Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | in_recoord | stage | position | program | type |
|
|
4698 | 1fjp RC | 4907 | cing | recoord | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 1H MET 1 1HT MET 1 25.114 2.095 2.323
2 2H MET 1 2HT MET 1 25.417 2.659 0.750
3 H MET 1 H MET 1 25.577 2.395 1.878
4 3H MET 1 3HT MET 1 24.155 1.557 1.030
5 HA MET 1 HA MET 1 23.511 3.979 0.702
6 1HB MET 1 2HB MET 1 21.783 3.666 2.484
7 2HB MET 1 1HB MET 1 22.038 2.228 1.515
8 1HG MET 1 2HG MET 1 23.540 1.314 3.239
9 2HG MET 1 1HG MET 1 23.263 2.755 4.205
10 1HE MET 1 1HE MET 1 21.356 0.317 6.332
11 2HE MET 1 2HE MET 1 22.871 1.151 5.993
12 3HE MET 1 3HE MET 1 22.548 -0.412 5.247
13 H ASP 2 H ASP 2 23.692 5.990 1.498
14 HA ASP 2 HA ASP 2 24.564 6.586 4.228
15 1HB ASP 2 2HB ASP 2 26.701 7.621 3.501
16 2HB ASP 2 1HB ASP 2 26.664 5.896 3.131
17 H LYS 3 H LYS 3 24.151 7.777 0.899
18 HA LYS 3 HA LYS 3 23.210 10.392 2.008
19 1HB LYS 3 2HB LYS 3 23.809 11.263 -0.217
20 2HB LYS 3 1HB LYS 3 25.176 10.389 0.476
21 1HG LYS 3 2HG LYS 3 24.569 8.388 -0.833
22 2HG LYS 3 1HG LYS 3 23.198 9.255 -1.524
23 1HD LYS 3 2HD LYS 3 24.727 10.899 -2.526
24 2HD LYS 3 1HD LYS 3 26.107 10.068 -1.804
25 1HE LYS 3 2HE LYS 3 25.556 8.026 -3.095
26 2HE LYS 3 1HE LYS 3 24.188 8.875 -3.840
27 1HZ LYS 3 1HZ LYS 3 25.594 10.407 -4.864
28 2HZ LYS 3 2HZ LYS 3 26.414 8.933 -5.069
29 3HZ LYS 3 3HZ LYS 3 26.911 10.025 -3.866
30 H VAL 4 H VAL 4 22.407 7.741 -0.205
31 HA VAL 4 HA VAL 4 19.973 8.868 -1.230
32 HB VAL 4 HB VAL 4 21.185 6.950 -2.200
33 1HG1 VAL 4 1HG1 VAL 4 21.290 6.088 0.460
34 2HG1 VAL 4 2HG1 VAL 4 21.839 5.186 -0.952
35 3HG1 VAL 4 3HG1 VAL 4 20.206 4.942 -0.330
36 1HG2 VAL 4 1HG2 VAL 4 18.532 5.885 -1.239
37 2HG2 VAL 4 2HG2 VAL 4 19.285 5.700 -2.822
38 3HG2 VAL 4 3HG2 VAL 4 18.607 7.256 -2.345
39 H GLN 5 H GLN 5 20.789 7.731 1.920
40 HA GLN 5 HA GLN 5 18.179 6.754 2.669
41 1HB GLN 5 2HB GLN 5 19.168 6.726 4.920
42 2HB GLN 5 1HB GLN 5 20.306 6.074 3.745
43 1HG GLN 5 2HG GLN 5 21.415 8.307 3.630
44 2HG GLN 5 1HG GLN 5 20.314 8.889 4.872
45 1HE2 GLN 5 1HE2 GLN 5 20.886 5.684 5.711
46 2HE2 GLN 5 2HE2 GLN 5 22.204 5.925 6.747
47 H TYR 6 H TYR 6 19.873 9.883 3.261
48 HA TYR 6 HA TYR 6 17.420 10.913 4.489
49 1HB TYR 6 2HB TYR 6 18.731 12.770 5.154
50 2HB TYR 6 1HB TYR 6 19.831 11.405 5.247
51 HD1 TYR 6 1HD TYR 6 21.373 10.987 3.136
52 HD2 TYR 6 2HD TYR 6 19.267 14.650 3.922
53 HE1 TYR 6 1HE TYR 6 22.904 12.208 1.611
54 HE2 TYR 6 2HE TYR 6 20.802 15.860 2.401
55 HH TYR 6 HH TYR 6 23.371 15.349 1.599
56 H LEU 7 H LEU 7 19.217 11.218 1.457
57 HA LEU 7 HA LEU 7 17.817 13.418 0.322
58 1HB LEU 7 2HB LEU 7 18.970 10.885 -0.885
59 2HB LEU 7 1HB LEU 7 18.465 12.281 -1.837
60 HG LEU 7 HG LEU 7 20.564 12.312 0.342
61 1HD1 LEU 7 1HD1 LEU 7 21.986 11.648 -1.273
62 2HD1 LEU 7 2HD1 LEU 7 21.587 13.110 -2.174
63 3HD1 LEU 7 3HD1 LEU 7 20.677 11.625 -2.453
64 1HD2 LEU 7 1HD2 LEU 7 20.961 14.617 -0.846
65 2HD2 LEU 7 2HD2 LEU 7 19.669 14.472 0.346
66 3HD2 LEU 7 3HD2 LEU 7 19.290 14.420 -1.376
67 H THR 8 H THR 8 17.003 9.942 0.424
68 HA THR 8 HA THR 8 14.627 10.158 -1.195
69 HB THR 8 HB THR 8 15.478 8.144 0.903
70 HG1 THR 8 1HG THR 8 16.299 7.052 -0.936
71 1HG2 THR 8 1HG2 THR 8 13.024 8.299 -0.196
72 2HG2 THR 8 2HG2 THR 8 13.801 6.761 0.176
73 3HG2 THR 8 3HG2 THR 8 13.849 7.396 -1.467
74 H ARG 9 H ARG 9 15.210 10.157 2.320
75 HA ARG 9 HA ARG 9 12.579 10.122 3.289
76 1HB ARG 9 2HB ARG 9 14.606 10.013 4.648
77 2HB ARG 9 1HB ARG 9 14.991 11.669 4.206
78 1HG ARG 9 2HG ARG 9 12.938 12.465 5.302
79 2HG ARG 9 1HG ARG 9 12.527 10.805 5.735
80 1HD ARG 9 2HD ARG 9 14.588 10.631 7.088
81 2HD ARG 9 1HD ARG 9 15.018 12.295 6.646
82 HE ARG 9 HE ARG 9 13.113 11.589 8.668
83 1HH1 ARG 9 1HH2 ARG 9 14.308 14.286 8.537
84 2HH1 ARG 9 2HH2 ARG 9 12.977 15.276 8.039
85 1HH2 ARG 9 1HH1 ARG 9 11.066 12.606 6.923
86 2HH2 ARG 9 2HH1 ARG 9 11.142 14.325 7.126
87 H SER 10 H SER 10 14.482 12.893 2.138
88 HA SER 10 HA SER 10 12.260 14.752 2.557
89 1HB SER 10 2HB SER 10 13.924 16.361 1.657
90 2HB SER 10 1HB SER 10 14.607 15.373 2.945
91 HG SER 10 HG SER 10 16.056 15.302 1.293
92 H ALA 11 H ALA 11 13.153 12.557 0.107
93 HA ALA 11 HA ALA 11 12.340 14.136 -2.189
94 1HB ALA 11 1HB ALA 11 12.489 11.831 -3.260
95 2HB ALA 11 2HB ALA 11 12.881 11.208 -1.658
96 3HB ALA 11 3HB ALA 11 13.951 12.373 -2.437
97 H ILE 12 H ILE 12 10.737 11.867 0.005
98 HA ILE 12 HA ILE 12 8.255 12.147 -1.594
99 HB ILE 12 HB ILE 12 9.202 10.040 0.327
100 1HG1 ILE 12 2HG1 ILE 12 8.959 8.576 -1.723
101 2HG1 ILE 12 1HG1 ILE 12 8.699 10.046 -2.659
102 1HG2 ILE 12 1HG2 ILE 12 6.533 10.468 -0.997
103 2HG2 ILE 12 2HG2 ILE 12 6.873 10.108 0.696
104 3HG2 ILE 12 3HG2 ILE 12 7.067 8.853 -0.528
105 1HD1 ILE 12 1HD1 ILE 12 11.145 8.932 -2.274
106 2HD1 ILE 12 2HD1 ILE 12 11.093 10.051 -0.911
107 3HD1 ILE 12 3HD1 ILE 12 10.898 10.656 -2.557
108 H ARG 13 H ARG 13 9.531 12.233 1.728
109 HA ARG 13 HA ARG 13 7.038 12.803 3.014
110 1HB ARG 13 2HB ARG 13 9.886 13.544 3.761
111 2HB ARG 13 1HB ARG 13 8.518 13.492 4.872
112 1HG ARG 13 2HG ARG 13 9.600 11.129 3.307
113 2HG ARG 13 1HG ARG 13 9.836 11.420 5.021
114 1HD ARG 13 2HD ARG 13 7.390 11.320 5.386
115 2HD ARG 13 1HD ARG 13 7.183 10.974 3.665
116 HE ARG 13 HE ARG 13 7.795 8.758 4.159
117 1HH1 ARG 13 1HH1 ARG 13 7.712 9.718 7.156
118 2HH1 ARG 13 2HH1 ARG 13 9.215 9.056 7.707
119 1HH2 ARG 13 1HH2 ARG 13 10.418 8.435 4.515
120 2HH2 ARG 13 2HH2 ARG 13 10.743 8.324 6.213
121 H ARG 14 H ARG 14 9.617 14.988 1.833
122 HA ARG 14 HA ARG 14 7.932 17.317 2.458
123 1HB ARG 14 2HB ARG 14 10.694 17.035 1.230
124 2HB ARG 14 1HB ARG 14 9.962 18.540 1.780
125 1HG ARG 14 2HG ARG 14 9.862 17.714 4.071
126 2HG ARG 14 1HG ARG 14 10.431 16.129 3.557
127 1HD ARG 14 2HD ARG 14 12.365 17.192 4.454
128 2HD ARG 14 1HD ARG 14 12.543 17.390 2.704
129 HE ARG 14 HE ARG 14 12.149 19.539 4.590
130 1HH1 ARG 14 1HH1 ARG 14 13.173 19.441 1.622
131 2HH1 ARG 14 2HH1 ARG 14 12.066 20.568 0.909
132 1HH2 ARG 14 1HH2 ARG 14 9.892 20.546 3.611
133 2HH2 ARG 14 2HH2 ARG 14 10.211 21.198 2.038
134 H ALA 15 H ALA 15 7.229 15.341 0.280
135 HA ALA 15 HA ALA 15 6.819 17.326 -1.864
136 1HB ALA 15 1HB ALA 15 8.778 15.291 -1.894
137 2HB ALA 15 2HB ALA 15 8.275 16.295 -3.255
138 3HB ALA 15 3HB ALA 15 7.493 14.740 -2.969
139 H SER 16 H SER 16 6.129 14.072 -0.606
140 HA SER 16 HA SER 16 3.584 13.994 -2.077
141 1HB SER 16 2HB SER 16 5.131 12.036 -0.425
142 2HB SER 16 1HB SER 16 3.594 11.662 -1.173
143 HG SER 16 HG SER 16 5.387 11.062 -2.484
144 H THR 17 H THR 17 4.552 15.211 0.830
145 HA THR 17 HA THR 17 1.938 14.575 2.107
146 HB THR 17 HB THR 17 4.653 15.080 3.360
147 HG1 THR 17 1HG THR 17 4.493 13.057 2.361
148 1HG2 THR 17 1HG2 THR 17 3.141 13.951 5.301
149 2HG2 THR 17 2HG2 THR 17 1.897 14.852 4.435
150 3HG2 THR 17 3HG2 THR 17 3.299 15.696 5.094
151 H ILE 18 H ILE 18 4.006 17.044 0.937
152 HA ILE 18 HA ILE 18 2.574 19.101 2.524
153 HB ILE 18 HB ILE 18 5.041 19.019 2.694
154 1HG1 ILE 18 2HG1 ILE 18 5.474 21.377 2.090
155 2HG1 ILE 18 1HG1 ILE 18 4.017 21.389 1.095
156 1HG2 ILE 18 1HG2 ILE 18 5.659 20.025 0.061
157 2HG2 ILE 18 2HG2 ILE 18 4.838 18.470 -0.074
158 3HG2 ILE 18 3HG2 ILE 18 6.311 18.609 0.883
159 1HD1 ILE 18 1HD1 ILE 18 2.592 21.234 2.955
160 2HD1 ILE 18 2HD1 ILE 18 3.865 22.311 3.529
161 3HD1 ILE 18 3HD1 ILE 18 3.870 20.611 4.000
162 H GLU 19 H GLU 19 3.028 17.784 -0.661
163 HA GLU 19 HA GLU 19 1.787 20.159 -1.918
164 1HB GLU 19 2HB GLU 19 3.137 17.712 -3.017
165 2HB GLU 19 1HB GLU 19 2.539 19.039 -4.004
166 1HG GLU 19 2HG GLU 19 4.655 19.251 -1.840
167 2HG GLU 19 1HG GLU 19 4.952 19.298 -3.578
168 H MET 20 H MET 20 1.113 16.901 -0.958
169 HA MET 20 HA MET 20 -1.625 17.157 -2.107
170 1HB MET 20 2HB MET 20 -1.396 14.836 -2.996
171 2HB MET 20 1HB MET 20 -0.252 15.952 -3.742
172 1HG MET 20 2HG MET 20 1.508 15.199 -2.190
173 2HG MET 20 1HG MET 20 0.369 14.085 -1.432
174 1HE MET 20 1HE MET 20 -1.202 12.913 -2.803
175 2HE MET 20 2HE MET 20 -0.461 11.454 -3.456
176 3HE MET 20 3HE MET 20 -1.095 12.680 -4.553
177 HA PRO 21 HA PRO 21 -1.198 15.238 2.191
178 1HB PRO 21 2HB PRO 21 -2.355 17.267 3.624
179 2HB PRO 21 1HB PRO 21 -0.615 17.175 3.319
180 1HG PRO 21 2HG PRO 21 -2.672 18.811 1.969
181 2HG PRO 21 1HG PRO 21 -1.016 19.234 2.411
182 1HD PRO 21 2HD PRO 21 -1.763 18.568 -0.124
183 2HD PRO 21 1HD PRO 21 -0.130 18.285 0.522
184 H GLN 22 H GLN 22 -3.700 17.058 0.503
185 HA GLN 22 HA GLN 22 -5.898 15.725 1.929
186 1HB GLN 22 2HB GLN 22 -5.778 17.546 -0.464
187 2HB GLN 22 1HB GLN 22 -7.253 17.100 0.382
188 1HG GLN 22 2HG GLN 22 -6.366 18.107 2.454
189 2HG GLN 22 1HG GLN 22 -4.891 18.558 1.603
190 1HE2 GLN 22 1HE2 GLN 22 -7.346 18.954 -0.672
191 2HE2 GLN 22 2HE2 GLN 22 -7.692 20.587 -0.391
192 H GLN 23 H GLN 23 -4.214 15.477 -1.162
193 HA GLN 23 HA GLN 23 -6.089 13.542 -2.266
194 1HB GLN 23 2HB GLN 23 -4.881 15.164 -3.645
195 2HB GLN 23 1HB GLN 23 -3.357 14.491 -3.088
196 1HG GLN 23 2HG GLN 23 -3.875 13.588 -5.296
197 2HG GLN 23 1HG GLN 23 -3.977 12.301 -4.095
198 1HE2 GLN 23 1HE2 GLN 23 -5.621 13.596 -6.707
199 2HE2 GLN 23 2HE2 GLN 23 -7.187 13.060 -6.335
200 H ALA 24 H ALA 24 -2.725 13.462 -1.083
201 HA ALA 24 HA ALA 24 -2.169 10.724 -1.415
202 1HB ALA 24 1HB ALA 24 -0.646 11.152 0.585
203 2HB ALA 24 2HB ALA 24 -1.404 12.739 0.719
204 3HB ALA 24 3HB ALA 24 -0.491 12.317 -0.732
205 H ARG 25 H ARG 25 -3.788 12.356 1.328
206 HA ARG 25 HA ARG 25 -4.134 10.100 3.004
207 1HB ARG 25 2HB ARG 25 -4.518 12.435 3.643
208 2HB ARG 25 1HB ARG 25 -5.884 12.503 2.540
209 1HG ARG 25 2HG ARG 25 -7.048 10.766 3.816
210 2HG ARG 25 1HG ARG 25 -5.668 10.628 4.905
211 1HD ARG 25 2HD ARG 25 -7.307 13.159 4.506
212 2HD ARG 25 1HD ARG 25 -7.443 12.062 5.894
213 HE ARG 25 HE ARG 25 -4.695 12.729 5.555
214 1HH1 ARG 25 1HH2 ARG 25 -5.651 15.463 5.119
215 2HH1 ARG 25 2HH2 ARG 25 -5.859 16.076 6.723
216 1HH2 ARG 25 1HH1 ARG 25 -5.852 12.941 8.207
217 2HH2 ARG 25 2HH1 ARG 25 -5.972 14.649 8.473
218 H GLN 26 H GLN 26 -6.255 11.391 0.447
219 HA GLN 26 HA GLN 26 -8.296 9.392 0.722
220 1HB GLN 26 2HB GLN 26 -7.476 11.156 -1.573
221 2HB GLN 26 1HB GLN 26 -9.030 10.341 -1.435
222 1HG GLN 26 2HG GLN 26 -7.935 12.372 0.525
223 2HG GLN 26 1HG GLN 26 -9.176 12.697 -0.686
224 1HE2 GLN 26 1HE2 GLN 26 -8.820 11.957 2.549
225 2HE2 GLN 26 2HE2 GLN 26 -10.321 11.213 2.827
226 H ASN 27 H ASN 27 -5.550 9.769 -1.507
227 HA ASN 27 HA ASN 27 -5.978 7.476 -3.108
228 1HB ASN 27 2HB ASN 27 -4.402 9.299 -3.577
229 2HB ASN 27 1HB ASN 27 -3.425 8.785 -2.208
230 1HD2 ASN 27 1HD2 ASN 27 -1.661 7.553 -2.862
231 2HD2 ASN 27 2HD2 ASN 27 -1.653 6.485 -4.181
232 H LEU 28 H LEU 28 -4.180 7.816 -0.046
233 HA LEU 28 HA LEU 28 -3.029 5.273 0.172
234 1HB LEU 28 2HB LEU 28 -2.713 7.153 1.717
235 2HB LEU 28 1HB LEU 28 -4.366 6.954 2.279
236 HG LEU 28 HG LEU 28 -3.840 4.671 3.053
237 1HD1 LEU 28 1HD1 LEU 28 -1.527 5.107 1.402
238 2HD1 LEU 28 2HD1 LEU 28 -2.048 3.619 2.192
239 3HD1 LEU 28 3HD1 LEU 28 -1.000 4.752 3.047
240 1HD2 LEU 28 1HD2 LEU 28 -3.184 7.019 4.279
241 2HD2 LEU 28 2HD2 LEU 28 -1.623 6.197 4.281
242 3HD2 LEU 28 3HD2 LEU 28 -3.020 5.436 5.039
243 H GLN 29 H GLN 29 -6.389 6.177 0.413
244 HA GLN 29 HA GLN 29 -7.493 4.041 1.870
245 1HB GLN 29 2HB GLN 29 -8.490 5.515 -0.554
246 2HB GLN 29 1HB GLN 29 -9.512 4.545 0.496
247 1HG GLN 29 2HG GLN 29 -8.923 5.981 2.406
248 2HG GLN 29 1HG GLN 29 -7.878 6.947 1.370
249 1HE2 GLN 29 1HE2 GLN 29 -10.491 6.131 -0.591
250 2HE2 GLN 29 2HE2 GLN 29 -11.467 7.483 -0.293
251 H ASN 30 H ASN 30 -6.253 4.092 -1.427
252 HA ASN 30 HA ASN 30 -7.441 1.728 -2.439
253 1HB ASN 30 2HB ASN 30 -4.743 2.968 -2.902
254 2HB ASN 30 1HB ASN 30 -5.464 1.759 -3.950
255 1HD2 ASN 30 1HD2 ASN 30 -8.074 3.595 -2.905
256 2HD2 ASN 30 2HD2 ASN 30 -8.105 4.739 -4.152
257 H LEU 31 H LEU 31 -4.699 2.171 -0.267
258 HA LEU 31 HA LEU 31 -3.573 -0.437 -0.460
259 1HB LEU 31 2HB LEU 31 -2.495 1.517 0.558
260 2HB LEU 31 1HB LEU 31 -3.712 1.512 1.826
261 HG LEU 31 HG LEU 31 -2.987 -0.736 2.535
262 1HD1 LEU 31 1HD2 LEU 31 -0.980 -0.369 0.292
263 2HD1 LEU 31 2HD2 LEU 31 -2.205 -1.631 0.429
264 3HD1 LEU 31 3HD2 LEU 31 -0.836 -1.606 1.540
265 1HD2 LEU 31 1HD1 LEU 31 -1.895 1.415 3.389
266 2HD2 LEU 31 2HD1 LEU 31 -0.561 1.057 2.292
267 3HD2 LEU 31 3HD1 LEU 31 -0.954 -0.063 3.597
268 H PHE 32 H PHE 32 -6.343 0.806 1.299
269 HA PHE 32 HA PHE 32 -6.644 -1.427 3.089
270 1HB PHE 32 2HB PHE 32 -7.516 0.827 3.512
271 2HB PHE 32 1HB PHE 32 -8.556 0.702 2.093
272 HD1 PHE 32 1HD PHE 32 -7.736 -1.433 5.080
273 HD2 PHE 32 2HD PHE 32 -10.779 0.237 2.552
274 HE1 PHE 32 1HE PHE 32 -9.482 -2.541 6.451
275 HE2 PHE 32 2HE PHE 32 -12.525 -0.869 3.922
276 HZ PHE 32 HZ PHE 32 -11.876 -2.258 5.871
277 H ILE 33 H ILE 33 -8.467 -0.444 0.159
278 HA ILE 33 HA ILE 33 -10.114 -2.772 0.029
279 HB ILE 33 HB ILE 33 -10.439 -0.557 -1.091
280 1HG1 ILE 33 2HG1 ILE 33 -11.649 -2.611 -1.882
281 2HG1 ILE 33 1HG1 ILE 33 -11.410 -1.409 -3.144
282 1HG2 ILE 33 1HG2 ILE 33 -9.226 -0.126 -3.204
283 2HG2 ILE 33 2HG2 ILE 33 -8.242 -1.561 -2.916
284 3HG2 ILE 33 3HG2 ILE 33 -8.139 -0.185 -1.817
285 1HD1 ILE 33 1HD1 ILE 33 -10.322 -4.142 -2.917
286 2HD1 ILE 33 2HD1 ILE 33 -9.145 -2.931 -3.423
287 3HD1 ILE 33 3HD1 ILE 33 -10.623 -3.165 -4.353
288 H ASN 34 H ASN 34 -6.897 -2.090 -1.358
289 HA ASN 34 HA ASN 34 -6.711 -4.412 -3.012
290 1HB ASN 34 2HB ASN 34 -5.256 -2.394 -3.083
291 2HB ASN 34 1HB ASN 34 -4.571 -2.852 -1.528
292 1HD2 ASN 34 1HD2 ASN 34 -5.173 -5.715 -3.305
293 2HD2 ASN 34 2HD2 ASN 34 -3.620 -5.911 -3.948
294 H PHE 35 H PHE 35 -5.371 -3.846 0.268
295 HA PHE 35 HA PHE 35 -4.431 -6.490 0.705
296 1HB PHE 35 2HB PHE 35 -3.846 -4.507 2.049
297 2HB PHE 35 1HB PHE 35 -5.507 -4.405 2.634
298 HD1 PHE 35 1HD PHE 35 -2.906 -7.091 2.255
299 HD2 PHE 35 2HD PHE 35 -5.832 -5.223 4.784
300 HE1 PHE 35 1HE PHE 35 -2.366 -8.698 4.066
301 HE2 PHE 35 2HE PHE 35 -5.293 -6.828 6.597
302 HZ PHE 35 HZ PHE 35 -3.561 -8.567 6.237
303 H CYS 36 H CYS 36 -7.575 -5.005 1.569
304 HA CYS 36 HA CYS 36 -8.729 -7.266 2.843
305 1HB CYS 36 2HB CYS 36 -9.634 -4.973 2.873
306 2HB CYS 36 1HB CYS 36 -9.968 -5.071 1.146
307 HG CYS 36 HG CYS 36 -11.743 -6.944 1.663
308 H LEU 37 H LEU 37 -8.612 -6.320 -0.582
309 HA LEU 37 HA LEU 37 -10.297 -8.378 -1.621
310 1HB LEU 37 2HB LEU 37 -9.478 -6.248 -2.717
311 2HB LEU 37 1HB LEU 37 -7.896 -7.001 -2.877
312 HG LEU 37 HG LEU 37 -9.251 -7.156 -4.960
313 1HD1 LEU 37 1HD2 LEU 37 -7.624 -9.031 -3.960
314 2HD1 LEU 37 2HD2 LEU 37 -8.481 -9.254 -5.484
315 3HD1 LEU 37 3HD2 LEU 37 -9.114 -9.972 -4.003
316 1HD2 LEU 37 1HD1 LEU 37 -11.409 -7.760 -4.917
317 2HD2 LEU 37 2HD1 LEU 37 -11.312 -7.803 -3.157
318 3HD2 LEU 37 3HD1 LEU 37 -11.014 -9.268 -4.094
319 H ILE 38 H ILE 38 -6.721 -8.172 -1.504
320 HA ILE 38 HA ILE 38 -6.274 -10.892 -2.340
321 HB ILE 38 HB ILE 38 -4.663 -8.999 -2.485
322 1HG1 ILE 38 2HG1 ILE 38 -2.676 -10.258 -1.707
323 2HG1 ILE 38 1HG1 ILE 38 -3.724 -11.313 -0.759
324 1HG2 ILE 38 1HG2 ILE 38 -4.546 -9.318 0.527
325 2HG2 ILE 38 2HG2 ILE 38 -5.196 -7.929 -0.341
326 3HG2 ILE 38 3HG2 ILE 38 -3.475 -8.295 -0.432
327 1HD1 ILE 38 1HD1 ILE 38 -4.674 -11.150 -3.487
328 2HD1 ILE 38 2HD1 ILE 38 -4.188 -12.573 -2.565
329 3HD1 ILE 38 3HD1 ILE 38 -2.982 -11.646 -3.457
330 H LEU 39 H LEU 39 -6.993 -9.454 0.762
331 HA LEU 39 HA LEU 39 -5.979 -11.631 2.369
332 1HB LEU 39 2HB LEU 39 -6.039 -9.367 3.184
333 2HB LEU 39 1HB LEU 39 -7.761 -9.232 2.826
334 HG LEU 39 HG LEU 39 -8.233 -10.988 4.470
335 1HD1 LEU 39 1HD1 LEU 39 -5.339 -11.274 4.350
336 2HD1 LEU 39 2HD1 LEU 39 -6.544 -12.393 4.989
337 3HD1 LEU 39 3HD1 LEU 39 -5.906 -11.105 6.011
338 1HD2 LEU 39 1HD2 LEU 39 -8.010 -9.610 6.381
339 2HD2 LEU 39 2HD2 LEU 39 -8.003 -8.473 5.032
340 3HD2 LEU 39 3HD2 LEU 39 -6.488 -8.927 5.811
341 H ILE 40 H ILE 40 -9.140 -10.759 1.004
342 HA ILE 40 HA ILE 40 -10.440 -12.950 2.479
343 HB ILE 40 HB ILE 40 -11.473 -10.841 0.609
344 1HG1 ILE 40 2HG1 ILE 40 -11.494 -11.023 3.633
345 2HG1 ILE 40 1HG1 ILE 40 -10.494 -9.927 2.678
346 1HG2 ILE 40 1HG2 ILE 40 -12.702 -13.191 1.764
347 2HG2 ILE 40 2HG2 ILE 40 -13.386 -12.031 0.623
348 3HG2 ILE 40 3HG2 ILE 40 -13.489 -11.729 2.359
349 1HD1 ILE 40 1HD1 ILE 40 -12.555 -8.910 1.728
350 2HD1 ILE 40 2HD1 ILE 40 -12.484 -8.744 3.483
351 3HD1 ILE 40 3HD1 ILE 40 -13.526 -9.967 2.755
352 H PHE 41 H PHE 41 -9.413 -12.168 -0.786
353 HA PHE 41 HA PHE 41 -10.945 -14.339 -1.983
354 1HB PHE 41 2HB PHE 41 -8.875 -12.358 -2.928
355 2HB PHE 41 1HB PHE 41 -9.520 -13.607 -3.994
356 HD1 PHE 41 1HD PHE 41 -10.881 -11.132 -1.477
357 HD2 PHE 41 2HD PHE 41 -11.294 -12.983 -5.334
358 HE1 PHE 41 1HE PHE 41 -12.903 -9.772 -1.913
359 HE2 PHE 41 2HE PHE 41 -13.314 -11.615 -5.770
360 HZ PHE 41 HZ PHE 41 -14.119 -10.011 -4.061
361 H LEU 42 H LEU 42 -7.726 -13.943 -0.645
362 HA LEU 42 HA LEU 42 -6.415 -16.084 -1.982
363 1HB LEU 42 2HB LEU 42 -4.925 -16.029 0.023
364 2HB LEU 42 1HB LEU 42 -5.255 -14.423 -0.615
365 HG LEU 42 HG LEU 42 -7.104 -14.238 1.140
366 1HD1 LEU 42 1HD2 LEU 42 -6.103 -15.946 3.102
367 2HD1 LEU 42 2HD2 LEU 42 -6.142 -16.954 1.656
368 3HD1 LEU 42 3HD2 LEU 42 -7.615 -16.163 2.221
369 1HD2 LEU 42 1HD1 LEU 42 -5.581 -13.464 2.778
370 2HD2 LEU 42 2HD1 LEU 42 -4.666 -13.358 1.274
371 3HD2 LEU 42 3HD1 LEU 42 -4.391 -14.702 2.380
372 H LEU 43 H LEU 43 -8.915 -16.096 0.420
373 HA LEU 43 HA LEU 43 -8.426 -18.875 1.229
374 1HB LEU 43 2HB LEU 43 -9.193 -17.165 2.820
375 2HB LEU 43 1HB LEU 43 -10.624 -16.876 1.831
376 HG LEU 43 HG LEU 43 -11.336 -19.219 2.179
377 1HD1 LEU 43 1HD2 LEU 43 -9.935 -20.219 4.269
378 2HD1 LEU 43 2HD2 LEU 43 -8.650 -19.332 3.447
379 3HD1 LEU 43 3HD2 LEU 43 -9.543 -20.588 2.589
380 1HD2 LEU 43 1HD1 LEU 43 -12.002 -18.978 4.498
381 2HD2 LEU 43 2HD1 LEU 43 -12.010 -17.378 3.758
382 3HD2 LEU 43 3HD1 LEU 43 -10.677 -17.858 4.807
383 H LEU 44 H LEU 44 -10.743 -17.040 -0.743
384 HA LEU 44 HA LEU 44 -12.573 -19.174 -1.265
385 1HB LEU 44 2HB LEU 44 -11.798 -16.722 -2.876
386 2HB LEU 44 1HB LEU 44 -13.267 -17.668 -3.118
387 HG LEU 44 HG LEU 44 -12.505 -16.221 -0.563
388 1HD1 LEU 44 1HD1 LEU 44 -14.168 -15.529 -2.936
389 2HD1 LEU 44 2HD1 LEU 44 -13.254 -14.474 -1.858
390 3HD1 LEU 44 3HD1 LEU 44 -14.823 -15.101 -1.356
391 1HD2 LEU 44 1HD2 LEU 44 -13.790 -18.109 0.072
392 2HD2 LEU 44 2HD2 LEU 44 -14.827 -17.984 -1.348
393 3HD2 LEU 44 3HD2 LEU 44 -14.967 -16.803 -0.048
394 H ILE 45 H ILE 45 -9.754 -17.989 -3.134
395 HA ILE 45 HA ILE 45 -9.969 -19.672 -5.384
396 HB ILE 45 HB ILE 45 -7.527 -19.265 -5.558
397 1HG1 ILE 45 2HG1 ILE 45 -7.846 -18.181 -2.739
398 2HG1 ILE 45 1HG1 ILE 45 -6.984 -19.657 -3.174
399 1HG2 ILE 45 1HG2 ILE 45 -8.073 -17.182 -6.212
400 2HG2 ILE 45 2HG2 ILE 45 -8.176 -16.653 -4.532
401 3HG2 ILE 45 3HG2 ILE 45 -9.594 -17.335 -5.330
402 1HD1 ILE 45 1HD1 ILE 45 -5.617 -18.124 -4.767
403 2HD1 ILE 45 2HD1 ILE 45 -5.265 -18.054 -3.041
404 3HD1 ILE 45 3HD1 ILE 45 -6.252 -16.800 -3.791
405 H CYS 46 H CYS 46 -9.113 -20.502 -2.112
406 HA CYS 46 HA CYS 46 -7.741 -22.978 -2.792
407 1HB CYS 46 2HB CYS 46 -7.212 -21.626 -0.818
408 2HB CYS 46 1HB CYS 46 -8.848 -21.874 -0.228
409 HG CYS 46 HG CYS 46 -7.562 -23.752 0.922
410 H ILE 47 H ILE 47 -11.014 -22.002 -2.044
411 HA ILE 47 HA ILE 47 -12.113 -24.485 -1.225
412 HB ILE 47 HB ILE 47 -13.273 -22.142 -2.757
413 1HG1 ILE 47 2HG1 ILE 47 -12.220 -21.528 -0.612
414 2HG1 ILE 47 1HG1 ILE 47 -13.974 -21.386 -0.505
415 1HG2 ILE 47 1HG2 ILE 47 -14.570 -24.401 -1.220
416 2HG2 ILE 47 2HG2 ILE 47 -14.787 -24.005 -2.924
417 3HG2 ILE 47 3HG2 ILE 47 -15.417 -22.924 -1.682
418 1HD1 ILE 47 1HD1 ILE 47 -13.986 -23.752 0.434
419 2HD1 ILE 47 2HD1 ILE 47 -13.277 -22.525 1.483
420 3HD1 ILE 47 3HD1 ILE 47 -12.234 -23.614 0.570
421 H ILE 48 H ILE 48 -11.727 -23.102 -4.494
422 HA ILE 48 HA ILE 48 -13.066 -25.331 -5.782
423 HB ILE 48 HB ILE 48 -12.424 -24.139 -7.822
424 1HG1 ILE 48 2HG1 ILE 48 -10.718 -22.442 -5.967
425 2HG1 ILE 48 1HG1 ILE 48 -10.105 -23.593 -7.154
426 1HG2 ILE 48 1HG2 ILE 48 -13.333 -21.870 -7.212
427 2HG2 ILE 48 2HG2 ILE 48 -13.246 -22.350 -5.518
428 3HG2 ILE 48 3HG2 ILE 48 -14.312 -23.215 -6.625
429 1HD1 ILE 48 1HD1 ILE 48 -11.769 -22.091 -8.709
430 2HD1 ILE 48 2HD1 ILE 48 -10.045 -21.777 -8.528
431 3HD1 ILE 48 3HD1 ILE 48 -11.211 -20.881 -7.556
432 H VAL 49 H VAL 49 -9.692 -24.412 -5.183
433 HA VAL 49 HA VAL 49 -8.539 -26.452 -6.886
434 HB VAL 49 HB VAL 49 -7.449 -24.897 -4.520
435 1HG1 VAL 49 1HG1 VAL 49 -5.252 -25.338 -5.749
436 2HG1 VAL 49 2HG1 VAL 49 -6.131 -26.546 -6.687
437 3HG1 VAL 49 3HG1 VAL 49 -5.972 -26.731 -4.940
438 1HG2 VAL 49 1HG2 VAL 49 -6.550 -23.396 -6.271
439 2HG2 VAL 49 2HG2 VAL 49 -8.312 -23.462 -6.331
440 3HG2 VAL 49 3HG2 VAL 49 -7.355 -24.363 -7.506
441 H MET 50 H MET 50 -9.540 -26.351 -3.494
442 HA MET 50 HA MET 50 -8.270 -28.897 -2.857
443 1HB MET 50 2HB MET 50 -10.210 -27.117 -1.415
444 2HB MET 50 1HB MET 50 -9.419 -28.507 -0.684
445 1HG MET 50 2HG MET 50 -7.992 -26.114 -1.883
446 2HG MET 50 1HG MET 50 -8.225 -26.394 -0.158
447 1HE MET 50 1HE MET 50 -5.590 -25.766 -1.368
448 2HE MET 50 2HE MET 50 -4.428 -26.979 -0.835
449 3HE MET 50 3HE MET 50 -5.566 -26.290 0.322
450 H LEU 51 H LEU 51 -11.032 -28.137 -4.587
451 HA LEU 51 HA LEU 51 -12.390 -30.667 -3.713
452 1HB LEU 51 2HB LEU 51 -13.499 -28.082 -4.857
453 2HB LEU 51 1HB LEU 51 -14.468 -29.506 -4.473
454 HG LEU 51 HG LEU 51 -12.785 -27.934 -2.498
455 1HD1 LEU 51 1HD1 LEU 51 -15.790 -28.234 -2.537
456 2HD1 LEU 51 2HD1 LEU 51 -14.985 -26.925 -3.403
457 3HD1 LEU 51 3HD1 LEU 51 -14.820 -27.057 -1.652
458 1HD2 LEU 51 1HD2 LEU 51 -14.223 -30.538 -2.402
459 2HD2 LEU 51 2HD2 LEU 51 -14.403 -29.486 -0.999
460 3HD2 LEU 51 3HD2 LEU 51 -12.798 -30.008 -1.510
461 H LEU 52 H LEU 52 -11.566 -28.584 -6.482
462 HA LEU 52 HA LEU 52 -11.980 -30.961 -8.270
463 1HB LEU 52 2HB LEU 52 -12.415 -28.003 -8.802
464 2HB LEU 52 1HB LEU 52 -12.678 -29.299 -9.971
465 HG LEU 52 HG LEU 52 -14.122 -28.996 -7.321
466 1HD1 LEU 52 1HD2 LEU 52 -14.568 -27.579 -9.620
467 2HD1 LEU 52 2HD2 LEU 52 -15.823 -27.976 -8.444
468 3HD1 LEU 52 3HD2 LEU 52 -15.606 -28.983 -9.877
469 1HD2 LEU 52 1HD1 LEU 52 -14.109 -31.104 -9.469
470 2HD2 LEU 52 2HD1 LEU 52 -15.567 -30.824 -8.518
471 3HD2 LEU 52 3HD1 LEU 52 -14.071 -31.308 -7.718
Start of MODEL 2
1 1H MET 1 1HT MET 1 18.424 -0.278 -17.246
2 2H MET 1 2HT MET 1 18.095 -1.822 -17.872
3 H MET 1 H MET 1 19.071 -0.824 -16.622
4 3H MET 1 3HT MET 1 19.073 -1.651 -16.493
5 HA MET 1 HA MET 1 16.215 -0.863 -16.589
6 1HB MET 1 2HB MET 1 16.634 -3.263 -17.038
7 2HB MET 1 1HB MET 1 17.562 -3.350 -15.557
8 1HG MET 1 2HG MET 1 15.258 -4.174 -15.240
9 2HG MET 1 1HG MET 1 15.582 -2.751 -14.268
10 1HE MET 1 1HE MET 1 14.761 -2.536 -18.342
11 2HE MET 1 2HE MET 1 13.163 -3.222 -18.057
12 3HE MET 1 3HE MET 1 14.598 -4.091 -17.515
13 H ASP 2 H ASP 2 19.114 -0.100 -15.296
14 HA ASP 2 HA ASP 2 18.023 0.183 -12.516
15 1HB ASP 2 2HB ASP 2 19.965 -1.308 -12.728
16 2HB ASP 2 1HB ASP 2 20.867 -0.038 -13.556
17 H LYS 3 H LYS 3 18.825 1.912 -15.328
18 HA LYS 3 HA LYS 3 19.553 4.374 -13.838
19 1HB LYS 3 2HB LYS 3 21.026 3.689 -15.626
20 2HB LYS 3 1HB LYS 3 19.661 3.509 -16.716
21 1HG LYS 3 2HG LYS 3 19.183 5.904 -16.531
22 2HG LYS 3 1HG LYS 3 20.572 6.104 -15.464
23 1HD LYS 3 2HD LYS 3 20.667 5.119 -18.331
24 2HD LYS 3 1HD LYS 3 21.169 6.715 -17.775
25 1HE LYS 3 2HE LYS 3 22.903 5.674 -16.342
26 2HE LYS 3 1HE LYS 3 22.411 4.072 -16.928
27 1HZ LYS 3 1HZ LYS 3 24.100 4.685 -18.384
28 2HZ LYS 3 2HZ LYS 3 23.598 6.308 -18.453
29 3HZ LYS 3 3HZ LYS 3 22.692 5.102 -19.234
30 H VAL 4 H VAL 4 17.140 2.991 -16.025
31 HA VAL 4 HA VAL 4 15.658 5.377 -16.556
32 HB VAL 4 HB VAL 4 14.830 2.491 -16.385
33 1HG1 VAL 4 1HG1 VAL 4 13.453 4.972 -17.265
34 2HG1 VAL 4 2HG1 VAL 4 12.772 3.492 -16.588
35 3HG1 VAL 4 3HG1 VAL 4 13.245 3.548 -18.286
36 1HG2 VAL 4 1HG2 VAL 4 15.538 4.046 -18.863
37 2HG2 VAL 4 2HG2 VAL 4 15.448 2.297 -18.661
38 3HG2 VAL 4 3HG2 VAL 4 16.772 3.204 -17.928
39 H GLN 5 H GLN 5 15.132 2.807 -14.116
40 HA GLN 5 HA GLN 5 12.874 3.903 -12.829
41 1HB GLN 5 2HB GLN 5 13.654 2.524 -10.925
42 2HB GLN 5 1HB GLN 5 13.858 1.661 -12.450
43 1HG GLN 5 2HG GLN 5 16.227 2.353 -12.528
44 2HG GLN 5 1HG GLN 5 16.027 3.205 -10.995
45 1HE2 GLN 5 1HE2 GLN 5 16.753 1.979 -9.257
46 2HE2 GLN 5 2HE2 GLN 5 16.683 0.286 -9.156
47 H TYR 6 H TYR 6 16.306 4.700 -12.490
48 HA TYR 6 HA TYR 6 16.009 6.418 -10.189
49 1HB TYR 6 2HB TYR 6 18.101 5.287 -10.933
50 2HB TYR 6 1HB TYR 6 18.112 6.292 -12.376
51 HD1 TYR 6 1HD TYR 6 20.509 6.623 -11.209
52 HD2 TYR 6 2HD TYR 6 16.821 8.289 -9.752
53 HE1 TYR 6 1HE TYR 6 21.774 8.359 -9.974
54 HE2 TYR 6 2HE TYR 6 18.093 10.024 -8.525
55 HH TYR 6 HH TYR 6 20.244 10.468 -7.677
56 H LEU 7 H LEU 7 16.664 7.176 -13.633
57 HA LEU 7 HA LEU 7 16.295 9.977 -13.477
58 1HB LEU 7 2HB LEU 7 15.711 8.009 -15.714
59 2HB LEU 7 1HB LEU 7 15.908 9.749 -15.930
60 HG LEU 7 HG LEU 7 18.013 7.871 -14.813
61 1HD1 LEU 7 1HD1 LEU 7 17.826 7.480 -17.165
62 2HD1 LEU 7 2HD1 LEU 7 19.194 8.576 -16.964
63 3HD1 LEU 7 3HD1 LEU 7 17.636 9.201 -17.504
64 1HD2 LEU 7 1HD2 LEU 7 19.334 10.128 -15.427
65 2HD2 LEU 7 2HD2 LEU 7 18.612 9.871 -13.839
66 3HD2 LEU 7 3HD2 LEU 7 17.762 10.832 -15.050
67 H THR 8 H THR 8 13.929 7.370 -13.802
68 HA THR 8 HA THR 8 11.669 9.019 -14.461
69 HB THR 8 HB THR 8 11.894 6.310 -13.127
70 HG1 THR 8 1HG THR 8 11.562 5.616 -15.318
71 1HG2 THR 8 1HG2 THR 8 9.648 7.561 -13.040
72 2HG2 THR 8 2HG2 THR 8 9.634 5.935 -13.726
73 3HG2 THR 8 3HG2 THR 8 9.601 7.341 -14.790
74 H ARG 9 H ARG 9 12.758 7.565 -11.368
75 HA ARG 9 HA ARG 9 10.736 8.449 -9.656
76 1HB ARG 9 2HB ARG 9 12.656 6.987 -9.097
77 2HB ARG 9 1HB ARG 9 13.707 8.394 -9.168
78 1HG ARG 9 2HG ARG 9 12.447 9.461 -7.347
79 2HG ARG 9 1HG ARG 9 11.362 8.071 -7.280
80 1HD ARG 9 2HD ARG 9 13.288 6.603 -6.710
81 2HD ARG 9 1HD ARG 9 14.352 8.023 -6.724
82 HE ARG 9 HE ARG 9 13.505 8.521 -4.583
83 1HH1 ARG 9 1HH2 ARG 9 12.178 5.747 -4.551
84 2HH1 ARG 9 2HH2 ARG 9 10.550 6.174 -4.142
85 1HH2 ARG 9 1HH1 ARG 9 10.968 9.538 -4.873
86 2HH2 ARG 9 2HH1 ARG 9 9.866 8.320 -4.324
87 H SER 10 H SER 10 13.410 10.284 -11.027
88 HA SER 10 HA SER 10 12.913 12.662 -9.441
89 1HB SER 10 2HB SER 10 15.121 12.073 -10.305
90 2HB SER 10 1HB SER 10 14.491 12.124 -11.942
91 HG SER 10 HG SER 10 14.815 14.244 -10.101
92 H ALA 11 H ALA 11 11.772 11.331 -12.455
93 HA ALA 11 HA ALA 11 10.719 13.854 -13.479
94 1HB ALA 11 1HB ALA 11 11.519 11.563 -14.609
95 2HB ALA 11 2HB ALA 11 10.300 12.586 -15.369
96 3HB ALA 11 3HB ALA 11 9.808 11.175 -14.432
97 H ILE 12 H ILE 12 9.284 10.842 -12.181
98 HA ILE 12 HA ILE 12 6.569 11.662 -12.222
99 HB ILE 12 HB ILE 12 7.404 9.357 -11.859
100 1HG1 ILE 12 2HG1 ILE 12 5.862 8.740 -10.036
101 2HG1 ILE 12 1HG1 ILE 12 5.803 10.423 -9.509
102 1HG2 ILE 12 1HG2 ILE 12 8.097 10.172 -9.040
103 2HG2 ILE 12 2HG2 ILE 12 9.298 10.255 -10.328
104 3HG2 ILE 12 3HG2 ILE 12 8.563 8.709 -9.907
105 1HD1 ILE 12 1HD1 ILE 12 5.099 9.688 -12.344
106 2HD1 ILE 12 2HD1 ILE 12 4.619 11.111 -11.420
107 3HD1 ILE 12 3HD1 ILE 12 3.900 9.541 -11.060
108 H ARG 13 H ARG 13 9.133 12.138 -9.818
109 HA ARG 13 HA ARG 13 7.660 13.174 -7.652
110 1HB ARG 13 2HB ARG 13 10.072 12.685 -7.659
111 2HB ARG 13 1HB ARG 13 10.349 13.998 -8.803
112 1HG ARG 13 2HG ARG 13 9.466 15.613 -7.136
113 2HG ARG 13 1HG ARG 13 9.264 14.290 -5.987
114 1HD ARG 13 2HD ARG 13 11.915 15.068 -7.251
115 2HD ARG 13 1HD ARG 13 11.406 15.510 -5.612
116 HE ARG 13 HE ARG 13 12.386 12.932 -6.375
117 1HH1 ARG 13 1HH1 ARG 13 12.419 13.749 -3.566
118 2HH1 ARG 13 2HH1 ARG 13 11.161 12.793 -2.853
119 1HH2 ARG 13 1HH2 ARG 13 9.674 12.009 -5.888
120 2HH2 ARG 13 2HH2 ARG 13 9.605 11.812 -4.168
121 H ARG 14 H ARG 14 8.290 14.571 -10.795
122 HA ARG 14 HA ARG 14 7.920 17.333 -10.185
123 1HB ARG 14 2HB ARG 14 7.202 15.710 -12.654
124 2HB ARG 14 1HB ARG 14 7.358 17.463 -12.593
125 1HG ARG 14 2HG ARG 14 9.702 17.311 -12.030
126 2HG ARG 14 1HG ARG 14 9.588 15.568 -11.823
127 1HD ARG 14 2HD ARG 14 10.603 15.944 -13.982
128 2HD ARG 14 1HD ARG 14 8.935 15.438 -14.294
129 HE ARG 14 HE ARG 14 10.039 18.056 -14.879
130 1HH1 ARG 14 1HH2 ARG 14 7.484 16.263 -15.699
131 2HH1 ARG 14 2HH2 ARG 14 6.269 17.482 -15.510
132 1HH2 ARG 14 1HH1 ARG 14 8.361 19.687 -13.842
133 2HH2 ARG 14 2HH1 ARG 14 6.764 19.420 -14.456
134 H ALA 15 H ALA 15 5.595 14.759 -10.975
135 HA ALA 15 HA ALA 15 3.364 16.620 -10.369
136 1HB ALA 15 1HB ALA 15 3.853 14.855 -12.446
137 2HB ALA 15 2HB ALA 15 2.275 15.532 -12.041
138 3HB ALA 15 3HB ALA 15 2.746 13.951 -11.415
139 H SER 16 H SER 16 5.067 13.834 -9.200
140 HA SER 16 HA SER 16 2.893 12.965 -7.438
141 1HB SER 16 2HB SER 16 4.353 11.364 -8.583
142 2HB SER 16 1HB SER 16 5.744 12.083 -7.793
143 HG SER 16 HG SER 16 4.692 11.525 -5.778
144 H THR 17 H THR 17 4.485 15.641 -7.194
145 HA THR 17 HA THR 17 5.142 15.316 -4.308
146 HB THR 17 HB THR 17 6.487 17.006 -6.437
147 HG1 THR 17 1HG THR 17 7.009 14.804 -6.504
148 1HG2 THR 17 1HG2 THR 17 6.953 16.751 -3.456
149 2HG2 THR 17 2HG2 THR 17 6.581 18.217 -4.365
150 3HG2 THR 17 3HG2 THR 17 8.146 17.430 -4.563
151 H ILE 18 H ILE 18 3.368 17.071 -6.696
152 HA ILE 18 HA ILE 18 2.911 19.367 -4.905
153 HB ILE 18 HB ILE 18 3.336 19.692 -7.321
154 1HG1 ILE 18 2HG1 ILE 18 1.363 21.100 -7.804
155 2HG1 ILE 18 1HG1 ILE 18 0.477 20.304 -6.503
156 1HG2 ILE 18 1HG2 ILE 18 1.404 18.972 -8.860
157 2HG2 ILE 18 2HG2 ILE 18 0.911 17.902 -7.548
158 3HG2 ILE 18 3HG2 ILE 18 2.491 17.699 -8.304
159 1HD1 ILE 18 1HD1 ILE 18 3.138 21.508 -5.860
160 2HD1 ILE 18 2HD1 ILE 18 1.708 21.340 -4.841
161 3HD1 ILE 18 3HD1 ILE 18 1.766 22.594 -6.082
162 H GLU 19 H GLU 19 1.462 16.360 -5.825
163 HA GLU 19 HA GLU 19 -1.043 17.129 -4.416
164 1HB GLU 19 2HB GLU 19 -2.156 15.527 -5.938
165 2HB GLU 19 1HB GLU 19 -1.311 16.781 -6.846
166 1HG GLU 19 2HG GLU 19 0.605 15.274 -7.174
167 2HG GLU 19 1HG GLU 19 -0.211 14.021 -6.239
168 H MET 20 H MET 20 1.707 15.555 -3.841
169 HA MET 20 HA MET 20 1.131 12.880 -3.194
170 1HB MET 20 2HB MET 20 3.354 13.900 -3.191
171 2HB MET 20 1HB MET 20 2.912 14.908 -1.815
172 1HG MET 20 2HG MET 20 2.549 12.889 -0.444
173 2HG MET 20 1HG MET 20 2.994 11.877 -1.819
174 1HE MET 20 1HE MET 20 4.818 12.425 -3.224
175 2HE MET 20 2HE MET 20 6.439 12.223 -2.563
176 3HE MET 20 3HE MET 20 5.844 13.837 -2.939
177 HA PRO 21 HA PRO 21 -0.256 14.311 1.154
178 1HB PRO 21 2HB PRO 21 -1.158 16.878 1.446
179 2HB PRO 21 1HB PRO 21 0.523 16.404 1.723
180 1HG PRO 21 2HG PRO 21 -0.691 17.746 -0.606
181 2HG PRO 21 1HG PRO 21 0.894 17.988 0.132
182 1HD PRO 21 2HD PRO 21 0.477 16.578 -2.167
183 2HD PRO 21 1HD PRO 21 1.855 16.314 -1.081
184 H GLN 22 H GLN 22 -1.892 15.854 -1.600
185 HA GLN 22 HA GLN 22 -4.544 15.242 -0.449
186 1HB GLN 22 2HB GLN 22 -3.650 16.502 -3.031
187 2HB GLN 22 1HB GLN 22 -5.317 16.436 -2.478
188 1HG GLN 22 2HG GLN 22 -4.690 17.716 -0.457
189 2HG GLN 22 1HG GLN 22 -3.024 17.801 -1.034
190 1HE2 GLN 22 1HE2 GLN 22 -5.828 19.597 -0.932
191 2HE2 GLN 22 2HE2 GLN 22 -5.583 20.573 -2.298
192 H GLN 23 H GLN 23 -2.239 13.626 -2.347
193 HA GLN 23 HA GLN 23 -4.264 12.043 -3.795
194 1HB GLN 23 2HB GLN 23 -2.363 12.991 -5.020
195 2HB GLN 23 1HB GLN 23 -1.264 12.178 -3.920
196 1HG GLN 23 2HG GLN 23 -1.462 10.908 -6.010
197 2HG GLN 23 1HG GLN 23 -2.126 9.989 -4.664
198 1HE2 GLN 23 1HE2 GLN 23 -2.799 10.916 -7.815
199 2HE2 GLN 23 2HE2 GLN 23 -4.489 10.770 -7.786
200 H ALA 24 H ALA 24 -1.581 11.675 -1.493
201 HA ALA 24 HA ALA 24 -1.820 8.830 -1.178
202 1HB ALA 24 1HB ALA 24 -0.273 9.187 0.599
203 2HB ALA 24 2HB ALA 24 -0.890 10.809 0.912
204 3HB ALA 24 3HB ALA 24 0.063 10.492 -0.538
205 H ARG 25 H ARG 25 -3.168 11.607 0.649
206 HA ARG 25 HA ARG 25 -4.509 10.179 2.683
207 1HB ARG 25 2HB ARG 25 -4.221 12.612 2.564
208 2HB ARG 25 1HB ARG 25 -5.309 12.669 1.190
209 1HG ARG 25 2HG ARG 25 -7.129 11.731 2.577
210 2HG ARG 25 1HG ARG 25 -6.048 11.708 3.965
211 1HD ARG 25 2HD ARG 25 -6.545 14.291 2.481
212 2HD ARG 25 1HD ARG 25 -7.682 13.730 3.719
213 HE ARG 25 HE ARG 25 -6.076 14.338 5.329
214 1HH1 ARG 25 1HH1 ARG 25 -4.656 15.958 3.163
215 2HH1 ARG 25 2HH1 ARG 25 -3.034 15.374 3.332
216 1HH2 ARG 25 1HH2 ARG 25 -3.950 12.590 5.188
217 2HH2 ARG 25 2HH2 ARG 25 -2.635 13.464 4.478
218 H GLN 26 H GLN 26 -5.375 10.773 -0.674
219 HA GLN 26 HA GLN 26 -8.061 9.709 -0.493
220 1HB GLN 26 2HB GLN 26 -6.188 10.170 -2.805
221 2HB GLN 26 1HB GLN 26 -7.923 9.912 -2.948
222 1HG GLN 26 2HG GLN 26 -6.632 12.184 -1.414
223 2HG GLN 26 1HG GLN 26 -7.290 12.328 -3.043
224 1HE2 GLN 26 1HE2 GLN 26 -9.402 13.080 -3.086
225 2HE2 GLN 26 2HE2 GLN 26 -10.540 12.880 -1.843
226 H ASN 27 H ASN 27 -5.058 8.520 -2.004
227 HA ASN 27 HA ASN 27 -5.972 5.912 -2.637
228 1HB ASN 27 2HB ASN 27 -3.274 7.042 -1.962
229 2HB ASN 27 1HB ASN 27 -3.495 5.436 -2.641
230 1HD2 ASN 27 1HD2 ASN 27 -2.745 8.518 -3.564
231 2HD2 ASN 27 2HD2 ASN 27 -3.362 8.508 -5.146
232 H LEU 28 H LEU 28 -4.588 7.209 0.356
233 HA LEU 28 HA LEU 28 -3.989 4.873 1.769
234 1HB LEU 28 2HB LEU 28 -3.614 7.196 2.508
235 2HB LEU 28 1HB LEU 28 -5.348 7.375 2.743
236 HG LEU 28 HG LEU 28 -5.330 5.571 4.415
237 1HD1 LEU 28 1HD1 LEU 28 -2.800 5.068 5.164
238 2HD1 LEU 28 2HD1 LEU 28 -2.515 5.356 3.446
239 3HD1 LEU 28 3HD1 LEU 28 -3.629 4.086 3.956
240 1HD2 LEU 28 1HD2 LEU 28 -3.514 7.943 4.728
241 2HD2 LEU 28 2HD2 LEU 28 -3.643 6.773 6.043
242 3HD2 LEU 28 3HD2 LEU 28 -5.078 7.632 5.480
243 H GLN 29 H GLN 29 -7.133 6.198 0.950
244 HA GLN 29 HA GLN 29 -8.685 4.635 2.795
245 1HB GLN 29 2HB GLN 29 -9.342 5.920 0.156
246 2HB GLN 29 1HB GLN 29 -10.537 5.375 1.323
247 1HG GLN 29 2HG GLN 29 -8.395 7.443 1.887
248 2HG GLN 29 1HG GLN 29 -10.067 7.824 1.487
249 1HE2 GLN 29 1HE2 GLN 29 -10.492 5.068 3.241
250 2HE2 GLN 29 2HE2 GLN 29 -10.573 5.721 4.801
251 H ASN 30 H ASN 30 -8.275 4.298 -0.746
252 HA ASN 30 HA ASN 30 -9.528 1.801 -1.059
253 1HB ASN 30 2HB ASN 30 -7.140 2.966 -2.470
254 2HB ASN 30 1HB ASN 30 -8.161 1.689 -3.115
255 1HD2 ASN 30 1HD2 ASN 30 -9.711 2.480 -4.538
256 2HD2 ASN 30 2HD2 ASN 30 -10.434 4.013 -4.446
257 H LEU 31 H LEU 31 -6.248 2.561 0.008
258 HA LEU 31 HA LEU 31 -5.047 0.016 -0.176
259 1HB LEU 31 2HB LEU 31 -3.925 2.137 0.374
260 2HB LEU 31 1HB LEU 31 -4.764 2.159 1.916
261 HG LEU 31 HG LEU 31 -3.672 0.055 2.567
262 1HD1 LEU 31 1HD1 LEU 31 -1.589 -0.209 0.725
263 2HD1 LEU 31 2HD1 LEU 31 -3.016 0.057 -0.276
264 3HD1 LEU 31 3HD1 LEU 31 -2.984 -1.278 0.875
265 1HD2 LEU 31 1HD2 LEU 31 -2.535 2.125 3.163
266 2HD2 LEU 31 2HD2 LEU 31 -1.792 2.214 1.566
267 3HD2 LEU 31 3HD2 LEU 31 -1.328 0.931 2.684
268 H PHE 32 H PHE 32 -7.272 1.321 2.229
269 HA PHE 32 HA PHE 32 -6.979 -0.829 4.123
270 1HB PHE 32 2HB PHE 32 -7.746 1.452 4.668
271 2HB PHE 32 1HB PHE 32 -9.171 1.212 3.658
272 HD1 PHE 32 1HD PHE 32 -7.367 -0.703 6.345
273 HD2 PHE 32 2HD PHE 32 -11.122 0.720 4.821
274 HE1 PHE 32 1HE PHE 32 -8.545 -1.762 8.253
275 HE2 PHE 32 2HE PHE 32 -12.299 -0.341 6.730
276 HZ PHE 32 HZ PHE 32 -11.009 -1.582 8.446
277 H ILE 33 H ILE 33 -9.813 0.053 2.117
278 HA ILE 33 HA ILE 33 -11.273 -2.330 2.434
279 HB ILE 33 HB ILE 33 -11.979 -0.143 1.419
280 1HG1 ILE 33 2HG1 ILE 33 -13.335 -2.228 1.097
281 2HG1 ILE 33 1HG1 ILE 33 -13.515 -1.071 -0.216
282 1HG2 ILE 33 1HG2 ILE 33 -9.937 0.096 -0.008
283 2HG2 ILE 33 2HG2 ILE 33 -11.445 0.359 -0.884
284 3HG2 ILE 33 3HG2 ILE 33 -10.578 -1.166 -1.062
285 1HD1 ILE 33 1HD1 ILE 33 -13.108 -2.873 -1.543
286 2HD1 ILE 33 2HD1 ILE 33 -12.341 -3.781 -0.241
287 3HD1 ILE 33 3HD1 ILE 33 -11.420 -2.574 -1.135
288 H ASN 34 H ASN 34 -8.756 -1.558 0.017
289 HA ASN 34 HA ASN 34 -8.958 -3.973 -1.490
290 1HB ASN 34 2HB ASN 34 -7.804 -1.914 -2.208
291 2HB ASN 34 1HB ASN 34 -6.606 -2.136 -0.931
292 1HD2 ASN 34 1HD2 ASN 34 -7.052 -2.651 -4.195
293 2HD2 ASN 34 2HD2 ASN 34 -5.987 -3.953 -4.418
294 H PHE 35 H PHE 35 -6.699 -3.079 1.144
295 HA PHE 35 HA PHE 35 -5.226 -5.444 1.364
296 1HB PHE 35 2HB PHE 35 -4.842 -3.365 2.625
297 2HB PHE 35 1HB PHE 35 -6.327 -3.632 3.537
298 HD1 PHE 35 1HD PHE 35 -3.308 -5.651 2.565
299 HD2 PHE 35 2HD PHE 35 -6.027 -4.480 5.677
300 HE1 PHE 35 1HE PHE 35 -2.067 -7.063 4.183
301 HE2 PHE 35 2HE PHE 35 -4.786 -5.893 7.294
302 HZ PHE 35 HZ PHE 35 -2.805 -7.185 6.546
303 H CYS 36 H CYS 36 -8.573 -4.901 2.221
304 HA CYS 36 HA CYS 36 -8.725 -7.420 3.740
305 1HB CYS 36 2HB CYS 36 -9.826 -5.373 4.549
306 2HB CYS 36 1HB CYS 36 -10.760 -5.281 3.057
307 HG CYS 36 HG CYS 36 -12.343 -6.563 4.576
308 H LEU 37 H LEU 37 -9.193 -6.329 0.511
309 HA LEU 37 HA LEU 37 -11.178 -8.395 -0.152
310 1HB LEU 37 2HB LEU 37 -11.249 -6.095 -1.065
311 2HB LEU 37 1HB LEU 37 -9.701 -6.391 -1.860
312 HG LEU 37 HG LEU 37 -10.682 -8.230 -3.149
313 1HD1 LEU 37 1HD2 LEU 37 -12.337 -9.205 -1.804
314 2HD1 LEU 37 2HD2 LEU 37 -13.307 -8.316 -2.981
315 3HD1 LEU 37 3HD2 LEU 37 -13.040 -7.646 -1.371
316 1HD2 LEU 37 1HD1 LEU 37 -10.966 -6.352 -4.433
317 2HD2 LEU 37 2HD1 LEU 37 -11.849 -5.501 -3.166
318 3HD2 LEU 37 3HD1 LEU 37 -12.668 -6.715 -4.146
319 H ILE 38 H ILE 38 -7.752 -7.665 -0.830
320 HA ILE 38 HA ILE 38 -7.413 -10.039 -2.494
321 HB ILE 38 HB ILE 38 -5.562 -8.019 -1.255
322 1HG1 ILE 38 2HG1 ILE 38 -5.233 -7.395 -3.673
323 2HG1 ILE 38 1HG1 ILE 38 -6.513 -8.535 -4.079
324 1HG2 ILE 38 1HG2 ILE 38 -4.221 -9.985 -1.423
325 2HG2 ILE 38 2HG2 ILE 38 -3.845 -9.026 -2.855
326 3HG2 ILE 38 3HG2 ILE 38 -4.927 -10.411 -2.982
327 1HD1 ILE 38 1HD1 ILE 38 -8.161 -7.254 -2.965
328 2HD1 ILE 38 2HD1 ILE 38 -7.173 -6.057 -3.803
329 3HD1 ILE 38 3HD1 ILE 38 -6.953 -6.327 -2.075
330 H LEU 39 H LEU 39 -6.536 -9.099 0.826
331 HA LEU 39 HA LEU 39 -5.077 -11.330 1.658
332 1HB LEU 39 2HB LEU 39 -5.704 -9.142 2.830
333 2HB LEU 39 1HB LEU 39 -7.236 -9.909 3.243
334 HG LEU 39 HG LEU 39 -4.522 -11.035 3.928
335 1HD1 LEU 39 1HD2 LEU 39 -5.503 -10.375 6.314
336 2HD1 LEU 39 2HD2 LEU 39 -6.357 -9.162 5.361
337 3HD1 LEU 39 3HD2 LEU 39 -4.595 -9.213 5.350
338 1HD2 LEU 39 1HD1 LEU 39 -5.872 -12.888 4.088
339 2HD2 LEU 39 2HD1 LEU 39 -7.335 -11.927 4.310
340 3HD2 LEU 39 3HD1 LEU 39 -6.234 -12.183 5.663
341 H ILE 40 H ILE 40 -8.611 -10.931 1.474
342 HA ILE 40 HA ILE 40 -9.097 -13.645 2.448
343 HB ILE 40 HB ILE 40 -11.444 -12.997 2.180
344 1HG1 ILE 40 2HG1 ILE 40 -10.336 -10.527 0.798
345 2HG1 ILE 40 1HG1 ILE 40 -11.224 -11.830 0.010
346 1HG2 ILE 40 1HG2 ILE 40 -9.461 -11.453 3.624
347 2HG2 ILE 40 2HG2 ILE 40 -11.076 -11.946 4.134
348 3HG2 ILE 40 3HG2 ILE 40 -10.858 -10.457 3.216
349 1HD1 ILE 40 1HD1 ILE 40 -12.835 -10.123 0.437
350 2HD1 ILE 40 2HD1 ILE 40 -12.245 -9.881 2.081
351 3HD1 ILE 40 3HD1 ILE 40 -13.112 -11.359 1.664
352 H PHE 41 H PHE 41 -9.228 -11.912 -0.658
353 HA PHE 41 HA PHE 41 -10.464 -13.833 -2.291
354 1HB PHE 41 2HB PHE 41 -9.757 -11.559 -2.957
355 2HB PHE 41 1HB PHE 41 -8.067 -12.059 -2.867
356 HD1 PHE 41 1HD PHE 41 -11.250 -13.391 -4.366
357 HD2 PHE 41 2HD PHE 41 -7.073 -12.542 -4.913
358 HE1 PHE 41 1HE PHE 41 -11.379 -14.245 -6.691
359 HE2 PHE 41 2HE PHE 41 -7.203 -13.398 -7.237
360 HZ PHE 41 HZ PHE 41 -9.355 -14.250 -8.126
361 H LEU 42 H LEU 42 -7.092 -13.713 -1.167
362 HA LEU 42 HA LEU 42 -6.080 -15.859 -2.744
363 1HB LEU 42 2HB LEU 42 -5.333 -14.804 -0.003
364 2HB LEU 42 1HB LEU 42 -4.320 -15.885 -0.961
365 HG LEU 42 HG LEU 42 -5.263 -13.132 -1.817
366 1HD1 LEU 42 1HD2 LEU 42 -2.509 -14.154 -1.055
367 2HD1 LEU 42 2HD2 LEU 42 -3.516 -13.098 -0.063
368 3HD1 LEU 42 3HD2 LEU 42 -2.890 -12.523 -1.607
369 1HD2 LEU 42 1HD1 LEU 42 -5.032 -14.278 -3.827
370 2HD2 LEU 42 2HD1 LEU 42 -3.797 -15.362 -3.187
371 3HD2 LEU 42 3HD1 LEU 42 -3.384 -13.694 -3.588
372 H LEU 43 H LEU 43 -8.228 -15.882 -0.032
373 HA LEU 43 HA LEU 43 -7.593 -18.636 0.749
374 1HB LEU 43 2HB LEU 43 -8.189 -16.915 2.395
375 2HB LEU 43 1HB LEU 43 -9.740 -16.669 1.590
376 HG LEU 43 HG LEU 43 -10.366 -19.005 2.071
377 1HD1 LEU 43 1HD2 LEU 43 -8.617 -19.905 3.981
378 2HD1 LEU 43 2HD2 LEU 43 -7.522 -19.107 2.853
379 3HD1 LEU 43 3HD2 LEU 43 -8.580 -20.399 2.289
380 1HD2 LEU 43 1HD1 LEU 43 -10.187 -16.893 3.886
381 2HD2 LEU 43 2HD1 LEU 43 -9.536 -18.273 4.771
382 3HD2 LEU 43 3HD1 LEU 43 -11.158 -18.352 4.084
383 H LEU 44 H LEU 44 -10.171 -16.906 -0.987
384 HA LEU 44 HA LEU 44 -11.874 -19.234 -1.241
385 1HB LEU 44 2HB LEU 44 -11.757 -16.498 -2.517
386 2HB LEU 44 1HB LEU 44 -12.988 -17.678 -2.961
387 HG LEU 44 HG LEU 44 -13.870 -16.197 -1.234
388 1HD1 LEU 44 1HD1 LEU 44 -14.806 -17.858 0.081
389 2HD1 LEU 44 2HD1 LEU 44 -13.272 -18.704 0.287
390 3HD1 LEU 44 3HD1 LEU 44 -14.151 -18.828 -1.238
391 1HD2 LEU 44 1HD2 LEU 44 -12.852 -15.868 0.882
392 2HD2 LEU 44 2HD2 LEU 44 -11.542 -15.699 -0.285
393 3HD2 LEU 44 3HD2 LEU 44 -11.719 -17.196 0.632
394 H ILE 45 H ILE 45 -9.595 -17.576 -3.458
395 HA ILE 45 HA ILE 45 -10.078 -19.096 -5.786
396 HB ILE 45 HB ILE 45 -7.752 -18.471 -6.364
397 1HG1 ILE 45 2HG1 ILE 45 -7.588 -17.595 -3.462
398 2HG1 ILE 45 1HG1 ILE 45 -6.760 -18.994 -4.148
399 1HG2 ILE 45 1HG2 ILE 45 -9.126 -16.647 -6.749
400 2HG2 ILE 45 2HG2 ILE 45 -8.019 -15.957 -5.563
401 3HG2 ILE 45 3HG2 ILE 45 -9.611 -16.520 -5.058
402 1HD1 ILE 45 1HD1 ILE 45 -5.588 -17.494 -5.744
403 2HD1 ILE 45 2HD1 ILE 45 -5.230 -17.080 -4.067
404 3HD1 ILE 45 3HD1 ILE 45 -6.374 -16.106 -4.993
405 H CYS 46 H CYS 46 -8.510 -20.040 -2.811
406 HA CYS 46 HA CYS 46 -7.138 -22.347 -3.911
407 1HB CYS 46 2HB CYS 46 -6.383 -21.122 -1.925
408 2HB CYS 46 1HB CYS 46 -7.881 -21.547 -1.110
409 HG CYS 46 HG CYS 46 -6.427 -23.459 -0.350
410 H ILE 47 H ILE 47 -10.292 -21.692 -2.535
411 HA ILE 47 HA ILE 47 -11.146 -24.246 -1.742
412 HB ILE 47 HB ILE 47 -12.607 -21.990 -3.150
413 1HG1 ILE 47 2HG1 ILE 47 -11.451 -21.317 -1.068
414 2HG1 ILE 47 1HG1 ILE 47 -13.199 -21.314 -0.845
415 1HG2 ILE 47 1HG2 ILE 47 -13.481 -24.582 -2.070
416 2HG2 ILE 47 2HG2 ILE 47 -14.295 -23.498 -3.199
417 3HG2 ILE 47 3HG2 ILE 47 -14.395 -23.202 -1.463
418 1HD1 ILE 47 1HD1 ILE 47 -11.160 -22.983 0.444
419 2HD1 ILE 47 2HD1 ILE 47 -12.515 -23.911 -0.196
420 3HD1 ILE 47 3HD1 ILE 47 -12.804 -22.615 0.964
421 H ILE 48 H ILE 48 -11.291 -22.784 -5.008
422 HA ILE 48 HA ILE 48 -12.448 -25.140 -6.225
423 HB ILE 48 HB ILE 48 -12.063 -23.879 -8.300
424 1HG1 ILE 48 2HG1 ILE 48 -10.460 -21.998 -6.537
425 2HG1 ILE 48 1HG1 ILE 48 -9.780 -23.082 -7.747
426 1HG2 ILE 48 1HG2 ILE 48 -12.934 -22.199 -5.933
427 2HG2 ILE 48 2HG2 ILE 48 -13.965 -23.179 -6.975
428 3HG2 ILE 48 3HG2 ILE 48 -13.185 -21.733 -7.614
429 1HD1 ILE 48 1HD1 ILE 48 -11.959 -21.370 -8.749
430 2HD1 ILE 48 2HD1 ILE 48 -10.392 -21.735 -9.472
431 3HD1 ILE 48 3HD1 ILE 48 -10.522 -20.485 -8.234
432 H VAL 49 H VAL 49 -9.165 -23.873 -5.831
433 HA VAL 49 HA VAL 49 -7.847 -25.685 -7.630
434 HB VAL 49 HB VAL 49 -6.905 -24.285 -5.105
435 1HG1 VAL 49 1HG2 VAL 49 -5.523 -25.829 -7.263
436 2HG1 VAL 49 2HG2 VAL 49 -5.157 -25.739 -5.540
437 3HG1 VAL 49 3HG2 VAL 49 -4.711 -24.407 -6.607
438 1HG2 VAL 49 1HG1 VAL 49 -6.831 -22.370 -6.306
439 2HG2 VAL 49 2HG1 VAL 49 -7.855 -23.190 -7.484
440 3HG2 VAL 49 3HG1 VAL 49 -6.104 -23.186 -7.691
441 H MET 50 H MET 50 -8.865 -25.940 -4.254
442 HA MET 50 HA MET 50 -7.439 -28.430 -3.786
443 1HB MET 50 2HB MET 50 -9.575 -26.933 -2.300
444 2HB MET 50 1HB MET 50 -8.732 -28.331 -1.650
445 1HG MET 50 2HG MET 50 -7.407 -25.752 -2.547
446 2HG MET 50 1HG MET 50 -7.717 -26.202 -0.870
447 1HE MET 50 1HE MET 50 -7.209 -29.442 -1.103
448 2HE MET 50 2HE MET 50 -6.962 -28.292 0.210
449 3HE MET 50 3HE MET 50 -5.637 -29.338 -0.298
450 H LEU 51 H LEU 51 -10.357 -27.625 -5.362
451 HA LEU 51 HA LEU 51 -11.448 -30.379 -4.895
452 1HB LEU 51 2HB LEU 51 -12.779 -27.800 -5.788
453 2HB LEU 51 1HB LEU 51 -13.609 -29.328 -5.485
454 HG LEU 51 HG LEU 51 -12.020 -27.749 -3.439
455 1HD1 LEU 51 1HD2 LEU 51 -14.077 -26.604 -3.821
456 2HD1 LEU 51 2HD2 LEU 51 -14.351 -27.591 -2.385
457 3HD1 LEU 51 3HD2 LEU 51 -14.978 -28.114 -3.948
458 1HD2 LEU 51 1HD1 LEU 51 -11.819 -29.876 -2.598
459 2HD2 LEU 51 2HD1 LEU 51 -13.218 -30.473 -3.491
460 3HD2 LEU 51 3HD1 LEU 51 -13.450 -29.535 -2.015
461 H LEU 52 H LEU 52 -10.570 -27.977 -7.341
462 HA LEU 52 HA LEU 52 -11.175 -29.981 -9.486
463 1HB LEU 52 2HB LEU 52 -10.792 -26.970 -9.553
464 2HB LEU 52 1HB LEU 52 -11.225 -27.971 -10.938
465 HG LEU 52 HG LEU 52 -12.859 -27.681 -8.399
466 1HD1 LEU 52 1HD1 LEU 52 -12.647 -25.964 -10.606
467 2HD1 LEU 52 2HD1 LEU 52 -13.942 -25.979 -9.409
468 3HD1 LEU 52 3HD1 LEU 52 -14.112 -26.900 -10.904
469 1HD2 LEU 52 1HD2 LEU 52 -13.603 -29.727 -9.083
470 2HD2 LEU 52 2HD2 LEU 52 -12.935 -29.533 -10.704
471 3HD2 LEU 52 3HD2 LEU 52 -14.484 -28.795 -10.294
Start of MODEL 3
1 1H MET 1 1HT MET 1 13.880 -8.472 12.991
2 2H MET 1 2HT MET 1 15.514 -8.312 12.560
3 H MET 1 H MET 1 14.582 -8.402 13.214
4 3H MET 1 3HT MET 1 14.393 -8.917 11.437
5 HA MET 1 HA MET 1 15.094 -6.521 11.123
6 1HB MET 1 2HB MET 1 12.718 -5.958 10.580
7 2HB MET 1 1HB MET 1 13.183 -7.562 10.049
8 1HG MET 1 2HG MET 1 12.165 -8.550 12.048
9 2HG MET 1 1HG MET 1 11.717 -6.942 12.595
10 1HE MET 1 1HE MET 1 8.291 -8.026 11.877
11 2HE MET 1 2HE MET 1 9.652 -8.065 12.995
12 3HE MET 1 3HE MET 1 9.345 -9.447 11.946
13 H ASP 2 H ASP 2 15.216 -4.568 12.065
14 HA ASP 2 HA ASP 2 13.496 -3.703 14.245
15 1HB ASP 2 2HB ASP 2 15.336 -3.678 15.951
16 2HB ASP 2 1HB ASP 2 14.863 -5.296 15.451
17 H LYS 3 H LYS 3 16.482 -3.193 12.399
18 HA LYS 3 HA LYS 3 16.249 -0.260 12.942
19 1HB LYS 3 2HB LYS 3 18.625 -0.220 12.369
20 2HB LYS 3 1HB LYS 3 18.322 -1.417 13.626
21 1HG LYS 3 2HG LYS 3 18.355 -3.212 11.980
22 2HG LYS 3 1HG LYS 3 18.521 -2.043 10.667
23 1HD LYS 3 2HD LYS 3 20.710 -2.995 11.227
24 2HD LYS 3 1HD LYS 3 20.662 -1.281 11.637
25 1HE LYS 3 2HE LYS 3 20.203 -1.841 13.998
26 2HE LYS 3 1HE LYS 3 20.246 -3.568 13.595
27 1HZ LYS 3 1HZ LYS 3 22.417 -2.863 14.342
28 2HZ LYS 3 2HZ LYS 3 22.450 -1.613 13.192
29 3HZ LYS 3 3HZ LYS 3 22.487 -3.236 12.690
30 H VAL 4 H VAL 4 15.950 -2.663 10.482
31 HA VAL 4 HA VAL 4 16.331 -0.676 8.304
32 HB VAL 4 HB VAL 4 17.391 -2.890 8.158
33 1HG1 VAL 4 1HG2 VAL 4 15.173 -4.571 7.629
34 2HG1 VAL 4 2HG2 VAL 4 14.817 -3.737 9.139
35 3HG1 VAL 4 3HG2 VAL 4 16.299 -4.678 8.981
36 1HG2 VAL 4 1HG1 VAL 4 16.541 -3.535 5.944
37 2HG2 VAL 4 2HG1 VAL 4 16.616 -1.779 6.080
38 3HG2 VAL 4 3HG1 VAL 4 15.067 -2.608 6.227
39 H GLN 5 H GLN 5 13.763 -2.381 9.980
40 HA GLN 5 HA GLN 5 11.794 -1.724 7.899
41 1HB GLN 5 2HB GLN 5 11.611 -3.077 10.606
42 2HB GLN 5 1HB GLN 5 10.287 -2.975 9.447
43 1HG GLN 5 2HG GLN 5 12.969 -4.299 8.942
44 2HG GLN 5 1HG GLN 5 11.453 -5.143 9.263
45 1HE2 GLN 5 1HE2 GLN 5 13.421 -4.203 6.740
46 2HE2 GLN 5 2HE2 GLN 5 12.262 -4.109 5.504
47 H TYR 6 H TYR 6 12.047 -1.124 11.424
48 HA TYR 6 HA TYR 6 10.035 0.897 11.499
49 1HB TYR 6 2HB TYR 6 12.437 0.372 13.277
50 2HB TYR 6 1HB TYR 6 11.027 1.330 13.730
51 HD1 TYR 6 1HD TYR 6 8.700 0.014 13.039
52 HD2 TYR 6 2HD TYR 6 12.441 -1.792 14.130
53 HE1 TYR 6 1HE TYR 6 7.505 -2.052 13.710
54 HE2 TYR 6 2HE TYR 6 11.246 -3.859 14.801
55 HH TYR 6 HH TYR 6 8.001 -4.455 13.985
56 H LEU 7 H LEU 7 13.384 1.011 10.508
57 HA LEU 7 HA LEU 7 13.774 3.843 10.936
58 1HB LEU 7 2HB LEU 7 15.601 2.249 10.839
59 2HB LEU 7 1HB LEU 7 15.141 1.809 9.200
60 HG LEU 7 HG LEU 7 15.605 4.107 8.440
61 1HD1 LEU 7 1HD1 LEU 7 16.746 5.661 10.034
62 2HD1 LEU 7 2HD1 LEU 7 16.416 4.517 11.334
63 3HD1 LEU 7 3HD1 LEU 7 15.081 5.309 10.495
64 1HD2 LEU 7 1HD2 LEU 7 17.782 2.656 9.955
65 2HD2 LEU 7 2HD2 LEU 7 18.114 4.083 8.973
66 3HD2 LEU 7 3HD2 LEU 7 17.460 2.629 8.222
67 H THR 8 H THR 8 13.403 1.964 7.900
68 HA THR 8 HA THR 8 13.101 4.160 6.151
69 HB THR 8 HB THR 8 11.781 1.433 6.079
70 HG1 THR 8 1HG THR 8 13.883 1.012 6.179
71 1HG2 THR 8 1HG2 THR 8 12.009 3.668 4.157
72 2HG2 THR 8 2HG2 THR 8 10.809 2.380 4.249
73 3HG2 THR 8 3HG2 THR 8 12.380 2.073 3.507
74 H ARG 9 H ARG 9 10.744 2.580 8.265
75 HA ARG 9 HA ARG 9 8.321 3.562 7.254
76 1HB ARG 9 2HB ARG 9 8.617 1.970 9.117
77 2HB ARG 9 1HB ARG 9 9.214 3.289 10.115
78 1HG ARG 9 2HG ARG 9 7.068 4.470 9.877
79 2HG ARG 9 1HG ARG 9 6.464 3.162 8.860
80 1HD ARG 9 2HD ARG 9 5.672 2.883 11.190
81 2HD ARG 9 1HD ARG 9 6.789 1.572 10.764
82 HE ARG 9 HE ARG 9 8.335 3.721 11.795
83 1HH1 ARG 9 1HH1 ARG 9 5.529 2.318 13.066
84 2HH1 ARG 9 2HH1 ARG 9 6.245 1.870 14.580
85 1HH2 ARG 9 1HH2 ARG 9 9.455 2.769 13.634
86 2HH2 ARG 9 2HH2 ARG 9 8.465 2.124 14.900
87 H SER 10 H SER 10 10.736 5.215 9.249
88 HA SER 10 HA SER 10 9.107 7.613 9.553
89 1HB SER 10 2HB SER 10 11.161 8.432 10.673
90 2HB SER 10 1HB SER 10 10.715 6.829 11.251
91 HG SER 10 HG SER 10 12.626 6.250 10.623
92 H ALA 11 H ALA 11 11.284 6.364 7.168
93 HA ALA 11 HA ALA 11 11.907 9.033 6.079
94 1HB ALA 11 1HB ALA 11 13.327 7.687 4.546
95 2HB ALA 11 2HB ALA 11 12.656 6.215 5.247
96 3HB ALA 11 3HB ALA 11 13.640 7.293 6.236
97 H ILE 12 H ILE 12 10.037 6.132 5.263
98 HA ILE 12 HA ILE 12 9.267 7.033 2.629
99 HB ILE 12 HB ILE 12 9.331 4.661 3.390
100 1HG1 ILE 12 2HG1 ILE 12 7.166 3.995 2.399
101 2HG1 ILE 12 1HG1 ILE 12 6.575 5.648 2.579
102 1HG2 ILE 12 1HG2 ILE 12 6.841 5.366 4.970
103 2HG2 ILE 12 2HG2 ILE 12 8.435 5.182 5.701
104 3HG2 ILE 12 3HG2 ILE 12 7.662 3.806 4.913
105 1HD1 ILE 12 1HD1 ILE 12 7.598 6.283 0.677
106 2HD1 ILE 12 2HD1 ILE 12 8.004 4.590 0.393
107 3HD1 ILE 12 3HD1 ILE 12 9.140 5.640 1.240
108 H ARG 13 H ARG 13 7.700 7.100 5.832
109 HA ARG 13 HA ARG 13 5.229 8.258 4.944
110 1HB ARG 13 2HB ARG 13 6.683 8.332 7.603
111 2HB ARG 13 1HB ARG 13 4.979 8.696 7.381
112 1HG ARG 13 2HG ARG 13 6.304 6.046 6.716
113 2HG ARG 13 1HG ARG 13 5.353 6.356 8.163
114 1HD ARG 13 2HD ARG 13 4.154 6.784 5.418
115 2HD ARG 13 1HD ARG 13 4.169 5.183 6.167
116 HE ARG 13 HE ARG 13 2.468 5.941 7.603
117 1HH1 ARG 13 1HH1 ARG 13 2.689 8.429 5.564
118 2HH1 ARG 13 2HH1 ARG 13 2.436 9.698 6.716
119 1HH2 ARG 13 1HH2 ARG 13 2.854 7.640 9.473
120 2HH2 ARG 13 2HH2 ARG 13 2.541 9.254 8.927
121 H ARG 14 H ARG 14 8.245 9.660 6.228
122 HA ARG 14 HA ARG 14 7.446 12.356 6.369
123 1HB ARG 14 2HB ARG 14 9.553 11.265 7.201
124 2HB ARG 14 1HB ARG 14 10.120 11.193 5.531
125 1HG ARG 14 2HG ARG 14 9.951 13.628 5.348
126 2HG ARG 14 1HG ARG 14 9.321 13.701 6.991
127 1HD ARG 14 2HD ARG 14 12.056 12.598 6.268
128 2HD ARG 14 1HD ARG 14 11.767 14.230 6.904
129 HE ARG 14 HE ARG 14 11.769 11.835 8.484
130 1HH1 ARG 14 1HH2 ARG 14 11.338 15.095 8.708
131 2HH1 ARG 14 2HH2 ARG 14 10.170 15.063 9.987
132 1HH2 ARG 14 1HH1 ARG 14 9.697 11.634 9.829
133 2HH2 ARG 14 2HH1 ARG 14 9.245 13.105 10.623
134 H ALA 15 H ALA 15 8.321 10.358 3.601
135 HA ALA 15 HA ALA 15 8.321 12.703 1.805
136 1HB ALA 15 1HB ALA 15 8.744 9.905 0.870
137 2HB ALA 15 2HB ALA 15 9.951 10.585 1.961
138 3HB ALA 15 3HB ALA 15 9.609 11.376 0.423
139 H SER 16 H SER 16 6.511 9.706 2.419
140 HA SER 16 HA SER 16 4.788 9.968 0.106
141 1HB SER 16 2HB SER 16 3.665 8.076 1.121
142 2HB SER 16 1HB SER 16 5.395 7.897 1.395
143 HG SER 16 HG SER 16 3.992 7.590 3.272
144 H THR 17 H THR 17 4.953 11.771 2.905
145 HA THR 17 HA THR 17 2.063 12.460 2.744
146 HB THR 17 HB THR 17 3.946 12.446 5.120
147 HG1 THR 17 1HG THR 17 3.339 10.452 5.170
148 1HG2 THR 17 1HG2 THR 17 2.489 13.899 6.033
149 2HG2 THR 17 2HG2 THR 17 1.280 12.614 5.971
150 3HG2 THR 17 3HG2 THR 17 1.408 13.770 4.645
151 H ILE 18 H ILE 18 5.081 13.565 1.983
152 HA ILE 18 HA ILE 18 4.380 16.390 2.575
153 HB ILE 18 HB ILE 18 6.464 15.358 3.601
154 1HG1 ILE 18 2HG1 ILE 18 6.252 17.812 3.251
155 2HG1 ILE 18 1HG1 ILE 18 7.917 17.261 3.104
156 1HG2 ILE 18 1HG2 ILE 18 7.753 15.569 0.908
157 2HG2 ILE 18 2HG2 ILE 18 6.864 14.102 1.313
158 3HG2 ILE 18 3HG2 ILE 18 8.232 14.608 2.303
159 1HD1 ILE 18 1HD1 ILE 18 7.089 17.043 0.515
160 2HD1 ILE 18 2HD1 ILE 18 7.882 18.469 1.176
161 3HD1 ILE 18 3HD1 ILE 18 6.124 18.417 1.056
162 H GLU 19 H GLU 19 5.289 14.026 0.128
163 HA GLU 19 HA GLU 19 5.267 16.094 -1.983
164 1HB GLU 19 2HB GLU 19 5.955 13.169 -1.990
165 2HB GLU 19 1HB GLU 19 6.167 14.249 -3.359
166 1HG GLU 19 2HG GLU 19 7.704 15.641 -1.997
167 2HG GLU 19 1HG GLU 19 7.520 14.506 -0.662
168 H MET 20 H MET 20 3.419 13.418 -0.716
169 HA MET 20 HA MET 20 1.285 13.962 -2.743
170 1HB MET 20 2HB MET 20 2.720 12.019 -3.392
171 2HB MET 20 1HB MET 20 2.318 11.247 -1.860
172 1HG MET 20 2HG MET 20 -0.092 11.343 -2.484
173 2HG MET 20 1HG MET 20 0.367 12.015 -4.047
174 1HE MET 20 1HE MET 20 2.333 11.215 -5.150
175 2HE MET 20 2HE MET 20 2.052 9.705 -6.014
176 3HE MET 20 3HE MET 20 3.229 9.756 -4.705
177 HA PRO 21 HA PRO 21 -0.219 13.433 1.648
178 1HB PRO 21 2HB PRO 21 -0.979 16.007 2.151
179 2HB PRO 21 1HB PRO 21 0.656 15.408 2.467
180 1HG PRO 21 2HG PRO 21 -0.320 17.140 0.312
181 2HG PRO 21 1HG PRO 21 1.279 17.053 1.053
182 1HD PRO 21 2HD PRO 21 0.535 15.962 -1.425
183 2HD PRO 21 1HD PRO 21 2.028 15.624 -0.525
184 H GLN 22 H GLN 22 -1.727 15.993 -0.374
185 HA GLN 22 HA GLN 22 -4.408 15.408 0.276
186 1HB GLN 22 2HB GLN 22 -3.180 16.494 -2.245
187 2HB GLN 22 1HB GLN 22 -4.879 16.648 -1.824
188 1HG GLN 22 2HG GLN 22 -4.240 17.857 0.243
189 2HG GLN 22 1HG GLN 22 -2.545 17.734 -0.219
190 1HE2 GLN 22 1HE2 GLN 22 -4.222 18.167 -3.118
191 2HE2 GLN 22 2HE2 GLN 22 -4.124 19.855 -3.215
192 H GLN 23 H GLN 23 -2.369 14.036 -2.292
193 HA GLN 23 HA GLN 23 -4.509 12.484 -3.467
194 1HB GLN 23 2HB GLN 23 -2.538 13.292 -4.690
195 2HB GLN 23 1HB GLN 23 -1.517 12.295 -3.667
196 1HG GLN 23 2HG GLN 23 -2.646 10.266 -4.477
197 2HG GLN 23 1HG GLN 23 -3.697 11.256 -5.490
198 1HE2 GLN 23 1HE2 GLN 23 -2.986 11.347 -7.621
199 2HE2 GLN 23 2HE2 GLN 23 -1.364 11.272 -8.113
200 H ALA 24 H ALA 24 -1.717 11.664 -1.365
201 HA ALA 24 HA ALA 24 -2.156 8.888 -1.119
202 1HB ALA 24 1HB ALA 24 -1.113 9.282 1.185
203 2HB ALA 24 2HB ALA 24 -1.192 11.006 0.822
204 3HB ALA 24 3HB ALA 24 -0.208 9.937 -0.178
205 H ARG 25 H ARG 25 -3.653 11.586 0.660
206 HA ARG 25 HA ARG 25 -5.189 10.124 2.526
207 1HB ARG 25 2HB ARG 25 -4.892 12.555 2.513
208 2HB ARG 25 1HB ARG 25 -5.795 12.653 1.009
209 1HG ARG 25 2HG ARG 25 -7.792 11.740 2.129
210 2HG ARG 25 1HG ARG 25 -6.891 11.639 3.643
211 1HD ARG 25 2HD ARG 25 -6.574 14.084 3.642
212 2HD ARG 25 1HD ARG 25 -7.449 14.201 2.102
213 HE ARG 25 HE ARG 25 -8.697 13.922 4.669
214 1HH1 ARG 25 1HH1 ARG 25 -9.838 14.639 1.849
215 2HH1 ARG 25 2HH1 ARG 25 -11.060 13.418 1.709
216 1HH2 ARG 25 1HH2 ARG 25 -9.822 11.502 4.321
217 2HH2 ARG 25 2HH2 ARG 25 -11.050 11.643 3.107
218 H GLN 26 H GLN 26 -5.773 10.856 -0.874
219 HA GLN 26 HA GLN 26 -8.449 9.731 -0.920
220 1HB GLN 26 2HB GLN 26 -6.488 10.475 -3.077
221 2HB GLN 26 1HB GLN 26 -8.204 10.173 -3.334
222 1HG GLN 26 2HG GLN 26 -7.028 12.343 -1.575
223 2HG GLN 26 1HG GLN 26 -7.761 12.592 -3.159
224 1HE2 GLN 26 1HE2 GLN 26 -8.466 12.773 0.100
225 2HE2 GLN 26 2HE2 GLN 26 -10.147 12.552 0.030
226 H ASN 27 H ASN 27 -5.295 8.763 -2.264
227 HA ASN 27 HA ASN 27 -6.073 6.233 -3.286
228 1HB ASN 27 2HB ASN 27 -3.458 7.216 -2.174
229 2HB ASN 27 1HB ASN 27 -3.635 5.815 -3.223
230 1HD2 ASN 27 1HD2 ASN 27 -3.166 6.317 -5.358
231 2HD2 ASN 27 2HD2 ASN 27 -3.463 7.814 -6.103
232 H LEU 28 H LEU 28 -5.276 7.259 -0.027
233 HA LEU 28 HA LEU 28 -4.599 4.826 1.208
234 1HB LEU 28 2HB LEU 28 -4.603 7.157 2.146
235 2HB LEU 28 1HB LEU 28 -6.347 7.028 2.283
236 HG LEU 28 HG LEU 28 -5.103 6.519 4.415
237 1HD1 LEU 28 1HD2 LEU 28 -7.368 5.357 3.416
238 2HD1 LEU 28 2HD2 LEU 28 -6.762 5.114 5.054
239 3HD1 LEU 28 3HD2 LEU 28 -6.387 3.941 3.792
240 1HD2 LEU 28 1HD1 LEU 28 -3.206 5.357 3.241
241 2HD2 LEU 28 2HD1 LEU 28 -4.288 3.994 2.957
242 3HD2 LEU 28 3HD1 LEU 28 -3.866 4.458 4.606
243 H GLN 29 H GLN 29 -7.764 6.044 0.221
244 HA GLN 29 HA GLN 29 -9.435 4.242 1.614
245 1HB GLN 29 2HB GLN 29 -9.667 5.497 -1.109
246 2HB GLN 29 1HB GLN 29 -11.015 4.778 -0.240
247 1HG GLN 29 2HG GLN 29 -9.314 7.054 0.810
248 2HG GLN 29 1HG GLN 29 -10.881 7.261 0.037
249 1HE2 GLN 29 1HE2 GLN 29 -11.341 4.408 1.643
250 2HE2 GLN 29 2HE2 GLN 29 -11.870 5.001 3.135
251 H ASN 30 H ASN 30 -7.860 3.889 -1.567
252 HA ASN 30 HA ASN 30 -8.968 1.322 -2.177
253 1HB ASN 30 2HB ASN 30 -8.007 2.873 -3.810
254 2HB ASN 30 1HB ASN 30 -6.435 2.685 -3.050
255 1HD2 ASN 30 1HD2 ASN 30 -5.123 1.237 -4.162
256 2HD2 ASN 30 2HD2 ASN 30 -5.678 -0.128 -5.008
257 H LEU 31 H LEU 31 -5.841 2.277 -0.738
258 HA LEU 31 HA LEU 31 -4.631 -0.244 -0.521
259 1HB LEU 31 2HB LEU 31 -3.606 1.932 0.011
260 2HB LEU 31 1HB LEU 31 -4.632 2.043 1.433
261 HG LEU 31 HG LEU 31 -3.624 -0.010 2.344
262 1HD1 LEU 31 1HD2 LEU 31 -2.083 0.113 -0.255
263 2HD1 LEU 31 2HD2 LEU 31 -3.040 -1.227 0.377
264 3HD1 LEU 31 3HD2 LEU 31 -1.506 -0.805 1.135
265 1HD2 LEU 31 1HD1 LEU 31 -1.304 1.712 1.529
266 2HD2 LEU 31 2HD1 LEU 31 -1.674 1.015 3.106
267 3HD2 LEU 31 3HD1 LEU 31 -2.585 2.407 2.521
268 H PHE 32 H PHE 32 -7.193 1.171 1.440
269 HA PHE 32 HA PHE 32 -7.122 -0.826 3.521
270 1HB PHE 32 2HB PHE 32 -7.994 1.493 3.746
271 2HB PHE 32 1HB PHE 32 -9.286 1.099 2.620
272 HD1 PHE 32 1HD PHE 32 -10.500 2.051 4.809
273 HD2 PHE 32 2HD PHE 32 -8.640 -1.817 4.530
274 HE1 PHE 32 1HE PHE 32 -11.884 1.242 6.701
275 HE2 PHE 32 2HE PHE 32 -10.029 -2.619 6.415
276 HZ PHE 32 HZ PHE 32 -11.649 -1.092 7.501
277 H ILE 33 H ILE 33 -9.645 -0.134 1.079
278 HA ILE 33 HA ILE 33 -11.106 -2.528 1.340
279 HB ILE 33 HB ILE 33 -11.770 -0.495 0.084
280 1HG1 ILE 33 2HG1 ILE 33 -12.767 -1.650 -1.866
281 2HG1 ILE 33 1HG1 ILE 33 -11.672 -3.009 -1.616
282 1HG2 ILE 33 1HG2 ILE 33 -10.829 -0.075 -2.140
283 2HG2 ILE 33 2HG2 ILE 33 -9.752 -1.461 -1.965
284 3HG2 ILE 33 3HG2 ILE 33 -9.551 -0.050 -0.927
285 1HD1 ILE 33 1HD1 ILE 33 -13.166 -2.222 0.796
286 2HD1 ILE 33 2HD1 ILE 33 -12.891 -3.826 0.119
287 3HD1 ILE 33 3HD1 ILE 33 -14.184 -2.811 -0.518
288 H ASN 34 H ASN 34 -8.180 -1.863 -0.554
289 HA ASN 34 HA ASN 34 -8.153 -4.348 -2.007
290 1HB ASN 34 2HB ASN 34 -6.958 -2.292 -2.666
291 2HB ASN 34 1HB ASN 34 -5.955 -2.411 -1.220
292 1HD2 ASN 34 1HD2 ASN 34 -3.950 -3.304 -1.675
293 2HD2 ASN 34 2HD2 ASN 34 -3.650 -4.491 -2.850
294 H PHE 35 H PHE 35 -6.290 -3.237 0.847
295 HA PHE 35 HA PHE 35 -4.966 -5.701 1.362
296 1HB PHE 35 2HB PHE 35 -4.342 -3.501 2.279
297 2HB PHE 35 1HB PHE 35 -5.833 -3.467 3.221
298 HD1 PHE 35 1HD PHE 35 -3.060 -5.918 2.562
299 HD2 PHE 35 2HD PHE 35 -5.590 -4.018 5.466
300 HE1 PHE 35 1HE PHE 35 -1.947 -7.200 4.370
301 HE2 PHE 35 2HE PHE 35 -4.477 -5.299 7.275
302 HZ PHE 35 HZ PHE 35 -2.655 -6.891 6.727
303 H CYS 36 H CYS 36 -8.164 -4.532 2.290
304 HA CYS 36 HA CYS 36 -8.728 -6.500 4.296
305 1HB CYS 36 2HB CYS 36 -9.936 -4.378 3.998
306 2HB CYS 36 1HB CYS 36 -10.515 -4.919 2.423
307 HG CYS 36 HG CYS 36 -11.343 -6.959 4.443
308 H LEU 37 H LEU 37 -9.521 -6.378 0.805
309 HA LEU 37 HA LEU 37 -10.834 -8.945 0.795
310 1HB LEU 37 2HB LEU 37 -9.684 -7.207 -1.388
311 2HB LEU 37 1HB LEU 37 -10.768 -8.574 -1.652
312 HG LEU 37 HG LEU 37 -11.394 -6.076 -0.050
313 1HD1 LEU 37 1HD2 LEU 37 -12.441 -7.182 -2.664
314 2HD1 LEU 37 2HD2 LEU 37 -11.465 -5.727 -2.461
315 3HD1 LEU 37 3HD2 LEU 37 -13.111 -5.780 -1.830
316 1HD2 LEU 37 1HD1 LEU 37 -12.714 -8.742 -0.284
317 2HD2 LEU 37 2HD1 LEU 37 -13.761 -7.323 -0.306
318 3HD2 LEU 37 3HD1 LEU 37 -12.698 -7.613 1.070
319 H ILE 38 H ILE 38 -7.612 -7.869 -0.370
320 HA ILE 38 HA ILE 38 -6.721 -10.387 -1.338
321 HB ILE 38 HB ILE 38 -5.657 -8.177 -1.723
322 1HG1 ILE 38 2HG1 ILE 38 -3.315 -8.918 -1.460
323 2HG1 ILE 38 1HG1 ILE 38 -3.841 -10.186 -0.351
324 1HG2 ILE 38 1HG2 ILE 38 -6.005 -7.570 0.786
325 2HG2 ILE 38 2HG2 ILE 38 -4.555 -6.985 -0.029
326 3HG2 ILE 38 3HG2 ILE 38 -4.464 -8.390 1.032
327 1HD1 ILE 38 1HD1 ILE 38 -5.325 -10.192 -2.876
328 2HD1 ILE 38 2HD1 ILE 38 -4.530 -11.524 -2.040
329 3HD1 ILE 38 3HD1 ILE 38 -3.596 -10.463 -3.094
330 H LEU 39 H LEU 39 -6.965 -9.156 1.943
331 HA LEU 39 HA LEU 39 -5.177 -11.012 3.196
332 1HB LEU 39 2HB LEU 39 -5.837 -8.918 4.212
333 2HB LEU 39 1HB LEU 39 -7.543 -9.355 4.112
334 HG LEU 39 HG LEU 39 -7.153 -11.233 5.627
335 1HD1 LEU 39 1HD1 LEU 39 -4.979 -11.976 5.476
336 2HD1 LEU 39 2HD1 LEU 39 -4.793 -10.921 6.877
337 3HD1 LEU 39 3HD1 LEU 39 -4.331 -10.348 5.276
338 1HD2 LEU 39 1HD2 LEU 39 -6.779 -9.918 7.673
339 2HD2 LEU 39 2HD2 LEU 39 -7.784 -9.014 6.540
340 3HD2 LEU 39 3HD2 LEU 39 -6.075 -8.615 6.715
341 H ILE 40 H ILE 40 -8.388 -11.329 1.928
342 HA ILE 40 HA ILE 40 -8.681 -13.940 3.327
343 HB ILE 40 HB ILE 40 -11.114 -13.519 3.178
344 1HG1 ILE 40 2HG1 ILE 40 -10.256 -10.872 1.964
345 2HG1 ILE 40 1HG1 ILE 40 -11.050 -12.182 1.091
346 1HG2 ILE 40 1HG2 ILE 40 -9.737 -11.066 4.287
347 2HG2 ILE 40 2HG2 ILE 40 -9.661 -12.636 5.084
348 3HG2 ILE 40 3HG2 ILE 40 -11.216 -11.832 4.867
349 1HD1 ILE 40 1HD1 ILE 40 -12.377 -10.115 2.290
350 2HD1 ILE 40 2HD1 ILE 40 -12.421 -11.333 3.566
351 3HD1 ILE 40 3HD1 ILE 40 -13.091 -11.698 1.976
352 H PHE 41 H PHE 41 -8.679 -12.254 0.280
353 HA PHE 41 HA PHE 41 -10.086 -14.119 -1.342
354 1HB PHE 41 2HB PHE 41 -9.407 -11.802 -1.942
355 2HB PHE 41 1HB PHE 41 -7.726 -12.330 -1.998
356 HD1 PHE 41 1HD PHE 41 -11.026 -13.572 -3.291
357 HD2 PHE 41 2HD PHE 41 -6.902 -12.730 -4.134
358 HE1 PHE 41 1HE PHE 41 -11.351 -14.330 -5.629
359 HE2 PHE 41 2HE PHE 41 -7.226 -13.489 -6.472
360 HZ PHE 41 HZ PHE 41 -9.451 -14.290 -7.220
361 H LEU 42 H LEU 42 -6.822 -14.165 -0.037
362 HA LEU 42 HA LEU 42 -5.563 -15.991 -1.789
363 1HB LEU 42 2HB LEU 42 -5.344 -15.644 1.218
364 2HB LEU 42 1HB LEU 42 -4.153 -16.472 0.215
365 HG LEU 42 HG LEU 42 -4.985 -13.570 -0.074
366 1HD1 LEU 42 1HD2 LEU 42 -2.615 -14.961 1.165
367 2HD1 LEU 42 2HD2 LEU 42 -3.609 -13.668 1.837
368 3HD1 LEU 42 3HD2 LEU 42 -2.469 -13.318 0.537
369 1HD2 LEU 42 1HD1 LEU 42 -4.230 -13.872 -2.188
370 2HD2 LEU 42 2HD1 LEU 42 -3.549 -15.453 -1.805
371 3HD2 LEU 42 3HD1 LEU 42 -2.626 -13.988 -1.463
372 H LEU 43 H LEU 43 -7.910 -16.580 0.786
373 HA LEU 43 HA LEU 43 -7.593 -19.500 0.545
374 1HB LEU 43 2HB LEU 43 -7.916 -18.210 2.713
375 2HB LEU 43 1HB LEU 43 -9.549 -17.841 2.167
376 HG LEU 43 HG LEU 43 -9.448 -19.810 3.704
377 1HD1 LEU 43 1HD2 LEU 43 -11.011 -19.491 1.526
378 2HD1 LEU 43 2HD2 LEU 43 -11.149 -20.875 2.610
379 3HD1 LEU 43 3HD2 LEU 43 -10.233 -21.018 1.109
380 1HD2 LEU 43 1HD1 LEU 43 -8.074 -21.579 3.354
381 2HD2 LEU 43 2HD1 LEU 43 -7.183 -20.468 2.313
382 3HD2 LEU 43 3HD1 LEU 43 -8.360 -21.579 1.612
383 H LEU 44 H LEU 44 -9.880 -16.914 -0.242
384 HA LEU 44 HA LEU 44 -12.117 -18.393 -1.071
385 1HB LEU 44 2HB LEU 44 -11.680 -15.867 -0.834
386 2HB LEU 44 1HB LEU 44 -10.974 -15.947 -2.448
387 HG LEU 44 HG LEU 44 -13.764 -16.878 -1.765
388 1HD1 LEU 44 1HD1 LEU 44 -13.263 -14.355 -1.559
389 2HD1 LEU 44 2HD1 LEU 44 -14.597 -14.823 -2.614
390 3HD1 LEU 44 3HD1 LEU 44 -13.036 -14.386 -3.308
391 1HD2 LEU 44 1HD2 LEU 44 -12.075 -16.843 -4.215
392 2HD2 LEU 44 2HD2 LEU 44 -13.769 -16.400 -4.422
393 3HD2 LEU 44 3HD2 LEU 44 -13.345 -17.972 -3.743
394 H ILE 45 H ILE 45 -9.102 -17.653 -2.830
395 HA ILE 45 HA ILE 45 -9.969 -18.814 -5.330
396 HB ILE 45 HB ILE 45 -7.601 -18.519 -5.923
397 1HG1 ILE 45 2HG1 ILE 45 -7.213 -17.939 -2.968
398 2HG1 ILE 45 1HG1 ILE 45 -6.655 -19.392 -3.796
399 1HG2 ILE 45 1HG2 ILE 45 -8.808 -16.482 -6.022
400 2HG2 ILE 45 2HG2 ILE 45 -7.365 -16.090 -5.088
401 3HG2 ILE 45 3HG2 ILE 45 -8.902 -16.356 -4.267
402 1HD1 ILE 45 1HD1 ILE 45 -5.659 -16.571 -4.040
403 2HD1 ILE 45 2HD1 ILE 45 -5.497 -17.664 -5.415
404 3HD1 ILE 45 3HD1 ILE 45 -4.738 -18.068 -3.874
405 H CYS 46 H CYS 46 -8.460 -20.073 -2.416
406 HA CYS 46 HA CYS 46 -7.342 -22.474 -3.397
407 1HB CYS 46 2HB CYS 46 -8.693 -21.818 -0.794
408 2HB CYS 46 1HB CYS 46 -7.673 -23.224 -1.043
409 HG CYS 46 HG CYS 46 -5.622 -21.733 -1.213
410 H ILE 47 H ILE 47 -10.681 -21.568 -3.070
411 HA ILE 47 HA ILE 47 -11.748 -24.257 -2.925
412 HB ILE 47 HB ILE 47 -12.857 -21.501 -3.514
413 1HG1 ILE 47 2HG1 ILE 47 -14.004 -21.890 -1.320
414 2HG1 ILE 47 1HG1 ILE 47 -13.134 -23.414 -1.171
415 1HG2 ILE 47 1HG2 ILE 47 -14.600 -22.525 -4.515
416 2HG2 ILE 47 2HG2 ILE 47 -15.028 -23.102 -2.905
417 3HG2 ILE 47 3HG2 ILE 47 -14.075 -24.121 -3.983
418 1HD1 ILE 47 1HD1 ILE 47 -11.672 -20.809 -1.593
419 2HD1 ILE 47 2HD1 ILE 47 -11.043 -22.331 -0.958
420 3HD1 ILE 47 3HD1 ILE 47 -12.138 -21.351 0.018
421 H ILE 48 H ILE 48 -11.789 -21.787 -5.533
422 HA ILE 48 HA ILE 48 -12.735 -23.525 -7.578
423 HB ILE 48 HB ILE 48 -12.670 -21.013 -7.550
424 1HG1 ILE 48 2HG1 ILE 48 -12.977 -22.300 -9.682
425 2HG1 ILE 48 1HG1 ILE 48 -12.227 -20.725 -9.919
426 1HG2 ILE 48 1HG2 ILE 48 -10.500 -19.965 -8.312
427 2HG2 ILE 48 2HG2 ILE 48 -9.718 -21.510 -7.983
428 3HG2 ILE 48 3HG2 ILE 48 -10.477 -20.608 -6.670
429 1HD1 ILE 48 1HD1 ILE 48 -10.691 -21.887 -11.123
430 2HD1 ILE 48 2HD1 ILE 48 -11.126 -23.423 -10.376
431 3HD1 ILE 48 3HD1 ILE 48 -10.024 -22.322 -9.552
432 H VAL 49 H VAL 49 -9.507 -22.910 -6.294
433 HA VAL 49 HA VAL 49 -8.080 -24.318 -8.400
434 HB VAL 49 HB VAL 49 -7.379 -23.609 -5.528
435 1HG1 VAL 49 1HG1 VAL 49 -6.010 -25.224 -7.433
436 2HG1 VAL 49 2HG1 VAL 49 -5.420 -24.662 -5.869
437 3HG1 VAL 49 3HG1 VAL 49 -5.136 -23.697 -7.316
438 1HG2 VAL 49 1HG2 VAL 49 -8.001 -21.715 -7.105
439 2HG2 VAL 49 2HG2 VAL 49 -6.617 -22.186 -8.092
440 3HG2 VAL 49 3HG2 VAL 49 -6.371 -21.624 -6.438
441 H MET 50 H MET 50 -9.567 -25.185 -5.319
442 HA MET 50 HA MET 50 -8.429 -27.730 -4.896
443 1HB MET 50 2HB MET 50 -9.816 -26.365 -3.353
444 2HB MET 50 1HB MET 50 -11.214 -26.732 -4.355
445 1HG MET 50 2HG MET 50 -10.941 -29.115 -3.937
446 2HG MET 50 1HG MET 50 -9.476 -28.779 -3.017
447 1HE MET 50 1HE MET 50 -13.058 -27.977 -3.557
448 2HE MET 50 2HE MET 50 -12.755 -26.413 -2.802
449 3HE MET 50 3HE MET 50 -13.766 -27.600 -1.980
450 H LEU 51 H LEU 51 -10.728 -26.657 -7.273
451 HA LEU 51 HA LEU 51 -11.653 -29.422 -7.839
452 1HB LEU 51 2HB LEU 51 -12.341 -26.712 -9.020
453 2HB LEU 51 1HB LEU 51 -13.186 -28.220 -9.372
454 HG LEU 51 HG LEU 51 -12.937 -26.943 -6.632
455 1HD1 LEU 51 1HD2 LEU 51 -15.605 -27.104 -7.237
456 2HD1 LEU 51 2HD2 LEU 51 -14.910 -26.745 -8.817
457 3HD1 LEU 51 3HD2 LEU 51 -14.622 -25.658 -7.460
458 1HD2 LEU 51 1HD1 LEU 51 -14.877 -28.778 -6.364
459 2HD2 LEU 51 2HD1 LEU 51 -13.180 -29.169 -6.088
460 3HD2 LEU 51 3HD1 LEU 51 -13.936 -29.572 -7.629
461 H LEU 52 H LEU 52 -8.869 -27.961 -8.532
462 HA LEU 52 HA LEU 52 -8.860 -28.752 -11.425
463 1HB LEU 52 2HB LEU 52 -7.086 -26.881 -9.820
464 2HB LEU 52 1HB LEU 52 -6.927 -27.192 -11.547
465 HG LEU 52 HG LEU 52 -9.363 -26.005 -10.184
466 1HD1 LEU 52 1HD1 LEU 52 -7.192 -24.822 -11.939
467 2HD1 LEU 52 2HD1 LEU 52 -7.580 -24.378 -10.278
468 3HD1 LEU 52 3HD1 LEU 52 -8.710 -23.998 -11.577
469 1HD2 LEU 52 1HD2 LEU 52 -9.623 -25.555 -12.871
470 2HD2 LEU 52 2HD2 LEU 52 -10.393 -26.890 -12.012
471 3HD2 LEU 52 3HD2 LEU 52 -8.869 -27.150 -12.862
Start of MODEL 4
1 1H MET 1 1HT MET 1 7.242 -9.727 7.278
2 2H MET 1 2HT MET 1 5.993 -9.316 6.203
3 H MET 1 H MET 1 6.400 -9.414 8.013
4 3H MET 1 3HT MET 1 5.814 -9.033 7.869
5 HA MET 1 HA MET 1 7.968 -7.745 6.303
6 1HB MET 1 2HB MET 1 6.352 -5.839 6.117
7 2HB MET 1 1HB MET 1 5.852 -7.262 5.225
8 1HG MET 1 2HG MET 1 4.383 -7.931 7.079
9 2HG MET 1 1HG MET 1 4.882 -6.497 7.962
10 1HE MET 1 1HE MET 1 1.300 -6.740 6.810
11 2HE MET 1 2HE MET 1 1.746 -5.269 7.672
12 3HE MET 1 3HE MET 1 2.473 -6.805 8.134
13 H ASP 2 H ASP 2 9.146 -6.459 7.588
14 HA ASP 2 HA ASP 2 8.113 -5.598 10.243
15 1HB ASP 2 2HB ASP 2 9.162 -7.808 10.550
16 2HB ASP 2 1HB ASP 2 10.630 -7.230 9.764
17 H LYS 3 H LYS 3 10.888 -5.587 7.996
18 HA LYS 3 HA LYS 3 11.553 -2.816 8.915
19 1HB LYS 3 2HB LYS 3 13.777 -3.332 7.987
20 2HB LYS 3 1HB LYS 3 13.281 -4.586 9.121
21 1HG LYS 3 2HG LYS 3 12.563 -6.016 7.252
22 2HG LYS 3 1HG LYS 3 13.012 -4.755 6.104
23 1HD LYS 3 2HD LYS 3 15.350 -4.893 6.850
24 2HD LYS 3 1HD LYS 3 14.910 -6.131 8.027
25 1HE LYS 3 2HE LYS 3 14.165 -7.620 6.194
26 2HE LYS 3 1HE LYS 3 14.627 -6.381 5.010
27 1HZ LYS 3 1HZ LYS 3 16.856 -6.529 5.595
28 2HZ LYS 3 2HZ LYS 3 16.359 -8.154 5.624
29 3HZ LYS 3 3HZ LYS 3 16.532 -7.288 7.076
30 H VAL 4 H VAL 4 10.439 -4.701 6.213
31 HA VAL 4 HA VAL 4 11.163 -2.870 4.100
32 HB VAL 4 HB VAL 4 10.590 -5.252 3.788
33 1HG1 VAL 4 1HG1 VAL 4 7.685 -4.789 4.086
34 2HG1 VAL 4 2HG1 VAL 4 8.594 -4.778 5.597
35 3HG1 VAL 4 3HG1 VAL 4 8.655 -6.191 4.543
36 1HG2 VAL 4 1HG2 VAL 4 9.752 -4.844 1.718
37 2HG2 VAL 4 2HG2 VAL 4 9.811 -3.145 2.187
38 3HG2 VAL 4 3HG2 VAL 4 8.312 -4.056 2.363
39 H GLN 5 H GLN 5 8.532 -3.004 6.414
40 HA GLN 5 HA GLN 5 6.805 -1.172 4.969
41 1HB GLN 5 2HB GLN 5 5.455 -1.323 7.010
42 2HB GLN 5 1HB GLN 5 6.025 -2.924 6.547
43 1HG GLN 5 2HG GLN 5 7.895 -2.700 8.181
44 2HG GLN 5 1HG GLN 5 7.239 -1.141 8.678
45 1HE2 GLN 5 1HE2 GLN 5 5.953 -1.294 10.509
46 2HE2 GLN 5 2HE2 GLN 5 5.015 -2.643 10.935
47 H TYR 6 H TYR 6 9.032 -0.860 7.759
48 HA TYR 6 HA TYR 6 8.462 1.915 8.245
49 1HB TYR 6 2HB TYR 6 10.865 0.167 8.849
50 2HB TYR 6 1HB TYR 6 10.604 1.765 9.543
51 HD1 TYR 6 1HD TYR 6 7.942 1.995 10.354
52 HD2 TYR 6 2HD TYR 6 10.352 -1.560 10.310
53 HE1 TYR 6 1HE TYR 6 6.514 1.005 12.123
54 HE2 TYR 6 2HE TYR 6 8.921 -2.554 12.076
55 HH TYR 6 HH TYR 6 5.924 -1.395 12.881
56 H LEU 7 H LEU 7 11.039 0.279 6.385
57 HA LEU 7 HA LEU 7 12.505 2.582 5.626
58 1HB LEU 7 2HB LEU 7 13.126 0.161 5.406
59 2HB LEU 7 1HB LEU 7 11.995 0.055 4.071
60 HG LEU 7 HG LEU 7 14.388 0.385 3.366
61 1HD1 LEU 7 1HD2 LEU 7 12.241 1.202 2.104
62 2HD1 LEU 7 2HD2 LEU 7 13.830 1.730 1.550
63 3HD1 LEU 7 3HD2 LEU 7 12.832 2.809 2.527
64 1HD2 LEU 7 1HD1 LEU 7 15.536 2.389 3.803
65 2HD2 LEU 7 2HD1 LEU 7 14.771 2.009 5.345
66 3HD2 LEU 7 3HD1 LEU 7 14.066 3.232 4.289
67 H THR 8 H THR 8 9.878 0.897 3.892
68 HA THR 8 HA THR 8 9.724 2.730 1.699
69 HB THR 8 HB THR 8 7.642 0.928 2.962
70 HG1 THR 8 1HG THR 8 9.471 0.463 0.846
71 1HG2 THR 8 1HG2 THR 8 7.118 0.918 0.306
72 2HG2 THR 8 2HG2 THR 8 7.726 2.563 0.491
73 3HG2 THR 8 3HG2 THR 8 6.340 2.024 1.439
74 H ARG 9 H ARG 9 8.037 2.602 4.836
75 HA ARG 9 HA ARG 9 6.101 4.598 4.432
76 1HB ARG 9 2HB ARG 9 6.275 3.136 6.389
77 2HB ARG 9 1HB ARG 9 7.768 3.931 6.846
78 1HG ARG 9 2HG ARG 9 6.003 4.857 8.212
79 2HG ARG 9 1HG ARG 9 6.487 6.089 7.051
80 1HD ARG 9 2HD ARG 9 4.177 4.214 6.481
81 2HD ARG 9 1HD ARG 9 3.951 5.736 7.362
82 HE ARG 9 HE ARG 9 5.477 6.347 5.067
83 1HH1 ARG 9 1HH1 ARG 9 2.314 6.049 6.236
84 2HH1 ARG 9 2HH1 ARG 9 1.553 6.293 4.699
85 1HH2 ARG 9 1HH2 ARG 9 4.529 6.266 2.919
86 2HH2 ARG 9 2HH2 ARG 9 2.805 6.416 2.823
87 H SER 10 H SER 10 9.442 4.952 5.614
88 HA SER 10 HA SER 10 9.346 7.844 5.682
89 1HB SER 10 2HB SER 10 11.778 7.549 6.100
90 2HB SER 10 1HB SER 10 10.813 6.464 7.098
91 HG SER 10 HG SER 10 11.486 4.792 5.950
92 H ALA 11 H ALA 11 9.876 5.485 3.197
93 HA ALA 11 HA ALA 11 11.458 7.215 1.463
94 1HB ALA 11 1HB ALA 11 11.751 4.819 1.409
95 2HB ALA 11 2HB ALA 11 11.026 5.294 -0.126
96 3HB ALA 11 3HB ALA 11 10.028 4.569 1.132
97 H ILE 12 H ILE 12 8.104 6.865 2.160
98 HA ILE 12 HA ILE 12 7.424 8.317 -0.340
99 HB ILE 12 HB ILE 12 5.822 6.334 1.245
100 1HG1 ILE 12 2HG1 ILE 12 7.143 6.129 -1.474
101 2HG1 ILE 12 1HG1 ILE 12 7.683 5.313 -0.007
102 1HG2 ILE 12 1HG2 ILE 12 5.226 7.850 -1.304
103 2HG2 ILE 12 2HG2 ILE 12 4.335 7.934 0.217
104 3HG2 ILE 12 3HG2 ILE 12 4.288 6.461 -0.752
105 1HD1 ILE 12 1HD1 ILE 12 5.595 4.538 -1.863
106 2HD1 ILE 12 2HD1 ILE 12 4.954 4.688 -0.228
107 3HD1 ILE 12 3HD1 ILE 12 6.313 3.609 -0.547
108 H ARG 13 H ARG 13 6.808 7.973 3.125
109 HA ARG 13 HA ARG 13 4.713 9.831 3.473
110 1HB ARG 13 2HB ARG 13 5.809 8.260 5.132
111 2HB ARG 13 1HB ARG 13 7.145 9.398 5.239
112 1HG ARG 13 2HG ARG 13 4.307 10.275 5.765
113 2HG ARG 13 1HG ARG 13 5.279 9.539 7.034
114 1HD ARG 13 2HD ARG 13 5.978 12.071 5.497
115 2HD ARG 13 1HD ARG 13 5.490 11.966 7.189
116 HE ARG 13 HE ARG 13 8.130 11.438 6.234
117 1HH1 ARG 13 1HH1 ARG 13 7.462 12.002 9.094
118 2HH1 ARG 13 2HH1 ARG 13 7.797 10.484 9.856
119 1HH2 ARG 13 1HH2 ARG 13 7.821 8.691 6.893
120 2HH2 ARG 13 2HH2 ARG 13 8.001 8.616 8.613
121 H ARG 14 H ARG 14 8.220 10.395 3.178
122 HA ARG 14 HA ARG 14 8.047 13.238 3.616
123 1HB ARG 14 2HB ARG 14 10.029 11.913 4.118
124 2HB ARG 14 1HB ARG 14 10.129 11.373 2.441
125 1HG ARG 14 2HG ARG 14 11.717 13.189 2.794
126 2HG ARG 14 1HG ARG 14 10.409 13.719 1.738
127 1HD ARG 14 2HD ARG 14 10.925 15.428 3.487
128 2HD ARG 14 1HD ARG 14 9.277 14.796 3.659
129 HE ARG 14 HE ARG 14 9.962 13.934 5.738
130 1HH1 ARG 14 1HH1 ARG 14 12.631 15.522 5.104
131 2HH1 ARG 14 2HH1 ARG 14 13.782 14.306 5.547
132 1HH2 ARG 14 1HH2 ARG 14 11.437 11.752 5.652
133 2HH2 ARG 14 2HH2 ARG 14 13.106 12.170 5.858
134 H ALA 15 H ALA 15 7.482 11.175 0.888
135 HA ALA 15 HA ALA 15 7.631 13.520 -0.940
136 1HB ALA 15 1HB ALA 15 7.825 11.578 -2.666
137 2HB ALA 15 2HB ALA 15 8.170 10.576 -1.255
138 3HB ALA 15 3HB ALA 15 9.224 11.934 -1.651
139 H SER 16 H SER 16 5.382 11.972 0.777
140 HA SER 16 HA SER 16 3.344 12.231 -1.351
141 1HB SER 16 2HB SER 16 3.809 9.945 0.520
142 2HB SER 16 1HB SER 16 2.347 10.129 -0.425
143 HG SER 16 HG SER 16 3.813 10.254 -2.283
144 H THR 17 H THR 17 4.274 13.328 1.543
145 HA THR 17 HA THR 17 1.488 13.698 2.502
146 HB THR 17 HB THR 17 4.053 13.374 4.086
147 HG1 THR 17 1HG THR 17 3.336 11.366 4.487
148 1HG2 THR 17 1HG2 THR 17 1.170 13.749 4.940
149 2HG2 THR 17 2HG2 THR 17 2.524 14.828 5.271
150 3HG2 THR 17 3HG2 THR 17 2.462 13.236 6.028
151 H ILE 18 H ILE 18 4.618 15.142 1.870
152 HA ILE 18 HA ILE 18 3.698 17.749 2.919
153 HB ILE 18 HB ILE 18 5.898 16.860 3.605
154 1HG1 ILE 18 2HG1 ILE 18 7.250 18.830 2.977
155 2HG1 ILE 18 1HG1 ILE 18 6.099 19.215 1.697
156 1HG2 ILE 18 1HG2 ILE 18 6.002 16.135 0.844
157 2HG2 ILE 18 2HG2 ILE 18 7.166 15.752 2.112
158 3HG2 ILE 18 3HG2 ILE 18 7.348 17.229 1.165
159 1HD1 ILE 18 1HD1 ILE 18 5.395 19.041 4.644
160 2HD1 ILE 18 2HD1 ILE 18 4.322 19.544 3.338
161 3HD1 ILE 18 3HD1 ILE 18 5.706 20.546 3.776
162 H GLU 19 H GLU 19 4.141 15.995 -0.027
163 HA GLU 19 HA GLU 19 3.751 18.503 -1.583
164 1HB GLU 19 2HB GLU 19 5.083 17.386 -3.348
165 2HB GLU 19 1HB GLU 19 5.996 17.519 -1.846
166 1HG GLU 19 2HG GLU 19 5.388 15.200 -1.265
167 2HG GLU 19 1HG GLU 19 4.475 15.061 -2.768
168 H MET 20 H MET 20 2.314 15.648 -0.608
169 HA MET 20 HA MET 20 0.202 15.855 -2.637
170 1HB MET 20 2HB MET 20 2.022 14.526 -3.716
171 2HB MET 20 1HB MET 20 1.931 13.371 -2.386
172 1HG MET 20 2HG MET 20 -0.446 12.947 -2.934
173 2HG MET 20 1HG MET 20 -0.324 14.070 -4.287
174 1HE MET 20 1HE MET 20 1.673 12.848 -6.827
175 2HE MET 20 2HE MET 20 2.934 12.889 -5.598
176 3HE MET 20 3HE MET 20 1.674 14.120 -5.597
177 HA PRO 21 HA PRO 21 -0.872 14.084 1.528
178 1HB PRO 21 2HB PRO 21 -2.161 16.245 2.589
179 2HB PRO 21 1HB PRO 21 -0.418 15.994 2.749
180 1HG PRO 21 2HG PRO 21 -1.884 17.877 1.058
181 2HG PRO 21 1HG PRO 21 -0.251 17.985 1.709
182 1HD PRO 21 2HD PRO 21 -0.979 17.287 -0.927
183 2HD PRO 21 1HD PRO 21 0.636 17.173 -0.200
184 H GLN 22 H GLN 22 -2.876 16.453 -0.265
185 HA GLN 22 HA GLN 22 -5.410 15.361 0.392
186 1HB GLN 22 2HB GLN 22 -4.441 16.795 -2.068
187 2HB GLN 22 1HB GLN 22 -6.131 16.621 -1.615
188 1HG GLN 22 2HG GLN 22 -5.672 17.807 0.507
189 2HG GLN 22 1HG GLN 22 -3.990 18.005 0.030
190 1HE2 GLN 22 1HE2 GLN 22 -5.792 18.301 -2.820
191 2HE2 GLN 22 2HE2 GLN 22 -5.974 19.984 -2.824
192 H GLN 23 H GLN 23 -3.360 14.749 -2.477
193 HA GLN 23 HA GLN 23 -5.107 12.758 -3.586
194 1HB GLN 23 2HB GLN 23 -3.503 14.042 -4.896
195 2HB GLN 23 1HB GLN 23 -2.187 13.356 -3.959
196 1HG GLN 23 2HG GLN 23 -2.401 12.181 -6.109
197 2HG GLN 23 1HG GLN 23 -2.771 11.096 -4.769
198 1HE2 GLN 23 1HE2 GLN 23 -3.912 12.099 -7.767
199 2HE2 GLN 23 2HE2 GLN 23 -5.544 11.668 -7.588
200 H ALA 24 H ALA 24 -1.984 12.470 -1.824
201 HA ALA 24 HA ALA 24 -1.812 9.662 -1.718
202 1HB ALA 24 1HB ALA 24 -0.588 10.121 0.451
203 2HB ALA 24 2HB ALA 24 -1.131 11.795 0.328
204 3HB ALA 24 3HB ALA 24 -0.060 11.122 -0.901
205 H ARG 25 H ARG 25 -3.760 11.856 0.291
206 HA ARG 25 HA ARG 25 -4.695 9.974 2.205
207 1HB ARG 25 2HB ARG 25 -4.943 12.416 2.348
208 2HB ARG 25 1HB ARG 25 -6.024 12.371 0.963
209 1HG ARG 25 2HG ARG 25 -7.601 10.955 2.216
210 2HG ARG 25 1HG ARG 25 -6.522 10.989 3.610
211 1HD ARG 25 2HD ARG 25 -7.801 13.440 2.345
212 2HD ARG 25 1HD ARG 25 -8.333 12.669 3.853
213 HE ARG 25 HE ARG 25 -6.058 14.408 3.612
214 1HH1 ARG 25 1HH1 ARG 25 -7.427 13.779 6.195
215 2HH1 ARG 25 2HH1 ARG 25 -6.224 12.856 7.032
216 1HH2 ARG 25 1HH2 ARG 25 -4.352 12.217 4.186
217 2HH2 ARG 25 2HH2 ARG 25 -4.483 11.971 5.895
218 H GLN 26 H GLN 26 -5.963 10.914 -0.977
219 HA GLN 26 HA GLN 26 -8.274 9.222 -0.931
220 1HB GLN 26 2HB GLN 26 -6.633 10.371 -3.177
221 2HB GLN 26 1HB GLN 26 -8.269 9.742 -3.351
222 1HG GLN 26 2HG GLN 26 -7.433 12.054 -1.581
223 2HG GLN 26 1HG GLN 26 -8.293 12.196 -3.114
224 1HE2 GLN 26 1HE2 GLN 26 -8.831 12.173 0.179
225 2HE2 GLN 26 2HE2 GLN 26 -10.437 11.625 0.192
226 H ASN 27 H ASN 27 -5.176 8.870 -2.672
227 HA ASN 27 HA ASN 27 -5.570 6.248 -3.640
228 1HB ASN 27 2HB ASN 27 -3.801 7.804 -4.336
229 2HB ASN 27 1HB ASN 27 -3.060 7.646 -2.750
230 1HD2 ASN 27 1HD2 ASN 27 -1.311 6.232 -2.802
231 2HD2 ASN 27 2HD2 ASN 27 -1.215 4.838 -3.766
232 H LEU 28 H LEU 28 -4.531 7.375 -0.470
233 HA LEU 28 HA LEU 28 -3.491 4.947 0.574
234 1HB LEU 28 2HB LEU 28 -3.224 7.157 1.581
235 2HB LEU 28 1HB LEU 28 -4.953 7.226 1.879
236 HG LEU 28 HG LEU 28 -4.800 5.268 3.359
237 1HD1 LEU 28 1HD2 LEU 28 -2.388 4.599 4.005
238 2HD1 LEU 28 2HD2 LEU 28 -1.905 5.391 2.504
239 3HD1 LEU 28 3HD2 LEU 28 -3.002 4.009 2.460
240 1HD2 LEU 28 1HD1 LEU 28 -3.056 7.664 3.862
241 2HD2 LEU 28 2HD1 LEU 28 -3.133 6.371 5.057
242 3HD2 LEU 28 3HD1 LEU 28 -4.599 7.238 4.603
243 H GLN 29 H GLN 29 -6.801 6.077 0.168
244 HA GLN 29 HA GLN 29 -8.156 4.340 1.936
245 1HB GLN 29 2HB GLN 29 -8.914 5.397 -0.775
246 2HB GLN 29 1HB GLN 29 -10.056 4.733 0.384
247 1HG GLN 29 2HG GLN 29 -9.359 6.466 2.022
248 2HG GLN 29 1HG GLN 29 -8.281 7.154 0.812
249 1HE2 GLN 29 1HE2 GLN 29 -10.979 6.066 -0.911
250 2HE2 GLN 29 2HE2 GLN 29 -11.875 7.503 -0.904
251 H ASN 30 H ASN 30 -6.810 3.735 -1.267
252 HA ASN 30 HA ASN 30 -8.107 1.289 -1.867
253 1HB ASN 30 2HB ASN 30 -6.781 2.627 -3.429
254 2HB ASN 30 1HB ASN 30 -5.335 2.271 -2.495
255 1HD2 ASN 30 1HD2 ASN 30 -4.118 0.632 -3.448
256 2HD2 ASN 30 2HD2 ASN 30 -4.761 -0.691 -4.293
257 H LEU 31 H LEU 31 -5.078 1.899 -0.084
258 HA LEU 31 HA LEU 31 -4.216 -0.736 0.335
259 1HB LEU 31 2HB LEU 31 -3.000 1.309 0.935
260 2HB LEU 31 1HB LEU 31 -4.182 1.625 2.198
261 HG LEU 31 HG LEU 31 -3.568 -0.472 3.327
262 1HD1 LEU 31 1HD2 LEU 31 -2.308 -0.962 0.768
263 2HD1 LEU 31 2HD2 LEU 31 -2.611 -2.092 2.088
264 3HD1 LEU 31 3HD2 LEU 31 -1.131 -1.133 2.070
265 1HD2 LEU 31 1HD1 LEU 31 -2.089 1.864 3.229
266 2HD2 LEU 31 2HD1 LEU 31 -0.871 0.621 2.941
267 3HD2 LEU 31 3HD1 LEU 31 -1.860 0.566 4.400
268 H PHE 32 H PHE 32 -6.817 1.032 1.937
269 HA PHE 32 HA PHE 32 -7.208 -0.819 4.096
270 1HB PHE 32 2HB PHE 32 -7.968 1.536 4.053
271 2HB PHE 32 1HB PHE 32 -9.092 1.140 2.754
272 HD1 PHE 32 1HD PHE 32 -8.130 -0.331 6.077
273 HD2 PHE 32 2HD PHE 32 -11.298 0.859 3.432
274 HE1 PHE 32 1HE PHE 32 -9.805 -1.067 7.753
275 HE2 PHE 32 2HE PHE 32 -12.973 0.123 5.107
276 HZ PHE 32 HZ PHE 32 -12.226 -0.839 7.267
277 H ILE 33 H ILE 33 -9.243 -0.246 1.198
278 HA ILE 33 HA ILE 33 -10.830 -2.596 1.482
279 HB ILE 33 HB ILE 33 -10.045 -0.990 -0.940
280 1HG1 ILE 33 2HG1 ILE 33 -12.420 -0.766 0.926
281 2HG1 ILE 33 1HG1 ILE 33 -11.058 0.353 0.871
282 1HG2 ILE 33 1HG2 ILE 33 -12.350 -1.817 -1.726
283 2HG2 ILE 33 2HG2 ILE 33 -12.213 -3.027 -0.450
284 3HG2 ILE 33 3HG2 ILE 33 -11.031 -2.988 -1.759
285 1HD1 ILE 33 1HD1 ILE 33 -11.600 0.992 -1.406
286 2HD1 ILE 33 2HD1 ILE 33 -13.054 1.154 -0.421
287 3HD1 ILE 33 3HD1 ILE 33 -12.864 -0.236 -1.490
288 H ASN 34 H ASN 34 -7.705 -2.042 -0.072
289 HA ASN 34 HA ASN 34 -7.521 -4.437 -1.595
290 1HB ASN 34 2HB ASN 34 -6.005 -2.487 -1.746
291 2HB ASN 34 1HB ASN 34 -5.395 -2.840 -0.129
292 1HD2 ASN 34 1HD2 ASN 34 -4.651 -3.290 -3.351
293 2HD2 ASN 34 2HD2 ASN 34 -3.696 -4.686 -3.220
294 H PHE 35 H PHE 35 -6.362 -3.740 1.717
295 HA PHE 35 HA PHE 35 -5.384 -6.319 2.362
296 1HB PHE 35 2HB PHE 35 -5.094 -4.181 3.631
297 2HB PHE 35 1HB PHE 35 -6.783 -4.263 4.111
298 HD1 PHE 35 1HD PHE 35 -5.429 -4.045 6.394
299 HD2 PHE 35 2HD PHE 35 -5.538 -7.585 3.959
300 HE1 PHE 35 1HE PHE 35 -4.791 -5.417 8.356
301 HE2 PHE 35 2HE PHE 35 -4.906 -8.954 5.925
302 HZ PHE 35 HZ PHE 35 -4.531 -7.871 8.122
303 H CYS 36 H CYS 36 -8.632 -4.913 2.843
304 HA CYS 36 HA CYS 36 -9.863 -7.171 4.057
305 1HB CYS 36 2HB CYS 36 -10.969 -4.999 2.246
306 2HB CYS 36 1HB CYS 36 -11.936 -6.006 3.321
307 HG CYS 36 HG CYS 36 -10.415 -4.940 5.319
308 H LEU 37 H LEU 37 -8.980 -6.535 0.746
309 HA LEU 37 HA LEU 37 -10.750 -8.610 -0.343
310 1HB LEU 37 2HB LEU 37 -10.328 -6.449 -1.469
311 2HB LEU 37 1HB LEU 37 -8.616 -6.854 -1.582
312 HG LEU 37 HG LEU 37 -10.750 -8.650 -2.750
313 1HD1 LEU 37 1HD1 LEU 37 -10.578 -6.120 -3.569
314 2HD1 LEU 37 2HD1 LEU 37 -10.790 -7.439 -4.719
315 3HD1 LEU 37 3HD1 LEU 37 -9.188 -6.752 -4.450
316 1HD2 LEU 37 1HD2 LEU 37 -8.592 -8.955 -4.305
317 2HD2 LEU 37 2HD2 LEU 37 -8.771 -9.852 -2.797
318 3HD2 LEU 37 3HD2 LEU 37 -7.770 -8.402 -2.845
319 H ILE 38 H ILE 38 -7.240 -8.041 0.002
320 HA ILE 38 HA ILE 38 -6.450 -10.592 -1.109
321 HB ILE 38 HB ILE 38 -5.074 -8.516 -0.981
322 1HG1 ILE 38 2HG1 ILE 38 -3.911 -10.887 0.516
323 2HG1 ILE 38 1HG1 ILE 38 -3.972 -10.715 -1.238
324 1HG2 ILE 38 1HG2 ILE 38 -4.187 -7.722 1.084
325 2HG2 ILE 38 2HG2 ILE 38 -4.723 -9.161 1.951
326 3HG2 ILE 38 3HG2 ILE 38 -5.905 -7.982 1.384
327 1HD1 ILE 38 1HD1 ILE 38 -1.781 -10.015 -0.610
328 2HD1 ILE 38 2HD1 ILE 38 -2.394 -9.058 0.738
329 3HD1 ILE 38 3HD1 ILE 38 -2.678 -8.529 -0.921
330 H LEU 39 H LEU 39 -7.590 -9.621 2.020
331 HA LEU 39 HA LEU 39 -6.324 -11.661 3.589
332 1HB LEU 39 2HB LEU 39 -7.150 -9.598 4.539
333 2HB LEU 39 1HB LEU 39 -8.772 -9.909 3.919
334 HG LEU 39 HG LEU 39 -8.928 -11.903 5.323
335 1HD1 LEU 39 1HD1 LEU 39 -6.238 -11.021 6.407
336 2HD1 LEU 39 2HD1 LEU 39 -6.508 -12.431 5.383
337 3HD1 LEU 39 3HD1 LEU 39 -7.196 -12.376 7.006
338 1HD2 LEU 39 1HD2 LEU 39 -8.393 -9.208 6.490
339 2HD2 LEU 39 2HD2 LEU 39 -8.579 -10.559 7.608
340 3HD2 LEU 39 3HD2 LEU 39 -9.883 -10.151 6.492
341 H ILE 40 H ILE 40 -9.073 -11.696 1.442
342 HA ILE 40 HA ILE 40 -9.712 -14.434 2.414
343 HB ILE 40 HB ILE 40 -12.094 -13.880 2.000
344 1HG1 ILE 40 2HG1 ILE 40 -10.984 -11.112 1.420
345 2HG1 ILE 40 1HG1 ILE 40 -11.722 -12.192 0.235
346 1HG2 ILE 40 1HG2 ILE 40 -11.066 -11.638 3.701
347 2HG2 ILE 40 2HG2 ILE 40 -10.692 -13.293 4.180
348 3HG2 ILE 40 3HG2 ILE 40 -12.371 -12.781 4.022
349 1HD1 ILE 40 1HD1 ILE 40 -13.793 -12.196 1.730
350 2HD1 ILE 40 2HD1 ILE 40 -13.450 -10.680 0.897
351 3HD1 ILE 40 3HD1 ILE 40 -13.047 -10.858 2.605
352 H PHE 41 H PHE 41 -9.733 -12.175 -0.327
353 HA PHE 41 HA PHE 41 -10.719 -13.865 -2.355
354 1HB PHE 41 2HB PHE 41 -10.224 -11.452 -2.554
355 2HB PHE 41 1HB PHE 41 -8.499 -11.800 -2.451
356 HD1 PHE 41 1HD PHE 41 -11.455 -13.128 -4.359
357 HD2 PHE 41 2HD PHE 41 -7.371 -11.800 -4.480
358 HE1 PHE 41 1HE PHE 41 -11.390 -13.549 -6.803
359 HE2 PHE 41 2HE PHE 41 -7.307 -12.219 -6.923
360 HZ PHE 41 HZ PHE 41 -9.316 -13.093 -8.084
361 H LEU 42 H LEU 42 -7.645 -13.962 -0.688
362 HA LEU 42 HA LEU 42 -6.342 -15.629 -2.689
363 1HB LEU 42 2HB LEU 42 -5.087 -13.998 -1.420
364 2HB LEU 42 1HB LEU 42 -5.684 -14.660 0.103
365 HG LEU 42 HG LEU 42 -4.552 -16.777 -0.376
366 1HD1 LEU 42 1HD1 LEU 42 -3.965 -15.360 -2.944
367 2HD1 LEU 42 2HD1 LEU 42 -4.396 -17.048 -2.673
368 3HD1 LEU 42 3HD1 LEU 42 -2.761 -16.490 -2.322
369 1HD2 LEU 42 1HD2 LEU 42 -3.421 -14.690 0.712
370 2HD2 LEU 42 2HD2 LEU 42 -2.497 -14.618 -0.790
371 3HD2 LEU 42 3HD2 LEU 42 -2.403 -16.049 0.237
372 H LEU 43 H LEU 43 -7.046 -16.130 0.788
373 HA LEU 43 HA LEU 43 -6.703 -18.950 0.737
374 1HB LEU 43 2HB LEU 43 -7.849 -18.811 2.942
375 2HB LEU 43 1HB LEU 43 -6.615 -17.570 2.751
376 HG LEU 43 HG LEU 43 -8.496 -15.998 2.007
377 1HD1 LEU 43 1HD2 LEU 43 -10.451 -17.088 1.572
378 2HD1 LEU 43 2HD2 LEU 43 -10.675 -17.020 3.320
379 3HD1 LEU 43 3HD2 LEU 43 -10.008 -18.470 2.573
380 1HD2 LEU 43 1HD1 LEU 43 -7.662 -15.619 4.175
381 2HD2 LEU 43 2HD1 LEU 43 -8.243 -17.176 4.767
382 3HD2 LEU 43 3HD1 LEU 43 -9.386 -15.869 4.455
383 H LEU 44 H LEU 44 -9.292 -17.067 -0.510
384 HA LEU 44 HA LEU 44 -11.332 -19.121 -0.179
385 1HB LEU 44 2HB LEU 44 -11.882 -16.767 -0.020
386 2HB LEU 44 1HB LEU 44 -11.155 -16.452 -1.595
387 HG LEU 44 HG LEU 44 -12.810 -17.901 -2.657
388 1HD1 LEU 44 1HD1 LEU 44 -13.212 -19.442 -0.790
389 2HD1 LEU 44 2HD1 LEU 44 -14.736 -18.734 -1.321
390 3HD1 LEU 44 3HD1 LEU 44 -13.951 -18.142 0.143
391 1HD2 LEU 44 1HD2 LEU 44 -13.447 -15.610 -2.608
392 2HD2 LEU 44 2HD2 LEU 44 -13.819 -15.673 -0.885
393 3HD2 LEU 44 3HD2 LEU 44 -14.873 -16.481 -2.045
394 H ILE 45 H ILE 45 -9.831 -17.513 -3.015
395 HA ILE 45 HA ILE 45 -10.879 -19.173 -5.027
396 HB ILE 45 HB ILE 45 -8.888 -18.391 -6.309
397 1HG1 ILE 45 2HG1 ILE 45 -7.994 -17.337 -3.605
398 2HG1 ILE 45 1HG1 ILE 45 -7.240 -18.675 -4.472
399 1HG2 ILE 45 1HG2 ILE 45 -9.194 -15.870 -5.507
400 2HG2 ILE 45 2HG2 ILE 45 -10.513 -16.574 -4.574
401 3HG2 ILE 45 3HG2 ILE 45 -10.495 -16.728 -6.329
402 1HD1 ILE 45 1HD1 ILE 45 -5.931 -16.731 -4.971
403 2HD1 ILE 45 2HD1 ILE 45 -7.370 -15.770 -5.311
404 3HD1 ILE 45 3HD1 ILE 45 -6.892 -17.062 -6.412
405 H CYS 46 H CYS 46 -8.404 -19.902 -2.679
406 HA CYS 46 HA CYS 46 -6.964 -21.943 -4.013
407 1HB CYS 46 2HB CYS 46 -6.355 -20.917 -1.871
408 2HB CYS 46 1HB CYS 46 -7.764 -21.661 -1.128
409 HG CYS 46 HG CYS 46 -6.151 -23.841 -2.368
410 H ILE 47 H ILE 47 -10.106 -22.049 -2.391
411 HA ILE 47 HA ILE 47 -10.297 -24.947 -2.581
412 HB ILE 47 HB ILE 47 -12.171 -22.700 -1.792
413 1HG1 ILE 47 2HG1 ILE 47 -11.911 -23.779 0.472
414 2HG1 ILE 47 1HG1 ILE 47 -10.697 -24.845 -0.229
415 1HG2 ILE 47 1HG2 ILE 47 -13.429 -24.810 -0.788
416 2HG2 ILE 47 2HG2 ILE 47 -12.662 -25.623 -2.151
417 3HG2 ILE 47 3HG2 ILE 47 -13.743 -24.259 -2.435
418 1HD1 ILE 47 1HD1 ILE 47 -9.886 -22.694 0.973
419 2HD1 ILE 47 2HD1 ILE 47 -10.444 -21.853 -0.473
420 3HD1 ILE 47 3HD1 ILE 47 -9.182 -23.078 -0.597
421 H ILE 48 H ILE 48 -11.057 -22.219 -4.584
422 HA ILE 48 HA ILE 48 -12.978 -23.696 -6.233
423 HB ILE 48 HB ILE 48 -11.764 -20.954 -6.410
424 1HG1 ILE 48 2HG1 ILE 48 -14.458 -21.899 -5.395
425 2HG1 ILE 48 1HG1 ILE 48 -13.130 -21.323 -4.387
426 1HG2 ILE 48 1HG2 ILE 48 -13.853 -20.570 -7.858
427 2HG2 ILE 48 2HG2 ILE 48 -13.952 -22.328 -7.966
428 3HG2 ILE 48 3HG2 ILE 48 -12.535 -21.483 -8.591
429 1HD1 ILE 48 1HD1 ILE 48 -15.153 -19.749 -5.476
430 2HD1 ILE 48 2HD1 ILE 48 -13.771 -19.447 -6.530
431 3HD1 ILE 48 3HD1 ILE 48 -13.636 -19.161 -4.796
432 H VAL 49 H VAL 49 -9.684 -22.382 -6.484
433 HA VAL 49 HA VAL 49 -9.238 -23.038 -9.234
434 HB VAL 49 HB VAL 49 -7.881 -21.488 -7.857
435 1HG1 VAL 49 1HG2 VAL 49 -8.002 -23.049 -5.814
436 2HG1 VAL 49 2HG2 VAL 49 -6.456 -22.254 -6.110
437 3HG1 VAL 49 3HG2 VAL 49 -6.681 -23.943 -6.563
438 1HG2 VAL 49 1HG1 VAL 49 -6.534 -22.011 -9.628
439 2HG2 VAL 49 2HG1 VAL 49 -6.743 -23.747 -9.401
440 3HG2 VAL 49 3HG1 VAL 49 -5.593 -22.858 -8.401
441 H MET 50 H MET 50 -8.626 -24.891 -6.233
442 HA MET 50 HA MET 50 -7.297 -27.106 -7.394
443 1HB MET 50 2HB MET 50 -9.152 -26.857 -5.043
444 2HB MET 50 1HB MET 50 -8.140 -28.266 -5.341
445 1HG MET 50 2HG MET 50 -7.110 -25.432 -5.023
446 2HG MET 50 1HG MET 50 -7.083 -26.657 -3.754
447 1HE MET 50 1HE MET 50 -6.390 -28.898 -4.112
448 2HE MET 50 2HE MET 50 -4.816 -29.331 -4.776
449 3HE MET 50 3HE MET 50 -6.248 -29.408 -5.800
450 H LEU 51 H LEU 51 -10.605 -26.134 -7.656
451 HA LEU 51 HA LEU 51 -11.489 -28.861 -8.449
452 1HB LEU 51 2HB LEU 51 -12.943 -26.218 -8.106
453 2HB LEU 51 1HB LEU 51 -13.720 -27.773 -8.406
454 HG LEU 51 HG LEU 51 -11.986 -27.100 -6.011
455 1HD1 LEU 51 1HD1 LEU 51 -13.921 -26.183 -5.261
456 2HD1 LEU 51 2HD1 LEU 51 -14.495 -27.845 -5.125
457 3HD1 LEU 51 3HD1 LEU 51 -14.863 -26.900 -6.567
458 1HD2 LEU 51 1HD2 LEU 51 -13.486 -29.610 -6.812
459 2HD2 LEU 51 2HD2 LEU 51 -12.816 -29.336 -5.203
460 3HD2 LEU 51 3HD2 LEU 51 -11.742 -29.439 -6.599
461 H LEU 52 H LEU 52 -11.233 -25.557 -9.787
462 HA LEU 52 HA LEU 52 -11.836 -26.650 -12.503
463 1HB LEU 52 2HB LEU 52 -11.681 -23.829 -11.387
464 2HB LEU 52 1HB LEU 52 -12.181 -24.245 -13.027
465 HG LEU 52 HG LEU 52 -13.552 -25.170 -10.486
466 1HD1 LEU 52 1HD2 LEU 52 -13.689 -22.682 -11.589
467 2HD1 LEU 52 2HD2 LEU 52 -15.023 -23.444 -10.724
468 3HD1 LEU 52 3HD2 LEU 52 -14.965 -23.507 -12.486
469 1HD2 LEU 52 1HD1 LEU 52 -13.928 -26.863 -12.078
470 2HD2 LEU 52 2HD1 LEU 52 -13.973 -25.719 -13.420
471 3HD2 LEU 52 3HD1 LEU 52 -15.323 -25.803 -12.287
Start of MODEL 5
1 1H MET 1 1HT MET 1 22.635 10.685 14.190
2 2H MET 1 2HT MET 1 21.288 10.663 15.227
3 H MET 1 H MET 1 21.652 11.106 15.716
4 3H MET 1 3HT MET 1 22.575 11.731 15.525
5 HA MET 1 HA MET 1 22.053 13.073 13.679
6 1HB MET 1 2HB MET 1 20.321 12.261 12.072
7 2HB MET 1 1HB MET 1 21.721 11.210 12.159
8 1HG MET 1 2HG MET 1 20.539 9.716 13.704
9 2HG MET 1 1HG MET 1 19.138 10.778 13.630
10 1HE MET 1 1HE MET 1 21.389 9.887 10.277
11 2HE MET 1 2HE MET 1 20.985 8.176 10.419
12 3HE MET 1 3HE MET 1 21.741 9.012 11.773
13 H ASP 2 H ASP 2 20.693 14.706 14.099
14 HA ASP 2 HA ASP 2 18.295 14.170 15.826
15 1HB ASP 2 2HB ASP 2 20.178 16.552 15.749
16 2HB ASP 2 1HB ASP 2 18.797 16.380 16.831
17 H LYS 3 H LYS 3 19.702 16.273 13.314
18 HA LYS 3 HA LYS 3 16.955 17.128 12.544
19 1HB LYS 3 2HB LYS 3 18.400 18.920 13.264
20 2HB LYS 3 1HB LYS 3 19.692 18.333 12.229
21 1HG LYS 3 2HG LYS 3 18.300 18.749 10.250
22 2HG LYS 3 1HG LYS 3 17.022 19.390 11.282
23 1HD LYS 3 2HD LYS 3 19.831 20.514 11.046
24 2HD LYS 3 1HD LYS 3 18.382 21.222 10.335
25 1HE LYS 3 2HE LYS 3 17.406 21.516 12.589
26 2HE LYS 3 1HE LYS 3 18.869 20.811 13.309
27 1HZ LYS 3 1HZ LYS 3 20.200 22.522 12.378
28 2HZ LYS 3 2HZ LYS 3 18.890 23.293 13.135
29 3HZ LYS 3 3HZ LYS 3 18.915 23.122 11.446
30 H VAL 4 H VAL 4 19.982 15.708 11.432
31 HA VAL 4 HA VAL 4 19.678 15.828 8.642
32 HB VAL 4 HB VAL 4 20.711 13.596 10.376
33 1HG1 VAL 4 1HG2 VAL 4 20.742 12.618 8.282
34 2HG1 VAL 4 2HG2 VAL 4 22.272 13.493 8.217
35 3HG1 VAL 4 3HG2 VAL 4 20.835 14.170 7.451
36 1HG2 VAL 4 1HG1 VAL 4 22.636 15.404 9.128
37 2HG2 VAL 4 2HG1 VAL 4 22.525 14.875 10.807
38 3HG2 VAL 4 3HG1 VAL 4 21.553 16.234 10.244
39 H GLN 5 H GLN 5 18.092 13.697 10.970
40 HA GLN 5 HA GLN 5 16.975 11.873 9.054
41 1HB GLN 5 2HB GLN 5 15.599 11.192 10.980
42 2HB GLN 5 1HB GLN 5 17.267 11.451 11.483
43 1HG GLN 5 2HG GLN 5 16.656 13.741 12.246
44 2HG GLN 5 1HG GLN 5 14.979 13.414 11.809
45 1HE2 GLN 5 1HE2 GLN 5 17.001 13.429 14.445
46 2HE2 GLN 5 2HE2 GLN 5 16.219 12.269 15.405
47 H TYR 6 H TYR 6 15.711 14.847 10.575
48 HA TYR 6 HA TYR 6 13.176 14.643 9.132
49 1HB TYR 6 2HB TYR 6 13.392 15.548 11.432
50 2HB TYR 6 1HB TYR 6 14.416 16.843 10.816
51 HD1 TYR 6 1HD TYR 6 13.364 18.243 8.800
52 HD2 TYR 6 2HD TYR 6 11.104 15.925 11.625
53 HE1 TYR 6 1HE TYR 6 11.334 19.553 8.252
54 HE2 TYR 6 2HE TYR 6 9.076 17.243 11.081
55 HH TYR 6 HH TYR 6 8.611 19.597 10.142
56 H LEU 7 H LEU 7 16.185 16.490 8.911
57 HA LEU 7 HA LEU 7 15.466 18.422 6.991
58 1HB LEU 7 2HB LEU 7 17.579 18.196 8.328
59 2HB LEU 7 1HB LEU 7 18.053 16.903 7.243
60 HG LEU 7 HG LEU 7 17.400 19.700 6.301
61 1HD1 LEU 7 1HD2 LEU 7 19.925 19.847 6.013
62 2HD1 LEU 7 2HD2 LEU 7 20.037 18.413 7.033
63 3HD1 LEU 7 3HD2 LEU 7 19.348 19.902 7.678
64 1HD2 LEU 7 1HD1 LEU 7 17.310 18.541 4.341
65 2HD2 LEU 7 2HD1 LEU 7 18.185 17.159 5.006
66 3HD2 LEU 7 3HD1 LEU 7 19.069 18.584 4.458
67 H THR 8 H THR 8 16.349 15.009 6.571
68 HA THR 8 HA THR 8 16.478 15.122 3.684
69 HB THR 8 HB THR 8 16.011 12.812 5.577
70 HG1 THR 8 1HG THR 8 18.224 12.679 5.659
71 1HG2 THR 8 1HG2 THR 8 16.378 13.037 2.691
72 2HG2 THR 8 2HG2 THR 8 15.846 11.656 3.650
73 3HG2 THR 8 3HG2 THR 8 17.568 11.974 3.440
74 H ARG 9 H ARG 9 13.937 14.411 6.046
75 HA ARG 9 HA ARG 9 11.984 13.172 4.490
76 1HB ARG 9 2HB ARG 9 11.840 13.672 6.899
77 2HB ARG 9 1HB ARG 9 11.701 15.372 6.519
78 1HG ARG 9 2HG ARG 9 9.486 14.338 6.984
79 2HG ARG 9 1HG ARG 9 9.595 15.036 5.374
80 1HD ARG 9 2HD ARG 9 8.515 12.896 5.126
81 2HD ARG 9 1HD ARG 9 10.163 12.681 4.528
82 HE ARG 9 HE ARG 9 9.040 11.404 6.876
83 1HH1 ARG 9 1HH1 ARG 9 11.564 10.967 4.946
84 2HH1 ARG 9 2HH1 ARG 9 12.783 10.807 6.167
85 1HH2 ARG 9 1HH2 ARG 9 10.752 11.974 8.724
86 2HH2 ARG 9 2HH2 ARG 9 12.322 11.373 8.306
87 H SER 10 H SER 10 12.893 16.580 4.551
88 HA SER 10 HA SER 10 10.746 17.597 2.967
89 1HB SER 10 2HB SER 10 12.321 19.490 2.656
90 2HB SER 10 1HB SER 10 12.303 18.940 4.329
91 HG SER 10 HG SER 10 14.268 18.690 2.363
92 H ALA 11 H ALA 11 13.457 15.610 2.138
93 HA ALA 11 HA ALA 11 13.471 16.418 -0.689
94 1HB ALA 11 1HB ALA 11 14.988 14.071 -0.206
95 2HB ALA 11 2HB ALA 11 15.183 15.104 1.211
96 3HB ALA 11 3HB ALA 11 15.591 15.717 -0.392
97 H ILE 12 H ILE 12 12.003 13.971 1.322
98 HA ILE 12 HA ILE 12 11.404 12.236 -0.968
99 HB ILE 12 HB ILE 12 10.839 12.087 1.979
100 1HG1 ILE 12 2HG1 ILE 12 12.435 10.122 1.794
101 2HG1 ILE 12 1HG1 ILE 12 12.782 10.655 0.152
102 1HG2 ILE 12 1HG2 ILE 12 10.319 9.617 1.316
103 2HG2 ILE 12 2HG2 ILE 12 10.032 10.291 -0.289
104 3HG2 ILE 12 3HG2 ILE 12 9.070 10.841 1.084
105 1HD1 ILE 12 1HD1 ILE 12 13.821 12.627 0.875
106 2HD1 ILE 12 2HD1 ILE 12 14.331 11.461 2.095
107 3HD1 ILE 12 3HD1 ILE 12 13.019 12.586 2.444
108 H ARG 13 H ARG 13 9.625 14.240 1.391
109 HA ARG 13 HA ARG 13 6.988 13.676 0.564
110 1HB ARG 13 2HB ARG 13 8.254 16.279 1.486
111 2HB ARG 13 1HB ARG 13 6.522 15.949 1.486
112 1HG ARG 13 2HG ARG 13 6.895 14.033 3.011
113 2HG ARG 13 1HG ARG 13 8.621 14.395 3.033
114 1HD ARG 13 2HD ARG 13 7.513 15.370 5.019
115 2HD ARG 13 1HD ARG 13 8.097 16.664 3.954
116 HE ARG 13 HE ARG 13 5.473 15.976 3.122
117 1HH1 ARG 13 1HH1 ARG 13 6.280 16.366 6.318
118 2HH1 ARG 13 2HH1 ARG 13 5.339 17.796 6.583
119 1HH2 ARG 13 1HH2 ARG 13 4.612 18.261 3.225
120 2HH2 ARG 13 2HH2 ARG 13 4.398 18.869 4.835
121 H ARG 14 H ARG 14 9.315 16.009 -0.786
122 HA ARG 14 HA ARG 14 7.623 17.279 -2.670
123 1HB ARG 14 2HB ARG 14 10.564 16.534 -2.792
124 2HB ARG 14 1HB ARG 14 9.792 17.736 -3.827
125 1HG ARG 14 2HG ARG 14 9.186 19.077 -1.870
126 2HG ARG 14 1HG ARG 14 9.876 17.858 -0.796
127 1HD ARG 14 2HD ARG 14 11.473 19.724 -1.153
128 2HD ARG 14 1HD ARG 14 12.106 18.221 -1.854
129 HE ARG 14 HE ARG 14 10.523 19.545 -3.826
130 1HH1 ARG 14 1HH1 ARG 14 12.294 21.685 -2.378
131 2HH1 ARG 14 2HH1 ARG 14 13.619 21.766 -3.491
132 1HH2 ARG 14 1HH2 ARG 14 12.751 18.844 -5.146
133 2HH2 ARG 14 2HH2 ARG 14 13.880 20.155 -5.056
134 H ALA 15 H ALA 15 8.868 14.036 -2.630
135 HA ALA 15 HA ALA 15 8.385 13.657 -5.516
136 1HB ALA 15 1HB ALA 15 10.325 12.799 -3.858
137 2HB ALA 15 2HB ALA 15 9.844 11.893 -5.293
138 3HB ALA 15 3HB ALA 15 9.206 11.443 -3.711
139 H SER 16 H SER 16 6.749 13.185 -2.515
140 HA SER 16 HA SER 16 4.737 11.507 -3.907
141 1HB SER 16 2HB SER 16 6.151 10.128 -2.468
142 2HB SER 16 1HB SER 16 5.815 11.203 -1.122
143 HG SER 16 HG SER 16 4.395 9.128 -1.990
144 H THR 17 H THR 17 5.058 14.464 -2.906
145 HA THR 17 HA THR 17 2.409 14.556 -1.556
146 HB THR 17 HB THR 17 4.863 16.270 -1.096
147 HG1 THR 17 1HG THR 17 3.628 14.165 0.324
148 1HG2 THR 17 1HG2 THR 17 2.896 17.606 -0.733
149 2HG2 THR 17 2HG2 THR 17 3.491 17.114 0.851
150 3HG2 THR 17 3HG2 THR 17 2.101 16.295 0.139
151 H ILE 18 H ILE 18 4.579 15.967 -3.935
152 HA ILE 18 HA ILE 18 2.643 18.091 -4.569
153 HB ILE 18 HB ILE 18 5.386 17.435 -5.601
154 1HG1 ILE 18 2HG1 ILE 18 4.432 19.513 -3.612
155 2HG1 ILE 18 1HG1 ILE 18 5.361 18.065 -3.220
156 1HG2 ILE 18 1HG2 ILE 18 5.209 19.923 -6.314
157 2HG2 ILE 18 2HG2 ILE 18 3.470 19.696 -6.129
158 3HG2 ILE 18 3HG2 ILE 18 4.368 18.722 -7.294
159 1HD1 ILE 18 1HD1 ILE 18 6.849 20.015 -3.371
160 2HD1 ILE 18 2HD1 ILE 18 6.283 20.332 -5.012
161 3HD1 ILE 18 3HD1 ILE 18 7.205 18.871 -4.665
162 H GLU 19 H GLU 19 3.589 14.953 -5.666
163 HA GLU 19 HA GLU 19 2.396 15.411 -8.332
164 1HB GLU 19 2HB GLU 19 4.633 14.439 -8.190
165 2HB GLU 19 1HB GLU 19 4.000 13.155 -7.172
166 1HG GLU 19 2HG GLU 19 2.516 12.417 -8.998
167 2HG GLU 19 1HG GLU 19 3.150 13.702 -10.024
168 H MET 20 H MET 20 1.964 13.523 -5.379
169 HA MET 20 HA MET 20 -0.619 12.517 -6.507
170 1HB MET 20 2HB MET 20 1.367 11.124 -4.731
171 2HB MET 20 1HB MET 20 -0.154 10.431 -5.277
172 1HG MET 20 2HG MET 20 0.591 10.709 -7.625
173 2HG MET 20 1HG MET 20 2.136 11.330 -7.048
174 1HE MET 20 1HE MET 20 3.557 10.255 -5.430
175 2HE MET 20 2HE MET 20 3.825 8.522 -5.245
176 3HE MET 20 3HE MET 20 2.531 9.308 -4.343
177 HA PRO 21 HA PRO 21 -1.010 14.550 -2.262
178 1HB PRO 21 2HB PRO 21 -2.269 16.865 -3.003
179 2HB PRO 21 1HB PRO 21 -0.510 16.727 -2.880
180 1HG PRO 21 2HG PRO 21 -2.233 16.678 -5.275
181 2HG PRO 21 1HG PRO 21 -0.632 17.388 -5.057
182 1HD PRO 21 2HD PRO 21 -1.086 14.999 -6.326
183 2HD PRO 21 1HD PRO 21 0.440 15.426 -5.524
184 H GLN 22 H GLN 22 -3.035 14.050 -5.057
185 HA GLN 22 HA GLN 22 -5.492 14.025 -3.377
186 1HB GLN 22 2HB GLN 22 -5.015 13.936 -6.347
187 2HB GLN 22 1HB GLN 22 -6.606 13.987 -5.603
188 1HG GLN 22 2HG GLN 22 -4.453 16.084 -5.214
189 2HG GLN 22 1HG GLN 22 -5.798 16.238 -6.338
190 1HE2 GLN 22 1HE2 GLN 22 -7.254 14.597 -3.873
191 2HE2 GLN 22 2HE2 GLN 22 -7.743 15.896 -2.907
192 H GLN 23 H GLN 23 -3.451 11.950 -5.383
193 HA GLN 23 HA GLN 23 -5.254 9.666 -5.168
194 1HB GLN 23 2HB GLN 23 -3.865 10.108 -7.146
195 2HB GLN 23 1HB GLN 23 -2.427 9.960 -6.147
196 1HG GLN 23 2HG GLN 23 -3.024 7.626 -5.610
197 2HG GLN 23 1HG GLN 23 -4.462 7.770 -6.620
198 1HE2 GLN 23 1HE2 GLN 23 -4.143 6.903 -8.670
199 2HE2 GLN 23 2HE2 GLN 23 -2.668 6.899 -9.511
200 H ALA 24 H ALA 24 -2.110 10.626 -3.785
201 HA ALA 24 HA ALA 24 -1.640 8.255 -2.272
202 1HB ALA 24 1HB ALA 24 -0.101 10.231 -2.827
203 2HB ALA 24 2HB ALA 24 0.014 9.606 -1.182
204 3HB ALA 24 3HB ALA 24 -0.892 11.086 -1.502
205 H ARG 25 H ARG 25 -3.274 11.317 -1.413
206 HA ARG 25 HA ARG 25 -3.883 10.697 1.288
207 1HB ARG 25 2HB ARG 25 -4.076 12.903 0.194
208 2HB ARG 25 1HB ARG 25 -5.424 12.286 -0.750
209 1HG ARG 25 2HG ARG 25 -6.700 11.861 1.316
210 2HG ARG 25 1HG ARG 25 -5.351 12.480 2.270
211 1HD ARG 25 2HD ARG 25 -5.567 14.683 1.152
212 2HD ARG 25 1HD ARG 25 -6.942 14.064 0.218
213 HE ARG 25 HE ARG 25 -8.247 14.403 2.150
214 1HH1 ARG 25 1HH2 ARG 25 -5.749 15.880 3.295
215 2HH1 ARG 25 2HH2 ARG 25 -5.648 15.129 4.852
216 1HH2 ARG 25 1HH1 ARG 25 -7.788 12.528 4.030
217 2HH2 ARG 25 2HH1 ARG 25 -6.806 13.234 5.270
218 H GLN 26 H GLN 26 -5.897 10.275 -1.634
219 HA GLN 26 HA GLN 26 -8.019 8.877 -0.295
220 1HB GLN 26 2HB GLN 26 -7.148 8.927 -3.175
221 2HB GLN 26 1HB GLN 26 -8.740 8.440 -2.607
222 1HG GLN 26 2HG GLN 26 -7.504 11.182 -2.225
223 2HG GLN 26 1HG GLN 26 -8.734 10.785 -3.421
224 1HE2 GLN 26 1HE2 GLN 26 -10.825 11.244 -2.740
225 2HE2 GLN 26 2HE2 GLN 26 -11.341 11.282 -1.124
226 H ASN 27 H ASN 27 -5.372 7.750 -2.398
227 HA ASN 27 HA ASN 27 -5.849 5.001 -2.396
228 1HB ASN 27 2HB ASN 27 -4.105 6.164 -3.667
229 2HB ASN 27 1HB ASN 27 -3.243 6.487 -2.170
230 1HD2 ASN 27 1HD2 ASN 27 -3.285 4.368 -4.751
231 2HD2 ASN 27 2HD2 ASN 27 -2.562 3.023 -4.010
232 H LEU 28 H LEU 28 -4.542 6.994 0.195
233 HA LEU 28 HA LEU 28 -3.397 5.048 1.875
234 1HB LEU 28 2HB LEU 28 -3.499 7.590 2.058
235 2HB LEU 28 1HB LEU 28 -5.102 7.366 2.740
236 HG LEU 28 HG LEU 28 -3.328 7.594 4.487
237 1HD1 LEU 28 1HD1 LEU 28 -5.481 5.961 4.518
238 2HD1 LEU 28 2HD1 LEU 28 -4.381 6.119 5.886
239 3HD1 LEU 28 3HD1 LEU 28 -4.207 4.769 4.764
240 1HD2 LEU 28 1HD2 LEU 28 -1.750 6.163 2.874
241 2HD2 LEU 28 2HD2 LEU 28 -2.377 4.836 3.853
242 3HD2 LEU 28 3HD2 LEU 28 -1.519 6.170 4.622
243 H GLN 29 H GLN 29 -6.797 5.898 1.371
244 HA GLN 29 HA GLN 29 -7.860 4.314 3.520
245 1HB GLN 29 2HB GLN 29 -9.037 5.302 0.937
246 2HB GLN 29 1HB GLN 29 -9.977 4.695 2.292
247 1HG GLN 29 2HG GLN 29 -9.033 6.472 3.728
248 2HG GLN 29 1HG GLN 29 -8.117 7.088 2.356
249 1HE2 GLN 29 1HE2 GLN 29 -11.047 6.027 1.053
250 2HE2 GLN 29 2HE2 GLN 29 -11.902 7.485 1.136
251 H ASN 30 H ASN 30 -7.025 3.630 0.163
252 HA ASN 30 HA ASN 30 -8.413 1.195 -0.195
253 1HB ASN 30 2HB ASN 30 -7.275 2.478 -1.947
254 2HB ASN 30 1HB ASN 30 -5.728 2.091 -1.208
255 1HD2 ASN 30 1HD2 ASN 30 -4.699 0.385 -2.255
256 2HD2 ASN 30 2HD2 ASN 30 -5.489 -0.923 -2.993
257 H LEU 31 H LEU 31 -5.384 1.880 1.478
258 HA LEU 31 HA LEU 31 -4.407 -0.775 1.725
259 1HB LEU 31 2HB LEU 31 -3.139 1.266 2.210
260 2HB LEU 31 1HB LEU 31 -4.204 1.592 3.569
261 HG LEU 31 HG LEU 31 -3.499 -0.492 4.660
262 1HD1 LEU 31 1HD1 LEU 31 -1.280 -1.413 3.417
263 2HD1 LEU 31 2HD1 LEU 31 -2.204 -0.879 2.012
264 3HD1 LEU 31 3HD1 LEU 31 -2.886 -2.074 3.116
265 1HD2 LEU 31 1HD2 LEU 31 -1.512 1.579 3.830
266 2HD2 LEU 31 2HD2 LEU 31 -0.906 0.152 4.671
267 3HD2 LEU 31 3HD2 LEU 31 -2.113 1.182 5.441
268 H PHE 32 H PHE 32 -6.874 0.982 3.538
269 HA PHE 32 HA PHE 32 -7.061 -1.012 5.635
270 1HB PHE 32 2HB PHE 32 -8.780 1.333 4.795
271 2HB PHE 32 1HB PHE 32 -9.051 0.391 6.263
272 HD1 PHE 32 1HD PHE 32 -6.605 -0.073 7.522
273 HD2 PHE 32 2HD PHE 32 -7.718 3.363 5.199
274 HE1 PHE 32 1HE PHE 32 -4.911 1.285 8.721
275 HE2 PHE 32 2HE PHE 32 -6.022 4.721 6.396
276 HZ PHE 32 HZ PHE 32 -4.619 3.681 8.158
277 H ILE 33 H ILE 33 -9.236 -0.003 2.969
278 HA ILE 33 HA ILE 33 -11.133 -2.119 3.340
279 HB ILE 33 HB ILE 33 -11.493 -0.012 2.066
280 1HG1 ILE 33 2HG1 ILE 33 -11.772 -2.517 0.373
281 2HG1 ILE 33 1HG1 ILE 33 -12.911 -2.000 1.616
282 1HG2 ILE 33 1HG2 ILE 33 -9.138 -0.139 1.035
283 2HG2 ILE 33 2HG2 ILE 33 -10.441 0.393 -0.027
284 3HG2 ILE 33 3HG2 ILE 33 -9.837 -1.261 -0.133
285 1HD1 ILE 33 1HD1 ILE 33 -13.917 -1.095 -0.269
286 2HD1 ILE 33 2HD1 ILE 33 -12.377 -0.808 -1.079
287 3HD1 ILE 33 3HD1 ILE 33 -12.897 0.257 0.224
288 H ASN 34 H ASN 34 -8.183 -1.865 1.370
289 HA ASN 34 HA ASN 34 -8.461 -4.297 -0.092
290 1HB ASN 34 2HB ASN 34 -6.878 -2.481 -0.606
291 2HB ASN 34 1HB ASN 34 -6.013 -2.801 0.898
292 1HD2 ASN 34 1HD2 ASN 34 -4.174 -4.043 0.559
293 2HD2 ASN 34 2HD2 ASN 34 -4.008 -5.242 -0.632
294 H PHE 35 H PHE 35 -6.887 -3.606 3.043
295 HA PHE 35 HA PHE 35 -5.783 -6.154 3.547
296 1HB PHE 35 2HB PHE 35 -5.435 -4.071 4.862
297 2HB PHE 35 1HB PHE 35 -7.083 -4.202 5.476
298 HD1 PHE 35 1HD PHE 35 -4.143 -6.503 5.025
299 HD2 PHE 35 2HD PHE 35 -7.260 -5.080 7.617
300 HE1 PHE 35 1HE PHE 35 -3.361 -8.040 6.809
301 HE2 PHE 35 2HE PHE 35 -6.478 -6.618 9.399
302 HZ PHE 35 HZ PHE 35 -4.528 -8.096 8.996
303 H CYS 36 H CYS 36 -9.108 -4.986 3.981
304 HA CYS 36 HA CYS 36 -10.078 -7.296 5.397
305 1HB CYS 36 2HB CYS 36 -11.169 -5.081 5.369
306 2HB CYS 36 1HB CYS 36 -11.465 -5.247 3.639
307 HG CYS 36 HG CYS 36 -12.658 -7.504 5.360
308 H LEU 37 H LEU 37 -9.632 -6.506 2.000
309 HA LEU 37 HA LEU 37 -11.197 -8.754 1.006
310 1HB LEU 37 2HB LEU 37 -10.927 -6.578 -0.152
311 2HB LEU 37 1HB LEU 37 -9.201 -6.895 -0.315
312 HG LEU 37 HG LEU 37 -11.278 -8.809 -1.398
313 1HD1 LEU 37 1HD1 LEU 37 -11.052 -7.705 -3.555
314 2HD1 LEU 37 2HD1 LEU 37 -9.890 -6.559 -2.881
315 3HD1 LEU 37 3HD1 LEU 37 -11.575 -6.517 -2.360
316 1HD2 LEU 37 1HD2 LEU 37 -8.314 -8.406 -1.631
317 2HD2 LEU 37 2HD2 LEU 37 -9.183 -9.082 -3.008
318 3HD2 LEU 37 3HD2 LEU 37 -9.223 -9.906 -1.450
319 H ILE 38 H ILE 38 -7.729 -7.981 1.362
320 HA ILE 38 HA ILE 38 -6.848 -10.531 0.252
321 HB ILE 38 HB ILE 38 -5.589 -8.385 0.186
322 1HG1 ILE 38 2HG1 ILE 38 -3.397 -9.333 0.821
323 2HG1 ILE 38 1HG1 ILE 38 -4.215 -10.595 1.743
324 1HG2 ILE 38 1HG2 ILE 38 -6.283 -8.250 2.875
325 2HG2 ILE 38 2HG2 ILE 38 -5.167 -7.174 2.035
326 3HG2 ILE 38 3HG2 ILE 38 -4.552 -8.582 2.900
327 1HD1 ILE 38 1HD1 ILE 38 -4.891 -10.194 -1.157
328 2HD1 ILE 38 2HD1 ILE 38 -5.039 -11.650 -0.173
329 3HD1 ILE 38 3HD1 ILE 38 -3.448 -11.106 -0.710
330 H LEU 39 H LEU 39 -7.968 -9.494 3.337
331 HA LEU 39 HA LEU 39 -6.501 -11.175 5.085
332 1HB LEU 39 2HB LEU 39 -7.826 -9.314 5.850
333 2HB LEU 39 1HB LEU 39 -9.284 -9.978 5.113
334 HG LEU 39 HG LEU 39 -9.151 -11.907 6.622
335 1HD1 LEU 39 1HD1 LEU 39 -6.836 -10.392 7.864
336 2HD1 LEU 39 2HD1 LEU 39 -6.708 -11.903 6.963
337 3HD1 LEU 39 3HD1 LEU 39 -7.552 -11.868 8.510
338 1HD2 LEU 39 1HD2 LEU 39 -9.792 -10.722 8.683
339 2HD2 LEU 39 2HD2 LEU 39 -10.463 -9.909 7.271
340 3HD2 LEU 39 3HD2 LEU 39 -9.040 -9.247 8.076
341 H ILE 40 H ILE 40 -8.858 -11.992 2.700
342 HA ILE 40 HA ILE 40 -8.828 -14.777 3.654
343 HB ILE 40 HB ILE 40 -11.259 -14.941 3.671
344 1HG1 ILE 40 2HG1 ILE 40 -11.644 -13.209 1.883
345 2HG1 ILE 40 1HG1 ILE 40 -12.711 -13.047 3.272
346 1HG2 ILE 40 1HG2 ILE 40 -10.006 -14.123 5.707
347 2HG2 ILE 40 2HG2 ILE 40 -11.707 -13.666 5.655
348 3HG2 ILE 40 3HG2 ILE 40 -10.462 -12.485 5.248
349 1HD1 ILE 40 1HD1 ILE 40 -10.579 -11.454 4.000
350 2HD1 ILE 40 2HD1 ILE 40 -12.067 -10.872 3.259
351 3HD1 ILE 40 3HD1 ILE 40 -10.655 -11.201 2.259
352 H PHE 41 H PHE 41 -9.747 -12.473 1.113
353 HA PHE 41 HA PHE 41 -10.646 -14.163 -0.913
354 1HB PHE 41 2HB PHE 41 -10.493 -11.705 -1.011
355 2HB PHE 41 1HB PHE 41 -8.734 -11.812 -1.080
356 HD1 PHE 41 1HD PHE 41 -11.646 -13.450 -2.806
357 HD2 PHE 41 2HD PHE 41 -7.820 -11.537 -3.197
358 HE1 PHE 41 1HE PHE 41 -11.758 -13.732 -5.267
359 HE2 PHE 41 2HE PHE 41 -7.932 -11.819 -5.658
360 HZ PHE 41 HZ PHE 41 -9.901 -12.915 -6.694
361 H LEU 42 H LEU 42 -7.347 -13.755 0.280
362 HA LEU 42 HA LEU 42 -5.928 -14.964 -1.855
363 1HB LEU 42 2HB LEU 42 -4.210 -15.372 -0.090
364 2HB LEU 42 1HB LEU 42 -4.877 -13.745 -0.021
365 HG LEU 42 HG LEU 42 -6.486 -14.614 1.758
366 1HD1 LEU 42 1HD1 LEU 42 -6.530 -16.857 1.998
367 2HD1 LEU 42 2HD1 LEU 42 -4.993 -16.688 2.844
368 3HD1 LEU 42 3HD1 LEU 42 -5.017 -17.060 1.119
369 1HD2 LEU 42 1HD2 LEU 42 -3.727 -13.853 1.906
370 2HD2 LEU 42 2HD2 LEU 42 -4.053 -15.035 3.176
371 3HD2 LEU 42 3HD2 LEU 42 -5.009 -13.557 3.081
372 H LEU 43 H LEU 43 -8.111 -16.394 0.408
373 HA LEU 43 HA LEU 43 -7.056 -19.117 -0.007
374 1HB LEU 43 2HB LEU 43 -7.858 -18.203 2.209
375 2HB LEU 43 1HB LEU 43 -9.477 -18.114 1.527
376 HG LEU 43 HG LEU 43 -9.068 -20.176 2.894
377 1HD1 LEU 43 1HD2 LEU 43 -10.512 -19.938 0.622
378 2HD1 LEU 43 2HD2 LEU 43 -10.444 -21.424 1.568
379 3HD1 LEU 43 3HD2 LEU 43 -9.417 -21.236 0.146
380 1HD2 LEU 43 1HD1 LEU 43 -7.514 -21.817 2.245
381 2HD2 LEU 43 2HD1 LEU 43 -6.634 -20.306 2.018
382 3HD2 LEU 43 3HD1 LEU 43 -7.333 -21.136 0.628
383 H LEU 44 H LEU 44 -9.977 -17.193 -0.684
384 HA LEU 44 HA LEU 44 -11.507 -19.210 -1.975
385 1HB LEU 44 2HB LEU 44 -11.372 -16.206 -2.377
386 2HB LEU 44 1HB LEU 44 -12.704 -17.232 -2.905
387 HG LEU 44 HG LEU 44 -11.775 -16.919 -0.033
388 1HD1 LEU 44 1HD1 LEU 44 -14.359 -15.983 -1.302
389 2HD1 LEU 44 2HD1 LEU 44 -12.954 -14.935 -1.110
390 3HD1 LEU 44 3HD1 LEU 44 -13.753 -15.608 0.312
391 1HD2 LEU 44 1HD2 LEU 44 -12.953 -18.798 0.357
392 2HD2 LEU 44 2HD2 LEU 44 -13.335 -18.930 -1.359
393 3HD2 LEU 44 3HD2 LEU 44 -14.392 -18.012 -0.290
394 H ILE 45 H ILE 45 -9.043 -16.982 -3.242
395 HA ILE 45 HA ILE 45 -9.401 -17.359 -6.012
396 HB ILE 45 HB ILE 45 -7.027 -16.678 -6.115
397 1HG1 ILE 45 2HG1 ILE 45 -7.089 -17.225 -3.128
398 2HG1 ILE 45 1HG1 ILE 45 -6.204 -18.169 -4.328
399 1HG2 ILE 45 1HG2 ILE 45 -7.468 -14.906 -4.006
400 2HG2 ILE 45 2HG2 ILE 45 -9.092 -15.383 -4.507
401 3HG2 ILE 45 3HG2 ILE 45 -7.978 -14.675 -5.678
402 1HD1 ILE 45 1HD1 ILE 45 -4.742 -16.519 -3.177
403 2HD1 ILE 45 2HD1 ILE 45 -5.766 -15.219 -3.784
404 3HD1 ILE 45 3HD1 ILE 45 -4.849 -16.217 -4.912
405 H CYS 46 H CYS 46 -8.101 -19.577 -3.634
406 HA CYS 46 HA CYS 46 -6.636 -21.243 -5.470
407 1HB CYS 46 2HB CYS 46 -6.207 -21.115 -3.066
408 2HB CYS 46 1HB CYS 46 -7.814 -21.758 -2.756
409 HG CYS 46 HG CYS 46 -5.466 -23.471 -3.211
410 H ILE 47 H ILE 47 -9.718 -21.861 -3.752
411 HA ILE 47 HA ILE 47 -10.381 -24.226 -5.176
412 HB ILE 47 HB ILE 47 -12.617 -23.813 -4.212
413 1HG1 ILE 47 2HG1 ILE 47 -11.473 -21.083 -3.536
414 2HG1 ILE 47 1HG1 ILE 47 -12.734 -21.393 -4.729
415 1HG2 ILE 47 1HG2 ILE 47 -11.937 -23.967 -1.975
416 2HG2 ILE 47 2HG2 ILE 47 -10.631 -22.804 -2.190
417 3HG2 ILE 47 3HG2 ILE 47 -10.474 -24.435 -2.840
418 1HD1 ILE 47 1HD1 ILE 47 -14.233 -21.167 -3.059
419 2HD1 ILE 47 2HD1 ILE 47 -12.957 -21.158 -1.839
420 3HD1 ILE 47 3HD1 ILE 47 -13.621 -22.689 -2.411
421 H ILE 48 H ILE 48 -10.716 -20.871 -6.153
422 HA ILE 48 HA ILE 48 -12.640 -21.589 -8.267
423 HB ILE 48 HB ILE 48 -12.772 -19.175 -8.602
424 1HG1 ILE 48 2HG1 ILE 48 -10.504 -19.022 -6.590
425 2HG1 ILE 48 1HG1 ILE 48 -10.362 -18.682 -8.313
426 1HG2 ILE 48 1HG2 ILE 48 -13.897 -18.740 -6.644
427 2HG2 ILE 48 2HG2 ILE 48 -12.587 -19.350 -5.632
428 3HG2 ILE 48 3HG2 ILE 48 -13.676 -20.478 -6.441
429 1HD1 ILE 48 1HD1 ILE 48 -10.754 -16.536 -7.593
430 2HD1 ILE 48 2HD1 ILE 48 -11.637 -17.067 -6.161
431 3HD1 ILE 48 3HD1 ILE 48 -12.432 -17.062 -7.735
432 H VAL 49 H VAL 49 -9.268 -20.497 -7.949
433 HA VAL 49 HA VAL 49 -8.921 -20.437 -10.880
434 HB VAL 49 HB VAL 49 -7.020 -20.068 -8.544
435 1HG1 VAL 49 1HG1 VAL 49 -6.708 -19.627 -11.524
436 2HG1 VAL 49 2HG1 VAL 49 -5.735 -20.672 -10.488
437 3HG1 VAL 49 3HG1 VAL 49 -5.624 -18.920 -10.326
438 1HG2 VAL 49 1HG2 VAL 49 -8.064 -18.074 -8.353
439 2HG2 VAL 49 2HG2 VAL 49 -9.027 -18.381 -9.796
440 3HG2 VAL 49 3HG2 VAL 49 -7.421 -17.668 -9.944
441 H MET 50 H MET 50 -8.710 -22.802 -8.399
442 HA MET 50 HA MET 50 -6.603 -24.384 -9.596
443 1HB MET 50 2HB MET 50 -6.969 -24.353 -7.214
444 2HB MET 50 1HB MET 50 -8.650 -24.814 -7.442
445 1HG MET 50 2HG MET 50 -7.322 -26.769 -6.790
446 2HG MET 50 1HG MET 50 -7.937 -26.937 -8.433
447 1HE MET 50 1HE MET 50 -4.705 -28.612 -7.494
448 2HE MET 50 2HE MET 50 -5.177 -28.814 -9.180
449 3HE MET 50 3HE MET 50 -6.414 -28.764 -7.925
450 H LEU 51 H LEU 51 -9.997 -23.988 -10.093
451 HA LEU 51 HA LEU 51 -10.336 -26.682 -11.289
452 1HB LEU 51 2HB LEU 51 -12.199 -24.316 -10.902
453 2HB LEU 51 1HB LEU 51 -12.693 -25.915 -11.459
454 HG LEU 51 HG LEU 51 -11.392 -25.305 -8.788
455 1HD1 LEU 51 1HD2 LEU 51 -13.831 -24.604 -9.174
456 2HD1 LEU 51 2HD2 LEU 51 -13.532 -25.685 -7.814
457 3HD1 LEU 51 3HD2 LEU 51 -14.189 -26.325 -9.321
458 1HD2 LEU 51 1HD1 LEU 51 -12.346 -27.790 -8.522
459 2HD2 LEU 51 2HD1 LEU 51 -10.729 -27.485 -9.155
460 3HD2 LEU 51 3HD1 LEU 51 -12.063 -27.814 -10.262
461 H LEU 52 H LEU 52 -9.322 -23.590 -12.305
462 HA LEU 52 HA LEU 52 -10.420 -23.867 -15.048
463 1HB LEU 52 2HB LEU 52 -8.706 -21.765 -13.682
464 2HB LEU 52 1HB LEU 52 -9.421 -21.605 -15.286
465 HG LEU 52 HG LEU 52 -10.966 -22.007 -12.709
466 1HD1 LEU 52 1HD2 LEU 52 -9.889 -19.657 -13.987
467 2HD1 LEU 52 2HD2 LEU 52 -10.817 -19.771 -12.491
468 3HD1 LEU 52 3HD2 LEU 52 -11.651 -19.599 -14.036
469 1HD2 LEU 52 1HD1 LEU 52 -11.643 -22.401 -15.487
470 2HD2 LEU 52 2HD1 LEU 52 -12.592 -21.069 -14.827
471 3HD2 LEU 52 3HD1 LEU 52 -12.648 -22.655 -14.060
Start of MODEL 6
1 1H MET 1 1HT MET 1 22.327 2.096 13.820
2 2H MET 1 2HT MET 1 21.090 2.271 14.971
3 H MET 1 H MET 1 21.166 3.012 14.948
4 3H MET 1 3HT MET 1 21.696 3.633 14.155
5 HA MET 1 HA MET 1 20.703 3.003 12.129
6 1HB MET 1 2HB MET 1 21.504 0.654 12.476
7 2HB MET 1 1HB MET 1 20.124 0.400 13.523
8 1HG MET 1 2HG MET 1 19.687 -0.432 11.248
9 2HG MET 1 1HG MET 1 18.618 0.894 11.662
10 1HE MET 1 1HE MET 1 19.294 -0.069 8.536
11 2HE MET 1 2HE MET 1 19.015 1.574 7.963
12 3HE MET 1 3HE MET 1 18.042 0.931 9.284
13 H ASP 2 H ASP 2 19.854 4.229 14.706
14 HA ASP 2 HA ASP 2 16.912 3.635 14.592
15 1HB ASP 2 2HB ASP 2 16.920 4.381 16.950
16 2HB ASP 2 1HB ASP 2 18.079 3.076 16.707
17 H LYS 3 H LYS 3 19.398 6.072 14.361
18 HA LYS 3 HA LYS 3 17.344 8.235 14.234
19 1HB LYS 3 2HB LYS 3 19.255 9.726 14.575
20 2HB LYS 3 1HB LYS 3 19.248 8.465 15.805
21 1HG LYS 3 2HG LYS 3 20.910 7.183 14.496
22 2HG LYS 3 1HG LYS 3 20.924 8.458 13.278
23 1HD LYS 3 2HD LYS 3 21.618 8.850 16.195
24 2HD LYS 3 1HD LYS 3 22.802 8.666 14.901
25 1HE LYS 3 2HE LYS 3 20.720 10.876 15.087
26 2HE LYS 3 1HE LYS 3 22.460 11.061 15.381
27 1HZ LYS 3 1HZ LYS 3 22.710 9.971 13.097
28 2HZ LYS 3 2HZ LYS 3 22.227 11.598 13.140
29 3HZ LYS 3 3HZ LYS 3 21.082 10.376 12.858
30 H VAL 4 H VAL 4 20.006 6.738 12.415
31 HA VAL 4 HA VAL 4 20.201 8.435 10.199
32 HB VAL 4 HB VAL 4 20.183 5.428 10.320
33 1HG1 VAL 4 1HG1 VAL 4 20.944 7.398 8.206
34 2HG1 VAL 4 2HG1 VAL 4 20.189 5.814 8.036
35 3HG1 VAL 4 3HG1 VAL 4 21.916 5.934 8.373
36 1HG2 VAL 4 1HG2 VAL 4 21.793 7.029 11.754
37 2HG2 VAL 4 2HG2 VAL 4 22.687 7.034 10.232
38 3HG2 VAL 4 3HG2 VAL 4 22.360 5.510 11.059
39 H GLN 5 H GLN 5 17.578 6.318 11.101
40 HA GLN 5 HA GLN 5 16.282 6.257 8.511
41 1HB GLN 5 2HB GLN 5 15.250 5.742 11.318
42 2HB GLN 5 1HB GLN 5 14.487 5.198 9.823
43 1HG GLN 5 2HG GLN 5 17.251 4.400 10.783
44 2HG GLN 5 1HG GLN 5 15.811 3.383 10.843
45 1HE2 GLN 5 1HE2 GLN 5 18.539 3.915 9.009
46 2HE2 GLN 5 2HE2 GLN 5 17.970 3.380 7.501
47 H TYR 6 H TYR 6 15.538 7.948 11.589
48 HA TYR 6 HA TYR 6 13.344 9.473 10.621
49 1HB TYR 6 2HB TYR 6 15.398 10.019 12.788
50 2HB TYR 6 1HB TYR 6 13.868 10.873 12.632
51 HD1 TYR 6 1HD TYR 6 14.089 9.782 15.148
52 HD2 TYR 6 2HD TYR 6 13.116 7.644 11.545
53 HE1 TYR 6 1HE TYR 6 12.968 8.025 16.487
54 HE2 TYR 6 2HE TYR 6 12.000 5.891 12.890
55 HH TYR 6 HH TYR 6 10.900 5.752 15.179
56 H LEU 7 H LEU 7 16.807 10.389 10.895
57 HA LEU 7 HA LEU 7 16.540 13.021 9.855
58 1HB LEU 7 2HB LEU 7 18.741 10.970 9.980
59 2HB LEU 7 1HB LEU 7 19.015 12.513 9.176
60 HG LEU 7 HG LEU 7 19.710 12.603 11.550
61 1HD1 LEU 7 1HD1 LEU 7 18.426 14.505 10.194
62 2HD1 LEU 7 2HD1 LEU 7 18.866 14.728 11.886
63 3HD1 LEU 7 3HD1 LEU 7 17.223 14.256 11.458
64 1HD2 LEU 7 1HD2 LEU 7 18.085 12.399 13.338
65 2HD2 LEU 7 2HD2 LEU 7 18.025 10.933 12.366
66 3HD2 LEU 7 3HD2 LEU 7 16.778 12.164 12.179
67 H THR 8 H THR 8 17.317 9.970 8.156
68 HA THR 8 HA THR 8 17.389 11.130 5.527
69 HB THR 8 HB THR 8 16.791 8.320 6.483
70 HG1 THR 8 1HG THR 8 18.919 8.064 6.584
71 1HG2 THR 8 1HG2 THR 8 17.979 9.188 3.844
72 2HG2 THR 8 2HG2 THR 8 16.256 8.883 4.062
73 3HG2 THR 8 3HG2 THR 8 17.418 7.578 4.297
74 H ARG 9 H ARG 9 14.909 9.062 7.083
75 HA ARG 9 HA ARG 9 12.887 9.281 5.151
76 1HB ARG 9 2HB ARG 9 12.803 9.092 8.149
77 2HB ARG 9 1HB ARG 9 11.399 8.813 7.133
78 1HG ARG 9 2HG ARG 9 14.013 7.283 6.935
79 2HG ARG 9 1HG ARG 9 12.565 6.693 7.751
80 1HD ARG 9 2HD ARG 9 11.306 6.824 5.624
81 2HD ARG 9 1HD ARG 9 12.762 7.414 4.802
82 HE ARG 9 HE ARG 9 12.263 4.667 5.454
83 1HH1 ARG 9 1HH2 ARG 9 14.472 5.384 7.390
84 2HH1 ARG 9 2HH2 ARG 9 15.884 5.024 6.453
85 1HH2 ARG 9 1HH1 ARG 9 14.184 4.946 3.432
86 2HH2 ARG 9 2HH1 ARG 9 15.722 4.777 4.212
87 H SER 10 H SER 10 13.691 11.496 7.806
88 HA SER 10 HA SER 10 11.451 13.264 7.383
89 1HB SER 10 2HB SER 10 12.745 14.720 8.892
90 2HB SER 10 1HB SER 10 12.778 13.060 9.476
91 HG SER 10 HG SER 10 14.845 14.368 9.253
92 H ALA 11 H ALA 11 14.583 12.869 5.891
93 HA ALA 11 HA ALA 11 14.724 15.534 4.741
94 1HB ALA 11 1HB ALA 11 16.706 14.202 5.231
95 2HB ALA 11 2HB ALA 11 16.614 14.463 3.489
96 3HB ALA 11 3HB ALA 11 16.132 12.911 4.174
97 H ILE 12 H ILE 12 13.534 12.376 3.670
98 HA ILE 12 HA ILE 12 12.956 13.435 0.979
99 HB ILE 12 HB ILE 12 14.013 11.229 1.266
100 1HG1 ILE 12 2HG1 ILE 12 12.414 9.909 -0.087
101 2HG1 ILE 12 1HG1 ILE 12 11.136 11.058 0.310
102 1HG2 ILE 12 1HG2 ILE 12 11.725 9.770 2.237
103 2HG2 ILE 12 2HG2 ILE 12 12.153 11.027 3.395
104 3HG2 ILE 12 3HG2 ILE 12 13.355 9.833 2.905
105 1HD1 ILE 12 1HD1 ILE 12 12.613 11.278 -1.927
106 2HD1 ILE 12 2HD1 ILE 12 13.648 12.186 -0.823
107 3HD1 ILE 12 3HD1 ILE 12 11.976 12.687 -1.077
108 H ARG 13 H ARG 13 11.356 12.691 3.985
109 HA ARG 13 HA ARG 13 8.693 12.282 3.081
110 1HB ARG 13 2HB ARG 13 9.552 11.898 5.373
111 2HB ARG 13 1HB ARG 13 9.755 13.637 5.581
112 1HG ARG 13 2HG ARG 13 7.647 12.885 6.605
113 2HG ARG 13 1HG ARG 13 7.327 13.953 5.241
114 1HD ARG 13 2HD ARG 13 5.861 11.924 5.214
115 2HD ARG 13 1HD ARG 13 6.912 12.000 3.788
116 HE ARG 13 HE ARG 13 7.919 10.026 4.575
117 1HH1 ARG 13 1HH1 ARG 13 5.858 11.147 7.002
118 2HH1 ARG 13 2HH1 ARG 13 6.677 10.345 8.300
119 1HH2 ARG 13 1HH2 ARG 13 9.332 9.301 6.333
120 2HH2 ARG 13 2HH2 ARG 13 8.644 9.301 7.921
121 H ARG 14 H ARG 14 10.647 15.171 3.284
122 HA ARG 14 HA ARG 14 8.579 17.144 3.341
123 1HB ARG 14 2HB ARG 14 11.346 17.159 2.096
124 2HB ARG 14 1HB ARG 14 10.395 18.595 2.470
125 1HG ARG 14 2HG ARG 14 10.366 17.938 4.862
126 2HG ARG 14 1HG ARG 14 11.366 16.538 4.475
127 1HD ARG 14 2HD ARG 14 12.165 19.434 3.992
128 2HD ARG 14 1HD ARG 14 12.766 18.408 5.310
129 HE ARG 14 HE ARG 14 13.118 16.995 2.863
130 1HH1 ARG 14 1HH1 ARG 14 15.085 17.961 5.140
131 2HH1 ARG 14 2HH1 ARG 14 16.286 18.730 4.156
132 1HH2 ARG 14 1HH2 ARG 14 14.306 18.776 1.309
133 2HH2 ARG 14 2HH2 ARG 14 15.845 19.191 1.986
134 H ALA 15 H ALA 15 9.790 15.087 0.790
135 HA ALA 15 HA ALA 15 8.352 16.659 -1.268
136 1HB ALA 15 1HB ALA 15 9.716 14.389 -2.318
137 2HB ALA 15 2HB ALA 15 10.767 15.123 -1.107
138 3HB ALA 15 3HB ALA 15 10.178 16.084 -2.462
139 H SER 16 H SER 16 8.509 13.423 0.191
140 HA SER 16 HA SER 16 6.470 12.279 -1.491
141 1HB SER 16 2HB SER 16 8.217 10.985 -0.368
142 2HB SER 16 1HB SER 16 7.589 11.497 1.188
143 HG SER 16 HG SER 16 6.890 9.372 0.332
144 H THR 17 H THR 17 6.210 14.595 0.909
145 HA THR 17 HA THR 17 3.402 13.790 1.463
146 HB THR 17 HB THR 17 5.414 15.145 3.281
147 HG1 THR 17 1HG THR 17 4.188 12.603 3.492
148 1HG2 THR 17 1HG2 THR 17 3.303 14.265 4.824
149 2HG2 THR 17 2HG2 THR 17 2.495 14.854 3.372
150 3HG2 THR 17 3HG2 THR 17 3.546 15.930 4.293
151 H ILE 18 H ILE 18 5.368 16.053 -0.013
152 HA ILE 18 HA ILE 18 3.393 18.226 0.381
153 HB ILE 18 HB ILE 18 6.294 18.283 -0.404
154 1HG1 ILE 18 2HG1 ILE 18 5.919 17.704 1.965
155 2HG1 ILE 18 1HG1 ILE 18 6.614 19.319 1.819
156 1HG2 ILE 18 1HG2 ILE 18 4.154 20.273 -0.549
157 2HG2 ILE 18 2HG2 ILE 18 5.760 20.302 -1.279
158 3HG2 ILE 18 3HG2 ILE 18 5.540 20.828 0.390
159 1HD1 ILE 18 1HD1 ILE 18 4.873 20.106 3.006
160 2HD1 ILE 18 2HD1 ILE 18 4.076 18.534 2.967
161 3HD1 ILE 18 3HD1 ILE 18 3.826 19.683 1.652
162 H GLU 19 H GLU 19 4.770 15.999 -1.861
163 HA GLU 19 HA GLU 19 3.969 17.591 -4.207
164 1HB GLU 19 2HB GLU 19 5.327 14.933 -3.884
165 2HB GLU 19 1HB GLU 19 5.119 15.770 -5.417
166 1HG GLU 19 2HG GLU 19 6.630 16.839 -3.013
167 2HG GLU 19 1HG GLU 19 7.367 16.185 -4.475
168 H MET 20 H MET 20 3.035 14.691 -2.421
169 HA MET 20 HA MET 20 0.588 14.527 -4.131
170 1HB MET 20 2HB MET 20 2.352 12.281 -3.187
171 2HB MET 20 1HB MET 20 0.862 12.075 -4.102
172 1HG MET 20 2HG MET 20 1.830 13.424 -5.941
173 2HG MET 20 1HG MET 20 3.334 13.566 -5.031
174 1HE MET 20 1HE MET 20 1.004 10.339 -5.064
175 2HE MET 20 2HE MET 20 1.462 9.695 -6.639
176 3HE MET 20 3HE MET 20 0.720 11.290 -6.529
177 HA PRO 21 HA PRO 21 -0.090 14.204 0.541
178 1HB PRO 21 2HB PRO 21 -1.227 16.656 0.972
179 2HB PRO 21 1HB PRO 21 0.512 16.361 1.115
180 1HG PRO 21 2HG PRO 21 -1.006 17.595 -1.099
181 2HG PRO 21 1HG PRO 21 0.579 18.023 -0.451
182 1HD PRO 21 2HD PRO 21 0.228 16.603 -2.759
183 2HD PRO 21 1HD PRO 21 1.666 16.462 -1.724
184 H GLN 22 H GLN 22 -2.073 15.808 -1.961
185 HA GLN 22 HA GLN 22 -4.611 15.092 -0.759
186 1HB GLN 22 2HB GLN 22 -3.833 15.903 -3.550
187 2HB GLN 22 1HB GLN 22 -5.475 15.912 -2.921
188 1HG GLN 22 2HG GLN 22 -3.155 17.532 -1.825
189 2HG GLN 22 1HG GLN 22 -4.476 18.167 -2.806
190 1HE2 GLN 22 1HE2 GLN 22 -3.497 17.890 0.369
191 2HE2 GLN 22 2HE2 GLN 22 -5.013 17.934 1.130
192 H GLN 23 H GLN 23 -2.822 13.846 -3.591
193 HA GLN 23 HA GLN 23 -4.618 11.720 -4.211
194 1HB GLN 23 2HB GLN 23 -2.723 12.815 -5.544
195 2HB GLN 23 1HB GLN 23 -1.643 11.791 -4.619
196 1HG GLN 23 2HG GLN 23 -3.956 10.654 -6.185
197 2HG GLN 23 1HG GLN 23 -2.376 10.912 -6.916
198 1HE2 GLN 23 1HE2 GLN 23 -0.900 9.231 -6.687
199 2HE2 GLN 23 2HE2 GLN 23 -1.041 7.957 -5.575
200 H ALA 24 H ALA 24 -1.515 11.662 -2.411
201 HA ALA 24 HA ALA 24 -1.542 8.956 -1.625
202 1HB ALA 24 1HB ALA 24 -0.079 9.762 0.202
203 2HB ALA 24 2HB ALA 24 -0.624 11.412 -0.094
204 3HB ALA 24 3HB ALA 24 0.315 10.561 -1.319
205 H ARG 25 H ARG 25 -3.187 11.757 -0.168
206 HA ARG 25 HA ARG 25 -4.154 10.457 2.179
207 1HB ARG 25 2HB ARG 25 -4.104 12.880 1.827
208 2HB ARG 25 1HB ARG 25 -5.275 12.707 0.527
209 1HG ARG 25 2HG ARG 25 -6.935 11.811 2.100
210 2HG ARG 25 1HG ARG 25 -5.764 11.932 3.412
211 1HD ARG 25 2HD ARG 25 -7.317 13.870 3.425
212 2HD ARG 25 1HD ARG 25 -5.661 14.399 3.069
213 HE ARG 25 HE ARG 25 -6.898 13.743 0.601
214 1HH1 ARG 25 1HH1 ARG 25 -6.536 16.222 2.945
215 2HH1 ARG 25 2HH1 ARG 25 -7.441 17.394 2.048
216 1HH2 ARG 25 1HH2 ARG 25 -8.337 15.187 -0.469
217 2HH2 ARG 25 2HH2 ARG 25 -8.456 16.811 0.122
218 H GLN 26 H GLN 26 -5.684 10.973 -1.003
219 HA GLN 26 HA GLN 26 -8.112 9.581 -0.439
220 1HB GLN 26 2HB GLN 26 -6.605 10.092 -2.993
221 2HB GLN 26 1HB GLN 26 -8.298 9.613 -2.912
222 1HG GLN 26 2HG GLN 26 -7.123 12.105 -1.655
223 2HG GLN 26 1HG GLN 26 -8.046 12.072 -3.158
224 1HE2 GLN 26 1HE2 GLN 26 -8.401 12.628 0.126
225 2HE2 GLN 26 2HE2 GLN 26 -10.054 12.279 0.282
226 H ASN 27 H ASN 27 -5.253 8.536 -2.300
227 HA ASN 27 HA ASN 27 -5.951 5.879 -2.820
228 1HB ASN 27 2HB ASN 27 -3.961 7.114 -3.624
229 2HB ASN 27 1HB ASN 27 -3.272 6.985 -2.016
230 1HD2 ASN 27 1HD2 ASN 27 -4.989 4.105 -2.647
231 2HD2 ASN 27 2HD2 ASN 27 -3.685 3.175 -3.191
232 H LEU 28 H LEU 28 -4.642 7.257 0.179
233 HA LEU 28 HA LEU 28 -3.996 4.935 1.610
234 1HB LEU 28 2HB LEU 28 -3.601 7.228 2.361
235 2HB LEU 28 1HB LEU 28 -5.334 7.469 2.527
236 HG LEU 28 HG LEU 28 -5.438 5.686 4.223
237 1HD1 LEU 28 1HD1 LEU 28 -3.021 5.061 5.104
238 2HD1 LEU 28 2HD1 LEU 28 -2.555 5.434 3.445
239 3HD1 LEU 28 3HD1 LEU 28 -3.741 4.168 3.765
240 1HD2 LEU 28 1HD2 LEU 28 -3.421 7.001 5.660
241 2HD2 LEU 28 2HD2 LEU 28 -5.129 7.437 5.608
242 3HD2 LEU 28 3HD2 LEU 28 -3.993 8.192 4.491
243 H GLN 29 H GLN 29 -7.171 6.293 0.903
244 HA GLN 29 HA GLN 29 -8.656 4.672 2.755
245 1HB GLN 29 2HB GLN 29 -9.461 6.006 0.186
246 2HB GLN 29 1HB GLN 29 -10.562 5.498 1.458
247 1HG GLN 29 2HG GLN 29 -8.359 7.562 1.765
248 2HG GLN 29 1HG GLN 29 -10.074 7.924 1.588
249 1HE2 GLN 29 1HE2 GLN 29 -11.122 8.248 3.545
250 2HE2 GLN 29 2HE2 GLN 29 -10.662 7.562 5.029
251 H ASN 30 H ASN 30 -7.177 3.973 -0.277
252 HA ASN 30 HA ASN 30 -8.998 1.880 -1.106
253 1HB ASN 30 2HB ASN 30 -7.569 3.236 -2.602
254 2HB ASN 30 1HB ASN 30 -6.159 2.498 -1.864
255 1HD2 ASN 30 1HD2 ASN 30 -8.609 0.126 -2.035
256 2HD2 ASN 30 2HD2 ASN 30 -8.123 -0.599 -3.484
257 H LEU 31 H LEU 31 -5.724 1.890 0.335
258 HA LEU 31 HA LEU 31 -5.267 -0.865 0.506
259 1HB LEU 31 2HB LEU 31 -3.673 0.915 1.066
260 2HB LEU 31 1HB LEU 31 -4.632 1.307 2.486
261 HG LEU 31 HG LEU 31 -4.244 -0.944 3.399
262 1HD1 LEU 31 1HD1 LEU 31 -3.223 -1.355 0.672
263 2HD1 LEU 31 2HD1 LEU 31 -3.833 -2.535 1.833
264 3HD1 LEU 31 3HD1 LEU 31 -2.158 -1.992 1.925
265 1HD2 LEU 31 1HD2 LEU 31 -1.603 0.250 2.524
266 2HD2 LEU 31 2HD2 LEU 31 -1.947 -0.634 4.011
267 3HD2 LEU 31 3HD2 LEU 31 -2.614 0.981 3.770
268 H PHE 32 H PHE 32 -7.379 1.140 2.485
269 HA PHE 32 HA PHE 32 -7.777 -0.645 4.660
270 1HB PHE 32 2HB PHE 32 -8.425 1.764 4.515
271 2HB PHE 32 1HB PHE 32 -9.698 1.323 3.377
272 HD1 PHE 32 1HD PHE 32 -11.309 -0.651 4.229
273 HD2 PHE 32 2HD PHE 32 -8.958 1.896 6.768
274 HE1 PHE 32 1HE PHE 32 -12.789 -1.187 6.140
275 HE2 PHE 32 2HE PHE 32 -10.445 1.362 8.677
276 HZ PHE 32 HZ PHE 32 -12.360 -0.180 8.363
277 H ILE 33 H ILE 33 -9.457 -0.362 1.525
278 HA ILE 33 HA ILE 33 -11.261 -2.589 2.163
279 HB ILE 33 HB ILE 33 -10.733 -0.933 -0.294
280 1HG1 ILE 33 2HG1 ILE 33 -13.061 -0.091 0.227
281 2HG1 ILE 33 1HG1 ILE 33 -12.966 -0.977 1.746
282 1HG2 ILE 33 1HG2 ILE 33 -12.854 -1.956 -1.165
283 2HG2 ILE 33 2HG2 ILE 33 -12.788 -3.100 0.176
284 3HG2 ILE 33 3HG2 ILE 33 -11.514 -3.095 -1.045
285 1HD1 ILE 33 1HD1 ILE 33 -10.793 0.959 0.997
286 2HD1 ILE 33 2HD1 ILE 33 -11.283 0.409 2.599
287 3HD1 ILE 33 3HD1 ILE 33 -12.294 1.549 1.712
288 H ASN 34 H ASN 34 -8.620 -2.004 -0.175
289 HA ASN 34 HA ASN 34 -8.468 -4.559 -1.342
290 1HB ASN 34 2HB ASN 34 -7.217 -2.502 -1.986
291 2HB ASN 34 1HB ASN 34 -6.224 -2.675 -0.542
292 1HD2 ASN 34 1HD2 ASN 34 -6.914 -5.808 -1.731
293 2HD2 ASN 34 2HD2 ASN 34 -5.497 -6.024 -2.629
294 H PHE 35 H PHE 35 -7.216 -3.423 1.780
295 HA PHE 35 HA PHE 35 -5.616 -5.711 2.411
296 1HB PHE 35 2HB PHE 35 -5.487 -3.506 3.505
297 2HB PHE 35 1HB PHE 35 -7.115 -3.716 4.143
298 HD1 PHE 35 1HD PHE 35 -7.478 -5.960 5.553
299 HD2 PHE 35 2HD PHE 35 -3.675 -4.093 4.833
300 HE1 PHE 35 1HE PHE 35 -6.529 -7.136 7.515
301 HE2 PHE 35 2HE PHE 35 -2.729 -5.268 6.800
302 HZ PHE 35 HZ PHE 35 -4.156 -6.789 8.143
303 H CYS 36 H CYS 36 -9.031 -4.922 3.083
304 HA CYS 36 HA CYS 36 -9.483 -7.432 4.492
305 1HB CYS 36 2HB CYS 36 -10.632 -5.315 5.039
306 2HB CYS 36 1HB CYS 36 -11.347 -5.288 3.426
307 HG CYS 36 HG CYS 36 -12.168 -7.874 4.525
308 H LEU 37 H LEU 37 -9.260 -6.611 1.216
309 HA LEU 37 HA LEU 37 -11.148 -8.752 0.402
310 1HB LEU 37 2HB LEU 37 -11.367 -6.391 -0.468
311 2HB LEU 37 1HB LEU 37 -9.787 -6.579 -1.221
312 HG LEU 37 HG LEU 37 -11.707 -6.989 -2.784
313 1HD1 LEU 37 1HD2 LEU 37 -9.324 -8.312 -2.630
314 2HD1 LEU 37 2HD2 LEU 37 -10.480 -8.504 -3.948
315 3HD1 LEU 37 3HD2 LEU 37 -10.462 -9.660 -2.616
316 1HD2 LEU 37 1HD1 LEU 37 -12.142 -9.498 -1.150
317 2HD2 LEU 37 2HD1 LEU 37 -13.092 -8.936 -2.527
318 3HD2 LEU 37 3HD1 LEU 37 -13.143 -8.055 -0.998
319 H ILE 38 H ILE 38 -7.794 -7.667 0.243
320 HA ILE 38 HA ILE 38 -6.889 -9.717 -1.598
321 HB ILE 38 HB ILE 38 -5.779 -7.523 -1.158
322 1HG1 ILE 38 2HG1 ILE 38 -3.472 -8.409 -1.042
323 2HG1 ILE 38 1HG1 ILE 38 -4.097 -9.956 -0.471
324 1HG2 ILE 38 1HG2 ILE 38 -4.767 -8.709 1.423
325 2HG2 ILE 38 2HG2 ILE 38 -6.254 -7.762 1.390
326 3HG2 ILE 38 3HG2 ILE 38 -4.729 -7.029 0.895
327 1HD1 ILE 38 1HD1 ILE 38 -3.648 -9.373 -3.102
328 2HD1 ILE 38 2HD1 ILE 38 -5.353 -8.952 -2.950
329 3HD1 ILE 38 3HD1 ILE 38 -4.807 -10.579 -2.544
330 H LEU 39 H LEU 39 -7.038 -9.444 1.954
331 HA LEU 39 HA LEU 39 -5.537 -11.826 2.523
332 1HB LEU 39 2HB LEU 39 -7.668 -10.319 4.065
333 2HB LEU 39 1HB LEU 39 -6.584 -11.520 4.766
334 HG LEU 39 HG LEU 39 -5.720 -8.953 3.403
335 1HD1 LEU 39 1HD2 LEU 39 -5.947 -9.806 6.294
336 2HD1 LEU 39 2HD2 LEU 39 -6.620 -8.368 5.526
337 3HD1 LEU 39 3HD2 LEU 39 -4.882 -8.492 5.790
338 1HD2 LEU 39 1HD1 LEU 39 -4.001 -10.547 3.045
339 2HD2 LEU 39 2HD1 LEU 39 -4.228 -11.270 4.637
340 3HD2 LEU 39 3HD1 LEU 39 -3.495 -9.672 4.490
341 H ILE 40 H ILE 40 -8.850 -11.296 1.561
342 HA ILE 40 HA ILE 40 -9.641 -14.010 2.385
343 HB ILE 40 HB ILE 40 -11.102 -11.635 1.267
344 1HG1 ILE 40 2HG1 ILE 40 -12.248 -11.737 3.514
345 2HG1 ILE 40 1HG1 ILE 40 -11.095 -12.984 3.979
346 1HG2 ILE 40 1HG2 ILE 40 -11.857 -14.393 1.173
347 2HG2 ILE 40 2HG2 ILE 40 -12.788 -12.987 0.657
348 3HG2 ILE 40 3HG2 ILE 40 -12.908 -13.562 2.320
349 1HD1 ILE 40 1HD1 ILE 40 -9.340 -11.500 4.129
350 2HD1 ILE 40 2HD1 ILE 40 -10.661 -10.393 4.498
351 3HD1 ILE 40 3HD1 ILE 40 -9.985 -10.447 2.871
352 H PHE 41 H PHE 41 -9.098 -12.083 -0.524
353 HA PHE 41 HA PHE 41 -10.178 -13.849 -2.462
354 1HB PHE 41 2HB PHE 41 -9.459 -11.531 -2.857
355 2HB PHE 41 1HB PHE 41 -7.784 -11.990 -2.559
356 HD1 PHE 41 1HD PHE 41 -10.651 -13.308 -4.606
357 HD2 PHE 41 2HD PHE 41 -6.492 -12.242 -4.472
358 HE1 PHE 41 1HE PHE 41 -10.407 -13.964 -6.985
359 HE2 PHE 41 2HE PHE 41 -6.247 -12.899 -6.852
360 HZ PHE 41 HZ PHE 41 -8.204 -13.759 -8.108
361 H LEU 42 H LEU 42 -6.865 -13.688 -1.118
362 HA LEU 42 HA LEU 42 -5.748 -15.771 -2.697
363 1HB LEU 42 2HB LEU 42 -4.013 -15.769 -0.915
364 2HB LEU 42 1HB LEU 42 -4.461 -14.137 -1.397
365 HG LEU 42 HG LEU 42 -6.099 -14.160 0.583
366 1HD1 LEU 42 1HD2 LEU 42 -4.897 -16.820 0.802
367 2HD1 LEU 42 2HD2 LEU 42 -6.336 -16.177 1.593
368 3HD1 LEU 42 3HD2 LEU 42 -4.742 -15.891 2.292
369 1HD2 LEU 42 1HD1 LEU 42 -3.110 -14.108 0.704
370 2HD2 LEU 42 2HD1 LEU 42 -3.997 -14.039 2.226
371 3HD2 LEU 42 3HD1 LEU 42 -4.264 -12.807 0.993
372 H LEU 43 H LEU 43 -8.033 -15.960 -0.125
373 HA LEU 43 HA LEU 43 -7.344 -18.744 0.544
374 1HB LEU 43 2HB LEU 43 -8.002 -16.964 2.213
375 2HB LEU 43 1HB LEU 43 -9.611 -16.967 1.495
376 HG LEU 43 HG LEU 43 -8.285 -19.433 2.657
377 1HD1 LEU 43 1HD2 LEU 43 -9.629 -19.102 4.633
378 2HD1 LEU 43 2HD2 LEU 43 -10.439 -17.712 3.911
379 3HD1 LEU 43 3HD2 LEU 43 -8.733 -17.612 4.343
380 1HD2 LEU 43 1HD1 LEU 43 -9.953 -20.381 1.430
381 2HD2 LEU 43 2HD1 LEU 43 -10.835 -18.863 1.275
382 3HD2 LEU 43 3HD1 LEU 43 -10.986 -19.824 2.746
383 H LEU 44 H LEU 44 -9.900 -16.896 -1.088
384 HA LEU 44 HA LEU 44 -11.678 -19.110 -1.525
385 1HB LEU 44 2HB LEU 44 -11.282 -16.481 -2.985
386 2HB LEU 44 1HB LEU 44 -12.707 -17.512 -3.126
387 HG LEU 44 HG LEU 44 -11.713 -16.249 -0.554
388 1HD1 LEU 44 1HD1 LEU 44 -14.379 -15.545 -1.536
389 2HD1 LEU 44 2HD1 LEU 44 -13.099 -15.056 -2.646
390 3HD1 LEU 44 3HD1 LEU 44 -13.079 -14.495 -0.973
391 1HD2 LEU 44 1HD2 LEU 44 -13.983 -17.048 0.256
392 2HD2 LEU 44 2HD2 LEU 44 -12.815 -18.331 -0.065
393 3HD2 LEU 44 3HD2 LEU 44 -14.096 -17.993 -1.228
394 H ILE 45 H ILE 45 -9.229 -17.552 -3.621
395 HA ILE 45 HA ILE 45 -9.640 -19.119 -5.943
396 HB ILE 45 HB ILE 45 -7.321 -18.405 -6.475
397 1HG1 ILE 45 2HG1 ILE 45 -7.309 -17.447 -3.593
398 2HG1 ILE 45 1HG1 ILE 45 -6.365 -18.796 -4.225
399 1HG2 ILE 45 1HG2 ILE 45 -9.015 -16.312 -5.076
400 2HG2 ILE 45 2HG2 ILE 45 -9.147 -16.799 -6.767
401 3HG2 ILE 45 3HG2 ILE 45 -7.701 -15.967 -6.197
402 1HD1 ILE 45 1HD1 ILE 45 -6.127 -15.874 -4.984
403 2HD1 ILE 45 2HD1 ILE 45 -5.338 -17.174 -5.878
404 3HD1 ILE 45 3HD1 ILE 45 -4.911 -16.877 -4.192
405 H CYS 46 H CYS 46 -7.966 -19.896 -2.955
406 HA CYS 46 HA CYS 46 -6.527 -22.173 -4.013
407 1HB CYS 46 2HB CYS 46 -5.799 -20.848 -2.086
408 2HB CYS 46 1HB CYS 46 -7.250 -21.333 -1.222
409 HG CYS 46 HG CYS 46 -4.960 -22.893 -0.846
410 H ILE 47 H ILE 47 -9.692 -21.694 -2.553
411 HA ILE 47 HA ILE 47 -10.076 -24.609 -2.323
412 HB ILE 47 HB ILE 47 -12.083 -23.977 -1.068
413 1HG1 ILE 47 2HG1 ILE 47 -11.331 -21.127 -1.797
414 2HG1 ILE 47 1HG1 ILE 47 -12.695 -22.014 -2.473
415 1HG2 ILE 47 1HG2 ILE 47 -10.286 -21.973 0.072
416 2HG2 ILE 47 2HG2 ILE 47 -9.446 -23.465 -0.353
417 3HG2 ILE 47 3HG2 ILE 47 -10.823 -23.511 0.749
418 1HD1 ILE 47 1HD1 ILE 47 -12.281 -21.353 0.457
419 2HD1 ILE 47 2HD1 ILE 47 -13.630 -22.281 -0.194
420 3HD1 ILE 47 3HD1 ILE 47 -13.443 -20.581 -0.623
421 H ILE 48 H ILE 48 -10.382 -22.473 -4.809
422 HA ILE 48 HA ILE 48 -12.816 -23.832 -5.851
423 HB ILE 48 HB ILE 48 -13.157 -21.789 -7.186
424 1HG1 ILE 48 2HG1 ILE 48 -10.661 -20.806 -5.763
425 2HG1 ILE 48 1HG1 ILE 48 -10.769 -21.212 -7.477
426 1HG2 ILE 48 1HG2 ILE 48 -14.287 -21.031 -5.397
427 2HG2 ILE 48 2HG2 ILE 48 -12.799 -20.330 -4.760
428 3HG2 ILE 48 3HG2 ILE 48 -13.250 -21.979 -4.331
429 1HD1 ILE 48 1HD1 ILE 48 -12.899 -19.473 -7.104
430 2HD1 ILE 48 2HD1 ILE 48 -11.337 -19.047 -7.803
431 3HD1 ILE 48 3HD1 ILE 48 -11.634 -18.786 -6.084
432 H VAL 49 H VAL 49 -9.472 -22.999 -6.426
433 HA VAL 49 HA VAL 49 -9.556 -23.978 -9.218
434 HB VAL 49 HB VAL 49 -7.339 -22.929 -7.425
435 1HG1 VAL 49 1HG1 VAL 49 -6.573 -24.412 -9.301
436 2HG1 VAL 49 2HG1 VAL 49 -6.020 -22.745 -9.457
437 3HG1 VAL 49 3HG1 VAL 49 -7.372 -23.320 -10.433
438 1HG2 VAL 49 1HG2 VAL 49 -9.480 -21.655 -8.882
439 2HG2 VAL 49 2HG2 VAL 49 -7.930 -21.194 -9.583
440 3HG2 VAL 49 3HG2 VAL 49 -8.241 -20.914 -7.870
441 H MET 50 H MET 50 -8.504 -25.037 -6.009
442 HA MET 50 HA MET 50 -6.846 -27.218 -6.834
443 1HB MET 50 2HB MET 50 -7.198 -27.962 -4.513
444 2HB MET 50 1HB MET 50 -6.942 -26.218 -4.566
445 1HG MET 50 2HG MET 50 -9.359 -25.833 -4.445
446 2HG MET 50 1HG MET 50 -9.654 -27.572 -4.465
447 1HE MET 50 1HE MET 50 -8.254 -29.039 -3.216
448 2HE MET 50 2HE MET 50 -8.628 -29.085 -1.495
449 3HE MET 50 3HE MET 50 -7.052 -28.509 -2.030
450 H LEU 51 H LEU 51 -10.278 -26.782 -6.917
451 HA LEU 51 HA LEU 51 -10.611 -29.709 -7.460
452 1HB LEU 51 2HB LEU 51 -12.941 -29.352 -6.559
453 2HB LEU 51 1HB LEU 51 -11.668 -29.107 -5.370
454 HG LEU 51 HG LEU 51 -11.814 -26.628 -5.834
455 1HD1 LEU 51 1HD2 LEU 51 -12.824 -26.282 -7.889
456 2HD1 LEU 51 2HD2 LEU 51 -14.233 -26.120 -6.839
457 3HD1 LEU 51 3HD2 LEU 51 -13.934 -27.637 -7.687
458 1HD2 LEU 51 1HD1 LEU 51 -14.057 -28.270 -4.717
459 2HD2 LEU 51 2HD1 LEU 51 -14.256 -26.520 -4.823
460 3HD2 LEU 51 3HD1 LEU 51 -12.929 -27.202 -3.881
461 H LEU 52 H LEU 52 -10.139 -27.179 -9.210
462 HA LEU 52 HA LEU 52 -12.570 -27.383 -10.922
463 1HB LEU 52 2HB LEU 52 -12.011 -25.162 -10.139
464 2HB LEU 52 1HB LEU 52 -10.325 -25.368 -10.613
465 HG LEU 52 HG LEU 52 -11.014 -25.563 -12.961
466 1HD1 LEU 52 1HD1 LEU 52 -13.507 -24.656 -13.277
467 2HD1 LEU 52 2HD1 LEU 52 -13.718 -25.419 -11.700
468 3HD1 LEU 52 3HD1 LEU 52 -13.175 -26.376 -13.077
469 1HD2 LEU 52 1HD2 LEU 52 -11.722 -23.148 -11.332
470 2HD2 LEU 52 2HD2 LEU 52 -12.075 -23.139 -13.060
471 3HD2 LEU 52 3HD2 LEU 52 -10.418 -23.361 -12.499
Start of MODEL 7
1 1H MET 1 1HT MET 1 23.059 3.245 2.403
2 2H MET 1 2HT MET 1 21.775 3.439 1.309
3 H MET 1 H MET 1 22.719 3.656 1.804
4 3H MET 1 3HT MET 1 22.019 1.946 2.082
5 HA MET 1 HA MET 1 20.163 3.302 3.034
6 1HB MET 1 2HB MET 1 21.418 1.444 4.115
7 2HB MET 1 1HB MET 1 22.533 2.625 4.764
8 1HG MET 1 2HG MET 1 20.829 1.985 6.423
9 2HG MET 1 1HG MET 1 20.704 3.680 5.994
10 1HE MET 1 1HE MET 1 17.033 2.892 6.575
11 2HE MET 1 2HE MET 1 18.527 3.620 7.156
12 3HE MET 1 3HE MET 1 18.257 1.892 7.368
13 H ASP 2 H ASP 2 22.553 5.173 2.039
14 HA ASP 2 HA ASP 2 22.147 7.261 4.154
15 1HB ASP 2 2HB ASP 2 24.442 6.379 3.975
16 2HB ASP 2 1HB ASP 2 24.458 6.754 2.251
17 H LYS 3 H LYS 3 21.513 6.421 0.906
18 HA LYS 3 HA LYS 3 21.218 9.296 0.127
19 1HB LYS 3 2HB LYS 3 21.396 8.427 -2.171
20 2HB LYS 3 1HB LYS 3 22.762 7.881 -1.198
21 1HG LYS 3 2HG LYS 3 21.664 5.710 -0.840
22 2HG LYS 3 1HG LYS 3 20.269 6.251 -1.772
23 1HD LYS 3 2HD LYS 3 21.685 6.522 -3.762
24 2HD LYS 3 1HD LYS 3 23.102 6.029 -2.833
25 1HE LYS 3 2HE LYS 3 20.646 4.298 -3.314
26 2HE LYS 3 1HE LYS 3 22.211 4.115 -4.132
27 1HZ LYS 3 1HZ LYS 3 22.365 2.692 -2.306
28 2HZ LYS 3 2HZ LYS 3 21.587 3.781 -1.259
29 3HZ LYS 3 3HZ LYS 3 23.173 4.091 -1.786
30 H VAL 4 H VAL 4 19.547 6.182 0.349
31 HA VAL 4 HA VAL 4 17.151 6.943 -1.042
32 HB VAL 4 HB VAL 4 17.870 4.626 -0.494
33 1HG1 VAL 4 1HG1 VAL 4 16.990 5.219 2.338
34 2HG1 VAL 4 2HG1 VAL 4 18.678 5.320 1.841
35 3HG1 VAL 4 3HG1 VAL 4 17.820 3.784 1.735
36 1HG2 VAL 4 1HG2 VAL 4 15.279 5.056 0.962
37 2HG2 VAL 4 2HG2 VAL 4 15.704 3.806 -0.207
38 3HG2 VAL 4 3HG2 VAL 4 15.383 5.451 -0.753
39 H GLN 5 H GLN 5 18.341 7.657 2.156
40 HA GLN 5 HA GLN 5 15.737 8.342 3.272
41 1HB GLN 5 2HB GLN 5 18.588 8.860 4.169
42 2HB GLN 5 1HB GLN 5 17.154 9.076 5.175
43 1HG GLN 5 2HG GLN 5 16.602 6.685 4.907
44 2HG GLN 5 1HG GLN 5 18.040 6.466 3.909
45 1HE2 GLN 5 1HE2 GLN 5 16.962 6.042 7.030
46 2HE2 GLN 5 2HE2 GLN 5 18.439 6.171 7.855
47 H TYR 6 H TYR 6 18.663 10.364 2.855
48 HA TYR 6 HA TYR 6 17.411 12.876 3.047
49 1HB TYR 6 2HB TYR 6 19.795 11.973 1.401
50 2HB TYR 6 1HB TYR 6 19.442 13.648 1.810
51 HD1 TYR 6 1HD TYR 6 21.992 12.973 2.614
52 HD2 TYR 6 2HD TYR 6 18.336 11.893 4.609
53 HE1 TYR 6 1HE TYR 6 23.226 12.716 4.746
54 HE2 TYR 6 2HE TYR 6 19.577 11.636 6.735
55 HH TYR 6 HH TYR 6 23.070 11.757 6.856
56 H LEU 7 H LEU 7 17.666 10.716 0.253
57 HA LEU 7 HA LEU 7 16.809 12.635 -1.712
58 1HB LEU 7 2HB LEU 7 18.080 10.582 -2.178
59 2HB LEU 7 1HB LEU 7 16.696 9.632 -1.651
60 HG LEU 7 HG LEU 7 15.316 10.624 -3.437
61 1HD1 LEU 7 1HD2 LEU 7 17.067 11.786 -5.202
62 2HD1 LEU 7 2HD2 LEU 7 17.703 12.342 -3.654
63 3HD1 LEU 7 3HD2 LEU 7 16.029 12.682 -4.093
64 1HD2 LEU 7 1HD1 LEU 7 17.806 9.096 -3.959
65 2HD2 LEU 7 2HD1 LEU 7 17.028 9.799 -5.376
66 3HD2 LEU 7 3HD1 LEU 7 16.135 8.686 -4.340
67 H THR 8 H THR 8 15.063 9.869 -0.254
68 HA THR 8 HA THR 8 12.513 10.438 -1.338
69 HB THR 8 HB THR 8 13.307 9.189 1.308
70 HG1 THR 8 1HG THR 8 13.046 8.223 -1.333
71 1HG2 THR 8 1HG2 THR 8 10.882 9.790 1.086
72 2HG2 THR 8 2HG2 THR 8 11.168 8.055 1.221
73 3HG2 THR 8 3HG2 THR 8 10.808 8.769 -0.351
74 H ARG 9 H ARG 9 13.964 11.515 1.744
75 HA ARG 9 HA ARG 9 11.786 12.829 2.909
76 1HB ARG 9 2HB ARG 9 13.994 12.500 3.923
77 2HB ARG 9 1HB ARG 9 14.677 13.651 2.785
78 1HG ARG 9 2HG ARG 9 13.198 15.422 3.678
79 2HG ARG 9 1HG ARG 9 12.545 14.269 4.842
80 1HD ARG 9 2HD ARG 9 15.469 15.091 4.659
81 2HD ARG 9 1HD ARG 9 14.317 15.650 5.889
82 HE ARG 9 HE ARG 9 14.202 12.813 5.827
83 1HH1 ARG 9 1HH2 ARG 9 14.956 14.971 8.034
84 2HH1 ARG 9 2HH2 ARG 9 16.423 14.255 8.615
85 1HH2 ARG 9 1HH1 ARG 9 16.712 12.048 5.960
86 2HH2 ARG 9 2HH1 ARG 9 17.414 12.600 7.443
87 H SER 10 H SER 10 13.611 13.751 0.084
88 HA SER 10 HA SER 10 12.088 16.298 -0.045
89 1HB SER 10 2HB SER 10 14.822 15.594 -1.061
90 2HB SER 10 1HB SER 10 14.052 17.157 -1.282
91 HG SER 10 HG SER 10 15.181 17.430 0.541
92 H ALA 11 H ALA 11 12.572 13.269 -1.513
93 HA ALA 11 HA ALA 11 11.902 14.218 -4.222
94 1HB ALA 11 1HB ALA 11 13.562 12.581 -4.273
95 2HB ALA 11 2HB ALA 11 12.115 11.603 -4.523
96 3HB ALA 11 3HB ALA 11 12.856 11.690 -2.925
97 H ILE 12 H ILE 12 10.279 13.042 -1.431
98 HA ILE 12 HA ILE 12 7.871 12.487 -3.073
99 HB ILE 12 HB ILE 12 8.897 11.061 -0.640
100 1HG1 ILE 12 2HG1 ILE 12 10.093 10.509 -2.725
101 2HG1 ILE 12 1HG1 ILE 12 9.113 9.144 -2.186
102 1HG2 ILE 12 1HG2 ILE 12 6.961 9.500 -1.132
103 2HG2 ILE 12 2HG2 ILE 12 6.353 10.731 -2.239
104 3HG2 ILE 12 3HG2 ILE 12 6.497 11.087 -0.517
105 1HD1 ILE 12 1HD1 ILE 12 8.837 10.818 -4.600
106 2HD1 ILE 12 2HD1 ILE 12 7.323 10.507 -3.751
107 3HD1 ILE 12 3HD1 ILE 12 8.311 9.160 -4.313
108 H ARG 13 H ARG 13 9.148 13.678 0.012
109 HA ARG 13 HA ARG 13 6.639 14.291 1.239
110 1HB ARG 13 2HB ARG 13 9.384 15.561 1.478
111 2HB ARG 13 1HB ARG 13 8.094 15.760 2.651
112 1HG ARG 13 2HG ARG 13 9.517 13.189 1.904
113 2HG ARG 13 1HG ARG 13 9.606 14.030 3.445
114 1HD ARG 13 2HD ARG 13 7.055 12.801 2.329
115 2HD ARG 13 1HD ARG 13 8.103 12.022 3.518
116 HE ARG 13 HE ARG 13 7.230 13.477 5.154
117 1HH1 ARG 13 1HH2 ARG 13 5.188 13.894 2.690
118 2HH1 ARG 13 2HH2 ARG 13 4.891 15.585 2.912
119 1HH2 ARG 13 1HH1 ARG 13 7.505 16.024 5.148
120 2HH2 ARG 13 2HH1 ARG 13 6.203 16.792 4.301
121 H ARG 14 H ARG 14 8.932 16.482 -0.415
122 HA ARG 14 HA ARG 14 6.859 18.536 -0.611
123 1HB ARG 14 2HB ARG 14 8.672 19.873 -1.548
124 2HB ARG 14 1HB ARG 14 9.237 19.021 -0.112
125 1HG ARG 14 2HG ARG 14 10.225 17.265 -1.554
126 2HG ARG 14 1HG ARG 14 9.683 18.150 -2.980
127 1HD ARG 14 2HD ARG 14 11.535 19.274 -0.861
128 2HD ARG 14 1HD ARG 14 12.058 18.661 -2.443
129 HE ARG 14 HE ARG 14 9.950 20.519 -2.878
130 1HH1 ARG 14 1HH1 ARG 14 12.150 21.374 -0.656
131 2HH1 ARG 14 2HH1 ARG 14 12.995 22.550 -1.607
132 1HH2 ARG 14 1HH2 ARG 14 11.489 21.615 -4.587
133 2HH2 ARG 14 2HH2 ARG 14 12.623 22.685 -3.832
134 H ALA 15 H ALA 15 7.151 15.793 -2.289
135 HA ALA 15 HA ALA 15 6.500 17.067 -4.898
136 1HB ALA 15 1HB ALA 15 7.589 14.285 -4.537
137 2HB ALA 15 2HB ALA 15 8.669 15.678 -4.529
138 3HB ALA 15 3HB ALA 15 7.693 15.329 -5.955
139 H SER 16 H SER 16 5.388 15.005 -2.372
140 HA SER 16 HA SER 16 3.065 14.230 -4.045
141 1HB SER 16 2HB SER 16 4.647 12.615 -2.085
142 2HB SER 16 1HB SER 16 3.120 12.087 -2.754
143 HG SER 16 HG SER 16 5.542 11.890 -3.812
144 H THR 17 H THR 17 4.010 15.931 -1.377
145 HA THR 17 HA THR 17 1.378 15.528 -0.052
146 HB THR 17 HB THR 17 4.074 16.188 1.168
147 HG1 THR 17 1HG THR 17 2.481 13.842 1.218
148 1HG2 THR 17 1HG2 THR 17 2.701 15.573 3.292
149 2HG2 THR 17 2HG2 THR 17 1.294 15.917 2.286
150 3HG2 THR 17 3HG2 THR 17 2.491 17.176 2.589
151 H ILE 18 H ILE 18 3.151 17.647 -1.871
152 HA ILE 18 HA ILE 18 2.070 20.043 -0.491
153 HB ILE 18 HB ILE 18 4.551 19.797 -0.787
154 1HG1 ILE 18 2HG1 ILE 18 3.441 22.055 -0.727
155 2HG1 ILE 18 1HG1 ILE 18 4.957 22.034 -1.620
156 1HG2 ILE 18 1HG2 ILE 18 3.747 19.747 -3.700
157 2HG2 ILE 18 2HG2 ILE 18 4.703 18.558 -2.815
158 3HG2 ILE 18 3HG2 ILE 18 5.381 20.146 -3.173
159 1HD1 ILE 18 1HD1 ILE 18 3.109 21.461 -3.593
160 2HD1 ILE 18 2HD1 ILE 18 3.780 23.054 -3.266
161 3HD1 ILE 18 3HD1 ILE 18 2.230 22.593 -2.566
162 H GLU 19 H GLU 19 2.129 18.156 -3.444
163 HA GLU 19 HA GLU 19 0.456 20.165 -4.832
164 1HB GLU 19 2HB GLU 19 2.466 19.347 -5.956
165 2HB GLU 19 1HB GLU 19 1.894 17.697 -5.759
166 1HG GLU 19 2HG GLU 19 1.393 18.449 -8.025
167 2HG GLU 19 1HG GLU 19 -0.110 18.246 -7.128
168 H MET 20 H MET 20 0.436 16.873 -3.597
169 HA MET 20 HA MET 20 -2.489 16.730 -4.202
170 1HB MET 20 2HB MET 20 -0.408 14.573 -4.465
171 2HB MET 20 1HB MET 20 -2.124 14.364 -4.778
172 1HG MET 20 2HG MET 20 -0.281 16.271 -6.251
173 2HG MET 20 1HG MET 20 -0.887 14.740 -6.882
174 1HE MET 20 1HE MET 20 -2.424 17.825 -8.713
175 2HE MET 20 2HE MET 20 -2.333 16.122 -9.158
176 3HE MET 20 3HE MET 20 -0.936 16.912 -8.430
177 HA PRO 21 HA PRO 21 -1.336 15.658 0.228
178 1HB PRO 21 2HB PRO 21 -2.625 17.732 1.465
179 2HB PRO 21 1HB PRO 21 -0.939 17.828 0.936
180 1HG PRO 21 2HG PRO 21 -3.369 18.921 -0.334
181 2HG PRO 21 1HG PRO 21 -1.749 19.611 -0.229
182 1HD PRO 21 2HD PRO 21 -2.746 18.392 -2.469
183 2HD PRO 21 1HD PRO 21 -1.015 18.496 -2.082
184 H GLN 22 H GLN 22 -4.308 16.920 -1.248
185 HA GLN 22 HA GLN 22 -6.082 15.554 0.629
186 1HB GLN 22 2HB GLN 22 -6.529 16.867 -2.043
187 2HB GLN 22 1HB GLN 22 -7.803 16.419 -0.917
188 1HG GLN 22 2HG GLN 22 -5.556 18.378 -0.348
189 2HG GLN 22 1HG GLN 22 -7.229 18.815 -0.703
190 1HE2 GLN 22 1HE2 GLN 22 -5.149 18.390 1.864
191 2HE2 GLN 22 2HE2 GLN 22 -6.276 17.994 3.070
192 H GLN 23 H GLN 23 -4.917 15.011 -2.679
193 HA GLN 23 HA GLN 23 -6.536 12.666 -3.142
194 1HB GLN 23 2HB GLN 23 -5.673 14.117 -4.918
195 2HB GLN 23 1HB GLN 23 -4.031 13.715 -4.437
196 1HG GLN 23 2HG GLN 23 -4.447 11.342 -4.955
197 2HG GLN 23 1HG GLN 23 -6.091 11.742 -5.443
198 1HE2 GLN 23 1HE2 GLN 23 -4.203 14.359 -6.448
199 2HE2 GLN 23 2HE2 GLN 23 -3.867 13.835 -8.024
200 H ALA 24 H ALA 24 -3.044 13.130 -2.468
201 HA ALA 24 HA ALA 24 -2.247 10.437 -2.316
202 1HB ALA 24 1HB ALA 24 -0.466 11.319 -0.854
203 2HB ALA 24 2HB ALA 24 -1.429 12.763 -0.539
204 3HB ALA 24 3HB ALA 24 -0.797 12.461 -2.157
205 H ARG 25 H ARG 25 -3.741 12.463 0.217
206 HA ARG 25 HA ARG 25 -3.744 10.432 2.250
207 1HB ARG 25 2HB ARG 25 -3.950 12.843 2.676
208 2HB ARG 25 1HB ARG 25 -5.471 12.854 1.795
209 1HG ARG 25 2HG ARG 25 -6.466 11.319 3.427
210 2HG ARG 25 1HG ARG 25 -4.938 11.246 4.303
211 1HD ARG 25 2HD ARG 25 -6.579 13.769 3.863
212 2HD ARG 25 1HD ARG 25 -6.481 12.855 5.382
213 HE ARG 25 HE ARG 25 -4.482 14.684 4.446
214 1HH1 ARG 25 1HH2 ARG 25 -5.168 12.306 6.713
215 2HH1 ARG 25 2HH2 ARG 25 -3.518 11.966 7.118
216 1HH2 ARG 25 1HH1 ARG 25 -2.213 13.927 4.573
217 2HH2 ARG 25 2HH1 ARG 25 -1.846 12.882 5.904
218 H GLN 26 H GLN 26 -5.842 11.262 -0.417
219 HA GLN 26 HA GLN 26 -8.099 9.661 0.413
220 1HB GLN 26 2HB GLN 26 -8.215 11.632 -1.076
221 2HB GLN 26 1HB GLN 26 -7.248 10.762 -2.253
222 1HG GLN 26 2HG GLN 26 -9.600 10.605 -2.877
223 2HG GLN 26 1HG GLN 26 -9.008 9.015 -2.396
224 1HE2 GLN 26 1HE2 GLN 26 -11.572 11.135 -1.944
225 2HE2 GLN 26 2HE2 GLN 26 -12.142 10.549 -0.456
226 H ASN 27 H ASN 27 -5.852 9.298 -2.337
227 HA ASN 27 HA ASN 27 -6.466 6.690 -3.110
228 1HB ASN 27 2HB ASN 27 -4.968 8.230 -4.283
229 2HB ASN 27 1HB ASN 27 -3.802 8.082 -2.977
230 1HD2 ASN 27 1HD2 ASN 27 -2.153 6.635 -3.458
231 2HD2 ASN 27 2HD2 ASN 27 -2.321 5.253 -4.429
232 H LEU 28 H LEU 28 -4.545 7.754 -0.358
233 HA LEU 28 HA LEU 28 -3.109 5.477 0.355
234 1HB LEU 28 2HB LEU 28 -3.086 7.646 1.503
235 2HB LEU 28 1HB LEU 28 -4.707 7.332 2.101
236 HG LEU 28 HG LEU 28 -3.888 5.340 3.305
237 1HD1 LEU 28 1HD1 LEU 28 -1.320 5.190 3.485
238 2HD1 LEU 28 2HD1 LEU 28 -1.284 6.189 2.032
239 3HD1 LEU 28 3HD1 LEU 28 -2.055 4.603 1.993
240 1HD2 LEU 28 1HD2 LEU 28 -3.127 6.555 5.104
241 2HD2 LEU 28 2HD2 LEU 28 -3.663 7.901 4.096
242 3HD2 LEU 28 3HD2 LEU 28 -1.958 7.451 4.135
243 H GLN 29 H GLN 29 -6.573 5.947 0.453
244 HA GLN 29 HA GLN 29 -7.370 3.976 2.314
245 1HB GLN 29 2HB GLN 29 -9.477 4.034 1.049
246 2HB GLN 29 1HB GLN 29 -8.802 5.660 1.162
247 1HG GLN 29 2HG GLN 29 -7.798 5.380 -1.093
248 2HG GLN 29 1HG GLN 29 -8.536 3.784 -1.205
249 1HE2 GLN 29 1HE2 GLN 29 -9.023 6.927 -2.169
250 2HE2 GLN 29 2HE2 GLN 29 -10.715 6.923 -2.296
251 H ASN 30 H ASN 30 -5.944 3.590 -0.843
252 HA ASN 30 HA ASN 30 -6.890 1.073 -1.655
253 1HB ASN 30 2HB ASN 30 -4.139 2.275 -1.818
254 2HB ASN 30 1HB ASN 30 -4.692 0.937 -2.807
255 1HD2 ASN 30 1HD2 ASN 30 -7.421 2.844 -2.488
256 2HD2 ASN 30 2HD2 ASN 30 -7.217 3.834 -3.846
257 H LEU 31 H LEU 31 -4.332 1.852 0.680
258 HA LEU 31 HA LEU 31 -3.276 -0.716 1.136
259 1HB LEU 31 2HB LEU 31 -2.406 1.409 2.019
260 2HB LEU 31 1HB LEU 31 -3.812 1.526 3.068
261 HG LEU 31 HG LEU 31 -3.176 -0.580 4.180
262 1HD1 LEU 31 1HD1 LEU 31 -0.699 -1.272 3.608
263 2HD1 LEU 31 2HD1 LEU 31 -1.048 -0.494 2.064
264 3HD1 LEU 31 3HD1 LEU 31 -2.026 -1.858 2.605
265 1HD2 LEU 31 1HD2 LEU 31 -2.326 1.575 5.063
266 2HD2 LEU 31 2HD2 LEU 31 -0.899 1.422 4.037
267 3HD2 LEU 31 3HD2 LEU 31 -1.178 0.266 5.340
268 H PHE 32 H PHE 32 -6.272 0.726 2.312
269 HA PHE 32 HA PHE 32 -6.830 -1.365 4.228
270 1HB PHE 32 2HB PHE 32 -7.616 0.995 4.358
271 2HB PHE 32 1HB PHE 32 -8.601 0.723 2.926
272 HD1 PHE 32 1HD PHE 32 -10.254 1.655 4.833
273 HD2 PHE 32 2HD PHE 32 -8.609 -2.317 4.733
274 HE1 PHE 32 1HE PHE 32 -12.103 0.846 6.270
275 HE2 PHE 32 2HE PHE 32 -10.461 -3.118 6.164
276 HZ PHE 32 HZ PHE 32 -12.209 -1.538 6.934
277 H ILE 33 H ILE 33 -8.463 -0.432 1.175
278 HA ILE 33 HA ILE 33 -10.107 -2.724 0.929
279 HB ILE 33 HB ILE 33 -10.287 -0.627 -0.374
280 1HG1 ILE 33 2HG1 ILE 33 -9.803 -3.076 -2.106
281 2HG1 ILE 33 1HG1 ILE 33 -11.307 -2.702 -1.265
282 1HG2 ILE 33 1HG2 ILE 33 -7.837 -1.647 -1.844
283 2HG2 ILE 33 2HG2 ILE 33 -7.816 -0.334 -0.666
284 3HG2 ILE 33 3HG2 ILE 33 -8.715 -0.152 -2.171
285 1HD1 ILE 33 1HD1 ILE 33 -10.117 -0.665 -3.123
286 2HD1 ILE 33 2HD1 ILE 33 -11.803 -0.905 -2.666
287 3HD1 ILE 33 3HD1 ILE 33 -11.028 -2.020 -3.790
288 H ASN 34 H ASN 34 -6.688 -2.335 0.350
289 HA ASN 34 HA ASN 34 -6.353 -4.634 -1.373
290 1HB ASN 34 2HB ASN 34 -4.820 -2.703 -1.273
291 2HB ASN 34 1HB ASN 34 -4.434 -3.097 0.402
292 1HD2 ASN 34 1HD2 ASN 34 -3.254 -3.471 -2.689
293 2HD2 ASN 34 2HD2 ASN 34 -2.341 -4.884 -2.469
294 H PHE 35 H PHE 35 -5.252 -4.102 1.997
295 HA PHE 35 HA PHE 35 -4.646 -6.799 2.590
296 1HB PHE 35 2HB PHE 35 -5.603 -4.489 4.306
297 2HB PHE 35 1HB PHE 35 -4.944 -5.982 4.967
298 HD1 PHE 35 1HD PHE 35 -3.511 -3.817 5.883
299 HD2 PHE 35 2HD PHE 35 -3.198 -5.586 1.974
300 HE1 PHE 35 1HE PHE 35 -1.214 -2.918 5.655
301 HE2 PHE 35 2HE PHE 35 -0.903 -4.682 1.753
302 HZ PHE 35 HZ PHE 35 0.089 -3.348 3.591
303 H CYS 36 H CYS 36 -7.748 -5.272 2.270
304 HA CYS 36 HA CYS 36 -9.176 -7.216 3.909
305 1HB CYS 36 2HB CYS 36 -9.901 -4.879 3.639
306 2HB CYS 36 1HB CYS 36 -10.077 -5.130 1.902
307 HG CYS 36 HG CYS 36 -11.747 -7.122 3.483
308 H LEU 37 H LEU 37 -8.696 -6.635 0.431
309 HA LEU 37 HA LEU 37 -10.343 -8.922 -0.322
310 1HB LEU 37 2HB LEU 37 -8.539 -7.041 -1.848
311 2HB LEU 37 1HB LEU 37 -9.631 -8.213 -2.593
312 HG LEU 37 HG LEU 37 -10.445 -5.944 -0.753
313 1HD1 LEU 37 1HD1 LEU 37 -11.377 -6.296 -3.563
314 2HD1 LEU 37 2HD1 LEU 37 -9.757 -5.655 -3.295
315 3HD1 LEU 37 3HD1 LEU 37 -11.160 -4.813 -2.635
316 1HD2 LEU 37 1HD2 LEU 37 -12.008 -7.654 -0.325
317 2HD2 LEU 37 2HD2 LEU 37 -11.942 -8.254 -1.983
318 3HD2 LEU 37 3HD2 LEU 37 -12.771 -6.739 -1.626
319 H ILE 38 H ILE 38 -6.890 -8.153 -0.095
320 HA ILE 38 HA ILE 38 -5.914 -10.513 -1.407
321 HB ILE 38 HB ILE 38 -4.720 -8.697 0.670
322 1HG1 ILE 38 2HG1 ILE 38 -5.475 -7.534 -1.370
323 2HG1 ILE 38 1HG1 ILE 38 -3.714 -7.565 -1.283
324 1HG2 ILE 38 1HG2 ILE 38 -3.202 -10.434 0.679
325 2HG2 ILE 38 2HG2 ILE 38 -2.602 -9.537 -0.715
326 3HG2 ILE 38 3HG2 ILE 38 -3.631 -10.949 -0.953
327 1HD1 ILE 38 1HD1 ILE 38 -5.504 -8.815 -3.239
328 2HD1 ILE 38 2HD1 ILE 38 -4.297 -9.928 -2.593
329 3HD1 ILE 38 3HD1 ILE 38 -3.790 -8.431 -3.373
330 H LEU 39 H LEU 39 -6.782 -9.818 1.963
331 HA LEU 39 HA LEU 39 -5.681 -12.308 2.976
332 1HB LEU 39 2HB LEU 39 -7.599 -10.250 4.095
333 2HB LEU 39 1HB LEU 39 -6.877 -11.553 5.039
334 HG LEU 39 HG LEU 39 -5.330 -9.417 3.542
335 1HD1 LEU 39 1HD2 LEU 39 -6.672 -8.871 5.737
336 2HD1 LEU 39 2HD2 LEU 39 -5.001 -8.329 5.583
337 3HD1 LEU 39 3HD2 LEU 39 -5.377 -9.773 6.526
338 1HD2 LEU 39 1HD1 LEU 39 -3.598 -10.840 3.735
339 2HD2 LEU 39 2HD1 LEU 39 -4.604 -12.004 4.600
340 3HD2 LEU 39 3HD1 LEU 39 -3.760 -10.735 5.488
341 H ILE 40 H ILE 40 -8.664 -11.389 1.471
342 HA ILE 40 HA ILE 40 -10.005 -13.837 2.462
343 HB ILE 40 HB ILE 40 -11.015 -11.402 1.025
344 1HG1 ILE 40 2HG1 ILE 40 -11.256 -12.263 3.921
345 2HG1 ILE 40 1HG1 ILE 40 -10.236 -10.954 3.325
346 1HG2 ILE 40 1HG2 ILE 40 -12.431 -13.802 2.197
347 2HG2 ILE 40 2HG2 ILE 40 -12.469 -13.250 0.522
348 3HG2 ILE 40 3HG2 ILE 40 -13.260 -12.301 1.781
349 1HD1 ILE 40 1HD1 ILE 40 -12.400 -9.968 2.324
350 2HD1 ILE 40 2HD1 ILE 40 -12.199 -9.863 4.072
351 3HD1 ILE 40 3HD1 ILE 40 -13.249 -11.099 3.380
352 H PHE 41 H PHE 41 -8.942 -12.196 -0.477
353 HA PHE 41 HA PHE 41 -10.208 -13.839 -2.411
354 1HB PHE 41 2HB PHE 41 -9.028 -11.700 -2.826
355 2HB PHE 41 1HB PHE 41 -7.491 -12.486 -2.464
356 HD1 PHE 41 1HD PHE 41 -10.534 -13.252 -4.531
357 HD2 PHE 41 2HD PHE 41 -6.246 -13.090 -4.336
358 HE1 PHE 41 1HE PHE 41 -10.397 -14.054 -6.873
359 HE2 PHE 41 2HE PHE 41 -6.108 -13.891 -6.678
360 HZ PHE 41 HZ PHE 41 -8.184 -14.373 -7.948
361 H LEU 42 H LEU 42 -7.110 -14.269 -0.691
362 HA LEU 42 HA LEU 42 -6.104 -16.498 -2.102
363 1HB LEU 42 2HB LEU 42 -6.007 -15.795 0.851
364 2HB LEU 42 1HB LEU 42 -4.934 -16.953 0.065
365 HG LEU 42 HG LEU 42 -5.188 -14.024 -0.684
366 1HD1 LEU 42 1HD1 LEU 42 -2.575 -14.736 0.173
367 2HD1 LEU 42 2HD1 LEU 42 -3.698 -15.355 1.384
368 3HD1 LEU 42 3HD1 LEU 42 -3.706 -13.641 0.967
369 1HD2 LEU 42 1HD2 LEU 42 -4.164 -16.307 -2.086
370 2HD2 LEU 42 2HD2 LEU 42 -2.812 -15.260 -1.647
371 3HD2 LEU 42 3HD2 LEU 42 -4.156 -14.617 -2.591
372 H LEU 43 H LEU 43 -8.383 -16.405 0.644
373 HA LEU 43 HA LEU 43 -8.704 -19.279 0.768
374 1HB LEU 43 2HB LEU 43 -9.047 -17.744 2.668
375 2HB LEU 43 1HB LEU 43 -10.377 -16.970 1.806
376 HG LEU 43 HG LEU 43 -11.605 -19.114 1.773
377 1HD1 LEU 43 1HD1 LEU 43 -9.107 -20.068 3.182
378 2HD1 LEU 43 2HD1 LEU 43 -9.884 -20.751 1.753
379 3HD1 LEU 43 3HD1 LEU 43 -10.642 -20.922 3.336
380 1HD2 LEU 43 1HD2 LEU 43 -12.282 -19.071 4.046
381 2HD2 LEU 43 2HD2 LEU 43 -11.680 -17.442 3.735
382 3HD2 LEU 43 3HD2 LEU 43 -10.674 -18.605 4.602
383 H LEU 44 H LEU 44 -10.350 -16.631 -0.898
384 HA LEU 44 HA LEU 44 -12.735 -17.967 -1.657
385 1HB LEU 44 2HB LEU 44 -12.069 -15.525 -1.677
386 2HB LEU 44 1HB LEU 44 -11.117 -15.867 -3.116
387 HG LEU 44 HG LEU 44 -13.350 -14.938 -3.585
388 1HD1 LEU 44 1HD2 LEU 44 -13.408 -17.733 -4.642
389 2HD1 LEU 44 2HD2 LEU 44 -12.023 -16.713 -5.029
390 3HD1 LEU 44 3HD2 LEU 44 -13.646 -16.210 -5.501
391 1HD2 LEU 44 1HD1 LEU 44 -15.262 -15.805 -2.748
392 2HD2 LEU 44 2HD1 LEU 44 -14.213 -16.668 -1.625
393 3HD2 LEU 44 3HD1 LEU 44 -14.761 -17.458 -3.102
394 H ILE 45 H ILE 45 -9.721 -17.442 -3.547
395 HA ILE 45 HA ILE 45 -10.455 -19.001 -5.801
396 HB ILE 45 HB ILE 45 -8.020 -18.964 -6.238
397 1HG1 ILE 45 2HG1 ILE 45 -7.850 -17.932 -3.387
398 2HG1 ILE 45 1HG1 ILE 45 -7.284 -19.509 -3.942
399 1HG2 ILE 45 1HG2 ILE 45 -8.514 -16.856 -6.866
400 2HG2 ILE 45 2HG2 ILE 45 -7.940 -16.331 -5.284
401 3HG2 ILE 45 3HG2 ILE 45 -9.653 -16.663 -5.535
402 1HD1 ILE 45 1HD1 ILE 45 -5.809 -18.259 -5.598
403 2HD1 ILE 45 2HD1 ILE 45 -5.359 -18.087 -3.902
404 3HD1 ILE 45 3HD1 ILE 45 -6.222 -16.785 -4.723
405 H CYS 46 H CYS 46 -9.350 -19.984 -2.634
406 HA CYS 46 HA CYS 46 -8.218 -22.508 -3.178
407 1HB CYS 46 2HB CYS 46 -8.222 -21.358 -1.010
408 2HB CYS 46 1HB CYS 46 -9.958 -21.610 -0.897
409 HG CYS 46 HG CYS 46 -8.786 -24.292 -1.284
410 H ILE 47 H ILE 47 -11.639 -21.597 -2.806
411 HA ILE 47 HA ILE 47 -12.779 -24.185 -2.813
412 HB ILE 47 HB ILE 47 -13.751 -21.529 -3.906
413 1HG1 ILE 47 2HG1 ILE 47 -14.112 -22.877 -1.210
414 2HG1 ILE 47 1HG1 ILE 47 -13.090 -21.476 -1.529
415 1HG2 ILE 47 1HG2 ILE 47 -15.877 -23.087 -2.908
416 2HG2 ILE 47 2HG2 ILE 47 -14.932 -24.160 -3.940
417 3HG2 ILE 47 3HG2 ILE 47 -15.572 -22.649 -4.587
418 1HD1 ILE 47 1HD1 ILE 47 -16.029 -21.640 -1.257
419 2HD1 ILE 47 2HD1 ILE 47 -15.459 -20.629 -2.584
420 3HD1 ILE 47 3HD1 ILE 47 -14.942 -20.291 -0.932
421 H ILE 48 H ILE 48 -11.357 -22.335 -5.410
422 HA ILE 48 HA ILE 48 -12.592 -23.993 -7.495
423 HB ILE 48 HB ILE 48 -10.615 -21.733 -7.544
424 1HG1 ILE 48 2HG1 ILE 48 -13.590 -21.818 -8.116
425 2HG1 ILE 48 1HG1 ILE 48 -12.842 -21.111 -6.681
426 1HG2 ILE 48 1HG2 ILE 48 -12.159 -22.162 -9.961
427 2HG2 ILE 48 2HG2 ILE 48 -11.210 -23.592 -9.553
428 3HG2 ILE 48 3HG2 ILE 48 -10.410 -22.036 -9.769
429 1HD1 ILE 48 1HD1 ILE 48 -11.506 -19.630 -8.287
430 2HD1 ILE 48 2HD1 ILE 48 -13.230 -19.282 -8.158
431 3HD1 ILE 48 3HD1 ILE 48 -12.613 -20.177 -9.546
432 H VAL 49 H VAL 49 -9.523 -23.624 -5.824
433 HA VAL 49 HA VAL 49 -7.950 -25.215 -7.672
434 HB VAL 49 HB VAL 49 -7.588 -24.498 -4.742
435 1HG1 VAL 49 1HG2 VAL 49 -5.994 -26.052 -6.646
436 2HG1 VAL 49 2HG2 VAL 49 -5.829 -25.916 -4.895
437 3HG1 VAL 49 3HG2 VAL 49 -5.098 -24.704 -5.947
438 1HG2 VAL 49 1HG1 VAL 49 -7.739 -22.808 -6.925
439 2HG2 VAL 49 2HG1 VAL 49 -6.007 -23.105 -6.787
440 3HG2 VAL 49 3HG1 VAL 49 -6.899 -22.445 -5.417
441 H MET 50 H MET 50 -9.704 -25.912 -4.648
442 HA MET 50 HA MET 50 -8.825 -28.591 -4.292
443 1HB MET 50 2HB MET 50 -11.421 -27.235 -3.608
444 2HB MET 50 1HB MET 50 -10.864 -28.741 -2.894
445 1HG MET 50 2HG MET 50 -8.869 -27.588 -2.016
446 2HG MET 50 1HG MET 50 -9.423 -26.077 -2.735
447 1HE MET 50 1HE MET 50 -11.183 -28.506 0.662
448 2HE MET 50 2HE MET 50 -10.285 -29.037 -0.757
449 3HE MET 50 3HE MET 50 -12.015 -28.726 -0.883
450 H LEU 51 H LEU 51 -11.037 -27.207 -6.580
451 HA LEU 51 HA LEU 51 -12.050 -29.934 -7.294
452 1HB LEU 51 2HB LEU 51 -13.105 -27.131 -7.770
453 2HB LEU 51 1HB LEU 51 -13.830 -28.567 -8.484
454 HG LEU 51 HG LEU 51 -14.101 -29.492 -6.145
455 1HD1 LEU 51 1HD2 LEU 51 -12.749 -26.930 -5.554
456 2HD1 LEU 51 2HD2 LEU 51 -12.820 -28.411 -4.598
457 3HD1 LEU 51 3HD2 LEU 51 -14.160 -27.266 -4.551
458 1HD2 LEU 51 1HD1 LEU 51 -16.051 -28.573 -7.143
459 2HD2 LEU 51 2HD1 LEU 51 -15.443 -26.924 -7.001
460 3HD2 LEU 51 3HD1 LEU 51 -15.955 -27.801 -5.560
461 H LEU 52 H LEU 52 -11.215 -26.845 -8.934
462 HA LEU 52 HA LEU 52 -10.380 -28.428 -11.321
463 1HB LEU 52 2HB LEU 52 -11.017 -25.502 -10.834
464 2HB LEU 52 1HB LEU 52 -10.422 -26.113 -12.376
465 HG LEU 52 HG LEU 52 -12.381 -27.699 -12.419
466 1HD1 LEU 52 1HD1 LEU 52 -12.987 -26.208 -9.886
467 2HD1 LEU 52 2HD1 LEU 52 -13.155 -27.928 -10.233
468 3HD1 LEU 52 3HD1 LEU 52 -14.317 -26.778 -10.892
469 1HD2 LEU 52 1HD2 LEU 52 -12.218 -25.174 -13.307
470 2HD2 LEU 52 2HD2 LEU 52 -13.548 -24.967 -12.167
471 3HD2 LEU 52 3HD2 LEU 52 -13.688 -26.134 -13.483
Start of MODEL 8
1 1H MET 1 1HT MET 1 23.537 -6.709 -3.982
2 2H MET 1 2HT MET 1 24.925 -6.131 -4.773
3 H MET 1 H MET 1 24.226 -6.604 -3.950
4 3H MET 1 3HT MET 1 23.542 -6.545 -5.671
5 HA MET 1 HA MET 1 23.967 -4.082 -5.265
6 1HB MET 1 2HB MET 1 21.501 -3.795 -5.008
7 2HB MET 1 1HB MET 1 21.921 -5.048 -6.160
8 1HG MET 1 2HG MET 1 21.560 -6.778 -4.476
9 2HG MET 1 1HG MET 1 21.205 -5.536 -3.284
10 1HE MET 1 1HE MET 1 18.963 -6.903 -6.920
11 2HE MET 1 2HE MET 1 20.689 -6.625 -6.699
12 3HE MET 1 3HE MET 1 19.646 -5.294 -7.194
13 H ASP 2 H ASP 2 24.057 -2.514 -3.746
14 HA ASP 2 HA ASP 2 23.042 -2.811 -1.036
15 1HB ASP 2 2HB ASP 2 25.292 -2.868 0.034
16 2HB ASP 2 1HB ASP 2 24.989 -4.296 -0.953
17 H LYS 3 H LYS 3 25.165 -1.049 -3.283
18 HA LYS 3 HA LYS 3 24.588 1.455 -1.747
19 1HB LYS 3 2HB LYS 3 26.671 2.269 -2.739
20 2HB LYS 3 1HB LYS 3 26.948 0.722 -1.940
21 1HG LYS 3 2HG LYS 3 26.820 -0.452 -4.074
22 2HG LYS 3 1HG LYS 3 26.434 1.056 -4.906
23 1HD LYS 3 2HD LYS 3 28.820 0.545 -5.154
24 2HD LYS 3 1HD LYS 3 28.598 1.997 -4.176
25 1HE LYS 3 2HE LYS 3 28.875 0.663 -2.112
26 2HE LYS 3 1HE LYS 3 29.111 -0.797 -3.093
27 1HZ LYS 3 1HZ LYS 3 31.171 0.566 -2.388
28 2HZ LYS 3 2HZ LYS 3 30.701 1.629 -3.628
29 3HZ LYS 3 3HZ LYS 3 31.068 0.009 -3.986
30 H VAL 4 H VAL 4 24.343 -0.153 -4.852
31 HA VAL 4 HA VAL 4 23.757 2.215 -6.419
32 HB VAL 4 HB VAL 4 23.021 0.497 -8.073
33 1HG1 VAL 4 1HG2 VAL 4 25.177 -0.138 -8.515
34 2HG1 VAL 4 2HG2 VAL 4 25.451 -0.725 -6.874
35 3HG1 VAL 4 3HG2 VAL 4 25.534 1.003 -7.219
36 1HG2 VAL 4 1HG1 VAL 4 22.525 -1.654 -7.507
37 2HG2 VAL 4 2HG1 VAL 4 22.276 -0.978 -5.899
38 3HG2 VAL 4 3HG1 VAL 4 23.812 -1.739 -6.306
39 H GLN 5 H GLN 5 21.885 0.150 -4.315
40 HA GLN 5 HA GLN 5 19.284 0.904 -5.370
41 1HB GLN 5 2HB GLN 5 20.197 -0.354 -2.766
42 2HB GLN 5 1HB GLN 5 18.524 -0.290 -3.317
43 1HG GLN 5 2HG GLN 5 20.805 -1.635 -4.797
44 2HG GLN 5 1HG GLN 5 19.558 -2.467 -3.868
45 1HE2 GLN 5 1HE2 GLN 5 20.340 -1.609 -6.998
46 2HE2 GLN 5 2HE2 GLN 5 18.783 -1.573 -7.670
47 H TYR 6 H TYR 6 20.921 1.600 -2.257
48 HA TYR 6 HA TYR 6 19.123 3.608 -1.372
49 1HB TYR 6 2HB TYR 6 20.836 2.427 -0.017
50 2HB TYR 6 1HB TYR 6 22.104 3.286 -0.892
51 HD1 TYR 6 1HD TYR 6 18.853 4.175 0.776
52 HD2 TYR 6 2HD TYR 6 23.018 5.093 0.250
53 HE1 TYR 6 1HE TYR 6 18.628 6.091 2.334
54 HE2 TYR 6 2HE TYR 6 22.790 7.010 1.808
55 HH TYR 6 HH TYR 6 20.987 7.498 3.867
56 H LEU 7 H LEU 7 21.935 3.780 -3.519
57 HA LEU 7 HA LEU 7 22.259 6.606 -3.591
58 1HB LEU 7 2HB LEU 7 23.869 4.960 -4.428
59 2HB LEU 7 1HB LEU 7 22.721 4.483 -5.670
60 HG LEU 7 HG LEU 7 22.775 6.759 -6.614
61 1HD1 LEU 7 1HD1 LEU 7 24.664 8.254 -5.743
62 2HD1 LEU 7 2HD1 LEU 7 24.706 7.200 -4.328
63 3HD1 LEU 7 3HD1 LEU 7 23.244 8.112 -4.707
64 1HD2 LEU 7 1HD2 LEU 7 24.340 5.609 -7.817
65 2HD2 LEU 7 2HD2 LEU 7 25.162 5.021 -6.371
66 3HD2 LEU 7 3HD2 LEU 7 25.474 6.654 -6.961
67 H THR 8 H THR 8 20.497 4.458 -5.838
68 HA THR 8 HA THR 8 19.340 6.582 -7.389
69 HB THR 8 HB THR 8 18.471 3.720 -6.920
70 HG1 THR 8 1HG THR 8 20.500 3.652 -7.701
71 1HG2 THR 8 1HG2 THR 8 16.681 4.627 -8.073
72 2HG2 THR 8 2HG2 THR 8 17.723 4.165 -9.419
73 3HG2 THR 8 3HG2 THR 8 17.679 5.841 -8.874
74 H ARG 9 H ARG 9 18.433 5.000 -4.397
75 HA ARG 9 HA ARG 9 15.685 5.407 -4.203
76 1HB ARG 9 2HB ARG 9 17.168 4.348 -2.531
77 2HB ARG 9 1HB ARG 9 17.790 5.938 -2.119
78 1HG ARG 9 2HG ARG 9 16.054 5.285 -0.515
79 2HG ARG 9 1HG ARG 9 15.507 6.660 -1.477
80 1HD ARG 9 2HD ARG 9 14.230 5.150 -2.951
81 2HD ARG 9 1HD ARG 9 14.802 3.750 -2.022
82 HE ARG 9 HE ARG 9 12.648 5.453 -1.223
83 1HH1 ARG 9 1HH2 ARG 9 13.101 2.790 0.000
84 2HH1 ARG 9 2HH2 ARG 9 13.584 3.190 1.614
85 1HH2 ARG 9 1HH1 ARG 9 14.312 6.495 0.862
86 2HH2 ARG 9 2HH1 ARG 9 14.270 5.287 2.102
87 H SER 10 H SER 10 18.266 7.793 -3.952
88 HA SER 10 HA SER 10 16.715 9.985 -2.986
89 1HB SER 10 2HB SER 10 19.167 9.878 -3.007
90 2HB SER 10 1HB SER 10 19.141 9.870 -4.762
91 HG SER 10 HG SER 10 19.447 11.968 -4.159
92 H ALA 11 H ALA 11 17.121 8.559 -6.167
93 HA ALA 11 HA ALA 11 15.905 10.800 -7.591
94 1HB ALA 11 1HB ALA 11 17.331 9.661 -8.986
95 2HB ALA 11 2HB ALA 11 15.884 8.707 -9.315
96 3HB ALA 11 3HB ALA 11 17.077 8.130 -8.150
97 H ILE 12 H ILE 12 14.881 7.706 -6.241
98 HA ILE 12 HA ILE 12 12.309 7.599 -7.518
99 HB ILE 12 HB ILE 12 13.355 6.393 -4.971
100 1HG1 ILE 12 2HG1 ILE 12 13.307 5.339 -7.812
101 2HG1 ILE 12 1HG1 ILE 12 14.746 5.858 -6.933
102 1HG2 ILE 12 1HG2 ILE 12 10.782 6.255 -6.314
103 2HG2 ILE 12 2HG2 ILE 12 11.249 5.625 -4.734
104 3HG2 ILE 12 3HG2 ILE 12 11.529 4.663 -6.185
105 1HD1 ILE 12 1HD1 ILE 12 13.292 3.324 -6.778
106 2HD1 ILE 12 2HD1 ILE 12 13.554 4.051 -5.193
107 3HD1 ILE 12 3HD1 ILE 12 14.928 3.712 -6.245
108 H ARG 13 H ARG 13 13.304 8.553 -4.216
109 HA ARG 13 HA ARG 13 10.726 9.349 -3.304
110 1HB ARG 13 2HB ARG 13 13.508 10.317 -2.573
111 2HB ARG 13 1HB ARG 13 12.067 10.554 -1.588
112 1HG ARG 13 2HG ARG 13 13.216 7.864 -2.399
113 2HG ARG 13 1HG ARG 13 13.377 8.604 -0.808
114 1HD ARG 13 2HD ARG 13 10.742 7.840 -2.126
115 2HD ARG 13 1HD ARG 13 11.528 6.972 -0.797
116 HE ARG 13 HE ARG 13 11.340 9.690 -0.028
117 1HH1 ARG 13 1HH1 ARG 13 8.720 8.539 -1.529
118 2HH1 ARG 13 2HH1 ARG 13 7.712 8.343 -0.133
119 1HH2 ARG 13 1HH2 ARG 13 10.305 8.780 2.128
120 2HH2 ARG 13 2HH2 ARG 13 8.611 8.474 1.938
121 H ARG 14 H ARG 14 12.971 10.920 -5.457
122 HA ARG 14 HA ARG 14 12.198 13.633 -5.091
123 1HB ARG 14 2HB ARG 14 14.201 12.909 -6.276
124 2HB ARG 14 1HB ARG 14 13.225 12.033 -7.456
125 1HG ARG 14 2HG ARG 14 13.921 14.191 -8.383
126 2HG ARG 14 1HG ARG 14 12.177 14.143 -8.132
127 1HD ARG 14 2HD ARG 14 12.397 15.398 -6.036
128 2HD ARG 14 1HD ARG 14 14.162 15.397 -6.205
129 HE ARG 14 HE ARG 14 13.893 17.196 -7.699
130 1HH1 ARG 14 1HH2 ARG 14 10.795 16.463 -6.877
131 2HH1 ARG 14 2HH2 ARG 14 10.079 16.827 -8.411
132 1HH2 ARG 14 1HH1 ARG 14 13.119 17.112 -10.059
133 2HH2 ARG 14 2HH1 ARG 14 11.396 17.196 -10.214
134 H ALA 15 H ALA 15 10.644 10.922 -6.632
135 HA ALA 15 HA ALA 15 8.567 12.736 -7.753
136 1HB ALA 15 1HB ALA 15 10.190 10.894 -9.011
137 2HB ALA 15 2HB ALA 15 8.653 11.479 -9.649
138 3HB ALA 15 3HB ALA 15 8.712 9.970 -8.737
139 H SER 16 H SER 16 9.235 9.983 -5.703
140 HA SER 16 HA SER 16 6.379 9.342 -5.404
141 1HB SER 16 2HB SER 16 8.028 7.560 -5.703
142 2HB SER 16 1HB SER 16 8.897 8.138 -4.292
143 HG SER 16 HG SER 16 7.519 6.414 -3.751
144 H THR 17 H THR 17 7.760 11.861 -4.291
145 HA THR 17 HA THR 17 6.908 11.463 -1.466
146 HB THR 17 HB THR 17 9.200 13.107 -2.575
147 HG1 THR 17 1HG THR 17 9.614 10.890 -2.543
148 1HG2 THR 17 1HG2 THR 17 7.734 13.335 -0.135
149 2HG2 THR 17 2HG2 THR 17 9.180 14.218 -0.624
150 3HG2 THR 17 3HG2 THR 17 9.332 12.693 0.247
151 H ILE 18 H ILE 18 6.508 13.273 -4.347
152 HA ILE 18 HA ILE 18 5.364 15.589 -2.918
153 HB ILE 18 HB ILE 18 6.017 15.077 -5.805
154 1HG1 ILE 18 2HG1 ILE 18 7.997 15.211 -4.342
155 2HG1 ILE 18 1HG1 ILE 18 7.894 16.632 -5.384
156 1HG2 ILE 18 1HG2 ILE 18 4.248 16.946 -4.757
157 2HG2 ILE 18 2HG2 ILE 18 5.032 17.041 -6.334
158 3HG2 ILE 18 3HG2 ILE 18 5.749 17.851 -4.942
159 1HD1 ILE 18 1HD1 ILE 18 6.385 17.338 -3.153
160 2HD1 ILE 18 2HD1 ILE 18 8.031 17.871 -3.501
161 3HD1 ILE 18 3HD1 ILE 18 7.758 16.462 -2.475
162 H GLU 19 H GLU 19 4.516 12.882 -4.978
163 HA GLU 19 HA GLU 19 1.675 13.750 -4.920
164 1HB GLU 19 2HB GLU 19 2.727 13.665 -7.136
165 2HB GLU 19 1HB GLU 19 3.168 11.989 -6.841
166 1HG GLU 19 2HG GLU 19 1.117 12.121 -8.202
167 2HG GLU 19 1HG GLU 19 0.788 11.383 -6.635
168 H MET 20 H MET 20 3.936 11.304 -3.996
169 HA MET 20 HA MET 20 2.205 9.043 -3.816
170 1HB MET 20 2HB MET 20 4.661 8.986 -3.703
171 2HB MET 20 1HB MET 20 4.625 9.831 -2.166
172 1HG MET 20 2HG MET 20 4.880 7.416 -1.824
173 2HG MET 20 1HG MET 20 3.336 7.978 -1.201
174 1HE MET 20 1HE MET 20 3.781 4.532 -2.335
175 2HE MET 20 2HE MET 20 2.057 4.778 -2.065
176 3HE MET 20 3HE MET 20 3.228 5.595 -1.032
177 HA PRO 21 HA PRO 21 1.315 10.417 0.670
178 1HB PRO 21 2HB PRO 21 1.736 13.035 1.345
179 2HB PRO 21 1HB PRO 21 2.966 11.779 1.548
180 1HG PRO 21 2HG PRO 21 2.719 13.848 -0.534
181 2HG PRO 21 1HG PRO 21 4.167 13.167 0.210
182 1HD PRO 21 2HD PRO 21 3.227 12.495 -2.281
183 2HD PRO 21 1HD PRO 21 4.283 11.468 -1.292
184 H GLN 22 H GLN 22 0.971 13.266 -1.492
185 HA GLN 22 HA GLN 22 -1.619 14.063 -0.672
186 1HB GLN 22 2HB GLN 22 -0.267 14.150 -3.360
187 2HB GLN 22 1HB GLN 22 -1.671 15.114 -2.927
188 1HG GLN 22 2HG GLN 22 1.025 15.203 -1.537
189 2HG GLN 22 1HG GLN 22 0.413 16.415 -2.662
190 1HE2 GLN 22 1HE2 GLN 22 0.719 15.824 0.604
191 2HE2 GLN 22 2HE2 GLN 22 -0.577 16.756 1.179
192 H GLN 23 H GLN 23 -0.573 11.508 -2.860
193 HA GLN 23 HA GLN 23 -3.271 10.908 -3.798
194 1HB GLN 23 2HB GLN 23 -1.261 10.653 -5.195
195 2HB GLN 23 1HB GLN 23 -0.639 9.473 -4.049
196 1HG GLN 23 2HG GLN 23 -2.579 8.014 -4.479
197 2HG GLN 23 1HG GLN 23 -3.201 9.191 -5.635
198 1HE2 GLN 23 1HE2 GLN 23 -2.684 8.658 -7.755
199 2HE2 GLN 23 2HE2 GLN 23 -1.282 7.832 -8.243
200 H ALA 24 H ALA 24 -0.883 9.451 -1.588
201 HA ALA 24 HA ALA 24 -2.225 7.075 -0.899
202 1HB ALA 24 1HB ALA 24 -1.103 8.043 1.463
203 2HB ALA 24 2HB ALA 24 -0.198 8.881 0.201
204 3HB ALA 24 3HB ALA 24 -0.251 7.119 0.227
205 H ARG 25 H ARG 25 -2.679 10.370 0.370
206 HA ARG 25 HA ARG 25 -4.557 9.830 2.415
207 1HB ARG 25 2HB ARG 25 -3.408 11.973 1.967
208 2HB ARG 25 1HB ARG 25 -4.361 12.146 0.501
209 1HG ARG 25 2HG ARG 25 -6.438 12.135 1.851
210 2HG ARG 25 1HG ARG 25 -5.464 12.018 3.318
211 1HD ARG 25 2HD ARG 25 -5.313 14.291 1.301
212 2HD ARG 25 1HD ARG 25 -6.101 14.374 2.889
213 HE ARG 25 HE ARG 25 -3.473 13.388 3.300
214 1HH1 ARG 25 1HH2 ARG 25 -3.324 15.642 1.116
215 2HH1 ARG 25 2HH2 ARG 25 -2.867 16.980 2.117
216 1HH2 ARG 25 1HH1 ARG 25 -3.637 15.363 5.087
217 2HH2 ARG 25 2HH1 ARG 25 -3.038 16.820 4.366
218 H GLN 26 H GLN 26 -5.123 10.659 -1.008
219 HA GLN 26 HA GLN 26 -7.974 10.253 -0.909
220 1HB GLN 26 2HB GLN 26 -5.989 10.304 -3.172
221 2HB GLN 26 1HB GLN 26 -7.729 10.495 -3.356
222 1HG GLN 26 2HG GLN 26 -5.911 12.313 -1.750
223 2HG GLN 26 1HG GLN 26 -6.592 12.689 -3.333
224 1HE2 GLN 26 1HE2 GLN 26 -7.107 13.218 -0.072
225 2HE2 GLN 26 2HE2 GLN 26 -8.781 13.495 -0.103
226 H ASN 27 H ASN 27 -5.343 8.366 -2.406
227 HA ASN 27 HA ASN 27 -6.836 6.143 -3.256
228 1HB ASN 27 2HB ASN 27 -4.505 6.615 -3.831
229 2HB ASN 27 1HB ASN 27 -4.039 6.311 -2.164
230 1HD2 ASN 27 1HD2 ASN 27 -3.169 4.256 -1.905
231 2HD2 ASN 27 2HD2 ASN 27 -3.656 2.876 -2.766
232 H LEU 28 H LEU 28 -5.974 7.096 -0.027
233 HA LEU 28 HA LEU 28 -5.911 4.697 1.406
234 1HB LEU 28 2HB LEU 28 -5.602 7.051 2.217
235 2HB LEU 28 1HB LEU 28 -7.346 7.234 2.155
236 HG LEU 28 HG LEU 28 -5.972 5.084 3.784
237 1HD1 LEU 28 1HD1 LEU 28 -6.695 7.929 4.417
238 2HD1 LEU 28 2HD1 LEU 28 -5.268 7.011 4.900
239 3HD1 LEU 28 3HD1 LEU 28 -6.819 6.707 5.682
240 1HD2 LEU 28 1HD2 LEU 28 -8.397 5.657 4.942
241 2HD2 LEU 28 2HD2 LEU 28 -8.121 4.334 3.808
242 3HD2 LEU 28 3HD2 LEU 28 -8.760 5.871 3.229
243 H GLN 29 H GLN 29 -8.700 6.359 -0.011
244 HA GLN 29 HA GLN 29 -10.817 5.007 1.281
245 1HB GLN 29 2HB GLN 29 -12.074 5.574 -0.756
246 2HB GLN 29 1HB GLN 29 -10.987 6.898 -0.337
247 1HG GLN 29 2HG GLN 29 -9.330 6.030 -1.970
248 2HG GLN 29 1HG GLN 29 -10.460 4.753 -2.414
249 1HE2 GLN 29 1HE2 GLN 29 -11.588 5.270 -4.289
250 2HE2 GLN 29 2HE2 GLN 29 -12.071 6.834 -4.740
251 H ASN 30 H ASN 30 -8.752 3.952 -1.400
252 HA ASN 30 HA ASN 30 -10.195 1.478 -1.851
253 1HB ASN 30 2HB ASN 30 -7.473 2.453 -2.675
254 2HB ASN 30 1HB ASN 30 -8.292 1.060 -3.370
255 1HD2 ASN 30 1HD2 ASN 30 -7.707 4.277 -3.976
256 2HD2 ASN 30 2HD2 ASN 30 -9.082 4.647 -4.901
257 H LEU 31 H LEU 31 -7.215 2.419 -0.150
258 HA LEU 31 HA LEU 31 -6.183 -0.111 0.506
259 1HB LEU 31 2HB LEU 31 -5.121 2.072 0.932
260 2HB LEU 31 1HB LEU 31 -6.331 2.396 2.165
261 HG LEU 31 HG LEU 31 -5.571 0.442 3.455
262 1HD1 LEU 31 1HD1 LEU 31 -3.853 0.094 1.020
263 2HD1 LEU 31 2HD1 LEU 31 -4.734 -1.119 1.947
264 3HD1 LEU 31 3HD1 LEU 31 -3.236 -0.441 2.583
265 1HD2 LEU 31 1HD2 LEU 31 -4.454 2.347 4.201
266 2HD2 LEU 31 2HD2 LEU 31 -3.633 2.594 2.660
267 3HD2 LEU 31 3HD2 LEU 31 -3.098 1.315 3.750
268 H PHE 32 H PHE 32 -8.874 1.670 1.943
269 HA PHE 32 HA PHE 32 -9.282 0.134 4.289
270 1HB PHE 32 2HB PHE 32 -10.388 2.263 3.766
271 2HB PHE 32 1HB PHE 32 -11.233 1.510 2.415
272 HD1 PHE 32 1HD PHE 32 -10.618 0.721 6.043
273 HD2 PHE 32 2HD PHE 32 -13.454 0.976 2.823
274 HE1 PHE 32 1HE PHE 32 -12.427 -0.015 7.574
275 HE2 PHE 32 2HE PHE 32 -15.258 0.241 4.356
276 HZ PHE 32 HZ PHE 32 -14.745 -0.254 6.730
277 H ILE 33 H ILE 33 -11.072 -0.174 1.198
278 HA ILE 33 HA ILE 33 -12.190 -2.743 1.848
279 HB ILE 33 HB ILE 33 -11.743 -1.331 -0.772
280 1HG1 ILE 33 2HG1 ILE 33 -13.009 0.016 0.852
281 2HG1 ILE 33 1HG1 ILE 33 -14.070 -0.543 -0.443
282 1HG2 ILE 33 1HG2 ILE 33 -13.300 -3.761 0.025
283 2HG2 ILE 33 2HG2 ILE 33 -12.336 -3.484 -1.424
284 3HG2 ILE 33 3HG2 ILE 33 -13.922 -2.729 -1.261
285 1HD1 ILE 33 1HD1 ILE 33 -15.396 -1.261 1.262
286 2HD1 ILE 33 2HD1 ILE 33 -14.071 -1.245 2.426
287 3HD1 ILE 33 3HD1 ILE 33 -14.268 -2.614 1.331
288 H ASN 34 H ASN 34 -9.303 -1.720 0.039
289 HA ASN 34 HA ASN 34 -8.542 -4.193 -1.101
290 1HB ASN 34 2HB ASN 34 -7.491 -1.988 -1.518
291 2HB ASN 34 1HB ASN 34 -6.843 -1.991 0.124
292 1HD2 ASN 34 1HD2 ASN 34 -4.698 -2.651 0.177
293 2HD2 ASN 34 2HD2 ASN 34 -3.993 -3.779 -0.877
294 H PHE 35 H PHE 35 -7.823 -2.859 2.132
295 HA PHE 35 HA PHE 35 -6.272 -5.059 3.086
296 1HB PHE 35 2HB PHE 35 -6.397 -2.790 4.081
297 2HB PHE 35 1HB PHE 35 -8.075 -3.084 4.526
298 HD1 PHE 35 1HD PHE 35 -8.479 -5.314 5.948
299 HD2 PHE 35 2HD PHE 35 -4.735 -3.225 5.645
300 HE1 PHE 35 1HE PHE 35 -7.711 -6.385 8.046
301 HE2 PHE 35 2HE PHE 35 -3.972 -4.293 7.747
302 HZ PHE 35 HZ PHE 35 -5.459 -5.874 8.948
303 H CYS 36 H CYS 36 -9.723 -4.503 2.800
304 HA CYS 36 HA CYS 36 -10.368 -6.938 4.338
305 1HB CYS 36 2HB CYS 36 -12.046 -4.784 3.022
306 2HB CYS 36 1HB CYS 36 -12.687 -6.075 4.037
307 HG CYS 36 HG CYS 36 -12.080 -4.730 6.016
308 H LEU 37 H LEU 37 -9.461 -6.307 1.211
309 HA LEU 37 HA LEU 37 -11.263 -8.390 0.090
310 1HB LEU 37 2HB LEU 37 -11.533 -6.125 -0.828
311 2HB LEU 37 1HB LEU 37 -9.819 -6.104 -1.249
312 HG LEU 37 HG LEU 37 -10.136 -8.030 -2.735
313 1HD1 LEU 37 1HD2 LEU 37 -12.814 -8.366 -3.122
314 2HD1 LEU 37 2HD2 LEU 37 -12.778 -8.061 -1.386
315 3HD1 LEU 37 3HD2 LEU 37 -11.847 -9.395 -2.068
316 1HD2 LEU 37 1HD1 LEU 37 -12.400 -6.356 -3.600
317 2HD2 LEU 37 2HD1 LEU 37 -10.883 -6.713 -4.427
318 3HD2 LEU 37 3HD1 LEU 37 -10.940 -5.461 -3.185
319 H ILE 38 H ILE 38 -8.021 -7.644 0.904
320 HA ILE 38 HA ILE 38 -7.029 -9.786 -0.935
321 HB ILE 38 HB ILE 38 -5.596 -7.522 0.433
322 1HG1 ILE 38 2HG1 ILE 38 -7.157 -6.753 -1.317
323 2HG1 ILE 38 1HG1 ILE 38 -5.483 -6.531 -1.826
324 1HG2 ILE 38 1HG2 ILE 38 -4.716 -9.674 -1.484
325 2HG2 ILE 38 2HG2 ILE 38 -4.002 -9.240 0.069
326 3HG2 ILE 38 3HG2 ILE 38 -3.821 -8.164 -1.317
327 1HD1 ILE 38 1HD1 ILE 38 -5.922 -7.767 -3.654
328 2HD1 ILE 38 2HD1 ILE 38 -7.550 -8.112 -3.069
329 3HD1 ILE 38 3HD1 ILE 38 -6.204 -9.154 -2.603
330 H LEU 39 H LEU 39 -7.427 -8.804 2.359
331 HA LEU 39 HA LEU 39 -5.434 -10.270 3.690
332 1HB LEU 39 2HB LEU 39 -6.843 -10.042 5.618
333 2HB LEU 39 1HB LEU 39 -7.140 -8.626 4.618
334 HG LEU 39 HG LEU 39 -8.880 -11.115 4.618
335 1HD1 LEU 39 1HD1 LEU 39 -9.257 -10.145 6.727
336 2HD1 LEU 39 2HD1 LEU 39 -10.500 -9.398 5.722
337 3HD1 LEU 39 3HD1 LEU 39 -9.031 -8.506 6.116
338 1HD2 LEU 39 1HD2 LEU 39 -9.135 -9.995 2.529
339 2HD2 LEU 39 2HD2 LEU 39 -9.091 -8.408 3.292
340 3HD2 LEU 39 3HD2 LEU 39 -10.491 -9.456 3.517
341 H ILE 40 H ILE 40 -8.140 -11.526 1.884
342 HA ILE 40 HA ILE 40 -7.261 -14.244 2.442
343 HB ILE 40 HB ILE 40 -8.487 -13.645 4.485
344 1HG1 ILE 40 2HG1 ILE 40 -10.006 -15.571 2.697
345 2HG1 ILE 40 1HG1 ILE 40 -8.593 -15.974 3.672
346 1HG2 ILE 40 1HG2 ILE 40 -11.054 -13.502 2.963
347 2HG2 ILE 40 2HG2 ILE 40 -10.022 -12.072 2.967
348 3HG2 ILE 40 3HG2 ILE 40 -10.612 -12.740 4.490
349 1HD1 ILE 40 1HD1 ILE 40 -10.720 -14.649 5.202
350 2HD1 ILE 40 2HD1 ILE 40 -9.807 -16.110 5.578
351 3HD1 ILE 40 3HD1 ILE 40 -11.211 -16.197 4.515
352 H PHE 41 H PHE 41 -9.736 -12.129 0.968
353 HA PHE 41 HA PHE 41 -11.122 -14.111 -0.513
354 1HB PHE 41 2HB PHE 41 -10.498 -11.198 -0.986
355 2HB PHE 41 1HB PHE 41 -11.597 -12.108 -2.022
356 HD1 PHE 41 1HD PHE 41 -13.391 -13.567 -0.705
357 HD2 PHE 41 2HD PHE 41 -11.401 -10.110 0.883
358 HE1 PHE 41 1HE PHE 41 -15.206 -13.287 0.960
359 HE2 PHE 41 2HE PHE 41 -13.220 -9.825 2.543
360 HZ PHE 41 HZ PHE 41 -15.124 -11.415 2.583
361 H LEU 42 H LEU 42 -7.883 -12.953 -0.964
362 HA LEU 42 HA LEU 42 -7.798 -13.899 -3.756
363 1HB LEU 42 2HB LEU 42 -5.954 -12.408 -1.903
364 2HB LEU 42 1HB LEU 42 -5.337 -13.099 -3.403
365 HG LEU 42 HG LEU 42 -6.032 -10.744 -3.714
366 1HD1 LEU 42 1HD2 LEU 42 -6.642 -12.923 -5.310
367 2HD1 LEU 42 2HD2 LEU 42 -6.735 -11.234 -5.809
368 3HD1 LEU 42 3HD2 LEU 42 -8.176 -12.059 -5.219
369 1HD2 LEU 42 1HD1 LEU 42 -8.896 -11.548 -3.383
370 2HD2 LEU 42 2HD1 LEU 42 -8.156 -9.953 -3.232
371 3HD2 LEU 42 3HD1 LEU 42 -7.963 -11.142 -1.943
372 H LEU 43 H LEU 43 -7.101 -15.029 -0.572
373 HA LEU 43 HA LEU 43 -5.220 -17.093 -1.492
374 1HB LEU 43 2HB LEU 43 -4.905 -15.885 0.639
375 2HB LEU 43 1HB LEU 43 -6.470 -16.476 1.203
376 HG LEU 43 HG LEU 43 -5.661 -18.800 1.017
377 1HD1 LEU 43 1HD2 LEU 43 -3.232 -17.386 -0.059
378 2HD1 LEU 43 2HD2 LEU 43 -4.065 -18.801 -0.701
379 3HD1 LEU 43 3HD2 LEU 43 -3.063 -18.948 0.742
380 1HD2 LEU 43 1HD1 LEU 43 -4.382 -18.775 2.991
381 2HD2 LEU 43 2HD1 LEU 43 -5.248 -17.239 3.067
382 3HD2 LEU 43 3HD1 LEU 43 -3.562 -17.276 2.550
383 H LEU 44 H LEU 44 -8.428 -16.965 0.098
384 HA LEU 44 HA LEU 44 -9.026 -19.714 0.104
385 1HB LEU 44 2HB LEU 44 -10.189 -17.662 1.139
386 2HB LEU 44 1HB LEU 44 -10.976 -17.460 -0.426
387 HG LEU 44 HG LEU 44 -11.069 -19.986 1.226
388 1HD1 LEU 44 1HD1 LEU 44 -12.277 -17.795 2.047
389 2HD1 LEU 44 2HD1 LEU 44 -13.154 -19.327 2.056
390 3HD1 LEU 44 3HD1 LEU 44 -13.414 -18.170 0.751
391 1HD2 LEU 44 1HD2 LEU 44 -11.572 -20.762 -0.883
392 2HD2 LEU 44 2HD2 LEU 44 -12.096 -19.176 -1.451
393 3HD2 LEU 44 3HD2 LEU 44 -13.170 -20.152 -0.449
394 H ILE 45 H ILE 45 -9.575 -17.270 -2.447
395 HA ILE 45 HA ILE 45 -11.069 -18.803 -4.276
396 HB ILE 45 HB ILE 45 -10.455 -16.347 -4.281
397 1HG1 ILE 45 2HG1 ILE 45 -11.495 -17.468 -6.260
398 2HG1 ILE 45 1HG1 ILE 45 -10.467 -16.109 -6.699
399 1HG2 ILE 45 1HG2 ILE 45 -8.361 -15.614 -5.133
400 2HG2 ILE 45 2HG2 ILE 45 -7.926 -17.235 -5.672
401 3HG2 ILE 45 3HG2 ILE 45 -7.975 -16.862 -3.949
402 1HD1 ILE 45 1HD1 ILE 45 -9.538 -17.568 -8.167
403 2HD1 ILE 45 2HD1 ILE 45 -10.157 -18.974 -7.305
404 3HD1 ILE 45 3HD1 ILE 45 -8.676 -18.189 -6.761
405 H CYS 46 H CYS 46 -7.640 -18.978 -3.506
406 HA CYS 46 HA CYS 46 -6.864 -20.494 -5.845
407 1HB CYS 46 2HB CYS 46 -5.397 -19.065 -4.470
408 2HB CYS 46 1HB CYS 46 -5.605 -20.180 -3.134
409 HG CYS 46 HG CYS 46 -4.600 -22.000 -5.033
410 H ILE 47 H ILE 47 -8.477 -21.329 -2.929
411 HA ILE 47 HA ILE 47 -7.518 -24.058 -2.759
412 HB ILE 47 HB ILE 47 -9.768 -22.460 -1.520
413 1HG1 ILE 47 2HG1 ILE 47 -8.405 -22.815 0.543
414 2HG1 ILE 47 1HG1 ILE 47 -7.196 -23.650 -0.429
415 1HG2 ILE 47 1HG2 ILE 47 -9.690 -24.600 0.076
416 2HG2 ILE 47 2HG2 ILE 47 -9.228 -25.391 -1.432
417 3HG2 ILE 47 3HG2 ILE 47 -10.761 -24.525 -1.324
418 1HD1 ILE 47 1HD1 ILE 47 -6.599 -21.683 -1.588
419 2HD1 ILE 47 2HD1 ILE 47 -6.809 -21.144 0.079
420 3HD1 ILE 47 3HD1 ILE 47 -8.075 -20.850 -1.110
421 H ILE 48 H ILE 48 -10.129 -22.413 -4.440
422 HA ILE 48 HA ILE 48 -11.433 -24.963 -5.128
423 HB ILE 48 HB ILE 48 -13.139 -23.496 -6.118
424 1HG1 ILE 48 2HG1 ILE 48 -11.281 -21.227 -5.348
425 2HG1 ILE 48 1HG1 ILE 48 -11.540 -21.788 -6.998
426 1HG2 ILE 48 1HG2 ILE 48 -12.748 -23.839 -3.520
427 2HG2 ILE 48 2HG2 ILE 48 -13.969 -22.706 -4.101
428 3HG2 ILE 48 3HG2 ILE 48 -12.397 -22.112 -3.567
429 1HD1 ILE 48 1HD1 ILE 48 -14.115 -21.427 -5.993
430 2HD1 ILE 48 2HD1 ILE 48 -13.265 -20.333 -7.085
431 3HD1 ILE 48 3HD1 ILE 48 -13.210 -20.059 -5.343
432 H VAL 49 H VAL 49 -9.294 -22.582 -6.552
433 HA VAL 49 HA VAL 49 -9.735 -23.363 -9.319
434 HB VAL 49 HB VAL 49 -7.750 -21.958 -9.686
435 1HG1 VAL 49 1HG1 VAL 49 -8.491 -19.954 -8.197
436 2HG1 VAL 49 2HG1 VAL 49 -9.784 -21.036 -7.680
437 3HG1 VAL 49 3HG1 VAL 49 -9.628 -20.600 -9.381
438 1HG2 VAL 49 1HG2 VAL 49 -6.523 -21.043 -7.729
439 2HG2 VAL 49 2HG2 VAL 49 -6.327 -22.786 -7.918
440 3HG2 VAL 49 3HG2 VAL 49 -7.427 -22.149 -6.700
441 H MET 50 H MET 50 -7.490 -24.340 -6.759
442 HA MET 50 HA MET 50 -5.799 -25.971 -8.423
443 1HB MET 50 2HB MET 50 -6.345 -25.904 -5.469
444 2HB MET 50 1HB MET 50 -4.990 -26.748 -6.207
445 1HG MET 50 2HG MET 50 -5.527 -23.774 -6.455
446 2HG MET 50 1HG MET 50 -4.344 -24.497 -5.366
447 1HE MET 50 1HE MET 50 -3.070 -26.378 -6.092
448 2HE MET 50 2HE MET 50 -1.685 -25.892 -7.067
449 3HE MET 50 3HE MET 50 -2.921 -26.936 -7.764
450 H LEU 51 H LEU 51 -8.932 -26.460 -7.054
451 HA LEU 51 HA LEU 51 -8.689 -29.406 -7.570
452 1HB LEU 51 2HB LEU 51 -10.368 -27.877 -5.557
453 2HB LEU 51 1HB LEU 51 -10.358 -29.632 -5.749
454 HG LEU 51 HG LEU 51 -7.954 -27.931 -5.023
455 1HD1 LEU 51 1HD2 LEU 51 -8.335 -29.639 -2.949
456 2HD1 LEU 51 2HD2 LEU 51 -10.007 -29.389 -3.452
457 3HD1 LEU 51 3HD2 LEU 51 -9.008 -28.010 -2.994
458 1HD2 LEU 51 1HD1 LEU 51 -7.426 -30.593 -4.437
459 2HD2 LEU 51 2HD1 LEU 51 -6.819 -29.711 -5.838
460 3HD2 LEU 51 3HD1 LEU 51 -8.285 -30.680 -5.976
461 H LEU 52 H LEU 52 -11.028 -26.690 -7.476
462 HA LEU 52 HA LEU 52 -12.753 -28.174 -9.410
463 1HB LEU 52 2HB LEU 52 -13.205 -25.697 -7.712
464 2HB LEU 52 1HB LEU 52 -14.438 -26.514 -8.674
465 HG LEU 52 HG LEU 52 -12.885 -27.751 -6.381
466 1HD1 LEU 52 1HD1 LEU 52 -15.728 -26.742 -6.651
467 2HD1 LEU 52 2HD1 LEU 52 -14.498 -26.192 -5.513
468 3HD1 LEU 52 3HD1 LEU 52 -15.200 -27.801 -5.343
469 1HD2 LEU 52 1HD2 LEU 52 -15.180 -29.253 -7.049
470 2HD2 LEU 52 2HD2 LEU 52 -13.496 -29.717 -7.298
471 3HD2 LEU 52 3HD2 LEU 52 -14.381 -28.889 -8.580
Start of MODEL 9
1 1H MET 1 1HT MET 1 21.931 2.634 -21.977
2 2H MET 1 2HT MET 1 22.917 3.022 -20.649
3 H MET 1 H MET 1 22.566 3.913 -20.758
4 3H MET 1 3HT MET 1 21.820 4.166 -21.257
5 HA MET 1 HA MET 1 19.961 2.755 -20.585
6 1HB MET 1 2HB MET 1 21.216 0.678 -20.935
7 2HB MET 1 1HB MET 1 22.223 1.058 -19.554
8 1HG MET 1 2HG MET 1 20.457 -0.541 -18.947
9 2HG MET 1 1HG MET 1 20.255 0.984 -18.104
10 1HE MET 1 1HE MET 1 18.123 -0.969 -21.453
11 2HE MET 1 2HE MET 1 19.852 -0.689 -21.261
12 3HE MET 1 3HE MET 1 18.870 0.480 -22.140
13 H ASP 2 H ASP 2 22.563 4.471 -19.354
14 HA ASP 2 HA ASP 2 21.303 4.632 -16.636
15 1HB ASP 2 2HB ASP 2 23.589 3.713 -16.692
16 2HB ASP 2 1HB ASP 2 24.148 5.145 -17.559
17 H LYS 3 H LYS 3 21.551 6.285 -19.532
18 HA LYS 3 HA LYS 3 21.511 8.955 -18.184
19 1HB LYS 3 2HB LYS 3 22.252 9.805 -20.356
20 2HB LYS 3 1HB LYS 3 23.315 8.501 -19.827
21 1HG LYS 3 2HG LYS 3 22.116 6.910 -21.254
22 2HG LYS 3 1HG LYS 3 21.002 8.182 -21.757
23 1HD LYS 3 2HD LYS 3 22.750 7.893 -23.448
24 2HD LYS 3 1HD LYS 3 22.911 9.467 -22.666
25 1HE LYS 3 2HE LYS 3 24.683 8.584 -21.197
26 2HE LYS 3 1HE LYS 3 24.514 6.985 -21.949
27 1HZ LYS 3 1HZ LYS 3 24.892 8.108 -24.125
28 2HZ LYS 3 2HZ LYS 3 26.243 8.127 -23.095
29 3HZ LYS 3 3HZ LYS 3 25.293 9.524 -23.280
30 H VAL 4 H VAL 4 19.818 6.775 -20.378
31 HA VAL 4 HA VAL 4 17.738 8.747 -21.032
32 HB VAL 4 HB VAL 4 18.496 7.014 -22.615
33 1HG1 VAL 4 1HG2 VAL 4 18.239 5.355 -20.278
34 2HG1 VAL 4 2HG2 VAL 4 18.956 4.953 -21.838
35 3HG1 VAL 4 3HG2 VAL 4 17.233 4.699 -21.569
36 1HG2 VAL 4 1HG1 VAL 4 16.112 7.842 -22.626
37 2HG2 VAL 4 2HG1 VAL 4 15.674 6.414 -21.686
38 3HG2 VAL 4 3HG1 VAL 4 16.318 6.233 -23.317
39 H GLN 5 H GLN 5 18.365 6.566 -18.450
40 HA GLN 5 HA GLN 5 15.593 6.031 -17.750
41 1HB GLN 5 2HB GLN 5 18.218 5.734 -16.259
42 2HB GLN 5 1HB GLN 5 16.684 5.023 -15.756
43 1HG GLN 5 2HG GLN 5 18.115 4.458 -18.371
44 2HG GLN 5 1HG GLN 5 18.058 3.376 -16.978
45 1HE2 GLN 5 1HE2 GLN 5 16.591 3.908 -19.926
46 2HE2 GLN 5 2HE2 GLN 5 15.078 3.207 -19.614
47 H TYR 6 H TYR 6 18.138 7.637 -15.816
48 HA TYR 6 HA TYR 6 16.373 9.046 -14.108
49 1HB TYR 6 2HB TYR 6 19.189 9.660 -15.050
50 2HB TYR 6 1HB TYR 6 18.427 10.405 -13.650
51 HD1 TYR 6 1HD TYR 6 20.803 9.240 -12.915
52 HD2 TYR 6 2HD TYR 6 17.110 7.172 -13.679
53 HE1 TYR 6 1HE TYR 6 21.559 7.358 -11.493
54 HE2 TYR 6 2HE TYR 6 17.873 5.292 -12.256
55 HH TYR 6 HH TYR 6 19.517 5.007 -10.317
56 H LEU 7 H LEU 7 17.731 9.960 -17.266
57 HA LEU 7 HA LEU 7 17.068 12.699 -17.306
58 1HB LEU 7 2HB LEU 7 18.413 11.569 -18.991
59 2HB LEU 7 1HB LEU 7 17.017 10.620 -19.478
60 HG LEU 7 HG LEU 7 15.832 12.685 -20.136
61 1HD1 LEU 7 1HD2 LEU 7 17.218 14.795 -20.252
62 2HD1 LEU 7 2HD2 LEU 7 18.436 13.974 -19.275
63 3HD1 LEU 7 3HD2 LEU 7 16.830 14.271 -18.613
64 1HD2 LEU 7 1HD1 LEU 7 16.837 11.873 -22.038
65 2HD2 LEU 7 2HD1 LEU 7 18.445 11.876 -21.317
66 3HD2 LEU 7 3HD1 LEU 7 17.739 13.383 -21.901
67 H THR 8 H THR 8 15.076 9.894 -18.231
68 HA THR 8 HA THR 8 12.765 11.452 -18.962
69 HB THR 8 HB THR 8 13.041 8.579 -18.057
70 HG1 THR 8 1HG THR 8 14.265 8.673 -19.808
71 1HG2 THR 8 1HG2 THR 8 11.002 8.263 -19.472
72 2HG2 THR 8 2HG2 THR 8 10.911 10.015 -19.655
73 3HG2 THR 8 3HG2 THR 8 10.720 9.284 -18.062
74 H ARG 9 H ARG 9 13.858 9.961 -15.928
75 HA ARG 9 HA ARG 9 11.529 10.052 -14.377
76 1HB ARG 9 2HB ARG 9 14.396 10.665 -13.724
77 2HB ARG 9 1HB ARG 9 13.166 10.430 -12.492
78 1HG ARG 9 2HG ARG 9 13.900 8.399 -14.621
79 2HG ARG 9 1HG ARG 9 14.451 8.347 -12.946
80 1HD ARG 9 2HD ARG 9 12.067 8.260 -12.194
81 2HD ARG 9 1HD ARG 9 11.568 8.188 -13.894
82 HE ARG 9 HE ARG 9 12.601 5.968 -12.408
83 1HH1 ARG 9 1HH1 ARG 9 11.200 6.129 -15.190
84 2HH1 ARG 9 2HH1 ARG 9 12.400 5.356 -16.173
85 1HH2 ARG 9 1HH2 ARG 9 14.890 5.578 -13.769
86 2HH2 ARG 9 2HH2 ARG 9 14.489 5.040 -15.365
87 H SER 10 H SER 10 13.784 12.691 -15.125
88 HA SER 10 HA SER 10 12.536 14.675 -13.480
89 1HB SER 10 2HB SER 10 13.844 16.215 -14.907
90 2HB SER 10 1HB SER 10 14.808 14.810 -14.459
91 HG SER 10 HG SER 10 14.767 14.129 -16.469
92 H ALA 11 H ALA 11 11.657 13.247 -16.535
93 HA ALA 11 HA ALA 11 9.930 15.446 -17.380
94 1HB ALA 11 1HB ALA 11 11.181 13.798 -18.850
95 2HB ALA 11 2HB ALA 11 9.469 13.976 -19.236
96 3HB ALA 11 3HB ALA 11 10.027 12.572 -18.326
97 H ILE 12 H ILE 12 9.645 12.610 -15.393
98 HA ILE 12 HA ILE 12 6.689 12.827 -15.390
99 HB ILE 12 HB ILE 12 8.558 10.651 -14.502
100 1HG1 ILE 12 2HG1 ILE 12 6.783 10.875 -16.947
101 2HG1 ILE 12 1HG1 ILE 12 8.542 11.007 -16.947
102 1HG2 ILE 12 1HG2 ILE 12 6.034 9.574 -14.933
103 2HG2 ILE 12 2HG2 ILE 12 5.702 11.103 -14.124
104 3HG2 ILE 12 3HG2 ILE 12 6.752 9.912 -13.358
105 1HD1 ILE 12 1HD1 ILE 12 6.852 8.612 -16.826
106 2HD1 ILE 12 2HD1 ILE 12 8.116 8.633 -15.597
107 3HD1 ILE 12 3HD1 ILE 12 8.543 8.772 -17.303
108 H ARG 13 H ARG 13 9.562 13.079 -13.432
109 HA ARG 13 HA ARG 13 8.562 12.835 -10.814
110 1HB ARG 13 2HB ARG 13 10.931 13.159 -11.600
111 2HB ARG 13 1HB ARG 13 10.555 14.858 -11.886
112 1HG ARG 13 2HG ARG 13 11.614 14.633 -9.700
113 2HG ARG 13 1HG ARG 13 9.927 15.074 -9.481
114 1HD ARG 13 2HD ARG 13 9.334 12.730 -9.047
115 2HD ARG 13 1HD ARG 13 11.022 12.275 -9.289
116 HE ARG 13 HE ARG 13 9.987 13.417 -6.887
117 1HH1 ARG 13 1HH2 ARG 13 12.539 11.989 -6.840
118 2HH1 ARG 13 2HH2 ARG 13 13.706 13.255 -6.642
119 1HH2 ARG 13 1HH1 ARG 13 11.525 15.777 -7.599
120 2HH2 ARG 13 2HH1 ARG 13 13.132 15.399 -7.076
121 H ARG 14 H ARG 14 8.465 15.626 -13.016
122 HA ARG 14 HA ARG 14 7.487 17.621 -11.322
123 1HB ARG 14 2HB ARG 14 8.222 17.736 -13.728
124 2HB ARG 14 1HB ARG 14 6.671 17.022 -14.181
125 1HG ARG 14 2HG ARG 14 5.486 18.891 -13.122
126 2HG ARG 14 1HG ARG 14 7.033 19.581 -12.633
127 1HD ARG 14 2HD ARG 14 7.696 19.852 -14.987
128 2HD ARG 14 1HD ARG 14 6.172 19.111 -15.509
129 HE ARG 14 HE ARG 14 6.454 21.840 -14.666
130 1HH1 ARG 14 1HH2 ARG 14 4.246 19.441 -15.452
131 2HH1 ARG 14 2HH2 ARG 14 2.898 20.167 -14.644
132 1HH2 ARG 14 1HH1 ARG 14 4.802 22.635 -13.121
133 2HH2 ARG 14 2HH1 ARG 14 3.213 21.978 -13.324
134 H ALA 15 H ALA 15 5.773 14.872 -12.739
135 HA ALA 15 HA ALA 15 3.194 15.906 -11.719
136 1HB ALA 15 1HB ALA 15 2.451 15.000 -13.641
137 2HB ALA 15 2HB ALA 15 3.015 13.412 -13.120
138 3HB ALA 15 3HB ALA 15 4.098 14.484 -14.007
139 H SER 16 H SER 16 5.422 13.165 -11.368
140 HA SER 16 HA SER 16 3.673 11.646 -9.624
141 1HB SER 16 2HB SER 16 5.617 10.202 -9.468
142 2HB SER 16 1HB SER 16 5.499 10.804 -11.116
143 HG SER 16 HG SER 16 7.624 10.944 -10.096
144 H THR 17 H THR 17 5.287 14.487 -9.076
145 HA THR 17 HA THR 17 5.599 13.883 -6.178
146 HB THR 17 HB THR 17 7.178 15.777 -7.944
147 HG1 THR 17 1HG THR 17 7.794 13.720 -8.392
148 1HG2 THR 17 1HG2 THR 17 8.478 15.146 -5.486
149 2HG2 THR 17 2HG2 THR 17 6.835 15.658 -5.107
150 3HG2 THR 17 3HG2 THR 17 7.895 16.717 -6.037
151 H ILE 18 H ILE 18 3.487 15.241 -8.122
152 HA ILE 18 HA ILE 18 3.074 17.642 -6.428
153 HB ILE 18 HB ILE 18 2.472 17.182 -9.334
154 1HG1 ILE 18 2HG1 ILE 18 4.867 17.525 -8.834
155 2HG1 ILE 18 1HG1 ILE 18 4.198 18.913 -9.695
156 1HG2 ILE 18 1HG2 ILE 18 0.797 18.626 -8.207
157 2HG2 ILE 18 2HG2 ILE 18 1.768 19.530 -9.369
158 3HG2 ILE 18 3HG2 ILE 18 2.105 19.666 -7.642
159 1HD1 ILE 18 1HD1 ILE 18 3.734 19.428 -6.966
160 2HD1 ILE 18 2HD1 ILE 18 4.912 20.221 -8.009
161 3HD1 ILE 18 3HD1 ILE 18 5.385 18.814 -7.057
162 H GLU 19 H GLU 19 1.687 14.775 -7.872
163 HA GLU 19 HA GLU 19 -0.932 15.450 -6.646
164 1HB GLU 19 2HB GLU 19 -0.951 15.338 -9.085
165 2HB GLU 19 1HB GLU 19 -0.224 13.740 -9.011
166 1HG GLU 19 2HG GLU 19 -2.624 13.504 -9.363
167 2HG GLU 19 1HG GLU 19 -2.212 12.921 -7.753
168 H MET 20 H MET 20 1.743 13.317 -6.573
169 HA MET 20 HA MET 20 0.605 10.849 -5.816
170 1HB MET 20 2HB MET 20 2.962 11.226 -6.360
171 2HB MET 20 1HB MET 20 3.157 12.212 -4.913
172 1HG MET 20 2HG MET 20 2.569 10.275 -3.505
173 2HG MET 20 1HG MET 20 2.373 9.284 -4.952
174 1HE MET 20 1HE MET 20 5.370 12.069 -4.534
175 2HE MET 20 2HE MET 20 6.135 11.169 -3.229
176 3HE MET 20 3HE MET 20 4.452 11.669 -3.076
177 HA PRO 21 HA PRO 21 0.708 12.328 -1.270
178 1HB PRO 21 2HB PRO 21 0.673 15.023 -0.782
179 2HB PRO 21 1HB PRO 21 2.165 14.081 -0.909
180 1HG PRO 21 2HG PRO 21 0.897 15.866 -2.880
181 2HG PRO 21 1HG PRO 21 2.608 15.589 -2.552
182 1HD PRO 21 2HD PRO 21 1.246 14.521 -4.673
183 2HD PRO 21 1HD PRO 21 2.720 13.817 -3.977
184 H GLN 22 H GLN 22 -0.948 14.587 -3.483
185 HA GLN 22 HA GLN 22 -3.305 14.908 -1.859
186 1HB GLN 22 2HB GLN 22 -2.817 15.175 -4.818
187 2HB GLN 22 1HB GLN 22 -4.212 15.830 -3.975
188 1HG GLN 22 2HG GLN 22 -1.335 16.542 -3.347
189 2HG GLN 22 1HG GLN 22 -2.402 17.520 -4.349
190 1HE2 GLN 22 1HE2 GLN 22 -4.545 16.335 -2.129
191 2HE2 GLN 22 2HE2 GLN 22 -4.396 17.515 -0.927
192 H GLN 23 H GLN 23 -2.341 12.607 -4.356
193 HA GLN 23 HA GLN 23 -4.959 11.337 -4.475
194 1HB GLN 23 2HB GLN 23 -3.504 11.525 -6.426
195 2HB GLN 23 1HB GLN 23 -2.252 10.636 -5.574
196 1HG GLN 23 2HG GLN 23 -3.440 9.131 -7.095
197 2HG GLN 23 1HG GLN 23 -3.753 8.672 -5.424
198 1HE2 GLN 23 1HE2 GLN 23 -5.304 9.191 -8.349
199 2HE2 GLN 23 2HE2 GLN 23 -6.865 9.526 -7.771
200 H ALA 24 H ALA 24 -1.751 10.577 -3.125
201 HA ALA 24 HA ALA 24 -2.225 7.964 -2.183
202 1HB ALA 24 1HB ALA 24 -0.462 8.547 -0.533
203 2HB ALA 24 2HB ALA 24 -0.696 10.255 -0.899
204 3HB ALA 24 3HB ALA 24 -0.065 9.167 -2.135
205 H ARG 25 H ARG 25 -3.032 11.096 -0.686
206 HA ARG 25 HA ARG 25 -4.030 10.186 1.797
207 1HB ARG 25 2HB ARG 25 -3.642 12.528 1.157
208 2HB ARG 25 1HB ARG 25 -4.960 12.415 0.000
209 1HG ARG 25 2HG ARG 25 -5.729 13.486 2.078
210 2HG ARG 25 1HG ARG 25 -6.542 11.941 1.830
211 1HD ARG 25 2HD ARG 25 -4.978 10.843 3.388
212 2HD ARG 25 1HD ARG 25 -4.129 12.384 3.626
213 HE ARG 25 HE ARG 25 -6.903 12.833 4.076
214 1HH1 ARG 25 1HH2 ARG 25 -5.813 10.101 5.367
215 2HH1 ARG 25 2HH2 ARG 25 -5.689 10.637 7.010
216 1HH2 ARG 25 1HH1 ARG 25 -6.056 13.994 6.220
217 2HH2 ARG 25 2HH1 ARG 25 -5.829 12.841 7.492
218 H GLN 26 H GLN 26 -5.648 10.537 -1.344
219 HA GLN 26 HA GLN 26 -8.220 9.615 -0.439
220 1HB GLN 26 2HB GLN 26 -6.942 9.757 -3.164
221 2HB GLN 26 1HB GLN 26 -8.670 9.598 -2.869
222 1HG GLN 26 2HG GLN 26 -6.950 11.894 -1.903
223 2HG GLN 26 1HG GLN 26 -7.981 11.953 -3.329
224 1HE2 GLN 26 1HE2 GLN 26 -9.821 10.060 -1.366
225 2HE2 GLN 26 2HE2 GLN 26 -10.680 11.250 -0.521
226 H ASN 27 H ASN 27 -5.620 8.099 -2.346
227 HA ASN 27 HA ASN 27 -6.797 5.522 -2.572
228 1HB ASN 27 2HB ASN 27 -3.934 6.432 -2.485
229 2HB ASN 27 1HB ASN 27 -4.448 4.856 -3.060
230 1HD2 ASN 27 1HD2 ASN 27 -6.915 6.907 -4.035
231 2HD2 ASN 27 2HD2 ASN 27 -6.326 7.320 -5.567
232 H LEU 28 H LEU 28 -5.299 7.100 0.126
233 HA LEU 28 HA LEU 28 -4.244 4.962 1.614
234 1HB LEU 28 2HB LEU 28 -4.085 7.337 2.196
235 2HB LEU 28 1HB LEU 28 -5.813 7.367 2.512
236 HG LEU 28 HG LEU 28 -5.538 5.714 4.310
237 1HD1 LEU 28 1HD2 LEU 28 -3.738 4.355 4.109
238 2HD1 LEU 28 2HD2 LEU 28 -2.813 5.672 4.831
239 3HD1 LEU 28 3HD2 LEU 28 -2.888 5.505 3.077
240 1HD2 LEU 28 1HD1 LEU 28 -5.141 8.282 4.591
241 2HD2 LEU 28 2HD1 LEU 28 -3.450 7.827 4.801
242 3HD2 LEU 28 3HD1 LEU 28 -4.674 7.204 5.906
243 H GLN 29 H GLN 29 -7.616 6.050 1.322
244 HA GLN 29 HA GLN 29 -8.732 4.285 3.270
245 1HB GLN 29 2HB GLN 29 -9.878 5.495 0.765
246 2HB GLN 29 1HB GLN 29 -10.831 4.829 2.083
247 1HG GLN 29 2HG GLN 29 -9.830 6.475 3.630
248 2HG GLN 29 1HG GLN 29 -8.892 7.151 2.300
249 1HE2 GLN 29 1HE2 GLN 29 -11.877 6.270 0.968
250 2HE2 GLN 29 2HE2 GLN 29 -12.674 7.754 1.140
251 H ASN 30 H ASN 30 -8.072 3.920 -0.194
252 HA ASN 30 HA ASN 30 -9.413 1.466 -0.654
253 1HB ASN 30 2HB ASN 30 -6.858 2.560 -1.808
254 2HB ASN 30 1HB ASN 30 -7.856 1.325 -2.560
255 1HD2 ASN 30 1HD2 ASN 30 -9.201 2.185 -4.141
256 2HD2 ASN 30 2HD2 ASN 30 -9.881 3.740 -4.106
257 H LEU 31 H LEU 31 -6.240 2.157 0.736
258 HA LEU 31 HA LEU 31 -5.117 -0.441 0.687
259 1HB LEU 31 2HB LEU 31 -3.940 1.644 1.233
260 2HB LEU 31 1HB LEU 31 -4.884 1.772 2.710
261 HG LEU 31 HG LEU 31 -3.941 -0.359 3.515
262 1HD1 LEU 31 1HD2 LEU 31 -3.198 -1.770 1.909
263 2HD1 LEU 31 2HD2 LEU 31 -1.734 -0.789 1.876
264 3HD1 LEU 31 3HD2 LEU 31 -3.040 -0.465 0.734
265 1HD2 LEU 31 1HD1 LEU 31 -1.862 1.650 2.593
266 2HD2 LEU 31 2HD1 LEU 31 -1.610 0.433 3.843
267 3HD2 LEU 31 3HD1 LEU 31 -2.781 1.727 4.095
268 H PHE 32 H PHE 32 -7.573 0.948 2.770
269 HA PHE 32 HA PHE 32 -7.415 -1.164 4.754
270 1HB PHE 32 2HB PHE 32 -9.292 1.135 4.198
271 2HB PHE 32 1HB PHE 32 -9.541 0.022 5.540
272 HD1 PHE 32 1HD PHE 32 -6.687 2.004 4.047
273 HD2 PHE 32 2HD PHE 32 -8.716 0.673 7.593
274 HE1 PHE 32 1HE PHE 32 -5.080 3.268 5.442
275 HE2 PHE 32 2HE PHE 32 -7.107 1.942 8.987
276 HZ PHE 32 HZ PHE 32 -5.289 3.239 7.910
277 H ILE 33 H ILE 33 -9.378 -0.415 1.916
278 HA ILE 33 HA ILE 33 -11.317 -2.539 2.410
279 HB ILE 33 HB ILE 33 -10.651 -0.875 -0.005
280 1HG1 ILE 33 2HG1 ILE 33 -12.758 -0.540 2.146
281 2HG1 ILE 33 1HG1 ILE 33 -11.319 0.461 1.954
282 1HG2 ILE 33 1HG2 ILE 33 -12.320 -1.913 -1.118
283 2HG2 ILE 33 2HG2 ILE 33 -13.391 -1.834 0.282
284 3HG2 ILE 33 3HG2 ILE 33 -12.231 -3.155 0.131
285 1HD1 ILE 33 1HD1 ILE 33 -13.839 0.819 0.711
286 2HD1 ILE 33 2HD1 ILE 33 -12.720 0.318 -0.556
287 3HD1 ILE 33 3HD1 ILE 33 -12.363 1.740 0.427
288 H ASN 34 H ASN 34 -8.513 -2.094 0.255
289 HA ASN 34 HA ASN 34 -8.742 -4.565 -1.155
290 1HB ASN 34 2HB ASN 34 -7.374 -2.615 -1.824
291 2HB ASN 34 1HB ASN 34 -6.318 -2.887 -0.438
292 1HD2 ASN 34 1HD2 ASN 34 -4.453 -3.996 -1.010
293 2HD2 ASN 34 2HD2 ASN 34 -4.347 -5.167 -2.235
294 H PHE 35 H PHE 35 -6.773 -3.697 1.712
295 HA PHE 35 HA PHE 35 -5.552 -6.226 2.118
296 1HB PHE 35 2HB PHE 35 -4.984 -4.037 3.187
297 2HB PHE 35 1HB PHE 35 -6.460 -4.144 4.136
298 HD1 PHE 35 1HD PHE 35 -4.483 -3.809 5.907
299 HD2 PHE 35 2HD PHE 35 -5.230 -7.444 3.737
300 HE1 PHE 35 1HE PHE 35 -3.264 -5.098 7.637
301 HE2 PHE 35 2HE PHE 35 -4.019 -8.727 5.472
302 HZ PHE 35 HZ PHE 35 -3.033 -7.555 7.420
303 H CYS 36 H CYS 36 -8.559 -4.895 3.547
304 HA CYS 36 HA CYS 36 -9.280 -7.165 5.089
305 1HB CYS 36 2HB CYS 36 -10.305 -4.923 5.232
306 2HB CYS 36 1HB CYS 36 -10.994 -5.130 3.621
307 HG CYS 36 HG CYS 36 -12.435 -5.961 5.981
308 H LEU 37 H LEU 37 -9.491 -6.555 1.654
309 HA LEU 37 HA LEU 37 -11.351 -8.724 1.082
310 1HB LEU 37 2HB LEU 37 -11.097 -6.589 -0.202
311 2HB LEU 37 1HB LEU 37 -9.494 -7.128 -0.700
312 HG LEU 37 HG LEU 37 -11.990 -8.760 -1.221
313 1HD1 LEU 37 1HD1 LEU 37 -12.251 -7.726 -3.300
314 2HD1 LEU 37 2HD1 LEU 37 -10.613 -7.073 -3.291
315 3HD1 LEU 37 3HD1 LEU 37 -11.852 -6.365 -2.254
316 1HD2 LEU 37 1HD2 LEU 37 -10.241 -9.375 -3.178
317 2HD2 LEU 37 2HD2 LEU 37 -10.253 -10.217 -1.630
318 3HD2 LEU 37 3HD2 LEU 37 -9.096 -8.920 -1.917
319 H ILE 38 H ILE 38 -7.879 -8.147 0.432
320 HA ILE 38 HA ILE 38 -7.338 -10.821 -0.512
321 HB ILE 38 HB ILE 38 -6.058 -8.730 -0.993
322 1HG1 ILE 38 2HG1 ILE 38 -3.807 -9.748 -0.783
323 2HG1 ILE 38 1HG1 ILE 38 -4.458 -10.934 0.348
324 1HG2 ILE 38 1HG2 ILE 38 -6.209 -7.885 1.381
325 2HG2 ILE 38 2HG2 ILE 38 -4.603 -7.766 0.664
326 3HG2 ILE 38 3HG2 ILE 38 -4.965 -9.058 1.809
327 1HD1 ILE 38 1HD1 ILE 38 -4.265 -11.730 -2.060
328 2HD1 ILE 38 2HD1 ILE 38 -5.538 -10.575 -2.456
329 3HD1 ILE 38 3HD1 ILE 38 -5.866 -11.899 -1.337
330 H LEU 39 H LEU 39 -7.762 -9.534 2.650
331 HA LEU 39 HA LEU 39 -5.993 -11.245 4.111
332 1HB LEU 39 2HB LEU 39 -6.814 -9.135 4.960
333 2HB LEU 39 1HB LEU 39 -8.487 -9.669 4.793
334 HG LEU 39 HG LEU 39 -8.079 -11.446 6.424
335 1HD1 LEU 39 1HD1 LEU 39 -5.338 -10.724 5.918
336 2HD1 LEU 39 2HD1 LEU 39 -5.962 -12.107 6.817
337 3HD1 LEU 39 3HD1 LEU 39 -5.674 -10.576 7.642
338 1HD2 LEU 39 1HD2 LEU 39 -8.962 -9.474 7.399
339 2HD2 LEU 39 2HD2 LEU 39 -7.440 -8.604 7.209
340 3HD2 LEU 39 3HD2 LEU 39 -7.582 -9.879 8.420
341 H ILE 40 H ILE 40 -9.245 -11.724 2.824
342 HA ILE 40 HA ILE 40 -9.268 -14.392 4.146
343 HB ILE 40 HB ILE 40 -11.726 -14.082 4.363
344 1HG1 ILE 40 2HG1 ILE 40 -11.097 -11.307 3.304
345 2HG1 ILE 40 1HG1 ILE 40 -12.023 -12.548 2.455
346 1HG2 ILE 40 1HG2 ILE 40 -10.007 -11.873 5.530
347 2HG2 ILE 40 2HG2 ILE 40 -10.289 -13.462 6.239
348 3HG2 ILE 40 3HG2 ILE 40 -11.615 -12.308 6.110
349 1HD1 ILE 40 1HD1 ILE 40 -13.899 -11.992 3.566
350 2HD1 ILE 40 2HD1 ILE 40 -13.024 -10.622 4.252
351 3HD1 ILE 40 3HD1 ILE 40 -13.080 -12.157 5.120
352 H PHE 41 H PHE 41 -10.351 -12.485 1.337
353 HA PHE 41 HA PHE 41 -11.477 -14.690 -0.103
354 1HB PHE 41 2HB PHE 41 -10.315 -12.018 -0.911
355 2HB PHE 41 1HB PHE 41 -11.131 -13.093 -2.048
356 HD1 PHE 41 1HD PHE 41 -13.409 -14.147 -0.878
357 HD2 PHE 41 2HD PHE 41 -11.670 -10.297 -0.110
358 HE1 PHE 41 1HE PHE 41 -15.614 -13.301 -0.123
359 HE2 PHE 41 2HE PHE 41 -13.875 -9.450 0.645
360 HZ PHE 41 HZ PHE 41 -15.847 -10.954 0.640
361 H LEU 42 H LEU 42 -8.197 -13.866 0.588
362 HA LEU 42 HA LEU 42 -6.862 -14.771 -1.729
363 1HB LEU 42 2HB LEU 42 -4.939 -15.020 -0.306
364 2HB LEU 42 1HB LEU 42 -5.872 -13.678 0.342
365 HG LEU 42 HG LEU 42 -6.148 -16.506 1.399
366 1HD1 LEU 42 1HD1 LEU 42 -4.036 -16.230 2.185
367 2HD1 LEU 42 2HD1 LEU 42 -4.761 -15.075 3.303
368 3HD1 LEU 42 3HD1 LEU 42 -4.027 -14.508 1.803
369 1HD2 LEU 42 1HD2 LEU 42 -7.948 -15.353 2.278
370 2HD2 LEU 42 2HD2 LEU 42 -7.139 -13.793 2.166
371 3HD2 LEU 42 3HD2 LEU 42 -6.725 -14.909 3.463
372 H LEU 43 H LEU 43 -8.343 -16.622 0.905
373 HA LEU 43 HA LEU 43 -7.289 -19.181 -0.006
374 1HB LEU 43 2HB LEU 43 -7.860 -18.690 2.344
375 2HB LEU 43 1HB LEU 43 -9.539 -18.413 1.883
376 HG LEU 43 HG LEU 43 -9.708 -20.746 1.087
377 1HD1 LEU 43 1HD1 LEU 43 -7.825 -21.878 0.601
378 2HD1 LEU 43 2HD1 LEU 43 -7.414 -21.893 2.316
379 3HD1 LEU 43 3HD1 LEU 43 -6.845 -20.582 1.285
380 1HD2 LEU 43 1HD2 LEU 43 -8.526 -20.884 3.852
381 2HD2 LEU 43 2HD2 LEU 43 -9.953 -21.702 3.213
382 3HD2 LEU 43 3HD2 LEU 43 -10.013 -19.977 3.572
383 H LEU 44 H LEU 44 -10.141 -17.237 -0.625
384 HA LEU 44 HA LEU 44 -11.720 -19.371 -1.788
385 1HB LEU 44 2HB LEU 44 -11.845 -16.348 -1.791
386 2HB LEU 44 1HB LEU 44 -13.037 -17.334 -2.632
387 HG LEU 44 HG LEU 44 -13.884 -16.779 -0.416
388 1HD1 LEU 44 1HD1 LEU 44 -14.498 -18.954 0.274
389 2HD1 LEU 44 2HD1 LEU 44 -12.962 -19.645 -0.250
390 3HD1 LEU 44 3HD1 LEU 44 -14.150 -19.127 -1.446
391 1HD2 LEU 44 1HD2 LEU 44 -11.559 -18.261 0.807
392 2HD2 LEU 44 2HD2 LEU 44 -12.736 -17.217 1.603
393 3HD2 LEU 44 3HD2 LEU 44 -11.508 -16.517 0.547
394 H ILE 45 H ILE 45 -9.727 -16.720 -3.107
395 HA ILE 45 HA ILE 45 -10.181 -17.335 -5.868
396 HB ILE 45 HB ILE 45 -8.221 -15.872 -6.188
397 1HG1 ILE 45 2HG1 ILE 45 -7.884 -16.175 -3.184
398 2HG1 ILE 45 1HG1 ILE 45 -6.805 -16.843 -4.408
399 1HG2 ILE 45 1HG2 ILE 45 -9.322 -14.452 -3.899
400 2HG2 ILE 45 2HG2 ILE 45 -10.592 -15.226 -4.848
401 3HG2 ILE 45 3HG2 ILE 45 -9.482 -14.092 -5.619
402 1HD1 ILE 45 1HD1 ILE 45 -7.188 -13.996 -3.571
403 2HD1 ILE 45 2HD1 ILE 45 -6.736 -14.325 -5.242
404 3HD1 ILE 45 3HD1 ILE 45 -5.697 -14.866 -3.925
405 H CYS 46 H CYS 46 -8.121 -18.760 -3.441
406 HA CYS 46 HA CYS 46 -6.300 -20.041 -5.301
407 1HB CYS 46 2HB CYS 46 -6.880 -20.204 -2.374
408 2HB CYS 46 1HB CYS 46 -5.671 -21.236 -3.119
409 HG CYS 46 HG CYS 46 -4.155 -19.291 -2.870
410 H ILE 47 H ILE 47 -8.880 -21.300 -3.144
411 HA ILE 47 HA ILE 47 -8.755 -23.997 -3.951
412 HB ILE 47 HB ILE 47 -11.112 -24.060 -3.146
413 1HG1 ILE 47 2HG1 ILE 47 -10.801 -21.043 -3.037
414 2HG1 ILE 47 1HG1 ILE 47 -11.818 -21.915 -4.186
415 1HG2 ILE 47 1HG2 ILE 47 -9.538 -24.161 -1.395
416 2HG2 ILE 47 2HG2 ILE 47 -10.600 -22.837 -0.914
417 3HG2 ILE 47 3HG2 ILE 47 -9.028 -22.490 -1.633
418 1HD1 ILE 47 1HD1 ILE 47 -13.164 -21.114 -2.290
419 2HD1 ILE 47 2HD1 ILE 47 -12.104 -21.965 -1.166
420 3HD1 ILE 47 3HD1 ILE 47 -13.102 -22.877 -2.297
421 H ILE 48 H ILE 48 -10.018 -21.255 -5.705
422 HA ILE 48 HA ILE 48 -11.476 -22.973 -7.598
423 HB ILE 48 HB ILE 48 -12.193 -20.822 -8.551
424 1HG1 ILE 48 2HG1 ILE 48 -10.298 -19.597 -6.519
425 2HG1 ILE 48 1HG1 ILE 48 -10.034 -19.631 -8.259
426 1HG2 ILE 48 1HG2 ILE 48 -13.128 -21.807 -6.341
427 2HG2 ILE 48 2HG2 ILE 48 -13.515 -20.130 -6.727
428 3HG2 ILE 48 3HG2 ILE 48 -12.250 -20.495 -5.556
429 1HD1 ILE 48 1HD1 ILE 48 -10.979 -17.486 -7.764
430 2HD1 ILE 48 2HD1 ILE 48 -12.231 -18.201 -6.750
431 3HD1 ILE 48 3HD1 ILE 48 -12.269 -18.437 -8.497
432 H VAL 49 H VAL 49 -8.497 -21.081 -7.431
433 HA VAL 49 HA VAL 49 -7.924 -21.572 -10.299
434 HB VAL 49 HB VAL 49 -6.441 -20.142 -8.068
435 1HG1 VAL 49 1HG2 VAL 49 -5.887 -20.283 -11.049
436 2HG1 VAL 49 2HG2 VAL 49 -4.880 -20.966 -9.772
437 3HG1 VAL 49 3HG2 VAL 49 -5.057 -19.216 -9.915
438 1HG2 VAL 49 1HG1 VAL 49 -7.325 -18.505 -10.270
439 2HG2 VAL 49 2HG1 VAL 49 -7.748 -18.374 -8.565
440 3HG2 VAL 49 3HG1 VAL 49 -8.691 -19.414 -9.629
441 H MET 50 H MET 50 -6.709 -22.532 -7.088
442 HA MET 50 HA MET 50 -4.461 -24.043 -7.972
443 1HB MET 50 2HB MET 50 -6.260 -24.337 -5.579
444 2HB MET 50 1HB MET 50 -4.661 -25.051 -5.719
445 1HG MET 50 2HG MET 50 -5.278 -22.082 -5.825
446 2HG MET 50 1HG MET 50 -4.578 -22.932 -4.448
447 1HE MET 50 1HE MET 50 -1.698 -20.746 -5.930
448 2HE MET 50 2HE MET 50 -2.445 -21.276 -4.426
449 3HE MET 50 3HE MET 50 -3.417 -20.445 -5.639
450 H LEU 51 H LEU 51 -7.880 -24.745 -7.938
451 HA LEU 51 HA LEU 51 -7.405 -27.640 -8.444
452 1HB LEU 51 2HB LEU 51 -9.902 -25.959 -8.047
453 2HB LEU 51 1HB LEU 51 -9.883 -27.717 -8.188
454 HG LEU 51 HG LEU 51 -8.443 -26.113 -6.055
455 1HD1 LEU 51 1HD1 LEU 51 -11.117 -26.595 -6.171
456 2HD1 LEU 51 2HD1 LEU 51 -10.213 -26.503 -4.658
457 3HD1 LEU 51 3HD1 LEU 51 -10.565 -28.074 -5.382
458 1HD2 LEU 51 1HD2 LEU 51 -8.680 -28.833 -5.356
459 2HD2 LEU 51 2HD2 LEU 51 -7.203 -27.983 -5.809
460 3HD2 LEU 51 3HD2 LEU 51 -8.149 -28.824 -7.036
461 H LEU 52 H LEU 52 -7.730 -24.769 -10.237
462 HA LEU 52 HA LEU 52 -8.624 -26.326 -12.639
463 1HB LEU 52 2HB LEU 52 -9.190 -23.448 -11.847
464 2HB LEU 52 1HB LEU 52 -9.731 -24.214 -13.341
465 HG LEU 52 HG LEU 52 -10.464 -25.116 -10.539
466 1HD1 LEU 52 1HD1 LEU 52 -11.470 -22.936 -11.567
467 2HD1 LEU 52 2HD1 LEU 52 -12.569 -24.131 -10.877
468 3HD1 LEU 52 3HD1 LEU 52 -12.352 -24.039 -12.625
469 1HD2 LEU 52 1HD2 LEU 52 -10.981 -27.072 -11.528
470 2HD2 LEU 52 2HD2 LEU 52 -10.531 -26.436 -13.111
471 3HD2 LEU 52 3HD2 LEU 52 -12.172 -26.211 -12.503
Start of MODEL 10
1 1H MET 1 1HT MET 1 17.734 20.330 20.308
2 2H MET 1 2HT MET 1 17.911 21.990 19.993
3 H MET 1 H MET 1 17.665 21.540 20.398
4 3H MET 1 3HT MET 1 18.973 20.869 19.283
5 HA MET 1 HA MET 1 17.513 21.351 17.542
6 1HB MET 1 2HB MET 1 17.869 18.941 18.131
7 2HB MET 1 1HB MET 1 16.373 19.024 19.036
8 1HG MET 1 2HG MET 1 15.126 19.628 17.033
9 2HG MET 1 1HG MET 1 16.620 19.591 16.108
10 1HE MET 1 1HE MET 1 14.423 16.165 18.128
11 2HE MET 1 2HE MET 1 14.441 17.880 18.525
12 3HE MET 1 3HE MET 1 15.781 16.854 19.027
13 H ASP 2 H ASP 2 15.835 22.663 17.107
14 HA ASP 2 HA ASP 2 13.231 22.401 18.367
15 1HB ASP 2 2HB ASP 2 13.311 24.594 19.529
16 2HB ASP 2 1HB ASP 2 14.527 23.487 20.167
17 H LYS 3 H LYS 3 15.455 24.546 16.589
18 HA LYS 3 HA LYS 3 13.269 25.830 15.123
19 1HB LYS 3 2HB LYS 3 15.159 27.110 15.871
20 2HB LYS 3 1HB LYS 3 16.271 25.966 15.134
21 1HG LYS 3 2HG LYS 3 15.467 26.552 12.925
22 2HG LYS 3 1HG LYS 3 14.288 27.666 13.615
23 1HD LYS 3 2HD LYS 3 16.123 28.992 14.611
24 2HD LYS 3 1HD LYS 3 17.302 27.889 13.907
25 1HE LYS 3 2HE LYS 3 15.293 29.445 12.243
26 2HE LYS 3 1HE LYS 3 16.945 30.004 12.561
27 1HZ LYS 3 1HZ LYS 3 16.765 27.238 11.722
28 2HZ LYS 3 2HZ LYS 3 17.819 28.464 11.211
29 3HZ LYS 3 3HZ LYS 3 16.262 28.349 10.544
30 H VAL 4 H VAL 4 15.805 23.412 14.530
31 HA VAL 4 HA VAL 4 15.439 23.224 11.684
32 HB VAL 4 HB VAL 4 16.619 21.074 11.998
33 1HG1 VAL 4 1HG2 VAL 4 17.845 23.260 12.192
34 2HG1 VAL 4 2HG2 VAL 4 18.605 21.944 13.087
35 3HG1 VAL 4 3HG2 VAL 4 17.652 23.158 13.941
36 1HG2 VAL 4 1HG1 VAL 4 16.177 21.556 14.959
37 2HG2 VAL 4 2HG1 VAL 4 17.046 20.205 14.237
38 3HG2 VAL 4 3HG1 VAL 4 15.306 20.361 14.000
39 H GLN 5 H GLN 5 13.626 22.019 14.416
40 HA GLN 5 HA GLN 5 12.192 19.933 13.029
41 1HB GLN 5 2HB GLN 5 11.572 21.558 15.515
42 2HB GLN 5 1HB GLN 5 10.776 20.048 15.066
43 1HG GLN 5 2HG GLN 5 12.946 18.876 15.150
44 2HG GLN 5 1HG GLN 5 13.741 20.383 15.607
45 1HE2 GLN 5 1HE2 GLN 5 12.543 17.584 16.946
46 2HE2 GLN 5 2HE2 GLN 5 12.167 18.154 18.500
47 H TYR 6 H TYR 6 11.200 23.231 14.070
48 HA TYR 6 HA TYR 6 8.658 23.234 12.814
49 1HB TYR 6 2HB TYR 6 10.627 25.485 13.340
50 2HB TYR 6 1HB TYR 6 8.913 25.709 12.996
51 HD1 TYR 6 1HD TYR 6 7.427 23.881 14.488
52 HD2 TYR 6 2HD TYR 6 11.145 25.723 15.594
53 HE1 TYR 6 1HE TYR 6 6.889 23.528 16.883
54 HE2 TYR 6 2HE TYR 6 10.608 25.367 17.989
55 HH TYR 6 HH TYR 6 7.567 24.636 19.101
56 H LEU 7 H LEU 7 11.805 24.423 11.580
57 HA LEU 7 HA LEU 7 10.918 25.333 9.050
58 1HB LEU 7 2HB LEU 7 13.517 24.026 9.915
59 2HB LEU 7 1HB LEU 7 13.309 24.949 8.425
60 HG LEU 7 HG LEU 7 12.843 26.021 11.224
61 1HD1 LEU 7 1HD2 LEU 7 14.926 27.015 11.126
62 2HD1 LEU 7 2HD2 LEU 7 14.955 27.037 9.364
63 3HD1 LEU 7 3HD2 LEU 7 15.264 25.533 10.234
64 1HD2 LEU 7 1HD1 LEU 7 12.070 26.933 8.573
65 2HD2 LEU 7 2HD1 LEU 7 13.119 28.104 9.370
66 3HD2 LEU 7 3HD1 LEU 7 11.624 27.585 10.148
67 H THR 8 H THR 8 11.948 22.066 10.058
68 HA THR 8 HA THR 8 11.771 20.835 7.482
69 HB THR 8 HB THR 8 11.360 19.733 10.274
70 HG1 THR 8 1HG THR 8 13.550 19.364 10.203
71 1HG2 THR 8 1HG2 THR 8 11.233 18.509 7.659
72 2HG2 THR 8 2HG2 THR 8 10.934 17.783 9.240
73 3HG2 THR 8 3HG2 THR 8 12.571 17.835 8.587
74 H ARG 9 H ARG 9 9.453 20.765 10.218
75 HA ARG 9 HA ARG 9 7.332 19.431 8.963
76 1HB ARG 9 2HB ARG 9 7.456 20.026 11.336
77 2HB ARG 9 1HB ARG 9 7.283 21.723 10.911
78 1HG ARG 9 2HG ARG 9 5.068 21.291 9.951
79 2HG ARG 9 1HG ARG 9 5.238 19.574 10.320
80 1HD ARG 9 2HD ARG 9 5.217 21.820 12.373
81 2HD ARG 9 1HD ARG 9 3.893 20.678 12.071
82 HE ARG 9 HE ARG 9 6.214 20.091 13.641
83 1HH1 ARG 9 1HH2 ARG 9 3.465 18.616 12.932
84 2HH1 ARG 9 2HH2 ARG 9 4.103 17.049 12.561
85 1HH2 ARG 9 1HH1 ARG 9 7.391 18.141 12.387
86 2HH2 ARG 9 2HH1 ARG 9 6.327 16.781 12.248
87 H SER 10 H SER 10 8.291 22.824 8.710
88 HA SER 10 HA SER 10 5.964 23.620 7.181
89 1HB SER 10 2HB SER 10 7.273 25.155 8.576
90 2HB SER 10 1HB SER 10 8.680 24.848 7.573
91 HG SER 10 HG SER 10 7.277 26.778 7.120
92 H ALA 11 H ALA 11 8.902 21.978 6.455
93 HA ALA 11 HA ALA 11 8.820 22.724 3.601
94 1HB ALA 11 1HB ALA 11 10.941 22.679 4.909
95 2HB ALA 11 2HB ALA 11 10.976 21.547 3.557
96 3HB ALA 11 3HB ALA 11 10.698 20.956 5.196
97 H ILE 12 H ILE 12 8.510 19.868 5.706
98 HA ILE 12 HA ILE 12 8.146 17.928 3.645
99 HB ILE 12 HB ILE 12 8.678 17.456 6.017
100 1HG1 ILE 12 2HG1 ILE 12 7.110 15.573 6.321
101 2HG1 ILE 12 1HG1 ILE 12 6.032 16.274 5.114
102 1HG2 ILE 12 1HG2 ILE 12 5.791 18.056 6.651
103 2HG2 ILE 12 2HG2 ILE 12 7.036 19.292 6.810
104 3HG2 ILE 12 3HG2 ILE 12 7.131 17.817 7.770
105 1HD1 ILE 12 1HD1 ILE 12 8.189 14.520 4.647
106 2HD1 ILE 12 2HD1 ILE 12 8.721 16.096 4.063
107 3HD1 ILE 12 3HD1 ILE 12 7.236 15.377 3.437
108 H ARG 13 H ARG 13 5.831 20.019 5.372
109 HA ARG 13 HA ARG 13 3.444 18.847 4.316
110 1HB ARG 13 2HB ARG 13 4.135 21.634 5.283
111 2HB ARG 13 1HB ARG 13 2.489 21.071 4.999
112 1HG ARG 13 2HG ARG 13 4.450 19.779 6.919
113 2HG ARG 13 1HG ARG 13 3.148 20.862 7.387
114 1HD ARG 13 2HD ARG 13 1.499 19.297 6.389
115 2HD ARG 13 1HD ARG 13 2.831 18.196 6.020
116 HE ARG 13 HE ARG 13 2.777 17.553 8.280
117 1HH1 ARG 13 1HH1 ARG 13 0.788 20.263 7.921
118 2HH1 ARG 13 2HH1 ARG 13 0.877 20.752 9.580
119 1HH2 ARG 13 1HH2 ARG 13 3.284 18.406 10.423
120 2HH2 ARG 13 2HH2 ARG 13 2.287 19.700 10.996
121 H ARG 14 H ARG 14 5.801 21.020 2.942
122 HA ARG 14 HA ARG 14 4.088 22.067 0.845
123 1HB ARG 14 2HB ARG 14 7.094 21.947 1.224
124 2HB ARG 14 1HB ARG 14 6.278 22.924 0.004
125 1HG ARG 14 2HG ARG 14 5.839 23.158 2.994
126 2HG ARG 14 1HG ARG 14 6.833 24.251 2.030
127 1HD ARG 14 2HD ARG 14 4.844 24.855 0.672
128 2HD ARG 14 1HD ARG 14 3.847 23.784 1.673
129 HE ARG 14 HE ARG 14 4.689 26.414 2.443
130 1HH1 ARG 14 1HH2 ARG 14 2.997 23.813 3.552
131 2HH1 ARG 14 2HH2 ARG 14 3.412 23.996 5.224
132 1HH2 ARG 14 1HH1 ARG 14 5.847 26.392 4.636
133 2HH2 ARG 14 2HH1 ARG 14 5.025 25.455 5.839
134 H ALA 15 H ALA 15 5.869 19.133 1.291
135 HA ALA 15 HA ALA 15 5.695 18.540 -1.618
136 1HB ALA 15 1HB ALA 15 7.310 17.043 0.439
137 2HB ALA 15 2HB ALA 15 7.900 18.551 -0.258
138 3HB ALA 15 3HB ALA 15 7.590 17.162 -1.298
139 H SER 16 H SER 16 4.005 17.976 1.187
140 HA SER 16 HA SER 16 3.134 15.286 0.262
141 1HB SER 16 2HB SER 16 2.794 14.778 2.640
142 2HB SER 16 1HB SER 16 4.433 15.358 2.372
143 HG SER 16 HG SER 16 3.740 17.419 3.042
144 H THR 17 H THR 17 2.210 18.475 0.695
145 HA THR 17 HA THR 17 -0.664 17.714 0.803
146 HB THR 17 HB THR 17 0.755 20.148 1.926
147 HG1 THR 17 1HG THR 17 -0.619 18.107 3.313
148 1HG2 THR 17 1HG2 THR 17 -1.718 20.105 3.065
149 2HG2 THR 17 2HG2 THR 17 -2.088 19.477 1.458
150 3HG2 THR 17 3HG2 THR 17 -1.316 21.053 1.632
151 H ILE 18 H ILE 18 1.834 19.351 -0.906
152 HA ILE 18 HA ILE 18 -0.136 20.823 -2.545
153 HB ILE 18 HB ILE 18 2.834 21.095 -2.168
154 1HG1 ILE 18 2HG1 ILE 18 2.146 23.388 -1.326
155 2HG1 ILE 18 1HG1 ILE 18 0.479 22.824 -1.375
156 1HG2 ILE 18 1HG2 ILE 18 2.620 23.115 -3.619
157 2HG2 ILE 18 2HG2 ILE 18 0.952 22.649 -3.960
158 3HG2 ILE 18 3HG2 ILE 18 2.282 21.614 -4.483
159 1HD1 ILE 18 1HD1 ILE 18 2.387 21.051 0.042
160 2HD1 ILE 18 2HD1 ILE 18 0.735 21.499 0.469
161 3HD1 ILE 18 3HD1 ILE 18 2.066 22.603 0.815
162 H GLU 19 H GLU 19 1.804 18.010 -2.510
163 HA GLU 19 HA GLU 19 1.748 17.872 -5.480
164 1HB GLU 19 2HB GLU 19 3.983 17.983 -4.477
165 2HB GLU 19 1HB GLU 19 3.586 16.592 -3.479
166 1HG GLU 19 2HG GLU 19 3.265 15.214 -5.499
167 2HG GLU 19 1HG GLU 19 3.666 16.606 -6.505
168 H MET 20 H MET 20 1.091 16.181 -2.459
169 HA MET 20 HA MET 20 -0.528 14.195 -3.988
170 1HB MET 20 2HB MET 20 1.515 13.622 -1.854
171 2HB MET 20 1HB MET 20 0.485 12.413 -2.610
172 1HG MET 20 2HG MET 20 1.467 12.962 -4.810
173 2HG MET 20 1HG MET 20 2.508 14.161 -4.041
174 1HE MET 20 1HE MET 20 2.555 9.631 -3.284
175 2HE MET 20 2HE MET 20 1.360 10.549 -4.196
176 3HE MET 20 3HE MET 20 1.433 10.707 -2.442
177 HA PRO 21 HA PRO 21 -2.547 15.679 -0.092
178 1HB PRO 21 2HB PRO 21 -4.462 17.308 -1.169
179 2HB PRO 21 1HB PRO 21 -2.838 17.873 -0.752
180 1HG PRO 21 2HG PRO 21 -4.020 17.406 -3.372
181 2HG PRO 21 1HG PRO 21 -2.631 18.395 -2.925
182 1HD PRO 21 2HD PRO 21 -2.623 15.784 -4.092
183 2HD PRO 21 1HD PRO 21 -1.228 16.772 -3.609
184 H GLN 22 H GLN 22 -4.969 15.879 -2.673
185 HA GLN 22 HA GLN 22 -6.872 14.216 -1.420
186 1HB GLN 22 2HB GLN 22 -7.894 14.190 -3.685
187 2HB GLN 22 1HB GLN 22 -7.310 15.798 -3.255
188 1HG GLN 22 2HG GLN 22 -5.220 15.362 -4.518
189 2HG GLN 22 1HG GLN 22 -5.842 13.776 -4.978
190 1HE2 GLN 22 1HE2 GLN 22 -5.542 16.889 -6.136
191 2HE2 GLN 22 2HE2 GLN 22 -6.846 16.908 -7.221
192 H GLN 23 H GLN 23 -4.074 13.317 -3.340
193 HA GLN 23 HA GLN 23 -5.021 10.605 -3.831
194 1HB GLN 23 2HB GLN 23 -3.553 11.821 -5.378
195 2HB GLN 23 1HB GLN 23 -2.332 11.922 -4.118
196 1HG GLN 23 2HG GLN 23 -2.172 9.468 -4.042
197 2HG GLN 23 1HG GLN 23 -3.409 9.351 -5.294
198 1HE2 GLN 23 1HE2 GLN 23 -0.099 9.267 -4.896
199 2HE2 GLN 23 2HE2 GLN 23 0.378 9.782 -6.442
200 H ALA 24 H ALA 24 -2.176 11.854 -2.038
201 HA ALA 24 HA ALA 24 -1.496 9.508 -0.665
202 1HB ALA 24 1HB ALA 24 -0.326 11.760 -0.743
203 2HB ALA 24 2HB ALA 24 -0.346 10.998 0.847
204 3HB ALA 24 3HB ALA 24 -1.465 12.313 0.484
205 H ARG 25 H ARG 25 -3.970 11.931 0.211
206 HA ARG 25 HA ARG 25 -4.662 10.820 2.751
207 1HB ARG 25 2HB ARG 25 -5.241 13.073 1.976
208 2HB ARG 25 1HB ARG 25 -6.261 12.370 0.732
209 1HG ARG 25 2HG ARG 25 -7.678 11.326 2.454
210 2HG ARG 25 1HG ARG 25 -6.657 12.023 3.711
211 1HD ARG 25 2HD ARG 25 -8.216 13.626 1.649
212 2HD ARG 25 1HD ARG 25 -8.674 13.420 3.352
213 HE ARG 25 HE ARG 25 -5.973 14.296 3.289
214 1HH1 ARG 25 1HH2 ARG 25 -8.366 15.636 1.401
215 2HH1 ARG 25 2HH2 ARG 25 -8.363 17.190 2.166
216 1HH2 ARG 25 1HH1 ARG 25 -6.296 16.200 4.768
217 2HH2 ARG 25 2HH1 ARG 25 -7.191 17.509 4.073
218 H GLN 26 H GLN 26 -6.322 10.517 -0.397
219 HA GLN 26 HA GLN 26 -8.173 8.509 0.425
220 1HB GLN 26 2HB GLN 26 -7.006 9.218 -2.257
221 2HB GLN 26 1HB GLN 26 -8.473 8.271 -2.026
222 1HG GLN 26 2HG GLN 26 -8.071 11.090 -0.997
223 2HG GLN 26 1HG GLN 26 -8.923 10.695 -2.489
224 1HE2 GLN 26 1HE2 GLN 26 -11.147 10.526 -2.223
225 2HE2 GLN 26 2HE2 GLN 26 -11.932 10.089 -0.783
226 H ASN 27 H ASN 27 -5.153 8.249 -1.436
227 HA ASN 27 HA ASN 27 -5.081 5.457 -1.753
228 1HB ASN 27 2HB ASN 27 -2.915 7.501 -1.372
229 2HB ASN 27 1HB ASN 27 -2.604 5.864 -1.933
230 1HD2 ASN 27 1HD2 ASN 27 -2.474 5.775 -4.178
231 2HD2 ASN 27 2HD2 ASN 27 -3.365 6.745 -5.248
232 H LEU 28 H LEU 28 -4.098 7.389 1.062
233 HA LEU 28 HA LEU 28 -2.696 5.418 2.515
234 1HB LEU 28 2HB LEU 28 -2.969 7.862 3.016
235 2HB LEU 28 1HB LEU 28 -4.596 7.501 3.569
236 HG LEU 28 HG LEU 28 -2.131 6.180 4.727
237 1HD1 LEU 28 1HD1 LEU 28 -2.278 8.727 5.019
238 2HD1 LEU 28 2HD1 LEU 28 -2.167 7.776 6.499
239 3HD1 LEU 28 3HD1 LEU 28 -3.723 8.424 5.983
240 1HD2 LEU 28 1HD2 LEU 28 -4.105 6.197 6.638
241 2HD2 LEU 28 2HD2 LEU 28 -3.773 4.840 5.560
242 3HD2 LEU 28 3HD2 LEU 28 -5.045 5.995 5.160
243 H GLN 29 H GLN 29 -6.174 5.901 2.112
244 HA GLN 29 HA GLN 29 -6.869 3.844 4.063
245 1HB GLN 29 2HB GLN 29 -8.455 5.366 2.013
246 2HB GLN 29 1HB GLN 29 -9.155 4.393 3.299
247 1HG GLN 29 2HG GLN 29 -8.046 5.828 4.979
248 2HG GLN 29 1HG GLN 29 -7.363 6.811 3.683
249 1HE2 GLN 29 1HE2 GLN 29 -9.889 6.773 5.851
250 2HE2 GLN 29 2HE2 GLN 29 -11.013 7.709 4.988
251 H ASN 30 H ASN 30 -6.720 4.159 0.538
252 HA ASN 30 HA ASN 30 -7.964 1.774 -0.263
253 1HB ASN 30 2HB ASN 30 -7.164 3.560 -1.742
254 2HB ASN 30 1HB ASN 30 -5.506 3.138 -1.338
255 1HD2 ASN 30 1HD2 ASN 30 -4.552 1.869 -2.928
256 2HD2 ASN 30 2HD2 ASN 30 -5.366 0.726 -3.881
257 H LEU 31 H LEU 31 -4.733 2.279 1.068
258 HA LEU 31 HA LEU 31 -3.562 -0.228 0.492
259 1HB LEU 31 2HB LEU 31 -2.408 1.743 1.386
260 2HB LEU 31 1HB LEU 31 -3.312 1.583 2.882
261 HG LEU 31 HG LEU 31 -2.298 -0.679 3.212
262 1HD1 LEU 31 1HD2 LEU 31 -1.675 -0.494 0.535
263 2HD1 LEU 31 2HD2 LEU 31 -0.958 -1.650 1.656
264 3HD1 LEU 31 3HD2 LEU 31 -0.127 -0.136 1.298
265 1HD2 LEU 31 1HD1 LEU 31 0.191 0.476 3.237
266 2HD2 LEU 31 2HD1 LEU 31 -1.025 0.709 4.493
267 3HD2 LEU 31 3HD1 LEU 31 -0.855 1.895 3.199
268 H PHE 32 H PHE 32 -5.855 0.722 2.994
269 HA PHE 32 HA PHE 32 -5.641 -1.748 4.484
270 1HB PHE 32 2HB PHE 32 -7.594 0.565 4.462
271 2HB PHE 32 1HB PHE 32 -7.658 -0.742 5.638
272 HD1 PHE 32 1HD PHE 32 -7.463 1.633 6.968
273 HD2 PHE 32 2HD PHE 32 -4.247 -0.363 4.923
274 HE1 PHE 32 1HE PHE 32 -5.816 2.822 8.387
275 HE2 PHE 32 2HE PHE 32 -2.607 0.829 6.345
276 HZ PHE 32 HZ PHE 32 -3.390 2.421 8.076
277 H ILE 33 H ILE 33 -7.945 -0.421 2.106
278 HA ILE 33 HA ILE 33 -9.662 -2.784 2.258
279 HB ILE 33 HB ILE 33 -9.540 -0.364 0.475
280 1HG1 ILE 33 2HG1 ILE 33 -11.690 0.179 1.668
281 2HG1 ILE 33 1HG1 ILE 33 -11.399 -1.209 2.713
282 1HG2 ILE 33 1HG2 ILE 33 -11.488 -2.673 0.480
283 2HG2 ILE 33 2HG2 ILE 33 -10.525 -2.084 -0.874
284 3HG2 ILE 33 3HG2 ILE 33 -11.857 -1.111 -0.249
285 1HD1 ILE 33 1HD1 ILE 33 -10.635 1.129 3.543
286 2HD1 ILE 33 2HD1 ILE 33 -9.312 0.941 2.393
287 3HD1 ILE 33 3HD1 ILE 33 -9.509 -0.218 3.708
288 H ASN 34 H ASN 34 -7.364 -1.440 -0.128
289 HA ASN 34 HA ASN 34 -7.613 -3.374 -2.158
290 1HB ASN 34 2HB ASN 34 -6.276 -1.292 -2.254
291 2HB ASN 34 1HB ASN 34 -5.131 -1.977 -1.099
292 1HD2 ASN 34 1HD2 ASN 34 -5.533 -1.484 -4.366
293 2HD2 ASN 34 2HD2 ASN 34 -4.586 -2.761 -4.961
294 H PHE 35 H PHE 35 -5.776 -3.534 0.879
295 HA PHE 35 HA PHE 35 -4.684 -6.168 0.224
296 1HB PHE 35 2HB PHE 35 -4.612 -4.338 2.631
297 2HB PHE 35 1HB PHE 35 -3.842 -5.924 2.628
298 HD1 PHE 35 1HD PHE 35 -4.048 -2.917 0.350
299 HD2 PHE 35 2HD PHE 35 -1.596 -5.987 2.091
300 HE1 PHE 35 1HE PHE 35 -2.071 -1.999 -0.820
301 HE2 PHE 35 2HE PHE 35 0.385 -5.062 0.924
302 HZ PHE 35 HZ PHE 35 0.147 -3.069 -0.533
303 H CYS 36 H CYS 36 -7.480 -4.850 1.796
304 HA CYS 36 HA CYS 36 -8.107 -7.215 3.370
305 1HB CYS 36 2HB CYS 36 -8.790 -4.917 3.977
306 2HB CYS 36 1HB CYS 36 -9.745 -4.814 2.497
307 HG CYS 36 HG CYS 36 -10.425 -7.033 4.584
308 H LEU 37 H LEU 37 -9.077 -5.856 0.237
309 HA LEU 37 HA LEU 37 -11.128 -7.808 -0.322
310 1HB LEU 37 2HB LEU 37 -10.990 -5.556 -1.314
311 2HB LEU 37 1HB LEU 37 -9.498 -6.022 -2.134
312 HG LEU 37 HG LEU 37 -10.686 -7.797 -3.341
313 1HD1 LEU 37 1HD2 LEU 37 -13.235 -7.775 -3.163
314 2HD1 LEU 37 2HD2 LEU 37 -13.034 -6.810 -1.702
315 3HD1 LEU 37 3HD2 LEU 37 -12.381 -8.446 -1.773
316 1HD2 LEU 37 1HD1 LEU 37 -10.707 -5.250 -3.987
317 2HD2 LEU 37 2HD1 LEU 37 -12.427 -5.379 -3.627
318 3HD2 LEU 37 3HD1 LEU 37 -11.712 -6.389 -4.884
319 H ILE 38 H ILE 38 -7.786 -7.383 -1.547
320 HA ILE 38 HA ILE 38 -7.661 -9.721 -3.142
321 HB ILE 38 HB ILE 38 -6.012 -7.875 -3.097
322 1HG1 ILE 38 2HG1 ILE 38 -3.973 -9.263 -3.194
323 2HG1 ILE 38 1HG1 ILE 38 -4.814 -10.565 -2.352
324 1HG2 ILE 38 1HG2 ILE 38 -6.097 -7.629 -0.581
325 2HG2 ILE 38 2HG2 ILE 38 -4.470 -7.616 -1.260
326 3HG2 ILE 38 3HG2 ILE 38 -5.084 -9.069 -0.471
327 1HD1 ILE 38 1HD1 ILE 38 -6.406 -10.782 -4.186
328 2HD1 ILE 38 2HD1 ILE 38 -4.767 -10.891 -4.830
329 3HD1 ILE 38 3HD1 ILE 38 -5.688 -9.398 -5.010
330 H LEU 39 H LEU 39 -7.025 -9.301 0.348
331 HA LEU 39 HA LEU 39 -6.013 -11.875 0.930
332 1HB LEU 39 2HB LEU 39 -6.182 -9.732 2.332
333 2HB LEU 39 1HB LEU 39 -7.854 -10.190 2.651
334 HG LEU 39 HG LEU 39 -5.463 -11.941 3.222
335 1HD1 LEU 39 1HD1 LEU 39 -5.429 -11.163 5.403
336 2HD1 LEU 39 2HD1 LEU 39 -7.136 -10.713 5.374
337 3HD1 LEU 39 3HD1 LEU 39 -5.940 -9.692 4.574
338 1HD2 LEU 39 1HD2 LEU 39 -7.377 -12.936 4.782
339 2HD2 LEU 39 2HD2 LEU 39 -7.232 -13.436 3.098
340 3HD2 LEU 39 3HD2 LEU 39 -8.424 -12.220 3.556
341 H ILE 40 H ILE 40 -9.378 -10.669 1.159
342 HA ILE 40 HA ILE 40 -10.580 -13.161 1.811
343 HB ILE 40 HB ILE 40 -11.633 -10.747 0.364
344 1HG1 ILE 40 2HG1 ILE 40 -11.657 -11.507 3.297
345 2HG1 ILE 40 1HG1 ILE 40 -10.650 -10.251 2.573
346 1HG2 ILE 40 1HG2 ILE 40 -13.250 -12.431 0.020
347 2HG2 ILE 40 2HG2 ILE 40 -13.819 -11.595 1.464
348 3HG2 ILE 40 3HG2 ILE 40 -12.975 -13.135 1.613
349 1HD1 ILE 40 1HD1 ILE 40 -13.631 -10.280 2.974
350 2HD1 ILE 40 2HD1 ILE 40 -12.920 -9.287 1.703
351 3HD1 ILE 40 3HD1 ILE 40 -12.469 -9.021 3.386
352 H PHE 41 H PHE 41 -10.099 -11.571 -1.348
353 HA PHE 41 HA PHE 41 -11.450 -13.398 -3.013
354 1HB PHE 41 2HB PHE 41 -10.477 -11.263 -3.734
355 2HB PHE 41 1HB PHE 41 -8.853 -11.874 -3.414
356 HD1 PHE 41 1HD PHE 41 -11.922 -13.059 -5.241
357 HD2 PHE 41 2HD PHE 41 -7.659 -12.534 -5.283
358 HE1 PHE 41 1HE PHE 41 -11.824 -14.028 -7.524
359 HE2 PHE 41 2HE PHE 41 -7.562 -13.503 -7.564
360 HZ PHE 41 HZ PHE 41 -9.643 -14.249 -8.683
361 H LEU 42 H LEU 42 -8.041 -13.488 -1.950
362 HA LEU 42 HA LEU 42 -7.223 -15.845 -3.237
363 1HB LEU 42 2HB LEU 42 -5.965 -14.081 -1.851
364 2HB LEU 42 1HB LEU 42 -6.479 -14.987 -0.429
365 HG LEU 42 HG LEU 42 -4.951 -16.174 -2.746
366 1HD1 LEU 42 1HD1 LEU 42 -4.049 -14.505 -0.608
367 2HD1 LEU 42 2HD1 LEU 42 -3.077 -15.335 -1.824
368 3HD1 LEU 42 3HD1 LEU 42 -3.462 -16.141 -0.303
369 1HD2 LEU 42 1HD2 LEU 42 -6.134 -17.228 -0.231
370 2HD2 LEU 42 2HD2 LEU 42 -4.521 -17.814 -0.635
371 3HD2 LEU 42 3HD2 LEU 42 -5.852 -18.045 -1.769
372 H LEU 43 H LEU 43 -8.880 -15.444 -0.098
373 HA LEU 43 HA LEU 43 -8.807 -18.135 0.777
374 1HB LEU 43 2HB LEU 43 -9.471 -16.177 2.119
375 2HB LEU 43 1HB LEU 43 -10.930 -16.002 1.141
376 HG LEU 43 HG LEU 43 -11.690 -18.233 1.853
377 1HD1 LEU 43 1HD2 LEU 43 -10.421 -19.371 3.696
378 2HD1 LEU 43 2HD2 LEU 43 -9.119 -18.203 3.462
379 3HD1 LEU 43 3HD2 LEU 43 -9.542 -19.324 2.167
380 1HD2 LEU 43 1HD1 LEU 43 -12.639 -17.286 3.666
381 2HD2 LEU 43 2HD1 LEU 43 -11.555 -15.916 3.425
382 3HD2 LEU 43 3HD1 LEU 43 -11.095 -17.226 4.515
383 H LEU 44 H LEU 44 -11.443 -16.500 -1.047
384 HA LEU 44 HA LEU 44 -13.053 -18.849 -1.322
385 1HB LEU 44 2HB LEU 44 -12.852 -16.193 -2.731
386 2HB LEU 44 1HB LEU 44 -14.012 -17.408 -3.265
387 HG LEU 44 HG LEU 44 -15.064 -15.856 -1.671
388 1HD1 LEU 44 1HD2 LEU 44 -14.688 -18.372 -0.088
389 2HD1 LEU 44 2HD2 LEU 44 -15.390 -18.485 -1.703
390 3HD1 LEU 44 3HD2 LEU 44 -16.174 -17.498 -0.467
391 1HD2 LEU 44 1HD1 LEU 44 -12.907 -15.340 -0.450
392 2HD2 LEU 44 2HD1 LEU 44 -13.089 -16.886 0.378
393 3HD2 LEU 44 3HD1 LEU 44 -14.300 -15.622 0.593
394 H ILE 45 H ILE 45 -10.806 -17.315 -3.667
395 HA ILE 45 HA ILE 45 -11.169 -19.379 -5.636
396 HB ILE 45 HB ILE 45 -9.247 -17.126 -5.202
397 1HG1 ILE 45 2HG1 ILE 45 -10.377 -16.240 -7.238
398 2HG1 ILE 45 1HG1 ILE 45 -11.406 -17.668 -7.256
399 1HG2 ILE 45 1HG2 ILE 45 -9.202 -19.233 -7.356
400 2HG2 ILE 45 2HG2 ILE 45 -7.855 -18.624 -6.392
401 3HG2 ILE 45 3HG2 ILE 45 -8.569 -17.612 -7.648
402 1HD1 ILE 45 1HD1 ILE 45 -11.245 -15.802 -4.885
403 2HD1 ILE 45 2HD1 ILE 45 -12.443 -17.057 -5.187
404 3HD1 ILE 45 3HD1 ILE 45 -12.420 -15.601 -6.180
405 H CYS 46 H CYS 46 -9.596 -19.576 -2.680
406 HA CYS 46 HA CYS 46 -7.397 -21.282 -3.638
407 1HB CYS 46 2HB CYS 46 -6.975 -19.637 -1.900
408 2HB CYS 46 1HB CYS 46 -8.249 -20.339 -0.916
409 HG CYS 46 HG CYS 46 -6.260 -22.487 -1.535
410 H ILE 47 H ILE 47 -10.517 -21.547 -2.050
411 HA ILE 47 HA ILE 47 -10.245 -24.210 -1.051
412 HB ILE 47 HB ILE 47 -12.641 -22.584 -1.950
413 1HG1 ILE 47 2HG1 ILE 47 -11.317 -22.924 0.763
414 2HG1 ILE 47 1HG1 ILE 47 -11.261 -21.470 -0.234
415 1HG2 ILE 47 1HG2 ILE 47 -12.445 -24.983 -0.112
416 2HG2 ILE 47 2HG2 ILE 47 -13.163 -24.975 -1.721
417 3HG2 ILE 47 3HG2 ILE 47 -13.906 -24.047 -0.419
418 1HD1 ILE 47 1HD1 ILE 47 -13.842 -21.551 -0.160
419 2HD1 ILE 47 2HD1 ILE 47 -13.004 -21.043 1.306
420 3HD1 ILE 47 3HD1 ILE 47 -13.637 -22.684 1.175
421 H ILE 48 H ILE 48 -10.568 -23.032 -4.271
422 HA ILE 48 HA ILE 48 -11.727 -25.573 -5.237
423 HB ILE 48 HB ILE 48 -12.627 -23.378 -5.990
424 1HG1 ILE 48 2HG1 ILE 48 -12.583 -23.885 -8.407
425 2HG1 ILE 48 1HG1 ILE 48 -11.218 -24.973 -8.154
426 1HG2 ILE 48 1HG2 ILE 48 -10.519 -22.095 -5.920
427 2HG2 ILE 48 2HG2 ILE 48 -11.245 -22.007 -7.523
428 3HG2 ILE 48 3HG2 ILE 48 -9.874 -23.074 -7.236
429 1HD1 ILE 48 1HD1 ILE 48 -13.432 -25.561 -6.347
430 2HD1 ILE 48 2HD1 ILE 48 -12.564 -26.641 -7.439
431 3HD1 ILE 48 3HD1 ILE 48 -13.913 -25.676 -8.041
432 H VAL 49 H VAL 49 -8.774 -23.616 -5.488
433 HA VAL 49 HA VAL 49 -7.495 -25.370 -7.430
434 HB VAL 49 HB VAL 49 -7.005 -22.944 -7.106
435 1HG1 VAL 49 1HG2 VAL 49 -5.966 -22.112 -5.161
436 2HG1 VAL 49 2HG2 VAL 49 -5.481 -23.721 -4.622
437 3HG1 VAL 49 3HG2 VAL 49 -7.170 -23.229 -4.521
438 1HG2 VAL 49 1HG1 VAL 49 -4.373 -23.492 -6.652
439 2HG2 VAL 49 2HG1 VAL 49 -5.177 -23.772 -8.196
440 3HG2 VAL 49 3HG1 VAL 49 -4.976 -25.100 -7.052
441 H MET 50 H MET 50 -7.589 -25.185 -3.901
442 HA MET 50 HA MET 50 -5.375 -26.984 -3.462
443 1HB MET 50 2HB MET 50 -7.678 -26.080 -1.759
444 2HB MET 50 1HB MET 50 -6.276 -26.943 -1.142
445 1HG MET 50 2HG MET 50 -6.198 -24.271 -2.577
446 2HG MET 50 1HG MET 50 -6.037 -24.495 -0.835
447 1HE MET 50 1HE MET 50 -3.733 -23.019 -2.776
448 2HE MET 50 2HE MET 50 -2.471 -23.529 -1.655
449 3HE MET 50 3HE MET 50 -4.057 -23.071 -1.038
450 H LEU 51 H LEU 51 -8.416 -27.590 -4.740
451 HA LEU 51 HA LEU 51 -8.580 -30.304 -3.496
452 1HB LEU 51 2HB LEU 51 -10.559 -28.664 -5.110
453 2HB LEU 51 1HB LEU 51 -10.900 -30.222 -4.358
454 HG LEU 51 HG LEU 51 -10.063 -27.703 -2.892
455 1HD1 LEU 51 1HD1 LEU 51 -12.689 -29.161 -2.641
456 2HD1 LEU 51 2HD1 LEU 51 -12.456 -27.932 -3.885
457 3HD1 LEU 51 3HD1 LEU 51 -12.303 -27.505 -2.182
458 1HD2 LEU 51 1HD2 LEU 51 -10.655 -30.530 -1.999
459 2HD2 LEU 51 2HD2 LEU 51 -10.744 -29.160 -0.892
460 3HD2 LEU 51 3HD2 LEU 51 -9.215 -29.566 -1.673
461 H LEU 52 H LEU 52 -6.972 -29.088 -6.004
462 HA LEU 52 HA LEU 52 -7.874 -31.128 -7.994
463 1HB LEU 52 2HB LEU 52 -6.101 -28.673 -8.219
464 2HB LEU 52 1HB LEU 52 -6.597 -29.696 -9.568
465 HG LEU 52 HG LEU 52 -8.465 -28.144 -7.753
466 1HD1 LEU 52 1HD1 LEU 52 -6.957 -27.337 -10.017
467 2HD1 LEU 52 2HD1 LEU 52 -8.236 -26.437 -9.201
468 3HD1 LEU 52 3HD1 LEU 52 -8.629 -27.501 -10.551
469 1HD2 LEU 52 1HD2 LEU 52 -9.952 -28.886 -9.885
470 2HD2 LEU 52 2HD2 LEU 52 -9.847 -29.850 -8.412
471 3HD2 LEU 52 3HD2 LEU 52 -8.847 -30.259 -9.807