HB SER 32 1HB SER 32 10.731 11.944 -7.845
261 HG SER 32 HG SER 32 10.479 12.769 -5.596
262 H ASP 33 H ASP 33 9.188 9.822 -8.968
263 HA ASP 33 HA ASP 33 6.632 11.153 -9.401
264 1HB ASP 33 2HB ASP 33 9.145 12.048 -10.573
265 2HB ASP 33 1HB ASP 33 7.934 11.665 -11.798
266 H GLY 34 H GLY 34 5.409 9.405 -9.881
267 1HA GLY 34 2HA GLY 34 5.110 8.198 -12.185
268 2HA GLY 34 1HA GLY 34 6.512 7.325 -11.576
269 H TRP 35 H TRP 35 5.764 5.378 -11.095
270 HA TRP 35 HA TRP 35 3.306 5.184 -9.510
271 1HB TRP 35 2HB TRP 35 4.588 2.744 -10.629
272 2HB TRP 35 1HB TRP 35 2.889 3.146 -10.427
273 HD1 TRP 35 HD TRP 35 2.907 5.871 -12.131
274 HE1 TRP 35 1HE TRP 35 3.067 5.724 -14.696
275 HE3 TRP 35 3HE TRP 35 4.904 1.185 -12.551
276 HZ2 TRP 35 2HZ TRP 35 3.927 3.867 -16.640
277 HZ3 TRP 35 3HZ TRP 35 5.364 0.297 -14.799
278 HH2 TRP 35 HH TRP 35 4.885 1.610 -16.799
279 H TRP 36 H TRP 36 3.329 4.419 -7.481
280 HA TRP 36 HA TRP 36 5.905 4.007 -6.235
281 1HB TRP 36 2HB TRP 36 3.138 4.584 -5.339
282 2HB TRP 36 1HB TRP 36 4.186 3.750 -4.200
283 HD1 TRP 36 HD TRP 36 6.581 5.099 -3.681
284 HE1 TRP 36 1HE TRP 36 6.939 7.631 -3.366
285 HE3 TRP 36 3HE TRP 36 2.351 6.792 -5.973
286 HZ2 TRP 36 2HZ TRP 36 5.595 10.031 -4.011
287 HZ3 TRP 36 3HZ TRP 36 1.956 9.218 -6.084
288 HH2 TRP 36 HH TRP 36 3.545 10.803 -5.123
289 H ARG 37 H ARG 37 6.740 2.092 -5.802
290 HA ARG 37 HA ARG 37 5.111 -0.299 -6.146
291 1HB ARG 37 2HB ARG 37 7.482 0.114 -7.158
292 2HB ARG 37 1HB ARG 37 8.036 -0.368 -5.559
293 1HG ARG 37 2HG ARG 37 7.987 -2.442 -6.366
294 2HG ARG 37 1HG ARG 37 6.245 -2.332 -6.142
295 1HD ARG 37 2HD ARG 37 5.876 -2.407 -8.337
296 2HD ARG 37 1HD ARG 37 7.058 -1.135 -8.643
297 HE ARG 37 HE ARG 37 8.604 -3.301 -8.200
298 1HH1 ARG 37 1HH1 ARG 37 5.885 -2.719 -10.311
299 2HH1 ARG 37 2HH1 ARG 37 6.422 -3.839 -11.516
300 1HH2 ARG 37 1HH2 ARG 37 9.310 -4.775 -9.783
301 2HH2 ARG 37 2HH2 ARG 37 8.366 -5.008 -11.216
302 H GLY 38 H GLY 38 5.054 -1.951 -4.627
303 1HA GLY 38 2HA GLY 38 6.199 -1.705 -2.024
304 2HA GLY 38 1HA GLY 38 4.499 -1.251 -2.024
305 H SER 39 H SER 39 5.289 -3.357 -0.491
306 HA SER 39 HA SER 39 4.171 -5.632 -1.965
307 1HB SER 39 2HB SER 39 6.456 -5.632 0.001
308 2HB SER 39 1HB SER 39 5.575 -7.100 -0.433
309 HG SER 39 HG SER 39 7.459 -5.705 -1.837
310 H TYR 40 H TYR 40 3.008 -7.190 -0.734
311 HA TYR 40 HA TYR 40 2.149 -6.402 1.930
312 1HB TYR 40 2HB TYR 40 0.511 -5.174 0.785
313 2HB TYR 40 1HB TYR 40 0.369 -6.377 -0.495
314 HD1 TYR 40 1HD TYR 40 -1.202 -8.147 -0.336
315 HD2 TYR 40 2HD TYR 40 -0.482 -5.652 3.034
316 HE1 TYR 40 1HE TYR 40 -3.155 -9.123 0.797
317 HE2 TYR 40 2HE TYR 40 -2.433 -6.621 4.175
318 HH TYR 40 HH TYR 40 -4.708 -8.617 2.555
319 H ASN 41 H ASN 41 1.331 -8.102 3.126
320 HA ASN 41 HA ASN 41 2.190 -10.682 2.445
321 1HB ASN 41 2HB ASN 41 0.411 -11.285 4.348
322 2HB ASN 41 1HB ASN 41 1.963 -10.537 4.721
323 1HD2 ASN 41 1HD2 ASN 41 2.030 -8.347 5.266
324 2HD2 ASN 41 2HD2 ASN 41 0.620 -7.489 5.776
325 H GLY 42 H GLY 42 1.373 -11.116 0.377
326 1HA GLY 42 2HA GLY 42 -0.566 -12.839 -0.048
327 2HA GLY 42 1HA GLY 42 -1.506 -11.359 0.065
328 H GLN 43 H GLN 43 0.709 -9.805 -1.171
329 HA GLN 43 HA GLN 43 1.222 -10.840 -3.749
330 1HB GLN 43 2HB GLN 43 -0.212 -9.065 -4.946
331 2HB GLN 43 1HB GLN 43 -1.008 -10.522 -4.354
332 1HG GLN 43 2HG GLN 43 -1.589 -9.182 -2.280
333 2HG GLN 43 1HG GLN 43 -1.076 -7.757 -3.189
334 1HE2 GLN 43 1HE2 GLN 43 -3.560 -9.973 -2.578
335 2HE2 GLN 43 2HE2 GLN 43 -4.690 -9.400 -3.758
336 H ILE 44 H ILE 44 2.075 -9.133 -5.256
337 HA ILE 44 HA ILE 44 3.201 -6.838 -3.820
338 HB ILE 44 HB ILE 44 4.693 -9.069 -5.093
339 1HG1 ILE 44 2HG1 ILE 44 6.363 -8.051 -3.309
340 2HG1 ILE 44 1HG1 ILE 44 4.886 -7.294 -2.708
341 1HG2 ILE 44 1HG2 ILE 44 6.658 -7.613 -5.510
342 2HG2 ILE 44 2HG2 ILE 44 5.627 -6.205 -5.259
343 3HG2 ILE 44 3HG2 ILE 44 5.312 -7.299 -6.606
344 1HD1 ILE 44 1HD1 ILE 44 5.028 -10.240 -3.206
345 2HD1 ILE 44 2HD1 ILE 44 3.918 -9.338 -2.173
346 3HD1 ILE 44 3HD1 ILE 44 5.607 -9.529 -1.700
347 H GLY 45 H GLY 45 3.973 -5.127 -5.212
348 1HA GLY 45 2HA GLY 45 4.112 -4.756 -7.818
349 2HA GLY 45 1HA GLY 45 2.372 -4.962 -7.658
350 H TRP 46 H TRP 46 1.145 -3.292 -6.957
351 HA TRP 46 HA TRP 46 2.535 -0.739 -6.588
352 1HB TRP 46 2HB TRP 46 0.506 -1.265 -8.265
353 2HB TRP 46 1HB TRP 46 -0.430 -0.844 -6.835
354 HD1 TRP 46 HD TRP 46 2.784 0.814 -8.244
355 HE1 TRP 46 1HE TRP 46 2.318 3.330 -8.508
356 HE3 TRP 46 3HE TRP 46 -2.130 0.883 -6.824
357 HZ2 TRP 46 2HZ TRP 46 0.153 5.110 -8.164
358 HZ3 TRP 46 3HZ TRP 46 -3.325 3.035 -6.820
359 HH2 TRP 46 HH TRP 46 -2.205 5.104 -7.476
360 H PHE 47 H PHE 47 2.105 0.620 -4.845
361 HA PHE 47 HA PHE 47 1.371 -0.748 -2.427
362 1HB PHE 47 2HB PHE 47 2.112 1.195 -1.269
363 2HB PHE 47 1HB PHE 47 3.225 0.951 -2.610
364 HD1 PHE 47 1HD PHE 47 3.000 3.488 -1.111
365 HD2 PHE 47 2HD PHE 47 0.918 2.131 -4.566
366 HE1 PHE 47 1HE PHE 47 2.643 5.819 -1.812
367 HE2 PHE 47 2HE PHE 47 0.551 4.455 -5.266
368 HZ PHE 47 HZ PHE 47 1.417 6.305 -3.891
369 HA PRO 48 HA PRO 48 -2.819 0.755 -2.297
370 1HB PRO 48 2HB PRO 48 -3.499 -0.158 0.117
371 2HB PRO 48 1HB PRO 48 -3.095 -1.271 -1.194
372 1HG PRO 48 2HG PRO 48 -1.512 -0.508 1.195
373 2HG PRO 48 1HG PRO 48 -1.514 -2.025 0.284
374 1HD PRO 48 2HD PRO 48 0.342 0.127 0.066
375 2HD PRO 48 1HD PRO 48 0.262 -1.335 -0.935
376 H SER 49 H SER 49 -0.671 2.641 -1.500
377 HA SER 49 HA SER 49 -0.822 3.991 0.796
378 1HB SER 49 2HB SER 49 -0.031 4.594 -1.849
379 2HB SER 49 1HB SER 49 -0.910 5.989 -1.224
380 HG SER 49 HG SER 49 0.968 6.398 -0.344
381 H ASN 50 H ASN 50 -3.498 3.787 -1.419
382 HA ASN 50 HA ASN 50 -4.932 6.033 -1.105
383 1HB ASN 50 2HB ASN 50 -5.613 3.199 -1.385
384 2HB ASN 50 1HB ASN 50 -6.909 4.206 -0.755
385 1HD2 ASN 50 1HD2 ASN 50 -7.558 6.036 -1.995
386 2HD2 ASN 50 2HD2 ASN 50 -7.384 6.011 -3.709
387 H TYR 51 H TYR 51 -4.291 3.659 1.363
388 HA TYR 51 HA TYR 51 -4.989 5.536 3.400
389 1HB TYR 51 2HB TYR 51 -6.674 3.051 3.034
390 2HB TYR 51 1HB TYR 51 -6.608 3.963 4.542
391 HD1 TYR 51 1HD TYR 51 -8.361 3.545 1.542
392 HD2 TYR 51 2HD TYR 51 -7.079 6.563 4.254
393 HE1 TYR 51 1HE TYR 51 -10.125 5.040 0.704
394 HE2 TYR 51 2HE TYR 51 -8.840 8.066 3.423
395 HH TYR 51 HH TYR 51 -10.182 8.162 0.992
396 H VAL 52 H VAL 52 -2.592 4.844 3.215
397 HA VAL 52 HA VAL 52 -2.185 2.807 5.261
398 HB VAL 52 HB VAL 52 -0.653 1.544 4.133
399 1HG1 VAL 52 1HG1 VAL 52 -2.579 1.015 2.975
400 2HG1 VAL 52 2HG1 VAL 52 -1.447 1.394 1.676
401 3HG1 VAL 52 3HG1 VAL 52 -2.650 2.582 2.172
402 1HG2 VAL 52 1HG2 VAL 52 0.324 2.519 1.868
403 2HG2 VAL 52 2HG2 VAL 52 1.057 2.886 3.429
404 3HG2 VAL 52 3HG2 VAL 52 -0.025 4.052 2.665
405 H LEU 53 H LEU 53 0.003 2.856 6.222
406 HA LEU 53 HA LEU 53 1.150 5.559 6.197
407 1HB LEU 53 2HB LEU 53 -0.019 4.050 8.336
408 2HB LEU 53 1HB LEU 53 1.674 4.328 8.679
409 HG LEU 53 HG LEU 53 0.759 6.162 9.688
410 1HD1 LEU 53 1HD1 LEU 53 0.611 7.571 7.104
411 2HD1 LEU 53 2HD1 LEU 53 2.129 6.741 7.450
412 3HD1 LEU 53 3HD1 LEU 53 1.516 7.963 8.565
413 1HD2 LEU 53 1HD2 LEU 53 -1.533 5.366 8.650
414 2HD2 LEU 53 2HD2 LEU 53 -1.264 6.761 7.601
415 3HD2 LEU 53 3HD2 LEU 53 -1.339 6.976 9.349
416 H GLU 54 H GLU 54 3.189 5.478 5.442
417 HA GLU 54 HA GLU 54 4.681 2.971 5.754
418 1HB GLU 54 2HB GLU 54 4.351 3.737 3.456
419 2HB GLU 54 1HB GLU 54 5.147 5.258 3.839
420 1HG GLU 54 2HG GLU 54 6.924 3.261 4.625
421 2HG GLU 54 1HG GLU 54 6.274 2.733 3.073
422 H GLU 55 H GLU 55 6.440 2.858 6.978
423 HA GLU 55 HA GLU 55 7.360 5.267 8.311
424 1HB GLU 55 2HB GLU 55 8.314 2.471 8.868
425 2HB GLU 55 1HB GLU 55 8.326 3.863 9.946
426 1HG GLU 55 2HG GLU 55 5.648 3.408 9.216
427 2HG GLU 55 1HG GLU 55 6.351 1.843 9.626
428 H VAL 56 H VAL 56 9.386 6.110 8.100
429 HA VAL 56 HA VAL 56 10.889 5.319 5.786
430 HB VAL 56 HB VAL 56 11.761 7.370 7.807
431 1HG1 VAL 56 1HG1 VAL 56 13.476 7.107 6.289
432 2HG1 VAL 56 2HG1 VAL 56 12.543 8.404 5.542
433 3HG1 VAL 56 3HG1 VAL 56 12.382 6.749 4.953
434 1HG2 VAL 56 1HG2 VAL 56 10.518 8.814 5.854
435 2HG2 VAL 56 2HG2 VAL 56 9.817 8.422 7.423
436 3HG2 VAL 56 3HG2 VAL 56 9.443 7.426 6.018
437 H ASP 57 H ASP 57 11.402 3.143 6.619
438 HA ASP 57 HA ASP 57 13.072 2.757 8.862
439 1HB ASP 57 2HB ASP 57 11.667 1.009 7.640
440 2HB ASP 57 1HB ASP 57 12.964 0.947 6.451
Start of MODEL 9
1 1H ILE 1 1HT ILE 1 10.758 -1.380 8.845
2 2H ILE 1 2HT ILE 1 10.131 -2.977 8.856
3 3H ILE 1 3HT ILE 1 10.866 -2.332 10.267
4 HA ILE 1 HA ILE 1 8.619 -2.242 10.653
5 HB ILE 1 HB ILE 1 9.254 0.506 9.595
6 1HG1 ILE 1 2HG1 ILE 1 10.108 -0.643 12.261
7 2HG1 ILE 1 1HG1 ILE 1 11.183 -0.468 10.878
8 1HG2 ILE 1 1HG2 ILE 1 7.861 -0.117 12.162
9 2HG2 ILE 1 2HG2 ILE 1 6.980 -0.211 10.637
10 3HG2 ILE 1 3HG2 ILE 1 7.730 1.307 11.132
11 1HD1 ILE 1 1HD1 ILE 1 10.465 2.021 10.966
12 2HD1 ILE 1 2HD1 ILE 1 11.655 1.410 12.116
13 3HD1 ILE 1 3HD1 ILE 1 9.979 1.632 12.616
14 HA PRO 2 HA PRO 2 6.151 -2.398 6.937
15 1HB PRO 2 2HB PRO 2 3.880 -3.277 8.030
16 2HB PRO 2 1HB PRO 2 5.311 -4.309 7.947
17 1HG PRO 2 2HG PRO 2 4.189 -2.809 10.267
18 2HG PRO 2 1HG PRO 2 4.952 -4.407 10.225
19 1HD PRO 2 2HD PRO 2 6.198 -2.019 10.969
20 2HD PRO 2 1HD PRO 2 7.024 -3.524 10.527
21 H ALA 3 H ALA 3 3.543 -1.846 6.713
22 HA ALA 3 HA ALA 3 3.339 0.969 7.496
23 1HB ALA 3 1HB ALA 3 1.701 0.995 5.470
24 2HB ALA 3 2HB ALA 3 2.564 -0.471 5.002
25 3HB ALA 3 3HB ALA 3 3.443 1.046 5.198
26 H PHE 4 H PHE 4 1.209 1.796 7.975
27 HA PHE 4 HA PHE 4 -0.555 -0.257 9.073
28 1HB PHE 4 2HB PHE 4 0.022 2.553 9.896
29 2HB PHE 4 1HB PHE 4 -1.449 1.749 10.425
30 HD1 PHE 4 1HD PHE 4 2.068 0.544 10.081
31 HD2 PHE 4 2HD PHE 4 -1.235 1.277 12.662
32 HE1 PHE 4 1HE PHE 4 3.312 -0.460 11.950
33 HE2 PHE 4 2HE PHE 4 0.003 0.274 14.537
34 HZ PHE 4 HZ PHE 4 2.280 -0.594 14.182
35 H VAL 5 H VAL 5 -2.349 -0.610 7.903
36 HA VAL 5 HA VAL 5 -3.238 1.280 5.924
37 HB VAL 5 HB VAL 5 -4.553 -1.277 6.861
38 1HG1 VAL 5 1HG1 VAL 5 -5.073 0.538 4.522
39 2HG1 VAL 5 2HG1 VAL 5 -6.205 -0.011 5.759
40 3HG1 VAL 5 3HG1 VAL 5 -5.602 -1.145 4.551
41 1HG2 VAL 5 1HG2 VAL 5 -3.180 -1.162 4.256
42 2HG2 VAL 5 2HG2 VAL 5 -3.260 -2.464 5.444
43 3HG2 VAL 5 3HG2 VAL 5 -2.138 -1.123 5.679
44 H LYS 6 H LYS 6 -5.445 2.117 5.823
45 HA LYS 6 HA LYS 6 -6.495 2.718 8.505
46 1HB LYS 6 2HB LYS 6 -6.771 4.427 6.039
47 2HB LYS 6 1HB LYS 6 -7.242 4.854 7.678
48 1HG LYS 6 2HG LYS 6 -5.064 5.186 8.361
49 2HG LYS 6 1HG LYS 6 -4.399 4.167 7.084
50 1HD LYS 6 2HD LYS 6 -3.877 6.413 6.514
51 2HD LYS 6 1HD LYS 6 -5.181 5.903 5.438
52 1HE LYS 6 2HE LYS 6 -6.603 7.427 6.259
53 2HE LYS 6 1HE LYS 6 -6.125 7.107 7.925
54 1HZ LYS 6 1HZ LYS 6 -5.309 9.189 7.729
55 2HZ LYS 6 2HZ LYS 6 -5.112 9.095 6.051
56 3HZ LYS 6 3HZ LYS 6 -3.974 8.380 7.078
57 H PHE 7 H PHE 7 -7.769 2.954 5.210
58 HA PHE 7 HA PHE 7 -10.190 1.599 6.146
59 1HB PHE 7 2HB PHE 7 -9.804 4.070 4.671
60 2HB PHE 7 1HB PHE 7 -10.888 2.966 3.825
61 HD1 PHE 7 1HD PHE 7 -12.288 1.648 6.015
62 HD2 PHE 7 2HD PHE 7 -11.141 5.721 5.568
63 HE1 PHE 7 1HE PHE 7 -14.132 2.325 7.497
64 HE2 PHE 7 2HE PHE 7 -12.982 6.407 7.049
65 HZ PHE 7 HZ PHE 7 -14.480 4.708 8.016
66 H ALA 8 H ALA 8 -11.357 0.297 4.604
67 HA ALA 8 HA ALA 8 -9.552 -1.118 2.813
68 1HB ALA 8 1HB ALA 8 -12.323 -1.978 3.583
69 2HB ALA 8 2HB ALA 8 -10.912 -2.309 4.587
70 3HB ALA 8 3HB ALA 8 -11.006 -2.967 2.954
71 H TYR 9 H TYR 9 -9.879 -1.307 0.647
72 HA TYR 9 HA TYR 9 -12.280 -0.094 -0.516
73 1HB TYR 9 2HB TYR 9 -10.128 1.414 -0.472
74 2HB TYR 9 1HB TYR 9 -9.624 0.391 -1.819
75 HD1 TYR 9 1HD TYR 9 -9.855 1.550 -3.800
76 HD2 TYR 9 2HD TYR 9 -12.913 1.898 -0.861
77 HE1 TYR 9 1HE TYR 9 -11.176 2.932 -5.347
78 HE2 TYR 9 2HE TYR 9 -14.242 3.280 -2.400
79 HH TYR 9 HH TYR 9 -13.437 3.627 -5.724
80 H VAL 10 H VAL 10 -13.140 -1.263 -2.133
81 HA VAL 10 HA VAL 10 -11.796 -3.708 -2.907
82 HB VAL 10 HB VAL 10 -13.982 -4.108 -4.185
83 1HG1 VAL 10 1HG1 VAL 10 -15.218 -4.526 -1.953
84 2HG1 VAL 10 2HG1 VAL 10 -13.720 -3.967 -1.207
85 3HG1 VAL 10 3HG1 VAL 10 -13.705 -5.378 -2.266
86 1HG2 VAL 10 1HG2 VAL 10 -14.628 -1.669 -4.098
87 2HG2 VAL 10 2HG2 VAL 10 -15.008 -1.918 -2.394
88 3HG2 VAL 10 3HG2 VAL 10 -15.887 -2.813 -3.633
89 H ALA 11 H ALA 11 -10.361 -3.542 -4.518
90 HA ALA 11 HA ALA 11 -11.172 -2.782 -7.124
91 1HB ALA 11 1HB ALA 11 -10.181 -0.739 -7.469
92 2HB ALA 11 2HB ALA 11 -9.058 -0.937 -6.124
93 3HB ALA 11 3HB ALA 11 -10.752 -0.560 -5.811
94 H GLU 12 H GLU 12 -10.293 -4.718 -7.786
95 HA GLU 12 HA GLU 12 -7.363 -4.928 -7.534
96 1HB GLU 12 2HB GLU 12 -9.265 -7.229 -7.973
97 2HB GLU 12 1HB GLU 12 -7.551 -7.316 -7.587
98 1HG GLU 12 2HG GLU 12 -7.899 -7.051 -5.391
99 2HG GLU 12 1HG GLU 12 -9.172 -5.856 -5.630
100 H ARG 13 H ARG 13 -6.355 -4.518 -9.340
101 HA ARG 13 HA ARG 13 -7.144 -5.699 -11.832
102 1HB ARG 13 2HB ARG 13 -8.464 -3.848 -12.243
103 2HB ARG 13 1HB ARG 13 -7.459 -2.787 -11.268
104 1HG ARG 13 2HG ARG 13 -6.080 -3.749 -13.648
105 2HG ARG 13 1HG ARG 13 -7.563 -2.874 -14.018
106 1HD ARG 13 2HD ARG 13 -6.075 -1.545 -11.951
107 2HD ARG 13 1HD ARG 13 -5.067 -1.804 -13.371
108 HE ARG 13 HE ARG 13 -7.617 -0.759 -14.079
109 1HH1 ARG 13 1HH1 ARG 13 -4.507 0.142 -12.779
110 2HH1 ARG 13 2HH1 ARG 13 -4.613 1.781 -13.324
111 1HH2 ARG 13 1HH2 ARG 13 -7.759 1.399 -14.797
112 2HH2 ARG 13 2HH2 ARG 13 -6.461 2.496 -14.469
113 H GLU 14 H GLU 14 -5.406 -5.503 -13.453
114 HA GLU 14 HA GLU 14 -2.861 -5.826 -12.375
115 1HB GLU 14 2HB GLU 14 -2.019 -5.551 -14.667
116 2HB GLU 14 1HB GLU 14 -3.452 -6.567 -14.641
117 1HG GLU 14 2HG GLU 14 -4.710 -4.353 -15.146
118 2HG GLU 14 1HG GLU 14 -3.124 -3.789 -15.669
119 H ASP 15 H ASP 15 -1.940 -4.342 -11.128
120 HA ASP 15 HA ASP 15 -0.519 -2.449 -10.970
121 1HB ASP 15 2HB ASP 15 -1.385 -1.796 -13.387
122 2HB ASP 15 1HB ASP 15 -2.437 -0.716 -12.472
123 H GLU 16 H GLU 16 -3.864 -2.889 -10.476
124 HA GLU 16 HA GLU 16 -3.874 -0.875 -8.335
125 1HB GLU 16 2HB GLU 16 -5.608 -0.251 -9.760
126 2HB GLU 16 1HB GLU 16 -6.013 -1.906 -10.160
127 1HG GLU 16 2HG GLU 16 -7.537 -2.014 -8.572
128 2HG GLU 16 1HG GLU 16 -6.422 -1.372 -7.368
129 H LEU 17 H LEU 17 -4.451 -1.484 -6.294
130 HA LEU 17 HA LEU 17 -5.090 -4.320 -5.861
131 1HB LEU 17 2HB LEU 17 -3.698 -4.043 -3.704
132 2HB LEU 17 1HB LEU 17 -2.873 -4.312 -5.232
133 HG LEU 17 HG LEU 17 -2.240 -2.006 -5.388
134 1HD1 LEU 17 1HD1 LEU 17 -4.083 -1.640 -3.051
135 2HD1 LEU 17 2HD1 LEU 17 -4.072 -0.793 -4.598
136 3HD1 LEU 17 3HD1 LEU 17 -2.801 -0.485 -3.418
137 1HD2 LEU 17 1HD2 LEU 17 -0.577 -2.935 -4.154
138 2HD2 LEU 17 2HD2 LEU 17 -1.671 -3.484 -2.885
139 3HD2 LEU 17 3HD2 LEU 17 -1.182 -1.791 -2.956
140 H SER 18 H SER 18 -6.363 -4.797 -4.051
141 HA SER 18 HA SER 18 -8.194 -2.720 -3.324
142 1HB SER 18 2HB SER 18 -9.595 -4.392 -2.623
143 2HB SER 18 1HB SER 18 -8.551 -5.344 -3.682
144 HG SER 18 HG SER 18 -7.854 -6.394 -2.001
145 H LEU 19 H LEU 19 -8.620 -1.919 -1.243
146 HA LEU 19 HA LEU 19 -6.271 -1.903 0.493
147 1HB LEU 19 2HB LEU 19 -8.529 -0.085 -0.040
148 2HB LEU 19 1HB LEU 19 -8.020 -0.157 1.640
149 HG LEU 19 HG LEU 19 -6.941 1.677 0.429
150 1HD1 LEU 19 1HD1 LEU 19 -4.841 1.375 1.353
151 2HD1 LEU 19 2HD1 LEU 19 -4.805 -0.347 0.969
152 3HD1 LEU 19 3HD1 LEU 19 -5.829 0.246 2.278
153 1HD2 LEU 19 1HD2 LEU 19 -5.455 -0.375 -1.179
154 2HD2 LEU 19 2HD2 LEU 19 -5.542 1.370 -1.419
155 3HD2 LEU 19 3HD2 LEU 19 -6.946 0.362 -1.767
156 H VAL 20 H VAL 20 -6.365 -2.330 2.713
157 HA VAL 20 HA VAL 20 -8.475 -4.209 3.459
158 HB VAL 20 HB VAL 20 -6.118 -3.668 5.215
159 1HG1 VAL 20 1HG1 VAL 20 -7.407 -5.229 6.248
160 2HG1 VAL 20 2HG1 VAL 20 -6.444 -6.307 5.239
161 3HG1 VAL 20 3HG1 VAL 20 -8.071 -5.846 4.735
162 1HG2 VAL 20 1HG2 VAL 20 -5.026 -3.885 3.107
163 2HG2 VAL 20 2HG2 VAL 20 -6.052 -5.245 2.648
164 3HG2 VAL 20 3HG2 VAL 20 -4.866 -5.432 3.940
165 H LYS 21 H LYS 21 -9.220 -4.175 5.744
166 HA LYS 21 HA LYS 21 -10.363 -1.659 6.354
167 1HB LYS 21 2HB LYS 21 -11.038 -2.866 8.516
168 2HB LYS 21 1HB LYS 21 -11.652 -3.504 6.998
169 1HG LYS 21 2HG LYS 21 -9.167 -4.768 7.571
170 2HG LYS 21 1HG LYS 21 -10.183 -4.837 9.011
171 1HD LYS 21 2HD LYS 21 -10.511 -6.788 7.563
172 2HD LYS 21 1HD LYS 21 -11.986 -5.833 7.720
173 1HE LYS 21 2HE LYS 21 -11.176 -4.689 5.540
174 2HE LYS 21 1HE LYS 21 -10.141 -6.106 5.376
175 1HZ LYS 21 1HZ LYS 21 -12.106 -6.582 4.206
176 2HZ LYS 21 2HZ LYS 21 -13.100 -6.017 5.453
177 3HZ LYS 21 3HZ LYS 21 -12.229 -7.454 5.650
178 H GLY 22 H GLY 22 -7.581 -3.410 7.638
179 1HA GLY 22 2HA GLY 22 -6.369 -1.053 8.606
180 2HA GLY 22 1HA GLY 22 -7.142 -1.892 9.935
181 H SER 23 H SER 23 -5.682 -3.532 7.212
182 HA SER 23 HA SER 23 -3.992 -5.028 8.980
183 1HB SER 23 2HB SER 23 -5.011 -5.350 6.333
184 2HB SER 23 1HB SER 23 -3.259 -5.540 6.296
185 HG SER 23 HG SER 23 -4.888 -6.857 8.196
186 H ARG 24 H ARG 24 -1.651 -5.452 7.849
187 HA ARG 24 HA ARG 24 -0.432 -2.794 7.563
188 1HB ARG 24 2HB ARG 24 0.787 -5.184 8.882
189 2HB ARG 24 1HB ARG 24 1.532 -3.608 8.729
190 1HG ARG 24 2HG ARG 24 -1.076 -3.478 9.990
191 2HG ARG 24 1HG ARG 24 0.044 -4.533 10.863
192 1HD ARG 24 2HD ARG 24 1.699 -2.511 10.443
193 2HD ARG 24 1HD ARG 24 0.190 -1.605 10.347
194 HE ARG 24 HE ARG 24 -0.088 -1.886 12.608
195 1HH1 ARG 24 1HH1 ARG 24 2.409 -4.052 11.486
196 2HH1 ARG 24 2HH1 ARG 24 2.905 -4.507 13.081
197 1HH2 ARG 24 1HH2 ARG 24 0.564 -2.481 14.706
198 2HH2 ARG 24 2HH2 ARG 24 1.857 -3.615 14.910
199 H VAL 25 H VAL 25 1.320 -2.565 6.177
200 HA VAL 25 HA VAL 25 1.663 -4.756 4.232
201 HB VAL 25 HB VAL 25 1.816 -1.790 3.671
202 1HG1 VAL 25 1HG1 VAL 25 1.605 -2.680 1.276
203 2HG1 VAL 25 2HG1 VAL 25 2.088 -4.234 1.955
204 3HG1 VAL 25 3HG1 VAL 25 3.162 -2.842 2.083
205 1HG2 VAL 25 1HG2 VAL 25 -0.388 -3.758 3.065
206 2HG2 VAL 25 2HG2 VAL 25 -0.319 -2.090 2.494
207 3HG2 VAL 25 3HG2 VAL 25 -0.461 -2.427 4.219
208 H THR 26 H THR 26 3.738 -4.611 2.969
209 HA THR 26 HA THR 26 5.946 -4.303 4.800
210 HB THR 26 HB THR 26 7.228 -5.498 3.285
211 HG1 THR 26 1HG THR 26 6.807 -3.985 1.569
212 1HG2 THR 26 1HG2 THR 26 5.987 -7.318 3.439
213 2HG2 THR 26 2HG2 THR 26 5.269 -6.868 1.894
214 3HG2 THR 26 3HG2 THR 26 4.490 -6.387 3.400
215 H VAL 27 H VAL 27 7.579 -2.773 4.709
216 HA VAL 27 HA VAL 27 6.931 -0.218 3.893
217 HB VAL 27 HB VAL 27 8.747 -0.675 5.477
218 1HG1 VAL 27 1HG1 VAL 27 10.666 -1.793 5.000
219 2HG1 VAL 27 2HG1 VAL 27 10.683 -1.271 3.316
220 3HG1 VAL 27 3HG1 VAL 27 9.608 -2.574 3.823
221 1HG2 VAL 27 1HG2 VAL 27 10.280 1.041 4.756
222 2HG2 VAL 27 2HG2 VAL 27 8.643 1.489 4.277
223 3HG2 VAL 27 3HG2 VAL 27 9.767 0.845 3.080
224 H MET 28 H MET 28 6.204 0.026 1.929
225 HA MET 28 HA MET 28 6.915 -1.093 -0.444
226 1HB MET 28 2HB MET 28 6.165 1.803 -0.397
227 2HB MET 28 1HB MET 28 5.630 0.531 -1.489
228 1HG MET 28 2HG MET 28 4.623 -0.384 0.833
229 2HG MET 28 1HG MET 28 4.574 1.352 1.130
230 1HE MET 28 1HE MET 28 2.945 -1.412 0.440
231 2HE MET 28 2HE MET 28 2.271 -1.446 -1.189
232 3HE MET 28 3HE MET 28 1.351 -0.723 0.130
233 H GLU 29 H GLU 29 7.612 0.498 -2.351
234 HA GLU 29 HA GLU 29 10.433 1.064 -1.856
235 1HB GLU 29 2HB GLU 29 10.796 0.454 -4.020
236 2HB GLU 29 1HB GLU 29 9.245 -0.330 -3.838
237 1HG GLU 29 2HG GLU 29 8.121 1.503 -4.904
238 2HG GLU 29 1HG GLU 29 9.622 2.420 -4.987
239 H LYS 30 H LYS 30 11.393 2.990 -2.920
240 HA LYS 30 HA LYS 30 9.815 5.317 -2.355
241 1HB LYS 30 2HB LYS 30 12.641 4.884 -3.279
242 2HB LYS 30 1HB LYS 30 11.929 6.491 -3.274
243 1HG LYS 30 2HG LYS 30 12.481 4.691 -0.937
244 2HG LYS 30 1HG LYS 30 13.111 6.308 -1.261
245 1HD LYS 30 2HD LYS 30 11.516 6.907 0.224
246 2HD LYS 30 1HD LYS 30 10.486 6.857 -1.207
247 1HE LYS 30 2HE LYS 30 9.242 5.570 0.212
248 2HE LYS 30 1HE LYS 30 10.249 4.321 -0.520
249 1HZ LYS 30 1HZ LYS 30 11.015 5.678 1.995
250 2HZ LYS 30 2HZ LYS 30 11.611 4.225 1.365
251 3HZ LYS 30 3HZ LYS 30 10.038 4.296 1.984
252 H CYS 31 H CYS 31 9.068 6.841 -3.855
253 HA CYS 31 HA CYS 31 8.884 5.801 -6.592
254 1HB CYS 31 2HB CYS 31 6.697 6.104 -5.883
255 2HB CYS 31 1HB CYS 31 7.095 7.502 -4.898
256 HG CYS 31 HG CYS 31 5.900 7.681 -7.557
257 H SER 32 H SER 32 9.339 7.116 -8.370
258 HA SER 32 HA SER 32 11.094 9.371 -7.770
259 1HB SER 32 2HB SER 32 11.797 7.548 -9.369
260 2HB SER 32 1HB SER 32 10.538 8.114 -10.465
261 HG SER 32 HG SER 32 11.641 10.236 -10.225
262 H ASP 33 H ASP 33 8.208 8.589 -9.692
263 HA ASP 33 HA ASP 33 7.332 11.347 -9.403
264 1HB ASP 33 2HB ASP 33 7.693 10.026 -12.096
265 2HB ASP 33 1HB ASP 33 6.791 11.519 -11.836
266 H GLY 34 H GLY 34 5.550 10.764 -8.214
267 1HA GLY 34 2HA GLY 34 3.376 10.132 -7.874
268 2HA GLY 34 1HA GLY 34 3.247 9.967 -9.615
269 H TRP 35 H TRP 35 5.067 7.788 -9.997
270 HA TRP 35 HA TRP 35 3.319 5.668 -9.184
271 1HB TRP 35 2HB TRP 35 4.544 4.271 -10.649
272 2HB TRP 35 1HB TRP 35 4.476 5.846 -11.431
273 HD1 TRP 35 HD TRP 35 6.858 7.405 -10.725
274 HE1 TRP 35 1HE TRP 35 9.283 6.575 -10.949
275 HE3 TRP 35 3HE TRP 35 5.995 2.365 -10.742
276 HZ2 TRP 35 2HZ TRP 35 10.650 4.112 -11.110
277 HZ3 TRP 35 3HZ TRP 35 7.917 0.840 -10.933
278 HH2 TRP 35 HH TRP 35 10.196 1.697 -11.114
279 H TRP 36 H TRP 36 3.397 4.766 -7.275
280 HA TRP 36 HA TRP 36 5.996 4.343 -5.983
281 1HB TRP 36 2HB TRP 36 3.606 5.584 -5.008
282 2HB TRP 36 1HB TRP 36 3.892 4.112 -4.089
283 HD1 TRP 36 HD TRP 36 7.052 4.230 -3.929
284 HE1 TRP 36 1HE TRP 36 8.171 5.991 -2.414
285 HE3 TRP 36 3HE TRP 36 3.225 7.602 -3.642
286 HZ2 TRP 36 2HZ TRP 36 7.518 8.483 -1.266
287 HZ3 TRP 36 3HZ TRP 36 3.553 9.650 -2.319
288 HH2 TRP 36 HH TRP 36 5.656 10.080 -1.156
289 H ARG 37 H ARG 37 6.581 2.283 -5.682
290 HA ARG 37 HA ARG 37 4.531 0.203 -6.005
291 1HB ARG 37 2HB ARG 37 6.780 0.369 -7.410
292 2HB ARG 37 1HB ARG 37 7.425 -0.473 -6.007
293 1HG ARG 37 2HG ARG 37 6.766 -2.348 -6.990
294 2HG ARG 37 1HG ARG 37 5.124 -1.868 -6.561
295 1HD ARG 37 2HD ARG 37 4.593 -1.682 -8.704
296 2HD ARG 37 1HD ARG 37 5.875 -0.495 -8.940
297 HE ARG 37 HE ARG 37 7.121 -2.111 -9.957
298 1HH1 ARG 37 1HH1 ARG 37 4.600 -3.657 -8.106
299 2HH1 ARG 37 2HH1 ARG 37 4.966 -5.243 -8.696
300 1HH2 ARG 37 1HH2 ARG 37 7.601 -4.193 -10.740
301 2HH2 ARG 37 2HH2 ARG 37 6.672 -5.548 -10.193
302 H GLY 38 H GLY 38 4.462 -1.562 -4.573
303 1HA GLY 38 2HA GLY 38 6.069 -1.394 -2.141
304 2HA GLY 38 1HA GLY 38 4.332 -1.190 -1.953
305 H SER 39 H SER 39 5.431 -3.166 -0.555
306 HA SER 39 HA SER 39 4.546 -5.563 -1.992
307 1HB SER 39 2HB SER 39 6.959 -5.428 -0.172
308 2HB SER 39 1HB SER 39 6.332 -6.883 -0.953
309 HG SER 39 HG SER 39 7.191 -4.576 -2.361
310 H TYR 40 H TYR 40 3.832 -7.314 -0.698
311 HA TYR 40 HA TYR 40 3.060 -6.637 2.049
312 1HB TYR 40 2HB TYR 40 1.166 -7.903 0.068
313 2HB TYR 40 1HB TYR 40 0.802 -7.394 1.711
314 HD1 TYR 40 1HD TYR 40 2.175 -5.900 -1.429
315 HD2 TYR 40 2HD TYR 40 -0.405 -5.447 1.923
316 HE1 TYR 40 1HE TYR 40 1.468 -3.710 -2.280
317 HE2 TYR 40 2HE TYR 40 -1.121 -3.252 1.079
318 HH TYR 40 HH TYR 40 0.394 -1.787 -1.739
319 H ASN 41 H ASN 41 2.923 -8.406 3.435
320 HA ASN 41 HA ASN 41 4.517 -10.635 2.807
321 1HB ASN 41 2HB ASN 41 3.377 -11.618 4.928
322 2HB ASN 41 1HB ASN 41 4.393 -10.187 5.095
323 1HD2 ASN 41 1HD2 ASN 41 3.455 -8.213 5.551
324 2HD2 ASN 41 2HD2 ASN 41 1.824 -8.063 6.096
325 H GLY 42 H GLY 42 3.689 -11.490 0.860
326 1HA GLY 42 2HA GLY 42 2.545 -13.706 0.502
327 2HA GLY 42 1HA GLY 42 1.121 -12.886 1.122
328 H GLN 43 H GLN 43 2.329 -10.434 -0.461
329 HA GLN 43 HA GLN 43 2.069 -11.147 -3.194
330 1HB GLN 43 2HB GLN 43 -0.058 -10.082 -3.702
331 2HB GLN 43 1HB GLN 43 -0.289 -11.393 -2.547
332 1HG GLN 43 2HG GLN 43 -0.048 -9.425 -0.804
333 2HG GLN 43 1HG GLN 43 -0.580 -8.460 -2.184
334 1HE2 GLN 43 1HE2 GLN 43 -1.476 -10.612 0.288
335 2HE2 GLN 43 2HE2 GLN 43 -3.156 -10.741 -0.108
336 H ILE 44 H ILE 44 2.373 -9.389 -4.628
337 HA ILE 44 HA ILE 44 3.184 -6.870 -3.343
338 HB ILE 44 HB ILE 44 4.642 -8.573 -5.320
339 1HG1 ILE 44 2HG1 ILE 44 6.557 -7.833 -3.907
340 2HG1 ILE 44 1HG1 ILE 44 5.414 -6.894 -2.947
341 1HG2 ILE 44 1HG2 ILE 44 6.072 -6.661 -5.949
342 2HG2 ILE 44 2HG2 ILE 44 4.952 -5.577 -5.127
343 3HG2 ILE 44 3HG2 ILE 44 4.420 -6.489 -6.540
344 1HD1 ILE 44 1HD1 ILE 44 4.774 -9.746 -3.276
345 2HD1 ILE 44 2HD1 ILE 44 4.630 -8.701 -1.862
346 3HD1 ILE 44 3HD1 ILE 44 6.199 -9.370 -2.309
347 H GLY 45 H GLY 45 3.134 -4.969 -4.761
348 1HA GLY 45 2HA GLY 45 2.017 -4.958 -7.331
349 2HA GLY 45 1HA GLY 45 0.689 -4.804 -6.189
350 H TRP 46 H TRP 46 0.099 -2.750 -6.721
351 HA TRP 46 HA TRP 46 2.100 -0.618 -6.564
352 1HB TRP 46 2HB TRP 46 0.118 -1.012 -8.373
353 2HB TRP 46 1HB TRP 46 -0.705 0.049 -7.231
354 HD1 TRP 46 HD TRP 46 3.032 0.425 -8.064
355 HE1 TRP 46 1HE TRP 46 3.380 2.702 -9.212
356 HE3 TRP 46 3HE TRP 46 -1.856 1.837 -8.568
357 HZ2 TRP 46 2HZ TRP 46 1.792 4.818 -10.203
358 HZ3 TRP 46 3HZ TRP 46 -2.356 4.001 -9.626
359 HH2 TRP 46 HH TRP 46 -0.569 5.459 -10.426
360 H PHE 47 H PHE 47 2.059 0.934 -5.041
361 HA PHE 47 HA PHE 47 1.047 0.459 -2.539
362 1HB PHE 47 2HB PHE 47 1.811 2.608 -1.939
363 2HB PHE 47 1HB PHE 47 2.878 2.060 -3.230
364 HD1 PHE 47 1HD PHE 47 1.860 4.918 -2.091
365 HD2 PHE 47 2HD PHE 47 1.214 2.619 -5.614
366 HE1 PHE 47 1HE PHE 47 1.369 6.978 -3.343
367 HE2 PHE 47 2HE PHE 47 0.723 4.675 -6.871
368 HZ PHE 47 HZ PHE 47 0.801 6.858 -5.736
369 HA PRO 48 HA PRO 48 -3.127 2.056 -2.793
370 1HB PRO 48 2HB PRO 48 -3.876 1.125 -0.378
371 2HB PRO 48 1HB PRO 48 -3.611 0.051 -1.750
372 1HG PRO 48 2HG PRO 48 -2.050 0.333 0.693
373 2HG PRO 48 1HG PRO 48 -1.959 -0.924 -0.547
374 1HD PRO 48 2HD PRO 48 -0.296 1.466 -0.200
375 2HD PRO 48 1HD PRO 48 0.001 0.026 -1.192
376 H SER 49 H SER 49 -0.859 3.755 -1.735
377 HA SER 49 HA SER 49 -0.977 5.020 0.555
378 1HB SER 49 2HB SER 49 -0.420 5.873 -2.139
379 2HB SER 49 1HB SER 49 -1.026 7.211 -1.162
380 HG SER 49 HG SER 49 1.032 5.476 -0.280
381 H ASN 50 H ASN 50 -3.663 5.184 -1.708
382 HA ASN 50 HA ASN 50 -5.049 7.380 -1.043
383 1HB ASN 50 2HB ASN 50 -5.789 4.635 -1.780
384 2HB ASN 50 1HB ASN 50 -7.079 5.600 -1.076
385 1HD2 ASN 50 1HD2 ASN 50 -8.023 7.149 -2.256
386 2HD2 ASN 50 2HD2 ASN 50 -7.587 7.535 -3.879
387 H TYR 51 H TYR 51 -4.574 4.576 0.996
388 HA TYR 51 HA TYR 51 -5.305 6.119 3.301
389 1HB TYR 51 2HB TYR 51 -6.913 3.623 2.702
390 2HB TYR 51 1HB TYR 51 -7.056 4.643 4.132
391 HD1 TYR 51 1HD TYR 51 -8.130 4.105 0.748
392 HD2 TYR 51 2HD TYR 51 -7.896 7.015 3.842
393 HE1 TYR 51 1HE TYR 51 -9.845 5.446 -0.392
394 HE2 TYR 51 2HE TYR 51 -9.612 8.365 2.711
395 HH TYR 51 HH TYR 51 -11.635 7.629 0.901
396 H VAL 52 H VAL 52 -2.914 5.442 3.087
397 HA VAL 52 HA VAL 52 -2.569 3.102 4.794
398 HB VAL 52 HB VAL 52 -0.987 2.045 3.518
399 1HG1 VAL 52 1HG1 VAL 52 -2.918 1.724 2.265
400 2HG1 VAL 52 2HG1 VAL 52 -1.729 2.238 1.067
401 3HG1 VAL 52 3HG1 VAL 52 -2.922 3.384 1.673
402 1HG2 VAL 52 1HG2 VAL 52 -0.353 4.763 2.500
403 2HG2 VAL 52 2HG2 VAL 52 0.018 3.391 1.455
404 3HG2 VAL 52 3HG2 VAL 52 0.723 3.488 3.069
405 H LEU 53 H LEU 53 -0.407 3.011 5.820
406 HA LEU 53 HA LEU 53 0.801 5.660 6.143
407 1HB LEU 53 2HB LEU 53 -0.735 4.951 8.040
408 2HB LEU 53 1HB LEU 53 0.451 3.715 8.384
409 HG LEU 53 HG LEU 53 2.078 5.302 8.982
410 1HD1 LEU 53 1HD1 LEU 53 1.851 6.934 7.283
411 2HD1 LEU 53 2HD1 LEU 53 1.585 7.761 8.819
412 3HD1 LEU 53 3HD1 LEU 53 0.213 7.334 7.797
413 1HD2 LEU 53 1HD2 LEU 53 -0.355 6.574 10.143
414 2HD2 LEU 53 2HD2 LEU 53 1.167 6.141 10.923
415 3HD2 LEU 53 3HD2 LEU 53 0.004 4.883 10.498
416 H GLU 54 H GLU 54 2.859 5.552 5.506
417 HA GLU 54 HA GLU 54 4.261 2.984 5.737
418 1HB GLU 54 2HB GLU 54 4.085 3.881 3.472
419 2HB GLU 54 1HB GLU 54 4.875 5.367 3.985
420 1HG GLU 54 2HG GLU 54 6.536 3.191 4.716
421 2HG GLU 54 1HG GLU 54 6.039 2.965 3.038
422 H GLU 55 H GLU 55 5.987 2.752 7.000
423 HA GLU 55 HA GLU 55 6.960 5.100 8.436
424 1HB GLU 55 2HB GLU 55 7.552 2.241 9.147
425 2HB GLU 55 1HB GLU 55 7.627 3.658 10.186
426 1HG GLU 55 2HG GLU 55 4.996 3.546 9.314
427 2HG GLU 55 1HG GLU 55 5.443 1.875 9.645
428 H VAL 56 H VAL 56 8.866 5.932 7.856
429 HA VAL 56 HA VAL 56 10.552 4.550 5.990
430 HB VAL 56 HB VAL 56 11.111 7.166 7.386
431 1HG1 VAL 56 1HG1 VAL 56 12.298 5.753 5.027
432 2HG1 VAL 56 2HG1 VAL 56 13.108 6.482 6.414
433 3HG1 VAL 56 3HG1 VAL 56 12.391 7.508 5.171
434 1HG2 VAL 56 1HG2 VAL 56 9.757 8.273 5.970
435 2HG2 VAL 56 2HG2 VAL 56 8.945 6.716 5.810
436 3HG2 VAL 56 3HG2 VAL 56 10.141 7.214 4.614
437 H ASP 57 H ASP 57 11.191 2.732 7.246
438 HA ASP 57 HA ASP 57 12.474 2.857 9.731
439 1HB ASP 57 2HB ASP 57 11.588 0.778 8.700
440 2HB ASP 57 1HB ASP 57 12.910 0.820 7.536
Start of MODEL 10
1 1H ILE 1 1HT ILE 1 10.811 -1.487 8.342
2 2H ILE 1 2HT ILE 1 10.254 -2.936 9.075
3 3H ILE 1 3HT ILE 1 11.247 -1.851 9.959
4 HA ILE 1 HA ILE 1 8.921 -1.768 10.571
5 HB ILE 1 HB ILE 1 8.763 0.833 9.954
6 1HG1 ILE 1 2HG1 ILE 1 11.172 1.671 9.890
7 2HG1 ILE 1 1HG1 ILE 1 11.625 0.034 9.426
8 1HG2 ILE 1 1HG2 ILE 1 9.456 1.166 12.074
9 2HG2 ILE 1 2HG2 ILE 1 10.937 0.233 11.853
10 3HG2 ILE 1 3HG2 ILE 1 9.405 -0.596 12.132
11 1HD1 ILE 1 1HD1 ILE 1 10.752 0.239 7.342
12 2HD1 ILE 1 2HD1 ILE 1 11.159 1.929 7.648
13 3HD1 ILE 1 3HD1 ILE 1 9.499 1.369 7.855
14 HA PRO 2 HA PRO 2 6.310 -1.943 6.912
15 1HB PRO 2 2HB PRO 2 4.165 -3.026 8.076
16 2HB PRO 2 1HB PRO 2 5.635 -3.973 7.812
17 1HG PRO 2 2HG PRO 2 4.617 -2.711 10.317
18 2HG PRO 2 1HG PRO 2 5.427 -4.271 10.095
19 1HD PRO 2 2HD PRO 2 6.647 -1.919 10.954
20 2HD PRO 2 1HD PRO 2 7.489 -3.337 10.304
21 H ALA 3 H ALA 3 3.657 -1.507 6.929
22 HA ALA 3 HA ALA 3 3.336 1.147 8.122
23 1HB ALA 3 1HB ALA 3 1.856 1.618 6.089
24 2HB ALA 3 2HB ALA 3 2.632 0.210 5.365
25 3HB ALA 3 3HB ALA 3 3.603 1.601 5.848
26 H PHE 4 H PHE 4 1.011 1.811 8.365
27 HA PHE 4 HA PHE 4 -0.627 -0.503 9.097
28 1HB PHE 4 2HB PHE 4 0.239 1.584 10.705
29 2HB PHE 4 1HB PHE 4 -1.430 1.996 10.324
30 HD1 PHE 4 1HD PHE 4 -0.007 1.090 12.992
31 HD2 PHE 4 2HD PHE 4 -2.488 -0.841 10.123
32 HE1 PHE 4 1HE PHE 4 -0.786 -0.475 14.724
33 HE2 PHE 4 2HE PHE 4 -3.271 -2.408 11.850
34 HZ PHE 4 HZ PHE 4 -2.421 -2.226 14.154
35 H VAL 5 H VAL 5 -2.288 -0.833 7.773
36 HA VAL 5 HA VAL 5 -3.289 1.332 6.115
37 HB VAL 5 HB VAL 5 -4.281 -1.514 6.179
38 1HG1 VAL 5 1HG1 VAL 5 -4.321 -0.312 3.602
39 2HG1 VAL 5 2HG1 VAL 5 -5.071 0.800 4.744
40 3HG1 VAL 5 3HG1 VAL 5 -5.680 -0.846 4.590
41 1HG2 VAL 5 1HG2 VAL 5 -2.523 -0.976 3.976
42 2HG2 VAL 5 2HG2 VAL 5 -2.419 -2.237 5.203
43 3HG2 VAL 5 3HG2 VAL 5 -1.691 -0.658 5.498
44 H LYS 6 H LYS 6 -5.395 2.121 6.126
45 HA LYS 6 HA LYS 6 -6.877 1.598 8.601
46 1HB LYS 6 2HB LYS 6 -7.090 3.983 6.767
47 2HB LYS 6 1HB LYS 6 -7.880 3.792 8.326
48 1HG LYS 6 2HG LYS 6 -5.945 4.153 9.503
49 2HG LYS 6 1HG LYS 6 -4.910 3.617 8.178
50 1HD LYS 6 2HD LYS 6 -5.827 5.707 6.949
51 2HD LYS 6 1HD LYS 6 -6.278 6.252 8.564
52 1HE LYS 6 2HE LYS 6 -4.094 6.453 9.253
53 2HE LYS 6 1HE LYS 6 -3.508 5.258 8.097
54 1HZ LYS 6 1HZ LYS 6 -4.166 6.997 6.355
55 2HZ LYS 6 2HZ LYS 6 -2.754 7.258 7.247
56 3HZ LYS 6 3HZ LYS 6 -4.169 8.096 7.641
57 H PHE 7 H PHE 7 -8.065 2.982 5.584
58 HA PHE 7 HA PHE 7 -10.359 1.216 5.706
59 1HB PHE 7 2HB PHE 7 -9.875 3.877 4.779
60 2HB PHE 7 1HB PHE 7 -10.513 2.921 3.444
61 HD1 PHE 7 1HD PHE 7 -11.386 4.959 6.113
62 HD2 PHE 7 2HD PHE 7 -12.572 1.370 4.158
63 HE1 PHE 7 1HE PHE 7 -13.656 5.219 7.024
64 HE2 PHE 7 2HE PHE 7 -14.845 1.624 5.066
65 HZ PHE 7 HZ PHE 7 -15.389 3.549 6.500
66 H ALA 8 H ALA 8 -11.123 0.026 3.874
67 HA ALA 8 HA ALA 8 -8.962 -0.838 2.098
68 1HB ALA 8 1HB ALA 8 -9.404 -2.955 2.598
69 2HB ALA 8 2HB ALA 8 -11.128 -2.731 2.305
70 3HB ALA 8 3HB ALA 8 -10.444 -2.344 3.882
71 H TYR 9 H TYR 9 -9.383 -1.190 -0.077
72 HA TYR 9 HA TYR 9 -12.055 -0.500 -1.072
73 1HB TYR 9 2HB TYR 9 -10.386 1.460 -1.177
74 2HB TYR 9 1HB TYR 9 -9.577 0.531 -2.439
75 HD1 TYR 9 1HD TYR 9 -9.968 1.654 -4.426
76 HD2 TYR 9 2HD TYR 9 -13.214 1.017 -1.751
77 HE1 TYR 9 1HE TYR 9 -11.520 2.566 -6.101
78 HE2 TYR 9 2HE TYR 9 -14.776 1.926 -3.420
79 HH TYR 9 HH TYR 9 -14.310 3.726 -5.587
80 H VAL 10 H VAL 10 -12.710 -1.668 -2.835
81 HA VAL 10 HA VAL 10 -11.053 -3.930 -3.548
82 HB VAL 10 HB VAL 10 -13.097 -4.638 -4.866
83 1HG1 VAL 10 1HG1 VAL 10 -14.282 -5.405 -2.907
84 2HG1 VAL 10 2HG1 VAL 10 -13.509 -4.168 -1.915
85 3HG1 VAL 10 3HG1 VAL 10 -12.545 -5.474 -2.607
86 1HG2 VAL 10 1HG2 VAL 10 -14.945 -3.371 -4.991
87 2HG2 VAL 10 2HG2 VAL 10 -13.875 -2.039 -4.555
88 3HG2 VAL 10 3HG2 VAL 10 -14.821 -2.853 -3.309
89 H ALA 11 H ALA 11 -9.582 -3.600 -5.095
90 HA ALA 11 HA ALA 11 -10.145 -3.254 -7.754
91 1HB ALA 11 1HB ALA 11 -9.139 -0.787 -7.880
92 2HB ALA 11 2HB ALA 11 -9.959 -0.670 -6.323
93 3HB ALA 11 3HB ALA 11 -10.870 -1.104 -7.769
94 H GLU 12 H GLU 12 -8.463 -4.565 -8.222
95 HA GLU 12 HA GLU 12 -5.775 -3.538 -7.616
96 1HB GLU 12 2HB GLU 12 -6.480 -6.471 -7.710
97 2HB GLU 12 1HB GLU 12 -4.958 -5.751 -7.203
98 1HG GLU 12 2HG GLU 12 -5.841 -5.007 -5.183
99 2HG GLU 12 1HG GLU 12 -7.504 -5.162 -5.747
100 H ARG 13 H ARG 13 -4.799 -3.017 -9.417
101 HA ARG 13 HA ARG 13 -4.694 -4.799 -11.657
102 1HB ARG 13 2HB ARG 13 -6.518 -3.865 -12.639
103 2HB ARG 13 1HB ARG 13 -6.420 -2.411 -11.657
104 1HG ARG 13 2HG ARG 13 -4.388 -2.767 -13.792
105 2HG ARG 13 1HG ARG 13 -6.039 -2.378 -14.270
106 1HD ARG 13 2HD ARG 13 -5.433 -0.677 -12.123
107 2HD ARG 13 1HD ARG 13 -4.014 -0.666 -13.167
108 HE ARG 13 HE ARG 13 -6.612 0.427 -13.753
109 1HH1 ARG 13 1HH1 ARG 13 -3.628 -0.770 -15.112
110 2HH1 ARG 13 2HH1 ARG 13 -3.808 0.105 -16.595
111 1HH2 ARG 13 1HH2 ARG 13 -6.850 1.576 -15.705
112 2HH2 ARG 13 2HH2 ARG 13 -5.635 1.436 -16.932
113 H GLU 14 H GLU 14 -3.009 -4.206 -13.167
114 HA GLU 14 HA GLU 14 -0.740 -3.094 -11.976
115 1HB GLU 14 2HB GLU 14 0.086 -2.896 -14.391
116 2HB GLU 14 1HB GLU 14 -0.377 -4.501 -13.838
117 1HG GLU 14 2HG GLU 14 -2.697 -3.336 -14.913
118 2HG GLU 14 1HG GLU 14 -1.386 -2.978 -16.039
119 H ASP 15 H ASP 15 -0.719 -1.088 -11.206
120 HA ASP 15 HA ASP 15 -0.181 1.205 -11.815
121 1HB ASP 15 2HB ASP 15 -1.108 1.016 -14.115
122 2HB ASP 15 1HB ASP 15 -2.735 1.082 -13.436
123 H GLU 16 H GLU 16 -3.119 -0.381 -10.880
124 HA GLU 16 HA GLU 16 -3.780 1.869 -9.110
125 1HB GLU 16 2HB GLU 16 -6.019 1.205 -9.102
126 2HB GLU 16 1HB GLU 16 -5.525 0.883 -10.747
127 1HG GLU 16 2HG GLU 16 -5.316 -1.447 -10.306
128 2HG GLU 16 1HG GLU 16 -5.644 -1.180 -8.598
129 H LEU 17 H LEU 17 -4.222 1.491 -6.907
130 HA LEU 17 HA LEU 17 -3.191 -1.072 -5.895
131 1HB LEU 17 2HB LEU 17 -2.512 0.641 -3.901
132 2HB LEU 17 1HB LEU 17 -1.429 0.107 -5.177
133 HG LEU 17 HG LEU 17 -2.564 2.285 -6.358
134 1HD1 LEU 17 1HD1 LEU 17 -3.142 3.935 -4.929
135 2HD1 LEU 17 2HD1 LEU 17 -2.040 3.382 -3.668
136 3HD1 LEU 17 3HD1 LEU 17 -3.586 2.567 -3.909
137 1HD2 LEU 17 1HD2 LEU 17 -0.357 2.490 -6.562
138 2HD2 LEU 17 2HD2 LEU 17 -0.054 1.630 -5.054
139 3HD2 LEU 17 3HD2 LEU 17 -0.401 3.358 -5.027
140 H SER 18 H SER 18 -4.603 -2.123 -4.692
141 HA SER 18 HA SER 18 -6.999 -0.854 -3.743
142 1HB SER 18 2HB SER 18 -7.818 -3.007 -3.334
143 2HB SER 18 1HB SER 18 -6.723 -3.260 -4.698
144 HG SER 18 HG SER 18 -6.445 -4.003 -2.017
145 H LEU 19 H LEU 19 -7.663 -0.645 -1.583
146 HA LEU 19 HA LEU 19 -5.450 -0.457 0.312
147 1HB LEU 19 2HB LEU 19 -8.050 0.463 1.264
148 2HB LEU 19 1HB LEU 19 -6.497 1.277 1.268
149 HG LEU 19 HG LEU 19 -8.208 1.066 -1.196
150 1HD1 LEU 19 1HD1 LEU 19 -9.524 2.194 0.479
151 2HD1 LEU 19 2HD1 LEU 19 -8.938 3.366 -0.699
152 3HD1 LEU 19 3HD1 LEU 19 -8.166 3.244 0.882
153 1HD2 LEU 19 1HD2 LEU 19 -6.876 3.052 -1.862
154 2HD2 LEU 19 2HD2 LEU 19 -5.915 1.587 -1.663
155 3HD2 LEU 19 3HD2 LEU 19 -5.898 2.829 -0.411
156 H VAL 20 H VAL 20 -5.555 -1.276 2.419
157 HA VAL 20 HA VAL 20 -7.006 -3.800 2.607
158 HB VAL 20 HB VAL 20 -5.136 -2.809 4.723
159 1HG1 VAL 20 1HG1 VAL 20 -6.047 -4.816 5.381
160 2HG1 VAL 20 2HG1 VAL 20 -4.576 -5.354 4.571
161 3HG1 VAL 20 3HG1 VAL 20 -6.127 -5.443 3.735
162 1HG2 VAL 20 1HG2 VAL 20 -3.234 -3.755 3.517
163 2HG2 VAL 20 2HG2 VAL 20 -3.953 -2.417 2.621
164 3HG2 VAL 20 3HG2 VAL 20 -4.269 -4.081 2.127
165 H LYS 21 H LYS 21 -7.944 -4.426 4.740
166 HA LYS 21 HA LYS 21 -9.798 -2.412 5.614
167 1HB LYS 21 2HB LYS 21 -9.358 -5.243 6.571
168 2HB LYS 21 1HB LYS 21 -10.698 -4.212 7.054
169 1HG LYS 21 2HG LYS 21 -11.749 -5.308 5.399
170 2HG LYS 21 1HG LYS 21 -10.981 -4.080 4.398
171 1HD LYS 21 2HD LYS 21 -10.593 -6.208 3.375
172 2HD LYS 21 1HD LYS 21 -9.071 -5.647 4.055
173 1HE LYS 21 2HE LYS 21 -9.617 -8.075 4.448
174 2HE LYS 21 1HE LYS 21 -9.227 -7.133 5.886
175 1HZ LYS 21 1HZ LYS 21 -12.002 -7.660 4.984
176 2HZ LYS 21 2HZ LYS 21 -11.509 -7.006 6.463
177 3HZ LYS 21 3HZ LYS 21 -11.189 -8.628 6.108
178 H GLY 22 H GLY 22 -7.002 -4.066 7.010
179 1HA GLY 22 2HA GLY 22 -6.357 -1.945 8.730
180 2HA GLY 22 1HA GLY 22 -7.296 -3.116 9.636
181 H SER 23 H SER 23 -5.086 -3.940 7.060
182 HA SER 23 HA SER 23 -3.481 -5.417 8.992
183 1HB SER 23 2HB SER 23 -4.502 -6.073 6.426
184 2HB SER 23 1HB SER 23 -2.740 -6.063 6.322
185 HG SER 23 HG SER 23 -2.875 -7.382 8.329
186 H ARG 24 H ARG 24 -1.111 -5.586 8.464
187 HA ARG 24 HA ARG 24 -0.110 -2.912 7.867
188 1HB ARG 24 2HB ARG 24 1.098 -5.250 9.279
189 2HB ARG 24 1HB ARG 24 2.021 -3.815 8.878
190 1HG ARG 24 2HG ARG 24 -0.442 -3.133 10.208
191 2HG ARG 24 1HG ARG 24 0.510 -4.272 11.170
192 1HD ARG 24 2HD ARG 24 2.474 -2.631 10.498
193 2HD ARG 24 1HD ARG 24 1.141 -1.492 10.324
194 HE ARG 24 HE ARG 24 1.107 -1.343 12.591
195 1HH1 ARG 24 1HH1 ARG 24 2.399 -4.473 11.747
196 2HH1 ARG 24 2HH1 ARG 24 2.671 -4.942 13.391
197 1HH2 ARG 24 1HH2 ARG 24 1.464 -1.958 14.752
198 2HH2 ARG 24 2HH2 ARG 24 2.136 -3.516 15.097
199 H VAL 25 H VAL 25 1.591 -2.542 6.420
200 HA VAL 25 HA VAL 25 2.025 -4.716 4.475
201 HB VAL 25 HB VAL 25 2.123 -1.794 3.771
202 1HG1 VAL 25 1HG1 VAL 25 1.398 -2.956 1.528
203 2HG1 VAL 25 2HG1 VAL 25 2.121 -4.373 2.288
204 3HG1 VAL 25 3HG1 VAL 25 3.089 -2.923 2.030
205 1HG2 VAL 25 1HG2 VAL 25 -0.101 -2.311 4.718
206 2HG2 VAL 25 2HG2 VAL 25 -0.284 -3.594 3.520
207 3HG2 VAL 25 3HG2 VAL 25 -0.163 -1.913 3.001
208 H THR 26 H THR 26 3.992 -4.473 3.156
209 HA THR 26 HA THR 26 6.285 -3.982 4.828
210 HB THR 26 HB THR 26 7.548 -5.135 3.238
211 HG1 THR 26 1HG THR 26 5.755 -4.018 1.478
212 1HG2 THR 26 1HG2 THR 26 5.004 -6.246 3.849
213 2HG2 THR 26 2HG2 THR 26 6.533 -7.070 3.537
214 3HG2 THR 26 3HG2 THR 26 5.446 -6.694 2.201
215 H VAL 27 H VAL 27 7.830 -2.370 4.562
216 HA VAL 27 HA VAL 27 6.998 0.099 3.638
217 HB VAL 27 HB VAL 27 8.894 -0.155 5.157
218 1HG1 VAL 27 1HG1 VAL 27 10.896 -1.146 4.638
219 2HG1 VAL 27 2HG1 VAL 27 10.709 -0.873 2.906
220 3HG1 VAL 27 3HG1 VAL 27 9.785 -2.146 3.705
221 1HG2 VAL 27 1HG2 VAL 27 9.887 1.210 2.668
222 2HG2 VAL 27 2HG2 VAL 27 10.216 1.627 4.349
223 3HG2 VAL 27 3HG2 VAL 27 8.606 1.880 3.676
224 H MET 28 H MET 28 6.099 -0.017 1.691
225 HA MET 28 HA MET 28 6.839 -1.165 -0.643
226 1HB MET 28 2HB MET 28 5.685 0.939 -1.682
227 2HB MET 28 1HB MET 28 4.762 -0.208 -0.715
228 1HG MET 28 2HG MET 28 5.992 1.905 0.852
229 2HG MET 28 1HG MET 28 4.853 2.505 -0.350
230 1HE MET 28 1HE MET 28 4.733 3.094 2.380
231 2HE MET 28 2HE MET 28 4.346 1.825 3.542
232 3HE MET 28 3HE MET 28 3.062 2.839 2.885
233 H GLU 29 H GLU 29 7.188 0.378 -2.692
234 HA GLU 29 HA GLU 29 9.929 1.342 -2.425
235 1HB GLU 29 2HB GLU 29 10.199 0.871 -4.681
236 2HB GLU 29 1HB GLU 29 9.042 -0.348 -4.209
237 1HG GLU 29 2HG GLU 29 7.236 0.872 -5.187
238 2HG GLU 29 1HG GLU 29 8.273 2.264 -5.486
239 H LYS 30 H LYS 30 10.567 3.285 -3.624
240 HA LYS 30 HA LYS 30 8.465 5.322 -3.542
241 1HB LYS 30 2HB LYS 30 11.435 5.481 -3.072
242 2HB LYS 30 1HB LYS 30 10.485 6.915 -3.436
243 1HG LYS 30 2HG LYS 30 9.162 6.618 -1.460
244 2HG LYS 30 1HG LYS 30 9.929 5.058 -1.132
245 1HD LYS 30 2HD LYS 30 11.674 6.028 -0.127
246 2HD LYS 30 1HD LYS 30 11.872 7.196 -1.435
247 1HE LYS 30 2HE LYS 30 11.404 8.332 0.661
248 2HE LYS 30 1HE LYS 30 10.078 8.562 -0.478
249 1HZ LYS 30 1HZ LYS 30 10.150 6.977 1.992
250 2HZ LYS 30 2HZ LYS 30 9.119 6.490 0.743
251 3HZ LYS 30 3HZ LYS 30 8.954 8.029 1.424
252 H CYS 31 H CYS 31 7.686 5.200 -5.603
253 HA CYS 31 HA CYS 31 9.582 5.294 -7.816
254 1HB CYS 31 2HB CYS 31 7.825 4.587 -9.231
255 2HB CYS 31 1HB CYS 31 7.634 3.658 -7.749
256 HG CYS 31 HG CYS 31 5.292 4.453 -8.257
257 H SER 32 H SER 32 9.223 6.804 -9.597
258 HA SER 32 HA SER 32 8.498 9.436 -8.589
259 1HB SER 32 2HB SER 32 10.589 9.414 -9.712
260 2HB SER 32 1HB SER 32 9.935 8.502 -11.071
261 HG SER 32 HG SER 32 9.004 11.085 -10.388
262 H ASP 33 H ASP 33 6.928 6.973 -10.186
263 HA ASP 33 HA ASP 33 5.212 8.818 -11.691
264 1HB ASP 33 2HB ASP 33 5.914 5.940 -11.980
265 2HB ASP 33 1HB ASP 33 4.290 6.433 -12.465
266 H GLY 34 H GLY 34 2.846 7.933 -11.785
267 1HA GLY 34 2HA GLY 34 1.779 8.218 -9.172
268 2HA GLY 34 1HA GLY 34 0.861 7.852 -10.628
269 H TRP 35 H TRP 35 2.562 5.438 -11.116
270 HA TRP 35 HA TRP 35 0.970 3.612 -9.555
271 1HB TRP 35 2HB TRP 35 2.284 1.871 -10.877
272 2HB TRP 35 1HB TRP 35 1.267 2.960 -11.806
273 HD1 TRP 35 HD TRP 35 2.503 4.782 -13.347
274 HE1 TRP 35 1HE TRP 35 4.885 4.861 -14.319
275 HE3 TRP 35 3HE TRP 35 4.714 1.242 -10.388
276 HZ2 TRP 35 2HZ TRP 35 7.367 3.590 -13.895
277 HZ3 TRP 35 3HZ TRP 35 7.094 0.732 -10.740
278 HH2 TRP 35 HH TRP 35 8.391 1.882 -12.458
279 H TRP 36 H TRP 36 1.585 3.568 -7.454
280 HA TRP 36 HA TRP 36 4.386 3.404 -6.744
281 1HB TRP 36 2HB TRP 36 1.948 4.271 -5.489
282 2HB TRP 36 1HB TRP 36 2.789 3.131 -4.447
283 HD1 TRP 36 HD TRP 36 5.752 4.156 -5.497
284 HE1 TRP 36 1HE TRP 36 6.647 6.357 -4.486
285 HE3 TRP 36 3HE TRP 36 1.344 6.153 -3.851
286 HZ2 TRP 36 2HZ TRP 36 5.616 8.632 -3.171
287 HZ3 TRP 36 3HZ TRP 36 1.382 8.342 -2.729
288 HH2 TRP 36 HH TRP 36 3.475 9.555 -2.397
289 H ARG 37 H ARG 37 5.450 1.596 -6.341
290 HA ARG 37 HA ARG 37 3.969 -0.912 -6.131
291 1HB ARG 37 2HB ARG 37 6.176 -0.267 -7.601
292 2HB ARG 37 1HB ARG 37 6.900 -1.055 -6.204
293 1HG ARG 37 2HG ARG 37 6.483 -2.997 -7.188
294 2HG ARG 37 1HG ARG 37 4.771 -2.695 -6.902
295 1HD ARG 37 2HD ARG 37 4.364 -2.341 -9.065
296 2HD ARG 37 1HD ARG 37 5.764 -1.283 -9.237
297 HE ARG 37 HE ARG 37 6.968 -3.056 -10.051
298 1HH1 ARG 37 1HH1 ARG 37 4.041 -4.250 -8.570
299 2HH1 ARG 37 2HH1 ARG 37 4.257 -5.867 -9.150
300 1HH2 ARG 37 1HH2 ARG 37 7.254 -5.185 -10.816
301 2HH2 ARG 37 2HH2 ARG 37 6.080 -6.398 -10.425
302 H GLY 38 H GLY 38 4.387 -2.454 -4.559
303 1HA GLY 38 2HA GLY 38 6.109 -1.962 -2.323
304 2HA GLY 38 1HA GLY 38 4.415 -1.673 -1.937
305 H SER 39 H SER 39 5.237 -3.522 -0.402
306 HA SER 39 HA SER 39 4.335 -6.036 -1.625
307 1HB SER 39 2HB SER 39 6.334 -6.487 0.447
308 2HB SER 39 1HB SER 39 6.244 -7.147 -1.184
309 HG SER 39 HG SER 39 7.732 -5.790 -1.733
310 H TYR 40 H TYR 40 3.088 -7.363 -0.324
311 HA TYR 40 HA TYR 40 2.695 -6.516 2.453
312 1HB TYR 40 2HB TYR 40 0.140 -7.289 1.569
313 2HB TYR 40 1HB TYR 40 0.671 -5.686 2.049
314 HD1 TYR 40 1HD TYR 40 2.017 -4.417 0.058
315 HD2 TYR 40 2HD TYR 40 -0.920 -7.448 -0.453
316 HE1 TYR 40 1HE TYR 40 1.579 -3.598 -2.216
317 HE2 TYR 40 2HE TYR 40 -1.367 -6.639 -2.732
318 HH TYR 40 HH TYR 40 -0.326 -5.361 -4.469
319 H ASN 41 H ASN 41 2.121 -8.124 3.885
320 HA ASN 41 HA ASN 41 2.961 -10.730 3.290
321 1HB ASN 41 2HB ASN 41 1.111 -10.087 5.547
322 2HB ASN 41 1HB ASN 41 2.372 -11.310 5.487
323 1HD2 ASN 41 1HD2 ASN 41 1.570 -8.167 6.401
324 2HD2 ASN 41 2HD2 ASN 41 3.152 -7.619 6.824
325 H GLY 42 H GLY 42 1.865 -11.512 1.498
326 1HA GLY 42 2HA GLY 42 -0.009 -13.286 1.505
327 2HA GLY 42 1HA GLY 42 -1.025 -11.873 1.753
328 H GLN 43 H GLN 43 0.754 -10.233 0.053
329 HA GLN 43 HA GLN 43 0.841 -11.330 -2.547
330 1HB GLN 43 2HB GLN 43 -0.943 -9.751 -3.495
331 2HB GLN 43 1HB GLN 43 -1.498 -11.210 -2.679
332 1HG GLN 43 2HG GLN 43 -1.392 -9.361 -0.645
333 2HG GLN 43 1HG GLN 43 -1.950 -8.414 -2.027
334 1HE2 GLN 43 1HE2 GLN 43 -2.907 -10.276 0.502
335 2HE2 GLN 43 2HE2 GLN 43 -4.478 -10.741 -0.059
336 H ILE 44 H ILE 44 1.634 -9.845 -4.126
337 HA ILE 44 HA ILE 44 2.732 -7.385 -2.956
338 HB ILE 44 HB ILE 44 4.021 -9.506 -4.612
339 1HG1 ILE 44 2HG1 ILE 44 5.853 -9.106 -3.043
340 2HG1 ILE 44 1HG1 ILE 44 4.978 -7.726 -2.380
341 1HG2 ILE 44 1HG2 ILE 44 4.885 -6.614 -4.639
342 2HG2 ILE 44 2HG2 ILE 44 4.315 -7.548 -6.021
343 3HG2 ILE 44 3HG2 ILE 44 5.840 -7.966 -5.242
344 1HD1 ILE 44 1HD1 ILE 44 3.614 -9.007 -1.134
345 2HD1 ILE 44 2HD1 ILE 44 4.951 -10.152 -1.269
346 3HD1 ILE 44 3HD1 ILE 44 3.553 -10.300 -2.334
347 H GLY 45 H GLY 45 3.196 -5.658 -4.462
348 1HA GLY 45 2HA GLY 45 2.670 -5.334 -7.071
349 2HA GLY 45 1HA GLY 45 1.043 -5.367 -6.392
350 H TRP 46 H TRP 46 0.295 -3.348 -6.315
351 HA TRP 46 HA TRP 46 2.125 -1.174 -5.650
352 1HB TRP 46 2HB TRP 46 -0.627 -1.228 -6.896
353 2HB TRP 46 1HB TRP 46 0.201 0.268 -6.453
354 HD1 TRP 46 HD TRP 46 2.033 1.140 -8.060
355 HE1 TRP 46 1HE TRP 46 2.999 0.361 -10.303
356 HE3 TRP 46 3HE TRP 46 -0.133 -3.470 -8.286
357 HZ2 TRP 46 2HZ TRP 46 2.840 -1.917 -11.974
358 HZ3 TRP 46 3HZ TRP 46 0.318 -4.891 -10.242
359 HH2 TRP 46 HH TRP 46 1.774 -4.130 -12.049
360 H PHE 47 H PHE 47 1.850 0.146 -3.876
361 HA PHE 47 HA PHE 47 0.125 -0.972 -1.816
362 1HB PHE 47 2HB PHE 47 1.378 0.332 -0.222
363 2HB PHE 47 1HB PHE 47 2.485 -0.525 -1.288
364 HD1 PHE 47 1HD PHE 47 1.295 2.715 -0.164
365 HD2 PHE 47 2HD PHE 47 3.776 0.697 -2.966
366 HE1 PHE 47 1HE PHE 47 2.488 4.819 -0.622
367 HE2 PHE 47 2HE PHE 47 4.970 2.797 -3.431
368 HZ PHE 47 HZ PHE 47 4.327 4.860 -2.252
369 HA PRO 48 HA PRO 48 -2.817 2.326 -2.071
370 1HB PRO 48 2HB PRO 48 -4.451 1.517 -0.164
371 2HB PRO 48 1HB PRO 48 -4.167 0.489 -1.574
372 1HG PRO 48 2HG PRO 48 -3.025 0.288 1.184
373 2HG PRO 48 1HG PRO 48 -3.603 -1.006 0.121
374 1HD PRO 48 2HD PRO 48 -0.943 -0.232 0.438
375 2HD PRO 48 1HD PRO 48 -1.587 -1.192 -0.907
376 H SER 49 H SER 49 -0.659 3.522 -0.983
377 HA SER 49 HA SER 49 -0.603 4.228 1.670
378 1HB SER 49 2HB SER 49 0.574 5.171 -0.724
379 2HB SER 49 1HB SER 49 -0.040 6.576 0.151
380 HG SER 49 HG SER 49 1.615 4.555 1.264
381 H ASN 50 H ASN 50 -3.019 5.065 -0.632
382 HA ASN 50 HA ASN 50 -4.007 7.470 0.052
383 1HB ASN 50 2HB ASN 50 -5.181 4.946 -0.868
384 2HB ASN 50 1HB ASN 50 -6.320 6.083 -0.158
385 1HD2 ASN 50 1HD2 ASN 50 -6.626 8.084 -1.121
386 2HD2 ASN 50 2HD2 ASN 50 -6.167 8.380 -2.755
387 H TYR 51 H TYR 51 -4.038 4.621 2.050
388 HA TYR 51 HA TYR 51 -4.839 6.226 4.302
389 1HB TYR 51 2HB TYR 51 -6.598 4.085 3.159
390 2HB TYR 51 1HB TYR 51 -6.559 4.331 4.904
391 HD1 TYR 51 1HD TYR 51 -7.197 6.586 5.826
392 HD2 TYR 51 2HD TYR 51 -7.823 5.533 1.751
393 HE1 TYR 51 1HE TYR 51 -8.818 8.422 5.607
394 HE2 TYR 51 2HE TYR 51 -9.444 7.367 1.520
395 HH TYR 51 HH TYR 51 -11.007 8.726 3.691
396 H VAL 52 H VAL 52 -2.471 5.476 4.285
397 HA VAL 52 HA VAL 52 -2.335 3.115 5.993
398 HB VAL 52 HB VAL 52 -0.653 2.046 4.848
399 1HG1 VAL 52 1HG1 VAL 52 -2.221 3.500 2.732
400 2HG1 VAL 52 2HG1 VAL 52 -2.613 1.947 3.472
401 3HG1 VAL 52 3HG1 VAL 52 -1.201 2.095 2.425
402 1HG2 VAL 52 1HG2 VAL 52 1.019 3.707 4.715
403 2HG2 VAL 52 2HG2 VAL 52 0.037 4.725 3.663
404 3HG2 VAL 52 3HG2 VAL 52 0.715 3.218 3.047
405 H LEU 53 H LEU 53 -0.269 2.990 7.238
406 HA LEU 53 HA LEU 53 0.708 5.690 7.871
407 1HB LEU 53 2HB LEU 53 -0.310 3.545 9.494
408 2HB LEU 53 1HB LEU 53 1.336 3.917 9.964
409 HG LEU 53 HG LEU 53 0.119 5.272 11.375
410 1HD1 LEU 53 1HD1 LEU 53 0.918 7.303 10.890
411 2HD1 LEU 53 2HD1 LEU 53 0.041 7.390 9.362
412 3HD1 LEU 53 3HD1 LEU 53 1.581 6.534 9.447
413 1HD2 LEU 53 1HD2 LEU 53 -1.750 6.337 9.336
414 2HD2 LEU 53 2HD2 LEU 53 -2.005 6.012 11.050
415 3HD2 LEU 53 3HD2 LEU 53 -1.993 4.679 9.891
416 H GLU 54 H GLU 54 2.740 6.006 7.173
417 HA GLU 54 HA GLU 54 4.490 3.667 6.912
418 1HB GLU 54 2HB GLU 54 4.031 4.968 4.867
419 2HB GLU 54 1HB GLU 54 4.773 6.376 5.617
420 1HG GLU 54 2HG GLU 54 6.575 4.186 5.806
421 2HG GLU 54 1HG GLU 54 5.997 4.306 4.143
422 H GLU 55 H GLU 55 6.388 3.516 7.948
423 HA GLU 55 HA GLU 55 7.187 5.759 9.654
424 1HB GLU 55 2HB GLU 55 7.933 2.944 10.306
425 2HB GLU 55 1HB GLU 55 7.723 4.312 11.388
426 1HG GLU 55 2HG GLU 55 5.222 3.971 10.358
427 2HG GLU 55 1HG GLU 55 5.824 2.321 10.478
428 H VAL 56 H VAL 56 9.015 6.666 8.952
429 HA VAL 56 HA VAL 56 10.866 5.077 7.363
430 HB VAL 56 HB VAL 56 11.082 8.041 7.813
431 1HG1 VAL 56 1HG1 VAL 56 12.644 8.020 6.194
432 2HG1 VAL 56 2HG1 VAL 56 11.784 6.815 5.235
433 3HG1 VAL 56 3HG1 VAL 56 12.776 6.310 6.603
434 1HG2 VAL 56 1HG2 VAL 56 9.026 8.181 6.886
435 2HG2 VAL 56 2HG2 VAL 56 9.106 6.557 6.202
436 3HG2 VAL 56 3HG2 VAL 56 9.913 7.898 5.388
437 H ASP 57 H ASP 57 11.551 3.945 9.354
438 HA ASP 57 HA ASP 57 12.910 5.292 11.431
439 1HB ASP 57 2HB ASP 57 11.965 2.858 11.322
440 2HB ASP 57 1HB ASP 57 13.552 2.463 10.668