Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
20135 | 2f3w RC | 6908 | cing | 1-original | 5 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 1H ALA 1 1HT ALA 1 12.211 23.584 -18.411
2 2H ALA 1 2HT ALA 1 13.382 22.546 -17.705
3 3H ALA 1 3HT ALA 1 11.796 21.968 -18.014
4 HA ALA 1 HA ALA 1 12.290 22.575 -20.409
5 1HB ALA 1 1HB ALA 1 14.623 22.449 -21.022
6 2HB ALA 1 2HB ALA 1 15.087 22.245 -19.333
7 3HB ALA 1 3HB ALA 1 14.381 23.768 -19.877
8 H THR 2 H THR 2 14.448 20.497 -18.472
9 HA THR 2 HA THR 2 13.010 18.153 -19.496
10 HB THR 2 HB THR 2 14.888 18.292 -20.956
11 HG1 THR 2 1HG THR 2 15.739 16.348 -20.580
12 1HG2 THR 2 1HG2 THR 2 16.701 18.493 -18.568
13 2HG2 THR 2 2HG2 THR 2 16.263 19.844 -19.614
14 3HG2 THR 2 3HG2 THR 2 17.171 18.480 -20.268
15 H SER 3 H SER 3 12.643 16.622 -18.007
16 HA SER 3 HA SER 3 13.834 17.010 -15.352
17 1HB SER 3 2HB SER 3 11.209 15.981 -16.315
18 2HB SER 3 1HB SER 3 11.859 15.292 -14.827
19 HG SER 3 HG SER 3 12.014 17.430 -14.010
20 H THR 4 H THR 4 14.573 15.205 -14.146
21 HA THR 4 HA THR 4 15.649 13.082 -15.844
22 HB THR 4 HB THR 4 16.794 12.624 -13.446
23 HG1 THR 4 1HG THR 4 16.438 15.432 -13.500
24 1HG2 THR 4 1HG2 THR 4 17.726 13.485 -15.804
25 2HG2 THR 4 2HG2 THR 4 18.707 13.385 -14.341
26 3HG2 THR 4 3HG2 THR 4 17.999 14.926 -14.824
27 H LYS 5 H LYS 5 14.969 11.031 -15.752
28 HA LYS 5 HA LYS 5 13.141 10.286 -13.563
29 1HB LYS 5 2HB LYS 5 12.892 10.022 -16.485
30 2HB LYS 5 1HB LYS 5 12.475 8.572 -15.582
31 1HG LYS 5 2HG LYS 5 10.702 9.595 -14.502
32 2HG LYS 5 1HG LYS 5 11.329 11.217 -14.798
33 1HD LYS 5 2HD LYS 5 10.540 11.278 -16.952
34 2HD LYS 5 1HD LYS 5 10.608 9.525 -17.139
35 1HE LYS 5 2HE LYS 5 8.750 9.735 -15.194
36 2HE LYS 5 1HE LYS 5 8.465 11.240 -16.065
37 1HZ LYS 5 1HZ LYS 5 8.321 9.879 -18.125
38 2HZ LYS 5 2HZ LYS 5 7.087 9.575 -17.011
39 3HZ LYS 5 3HZ LYS 5 8.373 8.487 -17.164
40 H LYS 6 H LYS 6 14.438 9.142 -12.232
41 HA LYS 6 HA LYS 6 15.776 6.786 -13.386
42 1HB LYS 6 2HB LYS 6 17.454 7.077 -11.476
43 2HB LYS 6 1HB LYS 6 17.582 8.185 -12.834
44 1HG LYS 6 2HG LYS 6 16.242 9.827 -11.489
45 2HG LYS 6 1HG LYS 6 16.427 8.735 -10.115
46 1HD LYS 6 2HD LYS 6 18.736 9.059 -10.016
47 2HD LYS 6 1HD LYS 6 18.812 9.683 -11.665
48 1HE LYS 6 2HE LYS 6 17.159 11.491 -10.507
49 2HE LYS 6 1HE LYS 6 18.189 11.060 -9.142
50 1HZ LYS 6 1HZ LYS 6 20.128 11.570 -10.532
51 2HZ LYS 6 2HZ LYS 6 19.125 12.916 -10.325
52 3HZ LYS 6 3HZ LYS 6 19.101 12.062 -11.784
53 H LEU 7 H LEU 7 15.583 4.884 -12.265
54 HA LEU 7 HA LEU 7 13.946 4.967 -9.816
55 1HB LEU 7 2HB LEU 7 13.860 2.750 -11.851
56 2HB LEU 7 1HB LEU 7 12.770 3.017 -10.504
57 HG LEU 7 HG LEU 7 12.976 4.736 -12.977
58 1HD1 LEU 7 1HD1 LEU 7 11.256 2.470 -12.177
59 2HD1 LEU 7 2HD1 LEU 7 11.775 2.995 -13.779
60 3HD1 LEU 7 3HD1 LEU 7 10.461 3.837 -12.958
61 1HD2 LEU 7 1HD2 LEU 7 10.913 4.936 -10.804
62 2HD2 LEU 7 2HD2 LEU 7 11.254 6.073 -12.108
63 3HD2 LEU 7 3HD2 LEU 7 12.399 5.886 -10.780
64 H HIS 8 H HIS 8 14.984 4.201 -8.110
65 HA HIS 8 HA HIS 8 17.162 2.268 -8.529
66 1HB HIS 8 2HB HIS 8 17.673 4.523 -7.460
67 2HB HIS 8 1HB HIS 8 16.743 3.969 -6.071
68 HD1 HIS 8 1HD HIS 8 17.700 1.326 -5.377
69 HD2 HIS 8 2HD HIS 8 20.293 4.150 -6.979
70 HE1 HIS 8 1HE HIS 8 20.005 0.580 -4.703
71 HE2 HIS 8 2HE HIS 8 21.549 2.356 -5.603
72 H LYS 9 H LYS 9 16.793 0.248 -7.923
73 HA LYS 9 HA LYS 9 14.438 -0.433 -6.420
74 1HB LYS 9 2HB LYS 9 16.627 -2.010 -7.736
75 2HB LYS 9 1HB LYS 9 15.477 -2.798 -6.664
76 1HG LYS 9 2HG LYS 9 13.674 -2.357 -8.080
77 2HG LYS 9 1HG LYS 9 14.562 -1.118 -8.970
78 1HD LYS 9 2HD LYS 9 14.623 -2.901 -10.441
79 2HD LYS 9 1HD LYS 9 16.155 -3.081 -9.586
80 1HE LYS 9 2HE LYS 9 14.368 -4.495 -8.024
81 2HE LYS 9 1HE LYS 9 13.844 -4.845 -9.671
82 1HZ LYS 9 1HZ LYS 9 16.275 -5.624 -8.295
83 2HZ LYS 9 2HZ LYS 9 16.481 -5.145 -9.903
84 3HZ LYS 9 3HZ LYS 9 15.427 -6.414 -9.528
85 H GLU 10 H GLU 10 14.399 -0.217 -4.290
86 HA GLU 10 HA GLU 10 16.719 -1.164 -2.746
87 1HB GLU 10 2HB GLU 10 16.137 1.441 -2.887
88 2HB GLU 10 1HB GLU 10 15.023 0.996 -1.602
89 1HG GLU 10 2HG GLU 10 16.730 1.323 -0.221
90 2HG GLU 10 1HG GLU 10 17.356 -0.212 -0.820
91 HA PRO 11 HA PRO 11 13.756 -3.971 -0.970
92 1HB PRO 11 2HB PRO 11 15.555 -3.801 1.396
93 2HB PRO 11 1HB PRO 11 14.971 -5.223 0.525
94 1HG PRO 11 2HG PRO 11 17.478 -4.381 0.222
95 2HG PRO 11 1HG PRO 11 16.555 -5.009 -1.155
96 1HD PRO 11 2HD PRO 11 17.223 -2.185 -0.447
97 2HD PRO 11 1HD PRO 11 17.126 -2.958 -2.044
98 H ALA 12 H ALA 12 11.868 -3.288 -0.229
99 HA ALA 12 HA ALA 12 11.748 -1.805 2.278
100 1HB ALA 12 1HB ALA 12 11.748 -0.150 0.375
101 2HB ALA 12 2HB ALA 12 10.361 -0.063 1.461
102 3HB ALA 12 3HB ALA 12 10.200 -0.837 -0.115
103 H THR 13 H THR 13 10.594 -3.205 3.466
104 HA THR 13 HA THR 13 8.082 -4.224 2.309
105 HB THR 13 HB THR 13 9.481 -6.122 2.432
106 HG1 THR 13 1HG THR 13 8.352 -7.366 3.801
107 1HG2 THR 13 1HG2 THR 13 10.233 -5.353 5.241
108 2HG2 THR 13 2HG2 THR 13 11.270 -5.202 3.822
109 3HG2 THR 13 3HG2 THR 13 10.754 -6.796 4.373
110 H LEU 14 H LEU 14 6.279 -4.190 3.591
111 HA LEU 14 HA LEU 14 6.203 -2.324 5.719
112 1HB LEU 14 2HB LEU 14 4.210 -4.327 4.679
113 2HB LEU 14 1HB LEU 14 3.854 -3.272 6.033
114 HG LEU 14 HG LEU 14 4.704 -1.471 4.168
115 1HD1 LEU 14 1HD1 LEU 14 4.741 -3.467 2.553
116 2HD1 LEU 14 2HD1 LEU 14 3.930 -1.989 2.035
117 3HD1 LEU 14 3HD1 LEU 14 2.981 -3.361 2.608
118 1HD2 LEU 14 1HD2 LEU 14 2.141 -2.396 5.243
119 2HD2 LEU 14 2HD2 LEU 14 2.021 -1.531 3.712
120 3HD2 LEU 14 3HD2 LEU 14 2.791 -0.763 5.099
121 H ILE 15 H ILE 15 5.972 -2.614 7.925
122 HA ILE 15 HA ILE 15 7.022 -5.117 8.957
123 HB ILE 15 HB ILE 15 6.961 -3.920 11.166
124 1HG1 ILE 15 2HG1 ILE 15 6.660 -1.317 9.792
125 2HG1 ILE 15 1HG1 ILE 15 5.180 -2.251 9.986
126 1HG2 ILE 15 1HG2 ILE 15 8.489 -2.129 9.390
127 2HG2 ILE 15 2HG2 ILE 15 8.804 -3.855 9.215
128 3HG2 ILE 15 3HG2 ILE 15 9.018 -3.075 10.781
129 1HD1 ILE 15 1HD1 ILE 15 5.580 -2.368 12.395
130 2HD1 ILE 15 2HD1 ILE 15 5.476 -0.703 11.822
131 3HD1 ILE 15 3HD1 ILE 15 7.048 -1.413 12.191
132 H LYS 16 H LYS 16 4.012 -3.378 8.817
133 HA LYS 16 HA LYS 16 2.509 -5.663 9.589
134 1HB LYS 16 2HB LYS 16 3.317 -4.832 11.816
135 2HB LYS 16 1HB LYS 16 2.431 -3.341 11.521
136 1HG LYS 16 2HG LYS 16 0.528 -5.274 11.093
137 2HG LYS 16 1HG LYS 16 1.479 -5.938 12.423
138 1HD LYS 16 2HD LYS 16 1.074 -4.045 13.783
139 2HD LYS 16 1HD LYS 16 0.444 -3.112 12.423
140 1HE LYS 16 2HE LYS 16 -1.582 -3.739 13.117
141 2HE LYS 16 1HE LYS 16 -1.186 -5.333 12.477
142 1HZ LYS 16 1HZ LYS 16 -1.646 -5.957 14.572
143 2HZ LYS 16 2HZ LYS 16 -1.342 -4.428 15.229
144 3HZ LYS 16 3HZ LYS 16 -0.056 -5.468 14.880
145 H ALA 17 H ALA 17 1.374 -5.308 7.710
146 HA ALA 17 HA ALA 17 0.007 -2.738 7.388
147 1HB ALA 17 1HB ALA 17 1.281 -4.381 5.574
148 2HB ALA 17 2HB ALA 17 0.202 -3.040 5.188
149 3HB ALA 17 3HB ALA 17 -0.430 -4.683 5.274
150 H ILE 18 H ILE 18 -1.962 -2.556 8.203
151 HA ILE 18 HA ILE 18 -3.552 -4.875 8.846
152 HB ILE 18 HB ILE 18 -4.364 -1.972 9.030
153 1HG1 ILE 18 2HG1 ILE 18 -3.362 -3.564 11.363
154 2HG1 ILE 18 1HG1 ILE 18 -2.204 -2.800 10.280
155 1HG2 ILE 18 1HG2 ILE 18 -5.382 -3.990 10.920
156 2HG2 ILE 18 2HG2 ILE 18 -5.940 -4.143 9.254
157 3HG2 ILE 18 3HG2 ILE 18 -6.209 -2.642 10.140
158 1HD1 ILE 18 1HD1 ILE 18 -2.790 -0.689 10.923
159 2HD1 ILE 18 2HD1 ILE 18 -3.063 -1.576 12.423
160 3HD1 ILE 18 3HD1 ILE 18 -4.425 -1.163 11.382
161 H ASP 19 H ASP 19 -3.476 -2.397 6.385
162 HA ASP 19 HA ASP 19 -4.528 -2.204 4.379
163 1HB ASP 19 2HB ASP 19 -5.670 -4.947 4.945
164 2HB ASP 19 1HB ASP 19 -5.595 -4.143 3.381
165 H GLY 20 H GLY 20 -6.857 -4.040 6.373
166 1HA GLY 20 2HA GLY 20 -9.144 -2.731 5.490
167 2HA GLY 20 1HA GLY 20 -8.991 -3.530 7.047
168 H ASP 21 H ASP 21 -6.719 -1.621 7.697
169 HA ASP 21 HA ASP 21 -8.387 0.735 8.288
170 1HB ASP 21 2HB ASP 21 -6.357 -0.652 10.044
171 2HB ASP 21 1HB ASP 21 -7.008 0.946 10.396
172 H THR 22 H THR 22 -4.942 0.060 8.830
173 HA THR 22 HA THR 22 -4.205 2.018 6.799
174 HB THR 22 HB THR 22 -3.003 2.322 9.529
175 HG1 THR 22 1HG THR 22 -4.737 3.205 10.275
176 1HG2 THR 22 1HG2 THR 22 -2.820 4.687 8.807
177 2HG2 THR 22 2HG2 THR 22 -3.429 4.203 7.224
178 3HG2 THR 22 3HG2 THR 22 -1.899 3.557 7.815
179 H VAL 23 H VAL 23 -1.894 2.026 6.333
180 HA VAL 23 HA VAL 23 -0.473 -0.373 7.258
181 HB VAL 23 HB VAL 23 0.372 -0.723 4.934
182 1HG1 VAL 23 1HG1 VAL 23 -1.477 -2.052 5.922
183 2HG1 VAL 23 2HG1 VAL 23 -1.563 -1.923 4.164
184 3HG1 VAL 23 3HG1 VAL 23 -2.624 -0.940 5.174
185 1HG2 VAL 23 1HG2 VAL 23 -0.013 1.415 3.951
186 2HG2 VAL 23 2HG2 VAL 23 -1.740 1.326 4.294
187 3HG2 VAL 23 3HG2 VAL 23 -1.022 0.249 3.096
188 H LYS 24 H LYS 24 1.785 -0.229 7.262
189 HA LYS 24 HA LYS 24 2.926 2.396 6.600
190 1HB LYS 24 2HB LYS 24 2.414 1.726 9.164
191 2HB LYS 24 1HB LYS 24 4.021 1.035 8.990
192 1HG LYS 24 2HG LYS 24 4.907 3.032 9.320
193 2HG LYS 24 1HG LYS 24 4.098 3.627 7.869
194 1HD LYS 24 2HD LYS 24 2.031 3.767 9.512
195 2HD LYS 24 1HD LYS 24 3.307 3.869 10.727
196 1HE LYS 24 2HE LYS 24 4.104 5.612 8.705
197 2HE LYS 24 1HE LYS 24 2.366 5.869 8.861
198 1HZ LYS 24 1HZ LYS 24 4.279 5.931 11.131
199 2HZ LYS 24 2HZ LYS 24 2.633 6.315 11.185
200 3HZ LYS 24 3HZ LYS 24 3.704 7.304 10.327
201 H LEU 25 H LEU 25 4.814 2.320 5.538
202 HA LEU 25 HA LEU 25 6.004 -0.317 5.079
203 1HB LEU 25 2HB LEU 25 5.901 2.235 3.554
204 2HB LEU 25 1HB LEU 25 7.315 1.217 3.339
205 HG LEU 25 HG LEU 25 4.557 0.083 3.011
206 1HD1 LEU 25 1HD1 LEU 25 5.739 2.136 1.397
207 2HD1 LEU 25 2HD1 LEU 25 4.174 1.343 1.227
208 3HD1 LEU 25 3HD1 LEU 25 5.603 0.643 0.468
209 1HD2 LEU 25 1HD2 LEU 25 7.268 -0.622 1.892
210 2HD2 LEU 25 2HD2 LEU 25 5.762 -1.453 1.507
211 3HD2 LEU 25 3HD2 LEU 25 6.393 -1.491 3.153
212 H MET 26 H MET 26 8.367 -0.473 4.959
213 HA MET 26 HA MET 26 9.653 1.278 6.948
214 1HB MET 26 2HB MET 26 9.373 -1.146 7.566
215 2HB MET 26 1HB MET 26 10.452 -1.547 6.237
216 1HG MET 26 2HG MET 26 12.272 -0.424 7.269
217 2HG MET 26 1HG MET 26 11.219 0.284 8.492
218 1HE MET 26 1HE MET 26 12.953 -1.799 10.967
219 2HE MET 26 2HE MET 26 11.382 -1.008 11.095
220 3HE MET 26 3HE MET 26 12.691 -0.233 10.201
221 H TYR 27 H TYR 27 10.520 2.814 5.599
222 HA TYR 27 HA TYR 27 12.523 1.845 3.668
223 1HB TYR 27 2HB TYR 27 10.594 2.869 2.529
224 2HB TYR 27 1HB TYR 27 10.834 4.347 3.454
225 HD1 TYR 27 1HD TYR 27 13.260 2.134 1.674
226 HD2 TYR 27 2HD TYR 27 11.503 5.996 1.976
227 HE1 TYR 27 1HE TYR 27 14.796 2.962 -0.058
228 HE2 TYR 27 2HE TYR 27 13.032 6.835 0.243
229 HH TYR 27 HH TYR 27 14.360 5.834 -1.683
230 H LYS 28 H LYS 28 14.458 2.155 4.553
231 HA LYS 28 HA LYS 28 16.217 3.108 5.638
232 1HB LYS 28 2HB LYS 28 15.010 5.754 4.847
233 2HB LYS 28 1HB LYS 28 16.709 5.373 5.093
234 1HG LYS 28 2HG LYS 28 15.665 3.650 3.076
235 2HG LYS 28 1HG LYS 28 15.229 5.316 2.692
236 1HD LYS 28 2HD LYS 28 17.396 5.960 2.400
237 2HD LYS 28 1HD LYS 28 18.013 4.804 3.580
238 1HE LYS 28 2HE LYS 28 18.742 3.711 1.750
239 2HE LYS 28 1HE LYS 28 17.083 3.121 1.686
240 1HZ LYS 28 1HZ LYS 28 17.424 3.899 -0.438
241 2HZ LYS 28 2HZ LYS 28 18.366 5.212 0.062
242 3HZ LYS 28 3HZ LYS 28 16.691 5.239 0.290
243 H GLY 29 H GLY 29 13.741 2.654 7.161
244 1HA GLY 29 2HA GLY 29 13.318 2.881 9.440
245 2HA GLY 29 1HA GLY 29 14.494 4.185 9.502
246 H GLN 30 H GLN 30 12.616 5.009 6.978
247 HA GLN 30 HA GLN 30 11.113 6.899 8.575
248 1HB GLN 30 2HB GLN 30 12.321 7.549 6.480
249 2HB GLN 30 1HB GLN 30 11.164 6.587 5.571
250 1HG GLN 30 2HG GLN 30 10.466 8.841 5.432
251 2HG GLN 30 1HG GLN 30 9.351 8.018 6.522
252 1HE2 GLN 30 1HE2 GLN 30 9.555 10.748 6.510
253 2HE2 GLN 30 2HE2 GLN 30 10.279 11.285 7.984
254 HA PRO 31 HA PRO 31 7.464 4.325 8.424
255 1HB PRO 31 2HB PRO 31 5.786 5.973 9.728
256 2HB PRO 31 1HB PRO 31 7.087 5.113 10.562
257 1HG PRO 31 2HG PRO 31 6.990 7.953 9.624
258 2HG PRO 31 1HG PRO 31 7.603 7.301 11.154
259 1HD PRO 31 2HD PRO 31 9.209 7.976 9.048
260 2HD PRO 31 1HD PRO 31 9.628 6.731 10.241
261 H MET 32 H MET 32 7.355 4.588 6.060
262 HA MET 32 HA MET 32 5.690 6.765 5.079
263 1HB MET 32 2HB MET 32 7.786 5.637 3.927
264 2HB MET 32 1HB MET 32 6.578 4.500 3.345
265 1HG MET 32 2HG MET 32 5.808 5.932 1.833
266 2HG MET 32 1HG MET 32 5.751 7.256 2.995
267 1HE MET 32 1HE MET 32 7.696 7.914 -0.473
268 2HE MET 32 2HE MET 32 6.899 9.062 0.602
269 3HE MET 32 3HE MET 32 6.099 7.549 0.178
270 H THR 33 H THR 33 3.560 6.565 5.311
271 HA THR 33 HA THR 33 2.327 3.944 5.444
272 HB THR 33 HB THR 33 1.625 5.699 7.009
273 HG1 THR 33 1HG THR 33 -0.420 5.041 5.160
274 1HG2 THR 33 1HG2 THR 33 0.521 7.140 4.611
275 2HG2 THR 33 2HG2 THR 33 1.910 7.658 5.568
276 3HG2 THR 33 3HG2 THR 33 0.308 7.591 6.303
277 H PHE 34 H PHE 34 0.532 3.320 4.128
278 HA PHE 34 HA PHE 34 0.493 4.615 1.483
279 1HB PHE 34 2HB PHE 34 1.688 2.394 1.535
280 2HB PHE 34 1HB PHE 34 0.152 1.653 1.969
281 HD1 PHE 34 1HD PHE 34 -1.784 1.866 0.369
282 HD2 PHE 34 2HD PHE 34 2.214 2.860 -0.694
283 HE1 PHE 34 1HE PHE 34 -2.380 1.695 -2.012
284 HE2 PHE 34 2HE PHE 34 1.626 2.692 -3.078
285 HZ PHE 34 HZ PHE 34 -0.673 2.109 -3.739
286 H ARG 35 H ARG 35 -1.371 5.763 1.702
287 HA ARG 35 HA ARG 35 -3.610 6.164 1.647
288 1HB ARG 35 2HB ARG 35 -3.411 3.838 0.335
289 2HB ARG 35 1HB ARG 35 -4.345 3.285 1.718
290 1HG ARG 35 2HG ARG 35 -6.122 3.911 0.527
291 2HG ARG 35 1HG ARG 35 -5.686 5.552 1.010
292 1HD ARG 35 2HD ARG 35 -4.847 4.152 -1.527
293 2HD ARG 35 1HD ARG 35 -6.055 5.428 -1.393
294 HE ARG 35 HE ARG 35 -3.197 5.738 -1.413
295 1HH1 ARG 35 1HH1 ARG 35 -6.226 7.172 -0.437
296 2HH1 ARG 35 2HH1 ARG 35 -5.593 8.783 -0.395
297 1HH2 ARG 35 1HH2 ARG 35 -2.363 7.856 -1.357
298 2HH2 ARG 35 2HH2 ARG 35 -3.400 9.172 -0.919
299 H LEU 36 H LEU 36 -4.682 6.875 3.355
300 HA LEU 36 HA LEU 36 -4.767 5.183 5.767
301 1HB LEU 36 2HB LEU 36 -4.719 8.190 5.519
302 2HB LEU 36 1HB LEU 36 -5.005 7.334 7.023
303 HG LEU 36 HG LEU 36 -2.741 6.252 6.714
304 1HD1 LEU 36 1HD1 LEU 36 -2.848 7.956 4.319
305 2HD1 LEU 36 2HD1 LEU 36 -1.947 6.470 4.621
306 3HD1 LEU 36 3HD1 LEU 36 -1.336 8.010 5.225
307 1HD2 LEU 36 1HD2 LEU 36 -3.023 9.223 7.095
308 2HD2 LEU 36 2HD2 LEU 36 -1.516 8.352 7.384
309 3HD2 LEU 36 3HD2 LEU 36 -2.953 7.967 8.332
310 H LEU 37 H LEU 37 -6.651 5.877 7.256
311 HA LEU 37 HA LEU 37 -9.054 5.220 6.040
312 1HB LEU 37 2HB LEU 37 -8.170 6.073 8.663
313 2HB LEU 37 1HB LEU 37 -9.752 6.729 8.287
314 HG LEU 37 HG LEU 37 -10.450 4.351 7.705
315 1HD1 LEU 37 1HD1 LEU 37 -8.985 2.711 9.129
316 2HD1 LEU 37 2HD1 LEU 37 -7.716 3.891 8.796
317 3HD1 LEU 37 3HD1 LEU 37 -8.550 3.092 7.462
318 1HD2 LEU 37 1HD2 LEU 37 -11.165 5.465 9.742
319 2HD2 LEU 37 2HD2 LEU 37 -9.663 5.004 10.543
320 3HD2 LEU 37 3HD2 LEU 37 -10.820 3.765 10.058
321 H LEU 38 H LEU 38 -9.761 6.377 4.331
322 HA LEU 38 HA LEU 38 -9.569 9.167 4.043
323 1HB LEU 38 2HB LEU 38 -10.336 7.054 2.448
324 2HB LEU 38 1HB LEU 38 -11.834 7.940 2.658
325 HG LEU 38 HG LEU 38 -10.724 9.985 1.824
326 1HD1 LEU 38 1HD1 LEU 38 -8.485 9.932 2.140
327 2HD1 LEU 38 2HD1 LEU 38 -8.509 9.276 0.503
328 3HD1 LEU 38 3HD1 LEU 38 -8.377 8.191 1.887
329 1HD2 LEU 38 1HD2 LEU 38 -11.890 8.988 0.122
330 2HD2 LEU 38 2HD2 LEU 38 -10.941 7.502 0.194
331 3HD2 LEU 38 3HD2 LEU 38 -10.259 8.950 -0.548
332 H VAL 39 H VAL 39 -12.013 10.136 3.342
333 HA VAL 39 HA VAL 39 -13.132 10.831 5.852
334 HB VAL 39 HB VAL 39 -14.397 11.263 3.145
335 1HG1 VAL 39 1HG1 VAL 39 -14.653 12.740 5.763
336 2HG1 VAL 39 2HG1 VAL 39 -15.877 11.715 5.012
337 3HG1 VAL 39 3HG1 VAL 39 -15.397 13.227 4.240
338 1HG2 VAL 39 1HG2 VAL 39 -12.035 12.506 4.406
339 2HG2 VAL 39 2HG2 VAL 39 -13.200 13.611 3.675
340 3HG2 VAL 39 3HG2 VAL 39 -12.459 12.341 2.702
341 H ASP 40 H ASP 40 -15.277 10.461 6.614
342 HA ASP 40 HA ASP 40 -16.138 7.751 6.249
343 1HB ASP 40 2HB ASP 40 -16.216 8.932 8.444
344 2HB ASP 40 1HB ASP 40 -17.486 9.970 7.803
345 H THR 41 H THR 41 -17.482 7.049 4.737
346 HA THR 41 HA THR 41 -19.168 8.980 3.324
347 HB THR 41 HB THR 41 -19.483 6.706 1.909
348 HG1 THR 41 1HG THR 41 -16.843 6.537 2.918
349 1HG2 THR 41 1HG2 THR 41 -18.726 8.355 0.575
350 2HG2 THR 41 2HG2 THR 41 -17.211 7.470 0.756
351 3HG2 THR 41 3HG2 THR 41 -17.520 8.900 1.740
352 HA PRO 42 HA PRO 42 -22.523 7.280 5.832
353 1HB PRO 42 2HB PRO 42 -24.429 8.998 4.922
354 2HB PRO 42 1HB PRO 42 -23.257 9.427 6.173
355 1HG PRO 42 2HG PRO 42 -23.215 10.049 3.245
356 2HG PRO 42 1HG PRO 42 -22.822 11.101 4.619
357 1HD PRO 42 2HD PRO 42 -20.915 9.907 3.128
358 2HD PRO 42 1HD PRO 42 -20.711 10.201 4.867
359 H GLU 43 H GLU 43 -22.449 7.780 2.370
360 HA GLU 43 HA GLU 43 -24.519 5.706 2.058
361 1HB GLU 43 2HB GLU 43 -25.030 6.688 -0.127
362 2HB GLU 43 1HB GLU 43 -25.233 7.868 1.160
363 1HG GLU 43 2HG GLU 43 -23.068 8.849 0.610
364 2HG GLU 43 1HG GLU 43 -22.855 7.659 -0.673
365 H THR 44 H THR 44 -21.982 4.852 2.545
366 HA THR 44 HA THR 44 -21.411 3.358 0.166
367 HB THR 44 HB THR 44 -19.057 4.907 1.165
368 HG1 THR 44 1HG THR 44 -20.813 5.859 -0.842
369 1HG2 THR 44 1HG2 THR 44 -18.878 3.027 -0.510
370 2HG2 THR 44 2HG2 THR 44 -18.152 4.567 -0.969
371 3HG2 THR 44 3HG2 THR 44 -19.711 4.090 -1.642
372 H LYS 45 H LYS 45 -20.219 4.362 3.352
373 HA LYS 45 HA LYS 45 -18.632 2.133 3.905
374 1HB LYS 45 2HB LYS 45 -19.176 4.431 5.212
375 2HB LYS 45 1HB LYS 45 -20.133 3.310 6.170
376 1HG LYS 45 2HG LYS 45 -18.048 1.902 6.377
377 2HG LYS 45 1HG LYS 45 -17.170 3.268 5.685
378 1HD LYS 45 2HD LYS 45 -17.890 4.694 7.506
379 2HD LYS 45 1HD LYS 45 -18.873 3.388 8.173
380 1HE LYS 45 2HE LYS 45 -16.454 2.180 8.013
381 2HE LYS 45 1HE LYS 45 -15.969 3.846 8.323
382 1HZ LYS 45 1HZ LYS 45 -16.256 3.168 10.444
383 2HZ LYS 45 2HZ LYS 45 -17.383 1.971 10.048
384 3HZ LYS 45 3HZ LYS 45 -17.866 3.590 10.137
385 H HIS 46 H HIS 46 -19.526 0.181 3.385
386 HA HIS 46 HA HIS 46 -22.019 -0.567 4.755
387 1HB HIS 46 2HB HIS 46 -20.977 -1.088 2.095
388 2HB HIS 46 1HB HIS 46 -21.408 -2.582 2.920
389 HD1 HIS 46 1HD HIS 46 -23.895 -3.024 3.351
390 HD2 HIS 46 2HD HIS 46 -23.140 0.638 1.535
391 HE1 HIS 46 1HE HIS 46 -26.136 -2.177 2.587
392 HE2 HIS 46 2HE HIS 46 -25.643 -0.002 1.416
393 HA PRO 47 HA PRO 47 -19.730 -3.321 7.343
394 1HB PRO 47 2HB PRO 47 -21.666 -5.085 8.019
395 2HB PRO 47 1HB PRO 47 -21.631 -3.430 8.637
396 1HG PRO 47 2HG PRO 47 -23.245 -4.580 6.394
397 2HG PRO 47 1HG PRO 47 -23.747 -3.460 7.674
398 1HD PRO 47 2HD PRO 47 -23.131 -2.646 5.156
399 2HD PRO 47 1HD PRO 47 -22.873 -1.629 6.588
400 H LYS 48 H LYS 48 -21.638 -4.674 4.703
401 HA LYS 48 HA LYS 48 -20.534 -7.273 4.757
402 1HB LYS 48 2HB LYS 48 -21.893 -5.673 2.594
403 2HB LYS 48 1HB LYS 48 -21.326 -7.316 2.326
404 1HG LYS 48 2HG LYS 48 -23.309 -6.496 4.439
405 2HG LYS 48 1HG LYS 48 -23.718 -7.205 2.875
406 1HD LYS 48 2HD LYS 48 -23.569 -9.196 3.872
407 2HD LYS 48 1HD LYS 48 -21.824 -8.937 3.923
408 1HE LYS 48 2HE LYS 48 -21.874 -8.208 6.132
409 2HE LYS 48 1HE LYS 48 -23.597 -7.837 6.072
410 1HZ LYS 48 1HZ LYS 48 -22.683 -9.990 7.248
411 2HZ LYS 48 2HZ LYS 48 -22.791 -10.621 5.682
412 3HZ LYS 48 3HZ LYS 48 -24.168 -9.990 6.436
413 H LYS 49 H LYS 49 -19.821 -4.518 2.605
414 HA LYS 49 HA LYS 49 -17.438 -5.823 1.615
415 1HB LYS 49 2HB LYS 49 -18.283 -2.978 1.089
416 2HB LYS 49 1HB LYS 49 -17.254 -4.000 0.096
417 1HG LYS 49 2HG LYS 49 -19.004 -4.721 -1.050
418 2HG LYS 49 1HG LYS 49 -19.801 -5.259 0.429
419 1HD LYS 49 2HD LYS 49 -21.337 -3.702 -0.078
420 2HD LYS 49 1HD LYS 49 -20.155 -2.558 0.559
421 1HE LYS 49 2HE LYS 49 -19.442 -1.921 -1.556
422 2HE LYS 49 1HE LYS 49 -20.056 -3.391 -2.312
423 1HZ LYS 49 1HZ LYS 49 -21.784 -1.269 -1.162
424 2HZ LYS 49 2HZ LYS 49 -22.284 -2.607 -2.066
425 3HZ LYS 49 3HZ LYS 49 -21.383 -1.379 -2.802
426 H GLY 50 H GLY 50 -18.283 -3.241 3.814
427 1HA GLY 50 2HA GLY 50 -17.053 -2.282 5.508
428 2HA GLY 50 1HA GLY 50 -15.749 -3.393 5.127
429 H VAL 51 H VAL 51 -15.044 -2.721 2.559
430 HA VAL 51 HA VAL 51 -14.512 0.158 2.722
431 HB VAL 51 HB VAL 51 -12.226 -0.088 2.068
432 1HG1 VAL 51 1HG1 VAL 51 -11.363 -0.856 4.061
433 2HG1 VAL 51 2HG1 VAL 51 -12.512 -2.191 4.161
434 3HG1 VAL 51 3HG1 VAL 51 -13.046 -0.541 4.486
435 1HG2 VAL 51 1HG2 VAL 51 -12.153 -1.912 0.584
436 2HG2 VAL 51 2HG2 VAL 51 -12.857 -3.014 1.771
437 3HG2 VAL 51 3HG2 VAL 51 -11.210 -2.423 1.982
438 H GLU 52 H GLU 52 -13.962 -2.532 0.406
439 HA GLU 52 HA GLU 52 -15.109 -0.788 -1.659
440 1HB GLU 52 2HB GLU 52 -12.738 -2.600 -1.712
441 2HB GLU 52 1HB GLU 52 -13.654 -2.347 -3.192
442 1HG GLU 52 2HG GLU 52 -13.100 0.153 -1.867
443 2HG GLU 52 1HG GLU 52 -11.621 -0.750 -2.184
444 H LYS 53 H LYS 53 -14.342 -4.259 -1.283
445 HA LYS 53 HA LYS 53 -17.056 -4.831 -2.307
446 1HB LYS 53 2HB LYS 53 -14.410 -6.057 -2.928
447 2HB LYS 53 1HB LYS 53 -15.856 -7.049 -3.037
448 1HG LYS 53 2HG LYS 53 -16.239 -4.523 -4.370
449 2HG LYS 53 1HG LYS 53 -14.814 -5.361 -4.988
450 1HD LYS 53 2HD LYS 53 -16.036 -7.006 -5.931
451 2HD LYS 53 1HD LYS 53 -17.189 -7.052 -4.596
452 1HE LYS 53 2HE LYS 53 -18.372 -5.169 -5.454
453 2HE LYS 53 1HE LYS 53 -17.119 -4.855 -6.654
454 1HZ LYS 53 1HZ LYS 53 -18.498 -5.995 -7.984
455 2HZ LYS 53 2HZ LYS 53 -19.292 -6.768 -6.708
456 3HZ LYS 53 3HZ LYS 53 -17.809 -7.362 -7.263
457 H TYR 54 H TYR 54 -14.426 -6.344 -0.408
458 HA TYR 54 HA TYR 54 -16.529 -7.571 1.255
459 1HB TYR 54 2HB TYR 54 -14.398 -8.830 -0.237
460 2HB TYR 54 1HB TYR 54 -14.258 -9.197 1.480
461 HD1 TYR 54 1HD TYR 54 -16.452 -9.463 -1.475
462 HD2 TYR 54 2HD TYR 54 -15.819 -10.639 2.566
463 HE1 TYR 54 1HE TYR 54 -18.207 -11.170 -1.702
464 HE2 TYR 54 2HE TYR 54 -17.572 -12.350 2.348
465 HH TYR 54 HH TYR 54 -18.823 -13.336 -0.608
466 H GLY 55 H GLY 55 -13.487 -5.891 1.164
467 1HA GLY 55 2HA GLY 55 -12.619 -4.599 2.912
468 2HA GLY 55 1HA GLY 55 -13.701 -5.418 4.025
469 HA PRO 56 HA PRO 56 -10.165 -7.431 5.816
470 1HB PRO 56 2HB PRO 56 -12.107 -9.705 5.952
471 2HB PRO 56 1HB PRO 56 -11.014 -9.087 7.197
472 1HG PRO 56 2HG PRO 56 -13.602 -8.482 7.258
473 2HG PRO 56 1HG PRO 56 -12.378 -7.271 7.678
474 1HD PRO 56 2HD PRO 56 -14.044 -7.507 5.231
475 2HD PRO 56 1HD PRO 56 -13.391 -6.057 6.017
476 H GLU 57 H GLU 57 -12.070 -8.898 3.246
477 HA GLU 57 HA GLU 57 -10.464 -11.078 2.618
478 1HB GLU 57 2HB GLU 57 -12.346 -9.364 1.065
479 2HB GLU 57 1HB GLU 57 -11.315 -10.480 0.180
480 1HG GLU 57 2HG GLU 57 -12.643 -11.685 2.479
481 2HG GLU 57 1HG GLU 57 -13.752 -11.076 1.252
482 H ALA 58 H ALA 58 -10.462 -8.050 0.730
483 HA ALA 58 HA ALA 58 -8.074 -8.476 -0.596
484 1HB ALA 58 1HB ALA 58 -8.545 -5.675 0.128
485 2HB ALA 58 2HB ALA 58 -9.937 -6.491 -0.583
486 3HB ALA 58 3HB ALA 58 -8.408 -6.430 -1.460
487 H SER 59 H SER 59 -8.634 -7.429 2.668
488 HA SER 59 HA SER 59 -6.049 -6.360 3.170
489 1HB SER 59 2HB SER 59 -7.735 -5.671 4.673
490 2HB SER 59 1HB SER 59 -8.288 -7.323 4.943
491 HG SER 59 HG SER 59 -6.449 -7.726 6.133
492 H ALA 60 H ALA 60 -7.540 -9.529 3.734
493 HA ALA 60 HA ALA 60 -5.376 -10.733 5.047
494 1HB ALA 60 1HB ALA 60 -6.621 -12.615 5.009
495 2HB ALA 60 2HB ALA 60 -6.998 -12.461 3.293
496 3HB ALA 60 3HB ALA 60 -7.890 -11.510 4.480
497 H PHE 61 H PHE 61 -6.193 -10.532 1.606
498 HA PHE 61 HA PHE 61 -4.150 -12.191 0.636
499 1HB PHE 61 2HB PHE 61 -6.194 -11.178 -0.597
500 2HB PHE 61 1HB PHE 61 -5.152 -9.786 -0.871
501 HD1 PHE 61 1HD PHE 61 -5.410 -13.442 -1.416
502 HD2 PHE 61 2HD PHE 61 -3.604 -9.782 -2.619
503 HE1 PHE 61 1HE PHE 61 -4.438 -14.571 -3.375
504 HE2 PHE 61 2HE PHE 61 -2.630 -10.903 -4.580
505 HZ PHE 61 HZ PHE 61 -3.046 -13.300 -4.961
506 H THR 62 H THR 62 -4.265 -8.707 1.237
507 HA THR 62 HA THR 62 -1.554 -8.276 0.391
508 HB THR 62 HB THR 62 -3.096 -6.384 2.144
509 HG1 THR 62 1HG THR 62 -4.194 -5.655 0.344
510 1HG2 THR 62 1HG2 THR 62 -1.540 -5.648 -0.288
511 2HG2 THR 62 2HG2 THR 62 -0.708 -5.975 1.233
512 3HG2 THR 62 3HG2 THR 62 -1.912 -4.689 1.144
513 H LYS 63 H LYS 63 -3.183 -9.109 3.335
514 HA LYS 63 HA LYS 63 -1.295 -8.306 5.229
515 1HB LYS 63 2HB LYS 63 -3.366 -10.473 5.160
516 2HB LYS 63 1HB LYS 63 -2.244 -10.373 6.511
517 1HG LYS 63 2HG LYS 63 -3.565 -7.849 5.801
518 2HG LYS 63 1HG LYS 63 -4.631 -9.118 6.410
519 1HD LYS 63 2HD LYS 63 -3.053 -9.382 8.343
520 2HD LYS 63 1HD LYS 63 -2.208 -7.944 7.766
521 1HE LYS 63 2HE LYS 63 -3.624 -6.845 9.120
522 2HE LYS 63 1HE LYS 63 -4.773 -7.064 7.802
523 1HZ LYS 63 1HZ LYS 63 -5.941 -8.583 8.955
524 2HZ LYS 63 2HZ LYS 63 -5.250 -7.824 10.299
525 3HZ LYS 63 3HZ LYS 63 -4.578 -9.256 9.698
526 H LYS 64 H LYS 64 -1.324 -10.960 2.990
527 HA LYS 64 HA LYS 64 0.937 -12.266 4.276
528 1HB LYS 64 2HB LYS 64 -1.196 -13.227 2.811
529 2HB LYS 64 1HB LYS 64 0.114 -13.250 1.639
530 1HG LYS 64 2HG LYS 64 0.755 -14.355 4.291
531 2HG LYS 64 1HG LYS 64 -0.420 -15.261 3.338
532 1HD LYS 64 2HD LYS 64 2.233 -14.360 2.237
533 2HD LYS 64 1HD LYS 64 2.007 -15.916 3.037
534 1HE LYS 64 2HE LYS 64 -0.011 -16.065 1.311
535 2HE LYS 64 1HE LYS 64 1.026 -14.966 0.402
536 1HZ LYS 64 1HZ LYS 64 2.827 -16.739 0.981
537 2HZ LYS 64 2HZ LYS 64 1.775 -16.985 -0.321
538 3HZ LYS 64 3HZ LYS 64 1.492 -17.763 1.154
539 H MET 65 H MET 65 0.126 -10.268 1.537
540 HA MET 65 HA MET 65 2.479 -10.568 0.035
541 1HB MET 65 2HB MET 65 0.442 -8.370 0.252
542 2HB MET 65 1HB MET 65 1.849 -8.208 -0.790
543 1HG MET 65 2HG MET 65 0.280 -10.688 -1.087
544 2HG MET 65 1HG MET 65 -0.497 -9.195 -1.610
545 1HE MET 65 1HE MET 65 0.456 -10.328 -5.073
546 2HE MET 65 2HE MET 65 -0.784 -10.193 -3.826
547 3HE MET 65 3HE MET 65 0.258 -11.614 -3.882
548 H VAL 66 H VAL 66 2.009 -9.132 3.079
549 HA VAL 66 HA VAL 66 4.524 -7.619 2.811
550 HB VAL 66 HB VAL 66 3.747 -6.265 4.735
551 1HG1 VAL 66 1HG1 VAL 66 3.442 -5.465 2.446
552 2HG1 VAL 66 2HG1 VAL 66 2.121 -4.934 3.488
553 3HG1 VAL 66 3HG1 VAL 66 1.877 -6.275 2.368
554 1HG2 VAL 66 1HG2 VAL 66 2.222 -7.803 5.778
555 2HG2 VAL 66 2HG2 VAL 66 1.193 -7.819 4.345
556 3HG2 VAL 66 3HG2 VAL 66 1.334 -6.353 5.315
557 H GLU 67 H GLU 67 2.613 -9.701 4.949
558 HA GLU 67 HA GLU 67 4.587 -9.872 6.985
559 1HB GLU 67 2HB GLU 67 2.015 -10.436 7.006
560 2HB GLU 67 1HB GLU 67 2.577 -12.044 6.566
561 1HG GLU 67 2HG GLU 67 4.213 -11.477 8.647
562 2HG GLU 67 1HG GLU 67 2.753 -10.607 9.116
563 H ASN 68 H ASN 68 3.439 -12.481 4.841
564 HA ASN 68 HA ASN 68 5.933 -13.904 5.217
565 1HB ASN 68 2HB ASN 68 3.443 -14.821 4.954
566 2HB ASN 68 1HB ASN 68 3.895 -14.833 3.251
567 1HD2 ASN 68 1HD2 ASN 68 6.054 -15.875 2.805
568 2HD2 ASN 68 2HD2 ASN 68 6.399 -17.337 3.659
569 H ALA 69 H ALA 69 4.172 -12.393 2.542
570 HA ALA 69 HA ALA 69 6.288 -12.922 0.659
571 1HB ALA 69 1HB ALA 69 3.544 -12.074 0.545
572 2HB ALA 69 2HB ALA 69 4.569 -12.726 -0.735
573 3HB ALA 69 3HB ALA 69 4.555 -10.992 -0.417
574 H LYS 70 H LYS 70 7.703 -11.765 2.428
575 HA LYS 70 HA LYS 70 7.700 -8.881 2.241
576 1HB LYS 70 2HB LYS 70 9.742 -9.077 3.691
577 2HB LYS 70 1HB LYS 70 8.284 -9.790 4.370
578 1HG LYS 70 2HG LYS 70 9.140 -11.864 4.364
579 2HG LYS 70 1HG LYS 70 9.947 -11.638 2.811
580 1HD LYS 70 2HD LYS 70 11.814 -10.630 3.796
581 2HD LYS 70 1HD LYS 70 10.948 -10.285 5.295
582 1HE LYS 70 2HE LYS 70 10.961 -13.114 4.764
583 2HE LYS 70 1HE LYS 70 12.605 -12.476 4.741
584 1HZ LYS 70 1HZ LYS 70 10.920 -11.570 6.927
585 2HZ LYS 70 2HZ LYS 70 12.550 -12.018 6.930
586 3HZ LYS 70 3HZ LYS 70 11.348 -13.207 6.962
587 H LYS 71 H LYS 71 7.930 -9.473 -0.250
588 HA LYS 71 HA LYS 71 10.800 -9.257 -0.883
589 1HB LYS 71 2HB LYS 71 8.630 -10.550 -2.547
590 2HB LYS 71 1HB LYS 71 10.304 -10.344 -3.046
591 1HG LYS 71 2HG LYS 71 11.037 -12.060 -1.778
592 2HG LYS 71 1HG LYS 71 9.874 -11.747 -0.487
593 1HD LYS 71 2HD LYS 71 8.097 -12.734 -1.830
594 2HD LYS 71 1HD LYS 71 9.232 -13.007 -3.153
595 1HE LYS 71 2HE LYS 71 10.434 -14.621 -1.918
596 2HE LYS 71 1HE LYS 71 9.644 -14.164 -0.409
597 1HZ LYS 71 1HZ LYS 71 7.592 -15.076 -1.198
598 2HZ LYS 71 2HZ LYS 71 8.795 -16.252 -1.376
599 3HZ LYS 71 3HZ LYS 71 8.248 -15.391 -2.725
600 H ILE 72 H ILE 72 8.919 -7.124 -0.288
601 HA ILE 72 HA ILE 72 8.355 -5.886 -2.856
602 HB ILE 72 HB ILE 72 7.941 -4.669 -0.134
603 1HG1 ILE 72 2HG1 ILE 72 5.526 -5.661 -1.360
604 2HG1 ILE 72 1HG1 ILE 72 6.686 -6.971 -1.161
605 1HG2 ILE 72 1HG2 ILE 72 6.290 -3.293 -1.285
606 2HG2 ILE 72 2HG2 ILE 72 6.655 -4.113 -2.803
607 3HG2 ILE 72 3HG2 ILE 72 7.883 -3.117 -2.021
608 1HD1 ILE 72 1HD1 ILE 72 5.025 -5.710 0.789
609 2HD1 ILE 72 2HD1 ILE 72 6.720 -5.530 1.241
610 3HD1 ILE 72 3HD1 ILE 72 6.052 -7.136 0.946
611 H GLU 73 H GLU 73 9.167 -3.870 -3.500
612 HA GLU 73 HA GLU 73 11.437 -2.766 -2.048
613 1HB GLU 73 2HB GLU 73 12.762 -2.711 -4.218
614 2HB GLU 73 1HB GLU 73 12.624 -4.274 -3.425
615 1HG GLU 73 2HG GLU 73 10.456 -3.928 -5.264
616 2HG GLU 73 1HG GLU 73 11.990 -3.618 -6.076
617 H VAL 74 H VAL 74 12.143 -0.673 -2.959
618 HA VAL 74 HA VAL 74 9.818 0.785 -3.971
619 HB VAL 74 HB VAL 74 11.249 2.820 -3.427
620 1HG1 VAL 74 1HG1 VAL 74 9.404 1.822 -2.008
621 2HG1 VAL 74 2HG1 VAL 74 10.583 2.826 -1.164
622 3HG1 VAL 74 3HG1 VAL 74 10.680 1.070 -1.051
623 1HG2 VAL 74 1HG2 VAL 74 13.291 1.059 -3.245
624 2HG2 VAL 74 2HG2 VAL 74 12.836 1.203 -1.547
625 3HG2 VAL 74 3HG2 VAL 74 13.281 2.641 -2.467
626 H GLU 75 H GLU 75 9.690 0.894 -6.113
627 HA GLU 75 HA GLU 75 12.155 1.135 -7.685
628 1HB GLU 75 2HB GLU 75 9.549 -0.108 -8.122
629 2HB GLU 75 1HB GLU 75 10.070 0.872 -9.485
630 1HG GLU 75 2HG GLU 75 12.133 -0.896 -8.388
631 2HG GLU 75 1HG GLU 75 10.742 -1.720 -9.091
632 H PHE 76 H PHE 76 12.269 3.403 -6.879
633 HA PHE 76 HA PHE 76 11.534 5.207 -8.891
634 1HB PHE 76 2HB PHE 76 9.876 6.586 -7.747
635 2HB PHE 76 1HB PHE 76 9.271 4.945 -7.951
636 HD1 PHE 76 1HD PHE 76 9.517 3.355 -5.948
637 HD2 PHE 76 2HD PHE 76 9.867 7.586 -5.659
638 HE1 PHE 76 1HE PHE 76 9.058 3.224 -3.535
639 HE2 PHE 76 2HE PHE 76 9.411 7.463 -3.245
640 HZ PHE 76 HZ PHE 76 9.005 5.280 -2.179
641 H ASP 77 H ASP 77 13.199 6.546 -8.858
642 HA ASP 77 HA ASP 77 14.327 7.335 -6.253
643 1HB ASP 77 2HB ASP 77 15.817 5.971 -7.746
644 2HB ASP 77 1HB ASP 77 15.764 7.288 -8.914
645 H LYS 78 H LYS 78 12.106 8.617 -7.654
646 HA LYS 78 HA LYS 78 12.871 10.924 -9.032
647 1HB LYS 78 2HB LYS 78 10.470 10.567 -7.229
648 2HB LYS 78 1HB LYS 78 10.658 11.797 -8.472
649 1HG LYS 78 2HG LYS 78 10.822 9.953 -10.153
650 2HG LYS 78 1HG LYS 78 10.399 8.827 -8.862
651 1HD LYS 78 2HD LYS 78 8.282 9.936 -8.528
652 2HD LYS 78 1HD LYS 78 8.715 11.187 -9.696
653 1HE LYS 78 2HE LYS 78 8.987 9.195 -11.338
654 2HE LYS 78 1HE LYS 78 8.003 8.319 -10.167
655 1HZ LYS 78 1HZ LYS 78 6.526 10.471 -10.420
656 2HZ LYS 78 2HZ LYS 78 6.373 9.159 -11.476
657 3HZ LYS 78 3HZ LYS 78 7.265 10.518 -11.941
658 H GLY 79 H GLY 79 12.828 10.203 -5.619
659 1HA GLY 79 2HA GLY 79 14.204 11.376 -4.075
660 2HA GLY 79 1HA GLY 79 14.126 12.786 -5.120
661 H GLN 80 H GLN 80 11.245 12.659 -5.463
662 HA GLN 80 HA GLN 80 10.500 14.134 -3.125
663 1HB GLN 80 2HB GLN 80 8.333 14.405 -4.250
664 2HB GLN 80 1HB GLN 80 9.671 14.788 -5.324
665 1HG GLN 80 2HG GLN 80 9.458 12.591 -6.371
666 2HG GLN 80 1HG GLN 80 8.113 12.213 -5.297
667 1HE2 GLN 80 1HE2 GLN 80 6.590 14.381 -5.295
668 2HE2 GLN 80 2HE2 GLN 80 6.020 14.760 -6.882
669 H ARG 81 H ARG 81 9.574 13.405 -1.333
670 HA ARG 81 HA ARG 81 8.536 10.656 -1.320
671 1HB ARG 81 2HB ARG 81 9.873 12.363 0.734
672 2HB ARG 81 1HB ARG 81 8.756 11.115 1.271
673 1HG ARG 81 2HG ARG 81 10.139 9.530 -0.203
674 2HG ARG 81 1HG ARG 81 11.350 10.812 -0.190
675 1HD ARG 81 2HD ARG 81 10.360 10.320 2.471
676 2HD ARG 81 1HD ARG 81 10.946 8.826 1.741
677 HE ARG 81 HE ARG 81 13.086 9.652 1.827
678 1HH1 ARG 81 1HH1 ARG 81 10.832 12.242 2.456
679 2HH1 ARG 81 2HH1 ARG 81 12.062 13.363 2.933
680 1HH2 ARG 81 1HH2 ARG 81 14.704 11.126 2.456
681 2HH2 ARG 81 2HH2 ARG 81 14.259 12.731 2.933
682 H THR 82 H THR 82 7.674 13.966 -0.848
683 HA THR 82 HA THR 82 4.915 13.146 -0.329
684 HB THR 82 HB THR 82 5.587 13.679 1.868
685 HG1 THR 82 1HG THR 82 4.422 15.550 2.298
686 1HG2 THR 82 1HG2 THR 82 7.736 14.720 1.401
687 2HG2 THR 82 2HG2 THR 82 6.773 15.696 2.511
688 3HG2 THR 82 3HG2 THR 82 6.914 16.166 0.817
689 H ASP 83 H ASP 83 3.458 14.259 -1.470
690 HA ASP 83 HA ASP 83 3.507 16.919 -2.222
691 1HB ASP 83 2HB ASP 83 5.525 15.868 -3.588
692 2HB ASP 83 1HB ASP 83 4.232 15.351 -4.663
693 H LYS 84 H LYS 84 2.679 13.645 -3.151
694 HA LYS 84 HA LYS 84 0.317 14.417 -4.600
695 1HB LYS 84 2HB LYS 84 0.757 11.626 -3.627
696 2HB LYS 84 1HB LYS 84 0.082 12.183 -5.150
697 1HG LYS 84 2HG LYS 84 2.371 12.929 -5.808
698 2HG LYS 84 1HG LYS 84 2.983 12.153 -4.344
699 1HD LYS 84 2HD LYS 84 2.114 10.006 -5.108
700 2HD LYS 84 1HD LYS 84 1.455 10.773 -6.554
701 1HE LYS 84 2HE LYS 84 4.081 11.553 -6.614
702 2HE LYS 84 1HE LYS 84 4.188 9.923 -5.950
703 1HZ LYS 84 1HZ LYS 84 3.152 10.790 -8.570
704 2HZ LYS 84 2HZ LYS 84 2.640 9.326 -7.896
705 3HZ LYS 84 3HZ LYS 84 4.281 9.579 -8.218
706 H TYR 85 H TYR 85 0.715 12.296 -1.761
707 HA TYR 85 HA TYR 85 -1.812 13.395 -0.712
708 1HB TYR 85 2HB TYR 85 -2.236 11.137 -1.324
709 2HB TYR 85 1HB TYR 85 -0.718 10.584 -0.624
710 HD1 TYR 85 1HD TYR 85 -0.480 10.403 1.831
711 HD2 TYR 85 2HD TYR 85 -4.198 11.416 0.023
712 HE1 TYR 85 1HE TYR 85 -1.642 9.860 3.930
713 HE2 TYR 85 2HE TYR 85 -5.369 10.876 2.117
714 HH TYR 85 HH TYR 85 -5.056 9.588 4.125
715 H GLY 86 H GLY 86 1.509 13.096 -0.164
716 1HA GLY 86 2HA GLY 86 2.522 14.283 1.654
717 2HA GLY 86 1HA GLY 86 1.110 13.910 2.635
718 H ARG 87 H ARG 87 2.999 11.721 0.610
719 HA ARG 87 HA ARG 87 4.526 10.082 1.186
720 1HB ARG 87 2HB ARG 87 4.659 11.498 3.472
721 2HB ARG 87 1HB ARG 87 3.856 10.055 4.075
722 1HG ARG 87 2HG ARG 87 5.762 8.928 4.091
723 2HG ARG 87 1HG ARG 87 6.070 9.324 2.399
724 1HD ARG 87 2HD ARG 87 7.878 10.128 3.815
725 2HD ARG 87 1HD ARG 87 7.015 11.478 3.079
726 HE ARG 87 HE ARG 87 6.072 10.776 5.707
727 1HH1 ARG 87 1HH1 ARG 87 8.377 12.672 3.895
728 2HH1 ARG 87 2HH1 ARG 87 8.605 13.833 5.161
729 1HH2 ARG 87 1HH2 ARG 87 6.370 12.302 7.371
730 2HH2 ARG 87 2HH2 ARG 87 7.466 13.623 7.134
731 H GLY 88 H GLY 88 1.614 9.966 0.672
732 1HA GLY 88 2HA GLY 88 0.908 7.478 2.071
733 2HA GLY 88 1HA GLY 88 -0.219 8.528 1.228
734 H LEU 89 H LEU 89 2.089 8.573 -0.922
735 HA LEU 89 HA LEU 89 1.163 6.118 -2.254
736 1HB LEU 89 2HB LEU 89 1.063 8.765 -3.107
737 2HB LEU 89 1HB LEU 89 2.413 8.083 -3.992
738 HG LEU 89 HG LEU 89 0.335 7.935 -5.271
739 1HD1 LEU 89 1HD1 LEU 89 0.337 5.320 -5.431
740 2HD1 LEU 89 2HD1 LEU 89 1.736 5.465 -4.369
741 3HD1 LEU 89 3HD1 LEU 89 1.741 6.254 -5.947
742 1HD2 LEU 89 1HD2 LEU 89 -1.058 7.694 -3.119
743 2HD2 LEU 89 2HD2 LEU 89 -0.714 5.971 -3.267
744 3HD2 LEU 89 3HD2 LEU 89 -1.573 6.812 -4.557
745 H ALA 90 H ALA 90 2.622 4.555 -2.351
746 HA ALA 90 HA ALA 90 5.404 5.229 -2.957
747 1HB ALA 90 1HB ALA 90 4.544 3.531 -0.619
748 2HB ALA 90 2HB ALA 90 5.416 5.063 -0.564
749 3HB ALA 90 3HB ALA 90 6.197 3.627 -1.227
750 H TYR 91 H TYR 91 6.265 3.911 -4.439
751 HA TYR 91 HA TYR 91 4.722 1.970 -5.757
752 1HB TYR 91 2HB TYR 91 7.669 2.604 -5.812
753 2HB TYR 91 1HB TYR 91 6.963 1.341 -6.816
754 HD1 TYR 91 1HD TYR 91 6.730 4.976 -6.059
755 HD2 TYR 91 2HD TYR 91 5.997 1.876 -8.877
756 HE1 TYR 91 1HE TYR 91 6.142 6.662 -7.750
757 HE2 TYR 91 2HE TYR 91 5.406 3.552 -10.577
758 HH TYR 91 HH TYR 91 5.994 6.062 -10.970
759 H ILE 92 H ILE 92 4.258 -0.049 -5.213
760 HA ILE 92 HA ILE 92 6.073 -1.459 -3.364
761 HB ILE 92 HB ILE 92 3.983 -2.814 -2.772
762 1HG1 ILE 92 2HG1 ILE 92 2.535 -0.349 -3.724
763 2HG1 ILE 92 1HG1 ILE 92 2.694 -1.780 -4.737
764 1HG2 ILE 92 1HG2 ILE 92 5.027 -1.284 -1.220
765 2HG2 ILE 92 2HG2 ILE 92 3.272 -1.149 -1.100
766 3HG2 ILE 92 3HG2 ILE 92 4.195 0.082 -1.964
767 1HD1 ILE 92 1HD1 ILE 92 0.933 -1.269 -2.479
768 2HD1 ILE 92 2HD1 ILE 92 1.762 -2.822 -2.388
769 3HD1 ILE 92 3HD1 ILE 92 0.784 -2.426 -3.800
770 H TYR 93 H TYR 93 7.163 -3.001 -4.377
771 HA TYR 93 HA TYR 93 5.776 -4.576 -6.446
772 1HB TYR 93 2HB TYR 93 8.641 -3.634 -6.345
773 2HB TYR 93 1HB TYR 93 8.111 -4.936 -7.406
774 HD1 TYR 93 1HD TYR 93 8.044 -1.338 -6.794
775 HD2 TYR 93 2HD TYR 93 6.632 -4.474 -9.300
776 HE1 TYR 93 1HE TYR 93 7.373 0.320 -8.482
777 HE2 TYR 93 2HE TYR 93 5.959 -2.825 -10.995
778 HH TYR 93 HH TYR 93 5.700 0.446 -10.378
779 H ALA 94 H ALA 94 5.140 -5.994 -4.696
780 HA ALA 94 HA ALA 94 7.156 -7.409 -3.211
781 1HB ALA 94 1HB ALA 94 4.630 -6.859 -2.631
782 2HB ALA 94 2HB ALA 94 5.447 -8.281 -1.983
783 3HB ALA 94 3HB ALA 94 4.377 -8.438 -3.375
784 H ASP 95 H ASP 95 8.228 -9.142 -3.844
785 HA ASP 95 HA ASP 95 8.885 -10.988 -4.996
786 1HB ASP 95 2HB ASP 95 6.639 -11.794 -4.130
787 2HB ASP 95 1HB ASP 95 5.976 -11.384 -5.708
788 H GLY 96 H GLY 96 9.244 -8.670 -6.334
789 1HA GLY 96 2HA GLY 96 9.625 -7.807 -8.426
790 2HA GLY 96 1HA GLY 96 9.537 -9.469 -8.993
791 H LYS 97 H LYS 97 6.778 -8.184 -7.375
792 HA LYS 97 HA LYS 97 5.495 -7.393 -9.863
793 1HB LYS 97 2HB LYS 97 4.310 -9.536 -8.096
794 2HB LYS 97 1HB LYS 97 3.606 -8.889 -9.571
795 1HG LYS 97 2HG LYS 97 5.343 -9.863 -10.902
796 2HG LYS 97 1HG LYS 97 6.227 -10.365 -9.459
797 1HD LYS 97 2HD LYS 97 4.320 -11.815 -8.842
798 2HD LYS 97 1HD LYS 97 3.523 -11.365 -10.351
799 1HE LYS 97 2HE LYS 97 5.359 -12.324 -11.626
800 2HE LYS 97 1HE LYS 97 6.207 -12.726 -10.133
801 1HZ LYS 97 1HZ LYS 97 3.532 -13.792 -10.848
802 2HZ LYS 97 2HZ LYS 97 4.516 -14.281 -9.562
803 3HZ LYS 97 3HZ LYS 97 4.982 -14.607 -11.155
804 H MET 98 H MET 98 3.530 -6.217 -9.565
805 HA MET 98 HA MET 98 3.526 -4.687 -7.121
806 1HB MET 98 2HB MET 98 2.659 -4.300 -9.814
807 2HB MET 98 1HB MET 98 1.287 -4.026 -8.748
808 1HG MET 98 2HG MET 98 2.791 -2.493 -7.421
809 2HG MET 98 1HG MET 98 3.938 -2.621 -8.753
810 1HE MET 98 1HE MET 98 3.526 0.170 -10.374
811 2HE MET 98 2HE MET 98 2.857 -0.959 -11.553
812 3HE MET 98 3HE MET 98 4.127 -1.487 -10.449
813 H VAL 99 H VAL 99 1.804 -4.479 -5.667
814 HA VAL 99 HA VAL 99 0.148 -6.872 -5.453
815 HB VAL 99 HB VAL 99 0.408 -4.625 -3.455
816 1HG1 VAL 99 1HG1 VAL 99 -0.357 -6.356 -1.863
817 2HG1 VAL 99 2HG1 VAL 99 -0.583 -7.463 -3.218
818 3HG1 VAL 99 3HG1 VAL 99 -1.550 -5.992 -3.110
819 1HG2 VAL 99 1HG2 VAL 99 2.555 -5.322 -3.339
820 2HG2 VAL 99 2HG2 VAL 99 2.201 -6.884 -4.080
821 3HG2 VAL 99 3HG2 VAL 99 1.851 -6.619 -2.371
822 H ASN 100 H ASN 100 -0.127 -3.415 -5.929
823 HA ASN 100 HA ASN 100 -2.906 -3.180 -5.486
824 1HB ASN 100 2HB ASN 100 -0.854 -1.525 -6.910
825 2HB ASN 100 1HB ASN 100 -2.561 -1.126 -7.078
826 1HD2 ASN 100 1HD2 ASN 100 0.199 -0.761 -5.214
827 2HD2 ASN 100 2HD2 ASN 100 -0.526 -0.050 -3.817
828 H GLU 101 H GLU 101 -1.049 -4.363 -8.153
829 HA GLU 101 HA GLU 101 -3.298 -4.209 -9.994
830 1HB GLU 101 2HB GLU 101 -0.399 -4.831 -10.229
831 2HB GLU 101 1HB GLU 101 -1.481 -5.546 -11.416
832 1HG GLU 101 2HG GLU 101 -2.352 -3.239 -11.867
833 2HG GLU 101 1HG GLU 101 -1.050 -2.627 -10.848
834 H ALA 102 H ALA 102 -1.914 -6.436 -7.789
835 HA ALA 102 HA ALA 102 -2.565 -8.870 -9.026
836 1HB ALA 102 1HB ALA 102 -1.213 -9.300 -7.272
837 2HB ALA 102 2HB ALA 102 -2.746 -9.525 -6.431
838 3HB ALA 102 3HB ALA 102 -1.883 -7.995 -6.294
839 H LEU 103 H LEU 103 -4.242 -7.947 -6.049
840 HA LEU 103 HA LEU 103 -6.755 -8.738 -7.354
841 1HB LEU 103 2HB LEU 103 -7.523 -9.698 -5.388
842 2HB LEU 103 1HB LEU 103 -5.836 -10.152 -5.440
843 HG LEU 103 HG LEU 103 -6.320 -9.608 -3.195
844 1HD1 LEU 103 1HD1 LEU 103 -5.055 -7.084 -4.203
845 2HD1 LEU 103 2HD1 LEU 103 -4.219 -8.636 -4.229
846 3HD1 LEU 103 3HD1 LEU 103 -4.753 -7.948 -2.696
847 1HD2 LEU 103 1HD2 LEU 103 -7.720 -8.010 -2.458
848 2HD2 LEU 103 2HD2 LEU 103 -8.339 -8.091 -4.107
849 3HD2 LEU 103 3HD2 LEU 103 -7.188 -6.832 -3.657
850 H VAL 104 H VAL 104 -5.138 -6.126 -5.891
851 HA VAL 104 HA VAL 104 -7.397 -4.744 -4.855
852 HB VAL 104 HB VAL 104 -4.835 -3.471 -5.802
853 1HG1 VAL 104 1HG1 VAL 104 -5.471 -1.614 -4.694
854 2HG1 VAL 104 2HG1 VAL 104 -6.247 -2.525 -3.398
855 3HG1 VAL 104 3HG1 VAL 104 -7.088 -2.278 -4.929
856 1HG2 VAL 104 1HG2 VAL 104 -5.431 -4.910 -3.229
857 2HG2 VAL 104 2HG2 VAL 104 -4.110 -3.754 -3.401
858 3HG2 VAL 104 3HG2 VAL 104 -4.127 -5.224 -4.375
859 H ARG 105 H ARG 105 -5.963 -5.026 -8.013
860 HA ARG 105 HA ARG 105 -7.195 -2.735 -9.167
861 1HB ARG 105 2HB ARG 105 -5.222 -3.779 -10.169
862 2HB ARG 105 1HB ARG 105 -6.138 -5.248 -10.475
863 1HG ARG 105 2HG ARG 105 -6.968 -4.442 -12.373
864 2HG ARG 105 1HG ARG 105 -7.431 -2.919 -11.612
865 1HD ARG 105 2HD ARG 105 -4.571 -3.069 -11.897
866 2HD ARG 105 1HD ARG 105 -5.358 -3.360 -13.448
867 HE ARG 105 HE ARG 105 -6.621 -1.161 -12.416
868 1HH1 ARG 105 1HH1 ARG 105 -3.323 -1.993 -13.193
869 2HH1 ARG 105 2HH1 ARG 105 -2.864 -0.363 -13.558
870 1HH2 ARG 105 1HH2 ARG 105 -6.021 0.985 -12.896
871 2HH2 ARG 105 2HH2 ARG 105 -4.397 1.327 -13.388
872 H GLN 106 H GLN 106 -8.392 -5.784 -8.236
873 HA GLN 106 HA GLN 106 -10.551 -5.824 -10.166
874 1HB GLN 106 2HB GLN 106 -9.281 -7.733 -8.505
875 2HB GLN 106 1HB GLN 106 -10.965 -7.662 -8.007
876 1HG GLN 106 2HG GLN 106 -11.723 -8.536 -9.947
877 2HG GLN 106 1HG GLN 106 -10.448 -7.791 -10.910
878 1HE2 GLN 106 1HE2 GLN 106 -9.916 -9.638 -12.012
879 2HE2 GLN 106 2HE2 GLN 106 -9.146 -10.994 -11.268
880 H GLY 107 H GLY 107 -10.086 -3.818 -7.749
881 1HA GLY 107 2HA GLY 107 -11.778 -2.356 -6.964
882 2HA GLY 107 1HA GLY 107 -12.946 -3.655 -7.142
883 H LEU 108 H LEU 108 -9.827 -3.952 -5.563
884 HA LEU 108 HA LEU 108 -9.258 -4.651 -3.478
885 1HB LEU 108 2HB LEU 108 -11.046 -2.357 -3.177
886 2HB LEU 108 1HB LEU 108 -10.941 -3.356 -1.739
887 HG LEU 108 HG LEU 108 -8.659 -1.980 -3.154
888 1HD1 LEU 108 1HD1 LEU 108 -9.477 -0.318 -1.858
889 2HD1 LEU 108 2HD1 LEU 108 -8.544 -1.152 -0.615
890 3HD1 LEU 108 3HD1 LEU 108 -10.281 -1.427 -0.748
891 1HD2 LEU 108 1HD2 LEU 108 -8.692 -4.047 -0.987
892 2HD2 LEU 108 2HD2 LEU 108 -7.391 -2.863 -1.097
893 3HD2 LEU 108 3HD2 LEU 108 -7.691 -3.971 -2.436
894 H ALA 109 H ALA 109 -9.635 -6.681 -3.027
895 HA ALA 109 HA ALA 109 -10.571 -8.420 -1.834
896 1HB ALA 109 1HB ALA 109 -12.442 -8.188 -0.575
897 2HB ALA 109 2HB ALA 109 -13.322 -7.324 -1.835
898 3HB ALA 109 3HB ALA 109 -12.116 -6.479 -0.865
899 H LYS 110 H LYS 110 -13.247 -7.160 -3.825
900 HA LYS 110 HA LYS 110 -14.515 -8.161 -5.433
901 1HB LYS 110 2HB LYS 110 -12.272 -7.672 -6.557
902 2HB LYS 110 1HB LYS 110 -11.936 -9.390 -6.386
903 1HG LYS 110 2HG LYS 110 -14.527 -8.746 -7.606
904 2HG LYS 110 1HG LYS 110 -13.112 -8.263 -8.542
905 1HD LYS 110 2HD LYS 110 -12.544 -10.392 -9.009
906 2HD LYS 110 1HD LYS 110 -12.965 -10.962 -7.392
907 1HE LYS 110 2HE LYS 110 -14.535 -12.023 -8.721
908 2HE LYS 110 1HE LYS 110 -15.408 -10.597 -8.167
909 1HZ LYS 110 1HZ LYS 110 -15.332 -9.636 -10.222
910 2HZ LYS 110 2HZ LYS 110 -15.399 -11.265 -10.674
911 3HZ LYS 110 3HZ LYS 110 -13.920 -10.444 -10.690
Start of MODEL 2
1 1H ALA 1 1HT ALA 1 9.118 20.962 -21.971
2 2H ALA 1 2HT ALA 1 10.350 20.679 -20.809
3 3H ALA 1 3HT ALA 1 9.423 19.369 -21.416
4 HA ALA 1 HA ALA 1 10.293 20.056 -23.663
5 1HB ALA 1 1HB ALA 1 12.656 21.073 -22.185
6 2HB ALA 1 2HB ALA 1 11.291 22.166 -22.409
7 3HB ALA 1 3HB ALA 1 12.085 21.450 -23.810
8 H THR 2 H THR 2 12.469 19.524 -20.886
9 HA THR 2 HA THR 2 13.167 16.916 -22.053
10 HB THR 2 HB THR 2 15.149 17.157 -20.389
11 HG1 THR 2 1HG THR 2 15.599 19.194 -19.736
12 1HG2 THR 2 1HG2 THR 2 16.157 19.004 -22.034
13 2HG2 THR 2 2HG2 THR 2 14.777 18.474 -22.997
14 3HG2 THR 2 3HG2 THR 2 15.987 17.304 -22.471
15 H SER 3 H SER 3 11.821 15.444 -21.185
16 HA SER 3 HA SER 3 11.462 15.455 -18.263
17 1HB SER 3 2HB SER 3 9.504 15.443 -20.126
18 2HB SER 3 1HB SER 3 9.740 13.708 -19.923
19 HG SER 3 HG SER 3 9.573 14.208 -17.582
20 H THR 4 H THR 4 12.769 14.090 -17.251
21 HA THR 4 HA THR 4 13.470 11.559 -18.586
22 HB THR 4 HB THR 4 15.015 12.702 -16.281
23 HG1 THR 4 1HG THR 4 15.233 13.435 -19.007
24 1HG2 THR 4 1HG2 THR 4 15.502 10.703 -18.409
25 2HG2 THR 4 2HG2 THR 4 15.976 10.697 -16.711
26 3HG2 THR 4 3HG2 THR 4 16.864 11.685 -17.870
27 H LYS 5 H LYS 5 13.420 9.632 -17.406
28 HA LYS 5 HA LYS 5 11.597 9.694 -15.119
29 1HB LYS 5 2HB LYS 5 11.294 7.303 -15.529
30 2HB LYS 5 1HB LYS 5 11.003 8.232 -16.993
31 1HG LYS 5 2HG LYS 5 13.652 7.642 -17.232
32 2HG LYS 5 1HG LYS 5 13.028 6.204 -16.420
33 1HD LYS 5 2HD LYS 5 12.876 5.805 -18.761
34 2HD LYS 5 1HD LYS 5 11.237 6.110 -18.182
35 1HE LYS 5 2HE LYS 5 11.018 7.936 -19.454
36 2HE LYS 5 1HE LYS 5 12.616 8.536 -19.013
37 1HZ LYS 5 1HZ LYS 5 13.611 7.173 -20.677
38 2HZ LYS 5 2HZ LYS 5 12.348 8.029 -21.407
39 3HZ LYS 5 3HZ LYS 5 12.145 6.396 -21.015
40 H LYS 6 H LYS 6 12.079 8.791 -13.141
41 HA LYS 6 HA LYS 6 14.932 8.262 -12.668
42 1HB LYS 6 2HB LYS 6 12.747 9.406 -10.967
43 2HB LYS 6 1HB LYS 6 14.132 8.641 -10.203
44 1HG LYS 6 2HG LYS 6 15.523 10.214 -11.721
45 2HG LYS 6 1HG LYS 6 14.020 11.127 -11.850
46 1HD LYS 6 2HD LYS 6 14.160 11.890 -9.740
47 2HD LYS 6 1HD LYS 6 14.727 10.340 -9.116
48 1HE LYS 6 2HE LYS 6 16.679 11.696 -10.812
49 2HE LYS 6 1HE LYS 6 16.238 12.619 -9.377
50 1HZ LYS 6 1HZ LYS 6 18.114 10.732 -9.403
51 2HZ LYS 6 2HZ LYS 6 16.778 9.803 -8.938
52 3HZ LYS 6 3HZ LYS 6 17.231 11.151 -8.020
53 H LEU 7 H LEU 7 15.416 6.172 -12.567
54 HA LEU 7 HA LEU 7 13.440 4.329 -11.396
55 1HB LEU 7 2HB LEU 7 14.689 4.197 -13.843
56 2HB LEU 7 1HB LEU 7 15.675 3.131 -12.860
57 HG LEU 7 HG LEU 7 14.006 1.807 -13.946
58 1HD1 LEU 7 1HD1 LEU 7 13.202 2.239 -11.073
59 2HD1 LEU 7 2HD1 LEU 7 14.527 1.216 -11.627
60 3HD1 LEU 7 3HD1 LEU 7 12.864 0.810 -12.049
61 1HD2 LEU 7 1HD2 LEU 7 12.394 3.495 -14.507
62 2HD2 LEU 7 2HD2 LEU 7 12.019 3.765 -12.805
63 3HD2 LEU 7 3HD2 LEU 7 11.590 2.234 -13.571
64 H HIS 8 H HIS 8 13.917 4.140 -9.296
65 HA HIS 8 HA HIS 8 16.693 3.481 -8.571
66 1HB HIS 8 2HB HIS 8 14.952 5.525 -7.541
67 2HB HIS 8 1HB HIS 8 15.328 4.378 -6.261
68 HD1 HIS 8 1HD HIS 8 17.791 5.281 -8.957
69 HD2 HIS 8 2HD HIS 8 17.097 6.036 -4.929
70 HE1 HIS 8 1HE HIS 8 19.858 6.445 -8.125
71 HE2 HIS 8 2HE HIS 8 19.367 6.997 -5.716
72 H LYS 9 H LYS 9 17.034 1.730 -7.253
73 HA LYS 9 HA LYS 9 14.639 0.163 -6.548
74 1HB LYS 9 2HB LYS 9 17.158 -0.592 -7.882
75 2HB LYS 9 1HB LYS 9 16.618 -1.703 -6.630
76 1HG LYS 9 2HG LYS 9 14.323 -1.506 -7.881
77 2HG LYS 9 1HG LYS 9 15.348 -1.011 -9.230
78 1HD LYS 9 2HD LYS 9 15.409 -3.245 -9.604
79 2HD LYS 9 1HD LYS 9 16.710 -3.171 -8.415
80 1HE LYS 9 2HE LYS 9 14.464 -3.382 -6.849
81 2HE LYS 9 1HE LYS 9 14.068 -4.399 -8.234
82 1HZ LYS 9 1HZ LYS 9 16.564 -5.182 -7.726
83 2HZ LYS 9 2HZ LYS 9 15.200 -5.927 -7.061
84 3HZ LYS 9 3HZ LYS 9 16.061 -4.784 -6.161
85 H GLU 10 H GLU 10 14.319 0.417 -4.434
86 HA GLU 10 HA GLU 10 16.595 -0.060 -2.636
87 1HB GLU 10 2HB GLU 10 14.390 1.905 -2.028
88 2HB GLU 10 1HB GLU 10 15.892 1.664 -1.147
89 1HG GLU 10 2HG GLU 10 16.913 2.324 -3.516
90 2HG GLU 10 1HG GLU 10 15.369 3.164 -3.639
91 HA PRO 11 HA PRO 11 13.859 -3.045 -0.850
92 1HB PRO 11 2HB PRO 11 15.124 -3.517 1.476
93 2HB PRO 11 1HB PRO 11 15.799 -4.028 -0.077
94 1HG PRO 11 2HG PRO 11 16.482 -1.638 1.590
95 2HG PRO 11 1HG PRO 11 17.565 -2.750 0.734
96 1HD PRO 11 2HD PRO 11 16.840 -0.305 -0.242
97 2HD PRO 11 1HD PRO 11 17.276 -1.679 -1.275
98 H ALA 12 H ALA 12 11.906 -2.620 -0.053
99 HA ALA 12 HA ALA 12 11.668 -1.208 2.490
100 1HB ALA 12 1HB ALA 12 11.178 0.684 1.351
101 2HB ALA 12 2HB ALA 12 9.582 -0.061 1.253
102 3HB ALA 12 3HB ALA 12 10.699 -0.187 -0.106
103 H THR 13 H THR 13 10.723 -2.743 3.677
104 HA THR 13 HA THR 13 8.457 -4.218 2.510
105 HB THR 13 HB THR 13 9.799 -5.162 5.000
106 HG1 THR 13 1HG THR 13 11.642 -5.132 3.986
107 1HG2 THR 13 1HG2 THR 13 8.770 -6.617 2.579
108 2HG2 THR 13 2HG2 THR 13 7.921 -6.428 4.112
109 3HG2 THR 13 3HG2 THR 13 9.416 -7.361 4.040
110 H LEU 14 H LEU 14 6.741 -4.838 4.077
111 HA LEU 14 HA LEU 14 6.227 -2.602 5.910
112 1HB LEU 14 2HB LEU 14 3.906 -2.963 5.607
113 2HB LEU 14 1HB LEU 14 4.636 -3.003 4.014
114 HG LEU 14 HG LEU 14 4.668 -5.640 4.601
115 1HD1 LEU 14 1HD1 LEU 14 3.293 -4.750 6.732
116 2HD1 LEU 14 2HD1 LEU 14 3.047 -6.338 6.005
117 3HD1 LEU 14 3HD1 LEU 14 1.967 -5.005 5.598
118 1HD2 LEU 14 1HD2 LEU 14 2.076 -5.044 3.567
119 2HD2 LEU 14 2HD2 LEU 14 3.505 -5.619 2.711
120 3HD2 LEU 14 3HD2 LEU 14 3.232 -3.889 2.907
121 H ILE 15 H ILE 15 5.830 -2.928 8.031
122 HA ILE 15 HA ILE 15 6.579 -5.440 9.175
123 HB ILE 15 HB ILE 15 5.341 -3.084 10.598
124 1HG1 ILE 15 2HG1 ILE 15 8.295 -3.599 10.396
125 2HG1 ILE 15 1HG1 ILE 15 7.463 -2.667 9.155
126 1HG2 ILE 15 1HG2 ILE 15 5.348 -4.676 12.209
127 2HG2 ILE 15 2HG2 ILE 15 7.025 -4.156 12.369
128 3HG2 ILE 15 3HG2 ILE 15 6.636 -5.605 11.441
129 1HD1 ILE 15 1HD1 ILE 15 8.511 -1.251 10.855
130 2HD1 ILE 15 2HD1 ILE 15 7.498 -2.004 12.090
131 3HD1 ILE 15 3HD1 ILE 15 6.760 -1.047 10.805
132 H LYS 16 H LYS 16 3.575 -3.523 9.409
133 HA LYS 16 HA LYS 16 1.954 -5.875 9.117
134 1HB LYS 16 2HB LYS 16 2.708 -5.012 11.754
135 2HB LYS 16 1HB LYS 16 0.974 -4.812 11.543
136 1HG LYS 16 2HG LYS 16 0.982 -7.213 10.673
137 2HG LYS 16 1HG LYS 16 2.604 -7.319 11.360
138 1HD LYS 16 2HD LYS 16 0.888 -6.147 13.305
139 2HD LYS 16 1HD LYS 16 0.101 -7.596 12.676
140 1HE LYS 16 2HE LYS 16 1.493 -8.120 14.610
141 2HE LYS 16 1HE LYS 16 2.105 -8.903 13.154
142 1HZ LYS 16 1HZ LYS 16 3.301 -6.815 14.779
143 2HZ LYS 16 2HZ LYS 16 3.484 -6.633 13.109
144 3HZ LYS 16 3HZ LYS 16 4.038 -8.037 13.871
145 H ALA 17 H ALA 17 -0.176 -5.412 8.638
146 HA ALA 17 HA ALA 17 -0.778 -2.553 8.266
147 1HB ALA 17 1HB ALA 17 -2.027 -3.086 6.360
148 2HB ALA 17 2HB ALA 17 -2.135 -4.791 6.797
149 3HB ALA 17 3HB ALA 17 -0.600 -4.116 6.248
150 H ILE 18 H ILE 18 -2.876 -1.786 8.741
151 HA ILE 18 HA ILE 18 -4.042 -2.855 11.067
152 HB ILE 18 HB ILE 18 -5.895 -1.243 10.656
153 1HG1 ILE 18 2HG1 ILE 18 -4.437 0.022 8.423
154 2HG1 ILE 18 1HG1 ILE 18 -5.264 -1.478 8.022
155 1HG2 ILE 18 1HG2 ILE 18 -3.467 -0.769 11.597
156 2HG2 ILE 18 2HG2 ILE 18 -4.655 0.520 11.393
157 3HG2 ILE 18 3HG2 ILE 18 -3.394 0.284 10.182
158 1HD1 ILE 18 1HD1 ILE 18 -7.032 -0.171 7.670
159 2HD1 ILE 18 2HD1 ILE 18 -6.344 1.169 8.588
160 3HD1 ILE 18 3HD1 ILE 18 -7.176 -0.140 9.427
161 H ASP 19 H ASP 19 -4.404 -3.762 7.811
162 HA ASP 19 HA ASP 19 -5.547 -5.545 6.935
163 1HB ASP 19 2HB ASP 19 -7.278 -5.627 9.400
164 2HB ASP 19 1HB ASP 19 -6.999 -6.909 8.230
165 H GLY 20 H GLY 20 -6.836 -2.596 7.889
166 1HA GLY 20 2HA GLY 20 -9.432 -3.063 6.646
167 2HA GLY 20 1HA GLY 20 -8.933 -1.608 7.486
168 H ASP 21 H ASP 21 -6.488 -1.188 6.069
169 HA ASP 21 HA ASP 21 -6.508 -1.229 3.347
170 1HB ASP 21 2HB ASP 21 -7.415 1.143 2.859
171 2HB ASP 21 1HB ASP 21 -8.576 -0.163 3.072
172 H THR 22 H THR 22 -5.692 0.355 6.279
173 HA THR 22 HA THR 22 -3.671 2.013 4.970
174 HB THR 22 HB THR 22 -4.639 1.879 7.829
175 HG1 THR 22 1HG THR 22 -6.054 3.093 6.787
176 1HG2 THR 22 1HG2 THR 22 -2.557 2.613 8.316
177 2HG2 THR 22 2HG2 THR 22 -3.276 4.148 7.830
178 3HG2 THR 22 3HG2 THR 22 -2.276 3.243 6.694
179 H VAL 23 H VAL 23 -1.478 1.782 5.320
180 HA VAL 23 HA VAL 23 -0.593 -0.529 6.896
181 HB VAL 23 HB VAL 23 0.585 -0.022 4.178
182 1HG1 VAL 23 1HG1 VAL 23 1.932 -1.364 5.619
183 2HG1 VAL 23 2HG1 VAL 23 1.192 -2.432 4.426
184 3HG1 VAL 23 3HG1 VAL 23 0.552 -2.366 6.067
185 1HG2 VAL 23 1HG2 VAL 23 -1.829 -0.433 3.881
186 2HG2 VAL 23 2HG2 VAL 23 -1.668 -1.937 4.786
187 3HG2 VAL 23 3HG2 VAL 23 -0.840 -1.744 3.241
188 H LYS 24 H LYS 24 1.689 -0.510 7.405
189 HA LYS 24 HA LYS 24 2.939 2.147 7.202
190 1HB LYS 24 2HB LYS 24 1.914 1.651 9.474
191 2HB LYS 24 1HB LYS 24 3.118 0.383 9.644
192 1HG LYS 24 2HG LYS 24 4.822 2.268 9.155
193 2HG LYS 24 1HG LYS 24 3.493 3.345 9.589
194 1HD LYS 24 2HD LYS 24 3.980 1.096 11.434
195 2HD LYS 24 1HD LYS 24 5.248 2.321 11.368
196 1HE LYS 24 2HE LYS 24 2.797 3.704 11.452
197 2HE LYS 24 1HE LYS 24 2.693 2.424 12.660
198 1HZ LYS 24 1HZ LYS 24 5.130 3.365 13.147
199 2HZ LYS 24 2HZ LYS 24 3.741 3.947 13.918
200 3HZ LYS 24 3HZ LYS 24 4.387 4.782 12.596
201 H LEU 25 H LEU 25 4.572 1.785 5.816
202 HA LEU 25 HA LEU 25 6.049 -0.707 5.885
203 1HB LEU 25 2HB LEU 25 6.019 1.683 4.087
204 2HB LEU 25 1HB LEU 25 7.369 0.565 4.027
205 HG LEU 25 HG LEU 25 4.959 -0.955 3.903
206 1HD1 LEU 25 1HD1 LEU 25 4.407 1.535 2.946
207 2HD1 LEU 25 2HD1 LEU 25 3.606 0.050 2.430
208 3HD1 LEU 25 3HD1 LEU 25 4.949 0.701 1.490
209 1HD2 LEU 25 1HD2 LEU 25 6.723 -0.441 1.551
210 2HD2 LEU 25 2HD2 LEU 25 5.992 -1.948 2.105
211 3HD2 LEU 25 3HD2 LEU 25 7.375 -1.271 2.964
212 H MET 26 H MET 26 8.422 -0.708 5.892
213 HA MET 26 HA MET 26 9.472 1.313 7.760
214 1HB MET 26 2HB MET 26 9.352 -0.961 8.700
215 2HB MET 26 1HB MET 26 10.355 -1.554 7.385
216 1HG MET 26 2HG MET 26 12.056 -1.240 8.783
217 2HG MET 26 1HG MET 26 11.884 0.467 8.383
218 1HE MET 26 1HE MET 26 12.501 -0.355 12.392
219 2HE MET 26 2HE MET 26 13.384 -0.135 10.882
220 3HE MET 26 3HE MET 26 12.601 -1.676 11.229
221 H TYR 27 H TYR 27 10.393 2.776 6.390
222 HA TYR 27 HA TYR 27 12.330 1.760 4.421
223 1HB TYR 27 2HB TYR 27 10.504 3.168 3.520
224 2HB TYR 27 1HB TYR 27 11.022 4.486 4.565
225 HD1 TYR 27 1HD TYR 27 12.556 6.042 3.769
226 HD2 TYR 27 2HD TYR 27 12.283 2.251 1.857
227 HE1 TYR 27 1HE TYR 27 14.108 6.816 2.026
228 HE2 TYR 27 2HE TYR 27 13.835 3.014 0.110
229 HH TYR 27 HH TYR 27 14.585 6.188 -0.424
230 H LYS 28 H LYS 28 14.281 1.650 5.353
231 HA LYS 28 HA LYS 28 16.183 2.232 6.459
232 1HB LYS 28 2HB LYS 28 15.873 4.090 4.653
233 2HB LYS 28 1HB LYS 28 15.493 5.120 6.026
234 1HG LYS 28 2HG LYS 28 17.743 4.154 6.970
235 2HG LYS 28 1HG LYS 28 18.070 3.848 5.263
236 1HD LYS 28 2HD LYS 28 17.745 6.184 4.740
237 2HD LYS 28 1HD LYS 28 17.262 6.522 6.404
238 1HE LYS 28 2HE LYS 28 19.391 6.514 7.162
239 2HE LYS 28 1HE LYS 28 19.885 5.221 6.069
240 1HZ LYS 28 1HZ LYS 28 19.368 7.985 5.140
241 2HZ LYS 28 2HZ LYS 28 20.160 6.741 4.312
242 3HZ LYS 28 3HZ LYS 28 20.895 7.467 5.651
243 H GLY 29 H GLY 29 14.360 1.592 8.245
244 1HA GLY 29 2HA GLY 29 13.742 1.837 10.441
245 2HA GLY 29 1HA GLY 29 15.123 2.914 10.585
246 H GLN 30 H GLN 30 12.608 3.671 8.322
247 HA GLN 30 HA GLN 30 11.521 5.670 10.188
248 1HB GLN 30 2HB GLN 30 13.116 6.669 8.527
249 2HB GLN 30 1HB GLN 30 12.025 6.151 7.250
250 1HG GLN 30 2HG GLN 30 11.411 8.343 7.548
251 2HG GLN 30 1HG GLN 30 10.245 7.495 8.563
252 1HE2 GLN 30 1HE2 GLN 30 12.827 9.737 8.458
253 2HE2 GLN 30 2HE2 GLN 30 12.860 10.124 10.142
254 HA PRO 31 HA PRO 31 7.720 3.509 9.168
255 1HB PRO 31 2HB PRO 31 6.579 6.059 10.209
256 2HB PRO 31 1HB PRO 31 6.185 4.390 10.640
257 1HG PRO 31 2HG PRO 31 7.645 5.903 12.271
258 2HG PRO 31 1HG PRO 31 8.014 4.183 12.050
259 1HD PRO 31 2HD PRO 31 9.414 6.578 10.954
260 2HD PRO 31 1HD PRO 31 10.085 5.026 11.493
261 H MET 32 H MET 32 7.625 3.518 6.955
262 HA MET 32 HA MET 32 7.149 5.973 5.495
263 1HB MET 32 2HB MET 32 8.613 4.263 4.539
264 2HB MET 32 1HB MET 32 7.296 3.101 4.563
265 1HG MET 32 2HG MET 32 6.177 5.095 3.124
266 2HG MET 32 1HG MET 32 7.872 5.272 2.676
267 1HE MET 32 1HE MET 32 8.955 2.037 1.324
268 2HE MET 32 2HE MET 32 9.306 3.651 1.941
269 3HE MET 32 3HE MET 32 8.703 3.447 0.296
270 H THR 33 H THR 33 5.246 6.655 4.662
271 HA THR 33 HA THR 33 2.844 5.313 5.576
272 HB THR 33 HB THR 33 1.803 7.384 4.351
273 HG1 THR 33 1HG THR 33 3.181 9.033 4.000
274 1HG2 THR 33 1HG2 THR 33 1.786 8.572 6.298
275 2HG2 THR 33 2HG2 THR 33 3.470 8.199 6.671
276 3HG2 THR 33 3HG2 THR 33 2.225 6.971 6.896
277 H PHE 34 H PHE 34 1.264 4.430 4.302
278 HA PHE 34 HA PHE 34 1.723 4.353 1.405
279 1HB PHE 34 2HB PHE 34 2.636 2.279 2.485
280 2HB PHE 34 1HB PHE 34 1.007 1.911 3.039
281 HD1 PHE 34 1HD PHE 34 0.216 0.103 1.862
282 HD2 PHE 34 2HD PHE 34 2.321 3.160 -0.219
283 HE1 PHE 34 1HE PHE 34 -0.252 -1.031 -0.270
284 HE2 PHE 34 2HE PHE 34 1.854 2.033 -2.355
285 HZ PHE 34 HZ PHE 34 0.567 -0.065 -2.383
286 H ARG 35 H ARG 35 0.010 5.677 0.968
287 HA ARG 35 HA ARG 35 -2.148 6.488 0.979
288 1HB ARG 35 2HB ARG 35 -3.651 4.987 -0.206
289 2HB ARG 35 1HB ARG 35 -2.038 4.922 -0.897
290 1HG ARG 35 2HG ARG 35 -2.395 2.910 1.147
291 2HG ARG 35 1HG ARG 35 -3.609 2.778 -0.123
292 1HD ARG 35 2HD ARG 35 -0.626 2.891 -0.549
293 2HD ARG 35 1HD ARG 35 -1.615 1.436 -0.609
294 HE ARG 35 HE ARG 35 -2.569 2.188 -2.626
295 1HH1 ARG 35 1HH1 ARG 35 -0.100 4.362 -1.442
296 2HH1 ARG 35 2HH1 ARG 35 0.103 5.154 -2.967
297 1HH2 ARG 35 1HH2 ARG 35 -2.299 3.235 -4.625
298 2HH2 ARG 35 2HH2 ARG 35 -1.144 4.517 -4.770
299 H LEU 36 H LEU 36 -2.195 6.742 3.343
300 HA LEU 36 HA LEU 36 -3.865 4.775 4.730
301 1HB LEU 36 2HB LEU 36 -2.516 7.199 5.906
302 2HB LEU 36 1HB LEU 36 -3.195 5.833 6.771
303 HG LEU 36 HG LEU 36 -1.390 4.478 5.410
304 1HD1 LEU 36 1HD1 LEU 36 -0.502 7.315 5.209
305 2HD1 LEU 36 2HD1 LEU 36 -0.386 6.012 4.027
306 3HD1 LEU 36 3HD1 LEU 36 0.700 6.043 5.415
307 1HD2 LEU 36 1HD2 LEU 36 -0.324 4.284 7.382
308 2HD2 LEU 36 2HD2 LEU 36 -1.645 5.287 7.982
309 3HD2 LEU 36 3HD2 LEU 36 -0.102 6.025 7.552
310 H LEU 37 H LEU 37 -5.953 5.121 5.102
311 HA LEU 37 HA LEU 37 -6.997 7.854 4.736
312 1HB LEU 37 2HB LEU 37 -7.934 5.221 3.784
313 2HB LEU 37 1HB LEU 37 -9.183 6.293 4.386
314 HG LEU 37 HG LEU 37 -8.891 6.461 1.948
315 1HD1 LEU 37 1HD1 LEU 37 -9.495 8.416 3.560
316 2HD1 LEU 37 2HD1 LEU 37 -9.165 8.744 1.859
317 3HD1 LEU 37 3HD1 LEU 37 -7.923 9.050 3.071
318 1HD2 LEU 37 1HD2 LEU 37 -6.548 5.980 1.735
319 2HD2 LEU 37 2HD2 LEU 37 -6.124 7.403 2.686
320 3HD2 LEU 37 3HD2 LEU 37 -6.852 7.594 1.091
321 H LEU 38 H LEU 38 -6.653 8.282 6.981
322 HA LEU 38 HA LEU 38 -7.781 6.708 9.043
323 1HB LEU 38 2HB LEU 38 -6.661 9.462 8.843
324 2HB LEU 38 1HB LEU 38 -7.595 9.046 10.268
325 HG LEU 38 HG LEU 38 -6.056 7.244 10.801
326 1HD1 LEU 38 1HD1 LEU 38 -5.048 7.829 8.085
327 2HD1 LEU 38 2HD1 LEU 38 -5.171 6.295 8.948
328 3HD1 LEU 38 3HD1 LEU 38 -3.850 7.407 9.307
329 1HD2 LEU 38 1HD2 LEU 38 -3.942 8.657 11.050
330 2HD2 LEU 38 2HD2 LEU 38 -5.420 9.265 11.797
331 3HD2 LEU 38 3HD2 LEU 38 -4.860 9.945 10.268
332 H VAL 39 H VAL 39 -9.881 6.355 9.306
333 HA VAL 39 HA VAL 39 -11.712 8.602 9.418
334 HB VAL 39 HB VAL 39 -12.345 6.293 7.581
335 1HG1 VAL 39 1HG1 VAL 39 -14.119 7.984 6.831
336 2HG1 VAL 39 2HG1 VAL 39 -13.758 8.829 8.335
337 3HG1 VAL 39 3HG1 VAL 39 -14.359 7.172 8.378
338 1HG2 VAL 39 1HG2 VAL 39 -11.411 9.079 6.900
339 2HG2 VAL 39 2HG2 VAL 39 -12.064 7.924 5.739
340 3HG2 VAL 39 3HG2 VAL 39 -10.556 7.569 6.581
341 H ASP 40 H ASP 40 -13.106 8.327 11.039
342 HA ASP 40 HA ASP 40 -13.828 5.607 11.862
343 1HB ASP 40 2HB ASP 40 -11.931 6.935 13.246
344 2HB ASP 40 1HB ASP 40 -13.369 7.548 14.056
345 H THR 41 H THR 41 -15.947 5.634 11.399
346 HA THR 41 HA THR 41 -17.628 7.512 12.853
347 HB THR 41 HB THR 41 -18.957 7.539 10.485
348 HG1 THR 41 1HG THR 41 -16.213 7.745 9.813
349 1HG2 THR 41 1HG2 THR 41 -17.140 9.687 10.298
350 2HG2 THR 41 2HG2 THR 41 -17.477 9.418 12.008
351 3HG2 THR 41 3HG2 THR 41 -18.804 9.700 10.880
352 HA PRO 42 HA PRO 42 -19.095 3.120 13.157
353 1HB PRO 42 2HB PRO 42 -20.453 4.480 15.436
354 2HB PRO 42 1HB PRO 42 -19.633 2.914 15.384
355 1HG PRO 42 2HG PRO 42 -18.466 5.015 16.526
356 2HG PRO 42 1HG PRO 42 -17.524 3.863 15.561
357 1HD PRO 42 2HD PRO 42 -18.454 6.610 14.858
358 2HD PRO 42 1HD PRO 42 -16.950 5.778 14.416
359 H GLU 43 H GLU 43 -20.731 6.212 13.091
360 HA GLU 43 HA GLU 43 -23.351 5.091 12.694
361 1HB GLU 43 2HB GLU 43 -23.979 7.470 12.195
362 2HB GLU 43 1HB GLU 43 -23.245 7.219 13.773
363 1HG GLU 43 2HG GLU 43 -21.191 8.156 13.070
364 2HG GLU 43 1HG GLU 43 -21.685 8.137 11.378
365 H THR 44 H THR 44 -20.732 6.233 10.684
366 HA THR 44 HA THR 44 -22.059 5.129 8.348
367 HB THR 44 HB THR 44 -21.019 7.961 8.256
368 HG1 THR 44 1HG THR 44 -23.217 8.569 8.261
369 1HG2 THR 44 1HG2 THR 44 -21.189 6.589 6.129
370 2HG2 THR 44 2HG2 THR 44 -22.019 8.145 6.154
371 3HG2 THR 44 3HG2 THR 44 -22.937 6.653 6.362
372 H LYS 45 H LYS 45 -20.599 3.832 7.471
373 HA LYS 45 HA LYS 45 -17.881 4.804 7.049
374 1HB LYS 45 2HB LYS 45 -18.056 3.465 9.239
375 2HB LYS 45 1HB LYS 45 -18.303 2.060 8.214
376 1HG LYS 45 2HG LYS 45 -16.074 1.882 8.361
377 2HG LYS 45 1HG LYS 45 -16.089 3.094 7.079
378 1HD LYS 45 2HD LYS 45 -16.300 4.549 9.449
379 2HD LYS 45 1HD LYS 45 -15.108 3.293 9.791
380 1HE LYS 45 2HE LYS 45 -15.049 5.257 7.502
381 2HE LYS 45 1HE LYS 45 -14.013 5.276 8.928
382 1HZ LYS 45 1HZ LYS 45 -12.654 3.795 8.013
383 2HZ LYS 45 2HZ LYS 45 -13.469 4.044 6.553
384 3HZ LYS 45 3HZ LYS 45 -13.920 2.766 7.565
385 H HIS 46 H HIS 46 -20.057 2.016 6.632
386 HA HIS 46 HA HIS 46 -19.154 1.854 3.835
387 1HB HIS 46 2HB HIS 46 -19.651 -0.685 4.129
388 2HB HIS 46 1HB HIS 46 -18.123 -0.037 4.716
389 HD1 HIS 46 1HD HIS 46 -21.556 -0.959 6.055
390 HD2 HIS 46 2HD HIS 46 -17.620 -0.580 7.332
391 HE1 HIS 46 1HE HIS 46 -21.535 -1.798 8.426
392 HE2 HIS 46 2HE HIS 46 -19.125 -1.643 9.147
393 HA PRO 47 HA PRO 47 -23.768 2.134 4.006
394 1HB PRO 47 2HB PRO 47 -24.085 4.275 2.433
395 2HB PRO 47 1HB PRO 47 -23.643 4.441 4.139
396 1HG PRO 47 2HG PRO 47 -21.907 4.604 1.706
397 2HG PRO 47 1HG PRO 47 -21.894 5.618 3.162
398 1HD PRO 47 2HD PRO 47 -20.158 3.528 2.709
399 2HD PRO 47 1HD PRO 47 -20.588 4.140 4.318
400 H LYS 48 H LYS 48 -21.476 1.282 1.762
401 HA LYS 48 HA LYS 48 -23.488 0.869 -0.345
402 1HB LYS 48 2HB LYS 48 -20.653 1.618 -0.415
403 2HB LYS 48 1HB LYS 48 -21.073 0.333 -1.541
404 1HG LYS 48 2HG LYS 48 -23.074 2.312 -1.756
405 2HG LYS 48 1HG LYS 48 -21.514 3.136 -1.769
406 1HD LYS 48 2HD LYS 48 -21.070 0.987 -3.420
407 2HD LYS 48 1HD LYS 48 -22.746 1.406 -3.780
408 1HE LYS 48 2HE LYS 48 -22.013 3.057 -5.072
409 2HE LYS 48 1HE LYS 48 -21.326 3.833 -3.645
410 1HZ LYS 48 1HZ LYS 48 -19.251 3.065 -4.113
411 2HZ LYS 48 2HZ LYS 48 -19.845 3.188 -5.692
412 3HZ LYS 48 3HZ LYS 48 -19.801 1.683 -4.920
413 H LYS 49 H LYS 49 -20.415 -0.839 -0.181
414 HA LYS 49 HA LYS 49 -21.930 -3.342 0.122
415 1HB LYS 49 2HB LYS 49 -19.904 -2.527 -1.710
416 2HB LYS 49 1HB LYS 49 -19.251 -3.832 -0.729
417 1HG LYS 49 2HG LYS 49 -21.971 -4.266 -1.761
418 2HG LYS 49 1HG LYS 49 -20.692 -4.196 -2.975
419 1HD LYS 49 2HD LYS 49 -19.443 -5.913 -1.732
420 2HD LYS 49 1HD LYS 49 -20.757 -6.001 -0.556
421 1HE LYS 49 2HE LYS 49 -21.928 -6.298 -3.101
422 2HE LYS 49 1HE LYS 49 -20.495 -7.323 -3.086
423 1HZ LYS 49 1HZ LYS 49 -21.401 -8.096 -0.825
424 2HZ LYS 49 2HZ LYS 49 -22.127 -8.689 -2.232
425 3HZ LYS 49 3HZ LYS 49 -22.874 -7.451 -1.353
426 H GLY 50 H GLY 50 -19.093 -1.574 1.245
427 1HA GLY 50 2HA GLY 50 -18.096 -1.657 3.335
428 2HA GLY 50 1HA GLY 50 -19.205 -2.945 3.778
429 H VAL 51 H VAL 51 -17.999 -4.016 0.965
430 HA VAL 51 HA VAL 51 -15.621 -5.217 2.208
431 HB VAL 51 HB VAL 51 -16.119 -7.333 1.088
432 1HG1 VAL 51 1HG1 VAL 51 -17.676 -6.145 3.216
433 2HG1 VAL 51 2HG1 VAL 51 -16.992 -7.766 3.088
434 3HG1 VAL 51 3HG1 VAL 51 -18.571 -7.417 2.387
435 1HG2 VAL 51 1HG2 VAL 51 -17.705 -5.881 -0.558
436 2HG2 VAL 51 2HG2 VAL 51 -18.909 -6.625 0.496
437 3HG2 VAL 51 3HG2 VAL 51 -17.778 -7.638 -0.404
438 H GLU 52 H GLU 52 -15.954 -2.965 0.339
439 HA GLU 52 HA GLU 52 -14.965 -3.913 -2.210
440 1HB GLU 52 2HB GLU 52 -15.945 -1.368 -1.108
441 2HB GLU 52 1HB GLU 52 -14.613 -1.188 -2.242
442 1HG GLU 52 2HG GLU 52 -15.892 -2.517 -3.888
443 2HG GLU 52 1HG GLU 52 -17.242 -2.557 -2.755
444 H LYS 53 H LYS 53 -13.778 -2.312 0.652
445 HA LYS 53 HA LYS 53 -11.056 -3.031 -0.063
446 1HB LYS 53 2HB LYS 53 -10.335 -0.737 0.852
447 2HB LYS 53 1HB LYS 53 -10.893 -0.853 -0.808
448 1HG LYS 53 2HG LYS 53 -12.822 0.300 -0.395
449 2HG LYS 53 1HG LYS 53 -12.886 -0.202 1.294
450 1HD LYS 53 2HD LYS 53 -10.953 1.278 1.760
451 2HD LYS 53 1HD LYS 53 -11.022 1.839 0.088
452 1HE LYS 53 2HE LYS 53 -12.157 3.314 1.789
453 2HE LYS 53 1HE LYS 53 -13.142 2.831 0.409
454 1HZ LYS 53 1HZ LYS 53 -13.972 2.638 2.914
455 2HZ LYS 53 2HZ LYS 53 -13.267 1.110 2.752
456 3HZ LYS 53 3HZ LYS 53 -14.496 1.589 1.694
457 H TYR 54 H TYR 54 -13.344 -3.528 1.980
458 HA TYR 54 HA TYR 54 -11.604 -3.425 4.359
459 1HB TYR 54 2HB TYR 54 -13.542 -1.815 4.444
460 2HB TYR 54 1HB TYR 54 -14.608 -3.215 4.356
461 HD1 TYR 54 1HD TYR 54 -14.285 -5.025 6.185
462 HD2 TYR 54 2HD TYR 54 -12.855 -1.032 6.527
463 HE1 TYR 54 1HE TYR 54 -14.185 -5.276 8.631
464 HE2 TYR 54 2HE TYR 54 -12.749 -1.273 8.973
465 HH TYR 54 HH TYR 54 -12.536 -3.154 10.631
466 H GLY 55 H GLY 55 -13.808 -5.167 2.352
467 1HA GLY 55 2HA GLY 55 -14.641 -7.271 3.885
468 2HA GLY 55 1HA GLY 55 -14.235 -7.399 2.177
469 HA PRO 56 HA PRO 56 -11.389 -10.002 5.017
470 1HB PRO 56 2HB PRO 56 -12.277 -12.066 3.071
471 2HB PRO 56 1HB PRO 56 -12.041 -12.189 4.818
472 1HG PRO 56 2HG PRO 56 -14.492 -12.077 3.789
473 2HG PRO 56 1HG PRO 56 -14.100 -11.229 5.296
474 1HD PRO 56 2HD PRO 56 -14.424 -10.134 2.533
475 2HD PRO 56 1HD PRO 56 -14.932 -9.441 4.085
476 H GLU 57 H GLU 57 -11.464 -8.730 1.926
477 HA GLU 57 HA GLU 57 -9.088 -10.194 1.057
478 1HB GLU 57 2HB GLU 57 -11.223 -8.751 -0.304
479 2HB GLU 57 1HB GLU 57 -9.625 -8.353 -0.925
480 1HG GLU 57 2HG GLU 57 -9.310 -10.941 -0.951
481 2HG GLU 57 1HG GLU 57 -11.072 -10.955 -0.939
482 H ALA 58 H ALA 58 -10.076 -6.762 1.595
483 HA ALA 58 HA ALA 58 -7.812 -5.424 0.984
484 1HB ALA 58 1HB ALA 58 -8.456 -3.740 2.461
485 2HB ALA 58 2HB ALA 58 -9.125 -4.885 3.624
486 3HB ALA 58 3HB ALA 58 -9.967 -4.578 2.105
487 H SER 59 H SER 59 -8.345 -7.049 4.114
488 HA SER 59 HA SER 59 -5.790 -6.536 5.164
489 1HB SER 59 2HB SER 59 -6.309 -8.165 6.836
490 2HB SER 59 1HB SER 59 -7.828 -7.366 6.432
491 HG SER 59 HG SER 59 -6.940 -9.948 5.753
492 H ALA 60 H ALA 60 -7.077 -9.348 3.426
493 HA ALA 60 HA ALA 60 -4.918 -11.037 3.474
494 1HB ALA 60 1HB ALA 60 -6.919 -11.848 2.549
495 2HB ALA 60 2HB ALA 60 -5.762 -11.834 1.217
496 3HB ALA 60 3HB ALA 60 -6.978 -10.562 1.343
497 H PHE 61 H PHE 61 -5.425 -8.217 1.430
498 HA PHE 61 HA PHE 61 -3.454 -8.567 -0.472
499 1HB PHE 61 2HB PHE 61 -5.029 -6.723 -0.581
500 2HB PHE 61 1HB PHE 61 -4.354 -6.012 0.880
501 HD1 PHE 61 1HD PHE 61 -2.646 -4.447 0.732
502 HD2 PHE 61 2HD PHE 61 -3.474 -6.953 -2.606
503 HE1 PHE 61 1HE PHE 61 -1.081 -3.133 -0.637
504 HE2 PHE 61 2HE PHE 61 -1.909 -5.643 -3.981
505 HZ PHE 61 HZ PHE 61 -0.709 -3.731 -2.996
506 H THR 62 H THR 62 -3.084 -6.713 2.558
507 HA THR 62 HA THR 62 -0.215 -6.721 2.322
508 HB THR 62 HB THR 62 -0.575 -5.847 4.821
509 HG1 THR 62 1HG THR 62 -2.707 -6.091 5.085
510 1HG2 THR 62 1HG2 THR 62 0.219 -4.086 3.732
511 2HG2 THR 62 2HG2 THR 62 -1.464 -3.628 3.470
512 3HG2 THR 62 3HG2 THR 62 -0.595 -4.539 2.235
513 H LYS 63 H LYS 63 -2.652 -8.562 3.999
514 HA LYS 63 HA LYS 63 -1.049 -9.818 5.925
515 1HB LYS 63 2HB LYS 63 -3.587 -9.813 5.766
516 2HB LYS 63 1HB LYS 63 -3.417 -11.087 4.567
517 1HG LYS 63 2HG LYS 63 -3.686 -12.389 6.391
518 2HG LYS 63 1HG LYS 63 -1.940 -12.162 6.500
519 1HD LYS 63 2HD LYS 63 -2.589 -11.654 8.649
520 2HD LYS 63 1HD LYS 63 -2.606 -10.053 7.904
521 1HE LYS 63 2HE LYS 63 -4.609 -10.564 9.306
522 2HE LYS 63 1HE LYS 63 -4.976 -10.120 7.639
523 1HZ LYS 63 1HZ LYS 63 -6.154 -12.137 8.678
524 2HZ LYS 63 2HZ LYS 63 -4.701 -12.955 8.398
525 3HZ LYS 63 3HZ LYS 63 -5.552 -12.277 7.103
526 H LYS 64 H LYS 64 -1.267 -10.263 2.514
527 HA LYS 64 HA LYS 64 -0.057 -12.903 2.589
528 1HB LYS 64 2HB LYS 64 -1.809 -12.387 0.911
529 2HB LYS 64 1HB LYS 64 -0.766 -11.146 0.228
530 1HG LYS 64 2HG LYS 64 0.715 -12.695 -0.656
531 2HG LYS 64 1HG LYS 64 0.176 -13.976 0.431
532 1HD LYS 64 2HD LYS 64 -1.708 -12.790 -1.573
533 2HD LYS 64 1HD LYS 64 -0.553 -14.036 -2.057
534 1HE LYS 64 2HE LYS 64 -1.526 -15.644 -0.696
535 2HE LYS 64 1HE LYS 64 -2.303 -14.444 0.335
536 1HZ LYS 64 1HZ LYS 64 -3.476 -13.924 -1.992
537 2HZ LYS 64 2HZ LYS 64 -4.099 -15.022 -0.866
538 3HZ LYS 64 3HZ LYS 64 -3.197 -15.581 -2.182
539 H MET 65 H MET 65 0.721 -9.564 1.937
540 HA MET 65 HA MET 65 3.210 -9.859 0.714
541 1HB MET 65 2HB MET 65 1.653 -7.742 1.816
542 2HB MET 65 1HB MET 65 3.294 -7.588 2.427
543 1HG MET 65 2HG MET 65 4.194 -7.428 0.251
544 2HG MET 65 1HG MET 65 2.677 -7.939 -0.489
545 1HE MET 65 1HE MET 65 0.298 -5.573 0.736
546 2HE MET 65 2HE MET 65 0.648 -6.869 -0.408
547 3HE MET 65 3HE MET 65 0.572 -5.198 -0.966
548 H VAL 66 H VAL 66 2.267 -10.620 3.907
549 HA VAL 66 HA VAL 66 5.081 -10.665 4.776
550 HB VAL 66 HB VAL 66 4.272 -10.545 7.077
551 1HG1 VAL 66 1HG1 VAL 66 4.002 -8.274 7.086
552 2HG1 VAL 66 2HG1 VAL 66 2.853 -8.296 5.746
553 3HG1 VAL 66 3HG1 VAL 66 4.578 -8.498 5.435
554 1HG2 VAL 66 1HG2 VAL 66 1.567 -10.498 5.766
555 2HG2 VAL 66 2HG2 VAL 66 1.835 -9.907 7.406
556 3HG2 VAL 66 3HG2 VAL 66 2.162 -11.595 7.011
557 H GLU 67 H GLU 67 2.008 -12.437 4.875
558 HA GLU 67 HA GLU 67 3.117 -14.708 6.207
559 1HB GLU 67 2HB GLU 67 0.623 -13.871 5.984
560 2HB GLU 67 1HB GLU 67 0.631 -14.911 4.565
561 1HG GLU 67 2HG GLU 67 1.272 -16.809 5.946
562 2HG GLU 67 1HG GLU 67 1.300 -15.772 7.372
563 H ASN 68 H ASN 68 1.749 -14.451 2.925
564 HA ASN 68 HA ASN 68 3.153 -16.824 2.090
565 1HB ASN 68 2HB ASN 68 0.823 -15.685 1.296
566 2HB ASN 68 1HB ASN 68 1.905 -15.105 0.032
567 1HD2 ASN 68 1HD2 ASN 68 2.557 -16.469 -1.527
568 2HD2 ASN 68 2HD2 ASN 68 2.107 -18.135 -1.619
569 H ALA 69 H ALA 69 3.345 -13.362 1.402
570 HA ALA 69 HA ALA 69 5.465 -13.571 -0.478
571 1HB ALA 69 1HB ALA 69 3.754 -11.558 0.430
572 2HB ALA 69 2HB ALA 69 4.990 -11.428 -0.825
573 3HB ALA 69 3HB ALA 69 5.382 -11.012 0.843
574 H LYS 70 H LYS 70 7.441 -11.914 0.159
575 HA LYS 70 HA LYS 70 8.544 -12.887 2.707
576 1HB LYS 70 2HB LYS 70 9.383 -13.841 0.306
577 2HB LYS 70 1HB LYS 70 10.480 -12.483 0.518
578 1HG LYS 70 2HG LYS 70 10.615 -13.641 2.964
579 2HG LYS 70 1HG LYS 70 10.349 -15.048 1.931
580 1HD LYS 70 2HD LYS 70 12.224 -14.033 0.467
581 2HD LYS 70 1HD LYS 70 12.611 -13.082 1.903
582 1HE LYS 70 2HE LYS 70 12.514 -15.424 3.086
583 2HE LYS 70 1HE LYS 70 12.813 -16.023 1.455
584 1HZ LYS 70 1HZ LYS 70 14.892 -15.137 1.409
585 2HZ LYS 70 2HZ LYS 70 14.771 -15.421 3.072
586 3HZ LYS 70 3HZ LYS 70 14.516 -13.865 2.459
587 H LYS 71 H LYS 71 9.162 -10.580 0.054
588 HA LYS 71 HA LYS 71 9.368 -8.419 1.971
589 1HB LYS 71 2HB LYS 71 11.694 -9.722 1.340
590 2HB LYS 71 1HB LYS 71 11.680 -8.423 0.156
591 1HG LYS 71 2HG LYS 71 12.028 -6.824 1.706
592 2HG LYS 71 1HG LYS 71 11.062 -7.646 2.932
593 1HD LYS 71 2HD LYS 71 12.835 -9.066 3.531
594 2HD LYS 71 1HD LYS 71 13.740 -8.694 2.062
595 1HE LYS 71 2HE LYS 71 14.890 -7.299 3.394
596 2HE LYS 71 1HE LYS 71 13.507 -6.228 3.168
597 1HZ LYS 71 1HZ LYS 71 14.330 -7.725 5.516
598 2HZ LYS 71 2HZ LYS 71 12.666 -7.699 5.217
599 3HZ LYS 71 3HZ LYS 71 13.511 -6.247 5.404
600 H ILE 72 H ILE 72 9.942 -6.311 0.735
601 HA ILE 72 HA ILE 72 8.933 -6.338 -2.009
602 HB ILE 72 HB ILE 72 7.788 -4.446 0.041
603 1HG1 ILE 72 2HG1 ILE 72 5.674 -5.948 -0.557
604 2HG1 ILE 72 1HG1 ILE 72 6.921 -7.167 -0.806
605 1HG2 ILE 72 1HG2 ILE 72 6.660 -3.468 -1.626
606 2HG2 ILE 72 2HG2 ILE 72 6.323 -5.003 -2.429
607 3HG2 ILE 72 3HG2 ILE 72 7.878 -4.206 -2.665
608 1HD1 ILE 72 1HD1 ILE 72 7.269 -7.413 1.381
609 2HD1 ILE 72 2HD1 ILE 72 5.716 -6.599 1.567
610 3HD1 ILE 72 3HD1 ILE 72 7.215 -5.676 1.684
611 H GLU 73 H GLU 73 9.637 -4.641 -3.275
612 HA GLU 73 HA GLU 73 11.622 -2.855 -2.026
613 1HB GLU 73 2HB GLU 73 12.821 -2.861 -4.162
614 2HB GLU 73 1HB GLU 73 12.666 -4.490 -3.518
615 1HG GLU 73 2HG GLU 73 10.427 -4.046 -5.167
616 2HG GLU 73 1HG GLU 73 11.842 -3.466 -6.045
617 H VAL 74 H VAL 74 11.961 -0.792 -3.252
618 HA VAL 74 HA VAL 74 9.369 0.213 -4.221
619 HB VAL 74 HB VAL 74 10.130 1.279 -2.145
620 1HG1 VAL 74 1HG1 VAL 74 12.315 2.776 -3.397
621 2HG1 VAL 74 2HG1 VAL 74 12.646 1.060 -3.165
622 3HG1 VAL 74 3HG1 VAL 74 12.199 2.066 -1.787
623 1HG2 VAL 74 1HG2 VAL 74 9.082 2.502 -4.310
624 2HG2 VAL 74 2HG2 VAL 74 10.529 3.478 -4.061
625 3HG2 VAL 74 3HG2 VAL 74 9.350 3.302 -2.762
626 H GLU 75 H GLU 75 9.346 0.314 -6.366
627 HA GLU 75 HA GLU 75 11.793 0.867 -7.846
628 1HB GLU 75 2HB GLU 75 9.024 0.014 -8.678
629 2HB GLU 75 1HB GLU 75 10.255 0.474 -9.845
630 1HG GLU 75 2HG GLU 75 11.705 -1.299 -8.627
631 2HG GLU 75 1HG GLU 75 10.154 -1.898 -8.039
632 H PHE 76 H PHE 76 12.293 2.771 -8.699
633 HA PHE 76 HA PHE 76 12.253 5.009 -9.079
634 1HB PHE 76 2HB PHE 76 10.134 5.746 -10.399
635 2HB PHE 76 1HB PHE 76 11.259 4.607 -11.125
636 HD1 PHE 76 1HD PHE 76 7.923 5.076 -9.738
637 HD2 PHE 76 2HD PHE 76 10.657 2.272 -11.404
638 HE1 PHE 76 1HE PHE 76 6.074 3.493 -10.095
639 HE2 PHE 76 2HE PHE 76 8.813 0.683 -11.765
640 HZ PHE 76 HZ PHE 76 6.518 1.292 -11.112
641 H ASP 77 H ASP 77 11.035 7.111 -8.799
642 HA ASP 77 HA ASP 77 9.851 7.079 -6.134
643 1HB ASP 77 2HB ASP 77 10.167 9.575 -6.282
644 2HB ASP 77 1HB ASP 77 11.652 8.633 -6.384
645 H LYS 78 H LYS 78 8.854 7.274 -9.370
646 HA LYS 78 HA LYS 78 6.751 7.387 -10.250
647 1HB LYS 78 2HB LYS 78 6.191 7.056 -7.531
648 2HB LYS 78 1HB LYS 78 5.249 8.459 -8.016
649 1HG LYS 78 2HG LYS 78 5.133 6.149 -9.835
650 2HG LYS 78 1HG LYS 78 4.399 5.923 -8.248
651 1HD LYS 78 2HD LYS 78 2.644 7.180 -8.800
652 2HD LYS 78 1HD LYS 78 3.681 8.486 -9.373
653 1HE LYS 78 2HE LYS 78 3.185 6.023 -11.016
654 2HE LYS 78 1HE LYS 78 2.083 7.399 -11.055
655 1HZ LYS 78 1HZ LYS 78 4.106 7.188 -12.709
656 2HZ LYS 78 2HZ LYS 78 4.930 7.937 -11.436
657 3HZ LYS 78 3HZ LYS 78 3.587 8.692 -12.131
658 H GLY 79 H GLY 79 8.455 9.911 -8.841
659 1HA GLY 79 2HA GLY 79 8.601 11.994 -10.029
660 2HA GLY 79 1HA GLY 79 6.893 11.847 -10.409
661 H GLN 80 H GLN 80 5.367 12.033 -8.588
662 HA GLN 80 HA GLN 80 6.367 13.996 -6.640
663 1HB GLN 80 2HB GLN 80 3.930 13.783 -8.229
664 2HB GLN 80 1HB GLN 80 3.598 14.074 -6.527
665 1HG GLN 80 2HG GLN 80 4.423 16.166 -6.582
666 2HG GLN 80 1HG GLN 80 5.696 15.751 -7.728
667 1HE2 GLN 80 1HE2 GLN 80 5.021 17.864 -8.617
668 2HE2 GLN 80 2HE2 GLN 80 3.734 17.883 -9.770
669 H ARG 81 H ARG 81 6.805 13.128 -4.730
670 HA ARG 81 HA ARG 81 5.098 10.946 -3.735
671 1HB ARG 81 2HB ARG 81 7.981 11.610 -3.405
672 2HB ARG 81 1HB ARG 81 7.165 10.847 -2.048
673 1HG ARG 81 2HG ARG 81 6.353 9.185 -3.939
674 2HG ARG 81 1HG ARG 81 7.824 9.760 -4.727
675 1HD ARG 81 2HD ARG 81 8.257 9.125 -1.928
676 2HD ARG 81 1HD ARG 81 7.637 7.744 -2.832
677 HE ARG 81 HE ARG 81 9.627 7.626 -3.969
678 1HH1 ARG 81 1HH1 ARG 81 9.466 10.666 -2.260
679 2HH1 ARG 81 2HH1 ARG 81 11.120 11.070 -2.571
680 1HH2 ARG 81 1HH2 ARG 81 11.802 8.158 -4.377
681 2HH2 ARG 81 2HH2 ARG 81 12.446 9.648 -3.774
682 H THR 82 H THR 82 6.352 14.127 -3.049
683 HA THR 82 HA THR 82 5.197 14.156 -0.382
684 HB THR 82 HB THR 82 6.173 16.420 -0.228
685 HG1 THR 82 1HG THR 82 5.969 16.876 -2.511
686 1HG2 THR 82 1HG2 THR 82 7.596 14.495 0.330
687 2HG2 THR 82 2HG2 THR 82 8.507 15.861 -0.313
688 3HG2 THR 82 3HG2 THR 82 8.169 14.465 -1.337
689 H ASP 83 H ASP 83 4.220 16.575 0.022
690 HA ASP 83 HA ASP 83 2.506 18.044 -0.343
691 1HB ASP 83 2HB ASP 83 3.389 18.002 -2.766
692 2HB ASP 83 1HB ASP 83 2.065 16.886 -3.088
693 H LYS 84 H LYS 84 1.695 15.047 -2.102
694 HA LYS 84 HA LYS 84 -0.993 14.999 -1.260
695 1HB LYS 84 2HB LYS 84 -0.979 12.659 -2.069
696 2HB LYS 84 1HB LYS 84 -0.287 13.783 -3.229
697 1HG LYS 84 2HG LYS 84 1.939 13.033 -1.911
698 2HG LYS 84 1HG LYS 84 0.967 11.568 -1.755
699 1HD LYS 84 2HD LYS 84 2.286 11.392 -3.752
700 2HD LYS 84 1HD LYS 84 0.600 11.623 -4.218
701 1HE LYS 84 2HE LYS 84 1.718 14.194 -3.985
702 2HE LYS 84 1HE LYS 84 2.901 13.217 -4.855
703 1HZ LYS 84 1HZ LYS 84 0.679 12.495 -6.106
704 2HZ LYS 84 2HZ LYS 84 1.626 13.807 -6.600
705 3HZ LYS 84 3HZ LYS 84 0.242 14.068 -5.664
706 H TYR 85 H TYR 85 1.892 14.209 0.384
707 HA TYR 85 HA TYR 85 0.633 13.707 2.825
708 1HB TYR 85 2HB TYR 85 0.394 11.498 1.211
709 2HB TYR 85 1HB TYR 85 1.849 11.127 2.129
710 HD1 TYR 85 1HD TYR 85 1.745 10.920 4.585
711 HD2 TYR 85 2HD TYR 85 -1.762 11.518 2.253
712 HE1 TYR 85 1HE TYR 85 0.365 10.200 6.489
713 HE2 TYR 85 2HE TYR 85 -3.152 10.801 4.150
714 HH TYR 85 HH TYR 85 -3.053 10.585 6.532
715 H GLY 86 H GLY 86 3.439 13.175 0.780
716 1HA GLY 86 2HA GLY 86 5.540 14.210 1.438
717 2HA GLY 86 1HA GLY 86 5.146 13.808 3.102
718 H ARG 87 H ARG 87 4.157 11.148 1.696
719 HA ARG 87 HA ARG 87 6.271 9.726 0.665
720 1HB ARG 87 2HB ARG 87 6.928 10.394 3.264
721 2HB ARG 87 1HB ARG 87 6.287 8.768 3.429
722 1HG ARG 87 2HG ARG 87 8.255 7.983 2.805
723 2HG ARG 87 1HG ARG 87 7.984 8.683 1.207
724 1HD ARG 87 2HD ARG 87 10.047 9.555 1.895
725 2HD ARG 87 1HD ARG 87 8.891 10.853 2.195
726 HE ARG 87 HE ARG 87 9.035 9.455 4.552
727 1HH1 ARG 87 1HH1 ARG 87 11.308 11.132 2.503
728 2HH1 ARG 87 2HH1 ARG 87 12.356 11.569 3.811
729 1HH2 ARG 87 1HH2 ARG 87 10.410 10.029 6.274
730 2HH2 ARG 87 2HH2 ARG 87 11.847 10.943 5.951
731 H GLY 88 H GLY 88 3.297 9.915 0.872
732 1HA GLY 88 2HA GLY 88 2.491 7.350 1.946
733 2HA GLY 88 1HA GLY 88 1.444 8.547 1.203
734 H LEU 89 H LEU 89 2.491 8.876 -1.277
735 HA LEU 89 HA LEU 89 1.643 6.475 -2.575
736 1HB LEU 89 2HB LEU 89 2.227 9.223 -3.321
737 2HB LEU 89 1HB LEU 89 2.817 8.083 -4.515
738 HG LEU 89 HG LEU 89 0.276 7.153 -4.036
739 1HD1 LEU 89 1HD1 LEU 89 0.268 9.666 -2.898
740 2HD1 LEU 89 2HD1 LEU 89 -1.147 8.752 -3.425
741 3HD1 LEU 89 3HD1 LEU 89 -0.408 9.935 -4.506
742 1HD2 LEU 89 1HD2 LEU 89 0.956 7.212 -6.231
743 2HD2 LEU 89 2HD2 LEU 89 1.520 8.880 -6.126
744 3HD2 LEU 89 3HD2 LEU 89 -0.207 8.538 -6.200
745 H ALA 90 H ALA 90 2.900 4.741 -2.656
746 HA ALA 90 HA ALA 90 5.605 5.021 -3.715
747 1HB ALA 90 1HB ALA 90 5.147 3.294 -1.302
748 2HB ALA 90 2HB ALA 90 5.648 4.980 -1.165
749 3HB ALA 90 3HB ALA 90 6.675 3.819 -2.007
750 H TYR 91 H TYR 91 5.850 3.638 -5.341
751 HA TYR 91 HA TYR 91 3.925 1.711 -6.029
752 1HB TYR 91 2HB TYR 91 6.459 2.668 -7.094
753 2HB TYR 91 1HB TYR 91 6.253 0.937 -7.343
754 HD1 TYR 91 1HD TYR 91 4.183 4.044 -7.618
755 HD2 TYR 91 2HD TYR 91 5.287 0.311 -9.337
756 HE1 TYR 91 1HE TYR 91 2.721 4.505 -9.541
757 HE2 TYR 91 2HE TYR 91 3.829 0.762 -11.265
758 HH TYR 91 HH TYR 91 1.923 2.107 -11.859
759 H ILE 92 H ILE 92 3.504 -0.080 -4.932
760 HA ILE 92 HA ILE 92 5.544 -1.370 -3.331
761 HB ILE 92 HB ILE 92 3.246 -1.133 -2.470
762 1HG1 ILE 92 2HG1 ILE 92 3.109 -3.944 -2.390
763 2HG1 ILE 92 1HG1 ILE 92 4.817 -3.555 -2.551
764 1HG2 ILE 92 1HG2 ILE 92 2.109 -1.435 -4.657
765 2HG2 ILE 92 2HG2 ILE 92 1.417 -2.408 -3.360
766 3HG2 ILE 92 3HG2 ILE 92 2.468 -3.158 -4.561
767 1HD1 ILE 92 1HD1 ILE 92 4.405 -1.908 -0.625
768 2HD1 ILE 92 2HD1 ILE 92 4.480 -3.633 -0.263
769 3HD1 ILE 92 3HD1 ILE 92 2.917 -2.820 -0.366
770 H TYR 93 H TYR 93 6.772 -3.004 -3.977
771 HA TYR 93 HA TYR 93 5.808 -4.765 -6.118
772 1HB TYR 93 2HB TYR 93 8.345 -3.181 -6.048
773 2HB TYR 93 1HB TYR 93 8.353 -4.765 -6.816
774 HD1 TYR 93 1HD TYR 93 8.236 -1.475 -7.587
775 HD2 TYR 93 2HD TYR 93 5.985 -5.014 -8.302
776 HE1 TYR 93 1HE TYR 93 7.331 -0.475 -9.642
777 HE2 TYR 93 2HE TYR 93 5.073 -4.024 -10.360
778 HH TYR 93 HH TYR 93 5.290 -0.758 -11.081
779 H ALA 94 H ALA 94 5.375 -6.344 -4.551
780 HA ALA 94 HA ALA 94 7.429 -7.240 -2.748
781 1HB ALA 94 1HB ALA 94 4.911 -7.292 -2.336
782 2HB ALA 94 2HB ALA 94 5.837 -8.722 -1.876
783 3HB ALA 94 3HB ALA 94 4.895 -8.722 -3.367
784 H ASP 95 H ASP 95 9.149 -7.910 -4.029
785 HA ASP 95 HA ASP 95 10.419 -9.354 -5.240
786 1HB ASP 95 2HB ASP 95 8.915 -10.901 -3.577
787 2HB ASP 95 1HB ASP 95 8.474 -11.574 -5.144
788 H GLY 96 H GLY 96 9.104 -7.673 -6.827
789 1HA GLY 96 2HA GLY 96 8.379 -7.358 -8.982
790 2HA GLY 96 1HA GLY 96 9.024 -8.960 -9.307
791 H LYS 97 H LYS 97 6.550 -8.562 -6.913
792 HA LYS 97 HA LYS 97 4.630 -9.825 -8.752
793 1HB LYS 97 2HB LYS 97 5.475 -11.128 -6.711
794 2HB LYS 97 1HB LYS 97 4.520 -10.008 -5.749
795 1HG LYS 97 2HG LYS 97 3.275 -12.033 -6.123
796 2HG LYS 97 1HG LYS 97 2.507 -10.696 -6.981
797 1HD LYS 97 2HD LYS 97 4.498 -12.132 -8.570
798 2HD LYS 97 1HD LYS 97 3.133 -13.132 -8.068
799 1HE LYS 97 2HE LYS 97 1.707 -11.112 -8.887
800 2HE LYS 97 1HE LYS 97 3.162 -10.684 -9.786
801 1HZ LYS 97 1HZ LYS 97 2.304 -13.449 -10.008
802 2HZ LYS 97 2HZ LYS 97 2.905 -12.403 -11.192
803 3HZ LYS 97 3HZ LYS 97 1.283 -12.308 -10.726
804 H MET 98 H MET 98 2.755 -8.824 -9.146
805 HA MET 98 HA MET 98 2.167 -6.381 -7.624
806 1HB MET 98 2HB MET 98 2.407 -6.679 -10.309
807 2HB MET 98 1HB MET 98 0.677 -6.928 -10.117
808 1HG MET 98 2HG MET 98 0.492 -4.776 -8.978
809 2HG MET 98 1HG MET 98 2.225 -4.529 -9.165
810 1HE MET 98 1HE MET 98 0.466 -1.972 -11.607
811 2HE MET 98 2HE MET 98 1.008 -2.235 -9.950
812 3HE MET 98 3HE MET 98 -0.607 -2.744 -10.441
813 H VAL 99 H VAL 99 1.169 -7.507 -5.887
814 HA VAL 99 HA VAL 99 -1.015 -9.278 -6.241
815 HB VAL 99 HB VAL 99 -1.489 -8.748 -3.807
816 1HG1 VAL 99 1HG1 VAL 99 1.377 -9.522 -4.207
817 2HG1 VAL 99 2HG1 VAL 99 0.069 -10.555 -4.783
818 3HG1 VAL 99 3HG1 VAL 99 0.196 -10.169 -3.068
819 1HG2 VAL 99 1HG2 VAL 99 -0.105 -6.472 -4.254
820 2HG2 VAL 99 2HG2 VAL 99 1.158 -7.481 -3.554
821 3HG2 VAL 99 3HG2 VAL 99 -0.333 -7.188 -2.659
822 H ASN 100 H ASN 100 -0.762 -5.858 -6.381
823 HA ASN 100 HA ASN 100 -3.266 -5.028 -5.511
824 1HB ASN 100 2HB ASN 100 -1.127 -3.744 -6.510
825 2HB ASN 100 1HB ASN 100 -2.170 -3.702 -7.929
826 1HD2 ASN 100 1HD2 ASN 100 -1.640 -2.540 -4.732
827 2HD2 ASN 100 2HD2 ASN 100 -2.910 -1.369 -4.714
828 H GLU 101 H GLU 101 -2.339 -5.543 -8.916
829 HA GLU 101 HA GLU 101 -4.942 -5.447 -9.935
830 1HB GLU 101 2HB GLU 101 -2.472 -5.553 -11.037
831 2HB GLU 101 1HB GLU 101 -3.022 -7.193 -11.347
832 1HG GLU 101 2HG GLU 101 -4.971 -5.105 -12.000
833 2HG GLU 101 1HG GLU 101 -3.490 -5.064 -12.956
834 H ALA 102 H ALA 102 -3.347 -7.933 -8.194
835 HA ALA 102 HA ALA 102 -4.981 -10.078 -9.236
836 1HB ALA 102 1HB ALA 102 -2.773 -9.859 -7.257
837 2HB ALA 102 2HB ALA 102 -2.941 -10.922 -8.655
838 3HB ALA 102 3HB ALA 102 -3.845 -11.258 -7.178
839 H LEU 103 H LEU 103 -4.720 -8.296 -6.159
840 HA LEU 103 HA LEU 103 -7.311 -9.455 -5.376
841 1HB LEU 103 2HB LEU 103 -5.512 -9.994 -3.842
842 2HB LEU 103 1HB LEU 103 -5.108 -8.297 -3.673
843 HG LEU 103 HG LEU 103 -7.847 -9.235 -2.919
844 1HD1 LEU 103 1HD1 LEU 103 -6.271 -10.776 -1.823
845 2HD1 LEU 103 2HD1 LEU 103 -7.101 -9.728 -0.674
846 3HD1 LEU 103 3HD1 LEU 103 -5.431 -9.391 -1.125
847 1HD2 LEU 103 1HD2 LEU 103 -7.809 -6.968 -2.713
848 2HD2 LEU 103 2HD2 LEU 103 -6.077 -6.912 -2.390
849 3HD2 LEU 103 3HD2 LEU 103 -7.196 -7.405 -1.118
850 H VAL 104 H VAL 104 -5.443 -6.425 -5.156
851 HA VAL 104 HA VAL 104 -7.510 -4.812 -4.214
852 HB VAL 104 HB VAL 104 -5.203 -3.979 -5.973
853 1HG1 VAL 104 1HG1 VAL 104 -7.179 -2.435 -4.331
854 2HG1 VAL 104 2HG1 VAL 104 -6.669 -2.165 -5.997
855 3HG1 VAL 104 3HG1 VAL 104 -5.572 -1.792 -4.668
856 1HG2 VAL 104 1HG2 VAL 104 -5.435 -4.029 -2.965
857 2HG2 VAL 104 2HG2 VAL 104 -4.051 -3.454 -3.896
858 3HG2 VAL 104 3HG2 VAL 104 -4.496 -5.160 -3.940
859 H ARG 105 H ARG 105 -7.131 -6.202 -7.314
860 HA ARG 105 HA ARG 105 -8.285 -4.320 -8.995
861 1HB ARG 105 2HB ARG 105 -7.438 -6.936 -9.229
862 2HB ARG 105 1HB ARG 105 -9.163 -7.054 -9.549
863 1HG ARG 105 2HG ARG 105 -7.488 -5.000 -10.935
864 2HG ARG 105 1HG ARG 105 -7.555 -6.663 -11.517
865 1HD ARG 105 2HD ARG 105 -10.213 -5.827 -11.003
866 2HD ARG 105 1HD ARG 105 -9.422 -4.547 -11.922
867 HE ARG 105 HE ARG 105 -8.745 -6.782 -13.281
868 1HH1 ARG 105 1HH1 ARG 105 -11.799 -5.500 -12.179
869 2HH1 ARG 105 2HH1 ARG 105 -12.703 -6.198 -13.479
870 1HH2 ARG 105 1HH2 ARG 105 -9.934 -7.701 -14.992
871 2HH2 ARG 105 2HH2 ARG 105 -11.646 -7.449 -15.076
872 H GLN 106 H GLN 106 -9.748 -6.173 -6.476
873 HA GLN 106 HA GLN 106 -12.442 -5.700 -7.496
874 1HB GLN 106 2HB GLN 106 -11.284 -7.376 -5.306
875 2HB GLN 106 1HB GLN 106 -12.984 -6.932 -5.241
876 1HG GLN 106 2HG GLN 106 -13.326 -8.767 -6.449
877 2HG GLN 106 1HG GLN 106 -12.727 -7.818 -7.808
878 1HE2 GLN 106 1HE2 GLN 106 -10.850 -8.375 -8.756
879 2HE2 GLN 106 2HE2 GLN 106 -9.855 -9.694 -8.256
880 H GLY 107 H GLY 107 -10.612 -3.535 -6.442
881 1HA GLY 107 2HA GLY 107 -11.331 -1.473 -5.538
882 2HA GLY 107 1HA GLY 107 -12.619 -2.320 -4.693
883 H LEU 108 H LEU 108 -10.013 -4.164 -4.165
884 HA LEU 108 HA LEU 108 -8.224 -4.148 -2.676
885 1HB LEU 108 2HB LEU 108 -8.802 -1.527 -2.442
886 2HB LEU 108 1HB LEU 108 -9.345 -2.095 -0.874
887 HG LEU 108 HG LEU 108 -6.580 -2.556 -1.987
888 1HD1 LEU 108 1HD1 LEU 108 -6.000 -0.876 -0.136
889 2HD1 LEU 108 2HD1 LEU 108 -7.697 -0.401 -0.230
890 3HD1 LEU 108 3HD1 LEU 108 -6.660 -0.254 -1.649
891 1HD2 LEU 108 1HD2 LEU 108 -7.833 -3.062 0.702
892 2HD2 LEU 108 2HD2 LEU 108 -6.091 -3.060 0.422
893 3HD2 LEU 108 3HD2 LEU 108 -7.115 -4.238 -0.397
894 H ALA 109 H ALA 109 -10.974 -5.322 -2.687
895 HA ALA 109 HA ALA 109 -10.723 -6.898 -0.404
896 1HB ALA 109 1HB ALA 109 -13.046 -5.033 -0.092
897 2HB ALA 109 2HB ALA 109 -11.485 -4.740 0.668
898 3HB ALA 109 3HB ALA 109 -12.401 -6.187 1.069
899 H LYS 110 H LYS 110 -13.363 -7.658 0.067
900 HA LYS 110 HA LYS 110 -14.907 -7.967 -2.270
901 1HB LYS 110 2HB LYS 110 -12.643 -9.610 -2.249
902 2HB LYS 110 1HB LYS 110 -13.966 -10.666 -1.774
903 1HG LYS 110 2HG LYS 110 -14.099 -8.898 -4.198
904 2HG LYS 110 1HG LYS 110 -13.449 -10.539 -4.240
905 1HD LYS 110 2HD LYS 110 -16.098 -10.186 -2.966
906 2HD LYS 110 1HD LYS 110 -16.023 -9.970 -4.717
907 1HE LYS 110 2HE LYS 110 -14.885 -12.372 -3.306
908 2HE LYS 110 1HE LYS 110 -16.541 -12.307 -3.905
909 1HZ LYS 110 1HZ LYS 110 -14.076 -12.026 -5.536
910 2HZ LYS 110 2HZ LYS 110 -15.653 -11.878 -6.131
911 3HZ LYS 110 3HZ LYS 110 -15.117 -13.360 -5.516
Start of MODEL 3
1 1H ALA 1 1HT ALA 1 22.485 21.240 -19.186
2 2H ALA 1 2HT ALA 1 21.720 19.856 -18.522
3 3H ALA 1 3HT ALA 1 21.650 21.358 -17.695
4 HA ALA 1 HA ALA 1 20.216 22.275 -19.176
5 1HB ALA 1 1HB ALA 1 19.736 21.357 -21.367
6 2HB ALA 1 2HB ALA 1 20.805 19.991 -21.051
7 3HB ALA 1 3HB ALA 1 21.470 21.620 -21.181
8 H THR 2 H THR 2 20.072 18.744 -19.646
9 HA THR 2 HA THR 2 17.620 18.707 -18.020
10 HB THR 2 HB THR 2 16.833 18.607 -20.265
11 HG1 THR 2 1HG THR 2 15.951 16.516 -20.322
12 1HG2 THR 2 1HG2 THR 2 18.867 16.450 -20.771
13 2HG2 THR 2 2HG2 THR 2 18.864 18.075 -21.457
14 3HG2 THR 2 3HG2 THR 2 17.589 16.934 -21.885
15 H SER 3 H SER 3 17.871 17.404 -16.343
16 HA SER 3 HA SER 3 20.016 15.505 -16.215
17 1HB SER 3 2HB SER 3 19.079 16.902 -14.279
18 2HB SER 3 1HB SER 3 17.757 15.735 -14.231
19 HG SER 3 HG SER 3 20.500 15.032 -14.061
20 H THR 4 H THR 4 19.888 13.268 -16.090
21 HA THR 4 HA THR 4 17.598 12.112 -17.454
22 HB THR 4 HB THR 4 18.973 10.075 -17.572
23 HG1 THR 4 1HG THR 4 20.072 10.413 -15.559
24 1HG2 THR 4 1HG2 THR 4 21.108 11.838 -18.338
25 2HG2 THR 4 2HG2 THR 4 19.548 12.467 -18.868
26 3HG2 THR 4 3HG2 THR 4 20.051 10.844 -19.341
27 H LYS 5 H LYS 5 16.335 10.422 -16.648
28 HA LYS 5 HA LYS 5 15.901 10.509 -13.810
29 1HB LYS 5 2HB LYS 5 14.263 10.084 -15.929
30 2HB LYS 5 1HB LYS 5 14.528 8.430 -15.398
31 1HG LYS 5 2HG LYS 5 13.928 9.358 -13.052
32 2HG LYS 5 1HG LYS 5 13.209 10.688 -13.962
33 1HD LYS 5 2HD LYS 5 12.575 7.806 -14.542
34 2HD LYS 5 1HD LYS 5 11.673 8.754 -13.356
35 1HE LYS 5 2HE LYS 5 11.197 10.418 -15.144
36 2HE LYS 5 1HE LYS 5 11.972 9.334 -16.300
37 1HZ LYS 5 1HZ LYS 5 10.226 7.679 -15.173
38 2HZ LYS 5 2HZ LYS 5 9.875 8.598 -16.550
39 3HZ LYS 5 3HZ LYS 5 9.370 9.132 -15.025
40 H LYS 6 H LYS 6 16.195 8.880 -12.314
41 HA LYS 6 HA LYS 6 17.749 6.547 -13.217
42 1HB LYS 6 2HB LYS 6 18.162 8.128 -10.673
43 2HB LYS 6 1HB LYS 6 19.033 6.667 -11.118
44 1HG LYS 6 2HG LYS 6 19.915 7.851 -13.105
45 2HG LYS 6 1HG LYS 6 19.125 9.323 -12.534
46 1HD LYS 6 2HD LYS 6 20.429 8.920 -10.350
47 2HD LYS 6 1HD LYS 6 21.415 7.818 -11.313
48 1HE LYS 6 2HE LYS 6 22.221 9.524 -12.669
49 2HE LYS 6 1HE LYS 6 20.896 10.611 -12.256
50 1HZ LYS 6 1HZ LYS 6 22.978 11.271 -11.206
51 2HZ LYS 6 2HZ LYS 6 23.070 9.781 -10.410
52 3HZ LYS 6 3HZ LYS 6 21.816 10.858 -10.047
53 H LEU 7 H LEU 7 17.388 4.599 -12.149
54 HA LEU 7 HA LEU 7 15.119 4.565 -10.271
55 1HB LEU 7 2HB LEU 7 15.405 3.264 -12.860
56 2HB LEU 7 1HB LEU 7 15.023 2.126 -11.584
57 HG LEU 7 HG LEU 7 13.048 3.043 -12.831
58 1HD1 LEU 7 1HD1 LEU 7 12.668 2.025 -10.722
59 2HD1 LEU 7 2HD1 LEU 7 11.742 3.526 -10.746
60 3HD1 LEU 7 3HD1 LEU 7 13.264 3.443 -9.859
61 1HD2 LEU 7 1HD2 LEU 7 13.989 5.366 -12.989
62 2HD2 LEU 7 2HD2 LEU 7 13.595 5.565 -11.282
63 3HD2 LEU 7 3HD2 LEU 7 12.311 5.272 -12.453
64 H HIS 8 H HIS 8 16.088 4.102 -8.382
65 HA HIS 8 HA HIS 8 18.038 1.898 -8.330
66 1HB HIS 8 2HB HIS 8 18.322 4.419 -7.319
67 2HB HIS 8 1HB HIS 8 17.743 3.546 -5.903
68 HD1 HIS 8 1HD HIS 8 19.386 0.914 -7.234
69 HD2 HIS 8 2HD HIS 8 20.807 4.563 -5.843
70 HE1 HIS 8 1HE HIS 8 21.807 0.523 -6.675
71 HE2 HIS 8 2HE HIS 8 22.669 2.769 -5.926
72 H LYS 9 H LYS 9 17.386 0.022 -7.537
73 HA LYS 9 HA LYS 9 14.821 -0.236 -6.269
74 1HB LYS 9 2HB LYS 9 16.985 -2.285 -6.775
75 2HB LYS 9 1HB LYS 9 15.363 -2.651 -6.203
76 1HG LYS 9 2HG LYS 9 14.391 -1.954 -8.254
77 2HG LYS 9 1HG LYS 9 15.919 -1.268 -8.814
78 1HD LYS 9 2HD LYS 9 16.752 -3.284 -9.421
79 2HD LYS 9 1HD LYS 9 15.969 -4.129 -8.084
80 1HE LYS 9 2HE LYS 9 13.841 -3.332 -9.621
81 2HE LYS 9 1HE LYS 9 15.067 -3.713 -10.830
82 1HZ LYS 9 1HZ LYS 9 14.110 -5.520 -8.675
83 2HZ LYS 9 2HZ LYS 9 15.341 -5.890 -9.776
84 3HZ LYS 9 3HZ LYS 9 13.759 -5.656 -10.326
85 H GLU 10 H GLU 10 14.540 0.250 -4.197
86 HA GLU 10 HA GLU 10 16.688 -0.420 -2.296
87 1HB GLU 10 2HB GLU 10 14.814 1.884 -2.475
88 2HB GLU 10 1HB GLU 10 15.256 1.320 -0.871
89 1HG GLU 10 2HG GLU 10 17.525 1.646 -2.683
90 2HG GLU 10 1HG GLU 10 16.646 3.138 -2.347
91 HA PRO 11 HA PRO 11 13.919 -3.407 -0.541
92 1HB PRO 11 2HB PRO 11 15.010 -3.548 1.964
93 2HB PRO 11 1HB PRO 11 15.699 -4.347 0.547
94 1HG PRO 11 2HG PRO 11 16.475 -1.753 1.824
95 2HG PRO 11 1HG PRO 11 17.514 -3.047 1.194
96 1HD PRO 11 2HD PRO 11 17.050 -0.795 -0.201
97 2HD PRO 11 1HD PRO 11 17.241 -2.369 -1.002
98 H ALA 12 H ALA 12 11.901 -2.976 0.053
99 HA ALA 12 HA ALA 12 11.413 -1.344 2.421
100 1HB ALA 12 1HB ALA 12 10.261 0.319 1.427
101 2HB ALA 12 2HB ALA 12 9.580 -0.745 0.196
102 3HB ALA 12 3HB ALA 12 11.222 -0.125 0.017
103 H THR 13 H THR 13 10.398 -2.800 3.657
104 HA THR 13 HA THR 13 8.179 -4.318 2.446
105 HB THR 13 HB THR 13 8.765 -5.885 4.519
106 HG1 THR 13 1HG THR 13 10.495 -5.010 5.405
107 1HG2 THR 13 1HG2 THR 13 10.192 -5.869 1.881
108 2HG2 THR 13 2HG2 THR 13 8.777 -6.810 2.351
109 3HG2 THR 13 3HG2 THR 13 10.351 -7.169 3.062
110 H LEU 14 H LEU 14 6.236 -4.239 3.456
111 HA LEU 14 HA LEU 14 5.776 -2.261 5.432
112 1HB LEU 14 2HB LEU 14 3.810 -4.438 4.863
113 2HB LEU 14 1HB LEU 14 3.514 -2.747 5.219
114 HG LEU 14 HG LEU 14 4.867 -2.580 2.848
115 1HD1 LEU 14 1HD1 LEU 14 4.552 -4.333 1.493
116 2HD1 LEU 14 2HD1 LEU 14 2.932 -4.650 2.114
117 3HD1 LEU 14 3HD1 LEU 14 4.343 -5.244 2.989
118 1HD2 LEU 14 1HD2 LEU 14 2.514 -1.739 3.807
119 2HD2 LEU 14 2HD2 LEU 14 1.940 -2.947 2.657
120 3HD2 LEU 14 3HD2 LEU 14 2.958 -1.618 2.104
121 H ILE 15 H ILE 15 6.316 -2.446 7.502
122 HA ILE 15 HA ILE 15 6.981 -4.835 8.801
123 HB ILE 15 HB ILE 15 7.727 -2.633 9.592
124 1HG1 ILE 15 2HG1 ILE 15 6.561 -3.190 12.080
125 2HG1 ILE 15 1HG1 ILE 15 6.616 -4.738 11.247
126 1HG2 ILE 15 1HG2 ILE 15 6.122 -1.278 10.972
127 2HG2 ILE 15 2HG2 ILE 15 4.826 -2.272 10.303
128 3HG2 ILE 15 3HG2 ILE 15 5.814 -1.276 9.235
129 1HD1 ILE 15 1HD1 ILE 15 8.745 -4.921 11.802
130 2HD1 ILE 15 2HD1 ILE 15 8.714 -3.317 12.537
131 3HD1 ILE 15 3HD1 ILE 15 9.107 -3.496 10.827
132 H LYS 16 H LYS 16 3.936 -3.164 8.443
133 HA LYS 16 HA LYS 16 2.465 -5.479 9.256
134 1HB LYS 16 2HB LYS 16 3.189 -3.978 11.371
135 2HB LYS 16 1HB LYS 16 1.716 -3.135 10.913
136 1HG LYS 16 2HG LYS 16 1.915 -6.081 11.501
137 2HG LYS 16 1HG LYS 16 1.327 -4.850 12.620
138 1HD LYS 16 2HD LYS 16 -0.278 -4.289 10.594
139 2HD LYS 16 1HD LYS 16 0.051 -5.972 10.178
140 1HE LYS 16 2HE LYS 16 -1.969 -5.719 11.564
141 2HE LYS 16 1HE LYS 16 -0.731 -6.700 12.347
142 1HZ LYS 16 1HZ LYS 16 -1.935 -4.876 13.688
143 2HZ LYS 16 2HZ LYS 16 -0.885 -3.812 12.898
144 3HZ LYS 16 3HZ LYS 16 -0.261 -5.051 13.864
145 H ALA 17 H ALA 17 1.520 -5.298 7.233
146 HA ALA 17 HA ALA 17 0.068 -2.842 6.599
147 1HB ALA 17 1HB ALA 17 0.403 -5.301 4.892
148 2HB ALA 17 2HB ALA 17 1.516 -3.933 4.891
149 3HB ALA 17 3HB ALA 17 -0.157 -3.709 4.379
150 H ILE 18 H ILE 18 -1.860 -2.730 7.570
151 HA ILE 18 HA ILE 18 -3.452 -5.075 8.088
152 HB ILE 18 HB ILE 18 -4.301 -2.196 8.381
153 1HG1 ILE 18 2HG1 ILE 18 -3.585 -3.356 10.883
154 2HG1 ILE 18 1HG1 ILE 18 -2.235 -3.596 9.778
155 1HG2 ILE 18 1HG2 ILE 18 -5.236 -4.422 10.120
156 2HG2 ILE 18 2HG2 ILE 18 -5.902 -4.280 8.493
157 3HG2 ILE 18 3HG2 ILE 18 -6.066 -2.944 9.633
158 1HD1 ILE 18 1HD1 ILE 18 -2.558 -1.401 11.261
159 2HD1 ILE 18 2HD1 ILE 18 -3.432 -0.903 9.812
160 3HD1 ILE 18 3HD1 ILE 18 -1.744 -1.400 9.697
161 H ASP 19 H ASP 19 -3.897 -2.121 6.149
162 HA ASP 19 HA ASP 19 -4.849 -1.839 4.085
163 1HB ASP 19 2HB ASP 19 -4.372 -4.529 4.015
164 2HB ASP 19 1HB ASP 19 -6.124 -4.479 3.845
165 H GLY 20 H GLY 20 -6.485 -3.114 6.827
166 1HA GLY 20 2HA GLY 20 -9.152 -2.929 5.981
167 2HA GLY 20 1HA GLY 20 -8.599 -2.788 7.643
168 H ASP 21 H ASP 21 -6.856 -0.470 6.859
169 HA ASP 21 HA ASP 21 -8.519 1.608 5.888
170 1HB ASP 21 2HB ASP 21 -8.526 1.068 8.803
171 2HB ASP 21 1HB ASP 21 -8.351 2.754 8.323
172 H THR 22 H THR 22 -5.782 0.766 7.972
173 HA THR 22 HA THR 22 -4.255 2.935 6.691
174 HB THR 22 HB THR 22 -3.648 2.088 9.497
175 HG1 THR 22 1HG THR 22 -5.520 2.803 10.090
176 1HG2 THR 22 1HG2 THR 22 -2.164 3.710 9.342
177 2HG2 THR 22 2HG2 THR 22 -3.484 4.864 9.152
178 3HG2 THR 22 3HG2 THR 22 -2.739 4.132 7.730
179 H VAL 23 H VAL 23 -1.925 2.597 6.641
180 HA VAL 23 HA VAL 23 -0.959 -0.108 7.083
181 HB VAL 23 HB VAL 23 -0.562 1.056 4.341
182 1HG1 VAL 23 1HG1 VAL 23 0.457 -0.887 3.846
183 2HG1 VAL 23 2HG1 VAL 23 -0.682 -1.846 4.791
184 3HG1 VAL 23 3HG1 VAL 23 0.649 -1.013 5.593
185 1HG2 VAL 23 1HG2 VAL 23 -2.938 0.892 4.498
186 2HG2 VAL 23 2HG2 VAL 23 -2.835 -0.696 5.257
187 3HG2 VAL 23 3HG2 VAL 23 -2.372 -0.494 3.568
188 H LYS 24 H LYS 24 1.281 -0.236 7.272
189 HA LYS 24 HA LYS 24 2.743 2.312 7.054
190 1HB LYS 24 2HB LYS 24 2.189 1.675 9.418
191 2HB LYS 24 1HB LYS 24 3.175 0.237 9.205
192 1HG LYS 24 2HG LYS 24 5.146 1.562 8.882
193 2HG LYS 24 1HG LYS 24 4.197 3.049 8.887
194 1HD LYS 24 2HD LYS 24 4.045 3.092 11.134
195 2HD LYS 24 1HD LYS 24 3.844 1.343 11.254
196 1HE LYS 24 2HE LYS 24 6.139 0.954 11.223
197 2HE LYS 24 1HE LYS 24 6.493 2.534 10.523
198 1HZ LYS 24 1HZ LYS 24 5.384 3.269 12.816
199 2HZ LYS 24 2HZ LYS 24 7.045 2.989 12.647
200 3HZ LYS 24 3HZ LYS 24 6.048 1.789 13.300
201 H LEU 25 H LEU 25 4.911 2.200 6.426
202 HA LEU 25 HA LEU 25 5.874 -0.441 5.565
203 1HB LEU 25 2HB LEU 25 5.391 1.964 3.953
204 2HB LEU 25 1HB LEU 25 6.963 1.232 3.704
205 HG LEU 25 HG LEU 25 4.739 -0.683 3.651
206 1HD1 LEU 25 1HD1 LEU 25 4.629 1.766 2.062
207 2HD1 LEU 25 2HD1 LEU 25 3.380 0.561 2.381
208 3HD1 LEU 25 3HD1 LEU 25 4.561 0.289 1.099
209 1HD2 LEU 25 1HD2 LEU 25 6.793 -1.540 2.997
210 2HD2 LEU 25 2HD2 LEU 25 7.225 -0.089 2.091
211 3HD2 LEU 25 3HD2 LEU 25 6.009 -1.198 1.455
212 H MET 26 H MET 26 8.184 -0.615 5.322
213 HA MET 26 HA MET 26 9.640 1.302 7.024
214 1HB MET 26 2HB MET 26 9.488 -0.953 7.990
215 2HB MET 26 1HB MET 26 10.219 -1.628 6.540
216 1HG MET 26 2HG MET 26 12.299 -0.984 7.119
217 2HG MET 26 1HG MET 26 11.746 0.497 7.894
218 1HE MET 26 1HE MET 26 12.876 -2.926 8.037
219 2HE MET 26 2HE MET 26 11.405 -3.603 8.736
220 3HE MET 26 3HE MET 26 12.850 -3.422 9.728
221 H TYR 27 H TYR 27 10.465 2.699 5.531
222 HA TYR 27 HA TYR 27 11.949 1.571 3.262
223 1HB TYR 27 2HB TYR 27 10.193 3.245 2.757
224 2HB TYR 27 1HB TYR 27 11.063 4.425 3.731
225 HD1 TYR 27 1HD TYR 27 12.670 5.787 2.738
226 HD2 TYR 27 2HD TYR 27 11.472 2.219 0.756
227 HE1 TYR 27 1HE TYR 27 13.988 6.446 0.770
228 HE2 TYR 27 2HE TYR 27 12.788 2.867 -1.217
229 HH TYR 27 HH TYR 27 14.640 4.289 -1.811
230 H LYS 28 H LYS 28 14.002 1.178 3.809
231 HA LYS 28 HA LYS 28 16.100 1.425 4.675
232 1HB LYS 28 2HB LYS 28 15.923 3.177 2.823
233 2HB LYS 28 1HB LYS 28 15.727 4.360 4.108
234 1HG LYS 28 2HG LYS 28 17.908 3.613 5.043
235 2HG LYS 28 1HG LYS 28 18.106 2.583 3.623
236 1HD LYS 28 2HD LYS 28 18.579 4.324 2.264
237 2HD LYS 28 1HD LYS 28 17.436 5.399 3.071
238 1HE LYS 28 2HE LYS 28 19.101 5.434 5.005
239 2HE LYS 28 1HE LYS 28 20.247 4.709 3.878
240 1HZ LYS 28 1HZ LYS 28 19.955 7.329 4.187
241 2HZ LYS 28 2HZ LYS 28 18.851 7.074 2.931
242 3HZ LYS 28 3HZ LYS 28 20.469 6.622 2.738
243 H GLY 29 H GLY 29 14.038 1.512 6.637
244 1HA GLY 29 2HA GLY 29 14.294 1.701 8.975
245 2HA GLY 29 1HA GLY 29 15.489 2.965 8.721
246 H GLN 30 H GLN 30 13.522 4.201 6.727
247 HA GLN 30 HA GLN 30 12.148 5.816 8.706
248 1HB GLN 30 2HB GLN 30 13.345 6.915 6.862
249 2HB GLN 30 1HB GLN 30 12.304 6.102 5.701
250 1HG GLN 30 2HG GLN 30 11.338 8.178 5.829
251 2HG GLN 30 1HG GLN 30 10.381 7.264 6.994
252 1HE2 GLN 30 1HE2 GLN 30 9.929 8.450 8.694
253 2HE2 GLN 30 2HE2 GLN 30 10.989 9.567 9.476
254 HA PRO 31 HA PRO 31 8.399 3.437 8.200
255 1HB PRO 31 2HB PRO 31 6.752 5.108 9.586
256 2HB PRO 31 1HB PRO 31 7.864 3.976 10.362
257 1HG PRO 31 2HG PRO 31 8.194 6.909 9.855
258 2HG PRO 31 1HG PRO 31 8.592 5.972 11.308
259 1HD PRO 31 2HD PRO 31 10.470 6.713 9.520
260 2HD PRO 31 1HD PRO 31 10.567 5.178 10.408
261 H MET 32 H MET 32 8.007 3.655 5.992
262 HA MET 32 HA MET 32 7.049 6.101 4.850
263 1HB MET 32 2HB MET 32 8.327 4.339 3.594
264 2HB MET 32 1HB MET 32 6.896 3.320 3.681
265 1HG MET 32 2HG MET 32 5.885 4.397 2.014
266 2HG MET 32 1HG MET 32 6.349 5.981 2.633
267 1HE MET 32 1HE MET 32 8.192 7.016 -0.350
268 2HE MET 32 2HE MET 32 8.295 7.472 1.352
269 3HE MET 32 3HE MET 32 6.726 7.122 0.625
270 H THR 33 H THR 33 5.011 6.813 4.696
271 HA THR 33 HA THR 33 2.920 5.308 5.984
272 HB THR 33 HB THR 33 2.746 7.971 4.564
273 HG1 THR 33 1HG THR 33 3.450 8.867 6.344
274 1HG2 THR 33 1HG2 THR 33 0.569 7.748 4.948
275 2HG2 THR 33 2HG2 THR 33 0.978 8.016 6.642
276 3HG2 THR 33 3HG2 THR 33 0.806 6.372 6.027
277 H PHE 34 H PHE 34 1.310 4.206 5.075
278 HA PHE 34 HA PHE 34 0.796 4.476 2.206
279 1HB PHE 34 2HB PHE 34 2.387 2.560 2.607
280 2HB PHE 34 1HB PHE 34 1.115 1.783 3.546
281 HD1 PHE 34 1HD PHE 34 -0.338 0.344 2.490
282 HD2 PHE 34 2HD PHE 34 1.726 3.264 0.182
283 HE1 PHE 34 1HE PHE 34 -1.261 -0.636 0.429
284 HE2 PHE 34 2HE PHE 34 0.805 2.290 -1.881
285 HZ PHE 34 HZ PHE 34 -0.691 0.338 -1.759
286 H ARG 35 H ARG 35 -0.623 5.423 4.486
287 HA ARG 35 HA ARG 35 -2.736 3.774 5.288
288 1HB ARG 35 2HB ARG 35 -2.110 5.861 6.433
289 2HB ARG 35 1HB ARG 35 -2.693 6.786 5.056
290 1HG ARG 35 2HG ARG 35 -4.954 5.922 5.443
291 2HG ARG 35 1HG ARG 35 -4.361 5.026 6.842
292 1HD ARG 35 2HD ARG 35 -5.306 6.997 7.716
293 2HD ARG 35 1HD ARG 35 -3.562 7.255 7.751
294 HE ARG 35 HE ARG 35 -3.810 8.943 6.221
295 1HH1 ARG 35 1HH1 ARG 35 -6.757 7.078 6.345
296 2HH1 ARG 35 2HH1 ARG 35 -7.652 8.195 5.370
297 1HH2 ARG 35 1HH2 ARG 35 -4.986 10.413 4.939
298 2HH2 ARG 35 2HH2 ARG 35 -6.647 10.088 4.572
299 H LEU 36 H LEU 36 -4.515 3.101 4.325
300 HA LEU 36 HA LEU 36 -5.556 4.576 2.012
301 1HB LEU 36 2HB LEU 36 -4.166 2.585 1.312
302 2HB LEU 36 1HB LEU 36 -5.354 1.568 2.105
303 HG LEU 36 HG LEU 36 -7.000 2.945 0.500
304 1HD1 LEU 36 1HD1 LEU 36 -5.133 4.265 -0.443
305 2HD1 LEU 36 2HD1 LEU 36 -6.005 3.329 -1.656
306 3HD1 LEU 36 3HD1 LEU 36 -4.436 2.774 -1.072
307 1HD2 LEU 36 1HD2 LEU 36 -6.330 1.007 -1.217
308 2HD2 LEU 36 2HD2 LEU 36 -7.238 0.707 0.266
309 3HD2 LEU 36 3HD2 LEU 36 -5.499 0.414 0.222
310 H LEU 37 H LEU 37 -7.093 5.366 3.558
311 HA LEU 37 HA LEU 37 -8.879 3.477 4.826
312 1HB LEU 37 2HB LEU 37 -8.091 5.688 5.820
313 2HB LEU 37 1HB LEU 37 -9.205 6.466 4.710
314 HG LEU 37 HG LEU 37 -10.323 4.327 6.436
315 1HD1 LEU 37 1HD1 LEU 37 -10.587 5.848 8.323
316 2HD1 LEU 37 2HD1 LEU 37 -9.606 7.057 7.497
317 3HD1 LEU 37 3HD1 LEU 37 -8.884 5.528 7.998
318 1HD2 LEU 37 1HD2 LEU 37 -11.392 6.050 4.670
319 2HD2 LEU 37 2HD2 LEU 37 -11.556 6.991 6.154
320 3HD2 LEU 37 3HD2 LEU 37 -12.277 5.384 6.043
321 H LEU 38 H LEU 38 -10.145 2.446 3.377
322 HA LEU 38 HA LEU 38 -12.018 4.114 1.855
323 1HB LEU 38 2HB LEU 38 -10.067 2.212 0.790
324 2HB LEU 38 1HB LEU 38 -11.704 1.885 0.256
325 HG LEU 38 HG LEU 38 -10.499 3.296 -1.339
326 1HD1 LEU 38 1HD1 LEU 38 -12.167 5.349 -1.066
327 2HD1 LEU 38 2HD1 LEU 38 -12.922 4.240 0.078
328 3HD1 LEU 38 3HD1 LEU 38 -12.705 3.758 -1.606
329 1HD2 LEU 38 1HD2 LEU 38 -9.300 4.438 0.779
330 2HD2 LEU 38 2HD2 LEU 38 -10.538 5.646 0.441
331 3HD2 LEU 38 3HD2 LEU 38 -9.387 5.189 -0.814
332 H VAL 39 H VAL 39 -13.862 3.703 2.918
333 HA VAL 39 HA VAL 39 -14.875 0.987 2.924
334 HB VAL 39 HB VAL 39 -14.781 2.506 5.530
335 1HG1 VAL 39 1HG1 VAL 39 -16.652 1.023 5.420
336 2HG1 VAL 39 2HG1 VAL 39 -15.431 0.281 6.454
337 3HG1 VAL 39 3HG1 VAL 39 -15.646 -0.285 4.798
338 1HG2 VAL 39 1HG2 VAL 39 -13.037 0.238 4.576
339 2HG2 VAL 39 2HG2 VAL 39 -13.123 0.808 6.243
340 3HG2 VAL 39 3HG2 VAL 39 -12.523 1.877 4.977
341 H ASP 40 H ASP 40 -17.157 0.870 3.466
342 HA ASP 40 HA ASP 40 -18.633 3.363 3.619
343 1HB ASP 40 2HB ASP 40 -18.523 1.654 1.177
344 2HB ASP 40 1HB ASP 40 -20.079 2.347 1.623
345 H THR 41 H THR 41 -19.375 2.591 5.605
346 HA THR 41 HA THR 41 -21.119 0.222 5.475
347 HB THR 41 HB THR 41 -20.723 -0.129 7.815
348 HG1 THR 41 1HG THR 41 -20.597 1.849 8.701
349 1HG2 THR 41 1HG2 THR 41 -18.434 -0.637 7.917
350 2HG2 THR 41 2HG2 THR 41 -18.026 0.605 6.735
351 3HG2 THR 41 3HG2 THR 41 -18.901 -0.838 6.228
352 HA PRO 42 HA PRO 42 -24.047 3.803 5.840
353 1HB PRO 42 2HB PRO 42 -25.831 1.570 5.005
354 2HB PRO 42 1HB PRO 42 -25.749 3.230 4.403
355 1HG PRO 42 2HG PRO 42 -24.769 1.209 2.967
356 2HG PRO 42 1HG PRO 42 -23.947 2.779 3.017
357 1HD PRO 42 2HD PRO 42 -23.247 0.226 4.397
358 2HD PRO 42 1HD PRO 42 -22.181 1.462 3.699
359 H GLU 43 H GLU 43 -24.360 0.437 6.863
360 HA GLU 43 HA GLU 43 -25.007 1.174 9.541
361 1HB GLU 43 2HB GLU 43 -27.185 1.149 7.865
362 2HB GLU 43 1HB GLU 43 -27.213 -0.475 8.536
363 1HG GLU 43 2HG GLU 43 -27.602 0.260 10.671
364 2HG GLU 43 1HG GLU 43 -26.876 1.840 10.375
365 H THR 44 H THR 44 -23.265 -0.611 7.788
366 HA THR 44 HA THR 44 -23.059 -2.775 9.616
367 HB THR 44 HB THR 44 -23.756 -3.670 6.834
368 HG1 THR 44 1HG THR 44 -25.598 -3.391 8.970
369 1HG2 THR 44 1HG2 THR 44 -22.710 -5.141 8.718
370 2HG2 THR 44 2HG2 THR 44 -24.002 -5.768 7.694
371 3HG2 THR 44 3HG2 THR 44 -24.367 -5.182 9.318
372 H LYS 45 H LYS 45 -21.068 -3.748 9.487
373 HA LYS 45 HA LYS 45 -19.124 -2.453 7.816
374 1HB LYS 45 2HB LYS 45 -19.106 -4.229 10.145
375 2HB LYS 45 1HB LYS 45 -17.801 -4.549 9.010
376 1HG LYS 45 2HG LYS 45 -17.203 -2.137 9.117
377 2HG LYS 45 1HG LYS 45 -18.413 -1.946 10.387
378 1HD LYS 45 2HD LYS 45 -16.519 -4.145 10.822
379 2HD LYS 45 1HD LYS 45 -15.789 -2.538 10.813
380 1HE LYS 45 2HE LYS 45 -16.358 -2.702 13.021
381 2HE LYS 45 1HE LYS 45 -17.830 -1.973 12.378
382 1HZ LYS 45 1HZ LYS 45 -18.840 -4.156 12.285
383 2HZ LYS 45 2HZ LYS 45 -18.307 -3.832 13.857
384 3HZ LYS 45 3HZ LYS 45 -17.422 -4.875 12.862
385 H HIS 46 H HIS 46 -21.102 -5.201 7.495
386 HA HIS 46 HA HIS 46 -19.525 -6.065 5.169
387 1HB HIS 46 2HB HIS 46 -20.385 -8.433 5.755
388 2HB HIS 46 1HB HIS 46 -19.025 -7.787 6.670
389 HD1 HIS 46 1HD HIS 46 -19.249 -8.430 9.036
390 HD2 HIS 46 2HD HIS 46 -22.936 -7.563 7.329
391 HE1 HIS 46 1HE HIS 46 -20.928 -8.701 10.888
392 HE2 HIS 46 2HE HIS 46 -23.139 -8.070 9.856
393 HA PRO 47 HA PRO 47 -24.068 -4.983 4.278
394 1HB PRO 47 2HB PRO 47 -22.628 -3.901 1.906
395 2HB PRO 47 1HB PRO 47 -23.979 -3.212 2.814
396 1HG PRO 47 2HG PRO 47 -21.514 -2.248 3.104
397 2HG PRO 47 1HG PRO 47 -22.608 -2.392 4.491
398 1HD PRO 47 2HD PRO 47 -20.275 -4.088 3.732
399 2HD PRO 47 1HD PRO 47 -20.857 -3.621 5.342
400 H LYS 48 H LYS 48 -21.396 -6.366 2.456
401 HA LYS 48 HA LYS 48 -23.270 -7.810 0.738
402 1HB LYS 48 2HB LYS 48 -21.436 -6.692 -0.398
403 2HB LYS 48 1HB LYS 48 -20.261 -7.532 0.605
404 1HG LYS 48 2HG LYS 48 -20.151 -8.820 -1.261
405 2HG LYS 48 1HG LYS 48 -21.448 -9.663 -0.413
406 1HD LYS 48 2HD LYS 48 -22.051 -9.323 -2.739
407 2HD LYS 48 1HD LYS 48 -23.103 -8.370 -1.692
408 1HE LYS 48 2HE LYS 48 -22.041 -6.362 -2.264
409 2HE LYS 48 1HE LYS 48 -20.628 -7.193 -2.912
410 1HZ LYS 48 1HZ LYS 48 -23.262 -6.776 -4.139
411 2HZ LYS 48 2HZ LYS 48 -22.368 -8.144 -4.575
412 3HZ LYS 48 3HZ LYS 48 -21.721 -6.601 -4.816
413 H LYS 49 H LYS 49 -20.185 -9.279 1.379
414 HA LYS 49 HA LYS 49 -21.585 -11.429 2.812
415 1HB LYS 49 2HB LYS 49 -19.670 -11.412 0.647
416 2HB LYS 49 1HB LYS 49 -19.073 -12.371 1.995
417 1HG LYS 49 2HG LYS 49 -20.261 -13.803 0.496
418 2HG LYS 49 1HG LYS 49 -21.203 -13.634 1.978
419 1HD LYS 49 2HD LYS 49 -22.746 -12.174 0.947
420 2HD LYS 49 1HD LYS 49 -21.691 -11.923 -0.445
421 1HE LYS 49 2HE LYS 49 -23.097 -13.432 -1.382
422 2HE LYS 49 1HE LYS 49 -21.988 -14.569 -0.618
423 1HZ LYS 49 1HZ LYS 49 -24.425 -13.589 0.744
424 2HZ LYS 49 2HZ LYS 49 -23.473 -14.928 1.143
425 3HZ LYS 49 3HZ LYS 49 -24.437 -14.960 -0.247
426 H GLY 50 H GLY 50 -18.680 -9.419 2.828
427 1HA GLY 50 2HA GLY 50 -17.274 -8.834 4.549
428 2HA GLY 50 1HA GLY 50 -18.510 -9.423 5.650
429 H VAL 51 H VAL 51 -16.806 -11.281 3.173
430 HA VAL 51 HA VAL 51 -15.513 -12.820 5.326
431 HB VAL 51 HB VAL 51 -15.818 -14.864 3.930
432 1HG1 VAL 51 1HG1 VAL 51 -18.502 -13.682 4.531
433 2HG1 VAL 51 2HG1 VAL 51 -17.358 -14.035 5.826
434 3HG1 VAL 51 3HG1 VAL 51 -17.932 -15.332 4.778
435 1HG2 VAL 51 1HG2 VAL 51 -17.163 -12.893 2.179
436 2HG2 VAL 51 2HG2 VAL 51 -17.938 -14.469 2.341
437 3HG2 VAL 51 3HG2 VAL 51 -16.276 -14.360 1.766
438 H GLU 52 H GLU 52 -15.451 -12.210 1.819
439 HA GLU 52 HA GLU 52 -12.519 -12.452 1.897
440 1HB GLU 52 2HB GLU 52 -13.966 -12.703 -0.686
441 2HB GLU 52 1HB GLU 52 -12.487 -13.485 -0.152
442 1HG GLU 52 2HG GLU 52 -14.318 -14.588 1.521
443 2HG GLU 52 1HG GLU 52 -15.265 -14.361 0.052
444 H LYS 53 H LYS 53 -15.195 -10.945 0.193
445 HA LYS 53 HA LYS 53 -14.374 -9.066 -1.396
446 1HB LYS 53 2HB LYS 53 -16.503 -9.261 0.462
447 2HB LYS 53 1HB LYS 53 -15.918 -7.607 0.498
448 1HG LYS 53 2HG LYS 53 -17.734 -7.871 -1.106
449 2HG LYS 53 1HG LYS 53 -16.229 -7.421 -1.911
450 1HD LYS 53 2HD LYS 53 -15.921 -9.973 -2.231
451 2HD LYS 53 1HD LYS 53 -17.651 -10.059 -1.894
452 1HE LYS 53 2HE LYS 53 -16.251 -8.655 -4.151
453 2HE LYS 53 1HE LYS 53 -17.467 -9.928 -4.239
454 1HZ LYS 53 1HZ LYS 53 -18.815 -8.037 -2.936
455 2HZ LYS 53 2HZ LYS 53 -18.825 -8.195 -4.621
456 3HZ LYS 53 3HZ LYS 53 -17.802 -7.068 -3.883
457 H TYR 54 H TYR 54 -14.690 -7.961 1.932
458 HA TYR 54 HA TYR 54 -12.041 -6.829 1.974
459 1HB TYR 54 2HB TYR 54 -14.068 -5.263 0.910
460 2HB TYR 54 1HB TYR 54 -13.965 -4.724 2.584
461 HD1 TYR 54 1HD TYR 54 -11.647 -5.560 -0.235
462 HD2 TYR 54 2HD TYR 54 -12.543 -2.967 3.018
463 HE1 TYR 54 1HE TYR 54 -9.699 -4.173 -0.810
464 HE2 TYR 54 2HE TYR 54 -10.599 -1.575 2.451
465 HH TYR 54 HH TYR 54 -8.206 -2.575 0.218
466 H GLY 55 H GLY 55 -13.802 -8.703 3.478
467 1HA GLY 55 2HA GLY 55 -14.268 -7.356 6.013
468 2HA GLY 55 1HA GLY 55 -14.586 -9.051 5.647
469 HA PRO 56 HA PRO 56 -10.917 -9.396 8.292
470 1HB PRO 56 2HB PRO 56 -11.548 -12.264 8.190
471 2HB PRO 56 1HB PRO 56 -11.434 -11.195 9.591
472 1HG PRO 56 2HG PRO 56 -13.791 -12.171 8.726
473 2HG PRO 56 1HG PRO 56 -13.644 -10.561 9.457
474 1HD PRO 56 2HD PRO 56 -13.865 -11.321 6.567
475 2HD PRO 56 1HD PRO 56 -14.632 -9.977 7.441
476 H GLU 57 H GLU 57 -11.660 -10.462 5.188
477 HA GLU 57 HA GLU 57 -9.182 -11.916 4.784
478 1HB GLU 57 2HB GLU 57 -11.734 -11.612 3.348
479 2HB GLU 57 1HB GLU 57 -10.317 -11.814 2.336
480 1HG GLU 57 2HG GLU 57 -11.218 -13.677 4.521
481 2HG GLU 57 1HG GLU 57 -11.382 -13.946 2.788
482 H ALA 58 H ALA 58 -10.764 -8.902 3.640
483 HA ALA 58 HA ALA 58 -9.116 -8.028 1.697
484 1HB ALA 58 1HB ALA 58 -10.840 -6.786 3.537
485 2HB ALA 58 2HB ALA 58 -10.226 -6.135 2.018
486 3HB ALA 58 3HB ALA 58 -9.353 -5.841 3.521
487 H SER 59 H SER 59 -8.221 -8.299 5.071
488 HA SER 59 HA SER 59 -5.807 -6.823 4.924
489 1HB SER 59 2HB SER 59 -5.947 -9.105 6.818
490 2HB SER 59 1HB SER 59 -5.505 -7.423 7.110
491 HG SER 59 HG SER 59 -7.433 -7.360 7.966
492 H ALA 60 H ALA 60 -6.486 -10.302 4.774
493 HA ALA 60 HA ALA 60 -4.061 -11.435 4.480
494 1HB ALA 60 1HB ALA 60 -6.060 -12.761 4.449
495 2HB ALA 60 2HB ALA 60 -5.128 -13.112 2.994
496 3HB ALA 60 3HB ALA 60 -6.547 -12.068 2.901
497 H PHE 61 H PHE 61 -5.859 -9.775 1.900
498 HA PHE 61 HA PHE 61 -4.334 -10.264 -0.300
499 1HB PHE 61 2HB PHE 61 -6.100 -8.880 -0.798
500 2HB PHE 61 1HB PHE 61 -5.877 -7.894 0.641
501 HD1 PHE 61 1HD PHE 61 -4.957 -5.786 0.439
502 HD2 PHE 61 2HD PHE 61 -4.296 -8.640 -2.647
503 HE1 PHE 61 1HE PHE 61 -3.862 -4.053 -0.925
504 HE2 PHE 61 2HE PHE 61 -3.200 -6.914 -4.015
505 HZ PHE 61 HZ PHE 61 -2.981 -4.617 -3.154
506 H THR 62 H THR 62 -3.675 -7.847 2.201
507 HA THR 62 HA THR 62 -1.094 -7.210 1.043
508 HB THR 62 HB THR 62 -1.717 -6.203 3.745
509 HG1 THR 62 1HG THR 62 -3.783 -6.085 3.026
510 1HG2 THR 62 1HG2 THR 62 -0.958 -4.865 1.160
511 2HG2 THR 62 2HG2 THR 62 0.100 -5.223 2.526
512 3HG2 THR 62 3HG2 THR 62 -1.190 -4.034 2.699
513 H LYS 63 H LYS 63 -2.359 -8.685 4.018
514 HA LYS 63 HA LYS 63 -0.016 -9.225 5.342
515 1HB LYS 63 2HB LYS 63 -2.421 -11.036 5.195
516 2HB LYS 63 1HB LYS 63 -1.181 -11.069 6.437
517 1HG LYS 63 2HG LYS 63 -1.825 -8.845 7.169
518 2HG LYS 63 1HG LYS 63 -3.041 -8.764 5.893
519 1HD LYS 63 2HD LYS 63 -4.399 -10.347 6.915
520 2HD LYS 63 1HD LYS 63 -3.073 -11.009 7.873
521 1HE LYS 63 2HE LYS 63 -3.092 -9.176 9.353
522 2HE LYS 63 1HE LYS 63 -4.091 -8.210 8.269
523 1HZ LYS 63 1HZ LYS 63 -5.097 -10.730 9.436
524 2HZ LYS 63 2HZ LYS 63 -5.978 -9.438 8.791
525 3HZ LYS 63 3HZ LYS 63 -5.201 -9.269 10.284
526 H LYS 64 H LYS 64 -1.292 -10.749 2.497
527 HA LYS 64 HA LYS 64 0.446 -13.040 2.609
528 1HB LYS 64 2HB LYS 64 -1.488 -11.938 0.593
529 2HB LYS 64 1HB LYS 64 -0.354 -13.199 0.129
530 1HG LYS 64 2HG LYS 64 -1.258 -14.505 2.127
531 2HG LYS 64 1HG LYS 64 -2.572 -13.327 2.138
532 1HD LYS 64 2HD LYS 64 -3.360 -14.003 0.054
533 2HD LYS 64 1HD LYS 64 -1.830 -14.768 -0.381
534 1HE LYS 64 2HE LYS 64 -2.241 -16.471 1.373
535 2HE LYS 64 1HE LYS 64 -3.817 -15.737 1.672
536 1HZ LYS 64 1HZ LYS 64 -4.114 -16.123 -0.864
537 2HZ LYS 64 2HZ LYS 64 -4.345 -17.405 0.214
538 3HZ LYS 64 3HZ LYS 64 -2.898 -17.280 -0.652
539 H MET 65 H MET 65 0.414 -9.866 1.188
540 HA MET 65 HA MET 65 2.891 -10.351 -0.276
541 1HB MET 65 2HB MET 65 1.420 -7.729 -0.101
542 2HB MET 65 1HB MET 65 2.519 -8.284 -1.357
543 1HG MET 65 2HG MET 65 0.931 -9.677 -2.311
544 2HG MET 65 1HG MET 65 -0.065 -9.700 -0.857
545 1HE MET 65 1HE MET 65 0.399 -5.764 -3.181
546 2HE MET 65 2HE MET 65 1.200 -7.211 -3.794
547 3HE MET 65 3HE MET 65 1.629 -6.570 -2.207
548 H VAL 66 H VAL 66 2.074 -9.661 2.811
549 HA VAL 66 HA VAL 66 4.422 -7.943 3.254
550 HB VAL 66 HB VAL 66 1.892 -8.172 4.888
551 1HG1 VAL 66 1HG1 VAL 66 4.528 -7.005 5.488
552 2HG1 VAL 66 2HG1 VAL 66 3.278 -7.618 6.571
553 3HG1 VAL 66 3HG1 VAL 66 3.129 -6.004 5.878
554 1HG2 VAL 66 1HG2 VAL 66 1.088 -6.608 3.538
555 2HG2 VAL 66 2HG2 VAL 66 2.609 -6.541 2.648
556 3HG2 VAL 66 3HG2 VAL 66 2.375 -5.527 4.070
557 H GLU 67 H GLU 67 2.536 -10.670 4.537
558 HA GLU 67 HA GLU 67 4.704 -11.302 6.389
559 1HB GLU 67 2HB GLU 67 1.890 -11.583 6.491
560 2HB GLU 67 1HB GLU 67 2.565 -13.207 6.512
561 1HG GLU 67 2HG GLU 67 3.252 -12.995 8.607
562 2HG GLU 67 1HG GLU 67 4.008 -11.436 8.280
563 H ASN 68 H ASN 68 2.605 -13.554 4.627
564 HA ASN 68 HA ASN 68 4.541 -15.535 4.345
565 1HB ASN 68 2HB ASN 68 1.956 -14.972 2.926
566 2HB ASN 68 1HB ASN 68 2.983 -16.308 2.411
567 1HD2 ASN 68 1HD2 ASN 68 0.606 -17.043 3.171
568 2HD2 ASN 68 2HD2 ASN 68 0.601 -17.739 4.752
569 H ALA 69 H ALA 69 4.067 -12.654 2.526
570 HA ALA 69 HA ALA 69 5.212 -13.422 0.075
571 1HB ALA 69 1HB ALA 69 4.082 -11.131 1.118
572 2HB ALA 69 2HB ALA 69 4.748 -11.323 -0.503
573 3HB ALA 69 3HB ALA 69 5.750 -10.663 0.791
574 H LYS 70 H LYS 70 7.290 -12.104 -0.663
575 HA LYS 70 HA LYS 70 9.444 -13.120 1.008
576 1HB LYS 70 2HB LYS 70 9.033 -12.801 -1.790
577 2HB LYS 70 1HB LYS 70 10.424 -11.824 -1.343
578 1HG LYS 70 2HG LYS 70 11.711 -13.614 -0.916
579 2HG LYS 70 1HG LYS 70 10.382 -14.534 -0.208
580 1HD LYS 70 2HD LYS 70 9.782 -14.247 -2.944
581 2HD LYS 70 1HD LYS 70 11.489 -14.683 -2.852
582 1HE LYS 70 2HE LYS 70 9.725 -16.215 -1.074
583 2HE LYS 70 1HE LYS 70 9.428 -16.456 -2.794
584 1HZ LYS 70 1HZ LYS 70 11.096 -17.984 -1.718
585 2HZ LYS 70 2HZ LYS 70 12.134 -16.653 -1.612
586 3HZ LYS 70 3HZ LYS 70 11.614 -17.201 -3.126
587 H LYS 71 H LYS 71 9.113 -10.125 -0.908
588 HA LYS 71 HA LYS 71 9.290 -8.305 1.174
589 1HB LYS 71 2HB LYS 71 11.708 -7.603 0.923
590 2HB LYS 71 1HB LYS 71 11.436 -9.113 1.783
591 1HG LYS 71 2HG LYS 71 11.748 -10.039 -0.732
592 2HG LYS 71 1HG LYS 71 12.781 -8.608 -0.781
593 1HD LYS 71 2HD LYS 71 12.995 -10.462 1.544
594 2HD LYS 71 1HD LYS 71 13.726 -10.932 0.007
595 1HE LYS 71 2HE LYS 71 14.254 -8.190 1.024
596 2HE LYS 71 1HE LYS 71 15.054 -9.539 1.832
597 1HZ LYS 71 1HZ LYS 71 16.295 -10.020 0.003
598 2HZ LYS 71 2HZ LYS 71 16.125 -8.355 -0.231
599 3HZ LYS 71 3HZ LYS 71 15.147 -9.433 -1.093
600 H ILE 72 H ILE 72 8.893 -6.316 0.411
601 HA ILE 72 HA ILE 72 8.930 -5.940 -2.485
602 HB ILE 72 HB ILE 72 7.667 -4.191 -0.382
603 1HG1 ILE 72 2HG1 ILE 72 5.610 -5.394 -1.720
604 2HG1 ILE 72 1HG1 ILE 72 6.797 -6.691 -1.632
605 1HG2 ILE 72 1HG2 ILE 72 7.852 -2.818 -2.213
606 2HG2 ILE 72 2HG2 ILE 72 6.270 -3.551 -2.478
607 3HG2 ILE 72 3HG2 ILE 72 7.676 -4.145 -3.355
608 1HD1 ILE 72 1HD1 ILE 72 5.004 -5.878 0.346
609 2HD1 ILE 72 2HD1 ILE 72 6.605 -5.380 0.901
610 3HD1 ILE 72 3HD1 ILE 72 6.301 -7.066 0.484
611 H GLU 73 H GLU 73 9.564 -3.832 -3.331
612 HA GLU 73 HA GLU 73 11.480 -2.323 -1.740
613 1HB GLU 73 2HB GLU 73 13.150 -2.450 -3.625
614 2HB GLU 73 1HB GLU 73 12.943 -3.935 -2.707
615 1HG GLU 73 2HG GLU 73 11.100 -4.037 -4.827
616 2HG GLU 73 1HG GLU 73 12.628 -3.481 -5.506
617 H VAL 74 H VAL 74 11.623 -0.197 -2.322
618 HA VAL 74 HA VAL 74 9.728 0.690 -4.365
619 HB VAL 74 HB VAL 74 11.231 2.382 -2.364
620 1HG1 VAL 74 1HG1 VAL 74 9.241 3.917 -2.841
621 2HG1 VAL 74 2HG1 VAL 74 8.965 2.909 -4.260
622 3HG1 VAL 74 3HG1 VAL 74 10.486 3.784 -4.082
623 1HG2 VAL 74 1HG2 VAL 74 9.396 0.495 -1.688
624 2HG2 VAL 74 2HG2 VAL 74 8.364 1.901 -1.942
625 3HG2 VAL 74 3HG2 VAL 74 9.688 1.978 -0.779
626 H GLU 75 H GLU 75 10.557 0.862 -6.341
627 HA GLU 75 HA GLU 75 13.281 1.950 -6.628
628 1HB GLU 75 2HB GLU 75 13.171 0.872 -8.928
629 2HB GLU 75 1HB GLU 75 13.277 -0.219 -7.553
630 1HG GLU 75 2HG GLU 75 11.129 -0.974 -7.808
631 2HG GLU 75 1HG GLU 75 10.595 0.493 -8.626
632 H PHE 76 H PHE 76 13.146 4.061 -6.999
633 HA PHE 76 HA PHE 76 12.292 5.144 -9.385
634 1HB PHE 76 2HB PHE 76 10.191 6.079 -9.078
635 2HB PHE 76 1HB PHE 76 10.010 4.537 -8.257
636 HD1 PHE 76 1HD PHE 76 10.416 8.156 -7.794
637 HD2 PHE 76 2HD PHE 76 9.655 4.422 -5.898
638 HE1 PHE 76 1HE PHE 76 9.709 9.340 -5.756
639 HE2 PHE 76 2HE PHE 76 8.946 5.601 -3.856
640 HZ PHE 76 HZ PHE 76 8.973 8.063 -3.784
641 H ASP 77 H ASP 77 13.659 6.790 -9.556
642 HA ASP 77 HA ASP 77 14.234 8.383 -7.144
643 1HB ASP 77 2HB ASP 77 16.085 8.274 -9.507
644 2HB ASP 77 1HB ASP 77 16.449 8.678 -7.833
645 H LYS 78 H LYS 78 12.272 9.594 -7.772
646 HA LYS 78 HA LYS 78 12.975 11.707 -9.690
647 1HB LYS 78 2HB LYS 78 10.919 9.808 -10.043
648 2HB LYS 78 1HB LYS 78 10.122 11.317 -9.619
649 1HG LYS 78 2HG LYS 78 12.250 11.557 -11.630
650 2HG LYS 78 1HG LYS 78 10.842 10.614 -12.126
651 1HD LYS 78 2HD LYS 78 9.383 12.420 -11.831
652 2HD LYS 78 1HD LYS 78 10.539 13.306 -10.834
653 1HE LYS 78 2HE LYS 78 12.009 13.311 -12.960
654 2HE LYS 78 1HE LYS 78 10.512 12.917 -13.804
655 1HZ LYS 78 1HZ LYS 78 10.338 15.146 -13.888
656 2HZ LYS 78 2HZ LYS 78 11.329 15.402 -12.541
657 3HZ LYS 78 3HZ LYS 78 9.708 14.969 -12.326
658 H GLY 79 H GLY 79 10.583 10.822 -7.191
659 1HA GLY 79 2HA GLY 79 11.095 12.600 -5.253
660 2HA GLY 79 1HA GLY 79 10.285 13.611 -6.440
661 H GLN 80 H GLN 80 8.098 13.546 -6.611
662 HA GLN 80 HA GLN 80 6.709 11.800 -4.697
663 1HB GLN 80 2HB GLN 80 5.565 14.259 -6.011
664 2HB GLN 80 1HB GLN 80 4.978 13.424 -4.579
665 1HG GLN 80 2HG GLN 80 7.487 15.063 -4.830
666 2HG GLN 80 1HG GLN 80 6.035 15.459 -3.911
667 1HE2 GLN 80 1HE2 GLN 80 5.764 14.635 -1.900
668 2HE2 GLN 80 2HE2 GLN 80 6.936 13.660 -1.090
669 H ARG 81 H ARG 81 5.577 10.157 -5.470
670 HA ARG 81 HA ARG 81 5.015 10.007 -8.319
671 1HB ARG 81 2HB ARG 81 4.342 7.676 -7.818
672 2HB ARG 81 1HB ARG 81 5.976 8.041 -7.284
673 1HG ARG 81 2HG ARG 81 5.222 8.263 -5.000
674 2HG ARG 81 1HG ARG 81 3.549 8.015 -5.502
675 1HD ARG 81 2HD ARG 81 3.796 5.786 -5.667
676 2HD ARG 81 1HD ARG 81 5.413 5.917 -6.361
677 HE ARG 81 HE ARG 81 5.291 6.558 -3.559
678 1HH1 ARG 81 1HH1 ARG 81 5.644 3.993 -5.900
679 2HH1 ARG 81 2HH1 ARG 81 6.471 2.938 -4.805
680 1HH2 ARG 81 1HH2 ARG 81 6.379 5.170 -2.117
681 2HH2 ARG 81 2HH2 ARG 81 6.889 3.605 -2.657
682 H THR 82 H THR 82 3.331 10.401 -5.287
683 HA THR 82 HA THR 82 0.748 10.301 -6.685
684 HB THR 82 HB THR 82 0.828 10.595 -3.737
685 HG1 THR 82 1HG THR 82 1.610 8.205 -5.046
686 1HG2 THR 82 1HG2 THR 82 -0.990 9.079 -3.757
687 2HG2 THR 82 2HG2 THR 82 -0.675 8.626 -5.433
688 3HG2 THR 82 3HG2 THR 82 -1.265 10.244 -5.052
689 H ASP 83 H ASP 83 -0.778 11.976 -6.410
690 HA ASP 83 HA ASP 83 0.448 14.570 -5.764
691 1HB ASP 83 2HB ASP 83 -1.377 13.657 -7.869
692 2HB ASP 83 1HB ASP 83 -1.888 15.154 -7.097
693 H LYS 84 H LYS 84 -1.967 12.345 -4.794
694 HA LYS 84 HA LYS 84 -3.737 14.192 -3.535
695 1HB LYS 84 2HB LYS 84 -4.195 11.893 -2.165
696 2HB LYS 84 1HB LYS 84 -4.921 12.275 -3.718
697 1HG LYS 84 2HG LYS 84 -3.355 10.921 -4.878
698 2HG LYS 84 1HG LYS 84 -2.357 10.726 -3.436
699 1HD LYS 84 2HD LYS 84 -3.483 8.745 -3.371
700 2HD LYS 84 1HD LYS 84 -4.622 9.743 -2.463
701 1HE LYS 84 2HE LYS 84 -6.053 8.772 -3.957
702 2HE LYS 84 1HE LYS 84 -5.599 10.214 -4.862
703 1HZ LYS 84 1HZ LYS 84 -5.018 8.826 -6.477
704 2HZ LYS 84 2HZ LYS 84 -5.125 7.467 -5.477
705 3HZ LYS 84 3HZ LYS 84 -3.696 8.370 -5.525
706 H TYR 85 H TYR 85 -1.935 11.667 -1.811
707 HA TYR 85 HA TYR 85 -1.354 13.645 0.288
708 1HB TYR 85 2HB TYR 85 -2.756 11.510 0.746
709 2HB TYR 85 1HB TYR 85 -1.212 10.668 0.679
710 HD1 TYR 85 1HD TYR 85 0.430 10.941 2.433
711 HD2 TYR 85 2HD TYR 85 -3.248 13.075 2.554
712 HE1 TYR 85 1HE TYR 85 0.845 11.509 4.789
713 HE2 TYR 85 2HE TYR 85 -2.843 13.652 4.911
714 HH TYR 85 HH TYR 85 -1.064 12.226 6.873
715 H GLY 86 H GLY 86 0.047 11.487 -2.012
716 1HA GLY 86 2HA GLY 86 2.271 11.522 -2.731
717 2HA GLY 86 1HA GLY 86 2.697 12.444 -1.297
718 H ARG 87 H ARG 87 0.977 10.135 0.057
719 HA ARG 87 HA ARG 87 3.149 8.155 0.103
720 1HB ARG 87 2HB ARG 87 1.782 9.500 2.414
721 2HB ARG 87 1HB ARG 87 2.518 7.917 2.599
722 1HG ARG 87 2HG ARG 87 4.046 10.254 1.510
723 2HG ARG 87 1HG ARG 87 3.912 9.944 3.241
724 1HD ARG 87 2HD ARG 87 4.862 7.702 2.893
725 2HD ARG 87 1HD ARG 87 5.030 8.052 1.174
726 HE ARG 87 HE ARG 87 6.937 9.203 1.653
727 1HH1 ARG 87 1HH1 ARG 87 5.041 8.964 4.573
728 2HH1 ARG 87 2HH1 ARG 87 6.258 9.687 5.572
729 1HH2 ARG 87 1HH2 ARG 87 8.538 10.152 2.965
730 2HH2 ARG 87 2HH2 ARG 87 8.243 10.361 4.658
731 H GLY 88 H GLY 88 -0.254 8.830 0.166
732 1HA GLY 88 2HA GLY 88 -1.230 6.356 1.066
733 2HA GLY 88 1HA GLY 88 -2.095 7.473 0.022
734 H LEU 89 H LEU 89 -1.641 7.359 -2.300
735 HA LEU 89 HA LEU 89 -1.645 4.642 -3.184
736 1HB LEU 89 2HB LEU 89 -2.154 7.283 -4.340
737 2HB LEU 89 1HB LEU 89 -1.404 6.164 -5.462
738 HG LEU 89 HG LEU 89 -3.778 6.037 -5.743
739 1HD1 LEU 89 1HD1 LEU 89 -3.281 3.590 -4.127
740 2HD1 LEU 89 2HD1 LEU 89 -2.261 3.903 -5.532
741 3HD1 LEU 89 3HD1 LEU 89 -4.009 3.762 -5.724
742 1HD2 LEU 89 1HD2 LEU 89 -5.341 5.745 -4.042
743 2HD2 LEU 89 2HD2 LEU 89 -4.191 6.891 -3.353
744 3HD2 LEU 89 3HD2 LEU 89 -4.126 5.190 -2.890
745 H ALA 90 H ALA 90 0.113 3.450 -3.444
746 HA ALA 90 HA ALA 90 2.436 4.602 -4.789
747 1HB ALA 90 1HB ALA 90 3.944 3.473 -3.109
748 2HB ALA 90 2HB ALA 90 2.522 3.294 -2.080
749 3HB ALA 90 3HB ALA 90 3.086 4.903 -2.533
750 H TYR 91 H TYR 91 3.925 2.970 -5.607
751 HA TYR 91 HA TYR 91 2.479 0.624 -6.512
752 1HB TYR 91 2HB TYR 91 4.962 2.050 -7.325
753 2HB TYR 91 1HB TYR 91 4.856 0.333 -7.699
754 HD1 TYR 91 1HD TYR 91 2.734 -0.447 -8.960
755 HD2 TYR 91 2HD TYR 91 3.992 3.612 -8.751
756 HE1 TYR 91 1HE TYR 91 1.388 0.066 -10.954
757 HE2 TYR 91 2HE TYR 91 2.647 4.138 -10.743
758 HH TYR 91 HH TYR 91 0.317 2.022 -11.999
759 H ILE 92 H ILE 92 3.012 -1.489 -6.093
760 HA ILE 92 HA ILE 92 5.011 -1.919 -3.968
761 HB ILE 92 HB ILE 92 2.575 -3.624 -4.471
762 1HG1 ILE 92 2HG1 ILE 92 2.983 -1.451 -2.404
763 2HG1 ILE 92 1HG1 ILE 92 1.897 -1.362 -3.786
764 1HG2 ILE 92 1HG2 ILE 92 4.691 -4.508 -3.287
765 2HG2 ILE 92 2HG2 ILE 92 3.120 -4.774 -2.530
766 3HG2 ILE 92 3HG2 ILE 92 4.174 -3.488 -1.945
767 1HD1 ILE 92 1HD1 ILE 92 0.482 -3.033 -2.884
768 2HD1 ILE 92 2HD1 ILE 92 0.819 -1.883 -1.590
769 3HD1 ILE 92 3HD1 ILE 92 1.653 -3.437 -1.629
770 H TYR 93 H TYR 93 6.748 -2.959 -4.670
771 HA TYR 93 HA TYR 93 6.437 -4.928 -6.841
772 1HB TYR 93 2HB TYR 93 8.956 -3.426 -6.115
773 2HB TYR 93 1HB TYR 93 8.692 -4.439 -7.531
774 HD1 TYR 93 1HD TYR 93 9.226 -1.232 -6.765
775 HD2 TYR 93 2HD TYR 93 6.214 -3.570 -8.650
776 HE1 TYR 93 1HE TYR 93 8.495 0.743 -8.034
777 HE2 TYR 93 2HE TYR 93 5.474 -1.601 -9.923
778 HH TYR 93 HH TYR 93 5.570 0.816 -9.797
779 H ALA 94 H ALA 94 5.896 -6.496 -5.165
780 HA ALA 94 HA ALA 94 7.878 -7.234 -3.224
781 1HB ALA 94 1HB ALA 94 5.453 -7.490 -2.827
782 2HB ALA 94 2HB ALA 94 6.351 -8.991 -2.600
783 3HB ALA 94 3HB ALA 94 5.409 -8.741 -4.070
784 H ASP 95 H ASP 95 9.731 -7.802 -4.302
785 HA ASP 95 HA ASP 95 11.218 -9.179 -5.320
786 1HB ASP 95 2HB ASP 95 8.974 -11.007 -4.644
787 2HB ASP 95 1HB ASP 95 10.143 -11.591 -5.826
788 H GLY 96 H GLY 96 9.900 -7.392 -6.915
789 1HA GLY 96 2HA GLY 96 9.467 -6.912 -9.117
790 2HA GLY 96 1HA GLY 96 10.361 -8.378 -9.492
791 H LYS 97 H LYS 97 7.531 -8.524 -7.485
792 HA LYS 97 HA LYS 97 5.992 -9.588 -9.748
793 1HB LYS 97 2HB LYS 97 7.020 -11.179 -7.821
794 2HB LYS 97 1HB LYS 97 5.472 -10.774 -7.094
795 1HG LYS 97 2HG LYS 97 4.348 -12.102 -8.486
796 2HG LYS 97 1HG LYS 97 5.245 -11.532 -9.895
797 1HD LYS 97 2HD LYS 97 6.457 -13.428 -7.904
798 2HD LYS 97 1HD LYS 97 5.480 -14.000 -9.259
799 1HE LYS 97 2HE LYS 97 7.078 -13.524 -10.783
800 2HE LYS 97 1HE LYS 97 7.593 -12.064 -9.940
801 1HZ LYS 97 1HZ LYS 97 8.561 -14.789 -9.687
802 2HZ LYS 97 2HZ LYS 97 8.420 -13.929 -8.237
803 3HZ LYS 97 3HZ LYS 97 9.383 -13.324 -9.488
804 H MET 98 H MET 98 3.692 -9.492 -9.542
805 HA MET 98 HA MET 98 2.776 -7.432 -7.643
806 1HB MET 98 2HB MET 98 2.427 -7.678 -10.564
807 2HB MET 98 1HB MET 98 0.975 -7.243 -9.671
808 1HG MET 98 2HG MET 98 1.723 -5.186 -9.198
809 2HG MET 98 1HG MET 98 3.376 -5.734 -8.927
810 1HE MET 98 1HE MET 98 3.706 -2.881 -11.056
811 2HE MET 98 2HE MET 98 5.077 -3.982 -11.182
812 3HE MET 98 3HE MET 98 4.216 -3.815 -9.650
813 H VAL 99 H VAL 99 1.846 -8.677 -6.108
814 HA VAL 99 HA VAL 99 0.298 -11.005 -6.676
815 HB VAL 99 HB VAL 99 0.197 -9.443 -4.104
816 1HG1 VAL 99 1HG1 VAL 99 -0.127 -11.663 -3.115
817 2HG1 VAL 99 2HG1 VAL 99 -0.058 -12.384 -4.723
818 3HG1 VAL 99 3HG1 VAL 99 -1.374 -11.287 -4.304
819 1HG2 VAL 99 1HG2 VAL 99 2.114 -10.959 -3.404
820 2HG2 VAL 99 2HG2 VAL 99 2.515 -9.621 -4.480
821 3HG2 VAL 99 3HG2 VAL 99 2.367 -11.256 -5.123
822 H ASN 100 H ASN 100 -0.413 -7.746 -6.993
823 HA ASN 100 HA ASN 100 -2.929 -7.340 -6.009
824 1HB ASN 100 2HB ASN 100 -3.280 -5.860 -8.040
825 2HB ASN 100 1HB ASN 100 -1.830 -5.537 -7.094
826 1HD2 ASN 100 1HD2 ASN 100 -0.577 -4.679 -8.657
827 2HD2 ASN 100 2HD2 ASN 100 -0.052 -5.537 -10.062
828 H GLU 101 H GLU 101 -2.028 -9.338 -8.739
829 HA GLU 101 HA GLU 101 -4.811 -9.718 -9.514
830 1HB GLU 101 2HB GLU 101 -2.172 -10.544 -10.671
831 2HB GLU 101 1HB GLU 101 -3.650 -11.347 -11.186
832 1HG GLU 101 2HG GLU 101 -4.541 -9.364 -12.079
833 2HG GLU 101 1HG GLU 101 -3.339 -8.364 -11.265
834 H ALA 102 H ALA 102 -2.463 -11.212 -7.533
835 HA ALA 102 HA ALA 102 -2.973 -13.891 -7.665
836 1HB ALA 102 1HB ALA 102 -1.992 -14.097 -5.583
837 2HB ALA 102 2HB ALA 102 -2.675 -12.581 -4.997
838 3HB ALA 102 3HB ALA 102 -1.357 -12.560 -6.167
839 H LEU 103 H LEU 103 -4.525 -11.890 -5.135
840 HA LEU 103 HA LEU 103 -6.802 -13.741 -5.287
841 1HB LEU 103 2HB LEU 103 -7.260 -13.355 -2.974
842 2HB LEU 103 1HB LEU 103 -5.588 -13.825 -3.161
843 HG LEU 103 HG LEU 103 -5.742 -12.138 -1.473
844 1HD1 LEU 103 1HD1 LEU 103 -4.690 -10.550 -3.756
845 2HD1 LEU 103 2HD1 LEU 103 -3.912 -12.075 -3.326
846 3HD1 LEU 103 3HD1 LEU 103 -4.030 -10.779 -2.138
847 1HD2 LEU 103 1HD2 LEU 103 -6.630 -9.941 -3.176
848 2HD2 LEU 103 2HD2 LEU 103 -7.033 -10.329 -1.508
849 3HD2 LEU 103 3HD2 LEU 103 -7.869 -11.145 -2.827
850 H VAL 104 H VAL 104 -5.950 -10.332 -5.237
851 HA VAL 104 HA VAL 104 -8.522 -9.291 -4.841
852 HB VAL 104 HB VAL 104 -6.517 -7.985 -6.662
853 1HG1 VAL 104 1HG1 VAL 104 -8.919 -7.127 -6.198
854 2HG1 VAL 104 2HG1 VAL 104 -7.568 -5.995 -6.145
855 3HG1 VAL 104 3HG1 VAL 104 -8.250 -6.625 -4.645
856 1HG2 VAL 104 1HG2 VAL 104 -6.497 -8.074 -3.648
857 2HG2 VAL 104 2HG2 VAL 104 -5.580 -6.916 -4.612
858 3HG2 VAL 104 3HG2 VAL 104 -5.233 -8.640 -4.741
859 H ARG 105 H ARG 105 -7.160 -10.934 -7.526
860 HA ARG 105 HA ARG 105 -8.953 -9.884 -9.506
861 1HB ARG 105 2HB ARG 105 -6.737 -10.765 -10.109
862 2HB ARG 105 1HB ARG 105 -7.222 -12.363 -9.556
863 1HG ARG 105 2HG ARG 105 -8.707 -12.657 -11.331
864 2HG ARG 105 1HG ARG 105 -8.735 -10.934 -11.712
865 1HD ARG 105 2HD ARG 105 -6.675 -10.998 -12.756
866 2HD ARG 105 1HD ARG 105 -6.169 -12.451 -11.895
867 HE ARG 105 HE ARG 105 -7.101 -13.706 -13.558
868 1HH1 ARG 105 1HH1 ARG 105 -8.410 -10.476 -13.738
869 2HH1 ARG 105 2HH1 ARG 105 -9.257 -10.768 -15.221
870 1HH2 ARG 105 1HH2 ARG 105 -8.214 -14.090 -15.510
871 2HH2 ARG 105 2HH2 ARG 105 -9.147 -12.818 -16.226
872 H GLN 106 H GLN 106 -9.042 -12.423 -7.149
873 HA GLN 106 HA GLN 106 -10.947 -14.114 -8.330
874 1HB GLN 106 2HB GLN 106 -10.069 -13.589 -5.518
875 2HB GLN 106 1HB GLN 106 -11.489 -14.584 -5.802
876 1HG GLN 106 2HG GLN 106 -9.824 -15.788 -7.485
877 2HG GLN 106 1HG GLN 106 -8.637 -15.138 -6.355
878 1HE2 GLN 106 1HE2 GLN 106 -11.490 -17.168 -6.642
879 2HE2 GLN 106 2HE2 GLN 106 -11.188 -18.113 -5.228
880 H GLY 107 H GLY 107 -11.258 -10.951 -7.068
881 1HA GLY 107 2HA GLY 107 -13.208 -9.649 -7.457
882 2HA GLY 107 1HA GLY 107 -14.165 -11.124 -7.420
883 H LEU 108 H LEU 108 -11.732 -10.251 -5.054
884 HA LEU 108 HA LEU 108 -13.643 -9.254 -3.170
885 1HB LEU 108 2HB LEU 108 -12.768 -11.140 -1.504
886 2HB LEU 108 1HB LEU 108 -14.214 -11.321 -2.464
887 HG LEU 108 HG LEU 108 -12.509 -13.271 -2.318
888 1HD1 LEU 108 1HD1 LEU 108 -14.353 -12.398 -4.304
889 2HD1 LEU 108 2HD1 LEU 108 -13.925 -14.039 -3.826
890 3HD1 LEU 108 3HD1 LEU 108 -13.009 -13.222 -5.089
891 1HD2 LEU 108 1HD2 LEU 108 -10.603 -13.233 -3.534
892 2HD2 LEU 108 2HD2 LEU 108 -10.705 -11.505 -3.214
893 3HD2 LEU 108 3HD2 LEU 108 -11.269 -12.149 -4.754
894 H ALA 109 H ALA 109 -11.129 -10.794 -1.514
895 HA ALA 109 HA ALA 109 -8.950 -9.123 -1.997
896 1HB ALA 109 1HB ALA 109 -10.513 -7.378 -1.175
897 2HB ALA 109 2HB ALA 109 -9.046 -7.530 -0.209
898 3HB ALA 109 3HB ALA 109 -10.563 -8.212 0.378
899 H LYS 110 H LYS 110 -10.012 -11.849 -0.961
900 HA LYS 110 HA LYS 110 -8.757 -12.210 1.578
901 1HB LYS 110 2HB LYS 110 -9.132 -14.637 1.113
902 2HB LYS 110 1HB LYS 110 -10.584 -13.654 0.994
903 1HG LYS 110 2HG LYS 110 -10.905 -14.223 -1.129
904 2HG LYS 110 1HG LYS 110 -9.230 -13.872 -1.556
905 1HD LYS 110 2HD LYS 110 -8.690 -16.039 -1.541
906 2HD LYS 110 1HD LYS 110 -9.438 -16.282 0.038
907 1HE LYS 110 2HE LYS 110 -11.621 -16.031 -1.569
908 2HE LYS 110 1HE LYS 110 -10.478 -16.823 -2.651
909 1HZ LYS 110 1HZ LYS 110 -12.018 -18.160 -0.987
910 2HZ LYS 110 2HZ LYS 110 -10.706 -17.900 0.048
911 3HZ LYS 110 3HZ LYS 110 -10.476 -18.704 -1.422
Start of MODEL 4
1 1H ALA 1 1HT ALA 1 12.008 22.250 -14.297
2 2H ALA 1 2HT ALA 1 11.706 23.935 -14.438
3 3H ALA 1 3HT ALA 1 12.527 23.321 -13.061
4 HA ALA 1 HA ALA 1 13.457 23.653 -15.805
5 1HB ALA 1 1HB ALA 1 14.227 25.439 -14.644
6 2HB ALA 1 2HB ALA 1 15.507 24.300 -14.222
7 3HB ALA 1 3HB ALA 1 14.180 24.595 -13.096
8 H THR 2 H THR 2 13.917 21.736 -12.872
9 HA THR 2 HA THR 2 15.827 20.041 -14.332
10 HB THR 2 HB THR 2 15.364 20.041 -11.351
11 HG1 THR 2 1HG THR 2 17.204 21.408 -11.263
12 1HG2 THR 2 1HG2 THR 2 17.288 18.838 -11.129
13 2HG2 THR 2 2HG2 THR 2 17.958 19.415 -12.655
14 3HG2 THR 2 3HG2 THR 2 16.684 18.195 -12.656
15 H SER 3 H SER 3 15.452 17.892 -14.602
16 HA SER 3 HA SER 3 12.738 16.984 -14.153
17 1HB SER 3 2HB SER 3 14.452 16.579 -16.207
18 2HB SER 3 1HB SER 3 14.734 15.108 -15.277
19 HG SER 3 HG SER 3 12.568 15.844 -16.769
20 H THR 4 H THR 4 12.093 15.394 -12.781
21 HA THR 4 HA THR 4 13.653 14.865 -10.490
22 HB THR 4 HB THR 4 11.238 14.866 -10.360
23 HG1 THR 4 1HG THR 4 12.159 12.218 -9.949
24 1HG2 THR 4 1HG2 THR 4 10.626 14.046 -12.542
25 2HG2 THR 4 2HG2 THR 4 9.891 13.042 -11.292
26 3HG2 THR 4 3HG2 THR 4 11.308 12.463 -12.169
27 H LYS 5 H LYS 5 14.991 13.235 -9.968
28 HA LYS 5 HA LYS 5 15.661 11.323 -12.066
29 1HB LYS 5 2HB LYS 5 17.029 12.334 -9.608
30 2HB LYS 5 1HB LYS 5 17.500 10.769 -10.257
31 1HG LYS 5 2HG LYS 5 18.970 12.445 -11.127
32 2HG LYS 5 1HG LYS 5 17.945 11.855 -12.437
33 1HD LYS 5 2HD LYS 5 16.710 13.814 -12.525
34 2HD LYS 5 1HD LYS 5 17.130 14.271 -10.873
35 1HE LYS 5 2HE LYS 5 19.357 14.848 -11.529
36 2HE LYS 5 1HE LYS 5 19.108 14.185 -13.142
37 1HZ LYS 5 1HZ LYS 5 17.861 16.609 -11.978
38 2HZ LYS 5 2HZ LYS 5 17.341 15.908 -13.428
39 3HZ LYS 5 3HZ LYS 5 18.913 16.521 -13.301
40 H LYS 6 H LYS 6 15.601 9.107 -11.820
41 HA LYS 6 HA LYS 6 13.728 8.142 -9.821
42 1HB LYS 6 2HB LYS 6 14.970 6.941 -12.282
43 2HB LYS 6 1HB LYS 6 14.093 5.946 -11.127
44 1HG LYS 6 2HG LYS 6 12.586 8.304 -11.862
45 2HG LYS 6 1HG LYS 6 13.030 7.340 -13.272
46 1HD LYS 6 2HD LYS 6 11.888 5.461 -12.498
47 2HD LYS 6 1HD LYS 6 11.862 6.047 -10.833
48 1HE LYS 6 2HE LYS 6 9.706 6.501 -11.405
49 2HE LYS 6 1HE LYS 6 10.457 8.002 -11.945
50 1HZ LYS 6 1HZ LYS 6 10.226 5.743 -13.813
51 2HZ LYS 6 2HZ LYS 6 10.289 7.401 -14.141
52 3HZ LYS 6 3HZ LYS 6 8.874 6.717 -13.516
53 H LEU 7 H LEU 7 14.154 6.317 -8.470
54 HA LEU 7 HA LEU 7 16.976 6.163 -7.673
55 1HB LEU 7 2HB LEU 7 14.584 6.487 -6.204
56 2HB LEU 7 1HB LEU 7 15.206 4.898 -5.803
57 HG LEU 7 HG LEU 7 17.391 5.957 -5.227
58 1HD1 LEU 7 1HD1 LEU 7 17.691 8.255 -5.144
59 2HD1 LEU 7 2HD1 LEU 7 15.961 8.585 -5.222
60 3HD1 LEU 7 3HD1 LEU 7 16.817 8.025 -6.658
61 1HD2 LEU 7 1HD2 LEU 7 16.452 7.134 -3.150
62 2HD2 LEU 7 2HD2 LEU 7 16.054 5.434 -3.390
63 3HD2 LEU 7 3HD2 LEU 7 14.869 6.680 -3.778
64 H HIS 8 H HIS 8 17.881 4.133 -7.077
65 HA HIS 8 HA HIS 8 17.216 2.034 -8.885
66 1HB HIS 8 2HB HIS 8 19.467 2.771 -7.404
67 2HB HIS 8 1HB HIS 8 18.983 1.220 -6.726
68 HD1 HIS 8 1HD HIS 8 21.232 2.406 -9.080
69 HD2 HIS 8 2HD HIS 8 18.356 -0.591 -9.204
70 HE1 HIS 8 1HE HIS 8 21.928 0.886 -10.958
71 HE2 HIS 8 2HE HIS 8 20.223 -0.970 -10.954
72 H LYS 9 H LYS 9 16.611 -0.129 -8.343
73 HA LYS 9 HA LYS 9 14.484 -0.261 -6.479
74 1HB LYS 9 2HB LYS 9 15.853 -2.683 -7.622
75 2HB LYS 9 1HB LYS 9 14.156 -2.473 -7.212
76 1HG LYS 9 2HG LYS 9 14.094 -0.740 -9.082
77 2HG LYS 9 1HG LYS 9 15.653 -1.402 -9.578
78 1HD LYS 9 2HD LYS 9 14.302 -2.730 -10.836
79 2HD LYS 9 1HD LYS 9 14.306 -3.686 -9.353
80 1HE LYS 9 2HE LYS 9 12.248 -2.235 -8.721
81 2HE LYS 9 1HE LYS 9 12.173 -1.898 -10.450
82 1HZ LYS 9 1HZ LYS 9 12.464 -4.693 -9.750
83 2HZ LYS 9 2HZ LYS 9 11.464 -3.963 -10.903
84 3HZ LYS 9 3HZ LYS 9 10.998 -3.991 -9.278
85 H GLU 10 H GLU 10 14.852 -0.131 -4.365
86 HA GLU 10 HA GLU 10 16.970 -1.823 -3.208
87 1HB GLU 10 2HB GLU 10 16.528 0.953 -2.928
88 2HB GLU 10 1HB GLU 10 16.077 0.225 -1.394
89 1HG GLU 10 2HG GLU 10 18.537 -0.913 -2.307
90 2HG GLU 10 1HG GLU 10 18.648 0.846 -2.328
91 HA PRO 11 HA PRO 11 13.950 -4.169 -1.034
92 1HB PRO 11 2HB PRO 11 15.132 -4.313 1.472
93 2HB PRO 11 1HB PRO 11 15.500 -5.375 0.112
94 1HG PRO 11 2HG PRO 11 16.963 -2.958 1.082
95 2HG PRO 11 1HG PRO 11 17.609 -4.485 0.453
96 1HD PRO 11 2HD PRO 11 17.546 -2.268 -1.053
97 2HD PRO 11 1HD PRO 11 17.249 -3.872 -1.756
98 H ALA 12 H ALA 12 12.062 -3.362 -0.462
99 HA ALA 12 HA ALA 12 11.855 -1.639 1.874
100 1HB ALA 12 1HB ALA 12 10.363 -0.834 -0.596
101 2HB ALA 12 2HB ALA 12 12.005 -0.256 -0.306
102 3HB ALA 12 3HB ALA 12 10.721 0.114 0.848
103 H THR 13 H THR 13 10.578 -2.893 3.109
104 HA THR 13 HA THR 13 8.159 -4.009 1.846
105 HB THR 13 HB THR 13 9.780 -5.759 2.476
106 HG1 THR 13 1HG THR 13 8.288 -6.928 3.871
107 1HG2 THR 13 1HG2 THR 13 9.772 -6.170 5.081
108 2HG2 THR 13 2HG2 THR 13 9.668 -4.409 5.109
109 3HG2 THR 13 3HG2 THR 13 11.016 -5.200 4.292
110 H LEU 14 H LEU 14 6.407 -4.478 3.497
111 HA LEU 14 HA LEU 14 5.900 -2.078 4.987
112 1HB LEU 14 2HB LEU 14 4.281 -4.615 4.776
113 2HB LEU 14 1HB LEU 14 3.728 -3.114 5.494
114 HG LEU 14 HG LEU 14 4.663 -2.722 2.771
115 1HD1 LEU 14 1HD1 LEU 14 3.897 -4.662 1.930
116 2HD1 LEU 14 2HD1 LEU 14 2.327 -3.871 2.073
117 3HD1 LEU 14 3HD1 LEU 14 2.870 -4.983 3.327
118 1HD2 LEU 14 1HD2 LEU 14 2.919 -1.267 2.682
119 2HD2 LEU 14 2HD2 LEU 14 3.088 -1.379 4.434
120 3HD2 LEU 14 3HD2 LEU 14 1.847 -2.319 3.605
121 H ILE 15 H ILE 15 5.692 -1.845 7.197
122 HA ILE 15 HA ILE 15 7.308 -3.592 8.793
123 HB ILE 15 HB ILE 15 5.541 -1.351 9.776
124 1HG1 ILE 15 2HG1 ILE 15 8.464 -1.058 9.142
125 2HG1 ILE 15 1HG1 ILE 15 7.250 -0.809 7.893
126 1HG2 ILE 15 1HG2 ILE 15 8.135 -2.081 11.020
127 2HG2 ILE 15 2HG2 ILE 15 6.761 -3.155 11.283
128 3HG2 ILE 15 3HG2 ILE 15 6.660 -1.460 11.758
129 1HD1 ILE 15 1HD1 ILE 15 6.820 0.629 10.429
130 2HD1 ILE 15 2HD1 ILE 15 6.569 1.153 8.764
131 3HD1 ILE 15 3HD1 ILE 15 8.194 1.145 9.452
132 H LYS 16 H LYS 16 3.856 -2.748 8.729
133 HA LYS 16 HA LYS 16 2.967 -5.326 9.375
134 1HB LYS 16 2HB LYS 16 2.176 -4.969 11.680
135 2HB LYS 16 1HB LYS 16 3.929 -4.908 11.572
136 1HG LYS 16 2HG LYS 16 3.023 -2.270 11.225
137 2HG LYS 16 1HG LYS 16 2.105 -2.945 12.571
138 1HD LYS 16 2HD LYS 16 4.059 -3.430 13.794
139 2HD LYS 16 1HD LYS 16 5.093 -3.213 12.380
140 1HE LYS 16 2HE LYS 16 4.853 -0.882 12.426
141 2HE LYS 16 1HE LYS 16 3.451 -0.960 13.490
142 1HZ LYS 16 1HZ LYS 16 4.890 -1.730 15.271
143 2HZ LYS 16 2HZ LYS 16 5.424 -0.239 14.679
144 3HZ LYS 16 3HZ LYS 16 6.237 -1.657 14.250
145 H ALA 17 H ALA 17 1.590 -4.736 7.662
146 HA ALA 17 HA ALA 17 -0.135 -2.476 7.788
147 1HB ALA 17 1HB ALA 17 -0.230 -4.956 6.079
148 2HB ALA 17 2HB ALA 17 0.454 -3.388 5.649
149 3HB ALA 17 3HB ALA 17 -1.287 -3.560 5.872
150 H ILE 18 H ILE 18 -1.831 -2.241 9.077
151 HA ILE 18 HA ILE 18 -2.920 -4.260 10.685
152 HB ILE 18 HB ILE 18 -4.349 -1.744 9.844
153 1HG1 ILE 18 2HG1 ILE 18 -2.155 -1.097 10.619
154 2HG1 ILE 18 1HG1 ILE 18 -3.323 -0.731 11.882
155 1HG2 ILE 18 1HG2 ILE 18 -5.323 -3.788 11.289
156 2HG2 ILE 18 2HG2 ILE 18 -5.805 -2.109 11.528
157 3HG2 ILE 18 3HG2 ILE 18 -4.582 -2.832 12.573
158 1HD1 ILE 18 1HD1 ILE 18 -2.466 -3.296 12.470
159 2HD1 ILE 18 2HD1 ILE 18 -1.978 -1.805 13.274
160 3HD1 ILE 18 3HD1 ILE 18 -1.010 -2.450 11.948
161 H ASP 19 H ASP 19 -4.452 -2.606 7.949
162 HA ASP 19 HA ASP 19 -5.307 -4.780 6.508
163 1HB ASP 19 2HB ASP 19 -7.663 -5.062 7.191
164 2HB ASP 19 1HB ASP 19 -6.568 -5.488 8.499
165 H GLY 20 H GLY 20 -8.180 -3.479 6.394
166 1HA GLY 20 2HA GLY 20 -7.585 -1.729 4.247
167 2HA GLY 20 1HA GLY 20 -9.161 -1.954 4.993
168 H ASP 21 H ASP 21 -7.451 -1.228 7.595
169 HA ASP 21 HA ASP 21 -8.372 1.470 7.668
170 1HB ASP 21 2HB ASP 21 -7.075 -0.412 9.541
171 2HB ASP 21 1HB ASP 21 -6.769 1.295 9.848
172 H THR 22 H THR 22 -5.100 0.602 8.688
173 HA THR 22 HA THR 22 -4.058 2.668 6.865
174 HB THR 22 HB THR 22 -2.976 2.133 9.629
175 HG1 THR 22 1HG THR 22 -4.812 4.131 8.812
176 1HG2 THR 22 1HG2 THR 22 -1.312 3.354 8.739
177 2HG2 THR 22 2HG2 THR 22 -2.397 4.693 9.119
178 3HG2 THR 22 3HG2 THR 22 -2.338 4.041 7.480
179 H VAL 23 H VAL 23 -1.778 2.445 6.321
180 HA VAL 23 HA VAL 23 -0.616 -0.200 6.741
181 HB VAL 23 HB VAL 23 -0.466 0.756 3.941
182 1HG1 VAL 23 1HG1 VAL 23 -1.161 -2.024 4.623
183 2HG1 VAL 23 2HG1 VAL 23 0.391 -1.446 5.230
184 3HG1 VAL 23 3HG1 VAL 23 0.046 -1.395 3.501
185 1HG2 VAL 23 1HG2 VAL 23 -2.957 -0.586 4.990
186 2HG2 VAL 23 2HG2 VAL 23 -2.600 -0.204 3.306
187 3HG2 VAL 23 3HG2 VAL 23 -2.850 1.096 4.471
188 H LYS 24 H LYS 24 1.329 0.234 7.537
189 HA LYS 24 HA LYS 24 2.804 2.562 6.509
190 1HB LYS 24 2HB LYS 24 2.247 1.917 9.090
191 2HB LYS 24 1HB LYS 24 3.822 1.159 8.900
192 1HG LYS 24 2HG LYS 24 4.347 3.265 9.691
193 2HG LYS 24 1HG LYS 24 4.556 3.439 7.948
194 1HD LYS 24 2HD LYS 24 2.871 4.913 7.777
195 2HD LYS 24 1HD LYS 24 1.840 4.002 8.881
196 1HE LYS 24 2HE LYS 24 3.127 4.906 10.782
197 2HE LYS 24 1HE LYS 24 4.086 5.863 9.652
198 1HZ LYS 24 1HZ LYS 24 2.315 7.235 9.176
199 2HZ LYS 24 2HZ LYS 24 2.073 6.935 10.822
200 3HZ LYS 24 3HZ LYS 24 1.151 6.110 9.668
201 H LEU 25 H LEU 25 4.940 2.364 5.823
202 HA LEU 25 HA LEU 25 5.785 -0.395 5.256
203 1HB LEU 25 2HB LEU 25 5.985 2.137 3.712
204 2HB LEU 25 1HB LEU 25 7.296 0.982 3.551
205 HG LEU 25 HG LEU 25 4.628 -0.205 3.247
206 1HD1 LEU 25 1HD1 LEU 25 4.667 2.216 2.170
207 2HD1 LEU 25 2HD1 LEU 25 3.904 0.847 1.365
208 3HD1 LEU 25 3HD1 LEU 25 5.524 1.357 0.892
209 1HD2 LEU 25 1HD2 LEU 25 6.905 -0.262 1.300
210 2HD2 LEU 25 2HD2 LEU 25 5.691 -1.496 1.631
211 3HD2 LEU 25 3HD2 LEU 25 6.971 -1.183 2.801
212 H MET 26 H MET 26 8.127 -0.781 5.178
213 HA MET 26 HA MET 26 9.489 0.733 7.300
214 1HB MET 26 2HB MET 26 9.027 -1.860 7.371
215 2HB MET 26 1HB MET 26 10.446 -1.933 6.336
216 1HG MET 26 2HG MET 26 11.797 -0.883 8.012
217 2HG MET 26 1HG MET 26 10.386 -0.593 9.027
218 1HE MET 26 1HE MET 26 13.159 -3.680 9.925
219 2HE MET 26 2HE MET 26 13.237 -1.966 9.525
220 3HE MET 26 3HE MET 26 13.272 -3.173 8.239
221 H TYR 27 H TYR 27 10.673 2.295 6.363
222 HA TYR 27 HA TYR 27 12.366 1.553 4.070
223 1HB TYR 27 2HB TYR 27 10.687 3.342 3.637
224 2HB TYR 27 1HB TYR 27 11.460 4.323 4.878
225 HD1 TYR 27 1HD TYR 27 12.486 6.112 3.828
226 HD2 TYR 27 2HD TYR 27 12.889 2.231 2.133
227 HE1 TYR 27 1HE TYR 27 14.040 7.012 2.150
228 HE2 TYR 27 2HE TYR 27 14.447 3.121 0.451
229 HH TYR 27 HH TYR 27 16.083 5.253 0.403
230 H LYS 28 H LYS 28 14.117 0.780 5.227
231 HA LYS 28 HA LYS 28 15.960 0.795 6.581
232 1HB LYS 28 2HB LYS 28 17.470 2.685 6.157
233 2HB LYS 28 1HB LYS 28 16.743 2.085 4.673
234 1HG LYS 28 2HG LYS 28 15.218 3.937 4.606
235 2HG LYS 28 1HG LYS 28 15.765 4.497 6.188
236 1HD LYS 28 2HD LYS 28 17.518 4.289 3.741
237 2HD LYS 28 1HD LYS 28 16.734 5.771 4.289
238 1HE LYS 28 2HE LYS 28 18.162 4.533 6.458
239 2HE LYS 28 1HE LYS 28 19.229 4.764 5.074
240 1HZ LYS 28 1HZ LYS 28 17.836 6.767 6.701
241 2HZ LYS 28 2HZ LYS 28 18.141 7.121 5.077
242 3HZ LYS 28 3HZ LYS 28 19.425 6.768 6.119
243 H GLY 29 H GLY 29 13.889 1.113 8.219
244 1HA GLY 29 2HA GLY 29 13.590 1.678 10.449
245 2HA GLY 29 1HA GLY 29 15.019 2.695 10.347
246 H GLN 30 H GLN 30 12.493 3.114 8.015
247 HA GLN 30 HA GLN 30 11.538 5.487 9.470
248 1HB GLN 30 2HB GLN 30 13.114 6.105 7.645
249 2HB GLN 30 1HB GLN 30 12.030 5.335 6.492
250 1HG GLN 30 2HG GLN 30 10.495 7.006 6.600
251 2HG GLN 30 1HG GLN 30 10.892 7.415 8.268
252 1HE2 GLN 30 1HE2 GLN 30 11.831 7.784 4.926
253 2HE2 GLN 30 2HE2 GLN 30 12.841 9.168 5.158
254 HA PRO 31 HA PRO 31 7.702 3.281 8.624
255 1HB PRO 31 2HB PRO 31 6.096 4.891 10.093
256 2HB PRO 31 1HB PRO 31 7.145 3.670 10.823
257 1HG PRO 31 2HG PRO 31 7.583 6.619 10.536
258 2HG PRO 31 1HG PRO 31 7.888 5.572 11.936
259 1HD PRO 31 2HD PRO 31 9.855 6.369 10.249
260 2HD PRO 31 1HD PRO 31 9.886 4.804 11.086
261 H MET 32 H MET 32 7.433 3.733 6.439
262 HA MET 32 HA MET 32 6.575 6.368 5.591
263 1HB MET 32 2HB MET 32 7.364 3.836 4.241
264 2HB MET 32 1HB MET 32 6.289 4.916 3.365
265 1HG MET 32 2HG MET 32 8.699 6.107 4.600
266 2HG MET 32 1HG MET 32 8.931 5.070 3.196
267 1HE MET 32 1HE MET 32 7.101 9.081 3.718
268 2HE MET 32 2HE MET 32 8.837 9.045 3.411
269 3HE MET 32 3HE MET 32 8.159 8.107 4.739
270 H THR 33 H THR 33 4.549 6.900 4.799
271 HA THR 33 HA THR 33 2.384 5.242 5.783
272 HB THR 33 HB THR 33 1.919 7.778 4.275
273 HG1 THR 33 1HG THR 33 3.550 8.438 5.589
274 1HG2 THR 33 1HG2 THR 33 -0.108 7.240 5.059
275 2HG2 THR 33 2HG2 THR 33 0.498 7.958 6.552
276 3HG2 THR 33 3HG2 THR 33 0.542 6.209 6.334
277 H PHE 34 H PHE 34 0.935 4.136 4.579
278 HA PHE 34 HA PHE 34 1.072 4.378 1.658
279 1HB PHE 34 2HB PHE 34 2.465 2.453 2.343
280 2HB PHE 34 1HB PHE 34 1.072 1.752 3.161
281 HD1 PHE 34 1HD PHE 34 2.805 2.141 0.045
282 HD2 PHE 34 2HD PHE 34 -0.928 1.087 1.794
283 HE1 PHE 34 1HE PHE 34 2.147 1.024 -2.045
284 HE2 PHE 34 2HE PHE 34 -1.593 -0.034 -0.293
285 HZ PHE 34 HZ PHE 34 -0.056 -0.067 -2.216
286 H ARG 35 H ARG 35 -0.894 5.121 1.173
287 HA ARG 35 HA ARG 35 -3.152 5.248 0.948
288 1HB ARG 35 2HB ARG 35 -2.585 2.599 0.774
289 2HB ARG 35 1HB ARG 35 -3.695 2.600 2.137
290 1HG ARG 35 2HG ARG 35 -5.475 3.073 0.855
291 2HG ARG 35 1HG ARG 35 -4.571 4.187 -0.171
292 1HD ARG 35 2HD ARG 35 -5.055 2.459 -1.630
293 2HD ARG 35 1HD ARG 35 -3.437 2.039 -1.075
294 HE ARG 35 HE ARG 35 -5.242 0.787 0.626
295 1HH1 ARG 35 1HH1 ARG 35 -4.346 0.679 -2.747
296 2HH1 ARG 35 2HH1 ARG 35 -4.770 -0.990 -2.934
297 1HH2 ARG 35 1HH2 ARG 35 -5.801 -1.407 0.379
298 2HH2 ARG 35 2HH2 ARG 35 -5.597 -2.174 -1.161
299 H LEU 36 H LEU 36 -5.149 5.489 2.147
300 HA LEU 36 HA LEU 36 -4.730 5.580 5.064
301 1HB LEU 36 2HB LEU 36 -5.592 7.658 3.179
302 2HB LEU 36 1HB LEU 36 -6.626 7.502 4.586
303 HG LEU 36 HG LEU 36 -4.070 7.506 5.662
304 1HD1 LEU 36 1HD1 LEU 36 -4.186 9.178 3.200
305 2HD1 LEU 36 2HD1 LEU 36 -2.846 8.248 3.873
306 3HD1 LEU 36 3HD1 LEU 36 -3.313 9.782 4.608
307 1HD2 LEU 36 1HD2 LEU 36 -5.866 9.898 5.300
308 2HD2 LEU 36 2HD2 LEU 36 -4.696 9.621 6.589
309 3HD2 LEU 36 3HD2 LEU 36 -6.144 8.620 6.484
310 H LEU 37 H LEU 37 -6.927 5.822 6.227
311 HA LEU 37 HA LEU 37 -8.590 3.623 5.324
312 1HB LEU 37 2HB LEU 37 -9.754 4.013 7.527
313 2HB LEU 37 1HB LEU 37 -8.069 3.540 7.621
314 HG LEU 37 HG LEU 37 -8.282 6.414 7.586
315 1HD1 LEU 37 1HD1 LEU 37 -10.184 4.950 9.306
316 2HD1 LEU 37 2HD1 LEU 37 -10.266 6.586 8.655
317 3HD1 LEU 37 3HD1 LEU 37 -9.266 6.248 10.068
318 1HD2 LEU 37 1HD2 LEU 37 -7.276 5.829 9.989
319 2HD2 LEU 37 2HD2 LEU 37 -6.330 5.716 8.504
320 3HD2 LEU 37 3HD2 LEU 37 -7.049 4.266 9.205
321 H LEU 38 H LEU 38 -9.600 4.572 3.508
322 HA LEU 38 HA LEU 38 -11.800 6.376 4.228
323 1HB LEU 38 2HB LEU 38 -9.589 7.028 2.557
324 2HB LEU 38 1HB LEU 38 -11.016 6.918 1.543
325 HG LEU 38 HG LEU 38 -11.031 8.559 4.058
326 1HD1 LEU 38 1HD1 LEU 38 -9.707 9.142 1.480
327 2HD1 LEU 38 2HD1 LEU 38 -9.354 9.736 3.103
328 3HD1 LEU 38 3HD1 LEU 38 -10.687 10.431 2.181
329 1HD2 LEU 38 1HD2 LEU 38 -13.048 7.838 2.434
330 2HD2 LEU 38 2HD2 LEU 38 -12.519 9.311 1.624
331 3HD2 LEU 38 3HD2 LEU 38 -13.007 9.363 3.318
332 H VAL 39 H VAL 39 -13.718 5.646 3.583
333 HA VAL 39 HA VAL 39 -13.872 3.885 1.246
334 HB VAL 39 HB VAL 39 -15.288 3.238 3.831
335 1HG1 VAL 39 1HG1 VAL 39 -14.858 1.272 1.651
336 2HG1 VAL 39 2HG1 VAL 39 -16.070 2.527 1.398
337 3HG1 VAL 39 3HG1 VAL 39 -16.203 1.438 2.778
338 1HG2 VAL 39 1HG2 VAL 39 -13.171 2.676 4.463
339 2HG2 VAL 39 2HG2 VAL 39 -12.621 2.431 2.805
340 3HG2 VAL 39 3HG2 VAL 39 -13.605 1.201 3.599
341 H ASP 40 H ASP 40 -15.308 4.697 -0.112
342 HA ASP 40 HA ASP 40 -17.741 5.947 0.969
343 1HB ASP 40 2HB ASP 40 -17.606 7.579 -0.956
344 2HB ASP 40 1HB ASP 40 -16.391 7.799 0.300
345 H THR 41 H THR 41 -19.033 4.195 0.520
346 HA THR 41 HA THR 41 -19.057 3.119 -2.191
347 HB THR 41 HB THR 41 -19.099 1.536 -0.326
348 HG1 THR 41 1HG THR 41 -20.739 0.298 -1.111
349 1HG2 THR 41 1HG2 THR 41 -21.815 1.844 0.511
350 2HG2 THR 41 2HG2 THR 41 -20.904 3.316 0.851
351 3HG2 THR 41 3HG2 THR 41 -20.343 1.768 1.480
352 HA PRO 42 HA PRO 42 -22.534 5.783 -3.119
353 1HB PRO 42 2HB PRO 42 -22.864 5.071 -5.687
354 2HB PRO 42 1HB PRO 42 -21.490 6.054 -5.166
355 1HG PRO 42 2HG PRO 42 -21.609 3.119 -5.741
356 2HG PRO 42 1HG PRO 42 -20.364 4.297 -6.191
357 1HD PRO 42 2HD PRO 42 -20.146 2.595 -4.058
358 2HD PRO 42 1HD PRO 42 -19.332 4.169 -4.151
359 H GLU 43 H GLU 43 -22.470 2.313 -3.509
360 HA GLU 43 HA GLU 43 -25.102 1.828 -4.285
361 1HB GLU 43 2HB GLU 43 -22.942 0.269 -3.705
362 2HB GLU 43 1HB GLU 43 -23.983 -0.075 -2.331
363 1HG GLU 43 2HG GLU 43 -24.431 -1.705 -3.988
364 2HG GLU 43 1HG GLU 43 -25.808 -0.605 -3.948
365 H THR 44 H THR 44 -23.820 1.566 -0.962
366 HA THR 44 HA THR 44 -25.797 3.099 0.268
367 HB THR 44 HB THR 44 -27.480 1.561 -0.290
368 HG1 THR 44 1HG THR 44 -27.551 1.992 1.913
369 1HG2 THR 44 1HG2 THR 44 -26.413 -0.902 0.797
370 2HG2 THR 44 2HG2 THR 44 -25.492 -0.317 -0.589
371 3HG2 THR 44 3HG2 THR 44 -27.227 -0.595 -0.737
372 H LYS 45 H LYS 45 -24.117 -0.003 0.802
373 HA LYS 45 HA LYS 45 -22.834 1.209 3.152
374 1HB LYS 45 2HB LYS 45 -23.008 -1.095 4.233
375 2HB LYS 45 1HB LYS 45 -24.487 -0.148 4.144
376 1HG LYS 45 2HG LYS 45 -24.891 -1.464 1.945
377 2HG LYS 45 1HG LYS 45 -23.710 -2.591 2.617
378 1HD LYS 45 2HD LYS 45 -25.629 -3.493 3.469
379 2HD LYS 45 1HD LYS 45 -25.240 -2.355 4.760
380 1HE LYS 45 2HE LYS 45 -27.372 -1.691 4.467
381 2HE LYS 45 1HE LYS 45 -26.686 -0.764 3.135
382 1HZ LYS 45 1HZ LYS 45 -28.607 -1.966 2.384
383 2HZ LYS 45 2HZ LYS 45 -27.975 -3.431 2.944
384 3HZ LYS 45 3HZ LYS 45 -27.232 -2.630 1.654
385 H HIS 46 H HIS 46 -21.138 -0.657 3.950
386 HA HIS 46 HA HIS 46 -19.803 -1.969 1.778
387 1HB HIS 46 2HB HIS 46 -19.004 0.272 1.346
388 2HB HIS 46 1HB HIS 46 -18.532 0.476 3.028
389 HD1 HIS 46 1HD HIS 46 -16.982 0.043 -0.034
390 HD2 HIS 46 2HD HIS 46 -16.583 -1.917 3.608
391 HE1 HIS 46 1HE HIS 46 -14.717 -1.046 -0.100
392 HE2 HIS 46 2HE HIS 46 -14.551 -2.325 2.063
393 HA PRO 47 HA PRO 47 -17.197 -2.582 5.920
394 1HB PRO 47 2HB PRO 47 -18.756 -1.753 8.103
395 2HB PRO 47 1HB PRO 47 -17.305 -0.955 7.491
396 1HG PRO 47 2HG PRO 47 -20.173 -0.328 6.979
397 2HG PRO 47 1HG PRO 47 -18.793 0.773 7.156
398 1HD PRO 47 2HD PRO 47 -19.826 0.252 4.756
399 2HD PRO 47 1HD PRO 47 -18.072 0.417 4.973
400 H LYS 48 H LYS 48 -20.636 -2.833 5.468
401 HA LYS 48 HA LYS 48 -21.477 -4.682 7.270
402 1HB LYS 48 2HB LYS 48 -22.896 -3.708 5.508
403 2HB LYS 48 1HB LYS 48 -22.097 -4.717 4.312
404 1HG LYS 48 2HG LYS 48 -22.962 -6.714 5.362
405 2HG LYS 48 1HG LYS 48 -23.688 -5.750 6.651
406 1HD LYS 48 2HD LYS 48 -25.403 -5.044 5.340
407 2HD LYS 48 1HD LYS 48 -24.417 -5.024 3.877
408 1HE LYS 48 2HE LYS 48 -24.458 -7.561 3.993
409 2HE LYS 48 1HE LYS 48 -25.721 -7.383 5.211
410 1HZ LYS 48 1HZ LYS 48 -26.261 -7.613 2.652
411 2HZ LYS 48 2HZ LYS 48 -26.067 -5.934 2.700
412 3HZ LYS 48 3HZ LYS 48 -27.221 -6.679 3.687
413 H LYS 49 H LYS 49 -19.830 -5.456 4.197
414 HA LYS 49 HA LYS 49 -19.351 -8.166 5.237
415 1HB LYS 49 2HB LYS 49 -19.637 -7.048 2.479
416 2HB LYS 49 1HB LYS 49 -18.671 -8.499 2.715
417 1HG LYS 49 2HG LYS 49 -21.480 -8.283 3.742
418 2HG LYS 49 1HG LYS 49 -21.118 -8.804 2.096
419 1HD LYS 49 2HD LYS 49 -19.453 -10.226 3.949
420 2HD LYS 49 1HD LYS 49 -21.142 -10.363 4.441
421 1HE LYS 49 2HE LYS 49 -21.339 -10.767 1.764
422 2HE LYS 49 1HE LYS 49 -19.757 -11.468 2.097
423 1HZ LYS 49 1HZ LYS 49 -22.036 -12.803 2.362
424 2HZ LYS 49 2HZ LYS 49 -21.882 -12.202 3.935
425 3HZ LYS 49 3HZ LYS 49 -20.651 -13.150 3.269
426 H GLY 50 H GLY 50 -17.778 -5.362 3.778
427 1HA GLY 50 2HA GLY 50 -15.601 -4.630 3.987
428 2HA GLY 50 1HA GLY 50 -15.318 -5.945 5.114
429 H VAL 51 H VAL 51 -15.753 -8.173 3.581
430 HA VAL 51 HA VAL 51 -13.355 -8.577 2.295
431 HB VAL 51 HB VAL 51 -14.835 -10.398 3.018
432 1HG1 VAL 51 1HG1 VAL 51 -16.517 -9.479 0.701
433 2HG1 VAL 51 2HG1 VAL 51 -16.990 -9.668 2.390
434 3HG1 VAL 51 3HG1 VAL 51 -16.658 -11.091 1.402
435 1HG2 VAL 51 1HG2 VAL 51 -13.232 -10.305 0.717
436 2HG2 VAL 51 2HG2 VAL 51 -14.656 -11.249 0.281
437 3HG2 VAL 51 3HG2 VAL 51 -13.675 -11.725 1.666
438 H GLU 52 H GLU 52 -16.090 -6.892 1.075
439 HA GLU 52 HA GLU 52 -15.962 -7.327 -1.645
440 1HB GLU 52 2HB GLU 52 -17.076 -5.337 0.114
441 2HB GLU 52 1HB GLU 52 -16.422 -4.564 -1.323
442 1HG GLU 52 2HG GLU 52 -17.724 -6.366 -2.619
443 2HG GLU 52 1HG GLU 52 -18.601 -6.600 -1.107
444 H LYS 53 H LYS 53 -13.675 -5.727 0.384
445 HA LYS 53 HA LYS 53 -11.631 -5.683 -1.453
446 1HB LYS 53 2HB LYS 53 -11.528 -3.171 -1.882
447 2HB LYS 53 1HB LYS 53 -12.660 -4.118 -2.836
448 1HG LYS 53 2HG LYS 53 -14.481 -3.419 -1.351
449 2HG LYS 53 1HG LYS 53 -13.337 -2.448 -0.423
450 1HD LYS 53 2HD LYS 53 -13.810 -0.763 -1.805
451 2HD LYS 53 1HD LYS 53 -12.939 -1.650 -3.054
452 1HE LYS 53 2HE LYS 53 -14.815 -1.957 -4.204
453 2HE LYS 53 1HE LYS 53 -15.593 -2.699 -2.806
454 1HZ LYS 53 1HZ LYS 53 -15.854 -0.242 -2.055
455 2HZ LYS 53 2HZ LYS 53 -16.929 -0.893 -3.187
456 3HZ LYS 53 3HZ LYS 53 -15.660 0.099 -3.701
457 H TYR 54 H TYR 54 -12.937 -4.860 1.531
458 HA TYR 54 HA TYR 54 -10.278 -4.080 2.477
459 1HB TYR 54 2HB TYR 54 -12.877 -2.683 3.057
460 2HB TYR 54 1HB TYR 54 -11.487 -2.558 4.131
461 HD1 TYR 54 1HD TYR 54 -9.213 -2.246 2.448
462 HD2 TYR 54 2HD TYR 54 -13.143 -0.723 1.872
463 HE1 TYR 54 1HE TYR 54 -8.301 -0.434 1.058
464 HE2 TYR 54 2HE TYR 54 -12.243 1.092 0.481
465 HH TYR 54 HH TYR 54 -10.205 2.262 0.067
466 H GLY 55 H GLY 55 -11.906 -6.586 2.504
467 1HA GLY 55 2HA GLY 55 -12.473 -6.874 5.371
468 2HA GLY 55 1HA GLY 55 -12.845 -8.049 4.116
469 HA PRO 56 HA PRO 56 -9.195 -9.923 6.039
470 1HB PRO 56 2HB PRO 56 -9.609 -12.412 5.074
471 2HB PRO 56 1HB PRO 56 -10.495 -11.784 6.468
472 1HG PRO 56 2HG PRO 56 -11.359 -11.989 3.608
473 2HG PRO 56 1HG PRO 56 -12.274 -12.357 5.082
474 1HD PRO 56 2HD PRO 56 -12.558 -10.031 3.696
475 2HD PRO 56 1HD PRO 56 -12.809 -10.152 5.449
476 H GLU 57 H GLU 57 -9.925 -9.037 2.941
477 HA GLU 57 HA GLU 57 -7.692 -10.416 1.675
478 1HB GLU 57 2HB GLU 57 -9.462 -8.419 0.313
479 2HB GLU 57 1HB GLU 57 -8.609 -9.791 -0.378
480 1HG GLU 57 2HG GLU 57 -10.855 -10.141 1.574
481 2HG GLU 57 1HG GLU 57 -11.135 -9.968 -0.156
482 H ALA 58 H ALA 58 -8.858 -7.006 1.687
483 HA ALA 58 HA ALA 58 -6.670 -5.717 0.762
484 1HB ALA 58 1HB ALA 58 -7.252 -3.925 2.581
485 2HB ALA 58 2HB ALA 58 -8.627 -4.986 2.884
486 3HB ALA 58 3HB ALA 58 -8.389 -4.288 1.283
487 H SER 59 H SER 59 -6.980 -7.192 3.922
488 HA SER 59 HA SER 59 -4.494 -6.122 4.907
489 1HB SER 59 2HB SER 59 -4.877 -7.734 6.797
490 2HB SER 59 1HB SER 59 -6.213 -6.616 6.529
491 HG SER 59 HG SER 59 -7.427 -8.293 6.251
492 H ALA 60 H ALA 60 -5.661 -9.287 3.793
493 HA ALA 60 HA ALA 60 -3.242 -10.680 4.069
494 1HB ALA 60 1HB ALA 60 -5.599 -11.594 3.634
495 2HB ALA 60 2HB ALA 60 -4.240 -12.410 2.859
496 3HB ALA 60 3HB ALA 60 -5.249 -11.302 1.929
497 H PHE 61 H PHE 61 -4.619 -8.916 1.313
498 HA PHE 61 HA PHE 61 -2.862 -9.487 -0.695
499 1HB PHE 61 2HB PHE 61 -4.695 -8.033 -1.148
500 2HB PHE 61 1HB PHE 61 -4.156 -6.863 0.050
501 HD1 PHE 61 1HD PHE 61 -2.734 -8.537 -2.975
502 HD2 PHE 61 2HD PHE 61 -3.304 -4.924 -0.800
503 HE1 PHE 61 1HE PHE 61 -1.541 -7.294 -4.733
504 HE2 PHE 61 2HE PHE 61 -2.112 -3.676 -2.553
505 HZ PHE 61 HZ PHE 61 -1.230 -4.861 -4.523
506 H THR 62 H THR 62 -2.364 -7.303 2.019
507 HA THR 62 HA THR 62 0.349 -6.702 1.122
508 HB THR 62 HB THR 62 -0.881 -4.795 1.912
509 HG1 THR 62 1HG THR 62 0.659 -4.060 3.176
510 1HG2 THR 62 1HG2 THR 62 -2.566 -5.810 3.288
511 2HG2 THR 62 2HG2 THR 62 -1.674 -4.620 4.235
512 3HG2 THR 62 3HG2 THR 62 -1.349 -6.340 4.449
513 H LYS 63 H LYS 63 -1.399 -8.548 3.493
514 HA LYS 63 HA LYS 63 0.699 -9.046 5.300
515 1HB LYS 63 2HB LYS 63 -1.872 -9.516 5.473
516 2HB LYS 63 1HB LYS 63 -1.439 -11.074 4.783
517 1HG LYS 63 2HG LYS 63 -1.351 -11.543 7.018
518 2HG LYS 63 1HG LYS 63 0.329 -11.104 6.704
519 1HD LYS 63 2HD LYS 63 -0.363 -9.995 8.709
520 2HD LYS 63 1HD LYS 63 -0.219 -8.780 7.439
521 1HE LYS 63 2HE LYS 63 -2.254 -8.553 8.872
522 2HE LYS 63 1HE LYS 63 -2.583 -8.694 7.147
523 1HZ LYS 63 1HZ LYS 63 -2.560 -11.152 8.732
524 2HZ LYS 63 2HZ LYS 63 -3.511 -10.737 7.396
525 3HZ LYS 63 3HZ LYS 63 -3.881 -10.110 8.922
526 H LYS 64 H LYS 64 -0.075 -10.376 2.191
527 HA LYS 64 HA LYS 64 1.742 -12.625 2.540
528 1HB LYS 64 2HB LYS 64 -0.543 -12.116 0.929
529 2HB LYS 64 1HB LYS 64 0.818 -12.356 -0.158
530 1HG LYS 64 2HG LYS 64 1.039 -14.540 0.379
531 2HG LYS 64 1HG LYS 64 0.529 -14.297 2.051
532 1HD LYS 64 2HD LYS 64 -1.796 -13.809 0.979
533 2HD LYS 64 1HD LYS 64 -1.134 -14.678 -0.406
534 1HE LYS 64 2HE LYS 64 -1.160 -16.672 0.663
535 2HE LYS 64 1HE LYS 64 -0.767 -15.958 2.227
536 1HZ LYS 64 1HZ LYS 64 -3.359 -16.467 1.020
537 2HZ LYS 64 2HZ LYS 64 -3.219 -15.008 1.861
538 3HZ LYS 64 3HZ LYS 64 -2.903 -16.470 2.650
539 H MET 65 H MET 65 1.451 -9.600 0.771
540 HA MET 65 HA MET 65 3.645 -9.831 -0.925
541 1HB MET 65 2HB MET 65 1.769 -7.956 -0.571
542 2HB MET 65 1HB MET 65 3.100 -7.172 0.270
543 1HG MET 65 2HG MET 65 3.007 -6.452 -2.034
544 2HG MET 65 1HG MET 65 4.483 -7.367 -1.731
545 1HE MET 65 1HE MET 65 1.948 -6.919 -4.571
546 2HE MET 65 2HE MET 65 3.101 -7.908 -5.469
547 3HE MET 65 3HE MET 65 3.680 -6.621 -4.410
548 H VAL 66 H VAL 66 3.581 -9.532 2.484
549 HA VAL 66 HA VAL 66 6.357 -8.589 2.547
550 HB VAL 66 HB VAL 66 5.925 -8.396 5.044
551 1HG1 VAL 66 1HG1 VAL 66 5.632 -6.628 3.019
552 2HG1 VAL 66 2HG1 VAL 66 5.471 -6.214 4.725
553 3HG1 VAL 66 3HG1 VAL 66 4.033 -6.547 3.758
554 1HG2 VAL 66 1HG2 VAL 66 3.546 -9.688 4.379
555 2HG2 VAL 66 2HG2 VAL 66 3.082 -8.025 4.728
556 3HG2 VAL 66 3HG2 VAL 66 3.966 -8.964 5.928
557 H GLU 67 H GLU 67 4.297 -11.234 3.720
558 HA GLU 67 HA GLU 67 6.647 -12.588 4.795
559 1HB GLU 67 2HB GLU 67 3.917 -12.492 5.519
560 2HB GLU 67 1HB GLU 67 4.253 -14.148 5.036
561 1HG GLU 67 2HG GLU 67 6.112 -12.758 6.906
562 2HG GLU 67 1HG GLU 67 4.583 -13.399 7.505
563 H ASN 68 H ASN 68 3.833 -13.949 3.122
564 HA ASN 68 HA ASN 68 5.156 -16.134 2.044
565 1HB ASN 68 2HB ASN 68 2.576 -15.337 2.107
566 2HB ASN 68 1HB ASN 68 2.949 -15.022 0.416
567 1HD2 ASN 68 1HD2 ASN 68 2.124 -16.617 -0.725
568 2HD2 ASN 68 2HD2 ASN 68 2.302 -18.303 -0.390
569 H ALA 69 H ALA 69 4.773 -12.898 0.744
570 HA ALA 69 HA ALA 69 5.854 -13.532 -1.829
571 1HB ALA 69 1HB ALA 69 4.298 -11.555 -1.023
572 2HB ALA 69 2HB ALA 69 5.394 -11.374 -2.397
573 3HB ALA 69 3HB ALA 69 5.852 -10.742 -0.814
574 H LYS 70 H LYS 70 7.666 -11.599 -2.395
575 HA LYS 70 HA LYS 70 10.047 -12.664 -1.234
576 1HB LYS 70 2HB LYS 70 9.500 -11.527 -3.621
577 2HB LYS 70 1HB LYS 70 10.224 -10.155 -2.792
578 1HG LYS 70 2HG LYS 70 11.525 -12.858 -3.013
579 2HG LYS 70 1HG LYS 70 11.818 -11.521 -4.126
580 1HD LYS 70 2HD LYS 70 12.519 -10.140 -2.168
581 2HD LYS 70 1HD LYS 70 12.388 -11.589 -1.167
582 1HE LYS 70 2HE LYS 70 14.571 -11.819 -1.677
583 2HE LYS 70 1HE LYS 70 13.938 -12.523 -3.165
584 1HZ LYS 70 1HZ LYS 70 15.507 -10.950 -3.843
585 2HZ LYS 70 2HZ LYS 70 14.977 -9.788 -2.733
586 3HZ LYS 70 3HZ LYS 70 14.020 -10.174 -4.072
587 H LYS 71 H LYS 71 9.109 -9.230 -1.491
588 HA LYS 71 HA LYS 71 9.134 -8.606 1.211
589 1HB LYS 71 2HB LYS 71 11.783 -9.008 0.115
590 2HB LYS 71 1HB LYS 71 11.592 -7.359 0.690
591 1HG LYS 71 2HG LYS 71 10.971 -9.799 2.340
592 2HG LYS 71 1HG LYS 71 12.510 -8.937 2.375
593 1HD LYS 71 2HD LYS 71 11.426 -6.934 3.157
594 2HD LYS 71 1HD LYS 71 9.838 -7.678 2.971
595 1HE LYS 71 2HE LYS 71 10.054 -8.147 5.157
596 2HE LYS 71 1HE LYS 71 11.066 -9.473 4.588
597 1HZ LYS 71 1HZ LYS 71 12.937 -7.725 4.734
598 2HZ LYS 71 2HZ LYS 71 12.389 -8.457 6.156
599 3HZ LYS 71 3HZ LYS 71 11.875 -6.896 5.759
600 H ILE 72 H ILE 72 9.872 -7.590 -2.057
601 HA ILE 72 HA ILE 72 9.017 -5.809 -3.239
602 HB ILE 72 HB ILE 72 8.136 -4.499 -0.681
603 1HG1 ILE 72 2HG1 ILE 72 6.043 -5.838 -2.210
604 2HG1 ILE 72 1HG1 ILE 72 7.217 -6.962 -1.538
605 1HG2 ILE 72 1HG2 ILE 72 8.187 -3.606 -3.298
606 2HG2 ILE 72 2HG2 ILE 72 7.252 -2.919 -1.973
607 3HG2 ILE 72 3HG2 ILE 72 6.516 -4.107 -3.049
608 1HD1 ILE 72 1HD1 ILE 72 6.472 -6.673 0.540
609 2HD1 ILE 72 2HD1 ILE 72 5.044 -5.983 -0.230
610 3HD1 ILE 72 3HD1 ILE 72 6.331 -4.926 0.350
611 H GLU 73 H GLU 73 9.872 -3.870 -3.881
612 HA GLU 73 HA GLU 73 11.996 -2.744 -2.188
613 1HB GLU 73 2HB GLU 73 13.249 -2.357 -4.393
614 2HB GLU 73 1HB GLU 73 13.232 -3.990 -3.740
615 1HG GLU 73 2HG GLU 73 11.162 -3.174 -5.725
616 2HG GLU 73 1HG GLU 73 12.789 -3.578 -6.268
617 H VAL 74 H VAL 74 12.376 -0.537 -2.384
618 HA VAL 74 HA VAL 74 10.161 0.950 -3.588
619 HB VAL 74 HB VAL 74 10.655 1.398 -1.223
620 1HG1 VAL 74 1HG1 VAL 74 12.694 1.808 -0.401
621 2HG1 VAL 74 2HG1 VAL 74 13.104 2.913 -1.713
622 3HG1 VAL 74 3HG1 VAL 74 13.288 1.172 -1.935
623 1HG2 VAL 74 1HG2 VAL 74 10.188 3.610 -1.389
624 2HG2 VAL 74 2HG2 VAL 74 10.011 3.200 -3.094
625 3HG2 VAL 74 3HG2 VAL 74 11.513 3.920 -2.510
626 H GLU 75 H GLU 75 10.501 1.547 -5.622
627 HA GLU 75 HA GLU 75 13.190 2.088 -6.587
628 1HB GLU 75 2HB GLU 75 10.817 1.132 -7.751
629 2HB GLU 75 1HB GLU 75 11.107 2.697 -8.498
630 1HG GLU 75 2HG GLU 75 13.478 0.993 -8.306
631 2HG GLU 75 1HG GLU 75 12.187 0.347 -9.320
632 H PHE 76 H PHE 76 10.198 3.905 -7.254
633 HA PHE 76 HA PHE 76 11.728 6.366 -7.239
634 1HB PHE 76 2HB PHE 76 9.679 7.416 -8.060
635 2HB PHE 76 1HB PHE 76 10.064 5.981 -9.004
636 HD1 PHE 76 1HD PHE 76 8.714 3.956 -8.793
637 HD2 PHE 76 2HD PHE 76 7.714 7.523 -6.700
638 HE1 PHE 76 1HE PHE 76 6.457 3.071 -8.372
639 HE2 PHE 76 2HE PHE 76 5.456 6.644 -6.273
640 HZ PHE 76 HZ PHE 76 4.826 4.416 -7.110
641 H ASP 77 H ASP 77 12.032 7.512 -5.467
642 HA ASP 77 HA ASP 77 10.007 7.383 -3.332
643 1HB ASP 77 2HB ASP 77 12.589 6.638 -3.084
644 2HB ASP 77 1HB ASP 77 12.735 8.347 -2.680
645 H LYS 78 H LYS 78 10.207 9.208 -5.709
646 HA LYS 78 HA LYS 78 9.950 11.704 -4.203
647 1HB LYS 78 2HB LYS 78 12.183 11.186 -5.749
648 2HB LYS 78 1HB LYS 78 11.158 12.116 -6.833
649 1HG LYS 78 2HG LYS 78 10.934 13.777 -4.905
650 2HG LYS 78 1HG LYS 78 12.300 12.923 -4.184
651 1HD LYS 78 2HD LYS 78 12.268 14.224 -6.908
652 2HD LYS 78 1HD LYS 78 13.036 14.878 -5.460
653 1HE LYS 78 2HE LYS 78 13.744 12.166 -6.533
654 2HE LYS 78 1HE LYS 78 14.510 13.629 -7.149
655 1HZ LYS 78 1HZ LYS 78 14.803 13.991 -4.535
656 2HZ LYS 78 2HZ LYS 78 15.950 13.198 -5.492
657 3HZ LYS 78 3HZ LYS 78 14.840 12.300 -4.587
658 H GLY 79 H GLY 79 9.675 10.323 -7.484
659 1HA GLY 79 2HA GLY 79 7.605 12.100 -8.283
660 2HA GLY 79 1HA GLY 79 8.079 10.626 -9.112
661 H GLN 80 H GLN 80 5.817 12.108 -7.001
662 HA GLN 80 HA GLN 80 4.581 9.645 -6.147
663 1HB GLN 80 2HB GLN 80 4.230 12.520 -5.618
664 2HB GLN 80 1HB GLN 80 2.741 11.586 -5.600
665 1HG GLN 80 2HG GLN 80 3.208 11.062 -3.503
666 2HG GLN 80 1HG GLN 80 4.520 10.060 -4.124
667 1HE2 GLN 80 1HE2 GLN 80 6.627 11.035 -4.311
668 2HE2 GLN 80 2HE2 GLN 80 7.083 12.302 -3.227
669 H ARG 81 H ARG 81 2.362 9.082 -6.638
670 HA ARG 81 HA ARG 81 1.737 9.629 -9.443
671 1HB ARG 81 2HB ARG 81 1.812 7.277 -8.076
672 2HB ARG 81 1HB ARG 81 0.101 7.666 -7.968
673 1HG ARG 81 2HG ARG 81 0.231 6.388 -9.890
674 2HG ARG 81 1HG ARG 81 0.247 8.041 -10.512
675 1HD ARG 81 2HD ARG 81 2.641 7.968 -10.775
676 2HD ARG 81 1HD ARG 81 2.713 6.382 -10.009
677 HE ARG 81 HE ARG 81 2.069 5.427 -11.992
678 1HH1 ARG 81 1HH1 ARG 81 1.514 8.870 -12.151
679 2HH1 ARG 81 2HH1 ARG 81 1.149 8.858 -13.844
680 1HH2 ARG 81 1HH2 ARG 81 1.591 5.411 -14.217
681 2HH2 ARG 81 2HH2 ARG 81 1.193 6.896 -15.016
682 H THR 82 H THR 82 0.202 9.642 -6.242
683 HA THR 82 HA THR 82 -2.047 11.149 -7.378
684 HB THR 82 HB THR 82 -2.074 10.159 -4.567
685 HG1 THR 82 1HG THR 82 -2.839 8.126 -5.402
686 1HG2 THR 82 1HG2 THR 82 -4.144 10.347 -6.737
687 2HG2 THR 82 2HG2 THR 82 -4.018 11.341 -5.285
688 3HG2 THR 82 3HG2 THR 82 -4.422 9.630 -5.149
689 H ASP 83 H ASP 83 -2.953 12.892 -5.982
690 HA ASP 83 HA ASP 83 -0.779 14.374 -4.654
691 1HB ASP 83 2HB ASP 83 -3.169 15.565 -6.071
692 2HB ASP 83 1HB ASP 83 -1.783 16.433 -5.418
693 H LYS 84 H LYS 84 -2.634 12.484 -3.424
694 HA LYS 84 HA LYS 84 -4.583 14.030 -1.977
695 1HB LYS 84 2HB LYS 84 -3.670 11.315 -1.098
696 2HB LYS 84 1HB LYS 84 -5.273 12.027 -1.016
697 1HG LYS 84 2HG LYS 84 -5.015 11.937 -3.662
698 2HG LYS 84 1HG LYS 84 -3.936 10.607 -3.236
699 1HD LYS 84 2HD LYS 84 -5.627 9.297 -2.491
700 2HD LYS 84 1HD LYS 84 -6.545 10.662 -1.852
701 1HE LYS 84 2HE LYS 84 -6.356 9.754 -4.719
702 2HE LYS 84 1HE LYS 84 -7.777 9.728 -3.675
703 1HZ LYS 84 1HZ LYS 84 -8.142 11.614 -4.888
704 2HZ LYS 84 2HZ LYS 84 -6.502 12.005 -5.018
705 3HZ LYS 84 3HZ LYS 84 -7.322 12.276 -3.565
706 H TYR 85 H TYR 85 -1.846 12.062 -0.818
707 HA TYR 85 HA TYR 85 -1.183 14.192 1.085
708 1HB TYR 85 2HB TYR 85 -2.582 12.639 2.323
709 2HB TYR 85 1HB TYR 85 -1.596 11.280 1.793
710 HD1 TYR 85 1HD TYR 85 0.262 10.601 3.043
711 HD2 TYR 85 2HD TYR 85 -1.481 14.407 3.801
712 HE1 TYR 85 1HE TYR 85 1.688 10.852 5.032
713 HE2 TYR 85 2HE TYR 85 -0.061 14.670 5.792
714 HH TYR 85 HH TYR 85 1.336 12.397 7.366
715 H GLY 86 H GLY 86 -0.068 12.611 -1.426
716 1HA GLY 86 2HA GLY 86 2.026 12.100 -2.216
717 2HA GLY 86 1HA GLY 86 2.648 13.056 -0.878
718 H ARG 87 H ARG 87 0.712 10.112 -0.717
719 HA ARG 87 HA ARG 87 2.834 8.323 -0.239
720 1HB ARG 87 2HB ARG 87 1.947 9.911 2.040
721 2HB ARG 87 1HB ARG 87 1.810 8.184 2.334
722 1HG ARG 87 2HG ARG 87 4.053 7.857 2.313
723 2HG ARG 87 1HG ARG 87 4.343 9.153 1.150
724 1HD ARG 87 2HD ARG 87 3.482 9.667 3.986
725 2HD ARG 87 1HD ARG 87 5.174 9.549 3.512
726 HE ARG 87 HE ARG 87 3.935 11.400 1.830
727 1HH1 ARG 87 1HH1 ARG 87 4.779 11.059 5.199
728 2HH1 ARG 87 2HH1 ARG 87 4.949 12.762 5.459
729 1HH2 ARG 87 1HH2 ARG 87 4.163 13.642 2.169
730 2HH2 ARG 87 2HH2 ARG 87 4.601 14.228 3.739
731 H GLY 88 H GLY 88 -0.531 9.161 -0.048
732 1HA GLY 88 2HA GLY 88 -1.755 6.869 0.822
733 2HA GLY 88 1HA GLY 88 -2.406 7.895 -0.446
734 H LEU 89 H LEU 89 -1.201 7.522 -2.648
735 HA LEU 89 HA LEU 89 -1.403 4.655 -3.156
736 1HB LEU 89 2HB LEU 89 -2.643 6.370 -4.525
737 2HB LEU 89 1HB LEU 89 -1.093 6.878 -5.166
738 HG LEU 89 HG LEU 89 -0.999 4.206 -5.671
739 1HD1 LEU 89 1HD1 LEU 89 -3.003 3.250 -6.039
740 2HD1 LEU 89 2HD1 LEU 89 -3.743 4.756 -6.583
741 3HD1 LEU 89 3HD1 LEU 89 -3.557 4.437 -4.859
742 1HD2 LEU 89 1HD2 LEU 89 -1.665 4.836 -7.991
743 2HD2 LEU 89 2HD2 LEU 89 -0.431 5.878 -7.282
744 3HD2 LEU 89 3HD2 LEU 89 -2.103 6.430 -7.377
745 H ALA 90 H ALA 90 0.381 3.480 -3.071
746 HA ALA 90 HA ALA 90 2.852 4.586 -4.216
747 1HB ALA 90 1HB ALA 90 3.185 2.734 -1.946
748 2HB ALA 90 2HB ALA 90 2.565 4.338 -1.552
749 3HB ALA 90 3HB ALA 90 4.109 4.170 -2.388
750 H TYR 91 H TYR 91 4.200 3.112 -5.257
751 HA TYR 91 HA TYR 91 2.863 0.732 -6.206
752 1HB TYR 91 2HB TYR 91 5.040 2.440 -7.104
753 2HB TYR 91 1HB TYR 91 5.436 0.733 -7.269
754 HD1 TYR 91 1HD TYR 91 3.214 3.429 -8.380
755 HD2 TYR 91 2HD TYR 91 4.217 -0.683 -8.816
756 HE1 TYR 91 1HE TYR 91 1.882 3.330 -10.443
757 HE2 TYR 91 2HE TYR 91 2.888 -0.794 -10.882
758 HH TYR 91 HH TYR 91 2.004 0.643 -12.583
759 H ILE 92 H ILE 92 3.081 -1.214 -5.357
760 HA ILE 92 HA ILE 92 5.494 -1.809 -3.769
761 HB ILE 92 HB ILE 92 3.469 -1.588 -2.366
762 1HG1 ILE 92 2HG1 ILE 92 4.563 -4.402 -2.580
763 2HG1 ILE 92 1HG1 ILE 92 5.273 -3.078 -1.660
764 1HG2 ILE 92 1HG2 ILE 92 2.343 -4.109 -3.454
765 2HG2 ILE 92 2HG2 ILE 92 2.055 -2.619 -4.351
766 3HG2 ILE 92 3HG2 ILE 92 1.535 -2.750 -2.671
767 1HD1 ILE 92 1HD1 ILE 92 4.187 -4.198 -0.004
768 2HD1 ILE 92 2HD1 ILE 92 2.885 -4.734 -1.065
769 3HD1 ILE 92 3HD1 ILE 92 2.923 -3.068 -0.490
770 H TYR 93 H TYR 93 6.731 -3.157 -4.935
771 HA TYR 93 HA TYR 93 5.410 -5.448 -6.225
772 1HB TYR 93 2HB TYR 93 7.682 -5.021 -7.756
773 2HB TYR 93 1HB TYR 93 6.031 -4.638 -8.213
774 HD1 TYR 93 1HD TYR 93 8.723 -3.080 -6.125
775 HD2 TYR 93 2HD TYR 93 5.727 -2.542 -9.099
776 HE1 TYR 93 1HE TYR 93 9.334 -0.705 -6.305
777 HE2 TYR 93 2HE TYR 93 6.331 -0.166 -9.286
778 HH TYR 93 HH TYR 93 8.648 1.193 -8.748
779 H ALA 94 H ALA 94 5.973 -7.145 -5.052
780 HA ALA 94 HA ALA 94 8.577 -7.347 -3.807
781 1HB ALA 94 1HB ALA 94 7.509 -8.632 -2.355
782 2HB ALA 94 2HB ALA 94 7.066 -9.769 -3.628
783 3HB ALA 94 3HB ALA 94 6.025 -8.389 -3.275
784 H ASP 95 H ASP 95 10.044 -7.542 -5.481
785 HA ASP 95 HA ASP 95 11.357 -8.641 -6.977
786 1HB ASP 95 2HB ASP 95 10.474 -10.606 -5.269
787 2HB ASP 95 1HB ASP 95 9.995 -11.238 -6.841
788 H GLY 96 H GLY 96 9.123 -7.252 -7.936
789 1HA GLY 96 2HA GLY 96 8.079 -6.923 -9.960
790 2HA GLY 96 1HA GLY 96 8.938 -8.334 -10.561
791 H LYS 97 H LYS 97 6.802 -8.359 -7.776
792 HA LYS 97 HA LYS 97 5.046 -10.207 -9.233
793 1HB LYS 97 2HB LYS 97 5.772 -9.876 -6.352
794 2HB LYS 97 1HB LYS 97 4.217 -10.588 -6.761
795 1HG LYS 97 2HG LYS 97 5.421 -12.267 -8.145
796 2HG LYS 97 1HG LYS 97 6.939 -11.602 -7.541
797 1HD LYS 97 2HD LYS 97 6.708 -13.177 -5.947
798 2HD LYS 97 1HD LYS 97 5.608 -12.004 -5.218
799 1HE LYS 97 2HE LYS 97 4.357 -13.959 -5.211
800 2HE LYS 97 1HE LYS 97 3.803 -13.143 -6.674
801 1HZ LYS 97 1HZ LYS 97 5.787 -14.569 -7.677
802 2HZ LYS 97 2HZ LYS 97 4.210 -15.169 -7.549
803 3HZ LYS 97 3HZ LYS 97 5.368 -15.583 -6.388
804 H MET 98 H MET 98 3.006 -9.680 -9.694
805 HA MET 98 HA MET 98 1.895 -7.249 -8.451
806 1HB MET 98 2HB MET 98 2.483 -7.482 -11.064
807 2HB MET 98 1HB MET 98 0.853 -8.142 -11.082
808 1HG MET 98 2HG MET 98 -0.082 -6.141 -10.815
809 2HG MET 98 1HG MET 98 1.061 -5.672 -9.558
810 1HE MET 98 1HE MET 98 0.428 -6.140 -13.292
811 2HE MET 98 2HE MET 98 2.096 -6.710 -13.346
812 3HE MET 98 3HE MET 98 1.666 -5.169 -14.088
813 H VAL 99 H VAL 99 0.924 -8.494 -6.786
814 HA VAL 99 HA VAL 99 -0.903 -10.615 -7.392
815 HB VAL 99 HB VAL 99 -0.698 -9.065 -4.811
816 1HG1 VAL 99 1HG1 VAL 99 -1.459 -11.296 -3.885
817 2HG1 VAL 99 2HG1 VAL 99 -1.837 -11.748 -5.547
818 3HG1 VAL 99 3HG1 VAL 99 -2.658 -10.378 -4.797
819 1HG2 VAL 99 1HG2 VAL 99 0.939 -11.352 -5.864
820 2HG2 VAL 99 2HG2 VAL 99 0.773 -11.035 -4.137
821 3HG2 VAL 99 3HG2 VAL 99 1.493 -9.818 -5.192
822 H ASN 100 H ASN 100 -1.147 -7.286 -7.684
823 HA ASN 100 HA ASN 100 -3.696 -6.681 -6.750
824 1HB ASN 100 2HB ASN 100 -1.829 -5.192 -7.861
825 2HB ASN 100 1HB ASN 100 -2.744 -5.508 -9.332
826 1HD2 ASN 100 1HD2 ASN 100 -2.589 -3.766 -6.403
827 2HD2 ASN 100 2HD2 ASN 100 -4.057 -2.874 -6.589
828 H GLU 101 H GLU 101 -2.731 -8.607 -9.444
829 HA GLU 101 HA GLU 101 -5.356 -8.478 -10.696
830 1HB GLU 101 2HB GLU 101 -3.229 -8.525 -12.036
831 2HB GLU 101 1HB GLU 101 -2.986 -10.177 -11.484
832 1HG GLU 101 2HG GLU 101 -5.438 -10.457 -12.450
833 2HG GLU 101 1HG GLU 101 -4.924 -9.091 -13.441
834 H ALA 102 H ALA 102 -3.661 -10.394 -8.422
835 HA ALA 102 HA ALA 102 -4.869 -12.896 -8.868
836 1HB ALA 102 1HB ALA 102 -2.906 -12.809 -7.540
837 2HB ALA 102 2HB ALA 102 -4.214 -13.346 -6.485
838 3HB ALA 102 3HB ALA 102 -3.644 -11.678 -6.404
839 H LEU 103 H LEU 103 -5.489 -11.123 -5.871
840 HA LEU 103 HA LEU 103 -8.334 -11.788 -6.191
841 1HB LEU 103 2HB LEU 103 -8.551 -12.020 -3.849
842 2HB LEU 103 1HB LEU 103 -7.130 -12.922 -4.324
843 HG LEU 103 HG LEU 103 -6.668 -11.835 -2.253
844 1HD1 LEU 103 1HD1 LEU 103 -4.931 -11.812 -4.132
845 2HD1 LEU 103 2HD1 LEU 103 -4.661 -10.778 -2.730
846 3HD1 LEU 103 3HD1 LEU 103 -5.268 -10.084 -4.231
847 1HD2 LEU 103 1HD2 LEU 103 -8.453 -9.981 -2.853
848 2HD2 LEU 103 2HD2 LEU 103 -7.005 -9.090 -3.321
849 3HD2 LEU 103 3HD2 LEU 103 -7.170 -9.698 -1.676
850 H VAL 104 H VAL 104 -6.124 -9.189 -5.763
851 HA VAL 104 HA VAL 104 -7.808 -7.300 -4.552
852 HB VAL 104 HB VAL 104 -5.671 -6.675 -6.583
853 1HG1 VAL 104 1HG1 VAL 104 -5.497 -4.564 -5.497
854 2HG1 VAL 104 2HG1 VAL 104 -6.581 -5.075 -4.203
855 3HG1 VAL 104 3HG1 VAL 104 -7.204 -4.840 -5.836
856 1HG2 VAL 104 1HG2 VAL 104 -4.367 -6.378 -4.288
857 2HG2 VAL 104 2HG2 VAL 104 -4.401 -7.915 -5.156
858 3HG2 VAL 104 3HG2 VAL 104 -5.483 -7.650 -3.789
859 H ARG 105 H ARG 105 -7.746 -8.551 -7.775
860 HA ARG 105 HA ARG 105 -9.455 -6.387 -8.754
861 1HB ARG 105 2HB ARG 105 -9.062 -7.252 -10.965
862 2HB ARG 105 1HB ARG 105 -7.520 -7.119 -10.130
863 1HG ARG 105 2HG ARG 105 -7.201 -9.186 -10.938
864 2HG ARG 105 1HG ARG 105 -8.166 -9.669 -9.542
865 1HD ARG 105 2HD ARG 105 -9.601 -10.613 -10.954
866 2HD ARG 105 1HD ARG 105 -10.018 -8.995 -11.521
867 HE ARG 105 HE ARG 105 -8.812 -9.383 -13.436
868 1HH1 ARG 105 1HH1 ARG 105 -8.082 -11.869 -11.097
869 2HH1 ARG 105 2HH1 ARG 105 -7.207 -12.848 -12.226
870 1HH2 ARG 105 1HH2 ARG 105 -7.663 -10.669 -14.921
871 2HH2 ARG 105 2HH2 ARG 105 -6.968 -12.167 -14.396
872 H GLN 106 H GLN 106 -9.696 -9.546 -7.500
873 HA GLN 106 HA GLN 106 -12.147 -10.201 -8.894
874 1HB GLN 106 2HB GLN 106 -10.257 -11.594 -7.128
875 2HB GLN 106 1HB GLN 106 -11.939 -12.048 -6.889
876 1HG GLN 106 2HG GLN 106 -11.538 -12.011 -9.660
877 2HG GLN 106 1HG GLN 106 -10.124 -12.809 -8.970
878 1HE2 GLN 106 1HE2 GLN 106 -10.718 -14.435 -7.202
879 2HE2 GLN 106 2HE2 GLN 106 -12.029 -15.500 -7.571
880 H GLY 107 H GLY 107 -11.966 -7.825 -7.016
881 1HA GLY 107 2HA GLY 107 -13.398 -6.775 -5.562
882 2HA GLY 107 1HA GLY 107 -14.552 -8.048 -5.922
883 H LEU 108 H LEU 108 -11.367 -8.150 -4.351
884 HA LEU 108 HA LEU 108 -12.688 -9.251 -1.957
885 1HB LEU 108 2HB LEU 108 -10.467 -10.271 -3.579
886 2HB LEU 108 1HB LEU 108 -10.136 -10.249 -1.857
887 HG LEU 108 HG LEU 108 -12.251 -11.554 -1.508
888 1HD1 LEU 108 1HD1 LEU 108 -13.642 -11.398 -3.281
889 2HD1 LEU 108 2HD1 LEU 108 -12.755 -12.830 -3.806
890 3HD1 LEU 108 3HD1 LEU 108 -12.323 -11.243 -4.443
891 1HD2 LEU 108 1HD2 LEU 108 -9.769 -12.419 -1.980
892 2HD2 LEU 108 2HD2 LEU 108 -10.593 -13.184 -3.339
893 3HD2 LEU 108 3HD2 LEU 108 -11.122 -13.513 -1.688
894 H ALA 109 H ALA 109 -9.868 -7.545 -3.189
895 HA ALA 109 HA ALA 109 -9.686 -6.023 -0.691
896 1HB ALA 109 1HB ALA 109 -7.171 -6.083 -1.023
897 2HB ALA 109 2HB ALA 109 -7.453 -7.391 -2.172
898 3HB ALA 109 3HB ALA 109 -7.921 -7.584 -0.486
899 H LYS 110 H LYS 110 -10.948 -5.257 -3.142
900 HA LYS 110 HA LYS 110 -9.289 -3.747 -4.830
901 1HB LYS 110 2HB LYS 110 -12.131 -2.967 -4.238
902 2HB LYS 110 1HB LYS 110 -11.244 -2.812 -5.745
903 1HG LYS 110 2HG LYS 110 -11.171 -5.469 -5.485
904 2HG LYS 110 1HG LYS 110 -12.666 -5.136 -4.609
905 1HD LYS 110 2HD LYS 110 -12.109 -4.020 -7.348
906 2HD LYS 110 1HD LYS 110 -12.879 -5.589 -7.101
907 1HE LYS 110 2HE LYS 110 -13.896 -2.978 -5.990
908 2HE LYS 110 1HE LYS 110 -14.497 -3.746 -7.457
909 1HZ LYS 110 1HZ LYS 110 -15.932 -4.295 -5.645
910 2HZ LYS 110 2HZ LYS 110 -14.638 -4.835 -4.700
911 3HZ LYS 110 3HZ LYS 110 -15.088 -5.694 -6.085
Start of MODEL 5
1 1H ALA 1 1HT ALA 1 14.029 -0.357 -30.344
2 2H ALA 1 2HT ALA 1 14.205 -1.887 -29.588
3 3H ALA 1 3HT ALA 1 15.266 -1.426 -30.856
4 HA ALA 1 HA ALA 1 16.096 -1.301 -28.506
5 1HB ALA 1 1HB ALA 1 17.139 1.012 -29.077
6 2HB ALA 1 2HB ALA 1 16.295 0.807 -30.612
7 3HB ALA 1 3HB ALA 1 17.490 -0.383 -30.097
8 H THR 2 H THR 2 13.453 -0.995 -27.852
9 HA THR 2 HA THR 2 13.094 1.702 -26.815
10 HB THR 2 HB THR 2 11.247 -0.647 -26.414
11 HG1 THR 2 1HG THR 2 10.235 -0.036 -28.318
12 1HG2 THR 2 1HG2 THR 2 10.801 1.417 -25.112
13 2HG2 THR 2 2HG2 THR 2 9.508 0.971 -26.226
14 3HG2 THR 2 3HG2 THR 2 10.616 2.282 -26.636
15 H SER 3 H SER 3 13.974 2.220 -24.934
16 HA SER 3 HA SER 3 14.405 0.125 -22.927
17 1HB SER 3 2HB SER 3 16.432 1.278 -23.380
18 2HB SER 3 1HB SER 3 15.636 2.850 -23.330
19 HG SER 3 HG SER 3 16.908 2.048 -21.404
20 H THR 4 H THR 4 13.419 0.150 -20.982
21 HA THR 4 HA THR 4 11.362 2.188 -20.569
22 HB THR 4 HB THR 4 10.516 0.601 -18.825
23 HG1 THR 4 1HG THR 4 12.476 -0.474 -18.401
24 1HG2 THR 4 1HG2 THR 4 9.315 0.226 -20.718
25 2HG2 THR 4 2HG2 THR 4 10.100 -1.344 -20.541
26 3HG2 THR 4 3HG2 THR 4 10.742 -0.162 -21.681
27 H LYS 5 H LYS 5 11.758 3.829 -19.254
28 HA LYS 5 HA LYS 5 14.063 3.944 -17.591
29 1HB LYS 5 2HB LYS 5 11.642 5.757 -17.601
30 2HB LYS 5 1HB LYS 5 13.208 6.121 -16.889
31 1HG LYS 5 2HG LYS 5 13.209 5.408 -19.752
32 2HG LYS 5 1HG LYS 5 12.462 6.949 -19.320
33 1HD LYS 5 2HD LYS 5 14.434 7.893 -18.797
34 2HD LYS 5 1HD LYS 5 15.030 6.436 -18.000
35 1HE LYS 5 2HE LYS 5 16.424 6.337 -19.764
36 2HE LYS 5 1HE LYS 5 15.029 5.631 -20.582
37 1HZ LYS 5 1HZ LYS 5 16.358 7.733 -21.506
38 2HZ LYS 5 2HZ LYS 5 15.180 8.533 -20.595
39 3HZ LYS 5 3HZ LYS 5 14.717 7.467 -21.823
40 H LYS 6 H LYS 6 14.271 2.877 -15.742
41 HA LYS 6 HA LYS 6 11.939 2.728 -13.949
42 1HB LYS 6 2HB LYS 6 12.843 0.528 -13.169
43 2HB LYS 6 1HB LYS 6 12.265 0.525 -14.829
44 1HG LYS 6 2HG LYS 6 14.399 0.373 -15.711
45 2HG LYS 6 1HG LYS 6 15.157 0.994 -14.244
46 1HD LYS 6 2HD LYS 6 15.293 -1.046 -13.322
47 2HD LYS 6 1HD LYS 6 13.658 -1.477 -13.822
48 1HE LYS 6 2HE LYS 6 14.971 -1.478 -16.205
49 2HE LYS 6 1HE LYS 6 16.239 -2.027 -15.107
50 1HZ LYS 6 1HZ LYS 6 13.784 -3.354 -15.919
51 2HZ LYS 6 2HZ LYS 6 14.210 -3.530 -14.291
52 3HZ LYS 6 3HZ LYS 6 15.287 -4.013 -15.503
53 H LEU 7 H LEU 7 12.358 2.795 -11.721
54 HA LEU 7 HA LEU 7 14.757 4.281 -11.037
55 1HB LEU 7 2HB LEU 7 12.278 4.717 -10.273
56 2HB LEU 7 1HB LEU 7 12.669 3.536 -9.036
57 HG LEU 7 HG LEU 7 14.468 4.928 -8.205
58 1HD1 LEU 7 1HD1 LEU 7 13.981 6.396 -10.721
59 2HD1 LEU 7 2HD1 LEU 7 15.485 6.099 -9.849
60 3HD1 LEU 7 3HD1 LEU 7 14.384 7.364 -9.302
61 1HD2 LEU 7 1HD2 LEU 7 13.101 6.243 -7.009
62 2HD2 LEU 7 2HD2 LEU 7 11.815 5.445 -7.914
63 3HD2 LEU 7 3HD2 LEU 7 12.422 7.014 -8.443
64 H HIS 8 H HIS 8 16.090 3.716 -9.225
65 HA HIS 8 HA HIS 8 16.839 0.978 -9.232
66 1HB HIS 8 2HB HIS 8 18.371 1.729 -7.322
67 2HB HIS 8 1HB HIS 8 18.598 2.515 -8.881
68 HD1 HIS 8 1HD HIS 8 15.663 3.769 -7.104
69 HD2 HIS 8 2HD HIS 8 19.726 4.630 -7.228
70 HE1 HIS 8 1HE HIS 8 15.899 6.048 -6.068
71 HE2 HIS 8 2HE HIS 8 18.374 6.522 -6.094
72 H LYS 9 H LYS 9 15.749 -0.571 -8.263
73 HA LYS 9 HA LYS 9 13.830 -0.134 -6.237
74 1HB LYS 9 2HB LYS 9 14.935 -2.446 -7.691
75 2HB LYS 9 1HB LYS 9 14.316 -2.808 -6.085
76 1HG LYS 9 2HG LYS 9 12.163 -1.839 -6.685
77 2HG LYS 9 1HG LYS 9 12.781 -1.450 -8.290
78 1HD LYS 9 2HD LYS 9 13.174 -4.246 -7.568
79 2HD LYS 9 1HD LYS 9 11.476 -3.771 -7.569
80 1HE LYS 9 2HE LYS 9 12.332 -2.613 -9.863
81 2HE LYS 9 1HE LYS 9 13.374 -4.033 -9.801
82 1HZ LYS 9 1HZ LYS 9 11.209 -5.296 -9.362
83 2HZ LYS 9 2HZ LYS 9 11.505 -4.758 -10.938
84 3HZ LYS 9 3HZ LYS 9 10.429 -3.912 -9.945
85 H GLU 10 H GLU 10 14.392 0.554 -4.278
86 HA GLU 10 HA GLU 10 16.777 -0.542 -2.980
87 1HB GLU 10 2HB GLU 10 16.466 1.233 -1.324
88 2HB GLU 10 1HB GLU 10 16.504 1.901 -2.951
89 1HG GLU 10 2HG GLU 10 13.835 1.472 -2.572
90 2HG GLU 10 1HG GLU 10 14.375 1.925 -0.956
91 HA PRO 11 HA PRO 11 14.508 -3.346 -0.464
92 1HB PRO 11 2HB PRO 11 15.740 -3.014 1.981
93 2HB PRO 11 1HB PRO 11 16.380 -4.000 0.662
94 1HG PRO 11 2HG PRO 11 17.099 -1.211 1.465
95 2HG PRO 11 1HG PRO 11 18.153 -2.531 0.922
96 1HD PRO 11 2HD PRO 11 17.444 -0.520 -0.716
97 2HD PRO 11 1HD PRO 11 17.649 -2.181 -1.311
98 H ALA 12 H ALA 12 12.488 -2.965 0.103
99 HA ALA 12 HA ALA 12 11.917 -1.188 2.340
100 1HB ALA 12 1HB ALA 12 11.667 -0.064 -0.047
101 2HB ALA 12 2HB ALA 12 10.528 0.267 1.259
102 3HB ALA 12 3HB ALA 12 10.112 -0.894 -0.002
103 H THR 13 H THR 13 10.996 -2.634 3.692
104 HA THR 13 HA THR 13 8.848 -4.319 2.580
105 HB THR 13 HB THR 13 10.636 -5.086 4.890
106 HG1 THR 13 1HG THR 13 11.774 -6.322 3.448
107 1HG2 THR 13 1HG2 THR 13 8.494 -6.490 3.367
108 2HG2 THR 13 2HG2 THR 13 8.792 -6.437 5.106
109 3HG2 THR 13 3HG2 THR 13 9.832 -7.407 4.062
110 H LEU 14 H LEU 14 7.006 -4.613 3.818
111 HA LEU 14 HA LEU 14 6.570 -2.573 5.852
112 1HB LEU 14 2HB LEU 14 4.160 -3.635 5.671
113 2HB LEU 14 1HB LEU 14 4.747 -2.478 4.493
114 HG LEU 14 HG LEU 14 5.184 -5.367 3.929
115 1HD1 LEU 14 1HD1 LEU 14 3.014 -5.807 3.237
116 2HD1 LEU 14 2HD1 LEU 14 2.559 -4.102 3.250
117 3HD1 LEU 14 3HD1 LEU 14 2.781 -4.967 4.770
118 1HD2 LEU 14 1HD2 LEU 14 4.310 -3.113 2.137
119 2HD2 LEU 14 2HD2 LEU 14 5.000 -4.666 1.669
120 3HD2 LEU 14 3HD2 LEU 14 6.000 -3.470 2.492
121 H ILE 15 H ILE 15 5.924 -2.983 7.948
122 HA ILE 15 HA ILE 15 6.742 -5.564 8.982
123 HB ILE 15 HB ILE 15 7.446 -3.490 10.117
124 1HG1 ILE 15 2HG1 ILE 15 6.500 -4.214 12.456
125 2HG1 ILE 15 1HG1 ILE 15 5.814 -5.557 11.548
126 1HG2 ILE 15 1HG2 ILE 15 4.565 -3.188 10.942
127 2HG2 ILE 15 2HG2 ILE 15 5.340 -2.235 9.676
128 3HG2 ILE 15 3HG2 ILE 15 5.912 -2.123 11.341
129 1HD1 ILE 15 1HD1 ILE 15 8.442 -5.250 12.553
130 2HD1 ILE 15 2HD1 ILE 15 8.525 -5.309 10.792
131 3HD1 ILE 15 3HD1 ILE 15 7.744 -6.616 11.682
132 H LYS 16 H LYS 16 3.798 -3.568 8.983
133 HA LYS 16 HA LYS 16 2.044 -5.732 8.751
134 1HB LYS 16 2HB LYS 16 3.039 -5.862 11.215
135 2HB LYS 16 1HB LYS 16 1.786 -4.665 11.520
136 1HG LYS 16 2HG LYS 16 0.473 -6.429 11.886
137 2HG LYS 16 1HG LYS 16 0.405 -6.552 10.127
138 1HD LYS 16 2HD LYS 16 2.657 -7.920 10.543
139 2HD LYS 16 1HD LYS 16 1.877 -8.210 12.099
140 1HE LYS 16 2HE LYS 16 0.060 -8.547 9.852
141 2HE LYS 16 1HE LYS 16 1.452 -9.625 9.766
142 1HZ LYS 16 1HZ LYS 16 0.792 -10.769 11.577
143 2HZ LYS 16 2HZ LYS 16 -0.738 -10.199 11.132
144 3HZ LYS 16 3HZ LYS 16 0.133 -9.417 12.352
145 H ALA 17 H ALA 17 0.067 -5.019 8.183
146 HA ALA 17 HA ALA 17 -0.485 -2.146 8.559
147 1HB ALA 17 1HB ALA 17 -0.086 -2.976 6.207
148 2HB ALA 17 2HB ALA 17 -1.600 -2.112 6.472
149 3HB ALA 17 3HB ALA 17 -1.597 -3.872 6.359
150 H ILE 18 H ILE 18 -2.629 -1.499 9.022
151 HA ILE 18 HA ILE 18 -4.017 -3.064 10.856
152 HB ILE 18 HB ILE 18 -4.289 -0.624 10.693
153 1HG1 ILE 18 2HG1 ILE 18 -7.028 -0.928 10.503
154 2HG1 ILE 18 1HG1 ILE 18 -6.481 -2.553 10.905
155 1HG2 ILE 18 1HG2 ILE 18 -4.363 -0.543 8.206
156 2HG2 ILE 18 2HG2 ILE 18 -5.620 0.409 8.997
157 3HG2 ILE 18 3HG2 ILE 18 -6.015 -1.154 8.285
158 1HD1 ILE 18 1HD1 ILE 18 -6.585 -1.841 13.013
159 2HD1 ILE 18 2HD1 ILE 18 -6.577 -0.142 12.541
160 3HD1 ILE 18 3HD1 ILE 18 -5.059 -1.031 12.660
161 H ASP 19 H ASP 19 -4.692 -2.512 7.425
162 HA ASP 19 HA ASP 19 -5.468 -5.019 6.718
163 1HB ASP 19 2HB ASP 19 -7.255 -4.867 8.419
164 2HB ASP 19 1HB ASP 19 -7.908 -3.449 7.607
165 H GLY 20 H GLY 20 -8.056 -2.986 5.795
166 1HA GLY 20 2HA GLY 20 -6.771 -2.550 3.211
167 2HA GLY 20 1HA GLY 20 -8.487 -2.405 3.556
168 H ASP 21 H ASP 21 -7.318 -0.810 6.060
169 HA ASP 21 HA ASP 21 -7.768 1.745 4.817
170 1HB ASP 21 2HB ASP 21 -7.219 0.902 7.659
171 2HB ASP 21 1HB ASP 21 -7.380 2.592 7.189
172 H THR 22 H THR 22 -5.302 1.378 7.300
173 HA THR 22 HA THR 22 -3.447 2.823 5.565
174 HB THR 22 HB THR 22 -2.984 2.222 8.472
175 HG1 THR 22 1HG THR 22 -4.670 4.185 7.342
176 1HG2 THR 22 1HG2 THR 22 -1.832 4.363 8.461
177 2HG2 THR 22 2HG2 THR 22 -2.204 4.561 6.748
178 3HG2 THR 22 3HG2 THR 22 -1.141 3.256 7.274
179 H VAL 23 H VAL 23 -1.182 2.251 5.551
180 HA VAL 23 HA VAL 23 -0.504 -0.496 6.242
181 HB VAL 23 HB VAL 23 0.276 0.318 3.489
182 1HG1 VAL 23 1HG1 VAL 23 0.863 -1.834 4.846
183 2HG1 VAL 23 2HG1 VAL 23 0.498 -1.943 3.125
184 3HG1 VAL 23 3HG1 VAL 23 -0.733 -2.365 4.315
185 1HG2 VAL 23 1HG2 VAL 23 -1.785 -0.518 2.508
186 2HG2 VAL 23 2HG2 VAL 23 -2.120 0.863 3.552
187 3HG2 VAL 23 3HG2 VAL 23 -2.467 -0.774 4.115
188 H LYS 24 H LYS 24 1.229 -0.136 7.486
189 HA LYS 24 HA LYS 24 3.034 2.055 6.948
190 1HB LYS 24 2HB LYS 24 2.227 0.987 9.251
191 2HB LYS 24 1HB LYS 24 3.661 -0.000 9.007
192 1HG LYS 24 2HG LYS 24 4.296 1.839 10.352
193 2HG LYS 24 1HG LYS 24 4.965 2.122 8.743
194 1HD LYS 24 2HD LYS 24 4.071 4.193 9.317
195 2HD LYS 24 1HD LYS 24 2.801 3.469 8.330
196 1HE LYS 24 2HE LYS 24 1.629 4.310 10.147
197 2HE LYS 24 1HE LYS 24 1.859 2.614 10.575
198 1HZ LYS 24 1HZ LYS 24 4.025 3.644 11.670
199 2HZ LYS 24 2HZ LYS 24 2.550 3.559 12.493
200 3HZ LYS 24 3HZ LYS 24 3.027 5.007 11.763
201 H LEU 25 H LEU 25 5.214 1.906 6.453
202 HA LEU 25 HA LEU 25 6.131 -0.715 5.472
203 1HB LEU 25 2HB LEU 25 6.182 1.963 4.165
204 2HB LEU 25 1HB LEU 25 7.521 0.870 3.867
205 HG LEU 25 HG LEU 25 4.727 -0.114 3.472
206 1HD1 LEU 25 1HD1 LEU 25 5.036 2.124 2.313
207 2HD1 LEU 25 2HD1 LEU 25 4.571 0.759 1.297
208 3HD1 LEU 25 3HD1 LEU 25 6.244 1.318 1.312
209 1HD2 LEU 25 1HD2 LEU 25 7.393 -0.707 2.195
210 2HD2 LEU 25 2HD2 LEU 25 5.864 -1.444 1.722
211 3HD2 LEU 25 3HD2 LEU 25 6.515 -1.725 3.336
212 H MET 26 H MET 26 8.062 -1.373 6.202
213 HA MET 26 HA MET 26 9.475 0.321 8.078
214 1HB MET 26 2HB MET 26 8.975 -2.179 8.378
215 2HB MET 26 1HB MET 26 10.286 -2.455 7.239
216 1HG MET 26 2HG MET 26 11.603 -2.496 9.027
217 2HG MET 26 1HG MET 26 11.432 -0.741 9.031
218 1HE MET 26 1HE MET 26 11.759 -3.421 11.235
219 2HE MET 26 2HE MET 26 10.245 -4.134 10.680
220 3HE MET 26 3HE MET 26 10.377 -3.518 12.326
221 H TYR 27 H TYR 27 10.661 1.852 7.069
222 HA TYR 27 HA TYR 27 12.703 0.909 5.167
223 1HB TYR 27 2HB TYR 27 10.877 2.263 4.085
224 2HB TYR 27 1HB TYR 27 11.381 3.627 5.077
225 HD1 TYR 27 1HD TYR 27 12.645 5.186 3.957
226 HD2 TYR 27 2HD TYR 27 13.080 1.085 2.915
227 HE1 TYR 27 1HE TYR 27 14.322 5.799 2.267
228 HE2 TYR 27 2HE TYR 27 14.760 1.687 1.221
229 HH TYR 27 HH TYR 27 15.472 3.565 -0.080
230 H LYS 28 H LYS 28 14.605 1.010 6.140
231 HA LYS 28 HA LYS 28 16.292 1.627 7.541
232 1HB LYS 28 2HB LYS 28 17.095 3.866 7.240
233 2HB LYS 28 1HB LYS 28 16.433 3.312 5.710
234 1HG LYS 28 2HG LYS 28 14.647 4.753 5.803
235 2HG LYS 28 1HG LYS 28 14.703 4.883 7.561
236 1HD LYS 28 2HD LYS 28 15.449 6.952 6.509
237 2HD LYS 28 1HD LYS 28 16.766 6.188 7.399
238 1HE LYS 28 2HE LYS 28 17.257 5.092 5.053
239 2HE LYS 28 1HE LYS 28 16.378 6.500 4.462
240 1HZ LYS 28 1HZ LYS 28 18.646 6.737 6.350
241 2HZ LYS 28 2HZ LYS 28 17.950 7.946 5.393
242 3HZ LYS 28 3HZ LYS 28 18.869 6.723 4.672
243 H GLY 29 H GLY 29 13.637 1.403 8.777
244 1HA GLY 29 2HA GLY 29 13.159 1.509 11.084
245 2HA GLY 29 1HA GLY 29 14.290 2.844 11.234
246 H GLN 30 H GLN 30 12.890 4.041 8.765
247 HA GLN 30 HA GLN 30 10.950 5.540 10.307
248 1HB GLN 30 2HB GLN 30 12.534 6.688 8.798
249 2HB GLN 30 1HB GLN 30 11.809 5.862 7.426
250 1HG GLN 30 2HG GLN 30 9.791 7.046 7.647
251 2HG GLN 30 1HG GLN 30 10.215 7.624 9.258
252 1HE2 GLN 30 1HE2 GLN 30 10.977 7.889 5.840
253 2HE2 GLN 30 2HE2 GLN 30 11.667 9.471 5.924
254 HA PRO 31 HA PRO 31 7.703 2.890 8.652
255 1HB PRO 31 2HB PRO 31 5.735 3.722 10.275
256 2HB PRO 31 1HB PRO 31 7.035 2.675 10.857
257 1HG PRO 31 2HG PRO 31 6.707 5.634 11.165
258 2HG PRO 31 1HG PRO 31 7.235 4.437 12.361
259 1HD PRO 31 2HD PRO 31 8.948 6.040 10.947
260 2HD PRO 31 1HD PRO 31 9.394 4.451 11.597
261 H MET 32 H MET 32 7.324 3.689 6.611
262 HA MET 32 HA MET 32 5.875 6.222 6.354
263 1HB MET 32 2HB MET 32 7.563 4.581 4.524
264 2HB MET 32 1HB MET 32 6.308 5.586 3.813
265 1HG MET 32 2HG MET 32 7.356 7.457 5.283
266 2HG MET 32 1HG MET 32 8.759 6.391 5.304
267 1HE MET 32 1HE MET 32 9.982 9.011 3.374
268 2HE MET 32 2HE MET 32 8.717 9.129 4.596
269 3HE MET 32 3HE MET 32 8.400 9.657 2.944
270 H THR 33 H THR 33 3.770 6.285 5.910
271 HA THR 33 HA THR 33 2.430 3.764 5.210
272 HB THR 33 HB THR 33 1.536 4.588 7.234
273 HG1 THR 33 1HG THR 33 -0.208 5.621 5.258
274 1HG2 THR 33 1HG2 THR 33 1.749 7.263 5.965
275 2HG2 THR 33 2HG2 THR 33 2.174 6.744 7.596
276 3HG2 THR 33 3HG2 THR 33 0.482 6.985 7.160
277 H PHE 34 H PHE 34 1.104 3.610 3.447
278 HA PHE 34 HA PHE 34 0.880 5.997 1.738
279 1HB PHE 34 2HB PHE 34 1.257 4.636 -0.233
280 2HB PHE 34 1HB PHE 34 2.609 4.439 0.876
281 HD1 PHE 34 1HD PHE 34 -0.360 2.831 -0.558
282 HD2 PHE 34 2HD PHE 34 3.066 2.335 1.916
283 HE1 PHE 34 1HE PHE 34 -0.668 0.392 -0.628
284 HE2 PHE 34 2HE PHE 34 2.766 -0.106 1.850
285 HZ PHE 34 HZ PHE 34 0.897 -1.082 0.576
286 H ARG 35 H ARG 35 -0.964 6.112 0.391
287 HA ARG 35 HA ARG 35 -3.181 5.928 -0.076
288 1HB ARG 35 2HB ARG 35 -2.467 3.695 -0.885
289 2HB ARG 35 1HB ARG 35 -2.797 3.035 0.711
290 1HG ARG 35 2HG ARG 35 -4.973 2.849 0.296
291 2HG ARG 35 1HG ARG 35 -5.068 4.483 -0.367
292 1HD ARG 35 2HD ARG 35 -4.057 2.058 -1.849
293 2HD ARG 35 1HD ARG 35 -5.671 2.748 -2.015
294 HE ARG 35 HE ARG 35 -4.066 4.843 -2.569
295 1HH1 ARG 35 1HH1 ARG 35 -4.182 1.569 -3.774
296 2HH1 ARG 35 2HH1 ARG 35 -3.570 1.992 -5.338
297 1HH2 ARG 35 1HH2 ARG 35 -3.262 5.399 -4.626
298 2HH2 ARG 35 2HH2 ARG 35 -3.048 4.165 -5.821
299 H LEU 36 H LEU 36 -4.253 7.128 1.383
300 HA LEU 36 HA LEU 36 -5.286 5.729 3.734
301 1HB LEU 36 2HB LEU 36 -4.906 7.583 5.206
302 2HB LEU 36 1HB LEU 36 -3.389 7.091 4.488
303 HG LEU 36 HG LEU 36 -3.166 9.359 4.410
304 1HD1 LEU 36 1HD1 LEU 36 -3.449 10.178 2.190
305 2HD1 LEU 36 2HD1 LEU 36 -4.691 8.978 1.846
306 3HD1 LEU 36 3HD1 LEU 36 -3.023 8.471 2.102
307 1HD2 LEU 36 1HD2 LEU 36 -4.850 10.613 5.094
308 2HD2 LEU 36 2HD2 LEU 36 -6.008 9.337 4.715
309 3HD2 LEU 36 3HD2 LEU 36 -5.551 10.509 3.479
310 H LEU 37 H LEU 37 -7.333 5.518 3.092
311 HA LEU 37 HA LEU 37 -8.809 7.994 2.488
312 1HB LEU 37 2HB LEU 37 -8.811 5.365 1.103
313 2HB LEU 37 1HB LEU 37 -10.350 6.193 1.256
314 HG LEU 37 HG LEU 37 -8.663 8.178 0.329
315 1HD1 LEU 37 1HD1 LEU 37 -7.747 5.527 -0.620
316 2HD1 LEU 37 2HD1 LEU 37 -6.848 7.027 -0.390
317 3HD1 LEU 37 3HD1 LEU 37 -7.869 6.820 -1.813
318 1HD2 LEU 37 1HD2 LEU 37 -10.265 6.420 -1.498
319 2HD2 LEU 37 2HD2 LEU 37 -10.019 8.166 -1.570
320 3HD2 LEU 37 3HD2 LEU 37 -11.040 7.471 -0.312
321 H LEU 38 H LEU 38 -10.444 8.414 3.825
322 HA LEU 38 HA LEU 38 -11.585 6.186 5.379
323 1HB LEU 38 2HB LEU 38 -10.106 8.354 6.366
324 2HB LEU 38 1HB LEU 38 -11.776 8.715 6.760
325 HG LEU 38 HG LEU 38 -10.658 7.550 8.594
326 1HD1 LEU 38 1HD1 LEU 38 -12.265 5.414 8.441
327 2HD1 LEU 38 2HD1 LEU 38 -12.980 6.408 7.174
328 3HD1 LEU 38 3HD1 LEU 38 -12.846 7.035 8.816
329 1HD2 LEU 38 1HD2 LEU 38 -10.395 5.208 6.716
330 2HD2 LEU 38 2HD2 LEU 38 -9.844 5.309 8.389
331 3HD2 LEU 38 3HD2 LEU 38 -9.069 6.287 7.143
332 H VAL 39 H VAL 39 -13.662 5.914 4.957
333 HA VAL 39 HA VAL 39 -15.309 8.279 4.346
334 HB VAL 39 HB VAL 39 -15.694 5.569 3.074
335 1HG1 VAL 39 1HG1 VAL 39 -17.415 6.492 1.856
336 2HG1 VAL 39 2HG1 VAL 39 -16.809 8.137 2.045
337 3HG1 VAL 39 3HG1 VAL 39 -17.598 7.328 3.399
338 1HG2 VAL 39 1HG2 VAL 39 -14.973 7.138 1.017
339 2HG2 VAL 39 2HG2 VAL 39 -13.835 6.138 1.917
340 3HG2 VAL 39 3HG2 VAL 39 -13.992 7.852 2.297
341 H ASP 40 H ASP 40 -16.960 8.521 5.696
342 HA ASP 40 HA ASP 40 -17.931 6.156 7.161
343 1HB ASP 40 2HB ASP 40 -16.737 8.186 8.364
344 2HB ASP 40 1HB ASP 40 -18.334 8.918 8.228
345 H THR 41 H THR 41 -19.874 5.529 6.521
346 HA THR 41 HA THR 41 -21.954 7.524 6.080
347 HB THR 41 HB THR 41 -22.210 5.459 4.078
348 HG1 THR 41 1HG THR 41 -20.209 5.329 3.489
349 1HG2 THR 41 1HG2 THR 41 -23.408 7.456 3.769
350 2HG2 THR 41 2HG2 THR 41 -22.145 7.448 2.538
351 3HG2 THR 41 3HG2 THR 41 -21.965 8.446 3.982
352 HA PRO 42 HA PRO 42 -24.162 4.650 8.669
353 1HB PRO 42 2HB PRO 42 -26.527 5.824 7.294
354 2HB PRO 42 1HB PRO 42 -26.201 5.649 9.022
355 1HG PRO 42 2HG PRO 42 -25.991 8.023 7.837
356 2HG PRO 42 1HG PRO 42 -24.839 7.526 9.091
357 1HD PRO 42 2HD PRO 42 -24.489 7.633 6.126
358 2HD PRO 42 1HD PRO 42 -23.325 8.000 7.416
359 H GLU 43 H GLU 43 -25.540 5.125 5.406
360 HA GLU 43 HA GLU 43 -26.379 2.358 5.304
361 1HB GLU 43 2HB GLU 43 -27.316 4.695 4.166
362 2HB GLU 43 1HB GLU 43 -26.560 3.870 2.808
363 1HG GLU 43 2HG GLU 43 -28.498 2.471 4.615
364 2HG GLU 43 1HG GLU 43 -29.037 3.445 3.248
365 H THR 44 H THR 44 -23.951 4.416 3.774
366 HA THR 44 HA THR 44 -22.927 2.123 2.272
367 HB THR 44 HB THR 44 -21.300 4.252 1.637
368 HG1 THR 44 1HG THR 44 -22.758 5.985 1.304
369 1HG2 THR 44 1HG2 THR 44 -23.882 3.903 0.188
370 2HG2 THR 44 2HG2 THR 44 -22.659 2.633 0.159
371 3HG2 THR 44 3HG2 THR 44 -22.272 4.242 -0.449
372 H LYS 45 H LYS 45 -21.853 0.890 3.768
373 HA LYS 45 HA LYS 45 -19.578 2.188 5.119
374 1HB LYS 45 2HB LYS 45 -21.512 1.199 6.535
375 2HB LYS 45 1HB LYS 45 -20.831 -0.361 6.096
376 1HG LYS 45 2HG LYS 45 -19.973 0.272 8.232
377 2HG LYS 45 1HG LYS 45 -18.664 0.373 7.053
378 1HD LYS 45 2HD LYS 45 -18.305 2.423 7.877
379 2HD LYS 45 1HD LYS 45 -19.742 2.897 6.970
380 1HE LYS 45 2HE LYS 45 -21.054 2.992 8.826
381 2HE LYS 45 1HE LYS 45 -20.159 1.719 9.657
382 1HZ LYS 45 1HZ LYS 45 -19.424 3.468 10.850
383 2HZ LYS 45 2HZ LYS 45 -19.694 4.591 9.615
384 3HZ LYS 45 3HZ LYS 45 -18.312 3.614 9.582
385 H HIS 46 H HIS 46 -19.726 0.961 2.429
386 HA HIS 46 HA HIS 46 -17.477 -0.880 2.773
387 1HB HIS 46 2HB HIS 46 -19.841 -1.486 0.984
388 2HB HIS 46 1HB HIS 46 -18.392 -2.469 1.158
389 HD1 HIS 46 1HD HIS 46 -21.083 -1.115 3.497
390 HD2 HIS 46 2HD HIS 46 -18.795 -4.523 2.853
391 HE1 HIS 46 1HE HIS 46 -21.841 -2.772 5.231
392 HE2 HIS 46 2HE HIS 46 -20.504 -4.855 4.765
393 HA PRO 47 HA PRO 47 -16.947 2.189 -0.709
394 1HB PRO 47 2HB PRO 47 -14.797 3.446 0.723
395 2HB PRO 47 1HB PRO 47 -16.360 4.133 0.285
396 1HG PRO 47 2HG PRO 47 -15.560 3.596 2.865
397 2HG PRO 47 1HG PRO 47 -17.248 3.725 2.342
398 1HD PRO 47 2HD PRO 47 -15.592 1.283 2.828
399 2HD PRO 47 1HD PRO 47 -17.304 1.579 3.197
400 H LYS 48 H LYS 48 -14.140 1.388 1.335
401 HA LYS 48 HA LYS 48 -13.032 -0.352 -0.677
402 1HB LYS 48 2HB LYS 48 -10.866 1.010 -0.738
403 2HB LYS 48 1HB LYS 48 -12.221 1.613 -1.683
404 1HG LYS 48 2HG LYS 48 -12.587 2.881 0.710
405 2HG LYS 48 1HG LYS 48 -10.828 2.808 0.587
406 1HD LYS 48 2HD LYS 48 -10.762 4.268 -1.128
407 2HD LYS 48 1HD LYS 48 -12.211 3.598 -1.883
408 1HE LYS 48 2HE LYS 48 -13.368 4.721 0.220
409 2HE LYS 48 1HE LYS 48 -11.940 5.752 0.146
410 1HZ LYS 48 1HZ LYS 48 -14.093 6.339 -1.188
411 2HZ LYS 48 2HZ LYS 48 -13.445 5.265 -2.323
412 3HZ LYS 48 3HZ LYS 48 -12.562 6.627 -1.853
413 H LYS 49 H LYS 49 -13.848 -0.469 2.127
414 HA LYS 49 HA LYS 49 -11.512 -0.556 3.762
415 1HB LYS 49 2HB LYS 49 -14.248 -0.607 4.208
416 2HB LYS 49 1HB LYS 49 -13.727 -2.220 4.676
417 1HG LYS 49 2HG LYS 49 -11.848 -0.781 5.923
418 2HG LYS 49 1HG LYS 49 -13.163 0.395 5.922
419 1HD LYS 49 2HD LYS 49 -14.521 -0.926 7.239
420 2HD LYS 49 1HD LYS 49 -13.711 -2.419 6.761
421 1HE LYS 49 2HE LYS 49 -11.663 -1.316 7.983
422 2HE LYS 49 1HE LYS 49 -12.922 -0.392 8.801
423 1HZ LYS 49 1HZ LYS 49 -12.302 -2.419 10.005
424 2HZ LYS 49 2HZ LYS 49 -12.798 -3.358 8.689
425 3HZ LYS 49 3HZ LYS 49 -13.930 -2.434 9.543
426 H GLY 50 H GLY 50 -12.664 -2.610 1.355
427 1HA GLY 50 2HA GLY 50 -11.113 -4.414 0.731
428 2HA GLY 50 1HA GLY 50 -11.046 -4.833 2.437
429 H VAL 51 H VAL 51 -13.677 -4.831 3.172
430 HA VAL 51 HA VAL 51 -14.581 -7.330 2.328
431 HB VAL 51 HB VAL 51 -15.283 -6.299 4.446
432 1HG1 VAL 51 1HG1 VAL 51 -17.226 -4.683 4.326
433 2HG1 VAL 51 2HG1 VAL 51 -16.816 -4.458 2.626
434 3HG1 VAL 51 3HG1 VAL 51 -15.648 -4.035 3.878
435 1HG2 VAL 51 1HG2 VAL 51 -17.900 -6.698 3.205
436 2HG2 VAL 51 2HG2 VAL 51 -17.102 -7.607 4.488
437 3HG2 VAL 51 3HG2 VAL 51 -16.722 -7.949 2.799
438 H GLU 52 H GLU 52 -14.696 -4.397 0.707
439 HA GLU 52 HA GLU 52 -17.060 -4.242 -0.627
440 1HB GLU 52 2HB GLU 52 -15.093 -2.724 -0.927
441 2HB GLU 52 1HB GLU 52 -14.359 -3.950 -1.952
442 1HG GLU 52 2HG GLU 52 -16.921 -3.552 -2.989
443 2HG GLU 52 1HG GLU 52 -16.310 -1.945 -2.602
444 H LYS 53 H LYS 53 -14.336 -6.381 -1.414
445 HA LYS 53 HA LYS 53 -16.146 -7.863 -3.201
446 1HB LYS 53 2HB LYS 53 -13.843 -6.773 -3.969
447 2HB LYS 53 1HB LYS 53 -13.206 -8.281 -3.336
448 1HG LYS 53 2HG LYS 53 -13.586 -8.515 -5.689
449 2HG LYS 53 1HG LYS 53 -14.754 -9.513 -4.820
450 1HD LYS 53 2HD LYS 53 -16.094 -7.143 -5.053
451 2HD LYS 53 1HD LYS 53 -15.176 -7.191 -6.559
452 1HE LYS 53 2HE LYS 53 -16.067 -9.456 -6.988
453 2HE LYS 53 1HE LYS 53 -17.041 -9.324 -5.524
454 1HZ LYS 53 1HZ LYS 53 -18.544 -8.628 -7.057
455 2HZ LYS 53 2HZ LYS 53 -17.378 -7.998 -8.107
456 3HZ LYS 53 3HZ LYS 53 -17.825 -7.133 -6.724
457 H TYR 54 H TYR 54 -14.020 -8.068 -0.423
458 HA TYR 54 HA TYR 54 -15.237 -10.492 0.409
459 1HB TYR 54 2HB TYR 54 -13.280 -10.962 -1.433
460 2HB TYR 54 1HB TYR 54 -12.381 -11.090 0.073
461 HD1 TYR 54 1HD TYR 54 -13.265 -13.213 -2.127
462 HD2 TYR 54 2HD TYR 54 -14.614 -12.223 1.785
463 HE1 TYR 54 1HE TYR 54 -14.104 -15.505 -1.841
464 HE2 TYR 54 2HE TYR 54 -15.454 -14.514 2.082
465 HH TYR 54 HH TYR 54 -16.136 -16.410 0.772
466 H GLY 55 H GLY 55 -12.762 -8.057 0.811
467 1HA GLY 55 2HA GLY 55 -12.201 -7.012 2.815
468 2HA GLY 55 1HA GLY 55 -13.083 -8.245 3.680
469 HA PRO 56 HA PRO 56 -9.291 -9.850 5.340
470 1HB PRO 56 2HB PRO 56 -10.469 -12.449 4.409
471 2HB PRO 56 1HB PRO 56 -9.665 -12.068 5.938
472 1HG PRO 56 2HG PRO 56 -12.318 -12.177 5.808
473 2HG PRO 56 1HG PRO 56 -11.509 -10.934 6.779
474 1HD PRO 56 2HD PRO 56 -12.936 -10.680 4.197
475 2HD PRO 56 1HD PRO 56 -12.699 -9.474 5.474
476 H GLU 57 H GLU 57 -10.428 -10.798 2.148
477 HA GLU 57 HA GLU 57 -7.927 -11.874 1.279
478 1HB GLU 57 2HB GLU 57 -10.570 -11.663 0.244
479 2HB GLU 57 1HB GLU 57 -9.477 -10.962 -0.939
480 1HG GLU 57 2HG GLU 57 -9.596 -13.187 -1.559
481 2HG GLU 57 1HG GLU 57 -8.097 -13.099 -0.635
482 H ALA 58 H ALA 58 -9.601 -8.771 0.849
483 HA ALA 58 HA ALA 58 -7.849 -7.492 -0.859
484 1HB ALA 58 1HB ALA 58 -9.673 -6.543 1.297
485 2HB ALA 58 2HB ALA 58 -9.734 -6.251 -0.441
486 3HB ALA 58 3HB ALA 58 -8.557 -5.396 0.557
487 H SER 59 H SER 59 -7.713 -7.617 2.693
488 HA SER 59 HA SER 59 -5.351 -6.102 2.956
489 1HB SER 59 2HB SER 59 -5.347 -6.764 5.232
490 2HB SER 59 1HB SER 59 -7.048 -6.696 4.774
491 HG SER 59 HG SER 59 -7.129 -8.885 4.719
492 H ALA 60 H ALA 60 -5.947 -9.542 2.529
493 HA ALA 60 HA ALA 60 -3.518 -10.660 3.109
494 1HB ALA 60 1HB ALA 60 -4.741 -11.618 0.603
495 2HB ALA 60 2HB ALA 60 -5.791 -11.596 2.020
496 3HB ALA 60 3HB ALA 60 -4.279 -12.505 2.055
497 H PHE 61 H PHE 61 -4.401 -8.756 0.294
498 HA PHE 61 HA PHE 61 -2.277 -9.311 -1.399
499 1HB PHE 61 2HB PHE 61 -3.373 -7.807 -2.639
500 2HB PHE 61 1HB PHE 61 -4.362 -7.389 -1.247
501 HD1 PHE 61 1HD PHE 61 -1.093 -6.613 -2.845
502 HD2 PHE 61 2HD PHE 61 -4.283 -5.243 -0.386
503 HE1 PHE 61 1HE PHE 61 -0.117 -4.354 -2.846
504 HE2 PHE 61 2HE PHE 61 -3.313 -2.981 -0.381
505 HZ PHE 61 HZ PHE 61 -1.228 -2.534 -1.613
506 H THR 62 H THR 62 -2.466 -6.991 1.266
507 HA THR 62 HA THR 62 0.369 -6.353 0.959
508 HB THR 62 HB THR 62 -0.413 -4.925 3.129
509 HG1 THR 62 1HG THR 62 -2.708 -5.026 1.474
510 1HG2 THR 62 1HG2 THR 62 -0.236 -4.357 0.273
511 2HG2 THR 62 2HG2 THR 62 0.396 -3.465 1.656
512 3HG2 THR 62 3HG2 THR 62 -1.286 -3.259 1.168
513 H LYS 63 H LYS 63 -1.820 -8.124 2.988
514 HA LYS 63 HA LYS 63 -0.107 -8.450 5.223
515 1HB LYS 63 2HB LYS 63 -2.720 -9.385 4.378
516 2HB LYS 63 1HB LYS 63 -1.806 -10.662 5.168
517 1HG LYS 63 2HG LYS 63 -2.044 -9.737 7.180
518 2HG LYS 63 1HG LYS 63 -1.658 -8.123 6.582
519 1HD LYS 63 2HD LYS 63 -3.848 -7.848 7.238
520 2HD LYS 63 1HD LYS 63 -4.047 -8.258 5.533
521 1HE LYS 63 2HE LYS 63 -4.756 -10.424 6.012
522 2HE LYS 63 1HE LYS 63 -4.068 -10.390 7.635
523 1HZ LYS 63 1HZ LYS 63 -5.843 -8.421 7.812
524 2HZ LYS 63 2HZ LYS 63 -6.200 -10.028 8.199
525 3HZ LYS 63 3HZ LYS 63 -6.629 -9.408 6.686
526 H LYS 64 H LYS 64 -0.252 -9.937 2.116
527 HA LYS 64 HA LYS 64 1.216 -12.297 2.921
528 1HB LYS 64 2HB LYS 64 -0.019 -11.294 0.404
529 2HB LYS 64 1HB LYS 64 1.334 -12.406 0.249
530 1HG LYS 64 2HG LYS 64 0.141 -14.034 1.645
531 2HG LYS 64 1HG LYS 64 -1.223 -12.921 1.753
532 1HD LYS 64 2HD LYS 64 -2.029 -13.778 -0.134
533 2HD LYS 64 1HD LYS 64 -0.607 -13.177 -0.985
534 1HE LYS 64 2HE LYS 64 0.524 -15.331 -0.072
535 2HE LYS 64 1HE LYS 64 -1.131 -15.897 0.145
536 1HZ LYS 64 1HZ LYS 64 -0.188 -14.815 -2.441
537 2HZ LYS 64 2HZ LYS 64 -1.543 -15.783 -2.136
538 3HZ LYS 64 3HZ LYS 64 0.010 -16.447 -2.035
539 H MET 65 H MET 65 1.779 -9.188 1.443
540 HA MET 65 HA MET 65 4.337 -9.579 0.408
541 1HB MET 65 2HB MET 65 2.573 -7.413 0.792
542 2HB MET 65 1HB MET 65 4.098 -6.943 1.527
543 1HG MET 65 2HG MET 65 4.251 -6.192 -0.668
544 2HG MET 65 1HG MET 65 5.186 -7.686 -0.649
545 1HE MET 65 1HE MET 65 3.344 -5.655 -2.629
546 2HE MET 65 2HE MET 65 2.527 -6.664 -3.822
547 3HE MET 65 3HE MET 65 4.281 -6.741 -3.657
548 H VAL 66 H VAL 66 3.324 -9.613 3.660
549 HA VAL 66 HA VAL 66 6.036 -9.007 4.611
550 HB VAL 66 HB VAL 66 4.997 -8.815 6.854
551 1HG1 VAL 66 1HG1 VAL 66 4.282 -6.632 6.542
552 2HG1 VAL 66 2HG1 VAL 66 3.500 -7.002 5.004
553 3HG1 VAL 66 3HG1 VAL 66 5.260 -6.922 5.102
554 1HG2 VAL 66 1HG2 VAL 66 2.413 -9.132 5.331
555 2HG2 VAL 66 2HG2 VAL 66 2.554 -8.653 7.023
556 3HG2 VAL 66 3HG2 VAL 66 3.071 -10.260 6.516
557 H GLU 67 H GLU 67 3.436 -11.413 4.894
558 HA GLU 67 HA GLU 67 5.218 -13.163 6.404
559 1HB GLU 67 2HB GLU 67 2.323 -13.605 5.664
560 2HB GLU 67 1HB GLU 67 3.266 -14.529 6.825
561 1HG GLU 67 2HG GLU 67 3.536 -12.026 7.818
562 2HG GLU 67 1HG GLU 67 1.925 -11.940 7.111
563 H ASN 68 H ASN 68 2.875 -13.838 3.817
564 HA ASN 68 HA ASN 68 4.142 -16.178 2.944
565 1HB ASN 68 2HB ASN 68 1.753 -15.012 2.430
566 2HB ASN 68 1HB ASN 68 2.597 -14.676 0.921
567 1HD2 ASN 68 1HD2 ASN 68 0.367 -16.547 1.796
568 2HD2 ASN 68 2HD2 ASN 68 0.827 -18.073 1.132
569 H ALA 69 H ALA 69 4.681 -12.846 2.104
570 HA ALA 69 HA ALA 69 6.299 -13.510 -0.207
571 1HB ALA 69 1HB ALA 69 4.762 -11.405 0.240
572 2HB ALA 69 2HB ALA 69 6.216 -11.300 -0.757
573 3HB ALA 69 3HB ALA 69 6.259 -10.764 0.923
574 H LYS 70 H LYS 70 8.482 -12.326 -0.356
575 HA LYS 70 HA LYS 70 10.019 -13.059 2.028
576 1HB LYS 70 2HB LYS 70 10.558 -13.016 -0.879
577 2HB LYS 70 1HB LYS 70 11.905 -12.554 0.152
578 1HG LYS 70 2HG LYS 70 10.452 -14.997 0.935
579 2HG LYS 70 1HG LYS 70 11.380 -15.081 -0.565
580 1HD LYS 70 2HD LYS 70 13.282 -14.021 0.835
581 2HD LYS 70 1HD LYS 70 12.337 -14.558 2.227
582 1HE LYS 70 2HE LYS 70 12.538 -16.679 0.306
583 2HE LYS 70 1HE LYS 70 14.146 -16.058 0.679
584 1HZ LYS 70 1HZ LYS 70 12.387 -16.498 2.951
585 2HZ LYS 70 2HZ LYS 70 14.042 -16.807 2.785
586 3HZ LYS 70 3HZ LYS 70 12.912 -17.891 2.146
587 H LYS 71 H LYS 71 10.143 -10.517 -0.485
588 HA LYS 71 HA LYS 71 10.395 -8.470 1.533
589 1HB LYS 71 2HB LYS 71 12.718 -9.351 -0.133
590 2HB LYS 71 1HB LYS 71 12.555 -7.649 0.278
591 1HG LYS 71 2HG LYS 71 13.704 -8.181 2.113
592 2HG LYS 71 1HG LYS 71 12.176 -8.843 2.699
593 1HD LYS 71 2HD LYS 71 13.585 -10.632 3.025
594 2HD LYS 71 1HD LYS 71 12.959 -10.986 1.413
595 1HE LYS 71 2HE LYS 71 14.948 -10.607 0.411
596 2HE LYS 71 1HE LYS 71 15.373 -9.297 1.513
597 1HZ LYS 71 1HZ LYS 71 16.120 -10.806 3.120
598 2HZ LYS 71 2HZ LYS 71 16.741 -11.398 1.661
599 3HZ LYS 71 3HZ LYS 71 15.388 -12.131 2.363
600 H ILE 72 H ILE 72 10.723 -6.279 0.469
601 HA ILE 72 HA ILE 72 9.663 -6.153 -2.254
602 HB ILE 72 HB ILE 72 8.441 -4.627 0.049
603 1HG1 ILE 72 2HG1 ILE 72 6.441 -6.121 -1.104
604 2HG1 ILE 72 1HG1 ILE 72 7.816 -7.220 -1.156
605 1HG2 ILE 72 1HG2 ILE 72 6.707 -4.350 -1.993
606 2HG2 ILE 72 2HG2 ILE 72 8.234 -4.382 -2.868
607 3HG2 ILE 72 3HG2 ILE 72 7.970 -3.184 -1.606
608 1HD1 ILE 72 1HD1 ILE 72 6.143 -6.932 0.949
609 2HD1 ILE 72 2HD1 ILE 72 7.455 -5.843 1.401
610 3HD1 ILE 72 3HD1 ILE 72 7.794 -7.540 1.055
611 H GLU 73 H GLU 73 9.942 -4.049 -3.249
612 HA GLU 73 HA GLU 73 11.869 -2.293 -1.902
613 1HB GLU 73 2HB GLU 73 12.117 -3.325 -4.732
614 2HB GLU 73 1HB GLU 73 13.135 -2.081 -4.023
615 1HG GLU 73 2HG GLU 73 14.359 -3.556 -2.848
616 2HG GLU 73 1HG GLU 73 12.984 -4.613 -2.532
617 H VAL 74 H VAL 74 12.168 -0.209 -3.233
618 HA VAL 74 HA VAL 74 9.497 0.681 -4.088
619 HB VAL 74 HB VAL 74 11.784 2.426 -3.176
620 1HG1 VAL 74 1HG1 VAL 74 9.182 2.938 -4.313
621 2HG1 VAL 74 2HG1 VAL 74 10.502 4.057 -3.977
622 3HG1 VAL 74 3HG1 VAL 74 9.333 3.671 -2.716
623 1HG2 VAL 74 1HG2 VAL 74 9.851 0.846 -1.643
624 2HG2 VAL 74 2HG2 VAL 74 9.923 2.549 -1.186
625 3HG2 VAL 74 3HG2 VAL 74 11.385 1.562 -1.145
626 H GLU 75 H GLU 75 9.245 0.893 -6.204
627 HA GLU 75 HA GLU 75 11.481 1.963 -7.798
628 1HB GLU 75 2HB GLU 75 11.016 -0.577 -8.029
629 2HB GLU 75 1HB GLU 75 9.584 -0.081 -8.918
630 1HG GLU 75 2HG GLU 75 11.688 1.391 -10.017
631 2HG GLU 75 1HG GLU 75 12.315 -0.240 -9.790
632 H PHE 76 H PHE 76 10.471 4.019 -7.669
633 HA PHE 76 HA PHE 76 7.921 4.252 -9.122
634 1HB PHE 76 2HB PHE 76 8.517 5.243 -6.669
635 2HB PHE 76 1HB PHE 76 8.971 6.609 -7.681
636 HD1 PHE 76 1HD PHE 76 6.985 6.543 -9.804
637 HD2 PHE 76 2HD PHE 76 6.538 5.811 -5.636
638 HE1 PHE 76 1HE PHE 76 4.625 7.223 -9.943
639 HE2 PHE 76 2HE PHE 76 4.176 6.488 -5.767
640 HZ PHE 76 HZ PHE 76 3.218 7.195 -7.923
641 H ASP 77 H ASP 77 7.866 5.252 -11.042
642 HA ASP 77 HA ASP 77 10.237 5.933 -12.403
643 1HB ASP 77 2HB ASP 77 7.733 5.350 -13.209
644 2HB ASP 77 1HB ASP 77 7.685 7.103 -13.369
645 H LYS 78 H LYS 78 7.608 8.016 -11.185
646 HA LYS 78 HA LYS 78 9.253 10.376 -11.608
647 1HB LYS 78 2HB LYS 78 6.632 10.062 -11.932
648 2HB LYS 78 1HB LYS 78 6.612 10.519 -10.235
649 1HG LYS 78 2HG LYS 78 8.305 12.364 -11.460
650 2HG LYS 78 1HG LYS 78 6.953 12.160 -12.575
651 1HD LYS 78 2HD LYS 78 6.147 12.385 -9.772
652 2HD LYS 78 1HD LYS 78 6.978 13.813 -10.390
653 1HE LYS 78 2HE LYS 78 5.386 13.642 -12.387
654 2HE LYS 78 1HE LYS 78 4.451 12.534 -11.384
655 1HZ LYS 78 1HZ LYS 78 4.082 15.165 -11.407
656 2HZ LYS 78 2HZ LYS 78 5.194 15.050 -10.139
657 3HZ LYS 78 3HZ LYS 78 3.738 14.193 -10.065
658 H GLY 79 H GLY 79 7.973 8.436 -8.973
659 1HA GLY 79 2HA GLY 79 8.599 8.311 -6.766
660 2HA GLY 79 1HA GLY 79 10.005 9.277 -7.184
661 H GLN 80 H GLN 80 6.561 9.470 -6.393
662 HA GLN 80 HA GLN 80 7.046 12.189 -5.363
663 1HB GLN 80 2HB GLN 80 4.860 11.063 -6.984
664 2HB GLN 80 1HB GLN 80 4.333 12.061 -5.634
665 1HG GLN 80 2HG GLN 80 6.466 13.079 -7.443
666 2HG GLN 80 1HG GLN 80 4.788 13.108 -7.982
667 1HE2 GLN 80 1HE2 GLN 80 3.293 14.393 -6.870
668 2HE2 GLN 80 2HE2 GLN 80 3.797 15.693 -5.850
669 H ARG 81 H ARG 81 7.229 12.110 -3.229
670 HA ARG 81 HA ARG 81 5.452 10.301 -1.728
671 1HB ARG 81 2HB ARG 81 8.086 11.460 -0.804
672 2HB ARG 81 1HB ARG 81 7.116 10.251 0.026
673 1HG ARG 81 2HG ARG 81 8.689 8.914 -0.932
674 2HG ARG 81 1HG ARG 81 7.469 8.908 -2.206
675 1HD ARG 81 2HD ARG 81 9.121 9.546 -3.570
676 2HD ARG 81 1HD ARG 81 8.966 11.129 -2.811
677 HE ARG 81 HE ARG 81 10.963 10.779 -1.739
678 1HH1 ARG 81 1HH1 ARG 81 9.831 7.751 -3.058
679 2HH1 ARG 81 2HH1 ARG 81 11.306 6.910 -2.719
680 1HH2 ARG 81 1HH2 ARG 81 12.902 9.671 -1.290
681 2HH2 ARG 81 2HH2 ARG 81 13.049 7.999 -1.714
682 H THR 82 H THR 82 6.565 13.573 -2.119
683 HA THR 82 HA THR 82 5.178 14.492 0.264
684 HB THR 82 HB THR 82 5.987 16.774 -0.650
685 HG1 THR 82 1HG THR 82 6.473 16.107 -2.748
686 1HG2 THR 82 1HG2 THR 82 8.279 16.443 0.126
687 2HG2 THR 82 2HG2 THR 82 8.019 14.697 0.127
688 3HG2 THR 82 3HG2 THR 82 7.098 15.726 1.224
689 H ASP 83 H ASP 83 4.081 16.820 -0.315
690 HA ASP 83 HA ASP 83 2.394 17.964 -1.357
691 1HB ASP 83 2HB ASP 83 2.110 15.754 -3.386
692 2HB ASP 83 1HB ASP 83 1.647 17.444 -3.540
693 H LYS 84 H LYS 84 1.780 14.453 -1.593
694 HA LYS 84 HA LYS 84 -0.968 14.705 -0.912
695 1HB LYS 84 2HB LYS 84 0.696 12.209 -0.599
696 2HB LYS 84 1HB LYS 84 -1.032 12.325 -0.892
697 1HG LYS 84 2HG LYS 84 0.636 13.574 -2.952
698 2HG LYS 84 1HG LYS 84 0.839 11.829 -2.789
699 1HD LYS 84 2HD LYS 84 -1.082 11.473 -3.851
700 2HD LYS 84 1HD LYS 84 -1.949 12.468 -2.682
701 1HE LYS 84 2HE LYS 84 -0.548 13.414 -5.179
702 2HE LYS 84 1HE LYS 84 -2.288 13.345 -4.907
703 1HZ LYS 84 1HZ LYS 84 -0.307 15.213 -3.799
704 2HZ LYS 84 2HZ LYS 84 -1.710 14.880 -2.912
705 3HZ LYS 84 3HZ LYS 84 -1.827 15.533 -4.468
706 H TYR 85 H TYR 85 1.571 13.012 0.929
707 HA TYR 85 HA TYR 85 0.792 14.363 3.368
708 1HB TYR 85 2HB TYR 85 -0.832 12.488 3.159
709 2HB TYR 85 1HB TYR 85 0.518 11.359 3.166
710 HD1 TYR 85 1HD TYR 85 1.308 10.513 5.187
711 HD2 TYR 85 2HD TYR 85 -1.053 14.053 5.208
712 HE1 TYR 85 1HE TYR 85 1.246 10.450 7.646
713 HE2 TYR 85 2HE TYR 85 -1.121 14.000 7.665
714 HH TYR 85 HH TYR 85 0.912 12.075 9.522
715 H GLY 86 H GLY 86 3.192 13.493 1.493
716 1HA GLY 86 2HA GLY 86 5.462 13.392 1.892
717 2HA GLY 86 1HA GLY 86 5.119 13.480 3.614
718 H ARG 87 H ARG 87 3.568 11.055 1.697
719 HA ARG 87 HA ARG 87 5.322 8.967 1.622
720 1HB ARG 87 2HB ARG 87 4.654 7.676 3.716
721 2HB ARG 87 1HB ARG 87 5.777 9.007 3.939
722 1HG ARG 87 2HG ARG 87 3.914 10.432 4.675
723 2HG ARG 87 1HG ARG 87 2.819 9.060 4.495
724 1HD ARG 87 2HD ARG 87 3.352 8.342 6.527
725 2HD ARG 87 1HD ARG 87 5.050 8.247 6.069
726 HE ARG 87 HE ARG 87 4.596 10.898 6.600
727 1HH1 ARG 87 1HH1 ARG 87 4.272 7.909 8.371
728 2HH1 ARG 87 2HH1 ARG 87 4.577 8.641 9.910
729 1HH2 ARG 87 1HH2 ARG 87 4.999 11.864 8.624
730 2HH2 ARG 87 2HH2 ARG 87 4.990 10.886 10.054
731 H GLY 88 H GLY 88 2.095 10.106 2.150
732 1HA GLY 88 2HA GLY 88 0.490 7.919 2.027
733 2HA GLY 88 1HA GLY 88 0.117 9.419 1.195
734 H LEU 89 H LEU 89 2.235 9.335 -0.715
735 HA LEU 89 HA LEU 89 1.194 7.181 -2.419
736 1HB LEU 89 2HB LEU 89 2.067 9.938 -2.880
737 2HB LEU 89 1HB LEU 89 2.699 8.800 -4.055
738 HG LEU 89 HG LEU 89 0.576 9.900 -4.747
739 1HD1 LEU 89 1HD1 LEU 89 0.965 7.953 -5.919
740 2HD1 LEU 89 2HD1 LEU 89 -0.616 7.634 -5.203
741 3HD1 LEU 89 3HD1 LEU 89 0.836 6.937 -4.483
742 1HD2 LEU 89 1HD2 LEU 89 -1.458 9.499 -3.671
743 2HD2 LEU 89 2HD2 LEU 89 -0.336 9.828 -2.351
744 3HD2 LEU 89 3HD2 LEU 89 -0.800 8.168 -2.720
745 H ALA 90 H ALA 90 2.401 5.407 -2.370
746 HA ALA 90 HA ALA 90 5.264 5.646 -2.888
747 1HB ALA 90 1HB ALA 90 5.660 3.844 -1.123
748 2HB ALA 90 2HB ALA 90 4.075 4.285 -0.491
749 3HB ALA 90 3HB ALA 90 5.365 5.486 -0.551
750 H TYR 91 H TYR 91 6.101 3.996 -4.098
751 HA TYR 91 HA TYR 91 4.169 1.982 -5.025
752 1HB TYR 91 2HB TYR 91 6.093 3.645 -6.385
753 2HB TYR 91 1HB TYR 91 6.444 1.949 -6.695
754 HD1 TYR 91 1HD TYR 91 5.065 4.513 -8.268
755 HD2 TYR 91 2HD TYR 91 3.838 0.703 -6.828
756 HE1 TYR 91 1HE TYR 91 3.277 4.459 -9.956
757 HE2 TYR 91 2HE TYR 91 2.048 0.637 -8.512
758 HH TYR 91 HH TYR 91 1.454 1.613 -10.609
759 H ILE 92 H ILE 92 4.463 -0.085 -4.500
760 HA ILE 92 HA ILE 92 7.142 -0.933 -3.609
761 HB ILE 92 HB ILE 92 5.921 -2.542 -2.076
762 1HG1 ILE 92 2HG1 ILE 92 3.640 -0.602 -2.495
763 2HG1 ILE 92 1HG1 ILE 92 3.694 -2.222 -3.181
764 1HG2 ILE 92 1HG2 ILE 92 7.068 -0.797 -1.036
765 2HG2 ILE 92 2HG2 ILE 92 5.434 -0.675 -0.387
766 3HG2 ILE 92 3HG2 ILE 92 5.960 0.426 -1.661
767 1HD1 ILE 92 1HD1 ILE 92 4.178 -2.301 -0.348
768 2HD1 ILE 92 2HD1 ILE 92 2.935 -3.109 -1.304
769 3HD1 ILE 92 3HD1 ILE 92 2.667 -1.470 -0.713
770 H TYR 93 H TYR 93 7.832 -2.958 -4.199
771 HA TYR 93 HA TYR 93 6.029 -4.651 -5.766
772 1HB TYR 93 2HB TYR 93 8.761 -3.762 -6.718
773 2HB TYR 93 1HB TYR 93 7.737 -4.947 -7.519
774 HD1 TYR 93 1HD TYR 93 8.029 -1.374 -6.610
775 HD2 TYR 93 2HD TYR 93 5.971 -4.268 -8.954
776 HE1 TYR 93 1HE TYR 93 6.953 0.432 -7.884
777 HE2 TYR 93 2HE TYR 93 4.889 -2.468 -10.235
778 HH TYR 93 HH TYR 93 5.902 0.528 -10.414
779 H ALA 94 H ALA 94 6.032 -6.466 -4.592
780 HA ALA 94 HA ALA 94 8.325 -7.308 -3.081
781 1HB ALA 94 1HB ALA 94 5.805 -7.607 -2.531
782 2HB ALA 94 2HB ALA 94 6.946 -8.881 -2.103
783 3HB ALA 94 3HB ALA 94 5.939 -9.046 -3.542
784 H ASP 95 H ASP 95 10.004 -8.107 -4.135
785 HA ASP 95 HA ASP 95 11.281 -9.233 -5.649
786 1HB ASP 95 2HB ASP 95 10.905 -11.632 -5.672
787 2HB ASP 95 1HB ASP 95 10.626 -11.005 -4.051
788 H GLY 96 H GLY 96 9.651 -7.568 -7.017
789 1HA GLY 96 2HA GLY 96 8.984 -7.189 -9.185
790 2HA GLY 96 1HA GLY 96 9.516 -8.819 -9.569
791 H LYS 97 H LYS 97 7.206 -8.361 -7.024
792 HA LYS 97 HA LYS 97 5.156 -9.542 -8.761
793 1HB LYS 97 2HB LYS 97 5.350 -9.595 -5.748
794 2HB LYS 97 1HB LYS 97 4.095 -10.365 -6.706
795 1HG LYS 97 2HG LYS 97 5.713 -11.856 -7.702
796 2HG LYS 97 1HG LYS 97 7.024 -11.045 -6.844
797 1HD LYS 97 2HD LYS 97 6.459 -13.075 -5.677
798 2HD LYS 97 1HD LYS 97 5.955 -11.694 -4.702
799 1HE LYS 97 2HE LYS 97 3.771 -12.210 -4.875
800 2HE LYS 97 1HE LYS 97 3.918 -12.705 -6.560
801 1HZ LYS 97 1HZ LYS 97 3.501 -14.393 -4.530
802 2HZ LYS 97 2HZ LYS 97 5.187 -14.469 -4.645
803 3HZ LYS 97 3HZ LYS 97 4.231 -14.837 -5.991
804 H MET 98 H MET 98 3.575 -8.250 -9.402
805 HA MET 98 HA MET 98 3.037 -5.800 -7.888
806 1HB MET 98 2HB MET 98 2.099 -6.602 -10.649
807 2HB MET 98 1HB MET 98 1.866 -5.031 -9.892
808 1HG MET 98 2HG MET 98 4.233 -4.613 -9.915
809 2HG MET 98 1HG MET 98 4.549 -6.236 -10.526
810 1HE MET 98 1HE MET 98 5.774 -5.318 -13.279
811 2HE MET 98 2HE MET 98 4.433 -6.202 -14.006
812 3HE MET 98 3HE MET 98 5.092 -6.719 -12.453
813 H VAL 99 H VAL 99 1.865 -6.829 -6.196
814 HA VAL 99 HA VAL 99 -0.535 -8.306 -6.798
815 HB VAL 99 HB VAL 99 0.306 -7.193 -4.121
816 1HG1 VAL 99 1HG1 VAL 99 -1.333 -9.648 -4.683
817 2HG1 VAL 99 2HG1 VAL 99 -2.060 -8.051 -4.503
818 3HG1 VAL 99 3HG1 VAL 99 -1.158 -8.766 -3.167
819 1HG2 VAL 99 1HG2 VAL 99 2.155 -8.476 -4.730
820 2HG2 VAL 99 2HG2 VAL 99 1.168 -9.673 -5.569
821 3HG2 VAL 99 3HG2 VAL 99 1.159 -9.600 -3.807
822 H ASN 100 H ASN 100 0.312 -5.008 -6.082
823 HA ASN 100 HA ASN 100 -2.116 -4.011 -5.163
824 1HB ASN 100 2HB ASN 100 0.228 -2.871 -5.494
825 2HB ASN 100 1HB ASN 100 -0.446 -2.393 -7.050
826 1HD2 ASN 100 1HD2 ASN 100 -0.210 -0.221 -6.267
827 2HD2 ASN 100 2HD2 ASN 100 -1.418 0.455 -5.234
828 H GLU 101 H GLU 101 -0.990 -4.524 -8.477
829 HA GLU 101 HA GLU 101 -3.468 -3.509 -9.587
830 1HB GLU 101 2HB GLU 101 -0.829 -4.333 -10.640
831 2HB GLU 101 1HB GLU 101 -2.199 -4.586 -11.713
832 1HG GLU 101 2HG GLU 101 -2.799 -2.160 -11.273
833 2HG GLU 101 1HG GLU 101 -1.197 -2.010 -10.551
834 H ALA 102 H ALA 102 -2.204 -6.521 -8.552
835 HA ALA 102 HA ALA 102 -3.994 -8.083 -10.226
836 1HB ALA 102 1HB ALA 102 -2.940 -9.926 -8.609
837 2HB ALA 102 2HB ALA 102 -1.711 -8.671 -8.444
838 3HB ALA 102 3HB ALA 102 -2.105 -9.314 -10.037
839 H LEU 103 H LEU 103 -3.890 -6.794 -7.000
840 HA LEU 103 HA LEU 103 -6.253 -8.399 -6.291
841 1HB LEU 103 2HB LEU 103 -4.381 -8.717 -4.780
842 2HB LEU 103 1HB LEU 103 -4.266 -6.989 -4.515
843 HG LEU 103 HG LEU 103 -5.373 -8.414 -2.695
844 1HD1 LEU 103 1HD1 LEU 103 -7.246 -6.266 -3.498
845 2HD1 LEU 103 2HD1 LEU 103 -5.554 -5.825 -3.263
846 3HD1 LEU 103 3HD1 LEU 103 -6.463 -6.570 -1.948
847 1HD2 LEU 103 1HD2 LEU 103 -7.831 -8.159 -4.386
848 2HD2 LEU 103 2HD2 LEU 103 -7.561 -9.147 -2.951
849 3HD2 LEU 103 3HD2 LEU 103 -6.809 -9.593 -4.483
850 H VAL 104 H VAL 104 -4.959 -5.198 -5.374
851 HA VAL 104 HA VAL 104 -7.354 -4.052 -4.623
852 HB VAL 104 HB VAL 104 -5.149 -2.512 -5.987
853 1HG1 VAL 104 1HG1 VAL 104 -7.531 -1.617 -5.101
854 2HG1 VAL 104 2HG1 VAL 104 -6.059 -0.645 -5.113
855 3HG1 VAL 104 3HG1 VAL 104 -6.569 -1.456 -3.632
856 1HG2 VAL 104 1HG2 VAL 104 -3.955 -3.744 -4.411
857 2HG2 VAL 104 2HG2 VAL 104 -5.274 -3.710 -3.241
858 3HG2 VAL 104 3HG2 VAL 104 -4.335 -2.249 -3.554
859 H ARG 105 H ARG 105 -5.961 -4.296 -7.853
860 HA ARG 105 HA ARG 105 -7.846 -2.587 -9.114
861 1HB ARG 105 2HB ARG 105 -5.531 -4.025 -9.864
862 2HB ARG 105 1HB ARG 105 -6.820 -4.545 -10.941
863 1HG ARG 105 2HG ARG 105 -6.425 -1.633 -10.454
864 2HG ARG 105 1HG ARG 105 -5.322 -2.488 -11.533
865 1HD ARG 105 2HD ARG 105 -7.147 -3.188 -12.932
866 2HD ARG 105 1HD ARG 105 -8.324 -2.527 -11.797
867 HE ARG 105 HE ARG 105 -6.517 -0.531 -12.722
868 1HH1 ARG 105 1HH1 ARG 105 -9.358 -2.349 -13.619
869 2HH1 ARG 105 2HH1 ARG 105 -9.945 -1.134 -14.705
870 1HH2 ARG 105 1HH2 ARG 105 -7.289 1.068 -14.149
871 2HH2 ARG 105 2HH2 ARG 105 -8.771 0.806 -15.005
872 H GLN 106 H GLN 106 -8.085 -5.774 -7.924
873 HA GLN 106 HA GLN 106 -10.152 -6.601 -9.772
874 1HB GLN 106 2HB GLN 106 -8.908 -7.860 -7.340
875 2HB GLN 106 1HB GLN 106 -10.322 -8.557 -8.116
876 1HG GLN 106 2HG GLN 106 -8.093 -7.929 -9.918
877 2HG GLN 106 1HG GLN 106 -7.771 -9.187 -8.726
878 1HE2 GLN 106 1HE2 GLN 106 -10.825 -8.403 -10.299
879 2HE2 GLN 106 2HE2 GLN 106 -11.008 -9.919 -11.106
880 H GLY 107 H GLY 107 -10.228 -4.370 -7.451
881 1HA GLY 107 2HA GLY 107 -12.247 -3.344 -6.745
882 2HA GLY 107 1HA GLY 107 -13.055 -4.898 -6.888
883 H LEU 108 H LEU 108 -9.979 -4.553 -5.279
884 HA LEU 108 HA LEU 108 -9.328 -4.817 -3.120
885 1HB LEU 108 2HB LEU 108 -11.886 -3.386 -2.923
886 2HB LEU 108 1HB LEU 108 -11.437 -4.264 -1.473
887 HG LEU 108 HG LEU 108 -9.623 -2.279 -2.838
888 1HD1 LEU 108 1HD1 LEU 108 -11.672 -1.916 -0.680
889 2HD1 LEU 108 2HD1 LEU 108 -11.417 -0.959 -2.140
890 3HD1 LEU 108 3HD1 LEU 108 -10.265 -0.861 -0.808
891 1HD2 LEU 108 1HD2 LEU 108 -9.545 -3.414 -0.048
892 2HD2 LEU 108 2HD2 LEU 108 -8.348 -2.368 -0.811
893 3HD2 LEU 108 3HD2 LEU 108 -8.577 -4.017 -1.393
894 H ALA 109 H ALA 109 -8.960 -6.879 -2.705
895 HA ALA 109 HA ALA 109 -9.232 -8.896 -1.672
896 1HB ALA 109 1HB ALA 109 -11.263 -9.516 -0.565
897 2HB ALA 109 2HB ALA 109 -12.173 -8.281 -1.429
898 3HB ALA 109 3HB ALA 109 -10.954 -7.811 -0.248
899 H LYS 110 H LYS 110 -12.349 -9.792 -2.499
900 HA LYS 110 HA LYS 110 -13.296 -10.949 -4.215
901 1HB LYS 110 2HB LYS 110 -12.731 -10.473 -6.354
902 2HB LYS 110 1HB LYS 110 -11.736 -9.237 -5.603
903 1HG LYS 110 2HG LYS 110 -10.115 -10.109 -6.875
904 2HG LYS 110 1HG LYS 110 -10.017 -11.335 -5.613
905 1HD LYS 110 2HD LYS 110 -12.099 -12.032 -7.450
906 2HD LYS 110 1HD LYS 110 -10.624 -11.685 -8.351
907 1HE LYS 110 2HE LYS 110 -11.084 -13.748 -6.221
908 2HE LYS 110 1HE LYS 110 -10.507 -13.975 -7.870
909 1HZ LYS 110 1HZ LYS 110 -8.602 -12.399 -6.907
910 2HZ LYS 110 2HZ LYS 110 -8.531 -14.088 -6.829
911 3HZ LYS 110 3HZ LYS 110 -9.044 -13.201 -5.483
Start of MODEL 6
1 1H ALA 1 1HT ALA 1 17.870 7.883 -29.728
2 2H ALA 1 2HT ALA 1 17.758 6.729 -28.463
3 3H ALA 1 3HT ALA 1 18.527 8.238 -28.185
4 HA ALA 1 HA ALA 1 16.593 9.397 -28.204
5 1HB ALA 1 1HB ALA 1 14.705 8.865 -29.358
6 2HB ALA 1 2HB ALA 1 14.884 7.134 -29.072
7 3HB ALA 1 3HB ALA 1 15.873 7.932 -30.296
8 H THR 2 H THR 2 17.950 7.613 -26.352
9 HA THR 2 HA THR 2 15.715 6.612 -24.733
10 HB THR 2 HB THR 2 17.699 5.612 -23.378
11 HG1 THR 2 1HG THR 2 19.540 5.274 -24.670
12 1HG2 THR 2 1HG2 THR 2 16.756 4.669 -26.044
13 2HG2 THR 2 2HG2 THR 2 16.432 4.012 -24.441
14 3HG2 THR 2 3HG2 THR 2 18.018 3.789 -25.182
15 H SER 3 H SER 3 14.946 8.322 -23.606
16 HA SER 3 HA SER 3 16.491 10.436 -22.582
17 1HB SER 3 2HB SER 3 14.442 10.812 -21.095
18 2HB SER 3 1HB SER 3 14.167 10.831 -22.837
19 HG SER 3 HG SER 3 13.685 8.668 -21.064
20 H THR 4 H THR 4 16.837 10.963 -20.298
21 HA THR 4 HA THR 4 17.837 8.632 -18.866
22 HB THR 4 HB THR 4 18.772 10.479 -17.325
23 HG1 THR 4 1HG THR 4 18.912 12.511 -18.342
24 1HG2 THR 4 1HG2 THR 4 20.311 9.399 -18.747
25 2HG2 THR 4 2HG2 THR 4 20.547 11.132 -18.976
26 3HG2 THR 4 3HG2 THR 4 19.657 10.196 -20.178
27 H LYS 5 H LYS 5 16.587 7.660 -17.427
28 HA LYS 5 HA LYS 5 14.574 9.259 -15.993
29 1HB LYS 5 2HB LYS 5 14.573 6.516 -17.101
30 2HB LYS 5 1HB LYS 5 13.799 6.705 -15.533
31 1HG LYS 5 2HG LYS 5 12.766 8.806 -16.947
32 2HG LYS 5 1HG LYS 5 12.914 7.552 -18.179
33 1HD LYS 5 2HD LYS 5 11.811 6.627 -15.622
34 2HD LYS 5 1HD LYS 5 10.813 7.812 -16.466
35 1HE LYS 5 2HE LYS 5 10.226 5.509 -17.080
36 2HE LYS 5 1HE LYS 5 10.817 6.433 -18.461
37 1HZ LYS 5 1HZ LYS 5 12.819 4.932 -16.985
38 2HZ LYS 5 2HZ LYS 5 12.640 5.148 -18.652
39 3HZ LYS 5 3HZ LYS 5 11.692 4.004 -17.841
40 H LYS 6 H LYS 6 14.533 9.281 -13.800
41 HA LYS 6 HA LYS 6 16.843 8.136 -12.443
42 1HB LYS 6 2HB LYS 6 14.914 10.323 -11.877
43 2HB LYS 6 1HB LYS 6 15.608 9.493 -10.491
44 1HG LYS 6 2HG LYS 6 17.844 10.033 -11.252
45 2HG LYS 6 1HG LYS 6 17.185 10.801 -12.698
46 1HD LYS 6 2HD LYS 6 15.824 12.146 -10.814
47 2HD LYS 6 1HD LYS 6 17.291 11.772 -9.907
48 1HE LYS 6 2HE LYS 6 17.338 13.004 -12.652
49 2HE LYS 6 1HE LYS 6 17.276 13.965 -11.175
50 1HZ LYS 6 1HZ LYS 6 19.314 12.360 -10.618
51 2HZ LYS 6 2HZ LYS 6 19.502 13.856 -11.385
52 3HZ LYS 6 3HZ LYS 6 19.474 12.434 -12.301
53 H LEU 7 H LEU 7 16.623 6.114 -11.744
54 HA LEU 7 HA LEU 7 14.140 5.398 -10.331
55 1HB LEU 7 2HB LEU 7 15.602 3.957 -12.478
56 2HB LEU 7 1HB LEU 7 14.925 2.989 -11.183
57 HG LEU 7 HG LEU 7 12.934 4.840 -12.095
58 1HD1 LEU 7 1HD1 LEU 7 12.664 3.880 -14.388
59 2HD1 LEU 7 2HD1 LEU 7 14.294 3.222 -14.240
60 3HD1 LEU 7 3HD1 LEU 7 14.039 4.967 -14.199
61 1HD2 LEU 7 1HD2 LEU 7 11.610 3.037 -11.866
62 2HD2 LEU 7 2HD2 LEU 7 13.022 2.332 -11.081
63 3HD2 LEU 7 3HD2 LEU 7 12.696 1.991 -12.780
64 H HIS 8 H HIS 8 14.397 4.580 -8.344
65 HA HIS 8 HA HIS 8 17.115 3.784 -7.526
66 1HB HIS 8 2HB HIS 8 15.177 5.638 -6.300
67 2HB HIS 8 1HB HIS 8 15.926 4.508 -5.178
68 HD1 HIS 8 1HD HIS 8 17.384 6.226 -4.004
69 HD2 HIS 8 2HD HIS 8 17.968 6.110 -8.117
70 HE1 HIS 8 1HE HIS 8 19.435 7.617 -4.431
71 HE2 HIS 8 2HE HIS 8 19.820 7.461 -6.916
72 H LYS 9 H LYS 9 17.160 1.648 -7.309
73 HA LYS 9 HA LYS 9 14.785 0.259 -6.293
74 1HB LYS 9 2HB LYS 9 16.974 -0.444 -8.128
75 2HB LYS 9 1HB LYS 9 16.538 -1.719 -6.999
76 1HG LYS 9 2HG LYS 9 14.114 -1.229 -7.765
77 2HG LYS 9 1HG LYS 9 14.892 -0.450 -9.143
78 1HD LYS 9 2HD LYS 9 16.262 -2.761 -9.094
79 2HD LYS 9 1HD LYS 9 14.728 -3.311 -8.416
80 1HE LYS 9 2HE LYS 9 14.495 -1.584 -10.783
81 2HE LYS 9 1HE LYS 9 15.272 -3.140 -11.072
82 1HZ LYS 9 1HZ LYS 9 13.083 -3.668 -11.372
83 2HZ LYS 9 2HZ LYS 9 12.526 -2.567 -10.215
84 3HZ LYS 9 3HZ LYS 9 13.242 -4.018 -9.724
85 H GLU 10 H GLU 10 14.789 0.130 -4.140
86 HA GLU 10 HA GLU 10 17.159 -0.999 -2.835
87 1HB GLU 10 2HB GLU 10 16.132 1.681 -2.463
88 2HB GLU 10 1HB GLU 10 16.063 0.777 -0.958
89 1HG GLU 10 2HG GLU 10 18.532 0.134 -1.656
90 2HG GLU 10 1HG GLU 10 18.407 1.652 -2.545
91 HA PRO 11 HA PRO 11 14.311 -3.694 -0.832
92 1HB PRO 11 2HB PRO 11 15.464 -3.945 1.642
93 2HB PRO 11 1HB PRO 11 16.043 -4.779 0.196
94 1HG PRO 11 2HG PRO 11 17.060 -2.272 1.473
95 2HG PRO 11 1HG PRO 11 17.972 -3.628 0.785
96 1HD PRO 11 2HD PRO 11 17.633 -1.322 -0.558
97 2HD PRO 11 1HD PRO 11 17.673 -2.891 -1.389
98 H ALA 12 H ALA 12 12.348 -3.106 -0.199
99 HA ALA 12 HA ALA 12 12.033 -1.501 2.216
100 1HB ALA 12 1HB ALA 12 10.169 -0.229 0.905
101 2HB ALA 12 2HB ALA 12 11.124 -0.681 -0.507
102 3HB ALA 12 3HB ALA 12 11.851 0.288 0.776
103 H THR 13 H THR 13 10.911 -2.879 3.443
104 HA THR 13 HA THR 13 8.545 -4.174 2.251
105 HB THR 13 HB THR 13 10.182 -5.868 2.768
106 HG1 THR 13 1HG THR 13 8.606 -7.004 3.507
107 1HG2 THR 13 1HG2 THR 13 11.696 -5.339 4.326
108 2HG2 THR 13 2HG2 THR 13 10.531 -6.064 5.435
109 3HG2 THR 13 3HG2 THR 13 10.574 -4.315 5.223
110 H LEU 14 H LEU 14 6.767 -4.581 3.753
111 HA LEU 14 HA LEU 14 6.554 -2.405 5.713
112 1HB LEU 14 2HB LEU 14 4.040 -3.167 5.556
113 2HB LEU 14 1HB LEU 14 4.744 -2.102 4.357
114 HG LEU 14 HG LEU 14 5.067 -4.011 2.843
115 1HD1 LEU 14 1HD1 LEU 14 5.331 -5.943 4.009
116 2HD1 LEU 14 2HD1 LEU 14 3.611 -6.079 3.637
117 3HD1 LEU 14 3HD1 LEU 14 4.127 -5.506 5.223
118 1HD2 LEU 14 1HD2 LEU 14 2.456 -4.601 2.818
119 2HD2 LEU 14 2HD2 LEU 14 3.101 -3.064 2.243
120 3HD2 LEU 14 3HD2 LEU 14 2.421 -3.183 3.865
121 H ILE 15 H ILE 15 5.990 -2.768 7.821
122 HA ILE 15 HA ILE 15 6.559 -5.383 8.864
123 HB ILE 15 HB ILE 15 5.500 -3.017 10.404
124 1HG1 ILE 15 2HG1 ILE 15 8.341 -3.356 10.652
125 2HG1 ILE 15 1HG1 ILE 15 7.926 -3.181 8.950
126 1HG2 ILE 15 1HG2 ILE 15 6.826 -4.102 12.242
127 2HG2 ILE 15 2HG2 ILE 15 7.028 -5.492 11.176
128 3HG2 ILE 15 3HG2 ILE 15 5.414 -5.007 11.696
129 1HD1 ILE 15 1HD1 ILE 15 6.914 -1.075 9.330
130 2HD1 ILE 15 2HD1 ILE 15 8.473 -1.061 10.153
131 3HD1 ILE 15 3HD1 ILE 15 6.988 -1.283 11.080
132 H LYS 16 H LYS 16 3.730 -3.227 9.185
133 HA LYS 16 HA LYS 16 2.035 -5.631 9.312
134 1HB LYS 16 2HB LYS 16 2.432 -4.356 11.529
135 2HB LYS 16 1HB LYS 16 1.383 -3.127 10.840
136 1HG LYS 16 2HG LYS 16 -0.387 -4.262 11.517
137 2HG LYS 16 1HG LYS 16 0.096 -5.621 10.499
138 1HD LYS 16 2HD LYS 16 0.160 -6.709 12.482
139 2HD LYS 16 1HD LYS 16 1.767 -5.985 12.575
140 1HE LYS 16 2HE LYS 16 -0.577 -4.451 13.593
141 2HE LYS 16 1HE LYS 16 0.071 -5.768 14.569
142 1HZ LYS 16 1HZ LYS 16 2.306 -4.474 13.946
143 2HZ LYS 16 2HZ LYS 16 1.400 -4.141 15.334
144 3HZ LYS 16 3HZ LYS 16 1.222 -3.174 13.958
145 H ALA 17 H ALA 17 0.520 -5.676 7.795
146 HA ALA 17 HA ALA 17 -0.266 -3.133 6.528
147 1HB ALA 17 1HB ALA 17 -0.978 -4.870 4.654
148 2HB ALA 17 2HB ALA 17 0.290 -5.829 5.418
149 3HB ALA 17 3HB ALA 17 0.663 -4.233 4.764
150 H ILE 18 H ILE 18 -2.197 -2.503 7.232
151 HA ILE 18 HA ILE 18 -4.183 -4.498 8.014
152 HB ILE 18 HB ILE 18 -4.390 -1.498 8.270
153 1HG1 ILE 18 2HG1 ILE 18 -2.431 -2.256 9.501
154 2HG1 ILE 18 1HG1 ILE 18 -3.716 -1.839 10.630
155 1HG2 ILE 18 1HG2 ILE 18 -6.529 -2.496 8.440
156 2HG2 ILE 18 2HG2 ILE 18 -6.009 -2.157 10.090
157 3HG2 ILE 18 3HG2 ILE 18 -5.920 -3.801 9.456
158 1HD1 ILE 18 1HD1 ILE 18 -4.217 -4.150 11.002
159 2HD1 ILE 18 2HD1 ILE 18 -2.484 -3.900 11.220
160 3HD1 ILE 18 3HD1 ILE 18 -3.088 -4.641 9.738
161 H ASP 19 H ASP 19 -3.928 -1.637 5.914
162 HA ASP 19 HA ASP 19 -4.898 -1.174 3.899
163 1HB ASP 19 2HB ASP 19 -6.390 -3.791 4.037
164 2HB ASP 19 1HB ASP 19 -5.977 -2.849 2.609
165 H GLY 20 H GLY 20 -7.224 -2.910 5.986
166 1HA GLY 20 2HA GLY 20 -9.552 -1.671 5.246
167 2HA GLY 20 1HA GLY 20 -9.223 -2.220 6.882
168 H ASP 21 H ASP 21 -6.932 -0.266 7.061
169 HA ASP 21 HA ASP 21 -8.468 2.235 7.202
170 1HB ASP 21 2HB ASP 21 -6.853 0.952 9.399
171 2HB ASP 21 1HB ASP 21 -7.220 2.674 9.395
172 H THR 22 H THR 22 -5.194 1.449 8.307
173 HA THR 22 HA THR 22 -4.069 2.976 6.080
174 HB THR 22 HB THR 22 -3.126 3.516 8.882
175 HG1 THR 22 1HG THR 22 -5.212 4.824 7.484
176 1HG2 THR 22 1HG2 THR 22 -1.586 4.520 7.564
177 2HG2 THR 22 2HG2 THR 22 -2.783 5.813 7.618
178 3HG2 THR 22 3HG2 THR 22 -2.709 4.739 6.221
179 H VAL 23 H VAL 23 -1.742 2.675 5.836
180 HA VAL 23 HA VAL 23 -0.721 0.262 7.172
181 HB VAL 23 HB VAL 23 -0.197 0.763 4.255
182 1HG1 VAL 23 1HG1 VAL 23 0.449 -1.296 6.231
183 2HG1 VAL 23 2HG1 VAL 23 1.259 -0.875 4.722
184 3HG1 VAL 23 3HG1 VAL 23 -0.153 -1.930 4.700
185 1HG2 VAL 23 1HG2 VAL 23 -2.660 -0.219 5.494
186 2HG2 VAL 23 2HG2 VAL 23 -1.992 -1.299 4.270
187 3HG2 VAL 23 3HG2 VAL 23 -2.370 0.375 3.859
188 H LYS 24 H LYS 24 1.590 0.063 7.198
189 HA LYS 24 HA LYS 24 3.047 2.549 6.614
190 1HB LYS 24 2HB LYS 24 4.254 2.372 8.725
191 2HB LYS 24 1HB LYS 24 2.526 2.508 9.011
192 1HG LYS 24 2HG LYS 24 2.531 0.630 10.178
193 2HG LYS 24 1HG LYS 24 3.225 -0.254 8.819
194 1HD LYS 24 2HD LYS 24 4.903 -0.574 10.320
195 2HD LYS 24 1HD LYS 24 5.431 0.979 9.671
196 1HE LYS 24 2HE LYS 24 4.050 2.032 11.541
197 2HE LYS 24 1HE LYS 24 3.988 0.418 12.247
198 1HZ LYS 24 1HZ LYS 24 5.816 1.888 13.073
199 2HZ LYS 24 2HZ LYS 24 6.529 1.776 11.544
200 3HZ LYS 24 3HZ LYS 24 6.324 0.385 12.486
201 H LEU 25 H LEU 25 4.989 2.278 5.675
202 HA LEU 25 HA LEU 25 5.923 -0.485 5.303
203 1HB LEU 25 2HB LEU 25 5.921 1.935 3.591
204 2HB LEU 25 1HB LEU 25 7.308 0.872 3.449
205 HG LEU 25 HG LEU 25 4.623 -0.389 3.303
206 1HD1 LEU 25 1HD1 LEU 25 4.883 1.846 1.851
207 2HD1 LEU 25 2HD1 LEU 25 3.999 0.428 1.290
208 3HD1 LEU 25 3HD1 LEU 25 5.659 0.699 0.760
209 1HD2 LEU 25 1HD2 LEU 25 6.064 -1.431 1.313
210 2HD2 LEU 25 2HD2 LEU 25 6.191 -1.994 2.980
211 3HD2 LEU 25 3HD2 LEU 25 7.380 -0.861 2.339
212 H MET 26 H MET 26 8.215 -0.890 5.301
213 HA MET 26 HA MET 26 9.628 0.861 7.188
214 1HB MET 26 2HB MET 26 9.242 -1.664 7.605
215 2HB MET 26 1HB MET 26 10.510 -1.906 6.411
216 1HG MET 26 2HG MET 26 12.043 -0.578 7.783
217 2HG MET 26 1HG MET 26 10.772 -0.369 8.984
218 1HE MET 26 1HE MET 26 12.229 -2.875 6.720
219 2HE MET 26 2HE MET 26 11.556 -4.347 7.421
220 3HE MET 26 3HE MET 26 13.219 -3.881 7.778
221 H TYR 27 H TYR 27 10.671 2.377 6.015
222 HA TYR 27 HA TYR 27 12.391 1.445 3.811
223 1HB TYR 27 2HB TYR 27 10.606 3.019 3.123
224 2HB TYR 27 1HB TYR 27 11.253 4.215 4.243
225 HD1 TYR 27 1HD TYR 27 13.493 5.215 3.815
226 HD2 TYR 27 2HD TYR 27 11.592 2.668 0.986
227 HE1 TYR 27 1HE TYR 27 15.010 6.038 2.065
228 HE2 TYR 27 2HE TYR 27 13.105 3.484 -0.773
229 HH TYR 27 HH TYR 27 15.258 4.538 -1.008
230 H LYS 28 H LYS 28 14.243 1.004 4.951
231 HA LYS 28 HA LYS 28 16.196 1.383 6.058
232 1HB LYS 28 2HB LYS 28 16.098 3.227 4.169
233 2HB LYS 28 1HB LYS 28 15.972 4.315 5.543
234 1HG LYS 28 2HG LYS 28 18.055 3.180 6.444
235 2HG LYS 28 1HG LYS 28 18.220 2.455 4.843
236 1HD LYS 28 2HD LYS 28 17.815 5.071 4.211
237 2HD LYS 28 1HD LYS 28 18.698 5.215 5.732
238 1HE LYS 28 2HE LYS 28 19.596 3.547 3.386
239 2HE LYS 28 1HE LYS 28 20.156 5.185 3.717
240 1HZ LYS 28 1HZ LYS 28 20.754 2.695 5.137
241 2HZ LYS 28 2HZ LYS 28 20.706 4.127 6.034
242 3HZ LYS 28 3HZ LYS 28 21.778 3.981 4.735
243 H GLY 29 H GLY 29 13.682 1.586 7.551
244 1HA GLY 29 2HA GLY 29 13.566 1.767 9.928
245 2HA GLY 29 1HA GLY 29 14.756 3.058 9.855
246 H GLN 30 H GLN 30 13.056 4.113 7.481
247 HA GLN 30 HA GLN 30 11.422 5.832 9.140
248 1HB GLN 30 2HB GLN 30 12.819 6.734 7.289
249 2HB GLN 30 1HB GLN 30 11.806 5.867 6.142
250 1HG GLN 30 2HG GLN 30 9.982 7.288 7.622
251 2HG GLN 30 1HG GLN 30 11.351 8.393 7.505
252 1HE2 GLN 30 1HE2 GLN 30 11.621 9.507 5.687
253 2HE2 GLN 30 2HE2 GLN 30 10.745 9.252 4.219
254 HA PRO 31 HA PRO 31 7.789 3.352 8.346
255 1HB PRO 31 2HB PRO 31 6.003 4.884 9.658
256 2HB PRO 31 1HB PRO 31 7.193 3.892 10.509
257 1HG PRO 31 2HG PRO 31 7.250 6.826 9.914
258 2HG PRO 31 1HG PRO 31 7.678 5.981 11.412
259 1HD PRO 31 2HD PRO 31 9.525 6.845 9.604
260 2HD PRO 31 1HD PRO 31 9.775 5.435 10.652
261 H MET 32 H MET 32 7.578 3.624 6.105
262 HA MET 32 HA MET 32 6.551 6.059 4.981
263 1HB MET 32 2HB MET 32 7.709 3.614 4.009
264 2HB MET 32 1HB MET 32 6.219 3.945 3.136
265 1HG MET 32 2HG MET 32 7.018 5.929 2.260
266 2HG MET 32 1HG MET 32 8.254 6.098 3.505
267 1HE MET 32 1HE MET 32 9.764 6.552 0.623
268 2HE MET 32 2HE MET 32 11.074 5.611 1.337
269 3HE MET 32 3HE MET 32 10.072 6.642 2.357
270 H THR 33 H THR 33 4.540 6.564 5.681
271 HA THR 33 HA THR 33 2.476 4.646 6.081
272 HB THR 33 HB THR 33 2.337 6.631 7.366
273 HG1 THR 33 1HG THR 33 0.332 5.853 6.363
274 1HG2 THR 33 1HG2 THR 33 2.580 8.111 4.772
275 2HG2 THR 33 2HG2 THR 33 3.586 8.239 6.214
276 3HG2 THR 33 3HG2 THR 33 1.935 8.859 6.232
277 H PHE 34 H PHE 34 0.962 3.891 4.734
278 HA PHE 34 HA PHE 34 0.860 5.028 2.016
279 1HB PHE 34 2HB PHE 34 1.824 2.803 1.970
280 2HB PHE 34 1HB PHE 34 0.484 2.164 2.914
281 HD1 PHE 34 1HD PHE 34 -0.321 0.533 1.432
282 HD2 PHE 34 2HD PHE 34 0.215 4.535 0.087
283 HE1 PHE 34 1HE PHE 34 -1.527 -0.007 -0.644
284 HE2 PHE 34 2HE PHE 34 -0.991 4.002 -1.991
285 HZ PHE 34 HZ PHE 34 -1.864 1.729 -2.357
286 H ARG 35 H ARG 35 -1.077 5.607 1.203
287 HA ARG 35 HA ARG 35 -3.288 6.138 1.122
288 1HB ARG 35 2HB ARG 35 -3.408 3.470 2.515
289 2HB ARG 35 1HB ARG 35 -4.861 4.383 2.137
290 1HG ARG 35 2HG ARG 35 -2.980 3.989 -0.094
291 2HG ARG 35 1HG ARG 35 -3.784 2.540 0.510
292 1HD ARG 35 2HD ARG 35 -5.887 3.310 -0.054
293 2HD ARG 35 1HD ARG 35 -5.386 5.000 -0.032
294 HE ARG 35 HE ARG 35 -3.977 3.937 -2.096
295 1HH1 ARG 35 1HH1 ARG 35 -7.366 4.003 -1.264
296 2HH1 ARG 35 2HH1 ARG 35 -7.899 3.968 -2.910
297 1HH2 ARG 35 1HH2 ARG 35 -4.678 3.890 -4.263
298 2HH2 ARG 35 2HH2 ARG 35 -6.374 3.902 -4.613
299 H LEU 36 H LEU 36 -5.195 6.761 2.458
300 HA LEU 36 HA LEU 36 -4.423 7.366 5.232
301 1HB LEU 36 2HB LEU 36 -5.785 9.516 4.889
302 2HB LEU 36 1HB LEU 36 -4.163 9.445 4.233
303 HG LEU 36 HG LEU 36 -5.869 10.517 2.745
304 1HD1 LEU 36 1HD1 LEU 36 -4.626 9.952 0.979
305 2HD1 LEU 36 2HD1 LEU 36 -5.005 8.236 1.139
306 3HD1 LEU 36 3HD1 LEU 36 -3.723 8.951 2.117
307 1HD2 LEU 36 1HD2 LEU 36 -6.853 7.756 2.136
308 2HD2 LEU 36 2HD2 LEU 36 -7.568 9.313 1.723
309 3HD2 LEU 36 3HD2 LEU 36 -7.618 8.733 3.388
310 H LEU 37 H LEU 37 -6.183 7.675 6.713
311 HA LEU 37 HA LEU 37 -8.175 5.736 6.539
312 1HB LEU 37 2HB LEU 37 -8.331 8.241 8.209
313 2HB LEU 37 1HB LEU 37 -9.111 6.703 8.526
314 HG LEU 37 HG LEU 37 -6.230 6.405 8.342
315 1HD1 LEU 37 1HD1 LEU 37 -5.704 8.391 9.277
316 2HD1 LEU 37 2HD1 LEU 37 -6.146 7.546 10.760
317 3HD1 LEU 37 3HD1 LEU 37 -7.308 8.615 9.975
318 1HD2 LEU 37 1HD2 LEU 37 -6.598 4.873 9.946
319 2HD2 LEU 37 2HD2 LEU 37 -8.291 5.087 9.498
320 3HD2 LEU 37 3HD2 LEU 37 -7.629 5.952 10.886
321 H LEU 38 H LEU 38 -9.575 5.741 4.873
322 HA LEU 38 HA LEU 38 -10.644 8.008 3.618
323 1HB LEU 38 2HB LEU 38 -12.399 6.377 2.783
324 2HB LEU 38 1HB LEU 38 -10.727 6.001 2.407
325 HG LEU 38 HG LEU 38 -11.317 4.709 4.854
326 1HD1 LEU 38 1HD1 LEU 38 -13.712 5.118 3.643
327 2HD1 LEU 38 2HD1 LEU 38 -13.342 3.763 4.709
328 3HD1 LEU 38 3HD1 LEU 38 -13.237 3.563 2.961
329 1HD2 LEU 38 1HD2 LEU 38 -9.801 3.580 3.605
330 2HD2 LEU 38 2HD2 LEU 38 -10.589 3.985 2.080
331 3HD2 LEU 38 3HD2 LEU 38 -11.242 2.701 3.096
332 H VAL 39 H VAL 39 -13.188 8.189 3.465
333 HA VAL 39 HA VAL 39 -14.046 9.100 6.044
334 HB VAL 39 HB VAL 39 -15.705 8.925 3.530
335 1HG1 VAL 39 1HG1 VAL 39 -17.211 9.457 5.168
336 2HG1 VAL 39 2HG1 VAL 39 -16.643 11.070 4.740
337 3HG1 VAL 39 3HG1 VAL 39 -16.004 10.261 6.171
338 1HG2 VAL 39 1HG2 VAL 39 -13.995 11.232 4.453
339 2HG2 VAL 39 2HG2 VAL 39 -14.992 11.167 3.001
340 3HG2 VAL 39 3HG2 VAL 39 -13.576 10.128 3.143
341 H ASP 40 H ASP 40 -15.987 8.457 7.128
342 HA ASP 40 HA ASP 40 -16.762 5.664 6.586
343 1HB ASP 40 2HB ASP 40 -16.526 7.025 9.279
344 2HB ASP 40 1HB ASP 40 -17.072 5.372 9.011
345 H THR 41 H THR 41 -18.701 5.825 5.630
346 HA THR 41 HA THR 41 -20.619 7.830 6.450
347 HB THR 41 HB THR 41 -21.136 5.583 4.514
348 HG1 THR 41 1HG THR 41 -19.701 6.393 3.245
349 1HG2 THR 41 1HG2 THR 41 -22.055 8.405 4.223
350 2HG2 THR 41 2HG2 THR 41 -22.929 7.283 5.265
351 3HG2 THR 41 3HG2 THR 41 -22.738 6.925 3.550
352 HA PRO 42 HA PRO 42 -22.397 5.032 9.472
353 1HB PRO 42 2HB PRO 42 -24.410 6.659 10.277
354 2HB PRO 42 1HB PRO 42 -22.736 6.883 10.794
355 1HG PRO 42 2HG PRO 42 -24.258 8.298 8.638
356 2HG PRO 42 1HG PRO 42 -23.158 8.969 9.857
357 1HD PRO 42 2HD PRO 42 -22.395 8.509 7.301
358 2HD PRO 42 1HD PRO 42 -21.275 8.371 8.671
359 H GLU 43 H GLU 43 -24.147 6.591 6.864
360 HA GLU 43 HA GLU 43 -26.559 5.124 7.125
361 1HB GLU 43 2HB GLU 43 -25.325 6.862 5.051
362 2HB GLU 43 1HB GLU 43 -26.617 5.786 4.536
363 1HG GLU 43 2HG GLU 43 -27.405 8.040 5.135
364 2HG GLU 43 1HG GLU 43 -28.138 6.766 6.108
365 H THR 44 H THR 44 -23.698 4.694 5.063
366 HA THR 44 HA THR 44 -24.719 2.095 4.193
367 HB THR 44 HB THR 44 -22.617 2.184 2.718
368 HG1 THR 44 1HG THR 44 -22.726 4.935 3.361
369 1HG2 THR 44 1HG2 THR 44 -23.597 3.750 1.107
370 2HG2 THR 44 2HG2 THR 44 -24.739 4.281 2.339
371 3HG2 THR 44 3HG2 THR 44 -24.783 2.618 1.754
372 H LYS 45 H LYS 45 -21.390 3.133 4.854
373 HA LYS 45 HA LYS 45 -19.739 2.257 6.146
374 1HB LYS 45 2HB LYS 45 -22.036 2.067 7.719
375 2HB LYS 45 1HB LYS 45 -21.296 0.475 7.822
376 1HG LYS 45 2HG LYS 45 -19.186 2.265 8.132
377 2HG LYS 45 1HG LYS 45 -20.514 2.955 9.065
378 1HD LYS 45 2HD LYS 45 -20.799 0.577 10.015
379 2HD LYS 45 1HD LYS 45 -19.181 0.286 9.376
380 1HE LYS 45 2HE LYS 45 -18.221 1.915 10.773
381 2HE LYS 45 1HE LYS 45 -19.788 2.628 11.156
382 1HZ LYS 45 1HZ LYS 45 -20.356 0.739 12.464
383 2HZ LYS 45 2HZ LYS 45 -18.821 1.248 12.958
384 3HZ LYS 45 3HZ LYS 45 -18.980 -0.111 11.965
385 H HIS 46 H HIS 46 -20.679 0.885 3.731
386 HA HIS 46 HA HIS 46 -19.062 -1.391 3.877
387 1HB HIS 46 2HB HIS 46 -20.663 -2.530 5.164
388 2HB HIS 46 1HB HIS 46 -22.008 -1.886 4.234
389 HD1 HIS 46 1HD HIS 46 -20.032 -4.853 4.630
390 HD2 HIS 46 2HD HIS 46 -21.996 -3.018 1.461
391 HE1 HIS 46 1HE HIS 46 -20.299 -6.639 2.880
392 HE2 HIS 46 2HE HIS 46 -21.422 -5.486 0.941
393 HA PRO 47 HA PRO 47 -21.261 -1.458 -0.391
394 1HB PRO 47 2HB PRO 47 -23.413 0.115 -0.810
395 2HB PRO 47 1HB PRO 47 -23.547 -1.505 -0.113
396 1HG PRO 47 2HG PRO 47 -23.517 1.153 1.273
397 2HG PRO 47 1HG PRO 47 -24.593 -0.232 1.541
398 1HD PRO 47 2HD PRO 47 -22.464 0.272 3.129
399 2HD PRO 47 1HD PRO 47 -23.020 -1.376 2.777
400 H LYS 48 H LYS 48 -20.386 1.296 1.350
401 HA LYS 48 HA LYS 48 -19.876 2.780 -1.144
402 1HB LYS 48 2HB LYS 48 -21.437 3.657 0.888
403 2HB LYS 48 1HB LYS 48 -19.877 4.291 1.392
404 1HG LYS 48 2HG LYS 48 -19.913 5.001 -1.227
405 2HG LYS 48 1HG LYS 48 -21.625 5.106 -0.810
406 1HD LYS 48 2HD LYS 48 -21.315 6.869 0.574
407 2HD LYS 48 1HD LYS 48 -19.747 6.284 1.136
408 1HE LYS 48 2HE LYS 48 -20.244 7.514 -1.571
409 2HE LYS 48 1HE LYS 48 -19.625 8.396 -0.174
410 1HZ LYS 48 1HZ LYS 48 -18.318 6.185 -1.651
411 2HZ LYS 48 2HZ LYS 48 -17.784 6.706 -0.133
412 3HZ LYS 48 3HZ LYS 48 -17.766 7.772 -1.447
413 H LYS 49 H LYS 49 -18.631 2.044 2.095
414 HA LYS 49 HA LYS 49 -16.181 3.351 1.905
415 1HB LYS 49 2HB LYS 49 -15.408 1.501 3.530
416 2HB LYS 49 1HB LYS 49 -16.701 2.577 4.037
417 1HG LYS 49 2HG LYS 49 -18.286 0.941 3.950
418 2HG LYS 49 1HG LYS 49 -17.437 0.028 2.701
419 1HD LYS 49 2HD LYS 49 -17.240 -1.264 4.659
420 2HD LYS 49 1HD LYS 49 -15.679 -0.461 4.475
421 1HE LYS 49 2HE LYS 49 -15.981 0.838 6.310
422 2HE LYS 49 1HE LYS 49 -17.724 0.963 6.068
423 1HZ LYS 49 1HZ LYS 49 -16.826 -0.391 8.045
424 2HZ LYS 49 2HZ LYS 49 -16.520 -1.595 6.899
425 3HZ LYS 49 3HZ LYS 49 -18.099 -1.034 7.133
426 H GLY 50 H GLY 50 -17.135 0.158 0.750
427 1HA GLY 50 2HA GLY 50 -16.106 -0.730 -1.241
428 2HA GLY 50 1HA GLY 50 -14.616 0.075 -0.777
429 H VAL 51 H VAL 51 -16.441 -1.619 1.633
430 HA VAL 51 HA VAL 51 -14.385 -3.179 2.571
431 HB VAL 51 HB VAL 51 -16.468 -2.889 3.803
432 1HG1 VAL 51 1HG1 VAL 51 -17.753 -3.429 1.493
433 2HG1 VAL 51 2HG1 VAL 51 -18.514 -3.505 3.082
434 3HG1 VAL 51 3HG1 VAL 51 -17.917 -4.979 2.319
435 1HG2 VAL 51 1HG2 VAL 51 -15.772 -5.763 3.214
436 2HG2 VAL 51 2HG2 VAL 51 -16.770 -5.235 4.570
437 3HG2 VAL 51 3HG2 VAL 51 -15.081 -4.734 4.469
438 H GLU 52 H GLU 52 -16.384 -3.718 -0.215
439 HA GLU 52 HA GLU 52 -16.113 -6.462 -0.552
440 1HB GLU 52 2HB GLU 52 -16.408 -5.966 -3.002
441 2HB GLU 52 1HB GLU 52 -17.636 -5.281 -1.947
442 1HG GLU 52 2HG GLU 52 -15.845 -3.248 -2.060
443 2HG GLU 52 1HG GLU 52 -15.667 -3.957 -3.664
444 H LYS 53 H LYS 53 -13.808 -3.890 -1.153
445 HA LYS 53 HA LYS 53 -11.955 -5.848 -2.309
446 1HB LYS 53 2HB LYS 53 -10.662 -3.829 -3.041
447 2HB LYS 53 1HB LYS 53 -12.237 -4.020 -3.792
448 1HG LYS 53 2HG LYS 53 -12.187 -2.363 -1.364
449 2HG LYS 53 1HG LYS 53 -11.315 -1.715 -2.752
450 1HD LYS 53 2HD LYS 53 -13.532 -2.434 -4.011
451 2HD LYS 53 1HD LYS 53 -14.220 -2.232 -2.399
452 1HE LYS 53 2HE LYS 53 -14.476 -0.133 -3.385
453 2HE LYS 53 1HE LYS 53 -13.035 0.038 -2.386
454 1HZ LYS 53 1HZ LYS 53 -11.699 0.229 -4.184
455 2HZ LYS 53 2HZ LYS 53 -13.117 0.802 -4.906
456 3HZ LYS 53 3HZ LYS 53 -12.632 -0.801 -5.149
457 H TYR 54 H TYR 54 -12.170 -3.337 0.176
458 HA TYR 54 HA TYR 54 -9.635 -4.301 1.264
459 1HB TYR 54 2HB TYR 54 -9.159 -2.199 2.055
460 2HB TYR 54 1HB TYR 54 -10.081 -1.808 0.613
461 HD1 TYR 54 1HD TYR 54 -12.850 -2.363 1.696
462 HD2 TYR 54 2HD TYR 54 -9.534 -0.285 3.362
463 HE1 TYR 54 1HE TYR 54 -14.389 -1.010 3.055
464 HE2 TYR 54 2HE TYR 54 -11.063 1.073 4.726
465 HH TYR 54 HH TYR 54 -13.642 1.784 4.448
466 H GLY 55 H GLY 55 -12.406 -5.412 1.626
467 1HA GLY 55 2HA GLY 55 -12.933 -4.946 4.448
468 2HA GLY 55 1HA GLY 55 -13.802 -6.055 3.394
469 HA PRO 56 HA PRO 56 -11.332 -9.118 5.500
470 1HB PRO 56 2HB PRO 56 -12.560 -11.297 4.582
471 2HB PRO 56 1HB PRO 56 -13.392 -10.188 5.679
472 1HG PRO 56 2HG PRO 56 -13.677 -10.502 2.727
473 2HG PRO 56 1HG PRO 56 -14.916 -10.154 3.944
474 1HD PRO 56 2HD PRO 56 -13.651 -8.274 2.298
475 2HD PRO 56 1HD PRO 56 -14.590 -7.913 3.760
476 H GLU 57 H GLU 57 -11.179 -8.258 2.296
477 HA GLU 57 HA GLU 57 -9.516 -10.519 1.488
478 1HB GLU 57 2HB GLU 57 -11.179 -8.576 0.109
479 2HB GLU 57 1HB GLU 57 -9.591 -8.737 -0.629
480 1HG GLU 57 2HG GLU 57 -11.321 -10.236 -1.586
481 2HG GLU 57 1HG GLU 57 -9.898 -11.072 -0.969
482 H ALA 58 H ALA 58 -9.227 -6.957 0.993
483 HA ALA 58 HA ALA 58 -6.588 -6.782 0.394
484 1HB ALA 58 1HB ALA 58 -6.537 -4.573 1.445
485 2HB ALA 58 2HB ALA 58 -8.034 -4.948 2.297
486 3HB ALA 58 3HB ALA 58 -8.025 -4.833 0.542
487 H SER 59 H SER 59 -7.783 -6.661 3.731
488 HA SER 59 HA SER 59 -5.319 -6.624 5.019
489 1HB SER 59 2HB SER 59 -7.893 -6.481 5.850
490 2HB SER 59 1HB SER 59 -7.475 -8.105 6.397
491 HG SER 59 HG SER 59 -6.170 -5.672 7.039
492 H ALA 60 H ALA 60 -6.841 -9.222 3.389
493 HA ALA 60 HA ALA 60 -5.358 -11.274 4.812
494 1HB ALA 60 1HB ALA 60 -6.828 -12.764 3.974
495 2HB ALA 60 2HB ALA 60 -6.865 -11.999 2.386
496 3HB ALA 60 3HB ALA 60 -7.812 -11.325 3.711
497 H PHE 61 H PHE 61 -5.446 -9.773 1.604
498 HA PHE 61 HA PHE 61 -3.539 -11.438 0.380
499 1HB PHE 61 2HB PHE 61 -5.096 -9.736 -0.739
500 2HB PHE 61 1HB PHE 61 -3.916 -8.515 -0.271
501 HD1 PHE 61 1HD PHE 61 -2.700 -7.826 -2.085
502 HD2 PHE 61 2HD PHE 61 -3.636 -11.958 -1.685
503 HE1 PHE 61 1HE PHE 61 -1.389 -8.315 -4.109
504 HE2 PHE 61 2HE PHE 61 -2.327 -12.454 -3.708
505 HZ PHE 61 HZ PHE 61 -1.201 -10.631 -4.924
506 H THR 62 H THR 62 -3.127 -8.109 1.592
507 HA THR 62 HA THR 62 -0.355 -8.034 1.507
508 HB THR 62 HB THR 62 -0.553 -6.294 3.314
509 HG1 THR 62 1HG THR 62 -2.672 -5.747 3.954
510 1HG2 THR 62 1HG2 THR 62 -2.653 -5.861 1.219
511 2HG2 THR 62 2HG2 THR 62 -0.926 -5.787 0.870
512 3HG2 THR 62 3HG2 THR 62 -1.642 -4.663 2.026
513 H LYS 63 H LYS 63 -2.521 -9.375 3.932
514 HA LYS 63 HA LYS 63 -0.854 -9.773 6.068
515 1HB LYS 63 2HB LYS 63 -3.274 -10.384 5.968
516 2HB LYS 63 1HB LYS 63 -2.830 -11.820 5.060
517 1HG LYS 63 2HG LYS 63 -3.157 -12.431 7.344
518 2HG LYS 63 1HG LYS 63 -1.434 -12.537 6.980
519 1HD LYS 63 2HD LYS 63 -1.629 -11.489 9.105
520 2HD LYS 63 1HD LYS 63 -1.199 -10.225 7.952
521 1HE LYS 63 2HE LYS 63 -2.902 -9.320 9.318
522 2HE LYS 63 1HE LYS 63 -3.666 -9.716 7.779
523 1HZ LYS 63 1HZ LYS 63 -3.713 -11.742 9.888
524 2HZ LYS 63 2HZ LYS 63 -4.864 -11.395 8.698
525 3HZ LYS 63 3HZ LYS 63 -4.734 -10.404 10.060
526 H LYS 64 H LYS 64 -0.919 -11.454 3.016
527 HA LYS 64 HA LYS 64 0.938 -13.495 3.856
528 1HB LYS 64 2HB LYS 64 -0.692 -12.908 1.464
529 2HB LYS 64 1HB LYS 64 0.875 -13.633 1.126
530 1HG LYS 64 2HG LYS 64 -0.721 -14.904 3.258
531 2HG LYS 64 1HG LYS 64 -1.338 -15.054 1.610
532 1HD LYS 64 2HD LYS 64 1.532 -15.543 1.820
533 2HD LYS 64 1HD LYS 64 0.561 -16.668 2.773
534 1HE LYS 64 2HE LYS 64 0.750 -17.690 0.676
535 2HE LYS 64 1HE LYS 64 -0.853 -16.955 0.665
536 1HZ LYS 64 1HZ LYS 64 -0.060 -16.269 -1.341
537 2HZ LYS 64 2HZ LYS 64 1.550 -16.198 -0.829
538 3HZ LYS 64 3HZ LYS 64 0.469 -14.975 -0.387
539 H MET 65 H MET 65 0.860 -10.495 2.058
540 HA MET 65 HA MET 65 3.641 -10.617 1.304
541 1HB MET 65 2HB MET 65 1.451 -9.244 0.361
542 2HB MET 65 1HB MET 65 2.351 -7.992 1.207
543 1HG MET 65 2HG MET 65 4.302 -9.294 -0.225
544 2HG MET 65 1HG MET 65 2.915 -9.327 -1.312
545 1HE MET 65 1HE MET 65 2.838 -6.710 -3.107
546 2HE MET 65 2HE MET 65 3.670 -8.260 -2.998
547 3HE MET 65 3HE MET 65 4.600 -6.764 -3.081
548 H VAL 66 H VAL 66 2.165 -10.137 4.183
549 HA VAL 66 HA VAL 66 4.115 -8.149 5.112
550 HB VAL 66 HB VAL 66 1.421 -8.084 5.409
551 1HG1 VAL 66 1HG1 VAL 66 0.788 -8.666 7.654
552 2HG1 VAL 66 2HG1 VAL 66 2.425 -9.215 8.015
553 3HG1 VAL 66 3HG1 VAL 66 1.437 -10.094 6.848
554 1HG2 VAL 66 1HG2 VAL 66 2.240 -6.748 7.653
555 2HG2 VAL 66 2HG2 VAL 66 2.232 -6.104 6.012
556 3HG2 VAL 66 3HG2 VAL 66 3.707 -6.807 6.677
557 H GLU 67 H GLU 67 2.672 -11.295 5.857
558 HA GLU 67 HA GLU 67 4.614 -11.717 7.995
559 1HB GLU 67 2HB GLU 67 2.256 -12.273 8.415
560 2HB GLU 67 1HB GLU 67 2.300 -13.443 7.103
561 1HG GLU 67 2HG GLU 67 3.563 -14.939 8.294
562 2HG GLU 67 1HG GLU 67 4.262 -13.694 9.327
563 H ASN 68 H ASN 68 3.340 -13.940 5.513
564 HA ASN 68 HA ASN 68 5.675 -15.524 5.486
565 1HB ASN 68 2HB ASN 68 3.139 -15.845 4.559
566 2HB ASN 68 1HB ASN 68 4.010 -15.576 3.052
567 1HD2 ASN 68 1HD2 ASN 68 2.997 -17.898 3.046
568 2HD2 ASN 68 2HD2 ASN 68 4.103 -19.154 3.477
569 H ALA 69 H ALA 69 4.513 -13.013 3.278
570 HA ALA 69 HA ALA 69 7.037 -13.133 1.803
571 1HB ALA 69 1HB ALA 69 4.289 -12.358 1.158
572 2HB ALA 69 2HB ALA 69 5.584 -12.949 0.110
573 3HB ALA 69 3HB ALA 69 5.509 -11.240 0.540
574 H LYS 70 H LYS 70 8.461 -11.423 1.687
575 HA LYS 70 HA LYS 70 7.842 -8.846 2.780
576 1HB LYS 70 2HB LYS 70 9.192 -10.874 4.437
577 2HB LYS 70 1HB LYS 70 9.993 -9.311 4.388
578 1HG LYS 70 2HG LYS 70 7.577 -8.412 4.881
579 2HG LYS 70 1HG LYS 70 7.336 -10.048 5.498
580 1HD LYS 70 2HD LYS 70 9.787 -9.273 6.550
581 2HD LYS 70 1HD LYS 70 8.788 -7.822 6.659
582 1HE LYS 70 2HE LYS 70 8.601 -9.172 8.680
583 2HE LYS 70 1HE LYS 70 7.061 -9.092 7.826
584 1HZ LYS 70 1HZ LYS 70 7.785 -11.343 8.688
585 2HZ LYS 70 2HZ LYS 70 8.938 -11.348 7.451
586 3HZ LYS 70 3HZ LYS 70 7.291 -11.279 7.072
587 H LYS 71 H LYS 71 8.932 -10.059 0.326
588 HA LYS 71 HA LYS 71 11.602 -8.816 0.290
589 1HB LYS 71 2HB LYS 71 11.001 -11.333 -0.454
590 2HB LYS 71 1HB LYS 71 10.728 -10.509 -1.983
591 1HG LYS 71 2HG LYS 71 13.030 -9.519 -1.731
592 2HG LYS 71 1HG LYS 71 13.268 -10.636 -0.386
593 1HD LYS 71 2HD LYS 71 12.269 -11.774 -2.934
594 2HD LYS 71 1HD LYS 71 13.950 -11.238 -2.894
595 1HE LYS 71 2HE LYS 71 12.656 -13.205 -1.010
596 2HE LYS 71 1HE LYS 71 13.783 -13.593 -2.310
597 1HZ LYS 71 1HZ LYS 71 15.267 -13.476 -0.641
598 2HZ LYS 71 2HZ LYS 71 14.300 -12.478 0.322
599 3HZ LYS 71 3HZ LYS 71 15.204 -11.812 -0.942
600 H ILE 72 H ILE 72 9.992 -6.863 0.233
601 HA ILE 72 HA ILE 72 9.314 -6.259 -2.567
602 HB ILE 72 HB ILE 72 8.292 -4.792 -0.147
603 1HG1 ILE 72 2HG1 ILE 72 6.202 -6.315 -1.199
604 2HG1 ILE 72 1HG1 ILE 72 7.571 -7.420 -1.143
605 1HG2 ILE 72 1HG2 ILE 72 7.019 -4.975 -2.851
606 2HG2 ILE 72 2HG2 ILE 72 8.253 -3.769 -2.486
607 3HG2 ILE 72 3HG2 ILE 72 6.744 -3.789 -1.575
608 1HD1 ILE 72 1HD1 ILE 72 6.743 -7.761 0.933
609 2HD1 ILE 72 2HD1 ILE 72 6.074 -6.133 1.058
610 3HD1 ILE 72 3HD1 ILE 72 7.802 -6.398 1.291
611 H GLU 73 H GLU 73 9.929 -4.323 -3.495
612 HA GLU 73 HA GLU 73 11.843 -2.680 -1.987
613 1HB GLU 73 2HB GLU 73 13.096 -2.453 -4.207
614 2HB GLU 73 1HB GLU 73 13.272 -3.971 -3.335
615 1HG GLU 73 2HG GLU 73 11.789 -5.089 -4.814
616 2HG GLU 73 1HG GLU 73 11.303 -3.571 -5.570
617 H VAL 74 H VAL 74 12.192 -0.525 -2.966
618 HA VAL 74 HA VAL 74 9.650 0.521 -3.961
619 HB VAL 74 HB VAL 74 10.723 2.765 -3.481
620 1HG1 VAL 74 1HG1 VAL 74 10.674 2.221 -0.886
621 2HG1 VAL 74 2HG1 VAL 74 9.987 0.706 -1.474
622 3HG1 VAL 74 3HG1 VAL 74 9.206 2.238 -1.864
623 1HG2 VAL 74 1HG2 VAL 74 12.637 1.547 -1.627
624 2HG2 VAL 74 2HG2 VAL 74 12.807 2.956 -2.673
625 3HG2 VAL 74 3HG2 VAL 74 13.043 1.337 -3.329
626 H GLU 75 H GLU 75 9.406 0.821 -6.068
627 HA GLU 75 HA GLU 75 11.721 0.964 -7.813
628 1HB GLU 75 2HB GLU 75 8.907 0.268 -8.088
629 2HB GLU 75 1HB GLU 75 9.452 1.324 -9.383
630 1HG GLU 75 2HG GLU 75 11.278 -0.879 -8.778
631 2HG GLU 75 1HG GLU 75 9.690 -1.382 -9.355
632 H PHE 76 H PHE 76 11.690 2.596 -9.617
633 HA PHE 76 HA PHE 76 11.852 4.755 -10.309
634 1HB PHE 76 2HB PHE 76 9.472 5.379 -8.569
635 2HB PHE 76 1HB PHE 76 9.962 6.167 -10.066
636 HD1 PHE 76 1HD PHE 76 8.020 3.546 -8.584
637 HD2 PHE 76 2HD PHE 76 9.770 4.889 -12.223
638 HE1 PHE 76 1HE PHE 76 6.521 2.062 -9.846
639 HE2 PHE 76 2HE PHE 76 8.272 3.407 -13.494
640 HZ PHE 76 HZ PHE 76 6.644 1.991 -12.306
641 H ASP 77 H ASP 77 12.269 7.004 -9.575
642 HA ASP 77 HA ASP 77 14.017 7.006 -7.353
643 1HB ASP 77 2HB ASP 77 14.056 9.511 -7.756
644 2HB ASP 77 1HB ASP 77 14.512 8.505 -9.128
645 H LYS 78 H LYS 78 10.638 7.465 -7.613
646 HA LYS 78 HA LYS 78 10.243 7.629 -4.845
647 1HB LYS 78 2HB LYS 78 9.391 9.936 -4.647
648 2HB LYS 78 1HB LYS 78 11.108 9.889 -5.021
649 1HG LYS 78 2HG LYS 78 10.609 10.359 -7.369
650 2HG LYS 78 1HG LYS 78 8.887 10.415 -6.987
651 1HD LYS 78 2HD LYS 78 9.093 12.392 -5.780
652 2HD LYS 78 1HD LYS 78 10.824 12.168 -5.524
653 1HE LYS 78 2HE LYS 78 10.732 12.300 -8.221
654 2HE LYS 78 1HE LYS 78 9.377 13.345 -7.804
655 1HZ LYS 78 1HZ LYS 78 10.729 14.896 -6.919
656 2HZ LYS 78 2HZ LYS 78 11.877 14.202 -7.951
657 3HZ LYS 78 3HZ LYS 78 11.839 13.771 -6.315
658 H GLY 79 H GLY 79 8.943 8.584 -8.000
659 1HA GLY 79 2HA GLY 79 6.933 8.091 -9.001
660 2HA GLY 79 1HA GLY 79 6.710 6.855 -7.771
661 H GLN 80 H GLN 80 6.135 10.193 -8.633
662 HA GLN 80 HA GLN 80 4.654 10.758 -6.218
663 1HB GLN 80 2HB GLN 80 4.085 12.899 -7.463
664 2HB GLN 80 1HB GLN 80 5.789 12.623 -7.131
665 1HG GLN 80 2HG GLN 80 6.234 12.042 -9.370
666 2HG GLN 80 1HG GLN 80 4.521 11.898 -9.752
667 1HE2 GLN 80 1HE2 GLN 80 6.003 13.395 -11.381
668 2HE2 GLN 80 2HE2 GLN 80 5.681 15.078 -11.152
669 H ARG 81 H ARG 81 2.716 9.873 -5.933
670 HA ARG 81 HA ARG 81 0.927 9.633 -8.262
671 1HB ARG 81 2HB ARG 81 1.758 7.643 -6.560
672 2HB ARG 81 1HB ARG 81 0.207 8.096 -5.868
673 1HG ARG 81 2HG ARG 81 0.033 7.846 -8.737
674 2HG ARG 81 1HG ARG 81 0.662 6.372 -8.001
675 1HD ARG 81 2HD ARG 81 -1.441 5.828 -7.527
676 2HD ARG 81 1HD ARG 81 -1.436 7.136 -6.346
677 HE ARG 81 HE ARG 81 -2.038 8.320 -8.752
678 1HH1 ARG 81 1HH1 ARG 81 -3.428 5.806 -6.770
679 2HH1 ARG 81 2HH1 ARG 81 -5.049 6.116 -7.294
680 1HH2 ARG 81 1HH2 ARG 81 -4.169 8.728 -9.444
681 2HH2 ARG 81 2HH2 ARG 81 -5.470 7.774 -8.813
682 H THR 82 H THR 82 1.179 10.640 -4.902
683 HA THR 82 HA THR 82 -1.519 11.787 -5.061
684 HB THR 82 HB THR 82 0.072 11.588 -2.522
685 HG1 THR 82 1HG THR 82 -0.343 9.485 -3.868
686 1HG2 THR 82 1HG2 THR 82 -2.737 12.050 -3.238
687 2HG2 THR 82 2HG2 THR 82 -1.810 12.595 -1.842
688 3HG2 THR 82 3HG2 THR 82 -2.460 10.958 -1.881
689 H ASP 83 H ASP 83 -1.511 13.812 -3.350
690 HA ASP 83 HA ASP 83 0.490 15.660 -4.449
691 1HB ASP 83 2HB ASP 83 -2.398 15.916 -3.834
692 2HB ASP 83 1HB ASP 83 -1.398 17.317 -3.468
693 H LYS 84 H LYS 84 -0.665 14.174 -1.607
694 HA LYS 84 HA LYS 84 -0.047 16.050 0.363
695 1HB LYS 84 2HB LYS 84 0.384 13.077 0.658
696 2HB LYS 84 1HB LYS 84 -0.078 14.234 1.900
697 1HG LYS 84 2HG LYS 84 -2.099 14.436 0.024
698 2HG LYS 84 1HG LYS 84 -1.725 12.713 0.071
699 1HD LYS 84 2HD LYS 84 -2.137 12.598 2.408
700 2HD LYS 84 1HD LYS 84 -2.197 14.357 2.550
701 1HE LYS 84 2HE LYS 84 -4.182 14.226 0.935
702 2HE LYS 84 1HE LYS 84 -4.202 12.503 1.305
703 1HZ LYS 84 1HZ LYS 84 -4.965 14.763 2.961
704 2HZ LYS 84 2HZ LYS 84 -4.127 13.527 3.754
705 3HZ LYS 84 3HZ LYS 84 -5.568 13.182 2.939
706 H TYR 85 H TYR 85 1.834 14.733 2.009
707 HA TYR 85 HA TYR 85 4.271 15.621 0.728
708 1HB TYR 85 2HB TYR 85 5.274 15.014 3.002
709 2HB TYR 85 1HB TYR 85 4.109 16.331 2.967
710 HD1 TYR 85 1HD TYR 85 3.983 12.596 3.297
711 HD2 TYR 85 2HD TYR 85 2.670 16.375 4.751
712 HE1 TYR 85 1HE TYR 85 2.670 11.466 5.041
713 HE2 TYR 85 2HE TYR 85 1.349 15.251 6.493
714 HH TYR 85 HH TYR 85 0.721 11.915 6.462
715 H GLY 86 H GLY 86 2.678 12.931 0.224
716 1HA GLY 86 2HA GLY 86 3.807 11.156 -0.963
717 2HA GLY 86 1HA GLY 86 5.142 11.305 0.167
718 H ARG 87 H ARG 87 1.727 11.244 1.025
719 HA ARG 87 HA ARG 87 2.245 8.828 2.610
720 1HB ARG 87 2HB ARG 87 1.360 10.905 3.718
721 2HB ARG 87 1HB ARG 87 -0.118 10.697 2.794
722 1HG ARG 87 2HG ARG 87 0.666 8.294 4.236
723 2HG ARG 87 1HG ARG 87 0.385 9.679 5.291
724 1HD ARG 87 2HD ARG 87 -1.761 9.948 3.775
725 2HD ARG 87 1HD ARG 87 -1.504 8.224 3.509
726 HE ARG 87 HE ARG 87 -2.157 7.816 5.670
727 1HH1 ARG 87 1HH1 ARG 87 -1.594 11.239 5.271
728 2HH1 ARG 87 2HH1 ARG 87 -2.269 11.655 6.809
729 1HH2 ARG 87 1HH2 ARG 87 -3.047 8.365 7.692
730 2HH2 ARG 87 2HH2 ARG 87 -3.095 10.024 8.184
731 H GLY 88 H GLY 88 0.430 10.015 -0.087
732 1HA GLY 88 2HA GLY 88 -1.335 7.685 -0.070
733 2HA GLY 88 1HA GLY 88 -1.468 9.075 -1.132
734 H LEU 89 H LEU 89 1.709 8.403 -1.289
735 HA LEU 89 HA LEU 89 1.284 6.603 -3.580
736 1HB LEU 89 2HB LEU 89 3.687 7.482 -4.183
737 2HB LEU 89 1HB LEU 89 2.251 8.384 -4.604
738 HG LEU 89 HG LEU 89 4.074 9.804 -3.758
739 1HD1 LEU 89 1HD1 LEU 89 1.388 9.910 -3.096
740 2HD1 LEU 89 2HD1 LEU 89 2.555 11.229 -3.014
741 3HD1 LEU 89 3HD1 LEU 89 2.228 10.250 -1.585
742 1HD2 LEU 89 1HD2 LEU 89 4.890 8.030 -2.130
743 2HD2 LEU 89 2HD2 LEU 89 3.625 8.605 -1.045
744 3HD2 LEU 89 3HD2 LEU 89 4.900 9.700 -1.574
745 H ALA 90 H ALA 90 1.779 4.578 -3.213
746 HA ALA 90 HA ALA 90 4.307 3.937 -1.903
747 1HB ALA 90 1HB ALA 90 3.436 2.577 -0.247
748 2HB ALA 90 2HB ALA 90 1.880 2.408 -1.059
749 3HB ALA 90 3HB ALA 90 2.297 3.924 -0.262
750 H TYR 91 H TYR 91 5.323 2.818 -3.443
751 HA TYR 91 HA TYR 91 3.823 1.092 -5.243
752 1HB TYR 91 2HB TYR 91 6.618 2.167 -5.183
753 2HB TYR 91 1HB TYR 91 6.263 0.743 -6.158
754 HD1 TYR 91 1HD TYR 91 5.864 4.342 -5.840
755 HD2 TYR 91 2HD TYR 91 4.688 0.906 -8.057
756 HE1 TYR 91 1HE TYR 91 5.035 5.795 -7.643
757 HE2 TYR 91 2HE TYR 91 3.857 2.349 -9.866
758 HH TYR 91 HH TYR 91 3.263 5.566 -9.523
759 H ILE 92 H ILE 92 3.640 -1.040 -4.998
760 HA ILE 92 HA ILE 92 5.428 -2.365 -3.066
761 HB ILE 92 HB ILE 92 2.648 -3.277 -3.782
762 1HG1 ILE 92 2HG1 ILE 92 2.467 -2.357 -1.216
763 2HG1 ILE 92 1HG1 ILE 92 3.558 -1.173 -1.929
764 1HG2 ILE 92 1HG2 ILE 92 2.893 -4.904 -2.216
765 2HG2 ILE 92 2HG2 ILE 92 3.988 -3.941 -1.225
766 3HG2 ILE 92 3HG2 ILE 92 4.584 -4.728 -2.686
767 1HD1 ILE 92 1HD1 ILE 92 1.844 -0.919 -3.772
768 2HD1 ILE 92 2HD1 ILE 92 1.400 -0.297 -2.183
769 3HD1 ILE 92 3HD1 ILE 92 0.751 -1.840 -2.740
770 H TYR 93 H TYR 93 6.919 -3.462 -4.168
771 HA TYR 93 HA TYR 93 6.005 -5.272 -6.296
772 1HB TYR 93 2HB TYR 93 8.409 -3.454 -6.307
773 2HB TYR 93 1HB TYR 93 8.303 -4.865 -7.353
774 HD1 TYR 93 1HD TYR 93 7.773 -1.438 -7.217
775 HD2 TYR 93 2HD TYR 93 5.963 -5.000 -8.678
776 HE1 TYR 93 1HE TYR 93 6.512 -0.114 -8.863
777 HE2 TYR 93 2HE TYR 93 4.698 -3.687 -10.327
778 HH TYR 93 HH TYR 93 5.087 -1.338 -11.502
779 H ALA 94 H ALA 94 5.951 -6.926 -4.700
780 HA ALA 94 HA ALA 94 8.325 -7.633 -3.243
781 1HB ALA 94 1HB ALA 94 6.032 -8.006 -2.368
782 2HB ALA 94 2HB ALA 94 7.037 -9.454 -2.358
783 3HB ALA 94 3HB ALA 94 5.806 -9.244 -3.603
784 H ASP 95 H ASP 95 10.007 -8.491 -4.267
785 HA ASP 95 HA ASP 95 11.268 -9.695 -5.740
786 1HB ASP 95 2HB ASP 95 10.215 -11.433 -4.167
787 2HB ASP 95 1HB ASP 95 9.147 -11.822 -5.512
788 H GLY 96 H GLY 96 9.219 -7.973 -6.907
789 1HA GLY 96 2HA GLY 96 8.634 -7.458 -9.084
790 2HA GLY 96 1HA GLY 96 9.358 -8.975 -9.596
791 H LYS 97 H LYS 97 6.948 -8.929 -7.091
792 HA LYS 97 HA LYS 97 5.243 -10.632 -8.659
793 1HB LYS 97 2HB LYS 97 5.328 -9.703 -5.840
794 2HB LYS 97 1HB LYS 97 3.763 -10.193 -6.470
795 1HG LYS 97 2HG LYS 97 5.829 -12.106 -7.138
796 2HG LYS 97 1HG LYS 97 5.712 -11.840 -5.398
797 1HD LYS 97 2HD LYS 97 3.220 -12.180 -5.638
798 2HD LYS 97 1HD LYS 97 3.539 -12.725 -7.287
799 1HE LYS 97 2HE LYS 97 5.041 -14.466 -6.385
800 2HE LYS 97 1HE LYS 97 4.626 -13.946 -4.752
801 1HZ LYS 97 1HZ LYS 97 2.555 -14.843 -4.889
802 2HZ LYS 97 2HZ LYS 97 3.367 -15.909 -5.922
803 3HZ LYS 97 3HZ LYS 97 2.440 -14.650 -6.567
804 H MET 98 H MET 98 2.874 -10.216 -8.794
805 HA MET 98 HA MET 98 2.388 -7.380 -9.425
806 1HB MET 98 2HB MET 98 0.527 -8.351 -10.889
807 2HB MET 98 1HB MET 98 2.182 -8.582 -11.435
808 1HG MET 98 2HG MET 98 1.212 -10.747 -9.745
809 2HG MET 98 1HG MET 98 0.271 -10.529 -11.220
810 1HE MET 98 1HE MET 98 3.692 -13.080 -10.823
811 2HE MET 98 2HE MET 98 2.549 -12.433 -9.648
812 3HE MET 98 3HE MET 98 4.075 -11.600 -9.945
813 H VAL 99 H VAL 99 1.776 -6.918 -7.256
814 HA VAL 99 HA VAL 99 -0.577 -8.267 -6.195
815 HB VAL 99 HB VAL 99 -0.234 -6.703 -4.238
816 1HG1 VAL 99 1HG1 VAL 99 0.803 -9.104 -4.714
817 2HG1 VAL 99 2HG1 VAL 99 1.171 -8.191 -3.251
818 3HG1 VAL 99 3HG1 VAL 99 2.305 -8.188 -4.602
819 1HG2 VAL 99 1HG2 VAL 99 2.464 -6.164 -5.438
820 2HG2 VAL 99 2HG2 VAL 99 1.696 -5.389 -4.053
821 3HG2 VAL 99 3HG2 VAL 99 1.104 -5.068 -5.683
822 H ASN 100 H ASN 100 0.379 -5.157 -7.516
823 HA ASN 100 HA ASN 100 -1.978 -3.746 -6.847
824 1HB ASN 100 2HB ASN 100 -1.240 -2.157 -8.634
825 2HB ASN 100 1HB ASN 100 0.010 -2.522 -7.448
826 1HD2 ASN 100 1HD2 ASN 100 -1.111 -3.148 -10.705
827 2HD2 ASN 100 2HD2 ASN 100 0.409 -3.676 -11.331
828 H GLU 101 H GLU 101 -1.088 -5.825 -9.518
829 HA GLU 101 HA GLU 101 -3.544 -5.221 -10.956
830 1HB GLU 101 2HB GLU 101 -1.238 -5.601 -12.033
831 2HB GLU 101 1HB GLU 101 -1.522 -7.309 -11.730
832 1HG GLU 101 2HG GLU 101 -2.708 -7.455 -13.584
833 2HG GLU 101 1HG GLU 101 -3.838 -6.246 -12.974
834 H ALA 102 H ALA 102 -2.347 -7.564 -8.726
835 HA ALA 102 HA ALA 102 -3.837 -9.812 -9.439
836 1HB ALA 102 1HB ALA 102 -2.727 -8.835 -6.838
837 2HB ALA 102 2HB ALA 102 -2.217 -10.203 -7.827
838 3HB ALA 102 3HB ALA 102 -3.716 -10.293 -6.901
839 H LEU 103 H LEU 103 -4.718 -8.130 -6.450
840 HA LEU 103 HA LEU 103 -7.519 -8.270 -7.330
841 1HB LEU 103 2HB LEU 103 -7.991 -8.179 -4.802
842 2HB LEU 103 1HB LEU 103 -7.476 -9.686 -5.519
843 HG LEU 103 HG LEU 103 -6.454 -9.199 -3.310
844 1HD1 LEU 103 1HD1 LEU 103 -5.254 -10.214 -5.623
845 2HD1 LEU 103 2HD1 LEU 103 -4.799 -10.520 -3.948
846 3HD1 LEU 103 3HD1 LEU 103 -4.030 -9.211 -4.845
847 1HD2 LEU 103 1HD2 LEU 103 -6.179 -6.664 -4.099
848 2HD2 LEU 103 2HD2 LEU 103 -4.572 -7.261 -4.505
849 3HD2 LEU 103 3HD2 LEU 103 -5.173 -7.396 -2.851
850 H VAL 104 H VAL 104 -5.010 -6.224 -6.152
851 HA VAL 104 HA VAL 104 -6.480 -4.099 -5.112
852 HB VAL 104 HB VAL 104 -3.884 -3.934 -6.644
853 1HG1 VAL 104 1HG1 VAL 104 -3.746 -1.987 -4.791
854 2HG1 VAL 104 2HG1 VAL 104 -5.480 -1.982 -5.113
855 3HG1 VAL 104 3HG1 VAL 104 -4.336 -1.730 -6.432
856 1HG2 VAL 104 1HG2 VAL 104 -4.420 -4.391 -3.709
857 2HG2 VAL 104 2HG2 VAL 104 -2.836 -4.035 -4.398
858 3HG2 VAL 104 3HG2 VAL 104 -3.676 -5.522 -4.840
859 H ARG 105 H ARG 105 -6.225 -5.201 -8.355
860 HA ARG 105 HA ARG 105 -6.605 -2.844 -9.798
861 1HB ARG 105 2HB ARG 105 -7.724 -4.342 -11.496
862 2HB ARG 105 1HB ARG 105 -6.110 -4.834 -11.002
863 1HG ARG 105 2HG ARG 105 -6.860 -6.686 -9.892
864 2HG ARG 105 1HG ARG 105 -8.449 -5.988 -9.574
865 1HD ARG 105 2HD ARG 105 -8.394 -7.857 -11.263
866 2HD ARG 105 1HD ARG 105 -9.162 -6.364 -11.798
867 HE ARG 105 HE ARG 105 -6.375 -6.552 -12.483
868 1HH1 ARG 105 1HH1 ARG 105 -9.630 -7.323 -13.475
869 2HH1 ARG 105 2HH1 ARG 105 -9.228 -7.425 -15.157
870 1HH2 ARG 105 1HH2 ARG 105 -5.843 -6.683 -14.693
871 2HH2 ARG 105 2HH2 ARG 105 -7.078 -7.060 -15.847
872 H GLN 106 H GLN 106 -8.871 -4.839 -8.007
873 HA GLN 106 HA GLN 106 -11.094 -3.113 -8.823
874 1HB GLN 106 2HB GLN 106 -11.287 -5.555 -7.072
875 2HB GLN 106 1HB GLN 106 -12.564 -4.783 -7.999
876 1HG GLN 106 2HG GLN 106 -11.218 -5.424 -10.066
877 2HG GLN 106 1HG GLN 106 -10.297 -6.474 -8.990
878 1HE2 GLN 106 1HE2 GLN 106 -11.965 -7.212 -11.230
879 2HE2 GLN 106 2HE2 GLN 106 -13.196 -8.249 -10.609
880 H GLY 107 H GLY 107 -8.854 -2.435 -6.921
881 1HA GLY 107 2HA GLY 107 -8.982 -0.773 -5.244
882 2HA GLY 107 1HA GLY 107 -10.573 -1.371 -4.805
883 H LEU 108 H LEU 108 -8.847 -4.092 -5.115
884 HA LEU 108 HA LEU 108 -6.983 -4.724 -3.485
885 1HB LEU 108 2HB LEU 108 -9.110 -3.640 -1.703
886 2HB LEU 108 1HB LEU 108 -8.172 -5.011 -1.152
887 HG LEU 108 HG LEU 108 -6.736 -2.604 -2.179
888 1HD1 LEU 108 1HD1 LEU 108 -6.700 -1.738 0.162
889 2HD1 LEU 108 2HD1 LEU 108 -7.992 -2.875 0.543
890 3HD1 LEU 108 3HD1 LEU 108 -8.260 -1.601 -0.646
891 1HD2 LEU 108 1HD2 LEU 108 -6.132 -5.043 -0.701
892 2HD2 LEU 108 2HD2 LEU 108 -5.453 -3.593 0.037
893 3HD2 LEU 108 3HD2 LEU 108 -5.072 -3.990 -1.637
894 H ALA 109 H ALA 109 -10.330 -5.345 -4.096
895 HA ALA 109 HA ALA 109 -9.852 -8.106 -4.510
896 1HB ALA 109 1HB ALA 109 -11.843 -8.430 -2.619
897 2HB ALA 109 2HB ALA 109 -10.711 -7.309 -1.864
898 3HB ALA 109 3HB ALA 109 -10.146 -8.872 -2.450
899 H LYS 110 H LYS 110 -12.902 -6.943 -3.184
900 HA LYS 110 HA LYS 110 -14.958 -6.694 -4.123
901 1HB LYS 110 2HB LYS 110 -14.346 -4.773 -5.237
902 2HB LYS 110 1HB LYS 110 -13.090 -5.578 -6.162
903 1HG LYS 110 2HG LYS 110 -14.766 -4.920 -7.687
904 2HG LYS 110 1HG LYS 110 -14.913 -6.667 -7.504
905 1HD LYS 110 2HD LYS 110 -16.982 -6.509 -6.652
906 2HD LYS 110 1HD LYS 110 -16.533 -5.173 -5.589
907 1HE LYS 110 2HE LYS 110 -16.495 -4.063 -8.130
908 2HE LYS 110 1HE LYS 110 -17.894 -5.136 -8.150
909 1HZ LYS 110 1HZ LYS 110 -18.668 -4.046 -6.108
910 2HZ LYS 110 2HZ LYS 110 -18.541 -2.961 -7.399
911 3HZ LYS 110 3HZ LYS 110 -17.363 -2.973 -6.185
Start of MODEL 7
1 1H ALA 1 1HT ALA 1 13.789 16.112 -26.583
2 2H ALA 1 2HT ALA 1 13.504 14.905 -25.397
3 3H ALA 1 3HT ALA 1 12.722 16.429 -25.280
4 HA ALA 1 HA ALA 1 11.332 16.013 -27.009
5 1HB ALA 1 1HB ALA 1 13.345 15.053 -28.353
6 2HB ALA 1 2HB ALA 1 11.703 14.554 -28.756
7 3HB ALA 1 3HB ALA 1 12.735 13.497 -27.794
8 H THR 2 H THR 2 12.750 13.066 -25.582
9 HA THR 2 HA THR 2 10.051 12.328 -24.663
10 HB THR 2 HB THR 2 12.216 10.298 -24.681
11 HG1 THR 2 1HG THR 2 12.665 10.774 -26.682
12 1HG2 THR 2 1HG2 THR 2 10.540 8.852 -24.679
13 2HG2 THR 2 2HG2 THR 2 9.756 9.645 -26.046
14 3HG2 THR 2 3HG2 THR 2 9.471 10.229 -24.406
15 H SER 3 H SER 3 9.670 12.320 -22.551
16 HA SER 3 HA SER 3 11.644 13.112 -20.680
17 1HB SER 3 2HB SER 3 8.787 12.238 -20.504
18 2HB SER 3 1HB SER 3 9.745 12.335 -19.027
19 HG SER 3 HG SER 3 10.130 14.508 -19.465
20 H THR 4 H THR 4 13.083 11.937 -19.603
21 HA THR 4 HA THR 4 12.796 9.012 -19.633
22 HB THR 4 HB THR 4 15.304 10.560 -18.996
23 HG1 THR 4 1HG THR 4 14.829 11.165 -21.051
24 1HG2 THR 4 1HG2 THR 4 16.306 8.602 -18.812
25 2HG2 THR 4 2HG2 THR 4 15.682 8.085 -20.379
26 3HG2 THR 4 3HG2 THR 4 14.726 7.827 -18.919
27 H LYS 5 H LYS 5 11.820 8.322 -17.835
28 HA LYS 5 HA LYS 5 12.431 9.616 -15.278
29 1HB LYS 5 2HB LYS 5 10.037 8.958 -16.263
30 2HB LYS 5 1HB LYS 5 10.419 7.433 -15.472
31 1HG LYS 5 2HG LYS 5 9.753 8.281 -13.543
32 2HG LYS 5 1HG LYS 5 11.031 9.493 -13.642
33 1HD LYS 5 2HD LYS 5 9.610 11.123 -14.294
34 2HD LYS 5 1HD LYS 5 8.648 10.029 -15.289
35 1HE LYS 5 2HE LYS 5 8.472 9.576 -12.388
36 2HE LYS 5 1HE LYS 5 7.810 11.112 -12.949
37 1HZ LYS 5 1HZ LYS 5 6.067 9.543 -13.008
38 2HZ LYS 5 2HZ LYS 5 7.017 8.384 -13.791
39 3HZ LYS 5 3HZ LYS 5 6.531 9.776 -14.617
40 H LYS 6 H LYS 6 13.828 8.726 -13.915
41 HA LYS 6 HA LYS 6 14.720 5.984 -14.386
42 1HB LYS 6 2HB LYS 6 16.133 8.249 -13.867
43 2HB LYS 6 1HB LYS 6 16.006 7.566 -12.252
44 1HG LYS 6 2HG LYS 6 17.602 6.099 -12.694
45 2HG LYS 6 1HG LYS 6 16.725 5.508 -14.106
46 1HD LYS 6 2HD LYS 6 17.647 7.561 -15.319
47 2HD LYS 6 1HD LYS 6 18.749 7.725 -13.951
48 1HE LYS 6 2HE LYS 6 19.054 5.099 -14.544
49 2HE LYS 6 1HE LYS 6 18.725 5.764 -16.143
50 1HZ LYS 6 1HZ LYS 6 21.075 5.775 -15.725
51 2HZ LYS 6 2HZ LYS 6 20.868 6.633 -14.281
52 3HZ LYS 6 3HZ LYS 6 20.522 7.374 -15.762
53 H LEU 7 H LEU 7 14.091 4.341 -13.156
54 HA LEU 7 HA LEU 7 12.924 4.934 -10.515
55 1HB LEU 7 2HB LEU 7 12.164 2.654 -12.338
56 2HB LEU 7 1HB LEU 7 11.410 3.073 -10.811
57 HG LEU 7 HG LEU 7 9.943 3.806 -12.525
58 1HD1 LEU 7 1HD1 LEU 7 10.068 6.326 -12.286
59 2HD1 LEU 7 2HD1 LEU 7 11.522 6.062 -11.326
60 3HD1 LEU 7 3HD1 LEU 7 9.980 5.395 -10.792
61 1HD2 LEU 7 1HD2 LEU 7 10.538 4.665 -14.519
62 2HD2 LEU 7 2HD2 LEU 7 12.099 3.941 -14.135
63 3HD2 LEU 7 3HD2 LEU 7 11.824 5.657 -13.832
64 H HIS 8 H HIS 8 14.423 4.388 -9.063
65 HA HIS 8 HA HIS 8 16.144 2.086 -9.508
66 1HB HIS 8 2HB HIS 8 16.404 4.544 -8.133
67 2HB HIS 8 1HB HIS 8 16.495 3.277 -6.915
68 HD1 HIS 8 1HD HIS 8 18.167 1.164 -8.015
69 HD2 HIS 8 2HD HIS 8 18.902 5.150 -8.929
70 HE1 HIS 8 1HE HIS 8 20.572 1.255 -8.742
71 HE2 HIS 8 2HE HIS 8 20.973 3.664 -9.363
72 H LYS 9 H LYS 9 16.341 0.354 -8.008
73 HA LYS 9 HA LYS 9 13.836 -0.184 -6.568
74 1HB LYS 9 2HB LYS 9 15.626 -1.814 -8.207
75 2HB LYS 9 1HB LYS 9 15.212 -2.577 -6.679
76 1HG LYS 9 2HG LYS 9 12.822 -2.240 -7.198
77 2HG LYS 9 1HG LYS 9 13.288 -1.585 -8.769
78 1HD LYS 9 2HD LYS 9 13.688 -3.620 -9.623
79 2HD LYS 9 1HD LYS 9 14.508 -4.172 -8.162
80 1HE LYS 9 2HE LYS 9 12.700 -5.281 -7.494
81 2HE LYS 9 1HE LYS 9 11.694 -3.845 -7.666
82 1HZ LYS 9 1HZ LYS 9 10.898 -4.547 -9.618
83 2HZ LYS 9 2HZ LYS 9 11.452 -6.075 -9.150
84 3HZ LYS 9 3HZ LYS 9 12.399 -5.108 -10.164
85 H GLU 10 H GLU 10 14.023 0.372 -4.494
86 HA GLU 10 HA GLU 10 16.481 -0.397 -3.062
87 1HB GLU 10 2HB GLU 10 14.524 1.700 -2.139
88 2HB GLU 10 1HB GLU 10 16.169 1.430 -1.581
89 1HG GLU 10 2HG GLU 10 16.597 1.932 -4.205
90 2HG GLU 10 1HG GLU 10 15.179 2.934 -3.895
91 HA PRO 11 HA PRO 11 14.163 -3.259 -0.647
92 1HB PRO 11 2HB PRO 11 15.421 -2.995 1.779
93 2HB PRO 11 1HB PRO 11 16.069 -3.923 0.423
94 1HG PRO 11 2HG PRO 11 16.733 -1.143 1.305
95 2HG PRO 11 1HG PRO 11 17.817 -2.431 0.746
96 1HD PRO 11 2HD PRO 11 17.082 -0.406 -0.861
97 2HD PRO 11 1HD PRO 11 17.318 -2.052 -1.486
98 H ALA 12 H ALA 12 12.150 -2.912 0.006
99 HA ALA 12 HA ALA 12 11.653 -1.102 2.236
100 1HB ALA 12 1HB ALA 12 10.882 0.505 0.889
101 2HB ALA 12 2HB ALA 12 9.498 -0.553 0.611
102 3HB ALA 12 3HB ALA 12 10.858 -0.566 -0.512
103 H THR 13 H THR 13 10.814 -2.498 3.662
104 HA THR 13 HA THR 13 8.733 -4.355 2.711
105 HB THR 13 HB THR 13 10.395 -4.727 5.198
106 HG1 THR 13 1HG THR 13 11.851 -5.812 4.042
107 1HG2 THR 13 1HG2 THR 13 8.851 -6.692 3.523
108 2HG2 THR 13 2HG2 THR 13 8.375 -6.075 5.105
109 3HG2 THR 13 3HG2 THR 13 9.820 -7.073 4.947
110 H LEU 14 H LEU 14 7.020 -4.854 4.232
111 HA LEU 14 HA LEU 14 6.343 -2.522 5.884
112 1HB LEU 14 2HB LEU 14 4.005 -3.878 5.672
113 2HB LEU 14 1HB LEU 14 4.503 -2.586 4.600
114 HG LEU 14 HG LEU 14 5.496 -4.403 3.108
115 1HD1 LEU 14 1HD1 LEU 14 4.509 -6.013 5.279
116 2HD1 LEU 14 2HD1 LEU 14 5.509 -6.473 3.902
117 3HD1 LEU 14 3HD1 LEU 14 3.752 -6.483 3.757
118 1HD2 LEU 14 1HD2 LEU 14 2.509 -4.459 3.475
119 2HD2 LEU 14 2HD2 LEU 14 3.415 -4.773 1.996
120 3HD2 LEU 14 3HD2 LEU 14 3.384 -3.149 2.683
121 H ILE 15 H ILE 15 5.704 -2.755 8.003
122 HA ILE 15 HA ILE 15 6.410 -5.315 9.221
123 HB ILE 15 HB ILE 15 7.457 -3.271 10.115
124 1HG1 ILE 15 2HG1 ILE 15 5.714 -4.123 12.355
125 2HG1 ILE 15 1HG1 ILE 15 6.561 -5.407 11.498
126 1HG2 ILE 15 1HG2 ILE 15 6.217 -1.608 11.295
127 2HG2 ILE 15 2HG2 ILE 15 4.719 -2.519 11.114
128 3HG2 ILE 15 3HG2 ILE 15 5.486 -1.794 9.701
129 1HD1 ILE 15 1HD1 ILE 15 8.048 -3.005 12.459
130 2HD1 ILE 15 2HD1 ILE 15 8.639 -4.634 12.137
131 3HD1 ILE 15 3HD1 ILE 15 7.654 -4.320 13.565
132 H LYS 16 H LYS 16 3.736 -2.952 9.290
133 HA LYS 16 HA LYS 16 1.858 -5.107 9.714
134 1HB LYS 16 2HB LYS 16 2.770 -4.356 12.002
135 2HB LYS 16 1HB LYS 16 1.849 -2.882 11.737
136 1HG LYS 16 2HG LYS 16 0.046 -3.881 12.536
137 2HG LYS 16 1HG LYS 16 0.113 -5.041 11.207
138 1HD LYS 16 2HD LYS 16 0.331 -6.553 12.864
139 2HD LYS 16 1HD LYS 16 2.020 -6.043 12.848
140 1HE LYS 16 2HE LYS 16 0.064 -4.537 14.518
141 2HE LYS 16 1HE LYS 16 0.651 -6.100 15.087
142 1HZ LYS 16 1HZ LYS 16 2.693 -5.285 15.486
143 2HZ LYS 16 2HZ LYS 16 1.893 -3.797 15.564
144 3HZ LYS 16 3HZ LYS 16 2.685 -4.257 14.142
145 H ALA 17 H ALA 17 -0.039 -4.693 8.785
146 HA ALA 17 HA ALA 17 -0.568 -1.932 7.898
147 1HB ALA 17 1HB ALA 17 -1.709 -4.370 6.574
148 2HB ALA 17 2HB ALA 17 -0.095 -3.786 6.174
149 3HB ALA 17 3HB ALA 17 -1.497 -2.750 5.916
150 H ILE 18 H ILE 18 -2.729 -1.156 7.981
151 HA ILE 18 HA ILE 18 -4.198 -1.828 10.238
152 HB ILE 18 HB ILE 18 -4.422 0.287 8.859
153 1HG1 ILE 18 2HG1 ILE 18 -7.184 -0.676 9.300
154 2HG1 ILE 18 1HG1 ILE 18 -6.089 -0.842 10.667
155 1HG2 ILE 18 1HG2 ILE 18 -4.785 -0.840 6.693
156 2HG2 ILE 18 2HG2 ILE 18 -6.038 0.340 7.072
157 3HG2 ILE 18 3HG2 ILE 18 -6.359 -1.381 7.268
158 1HD1 ILE 18 1HD1 ILE 18 -7.399 1.256 10.664
159 2HD1 ILE 18 2HD1 ILE 18 -6.565 1.730 9.184
160 3HD1 ILE 18 3HD1 ILE 18 -5.654 1.509 10.679
161 H ASP 19 H ASP 19 -4.599 -2.870 6.899
162 HA ASP 19 HA ASP 19 -5.342 -5.442 7.352
163 1HB ASP 19 2HB ASP 19 -7.910 -5.225 6.931
164 2HB ASP 19 1HB ASP 19 -7.280 -5.023 8.561
165 H GLY 20 H GLY 20 -7.810 -4.108 5.395
166 1HA GLY 20 2HA GLY 20 -6.342 -4.942 3.021
167 2HA GLY 20 1HA GLY 20 -8.068 -4.647 3.125
168 H ASP 21 H ASP 21 -6.994 -2.031 4.638
169 HA ASP 21 HA ASP 21 -7.083 -0.473 2.172
170 1HB ASP 21 2HB ASP 21 -7.439 0.283 5.068
171 2HB ASP 21 1HB ASP 21 -7.411 1.464 3.761
172 H THR 22 H THR 22 -5.457 0.459 5.172
173 HA THR 22 HA THR 22 -3.182 1.343 3.580
174 HB THR 22 HB THR 22 -4.303 2.901 5.150
175 HG1 THR 22 1HG THR 22 -1.633 2.340 5.909
176 1HG2 THR 22 1HG2 THR 22 -4.921 1.989 7.106
177 2HG2 THR 22 2HG2 THR 22 -3.304 2.497 7.594
178 3HG2 THR 22 3HG2 THR 22 -3.596 0.826 7.112
179 H VAL 23 H VAL 23 -1.007 1.081 4.356
180 HA VAL 23 HA VAL 23 -0.486 -1.126 6.170
181 HB VAL 23 HB VAL 23 -0.677 -2.326 4.100
182 1HG1 VAL 23 1HG1 VAL 23 1.203 -0.259 2.979
183 2HG1 VAL 23 2HG1 VAL 23 -0.471 -0.555 2.507
184 3HG1 VAL 23 3HG1 VAL 23 0.771 -1.757 2.156
185 1HG2 VAL 23 1HG2 VAL 23 2.221 -2.293 4.017
186 2HG2 VAL 23 2HG2 VAL 23 1.120 -3.572 4.532
187 3HG2 VAL 23 3HG2 VAL 23 1.606 -2.318 5.671
188 H LYS 24 H LYS 24 1.329 -0.806 7.326
189 HA LYS 24 HA LYS 24 2.811 1.635 6.887
190 1HB LYS 24 2HB LYS 24 2.044 0.551 9.146
191 2HB LYS 24 1HB LYS 24 3.524 -0.384 8.983
192 1HG LYS 24 2HG LYS 24 4.828 1.672 8.905
193 2HG LYS 24 1HG LYS 24 3.347 2.621 9.035
194 1HD LYS 24 2HD LYS 24 2.931 1.300 11.200
195 2HD LYS 24 1HD LYS 24 4.636 0.855 11.091
196 1HE LYS 24 2HE LYS 24 5.355 3.043 11.385
197 2HE LYS 24 1HE LYS 24 3.805 3.722 10.893
198 1HZ LYS 24 1HZ LYS 24 4.583 3.531 13.424
199 2HZ LYS 24 2HZ LYS 24 3.765 2.058 13.273
200 3HZ LYS 24 3HZ LYS 24 2.958 3.510 12.952
201 H LEU 25 H LEU 25 4.978 1.827 6.401
202 HA LEU 25 HA LEU 25 6.415 -0.635 5.693
203 1HB LEU 25 2HB LEU 25 6.111 1.835 3.996
204 2HB LEU 25 1HB LEU 25 7.338 0.616 3.705
205 HG LEU 25 HG LEU 25 4.598 -0.438 3.894
206 1HD1 LEU 25 1HD1 LEU 25 4.703 1.915 2.589
207 2HD1 LEU 25 2HD1 LEU 25 3.623 0.593 2.146
208 3HD1 LEU 25 3HD1 LEU 25 5.148 0.813 1.285
209 1HD2 LEU 25 1HD2 LEU 25 6.405 -1.877 3.263
210 2HD2 LEU 25 2HD2 LEU 25 6.905 -0.770 1.985
211 3HD2 LEU 25 3HD2 LEU 25 5.375 -1.635 1.852
212 H MET 26 H MET 26 8.673 -0.538 5.845
213 HA MET 26 HA MET 26 9.667 1.734 7.432
214 1HB MET 26 2HB MET 26 9.728 -0.415 8.607
215 2HB MET 26 1HB MET 26 10.670 -1.116 7.298
216 1HG MET 26 2HG MET 26 12.369 0.747 7.821
217 2HG MET 26 1HG MET 26 11.498 0.894 9.347
218 1HE MET 26 1HE MET 26 14.536 -1.464 7.741
219 2HE MET 26 2HE MET 26 15.052 -0.965 9.351
220 3HE MET 26 3HE MET 26 14.364 0.218 8.239
221 H TYR 27 H TYR 27 10.443 3.108 5.894
222 HA TYR 27 HA TYR 27 12.358 2.037 3.940
223 1HB TYR 27 2HB TYR 27 10.359 3.379 3.147
224 2HB TYR 27 1HB TYR 27 11.096 4.780 3.921
225 HD1 TYR 27 1HD TYR 27 12.352 6.169 2.581
226 HD2 TYR 27 2HD TYR 27 12.053 2.055 1.541
227 HE1 TYR 27 1HE TYR 27 13.681 6.591 0.555
228 HE2 TYR 27 2HE TYR 27 13.380 2.465 -0.488
229 HH TYR 27 HH TYR 27 15.179 4.296 -1.174
230 H LYS 28 H LYS 28 14.357 2.072 4.758
231 HA LYS 28 HA LYS 28 16.298 2.817 5.679
232 1HB LYS 28 2HB LYS 28 15.139 5.511 4.941
233 2HB LYS 28 1HB LYS 28 16.810 5.230 5.411
234 1HG LYS 28 2HG LYS 28 15.917 3.517 3.226
235 2HG LYS 28 1HG LYS 28 15.854 5.241 2.851
236 1HD LYS 28 2HD LYS 28 18.220 5.398 3.696
237 2HD LYS 28 1HD LYS 28 18.236 3.635 3.758
238 1HE LYS 28 2HE LYS 28 19.044 3.847 1.662
239 2HE LYS 28 1HE LYS 28 17.337 3.997 1.253
240 1HZ LYS 28 1HZ LYS 28 17.702 6.480 1.596
241 2HZ LYS 28 2HZ LYS 28 18.352 5.786 0.196
242 3HZ LYS 28 3HZ LYS 28 19.359 6.136 1.511
243 H GLY 29 H GLY 29 13.958 2.447 7.397
244 1HA GLY 29 2HA GLY 29 13.862 2.534 9.739
245 2HA GLY 29 1HA GLY 29 14.997 3.874 9.716
246 H GLN 30 H GLN 30 13.022 4.936 7.489
247 HA GLN 30 HA GLN 30 11.503 6.542 9.359
248 1HB GLN 30 2HB GLN 30 12.700 7.406 7.264
249 2HB GLN 30 1HB GLN 30 11.372 6.701 6.354
250 1HG GLN 30 2HG GLN 30 10.287 8.608 6.632
251 2HG GLN 30 1HG GLN 30 10.136 8.194 8.339
252 1HE2 GLN 30 1HE2 GLN 30 12.823 8.450 9.072
253 2HE2 GLN 30 2HE2 GLN 30 13.256 10.120 8.991
254 HA PRO 31 HA PRO 31 7.935 3.866 9.005
255 1HB PRO 31 2HB PRO 31 6.171 5.486 10.301
256 2HB PRO 31 1HB PRO 31 7.373 4.498 11.140
257 1HG PRO 31 2HG PRO 31 7.466 7.408 10.442
258 2HG PRO 31 1HG PRO 31 7.938 6.603 11.951
259 1HD PRO 31 2HD PRO 31 9.751 7.372 10.106
260 2HD PRO 31 1HD PRO 31 9.970 5.915 11.096
261 H MET 32 H MET 32 7.636 3.999 6.753
262 HA MET 32 HA MET 32 6.351 6.298 5.579
263 1HB MET 32 2HB MET 32 7.978 5.006 4.289
264 2HB MET 32 1HB MET 32 6.972 3.572 4.428
265 1HG MET 32 2HG MET 32 6.487 4.325 2.309
266 2HG MET 32 1HG MET 32 5.168 4.999 3.264
267 1HE MET 32 1HE MET 32 6.233 5.528 0.476
268 2HE MET 32 2HE MET 32 6.976 7.100 0.184
269 3HE MET 32 3HE MET 32 5.266 6.998 0.607
270 H THR 33 H THR 33 4.243 6.665 5.605
271 HA THR 33 HA THR 33 2.416 4.517 6.336
272 HB THR 33 HB THR 33 1.660 7.390 5.856
273 HG1 THR 33 1HG THR 33 2.147 7.772 8.026
274 1HG2 THR 33 1HG2 THR 33 -0.215 5.940 6.215
275 2HG2 THR 33 2HG2 THR 33 0.027 6.946 7.644
276 3HG2 THR 33 3HG2 THR 33 0.541 5.258 7.655
277 H PHE 34 H PHE 34 1.327 3.404 4.869
278 HA PHE 34 HA PHE 34 1.040 4.530 2.168
279 1HB PHE 34 2HB PHE 34 2.210 2.267 2.611
280 2HB PHE 34 1HB PHE 34 0.588 1.643 2.888
281 HD1 PHE 34 1HD PHE 34 2.620 3.476 0.371
282 HD2 PHE 34 2HD PHE 34 -0.688 0.900 1.107
283 HE1 PHE 34 1HE PHE 34 2.331 3.161 -2.052
284 HE2 PHE 34 2HE PHE 34 -0.981 0.580 -1.316
285 HZ PHE 34 HZ PHE 34 0.530 1.711 -2.897
286 H ARG 35 H ARG 35 -0.734 5.761 3.495
287 HA ARG 35 HA ARG 35 -3.135 4.415 4.136
288 1HB ARG 35 2HB ARG 35 -2.389 7.277 3.664
289 2HB ARG 35 1HB ARG 35 -4.084 6.833 3.814
290 1HG ARG 35 2HG ARG 35 -3.169 5.606 5.985
291 2HG ARG 35 1HG ARG 35 -1.941 6.868 5.854
292 1HD ARG 35 2HD ARG 35 -3.386 8.513 6.390
293 2HD ARG 35 1HD ARG 35 -4.720 7.770 5.508
294 HE ARG 35 HE ARG 35 -4.090 7.452 8.295
295 1HH1 ARG 35 1HH1 ARG 35 -5.696 6.030 5.543
296 2HH1 ARG 35 2HH1 ARG 35 -6.785 5.089 6.505
297 1HH2 ARG 35 1HH2 ARG 35 -5.521 6.216 9.563
298 2HH2 ARG 35 2HH2 ARG 35 -6.686 5.196 8.788
299 H LEU 36 H LEU 36 -3.816 3.102 2.472
300 HA LEU 36 HA LEU 36 -4.526 4.440 -0.052
301 1HB LEU 36 2HB LEU 36 -2.977 2.279 0.184
302 2HB LEU 36 1HB LEU 36 -4.535 1.477 0.167
303 HG LEU 36 HG LEU 36 -5.016 2.726 -1.991
304 1HD1 LEU 36 1HD1 LEU 36 -3.554 4.424 -2.295
305 2HD1 LEU 36 2HD1 LEU 36 -2.629 3.164 -3.111
306 3HD1 LEU 36 3HD1 LEU 36 -2.246 3.601 -1.446
307 1HD2 LEU 36 1HD2 LEU 36 -4.127 0.300 -1.639
308 2HD2 LEU 36 2HD2 LEU 36 -2.642 0.948 -2.332
309 3HD2 LEU 36 3HD2 LEU 36 -4.144 1.008 -3.254
310 H LEU 37 H LEU 37 -6.464 5.277 0.899
311 HA LEU 37 HA LEU 37 -8.529 3.280 1.503
312 1HB LEU 37 2HB LEU 37 -8.188 6.178 2.176
313 2HB LEU 37 1HB LEU 37 -9.789 5.467 2.182
314 HG LEU 37 HG LEU 37 -8.690 5.557 4.421
315 1HD1 LEU 37 1HD1 LEU 37 -10.345 3.696 3.411
316 2HD1 LEU 37 2HD1 LEU 37 -9.789 3.705 5.085
317 3HD1 LEU 37 3HD1 LEU 37 -8.992 2.674 3.897
318 1HD2 LEU 37 1HD2 LEU 37 -6.402 5.118 3.742
319 2HD2 LEU 37 2HD2 LEU 37 -6.854 3.504 3.193
320 3HD2 LEU 37 3HD2 LEU 37 -6.937 3.908 4.907
321 H LEU 38 H LEU 38 -10.117 2.884 0.103
322 HA LEU 38 HA LEU 38 -10.201 4.352 -2.388
323 1HB LEU 38 2HB LEU 38 -11.193 1.773 -1.384
324 2HB LEU 38 1HB LEU 38 -12.266 2.567 -2.521
325 HG LEU 38 HG LEU 38 -9.381 2.301 -3.234
326 1HD1 LEU 38 1HD1 LEU 38 -11.410 0.077 -3.367
327 2HD1 LEU 38 2HD1 LEU 38 -9.887 0.081 -2.478
328 3HD1 LEU 38 3HD1 LEU 38 -9.878 0.089 -4.241
329 1HD2 LEU 38 1HD2 LEU 38 -11.995 2.357 -4.725
330 2HD2 LEU 38 2HD2 LEU 38 -10.453 1.975 -5.492
331 3HD2 LEU 38 3HD2 LEU 38 -10.702 3.555 -4.749
332 H VAL 39 H VAL 39 -12.699 4.452 -3.222
333 HA VAL 39 HA VAL 39 -13.809 6.656 -1.848
334 HB VAL 39 HB VAL 39 -15.238 4.908 -3.852
335 1HG1 VAL 39 1HG1 VAL 39 -15.561 7.853 -3.333
336 2HG1 VAL 39 2HG1 VAL 39 -16.544 6.619 -2.544
337 3HG1 VAL 39 3HG1 VAL 39 -16.595 6.800 -4.298
338 1HG2 VAL 39 1HG2 VAL 39 -14.343 6.971 -5.324
339 2HG2 VAL 39 2HG2 VAL 39 -13.482 5.440 -5.173
340 3HG2 VAL 39 3HG2 VAL 39 -13.010 6.817 -4.178
341 H ASP 40 H ASP 40 -15.054 6.708 -0.105
342 HA ASP 40 HA ASP 40 -16.139 4.255 0.980
343 1HB ASP 40 2HB ASP 40 -15.101 6.500 2.139
344 2HB ASP 40 1HB ASP 40 -16.830 6.794 2.309
345 H THR 41 H THR 41 -18.002 3.524 0.201
346 HA THR 41 HA THR 41 -20.283 5.342 0.089
347 HB THR 41 HB THR 41 -20.966 4.317 -2.117
348 HG1 THR 41 1HG THR 41 -19.592 3.091 -3.192
349 1HG2 THR 41 1HG2 THR 41 -19.941 5.902 -3.384
350 2HG2 THR 41 2HG2 THR 41 -18.374 5.675 -2.604
351 3HG2 THR 41 3HG2 THR 41 -19.653 6.561 -1.773
352 HA PRO 42 HA PRO 42 -22.430 1.897 1.813
353 1HB PRO 42 2HB PRO 42 -24.953 2.280 0.924
354 2HB PRO 42 1HB PRO 42 -24.202 3.340 2.124
355 1HG PRO 42 2HG PRO 42 -24.537 3.753 -0.822
356 2HG PRO 42 1HG PRO 42 -24.781 4.906 0.504
357 1HD PRO 42 2HD PRO 42 -22.530 4.856 -1.020
358 2HD PRO 42 1HD PRO 42 -22.537 5.373 0.677
359 H GLU 43 H GLU 43 -20.979 0.843 -0.122
360 HA GLU 43 HA GLU 43 -22.631 -1.243 -1.162
361 1HB GLU 43 2HB GLU 43 -21.718 0.954 -2.940
362 2HB GLU 43 1HB GLU 43 -21.575 -0.683 -3.563
363 1HG GLU 43 2HG GLU 43 -24.036 -0.935 -2.860
364 2HG GLU 43 1HG GLU 43 -24.037 0.827 -2.789
365 H THR 44 H THR 44 -19.499 0.402 -1.386
366 HA THR 44 HA THR 44 -18.167 -2.194 -1.669
367 HB THR 44 HB THR 44 -17.549 -0.431 -3.269
368 HG1 THR 44 1HG THR 44 -15.448 -0.978 -1.445
369 1HG2 THR 44 1HG2 THR 44 -17.017 1.655 -2.744
370 2HG2 THR 44 2HG2 THR 44 -15.935 1.140 -1.449
371 3HG2 THR 44 3HG2 THR 44 -17.664 1.309 -1.141
372 H LYS 45 H LYS 45 -19.375 -1.160 0.849
373 HA LYS 45 HA LYS 45 -17.038 -0.704 2.532
374 1HB LYS 45 2HB LYS 45 -19.866 -0.102 2.699
375 2HB LYS 45 1HB LYS 45 -19.308 -0.902 4.162
376 1HG LYS 45 2HG LYS 45 -17.363 1.020 3.556
377 2HG LYS 45 1HG LYS 45 -18.923 1.806 3.304
378 1HD LYS 45 2HD LYS 45 -18.484 0.174 5.766
379 2HD LYS 45 1HD LYS 45 -17.803 1.798 5.674
380 1HE LYS 45 2HE LYS 45 -19.920 2.031 6.697
381 2HE LYS 45 1HE LYS 45 -20.111 2.597 5.038
382 1HZ LYS 45 1HZ LYS 45 -21.267 0.681 4.442
383 2HZ LYS 45 2HZ LYS 45 -21.884 1.053 5.971
384 3HZ LYS 45 3HZ LYS 45 -20.748 -0.187 5.799
385 H HIS 46 H HIS 46 -19.914 -2.796 2.796
386 HA HIS 46 HA HIS 46 -20.185 -4.921 3.559
387 1HB HIS 46 2HB HIS 46 -17.595 -4.946 2.160
388 2HB HIS 46 1HB HIS 46 -17.814 -6.254 3.317
389 HD1 HIS 46 1HD HIS 46 -20.471 -7.325 2.953
390 HD2 HIS 46 2HD HIS 46 -18.380 -5.765 -0.282
391 HE1 HIS 46 1HE HIS 46 -21.528 -8.345 0.912
392 HE2 HIS 46 2HE HIS 46 -20.191 -7.454 -1.027
393 HA PRO 47 HA PRO 47 -18.033 -3.991 7.547
394 1HB PRO 47 2HB PRO 47 -20.117 -3.174 8.995
395 2HB PRO 47 1HB PRO 47 -19.332 -2.089 7.841
396 1HG PRO 47 2HG PRO 47 -21.885 -3.617 7.572
397 2HG PRO 47 1HG PRO 47 -21.502 -1.973 7.038
398 1HD PRO 47 2HD PRO 47 -21.484 -4.235 5.419
399 2HD PRO 47 1HD PRO 47 -20.663 -2.706 5.052
400 H LYS 48 H LYS 48 -19.789 -6.393 6.354
401 HA LYS 48 HA LYS 48 -20.299 -7.659 8.959
402 1HB LYS 48 2HB LYS 48 -22.305 -7.478 7.599
403 2HB LYS 48 1HB LYS 48 -21.499 -8.264 6.250
404 1HG LYS 48 2HG LYS 48 -21.185 -10.137 8.176
405 2HG LYS 48 1HG LYS 48 -22.722 -9.417 8.658
406 1HD LYS 48 2HD LYS 48 -22.343 -10.073 5.786
407 2HD LYS 48 1HD LYS 48 -22.579 -11.414 6.910
408 1HE LYS 48 2HE LYS 48 -24.752 -10.949 6.332
409 2HE LYS 48 1HE LYS 48 -24.569 -9.942 7.767
410 1HZ LYS 48 1HZ LYS 48 -24.228 -8.984 4.976
411 2HZ LYS 48 2HZ LYS 48 -24.181 -8.036 6.377
412 3HZ LYS 48 3HZ LYS 48 -25.628 -8.773 5.902
413 H LYS 49 H LYS 49 -19.909 -9.223 5.803
414 HA LYS 49 HA LYS 49 -17.709 -10.788 6.963
415 1HB LYS 49 2HB LYS 49 -20.011 -11.470 5.319
416 2HB LYS 49 1HB LYS 49 -18.510 -12.074 4.630
417 1HG LYS 49 2HG LYS 49 -18.305 -13.657 6.185
418 2HG LYS 49 1HG LYS 49 -18.722 -12.550 7.495
419 1HD LYS 49 2HD LYS 49 -20.392 -14.265 7.408
420 2HD LYS 49 1HD LYS 49 -21.115 -12.767 6.819
421 1HE LYS 49 2HE LYS 49 -21.845 -14.347 5.281
422 2HE LYS 49 1HE LYS 49 -20.448 -13.624 4.483
423 1HZ LYS 49 1HZ LYS 49 -19.104 -15.491 5.226
424 2HZ LYS 49 2HZ LYS 49 -20.414 -16.028 4.300
425 3HZ LYS 49 3HZ LYS 49 -20.448 -16.187 5.983
426 H GLY 50 H GLY 50 -18.706 -8.965 4.111
427 1HA GLY 50 2HA GLY 50 -17.458 -7.945 2.475
428 2HA GLY 50 1HA GLY 50 -16.061 -8.155 3.517
429 H VAL 51 H VAL 51 -18.039 -10.792 2.336
430 HA VAL 51 HA VAL 51 -15.735 -12.001 1.116
431 HB VAL 51 HB VAL 51 -17.276 -13.344 2.514
432 1HG1 VAL 51 1HG1 VAL 51 -19.258 -13.462 0.308
433 2HG1 VAL 51 2HG1 VAL 51 -19.304 -12.066 1.384
434 3HG1 VAL 51 3HG1 VAL 51 -19.477 -13.692 2.043
435 1HG2 VAL 51 1HG2 VAL 51 -17.648 -14.720 -0.017
436 2HG2 VAL 51 2HG2 VAL 51 -16.648 -15.153 1.370
437 3HG2 VAL 51 3HG2 VAL 51 -16.027 -14.043 0.147
438 H GLU 52 H GLU 52 -16.972 -9.600 -0.103
439 HA GLU 52 HA GLU 52 -18.496 -10.127 -2.351
440 1HB GLU 52 2HB GLU 52 -17.727 -7.856 -1.536
441 2HB GLU 52 1HB GLU 52 -16.172 -8.191 -2.283
442 1HG GLU 52 2HG GLU 52 -17.006 -7.212 -4.093
443 2HG GLU 52 1HG GLU 52 -17.936 -8.692 -4.319
444 H LYS 53 H LYS 53 -15.152 -10.681 -1.682
445 HA LYS 53 HA LYS 53 -14.881 -12.132 -4.212
446 1HB LYS 53 2HB LYS 53 -13.375 -9.890 -3.381
447 2HB LYS 53 1HB LYS 53 -12.318 -11.285 -3.231
448 1HG LYS 53 2HG LYS 53 -13.802 -10.431 -5.707
449 2HG LYS 53 1HG LYS 53 -12.069 -10.272 -5.409
450 1HD LYS 53 2HD LYS 53 -11.666 -12.420 -5.925
451 2HD LYS 53 1HD LYS 53 -13.091 -12.993 -5.058
452 1HE LYS 53 2HE LYS 53 -14.024 -13.381 -7.041
453 2HE LYS 53 1HE LYS 53 -14.112 -11.634 -7.259
454 1HZ LYS 53 1HZ LYS 53 -12.133 -11.624 -8.480
455 2HZ LYS 53 2HZ LYS 53 -12.979 -12.964 -9.070
456 3HZ LYS 53 3HZ LYS 53 -11.698 -13.183 -7.987
457 H TYR 54 H TYR 54 -14.315 -12.030 -0.718
458 HA TYR 54 HA TYR 54 -14.163 -14.828 -0.568
459 1HB TYR 54 2HB TYR 54 -11.818 -13.904 -1.528
460 2HB TYR 54 1HB TYR 54 -11.494 -13.824 0.200
461 HD1 TYR 54 1HD TYR 54 -11.021 -15.763 1.433
462 HD2 TYR 54 2HD TYR 54 -12.499 -16.113 -2.537
463 HE1 TYR 54 1HE TYR 54 -10.522 -18.174 1.467
464 HE2 TYR 54 2HE TYR 54 -12.006 -18.523 -2.518
465 HH TYR 54 HH TYR 54 -10.055 -19.987 -0.807
466 H GLY 55 H GLY 55 -13.658 -11.691 0.853
467 1HA GLY 55 2HA GLY 55 -14.332 -10.961 2.940
468 2HA GLY 55 1HA GLY 55 -14.787 -12.606 3.336
469 HA PRO 56 HA PRO 56 -11.543 -12.753 6.367
470 1HB PRO 56 2HB PRO 56 -10.716 -15.376 5.560
471 2HB PRO 56 1HB PRO 56 -11.699 -14.927 6.954
472 1HG PRO 56 2HG PRO 56 -12.538 -15.907 4.291
473 2HG PRO 56 1HG PRO 56 -13.362 -16.044 5.853
474 1HD PRO 56 2HD PRO 56 -14.248 -14.376 3.956
475 2HD PRO 56 1HD PRO 56 -14.315 -13.932 5.672
476 H GLU 57 H GLU 57 -10.988 -13.587 2.988
477 HA GLU 57 HA GLU 57 -8.128 -13.433 3.227
478 1HB GLU 57 2HB GLU 57 -9.355 -14.844 1.530
479 2HB GLU 57 1HB GLU 57 -9.722 -13.358 0.672
480 1HG GLU 57 2HG GLU 57 -7.856 -14.069 -0.438
481 2HG GLU 57 1HG GLU 57 -7.150 -12.990 0.766
482 H ALA 58 H ALA 58 -10.732 -11.213 2.388
483 HA ALA 58 HA ALA 58 -9.590 -9.199 1.002
484 1HB ALA 58 1HB ALA 58 -11.275 -7.903 1.748
485 2HB ALA 58 2HB ALA 58 -10.897 -8.208 3.444
486 3HB ALA 58 3HB ALA 58 -11.825 -9.389 2.522
487 H SER 59 H SER 59 -9.352 -9.313 4.569
488 HA SER 59 HA SER 59 -7.193 -7.389 4.530
489 1HB SER 59 2HB SER 59 -8.231 -8.901 6.930
490 2HB SER 59 1HB SER 59 -7.373 -7.361 6.909
491 HG SER 59 HG SER 59 -9.373 -6.646 7.014
492 H ALA 60 H ALA 60 -7.637 -10.783 5.478
493 HA ALA 60 HA ALA 60 -5.139 -11.408 6.413
494 1HB ALA 60 1HB ALA 60 -6.732 -13.232 4.624
495 2HB ALA 60 2HB ALA 60 -7.136 -12.920 6.311
496 3HB ALA 60 3HB ALA 60 -5.601 -13.684 5.898
497 H PHE 61 H PHE 61 -6.116 -10.883 3.094
498 HA PHE 61 HA PHE 61 -3.967 -12.045 1.751
499 1HB PHE 61 2HB PHE 61 -6.043 -11.097 0.696
500 2HB PHE 61 1HB PHE 61 -5.372 -9.489 0.948
501 HD1 PHE 61 1HD PHE 61 -3.733 -8.605 -0.510
502 HD2 PHE 61 2HD PHE 61 -4.902 -12.685 -0.832
503 HE1 PHE 61 1HE PHE 61 -2.537 -8.775 -2.653
504 HE2 PHE 61 2HE PHE 61 -3.707 -12.861 -2.974
505 HZ PHE 61 HZ PHE 61 -2.522 -10.905 -3.887
506 H THR 62 H THR 62 -4.354 -8.624 2.682
507 HA THR 62 HA THR 62 -1.565 -8.081 2.205
508 HB THR 62 HB THR 62 -3.224 -6.166 3.757
509 HG1 THR 62 1HG THR 62 -3.727 -6.716 1.022
510 1HG2 THR 62 1HG2 THR 62 -1.297 -5.136 3.101
511 2HG2 THR 62 2HG2 THR 62 -2.364 -4.717 1.759
512 3HG2 THR 62 3HG2 THR 62 -1.202 -6.032 1.585
513 H LYS 63 H LYS 63 -3.530 -9.066 4.868
514 HA LYS 63 HA LYS 63 -1.854 -8.163 6.972
515 1HB LYS 63 2HB LYS 63 -4.343 -9.055 6.972
516 2HB LYS 63 1HB LYS 63 -3.554 -10.593 7.288
517 1HG LYS 63 2HG LYS 63 -4.135 -9.676 9.386
518 2HG LYS 63 1HG LYS 63 -2.388 -9.486 9.216
519 1HD LYS 63 2HD LYS 63 -2.782 -7.356 9.816
520 2HD LYS 63 1HD LYS 63 -3.291 -7.156 8.139
521 1HE LYS 63 2HE LYS 63 -4.966 -6.230 9.613
522 2HE LYS 63 1HE LYS 63 -5.608 -7.662 8.811
523 1HZ LYS 63 1HZ LYS 63 -5.781 -7.246 11.427
524 2HZ LYS 63 2HZ LYS 63 -4.329 -8.112 11.380
525 3HZ LYS 63 3HZ LYS 63 -5.739 -8.791 10.738
526 H LYS 64 H LYS 64 -1.761 -10.891 4.838
527 HA LYS 64 HA LYS 64 0.100 -12.367 6.500
528 1HB LYS 64 2HB LYS 64 -1.427 -12.882 4.015
529 2HB LYS 64 1HB LYS 64 0.133 -13.684 4.138
530 1HG LYS 64 2HG LYS 64 -1.555 -15.161 4.956
531 2HG LYS 64 1HG LYS 64 -0.577 -14.618 6.322
532 1HD LYS 64 2HD LYS 64 -2.516 -12.734 6.321
533 2HD LYS 64 1HD LYS 64 -3.414 -14.120 5.702
534 1HE LYS 64 2HE LYS 64 -1.696 -14.731 7.992
535 2HE LYS 64 1HE LYS 64 -2.976 -13.569 8.344
536 1HZ LYS 64 1HZ LYS 64 -3.227 -16.357 7.400
537 2HZ LYS 64 2HZ LYS 64 -4.493 -15.252 7.203
538 3HZ LYS 64 3HZ LYS 64 -3.936 -15.629 8.754
539 H MET 65 H MET 65 0.110 -10.152 3.836
540 HA MET 65 HA MET 65 2.723 -10.718 2.875
541 1HB MET 65 2HB MET 65 0.677 -8.632 2.444
542 2HB MET 65 1HB MET 65 2.337 -8.153 2.119
543 1HG MET 65 2HG MET 65 1.171 -8.972 0.123
544 2HG MET 65 1HG MET 65 2.592 -9.936 0.525
545 1HE MET 65 1HE MET 65 -0.052 -10.236 -1.254
546 2HE MET 65 2HE MET 65 -0.877 -11.762 -0.938
547 3HE MET 65 3HE MET 65 0.813 -11.763 -1.441
548 H VAL 66 H VAL 66 1.742 -9.396 5.782
549 HA VAL 66 HA VAL 66 4.201 -7.799 6.031
550 HB VAL 66 HB VAL 66 3.092 -6.731 7.986
551 1HG1 VAL 66 1HG1 VAL 66 1.135 -5.813 6.281
552 2HG1 VAL 66 2HG1 VAL 66 2.362 -6.443 5.183
553 3HG1 VAL 66 3HG1 VAL 66 2.791 -5.216 6.374
554 1HG2 VAL 66 1HG2 VAL 66 1.516 -8.474 8.562
555 2HG2 VAL 66 2HG2 VAL 66 0.686 -8.270 7.020
556 3HG2 VAL 66 3HG2 VAL 66 0.650 -6.977 8.217
557 H GLU 67 H GLU 67 2.181 -10.204 7.677
558 HA GLU 67 HA GLU 67 4.157 -10.543 9.773
559 1HB GLU 67 2HB GLU 67 1.498 -11.870 9.249
560 2HB GLU 67 1HB GLU 67 2.540 -12.282 10.605
561 1HG GLU 67 2HG GLU 67 2.298 -9.517 10.720
562 2HG GLU 67 1HG GLU 67 0.687 -10.096 10.300
563 H ASN 68 H ASN 68 2.481 -12.919 7.709
564 HA ASN 68 HA ASN 68 4.585 -14.827 8.018
565 1HB ASN 68 2HB ASN 68 1.987 -14.711 6.583
566 2HB ASN 68 1HB ASN 68 3.177 -15.862 5.983
567 1HD2 ASN 68 1HD2 ASN 68 0.753 -15.307 8.219
568 2HD2 ASN 68 2HD2 ASN 68 1.031 -16.667 9.248
569 H ALA 69 H ALA 69 3.733 -12.458 5.597
570 HA ALA 69 HA ALA 69 6.044 -13.311 3.982
571 1HB ALA 69 1HB ALA 69 3.335 -12.479 3.267
572 2HB ALA 69 2HB ALA 69 4.518 -13.413 2.348
573 3HB ALA 69 3HB ALA 69 4.597 -11.651 2.350
574 H LYS 70 H LYS 70 7.456 -11.724 3.170
575 HA LYS 70 HA LYS 70 7.123 -8.951 3.755
576 1HB LYS 70 2HB LYS 70 8.663 -10.662 5.621
577 2HB LYS 70 1HB LYS 70 9.416 -9.139 5.164
578 1HG LYS 70 2HG LYS 70 6.924 -8.291 5.755
579 2HG LYS 70 1HG LYS 70 7.073 -9.660 6.858
580 1HD LYS 70 2HD LYS 70 9.473 -8.478 7.222
581 2HD LYS 70 1HD LYS 70 8.478 -7.068 6.847
582 1HE LYS 70 2HE LYS 70 6.867 -7.843 8.593
583 2HE LYS 70 1HE LYS 70 8.028 -9.093 9.034
584 1HZ LYS 70 1HZ LYS 70 8.969 -6.324 8.948
585 2HZ LYS 70 2HZ LYS 70 9.433 -7.592 9.968
586 3HZ LYS 70 3HZ LYS 70 7.977 -6.777 10.243
587 H LYS 71 H LYS 71 7.485 -9.392 1.387
588 HA LYS 71 HA LYS 71 10.322 -8.993 0.806
589 1HB LYS 71 2HB LYS 71 9.321 -11.448 0.409
590 2HB LYS 71 1HB LYS 71 8.841 -10.707 -1.113
591 1HG LYS 71 2HG LYS 71 11.007 -10.429 -1.818
592 2HG LYS 71 1HG LYS 71 11.653 -10.409 -0.177
593 1HD LYS 71 2HD LYS 71 10.908 -12.863 -0.065
594 2HD LYS 71 1HD LYS 71 10.770 -12.760 -1.822
595 1HE LYS 71 2HE LYS 71 13.202 -11.741 -1.580
596 2HE LYS 71 1HE LYS 71 13.184 -12.686 -0.091
597 1HZ LYS 71 1HZ LYS 71 13.233 -14.621 -1.214
598 2HZ LYS 71 2HZ LYS 71 13.916 -13.677 -2.441
599 3HZ LYS 71 3HZ LYS 71 12.269 -14.056 -2.485
600 H ILE 72 H ILE 72 9.706 -6.801 0.506
601 HA ILE 72 HA ILE 72 8.459 -6.326 -2.110
602 HB ILE 72 HB ILE 72 7.915 -4.542 0.252
603 1HG1 ILE 72 2HG1 ILE 72 5.527 -5.685 -0.163
604 2HG1 ILE 72 1HG1 ILE 72 6.561 -7.037 -0.620
605 1HG2 ILE 72 1HG2 ILE 72 7.739 -3.614 -2.057
606 2HG2 ILE 72 2HG2 ILE 72 6.244 -3.551 -1.124
607 3HG2 ILE 72 3HG2 ILE 72 6.458 -4.784 -2.364
608 1HD1 ILE 72 1HD1 ILE 72 6.708 -7.549 1.525
609 2HD1 ILE 72 2HD1 ILE 72 5.869 -6.069 1.986
610 3HD1 ILE 72 3HD1 ILE 72 7.620 -6.061 1.771
611 H GLU 73 H GLU 73 9.153 -4.450 -3.186
612 HA GLU 73 HA GLU 73 11.413 -3.007 -2.003
613 1HB GLU 73 2HB GLU 73 12.053 -4.972 -3.600
614 2HB GLU 73 1HB GLU 73 11.539 -3.873 -4.872
615 1HG GLU 73 2HG GLU 73 13.187 -2.259 -4.225
616 2HG GLU 73 1HG GLU 73 13.629 -3.217 -2.812
617 H VAL 74 H VAL 74 11.748 -0.911 -2.841
618 HA VAL 74 HA VAL 74 9.362 0.215 -4.106
619 HB VAL 74 HB VAL 74 10.462 2.424 -3.520
620 1HG1 VAL 74 1HG1 VAL 74 8.812 2.087 -2.028
621 2HG1 VAL 74 2HG1 VAL 74 10.140 1.773 -0.912
622 3HG1 VAL 74 3HG1 VAL 74 9.310 0.430 -1.696
623 1HG2 VAL 74 1HG2 VAL 74 12.692 0.914 -3.104
624 2HG2 VAL 74 2HG2 VAL 74 12.102 1.146 -1.458
625 3HG2 VAL 74 3HG2 VAL 74 12.445 2.544 -2.477
626 H GLU 75 H GLU 75 9.408 0.249 -6.251
627 HA GLU 75 HA GLU 75 11.958 0.736 -7.621
628 1HB GLU 75 2HB GLU 75 10.437 -1.271 -8.149
629 2HB GLU 75 1HB GLU 75 9.393 -0.104 -8.950
630 1HG GLU 75 2HG GLU 75 12.088 0.269 -9.829
631 2HG GLU 75 1HG GLU 75 11.641 -1.428 -9.991
632 H PHE 76 H PHE 76 11.959 3.014 -7.202
633 HA PHE 76 HA PHE 76 10.989 4.566 -9.309
634 1HB PHE 76 2HB PHE 76 9.249 5.890 -8.295
635 2HB PHE 76 1HB PHE 76 8.797 4.194 -8.173
636 HD1 PHE 76 1HD PHE 76 8.873 3.045 -6.013
637 HD2 PHE 76 2HD PHE 76 9.694 7.204 -6.355
638 HE1 PHE 76 1HE PHE 76 8.561 3.300 -3.586
639 HE2 PHE 76 2HE PHE 76 9.387 7.468 -3.928
640 HZ PHE 76 HZ PHE 76 8.819 5.515 -2.539
641 H ASP 77 H ASP 77 12.151 6.401 -9.430
642 HA ASP 77 HA ASP 77 13.668 7.186 -7.030
643 1HB ASP 77 2HB ASP 77 14.784 6.310 -9.284
644 2HB ASP 77 1HB ASP 77 14.585 7.998 -9.745
645 H LYS 78 H LYS 78 10.967 8.097 -8.238
646 HA LYS 78 HA LYS 78 11.282 10.764 -9.104
647 1HB LYS 78 2HB LYS 78 9.223 9.253 -9.306
648 2HB LYS 78 1HB LYS 78 8.864 9.713 -7.649
649 1HG LYS 78 2HG LYS 78 9.061 12.135 -8.527
650 2HG LYS 78 1HG LYS 78 8.857 11.396 -10.116
651 1HD LYS 78 2HD LYS 78 6.964 10.729 -7.898
652 2HD LYS 78 1HD LYS 78 6.771 12.232 -8.802
653 1HE LYS 78 2HE LYS 78 7.078 10.502 -10.839
654 2HE LYS 78 1HE LYS 78 6.340 9.435 -9.645
655 1HZ LYS 78 1HZ LYS 78 4.400 10.611 -9.653
656 2HZ LYS 78 2HZ LYS 78 4.879 10.852 -11.258
657 3HZ LYS 78 3HZ LYS 78 5.132 12.067 -10.109
658 H GLY 79 H GLY 79 10.988 9.300 -5.929
659 1HA GLY 79 2HA GLY 79 11.320 10.155 -3.826
660 2HA GLY 79 1HA GLY 79 12.213 11.452 -4.604
661 H GLN 80 H GLN 80 8.866 10.855 -5.377
662 HA GLN 80 HA GLN 80 8.163 13.342 -3.958
663 1HB GLN 80 2HB GLN 80 8.050 13.307 -6.508
664 2HB GLN 80 1HB GLN 80 6.691 12.206 -6.332
665 1HG GLN 80 2HG GLN 80 5.985 14.243 -4.662
666 2HG GLN 80 1HG GLN 80 6.836 15.096 -5.949
667 1HE2 GLN 80 1HE2 GLN 80 4.314 12.680 -5.394
668 2HE2 GLN 80 2HE2 GLN 80 3.343 13.123 -6.753
669 H ARG 81 H ARG 81 7.110 12.891 -2.146
670 HA ARG 81 HA ARG 81 5.154 10.688 -2.162
671 1HB ARG 81 2HB ARG 81 6.835 11.818 0.072
672 2HB ARG 81 1HB ARG 81 5.467 10.752 0.359
673 1HG ARG 81 2HG ARG 81 6.518 8.928 -0.597
674 2HG ARG 81 1HG ARG 81 7.645 9.928 -1.511
675 1HD ARG 81 2HD ARG 81 8.068 10.502 1.219
676 2HD ARG 81 1HD ARG 81 7.960 8.749 1.077
677 HE ARG 81 HE ARG 81 9.920 8.740 -0.137
678 1HH1 ARG 81 1HH1 ARG 81 8.824 12.026 0.302
679 2HH1 ARG 81 2HH1 ARG 81 10.308 12.725 -0.250
680 1HH2 ARG 81 1HH2 ARG 81 11.869 9.660 -0.868
681 2HH2 ARG 81 2HH2 ARG 81 12.036 11.385 -0.916
682 H THR 82 H THR 82 5.363 13.998 -2.244
683 HA THR 82 HA THR 82 3.077 14.515 -0.526
684 HB THR 82 HB THR 82 4.116 16.660 -2.283
685 HG1 THR 82 1HG THR 82 6.076 15.845 -1.816
686 1HG2 THR 82 1HG2 THR 82 2.859 16.423 0.297
687 2HG2 THR 82 2HG2 THR 82 3.035 17.831 -0.750
688 3HG2 THR 82 3HG2 THR 82 4.321 17.406 0.380
689 H ASP 83 H ASP 83 1.609 16.359 -1.702
690 HA ASP 83 HA ASP 83 0.140 16.907 -3.384
691 1HB ASP 83 2HB ASP 83 2.049 15.684 -4.884
692 2HB ASP 83 1HB ASP 83 0.691 14.590 -5.131
693 H LYS 84 H LYS 84 0.535 13.399 -2.902
694 HA LYS 84 HA LYS 84 -2.327 12.994 -3.053
695 1HB LYS 84 2HB LYS 84 -0.384 10.891 -2.161
696 2HB LYS 84 1HB LYS 84 -1.888 10.703 -3.052
697 1HG LYS 84 2HG LYS 84 -0.311 12.240 -4.728
698 2HG LYS 84 1HG LYS 84 0.813 11.076 -4.025
699 1HD LYS 84 2HD LYS 84 0.058 9.851 -5.798
700 2HD LYS 84 1HD LYS 84 -1.148 9.391 -4.596
701 1HE LYS 84 2HE LYS 84 -1.563 11.726 -6.436
702 2HE LYS 84 1HE LYS 84 -1.972 10.082 -6.923
703 1HZ LYS 84 1HZ LYS 84 -3.263 10.068 -4.699
704 2HZ LYS 84 2HZ LYS 84 -3.940 10.838 -6.044
705 3HZ LYS 84 3HZ LYS 84 -3.193 11.754 -4.834
706 H TYR 85 H TYR 85 0.071 12.001 -0.601
707 HA TYR 85 HA TYR 85 -1.614 13.089 1.503
708 1HB TYR 85 2HB TYR 85 -2.474 10.795 1.101
709 2HB TYR 85 1HB TYR 85 -0.874 10.158 1.467
710 HD1 TYR 85 1HD TYR 85 -0.315 9.615 3.664
711 HD2 TYR 85 2HD TYR 85 -3.626 12.187 2.946
712 HE1 TYR 85 1HE TYR 85 -0.894 9.527 6.052
713 HE2 TYR 85 2HE TYR 85 -4.215 12.107 5.333
714 HH TYR 85 HH TYR 85 -3.060 11.656 7.500
715 H GLY 86 H GLY 86 1.307 13.041 0.275
716 1HA GLY 86 2HA GLY 86 3.360 13.614 1.143
717 2HA GLY 86 1HA GLY 86 2.591 13.745 2.716
718 H ARG 87 H ARG 87 2.181 10.757 1.088
719 HA ARG 87 HA ARG 87 4.445 9.318 1.607
720 1HB ARG 87 2HB ARG 87 3.231 10.114 4.064
721 2HB ARG 87 1HB ARG 87 3.044 8.374 3.905
722 1HG ARG 87 2HG ARG 87 5.194 8.003 4.330
723 2HG ARG 87 1HG ARG 87 5.717 9.258 3.207
724 1HD ARG 87 2HD ARG 87 6.479 9.936 5.333
725 2HD ARG 87 1HD ARG 87 5.069 10.935 4.987
726 HE ARG 87 HE ARG 87 4.455 8.561 6.480
727 1HH1 ARG 87 1HH1 ARG 87 5.515 11.877 6.699
728 2HH1 ARG 87 2HH1 ARG 87 4.969 12.077 8.329
729 1HH2 ARG 87 1HH2 ARG 87 3.738 8.820 8.628
730 2HH2 ARG 87 2HH2 ARG 87 3.960 10.342 9.426
731 H GLY 88 H GLY 88 0.984 9.455 1.505
732 1HA GLY 88 2HA GLY 88 0.311 6.754 1.506
733 2HA GLY 88 1HA GLY 88 -0.575 8.007 0.653
734 H LEU 89 H LEU 89 1.488 8.764 -1.157
735 HA LEU 89 HA LEU 89 1.167 6.651 -3.089
736 1HB LEU 89 2HB LEU 89 1.067 9.189 -3.500
737 2HB LEU 89 1HB LEU 89 2.819 9.131 -3.467
738 HG LEU 89 HG LEU 89 1.900 9.087 -5.758
739 1HD1 LEU 89 1HD1 LEU 89 3.188 6.447 -5.131
740 2HD1 LEU 89 2HD1 LEU 89 4.069 7.973 -5.078
741 3HD1 LEU 89 3HD1 LEU 89 3.345 7.426 -6.589
742 1HD2 LEU 89 1HD2 LEU 89 1.007 6.290 -5.483
743 2HD2 LEU 89 2HD2 LEU 89 0.385 7.587 -6.502
744 3HD2 LEU 89 3HD2 LEU 89 -0.056 7.519 -4.796
745 H ALA 90 H ALA 90 2.454 4.930 -3.004
746 HA ALA 90 HA ALA 90 5.344 5.351 -2.947
747 1HB ALA 90 1HB ALA 90 4.344 4.814 -0.608
748 2HB ALA 90 2HB ALA 90 5.798 3.975 -1.149
749 3HB ALA 90 3HB ALA 90 4.232 3.171 -1.234
750 H TYR 91 H TYR 91 6.141 4.358 -4.673
751 HA TYR 91 HA TYR 91 4.660 2.248 -5.985
752 1HB TYR 91 2HB TYR 91 6.568 4.199 -6.775
753 2HB TYR 91 1HB TYR 91 7.260 2.619 -7.132
754 HD1 TYR 91 1HD TYR 91 3.984 4.393 -7.486
755 HD2 TYR 91 2HD TYR 91 6.822 1.737 -9.214
756 HE1 TYR 91 1HE TYR 91 2.612 4.262 -9.522
757 HE2 TYR 91 2HE TYR 91 5.459 1.599 -11.255
758 HH TYR 91 HH TYR 91 3.497 3.493 -12.291
759 H ILE 92 H ILE 92 4.745 0.456 -4.671
760 HA ILE 92 HA ILE 92 7.423 -0.643 -4.120
761 HB ILE 92 HB ILE 92 6.373 -1.970 -2.341
762 1HG1 ILE 92 2HG1 ILE 92 3.901 -0.352 -2.346
763 2HG1 ILE 92 1HG1 ILE 92 4.023 -1.545 -3.634
764 1HG2 ILE 92 1HG2 ILE 92 7.241 -0.167 -1.306
765 2HG2 ILE 92 2HG2 ILE 92 5.546 0.227 -1.029
766 3HG2 ILE 92 3HG2 ILE 92 6.416 0.974 -2.368
767 1HD1 ILE 92 1HD1 ILE 92 4.334 -2.149 -0.705
768 2HD1 ILE 92 2HD1 ILE 92 4.295 -3.314 -2.029
769 3HD1 ILE 92 3HD1 ILE 92 2.853 -2.377 -1.636
770 H TYR 93 H TYR 93 7.668 -2.970 -4.259
771 HA TYR 93 HA TYR 93 5.746 -4.284 -6.053
772 1HB TYR 93 2HB TYR 93 8.729 -4.056 -6.391
773 2HB TYR 93 1HB TYR 93 7.820 -5.369 -7.132
774 HD1 TYR 93 1HD TYR 93 7.688 -1.639 -6.852
775 HD2 TYR 93 2HD TYR 93 7.088 -5.070 -9.297
776 HE1 TYR 93 1HE TYR 93 7.146 -0.181 -8.756
777 HE2 TYR 93 2HE TYR 93 6.543 -3.620 -11.208
778 HH TYR 93 HH TYR 93 7.318 -0.717 -11.593
779 H ALA 94 H ALA 94 4.934 -5.476 -4.319
780 HA ALA 94 HA ALA 94 6.666 -7.032 -2.636
781 1HB ALA 94 1HB ALA 94 4.316 -6.006 -2.126
782 2HB ALA 94 2HB ALA 94 4.801 -7.536 -1.398
783 3HB ALA 94 3HB ALA 94 3.732 -7.528 -2.800
784 H ASP 95 H ASP 95 7.038 -9.190 -2.669
785 HA ASP 95 HA ASP 95 7.489 -11.200 -3.629
786 1HB ASP 95 2HB ASP 95 5.582 -12.540 -4.143
787 2HB ASP 95 1HB ASP 95 5.105 -11.444 -2.851
788 H GLY 96 H GLY 96 7.989 -8.883 -5.298
789 1HA GLY 96 2HA GLY 96 9.019 -8.852 -7.412
790 2HA GLY 96 1HA GLY 96 8.120 -10.295 -7.848
791 H LYS 97 H LYS 97 5.525 -9.317 -7.115
792 HA LYS 97 HA LYS 97 5.166 -7.013 -8.878
793 1HB LYS 97 2HB LYS 97 3.668 -9.623 -9.162
794 2HB LYS 97 1HB LYS 97 3.278 -8.141 -10.023
795 1HG LYS 97 2HG LYS 97 5.076 -8.313 -11.422
796 2HG LYS 97 1HG LYS 97 6.035 -9.224 -10.253
797 1HD LYS 97 2HD LYS 97 5.534 -10.928 -11.669
798 2HD LYS 97 1HD LYS 97 4.091 -11.003 -10.657
799 1HE LYS 97 2HE LYS 97 3.344 -11.078 -12.903
800 2HE LYS 97 1HE LYS 97 2.987 -9.457 -12.311
801 1HZ LYS 97 1HZ LYS 97 5.145 -8.773 -13.367
802 2HZ LYS 97 2HZ LYS 97 3.915 -9.206 -14.444
803 3HZ LYS 97 3HZ LYS 97 5.177 -10.285 -14.125
804 H MET 98 H MET 98 3.516 -5.673 -8.344
805 HA MET 98 HA MET 98 2.533 -5.676 -5.733
806 1HB MET 98 2HB MET 98 1.785 -4.196 -8.231
807 2HB MET 98 1HB MET 98 0.810 -4.012 -6.779
808 1HG MET 98 2HG MET 98 2.541 -3.018 -5.589
809 2HG MET 98 1HG MET 98 3.773 -3.617 -6.701
810 1HE MET 98 1HE MET 98 3.095 -1.522 -9.884
811 2HE MET 98 2HE MET 98 3.232 -3.181 -9.299
812 3HE MET 98 3HE MET 98 4.538 -2.033 -9.006
813 H VAL 99 H VAL 99 1.498 -7.556 -5.151
814 HA VAL 99 HA VAL 99 -0.705 -8.572 -6.729
815 HB VAL 99 HB VAL 99 -0.926 -10.248 -4.892
816 1HG1 VAL 99 1HG1 VAL 99 1.595 -9.835 -6.427
817 2HG1 VAL 99 2HG1 VAL 99 0.348 -11.069 -6.618
818 3HG1 VAL 99 3HG1 VAL 99 1.495 -11.174 -5.282
819 1HG2 VAL 99 1HG2 VAL 99 0.667 -10.354 -3.119
820 2HG2 VAL 99 2HG2 VAL 99 -0.021 -8.730 -3.115
821 3HG2 VAL 99 3HG2 VAL 99 1.587 -9.006 -3.787
822 H ASN 100 H ASN 100 -0.215 -6.597 -3.905
823 HA ASN 100 HA ASN 100 -2.805 -6.809 -2.796
824 1HB ASN 100 2HB ASN 100 -1.003 -4.395 -2.599
825 2HB ASN 100 1HB ASN 100 -2.220 -4.930 -1.444
826 1HD2 ASN 100 1HD2 ASN 100 -1.829 -7.141 -0.526
827 2HD2 ASN 100 2HD2 ASN 100 -0.199 -7.538 -0.109
828 H GLU 101 H GLU 101 -1.402 -4.702 -5.243
829 HA GLU 101 HA GLU 101 -3.484 -2.845 -5.451
830 1HB GLU 101 2HB GLU 101 -1.067 -3.372 -6.785
831 2HB GLU 101 1HB GLU 101 -2.307 -3.393 -8.030
832 1HG GLU 101 2HG GLU 101 -2.094 -1.186 -8.086
833 2HG GLU 101 1HG GLU 101 -2.949 -1.168 -6.545
834 H ALA 102 H ALA 102 -3.170 -6.095 -6.672
835 HA ALA 102 HA ALA 102 -5.452 -5.851 -8.440
836 1HB ALA 102 1HB ALA 102 -3.985 -7.337 -9.366
837 2HB ALA 102 2HB ALA 102 -5.032 -8.454 -8.490
838 3HB ALA 102 3HB ALA 102 -3.477 -7.981 -7.805
839 H LEU 103 H LEU 103 -4.702 -7.119 -5.262
840 HA LEU 103 HA LEU 103 -7.002 -8.645 -4.814
841 1HB LEU 103 2HB LEU 103 -5.196 -8.870 -3.304
842 2HB LEU 103 1HB LEU 103 -5.148 -7.151 -2.977
843 HG LEU 103 HG LEU 103 -6.078 -8.725 -1.167
844 1HD1 LEU 103 1HD1 LEU 103 -6.310 -6.138 -1.486
845 2HD1 LEU 103 2HD1 LEU 103 -7.245 -6.982 -0.252
846 3HD1 LEU 103 3HD1 LEU 103 -8.000 -6.538 -1.783
847 1HD2 LEU 103 1HD2 LEU 103 -7.592 -9.874 -2.873
848 2HD2 LEU 103 2HD2 LEU 103 -8.628 -8.454 -2.726
849 3HD2 LEU 103 3HD2 LEU 103 -8.297 -9.454 -1.313
850 H VAL 104 H VAL 104 -6.351 -5.297 -3.762
851 HA VAL 104 HA VAL 104 -8.994 -4.805 -2.894
852 HB VAL 104 HB VAL 104 -6.956 -2.752 -3.755
853 1HG1 VAL 104 1HG1 VAL 104 -9.554 -2.646 -2.319
854 2HG1 VAL 104 2HG1 VAL 104 -8.837 -1.501 -3.454
855 3HG1 VAL 104 3HG1 VAL 104 -8.269 -1.561 -1.786
856 1HG2 VAL 104 1HG2 VAL 104 -5.978 -4.266 -2.120
857 2HG2 VAL 104 2HG2 VAL 104 -7.364 -4.035 -1.055
858 3HG2 VAL 104 3HG2 VAL 104 -6.281 -2.686 -1.397
859 H ARG 105 H ARG 105 -7.673 -4.983 -6.026
860 HA ARG 105 HA ARG 105 -9.370 -3.078 -7.305
861 1HB ARG 105 2HB ARG 105 -7.121 -4.357 -8.066
862 2HB ARG 105 1HB ARG 105 -8.318 -5.352 -8.882
863 1HG ARG 105 2HG ARG 105 -7.732 -3.747 -10.462
864 2HG ARG 105 1HG ARG 105 -9.256 -3.158 -9.798
865 1HD ARG 105 2HD ARG 105 -8.298 -1.276 -9.108
866 2HD ARG 105 1HD ARG 105 -7.048 -2.170 -8.245
867 HE ARG 105 HE ARG 105 -5.611 -1.656 -9.931
868 1HH1 ARG 105 1HH1 ARG 105 -8.864 -1.407 -11.170
869 2HH1 ARG 105 2HH1 ARG 105 -8.362 -0.810 -12.716
870 1HH2 ARG 105 1HH2 ARG 105 -4.949 -0.873 -11.966
871 2HH2 ARG 105 2HH2 ARG 105 -6.141 -0.508 -13.169
872 H GLN 106 H GLN 106 -9.726 -6.376 -6.312
873 HA GLN 106 HA GLN 106 -12.096 -6.755 -7.974
874 1HB GLN 106 2HB GLN 106 -10.836 -8.685 -6.020
875 2HB GLN 106 1HB GLN 106 -12.051 -9.057 -7.235
876 1HG GLN 106 2HG GLN 106 -9.510 -7.868 -8.175
877 2HG GLN 106 1HG GLN 106 -9.465 -9.532 -7.595
878 1HE2 GLN 106 1HE2 GLN 106 -10.396 -7.423 -10.118
879 2HE2 GLN 106 2HE2 GLN 106 -11.049 -8.615 -11.185
880 H GLY 107 H GLY 107 -11.923 -4.866 -5.636
881 1HA GLY 107 2HA GLY 107 -13.791 -4.132 -4.374
882 2HA GLY 107 1HA GLY 107 -14.380 -5.787 -4.333
883 H LEU 108 H LEU 108 -11.213 -6.102 -3.692
884 HA LEU 108 HA LEU 108 -9.933 -6.368 -1.832
885 1HB LEU 108 2HB LEU 108 -10.928 -3.968 -1.411
886 2HB LEU 108 1HB LEU 108 -11.847 -4.791 -0.164
887 HG LEU 108 HG LEU 108 -8.867 -5.087 -0.264
888 1HD1 LEU 108 1HD1 LEU 108 -9.005 -3.165 1.511
889 2HD1 LEU 108 2HD1 LEU 108 -10.431 -2.697 0.583
890 3HD1 LEU 108 3HD1 LEU 108 -8.856 -2.797 -0.206
891 1HD2 LEU 108 1HD2 LEU 108 -9.256 -6.276 1.567
892 2HD2 LEU 108 2HD2 LEU 108 -10.984 -5.949 1.438
893 3HD2 LEU 108 3HD2 LEU 108 -9.944 -4.849 2.341
894 H ALA 109 H ALA 109 -10.503 -8.576 -1.816
895 HA ALA 109 HA ALA 109 -11.754 -9.418 0.598
896 1HB ALA 109 1HB ALA 109 -13.824 -9.822 -0.034
897 2HB ALA 109 2HB ALA 109 -13.257 -10.763 -1.407
898 3HB ALA 109 3HB ALA 109 -13.467 -9.024 -1.565
899 H LYS 110 H LYS 110 -10.679 -10.386 -2.625
900 HA LYS 110 HA LYS 110 -10.094 -13.074 -1.791
901 1HB LYS 110 2HB LYS 110 -9.106 -13.302 -4.056
902 2HB LYS 110 1HB LYS 110 -10.760 -12.709 -4.080
903 1HG LYS 110 2HG LYS 110 -10.082 -11.033 -5.352
904 2HG LYS 110 1HG LYS 110 -9.145 -10.427 -3.985
905 1HD LYS 110 2HD LYS 110 -7.441 -10.645 -5.470
906 2HD LYS 110 1HD LYS 110 -7.452 -12.303 -4.862
907 1HE LYS 110 2HE LYS 110 -9.071 -11.456 -7.248
908 2HE LYS 110 1HE LYS 110 -7.396 -11.987 -7.390
909 1HZ LYS 110 1HZ LYS 110 -7.930 -14.121 -6.728
910 2HZ LYS 110 2HZ LYS 110 -9.266 -13.702 -7.675
911 3HZ LYS 110 3HZ LYS 110 -9.381 -13.658 -5.988
Start of MODEL 8
1 1H ALA 1 1HT ALA 1 23.616 20.463 -12.771
2 2H ALA 1 2HT ALA 1 22.867 19.013 -13.298
3 3H ALA 1 3HT ALA 1 22.327 19.789 -11.866
4 HA ALA 1 HA ALA 1 21.399 21.530 -12.999
5 1HB ALA 1 1HB ALA 1 22.388 20.605 -15.653
6 2HB ALA 1 2HB ALA 1 23.472 21.519 -14.606
7 3HB ALA 1 3HB ALA 1 21.939 22.224 -15.117
8 H THR 2 H THR 2 21.744 18.747 -15.206
9 HA THR 2 HA THR 2 18.888 18.173 -14.790
10 HB THR 2 HB THR 2 20.131 17.657 -17.456
11 HG1 THR 2 1HG THR 2 20.409 19.689 -17.814
12 1HG2 THR 2 1HG2 THR 2 17.778 18.519 -18.108
13 2HG2 THR 2 2HG2 THR 2 17.389 18.195 -16.419
14 3HG2 THR 2 3HG2 THR 2 17.965 16.891 -17.457
15 H SER 3 H SER 3 18.727 16.257 -13.846
16 HA SER 3 HA SER 3 20.707 14.183 -14.495
17 1HB SER 3 2HB SER 3 20.623 14.735 -12.127
18 2HB SER 3 1HB SER 3 18.880 14.463 -12.097
19 HG SER 3 HG SER 3 20.876 12.684 -11.828
20 H THR 4 H THR 4 19.999 12.016 -14.828
21 HA THR 4 HA THR 4 17.539 11.871 -16.321
22 HB THR 4 HB THR 4 19.361 9.564 -15.660
23 HG1 THR 4 1HG THR 4 19.676 11.594 -17.600
24 1HG2 THR 4 1HG2 THR 4 17.049 9.743 -17.218
25 2HG2 THR 4 2HG2 THR 4 18.196 8.406 -17.133
26 3HG2 THR 4 3HG2 THR 4 18.398 9.665 -18.351
27 H LYS 5 H LYS 5 15.688 10.805 -15.789
28 HA LYS 5 HA LYS 5 15.251 10.274 -12.992
29 1HB LYS 5 2HB LYS 5 13.519 10.325 -15.438
30 2HB LYS 5 1HB LYS 5 12.919 9.589 -13.958
31 1HG LYS 5 2HG LYS 5 12.166 11.668 -13.562
32 2HG LYS 5 1HG LYS 5 13.811 11.926 -12.978
33 1HD LYS 5 2HD LYS 5 13.313 13.735 -14.433
34 2HD LYS 5 1HD LYS 5 14.405 12.663 -15.313
35 1HE LYS 5 2HE LYS 5 12.815 13.071 -16.917
36 2HE LYS 5 1HE LYS 5 12.172 11.603 -16.181
37 1HZ LYS 5 1HZ LYS 5 11.330 14.356 -15.452
38 2HZ LYS 5 2HZ LYS 5 10.656 12.912 -14.886
39 3HZ LYS 5 3HZ LYS 5 10.485 13.343 -16.513
40 H LYS 6 H LYS 6 16.202 8.440 -12.289
41 HA LYS 6 HA LYS 6 15.460 5.941 -13.661
42 1HB LYS 6 2HB LYS 6 18.055 6.547 -12.231
43 2HB LYS 6 1HB LYS 6 17.612 4.987 -12.910
44 1HG LYS 6 2HG LYS 6 17.391 6.221 -15.136
45 2HG LYS 6 1HG LYS 6 18.263 7.535 -14.343
46 1HD LYS 6 2HD LYS 6 20.158 6.145 -13.952
47 2HD LYS 6 1HD LYS 6 19.275 4.700 -14.445
48 1HE LYS 6 2HE LYS 6 19.115 5.572 -16.723
49 2HE LYS 6 1HE LYS 6 19.986 7.025 -16.231
50 1HZ LYS 6 1HZ LYS 6 21.949 5.951 -16.221
51 2HZ LYS 6 2HZ LYS 6 21.169 4.904 -17.297
52 3HZ LYS 6 3HZ LYS 6 21.296 4.494 -15.660
53 H LEU 7 H LEU 7 14.718 4.288 -12.422
54 HA LEU 7 HA LEU 7 13.823 4.938 -9.776
55 1HB LEU 7 2HB LEU 7 12.984 2.533 -9.838
56 2HB LEU 7 1HB LEU 7 12.305 3.654 -11.002
57 HG LEU 7 HG LEU 7 14.636 2.229 -12.036
58 1HD1 LEU 7 1HD1 LEU 7 12.423 0.719 -10.781
59 2HD1 LEU 7 2HD1 LEU 7 14.111 0.269 -11.028
60 3HD1 LEU 7 3HD1 LEU 7 12.969 0.180 -12.369
61 1HD2 LEU 7 1HD2 LEU 7 13.244 3.503 -13.496
62 2HD2 LEU 7 2HD2 LEU 7 11.796 2.659 -12.944
63 3HD2 LEU 7 3HD2 LEU 7 13.013 1.799 -13.889
64 H HIS 8 H HIS 8 15.114 4.843 -8.071
65 HA HIS 8 HA HIS 8 17.458 3.157 -8.046
66 1HB HIS 8 2HB HIS 8 17.908 4.190 -5.859
67 2HB HIS 8 1HB HIS 8 17.569 5.407 -7.084
68 HD1 HIS 8 1HD HIS 8 16.511 4.245 -3.789
69 HD2 HIS 8 2HD HIS 8 14.893 6.535 -6.855
70 HE1 HIS 8 1HE HIS 8 14.577 5.478 -2.758
71 HE2 HIS 8 2HE HIS 8 13.562 6.793 -4.652
72 H LYS 9 H LYS 9 17.214 1.057 -7.657
73 HA LYS 9 HA LYS 9 15.014 -0.060 -6.269
74 1HB LYS 9 2HB LYS 9 17.541 -1.075 -7.448
75 2HB LYS 9 1HB LYS 9 16.774 -2.085 -6.230
76 1HG LYS 9 2HG LYS 9 14.632 -1.645 -7.696
77 2HG LYS 9 1HG LYS 9 15.838 -1.346 -8.951
78 1HD LYS 9 2HD LYS 9 15.625 -3.842 -7.269
79 2HD LYS 9 1HD LYS 9 15.101 -3.683 -8.946
80 1HE LYS 9 2HE LYS 9 17.148 -4.443 -9.450
81 2HE LYS 9 1HE LYS 9 17.678 -2.803 -9.081
82 1HZ LYS 9 1HZ LYS 9 19.049 -3.928 -7.702
83 2HZ LYS 9 2HZ LYS 9 18.012 -5.255 -7.543
84 3HZ LYS 9 3HZ LYS 9 17.722 -3.844 -6.656
85 H GLU 10 H GLU 10 14.675 0.192 -4.167
86 HA GLU 10 HA GLU 10 16.941 -0.197 -2.333
87 1HB GLU 10 2HB GLU 10 14.982 2.032 -2.460
88 2HB GLU 10 1HB GLU 10 15.419 1.446 -0.861
89 1HG GLU 10 2HG GLU 10 17.819 1.772 -1.507
90 2HG GLU 10 1HG GLU 10 17.241 2.580 -2.962
91 HA PRO 11 HA PRO 11 14.364 -3.283 -0.492
92 1HB PRO 11 2HB PRO 11 15.419 -3.326 2.022
93 2HB PRO 11 1HB PRO 11 16.215 -4.053 0.621
94 1HG PRO 11 2HG PRO 11 16.709 -1.399 1.915
95 2HG PRO 11 1HG PRO 11 17.882 -2.591 1.322
96 1HD PRO 11 2HD PRO 11 17.235 -0.387 -0.093
97 2HD PRO 11 1HD PRO 11 17.629 -1.929 -0.878
98 H ALA 12 H ALA 12 12.306 -2.966 0.043
99 HA ALA 12 HA ALA 12 11.664 -1.353 2.387
100 1HB ALA 12 1HB ALA 12 9.842 -0.190 1.182
101 2HB ALA 12 2HB ALA 12 10.438 -0.880 -0.327
102 3HB ALA 12 3HB ALA 12 11.446 0.240 0.589
103 H THR 13 H THR 13 10.710 -2.850 3.619
104 HA THR 13 HA THR 13 8.583 -4.481 2.397
105 HB THR 13 HB THR 13 9.375 -5.933 4.594
106 HG1 THR 13 1HG THR 13 11.229 -4.749 4.928
107 1HG2 THR 13 1HG2 THR 13 9.128 -6.443 1.963
108 2HG2 THR 13 2HG2 THR 13 9.802 -7.574 3.138
109 3HG2 THR 13 3HG2 THR 13 10.877 -6.575 2.161
110 H LEU 14 H LEU 14 6.761 -4.924 3.679
111 HA LEU 14 HA LEU 14 6.319 -2.963 5.807
112 1HB LEU 14 2HB LEU 14 3.886 -3.837 5.495
113 2HB LEU 14 1HB LEU 14 4.575 -2.730 4.327
114 HG LEU 14 HG LEU 14 4.871 -5.627 3.758
115 1HD1 LEU 14 1HD1 LEU 14 2.708 -6.103 3.358
116 2HD1 LEU 14 2HD1 LEU 14 2.325 -4.454 2.865
117 3HD1 LEU 14 3HD1 LEU 14 2.421 -4.862 4.577
118 1HD2 LEU 14 1HD2 LEU 14 5.793 -3.965 2.246
119 2HD2 LEU 14 2HD2 LEU 14 4.211 -3.203 2.090
120 3HD2 LEU 14 3HD2 LEU 14 4.468 -4.833 1.469
121 H ILE 15 H ILE 15 5.767 -3.526 7.869
122 HA ILE 15 HA ILE 15 6.047 -6.376 8.538
123 HB ILE 15 HB ILE 15 6.345 -5.446 10.914
124 1HG1 ILE 15 2HG1 ILE 15 7.357 -2.951 9.666
125 2HG1 ILE 15 1HG1 ILE 15 5.611 -3.083 9.851
126 1HG2 ILE 15 1HG2 ILE 15 8.547 -4.634 9.058
127 2HG2 ILE 15 2HG2 ILE 15 8.100 -6.330 9.249
128 3HG2 ILE 15 3HG2 ILE 15 8.650 -5.400 10.643
129 1HD1 ILE 15 1HD1 ILE 15 7.184 -2.056 11.724
130 2HD1 ILE 15 2HD1 ILE 15 7.265 -3.751 12.208
131 3HD1 ILE 15 3HD1 ILE 15 5.704 -2.936 12.105
132 H LYS 16 H LYS 16 3.964 -3.579 8.932
133 HA LYS 16 HA LYS 16 1.829 -5.369 9.835
134 1HB LYS 16 2HB LYS 16 3.099 -3.407 11.468
135 2HB LYS 16 1HB LYS 16 1.466 -2.853 11.129
136 1HG LYS 16 2HG LYS 16 0.628 -5.069 11.898
137 2HG LYS 16 1HG LYS 16 2.277 -5.463 12.387
138 1HD LYS 16 2HD LYS 16 2.240 -3.395 13.813
139 2HD LYS 16 1HD LYS 16 0.520 -3.256 13.448
140 1HE LYS 16 2HE LYS 16 0.550 -4.386 15.482
141 2HE LYS 16 1HE LYS 16 0.362 -5.679 14.298
142 1HZ LYS 16 1HZ LYS 16 2.015 -6.482 15.658
143 2HZ LYS 16 2HZ LYS 16 2.725 -4.966 15.899
144 3HZ LYS 16 3HZ LYS 16 2.925 -5.767 14.423
145 H ALA 17 H ALA 17 0.826 -5.271 7.856
146 HA ALA 17 HA ALA 17 0.101 -2.636 6.808
147 1HB ALA 17 1HB ALA 17 0.769 -5.153 5.619
148 2HB ALA 17 2HB ALA 17 0.564 -3.578 4.855
149 3HB ALA 17 3HB ALA 17 -0.827 -4.640 5.072
150 H ILE 18 H ILE 18 -1.747 -1.839 7.556
151 HA ILE 18 HA ILE 18 -3.957 -3.668 8.177
152 HB ILE 18 HB ILE 18 -3.732 -0.733 8.854
153 1HG1 ILE 18 2HG1 ILE 18 -3.487 -2.829 10.946
154 2HG1 ILE 18 1HG1 ILE 18 -2.095 -2.595 9.890
155 1HG2 ILE 18 1HG2 ILE 18 -5.779 -2.810 9.266
156 2HG2 ILE 18 2HG2 ILE 18 -5.944 -1.058 9.140
157 3HG2 ILE 18 3HG2 ILE 18 -5.430 -1.788 10.660
158 1HD1 ILE 18 1HD1 ILE 18 -2.992 -1.018 12.113
159 2HD1 ILE 18 2HD1 ILE 18 -2.875 -0.031 10.656
160 3HD1 ILE 18 3HD1 ILE 18 -1.474 -0.943 11.219
161 H ASP 19 H ASP 19 -3.260 -0.648 6.446
162 HA ASP 19 HA ASP 19 -4.173 0.273 4.576
163 1HB ASP 19 2HB ASP 19 -4.415 -2.429 4.124
164 2HB ASP 19 1HB ASP 19 -6.074 -1.868 3.940
165 H GLY 20 H GLY 20 -6.788 -1.666 6.063
166 1HA GLY 20 2HA GLY 20 -8.925 -0.046 5.546
167 2HA GLY 20 1HA GLY 20 -8.775 -0.998 7.015
168 H ASP 21 H ASP 21 -6.369 0.555 7.843
169 HA ASP 21 HA ASP 21 -7.683 3.097 8.540
170 1HB ASP 21 2HB ASP 21 -6.146 1.239 10.360
171 2HB ASP 21 1HB ASP 21 -6.541 2.902 10.783
172 H THR 22 H THR 22 -4.505 1.710 9.311
173 HA THR 22 HA THR 22 -3.224 3.728 7.621
174 HB THR 22 HB THR 22 -1.724 3.487 10.060
175 HG1 THR 22 1HG THR 22 -3.318 3.379 11.416
176 1HG2 THR 22 1HG2 THR 22 -3.103 6.011 9.643
177 2HG2 THR 22 2HG2 THR 22 -2.234 5.444 8.216
178 3HG2 THR 22 3HG2 THR 22 -1.378 5.658 9.745
179 H VAL 23 H VAL 23 -1.171 3.173 6.878
180 HA VAL 23 HA VAL 23 -0.333 0.406 7.467
181 HB VAL 23 HB VAL 23 0.128 1.794 4.831
182 1HG1 VAL 23 1HG1 VAL 23 0.954 -0.196 4.068
183 2HG1 VAL 23 2HG1 VAL 23 -0.004 -1.154 5.197
184 3HG1 VAL 23 3HG1 VAL 23 1.432 -0.301 5.762
185 1HG2 VAL 23 1HG2 VAL 23 -1.852 1.098 3.978
186 2HG2 VAL 23 2HG2 VAL 23 -2.365 1.245 5.658
187 3HG2 VAL 23 3HG2 VAL 23 -1.918 -0.331 5.008
188 H LYS 24 H LYS 24 1.847 0.000 7.710
189 HA LYS 24 HA LYS 24 3.640 2.333 7.622
190 1HB LYS 24 2HB LYS 24 2.869 1.663 9.958
191 2HB LYS 24 1HB LYS 24 3.805 0.191 9.736
192 1HG LYS 24 2HG LYS 24 5.826 1.309 9.772
193 2HG LYS 24 1HG LYS 24 5.093 2.855 9.340
194 1HD LYS 24 2HD LYS 24 4.588 3.355 11.479
195 2HD LYS 24 1HD LYS 24 4.144 1.693 11.868
196 1HE LYS 24 2HE LYS 24 6.993 2.032 11.355
197 2HE LYS 24 1HE LYS 24 6.416 3.002 12.708
198 1HZ LYS 24 1HZ LYS 24 5.501 0.246 12.641
199 2HZ LYS 24 2HZ LYS 24 6.011 1.186 13.950
200 3HZ LYS 24 3HZ LYS 24 7.154 0.461 12.935
201 H LEU 25 H LEU 25 5.034 1.935 6.030
202 HA LEU 25 HA LEU 25 6.003 -0.807 5.624
203 1HB LEU 25 2HB LEU 25 5.603 1.541 3.877
204 2HB LEU 25 1HB LEU 25 7.042 0.593 3.550
205 HG LEU 25 HG LEU 25 4.505 -0.909 3.827
206 1HD1 LEU 25 1HD1 LEU 25 4.322 1.320 2.340
207 2HD1 LEU 25 2HD1 LEU 25 3.474 -0.179 1.961
208 3HD1 LEU 25 3HD1 LEU 25 4.988 0.207 1.145
209 1HD2 LEU 25 1HD2 LEU 25 5.665 -1.897 1.675
210 2HD2 LEU 25 2HD2 LEU 25 6.229 -2.317 3.293
211 3HD2 LEU 25 3HD2 LEU 25 7.082 -1.094 2.352
212 H MET 26 H MET 26 8.262 -1.192 5.304
213 HA MET 26 HA MET 26 9.906 0.450 7.040
214 1HB MET 26 2HB MET 26 9.880 -2.116 6.979
215 2HB MET 26 1HB MET 26 10.821 -1.972 5.500
216 1HG MET 26 2HG MET 26 12.291 -2.350 7.357
217 2HG MET 26 1HG MET 26 12.533 -0.716 6.740
218 1HE MET 26 1HE MET 26 10.677 -2.103 10.626
219 2HE MET 26 2HE MET 26 12.388 -2.415 10.336
220 3HE MET 26 3HE MET 26 11.175 -3.037 9.217
221 H TYR 27 H TYR 27 10.340 2.340 5.961
222 HA TYR 27 HA TYR 27 11.884 2.078 3.464
223 1HB TYR 27 2HB TYR 27 9.627 3.167 3.217
224 2HB TYR 27 1HB TYR 27 10.203 4.459 4.266
225 HD1 TYR 27 1HD TYR 27 11.481 6.236 3.399
226 HD2 TYR 27 2HD TYR 27 10.822 2.770 1.021
227 HE1 TYR 27 1HE TYR 27 12.429 7.400 1.451
228 HE2 TYR 27 2HE TYR 27 11.768 3.924 -0.933
229 HH TYR 27 HH TYR 27 12.056 6.353 -1.675
230 H LYS 28 H LYS 28 13.908 2.059 4.394
231 HA LYS 28 HA LYS 28 15.805 2.866 5.364
232 1HB LYS 28 2HB LYS 28 15.024 4.707 3.612
233 2HB LYS 28 1HB LYS 28 14.841 5.671 5.071
234 1HG LYS 28 2HG LYS 28 17.094 5.683 5.514
235 2HG LYS 28 1HG LYS 28 17.387 4.193 4.614
236 1HD LYS 28 2HD LYS 28 17.555 5.271 2.620
237 2HD LYS 28 1HD LYS 28 16.382 6.510 3.070
238 1HE LYS 28 2HE LYS 28 19.165 6.355 4.210
239 2HE LYS 28 1HE LYS 28 18.743 7.318 2.795
240 1HZ LYS 28 1HZ LYS 28 16.905 8.154 4.519
241 2HZ LYS 28 2HZ LYS 28 18.416 8.893 4.347
242 3HZ LYS 28 3HZ LYS 28 18.155 7.787 5.599
243 H GLY 29 H GLY 29 13.806 2.178 7.185
244 1HA GLY 29 2HA GLY 29 13.502 2.320 9.466
245 2HA GLY 29 1HA GLY 29 14.708 3.596 9.496
246 H GLN 30 H GLN 30 12.136 4.110 7.307
247 HA GLN 30 HA GLN 30 10.856 5.937 9.231
248 1HB GLN 30 2HB GLN 30 12.177 6.716 7.007
249 2HB GLN 30 1HB GLN 30 10.568 6.487 6.337
250 1HG GLN 30 2HG GLN 30 9.703 8.255 7.438
251 2HG GLN 30 1HG GLN 30 10.732 8.019 8.851
252 1HE2 GLN 30 1HE2 GLN 30 11.101 8.802 5.404
253 2HE2 GLN 30 2HE2 GLN 30 12.237 10.082 5.643
254 HA PRO 31 HA PRO 31 7.145 3.646 8.454
255 1HB PRO 31 2HB PRO 31 5.318 5.395 9.390
256 2HB PRO 31 1HB PRO 31 6.416 4.517 10.459
257 1HG PRO 31 2HG PRO 31 6.605 7.326 9.444
258 2HG PRO 31 1HG PRO 31 6.908 6.705 11.077
259 1HD PRO 31 2HD PRO 31 8.897 7.253 9.301
260 2HD PRO 31 1HD PRO 31 9.030 6.000 10.551
261 H MET 32 H MET 32 7.020 3.534 6.210
262 HA MET 32 HA MET 32 6.208 5.768 4.612
263 1HB MET 32 2HB MET 32 7.160 3.083 4.168
264 2HB MET 32 1HB MET 32 5.750 3.394 3.166
265 1HG MET 32 2HG MET 32 6.892 5.500 2.406
266 2HG MET 32 1HG MET 32 8.338 4.913 3.225
267 1HE MET 32 1HE MET 32 6.468 4.417 -0.501
268 2HE MET 32 2HE MET 32 8.167 4.800 -0.780
269 3HE MET 32 3HE MET 32 7.226 5.751 0.369
270 H THR 33 H THR 33 4.221 6.570 4.840
271 HA THR 33 HA THR 33 1.987 5.012 5.676
272 HB THR 33 HB THR 33 0.698 7.035 5.422
273 HG1 THR 33 1HG THR 33 1.468 8.795 4.321
274 1HG2 THR 33 1HG2 THR 33 3.458 7.797 6.341
275 2HG2 THR 33 2HG2 THR 33 2.221 7.023 7.333
276 3HG2 THR 33 3HG2 THR 33 1.956 8.650 6.703
277 H PHE 34 H PHE 34 0.637 3.833 4.500
278 HA PHE 34 HA PHE 34 0.624 4.218 1.579
279 1HB PHE 34 2HB PHE 34 1.510 2.005 2.654
280 2HB PHE 34 1HB PHE 34 -0.197 1.643 2.883
281 HD1 PHE 34 1HD PHE 34 -1.649 1.237 0.989
282 HD2 PHE 34 2HD PHE 34 2.490 2.061 0.453
283 HE1 PHE 34 1HE PHE 34 -1.791 0.418 -1.328
284 HE2 PHE 34 2HE PHE 34 2.356 1.245 -1.865
285 HZ PHE 34 HZ PHE 34 0.214 0.423 -2.757
286 H ARG 35 H ARG 35 -1.101 5.589 1.381
287 HA ARG 35 HA ARG 35 -3.274 6.235 1.214
288 1HB ARG 35 2HB ARG 35 -3.771 3.288 1.677
289 2HB ARG 35 1HB ARG 35 -5.010 4.443 1.200
290 1HG ARG 35 2HG ARG 35 -3.590 4.941 -0.827
291 2HG ARG 35 1HG ARG 35 -2.621 3.535 -0.377
292 1HD ARG 35 2HD ARG 35 -4.538 2.092 -0.567
293 2HD ARG 35 1HD ARG 35 -5.598 3.473 -0.850
294 HE ARG 35 HE ARG 35 -3.896 2.168 -2.764
295 1HH1 ARG 35 1HH1 ARG 35 -5.547 5.135 -1.959
296 2HH1 ARG 35 2HH1 ARG 35 -5.617 5.687 -3.598
297 1HH2 ARG 35 1HH2 ARG 35 -3.987 2.892 -4.920
298 2HH2 ARG 35 2HH2 ARG 35 -4.732 4.415 -5.281
299 H LEU 36 H LEU 36 -3.241 7.535 3.051
300 HA LEU 36 HA LEU 36 -3.728 6.501 5.670
301 1HB LEU 36 2HB LEU 36 -4.069 9.352 4.758
302 2HB LEU 36 1HB LEU 36 -3.768 8.782 6.387
303 HG LEU 36 HG LEU 36 -1.667 7.963 4.549
304 1HD1 LEU 36 1HD1 LEU 36 -2.441 10.148 3.528
305 2HD1 LEU 36 2HD1 LEU 36 -0.744 10.058 4.000
306 3HD1 LEU 36 3HD1 LEU 36 -1.898 10.922 5.015
307 1HD2 LEU 36 1HD2 LEU 36 -0.272 8.552 6.310
308 2HD2 LEU 36 2HD2 LEU 36 -1.760 8.067 7.125
309 3HD2 LEU 36 3HD2 LEU 36 -1.388 9.777 6.913
310 H LEU 37 H LEU 37 -5.580 7.523 6.994
311 HA LEU 37 HA LEU 37 -8.046 6.720 5.731
312 1HB LEU 37 2HB LEU 37 -7.487 6.142 8.080
313 2HB LEU 37 1HB LEU 37 -7.580 7.843 8.494
314 HG LEU 37 HG LEU 37 -9.998 7.735 7.627
315 1HD1 LEU 37 1HD1 LEU 37 -10.984 5.759 7.170
316 2HD1 LEU 37 2HD1 LEU 37 -10.010 4.875 8.343
317 3HD1 LEU 37 3HD1 LEU 37 -9.336 5.281 6.764
318 1HD2 LEU 37 1HD2 LEU 37 -9.775 6.030 10.033
319 2HD2 LEU 37 2HD2 LEU 37 -10.695 7.513 9.770
320 3HD2 LEU 37 3HD2 LEU 37 -8.962 7.596 10.087
321 H LEU 38 H LEU 38 -8.850 8.150 4.306
322 HA LEU 38 HA LEU 38 -9.323 10.891 5.271
323 1HB LEU 38 2HB LEU 38 -8.744 10.162 2.406
324 2HB LEU 38 1HB LEU 38 -8.907 11.773 3.080
325 HG LEU 38 HG LEU 38 -6.779 10.155 4.306
326 1HD1 LEU 38 1HD1 LEU 38 -6.888 9.673 1.715
327 2HD1 LEU 38 2HD1 LEU 38 -5.352 9.944 2.541
328 3HD1 LEU 38 3HD1 LEU 38 -6.108 11.253 1.629
329 1HD2 LEU 38 1HD2 LEU 38 -6.889 12.404 4.949
330 2HD2 LEU 38 2HD2 LEU 38 -7.122 12.959 3.292
331 3HD2 LEU 38 3HD2 LEU 38 -5.552 12.338 3.803
332 H VAL 39 H VAL 39 -11.167 11.969 4.275
333 HA VAL 39 HA VAL 39 -13.194 10.082 3.266
334 HB VAL 39 HB VAL 39 -14.857 11.682 4.463
335 1HG1 VAL 39 1HG1 VAL 39 -14.303 10.334 6.679
336 2HG1 VAL 39 2HG1 VAL 39 -13.251 9.450 5.574
337 3HG1 VAL 39 3HG1 VAL 39 -14.982 9.551 5.252
338 1HG2 VAL 39 1HG2 VAL 39 -12.349 12.161 6.071
339 2HG2 VAL 39 2HG2 VAL 39 -13.981 12.615 6.565
340 3HG2 VAL 39 3HG2 VAL 39 -13.248 13.365 5.147
341 H ASP 40 H ASP 40 -13.624 10.619 1.233
342 HA ASP 40 HA ASP 40 -14.438 13.319 0.601
343 1HB ASP 40 2HB ASP 40 -11.968 13.360 0.277
344 2HB ASP 40 1HB ASP 40 -12.134 12.069 -0.911
345 H THR 41 H THR 41 -16.439 12.326 0.201
346 HA THR 41 HA THR 41 -16.633 11.138 -2.448
347 HB THR 41 HB THR 41 -18.419 9.551 -1.111
348 HG1 THR 41 1HG THR 41 -16.087 9.652 0.490
349 1HG2 THR 41 1HG2 THR 41 -17.244 7.848 -1.942
350 2HG2 THR 41 2HG2 THR 41 -15.741 8.385 -1.190
351 3HG2 THR 41 3HG2 THR 41 -16.274 9.109 -2.707
352 HA PRO 42 HA PRO 42 -20.069 14.069 -1.479
353 1HB PRO 42 2HB PRO 42 -19.620 15.866 -3.405
354 2HB PRO 42 1HB PRO 42 -18.668 15.868 -1.915
355 1HG PRO 42 2HG PRO 42 -17.950 14.822 -4.621
356 2HG PRO 42 1HG PRO 42 -16.948 15.714 -3.461
357 1HD PRO 42 2HD PRO 42 -16.908 12.966 -3.800
358 2HD PRO 42 1HD PRO 42 -16.364 13.815 -2.341
359 H GLU 43 H GLU 43 -21.312 12.173 -2.227
360 HA GLU 43 HA GLU 43 -22.917 12.770 -4.441
361 1HB GLU 43 2HB GLU 43 -20.631 11.872 -5.438
362 2HB GLU 43 1HB GLU 43 -21.350 10.310 -5.071
363 1HG GLU 43 2HG GLU 43 -22.313 10.443 -7.065
364 2HG GLU 43 1HG GLU 43 -23.385 11.646 -6.348
365 H THR 44 H THR 44 -21.592 9.713 -3.162
366 HA THR 44 HA THR 44 -24.334 8.987 -2.357
367 HB THR 44 HB THR 44 -22.322 6.843 -2.725
368 HG1 THR 44 1HG THR 44 -22.694 6.870 -4.994
369 1HG2 THR 44 1HG2 THR 44 -25.233 7.179 -3.344
370 2HG2 THR 44 2HG2 THR 44 -24.466 6.067 -2.210
371 3HG2 THR 44 3HG2 THR 44 -24.290 5.818 -3.947
372 H LYS 45 H LYS 45 -20.997 9.207 -1.394
373 HA LYS 45 HA LYS 45 -19.894 8.746 0.551
374 1HB LYS 45 2HB LYS 45 -21.109 9.619 2.590
375 2HB LYS 45 1HB LYS 45 -20.917 10.755 1.264
376 1HG LYS 45 2HG LYS 45 -23.209 10.435 0.595
377 2HG LYS 45 1HG LYS 45 -23.421 9.175 1.812
378 1HD LYS 45 2HD LYS 45 -22.529 11.214 3.351
379 2HD LYS 45 1HD LYS 45 -23.399 12.105 2.099
380 1HE LYS 45 2HE LYS 45 -24.674 9.741 3.409
381 2HE LYS 45 1HE LYS 45 -24.653 11.298 4.237
382 1HZ LYS 45 1HZ LYS 45 -26.668 10.871 2.867
383 2HZ LYS 45 2HZ LYS 45 -25.694 10.925 1.485
384 3HZ LYS 45 3HZ LYS 45 -25.848 12.295 2.465
385 H HIS 46 H HIS 46 -19.590 6.572 0.695
386 HA HIS 46 HA HIS 46 -21.603 5.075 2.244
387 1HB HIS 46 2HB HIS 46 -21.519 4.309 -0.090
388 2HB HIS 46 1HB HIS 46 -19.792 4.007 0.069
389 HD1 HIS 46 1HD HIS 46 -23.016 2.844 1.727
390 HD2 HIS 46 2HD HIS 46 -19.224 1.453 0.751
391 HE1 HIS 46 1HE HIS 46 -23.002 0.416 2.379
392 HE2 HIS 46 2HE HIS 46 -20.667 -0.381 1.866
393 HA PRO 47 HA PRO 47 -17.323 4.901 4.251
394 1HB PRO 47 2HB PRO 47 -17.668 6.565 6.325
395 2HB PRO 47 1HB PRO 47 -17.196 7.162 4.729
396 1HG PRO 47 2HG PRO 47 -19.904 7.133 6.013
397 2HG PRO 47 1HG PRO 47 -19.113 8.434 5.104
398 1HD PRO 47 2HD PRO 47 -20.971 6.753 4.016
399 2HD PRO 47 1HD PRO 47 -19.680 7.528 3.075
400 H LYS 48 H LYS 48 -20.523 4.204 4.953
401 HA LYS 48 HA LYS 48 -20.517 3.467 7.635
402 1HB LYS 48 2HB LYS 48 -22.278 3.259 5.466
403 2HB LYS 48 1HB LYS 48 -22.055 1.609 6.033
404 1HG LYS 48 2HG LYS 48 -22.442 3.368 8.266
405 2HG LYS 48 1HG LYS 48 -23.742 3.578 7.090
406 1HD LYS 48 2HD LYS 48 -24.383 1.864 8.648
407 2HD LYS 48 1HD LYS 48 -24.058 1.111 7.085
408 1HE LYS 48 2HE LYS 48 -22.053 0.180 7.812
409 2HE LYS 48 1HE LYS 48 -21.915 1.300 9.168
410 1HZ LYS 48 1HZ LYS 48 -23.515 0.147 10.378
411 2HZ LYS 48 2HZ LYS 48 -22.594 -1.083 9.670
412 3HZ LYS 48 3HZ LYS 48 -24.103 -0.679 9.023
413 H LYS 49 H LYS 49 -20.429 1.072 5.000
414 HA LYS 49 HA LYS 49 -18.953 -0.736 6.741
415 1HB LYS 49 2HB LYS 49 -20.033 -1.226 3.961
416 2HB LYS 49 1HB LYS 49 -19.437 -2.442 5.083
417 1HG LYS 49 2HG LYS 49 -21.323 -2.394 6.359
418 2HG LYS 49 1HG LYS 49 -21.674 -0.708 5.974
419 1HD LYS 49 2HD LYS 49 -21.880 -1.981 3.532
420 2HD LYS 49 1HD LYS 49 -22.568 -3.149 4.663
421 1HE LYS 49 2HE LYS 49 -23.961 -1.253 5.579
422 2HE LYS 49 1HE LYS 49 -23.414 -0.297 4.202
423 1HZ LYS 49 1HZ LYS 49 -24.630 -1.532 2.743
424 2HZ LYS 49 2HZ LYS 49 -25.625 -1.668 4.104
425 3HZ LYS 49 3HZ LYS 49 -24.584 -2.934 3.688
426 H GLY 50 H GLY 50 -18.548 0.987 3.687
427 1HA GLY 50 2HA GLY 50 -16.646 1.517 2.510
428 2HA GLY 50 1HA GLY 50 -15.730 1.072 3.942
429 H VAL 51 H VAL 51 -17.869 -0.940 1.963
430 HA VAL 51 HA VAL 51 -15.675 -2.845 1.634
431 HB VAL 51 HB VAL 51 -18.561 -3.258 0.863
432 1HG1 VAL 51 1HG1 VAL 51 -17.609 -5.681 1.531
433 2HG1 VAL 51 2HG1 VAL 51 -16.128 -4.926 0.940
434 3HG1 VAL 51 3HG1 VAL 51 -17.545 -5.028 -0.105
435 1HG2 VAL 51 1HG2 VAL 51 -17.262 -3.306 3.512
436 2HG2 VAL 51 2HG2 VAL 51 -18.319 -4.667 3.139
437 3HG2 VAL 51 3HG2 VAL 51 -18.947 -3.020 3.078
438 H GLU 52 H GLU 52 -15.994 -0.296 0.077
439 HA GLU 52 HA GLU 52 -16.186 -1.443 -2.625
440 1HB GLU 52 2HB GLU 52 -16.579 1.391 -1.665
441 2HB GLU 52 1HB GLU 52 -16.493 0.943 -3.363
442 1HG GLU 52 2HG GLU 52 -18.400 -0.738 -2.098
443 2HG GLU 52 1HG GLU 52 -18.736 0.930 -1.636
444 H LYS 53 H LYS 53 -13.908 -1.095 -0.534
445 HA LYS 53 HA LYS 53 -11.715 -1.183 -2.076
446 1HB LYS 53 2HB LYS 53 -10.806 1.215 -1.853
447 2HB LYS 53 1HB LYS 53 -11.961 0.878 -3.136
448 1HG LYS 53 2HG LYS 53 -13.620 2.109 -2.159
449 2HG LYS 53 1HG LYS 53 -12.999 1.851 -0.527
450 1HD LYS 53 2HD LYS 53 -11.300 3.464 -0.813
451 2HD LYS 53 1HD LYS 53 -11.535 3.514 -2.560
452 1HE LYS 53 2HE LYS 53 -14.009 4.198 -1.660
453 2HE LYS 53 1HE LYS 53 -12.978 4.904 -0.417
454 1HZ LYS 53 1HZ LYS 53 -12.976 6.597 -1.899
455 2HZ LYS 53 2HZ LYS 53 -13.222 5.597 -3.241
456 3HZ LYS 53 3HZ LYS 53 -11.684 5.723 -2.551
457 H TYR 54 H TYR 54 -13.179 -0.806 0.864
458 HA TYR 54 HA TYR 54 -10.593 -0.866 2.253
459 1HB TYR 54 2HB TYR 54 -12.960 0.845 2.783
460 2HB TYR 54 1HB TYR 54 -12.111 0.186 4.177
461 HD1 TYR 54 1HD TYR 54 -11.409 1.986 0.979
462 HD2 TYR 54 2HD TYR 54 -10.328 1.378 5.049
463 HE1 TYR 54 1HE TYR 54 -9.736 3.778 0.795
464 HE2 TYR 54 2HE TYR 54 -8.652 3.170 4.877
465 HH TYR 54 HH TYR 54 -8.596 5.415 2.525
466 H GLY 55 H GLY 55 -13.326 -2.558 1.512
467 1HA GLY 55 2HA GLY 55 -14.091 -3.704 3.963
468 2HA GLY 55 1HA GLY 55 -14.331 -4.424 2.379
469 HA PRO 56 HA PRO 56 -11.410 -7.284 4.376
470 1HB PRO 56 2HB PRO 56 -12.187 -9.491 3.053
471 2HB PRO 56 1HB PRO 56 -13.118 -8.835 4.406
472 1HG PRO 56 2HG PRO 56 -13.588 -8.541 1.464
473 2HG PRO 56 1HG PRO 56 -14.758 -8.863 2.757
474 1HD PRO 56 2HD PRO 56 -14.354 -6.389 1.675
475 2HD PRO 56 1HD PRO 56 -14.910 -6.650 3.339
476 H GLU 57 H GLU 57 -11.517 -5.916 1.355
477 HA GLU 57 HA GLU 57 -9.440 -7.630 0.215
478 1HB GLU 57 2HB GLU 57 -11.291 -5.570 -0.858
479 2HB GLU 57 1HB GLU 57 -9.762 -5.806 -1.690
480 1HG GLU 57 2HG GLU 57 -10.465 -8.334 -1.574
481 2HG GLU 57 1HG GLU 57 -12.080 -7.646 -1.411
482 H ALA 58 H ALA 58 -9.927 -4.079 0.497
483 HA ALA 58 HA ALA 58 -7.426 -3.175 -0.005
484 1HB ALA 58 1HB ALA 58 -9.688 -2.128 1.186
485 2HB ALA 58 2HB ALA 58 -8.226 -1.242 0.751
486 3HB ALA 58 3HB ALA 58 -8.422 -1.877 2.385
487 H SER 59 H SER 59 -8.430 -4.852 2.906
488 HA SER 59 HA SER 59 -5.925 -4.380 4.266
489 1HB SER 59 2HB SER 59 -8.056 -6.388 5.014
490 2HB SER 59 1HB SER 59 -6.840 -5.663 6.066
491 HG SER 59 HG SER 59 -7.923 -3.764 6.027
492 H ALA 60 H ALA 60 -7.597 -7.291 3.072
493 HA ALA 60 HA ALA 60 -5.605 -9.148 3.421
494 1HB ALA 60 1HB ALA 60 -6.653 -10.244 1.321
495 2HB ALA 60 2HB ALA 60 -7.804 -8.912 1.412
496 3HB ALA 60 3HB ALA 60 -7.640 -10.028 2.767
497 H PHE 61 H PHE 61 -5.820 -6.651 1.004
498 HA PHE 61 HA PHE 61 -4.064 -7.635 -0.925
499 1HB PHE 61 2HB PHE 61 -5.345 -5.682 -1.425
500 2HB PHE 61 1HB PHE 61 -4.693 -4.817 -0.039
501 HD1 PHE 61 1HD PHE 61 -3.645 -6.373 -3.254
502 HD2 PHE 61 2HD PHE 61 -2.912 -3.375 -0.325
503 HE1 PHE 61 1HE PHE 61 -1.899 -5.401 -4.689
504 HE2 PHE 61 2HE PHE 61 -1.163 -2.400 -1.753
505 HZ PHE 61 HZ PHE 61 -0.654 -3.414 -3.939
506 H THR 62 H THR 62 -3.268 -5.218 1.571
507 HA THR 62 HA THR 62 -0.454 -5.752 1.291
508 HB THR 62 HB THR 62 -0.199 -4.055 3.074
509 HG1 THR 62 1HG THR 62 -3.024 -3.871 3.014
510 1HG2 THR 62 1HG2 THR 62 -0.500 -2.336 1.691
511 2HG2 THR 62 2HG2 THR 62 -2.209 -2.698 1.452
512 3HG2 THR 62 3HG2 THR 62 -0.985 -3.565 0.523
513 H LYS 63 H LYS 63 -3.036 -6.773 3.370
514 HA LYS 63 HA LYS 63 -1.587 -7.612 5.610
515 1HB LYS 63 2HB LYS 63 -4.092 -7.460 5.412
516 2HB LYS 63 1HB LYS 63 -4.045 -8.963 4.501
517 1HG LYS 63 2HG LYS 63 -2.952 -10.036 6.465
518 2HG LYS 63 1HG LYS 63 -3.226 -8.543 7.364
519 1HD LYS 63 2HD LYS 63 -5.488 -9.943 5.984
520 2HD LYS 63 1HD LYS 63 -4.942 -10.466 7.578
521 1HE LYS 63 2HE LYS 63 -5.595 -8.496 8.592
522 2HE LYS 63 1HE LYS 63 -5.526 -7.578 7.088
523 1HZ LYS 63 1HZ LYS 63 -7.803 -8.244 8.103
524 2HZ LYS 63 2HZ LYS 63 -7.501 -9.736 7.369
525 3HZ LYS 63 3HZ LYS 63 -7.574 -8.332 6.429
526 H LYS 64 H LYS 64 -1.861 -8.964 2.438
527 HA LYS 64 HA LYS 64 -0.756 -11.527 3.267
528 1HB LYS 64 2HB LYS 64 -2.499 -10.795 1.244
529 2HB LYS 64 1HB LYS 64 -0.983 -11.042 0.389
530 1HG LYS 64 2HG LYS 64 -0.965 -13.273 0.774
531 2HG LYS 64 1HG LYS 64 -1.777 -13.123 2.334
532 1HD LYS 64 2HD LYS 64 -3.662 -13.770 1.340
533 2HD LYS 64 1HD LYS 64 -3.641 -12.257 0.433
534 1HE LYS 64 2HE LYS 64 -1.862 -14.294 -0.668
535 2HE LYS 64 1HE LYS 64 -3.557 -14.782 -0.646
536 1HZ LYS 64 1HZ LYS 64 -2.483 -12.293 -1.858
537 2HZ LYS 64 2HZ LYS 64 -4.114 -12.738 -1.822
538 3HZ LYS 64 3HZ LYS 64 -3.004 -13.663 -2.703
539 H MET 65 H MET 65 0.161 -8.502 1.888
540 HA MET 65 HA MET 65 2.548 -9.236 0.599
541 1HB MET 65 2HB MET 65 1.533 -6.670 1.779
542 2HB MET 65 1HB MET 65 3.150 -6.773 1.098
543 1HG MET 65 2HG MET 65 1.514 -7.903 -0.836
544 2HG MET 65 1HG MET 65 0.596 -6.528 -0.224
545 1HE MET 65 1HE MET 65 1.982 -3.636 -1.976
546 2HE MET 65 2HE MET 65 1.708 -3.903 -0.254
547 3HE MET 65 3HE MET 65 0.586 -4.570 -1.439
548 H VAL 66 H VAL 66 1.792 -9.358 3.885
549 HA VAL 66 HA VAL 66 4.628 -9.105 4.639
550 HB VAL 66 HB VAL 66 3.826 -8.750 6.948
551 1HG1 VAL 66 1HG1 VAL 66 2.365 -6.678 5.433
552 2HG1 VAL 66 2HG1 VAL 66 4.049 -6.938 4.980
553 3HG1 VAL 66 3HG1 VAL 66 3.639 -6.515 6.642
554 1HG2 VAL 66 1HG2 VAL 66 1.106 -8.759 5.647
555 2HG2 VAL 66 2HG2 VAL 66 1.431 -8.191 7.285
556 3HG2 VAL 66 3HG2 VAL 66 1.706 -9.882 6.867
557 H GLU 67 H GLU 67 1.703 -11.054 5.133
558 HA GLU 67 HA GLU 67 3.197 -13.045 6.622
559 1HB GLU 67 2HB GLU 67 0.345 -12.498 6.055
560 2HB GLU 67 1HB GLU 67 0.778 -14.186 6.288
561 1HG GLU 67 2HG GLU 67 2.056 -12.927 8.370
562 2HG GLU 67 1HG GLU 67 0.546 -12.029 8.223
563 H ASN 68 H ASN 68 0.955 -13.369 3.880
564 HA ASN 68 HA ASN 68 2.065 -15.846 3.059
565 1HB ASN 68 2HB ASN 68 -0.226 -14.364 2.459
566 2HB ASN 68 1HB ASN 68 0.648 -14.471 0.934
567 1HD2 ASN 68 1HD2 ASN 68 0.340 -16.224 -0.234
568 2HD2 ASN 68 2HD2 ASN 68 -0.301 -17.724 0.336
569 H ALA 69 H ALA 69 2.722 -12.532 2.210
570 HA ALA 69 HA ALA 69 4.175 -13.090 -0.177
571 1HB ALA 69 1HB ALA 69 3.094 -10.869 0.722
572 2HB ALA 69 2HB ALA 69 4.509 -10.833 -0.333
573 3HB ALA 69 3HB ALA 69 4.702 -10.630 1.409
574 H LYS 70 H LYS 70 6.531 -12.344 -0.354
575 HA LYS 70 HA LYS 70 8.039 -13.602 1.837
576 1HB LYS 70 2HB LYS 70 8.087 -14.007 -0.968
577 2HB LYS 70 1HB LYS 70 9.620 -13.267 -0.532
578 1HG LYS 70 2HG LYS 70 9.729 -15.056 1.306
579 2HG LYS 70 1HG LYS 70 8.462 -15.870 0.385
580 1HD LYS 70 2HD LYS 70 10.273 -15.242 -1.564
581 2HD LYS 70 1HD LYS 70 11.321 -15.583 -0.185
582 1HE LYS 70 2HE LYS 70 9.950 -17.709 0.119
583 2HE LYS 70 1HE LYS 70 9.299 -17.385 -1.488
584 1HZ LYS 70 1HZ LYS 70 11.229 -17.935 -2.479
585 2HZ LYS 70 2HZ LYS 70 11.478 -18.831 -1.065
586 3HZ LYS 70 3HZ LYS 70 12.194 -17.308 -1.238
587 H LYS 71 H LYS 71 8.428 -11.047 -0.627
588 HA LYS 71 HA LYS 71 9.318 -9.141 1.297
589 1HB LYS 71 2HB LYS 71 11.292 -10.885 0.405
590 2HB LYS 71 1HB LYS 71 11.521 -9.449 -0.584
591 1HG LYS 71 2HG LYS 71 11.116 -8.730 2.174
592 2HG LYS 71 1HG LYS 71 12.436 -9.888 2.011
593 1HD LYS 71 2HD LYS 71 12.314 -7.581 0.129
594 2HD LYS 71 1HD LYS 71 12.857 -7.297 1.784
595 1HE LYS 71 2HE LYS 71 14.770 -8.506 1.512
596 2HE LYS 71 1HE LYS 71 14.040 -9.598 0.335
597 1HZ LYS 71 1HZ LYS 71 15.449 -8.376 -0.972
598 2HZ LYS 71 2HZ LYS 71 15.240 -6.950 -0.085
599 3HZ LYS 71 3HZ LYS 71 14.025 -7.476 -1.138
600 H ILE 72 H ILE 72 9.977 -7.072 0.250
601 HA ILE 72 HA ILE 72 9.133 -6.813 -2.535
602 HB ILE 72 HB ILE 72 8.068 -4.854 -0.528
603 1HG1 ILE 72 2HG1 ILE 72 5.859 -6.241 -1.008
604 2HG1 ILE 72 1HG1 ILE 72 7.009 -7.558 -1.215
605 1HG2 ILE 72 1HG2 ILE 72 6.304 -5.037 -2.601
606 2HG2 ILE 72 2HG2 ILE 72 7.850 -5.316 -3.397
607 3HG2 ILE 72 3HG2 ILE 72 7.595 -3.844 -2.462
608 1HD1 ILE 72 1HD1 ILE 72 7.475 -7.670 0.979
609 2HD1 ILE 72 2HD1 ILE 72 5.898 -6.894 1.133
610 3HD1 ILE 72 3HD1 ILE 72 7.370 -5.924 1.200
611 H GLU 73 H GLU 73 9.644 -4.666 -3.433
612 HA GLU 73 HA GLU 73 11.820 -3.287 -2.031
613 1HB GLU 73 2HB GLU 73 12.931 -4.792 -3.546
614 2HB GLU 73 1HB GLU 73 11.867 -4.332 -4.866
615 1HG GLU 73 2HG GLU 73 13.280 -2.751 -5.474
616 2HG GLU 73 1HG GLU 73 13.130 -1.985 -3.894
617 H VAL 74 H VAL 74 11.820 -1.099 -2.267
618 HA VAL 74 HA VAL 74 9.565 0.038 -3.740
619 HB VAL 74 HB VAL 74 9.835 0.683 -1.375
620 1HG1 VAL 74 1HG1 VAL 74 12.270 2.254 -2.150
621 2HG1 VAL 74 2HG1 VAL 74 12.396 0.607 -1.533
622 3HG1 VAL 74 3HG1 VAL 74 11.664 1.868 -0.539
623 1HG2 VAL 74 1HG2 VAL 74 9.785 3.182 -1.762
624 2HG2 VAL 74 2HG2 VAL 74 8.652 2.227 -2.718
625 3HG2 VAL 74 3HG2 VAL 74 10.135 2.835 -3.454
626 H GLU 75 H GLU 75 9.973 0.558 -5.777
627 HA GLU 75 HA GLU 75 12.446 2.047 -6.360
628 1HB GLU 75 2HB GLU 75 12.308 0.928 -8.672
629 2HB GLU 75 1HB GLU 75 12.916 -0.031 -7.329
630 1HG GLU 75 2HG GLU 75 10.507 -0.867 -7.090
631 2HG GLU 75 1HG GLU 75 10.263 -0.195 -8.702
632 H PHE 76 H PHE 76 12.255 3.789 -7.692
633 HA PHE 76 HA PHE 76 9.998 4.261 -9.362
634 1HB PHE 76 2HB PHE 76 9.613 4.915 -6.668
635 2HB PHE 76 1HB PHE 76 9.959 6.448 -7.459
636 HD1 PHE 76 1HD PHE 76 7.341 5.251 -6.167
637 HD2 PHE 76 2HD PHE 76 8.736 5.761 -10.155
638 HE1 PHE 76 1HE PHE 76 5.015 5.355 -6.963
639 HE2 PHE 76 2HE PHE 76 6.412 5.866 -10.959
640 HZ PHE 76 HZ PHE 76 4.548 5.663 -9.360
641 H ASP 77 H ASP 77 10.564 5.643 -10.935
642 HA ASP 77 HA ASP 77 13.185 6.658 -11.089
643 1HB ASP 77 2HB ASP 77 12.324 7.872 -13.119
644 2HB ASP 77 1HB ASP 77 12.025 6.136 -13.118
645 H LYS 78 H LYS 78 10.184 8.044 -9.974
646 HA LYS 78 HA LYS 78 11.520 10.637 -9.594
647 1HB LYS 78 2HB LYS 78 8.797 9.861 -10.312
648 2HB LYS 78 1HB LYS 78 8.845 11.025 -8.994
649 1HG LYS 78 2HG LYS 78 10.326 12.449 -10.429
650 2HG LYS 78 1HG LYS 78 10.002 11.328 -11.753
651 1HD LYS 78 2HD LYS 78 8.316 12.771 -12.184
652 2HD LYS 78 1HD LYS 78 7.485 11.826 -10.946
653 1HE LYS 78 2HE LYS 78 8.500 13.509 -9.283
654 2HE LYS 78 1HE LYS 78 8.795 14.513 -10.703
655 1HZ LYS 78 1HZ LYS 78 6.738 15.228 -10.009
656 2HZ LYS 78 2HZ LYS 78 6.233 13.692 -9.513
657 3HZ LYS 78 3HZ LYS 78 6.304 14.066 -11.162
658 H GLY 79 H GLY 79 9.394 8.300 -7.958
659 1HA GLY 79 2HA GLY 79 9.975 7.608 -5.700
660 2HA GLY 79 1HA GLY 79 10.508 9.255 -5.398
661 H GLN 80 H GLN 80 8.317 10.626 -6.522
662 HA GLN 80 HA GLN 80 6.265 9.988 -4.520
663 1HB GLN 80 2HB GLN 80 7.552 12.389 -5.158
664 2HB GLN 80 1HB GLN 80 5.933 12.556 -5.821
665 1HG GLN 80 2HG GLN 80 5.183 13.061 -3.808
666 2HG GLN 80 1HG GLN 80 5.641 11.453 -3.249
667 1HE2 GLN 80 1HE2 GLN 80 6.387 14.801 -3.231
668 2HE2 GLN 80 2HE2 GLN 80 7.727 14.726 -2.143
669 H ARG 81 H ARG 81 4.521 8.982 -5.248
670 HA ARG 81 HA ARG 81 3.869 8.987 -8.063
671 1HB ARG 81 2HB ARG 81 3.683 6.911 -6.797
672 2HB ARG 81 1HB ARG 81 2.521 7.656 -5.708
673 1HG ARG 81 2HG ARG 81 1.217 6.385 -7.152
674 2HG ARG 81 1HG ARG 81 1.081 8.025 -7.787
675 1HD ARG 81 2HD ARG 81 3.234 7.157 -9.155
676 2HD ARG 81 1HD ARG 81 2.366 5.636 -8.945
677 HE ARG 81 HE ARG 81 0.751 7.821 -9.916
678 1HH1 ARG 81 1HH1 ARG 81 2.807 5.139 -10.790
679 2HH1 ARG 81 2HH1 ARG 81 2.131 4.977 -12.375
680 1HH2 ARG 81 1HH2 ARG 81 -0.138 7.609 -12.000
681 2HH2 ARG 81 2HH2 ARG 81 0.460 6.377 -13.063
682 H THR 82 H THR 82 2.123 9.840 -5.067
683 HA THR 82 HA THR 82 0.531 11.723 -6.668
684 HB THR 82 HB THR 82 -0.372 10.079 -4.308
685 HG1 THR 82 1HG THR 82 -1.308 8.837 -5.730
686 1HG2 THR 82 1HG2 THR 82 -1.983 12.004 -5.966
687 2HG2 THR 82 2HG2 THR 82 -1.457 12.280 -4.306
688 3HG2 THR 82 3HG2 THR 82 -2.584 10.974 -4.666
689 H ASP 83 H ASP 83 -0.263 13.614 -5.523
690 HA ASP 83 HA ASP 83 1.694 14.547 -3.554
691 1HB ASP 83 2HB ASP 83 0.809 16.812 -4.110
692 2HB ASP 83 1HB ASP 83 1.478 15.965 -5.501
693 H LYS 84 H LYS 84 -0.056 12.805 -2.481
694 HA LYS 84 HA LYS 84 -2.210 14.298 -1.211
695 1HB LYS 84 2HB LYS 84 -2.970 12.170 -0.349
696 2HB LYS 84 1HB LYS 84 -2.632 12.001 -2.064
697 1HG LYS 84 2HG LYS 84 -0.597 11.244 -0.001
698 2HG LYS 84 1HG LYS 84 -1.888 10.141 -0.467
699 1HD LYS 84 2HD LYS 84 -0.753 9.543 -2.273
700 2HD LYS 84 1HD LYS 84 -0.726 11.211 -2.829
701 1HE LYS 84 2HE LYS 84 1.352 11.631 -1.897
702 2HE LYS 84 1HE LYS 84 1.203 10.321 -0.733
703 1HZ LYS 84 1HZ LYS 84 1.144 9.269 -3.347
704 2HZ LYS 84 2HZ LYS 84 2.269 8.985 -2.117
705 3HZ LYS 84 3HZ LYS 84 2.497 10.273 -3.186
706 H TYR 85 H TYR 85 0.805 12.683 -0.415
707 HA TYR 85 HA TYR 85 1.105 14.292 1.953
708 1HB TYR 85 2HB TYR 85 -0.316 12.205 2.539
709 2HB TYR 85 1HB TYR 85 1.195 11.317 2.374
710 HD1 TYR 85 1HD TYR 85 1.961 10.730 4.467
711 HD2 TYR 85 2HD TYR 85 0.367 14.632 3.893
712 HE1 TYR 85 1HE TYR 85 2.554 11.308 6.784
713 HE2 TYR 85 2HE TYR 85 0.955 15.221 6.207
714 HH TYR 85 HH TYR 85 1.352 13.989 8.376
715 H GLY 86 H GLY 86 2.432 13.178 -0.713
716 1HA GLY 86 2HA GLY 86 4.591 12.895 -1.439
717 2HA GLY 86 1HA GLY 86 5.089 13.641 0.073
718 H ARG 87 H ARG 87 3.224 10.684 -0.111
719 HA ARG 87 HA ARG 87 5.249 8.789 -0.091
720 1HB ARG 87 2HB ARG 87 5.110 8.258 2.454
721 2HB ARG 87 1HB ARG 87 6.212 9.506 1.889
722 1HG ARG 87 2HG ARG 87 3.659 10.671 2.446
723 2HG ARG 87 1HG ARG 87 4.195 9.722 3.833
724 1HD ARG 87 2HD ARG 87 6.435 10.915 3.565
725 2HD ARG 87 1HD ARG 87 5.584 12.023 2.490
726 HE ARG 87 HE ARG 87 4.291 11.707 5.028
727 1HH1 ARG 87 1HH1 ARG 87 6.812 13.408 3.316
728 2HH1 ARG 87 2HH1 ARG 87 6.797 14.767 4.389
729 1HH2 ARG 87 1HH2 ARG 87 4.268 13.495 6.442
730 2HH2 ARG 87 2HH2 ARG 87 5.354 14.817 6.164
731 H GLY 88 H GLY 88 2.064 9.786 0.855
732 1HA GLY 88 2HA GLY 88 0.840 7.535 1.781
733 2HA GLY 88 1HA GLY 88 0.060 8.666 0.687
734 H LEU 89 H LEU 89 0.322 8.290 -1.641
735 HA LEU 89 HA LEU 89 0.067 5.478 -2.228
736 1HB LEU 89 2HB LEU 89 -0.980 7.807 -3.301
737 2HB LEU 89 1HB LEU 89 0.149 7.266 -4.528
738 HG LEU 89 HG LEU 89 -1.863 5.362 -3.382
739 1HD1 LEU 89 1HD1 LEU 89 -2.544 6.722 -5.904
740 2HD1 LEU 89 2HD1 LEU 89 -2.731 7.678 -4.435
741 3HD1 LEU 89 3HD1 LEU 89 -3.586 6.145 -4.605
742 1HD2 LEU 89 1HD2 LEU 89 -0.136 4.373 -4.716
743 2HD2 LEU 89 2HD2 LEU 89 -0.369 5.567 -5.991
744 3HD2 LEU 89 3HD2 LEU 89 -1.628 4.377 -5.657
745 H ALA 90 H ALA 90 1.670 4.189 -2.827
746 HA ALA 90 HA ALA 90 3.882 5.259 -4.404
747 1HB ALA 90 1HB ALA 90 5.590 4.518 -2.988
748 2HB ALA 90 2HB ALA 90 4.486 3.542 -2.018
749 3HB ALA 90 3HB ALA 90 4.436 5.302 -1.908
750 H TYR 91 H TYR 91 4.959 3.721 -5.668
751 HA TYR 91 HA TYR 91 3.378 1.468 -6.416
752 1HB TYR 91 2HB TYR 91 5.396 2.997 -7.606
753 2HB TYR 91 1HB TYR 91 6.088 1.387 -7.446
754 HD1 TYR 91 1HD TYR 91 5.129 -0.505 -8.651
755 HD2 TYR 91 2HD TYR 91 3.510 3.408 -9.066
756 HE1 TYR 91 1HE TYR 91 3.892 -1.235 -10.647
757 HE2 TYR 91 2HE TYR 91 2.269 2.690 -11.064
758 HH TYR 91 HH TYR 91 1.817 -0.521 -11.890
759 H ILE 92 H ILE 92 3.742 -0.700 -6.102
760 HA ILE 92 HA ILE 92 5.939 -1.427 -4.280
761 HB ILE 92 HB ILE 92 3.205 -2.685 -4.156
762 1HG1 ILE 92 2HG1 ILE 92 3.052 -0.283 -3.579
763 2HG1 ILE 92 1HG1 ILE 92 2.752 -1.321 -2.187
764 1HG2 ILE 92 1HG2 ILE 92 5.755 -2.961 -2.671
765 2HG2 ILE 92 2HG2 ILE 92 4.562 -4.182 -3.116
766 3HG2 ILE 92 3HG2 ILE 92 4.255 -3.103 -1.754
767 1HD1 ILE 92 1HD1 ILE 92 5.512 -0.324 -2.637
768 2HD1 ILE 92 2HD1 ILE 92 4.670 -0.687 -1.132
769 3HD1 ILE 92 3HD1 ILE 92 4.295 0.792 -2.018
770 H TYR 93 H TYR 93 7.235 -2.896 -5.156
771 HA TYR 93 HA TYR 93 6.109 -4.757 -7.148
772 1HB TYR 93 2HB TYR 93 9.024 -4.032 -7.030
773 2HB TYR 93 1HB TYR 93 8.106 -4.693 -8.378
774 HD1 TYR 93 1HD TYR 93 8.422 -1.632 -6.277
775 HD2 TYR 93 2HD TYR 93 7.308 -3.270 -10.041
776 HE1 TYR 93 1HE TYR 93 8.118 0.639 -7.169
777 HE2 TYR 93 2HE TYR 93 7.001 -1.003 -10.944
778 HH TYR 93 HH TYR 93 6.591 1.248 -10.170
779 H ALA 94 H ALA 94 5.574 -6.136 -5.310
780 HA ALA 94 HA ALA 94 7.701 -7.254 -3.735
781 1HB ALA 94 1HB ALA 94 5.359 -6.936 -2.914
782 2HB ALA 94 2HB ALA 94 6.017 -8.553 -2.660
783 3HB ALA 94 3HB ALA 94 4.874 -8.261 -3.972
784 H ASP 95 H ASP 95 9.103 -8.616 -4.601
785 HA ASP 95 HA ASP 95 9.971 -10.447 -5.634
786 1HB ASP 95 2HB ASP 95 7.136 -11.394 -6.085
787 2HB ASP 95 1HB ASP 95 8.600 -12.370 -6.028
788 H GLY 96 H GLY 96 9.723 -8.148 -7.086
789 1HA GLY 96 2HA GLY 96 9.767 -7.345 -9.235
790 2HA GLY 96 1HA GLY 96 10.026 -9.014 -9.722
791 H LYS 97 H LYS 97 7.160 -8.164 -7.966
792 HA LYS 97 HA LYS 97 5.603 -8.155 -10.449
793 1HB LYS 97 2HB LYS 97 5.424 -10.059 -8.182
794 2HB LYS 97 1HB LYS 97 3.907 -9.513 -8.883
795 1HG LYS 97 2HG LYS 97 4.188 -10.716 -10.749
796 2HG LYS 97 1HG LYS 97 5.913 -10.355 -10.844
797 1HD LYS 97 2HD LYS 97 6.405 -12.037 -9.190
798 2HD LYS 97 1HD LYS 97 4.685 -12.324 -8.918
799 1HE LYS 97 2HE LYS 97 4.495 -13.637 -10.729
800 2HE LYS 97 1HE LYS 97 5.524 -12.596 -11.711
801 1HZ LYS 97 1HZ LYS 97 6.221 -14.924 -10.120
802 2HZ LYS 97 2HZ LYS 97 7.321 -13.641 -10.055
803 3HZ LYS 97 3HZ LYS 97 6.920 -14.336 -11.544
804 H MET 98 H MET 98 3.595 -7.101 -10.357
805 HA MET 98 HA MET 98 3.306 -5.287 -8.053
806 1HB MET 98 2HB MET 98 2.200 -4.794 -10.812
807 2HB MET 98 1HB MET 98 2.415 -3.637 -9.507
808 1HG MET 98 2HG MET 98 4.432 -3.115 -10.238
809 2HG MET 98 1HG MET 98 4.940 -4.801 -10.154
810 1HE MET 98 1HE MET 98 3.748 -2.086 -13.338
811 2HE MET 98 2HE MET 98 2.804 -2.368 -11.877
812 3HE MET 98 3HE MET 98 2.365 -3.178 -13.380
813 H VAL 99 H VAL 99 1.781 -6.075 -6.746
814 HA VAL 99 HA VAL 99 -0.379 -7.700 -7.652
815 HB VAL 99 HB VAL 99 -0.211 -6.322 -4.977
816 1HG1 VAL 99 1HG1 VAL 99 -1.251 -8.793 -4.563
817 2HG1 VAL 99 2HG1 VAL 99 -1.872 -8.427 -6.172
818 3HG1 VAL 99 3HG1 VAL 99 -2.211 -7.339 -4.828
819 1HG2 VAL 99 1HG2 VAL 99 0.785 -8.716 -4.409
820 2HG2 VAL 99 2HG2 VAL 99 1.813 -7.366 -4.890
821 3HG2 VAL 99 3HG2 VAL 99 1.357 -8.592 -6.074
822 H ASN 100 H ASN 100 0.081 -4.384 -7.772
823 HA ASN 100 HA ASN 100 -2.401 -3.327 -7.064
824 1HB ASN 100 2HB ASN 100 -0.174 -2.474 -8.842
825 2HB ASN 100 1HB ASN 100 -1.713 -1.639 -9.012
826 1HD2 ASN 100 1HD2 ASN 100 0.761 -2.556 -6.680
827 2HD2 ASN 100 2HD2 ASN 100 0.511 -1.219 -5.615
828 H GLU 101 H GLU 101 -1.530 -5.299 -9.742
829 HA GLU 101 HA GLU 101 -3.850 -4.505 -11.310
830 1HB GLU 101 2HB GLU 101 -1.445 -6.201 -11.784
831 2HB GLU 101 1HB GLU 101 -2.888 -6.529 -12.736
832 1HG GLU 101 2HG GLU 101 -2.904 -4.185 -13.479
833 2HG GLU 101 1HG GLU 101 -1.419 -3.908 -12.571
834 H ALA 102 H ALA 102 -3.003 -6.860 -8.971
835 HA ALA 102 HA ALA 102 -4.632 -9.001 -9.744
836 1HB ALA 102 1HB ALA 102 -4.569 -9.603 -7.301
837 2HB ALA 102 2HB ALA 102 -3.667 -8.111 -7.039
838 3HB ALA 102 3HB ALA 102 -3.001 -9.375 -8.073
839 H LEU 103 H LEU 103 -5.452 -7.227 -6.795
840 HA LEU 103 HA LEU 103 -8.245 -7.206 -7.711
841 1HB LEU 103 2HB LEU 103 -8.700 -7.023 -5.165
842 2HB LEU 103 1HB LEU 103 -8.318 -8.576 -5.878
843 HG LEU 103 HG LEU 103 -7.215 -8.109 -3.679
844 1HD1 LEU 103 1HD1 LEU 103 -4.864 -8.429 -5.313
845 2HD1 LEU 103 2HD1 LEU 103 -6.215 -9.362 -5.956
846 3HD1 LEU 103 3HD1 LEU 103 -5.695 -9.600 -4.289
847 1HD2 LEU 103 1HD2 LEU 103 -6.744 -5.652 -4.499
848 2HD2 LEU 103 2HD2 LEU 103 -5.245 -6.379 -5.082
849 3HD2 LEU 103 3HD2 LEU 103 -5.660 -6.468 -3.372
850 H VAL 104 H VAL 104 -5.649 -5.235 -6.587
851 HA VAL 104 HA VAL 104 -6.985 -3.062 -5.504
852 HB VAL 104 HB VAL 104 -4.565 -2.804 -7.280
853 1HG1 VAL 104 1HG1 VAL 104 -5.954 -1.084 -5.343
854 2HG1 VAL 104 2HG1 VAL 104 -4.943 -0.657 -6.723
855 3HG1 VAL 104 3HG1 VAL 104 -4.199 -1.124 -5.194
856 1HG2 VAL 104 1HG2 VAL 104 -3.640 -4.334 -5.910
857 2HG2 VAL 104 2HG2 VAL 104 -4.882 -4.129 -4.676
858 3HG2 VAL 104 3HG2 VAL 104 -3.546 -2.984 -4.780
859 H ARG 105 H ARG 105 -6.877 -4.134 -8.786
860 HA ARG 105 HA ARG 105 -7.381 -1.761 -10.160
861 1HB ARG 105 2HB ARG 105 -7.688 -4.631 -10.679
862 2HB ARG 105 1HB ARG 105 -8.829 -3.629 -11.565
863 1HG ARG 105 2HG ARG 105 -7.093 -2.441 -12.644
864 2HG ARG 105 1HG ARG 105 -5.869 -3.114 -11.565
865 1HD ARG 105 2HD ARG 105 -5.915 -5.186 -12.592
866 2HD ARG 105 1HD ARG 105 -7.532 -4.938 -13.248
867 HE ARG 105 HE ARG 105 -5.033 -4.154 -14.439
868 1HH1 ARG 105 1HH1 ARG 105 -8.468 -3.545 -14.321
869 2HH1 ARG 105 2HH1 ARG 105 -8.526 -2.849 -15.906
870 1HH2 ARG 105 1HH2 ARG 105 -5.108 -3.240 -16.524
871 2HH2 ARG 105 2HH2 ARG 105 -6.619 -2.677 -17.158
872 H GLN 106 H GLN 106 -9.424 -3.629 -8.087
873 HA GLN 106 HA GLN 106 -11.789 -2.127 -8.968
874 1HB GLN 106 2HB GLN 106 -11.408 -4.716 -7.513
875 2HB GLN 106 1HB GLN 106 -12.911 -3.825 -7.317
876 1HG GLN 106 2HG GLN 106 -13.403 -3.985 -9.635
877 2HG GLN 106 1HG GLN 106 -11.798 -4.614 -9.994
878 1HE2 GLN 106 1HE2 GLN 106 -12.306 -6.556 -10.824
879 2HE2 GLN 106 2HE2 GLN 106 -13.147 -7.799 -9.967
880 H GLY 107 H GLY 107 -9.485 -1.245 -7.142
881 1HA GLY 107 2HA GLY 107 -9.460 0.382 -5.483
882 2HA GLY 107 1HA GLY 107 -11.181 0.133 -5.250
883 H LEU 108 H LEU 108 -9.949 -2.878 -5.150
884 HA LEU 108 HA LEU 108 -9.235 -4.328 -3.542
885 1HB LEU 108 2HB LEU 108 -8.913 -2.150 -1.520
886 2HB LEU 108 1HB LEU 108 -8.017 -3.645 -1.698
887 HG LEU 108 HG LEU 108 -7.599 -1.962 -4.005
888 1HD1 LEU 108 1HD1 LEU 108 -6.114 -0.424 -2.340
889 2HD1 LEU 108 2HD1 LEU 108 -7.580 -0.642 -1.384
890 3HD1 LEU 108 3HD1 LEU 108 -7.679 0.046 -3.005
891 1HD2 LEU 108 1HD2 LEU 108 -6.193 -3.855 -3.221
892 2HD2 LEU 108 2HD2 LEU 108 -5.690 -2.861 -1.853
893 3HD2 LEU 108 3HD2 LEU 108 -5.290 -2.365 -3.497
894 H ALA 109 H ALA 109 -11.538 -4.812 -3.756
895 HA ALA 109 HA ALA 109 -12.963 -5.831 -1.956
896 1HB ALA 109 1HB ALA 109 -13.166 -2.919 -1.199
897 2HB ALA 109 2HB ALA 109 -12.567 -4.250 -0.208
898 3HB ALA 109 3HB ALA 109 -14.279 -4.162 -0.626
899 H LYS 110 H LYS 110 -13.948 -2.620 -3.082
900 HA LYS 110 HA LYS 110 -15.548 -1.933 -4.552
901 1HB LYS 110 2HB LYS 110 -14.251 -3.959 -5.851
902 2HB LYS 110 1HB LYS 110 -15.913 -4.531 -5.887
903 1HG LYS 110 2HG LYS 110 -15.411 -1.713 -6.664
904 2HG LYS 110 1HG LYS 110 -14.907 -2.983 -7.782
905 1HD LYS 110 2HD LYS 110 -17.031 -3.554 -8.295
906 2HD LYS 110 1HD LYS 110 -17.608 -3.290 -6.648
907 1HE LYS 110 2HE LYS 110 -17.667 -0.907 -7.002
908 2HE LYS 110 1HE LYS 110 -16.935 -1.089 -8.596
909 1HZ LYS 110 1HZ LYS 110 -19.390 -2.576 -8.144
910 2HZ LYS 110 2HZ LYS 110 -18.879 -1.718 -9.511
911 3HZ LYS 110 3HZ LYS 110 -19.554 -0.892 -8.198
Start of MODEL 9
1 1H ALA 1 1HT ALA 1 7.696 13.821 -27.971
2 2H ALA 1 2HT ALA 1 8.671 15.202 -28.267
3 3H ALA 1 3HT ALA 1 7.790 15.071 -26.801
4 HA ALA 1 HA ALA 1 9.892 13.198 -27.635
5 1HB ALA 1 1HB ALA 1 11.481 14.570 -26.890
6 2HB ALA 1 2HB ALA 1 10.556 14.981 -25.445
7 3HB ALA 1 3HB ALA 1 10.271 15.852 -26.952
8 H THR 2 H THR 2 10.696 11.983 -25.767
9 HA THR 2 HA THR 2 8.573 11.549 -23.770
10 HB THR 2 HB THR 2 8.696 9.616 -25.158
11 HG1 THR 2 1HG THR 2 8.636 8.489 -23.410
12 1HG2 THR 2 1HG2 THR 2 11.102 8.410 -24.983
13 2HG2 THR 2 2HG2 THR 2 11.586 10.101 -25.111
14 3HG2 THR 2 3HG2 THR 2 10.569 9.378 -26.357
15 H SER 3 H SER 3 9.116 11.416 -21.637
16 HA SER 3 HA SER 3 11.882 12.143 -20.971
17 1HB SER 3 2HB SER 3 11.052 13.118 -18.961
18 2HB SER 3 1HB SER 3 9.950 13.624 -20.243
19 HG SER 3 HG SER 3 9.479 12.072 -18.043
20 H THR 4 H THR 4 13.165 10.739 -19.970
21 HA THR 4 HA THR 4 12.324 8.087 -19.426
22 HB THR 4 HB THR 4 14.654 8.019 -18.260
23 HG1 THR 4 1HG THR 4 15.991 9.730 -18.877
24 1HG2 THR 4 1HG2 THR 4 14.593 6.995 -20.334
25 2HG2 THR 4 2HG2 THR 4 15.820 8.247 -20.533
26 3HG2 THR 4 3HG2 THR 4 14.195 8.495 -21.174
27 H LYS 5 H LYS 5 11.431 7.246 -17.663
28 HA LYS 5 HA LYS 5 10.966 8.915 -15.356
29 1HB LYS 5 2HB LYS 5 9.316 7.253 -16.413
30 2HB LYS 5 1HB LYS 5 10.242 6.004 -15.593
31 1HG LYS 5 2HG LYS 5 9.170 6.382 -13.694
32 2HG LYS 5 1HG LYS 5 9.598 8.092 -13.744
33 1HD LYS 5 2HD LYS 5 7.651 8.068 -15.589
34 2HD LYS 5 1HD LYS 5 7.110 6.729 -14.574
35 1HE LYS 5 2HE LYS 5 7.707 9.541 -13.663
36 2HE LYS 5 1HE LYS 5 6.108 8.818 -13.838
37 1HZ LYS 5 1HZ LYS 5 6.392 8.411 -11.657
38 2HZ LYS 5 2HZ LYS 5 8.080 8.469 -11.735
39 3HZ LYS 5 3HZ LYS 5 7.262 7.066 -12.207
40 H LYS 6 H LYS 6 12.148 8.962 -13.562
41 HA LYS 6 HA LYS 6 14.400 7.166 -13.286
42 1HB LYS 6 2HB LYS 6 13.466 9.571 -11.724
43 2HB LYS 6 1HB LYS 6 14.842 8.595 -11.224
44 1HG LYS 6 2HG LYS 6 14.677 9.839 -13.950
45 2HG LYS 6 1HG LYS 6 15.332 10.698 -12.555
46 1HD LYS 6 2HD LYS 6 16.402 7.991 -12.942
47 2HD LYS 6 1HD LYS 6 16.787 9.128 -14.236
48 1HE LYS 6 2HE LYS 6 17.118 10.187 -11.516
49 2HE LYS 6 1HE LYS 6 18.206 8.863 -11.934
50 1HZ LYS 6 1HZ LYS 6 19.423 10.550 -12.763
51 2HZ LYS 6 2HZ LYS 6 18.095 11.573 -12.979
52 3HZ LYS 6 3HZ LYS 6 18.420 10.359 -14.112
53 H LEU 7 H LEU 7 14.080 5.224 -12.427
54 HA LEU 7 HA LEU 7 12.392 5.031 -10.022
55 1HB LEU 7 2HB LEU 7 12.644 2.908 -12.150
56 2HB LEU 7 1HB LEU 7 11.620 2.852 -10.729
57 HG LEU 7 HG LEU 7 11.296 4.835 -12.982
58 1HD1 LEU 7 1HD1 LEU 7 10.835 2.229 -13.279
59 2HD1 LEU 7 2HD1 LEU 7 9.803 3.466 -14.000
60 3HD1 LEU 7 3HD1 LEU 7 9.323 2.683 -12.493
61 1HD2 LEU 7 1HD2 LEU 7 9.095 4.214 -11.127
62 2HD2 LEU 7 2HD2 LEU 7 9.582 5.751 -11.840
63 3HD2 LEU 7 3HD2 LEU 7 10.446 5.115 -10.441
64 H HIS 8 H HIS 8 13.862 4.843 -8.437
65 HA HIS 8 HA HIS 8 16.197 3.131 -8.826
66 1HB HIS 8 2HB HIS 8 16.104 5.528 -7.695
67 2HB HIS 8 1HB HIS 8 15.695 4.583 -6.268
68 HD1 HIS 8 1HD HIS 8 17.572 2.209 -6.567
69 HD2 HIS 8 2HD HIS 8 18.715 6.138 -7.292
70 HE1 HIS 8 1HE HIS 8 20.073 2.243 -6.298
71 HE2 HIS 8 2HE HIS 8 20.750 4.610 -6.829
72 H LYS 9 H LYS 9 16.358 1.147 -8.000
73 HA LYS 9 HA LYS 9 14.120 0.031 -6.569
74 1HB LYS 9 2HB LYS 9 15.371 -1.189 -8.366
75 2HB LYS 9 1HB LYS 9 16.742 -1.295 -7.269
76 1HG LYS 9 2HG LYS 9 14.125 -2.287 -6.295
77 2HG LYS 9 1HG LYS 9 14.969 -3.245 -7.513
78 1HD LYS 9 2HD LYS 9 16.560 -3.901 -6.063
79 2HD LYS 9 1HD LYS 9 16.669 -2.305 -5.315
80 1HE LYS 9 2HE LYS 9 14.696 -2.747 -3.995
81 2HE LYS 9 1HE LYS 9 14.458 -4.292 -4.810
82 1HZ LYS 9 1HZ LYS 9 16.533 -5.076 -3.870
83 2HZ LYS 9 2HZ LYS 9 15.492 -4.566 -2.638
84 3HZ LYS 9 3HZ LYS 9 16.789 -3.586 -3.108
85 H GLU 10 H GLU 10 13.912 0.189 -4.449
86 HA GLU 10 HA GLU 10 16.287 -0.133 -2.762
87 1HB GLU 10 2HB GLU 10 15.044 2.311 -3.124
88 2HB GLU 10 1HB GLU 10 14.326 1.715 -1.633
89 1HG GLU 10 2HG GLU 10 16.890 1.200 -1.101
90 2HG GLU 10 1HG GLU 10 17.097 2.559 -2.205
91 HA PRO 11 HA PRO 11 13.635 -3.211 -0.928
92 1HB PRO 11 2HB PRO 11 15.412 -2.923 1.422
93 2HB PRO 11 1HB PRO 11 15.029 -4.360 0.470
94 1HG PRO 11 2HG PRO 11 17.413 -3.165 0.278
95 2HG PRO 11 1HG PRO 11 16.623 -3.884 -1.137
96 1HD PRO 11 2HD PRO 11 16.839 -1.008 -0.339
97 2HD PRO 11 1HD PRO 11 16.943 -1.744 -1.951
98 H ALA 12 H ALA 12 11.707 -2.703 -0.127
99 HA ALA 12 HA ALA 12 11.539 -1.217 2.377
100 1HB ALA 12 1HB ALA 12 9.990 -0.404 -0.081
101 2HB ALA 12 2HB ALA 12 11.315 0.499 0.651
102 3HB ALA 12 3HB ALA 12 9.804 0.281 1.533
103 H THR 13 H THR 13 10.573 -2.711 3.610
104 HA THR 13 HA THR 13 8.208 -4.083 2.511
105 HB THR 13 HB THR 13 9.940 -5.691 2.930
106 HG1 THR 13 1HG THR 13 8.194 -5.816 5.155
107 1HG2 THR 13 1HG2 THR 13 10.472 -5.889 5.561
108 2HG2 THR 13 2HG2 THR 13 10.393 -4.136 5.376
109 3HG2 THR 13 3HG2 THR 13 11.517 -5.077 4.396
110 H LEU 14 H LEU 14 6.591 -4.728 4.165
111 HA LEU 14 HA LEU 14 6.159 -2.505 6.013
112 1HB LEU 14 2HB LEU 14 4.153 -4.650 5.458
113 2HB LEU 14 1HB LEU 14 3.880 -2.988 5.935
114 HG LEU 14 HG LEU 14 5.185 -3.030 3.378
115 1HD1 LEU 14 1HD1 LEU 14 4.320 -5.218 3.007
116 2HD1 LEU 14 2HD1 LEU 14 3.303 -4.085 2.114
117 3HD1 LEU 14 3HD1 LEU 14 2.739 -4.762 3.642
118 1HD2 LEU 14 1HD2 LEU 14 3.651 -1.308 4.517
119 2HD2 LEU 14 2HD2 LEU 14 2.327 -2.296 3.899
120 3HD2 LEU 14 3HD2 LEU 14 3.476 -1.564 2.780
121 H ILE 15 H ILE 15 5.783 -2.774 8.190
122 HA ILE 15 HA ILE 15 6.835 -5.240 9.324
123 HB ILE 15 HB ILE 15 7.616 -3.002 10.118
124 1HG1 ILE 15 2HG1 ILE 15 7.543 -5.243 11.465
125 2HG1 ILE 15 1HG1 ILE 15 7.972 -3.746 12.283
126 1HG2 ILE 15 1HG2 ILE 15 4.868 -2.824 11.345
127 2HG2 ILE 15 2HG2 ILE 15 5.480 -1.829 10.022
128 3HG2 ILE 15 3HG2 ILE 15 6.206 -1.708 11.625
129 1HD1 ILE 15 1HD1 ILE 15 6.493 -4.941 13.692
130 2HD1 ILE 15 2HD1 ILE 15 5.347 -5.202 12.380
131 3HD1 ILE 15 3HD1 ILE 15 5.587 -3.581 13.030
132 H LYS 16 H LYS 16 3.876 -3.310 9.351
133 HA LYS 16 HA LYS 16 2.149 -5.474 9.628
134 1HB LYS 16 2HB LYS 16 3.415 -5.105 12.014
135 2HB LYS 16 1HB LYS 16 1.992 -4.096 12.231
136 1HG LYS 16 2HG LYS 16 0.606 -5.855 12.376
137 2HG LYS 16 1HG LYS 16 1.457 -6.760 11.122
138 1HD LYS 16 2HD LYS 16 2.687 -7.885 12.621
139 2HD LYS 16 1HD LYS 16 3.021 -6.432 13.564
140 1HE LYS 16 2HE LYS 16 1.746 -8.170 14.805
141 2HE LYS 16 1HE LYS 16 0.924 -6.614 14.706
142 1HZ LYS 16 1HZ LYS 16 0.307 -8.512 12.595
143 2HZ LYS 16 2HZ LYS 16 -0.715 -7.460 13.440
144 3HZ LYS 16 3HZ LYS 16 -0.249 -8.928 14.139
145 H ALA 17 H ALA 17 0.259 -4.779 8.875
146 HA ALA 17 HA ALA 17 -0.325 -1.901 9.016
147 1HB ALA 17 1HB ALA 17 -1.410 -4.014 7.157
148 2HB ALA 17 2HB ALA 17 -0.191 -2.802 6.765
149 3HB ALA 17 3HB ALA 17 -1.844 -2.307 7.126
150 H ILE 18 H ILE 18 -2.385 -1.161 9.637
151 HA ILE 18 HA ILE 18 -3.574 -2.386 11.798
152 HB ILE 18 HB ILE 18 -5.644 -0.975 11.191
153 1HG1 ILE 18 2HG1 ILE 18 -3.641 0.123 9.202
154 2HG1 ILE 18 1HG1 ILE 18 -5.138 -0.713 8.799
155 1HG2 ILE 18 1HG2 ILE 18 -3.998 1.147 11.587
156 2HG2 ILE 18 2HG2 ILE 18 -2.972 -0.190 12.102
157 3HG2 ILE 18 3HG2 ILE 18 -4.550 0.051 12.853
158 1HD1 ILE 18 1HD1 ILE 18 -5.218 1.743 10.486
159 2HD1 ILE 18 2HD1 ILE 18 -6.450 1.074 9.419
160 3HD1 ILE 18 3HD1 ILE 18 -5.035 1.877 8.738
161 H ASP 19 H ASP 19 -4.421 -2.664 8.397
162 HA ASP 19 HA ASP 19 -5.253 -5.229 8.354
163 1HB ASP 19 2HB ASP 19 -7.831 -4.923 8.424
164 2HB ASP 19 1HB ASP 19 -6.958 -5.040 9.947
165 H GLY 20 H GLY 20 -7.963 -3.597 7.148
166 1HA GLY 20 2HA GLY 20 -6.843 -3.721 4.460
167 2HA GLY 20 1HA GLY 20 -8.545 -3.579 4.874
168 H ASP 21 H ASP 21 -7.337 -1.382 6.857
169 HA ASP 21 HA ASP 21 -8.117 0.790 5.185
170 1HB ASP 21 2HB ASP 21 -7.592 0.355 7.984
171 2HB ASP 21 1HB ASP 21 -6.815 1.841 7.446
172 H THR 22 H THR 22 -5.140 0.858 7.101
173 HA THR 22 HA THR 22 -3.662 1.597 4.668
174 HB THR 22 HB THR 22 -3.544 2.968 7.359
175 HG1 THR 22 1HG THR 22 -5.086 4.029 6.393
176 1HG2 THR 22 1HG2 THR 22 -1.311 2.898 6.431
177 2HG2 THR 22 2HG2 THR 22 -1.972 4.531 6.334
178 3HG2 THR 22 3HG2 THR 22 -1.911 3.516 4.893
179 H VAL 23 H VAL 23 -1.330 1.357 4.835
180 HA VAL 23 HA VAL 23 -0.529 -0.676 6.810
181 HB VAL 23 HB VAL 23 0.855 -1.758 5.133
182 1HG1 VAL 23 1HG1 VAL 23 -2.036 -1.548 4.942
183 2HG1 VAL 23 2HG1 VAL 23 -0.999 -2.973 4.889
184 3HG1 VAL 23 3HG1 VAL 23 -1.294 -2.044 3.420
185 1HG2 VAL 23 1HG2 VAL 23 1.419 0.181 3.773
186 2HG2 VAL 23 2HG2 VAL 23 -0.251 0.292 3.212
187 3HG2 VAL 23 3HG2 VAL 23 0.739 -1.099 2.767
188 H LYS 24 H LYS 24 1.708 -0.707 7.389
189 HA LYS 24 HA LYS 24 3.051 1.880 6.953
190 1HB LYS 24 2HB LYS 24 2.208 1.115 9.321
191 2HB LYS 24 1HB LYS 24 3.665 0.132 9.302
192 1HG LYS 24 2HG LYS 24 5.067 1.979 9.291
193 2HG LYS 24 1HG LYS 24 3.799 3.061 8.715
194 1HD LYS 24 2HD LYS 24 2.859 2.019 11.139
195 2HD LYS 24 1HD LYS 24 4.559 2.401 11.416
196 1HE LYS 24 2HE LYS 24 3.806 4.615 10.102
197 2HE LYS 24 1HE LYS 24 2.270 4.187 10.854
198 1HZ LYS 24 1HZ LYS 24 3.180 4.379 12.979
199 2HZ LYS 24 2HZ LYS 24 3.826 5.700 12.145
200 3HZ LYS 24 3HZ LYS 24 4.776 4.328 12.418
201 H LEU 25 H LEU 25 5.108 1.894 6.212
202 HA LEU 25 HA LEU 25 6.356 -0.724 5.723
203 1HB LEU 25 2HB LEU 25 6.389 1.840 4.178
204 2HB LEU 25 1HB LEU 25 7.683 0.672 3.984
205 HG LEU 25 HG LEU 25 5.620 -0.973 3.594
206 1HD1 LEU 25 1HD1 LEU 25 4.610 1.762 2.864
207 2HD1 LEU 25 2HD1 LEU 25 3.846 0.558 3.904
208 3HD1 LEU 25 3HD1 LEU 25 3.963 0.277 2.166
209 1HD2 LEU 25 1HD2 LEU 25 6.212 0.692 1.234
210 2HD2 LEU 25 2HD2 LEU 25 6.346 -1.051 1.459
211 3HD2 LEU 25 3HD2 LEU 25 7.607 0.016 2.076
212 H MET 26 H MET 26 8.713 -0.795 5.751
213 HA MET 26 HA MET 26 9.779 0.931 7.878
214 1HB MET 26 2HB MET 26 9.704 -1.638 8.086
215 2HB MET 26 1HB MET 26 11.026 -1.637 6.927
216 1HG MET 26 2HG MET 26 12.411 -1.428 8.636
217 2HG MET 26 1HG MET 26 11.795 0.211 8.848
218 1HE MET 26 1HE MET 26 11.718 -3.369 11.240
219 2HE MET 26 2HE MET 26 12.584 -1.996 11.932
220 3HE MET 26 3HE MET 26 12.912 -2.499 10.275
221 H TYR 27 H TYR 27 10.517 2.682 6.734
222 HA TYR 27 HA TYR 27 12.463 2.173 4.592
223 1HB TYR 27 2HB TYR 27 10.318 3.839 4.561
224 2HB TYR 27 1HB TYR 27 11.580 4.947 5.091
225 HD1 TYR 27 1HD TYR 27 13.558 5.349 3.639
226 HD2 TYR 27 2HD TYR 27 10.231 3.050 2.314
227 HE1 TYR 27 1HE TYR 27 14.307 5.613 1.312
228 HE2 TYR 27 2HE TYR 27 10.972 3.308 -0.015
229 HH TYR 27 HH TYR 27 13.269 5.551 -0.977
230 H LYS 28 H LYS 28 14.334 1.802 5.714
231 HA LYS 28 HA LYS 28 16.241 2.279 6.858
232 1HB LYS 28 2HB LYS 28 15.803 4.438 5.348
233 2HB LYS 28 1HB LYS 28 15.640 5.192 6.928
234 1HG LYS 28 2HG LYS 28 17.991 3.462 6.612
235 2HG LYS 28 1HG LYS 28 17.973 4.907 5.598
236 1HD LYS 28 2HD LYS 28 18.728 6.033 7.368
237 2HD LYS 28 1HD LYS 28 17.140 5.798 8.099
238 1HE LYS 28 2HE LYS 28 18.774 5.053 9.667
239 2HE LYS 28 1HE LYS 28 17.972 3.626 9.012
240 1HZ LYS 28 1HZ LYS 28 19.823 3.072 7.749
241 2HZ LYS 28 2HZ LYS 28 20.503 3.605 9.202
242 3HZ LYS 28 3HZ LYS 28 20.498 4.620 7.850
243 H GLY 29 H GLY 29 13.736 1.839 8.310
244 1HA GLY 29 2HA GLY 29 13.498 1.579 10.643
245 2HA GLY 29 1HA GLY 29 14.634 2.896 10.883
246 H GLN 30 H GLN 30 13.024 4.448 8.787
247 HA GLN 30 HA GLN 30 11.217 5.646 10.707
248 1HB GLN 30 2HB GLN 30 12.692 7.020 9.245
249 2HB GLN 30 1HB GLN 30 11.783 6.454 7.849
250 1HG GLN 30 2HG GLN 30 9.892 7.656 8.430
251 2HG GLN 30 1HG GLN 30 10.383 7.805 10.116
252 1HE2 GLN 30 1HE2 GLN 30 9.523 9.929 8.463
253 2HE2 GLN 30 2HE2 GLN 30 10.842 11.031 8.289
254 HA PRO 31 HA PRO 31 7.812 3.070 9.266
255 1HB PRO 31 2HB PRO 31 6.282 5.145 10.752
256 2HB PRO 31 1HB PRO 31 6.202 3.384 10.874
257 1HG PRO 31 2HG PRO 31 7.410 4.821 12.762
258 2HG PRO 31 1HG PRO 31 8.074 3.261 12.239
259 1HD PRO 31 2HD PRO 31 8.982 6.030 11.574
260 2HD PRO 31 1HD PRO 31 9.943 4.568 11.873
261 H MET 32 H MET 32 7.674 3.489 7.094
262 HA MET 32 HA MET 32 6.734 6.075 6.160
263 1HB MET 32 2HB MET 32 8.534 4.581 5.045
264 2HB MET 32 1HB MET 32 7.171 3.662 4.421
265 1HG MET 32 2HG MET 32 6.404 6.133 3.724
266 2HG MET 32 1HG MET 32 8.154 6.340 3.686
267 1HE MET 32 1HE MET 32 6.372 2.687 2.156
268 2HE MET 32 2HE MET 32 5.366 3.842 1.282
269 3HE MET 32 3HE MET 32 5.466 3.915 3.041
270 H THR 33 H THR 33 4.833 6.387 4.941
271 HA THR 33 HA THR 33 2.731 4.421 5.541
272 HB THR 33 HB THR 33 2.270 7.258 4.645
273 HG1 THR 33 1HG THR 33 2.710 6.306 7.277
274 1HG2 THR 33 1HG2 THR 33 0.173 6.490 4.706
275 2HG2 THR 33 2HG2 THR 33 0.346 6.671 6.452
276 3HG2 THR 33 3HG2 THR 33 0.602 5.096 5.699
277 H PHE 34 H PHE 34 1.459 3.563 3.958
278 HA PHE 34 HA PHE 34 2.080 4.338 1.184
279 1HB PHE 34 2HB PHE 34 3.144 2.215 1.598
280 2HB PHE 34 1HB PHE 34 1.672 1.559 2.308
281 HD1 PHE 34 1HD PHE 34 1.093 -0.218 0.942
282 HD2 PHE 34 2HD PHE 34 2.120 3.515 -0.823
283 HE1 PHE 34 1HE PHE 34 0.417 -1.079 -1.262
284 HE2 PHE 34 2HE PHE 34 1.444 2.662 -3.030
285 HZ PHE 34 HZ PHE 34 0.591 0.363 -3.251
286 H ARG 35 H ARG 35 0.357 5.265 0.332
287 HA ARG 35 HA ARG 35 -1.799 5.811 -0.152
288 1HB ARG 35 2HB ARG 35 -1.406 3.123 -0.732
289 2HB ARG 35 1HB ARG 35 -2.923 3.142 0.157
290 1HG ARG 35 2HG ARG 35 -3.348 5.187 -1.539
291 2HG ARG 35 1HG ARG 35 -2.280 4.179 -2.520
292 1HD ARG 35 2HD ARG 35 -3.907 2.273 -1.665
293 2HD ARG 35 1HD ARG 35 -5.020 3.631 -1.504
294 HE ARG 35 HE ARG 35 -5.225 3.658 -3.771
295 1HH1 ARG 35 1HH1 ARG 35 -2.270 1.988 -2.962
296 2HH1 ARG 35 2HH1 ARG 35 -1.932 1.532 -4.598
297 1HH2 ARG 35 1HH2 ARG 35 -4.782 3.060 -5.925
298 2HH2 ARG 35 2HH2 ARG 35 -3.358 2.141 -6.280
299 H LEU 36 H LEU 36 -2.215 7.006 1.743
300 HA LEU 36 HA LEU 36 -3.688 5.575 3.848
301 1HB LEU 36 2HB LEU 36 -3.357 7.965 4.960
302 2HB LEU 36 1HB LEU 36 -2.134 6.712 5.050
303 HG LEU 36 HG LEU 36 -0.952 7.758 3.144
304 1HD1 LEU 36 1HD1 LEU 36 -1.588 9.944 2.353
305 2HD1 LEU 36 2HD1 LEU 36 -2.966 9.979 3.455
306 3HD1 LEU 36 3HD1 LEU 36 -2.930 8.824 2.122
307 1HD2 LEU 36 1HD2 LEU 36 -1.400 9.046 5.755
308 2HD2 LEU 36 2HD2 LEU 36 -0.626 10.047 4.527
309 3HD2 LEU 36 3HD2 LEU 36 0.097 8.508 4.992
310 H LEU 37 H LEU 37 -5.601 5.480 2.545
311 HA LEU 37 HA LEU 37 -7.066 8.034 2.503
312 1HB LEU 37 2HB LEU 37 -6.371 7.069 0.233
313 2HB LEU 37 1HB LEU 37 -7.548 5.805 0.542
314 HG LEU 37 HG LEU 37 -9.107 7.955 0.952
315 1HD1 LEU 37 1HD1 LEU 37 -7.631 8.949 -1.403
316 2HD1 LEU 37 2HD1 LEU 37 -6.896 9.244 0.173
317 3HD1 LEU 37 3HD1 LEU 37 -8.523 9.832 -0.164
318 1HD2 LEU 37 1HD2 LEU 37 -10.163 7.350 -0.982
319 2HD2 LEU 37 2HD2 LEU 37 -9.138 5.934 -0.742
320 3HD2 LEU 37 3HD2 LEU 37 -8.656 7.187 -1.885
321 H LEU 38 H LEU 38 -9.235 7.975 3.106
322 HA LEU 38 HA LEU 38 -10.109 5.432 4.317
323 1HB LEU 38 2HB LEU 38 -9.617 7.669 5.695
324 2HB LEU 38 1HB LEU 38 -11.273 8.010 5.226
325 HG LEU 38 HG LEU 38 -10.767 5.342 6.411
326 1HD1 LEU 38 1HD1 LEU 38 -9.381 6.891 7.780
327 2HD1 LEU 38 2HD1 LEU 38 -10.708 6.140 8.666
328 3HD1 LEU 38 3HD1 LEU 38 -10.842 7.814 8.129
329 1HD2 LEU 38 1HD2 LEU 38 -12.889 7.153 7.364
330 2HD2 LEU 38 2HD2 LEU 38 -12.959 5.445 6.932
331 3HD2 LEU 38 3HD2 LEU 38 -12.981 6.676 5.670
332 H VAL 39 H VAL 39 -11.487 4.543 2.915
333 HA VAL 39 HA VAL 39 -13.934 5.959 2.292
334 HB VAL 39 HB VAL 39 -13.760 5.289 -0.155
335 1HG1 VAL 39 1HG1 VAL 39 -13.261 7.615 1.067
336 2HG1 VAL 39 2HG1 VAL 39 -13.147 7.404 -0.681
337 3HG1 VAL 39 3HG1 VAL 39 -11.690 7.346 0.312
338 1HG2 VAL 39 1HG2 VAL 39 -11.794 3.799 0.166
339 2HG2 VAL 39 2HG2 VAL 39 -10.808 5.232 0.458
340 3HG2 VAL 39 3HG2 VAL 39 -11.576 4.995 -1.112
341 H ASP 40 H ASP 40 -15.662 4.593 1.969
342 HA ASP 40 HA ASP 40 -15.159 1.741 1.624
343 1HB ASP 40 2HB ASP 40 -15.389 2.604 4.158
344 2HB ASP 40 1HB ASP 40 -17.097 2.408 3.773
345 H THR 41 H THR 41 -16.143 2.012 -0.403
346 HA THR 41 HA THR 41 -19.046 1.951 -0.290
347 HB THR 41 HB THR 41 -17.872 3.688 -2.416
348 HG1 THR 41 1HG THR 41 -18.441 4.575 0.216
349 1HG2 THR 41 1HG2 THR 41 -20.121 3.537 -2.772
350 2HG2 THR 41 2HG2 THR 41 -20.047 4.966 -1.740
351 3HG2 THR 41 3HG2 THR 41 -20.498 3.404 -1.054
352 HA PRO 42 HA PRO 42 -17.305 -0.974 -3.392
353 1HB PRO 42 2HB PRO 42 -17.961 -3.281 -2.246
354 2HB PRO 42 1HB PRO 42 -16.569 -2.355 -1.672
355 1HG PRO 42 2HG PRO 42 -19.300 -2.599 -0.492
356 2HG PRO 42 1HG PRO 42 -17.728 -2.509 0.322
357 1HD PRO 42 2HD PRO 42 -19.505 -0.380 -0.054
358 2HD PRO 42 1HD PRO 42 -17.793 -0.239 0.389
359 H GLU 43 H GLU 43 -20.363 -0.423 -1.990
360 HA GLU 43 HA GLU 43 -21.921 -0.522 -4.207
361 1HB GLU 43 2HB GLU 43 -21.409 -2.849 -4.581
362 2HB GLU 43 1HB GLU 43 -21.774 -3.253 -2.910
363 1HG GLU 43 2HG GLU 43 -24.026 -1.998 -4.216
364 2HG GLU 43 1HG GLU 43 -23.477 -3.427 -5.090
365 H THR 44 H THR 44 -21.555 -1.196 -0.832
366 HA THR 44 HA THR 44 -23.909 0.368 -0.217
367 HB THR 44 HB THR 44 -24.601 -1.531 1.451
368 HG1 THR 44 1HG THR 44 -23.308 -3.005 -0.598
369 1HG2 THR 44 1HG2 THR 44 -25.516 -0.822 -1.096
370 2HG2 THR 44 2HG2 THR 44 -26.386 -1.697 0.164
371 3HG2 THR 44 3HG2 THR 44 -25.474 -2.585 -1.057
372 H LYS 45 H LYS 45 -21.787 -1.978 1.434
373 HA LYS 45 HA LYS 45 -20.089 -0.244 2.713
374 1HB LYS 45 2HB LYS 45 -22.705 0.045 3.766
375 2HB LYS 45 1HB LYS 45 -21.759 -0.797 4.984
376 1HG LYS 45 2HG LYS 45 -20.024 1.140 4.346
377 2HG LYS 45 1HG LYS 45 -21.539 1.969 3.988
378 1HD LYS 45 2HD LYS 45 -21.489 0.482 6.527
379 2HD LYS 45 1HD LYS 45 -20.397 1.866 6.443
380 1HE LYS 45 2HE LYS 45 -23.301 2.033 5.679
381 2HE LYS 45 1HE LYS 45 -22.733 2.316 7.324
382 1HZ LYS 45 1HZ LYS 45 -21.332 4.101 6.491
383 2HZ LYS 45 2HZ LYS 45 -22.952 4.383 6.100
384 3HZ LYS 45 3HZ LYS 45 -21.880 3.830 4.914
385 H HIS 46 H HIS 46 -22.226 -2.914 3.709
386 HA HIS 46 HA HIS 46 -20.307 -4.934 3.609
387 1HB HIS 46 2HB HIS 46 -19.987 -5.243 6.117
388 2HB HIS 46 1HB HIS 46 -19.083 -3.926 5.375
389 HD1 HIS 46 1HD HIS 46 -21.958 -4.595 7.688
390 HD2 HIS 46 2HD HIS 46 -19.768 -1.373 6.246
391 HE1 HIS 46 1HE HIS 46 -22.637 -2.632 9.105
392 HE2 HIS 46 2HE HIS 46 -21.363 -0.676 8.158
393 HA PRO 47 HA PRO 47 -24.771 -6.169 3.903
394 1HB PRO 47 2HB PRO 47 -24.092 -8.588 2.630
395 2HB PRO 47 1HB PRO 47 -24.833 -7.174 1.876
396 1HG PRO 47 2HG PRO 47 -21.983 -8.027 1.917
397 2HG PRO 47 1HG PRO 47 -22.890 -7.186 0.648
398 1HD PRO 47 2HD PRO 47 -21.130 -5.890 2.194
399 2HD PRO 47 1HD PRO 47 -22.639 -5.114 1.669
400 H LYS 48 H LYS 48 -21.757 -7.718 4.764
401 HA LYS 48 HA LYS 48 -22.568 -8.525 7.281
402 1HB LYS 48 2HB LYS 48 -22.664 -11.040 6.883
403 2HB LYS 48 1HB LYS 48 -24.080 -10.110 6.415
404 1HG LYS 48 2HG LYS 48 -22.730 -10.087 4.093
405 2HG LYS 48 1HG LYS 48 -22.168 -11.621 4.761
406 1HD LYS 48 2HD LYS 48 -24.277 -12.554 4.744
407 2HD LYS 48 1HD LYS 48 -25.085 -10.986 4.808
408 1HE LYS 48 2HE LYS 48 -24.229 -10.572 2.479
409 2HE LYS 48 1HE LYS 48 -23.708 -12.256 2.450
410 1HZ LYS 48 1HZ LYS 48 -26.157 -12.701 3.112
411 2HZ LYS 48 2HZ LYS 48 -25.779 -12.371 1.496
412 3HZ LYS 48 3HZ LYS 48 -26.436 -11.158 2.474
413 H LYS 49 H LYS 49 -20.686 -9.880 4.562
414 HA LYS 49 HA LYS 49 -18.405 -10.140 6.401
415 1HB LYS 49 2HB LYS 49 -19.395 -11.746 4.140
416 2HB LYS 49 1HB LYS 49 -17.651 -11.522 4.177
417 1HG LYS 49 2HG LYS 49 -17.637 -12.366 6.505
418 2HG LYS 49 1HG LYS 49 -19.365 -12.698 6.353
419 1HD LYS 49 2HD LYS 49 -17.427 -13.808 4.359
420 2HD LYS 49 1HD LYS 49 -17.662 -14.605 5.914
421 1HE LYS 49 2HE LYS 49 -19.241 -15.703 4.688
422 2HE LYS 49 1HE LYS 49 -20.209 -14.344 5.256
423 1HZ LYS 49 1HZ LYS 49 -20.223 -13.376 3.205
424 2HZ LYS 49 2HZ LYS 49 -20.169 -15.001 2.745
425 3HZ LYS 49 3HZ LYS 49 -18.758 -14.071 2.723
426 H GLY 50 H GLY 50 -19.352 -8.922 3.221
427 1HA GLY 50 2HA GLY 50 -18.408 -6.836 2.441
428 2HA GLY 50 1HA GLY 50 -16.907 -7.271 3.243
429 H VAL 51 H VAL 51 -18.844 -9.415 1.257
430 HA VAL 51 HA VAL 51 -16.653 -10.265 -0.302
431 HB VAL 51 HB VAL 51 -19.566 -10.599 -1.008
432 1HG1 VAL 51 1HG1 VAL 51 -18.433 -12.866 -1.788
433 2HG1 VAL 51 2HG1 VAL 51 -17.014 -11.825 -1.903
434 3HG1 VAL 51 3HG1 VAL 51 -18.469 -11.437 -2.822
435 1HG2 VAL 51 1HG2 VAL 51 -17.967 -11.754 1.172
436 2HG2 VAL 51 2HG2 VAL 51 -18.877 -12.919 0.211
437 3HG2 VAL 51 3HG2 VAL 51 -19.715 -11.588 1.010
438 H GLU 52 H GLU 52 -18.116 -7.351 -0.434
439 HA GLU 52 HA GLU 52 -18.186 -7.082 -3.329
440 1HB GLU 52 2HB GLU 52 -18.598 -4.932 -1.247
441 2HB GLU 52 1HB GLU 52 -19.060 -4.877 -2.943
442 1HG GLU 52 2HG GLU 52 -20.216 -7.104 -1.431
443 2HG GLU 52 1HG GLU 52 -20.723 -5.503 -0.897
444 H LYS 53 H LYS 53 -15.715 -7.479 -1.503
445 HA LYS 53 HA LYS 53 -13.923 -5.902 -3.012
446 1HB LYS 53 2HB LYS 53 -14.979 -4.536 -0.890
447 2HB LYS 53 1HB LYS 53 -13.537 -5.242 -0.177
448 1HG LYS 53 2HG LYS 53 -12.142 -3.937 -1.377
449 2HG LYS 53 1HG LYS 53 -13.182 -3.948 -2.800
450 1HD LYS 53 2HD LYS 53 -14.592 -2.273 -1.894
451 2HD LYS 53 1HD LYS 53 -13.865 -2.430 -0.294
452 1HE LYS 53 2HE LYS 53 -11.787 -1.510 -1.098
453 2HE LYS 53 1HE LYS 53 -12.400 -1.479 -2.751
454 1HZ LYS 53 1HZ LYS 53 -12.663 0.688 -2.016
455 2HZ LYS 53 2HZ LYS 53 -13.171 0.227 -0.470
456 3HZ LYS 53 3HZ LYS 53 -14.207 0.031 -1.792
457 H TYR 54 H TYR 54 -14.432 -7.700 0.000
458 HA TYR 54 HA TYR 54 -12.931 -9.889 -0.572
459 1HB TYR 54 2HB TYR 54 -10.899 -9.148 1.052
460 2HB TYR 54 1HB TYR 54 -10.821 -9.083 -0.700
461 HD1 TYR 54 1HD TYR 54 -12.523 -6.785 1.703
462 HD2 TYR 54 2HD TYR 54 -9.458 -7.280 -1.203
463 HE1 TYR 54 1HE TYR 54 -12.040 -4.378 1.814
464 HE2 TYR 54 2HE TYR 54 -8.964 -4.873 -1.098
465 HH TYR 54 HH TYR 54 -10.086 -2.789 -0.465
466 H GLY 55 H GLY 55 -14.184 -7.638 1.699
467 1HA GLY 55 2HA GLY 55 -14.928 -7.835 3.866
468 2HA GLY 55 1HA GLY 55 -15.462 -9.419 3.320
469 HA PRO 56 HA PRO 56 -12.832 -10.958 6.595
470 1HB PRO 56 2HB PRO 56 -12.678 -13.550 5.643
471 2HB PRO 56 1HB PRO 56 -13.983 -12.931 6.659
472 1HG PRO 56 2HG PRO 56 -13.898 -13.297 3.695
473 2HG PRO 56 1HG PRO 56 -15.231 -13.596 4.825
474 1HD PRO 56 2HD PRO 56 -15.162 -11.404 3.275
475 2HD PRO 56 1HD PRO 56 -15.810 -11.354 4.928
476 H GLU 57 H GLU 57 -12.243 -11.074 3.194
477 HA GLU 57 HA GLU 57 -9.487 -11.926 3.482
478 1HB GLU 57 2HB GLU 57 -11.422 -11.890 1.375
479 2HB GLU 57 1HB GLU 57 -10.000 -11.002 0.851
480 1HG GLU 57 2HG GLU 57 -9.713 -13.254 0.188
481 2HG GLU 57 1HG GLU 57 -8.619 -12.965 1.540
482 H ALA 58 H ALA 58 -11.292 -8.973 3.329
483 HA ALA 58 HA ALA 58 -9.716 -7.114 2.173
484 1HB ALA 58 1HB ALA 58 -11.832 -6.812 3.606
485 2HB ALA 58 2HB ALA 58 -10.654 -5.499 3.567
486 3HB ALA 58 3HB ALA 58 -10.711 -6.592 4.950
487 H SER 59 H SER 59 -9.002 -8.749 5.200
488 HA SER 59 HA SER 59 -6.664 -7.150 5.729
489 1HB SER 59 2HB SER 59 -7.376 -9.811 6.979
490 2HB SER 59 1HB SER 59 -6.335 -8.554 7.644
491 HG SER 59 HG SER 59 -9.106 -8.240 7.129
492 H ALA 60 H ALA 60 -7.384 -10.379 4.512
493 HA ALA 60 HA ALA 60 -4.870 -11.461 4.268
494 1HB ALA 60 1HB ALA 60 -6.426 -13.003 3.704
495 2HB ALA 60 2HB ALA 60 -6.001 -12.484 2.073
496 3HB ALA 60 3HB ALA 60 -7.441 -11.834 2.859
497 H PHE 61 H PHE 61 -6.500 -9.199 2.059
498 HA PHE 61 HA PHE 61 -4.951 -9.203 -0.154
499 1HB PHE 61 2HB PHE 61 -6.644 -7.608 -0.185
500 2HB PHE 61 1HB PHE 61 -6.202 -6.957 1.387
501 HD1 PHE 61 1HD PHE 61 -5.148 -4.920 1.465
502 HD2 PHE 61 2HD PHE 61 -4.816 -7.276 -2.062
503 HE1 PHE 61 1HE PHE 61 -3.919 -3.093 0.367
504 HE2 PHE 61 2HE PHE 61 -3.585 -5.454 -3.168
505 HZ PHE 61 HZ PHE 61 -3.135 -3.360 -1.953
506 H THR 62 H THR 62 -4.188 -7.153 2.658
507 HA THR 62 HA THR 62 -1.435 -6.912 1.755
508 HB THR 62 HB THR 62 -2.507 -5.788 4.329
509 HG1 THR 62 1HG THR 62 -3.358 -4.087 3.242
510 1HG2 THR 62 1HG2 THR 62 -0.520 -4.829 4.398
511 2HG2 THR 62 2HG2 THR 62 -0.952 -3.928 2.944
512 3HG2 THR 62 3HG2 THR 62 -0.104 -5.468 2.807
513 H LYS 63 H LYS 63 -3.184 -8.054 4.624
514 HA LYS 63 HA LYS 63 -1.258 -8.937 6.278
515 1HB LYS 63 2HB LYS 63 -3.654 -9.175 6.712
516 2HB LYS 63 1HB LYS 63 -3.737 -10.492 5.549
517 1HG LYS 63 2HG LYS 63 -2.301 -11.855 6.930
518 2HG LYS 63 1HG LYS 63 -2.083 -10.523 8.065
519 1HD LYS 63 2HD LYS 63 -4.777 -11.700 7.413
520 2HD LYS 63 1HD LYS 63 -3.767 -12.286 8.736
521 1HE LYS 63 2HE LYS 63 -3.897 -10.225 9.878
522 2HE LYS 63 1HE LYS 63 -4.543 -9.394 8.465
523 1HZ LYS 63 1HZ LYS 63 -6.519 -10.920 8.693
524 2HZ LYS 63 2HZ LYS 63 -6.351 -9.740 9.895
525 3HZ LYS 63 3HZ LYS 63 -5.918 -11.344 10.218
526 H LYS 64 H LYS 64 -2.037 -10.368 3.186
527 HA LYS 64 HA LYS 64 -0.426 -12.724 3.677
528 1HB LYS 64 2HB LYS 64 -2.576 -12.508 2.195
529 2HB LYS 64 1HB LYS 64 -1.450 -11.933 0.973
530 1HG LYS 64 2HG LYS 64 -0.555 -13.975 0.640
531 2HG LYS 64 1HG LYS 64 -0.698 -14.434 2.339
532 1HD LYS 64 2HD LYS 64 -2.781 -15.292 2.070
533 2HD LYS 64 1HD LYS 64 -3.226 -14.108 0.838
534 1HE LYS 64 2HE LYS 64 -1.433 -16.503 0.450
535 2HE LYS 64 1HE LYS 64 -3.097 -16.346 -0.113
536 1HZ LYS 64 1HZ LYS 64 -2.055 -15.702 -1.988
537 2HZ LYS 64 2HZ LYS 64 -0.655 -15.189 -1.190
538 3HZ LYS 64 3HZ LYS 64 -2.023 -14.195 -1.220
539 H MET 65 H MET 65 -0.207 -9.653 2.042
540 HA MET 65 HA MET 65 2.413 -10.304 0.932
541 1HB MET 65 2HB MET 65 0.356 -8.826 -0.070
542 2HB MET 65 1HB MET 65 1.371 -7.566 0.618
543 1HG MET 65 2HG MET 65 1.930 -7.887 -1.695
544 2HG MET 65 1HG MET 65 3.273 -8.413 -0.683
545 1HE MET 65 1HE MET 65 0.319 -11.340 -2.686
546 2HE MET 65 2HE MET 65 0.184 -9.586 -2.808
547 3HE MET 65 3HE MET 65 -0.080 -10.385 -1.259
548 H VAL 66 H VAL 66 1.286 -9.286 3.847
549 HA VAL 66 HA VAL 66 3.689 -7.662 4.359
550 HB VAL 66 HB VAL 66 1.727 -6.253 4.481
551 1HG1 VAL 66 1HG1 VAL 66 0.510 -7.456 6.831
552 2HG1 VAL 66 2HG1 VAL 66 0.415 -8.478 5.401
553 3HG1 VAL 66 3HG1 VAL 66 -0.235 -6.841 5.357
554 1HG2 VAL 66 1HG2 VAL 66 2.416 -5.143 6.307
555 2HG2 VAL 66 2HG2 VAL 66 3.652 -6.398 6.380
556 3HG2 VAL 66 3HG2 VAL 66 2.193 -6.538 7.361
557 H GLU 67 H GLU 67 1.374 -9.962 5.762
558 HA GLU 67 HA GLU 67 3.180 -10.425 8.006
559 1HB GLU 67 2HB GLU 67 0.433 -10.321 7.835
560 2HB GLU 67 1HB GLU 67 0.750 -12.048 7.900
561 1HG GLU 67 2HG GLU 67 0.446 -11.377 10.122
562 2HG GLU 67 1HG GLU 67 2.186 -11.575 9.923
563 H ASN 68 H ASN 68 1.417 -12.386 5.615
564 HA ASN 68 HA ASN 68 3.135 -14.662 6.163
565 1HB ASN 68 2HB ASN 68 0.578 -14.206 4.763
566 2HB ASN 68 1HB ASN 68 1.602 -15.457 4.065
567 1HD2 ASN 68 1HD2 ASN 68 -0.946 -15.766 5.362
568 2HD2 ASN 68 2HD2 ASN 68 -0.691 -16.802 6.720
569 H ALA 69 H ALA 69 3.679 -11.988 4.459
570 HA ALA 69 HA ALA 69 4.825 -13.313 2.114
571 1HB ALA 69 1HB ALA 69 3.435 -10.972 2.381
572 2HB ALA 69 2HB ALA 69 4.418 -11.431 0.989
573 3HB ALA 69 3HB ALA 69 5.106 -10.417 2.261
574 H LYS 70 H LYS 70 6.957 -12.237 1.366
575 HA LYS 70 HA LYS 70 8.853 -12.563 3.547
576 1HB LYS 70 2HB LYS 70 8.887 -12.905 0.657
577 2HB LYS 70 1HB LYS 70 10.297 -12.027 1.229
578 1HG LYS 70 2HG LYS 70 9.578 -14.449 2.749
579 2HG LYS 70 1HG LYS 70 10.159 -14.700 1.102
580 1HD LYS 70 2HD LYS 70 12.081 -13.133 1.741
581 2HD LYS 70 1HD LYS 70 11.564 -13.383 3.409
582 1HE LYS 70 2HE LYS 70 12.240 -15.561 3.438
583 2HE LYS 70 1HE LYS 70 11.950 -15.787 1.713
584 1HZ LYS 70 1HZ LYS 70 14.373 -15.559 2.779
585 2HZ LYS 70 2HZ LYS 70 14.077 -13.938 2.406
586 3HZ LYS 70 3HZ LYS 70 14.014 -15.109 1.188
587 H LYS 71 H LYS 71 8.667 -10.267 0.817
588 HA LYS 71 HA LYS 71 8.778 -7.976 2.506
589 1HB LYS 71 2HB LYS 71 10.998 -7.178 1.935
590 2HB LYS 71 1HB LYS 71 11.111 -8.743 2.729
591 1HG LYS 71 2HG LYS 71 10.965 -8.862 -0.198
592 2HG LYS 71 1HG LYS 71 12.403 -8.069 0.447
593 1HD LYS 71 2HD LYS 71 13.216 -9.982 1.357
594 2HD LYS 71 1HD LYS 71 11.610 -10.611 1.731
595 1HE LYS 71 2HE LYS 71 12.915 -11.851 -0.047
596 2HE LYS 71 1HE LYS 71 11.278 -11.358 -0.479
597 1HZ LYS 71 1HZ LYS 71 13.156 -10.948 -2.147
598 2HZ LYS 71 2HZ LYS 71 13.590 -9.653 -1.148
599 3HZ LYS 71 3HZ LYS 71 12.058 -9.692 -1.865
600 H ILE 72 H ILE 72 9.624 -6.017 0.974
601 HA ILE 72 HA ILE 72 8.580 -6.371 -1.734
602 HB ILE 72 HB ILE 72 7.584 -4.156 0.061
603 1HG1 ILE 72 2HG1 ILE 72 5.362 -5.556 -0.426
604 2HG1 ILE 72 1HG1 ILE 72 6.520 -6.880 -0.500
605 1HG2 ILE 72 1HG2 ILE 72 7.685 -4.283 -2.688
606 2HG2 ILE 72 2HG2 ILE 72 6.625 -3.248 -1.738
607 3HG2 ILE 72 3HG2 ILE 72 6.044 -4.807 -2.319
608 1HD1 ILE 72 1HD1 ILE 72 5.617 -6.718 1.715
609 2HD1 ILE 72 2HD1 ILE 72 6.068 -5.015 1.814
610 3HD1 ILE 72 3HD1 ILE 72 7.318 -6.256 1.748
611 H GLU 73 H GLU 73 9.384 -4.910 -3.229
612 HA GLU 73 HA GLU 73 11.526 -3.145 -2.243
613 1HB GLU 73 2HB GLU 73 12.582 -3.435 -4.462
614 2HB GLU 73 1HB GLU 73 12.422 -4.954 -3.590
615 1HG GLU 73 2HG GLU 73 10.332 -5.371 -4.920
616 2HG GLU 73 1HG GLU 73 10.772 -3.974 -5.901
617 H VAL 74 H VAL 74 11.445 -1.023 -2.747
618 HA VAL 74 HA VAL 74 9.118 -0.106 -4.259
619 HB VAL 74 HB VAL 74 9.850 2.179 -3.394
620 1HG1 VAL 74 1HG1 VAL 74 8.730 -0.072 -1.837
621 2HG1 VAL 74 2HG1 VAL 74 8.010 1.478 -2.271
622 3HG1 VAL 74 3HG1 VAL 74 9.163 1.384 -0.940
623 1HG2 VAL 74 1HG2 VAL 74 11.448 2.377 -1.729
624 2HG2 VAL 74 2HG2 VAL 74 12.184 1.207 -2.823
625 3HG2 VAL 74 3HG2 VAL 74 11.405 0.656 -1.341
626 H GLU 75 H GLU 75 9.319 0.398 -6.316
627 HA GLU 75 HA GLU 75 11.965 0.969 -7.414
628 1HB GLU 75 2HB GLU 75 10.055 -0.643 -8.360
629 2HB GLU 75 1HB GLU 75 9.566 0.842 -9.163
630 1HG GLU 75 2HG GLU 75 11.943 1.023 -9.994
631 2HG GLU 75 1HG GLU 75 12.175 -0.624 -9.409
632 H PHE 76 H PHE 76 12.062 3.101 -6.421
633 HA PHE 76 HA PHE 76 11.363 5.143 -8.242
634 1HB PHE 76 2HB PHE 76 9.712 6.375 -7.067
635 2HB PHE 76 1HB PHE 76 9.137 4.713 -7.097
636 HD1 PHE 76 1HD PHE 76 8.575 3.620 -5.119
637 HD2 PHE 76 2HD PHE 76 10.886 7.191 -4.956
638 HE1 PHE 76 1HE PHE 76 8.324 3.669 -2.671
639 HE2 PHE 76 2HE PHE 76 10.641 7.242 -2.509
640 HZ PHE 76 HZ PHE 76 9.359 5.480 -1.363
641 H ASP 77 H ASP 77 12.650 6.892 -7.962
642 HA ASP 77 HA ASP 77 14.808 6.715 -6.161
643 1HB ASP 77 2HB ASP 77 15.227 9.137 -6.906
644 2HB ASP 77 1HB ASP 77 15.258 7.886 -8.144
645 H LYS 78 H LYS 78 12.217 9.186 -6.246
646 HA LYS 78 HA LYS 78 11.559 9.102 -3.560
647 1HB LYS 78 2HB LYS 78 14.124 10.077 -3.769
648 2HB LYS 78 1HB LYS 78 13.169 11.551 -3.710
649 1HG LYS 78 2HG LYS 78 12.048 10.563 -1.657
650 2HG LYS 78 1HG LYS 78 13.340 9.362 -1.667
651 1HD LYS 78 2HD LYS 78 14.012 11.100 -0.186
652 2HD LYS 78 1HD LYS 78 14.977 11.269 -1.654
653 1HE LYS 78 2HE LYS 78 12.823 12.831 -2.233
654 2HE LYS 78 1HE LYS 78 12.968 13.066 -0.492
655 1HZ LYS 78 1HZ LYS 78 14.300 14.708 -1.467
656 2HZ LYS 78 2HZ LYS 78 14.983 13.637 -2.584
657 3HZ LYS 78 3HZ LYS 78 15.397 13.529 -0.947
658 H GLY 79 H GLY 79 11.969 11.034 -6.445
659 1HA GLY 79 2HA GLY 79 10.552 13.300 -6.037
660 2HA GLY 79 1HA GLY 79 10.435 12.379 -7.526
661 H GLN 80 H GLN 80 8.535 13.954 -5.643
662 HA GLN 80 HA GLN 80 6.592 12.100 -4.738
663 1HB GLN 80 2HB GLN 80 7.021 14.757 -4.351
664 2HB GLN 80 1HB GLN 80 5.657 14.803 -5.459
665 1HG GLN 80 2HG GLN 80 4.253 14.311 -3.827
666 2HG GLN 80 1HG GLN 80 5.164 12.855 -3.428
667 1HE2 GLN 80 1HE2 GLN 80 3.950 15.523 -2.116
668 2HE2 GLN 80 2HE2 GLN 80 5.088 15.811 -0.849
669 H ARG 81 H ARG 81 4.695 11.394 -5.654
670 HA ARG 81 HA ARG 81 4.412 11.896 -8.542
671 1HB ARG 81 2HB ARG 81 4.933 9.516 -7.551
672 2HB ARG 81 1HB ARG 81 3.208 9.505 -7.208
673 1HG ARG 81 2HG ARG 81 4.366 10.020 -9.936
674 2HG ARG 81 1HG ARG 81 3.864 8.429 -9.361
675 1HD ARG 81 2HD ARG 81 1.853 8.940 -10.189
676 2HD ARG 81 1HD ARG 81 1.683 9.996 -8.787
677 HE ARG 81 HE ARG 81 1.907 11.813 -10.168
678 1HH1 ARG 81 1HH1 ARG 81 2.898 8.946 -11.893
679 2HH1 ARG 81 2HH1 ARG 81 3.021 9.754 -13.419
680 1HH2 ARG 81 1HH2 ARG 81 2.068 12.879 -12.174
681 2HH2 ARG 81 2HH2 ARG 81 2.551 11.988 -13.579
682 H THR 82 H THR 82 2.737 11.670 -5.466
683 HA THR 82 HA THR 82 0.346 12.808 -6.762
684 HB THR 82 HB THR 82 -0.830 11.747 -4.679
685 HG1 THR 82 1HG THR 82 0.358 10.467 -3.547
686 1HG2 THR 82 1HG2 THR 82 0.107 9.764 -6.714
687 2HG2 THR 82 2HG2 THR 82 -1.038 11.042 -7.122
688 3HG2 THR 82 3HG2 THR 82 -1.445 9.856 -5.881
689 H ASP 83 H ASP 83 -0.753 14.443 -5.674
690 HA ASP 83 HA ASP 83 0.887 15.935 -3.794
691 1HB ASP 83 2HB ASP 83 -0.302 16.937 -5.836
692 2HB ASP 83 1HB ASP 83 -1.782 16.803 -4.890
693 H LYS 84 H LYS 84 -1.600 13.684 -3.622
694 HA LYS 84 HA LYS 84 -3.316 14.558 -1.662
695 1HB LYS 84 2HB LYS 84 -3.322 12.071 -0.943
696 2HB LYS 84 1HB LYS 84 -3.843 12.482 -2.571
697 1HG LYS 84 2HG LYS 84 -2.295 11.168 -3.446
698 2HG LYS 84 1HG LYS 84 -1.021 12.016 -2.567
699 1HD LYS 84 2HD LYS 84 -0.729 9.997 -1.597
700 2HD LYS 84 1HD LYS 84 -2.060 10.537 -0.571
701 1HE LYS 84 2HE LYS 84 -3.371 9.466 -2.727
702 2HE LYS 84 1HE LYS 84 -1.969 8.407 -2.571
703 1HZ LYS 84 1HZ LYS 84 -3.592 7.460 -1.217
704 2HZ LYS 84 2HZ LYS 84 -4.088 8.948 -0.584
705 3HZ LYS 84 3HZ LYS 84 -2.599 8.291 -0.127
706 H TYR 85 H TYR 85 0.025 13.651 -1.355
707 HA TYR 85 HA TYR 85 0.342 14.856 1.152
708 1HB TYR 85 2HB TYR 85 -0.975 12.923 1.951
709 2HB TYR 85 1HB TYR 85 0.226 11.834 1.269
710 HD1 TYR 85 1HD TYR 85 1.671 10.903 2.797
711 HD2 TYR 85 2HD TYR 85 0.213 14.837 3.508
712 HE1 TYR 85 1HE TYR 85 2.942 10.988 4.899
713 HE2 TYR 85 2HE TYR 85 1.483 14.932 5.612
714 HH TYR 85 HH TYR 85 2.393 12.973 7.303
715 H GLY 86 H GLY 86 1.455 12.370 -1.081
716 1HA GLY 86 2HA GLY 86 3.594 12.686 -2.174
717 2HA GLY 86 1HA GLY 86 4.203 13.356 -0.671
718 H ARG 87 H ARG 87 2.478 10.953 0.490
719 HA ARG 87 HA ARG 87 4.544 8.902 0.053
720 1HB ARG 87 2HB ARG 87 3.429 9.973 2.614
721 2HB ARG 87 1HB ARG 87 3.929 8.289 2.538
722 1HG ARG 87 2HG ARG 87 6.103 8.804 2.567
723 2HG ARG 87 1HG ARG 87 5.898 10.158 1.453
724 1HD ARG 87 2HD ARG 87 5.717 11.658 3.118
725 2HD ARG 87 1HD ARG 87 4.745 10.580 4.117
726 HE ARG 87 HE ARG 87 7.508 9.814 3.959
727 1HH1 ARG 87 1HH1 ARG 87 5.195 11.831 5.623
728 2HH1 ARG 87 2HH1 ARG 87 6.145 11.942 7.067
729 1HH2 ARG 87 1HH2 ARG 87 8.756 9.958 5.859
730 2HH2 ARG 87 2HH2 ARG 87 8.166 10.879 7.201
731 H GLY 88 H GLY 88 1.310 9.658 -0.202
732 1HA GLY 88 2HA GLY 88 0.136 7.189 0.613
733 2HA GLY 88 1HA GLY 88 -0.623 8.424 -0.379
734 H LEU 89 H LEU 89 0.030 8.487 -2.683
735 HA LEU 89 HA LEU 89 -0.105 5.857 -3.794
736 1HB LEU 89 2HB LEU 89 -0.622 8.507 -4.661
737 2HB LEU 89 1HB LEU 89 0.543 7.818 -5.776
738 HG LEU 89 HG LEU 89 -1.721 7.478 -6.587
739 1HD1 LEU 89 1HD1 LEU 89 -1.626 4.812 -6.373
740 2HD1 LEU 89 2HD1 LEU 89 0.009 5.205 -5.839
741 3HD1 LEU 89 3HD1 LEU 89 -0.551 5.734 -7.424
742 1HD2 LEU 89 1HD2 LEU 89 -2.982 5.641 -5.105
743 2HD2 LEU 89 2HD2 LEU 89 -3.233 7.374 -4.905
744 3HD2 LEU 89 3HD2 LEU 89 -2.138 6.512 -3.825
745 H ALA 90 H ALA 90 1.618 4.575 -3.845
746 HA ALA 90 HA ALA 90 4.088 5.594 -5.025
747 1HB ALA 90 1HB ALA 90 4.928 5.803 -2.934
748 2HB ALA 90 2HB ALA 90 5.202 4.072 -3.122
749 3HB ALA 90 3HB ALA 90 3.789 4.650 -2.241
750 H TYR 91 H TYR 91 5.177 4.115 -6.242
751 HA TYR 91 HA TYR 91 3.775 1.727 -6.965
752 1HB TYR 91 2HB TYR 91 6.479 2.782 -7.814
753 2HB TYR 91 1HB TYR 91 5.687 1.381 -8.527
754 HD1 TYR 91 1HD TYR 91 3.900 1.639 -10.100
755 HD2 TYR 91 2HD TYR 91 5.537 5.043 -8.142
756 HE1 TYR 91 1HE TYR 91 2.721 3.108 -11.682
757 HE2 TYR 91 2HE TYR 91 4.362 6.521 -9.718
758 HH TYR 91 HH TYR 91 1.953 5.961 -11.319
759 H ILE 92 H ILE 92 3.842 -0.065 -5.791
760 HA ILE 92 HA ILE 92 6.323 -0.718 -4.344
761 HB ILE 92 HB ILE 92 4.839 -2.280 -3.018
762 1HG1 ILE 92 2HG1 ILE 92 2.486 -0.630 -3.727
763 2HG1 ILE 92 1HG1 ILE 92 2.986 -1.808 -4.937
764 1HG2 ILE 92 1HG2 ILE 92 4.182 -0.588 -1.496
765 2HG2 ILE 92 2HG2 ILE 92 4.067 0.617 -2.779
766 3HG2 ILE 92 3HG2 ILE 92 5.644 -0.006 -2.294
767 1HD1 ILE 92 1HD1 ILE 92 1.971 -3.408 -3.805
768 2HD1 ILE 92 2HD1 ILE 92 1.457 -2.223 -2.604
769 3HD1 ILE 92 3HD1 ILE 92 2.983 -3.080 -2.400
770 H TYR 93 H TYR 93 6.978 -2.954 -4.257
771 HA TYR 93 HA TYR 93 5.871 -4.695 -6.328
772 1HB TYR 93 2HB TYR 93 8.783 -3.902 -6.144
773 2HB TYR 93 1HB TYR 93 8.179 -5.229 -7.130
774 HD1 TYR 93 1HD TYR 93 8.147 -1.562 -6.696
775 HD2 TYR 93 2HD TYR 93 7.139 -4.824 -9.236
776 HE1 TYR 93 1HE TYR 93 7.724 0.010 -8.540
777 HE2 TYR 93 2HE TYR 93 6.715 -3.260 -11.086
778 HH TYR 93 HH TYR 93 6.459 0.102 -10.630
779 H ALA 94 H ALA 94 5.072 -5.883 -4.523
780 HA ALA 94 HA ALA 94 6.908 -7.005 -2.609
781 1HB ALA 94 1HB ALA 94 4.552 -6.434 -2.057
782 2HB ALA 94 2HB ALA 94 4.992 -8.094 -1.659
783 3HB ALA 94 3HB ALA 94 4.030 -7.757 -3.099
784 H ASP 95 H ASP 95 8.312 -8.484 -3.319
785 HA ASP 95 HA ASP 95 9.144 -10.424 -4.167
786 1HB ASP 95 2HB ASP 95 6.836 -11.190 -3.040
787 2HB ASP 95 1HB ASP 95 6.455 -11.573 -4.716
788 H GLY 96 H GLY 96 8.836 -8.287 -5.909
789 1HA GLY 96 2HA GLY 96 9.052 -7.864 -8.159
790 2HA GLY 96 1HA GLY 96 9.027 -9.602 -8.419
791 H LYS 97 H LYS 97 6.370 -8.180 -6.731
792 HA LYS 97 HA LYS 97 4.769 -7.735 -9.082
793 1HB LYS 97 2HB LYS 97 3.068 -9.450 -8.488
794 2HB LYS 97 1HB LYS 97 4.601 -10.138 -9.007
795 1HG LYS 97 2HG LYS 97 5.194 -10.724 -6.792
796 2HG LYS 97 1HG LYS 97 3.868 -9.775 -6.117
797 1HD LYS 97 2HD LYS 97 2.561 -11.482 -7.814
798 2HD LYS 97 1HD LYS 97 3.875 -12.490 -7.204
799 1HE LYS 97 2HE LYS 97 2.008 -12.772 -5.747
800 2HE LYS 97 1HE LYS 97 3.215 -11.813 -4.892
801 1HZ LYS 97 1HZ LYS 97 0.953 -10.585 -6.357
802 2HZ LYS 97 2HZ LYS 97 1.970 -9.861 -5.216
803 3HZ LYS 97 3HZ LYS 97 0.846 -11.026 -4.727
804 H MET 98 H MET 98 2.652 -6.891 -8.584
805 HA MET 98 HA MET 98 2.687 -5.268 -6.214
806 1HB MET 98 2HB MET 98 1.364 -5.237 -8.752
807 2HB MET 98 1HB MET 98 0.155 -5.106 -7.484
808 1HG MET 98 2HG MET 98 2.297 -3.381 -6.812
809 2HG MET 98 1HG MET 98 1.895 -3.109 -8.506
810 1HE MET 98 1HE MET 98 -1.876 -2.170 -8.348
811 2HE MET 98 2HE MET 98 -0.983 -3.594 -8.881
812 3HE MET 98 3HE MET 98 -0.422 -1.983 -9.328
813 H VAL 99 H VAL 99 0.672 -5.077 -4.853
814 HA VAL 99 HA VAL 99 0.017 -7.706 -3.832
815 HB VAL 99 HB VAL 99 -0.976 -5.045 -2.809
816 1HG1 VAL 99 1HG1 VAL 99 -1.352 -6.207 -0.742
817 2HG1 VAL 99 2HG1 VAL 99 -0.616 -7.677 -1.384
818 3HG1 VAL 99 3HG1 VAL 99 -2.148 -7.096 -2.040
819 1HG2 VAL 99 1HG2 VAL 99 1.693 -5.982 -2.880
820 2HG2 VAL 99 2HG2 VAL 99 1.134 -6.111 -1.212
821 3HG2 VAL 99 3HG2 VAL 99 1.054 -4.562 -2.051
822 H ASN 100 H ASN 100 -1.593 -5.051 -5.479
823 HA ASN 100 HA ASN 100 -4.248 -5.846 -5.141
824 1HB ASN 100 2HB ASN 100 -2.890 -4.350 -7.385
825 2HB ASN 100 1HB ASN 100 -4.634 -4.589 -7.312
826 1HD2 ASN 100 1HD2 ASN 100 -5.802 -3.633 -5.591
827 2HD2 ASN 100 2HD2 ASN 100 -5.177 -2.256 -4.757
828 H GLU 101 H GLU 101 -1.752 -7.081 -7.220
829 HA GLU 101 HA GLU 101 -3.471 -8.486 -9.010
830 1HB GLU 101 2HB GLU 101 -0.569 -8.290 -8.515
831 2HB GLU 101 1HB GLU 101 -1.110 -9.819 -9.195
832 1HG GLU 101 2HG GLU 101 -2.407 -7.808 -10.660
833 2HG GLU 101 1HG GLU 101 -0.731 -7.290 -10.480
834 H ALA 102 H ALA 102 -2.379 -9.088 -5.819
835 HA ALA 102 HA ALA 102 -2.536 -11.945 -5.918
836 1HB ALA 102 1HB ALA 102 -1.110 -11.134 -4.263
837 2HB ALA 102 2HB ALA 102 -2.536 -11.662 -3.369
838 3HB ALA 102 3HB ALA 102 -2.286 -9.947 -3.698
839 H LEU 103 H LEU 103 -4.435 -9.788 -3.821
840 HA LEU 103 HA LEU 103 -6.685 -11.635 -4.037
841 1HB LEU 103 2HB LEU 103 -5.707 -10.701 -1.846
842 2HB LEU 103 1HB LEU 103 -6.555 -9.223 -2.259
843 HG LEU 103 HG LEU 103 -7.898 -11.906 -1.929
844 1HD1 LEU 103 1HD1 LEU 103 -8.561 -9.942 0.063
845 2HD1 LEU 103 2HD1 LEU 103 -6.826 -10.256 0.060
846 3HD1 LEU 103 3HD1 LEU 103 -7.963 -11.588 0.266
847 1HD2 LEU 103 1HD2 LEU 103 -9.935 -10.452 -1.760
848 2HD2 LEU 103 2HD2 LEU 103 -9.187 -10.507 -3.356
849 3HD2 LEU 103 3HD2 LEU 103 -8.937 -9.107 -2.315
850 H VAL 104 H VAL 104 -6.217 -8.102 -4.108
851 HA VAL 104 HA VAL 104 -8.711 -7.304 -4.886
852 HB VAL 104 HB VAL 104 -6.200 -6.067 -6.007
853 1HG1 VAL 104 1HG1 VAL 104 -8.814 -5.410 -6.434
854 2HG1 VAL 104 2HG1 VAL 104 -7.455 -4.295 -6.561
855 3HG1 VAL 104 3HG1 VAL 104 -8.396 -4.373 -5.072
856 1HG2 VAL 104 1HG2 VAL 104 -7.308 -6.054 -3.235
857 2HG2 VAL 104 2HG2 VAL 104 -6.508 -4.608 -3.854
858 3HG2 VAL 104 3HG2 VAL 104 -5.633 -6.137 -3.776
859 H ARG 105 H ARG 105 -6.338 -8.930 -6.839
860 HA ARG 105 HA ARG 105 -7.488 -8.256 -9.366
861 1HB ARG 105 2HB ARG 105 -5.138 -9.473 -8.505
862 2HB ARG 105 1HB ARG 105 -5.996 -10.748 -9.357
863 1HG ARG 105 2HG ARG 105 -5.690 -8.050 -10.601
864 2HG ARG 105 1HG ARG 105 -4.369 -9.218 -10.655
865 1HD ARG 105 2HD ARG 105 -6.001 -10.865 -11.620
866 2HD ARG 105 1HD ARG 105 -7.158 -9.541 -11.750
867 HE ARG 105 HE ARG 105 -4.998 -8.577 -13.046
868 1HH1 ARG 105 1HH1 ARG 105 -6.775 -11.570 -13.314
869 2HH1 ARG 105 2HH1 ARG 105 -6.435 -11.765 -14.999
870 1HH2 ARG 105 1HH2 ARG 105 -4.552 -8.832 -15.263
871 2HH2 ARG 105 2HH2 ARG 105 -5.172 -10.211 -16.107
872 H GLN 106 H GLN 106 -8.363 -10.430 -6.902
873 HA GLN 106 HA GLN 106 -9.598 -12.417 -8.550
874 1HB GLN 106 2HB GLN 106 -8.758 -12.574 -6.082
875 2HB GLN 106 1HB GLN 106 -10.354 -11.949 -5.690
876 1HG GLN 106 2HG GLN 106 -10.643 -14.231 -5.539
877 2HG GLN 106 1HG GLN 106 -11.226 -13.872 -7.163
878 1HE2 GLN 106 1HE2 GLN 106 -9.935 -16.264 -5.777
879 2HE2 GLN 106 2HE2 GLN 106 -8.697 -16.755 -6.877
880 H GLY 107 H GLY 107 -10.418 -9.297 -8.275
881 1HA GLY 107 2HA GLY 107 -12.394 -8.432 -9.247
882 2HA GLY 107 1HA GLY 107 -13.234 -9.900 -8.782
883 H LEU 108 H LEU 108 -11.422 -8.877 -6.162
884 HA LEU 108 HA LEU 108 -11.908 -7.880 -4.208
885 1HB LEU 108 2HB LEU 108 -13.382 -6.220 -6.187
886 2HB LEU 108 1HB LEU 108 -13.779 -5.996 -4.500
887 HG LEU 108 HG LEU 108 -11.095 -5.584 -5.811
888 1HD1 LEU 108 1HD1 LEU 108 -13.280 -3.837 -4.870
889 2HD1 LEU 108 2HD1 LEU 108 -12.124 -3.610 -6.184
890 3HD1 LEU 108 3HD1 LEU 108 -11.635 -3.306 -4.517
891 1HD2 LEU 108 1HD2 LEU 108 -11.827 -5.547 -2.887
892 2HD2 LEU 108 2HD2 LEU 108 -10.354 -4.839 -3.542
893 3HD2 LEU 108 3HD2 LEU 108 -10.633 -6.573 -3.680
894 H ALA 109 H ALA 109 -12.761 -9.991 -3.687
895 HA ALA 109 HA ALA 109 -15.221 -9.933 -2.376
896 1HB ALA 109 1HB ALA 109 -16.557 -11.447 -3.808
897 2HB ALA 109 2HB ALA 109 -15.335 -11.294 -5.068
898 3HB ALA 109 3HB ALA 109 -16.262 -9.881 -4.563
899 H LYS 110 H LYS 110 -14.348 -11.110 -0.735
900 HA LYS 110 HA LYS 110 -14.022 -13.926 -1.094
901 1HB LYS 110 2HB LYS 110 -11.602 -12.184 -0.758
902 2HB LYS 110 1HB LYS 110 -11.618 -13.808 -0.084
903 1HG LYS 110 2HG LYS 110 -12.485 -14.268 -2.622
904 2HG LYS 110 1HG LYS 110 -11.371 -12.920 -2.863
905 1HD LYS 110 2HD LYS 110 -10.110 -14.703 -1.079
906 2HD LYS 110 1HD LYS 110 -10.795 -15.687 -2.374
907 1HE LYS 110 2HE LYS 110 -9.464 -14.751 -3.977
908 2HE LYS 110 1HE LYS 110 -9.338 -13.210 -3.129
909 1HZ LYS 110 1HZ LYS 110 -7.556 -13.897 -1.967
910 2HZ LYS 110 2HZ LYS 110 -7.369 -14.990 -3.243
911 3HZ LYS 110 3HZ LYS 110 -8.112 -15.486 -1.807
Start of MODEL 10
1 1H ALA 1 1HT ALA 1 17.447 13.099 -27.448
2 2H ALA 1 2HT ALA 1 18.285 13.027 -28.945
3 3H ALA 1 3HT ALA 1 18.560 14.333 -27.866
4 HA ALA 1 HA ALA 1 19.390 11.539 -27.668
5 1HB ALA 1 1HB ALA 1 20.681 13.703 -28.598
6 2HB ALA 1 2HB ALA 1 21.493 12.348 -27.810
7 3HB ALA 1 3HB ALA 1 21.113 13.805 -26.890
8 H THR 2 H THR 2 17.439 11.724 -25.968
9 HA THR 2 HA THR 2 18.758 12.069 -23.370
10 HB THR 2 HB THR 2 16.577 12.949 -22.465
11 HG1 THR 2 1HG THR 2 15.996 13.144 -25.230
12 1HG2 THR 2 1HG2 THR 2 18.345 14.531 -22.852
13 2HG2 THR 2 2HG2 THR 2 16.805 15.233 -23.344
14 3HG2 THR 2 3HG2 THR 2 17.929 14.628 -24.562
15 H SER 3 H SER 3 18.552 10.344 -22.099
16 HA SER 3 HA SER 3 16.681 8.242 -22.910
17 1HB SER 3 2HB SER 3 18.902 7.415 -22.715
18 2HB SER 3 1HB SER 3 19.150 8.231 -21.172
19 HG SER 3 HG SER 3 18.720 5.973 -20.953
20 H THR 4 H THR 4 15.308 7.212 -21.413
21 HA THR 4 HA THR 4 14.021 8.925 -19.591
22 HB THR 4 HB THR 4 12.738 7.181 -20.566
23 HG1 THR 4 1HG THR 4 12.140 7.555 -18.433
24 1HG2 THR 4 1HG2 THR 4 13.194 4.771 -19.966
25 2HG2 THR 4 2HG2 THR 4 14.801 5.300 -19.473
26 3HG2 THR 4 3HG2 THR 4 14.279 5.508 -21.145
27 H LYS 5 H LYS 5 13.988 8.991 -17.352
28 HA LYS 5 HA LYS 5 16.416 7.991 -16.072
29 1HB LYS 5 2HB LYS 5 14.861 10.367 -15.841
30 2HB LYS 5 1HB LYS 5 14.823 9.548 -14.286
31 1HG LYS 5 2HG LYS 5 17.413 9.973 -15.721
32 2HG LYS 5 1HG LYS 5 16.687 11.260 -14.756
33 1HD LYS 5 2HD LYS 5 17.136 8.498 -13.655
34 2HD LYS 5 1HD LYS 5 18.385 9.744 -13.598
35 1HE LYS 5 2HE LYS 5 16.890 11.204 -12.347
36 2HE LYS 5 1HE LYS 5 15.612 9.993 -12.436
37 1HZ LYS 5 1HZ LYS 5 17.570 8.560 -11.356
38 2HZ LYS 5 2HZ LYS 5 16.438 9.419 -10.440
39 3HZ LYS 5 3HZ LYS 5 17.964 10.085 -10.737
40 H LYS 6 H LYS 6 16.212 5.979 -15.313
41 HA LYS 6 HA LYS 6 13.699 5.185 -14.029
42 1HB LYS 6 2HB LYS 6 15.518 3.846 -15.742
43 2HB LYS 6 1HB LYS 6 15.600 3.041 -14.181
44 1HG LYS 6 2HG LYS 6 12.931 3.258 -14.463
45 2HG LYS 6 1HG LYS 6 13.420 3.137 -16.154
46 1HD LYS 6 2HD LYS 6 14.889 1.211 -14.659
47 2HD LYS 6 1HD LYS 6 13.186 1.066 -14.223
48 1HE LYS 6 2HE LYS 6 13.332 -0.336 -16.051
49 2HE LYS 6 1HE LYS 6 12.793 1.170 -16.790
50 1HZ LYS 6 1HZ LYS 6 15.231 1.620 -17.201
51 2HZ LYS 6 2HZ LYS 6 14.529 0.394 -18.131
52 3HZ LYS 6 3HZ LYS 6 15.509 -0.002 -16.810
53 H LEU 7 H LEU 7 13.548 4.848 -11.897
54 HA LEU 7 HA LEU 7 15.748 5.582 -10.208
55 1HB LEU 7 2HB LEU 7 12.878 5.092 -9.912
56 2HB LEU 7 1HB LEU 7 13.821 4.545 -8.539
57 HG LEU 7 HG LEU 7 12.953 6.842 -8.263
58 1HD1 LEU 7 1HD1 LEU 7 15.821 6.141 -8.185
59 2HD1 LEU 7 2HD1 LEU 7 14.739 6.653 -6.889
60 3HD1 LEU 7 3HD1 LEU 7 15.415 7.847 -7.996
61 1HD2 LEU 7 1HD2 LEU 7 14.545 7.277 -10.760
62 2HD2 LEU 7 2HD2 LEU 7 14.291 8.595 -9.616
63 3HD2 LEU 7 3HD2 LEU 7 12.906 7.805 -10.370
64 H HIS 8 H HIS 8 16.797 4.294 -8.670
65 HA HIS 8 HA HIS 8 17.276 1.600 -9.505
66 1HB HIS 8 2HB HIS 8 18.756 1.560 -7.439
67 2HB HIS 8 1HB HIS 8 19.152 2.777 -8.649
68 HD1 HIS 8 1HD HIS 8 19.862 4.839 -7.507
69 HD2 HIS 8 2HD HIS 8 16.740 2.971 -5.500
70 HE1 HIS 8 1HE HIS 8 19.328 6.333 -5.554
71 HE2 HIS 8 2HE HIS 8 17.368 5.233 -4.415
72 H LYS 9 H LYS 9 16.987 -0.304 -8.247
73 HA LYS 9 HA LYS 9 14.575 -0.193 -6.594
74 1HB LYS 9 2HB LYS 9 15.915 -2.334 -8.197
75 2HB LYS 9 1HB LYS 9 14.847 -2.789 -6.877
76 1HG LYS 9 2HG LYS 9 12.993 -2.200 -7.997
77 2HG LYS 9 1HG LYS 9 13.755 -0.784 -8.724
78 1HD LYS 9 2HD LYS 9 14.784 -3.369 -9.671
79 2HD LYS 9 1HD LYS 9 13.095 -3.048 -10.076
80 1HE LYS 9 2HE LYS 9 14.723 -0.711 -10.530
81 2HE LYS 9 1HE LYS 9 15.372 -2.101 -11.397
82 1HZ LYS 9 1HZ LYS 9 13.608 -2.181 -12.767
83 2HZ LYS 9 2HZ LYS 9 13.431 -0.553 -12.344
84 3HZ LYS 9 3HZ LYS 9 12.498 -1.733 -11.571
85 H GLU 10 H GLU 10 14.626 -0.491 -4.469
86 HA GLU 10 HA GLU 10 16.958 -1.816 -3.267
87 1HB GLU 10 2HB GLU 10 16.467 0.925 -3.113
88 2HB GLU 10 1HB GLU 10 15.885 0.295 -1.579
89 1HG GLU 10 2HG GLU 10 17.964 -0.373 -0.903
90 2HG GLU 10 1HG GLU 10 18.557 -0.572 -2.551
91 HA PRO 11 HA PRO 11 14.030 -4.265 -1.063
92 1HB PRO 11 2HB PRO 11 15.322 -4.441 1.382
93 2HB PRO 11 1HB PRO 11 15.656 -5.465 -0.018
94 1HG PRO 11 2HG PRO 11 17.106 -3.038 0.944
95 2HG PRO 11 1HG PRO 11 17.759 -4.539 0.264
96 1HD PRO 11 2HD PRO 11 17.594 -2.299 -1.198
97 2HD PRO 11 1HD PRO 11 17.302 -3.895 -1.919
98 H ALA 12 H ALA 12 12.156 -3.491 -0.375
99 HA ALA 12 HA ALA 12 12.077 -1.770 1.976
100 1HB ALA 12 1HB ALA 12 10.463 -0.234 0.876
101 2HB ALA 12 2HB ALA 12 10.817 -1.025 -0.658
102 3HB ALA 12 3HB ALA 12 12.090 -0.156 0.199
103 H THR 13 H THR 13 10.899 -3.004 3.302
104 HA THR 13 HA THR 13 8.383 -4.123 2.255
105 HB THR 13 HB THR 13 9.717 -5.351 4.629
106 HG1 THR 13 1HG THR 13 10.537 -5.691 1.944
107 1HG2 THR 13 1HG2 THR 13 8.899 -7.374 3.031
108 2HG2 THR 13 2HG2 THR 13 7.717 -6.126 2.639
109 3HG2 THR 13 3HG2 THR 13 7.927 -6.647 4.311
110 H LEU 14 H LEU 14 6.777 -4.552 4.084
111 HA LEU 14 HA LEU 14 6.785 -2.219 5.872
112 1HB LEU 14 2HB LEU 14 4.257 -2.900 6.037
113 2HB LEU 14 1HB LEU 14 4.851 -1.960 4.682
114 HG LEU 14 HG LEU 14 5.064 -4.173 3.428
115 1HD1 LEU 14 1HD1 LEU 14 2.974 -5.498 4.827
116 2HD1 LEU 14 2HD1 LEU 14 4.282 -5.168 5.963
117 3HD1 LEU 14 3HD1 LEU 14 4.606 -6.069 4.479
118 1HD2 LEU 14 1HD2 LEU 14 2.375 -4.233 3.361
119 2HD2 LEU 14 2HD2 LEU 14 3.347 -3.006 2.550
120 3HD2 LEU 14 3HD2 LEU 14 2.631 -2.664 4.124
121 H ILE 15 H ILE 15 6.353 -2.431 8.050
122 HA ILE 15 HA ILE 15 6.996 -5.008 9.177
123 HB ILE 15 HB ILE 15 7.948 -2.940 10.123
124 1HG1 ILE 15 2HG1 ILE 15 6.356 -3.807 12.421
125 2HG1 ILE 15 1HG1 ILE 15 6.991 -5.151 11.479
126 1HG2 ILE 15 1HG2 ILE 15 5.294 -2.308 11.349
127 2HG2 ILE 15 2HG2 ILE 15 5.714 -1.683 9.755
128 3HG2 ILE 15 3HG2 ILE 15 6.710 -1.275 11.151
129 1HD1 ILE 15 1HD1 ILE 15 8.413 -3.122 13.096
130 2HD1 ILE 15 2HD1 ILE 15 9.215 -3.729 11.647
131 3HD1 ILE 15 3HD1 ILE 15 8.717 -4.850 12.914
132 H LYS 16 H LYS 16 4.199 -2.829 9.148
133 HA LYS 16 HA LYS 16 2.497 -5.098 9.848
134 1HB LYS 16 2HB LYS 16 2.985 -3.975 11.977
135 2HB LYS 16 1HB LYS 16 2.414 -2.453 11.307
136 1HG LYS 16 2HG LYS 16 0.210 -3.783 10.897
137 2HG LYS 16 1HG LYS 16 0.863 -4.858 12.136
138 1HD LYS 16 2HD LYS 16 0.712 -1.890 12.557
139 2HD LYS 16 1HD LYS 16 -0.667 -2.939 12.889
140 1HE LYS 16 2HE LYS 16 1.852 -3.893 14.027
141 2HE LYS 16 1HE LYS 16 1.333 -2.331 14.657
142 1HZ LYS 16 1HZ LYS 16 -0.938 -3.554 14.879
143 2HZ LYS 16 2HZ LYS 16 0.257 -3.765 16.056
144 3HZ LYS 16 3HZ LYS 16 0.021 -4.949 14.872
145 H ALA 17 H ALA 17 1.289 -5.199 8.057
146 HA ALA 17 HA ALA 17 0.070 -2.707 7.062
147 1HB ALA 17 1HB ALA 17 0.633 -5.249 5.537
148 2HB ALA 17 2HB ALA 17 1.572 -3.759 5.446
149 3HB ALA 17 3HB ALA 17 -0.097 -3.783 4.880
150 H ILE 18 H ILE 18 -2.056 -2.510 7.333
151 HA ILE 18 HA ILE 18 -3.607 -4.853 8.135
152 HB ILE 18 HB ILE 18 -4.519 -1.978 8.072
153 1HG1 ILE 18 2HG1 ILE 18 -4.056 -2.899 10.728
154 2HG1 ILE 18 1HG1 ILE 18 -2.599 -3.216 9.791
155 1HG2 ILE 18 1HG2 ILE 18 -5.708 -4.534 8.914
156 2HG2 ILE 18 2HG2 ILE 18 -6.480 -3.047 8.359
157 3HG2 ILE 18 3HG2 ILE 18 -5.930 -3.185 10.029
158 1HD1 ILE 18 1HD1 ILE 18 -3.831 -0.546 9.498
159 2HD1 ILE 18 2HD1 ILE 18 -2.133 -1.022 9.519
160 3HD1 ILE 18 3HD1 ILE 18 -3.039 -0.915 11.030
161 H ASP 19 H ASP 19 -3.426 -2.441 5.592
162 HA ASP 19 HA ASP 19 -4.283 -2.392 3.485
163 1HB ASP 19 2HB ASP 19 -4.370 -5.204 4.194
164 2HB ASP 19 1HB ASP 19 -5.702 -4.775 3.125
165 H GLY 20 H GLY 20 -6.670 -4.291 5.347
166 1HA GLY 20 2HA GLY 20 -8.964 -3.292 4.206
167 2HA GLY 20 1HA GLY 20 -8.864 -3.846 5.869
168 H ASP 21 H ASP 21 -6.861 -1.694 6.473
169 HA ASP 21 HA ASP 21 -8.669 0.628 6.412
170 1HB ASP 21 2HB ASP 21 -7.675 -0.831 8.721
171 2HB ASP 21 1HB ASP 21 -7.228 0.872 8.787
172 H THR 22 H THR 22 -5.469 0.195 7.880
173 HA THR 22 HA THR 22 -4.359 2.047 5.883
174 HB THR 22 HB THR 22 -3.840 2.179 8.858
175 HG1 THR 22 1HG THR 22 -5.232 4.019 7.217
176 1HG2 THR 22 1HG2 THR 22 -1.915 2.926 7.588
177 2HG2 THR 22 2HG2 THR 22 -2.717 4.286 8.372
178 3HG2 THR 22 3HG2 THR 22 -2.941 4.007 6.645
179 H VAL 23 H VAL 23 -2.010 1.974 5.711
180 HA VAL 23 HA VAL 23 -0.776 -0.467 6.767
181 HB VAL 23 HB VAL 23 -1.572 -1.057 4.535
182 1HG1 VAL 23 1HG1 VAL 23 -0.128 0.233 2.674
183 2HG1 VAL 23 2HG1 VAL 23 -0.345 1.535 3.843
184 3HG1 VAL 23 3HG1 VAL 23 -1.751 0.721 3.156
185 1HG2 VAL 23 1HG2 VAL 23 1.363 -0.720 4.149
186 2HG2 VAL 23 2HG2 VAL 23 0.342 -2.130 3.867
187 3HG2 VAL 23 3HG2 VAL 23 0.787 -1.680 5.513
188 H LYS 24 H LYS 24 1.440 -0.357 7.066
189 HA LYS 24 HA LYS 24 2.710 2.233 6.475
190 1HB LYS 24 2HB LYS 24 1.994 1.584 8.968
191 2HB LYS 24 1HB LYS 24 3.542 0.753 8.917
192 1HG LYS 24 2HG LYS 24 4.369 2.712 9.600
193 2HG LYS 24 1HG LYS 24 4.217 3.179 7.905
194 1HD LYS 24 2HD LYS 24 3.236 4.887 9.303
195 2HD LYS 24 1HD LYS 24 1.963 4.073 8.391
196 1HE LYS 24 2HE LYS 24 2.119 2.581 10.696
197 2HE LYS 24 1HE LYS 24 2.410 4.222 11.273
198 1HZ LYS 24 1HZ LYS 24 -0.002 3.047 10.162
199 2HZ LYS 24 2HZ LYS 24 0.336 4.627 9.661
200 3HZ LYS 24 3HZ LYS 24 0.175 4.280 11.309
201 H LEU 25 H LEU 25 4.838 2.185 5.840
202 HA LEU 25 HA LEU 25 5.992 -0.494 5.419
203 1HB LEU 25 2HB LEU 25 5.894 1.938 3.702
204 2HB LEU 25 1HB LEU 25 7.305 0.903 3.591
205 HG LEU 25 HG LEU 25 4.675 -0.445 3.399
206 1HD1 LEU 25 1HD1 LEU 25 4.887 1.843 1.977
207 2HD1 LEU 25 2HD1 LEU 25 3.972 0.428 1.453
208 3HD1 LEU 25 3HD1 LEU 25 5.611 0.688 0.856
209 1HD2 LEU 25 1HD2 LEU 25 6.907 -0.801 1.477
210 2HD2 LEU 25 2HD2 LEU 25 5.840 -1.998 2.211
211 3HD2 LEU 25 3HD2 LEU 25 7.171 -1.313 3.143
212 H MET 26 H MET 26 8.263 -0.727 5.628
213 HA MET 26 HA MET 26 9.421 1.164 7.535
214 1HB MET 26 2HB MET 26 9.355 -1.277 8.070
215 2HB MET 26 1HB MET 26 10.441 -1.560 6.715
216 1HG MET 26 2HG MET 26 12.098 -1.339 8.171
217 2HG MET 26 1HG MET 26 11.741 0.387 8.159
218 1HE MET 26 1HE MET 26 10.033 1.482 9.642
219 2HE MET 26 2HE MET 26 9.618 0.958 11.274
220 3HE MET 26 3HE MET 26 8.759 0.290 9.887
221 H TYR 27 H TYR 27 10.191 2.831 6.300
222 HA TYR 27 HA TYR 27 12.104 2.163 4.169
223 1HB TYR 27 2HB TYR 27 10.137 3.623 3.602
224 2HB TYR 27 1HB TYR 27 10.792 4.834 4.699
225 HD1 TYR 27 1HD TYR 27 12.170 6.475 3.834
226 HD2 TYR 27 2HD TYR 27 11.819 2.785 1.748
227 HE1 TYR 27 1HE TYR 27 13.560 7.377 2.018
228 HE2 TYR 27 2HE TYR 27 13.209 3.675 -0.074
229 HH TYR 27 HH TYR 27 13.838 5.882 -1.002
230 H LYS 28 H LYS 28 13.958 1.822 5.351
231 HA LYS 28 HA LYS 28 15.864 2.333 6.483
232 1HB LYS 28 2HB LYS 28 15.776 4.178 4.704
233 2HB LYS 28 1HB LYS 28 15.227 5.235 5.997
234 1HG LYS 28 2HG LYS 28 17.344 4.403 7.239
235 2HG LYS 28 1HG LYS 28 17.884 3.928 5.627
236 1HD LYS 28 2HD LYS 28 17.078 6.413 5.078
237 2HD LYS 28 1HD LYS 28 17.486 6.628 6.781
238 1HE LYS 28 2HE LYS 28 19.443 5.175 5.100
239 2HE LYS 28 1HE LYS 28 19.272 6.906 4.812
240 1HZ LYS 28 1HZ LYS 28 19.460 6.962 7.418
241 2HZ LYS 28 2HZ LYS 28 20.838 6.925 6.438
242 3HZ LYS 28 3HZ LYS 28 20.284 5.505 7.172
243 H GLY 29 H GLY 29 13.623 1.926 8.076
244 1HA GLY 29 2HA GLY 29 13.172 2.059 10.339
245 2HA GLY 29 1HA GLY 29 14.470 3.234 10.489
246 H GLN 30 H GLN 30 11.965 3.769 8.155
247 HA GLN 30 HA GLN 30 10.724 5.745 9.947
248 1HB GLN 30 2HB GLN 30 12.307 6.544 7.982
249 2HB GLN 30 1HB GLN 30 10.866 6.272 7.013
250 1HG GLN 30 2HG GLN 30 9.902 8.135 7.739
251 2HG GLN 30 1HG GLN 30 10.292 7.776 9.421
252 1HE2 GLN 30 1HE2 GLN 30 11.325 9.419 10.283
253 2HE2 GLN 30 2HE2 GLN 30 12.585 10.336 9.538
254 HA PRO 31 HA PRO 31 7.052 3.480 8.807
255 1HB PRO 31 2HB PRO 31 5.236 5.128 9.970
256 2HB PRO 31 1HB PRO 31 6.237 4.001 10.891
257 1HG PRO 31 2HG PRO 31 6.611 6.937 10.444
258 2HG PRO 31 1HG PRO 31 6.804 5.998 11.937
259 1HD PRO 31 2HD PRO 31 8.908 6.760 10.414
260 2HD PRO 31 1HD PRO 31 8.900 5.247 11.340
261 H MET 32 H MET 32 7.211 3.877 6.538
262 HA MET 32 HA MET 32 6.243 6.345 5.423
263 1HB MET 32 2HB MET 32 7.992 4.915 4.340
264 2HB MET 32 1HB MET 32 6.745 3.717 4.017
265 1HG MET 32 2HG MET 32 5.898 4.870 2.295
266 2HG MET 32 1HG MET 32 6.115 6.426 3.093
267 1HE MET 32 1HE MET 32 8.800 6.688 3.897
268 2HE MET 32 2HE MET 32 8.564 7.958 2.696
269 3HE MET 32 3HE MET 32 9.986 6.918 2.612
270 H THR 33 H THR 33 4.154 6.840 5.428
271 HA THR 33 HA THR 33 2.107 4.870 5.733
272 HB THR 33 HB THR 33 0.550 6.764 5.541
273 HG1 THR 33 1HG THR 33 2.871 8.287 4.974
274 1HG2 THR 33 1HG2 THR 33 0.979 7.624 7.567
275 2HG2 THR 33 2HG2 THR 33 2.650 8.024 7.163
276 3HG2 THR 33 3HG2 THR 33 2.220 6.371 7.604
277 H PHE 34 H PHE 34 0.801 3.954 4.252
278 HA PHE 34 HA PHE 34 1.066 4.834 1.458
279 1HB PHE 34 2HB PHE 34 2.371 2.819 1.666
280 2HB PHE 34 1HB PHE 34 1.063 2.000 2.511
281 HD1 PHE 34 1HD PHE 34 0.492 4.122 -0.433
282 HD2 PHE 34 2HD PHE 34 0.967 0.146 1.007
283 HE1 PHE 34 1HE PHE 34 -0.347 3.251 -2.575
284 HE2 PHE 34 2HE PHE 34 0.129 -0.732 -1.133
285 HZ PHE 34 HZ PHE 34 -0.529 0.820 -2.927
286 H ARG 35 H ARG 35 -0.841 5.686 0.940
287 HA ARG 35 HA ARG 35 -3.072 5.905 0.562
288 1HB ARG 35 2HB ARG 35 -2.713 3.481 -0.206
289 2HB ARG 35 1HB ARG 35 -3.419 3.017 1.335
290 1HG ARG 35 2HG ARG 35 -5.230 2.961 -0.093
291 2HG ARG 35 1HG ARG 35 -5.372 4.559 0.643
292 1HD ARG 35 2HD ARG 35 -4.876 5.640 -1.287
293 2HD ARG 35 1HD ARG 35 -3.760 4.385 -1.827
294 HE ARG 35 HE ARG 35 -6.191 3.198 -2.016
295 1HH1 ARG 35 1HH1 ARG 35 -4.876 6.193 -3.233
296 2HH1 ARG 35 2HH1 ARG 35 -5.882 6.209 -4.642
297 1HH2 ARG 35 1HH2 ARG 35 -7.514 3.216 -3.871
298 2HH2 ARG 35 2HH2 ARG 35 -7.380 4.518 -5.004
299 H LEU 36 H LEU 36 -4.909 6.468 1.693
300 HA LEU 36 HA LEU 36 -4.650 6.353 4.591
301 1HB LEU 36 2HB LEU 36 -6.365 7.940 2.705
302 2HB LEU 36 1HB LEU 36 -6.720 7.888 4.420
303 HG LEU 36 HG LEU 36 -4.378 8.736 4.828
304 1HD1 LEU 36 1HD1 LEU 36 -3.692 10.072 2.603
305 2HD1 LEU 36 2HD1 LEU 36 -4.393 8.624 1.883
306 3HD1 LEU 36 3HD1 LEU 36 -3.053 8.482 3.020
307 1HD2 LEU 36 1HD2 LEU 36 -6.526 10.112 4.752
308 2HD2 LEU 36 2HD2 LEU 36 -5.995 10.634 3.154
309 3HD2 LEU 36 3HD2 LEU 36 -5.002 10.982 4.570
310 H LEU 37 H LEU 37 -6.823 6.157 5.804
311 HA LEU 37 HA LEU 37 -7.939 3.587 5.092
312 1HB LEU 37 2HB LEU 37 -9.125 3.774 7.249
313 2HB LEU 37 1HB LEU 37 -7.389 3.967 7.401
314 HG LEU 37 HG LEU 37 -8.481 6.561 7.066
315 1HD1 LEU 37 1HD1 LEU 37 -9.868 6.534 9.225
316 2HD1 LEU 37 2HD1 LEU 37 -10.040 4.804 8.927
317 3HD1 LEU 37 3HD1 LEU 37 -10.630 5.968 7.739
318 1HD2 LEU 37 1HD2 LEU 37 -7.780 6.501 9.644
319 2HD2 LEU 37 2HD2 LEU 37 -6.604 6.562 8.332
320 3HD2 LEU 37 3HD2 LEU 37 -6.986 5.022 9.102
321 H LEU 38 H LEU 38 -9.329 3.747 3.405
322 HA LEU 38 HA LEU 38 -11.714 5.412 3.828
323 1HB LEU 38 2HB LEU 38 -10.319 6.538 2.185
324 2HB LEU 38 1HB LEU 38 -10.205 5.068 1.237
325 HG LEU 38 HG LEU 38 -12.635 5.180 0.802
326 1HD1 LEU 38 1HD1 LEU 38 -13.740 6.322 2.410
327 2HD1 LEU 38 2HD1 LEU 38 -13.481 7.666 1.297
328 3HD1 LEU 38 3HD1 LEU 38 -12.410 7.448 2.680
329 1HD2 LEU 38 1HD2 LEU 38 -11.500 6.071 -0.974
330 2HD2 LEU 38 2HD2 LEU 38 -10.763 7.347 -0.006
331 3HD2 LEU 38 3HD2 LEU 38 -12.456 7.468 -0.484
332 H VAL 39 H VAL 39 -13.246 3.944 4.236
333 HA VAL 39 HA VAL 39 -13.653 1.810 2.261
334 HB VAL 39 HB VAL 39 -13.985 1.349 5.223
335 1HG1 VAL 39 1HG1 VAL 39 -13.790 -1.085 4.231
336 2HG1 VAL 39 2HG1 VAL 39 -14.353 -0.284 2.763
337 3HG1 VAL 39 3HG1 VAL 39 -15.327 -0.219 4.233
338 1HG2 VAL 39 1HG2 VAL 39 -11.712 1.420 5.190
339 2HG2 VAL 39 2HG2 VAL 39 -11.613 1.049 3.470
340 3HG2 VAL 39 3HG2 VAL 39 -11.931 -0.238 4.633
341 H ASP 40 H ASP 40 -15.844 0.944 2.249
342 HA ASP 40 HA ASP 40 -17.785 3.047 2.814
343 1HB ASP 40 2HB ASP 40 -17.459 1.470 0.628
344 2HB ASP 40 1HB ASP 40 -18.691 0.561 1.498
345 H THR 41 H THR 41 -19.181 2.963 4.448
346 HA THR 41 HA THR 41 -19.634 0.369 5.773
347 HB THR 41 HB THR 41 -18.293 1.549 7.303
348 HG1 THR 41 1HG THR 41 -19.709 1.997 8.992
349 1HG2 THR 41 1HG2 THR 41 -19.957 3.999 6.778
350 2HG2 THR 41 2HG2 THR 41 -18.279 3.744 6.303
351 3HG2 THR 41 3HG2 THR 41 -18.705 3.859 8.010
352 HA PRO 42 HA PRO 42 -23.726 1.962 4.369
353 1HB PRO 42 2HB PRO 42 -24.817 -0.533 4.105
354 2HB PRO 42 1HB PRO 42 -23.922 0.290 2.822
355 1HG PRO 42 2HG PRO 42 -22.996 -1.820 4.726
356 2HG PRO 42 1HG PRO 42 -22.646 -1.636 2.998
357 1HD PRO 42 2HD PRO 42 -20.880 -0.924 4.917
358 2HD PRO 42 1HD PRO 42 -20.999 -0.066 3.369
359 H GLU 43 H GLU 43 -23.414 -0.952 6.412
360 HA GLU 43 HA GLU 43 -25.401 0.234 8.234
361 1HB GLU 43 2HB GLU 43 -25.690 -2.098 6.946
362 2HB GLU 43 1HB GLU 43 -24.812 -2.675 8.355
363 1HG GLU 43 2HG GLU 43 -26.801 -2.825 9.332
364 2HG GLU 43 1HG GLU 43 -26.728 -1.068 9.468
365 H THR 44 H THR 44 -22.208 -1.066 7.934
366 HA THR 44 HA THR 44 -21.478 -0.098 10.522
367 HB THR 44 HB THR 44 -20.830 -2.974 10.350
368 HG1 THR 44 1HG THR 44 -22.794 -3.711 10.581
369 1HG2 THR 44 1HG2 THR 44 -22.103 -2.238 12.771
370 2HG2 THR 44 2HG2 THR 44 -20.941 -0.982 12.348
371 3HG2 THR 44 3HG2 THR 44 -20.414 -2.658 12.491
372 H LYS 45 H LYS 45 -20.476 -2.489 8.074
373 HA LYS 45 HA LYS 45 -18.200 -0.919 7.325
374 1HB LYS 45 2HB LYS 45 -17.745 -2.438 9.527
375 2HB LYS 45 1HB LYS 45 -17.316 -3.579 8.261
376 1HG LYS 45 2HG LYS 45 -16.036 -1.308 7.442
377 2HG LYS 45 1HG LYS 45 -15.915 -1.199 9.200
378 1HD LYS 45 2HD LYS 45 -15.191 -3.679 7.651
379 2HD LYS 45 1HD LYS 45 -14.027 -2.410 8.036
380 1HE LYS 45 2HE LYS 45 -15.691 -3.741 10.153
381 2HE LYS 45 1HE LYS 45 -14.156 -4.418 9.613
382 1HZ LYS 45 1HZ LYS 45 -13.349 -3.125 11.244
383 2HZ LYS 45 2HZ LYS 45 -14.676 -2.077 11.244
384 3HZ LYS 45 3HZ LYS 45 -13.455 -1.893 10.089
385 H HIS 46 H HIS 46 -19.559 -4.204 7.328
386 HA HIS 46 HA HIS 46 -19.254 -4.249 4.408
387 1HB HIS 46 2HB HIS 46 -17.847 -5.897 6.267
388 2HB HIS 46 1HB HIS 46 -18.975 -6.913 5.376
389 HD1 HIS 46 1HD HIS 46 -16.358 -4.266 4.565
390 HD2 HIS 46 2HD HIS 46 -17.956 -7.780 3.030
391 HE1 HIS 46 1HE HIS 46 -15.026 -4.760 2.491
392 HE2 HIS 46 2HE HIS 46 -15.963 -6.931 1.619
393 HA PRO 47 HA PRO 47 -23.456 -5.646 4.687
394 1HB PRO 47 2HB PRO 47 -23.940 -6.080 2.103
395 2HB PRO 47 1HB PRO 47 -23.606 -4.450 2.703
396 1HG PRO 47 2HG PRO 47 -21.810 -6.339 1.244
397 2HG PRO 47 1HG PRO 47 -21.954 -4.580 1.089
398 1HD PRO 47 2HD PRO 47 -20.010 -5.928 2.569
399 2HD PRO 47 1HD PRO 47 -20.438 -4.216 2.744
400 H LYS 48 H LYS 48 -21.188 -7.692 4.963
401 HA LYS 48 HA LYS 48 -20.961 -9.948 5.087
402 1HB LYS 48 2HB LYS 48 -23.841 -9.441 5.301
403 2HB LYS 48 1HB LYS 48 -23.453 -11.062 4.743
404 1HG LYS 48 2HG LYS 48 -21.809 -11.073 6.758
405 2HG LYS 48 1HG LYS 48 -22.829 -9.758 7.351
406 1HD LYS 48 2HD LYS 48 -24.710 -11.557 6.610
407 2HD LYS 48 1HD LYS 48 -23.401 -12.637 7.093
408 1HE LYS 48 2HE LYS 48 -24.222 -10.354 8.847
409 2HE LYS 48 1HE LYS 48 -25.126 -11.869 8.866
410 1HZ LYS 48 1HZ LYS 48 -23.043 -13.027 9.383
411 2HZ LYS 48 2HZ LYS 48 -23.449 -11.891 10.569
412 3HZ LYS 48 3HZ LYS 48 -22.232 -11.542 9.447
413 H LYS 49 H LYS 49 -20.875 -8.578 2.469
414 HA LYS 49 HA LYS 49 -21.716 -10.774 0.703
415 1HB LYS 49 2HB LYS 49 -22.529 -8.404 0.273
416 2HB LYS 49 1HB LYS 49 -20.869 -8.010 -0.157
417 1HG LYS 49 2HG LYS 49 -21.023 -8.998 -2.159
418 2HG LYS 49 1HG LYS 49 -21.934 -10.369 -1.525
419 1HD LYS 49 2HD LYS 49 -23.321 -7.750 -1.647
420 2HD LYS 49 1HD LYS 49 -23.009 -8.575 -3.176
421 1HE LYS 49 2HE LYS 49 -24.049 -10.630 -2.124
422 2HE LYS 49 1HE LYS 49 -24.578 -9.577 -0.811
423 1HZ LYS 49 1HZ LYS 49 -25.210 -8.674 -3.499
424 2HZ LYS 49 2HZ LYS 49 -26.146 -8.624 -2.091
425 3HZ LYS 49 3HZ LYS 49 -26.032 -10.059 -2.979
426 H GLY 50 H GLY 50 -18.972 -8.735 1.594
427 1HA GLY 50 2HA GLY 50 -16.711 -9.087 1.357
428 2HA GLY 50 1HA GLY 50 -17.090 -10.768 1.011
429 H VAL 51 H VAL 51 -18.064 -7.863 -0.758
430 HA VAL 51 HA VAL 51 -16.614 -8.908 -3.099
431 HB VAL 51 HB VAL 51 -19.073 -9.006 -3.341
432 1HG1 VAL 51 1HG1 VAL 51 -19.383 -6.885 -1.922
433 2HG1 VAL 51 2HG1 VAL 51 -20.457 -7.132 -3.300
434 3HG1 VAL 51 3HG1 VAL 51 -19.103 -6.009 -3.428
435 1HG2 VAL 51 1HG2 VAL 51 -17.243 -8.241 -5.180
436 2HG2 VAL 51 2HG2 VAL 51 -18.377 -6.894 -5.267
437 3HG2 VAL 51 3HG2 VAL 51 -18.942 -8.543 -5.540
438 H GLU 52 H GLU 52 -15.965 -6.832 -0.890
439 HA GLU 52 HA GLU 52 -15.263 -4.633 -2.735
440 1HB GLU 52 2HB GLU 52 -15.592 -4.473 0.267
441 2HB GLU 52 1HB GLU 52 -15.250 -3.134 -0.819
442 1HG GLU 52 2HG GLU 52 -17.392 -3.043 -1.612
443 2HG GLU 52 1HG GLU 52 -17.705 -4.746 -1.276
444 H LYS 53 H LYS 53 -13.981 -7.257 -1.729
445 HA LYS 53 HA LYS 53 -11.467 -7.248 -2.182
446 1HB LYS 53 2HB LYS 53 -10.119 -6.390 -0.328
447 2HB LYS 53 1HB LYS 53 -11.071 -5.099 -1.032
448 1HG LYS 53 2HG LYS 53 -12.687 -5.307 0.809
449 2HG LYS 53 1HG LYS 53 -11.692 -6.578 1.519
450 1HD LYS 53 2HD LYS 53 -11.207 -4.503 2.633
451 2HD LYS 53 1HD LYS 53 -9.813 -4.962 1.652
452 1HE LYS 53 2HE LYS 53 -10.413 -3.384 -0.050
453 2HE LYS 53 1HE LYS 53 -11.941 -3.027 0.755
454 1HZ LYS 53 1HZ LYS 53 -10.507 -1.278 1.307
455 2HZ LYS 53 2HZ LYS 53 -9.207 -2.309 1.631
456 3HZ LYS 53 3HZ LYS 53 -10.528 -2.259 2.686
457 H TYR 54 H TYR 54 -13.458 -9.024 -1.659
458 HA TYR 54 HA TYR 54 -14.024 -10.954 -0.611
459 1HB TYR 54 2HB TYR 54 -11.537 -11.281 -1.395
460 2HB TYR 54 1HB TYR 54 -11.196 -11.246 0.328
461 HD1 TYR 54 1HD TYR 54 -10.413 -13.603 -1.026
462 HD2 TYR 54 2HD TYR 54 -14.286 -12.595 0.426
463 HE1 TYR 54 1HE TYR 54 -10.971 -15.991 -0.868
464 HE2 TYR 54 2HE TYR 54 -14.851 -14.982 0.585
465 HH TYR 54 HH TYR 54 -12.562 -17.429 0.424
466 H GLY 55 H GLY 55 -14.014 -8.412 0.909
467 1HA GLY 55 2HA GLY 55 -14.430 -7.680 3.027
468 2HA GLY 55 1HA GLY 55 -14.846 -9.343 3.389
469 HA PRO 56 HA PRO 56 -11.208 -9.060 5.978
470 1HB PRO 56 2HB PRO 56 -11.471 -11.366 7.287
471 2HB PRO 56 1HB PRO 56 -12.621 -10.044 7.532
472 1HG PRO 56 2HG PRO 56 -12.909 -12.532 5.899
473 2HG PRO 56 1HG PRO 56 -14.103 -11.723 6.929
474 1HD PRO 56 2HD PRO 56 -13.934 -11.470 4.166
475 2HD PRO 56 1HD PRO 56 -14.761 -10.333 5.248
476 H GLU 57 H GLU 57 -11.533 -10.970 3.277
477 HA GLU 57 HA GLU 57 -9.256 -12.687 3.755
478 1HB GLU 57 2HB GLU 57 -11.472 -12.706 1.999
479 2HB GLU 57 1HB GLU 57 -10.025 -12.656 1.002
480 1HG GLU 57 2HG GLU 57 -9.990 -14.572 3.239
481 2HG GLU 57 1HG GLU 57 -11.122 -14.917 1.932
482 H ALA 58 H ALA 58 -9.971 -10.282 1.174
483 HA ALA 58 HA ALA 58 -7.493 -10.104 0.047
484 1HB ALA 58 1HB ALA 58 -9.249 -7.721 0.575
485 2HB ALA 58 2HB ALA 58 -9.524 -8.896 -0.711
486 3HB ALA 58 3HB ALA 58 -8.063 -7.907 -0.716
487 H SER 59 H SER 59 -8.609 -8.230 2.865
488 HA SER 59 HA SER 59 -6.396 -6.669 3.329
489 1HB SER 59 2HB SER 59 -8.290 -6.329 4.719
490 2HB SER 59 1HB SER 59 -8.290 -8.007 5.261
491 HG SER 59 HG SER 59 -6.506 -7.610 6.494
492 H ALA 60 H ALA 60 -6.792 -10.078 3.823
493 HA ALA 60 HA ALA 60 -4.275 -10.348 5.253
494 1HB ALA 60 1HB ALA 60 -6.585 -11.708 5.504
495 2HB ALA 60 2HB ALA 60 -5.011 -12.366 5.948
496 3HB ALA 60 3HB ALA 60 -5.724 -12.765 4.386
497 H PHE 61 H PHE 61 -5.733 -11.111 2.126
498 HA PHE 61 HA PHE 61 -3.770 -12.711 1.011
499 1HB PHE 61 2HB PHE 61 -6.068 -11.491 0.090
500 2HB PHE 61 1HB PHE 61 -4.810 -10.715 -0.866
501 HD1 PHE 61 1HD PHE 61 -6.087 -14.051 0.155
502 HD2 PHE 61 2HD PHE 61 -3.931 -11.784 -2.730
503 HE1 PHE 61 1HE PHE 61 -6.013 -16.014 -1.325
504 HE2 PHE 61 2HE PHE 61 -3.852 -13.744 -4.217
505 HZ PHE 61 HZ PHE 61 -4.894 -15.862 -3.514
506 H THR 62 H THR 62 -4.044 -9.188 0.434
507 HA THR 62 HA THR 62 -1.448 -8.912 -0.603
508 HB THR 62 HB THR 62 -2.575 -6.598 0.860
509 HG1 THR 62 1HG THR 62 -4.281 -6.365 -0.583
510 1HG2 THR 62 1HG2 THR 62 -1.437 -7.099 -1.852
511 2HG2 THR 62 2HG2 THR 62 -0.908 -5.971 -0.605
512 3HG2 THR 62 3HG2 THR 62 -2.377 -5.644 -1.523
513 H LYS 63 H LYS 63 -2.604 -9.296 2.604
514 HA LYS 63 HA LYS 63 -0.549 -8.012 4.038
515 1HB LYS 63 2HB LYS 63 -2.879 -9.218 4.717
516 2HB LYS 63 1HB LYS 63 -1.722 -10.428 5.251
517 1HG LYS 63 2HG LYS 63 -0.675 -8.042 6.184
518 2HG LYS 63 1HG LYS 63 -2.414 -7.874 6.425
519 1HD LYS 63 2HD LYS 63 -1.537 -10.507 7.201
520 2HD LYS 63 1HD LYS 63 -0.593 -9.271 8.035
521 1HE LYS 63 2HE LYS 63 -2.376 -8.504 9.207
522 2HE LYS 63 1HE LYS 63 -3.516 -8.845 7.906
523 1HZ LYS 63 1HZ LYS 63 -2.357 -10.786 9.829
524 2HZ LYS 63 2HZ LYS 63 -3.262 -11.239 8.473
525 3HZ LYS 63 3HZ LYS 63 -3.978 -10.315 9.697
526 H LYS 64 H LYS 64 -0.838 -11.182 2.591
527 HA LYS 64 HA LYS 64 1.680 -12.074 3.746
528 1HB LYS 64 2HB LYS 64 -0.538 -13.380 2.221
529 2HB LYS 64 1HB LYS 64 1.055 -14.123 2.201
530 1HG LYS 64 2HG LYS 64 0.851 -14.892 4.286
531 2HG LYS 64 1HG LYS 64 0.160 -13.378 4.875
532 1HD LYS 64 2HD LYS 64 -1.928 -14.164 4.736
533 2HD LYS 64 1HD LYS 64 -1.657 -14.821 3.120
534 1HE LYS 64 2HE LYS 64 -2.213 -16.606 4.661
535 2HE LYS 64 1HE LYS 64 -0.543 -16.771 4.120
536 1HZ LYS 64 1HZ LYS 64 0.173 -15.735 6.199
537 2HZ LYS 64 2HZ LYS 64 -0.710 -17.149 6.484
538 3HZ LYS 64 3HZ LYS 64 -1.435 -15.641 6.718
539 H MET 65 H MET 65 0.407 -10.662 0.893
540 HA MET 65 HA MET 65 2.452 -11.518 -0.911
541 1HB MET 65 2HB MET 65 0.190 -10.811 -1.642
542 2HB MET 65 1HB MET 65 0.560 -9.172 -1.125
543 1HG MET 65 2HG MET 65 2.641 -10.006 -2.846
544 2HG MET 65 1HG MET 65 1.113 -10.435 -3.610
545 1HE MET 65 1HE MET 65 3.722 -8.232 -3.197
546 2HE MET 65 2HE MET 65 3.065 -6.967 -2.161
547 3HE MET 65 3HE MET 65 3.223 -6.692 -3.895
548 H VAL 66 H VAL 66 2.524 -9.441 1.689
549 HA VAL 66 HA VAL 66 4.762 -7.921 0.526
550 HB VAL 66 HB VAL 66 4.223 -6.114 2.149
551 1HG1 VAL 66 1HG1 VAL 66 2.670 -6.873 -0.195
552 2HG1 VAL 66 2HG1 VAL 66 3.377 -5.317 0.240
553 3HG1 VAL 66 3HG1 VAL 66 1.803 -5.783 0.885
554 1HG2 VAL 66 1HG2 VAL 66 1.866 -6.139 3.061
555 2HG2 VAL 66 2HG2 VAL 66 3.003 -7.247 3.830
556 3HG2 VAL 66 3HG2 VAL 66 1.828 -7.858 2.668
557 H GLU 67 H GLU 67 3.425 -9.377 3.461
558 HA GLU 67 HA GLU 67 5.777 -8.937 5.020
559 1HB GLU 67 2HB GLU 67 3.419 -9.228 5.899
560 2HB GLU 67 1HB GLU 67 3.600 -10.947 5.578
561 1HG GLU 67 2HG GLU 67 5.385 -11.125 7.154
562 2HG GLU 67 1HG GLU 67 5.442 -9.374 7.360
563 H ASN 68 H ASN 68 4.290 -12.033 4.048
564 HA ASN 68 HA ASN 68 6.903 -13.306 4.264
565 1HB ASN 68 2HB ASN 68 4.526 -14.175 5.104
566 2HB ASN 68 1HB ASN 68 4.490 -14.860 3.482
567 1HD2 ASN 68 1HD2 ASN 68 4.512 -16.931 4.473
568 2HD2 ASN 68 2HD2 ASN 68 5.989 -17.612 5.053
569 H ALA 69 H ALA 69 5.506 -11.644 1.874
570 HA ALA 69 HA ALA 69 6.148 -13.552 -0.253
571 1HB ALA 69 1HB ALA 69 4.105 -11.712 0.026
572 2HB ALA 69 2HB ALA 69 4.537 -12.588 -1.442
573 3HB ALA 69 3HB ALA 69 5.189 -10.974 -1.154
574 H LYS 70 H LYS 70 8.380 -13.532 -0.250
575 HA LYS 70 HA LYS 70 10.466 -12.845 -0.818
576 1HB LYS 70 2HB LYS 70 8.835 -10.829 -2.356
577 2HB LYS 70 1HB LYS 70 10.588 -10.916 -2.466
578 1HG LYS 70 2HG LYS 70 9.092 -13.429 -2.906
579 2HG LYS 70 1HG LYS 70 8.967 -12.185 -4.152
580 1HD LYS 70 2HD LYS 70 11.059 -12.540 -4.862
581 2HD LYS 70 1HD LYS 70 11.699 -12.588 -3.220
582 1HE LYS 70 2HE LYS 70 10.080 -14.910 -4.056
583 2HE LYS 70 1HE LYS 70 11.635 -14.719 -4.864
584 1HZ LYS 70 1HZ LYS 70 12.782 -15.067 -2.941
585 2HZ LYS 70 2HZ LYS 70 11.425 -16.026 -2.622
586 3HZ LYS 70 3HZ LYS 70 11.547 -14.481 -1.945
587 H LYS 71 H LYS 71 9.117 -9.573 -0.842
588 HA LYS 71 HA LYS 71 9.572 -8.701 1.700
589 1HB LYS 71 2HB LYS 71 12.081 -9.286 0.371
590 2HB LYS 71 1HB LYS 71 11.992 -7.592 0.829
591 1HG LYS 71 2HG LYS 71 11.713 -8.125 3.112
592 2HG LYS 71 1HG LYS 71 11.409 -9.826 2.752
593 1HD LYS 71 2HD LYS 71 13.660 -10.215 2.184
594 2HD LYS 71 1HD LYS 71 14.011 -8.490 2.061
595 1HE LYS 71 2HE LYS 71 13.176 -8.655 4.629
596 2HE LYS 71 1HE LYS 71 13.912 -10.244 4.422
597 1HZ LYS 71 1HZ LYS 71 15.831 -8.826 3.394
598 2HZ LYS 71 2HZ LYS 71 15.707 -9.017 5.069
599 3HZ LYS 71 3HZ LYS 71 15.161 -7.592 4.337
600 H ILE 72 H ILE 72 9.915 -8.037 -1.706
601 HA ILE 72 HA ILE 72 9.050 -6.325 -2.959
602 HB ILE 72 HB ILE 72 8.376 -4.801 -0.459
603 1HG1 ILE 72 2HG1 ILE 72 6.219 -6.339 -1.739
604 2HG1 ILE 72 1HG1 ILE 72 7.417 -7.314 -0.894
605 1HG2 ILE 72 1HG2 ILE 72 7.341 -4.742 -3.273
606 2HG2 ILE 72 2HG2 ILE 72 8.211 -3.470 -2.415
607 3HG2 ILE 72 3HG2 ILE 72 6.571 -3.901 -1.931
608 1HD1 ILE 72 1HD1 ILE 72 6.611 -5.044 0.687
609 2HD1 ILE 72 2HD1 ILE 72 6.579 -6.762 1.077
610 3HD1 ILE 72 3HD1 ILE 72 5.231 -6.030 0.211
611 H GLU 73 H GLU 73 9.620 -4.122 -3.563
612 HA GLU 73 HA GLU 73 11.940 -3.007 -2.178
613 1HB GLU 73 2HB GLU 73 13.244 -2.839 -4.208
614 2HB GLU 73 1HB GLU 73 12.808 -4.520 -3.937
615 1HG GLU 73 2HG GLU 73 10.832 -4.016 -5.523
616 2HG GLU 73 1HG GLU 73 11.791 -2.615 -6.001
617 H VAL 74 H VAL 74 12.102 -0.806 -2.303
618 HA VAL 74 HA VAL 74 9.829 0.556 -3.537
619 HB VAL 74 HB VAL 74 10.298 1.021 -1.163
620 1HG1 VAL 74 1HG1 VAL 74 12.904 0.914 -1.765
621 2HG1 VAL 74 2HG1 VAL 74 12.277 1.746 -0.343
622 3HG1 VAL 74 3HG1 VAL 74 12.671 2.663 -1.797
623 1HG2 VAL 74 1HG2 VAL 74 10.239 3.084 -3.263
624 2HG2 VAL 74 2HG2 VAL 74 10.704 3.645 -1.657
625 3HG2 VAL 74 3HG2 VAL 74 9.160 2.824 -1.892
626 H GLU 75 H GLU 75 10.136 1.185 -5.565
627 HA GLU 75 HA GLU 75 12.690 2.492 -6.238
628 1HB GLU 75 2HB GLU 75 11.957 1.631 -8.661
629 2HB GLU 75 1HB GLU 75 12.958 0.674 -7.580
630 1HG GLU 75 2HG GLU 75 11.320 -0.840 -7.175
631 2HG GLU 75 1HG GLU 75 10.026 0.343 -7.354
632 H PHE 76 H PHE 76 9.841 2.119 -8.293
633 HA PHE 76 HA PHE 76 8.473 3.633 -9.290
634 1HB PHE 76 2HB PHE 76 8.025 4.016 -6.750
635 2HB PHE 76 1HB PHE 76 8.902 5.522 -6.999
636 HD1 PHE 76 1HD PHE 76 7.327 7.208 -6.879
637 HD2 PHE 76 2HD PHE 76 6.494 3.748 -9.213
638 HE1 PHE 76 1HE PHE 76 5.269 8.269 -7.710
639 HE2 PHE 76 2HE PHE 76 4.434 4.803 -10.049
640 HZ PHE 76 HZ PHE 76 3.820 7.066 -9.297
641 H ASP 77 H ASP 77 9.081 4.715 -11.033
642 HA ASP 77 HA ASP 77 11.488 6.331 -10.993
643 1HB ASP 77 2HB ASP 77 11.055 6.542 -13.452
644 2HB ASP 77 1HB ASP 77 11.207 4.879 -12.892
645 H LYS 78 H LYS 78 9.975 7.641 -9.355
646 HA LYS 78 HA LYS 78 9.487 10.135 -10.642
647 1HB LYS 78 2HB LYS 78 7.376 8.685 -11.057
648 2HB LYS 78 1HB LYS 78 7.037 8.965 -9.354
649 1HG LYS 78 2HG LYS 78 5.864 10.677 -10.287
650 2HG LYS 78 1HG LYS 78 7.417 11.477 -10.029
651 1HD LYS 78 2HD LYS 78 7.789 10.388 -12.488
652 2HD LYS 78 1HD LYS 78 6.060 10.734 -12.529
653 1HE LYS 78 2HE LYS 78 6.378 13.013 -12.281
654 2HE LYS 78 1HE LYS 78 7.974 12.812 -11.559
655 1HZ LYS 78 1HZ LYS 78 7.558 13.530 -14.096
656 2HZ LYS 78 2HZ LYS 78 7.722 11.857 -14.281
657 3HZ LYS 78 3HZ LYS 78 8.961 12.751 -13.558
658 H GLY 79 H GLY 79 8.836 8.152 -7.772
659 1HA GLY 79 2HA GLY 79 9.592 8.575 -5.600
660 2HA GLY 79 1HA GLY 79 10.078 10.185 -6.109
661 H GLN 80 H GLN 80 8.484 9.186 -3.777
662 HA GLN 80 HA GLN 80 5.964 10.626 -4.268
663 1HB GLN 80 2HB GLN 80 5.350 9.524 -2.012
664 2HB GLN 80 1HB GLN 80 5.401 8.512 -3.448
665 1HG GLN 80 2HG GLN 80 7.914 8.701 -1.927
666 2HG GLN 80 1HG GLN 80 6.578 7.886 -1.114
667 1HE2 GLN 80 1HE2 GLN 80 7.495 5.868 -1.202
668 2HE2 GLN 80 2HE2 GLN 80 7.692 4.986 -2.673
669 H ARG 81 H ARG 81 6.112 12.715 -3.718
670 HA ARG 81 HA ARG 81 7.611 13.393 -1.274
671 1HB ARG 81 2HB ARG 81 8.532 14.332 -3.375
672 2HB ARG 81 1HB ARG 81 7.014 15.182 -3.633
673 1HG ARG 81 2HG ARG 81 7.357 16.531 -1.692
674 2HG ARG 81 1HG ARG 81 8.763 15.576 -1.217
675 1HD ARG 81 2HD ARG 81 10.044 16.983 -2.362
676 2HD ARG 81 1HD ARG 81 9.261 16.431 -3.842
677 HE ARG 81 HE ARG 81 8.198 18.440 -3.952
678 1HH1 ARG 81 1HH1 ARG 81 9.191 17.917 -0.648
679 2HH1 ARG 81 2HH1 ARG 81 8.673 19.478 -0.113
680 1HH2 ARG 81 1HH2 ARG 81 7.514 20.496 -3.249
681 2HH2 ARG 81 2HH2 ARG 81 7.720 20.943 -1.588
682 H THR 82 H THR 82 4.855 14.590 -3.216
683 HA THR 82 HA THR 82 3.398 15.072 -0.731
684 HB THR 82 HB THR 82 2.658 17.272 -2.139
685 HG1 THR 82 1HG THR 82 5.446 17.003 -2.565
686 1HG2 THR 82 1HG2 THR 82 3.214 17.509 0.130
687 2HG2 THR 82 2HG2 THR 82 4.338 18.542 -0.753
688 3HG2 THR 82 3HG2 THR 82 4.874 16.977 -0.140
689 H ASP 83 H ASP 83 1.146 16.153 -1.522
690 HA ASP 83 HA ASP 83 -0.659 16.082 -3.031
691 1HB ASP 83 2HB ASP 83 0.838 14.944 -4.754
692 2HB ASP 83 1HB ASP 83 0.329 13.417 -4.042
693 H LYS 84 H LYS 84 0.135 12.694 -2.261
694 HA LYS 84 HA LYS 84 -2.459 12.447 -0.962
695 1HB LYS 84 2HB LYS 84 -0.635 10.117 -1.074
696 2HB LYS 84 1HB LYS 84 -2.361 10.215 -1.394
697 1HG LYS 84 2HG LYS 84 -1.825 11.325 -3.561
698 2HG LYS 84 1HG LYS 84 -0.118 11.001 -3.242
699 1HD LYS 84 2HD LYS 84 -0.848 9.235 -4.624
700 2HD LYS 84 1HD LYS 84 -0.788 8.559 -2.995
701 1HE LYS 84 2HE LYS 84 -2.836 7.799 -3.685
702 2HE LYS 84 1HE LYS 84 -3.298 9.323 -2.930
703 1HZ LYS 84 1HZ LYS 84 -2.779 10.078 -5.458
704 2HZ LYS 84 2HZ LYS 84 -4.318 9.693 -4.871
705 3HZ LYS 84 3HZ LYS 84 -3.417 8.529 -5.703
706 H TYR 85 H TYR 85 -2.174 13.540 0.977
707 HA TYR 85 HA TYR 85 -1.719 13.731 3.194
708 1HB TYR 85 2HB TYR 85 -2.299 11.335 3.257
709 2HB TYR 85 1HB TYR 85 -0.620 10.927 2.921
710 HD1 TYR 85 1HD TYR 85 0.549 10.171 4.751
711 HD2 TYR 85 2HD TYR 85 -2.435 13.149 5.329
712 HE1 TYR 85 1HE TYR 85 1.035 10.182 7.161
713 HE2 TYR 85 2HE TYR 85 -1.956 13.169 7.740
714 HH TYR 85 HH TYR 85 0.769 11.874 9.086
715 H GLY 86 H GLY 86 0.490 13.987 0.939
716 1HA GLY 86 2HA GLY 86 2.658 14.731 0.872
717 2HA GLY 86 1HA GLY 86 2.420 15.221 2.541
718 H ARG 87 H ARG 87 2.142 11.911 1.468
719 HA ARG 87 HA ARG 87 4.639 10.867 1.696
720 1HB ARG 87 2HB ARG 87 4.876 11.880 3.906
721 2HB ARG 87 1HB ARG 87 3.405 11.091 4.451
722 1HG ARG 87 2HG ARG 87 4.554 9.306 5.068
723 2HG ARG 87 1HG ARG 87 5.199 9.117 3.436
724 1HD ARG 87 2HD ARG 87 7.192 9.535 4.357
725 2HD ARG 87 1HD ARG 87 6.665 11.216 4.420
726 HE ARG 87 HE ARG 87 5.890 9.634 6.703
727 1HH1 ARG 87 1HH1 ARG 87 8.354 11.682 5.316
728 2HH1 ARG 87 2HH1 ARG 87 9.029 12.118 6.850
729 1HH2 ARG 87 1HH2 ARG 87 6.778 10.207 8.719
730 2HH2 ARG 87 2HH2 ARG 87 8.135 11.282 8.781
731 H GLY 88 H GLY 88 1.254 10.572 2.368
732 1HA GLY 88 2HA GLY 88 1.062 7.817 2.844
733 2HA GLY 88 1HA GLY 88 -0.213 8.827 2.184
734 H LEU 89 H LEU 89 1.980 9.417 -0.014
735 HA LEU 89 HA LEU 89 0.973 7.385 -1.803
736 1HB LEU 89 2HB LEU 89 2.439 8.659 -3.475
737 2HB LEU 89 1HB LEU 89 1.035 9.474 -2.820
738 HG LEU 89 HG LEU 89 3.615 9.905 -1.417
739 1HD1 LEU 89 1HD1 LEU 89 4.002 10.010 -3.955
740 2HD1 LEU 89 2HD1 LEU 89 4.510 11.387 -2.976
741 3HD1 LEU 89 3HD1 LEU 89 3.011 11.469 -3.901
742 1HD2 LEU 89 1HD2 LEU 89 1.013 11.086 -1.550
743 2HD2 LEU 89 2HD2 LEU 89 2.229 12.287 -1.980
744 3HD2 LEU 89 3HD2 LEU 89 2.340 11.434 -0.443
745 H ALA 90 H ALA 90 1.896 5.447 -1.781
746 HA ALA 90 HA ALA 90 4.796 5.271 -2.073
747 1HB ALA 90 1HB ALA 90 4.944 4.806 0.134
748 2HB ALA 90 2HB ALA 90 4.469 3.195 -0.404
749 3HB ALA 90 3HB ALA 90 3.259 4.298 0.252
750 H TYR 91 H TYR 91 5.416 3.710 -3.469
751 HA TYR 91 HA TYR 91 3.314 1.900 -4.459
752 1HB TYR 91 2HB TYR 91 5.430 3.465 -5.817
753 2HB TYR 91 1HB TYR 91 5.144 1.844 -6.444
754 HD1 TYR 91 1HD TYR 91 2.583 1.263 -6.827
755 HD2 TYR 91 2HD TYR 91 4.182 5.203 -6.687
756 HE1 TYR 91 1HE TYR 91 0.643 2.089 -8.092
757 HE2 TYR 91 2HE TYR 91 2.246 6.041 -7.951
758 HH TYR 91 HH TYR 91 -0.134 5.337 -8.353
759 H ILE 92 H ILE 92 3.553 -0.162 -3.962
760 HA ILE 92 HA ILE 92 6.142 -1.152 -3.055
761 HB ILE 92 HB ILE 92 4.820 -3.251 -2.538
762 1HG1 ILE 92 2HG1 ILE 92 2.314 -1.676 -2.615
763 2HG1 ILE 92 1HG1 ILE 92 2.930 -2.215 -4.173
764 1HG2 ILE 92 1HG2 ILE 92 5.223 -2.064 -0.638
765 2HG2 ILE 92 2HG2 ILE 92 3.464 -1.932 -0.683
766 3HG2 ILE 92 3HG2 ILE 92 4.465 -0.598 -1.259
767 1HD1 ILE 92 1HD1 ILE 92 1.504 -3.919 -3.546
768 2HD1 ILE 92 2HD1 ILE 92 1.985 -3.838 -1.852
769 3HD1 ILE 92 3HD1 ILE 92 3.081 -4.531 -3.048
770 H TYR 93 H TYR 93 7.373 -2.615 -4.143
771 HA TYR 93 HA TYR 93 6.279 -3.681 -6.661
772 1HB TYR 93 2HB TYR 93 8.954 -2.390 -6.173
773 2HB TYR 93 1HB TYR 93 8.664 -3.446 -7.552
774 HD1 TYR 93 1HD TYR 93 8.044 -0.168 -6.091
775 HD2 TYR 93 2HD TYR 93 7.097 -2.766 -9.325
776 HE1 TYR 93 1HE TYR 93 7.123 1.736 -7.344
777 HE2 TYR 93 2HE TYR 93 6.175 -0.867 -10.587
778 HH TYR 93 HH TYR 93 5.285 1.334 -10.212
779 H ALA 94 H ALA 94 5.839 -5.583 -5.346
780 HA ALA 94 HA ALA 94 8.042 -7.114 -4.304
781 1HB ALA 94 1HB ALA 94 6.458 -8.655 -3.570
782 2HB ALA 94 2HB ALA 94 5.294 -8.198 -4.811
783 3HB ALA 94 3HB ALA 94 5.616 -7.112 -3.460
784 H ASP 95 H ASP 95 9.001 -8.914 -5.204
785 HA ASP 95 HA ASP 95 9.915 -10.097 -6.930
786 1HB ASP 95 2HB ASP 95 8.390 -11.491 -8.180
787 2HB ASP 95 1HB ASP 95 7.797 -11.361 -6.528
788 H GLY 96 H GLY 96 9.625 -7.279 -7.236
789 1HA GLY 96 2HA GLY 96 10.471 -5.894 -8.925
790 2HA GLY 96 1HA GLY 96 9.968 -7.078 -10.124
791 H LYS 97 H LYS 97 7.300 -7.426 -9.519
792 HA LYS 97 HA LYS 97 5.989 -4.906 -9.178
793 1HB LYS 97 2HB LYS 97 6.913 -5.142 -11.665
794 2HB LYS 97 1HB LYS 97 5.427 -6.060 -11.862
795 1HG LYS 97 2HG LYS 97 4.089 -4.199 -11.293
796 2HG LYS 97 1HG LYS 97 5.482 -3.287 -10.710
797 1HD LYS 97 2HD LYS 97 6.339 -3.611 -13.162
798 2HD LYS 97 1HD LYS 97 4.630 -3.871 -13.511
799 1HE LYS 97 2HE LYS 97 4.544 -1.636 -11.953
800 2HE LYS 97 1HE LYS 97 6.065 -1.409 -12.815
801 1HZ LYS 97 1HZ LYS 97 4.478 -2.147 -14.813
802 2HZ LYS 97 2HZ LYS 97 4.705 -0.534 -14.360
803 3HZ LYS 97 3HZ LYS 97 3.341 -1.377 -13.823
804 H MET 98 H MET 98 4.325 -5.554 -7.905
805 HA MET 98 HA MET 98 2.520 -7.561 -8.993
806 1HB MET 98 2HB MET 98 4.086 -8.846 -7.579
807 2HB MET 98 1HB MET 98 3.664 -7.829 -6.208
808 1HG MET 98 2HG MET 98 1.612 -8.789 -5.945
809 2HG MET 98 1HG MET 98 1.482 -9.243 -7.643
810 1HE MET 98 1HE MET 98 1.851 -12.338 -8.053
811 2HE MET 98 2HE MET 98 3.600 -12.144 -8.177
812 3HE MET 98 3HE MET 98 2.529 -10.872 -8.762
813 H VAL 99 H VAL 99 1.226 -5.610 -9.245
814 HA VAL 99 HA VAL 99 0.203 -4.497 -6.734
815 HB VAL 99 HB VAL 99 -0.407 -3.539 -9.528
816 1HG1 VAL 99 1HG1 VAL 99 -1.722 -2.965 -7.246
817 2HG1 VAL 99 2HG1 VAL 99 -1.564 -1.842 -8.597
818 3HG1 VAL 99 3HG1 VAL 99 -0.475 -1.718 -7.215
819 1HG2 VAL 99 1HG2 VAL 99 1.694 -2.513 -7.623
820 2HG2 VAL 99 2HG2 VAL 99 1.290 -1.831 -9.198
821 3HG2 VAL 99 3HG2 VAL 99 2.008 -3.438 -9.091
822 H ASN 100 H ASN 100 -1.146 -5.523 -9.855
823 HA ASN 100 HA ASN 100 -3.712 -6.020 -8.601
824 1HB ASN 100 2HB ASN 100 -4.368 -6.603 -11.013
825 2HB ASN 100 1HB ASN 100 -3.954 -4.929 -10.658
826 1HD2 ASN 100 1HD2 ASN 100 -3.620 -7.227 -12.888
827 2HD2 ASN 100 2HD2 ASN 100 -2.107 -6.773 -13.591
828 H GLU 101 H GLU 101 -1.520 -7.902 -10.690
829 HA GLU 101 HA GLU 101 -2.717 -10.300 -10.731
830 1HB GLU 101 2HB GLU 101 -0.398 -11.333 -10.703
831 2HB GLU 101 1HB GLU 101 -0.688 -10.083 -11.906
832 1HG GLU 101 2HG GLU 101 0.334 -8.471 -10.207
833 2HG GLU 101 1HG GLU 101 0.907 -9.916 -9.377
834 H ALA 102 H ALA 102 -1.247 -8.917 -7.893
835 HA ALA 102 HA ALA 102 -1.085 -11.327 -6.413
836 1HB ALA 102 1HB ALA 102 -1.418 -9.387 -4.510
837 2HB ALA 102 2HB ALA 102 -0.777 -8.470 -5.874
838 3HB ALA 102 3HB ALA 102 0.120 -9.850 -5.240
839 H LEU 103 H LEU 103 -3.192 -8.692 -5.378
840 HA LEU 103 HA LEU 103 -5.370 -10.654 -5.067
841 1HB LEU 103 2HB LEU 103 -4.559 -9.895 -2.913
842 2HB LEU 103 1HB LEU 103 -4.750 -8.221 -3.395
843 HG LEU 103 HG LEU 103 -6.529 -9.437 -1.859
844 1HD1 LEU 103 1HD1 LEU 103 -8.292 -7.931 -3.068
845 2HD1 LEU 103 2HD1 LEU 103 -6.884 -7.374 -3.971
846 3HD1 LEU 103 3HD1 LEU 103 -6.924 -7.215 -2.216
847 1HD2 LEU 103 1HD2 LEU 103 -7.901 -9.857 -4.469
848 2HD2 LEU 103 2HD2 LEU 103 -8.231 -10.573 -2.893
849 3HD2 LEU 103 3HD2 LEU 103 -6.847 -11.122 -3.838
850 H VAL 104 H VAL 104 -4.850 -7.174 -5.360
851 HA VAL 104 HA VAL 104 -7.347 -6.336 -6.053
852 HB VAL 104 HB VAL 104 -4.833 -5.206 -7.267
853 1HG1 VAL 104 1HG1 VAL 104 -6.205 -3.683 -8.118
854 2HG1 VAL 104 2HG1 VAL 104 -6.643 -3.205 -6.477
855 3HG1 VAL 104 3HG1 VAL 104 -7.590 -4.430 -7.321
856 1HG2 VAL 104 1HG2 VAL 104 -5.491 -5.519 -4.515
857 2HG2 VAL 104 2HG2 VAL 104 -5.615 -3.807 -4.920
858 3HG2 VAL 104 3HG2 VAL 104 -4.113 -4.679 -5.229
859 H ARG 105 H ARG 105 -5.349 -8.336 -8.000
860 HA ARG 105 HA ARG 105 -5.989 -7.627 -10.582
861 1HB ARG 105 2HB ARG 105 -5.938 -10.162 -11.031
862 2HB ARG 105 1HB ARG 105 -4.489 -9.416 -10.377
863 1HG ARG 105 2HG ARG 105 -4.633 -10.531 -8.425
864 2HG ARG 105 1HG ARG 105 -6.397 -10.465 -8.394
865 1HD ARG 105 2HD ARG 105 -4.781 -12.267 -10.193
866 2HD ARG 105 1HD ARG 105 -5.478 -12.761 -8.654
867 HE ARG 105 HE ARG 105 -7.624 -12.625 -9.597
868 1HH1 ARG 105 1HH1 ARG 105 -5.130 -11.861 -11.929
869 2HH1 ARG 105 2HH1 ARG 105 -6.174 -12.076 -13.292
870 1HH2 ARG 105 1HH2 ARG 105 -8.985 -12.902 -11.393
871 2HH2 ARG 105 2HH2 ARG 105 -8.358 -12.664 -12.990
872 H GLN 106 H GLN 106 -8.003 -9.056 -8.138
873 HA GLN 106 HA GLN 106 -10.161 -9.507 -10.073
874 1HB GLN 106 2HB GLN 106 -9.450 -10.615 -7.449
875 2HB GLN 106 1HB GLN 106 -11.164 -10.266 -7.632
876 1HG GLN 106 2HG GLN 106 -9.509 -11.989 -9.463
877 2HG GLN 106 1HG GLN 106 -10.649 -12.561 -8.244
878 1HE2 GLN 106 1HE2 GLN 106 -12.793 -10.999 -8.562
879 2HE2 GLN 106 2HE2 GLN 106 -13.465 -11.179 -10.144
880 H GLY 107 H GLY 107 -9.200 -6.829 -9.073
881 1HA GLY 107 2HA GLY 107 -10.106 -4.820 -8.438
882 2HA GLY 107 1HA GLY 107 -11.627 -5.486 -9.011
883 H LEU 108 H LEU 108 -9.674 -6.663 -6.310
884 HA LEU 108 HA LEU 108 -10.172 -6.989 -4.116
885 1HB LEU 108 2HB LEU 108 -11.434 -4.325 -4.670
886 2HB LEU 108 1HB LEU 108 -11.595 -5.071 -3.091
887 HG LEU 108 HG LEU 108 -8.949 -4.464 -4.409
888 1HD1 LEU 108 1HD1 LEU 108 -9.575 -2.336 -3.974
889 2HD1 LEU 108 2HD1 LEU 108 -9.050 -2.768 -2.345
890 3HD1 LEU 108 3HD1 LEU 108 -10.764 -2.816 -2.762
891 1HD2 LEU 108 1HD2 LEU 108 -7.942 -5.377 -2.620
892 2HD2 LEU 108 2HD2 LEU 108 -9.468 -6.239 -2.419
893 3HD2 LEU 108 3HD2 LEU 108 -9.157 -4.768 -1.496
894 H ALA 109 H ALA 109 -11.379 -8.872 -4.447
895 HA ALA 109 HA ALA 109 -14.051 -8.769 -3.490
896 1HB ALA 109 1HB ALA 109 -15.346 -9.035 -5.323
897 2HB ALA 109 2HB ALA 109 -14.095 -9.897 -6.220
898 3HB ALA 109 3HB ALA 109 -14.027 -8.139 -6.078
899 H LYS 110 H LYS 110 -11.230 -10.429 -4.201
900 HA LYS 110 HA LYS 110 -11.918 -12.698 -2.742
901 1HB LYS 110 2HB LYS 110 -11.943 -14.408 -4.542
902 2HB LYS 110 1HB LYS 110 -13.337 -13.337 -4.585
903 1HG LYS 110 2HG LYS 110 -12.544 -12.198 -6.473
904 2HG LYS 110 1HG LYS 110 -10.917 -12.856 -6.290
905 1HD LYS 110 2HD LYS 110 -11.638 -14.252 -7.927
906 2HD LYS 110 1HD LYS 110 -12.274 -15.147 -6.546
907 1HE LYS 110 2HE LYS 110 -14.442 -14.499 -6.953
908 2HE LYS 110 1HE LYS 110 -13.956 -13.022 -7.784
909 1HZ LYS 110 1HZ LYS 110 -13.047 -14.627 -9.548
910 2HZ LYS 110 2HZ LYS 110 -14.718 -14.371 -9.481
911 3HZ LYS 110 3HZ LYS 110 -14.053 -15.779 -8.823
Start of MODEL 11
1 1H ALA 1 1HT ALA 1 24.868 11.030 -27.020
2 2H ALA 1 2HT ALA 1 25.765 9.781 -26.257
3 3H ALA 1 3HT ALA 1 26.406 11.371 -26.344
4 HA ALA 1 HA ALA 1 25.425 10.604 -24.182
5 1HB ALA 1 1HB ALA 1 24.095 13.110 -24.998
6 2HB ALA 1 2HB ALA 1 25.840 13.028 -25.241
7 3HB ALA 1 3HB ALA 1 25.162 12.780 -23.632
8 H THR 2 H THR 2 23.865 9.180 -23.718
9 HA THR 2 HA THR 2 21.177 9.647 -24.825
10 HB THR 2 HB THR 2 20.796 7.216 -24.190
11 HG1 THR 2 1HG THR 2 22.528 5.989 -23.699
12 1HG2 THR 2 1HG2 THR 2 23.034 7.420 -26.160
13 2HG2 THR 2 2HG2 THR 2 21.435 8.069 -26.521
14 3HG2 THR 2 3HG2 THR 2 21.630 6.352 -26.170
15 H SER 3 H SER 3 19.543 10.102 -23.484
16 HA SER 3 HA SER 3 20.068 10.619 -20.730
17 1HB SER 3 2HB SER 3 17.463 10.934 -20.753
18 2HB SER 3 1HB SER 3 18.490 12.083 -21.609
19 HG SER 3 HG SER 3 16.826 11.447 -22.964
20 H THR 4 H THR 4 20.135 9.152 -19.176
21 HA THR 4 HA THR 4 18.646 6.647 -19.510
22 HB THR 4 HB THR 4 20.814 7.282 -17.503
23 HG1 THR 4 1HG THR 4 21.489 7.350 -19.747
24 1HG2 THR 4 1HG2 THR 4 20.923 4.611 -17.997
25 2HG2 THR 4 2HG2 THR 4 19.187 4.919 -18.024
26 3HG2 THR 4 3HG2 THR 4 20.139 5.360 -16.606
27 H LYS 5 H LYS 5 17.301 5.840 -17.888
28 HA LYS 5 HA LYS 5 16.026 7.879 -16.280
29 1HB LYS 5 2HB LYS 5 15.331 4.947 -16.340
30 2HB LYS 5 1HB LYS 5 14.292 6.297 -15.908
31 1HG LYS 5 2HG LYS 5 14.952 6.960 -18.447
32 2HG LYS 5 1HG LYS 5 14.966 5.196 -18.542
33 1HD LYS 5 2HD LYS 5 12.683 6.679 -17.275
34 2HD LYS 5 1HD LYS 5 12.756 6.421 -19.019
35 1HE LYS 5 2HE LYS 5 11.532 4.594 -18.328
36 2HE LYS 5 1HE LYS 5 13.168 3.937 -18.357
37 1HZ LYS 5 1HZ LYS 5 11.904 3.362 -16.335
38 2HZ LYS 5 2HZ LYS 5 11.841 5.001 -15.926
39 3HZ LYS 5 3HZ LYS 5 13.331 4.205 -16.001
40 H LYS 6 H LYS 6 16.163 8.125 -14.123
41 HA LYS 6 HA LYS 6 18.158 6.549 -12.716
42 1HB LYS 6 2HB LYS 6 17.204 9.234 -12.569
43 2HB LYS 6 1HB LYS 6 16.955 8.476 -11.002
44 1HG LYS 6 2HG LYS 6 19.368 7.746 -11.110
45 2HG LYS 6 1HG LYS 6 19.533 8.819 -12.503
46 1HD LYS 6 2HD LYS 6 19.405 10.699 -11.238
47 2HD LYS 6 1HD LYS 6 18.277 9.976 -10.090
48 1HE LYS 6 2HE LYS 6 21.249 9.486 -10.242
49 2HE LYS 6 1HE LYS 6 20.403 10.421 -9.010
50 1HZ LYS 6 1HZ LYS 6 19.116 8.105 -8.833
51 2HZ LYS 6 2HZ LYS 6 20.488 8.474 -7.914
52 3HZ LYS 6 3HZ LYS 6 20.637 7.542 -9.317
53 H LEU 7 H LEU 7 17.430 4.656 -11.969
54 HA LEU 7 HA LEU 7 14.974 4.689 -10.345
55 1HB LEU 7 2HB LEU 7 15.844 2.258 -11.870
56 2HB LEU 7 1HB LEU 7 14.268 2.625 -11.193
57 HG LEU 7 HG LEU 7 15.392 4.242 -13.461
58 1HD1 LEU 7 1HD1 LEU 7 13.627 1.832 -13.802
59 2HD1 LEU 7 2HD1 LEU 7 15.379 1.777 -13.999
60 3HD1 LEU 7 3HD1 LEU 7 14.404 2.801 -15.052
61 1HD2 LEU 7 1HD2 LEU 7 13.481 5.166 -12.279
62 2HD2 LEU 7 2HD2 LEU 7 12.590 3.661 -12.506
63 3HD2 LEU 7 3HD2 LEU 7 13.014 4.654 -13.900
64 H HIS 8 H HIS 8 15.755 4.625 -8.319
65 HA HIS 8 HA HIS 8 18.025 2.913 -7.682
66 1HB HIS 8 2HB HIS 8 17.516 5.355 -6.801
67 2HB HIS 8 1HB HIS 8 16.563 4.482 -5.604
68 HD1 HIS 8 1HD HIS 8 19.073 2.173 -6.065
69 HD2 HIS 8 2HD HIS 8 19.061 5.961 -4.361
70 HE1 HIS 8 1HE HIS 8 21.081 2.236 -4.554
71 HE2 HIS 8 2HE HIS 8 21.104 4.569 -3.602
72 H LYS 9 H LYS 9 17.524 0.829 -7.435
73 HA LYS 9 HA LYS 9 14.981 0.031 -6.291
74 1HB LYS 9 2HB LYS 9 16.695 -1.102 -8.145
75 2HB LYS 9 1HB LYS 9 16.944 -2.092 -6.715
76 1HG LYS 9 2HG LYS 9 14.222 -1.489 -7.832
77 2HG LYS 9 1HG LYS 9 15.179 -2.892 -8.312
78 1HD LYS 9 2HD LYS 9 14.533 -2.295 -5.436
79 2HD LYS 9 1HD LYS 9 13.455 -3.241 -6.468
80 1HE LYS 9 2HE LYS 9 14.863 -5.024 -6.535
81 2HE LYS 9 1HE LYS 9 16.311 -4.025 -6.423
82 1HZ LYS 9 1HZ LYS 9 16.304 -4.116 -4.192
83 2HZ LYS 9 2HZ LYS 9 15.385 -5.517 -4.424
84 3HZ LYS 9 3HZ LYS 9 14.617 -4.052 -4.067
85 H GLU 10 H GLU 10 14.807 0.210 -4.148
86 HA GLU 10 HA GLU 10 16.945 -0.960 -2.500
87 1HB GLU 10 2HB GLU 10 15.754 1.723 -2.378
88 2HB GLU 10 1HB GLU 10 15.811 0.892 -0.829
89 1HG GLU 10 2HG GLU 10 18.212 0.548 -1.099
90 2HG GLU 10 1HG GLU 10 18.156 1.383 -2.651
91 HA PRO 11 HA PRO 11 13.656 -3.646 -1.131
92 1HB PRO 11 2HB PRO 11 15.388 -3.857 1.279
93 2HB PRO 11 1HB PRO 11 14.700 -5.136 0.273
94 1HG PRO 11 2HG PRO 11 17.283 -4.516 0.100
95 2HG PRO 11 1HG PRO 11 16.346 -4.931 -1.347
96 1HD PRO 11 2HD PRO 11 17.256 -2.257 -0.375
97 2HD PRO 11 1HD PRO 11 17.133 -2.874 -2.035
98 H ALA 12 H ALA 12 11.808 -2.881 -0.348
99 HA ALA 12 HA ALA 12 11.793 -1.545 2.250
100 1HB ALA 12 1HB ALA 12 11.756 0.401 1.020
101 2HB ALA 12 2HB ALA 12 10.032 0.060 1.170
102 3HB ALA 12 3HB ALA 12 10.882 -0.337 -0.322
103 H THR 13 H THR 13 10.581 -2.929 3.379
104 HA THR 13 HA THR 13 7.994 -3.746 2.232
105 HB THR 13 HB THR 13 8.200 -5.916 3.063
106 HG1 THR 13 1HG THR 13 8.955 -6.137 4.989
107 1HG2 THR 13 1HG2 THR 13 11.111 -5.721 2.719
108 2HG2 THR 13 2HG2 THR 13 10.133 -5.139 1.372
109 3HG2 THR 13 3HG2 THR 13 9.938 -6.793 1.954
110 H LEU 14 H LEU 14 6.251 -3.939 3.701
111 HA LEU 14 HA LEU 14 6.386 -2.094 5.896
112 1HB LEU 14 2HB LEU 14 3.963 -3.089 6.248
113 2HB LEU 14 1HB LEU 14 4.307 -1.921 4.988
114 HG LEU 14 HG LEU 14 4.581 -4.761 4.211
115 1HD1 LEU 14 1HD1 LEU 14 1.851 -3.547 4.584
116 2HD1 LEU 14 2HD1 LEU 14 2.566 -4.725 5.686
117 3HD1 LEU 14 3HD1 LEU 14 2.241 -5.169 4.010
118 1HD2 LEU 14 1HD2 LEU 14 3.705 -3.973 2.147
119 2HD2 LEU 14 2HD2 LEU 14 4.868 -2.771 2.707
120 3HD2 LEU 14 3HD2 LEU 14 3.139 -2.475 2.887
121 H ILE 15 H ILE 15 6.281 -2.497 8.064
122 HA ILE 15 HA ILE 15 7.143 -5.149 8.870
123 HB ILE 15 HB ILE 15 8.314 -3.165 9.741
124 1HG1 ILE 15 2HG1 ILE 15 6.929 -4.502 12.053
125 2HG1 ILE 15 1HG1 ILE 15 8.020 -5.403 11.005
126 1HG2 ILE 15 1HG2 ILE 15 7.308 -1.668 11.307
127 2HG2 ILE 15 2HG2 ILE 15 5.812 -2.601 11.319
128 3HG2 ILE 15 3HG2 ILE 15 6.286 -1.716 9.869
129 1HD1 ILE 15 1HD1 ILE 15 8.909 -2.851 12.275
130 2HD1 ILE 15 2HD1 ILE 15 9.873 -4.212 11.701
131 3HD1 ILE 15 3HD1 ILE 15 8.925 -4.365 13.180
132 H LYS 16 H LYS 16 4.497 -2.897 9.676
133 HA LYS 16 HA LYS 16 2.771 -5.145 10.256
134 1HB LYS 16 2HB LYS 16 3.538 -3.160 12.399
135 2HB LYS 16 1HB LYS 16 2.160 -4.245 12.516
136 1HG LYS 16 2HG LYS 16 3.637 -6.169 12.414
137 2HG LYS 16 1HG LYS 16 5.032 -5.104 12.231
138 1HD LYS 16 2HD LYS 16 3.605 -4.234 14.515
139 2HD LYS 16 1HD LYS 16 3.750 -5.989 14.625
140 1HE LYS 16 2HE LYS 16 6.111 -5.895 14.492
141 2HE LYS 16 1HE LYS 16 6.086 -4.203 13.997
142 1HZ LYS 16 1HZ LYS 16 6.533 -4.995 16.491
143 2HZ LYS 16 2HZ LYS 16 4.856 -4.792 16.561
144 3HZ LYS 16 3HZ LYS 16 5.845 -3.499 16.105
145 H ALA 17 H ALA 17 0.745 -4.713 9.658
146 HA ALA 17 HA ALA 17 -0.006 -1.892 9.245
147 1HB ALA 17 1HB ALA 17 -0.009 -2.803 7.112
148 2HB ALA 17 2HB ALA 17 -1.695 -2.968 7.600
149 3HB ALA 17 3HB ALA 17 -0.617 -4.363 7.670
150 H ILE 18 H ILE 18 -1.806 -1.137 10.232
151 HA ILE 18 HA ILE 18 -2.961 -2.459 12.377
152 HB ILE 18 HB ILE 18 -3.091 -0.032 12.097
153 1HG1 ILE 18 2HG1 ILE 18 -5.841 -1.284 12.261
154 2HG1 ILE 18 1HG1 ILE 18 -4.681 -1.246 13.585
155 1HG2 ILE 18 1HG2 ILE 18 -5.289 -0.463 10.099
156 2HG2 ILE 18 2HG2 ILE 18 -3.613 -0.205 9.617
157 3HG2 ILE 18 3HG2 ILE 18 -4.470 1.039 10.528
158 1HD1 ILE 18 1HD1 ILE 18 -6.179 1.023 12.338
159 2HD1 ILE 18 2HD1 ILE 18 -4.720 1.293 13.293
160 3HD1 ILE 18 3HD1 ILE 18 -6.125 0.521 14.026
161 H ASP 19 H ASP 19 -4.248 -2.054 9.113
162 HA ASP 19 HA ASP 19 -5.313 -4.522 8.714
163 1HB ASP 19 2HB ASP 19 -6.760 -3.315 10.806
164 2HB ASP 19 1HB ASP 19 -7.793 -3.158 9.395
165 H GLY 20 H GLY 20 -7.937 -3.649 7.644
166 1HA GLY 20 2HA GLY 20 -7.147 -2.789 5.114
167 2HA GLY 20 1HA GLY 20 -8.784 -2.689 5.747
168 H ASP 21 H ASP 21 -7.263 -0.956 7.983
169 HA ASP 21 HA ASP 21 -8.121 1.531 6.932
170 1HB ASP 21 2HB ASP 21 -8.019 0.972 9.360
171 2HB ASP 21 1HB ASP 21 -6.264 1.052 9.268
172 H THR 22 H THR 22 -4.807 0.744 7.995
173 HA THR 22 HA THR 22 -3.745 1.871 5.527
174 HB THR 22 HB THR 22 -2.089 3.182 7.117
175 HG1 THR 22 1HG THR 22 -3.112 2.429 9.036
176 1HG2 THR 22 1HG2 THR 22 -4.466 4.774 7.166
177 2HG2 THR 22 2HG2 THR 22 -4.324 3.939 5.619
178 3HG2 THR 22 3HG2 THR 22 -3.008 4.963 6.191
179 H VAL 23 H VAL 23 -1.438 1.486 5.265
180 HA VAL 23 HA VAL 23 -0.483 -0.783 6.888
181 HB VAL 23 HB VAL 23 0.676 -1.632 4.884
182 1HG1 VAL 23 1HG1 VAL 23 -2.283 -1.260 4.431
183 2HG1 VAL 23 2HG1 VAL 23 -1.564 -2.457 5.508
184 3HG1 VAL 23 3HG1 VAL 23 -1.268 -2.542 3.771
185 1HG2 VAL 23 1HG2 VAL 23 1.065 -0.110 3.283
186 2HG2 VAL 23 2HG2 VAL 23 -0.303 0.891 3.769
187 3HG2 VAL 23 3HG2 VAL 23 -0.559 -0.507 2.725
188 H LYS 24 H LYS 24 1.253 -0.264 8.035
189 HA LYS 24 HA LYS 24 2.836 2.054 7.361
190 1HB LYS 24 2HB LYS 24 2.157 1.401 9.712
191 2HB LYS 24 1HB LYS 24 3.326 0.093 9.599
192 1HG LYS 24 2HG LYS 24 4.843 2.224 8.868
193 2HG LYS 24 1HG LYS 24 3.737 2.960 10.029
194 1HD LYS 24 2HD LYS 24 5.067 0.374 10.709
195 2HD LYS 24 1HD LYS 24 5.984 1.877 10.832
196 1HE LYS 24 2HE LYS 24 3.968 2.736 12.188
197 2HE LYS 24 1HE LYS 24 3.532 1.033 12.337
198 1HZ LYS 24 1HZ LYS 24 5.368 0.582 13.612
199 2HZ LYS 24 2HZ LYS 24 5.014 2.154 14.125
200 3HZ LYS 24 3HZ LYS 24 6.262 1.889 13.015
201 H LEU 25 H LEU 25 4.660 2.043 6.208
202 HA LEU 25 HA LEU 25 5.819 -0.515 5.450
203 1HB LEU 25 2HB LEU 25 5.754 2.177 4.325
204 2HB LEU 25 1HB LEU 25 7.345 1.441 4.241
205 HG LEU 25 HG LEU 25 6.148 -0.583 3.199
206 1HD1 LEU 25 1HD1 LEU 25 3.952 1.296 3.520
207 2HD1 LEU 25 2HD1 LEU 25 3.926 -0.437 3.192
208 3HD1 LEU 25 3HD1 LEU 25 4.121 0.708 1.865
209 1HD2 LEU 25 1HD2 LEU 25 6.868 2.015 2.012
210 2HD2 LEU 25 2HD2 LEU 25 5.903 0.948 0.994
211 3HD2 LEU 25 3HD2 LEU 25 7.450 0.393 1.637
212 H MET 26 H MET 26 8.179 -0.797 5.456
213 HA MET 26 HA MET 26 9.380 0.444 7.842
214 1HB MET 26 2HB MET 26 8.895 -2.100 7.763
215 2HB MET 26 1HB MET 26 10.278 -2.177 6.678
216 1HG MET 26 2HG MET 26 11.687 -1.176 8.403
217 2HG MET 26 1HG MET 26 10.302 -1.109 9.491
218 1HE MET 26 1HE MET 26 12.074 -3.626 11.391
219 2HE MET 26 2HE MET 26 12.258 -1.970 10.814
220 3HE MET 26 3HE MET 26 13.297 -3.244 10.178
221 H TYR 27 H TYR 27 10.427 2.154 6.897
222 HA TYR 27 HA TYR 27 12.447 1.492 4.858
223 1HB TYR 27 2HB TYR 27 10.567 3.134 4.269
224 2HB TYR 27 1HB TYR 27 11.356 4.254 5.373
225 HD1 TYR 27 1HD TYR 27 13.195 5.537 4.671
226 HD2 TYR 27 2HD TYR 27 11.895 2.262 2.287
227 HE1 TYR 27 1HE TYR 27 14.710 6.255 2.873
228 HE2 TYR 27 2HE TYR 27 13.407 2.970 0.480
229 HH TYR 27 HH TYR 27 15.837 5.324 0.935
230 H LYS 28 H LYS 28 14.216 1.056 6.087
231 HA LYS 28 HA LYS 28 16.018 1.405 7.430
232 1HB LYS 28 2HB LYS 28 15.337 4.309 6.935
233 2HB LYS 28 1HB LYS 28 16.858 3.720 7.593
234 1HG LYS 28 2HG LYS 28 15.976 2.624 4.984
235 2HG LYS 28 1HG LYS 28 16.552 4.292 5.028
236 1HD LYS 28 2HD LYS 28 18.689 3.681 5.485
237 2HD LYS 28 1HD LYS 28 18.196 2.293 6.457
238 1HE LYS 28 2HE LYS 28 17.406 1.357 4.134
239 2HE LYS 28 1HE LYS 28 18.582 2.512 3.509
240 1HZ LYS 28 1HZ LYS 28 19.977 0.794 3.806
241 2HZ LYS 28 2HZ LYS 28 19.009 0.043 4.972
242 3HZ LYS 28 3HZ LYS 28 20.014 1.331 5.410
243 H GLY 29 H GLY 29 13.682 0.844 8.793
244 1HA GLY 29 2HA GLY 29 12.937 0.797 10.969
245 2HA GLY 29 1HA GLY 29 14.330 1.778 11.399
246 H GLN 30 H GLN 30 12.182 2.942 8.951
247 HA GLN 30 HA GLN 30 11.113 4.901 10.874
248 1HB GLN 30 2HB GLN 30 12.626 5.874 9.185
249 2HB GLN 30 1HB GLN 30 11.591 5.249 7.909
250 1HG GLN 30 2HG GLN 30 9.791 6.679 8.585
251 2HG GLN 30 1HG GLN 30 10.691 7.210 10.004
252 1HE2 GLN 30 1HE2 GLN 30 13.095 7.845 9.159
253 2HE2 GLN 30 2HE2 GLN 30 13.055 9.072 7.945
254 HA PRO 31 HA PRO 31 7.142 3.183 9.836
255 1HB PRO 31 2HB PRO 31 5.577 5.001 11.066
256 2HB PRO 31 1HB PRO 31 6.531 3.817 11.968
257 1HG PRO 31 2HG PRO 31 7.131 6.696 11.402
258 2HG PRO 31 1HG PRO 31 7.320 5.792 12.916
259 1HD PRO 31 2HD PRO 31 9.390 6.314 11.229
260 2HD PRO 31 1HD PRO 31 9.323 4.871 12.261
261 H MET 32 H MET 32 6.975 3.435 7.614
262 HA MET 32 HA MET 32 6.237 6.064 6.569
263 1HB MET 32 2HB MET 32 7.692 3.827 5.543
264 2HB MET 32 1HB MET 32 6.300 4.104 4.508
265 1HG MET 32 2HG MET 32 6.970 6.370 4.114
266 2HG MET 32 1HG MET 32 8.275 6.231 5.291
267 1HE MET 32 1HE MET 32 9.128 6.873 1.654
268 2HE MET 32 2HE MET 32 10.549 6.653 2.675
269 3HE MET 32 3HE MET 32 9.132 7.491 3.307
270 H THR 33 H THR 33 4.347 6.392 5.340
271 HA THR 33 HA THR 33 2.209 4.460 5.938
272 HB THR 33 HB THR 33 1.621 6.487 6.960
273 HG1 THR 33 1HG THR 33 -0.071 5.731 5.649
274 1HG2 THR 33 1HG2 THR 33 3.020 7.734 4.715
275 2HG2 THR 33 2HG2 THR 33 2.844 8.264 6.386
276 3HG2 THR 33 3HG2 THR 33 1.549 8.560 5.228
277 H PHE 34 H PHE 34 0.794 3.799 4.342
278 HA PHE 34 HA PHE 34 1.302 4.722 1.607
279 1HB PHE 34 2HB PHE 34 2.628 2.652 1.992
280 2HB PHE 34 1HB PHE 34 1.137 1.801 2.381
281 HD1 PHE 34 1HD PHE 34 -0.622 1.570 0.602
282 HD2 PHE 34 2HD PHE 34 3.318 2.947 -0.227
283 HE1 PHE 34 1HE PHE 34 -0.949 1.055 -1.781
284 HE2 PHE 34 2HE PHE 34 2.999 2.435 -2.613
285 HZ PHE 34 HZ PHE 34 0.863 1.487 -3.393
286 H ARG 35 H ARG 35 -0.537 5.262 0.654
287 HA ARG 35 HA ARG 35 -2.742 5.394 0.110
288 1HB ARG 35 2HB ARG 35 -2.185 2.728 0.118
289 2HB ARG 35 1HB ARG 35 -3.494 2.799 1.290
290 1HG ARG 35 2HG ARG 35 -4.977 3.758 -0.308
291 2HG ARG 35 1HG ARG 35 -3.667 3.986 -1.469
292 1HD ARG 35 2HD ARG 35 -3.380 1.431 -1.315
293 2HD ARG 35 1HD ARG 35 -4.985 1.440 -0.588
294 HE ARG 35 HE ARG 35 -5.885 1.885 -2.648
295 1HH1 ARG 35 1HH1 ARG 35 -2.440 2.432 -2.769
296 2HH1 ARG 35 2HH1 ARG 35 -2.407 2.637 -4.489
297 1HH2 ARG 35 1HH2 ARG 35 -5.844 2.153 -4.909
298 2HH2 ARG 35 2HH2 ARG 35 -4.340 2.479 -5.704
299 H LEU 36 H LEU 36 -4.688 6.051 1.010
300 HA LEU 36 HA LEU 36 -4.919 5.830 3.935
301 1HB LEU 36 2HB LEU 36 -5.672 8.327 2.443
302 2HB LEU 36 1HB LEU 36 -5.465 8.111 4.171
303 HG LEU 36 HG LEU 36 -3.100 7.722 2.392
304 1HD1 LEU 36 1HD1 LEU 36 -2.766 9.900 1.924
305 2HD1 LEU 36 2HD1 LEU 36 -3.535 10.452 3.412
306 3HD1 LEU 36 3HD1 LEU 36 -4.525 9.973 2.034
307 1HD2 LEU 36 1HD2 LEU 36 -3.575 8.676 5.206
308 2HD2 LEU 36 2HD2 LEU 36 -2.009 8.783 4.404
309 3HD2 LEU 36 3HD2 LEU 36 -2.752 7.208 4.679
310 H LEU 37 H LEU 37 -6.611 4.480 4.112
311 HA LEU 37 HA LEU 37 -9.053 5.136 2.599
312 1HB LEU 37 2HB LEU 37 -7.761 2.574 3.298
313 2HB LEU 37 1HB LEU 37 -9.506 2.609 3.466
314 HG LEU 37 HG LEU 37 -9.536 3.510 1.057
315 1HD1 LEU 37 1HD1 LEU 37 -6.795 2.260 1.030
316 2HD1 LEU 37 2HD1 LEU 37 -7.091 3.998 1.024
317 3HD1 LEU 37 3HD1 LEU 37 -7.650 3.005 -0.322
318 1HD2 LEU 37 1HD2 LEU 37 -8.939 1.042 0.266
319 2HD2 LEU 37 2HD2 LEU 37 -10.409 1.415 1.165
320 3HD2 LEU 37 3HD2 LEU 37 -9.006 0.752 2.004
321 H LEU 38 H LEU 38 -10.226 6.387 3.936
322 HA LEU 38 HA LEU 38 -10.605 5.468 6.708
323 1HB LEU 38 2HB LEU 38 -11.426 7.853 7.066
324 2HB LEU 38 1HB LEU 38 -9.706 7.625 6.815
325 HG LEU 38 HG LEU 38 -11.379 8.254 4.435
326 1HD1 LEU 38 1HD1 LEU 38 -11.817 10.405 4.945
327 2HD1 LEU 38 2HD1 LEU 38 -10.369 10.581 5.934
328 3HD1 LEU 38 3HD1 LEU 38 -11.799 9.792 6.598
329 1HD2 LEU 38 1HD2 LEU 38 -9.245 8.106 3.717
330 2HD2 LEU 38 2HD2 LEU 38 -8.570 8.462 5.307
331 3HD2 LEU 38 3HD2 LEU 38 -9.165 9.773 4.287
332 H VAL 39 H VAL 39 -12.397 4.277 6.827
333 HA VAL 39 HA VAL 39 -14.772 5.140 5.318
334 HB VAL 39 HB VAL 39 -14.334 2.449 6.613
335 1HG1 VAL 39 1HG1 VAL 39 -16.338 1.833 5.792
336 2HG1 VAL 39 2HG1 VAL 39 -16.136 2.769 4.312
337 3HG1 VAL 39 3HG1 VAL 39 -16.655 3.567 5.794
338 1HG2 VAL 39 1HG2 VAL 39 -13.617 1.575 4.538
339 2HG2 VAL 39 2HG2 VAL 39 -12.663 3.035 4.800
340 3HG2 VAL 39 3HG2 VAL 39 -14.029 3.062 3.684
341 H ASP 40 H ASP 40 -16.685 5.552 6.340
342 HA ASP 40 HA ASP 40 -16.868 5.113 9.225
343 1HB ASP 40 2HB ASP 40 -15.981 7.453 8.706
344 2HB ASP 40 1HB ASP 40 -17.571 7.793 8.032
345 H THR 41 H THR 41 -18.442 3.550 8.809
346 HA THR 41 HA THR 41 -20.676 3.912 7.141
347 HB THR 41 HB THR 41 -21.677 2.066 8.612
348 HG1 THR 41 1HG THR 41 -20.499 2.423 10.485
349 1HG2 THR 41 1HG2 THR 41 -19.678 1.938 6.656
350 2HG2 THR 41 2HG2 THR 41 -20.782 0.662 7.166
351 3HG2 THR 41 3HG2 THR 41 -19.203 0.818 7.932
352 HA PRO 42 HA PRO 42 -23.226 6.621 9.519
353 1HB PRO 42 2HB PRO 42 -25.674 5.953 8.558
354 2HB PRO 42 1HB PRO 42 -24.501 6.895 7.629
355 1HG PRO 42 2HG PRO 42 -25.156 3.983 7.458
356 2HG PRO 42 1HG PRO 42 -24.841 5.140 6.154
357 1HD PRO 42 2HD PRO 42 -22.983 3.365 7.050
358 2HD PRO 42 1HD PRO 42 -22.562 4.948 6.366
359 H GLU 43 H GLU 43 -24.617 3.350 9.215
360 HA GLU 43 HA GLU 43 -24.727 3.048 12.072
361 1HB GLU 43 2HB GLU 43 -27.219 3.526 10.465
362 2HB GLU 43 1HB GLU 43 -27.267 2.542 11.921
363 1HG GLU 43 2HG GLU 43 -25.948 4.725 12.824
364 2HG GLU 43 1HG GLU 43 -26.999 5.444 11.604
365 H THR 44 H THR 44 -23.612 1.714 9.695
366 HA THR 44 HA THR 44 -24.490 -0.976 10.358
367 HB THR 44 HB THR 44 -25.962 -0.326 8.489
368 HG1 THR 44 1HG THR 44 -25.250 -2.493 8.646
369 1HG2 THR 44 1HG2 THR 44 -23.431 0.518 7.269
370 2HG2 THR 44 2HG2 THR 44 -25.077 1.093 7.000
371 3HG2 THR 44 3HG2 THR 44 -24.519 -0.386 6.219
372 H LYS 45 H LYS 45 -23.166 -2.395 8.431
373 HA LYS 45 HA LYS 45 -20.370 -1.543 8.803
374 1HB LYS 45 2HB LYS 45 -21.188 -3.616 10.055
375 2HB LYS 45 1HB LYS 45 -21.277 -4.396 8.481
376 1HG LYS 45 2HG LYS 45 -19.039 -4.591 8.298
377 2HG LYS 45 1HG LYS 45 -18.730 -3.057 9.114
378 1HD LYS 45 2HD LYS 45 -19.654 -5.561 10.517
379 2HD LYS 45 1HD LYS 45 -17.963 -5.079 10.372
380 1HE LYS 45 2HE LYS 45 -18.165 -3.424 11.900
381 2HE LYS 45 1HE LYS 45 -19.810 -3.024 11.405
382 1HZ LYS 45 1HZ LYS 45 -19.801 -3.933 13.621
383 2HZ LYS 45 2HZ LYS 45 -18.999 -5.327 13.097
384 3HZ LYS 45 3HZ LYS 45 -20.577 -5.016 12.578
385 H HIS 46 H HIS 46 -19.281 -1.114 7.014
386 HA HIS 46 HA HIS 46 -20.428 -1.466 4.440
387 1HB HIS 46 2HB HIS 46 -18.338 0.050 5.560
388 2HB HIS 46 1HB HIS 46 -17.595 -0.943 4.310
389 HD1 HIS 46 1HD HIS 46 -18.237 2.255 4.317
390 HD2 HIS 46 2HD HIS 46 -20.158 -0.740 2.170
391 HE1 HIS 46 1HE HIS 46 -19.291 3.411 2.347
392 HE2 HIS 46 2HE HIS 46 -20.528 1.593 1.116
393 HA PRO 47 HA PRO 47 -16.631 -4.578 3.735
394 1HB PRO 47 2HB PRO 47 -16.182 -5.834 6.236
395 2HB PRO 47 1HB PRO 47 -15.072 -4.783 5.355
396 1HG PRO 47 2HG PRO 47 -16.910 -4.140 7.597
397 2HG PRO 47 1HG PRO 47 -15.341 -3.426 7.183
398 1HD PRO 47 2HD PRO 47 -17.626 -2.112 6.734
399 2HD PRO 47 1HD PRO 47 -16.269 -2.006 5.593
400 H LYS 48 H LYS 48 -18.906 -5.244 6.399
401 HA LYS 48 HA LYS 48 -19.375 -7.932 5.807
402 1HB LYS 48 2HB LYS 48 -20.509 -5.918 7.521
403 2HB LYS 48 1HB LYS 48 -21.796 -6.864 6.789
404 1HG LYS 48 2HG LYS 48 -19.443 -8.067 8.224
405 2HG LYS 48 1HG LYS 48 -20.995 -7.716 8.987
406 1HD LYS 48 2HD LYS 48 -20.878 -9.376 6.499
407 2HD LYS 48 1HD LYS 48 -20.529 -10.103 8.069
408 1HE LYS 48 2HE LYS 48 -22.745 -10.437 8.169
409 2HE LYS 48 1HE LYS 48 -22.814 -8.732 8.607
410 1HZ LYS 48 1HZ LYS 48 -22.813 -8.555 5.957
411 2HZ LYS 48 2HZ LYS 48 -24.227 -8.659 6.876
412 3HZ LYS 48 3HZ LYS 48 -23.597 -10.043 6.139
413 H LYS 49 H LYS 49 -20.583 -5.033 4.317
414 HA LYS 49 HA LYS 49 -22.782 -6.252 2.963
415 1HB LYS 49 2HB LYS 49 -22.612 -3.810 3.451
416 2HB LYS 49 1HB LYS 49 -21.326 -3.699 2.258
417 1HG LYS 49 2HG LYS 49 -22.770 -4.100 0.481
418 2HG LYS 49 1HG LYS 49 -24.012 -4.794 1.523
419 1HD LYS 49 2HD LYS 49 -24.733 -2.728 2.263
420 2HD LYS 49 1HD LYS 49 -23.196 -1.945 1.895
421 1HE LYS 49 2HE LYS 49 -24.266 -1.154 0.091
422 2HE LYS 49 1HE LYS 49 -23.997 -2.764 -0.576
423 1HZ LYS 49 1HZ LYS 49 -26.248 -3.164 0.778
424 2HZ LYS 49 2HZ LYS 49 -26.216 -2.691 -0.845
425 3HZ LYS 49 3HZ LYS 49 -26.453 -1.535 0.366
426 H GLY 50 H GLY 50 -19.385 -5.820 2.281
427 1HA GLY 50 2HA GLY 50 -18.412 -7.489 0.759
428 2HA GLY 50 1HA GLY 50 -19.798 -7.221 -0.288
429 H VAL 51 H VAL 51 -17.786 -4.828 1.382
430 HA VAL 51 HA VAL 51 -17.318 -3.520 -1.193
431 HB VAL 51 HB VAL 51 -16.474 -1.624 0.164
432 1HG1 VAL 51 1HG1 VAL 51 -19.002 -2.234 -0.397
433 2HG1 VAL 51 2HG1 VAL 51 -18.561 -0.796 0.523
434 3HG1 VAL 51 3HG1 VAL 51 -19.113 -2.246 1.364
435 1HG2 VAL 51 1HG2 VAL 51 -15.728 -3.044 2.085
436 2HG2 VAL 51 2HG2 VAL 51 -17.421 -3.197 2.552
437 3HG2 VAL 51 3HG2 VAL 51 -16.648 -1.612 2.547
438 H GLU 52 H GLU 52 -15.633 -5.159 1.391
439 HA GLU 52 HA GLU 52 -13.026 -4.498 0.263
440 1HB GLU 52 2HB GLU 52 -14.010 -5.642 2.819
441 2HB GLU 52 1HB GLU 52 -12.426 -6.176 2.272
442 1HG GLU 52 2HG GLU 52 -11.749 -3.793 2.097
443 2HG GLU 52 1HG GLU 52 -13.300 -3.349 2.810
444 H LYS 53 H LYS 53 -15.216 -6.444 -0.832
445 HA LYS 53 HA LYS 53 -15.255 -8.308 -2.099
446 1HB LYS 53 2HB LYS 53 -12.259 -8.054 -1.858
447 2HB LYS 53 1HB LYS 53 -13.072 -9.201 -2.907
448 1HG LYS 53 2HG LYS 53 -13.116 -6.205 -3.085
449 2HG LYS 53 1HG LYS 53 -12.432 -7.349 -4.240
450 1HD LYS 53 2HD LYS 53 -14.388 -7.065 -5.319
451 2HD LYS 53 1HD LYS 53 -15.003 -8.207 -4.122
452 1HE LYS 53 2HE LYS 53 -16.513 -6.604 -3.685
453 2HE LYS 53 1HE LYS 53 -15.203 -5.860 -2.770
454 1HZ LYS 53 1HZ LYS 53 -15.688 -4.117 -4.086
455 2HZ LYS 53 2HZ LYS 53 -16.373 -5.066 -5.307
456 3HZ LYS 53 3HZ LYS 53 -14.692 -4.915 -5.197
457 H TYR 54 H TYR 54 -14.526 -8.305 1.043
458 HA TYR 54 HA TYR 54 -15.294 -10.873 1.608
459 1HB TYR 54 2HB TYR 54 -12.738 -11.001 0.535
460 2HB TYR 54 1HB TYR 54 -12.454 -11.050 2.270
461 HD1 TYR 54 1HD TYR 54 -14.044 -12.775 -0.561
462 HD2 TYR 54 2HD TYR 54 -13.118 -12.947 3.589
463 HE1 TYR 54 1HE TYR 54 -14.630 -15.163 -0.534
464 HE2 TYR 54 2HE TYR 54 -13.700 -15.334 3.627
465 HH TYR 54 HH TYR 54 -14.198 -17.151 0.769
466 H GLY 55 H GLY 55 -13.478 -8.046 2.481
467 1HA GLY 55 2HA GLY 55 -13.812 -6.820 4.453
468 2HA GLY 55 1HA GLY 55 -14.524 -8.242 5.194
469 HA PRO 56 HA PRO 56 -10.793 -8.645 7.562
470 1HB PRO 56 2HB PRO 56 -11.343 -11.561 7.428
471 2HB PRO 56 1HB PRO 56 -11.093 -10.527 8.838
472 1HG PRO 56 2HG PRO 56 -13.528 -11.405 8.213
473 2HG PRO 56 1HG PRO 56 -13.283 -9.759 8.827
474 1HD PRO 56 2HD PRO 56 -13.778 -10.685 6.027
475 2HD PRO 56 1HD PRO 56 -14.395 -9.246 6.865
476 H GLU 57 H GLU 57 -11.389 -10.518 4.667
477 HA GLU 57 HA GLU 57 -8.730 -11.530 4.412
478 1HB GLU 57 2HB GLU 57 -11.114 -12.147 3.245
479 2HB GLU 57 1HB GLU 57 -10.327 -11.253 1.952
480 1HG GLU 57 2HG GLU 57 -8.981 -13.519 3.385
481 2HG GLU 57 1HG GLU 57 -10.016 -13.767 1.980
482 H ALA 58 H ALA 58 -10.450 -8.703 3.202
483 HA ALA 58 HA ALA 58 -8.771 -7.774 1.249
484 1HB ALA 58 1HB ALA 58 -9.412 -5.436 2.278
485 2HB ALA 58 2HB ALA 58 -10.505 -6.421 3.250
486 3HB ALA 58 3HB ALA 58 -10.619 -6.452 1.491
487 H SER 59 H SER 59 -8.153 -7.934 4.665
488 HA SER 59 HA SER 59 -5.796 -6.228 4.445
489 1HB SER 59 2HB SER 59 -6.464 -7.684 6.963
490 2HB SER 59 1HB SER 59 -5.829 -6.055 6.742
491 HG SER 59 HG SER 59 -7.852 -5.591 7.205
492 H ALA 60 H ALA 60 -6.699 -9.578 4.809
493 HA ALA 60 HA ALA 60 -4.317 -10.721 5.632
494 1HB ALA 60 1HB ALA 60 -6.705 -11.653 4.179
495 2HB ALA 60 2HB ALA 60 -5.911 -12.316 5.607
496 3HB ALA 60 3HB ALA 60 -5.257 -12.644 4.002
497 H PHE 61 H PHE 61 -5.397 -10.026 2.307
498 HA PHE 61 HA PHE 61 -3.342 -11.134 0.870
499 1HB PHE 61 2HB PHE 61 -4.355 -10.113 -0.851
500 2HB PHE 61 1HB PHE 61 -5.448 -9.393 0.322
501 HD1 PHE 61 1HD PHE 61 -5.414 -7.080 0.752
502 HD2 PHE 61 2HD PHE 61 -2.339 -8.840 -1.597
503 HE1 PHE 61 1HE PHE 61 -4.635 -4.839 0.109
504 HE2 PHE 61 2HE PHE 61 -1.550 -6.601 -2.248
505 HZ PHE 61 HZ PHE 61 -2.698 -4.596 -1.394
506 H THR 62 H THR 62 -3.398 -7.914 2.361
507 HA THR 62 HA THR 62 -0.644 -7.407 1.651
508 HB THR 62 HB THR 62 -2.230 -5.551 1.710
509 HG1 THR 62 1HG THR 62 -0.698 -4.310 2.396
510 1HG2 THR 62 1HG2 THR 62 -3.072 -4.683 3.845
511 2HG2 THR 62 2HG2 THR 62 -2.484 -6.139 4.649
512 3HG2 THR 62 3HG2 THR 62 -3.756 -6.255 3.432
513 H LYS 63 H LYS 63 -2.426 -8.685 4.332
514 HA LYS 63 HA LYS 63 -0.465 -8.309 6.341
515 1HB LYS 63 2HB LYS 63 -2.956 -8.870 6.624
516 2HB LYS 63 1HB LYS 63 -2.484 -10.537 6.322
517 1HG LYS 63 2HG LYS 63 -2.591 -10.237 8.672
518 2HG LYS 63 1HG LYS 63 -0.885 -10.345 8.232
519 1HD LYS 63 2HD LYS 63 -1.147 -8.564 9.819
520 2HD LYS 63 1HD LYS 63 -0.790 -7.856 8.244
521 1HE LYS 63 2HE LYS 63 -2.602 -6.591 8.492
522 2HE LYS 63 1HE LYS 63 -3.571 -8.056 8.338
523 1HZ LYS 63 1HZ LYS 63 -3.605 -8.318 10.682
524 2HZ LYS 63 2HZ LYS 63 -4.029 -6.712 10.362
525 3HZ LYS 63 3HZ LYS 63 -2.473 -7.081 10.916
526 H LYS 64 H LYS 64 -0.905 -10.639 3.809
527 HA LYS 64 HA LYS 64 1.065 -12.464 4.946
528 1HB LYS 64 2HB LYS 64 -0.908 -12.577 2.722
529 2HB LYS 64 1HB LYS 64 0.549 -13.545 2.550
530 1HG LYS 64 2HG LYS 64 -0.029 -14.394 4.927
531 2HG LYS 64 1HG LYS 64 -1.642 -13.771 4.567
532 1HD LYS 64 2HD LYS 64 -1.379 -15.121 2.359
533 2HD LYS 64 1HD LYS 64 -0.129 -15.991 3.249
534 1HE LYS 64 2HE LYS 64 -1.865 -17.290 3.875
535 2HE LYS 64 1HE LYS 64 -2.102 -16.020 5.074
536 1HZ LYS 64 1HZ LYS 64 -3.377 -15.602 2.495
537 2HZ LYS 64 2HZ LYS 64 -3.952 -15.280 4.052
538 3HZ LYS 64 3HZ LYS 64 -4.013 -16.853 3.438
539 H MET 65 H MET 65 0.769 -9.932 2.620
540 HA MET 65 HA MET 65 2.892 -10.461 0.904
541 1HB MET 65 2HB MET 65 1.086 -8.575 0.899
542 2HB MET 65 1HB MET 65 2.292 -7.670 1.804
543 1HG MET 65 2HG MET 65 3.882 -7.934 -0.011
544 2HG MET 65 1HG MET 65 2.712 -8.895 -0.913
545 1HE MET 65 1HE MET 65 3.070 -5.876 1.148
546 2HE MET 65 2HE MET 65 1.600 -4.988 0.744
547 3HE MET 65 3HE MET 65 3.121 -4.589 -0.057
548 H VAL 66 H VAL 66 2.974 -9.728 4.238
549 HA VAL 66 HA VAL 66 5.755 -8.804 4.077
550 HB VAL 66 HB VAL 66 5.492 -8.105 6.404
551 1HG1 VAL 66 1HG1 VAL 66 3.067 -7.006 5.074
552 2HG1 VAL 66 2HG1 VAL 66 4.631 -6.785 4.289
553 3HG1 VAL 66 3HG1 VAL 66 4.368 -6.167 5.920
554 1HG2 VAL 66 1HG2 VAL 66 2.698 -9.198 6.115
555 2HG2 VAL 66 2HG2 VAL 66 3.228 -8.156 7.435
556 3HG2 VAL 66 3HG2 VAL 66 3.952 -9.749 7.227
557 H GLU 67 H GLU 67 3.713 -11.222 5.686
558 HA GLU 67 HA GLU 67 6.092 -12.512 6.783
559 1HB GLU 67 2HB GLU 67 3.297 -12.352 7.525
560 2HB GLU 67 1HB GLU 67 3.848 -14.021 7.492
561 1HG GLU 67 2HG GLU 67 5.861 -13.066 8.861
562 2HG GLU 67 1HG GLU 67 4.726 -11.766 9.223
563 H ASN 68 H ASN 68 3.124 -13.791 5.314
564 HA ASN 68 HA ASN 68 4.265 -16.217 4.499
565 1HB ASN 68 2HB ASN 68 1.733 -14.784 4.028
566 2HB ASN 68 1HB ASN 68 2.180 -15.931 2.769
567 1HD2 ASN 68 1HD2 ASN 68 3.341 -17.945 4.091
568 2HD2 ASN 68 2HD2 ASN 68 2.236 -18.674 5.200
569 H ALA 69 H ALA 69 4.440 -13.094 3.084
570 HA ALA 69 HA ALA 69 5.176 -14.136 0.465
571 1HB ALA 69 1HB ALA 69 3.773 -11.955 1.128
572 2HB ALA 69 2HB ALA 69 4.702 -12.090 -0.368
573 3HB ALA 69 3HB ALA 69 5.385 -11.246 1.021
574 H LYS 70 H LYS 70 7.086 -12.699 -0.526
575 HA LYS 70 HA LYS 70 9.408 -13.414 1.052
576 1HB LYS 70 2HB LYS 70 8.948 -13.592 -1.584
577 2HB LYS 70 1HB LYS 70 9.711 -12.009 -1.546
578 1HG LYS 70 2HG LYS 70 11.647 -13.091 -1.652
579 2HG LYS 70 1HG LYS 70 11.369 -13.542 0.032
580 1HD LYS 70 2HD LYS 70 10.897 -15.683 -0.491
581 2HD LYS 70 1HD LYS 70 10.012 -15.237 -1.952
582 1HE LYS 70 2HE LYS 70 12.544 -14.586 -2.664
583 2HE LYS 70 1HE LYS 70 12.843 -15.954 -1.592
584 1HZ LYS 70 1HZ LYS 70 10.806 -16.146 -3.713
585 2HZ LYS 70 2HZ LYS 70 11.672 -17.383 -2.953
586 3HZ LYS 70 3HZ LYS 70 12.441 -16.384 -4.081
587 H LYS 71 H LYS 71 8.690 -10.490 -0.864
588 HA LYS 71 HA LYS 71 8.776 -8.608 1.145
589 1HB LYS 71 2HB LYS 71 11.170 -7.742 0.756
590 2HB LYS 71 1HB LYS 71 10.959 -9.133 1.811
591 1HG LYS 71 2HG LYS 71 11.950 -10.572 0.349
592 2HG LYS 71 1HG LYS 71 11.472 -9.636 -1.069
593 1HD LYS 71 2HD LYS 71 13.189 -7.989 0.443
594 2HD LYS 71 1HD LYS 71 13.940 -9.586 0.391
595 1HE LYS 71 2HE LYS 71 14.758 -8.847 -1.576
596 2HE LYS 71 1HE LYS 71 13.175 -9.334 -2.180
597 1HZ LYS 71 1HZ LYS 71 13.529 -6.617 -1.123
598 2HZ LYS 71 2HZ LYS 71 12.457 -7.176 -2.306
599 3HZ LYS 71 3HZ LYS 71 14.095 -6.973 -2.678
600 H ILE 72 H ILE 72 8.726 -6.474 0.369
601 HA ILE 72 HA ILE 72 8.431 -6.289 -2.544
602 HB ILE 72 HB ILE 72 7.505 -4.194 -0.602
603 1HG1 ILE 72 2HG1 ILE 72 5.227 -5.565 -1.209
604 2HG1 ILE 72 1HG1 ILE 72 6.389 -6.880 -1.065
605 1HG2 ILE 72 1HG2 ILE 72 6.827 -4.934 -3.422
606 2HG2 ILE 72 2HG2 ILE 72 7.465 -3.410 -2.810
607 3HG2 ILE 72 3HG2 ILE 72 5.801 -3.878 -2.454
608 1HD1 ILE 72 1HD1 ILE 72 6.918 -6.251 1.174
609 2HD1 ILE 72 2HD1 ILE 72 5.163 -6.348 1.025
610 3HD1 ILE 72 3HD1 ILE 72 5.962 -4.775 1.038
611 H GLU 73 H GLU 73 9.090 -4.251 -3.571
612 HA GLU 73 HA GLU 73 11.359 -2.948 -2.238
613 1HB GLU 73 2HB GLU 73 11.418 -3.760 -5.142
614 2HB GLU 73 1HB GLU 73 12.743 -3.130 -4.173
615 1HG GLU 73 2HG GLU 73 13.168 -5.129 -3.193
616 2HG GLU 73 1HG GLU 73 11.487 -5.652 -3.270
617 H VAL 74 H VAL 74 11.790 -0.816 -2.899
618 HA VAL 74 HA VAL 74 9.501 0.481 -4.196
619 HB VAL 74 HB VAL 74 10.116 1.300 -1.958
620 1HG1 VAL 74 1HG1 VAL 74 12.712 0.969 -2.777
621 2HG1 VAL 74 2HG1 VAL 74 12.194 1.820 -1.323
622 3HG1 VAL 74 3HG1 VAL 74 12.517 2.722 -2.802
623 1HG2 VAL 74 1HG2 VAL 74 9.014 2.916 -3.220
624 2HG2 VAL 74 2HG2 VAL 74 10.381 3.132 -4.314
625 3HG2 VAL 74 3HG2 VAL 74 10.464 3.753 -2.664
626 H GLU 75 H GLU 75 9.749 0.742 -6.318
627 HA GLU 75 HA GLU 75 12.395 1.104 -7.466
628 1HB GLU 75 2HB GLU 75 10.265 -0.261 -8.366
629 2HB GLU 75 1HB GLU 75 9.973 1.274 -9.171
630 1HG GLU 75 2HG GLU 75 11.411 0.701 -10.745
631 2HG GLU 75 1HG GLU 75 12.697 0.675 -9.540
632 H PHE 76 H PHE 76 12.233 2.700 -9.505
633 HA PHE 76 HA PHE 76 12.532 4.883 -10.067
634 1HB PHE 76 2HB PHE 76 10.395 6.273 -9.798
635 2HB PHE 76 1HB PHE 76 10.299 4.815 -10.776
636 HD1 PHE 76 1HD PHE 76 9.058 2.884 -10.011
637 HD2 PHE 76 2HD PHE 76 9.277 6.427 -7.665
638 HE1 PHE 76 1HE PHE 76 7.187 2.080 -8.631
639 HE2 PHE 76 2HE PHE 76 7.405 5.630 -6.280
640 HZ PHE 76 HZ PHE 76 6.359 3.454 -6.762
641 H ASP 77 H ASP 77 13.844 6.278 -9.141
642 HA ASP 77 HA ASP 77 13.268 7.148 -6.385
643 1HB ASP 77 2HB ASP 77 15.385 5.820 -6.753
644 2HB ASP 77 1HB ASP 77 15.972 7.159 -7.734
645 H LYS 78 H LYS 78 12.176 8.327 -8.798
646 HA LYS 78 HA LYS 78 13.527 10.630 -9.622
647 1HB LYS 78 2HB LYS 78 10.646 9.812 -9.578
648 2HB LYS 78 1HB LYS 78 11.074 11.457 -10.030
649 1HG LYS 78 2HG LYS 78 12.460 9.186 -11.368
650 2HG LYS 78 1HG LYS 78 10.809 9.593 -11.842
651 1HD LYS 78 2HD LYS 78 11.418 11.712 -12.596
652 2HD LYS 78 1HD LYS 78 12.921 11.712 -11.672
653 1HE LYS 78 2HE LYS 78 12.278 10.161 -14.169
654 2HE LYS 78 1HE LYS 78 13.505 11.408 -13.955
655 1HZ LYS 78 1HZ LYS 78 14.737 9.491 -13.836
656 2HZ LYS 78 2HZ LYS 78 13.527 8.611 -13.049
657 3HZ LYS 78 3HZ LYS 78 14.422 9.765 -12.196
658 H GLY 79 H GLY 79 11.712 9.967 -6.732
659 1HA GLY 79 2HA GLY 79 12.140 11.295 -4.764
660 2HA GLY 79 1HA GLY 79 12.312 12.700 -5.808
661 H GLN 80 H GLN 80 10.407 13.603 -6.775
662 HA GLN 80 HA GLN 80 8.113 13.397 -5.015
663 1HB GLN 80 2HB GLN 80 9.083 15.311 -7.057
664 2HB GLN 80 1HB GLN 80 7.337 15.187 -6.885
665 1HG GLN 80 2HG GLN 80 7.344 16.332 -4.985
666 2HG GLN 80 1HG GLN 80 8.669 15.377 -4.321
667 1HE2 GLN 80 1HE2 GLN 80 10.590 16.311 -4.115
668 2HE2 GLN 80 2HE2 GLN 80 11.047 17.828 -4.799
669 H ARG 81 H ARG 81 6.687 11.829 -5.373
670 HA ARG 81 HA ARG 81 6.078 11.087 -8.156
671 1HB ARG 81 2HB ARG 81 5.484 9.439 -5.700
672 2HB ARG 81 1HB ARG 81 5.461 8.918 -7.380
673 1HG ARG 81 2HG ARG 81 7.734 8.732 -7.501
674 2HG ARG 81 1HG ARG 81 8.012 9.951 -6.258
675 1HD ARG 81 2HD ARG 81 6.622 7.487 -5.404
676 2HD ARG 81 1HD ARG 81 8.321 7.319 -5.842
677 HE ARG 81 HE ARG 81 7.243 8.655 -3.531
678 1HH1 ARG 81 1HH1 ARG 81 9.988 8.373 -5.669
679 2HH1 ARG 81 2HH1 ARG 81 11.115 8.986 -4.505
680 1HH2 ARG 81 1HH2 ARG 81 8.724 9.463 -2.001
681 2HH2 ARG 81 2HH2 ARG 81 10.398 9.606 -2.424
682 H THR 82 H THR 82 4.642 11.825 -5.011
683 HA THR 82 HA THR 82 2.116 12.409 -6.402
684 HB THR 82 HB THR 82 0.881 11.579 -4.435
685 HG1 THR 82 1HG THR 82 3.396 10.615 -3.554
686 1HG2 THR 82 1HG2 THR 82 2.725 9.383 -5.298
687 2HG2 THR 82 2HG2 THR 82 1.490 10.049 -6.368
688 3HG2 THR 82 3HG2 THR 82 1.022 9.289 -4.847
689 H ASP 83 H ASP 83 1.204 14.319 -5.933
690 HA ASP 83 HA ASP 83 2.644 16.120 -4.178
691 1HB ASP 83 2HB ASP 83 0.163 16.696 -5.807
692 2HB ASP 83 1HB ASP 83 1.295 17.867 -5.134
693 H LYS 84 H LYS 84 0.129 13.946 -3.821
694 HA LYS 84 HA LYS 84 -1.607 15.389 -2.103
695 1HB LYS 84 2HB LYS 84 -2.348 13.059 -1.412
696 2HB LYS 84 1HB LYS 84 -2.494 13.446 -3.121
697 1HG LYS 84 2HG LYS 84 -1.205 11.736 -3.676
698 2HG LYS 84 1HG LYS 84 0.077 12.288 -2.596
699 1HD LYS 84 2HD LYS 84 -0.415 10.215 -1.709
700 2HD LYS 84 1HD LYS 84 -1.441 11.268 -0.733
701 1HE LYS 84 2HE LYS 84 -3.010 10.662 -2.930
702 2HE LYS 84 1HE LYS 84 -2.167 9.152 -2.587
703 1HZ LYS 84 1HZ LYS 84 -3.227 8.901 -0.623
704 2HZ LYS 84 2HZ LYS 84 -4.408 9.846 -1.379
705 3HZ LYS 84 3HZ LYS 84 -3.310 10.561 -0.308
706 H TYR 85 H TYR 85 1.340 13.577 -1.612
707 HA TYR 85 HA TYR 85 1.890 14.751 0.875
708 1HB TYR 85 2HB TYR 85 -0.038 13.126 1.435
709 2HB TYR 85 1HB TYR 85 1.153 11.852 1.202
710 HD1 TYR 85 1HD TYR 85 1.887 11.000 3.208
711 HD2 TYR 85 2HD TYR 85 1.198 15.188 2.901
712 HE1 TYR 85 1HE TYR 85 2.658 11.292 5.525
713 HE2 TYR 85 2HE TYR 85 1.968 15.490 5.217
714 HH TYR 85 HH TYR 85 2.078 13.938 7.337
715 H GLY 86 H GLY 86 2.329 11.945 -1.212
716 1HA GLY 86 2HA GLY 86 4.509 11.584 -2.210
717 2HA GLY 86 1HA GLY 86 5.229 12.132 -0.703
718 H ARG 87 H ARG 87 2.847 10.374 0.466
719 HA ARG 87 HA ARG 87 4.307 7.826 0.259
720 1HB ARG 87 2HB ARG 87 3.792 9.431 2.572
721 2HB ARG 87 1HB ARG 87 2.924 7.911 2.734
722 1HG ARG 87 2HG ARG 87 4.904 7.292 3.647
723 2HG ARG 87 1HG ARG 87 5.260 6.928 1.957
724 1HD ARG 87 2HD ARG 87 7.121 8.130 2.811
725 2HD ARG 87 1HD ARG 87 6.228 9.236 1.767
726 HE ARG 87 HE ARG 87 5.453 9.427 4.518
727 1HH1 ARG 87 1HH1 ARG 87 7.796 10.480 2.156
728 2HH1 ARG 87 2HH1 ARG 87 8.193 11.930 3.015
729 1HH2 ARG 87 1HH2 ARG 87 5.974 11.333 5.648
730 2HH2 ARG 87 2HH2 ARG 87 7.160 12.415 4.997
731 H GLY 88 H GLY 88 1.249 9.457 0.244
732 1HA GLY 88 2HA GLY 88 -0.547 7.426 0.776
733 2HA GLY 88 1HA GLY 88 -0.844 8.736 -0.358
734 H LEU 89 H LEU 89 -0.264 8.426 -2.586
735 HA LEU 89 HA LEU 89 -0.612 5.655 -3.395
736 1HB LEU 89 2HB LEU 89 -1.835 7.740 -4.353
737 2HB LEU 89 1HB LEU 89 -0.368 7.966 -5.287
738 HG LEU 89 HG LEU 89 -0.816 5.416 -5.911
739 1HD1 LEU 89 1HD1 LEU 89 -2.740 4.783 -4.901
740 2HD1 LEU 89 2HD1 LEU 89 -3.453 5.527 -6.332
741 3HD1 LEU 89 3HD1 LEU 89 -3.369 6.428 -4.818
742 1HD2 LEU 89 1HD2 LEU 89 -0.763 7.632 -7.299
743 2HD2 LEU 89 2HD2 LEU 89 -2.515 7.425 -7.314
744 3HD2 LEU 89 3HD2 LEU 89 -1.473 6.168 -7.979
745 H ALA 90 H ALA 90 1.088 4.407 -3.751
746 HA ALA 90 HA ALA 90 3.388 5.491 -5.189
747 1HB ALA 90 1HB ALA 90 4.800 4.068 -3.477
748 2HB ALA 90 2HB ALA 90 3.441 4.426 -2.412
749 3HB ALA 90 3HB ALA 90 4.363 5.743 -3.136
750 H TYR 91 H TYR 91 4.423 4.022 -6.486
751 HA TYR 91 HA TYR 91 2.997 1.575 -7.019
752 1HB TYR 91 2HB TYR 91 4.985 3.236 -8.390
753 2HB TYR 91 1HB TYR 91 5.244 1.510 -8.613
754 HD1 TYR 91 1HD TYR 91 3.526 4.343 -9.803
755 HD2 TYR 91 2HD TYR 91 3.103 0.142 -9.291
756 HE1 TYR 91 1HE TYR 91 1.776 4.316 -11.530
757 HE2 TYR 91 2HE TYR 91 1.352 0.102 -11.017
758 HH TYR 91 HH TYR 91 0.827 1.791 -13.145
759 H ILE 92 H ILE 92 3.486 -0.387 -6.291
760 HA ILE 92 HA ILE 92 6.185 -0.858 -5.213
761 HB ILE 92 HB ILE 92 5.221 -2.256 -3.439
762 1HG1 ILE 92 2HG1 ILE 92 3.066 -2.689 -4.727
763 2HG1 ILE 92 1HG1 ILE 92 2.894 -2.389 -3.002
764 1HG2 ILE 92 1HG2 ILE 92 4.790 0.644 -3.653
765 2HG2 ILE 92 2HG2 ILE 92 5.662 -0.292 -2.439
766 3HG2 ILE 92 3HG2 ILE 92 3.905 -0.161 -2.356
767 1HD1 ILE 92 1HD1 ILE 92 1.496 -0.729 -3.411
768 2HD1 ILE 92 2HD1 ILE 92 1.611 -1.086 -5.134
769 3HD1 ILE 92 3HD1 ILE 92 2.704 0.089 -4.402
770 H TYR 93 H TYR 93 6.975 -2.983 -5.382
771 HA TYR 93 HA TYR 93 5.381 -4.826 -7.020
772 1HB TYR 93 2HB TYR 93 8.292 -4.164 -7.508
773 2HB TYR 93 1HB TYR 93 7.333 -5.339 -8.404
774 HD1 TYR 93 1HD TYR 93 7.541 -1.713 -7.591
775 HD2 TYR 93 2HD TYR 93 6.121 -4.678 -10.291
776 HE1 TYR 93 1HE TYR 93 6.857 0.054 -9.160
777 HE2 TYR 93 2HE TYR 93 5.433 -2.921 -11.868
778 HH TYR 93 HH TYR 93 5.091 0.245 -11.061
779 H ALA 94 H ALA 94 5.004 -6.094 -5.187
780 HA ALA 94 HA ALA 94 7.174 -7.071 -3.583
781 1HB ALA 94 1HB ALA 94 5.543 -8.176 -2.294
782 2HB ALA 94 2HB ALA 94 4.375 -8.162 -3.617
783 3HB ALA 94 3HB ALA 94 4.796 -6.659 -2.796
784 H ASP 95 H ASP 95 8.511 -8.592 -4.228
785 HA ASP 95 HA ASP 95 9.336 -10.527 -5.082
786 1HB ASP 95 2HB ASP 95 7.153 -11.411 -3.981
787 2HB ASP 95 1HB ASP 95 6.552 -11.514 -5.635
788 H GLY 96 H GLY 96 8.584 -8.194 -6.761
789 1HA GLY 96 2HA GLY 96 9.210 -7.878 -9.019
790 2HA GLY 96 1HA GLY 96 8.838 -9.567 -9.333
791 H LYS 97 H LYS 97 6.221 -9.405 -8.001
792 HA LYS 97 HA LYS 97 4.782 -7.622 -9.839
793 1HB LYS 97 2HB LYS 97 3.899 -10.452 -9.293
794 2HB LYS 97 1HB LYS 97 3.248 -9.331 -10.480
795 1HG LYS 97 2HG LYS 97 5.081 -9.571 -11.897
796 2HG LYS 97 1HG LYS 97 6.093 -10.248 -10.620
797 1HD LYS 97 2HD LYS 97 4.291 -12.142 -10.602
798 2HD LYS 97 1HD LYS 97 3.936 -11.547 -12.225
799 1HE LYS 97 2HE LYS 97 5.851 -12.365 -13.078
800 2HE LYS 97 1HE LYS 97 6.789 -11.934 -11.649
801 1HZ LYS 97 1HZ LYS 97 6.272 -13.904 -10.607
802 2HZ LYS 97 2HZ LYS 97 6.406 -14.406 -12.215
803 3HZ LYS 97 3HZ LYS 97 4.878 -14.170 -11.530
804 H MET 98 H MET 98 3.174 -6.513 -8.927
805 HA MET 98 HA MET 98 2.798 -6.431 -6.168
806 1HB MET 98 2HB MET 98 0.666 -5.171 -6.772
807 2HB MET 98 1HB MET 98 2.175 -4.516 -7.390
808 1HG MET 98 2HG MET 98 0.894 -6.412 -9.199
809 2HG MET 98 1HG MET 98 -0.081 -4.985 -8.857
810 1HE MET 98 1HE MET 98 0.953 -2.623 -8.825
811 2HE MET 98 2HE MET 98 2.178 -2.069 -9.965
812 3HE MET 98 3HE MET 98 2.663 -2.830 -8.451
813 H VAL 99 H VAL 99 0.868 -6.924 -4.916
814 HA VAL 99 HA VAL 99 -0.205 -9.535 -5.663
815 HB VAL 99 HB VAL 99 -0.570 -8.131 -3.021
816 1HG1 VAL 99 1HG1 VAL 99 -2.101 -9.930 -3.290
817 2HG1 VAL 99 2HG1 VAL 99 -0.811 -10.507 -2.236
818 3HG1 VAL 99 3HG1 VAL 99 -0.843 -10.988 -3.932
819 1HG2 VAL 99 1HG2 VAL 99 1.317 -9.719 -2.307
820 2HG2 VAL 99 2HG2 VAL 99 1.759 -8.253 -3.184
821 3HG2 VAL 99 3HG2 VAL 99 1.710 -9.802 -4.025
822 H ASN 100 H ASN 100 -1.160 -6.318 -5.847
823 HA ASN 100 HA ASN 100 -3.871 -6.466 -5.115
824 1HB ASN 100 2HB ASN 100 -4.152 -4.456 -6.578
825 2HB ASN 100 1HB ASN 100 -2.844 -4.311 -5.407
826 1HD2 ASN 100 1HD2 ASN 100 -3.485 -5.232 -8.765
827 2HD2 ASN 100 2HD2 ASN 100 -1.994 -4.627 -9.396
828 H GLU 101 H GLU 101 -2.218 -7.829 -7.767
829 HA GLU 101 HA GLU 101 -4.548 -7.935 -9.487
830 1HB GLU 101 2HB GLU 101 -1.927 -7.862 -10.069
831 2HB GLU 101 1HB GLU 101 -2.166 -9.604 -10.072
832 1HG GLU 101 2HG GLU 101 -4.280 -8.771 -11.560
833 2HG GLU 101 1HG GLU 101 -3.058 -7.571 -11.979
834 H ALA 102 H ALA 102 -3.143 -9.820 -6.993
835 HA ALA 102 HA ALA 102 -3.911 -12.403 -7.764
836 1HB ALA 102 1HB ALA 102 -2.374 -12.164 -5.974
837 2HB ALA 102 2HB ALA 102 -3.832 -12.894 -5.298
838 3HB ALA 102 3HB ALA 102 -3.505 -11.180 -5.045
839 H LEU 103 H LEU 103 -5.482 -10.914 -4.961
840 HA LEU 103 HA LEU 103 -8.055 -11.823 -6.060
841 1HB LEU 103 2HB LEU 103 -8.742 -11.707 -3.555
842 2HB LEU 103 1HB LEU 103 -7.861 -13.089 -4.167
843 HG LEU 103 HG LEU 103 -7.108 -12.262 -1.932
844 1HD1 LEU 103 1HD1 LEU 103 -4.672 -11.864 -3.434
845 2HD1 LEU 103 2HD1 LEU 103 -5.619 -13.208 -4.070
846 3HD1 LEU 103 3HD1 LEU 103 -5.144 -13.191 -2.372
847 1HD2 LEU 103 1HD2 LEU 103 -6.194 -10.210 -1.583
848 2HD2 LEU 103 2HD2 LEU 103 -7.351 -9.795 -2.844
849 3HD2 LEU 103 3HD2 LEU 103 -5.653 -10.037 -3.252
850 H VAL 104 H VAL 104 -6.321 -9.098 -4.821
851 HA VAL 104 HA VAL 104 -8.441 -7.446 -4.051
852 HB VAL 104 HB VAL 104 -5.827 -6.617 -5.323
853 1HG1 VAL 104 1HG1 VAL 104 -6.186 -4.456 -4.322
854 2HG1 VAL 104 2HG1 VAL 104 -7.687 -5.007 -3.581
855 3HG1 VAL 104 3HG1 VAL 104 -7.573 -4.856 -5.334
856 1HG2 VAL 104 1HG2 VAL 104 -5.744 -8.048 -3.224
857 2HG2 VAL 104 2HG2 VAL 104 -6.477 -6.677 -2.392
858 3HG2 VAL 104 3HG2 VAL 104 -4.902 -6.500 -3.164
859 H ARG 105 H ARG 105 -7.203 -8.277 -7.207
860 HA ARG 105 HA ARG 105 -8.981 -6.338 -8.493
861 1HB ARG 105 2HB ARG 105 -6.494 -6.761 -9.140
862 2HB ARG 105 1HB ARG 105 -7.124 -8.178 -9.966
863 1HG ARG 105 2HG ARG 105 -8.423 -6.865 -11.433
864 2HG ARG 105 1HG ARG 105 -8.182 -5.411 -10.462
865 1HD ARG 105 2HD ARG 105 -6.439 -4.907 -11.742
866 2HD ARG 105 1HD ARG 105 -5.616 -6.336 -11.121
867 HE ARG 105 HE ARG 105 -6.027 -7.405 -13.108
868 1HH1 ARG 105 1HH1 ARG 105 -7.967 -4.506 -12.946
869 2HH1 ARG 105 2HH1 ARG 105 -8.484 -4.611 -14.596
870 1HH2 ARG 105 1HH2 ARG 105 -6.710 -7.546 -15.276
871 2HH2 ARG 105 2HH2 ARG 105 -7.771 -6.337 -15.918
872 H GLN 106 H GLN 106 -8.844 -9.634 -7.641
873 HA GLN 106 HA GLN 106 -10.558 -10.566 -9.769
874 1HB GLN 106 2HB GLN 106 -8.730 -11.835 -8.281
875 2HB GLN 106 1HB GLN 106 -10.157 -12.193 -7.318
876 1HG GLN 106 2HG GLN 106 -11.194 -13.337 -9.093
877 2HG GLN 106 1HG GLN 106 -10.043 -12.709 -10.271
878 1HE2 GLN 106 1HE2 GLN 106 -10.769 -15.205 -8.093
879 2HE2 GLN 106 2HE2 GLN 106 -9.306 -16.106 -8.262
880 H GLY 107 H GLY 107 -10.938 -9.312 -6.548
881 1HA GLY 107 2HA GLY 107 -13.024 -8.466 -5.778
882 2HA GLY 107 1HA GLY 107 -13.843 -9.577 -6.865
883 H LEU 108 H LEU 108 -11.350 -10.110 -4.381
884 HA LEU 108 HA LEU 108 -13.253 -11.604 -2.767
885 1HB LEU 108 2HB LEU 108 -12.303 -13.205 -4.421
886 2HB LEU 108 1HB LEU 108 -10.711 -12.886 -3.759
887 HG LEU 108 HG LEU 108 -12.618 -13.671 -1.701
888 1HD1 LEU 108 1HD1 LEU 108 -13.327 -15.693 -2.401
889 2HD1 LEU 108 2HD1 LEU 108 -11.894 -15.975 -3.390
890 3HD1 LEU 108 3HD1 LEU 108 -13.191 -14.943 -3.992
891 1HD2 LEU 108 1HD2 LEU 108 -10.064 -13.550 -1.649
892 2HD2 LEU 108 2HD2 LEU 108 -10.100 -15.078 -2.529
893 3HD2 LEU 108 3HD2 LEU 108 -10.831 -14.966 -0.927
894 H ALA 109 H ALA 109 -10.968 -9.324 -2.822
895 HA ALA 109 HA ALA 109 -10.607 -9.166 -0.080
896 1HB ALA 109 1HB ALA 109 -8.733 -10.985 -1.390
897 2HB ALA 109 2HB ALA 109 -9.131 -10.801 0.319
898 3HB ALA 109 3HB ALA 109 -7.949 -9.727 -0.432
899 H LYS 110 H LYS 110 -11.032 -7.011 -0.700
900 HA LYS 110 HA LYS 110 -8.847 -5.630 -2.099
901 1HB LYS 110 2HB LYS 110 -11.768 -5.225 -1.943
902 2HB LYS 110 1HB LYS 110 -10.804 -3.756 -1.889
903 1HG LYS 110 2HG LYS 110 -9.635 -5.053 -3.958
904 2HG LYS 110 1HG LYS 110 -11.303 -5.609 -4.108
905 1HD LYS 110 2HD LYS 110 -11.473 -2.862 -3.594
906 2HD LYS 110 1HD LYS 110 -10.159 -3.043 -4.759
907 1HE LYS 110 2HE LYS 110 -12.022 -4.716 -5.806
908 2HE LYS 110 1HE LYS 110 -13.049 -3.483 -5.074
909 1HZ LYS 110 1HZ LYS 110 -11.272 -3.294 -7.358
910 2HZ LYS 110 2HZ LYS 110 -11.236 -1.968 -6.309
911 3HZ LYS 110 3HZ LYS 110 -12.695 -2.445 -7.019
Start of MODEL 12
1 1H ALA 1 1HT ALA 1 21.066 13.563 -26.312
2 2H ALA 1 2HT ALA 1 22.025 14.870 -26.876
3 3H ALA 1 3HT ALA 1 20.537 15.176 -26.074
4 HA ALA 1 HA ALA 1 22.709 13.717 -24.771
5 1HB ALA 1 1HB ALA 1 23.136 16.070 -23.723
6 2HB ALA 1 2HB ALA 1 22.456 16.652 -25.242
7 3HB ALA 1 3HB ALA 1 23.892 15.631 -25.254
8 H THR 2 H THR 2 19.828 13.416 -24.724
9 HA THR 2 HA THR 2 19.218 14.443 -22.032
10 HB THR 2 HB THR 2 17.304 13.512 -24.182
11 HG1 THR 2 1HG THR 2 18.066 16.087 -23.293
12 1HG2 THR 2 1HG2 THR 2 15.553 13.880 -22.818
13 2HG2 THR 2 2HG2 THR 2 16.376 15.156 -21.919
14 3HG2 THR 2 3HG2 THR 2 16.733 13.464 -21.575
15 H SER 3 H SER 3 20.090 12.841 -20.776
16 HA SER 3 HA SER 3 19.413 10.062 -21.314
17 1HB SER 3 2HB SER 3 20.869 9.643 -19.283
18 2HB SER 3 1HB SER 3 21.683 10.413 -20.645
19 HG SER 3 HG SER 3 20.611 11.782 -18.401
20 H THR 4 H THR 4 17.631 9.175 -20.523
21 HA THR 4 HA THR 4 16.027 10.503 -18.561
22 HB THR 4 HB THR 4 14.489 8.641 -18.831
23 HG1 THR 4 1HG THR 4 15.056 6.813 -19.935
24 1HG2 THR 4 1HG2 THR 4 14.013 8.727 -21.155
25 2HG2 THR 4 2HG2 THR 4 15.669 9.202 -21.536
26 3HG2 THR 4 3HG2 THR 4 14.608 10.315 -20.672
27 H LYS 5 H LYS 5 16.021 10.252 -16.420
28 HA LYS 5 HA LYS 5 17.985 8.648 -15.133
29 1HB LYS 5 2HB LYS 5 15.590 10.036 -13.916
30 2HB LYS 5 1HB LYS 5 17.009 9.461 -13.051
31 1HG LYS 5 2HG LYS 5 17.475 11.371 -15.260
32 2HG LYS 5 1HG LYS 5 16.697 11.995 -13.804
33 1HD LYS 5 2HD LYS 5 18.797 12.247 -13.046
34 2HD LYS 5 1HD LYS 5 18.720 10.510 -12.747
35 1HE LYS 5 2HE LYS 5 19.474 11.287 -15.483
36 2HE LYS 5 1HE LYS 5 20.635 11.724 -14.230
37 1HZ LYS 5 1HZ LYS 5 20.026 9.188 -13.578
38 2HZ LYS 5 2HZ LYS 5 21.360 9.642 -14.514
39 3HZ LYS 5 3HZ LYS 5 19.937 9.123 -15.266
40 H LYS 6 H LYS 6 17.817 6.714 -14.093
41 HA LYS 6 HA LYS 6 15.310 5.246 -14.504
42 1HB LYS 6 2HB LYS 6 17.728 4.482 -15.299
43 2HB LYS 6 1HB LYS 6 17.811 3.869 -13.653
44 1HG LYS 6 2HG LYS 6 15.413 2.903 -14.373
45 2HG LYS 6 1HG LYS 6 16.212 2.939 -15.946
46 1HD LYS 6 2HD LYS 6 17.466 1.705 -13.505
47 2HD LYS 6 1HD LYS 6 16.445 0.794 -14.620
48 1HE LYS 6 2HE LYS 6 18.020 0.754 -16.240
49 2HE LYS 6 1HE LYS 6 18.607 2.371 -15.853
50 1HZ LYS 6 1HZ LYS 6 20.360 1.185 -15.107
51 2HZ LYS 6 2HZ LYS 6 19.455 -0.211 -14.810
52 3HZ LYS 6 3HZ LYS 6 19.420 1.067 -13.705
53 H LEU 7 H LEU 7 14.208 4.325 -12.889
54 HA LEU 7 HA LEU 7 14.719 5.295 -10.238
55 1HB LEU 7 2HB LEU 7 12.598 3.375 -11.194
56 2HB LEU 7 1HB LEU 7 12.620 4.200 -9.651
57 HG LEU 7 HG LEU 7 11.058 5.385 -10.930
58 1HD1 LEU 7 1HD1 LEU 7 12.391 6.997 -9.864
59 2HD1 LEU 7 2HD1 LEU 7 12.218 7.564 -11.523
60 3HD1 LEU 7 3HD1 LEU 7 13.713 6.783 -11.009
61 1HD2 LEU 7 1HD2 LEU 7 11.047 5.621 -13.164
62 2HD2 LEU 7 2HD2 LEU 7 12.219 4.304 -13.102
63 3HD2 LEU 7 3HD2 LEU 7 12.772 5.973 -13.245
64 H HIS 8 H HIS 8 16.139 4.366 -8.948
65 HA HIS 8 HA HIS 8 17.096 1.713 -9.306
66 1HB HIS 8 2HB HIS 8 18.302 3.735 -8.249
67 2HB HIS 8 1HB HIS 8 17.432 3.314 -6.780
68 HD1 HIS 8 1HD HIS 8 19.330 2.453 -5.382
69 HD2 HIS 8 2HD HIS 8 19.174 0.677 -9.135
70 HE1 HIS 8 1HE HIS 8 21.018 0.590 -5.315
71 HE2 HIS 8 2HE HIS 8 20.832 -0.533 -7.561
72 H LYS 9 H LYS 9 16.909 -0.065 -7.852
73 HA LYS 9 HA LYS 9 14.326 -0.106 -6.449
74 1HB LYS 9 2HB LYS 9 15.931 -2.219 -7.845
75 2HB LYS 9 1HB LYS 9 14.757 -2.672 -6.617
76 1HG LYS 9 2HG LYS 9 13.196 -1.098 -8.072
77 2HG LYS 9 1HG LYS 9 14.338 -1.565 -9.332
78 1HD LYS 9 2HD LYS 9 13.569 -3.862 -7.781
79 2HD LYS 9 1HD LYS 9 12.138 -3.027 -8.387
80 1HE LYS 9 2HE LYS 9 12.533 -4.308 -10.209
81 2HE LYS 9 1HE LYS 9 13.634 -2.990 -10.605
82 1HZ LYS 9 1HZ LYS 9 15.376 -4.338 -9.389
83 2HZ LYS 9 2HZ LYS 9 14.866 -4.943 -10.884
84 3HZ LYS 9 3HZ LYS 9 14.290 -5.635 -9.451
85 H GLU 10 H GLU 10 14.609 0.318 -4.353
86 HA GLU 10 HA GLU 10 16.858 -0.967 -2.955
87 1HB GLU 10 2HB GLU 10 15.266 1.492 -2.208
88 2HB GLU 10 1HB GLU 10 16.519 0.772 -1.208
89 1HG GLU 10 2HG GLU 10 18.041 1.103 -3.254
90 2HG GLU 10 1HG GLU 10 16.787 2.207 -3.817
91 HA PRO 11 HA PRO 11 13.877 -3.695 -1.085
92 1HB PRO 11 2HB PRO 11 15.849 -3.757 1.139
93 2HB PRO 11 1HB PRO 11 15.130 -5.093 0.235
94 1HG PRO 11 2HG PRO 11 17.654 -4.355 -0.195
95 2HG PRO 11 1HG PRO 11 16.610 -4.864 -1.535
96 1HD PRO 11 2HD PRO 11 17.461 -2.116 -0.729
97 2HD PRO 11 1HD PRO 11 17.230 -2.797 -2.353
98 H ALA 12 H ALA 12 12.101 -2.940 -0.170
99 HA ALA 12 HA ALA 12 12.248 -1.593 2.408
100 1HB ALA 12 1HB ALA 12 10.804 0.228 1.751
101 2HB ALA 12 2HB ALA 12 10.701 -0.403 0.108
102 3HB ALA 12 3HB ALA 12 12.235 0.216 0.720
103 H THR 13 H THR 13 11.085 -2.987 3.601
104 HA THR 13 HA THR 13 8.509 -3.904 2.502
105 HB THR 13 HB THR 13 10.049 -5.765 2.783
106 HG1 THR 13 1HG THR 13 7.782 -5.974 3.413
107 1HG2 THR 13 1HG2 THR 13 11.006 -4.421 5.005
108 2HG2 THR 13 2HG2 THR 13 11.447 -6.044 4.475
109 3HG2 THR 13 3HG2 THR 13 10.164 -5.824 5.664
110 H LEU 14 H LEU 14 6.843 -4.377 4.166
111 HA LEU 14 HA LEU 14 6.933 -2.332 6.278
112 1HB LEU 14 2HB LEU 14 4.497 -2.396 6.241
113 2HB LEU 14 1HB LEU 14 5.147 -2.034 4.654
114 HG LEU 14 HG LEU 14 4.851 -4.799 4.640
115 1HD1 LEU 14 1HD1 LEU 14 2.287 -3.649 5.683
116 2HD1 LEU 14 2HD1 LEU 14 3.481 -4.373 6.761
117 3HD1 LEU 14 3HD1 LEU 14 2.745 -5.340 5.482
118 1HD2 LEU 14 1HD2 LEU 14 3.606 -4.386 2.795
119 2HD2 LEU 14 2HD2 LEU 14 4.258 -2.761 3.015
120 3HD2 LEU 14 3HD2 LEU 14 2.636 -3.146 3.590
121 H ILE 15 H ILE 15 6.388 -2.828 8.386
122 HA ILE 15 HA ILE 15 7.039 -5.398 9.319
123 HB ILE 15 HB ILE 15 5.464 -3.304 10.818
124 1HG1 ILE 15 2HG1 ILE 15 7.481 -2.285 9.930
125 2HG1 ILE 15 1HG1 ILE 15 7.674 -2.545 11.660
126 1HG2 ILE 15 1HG2 ILE 15 7.363 -5.351 11.930
127 2HG2 ILE 15 2HG2 ILE 15 5.636 -5.657 11.743
128 3HG2 ILE 15 3HG2 ILE 15 6.192 -4.356 12.796
129 1HD1 ILE 15 1HD1 ILE 15 8.789 -4.786 10.854
130 2HD1 ILE 15 2HD1 ILE 15 9.693 -3.272 10.913
131 3HD1 ILE 15 3HD1 ILE 15 9.043 -3.853 9.379
132 H LYS 16 H LYS 16 3.871 -3.748 9.407
133 HA LYS 16 HA LYS 16 2.446 -6.056 8.566
134 1HB LYS 16 2HB LYS 16 1.157 -6.293 10.760
135 2HB LYS 16 1HB LYS 16 2.775 -6.978 10.706
136 1HG LYS 16 2HG LYS 16 3.557 -5.583 12.275
137 2HG LYS 16 1HG LYS 16 2.662 -4.201 11.638
138 1HD LYS 16 2HD LYS 16 0.591 -5.468 12.601
139 2HD LYS 16 1HD LYS 16 1.795 -6.293 13.590
140 1HE LYS 16 2HE LYS 16 1.951 -3.337 13.439
141 2HE LYS 16 1HE LYS 16 0.610 -4.028 14.352
142 1HZ LYS 16 1HZ LYS 16 2.332 -3.746 15.887
143 2HZ LYS 16 2HZ LYS 16 3.510 -4.353 14.835
144 3HZ LYS 16 3HZ LYS 16 2.369 -5.397 15.520
145 H ALA 17 H ALA 17 0.476 -5.484 7.812
146 HA ALA 17 HA ALA 17 -0.449 -2.757 8.440
147 1HB ALA 17 1HB ALA 17 0.322 -3.506 6.033
148 2HB ALA 17 2HB ALA 17 -1.050 -2.423 6.260
149 3HB ALA 17 3HB ALA 17 -1.321 -4.139 5.955
150 H ILE 18 H ILE 18 -2.524 -2.438 9.077
151 HA ILE 18 HA ILE 18 -3.977 -4.523 10.229
152 HB ILE 18 HB ILE 18 -4.275 -2.182 10.887
153 1HG1 ILE 18 2HG1 ILE 18 -6.971 -2.995 9.886
154 2HG1 ILE 18 1HG1 ILE 18 -6.128 -4.065 11.001
155 1HG2 ILE 18 1HG2 ILE 18 -5.293 -0.553 9.561
156 2HG2 ILE 18 2HG2 ILE 18 -5.916 -1.742 8.416
157 3HG2 ILE 18 3HG2 ILE 18 -4.191 -1.379 8.460
158 1HD1 ILE 18 1HD1 ILE 18 -7.738 -2.428 12.025
159 2HD1 ILE 18 2HD1 ILE 18 -6.599 -1.157 11.577
160 3HD1 ILE 18 3HD1 ILE 18 -6.107 -2.428 12.698
161 H ASP 19 H ASP 19 -4.434 -2.870 7.128
162 HA ASP 19 HA ASP 19 -5.145 -4.972 5.581
163 1HB ASP 19 2HB ASP 19 -7.734 -4.664 5.546
164 2HB ASP 19 1HB ASP 19 -7.009 -5.666 6.799
165 H GLY 20 H GLY 20 -7.762 -2.791 5.289
166 1HA GLY 20 2HA GLY 20 -6.403 -1.494 3.058
167 2HA GLY 20 1HA GLY 20 -8.132 -1.488 3.367
168 H ASP 21 H ASP 21 -7.086 -0.830 6.299
169 HA ASP 21 HA ASP 21 -7.663 1.944 6.110
170 1HB ASP 21 2HB ASP 21 -6.838 0.100 8.318
171 2HB ASP 21 1HB ASP 21 -6.796 1.840 8.586
172 H THR 22 H THR 22 -4.797 0.694 7.786
173 HA THR 22 HA THR 22 -3.149 2.566 6.227
174 HB THR 22 HB THR 22 -3.054 2.188 9.225
175 HG1 THR 22 1HG THR 22 -3.744 4.343 9.256
176 1HG2 THR 22 1HG2 THR 22 -0.826 2.608 8.342
177 2HG2 THR 22 2HG2 THR 22 -1.431 3.995 9.248
178 3HG2 THR 22 3HG2 THR 22 -1.428 4.027 7.485
179 H VAL 23 H VAL 23 -0.869 2.095 6.231
180 HA VAL 23 HA VAL 23 -0.047 -0.548 7.126
181 HB VAL 23 HB VAL 23 -0.917 -1.016 4.903
182 1HG1 VAL 23 1HG1 VAL 23 -0.739 0.368 3.176
183 2HG1 VAL 23 2HG1 VAL 23 1.016 0.449 3.335
184 3HG1 VAL 23 3HG1 VAL 23 -0.008 1.534 4.278
185 1HG2 VAL 23 1HG2 VAL 23 1.952 -1.071 4.268
186 2HG2 VAL 23 2HG2 VAL 23 0.780 -2.386 4.354
187 3HG2 VAL 23 3HG2 VAL 23 1.516 -1.763 5.830
188 H LYS 24 H LYS 24 1.668 0.009 8.314
189 HA LYS 24 HA LYS 24 3.356 2.234 7.576
190 1HB LYS 24 2HB LYS 24 2.621 1.305 9.966
191 2HB LYS 24 1HB LYS 24 4.111 0.390 9.783
192 1HG LYS 24 2HG LYS 24 5.423 2.332 9.697
193 2HG LYS 24 1HG LYS 24 4.022 3.366 9.412
194 1HD LYS 24 2HD LYS 24 3.840 1.823 11.885
195 2HD LYS 24 1HD LYS 24 5.226 2.916 11.845
196 1HE LYS 24 2HE LYS 24 2.882 4.235 10.823
197 2HE LYS 24 1HE LYS 24 2.552 3.549 12.414
198 1HZ LYS 24 1HZ LYS 24 5.075 4.964 12.139
199 2HZ LYS 24 2HZ LYS 24 3.962 4.969 13.413
200 3HZ LYS 24 3HZ LYS 24 3.683 5.922 12.045
201 H LEU 25 H LEU 25 4.850 1.989 6.061
202 HA LEU 25 HA LEU 25 6.111 -0.599 5.629
203 1HB LEU 25 2HB LEU 25 5.827 1.915 4.097
204 2HB LEU 25 1HB LEU 25 7.321 1.029 3.846
205 HG LEU 25 HG LEU 25 4.693 -0.390 3.622
206 1HD1 LEU 25 1HD1 LEU 25 5.851 1.589 1.730
207 2HD1 LEU 25 2HD1 LEU 25 4.165 1.231 2.100
208 3HD1 LEU 25 3HD1 LEU 25 5.094 0.137 1.075
209 1HD2 LEU 25 1HD2 LEU 25 7.334 -0.758 2.215
210 2HD2 LEU 25 2HD2 LEU 25 5.934 -1.827 2.137
211 3HD2 LEU 25 3HD2 LEU 25 6.823 -1.647 3.649
212 H MET 26 H MET 26 8.484 -0.716 5.360
213 HA MET 26 HA MET 26 9.809 0.932 7.404
214 1HB MET 26 2HB MET 26 9.696 -1.618 7.622
215 2HB MET 26 1HB MET 26 10.851 -1.669 6.299
216 1HG MET 26 2HG MET 26 12.564 -0.976 7.584
217 2HG MET 26 1HG MET 26 11.550 0.096 8.550
218 1HE MET 26 1HE MET 26 12.998 -4.008 9.088
219 2HE MET 26 2HE MET 26 12.458 -3.301 7.565
220 3HE MET 26 3HE MET 26 11.352 -4.290 8.518
221 H TYR 27 H TYR 27 10.857 2.592 6.524
222 HA TYR 27 HA TYR 27 12.545 2.068 4.167
223 1HB TYR 27 2HB TYR 27 10.584 3.432 3.545
224 2HB TYR 27 1HB TYR 27 11.034 4.621 4.764
225 HD1 TYR 27 1HD TYR 27 11.590 6.543 3.575
226 HD2 TYR 27 2HD TYR 27 13.166 2.800 2.306
227 HE1 TYR 27 1HE TYR 27 12.998 7.701 1.924
228 HE2 TYR 27 2HE TYR 27 14.577 3.948 0.653
229 HH TYR 27 HH TYR 27 14.689 6.027 -0.548
230 H LYS 28 H LYS 28 14.409 1.770 5.349
231 HA LYS 28 HA LYS 28 16.205 2.260 6.673
232 1HB LYS 28 2HB LYS 28 17.324 4.319 6.098
233 2HB LYS 28 1HB LYS 28 16.590 3.639 4.654
234 1HG LYS 28 2HG LYS 28 14.976 5.287 4.534
235 2HG LYS 28 1HG LYS 28 15.131 5.705 6.241
236 1HD LYS 28 2HD LYS 28 16.676 7.246 5.796
237 2HD LYS 28 1HD LYS 28 17.630 6.098 4.855
238 1HE LYS 28 2HE LYS 28 15.583 6.595 3.148
239 2HE LYS 28 1HE LYS 28 15.716 8.148 3.971
240 1HZ LYS 28 1HZ LYS 28 18.006 6.741 2.714
241 2HZ LYS 28 2HZ LYS 28 17.992 8.313 3.337
242 3HZ LYS 28 3HZ LYS 28 17.103 7.947 1.945
243 H GLY 29 H GLY 29 13.844 2.369 8.152
244 1HA GLY 29 2HA GLY 29 13.438 2.917 10.384
245 2HA GLY 29 1HA GLY 29 14.697 4.139 10.289
246 H GLN 30 H GLN 30 12.176 4.025 7.897
247 HA GLN 30 HA GLN 30 10.900 6.357 9.165
248 1HB GLN 30 2HB GLN 30 12.312 6.998 7.224
249 2HB GLN 30 1HB GLN 30 11.338 5.951 6.203
250 1HG GLN 30 2HG GLN 30 10.330 7.939 5.782
251 2HG GLN 30 1HG GLN 30 9.371 7.413 7.164
252 1HE2 GLN 30 1HE2 GLN 30 9.205 8.748 8.828
253 2HE2 GLN 30 2HE2 GLN 30 10.197 10.134 9.112
254 HA PRO 31 HA PRO 31 7.395 3.561 8.728
255 1HB PRO 31 2HB PRO 31 5.610 5.102 10.062
256 2HB PRO 31 1HB PRO 31 6.830 4.122 10.887
257 1HG PRO 31 2HG PRO 31 6.859 7.051 10.261
258 2HG PRO 31 1HG PRO 31 7.335 6.221 11.754
259 1HD PRO 31 2HD PRO 31 9.138 7.074 9.919
260 2HD PRO 31 1HD PRO 31 9.399 5.630 10.917
261 H MET 32 H MET 32 7.419 4.024 6.401
262 HA MET 32 HA MET 32 5.914 6.281 5.428
263 1HB MET 32 2HB MET 32 7.373 3.988 4.193
264 2HB MET 32 1HB MET 32 6.170 4.834 3.228
265 1HG MET 32 2HG MET 32 7.596 6.908 4.255
266 2HG MET 32 1HG MET 32 8.841 5.672 4.076
267 1HE MET 32 1HE MET 32 8.367 4.774 0.239
268 2HE MET 32 2HE MET 32 7.621 4.023 1.650
269 3HE MET 32 3HE MET 32 9.335 4.433 1.674
270 H THR 33 H THR 33 3.780 6.360 5.203
271 HA THR 33 HA THR 33 2.281 3.827 5.208
272 HB THR 33 HB THR 33 1.799 5.277 7.125
273 HG1 THR 33 1HG THR 33 0.091 4.047 6.161
274 1HG2 THR 33 1HG2 THR 33 1.409 7.329 5.029
275 2HG2 THR 33 2HG2 THR 33 2.071 7.475 6.658
276 3HG2 THR 33 3HG2 THR 33 0.327 7.354 6.422
277 H PHE 34 H PHE 34 0.570 3.535 3.759
278 HA PHE 34 HA PHE 34 0.855 5.045 1.296
279 1HB PHE 34 2HB PHE 34 -0.135 3.258 0.202
280 2HB PHE 34 1HB PHE 34 0.658 2.451 1.548
281 HD1 PHE 34 1HD PHE 34 -1.289 3.101 3.726
282 HD2 PHE 34 2HD PHE 34 -1.888 1.813 -0.288
283 HE1 PHE 34 1HE PHE 34 -3.439 2.092 4.372
284 HE2 PHE 34 2HE PHE 34 -4.038 0.804 0.353
285 HZ PHE 34 HZ PHE 34 -4.816 0.943 2.686
286 H ARG 35 H ARG 35 -1.597 4.939 0.147
287 HA ARG 35 HA ARG 35 -2.889 7.202 0.961
288 1HB ARG 35 2HB ARG 35 -4.886 6.338 -0.262
289 2HB ARG 35 1HB ARG 35 -3.386 6.214 -1.170
290 1HG ARG 35 2HG ARG 35 -3.240 3.827 -0.453
291 2HG ARG 35 1HG ARG 35 -4.854 4.001 0.242
292 1HD ARG 35 2HD ARG 35 -5.241 4.990 -2.258
293 2HD ARG 35 1HD ARG 35 -4.014 3.762 -2.563
294 HE ARG 35 HE ARG 35 -5.854 2.486 -1.020
295 1HH1 ARG 35 1HH1 ARG 35 -6.006 4.271 -4.014
296 2HH1 ARG 35 2HH1 ARG 35 -7.349 3.368 -4.630
297 1HH2 ARG 35 1HH2 ARG 35 -7.620 1.296 -1.827
298 2HH2 ARG 35 2HH2 ARG 35 -8.266 1.679 -3.388
299 H LEU 36 H LEU 36 -4.730 7.689 2.181
300 HA LEU 36 HA LEU 36 -5.125 5.936 4.465
301 1HB LEU 36 2HB LEU 36 -6.699 8.419 4.300
302 2HB LEU 36 1HB LEU 36 -5.752 7.771 5.626
303 HG LEU 36 HG LEU 36 -3.760 8.514 3.962
304 1HD1 LEU 36 1HD1 LEU 36 -4.770 10.978 3.437
305 2HD1 LEU 36 2HD1 LEU 36 -6.164 9.952 3.100
306 3HD1 LEU 36 3HD1 LEU 36 -4.641 9.674 2.257
307 1HD2 LEU 36 1HD2 LEU 36 -4.070 10.808 5.315
308 2HD2 LEU 36 2HD2 LEU 36 -3.472 9.322 6.053
309 3HD2 LEU 36 3HD2 LEU 36 -5.168 9.775 6.230
310 H LEU 37 H LEU 37 -7.464 5.879 5.335
311 HA LEU 37 HA LEU 37 -9.133 4.834 3.179
312 1HB LEU 37 2HB LEU 37 -10.383 3.700 4.873
313 2HB LEU 37 1HB LEU 37 -8.678 3.452 5.193
314 HG LEU 37 HG LEU 37 -10.065 5.685 6.600
315 1HD1 LEU 37 1HD1 LEU 37 -10.120 3.095 7.984
316 2HD1 LEU 37 2HD1 LEU 37 -11.266 3.264 6.654
317 3HD1 LEU 37 3HD1 LEU 37 -11.290 4.416 7.988
318 1HD2 LEU 37 1HD2 LEU 37 -7.906 5.711 7.273
319 2HD2 LEU 37 2HD2 LEU 37 -7.659 4.000 6.922
320 3HD2 LEU 37 3HD2 LEU 37 -8.488 4.487 8.400
321 H LEU 38 H LEU 38 -11.409 5.338 3.079
322 HA LEU 38 HA LEU 38 -11.916 8.123 3.262
323 1HB LEU 38 2HB LEU 38 -13.616 5.737 2.600
324 2HB LEU 38 1HB LEU 38 -14.320 7.337 2.734
325 HG LEU 38 HG LEU 38 -11.980 6.905 0.920
326 1HD1 LEU 38 1HD1 LEU 38 -13.709 5.145 0.457
327 2HD1 LEU 38 2HD1 LEU 38 -13.373 6.242 -0.882
328 3HD1 LEU 38 3HD1 LEU 38 -14.833 6.452 0.082
329 1HD2 LEU 38 1HD2 LEU 38 -14.274 8.623 0.229
330 2HD2 LEU 38 2HD2 LEU 38 -12.542 8.910 0.050
331 3HD2 LEU 38 3HD2 LEU 38 -13.316 9.129 1.620
332 H VAL 39 H VAL 39 -14.282 8.671 4.213
333 HA VAL 39 HA VAL 39 -13.964 8.398 7.063
334 HB VAL 39 HB VAL 39 -16.237 9.726 5.584
335 1HG1 VAL 39 1HG1 VAL 39 -15.181 9.967 8.395
336 2HG1 VAL 39 2HG1 VAL 39 -16.767 9.387 7.886
337 3HG1 VAL 39 3HG1 VAL 39 -16.344 11.086 7.681
338 1HG2 VAL 39 1HG2 VAL 39 -13.937 10.545 4.934
339 2HG2 VAL 39 2HG2 VAL 39 -13.748 11.075 6.605
340 3HG2 VAL 39 3HG2 VAL 39 -15.024 11.762 5.601
341 H ASP 40 H ASP 40 -15.198 7.243 8.465
342 HA ASP 40 HA ASP 40 -17.021 5.282 7.279
343 1HB ASP 40 2HB ASP 40 -15.000 4.837 8.973
344 2HB ASP 40 1HB ASP 40 -16.268 5.146 10.156
345 H THR 41 H THR 41 -18.947 6.344 7.067
346 HA THR 41 HA THR 41 -20.183 7.290 9.570
347 HB THR 41 HB THR 41 -21.543 8.827 8.076
348 HG1 THR 41 1HG THR 41 -21.102 7.916 6.081
349 1HG2 THR 41 1HG2 THR 41 -18.885 9.848 7.578
350 2HG2 THR 41 2HG2 THR 41 -19.078 9.257 9.229
351 3HG2 THR 41 3HG2 THR 41 -20.174 10.486 8.599
352 HA PRO 42 HA PRO 42 -23.475 4.442 8.927
353 1HB PRO 42 2HB PRO 42 -25.660 5.926 9.642
354 2HB PRO 42 1HB PRO 42 -24.530 5.220 10.801
355 1HG PRO 42 2HG PRO 42 -24.662 8.017 9.747
356 2HG PRO 42 1HG PRO 42 -24.372 7.458 11.406
357 1HD PRO 42 2HD PRO 42 -22.365 8.279 9.815
358 2HD PRO 42 1HD PRO 42 -22.152 6.959 10.985
359 H GLU 43 H GLU 43 -23.382 7.414 7.205
360 HA GLU 43 HA GLU 43 -25.706 7.270 5.671
361 1HB GLU 43 2HB GLU 43 -23.172 8.700 5.569
362 2HB GLU 43 1HB GLU 43 -23.792 8.339 3.964
363 1HG GLU 43 2HG GLU 43 -26.021 9.256 5.245
364 2HG GLU 43 1HG GLU 43 -24.744 10.234 5.969
365 H THR 44 H THR 44 -22.722 5.490 5.443
366 HA THR 44 HA THR 44 -23.896 3.659 3.568
367 HB THR 44 HB THR 44 -21.477 5.252 2.697
368 HG1 THR 44 1HG THR 44 -24.168 5.281 1.822
369 1HG2 THR 44 1HG2 THR 44 -22.708 2.791 1.678
370 2HG2 THR 44 2HG2 THR 44 -21.066 3.408 1.495
371 3HG2 THR 44 3HG2 THR 44 -22.362 4.030 0.472
372 H LYS 45 H LYS 45 -23.465 2.386 5.490
373 HA LYS 45 HA LYS 45 -20.772 1.915 6.336
374 1HB LYS 45 2HB LYS 45 -23.057 1.585 7.608
375 2HB LYS 45 1HB LYS 45 -22.982 -0.020 6.896
376 1HG LYS 45 2HG LYS 45 -20.505 0.126 7.906
377 2HG LYS 45 1HG LYS 45 -21.352 1.183 9.037
378 1HD LYS 45 2HD LYS 45 -22.765 -1.313 8.430
379 2HD LYS 45 1HD LYS 45 -21.209 -1.537 9.234
380 1HE LYS 45 2HE LYS 45 -21.894 -0.026 11.015
381 2HE LYS 45 1HE LYS 45 -23.431 0.261 10.201
382 1HZ LYS 45 1HZ LYS 45 -24.256 -1.705 10.880
383 2HZ LYS 45 2HZ LYS 45 -23.096 -1.562 12.102
384 3HZ LYS 45 3HZ LYS 45 -22.780 -2.518 10.744
385 H HIS 46 H HIS 46 -19.606 -0.068 6.145
386 HA HIS 46 HA HIS 46 -20.036 -1.358 3.555
387 1HB HIS 46 2HB HIS 46 -17.646 -1.507 5.398
388 2HB HIS 46 1HB HIS 46 -17.733 -2.132 3.755
389 HD1 HIS 46 1HD HIS 46 -15.587 -0.503 3.464
390 HD2 HIS 46 2HD HIS 46 -19.277 1.343 3.964
391 HE1 HIS 46 1HE HIS 46 -15.267 1.863 2.677
392 HE2 HIS 46 2HE HIS 46 -17.534 2.937 2.909
393 HA PRO 47 HA PRO 47 -21.686 -4.747 6.105
394 1HB PRO 47 2HB PRO 47 -22.928 -6.027 4.068
395 2HB PRO 47 1HB PRO 47 -23.628 -4.616 4.873
396 1HG PRO 47 2HG PRO 47 -22.132 -4.769 2.284
397 2HG PRO 47 1HG PRO 47 -23.610 -3.868 2.670
398 1HD PRO 47 2HD PRO 47 -21.167 -2.699 2.589
399 2HD PRO 47 1HD PRO 47 -22.451 -2.157 3.688
400 H LYS 48 H LYS 48 -20.252 -5.156 2.876
401 HA LYS 48 HA LYS 48 -18.513 -7.243 3.939
402 1HB LYS 48 2HB LYS 48 -20.131 -7.684 1.424
403 2HB LYS 48 1HB LYS 48 -19.041 -8.825 2.200
404 1HG LYS 48 2HG LYS 48 -20.688 -8.476 4.234
405 2HG LYS 48 1HG LYS 48 -21.802 -8.029 2.941
406 1HD LYS 48 2HD LYS 48 -21.597 -10.146 1.905
407 2HD LYS 48 1HD LYS 48 -20.195 -10.571 2.888
408 1HE LYS 48 2HE LYS 48 -22.800 -9.971 4.217
409 2HE LYS 48 1HE LYS 48 -22.555 -11.543 3.457
410 1HZ LYS 48 1HZ LYS 48 -21.968 -11.341 5.895
411 2HZ LYS 48 2HZ LYS 48 -20.627 -10.433 5.408
412 3HZ LYS 48 3HZ LYS 48 -20.794 -12.035 4.894
413 H LYS 49 H LYS 49 -19.453 -5.586 0.924
414 HA LYS 49 HA LYS 49 -16.626 -5.406 0.189
415 1HB LYS 49 2HB LYS 49 -19.113 -4.890 -1.446
416 2HB LYS 49 1HB LYS 49 -17.465 -4.764 -2.049
417 1HG LYS 49 2HG LYS 49 -17.116 -7.135 -1.646
418 2HG LYS 49 1HG LYS 49 -18.745 -7.275 -0.984
419 1HD LYS 49 2HD LYS 49 -19.538 -6.365 -3.243
420 2HD LYS 49 1HD LYS 49 -17.910 -6.729 -3.817
421 1HE LYS 49 2HE LYS 49 -18.344 -9.073 -2.801
422 2HE LYS 49 1HE LYS 49 -20.041 -8.600 -2.859
423 1HZ LYS 49 1HZ LYS 49 -20.099 -8.767 -5.085
424 2HZ LYS 49 2HZ LYS 49 -18.758 -9.777 -4.876
425 3HZ LYS 49 3HZ LYS 49 -18.536 -8.155 -5.297
426 H GLY 50 H GLY 50 -19.437 -3.526 0.933
427 1HA GLY 50 2HA GLY 50 -19.692 -1.359 1.613
428 2HA GLY 50 1HA GLY 50 -17.944 -1.237 1.696
429 H VAL 51 H VAL 51 -17.097 -1.489 -0.908
430 HA VAL 51 HA VAL 51 -18.753 0.451 -2.364
431 HB VAL 51 HB VAL 51 -17.052 1.842 -1.539
432 1HG1 VAL 51 1HG1 VAL 51 -14.704 0.424 -2.556
433 2HG1 VAL 51 2HG1 VAL 51 -15.538 -0.401 -1.240
434 3HG1 VAL 51 3HG1 VAL 51 -14.959 1.249 -1.019
435 1HG2 VAL 51 1HG2 VAL 51 -15.707 1.300 -4.113
436 2HG2 VAL 51 2HG2 VAL 51 -16.363 2.803 -3.465
437 3HG2 VAL 51 3HG2 VAL 51 -17.443 1.606 -4.180
438 H GLU 52 H GLU 52 -15.711 -1.359 -2.981
439 HA GLU 52 HA GLU 52 -17.012 -2.414 -5.408
440 1HB GLU 52 2HB GLU 52 -15.192 -0.674 -5.789
441 2HB GLU 52 1HB GLU 52 -14.053 -1.874 -5.202
442 1HG GLU 52 2HG GLU 52 -14.089 -1.894 -7.603
443 2HG GLU 52 1HG GLU 52 -14.771 -3.400 -6.990
444 H LYS 53 H LYS 53 -13.910 -3.070 -3.924
445 HA LYS 53 HA LYS 53 -14.646 -5.608 -2.834
446 1HB LYS 53 2HB LYS 53 -13.190 -5.425 -5.444
447 2HB LYS 53 1HB LYS 53 -12.784 -6.717 -4.325
448 1HG LYS 53 2HG LYS 53 -14.463 -7.888 -5.163
449 2HG LYS 53 1HG LYS 53 -15.576 -6.710 -4.468
450 1HD LYS 53 2HD LYS 53 -14.960 -5.360 -6.652
451 2HD LYS 53 1HD LYS 53 -14.577 -6.972 -7.262
452 1HE LYS 53 2HE LYS 53 -16.902 -7.615 -6.332
453 2HE LYS 53 1HE LYS 53 -17.205 -5.879 -6.327
454 1HZ LYS 53 1HZ LYS 53 -16.647 -7.635 -8.638
455 2HZ LYS 53 2HZ LYS 53 -16.465 -5.956 -8.739
456 3HZ LYS 53 3HZ LYS 53 -17.978 -6.622 -8.382
457 H TYR 54 H TYR 54 -12.877 -2.878 -2.806
458 HA TYR 54 HA TYR 54 -10.383 -3.908 -1.779
459 1HB TYR 54 2HB TYR 54 -10.403 -1.831 -3.099
460 2HB TYR 54 1HB TYR 54 -11.460 -1.083 -1.910
461 HD1 TYR 54 1HD TYR 54 -8.044 -2.307 -2.540
462 HD2 TYR 54 2HD TYR 54 -10.594 -0.220 0.151
463 HE1 TYR 54 1HE TYR 54 -6.075 -1.523 -1.291
464 HE2 TYR 54 2HE TYR 54 -8.635 0.569 1.407
465 HH TYR 54 HH TYR 54 -6.341 0.033 1.773
466 H GLY 55 H GLY 55 -13.383 -3.760 -0.583
467 1HA GLY 55 2HA GLY 55 -12.758 -2.755 2.061
468 2HA GLY 55 1HA GLY 55 -14.305 -3.402 1.507
469 HA PRO 56 HA PRO 56 -13.081 -7.344 3.168
470 1HB PRO 56 2HB PRO 56 -14.315 -9.088 1.563
471 2HB PRO 56 1HB PRO 56 -15.224 -7.913 2.519
472 1HG PRO 56 2HG PRO 56 -14.665 -7.953 -0.390
473 2HG PRO 56 1HG PRO 56 -16.039 -7.258 0.482
474 1HD PRO 56 2HD PRO 56 -13.725 -5.899 -0.491
475 2HD PRO 56 1HD PRO 56 -15.045 -5.220 0.475
476 H GLU 57 H GLU 57 -12.666 -7.506 -0.383
477 HA GLU 57 HA GLU 57 -10.858 -9.654 -0.362
478 1HB GLU 57 2HB GLU 57 -12.126 -8.005 -2.297
479 2HB GLU 57 1HB GLU 57 -10.406 -8.026 -2.660
480 1HG GLU 57 2HG GLU 57 -11.510 -9.783 -3.866
481 2HG GLU 57 1HG GLU 57 -10.456 -10.485 -2.639
482 H ALA 58 H ALA 58 -10.188 -6.175 -0.933
483 HA ALA 58 HA ALA 58 -7.468 -6.254 -1.176
484 1HB ALA 58 1HB ALA 58 -7.563 -3.981 0.101
485 2HB ALA 58 2HB ALA 58 -9.303 -4.233 0.014
486 3HB ALA 58 3HB ALA 58 -8.353 -4.152 -1.467
487 H SER 59 H SER 59 -9.254 -6.054 1.898
488 HA SER 59 HA SER 59 -7.025 -6.026 3.593
489 1HB SER 59 2HB SER 59 -9.670 -7.298 4.294
490 2HB SER 59 1HB SER 59 -8.536 -6.484 5.369
491 HG SER 59 HG SER 59 -9.003 -4.566 4.006
492 H ALA 60 H ALA 60 -8.380 -8.566 1.734
493 HA ALA 60 HA ALA 60 -7.157 -10.666 3.337
494 1HB ALA 60 1HB ALA 60 -9.072 -10.600 1.059
495 2HB ALA 60 2HB ALA 60 -9.176 -11.455 2.598
496 3HB ALA 60 3HB ALA 60 -8.118 -12.059 1.323
497 H PHE 61 H PHE 61 -7.068 -9.654 -0.083
498 HA PHE 61 HA PHE 61 -4.705 -11.150 -0.636
499 1HB PHE 61 2HB PHE 61 -6.686 -10.013 -2.166
500 2HB PHE 61 1HB PHE 61 -5.320 -8.951 -2.481
501 HD1 PHE 61 1HD PHE 61 -5.318 -12.610 -1.837
502 HD2 PHE 61 2HD PHE 61 -4.690 -9.489 -4.663
503 HE1 PHE 61 1HE PHE 61 -4.431 -14.246 -3.444
504 HE2 PHE 61 2HE PHE 61 -3.802 -11.119 -6.273
505 HZ PHE 61 HZ PHE 61 -3.672 -13.502 -5.666
506 H THR 62 H THR 62 -5.268 -7.615 -0.712
507 HA THR 62 HA THR 62 -2.656 -6.793 -0.921
508 HB THR 62 HB THR 62 -4.568 -5.323 0.867
509 HG1 THR 62 1HG THR 62 -5.529 -4.516 -1.060
510 1HG2 THR 62 1HG2 THR 62 -3.203 -3.622 0.542
511 2HG2 THR 62 2HG2 THR 62 -3.455 -3.739 -1.199
512 3HG2 THR 62 3HG2 THR 62 -2.151 -4.648 -0.434
513 H LYS 63 H LYS 63 -4.277 -8.093 1.872
514 HA LYS 63 HA LYS 63 -2.323 -7.202 3.770
515 1HB LYS 63 2HB LYS 63 -4.576 -7.629 4.518
516 2HB LYS 63 1HB LYS 63 -4.488 -9.295 3.966
517 1HG LYS 63 2HG LYS 63 -2.868 -9.827 5.653
518 2HG LYS 63 1HG LYS 63 -2.753 -8.134 6.134
519 1HD LYS 63 2HD LYS 63 -5.304 -9.730 6.277
520 2HD LYS 63 1HD LYS 63 -4.171 -9.587 7.622
521 1HE LYS 63 2HE LYS 63 -4.457 -7.183 7.650
522 2HE LYS 63 1HE LYS 63 -5.503 -7.264 6.235
523 1HZ LYS 63 1HZ LYS 63 -7.246 -7.962 7.453
524 2HZ LYS 63 2HZ LYS 63 -6.419 -7.213 8.723
525 3HZ LYS 63 3HZ LYS 63 -6.303 -8.887 8.510
526 H LYS 64 H LYS 64 -2.569 -9.842 1.580
527 HA LYS 64 HA LYS 64 -0.626 -11.471 2.988
528 1HB LYS 64 2HB LYS 64 -2.696 -12.157 1.391
529 2HB LYS 64 1HB LYS 64 -1.399 -12.132 0.203
530 1HG LYS 64 2HG LYS 64 -0.666 -14.103 0.887
531 2HG LYS 64 1HG LYS 64 -0.531 -13.527 2.549
532 1HD LYS 64 2HD LYS 64 -3.275 -14.071 1.655
533 2HD LYS 64 1HD LYS 64 -2.225 -15.488 1.719
534 1HE LYS 64 2HE LYS 64 -1.619 -14.859 4.047
535 2HE LYS 64 1HE LYS 64 -2.806 -13.559 3.961
536 1HZ LYS 64 1HZ LYS 64 -4.558 -15.103 3.776
537 2HZ LYS 64 2HZ LYS 64 -3.576 -15.681 5.027
538 3HZ LYS 64 3HZ LYS 64 -3.507 -16.400 3.497
539 H MET 65 H MET 65 -0.801 -9.081 0.524
540 HA MET 65 HA MET 65 1.833 -9.689 -0.546
541 1HB MET 65 2HB MET 65 -0.077 -7.439 -1.199
542 2HB MET 65 1HB MET 65 1.409 -7.805 -2.065
543 1HG MET 65 2HG MET 65 -0.504 -10.026 -1.827
544 2HG MET 65 1HG MET 65 -1.029 -8.660 -2.810
545 1HE MET 65 1HE MET 65 1.401 -11.221 -1.975
546 2HE MET 65 2HE MET 65 2.665 -11.183 -3.206
547 3HE MET 65 3HE MET 65 1.193 -12.115 -3.483
548 H VAL 66 H VAL 66 0.728 -8.193 2.169
549 HA VAL 66 HA VAL 66 3.000 -6.314 2.207
550 HB VAL 66 HB VAL 66 1.680 -4.969 3.850
551 1HG1 VAL 66 1HG1 VAL 66 0.810 -3.657 2.203
552 2HG1 VAL 66 2HG1 VAL 66 0.078 -5.017 1.352
553 3HG1 VAL 66 3HG1 VAL 66 1.812 -4.723 1.219
554 1HG2 VAL 66 1HG2 VAL 66 -0.922 -5.461 3.313
555 2HG2 VAL 66 2HG2 VAL 66 -0.071 -6.071 4.730
556 3HG2 VAL 66 3HG2 VAL 66 -0.271 -7.099 3.312
557 H GLU 67 H GLU 67 0.940 -8.446 4.159
558 HA GLU 67 HA GLU 67 2.748 -8.268 6.420
559 1HB GLU 67 2HB GLU 67 0.256 -9.920 5.970
560 2HB GLU 67 1HB GLU 67 1.176 -9.902 7.466
561 1HG GLU 67 2HG GLU 67 0.682 -7.227 6.925
562 2HG GLU 67 1HG GLU 67 -0.816 -8.053 6.501
563 H ASN 68 H ASN 68 1.354 -11.121 4.826
564 HA ASN 68 HA ASN 68 3.481 -12.827 5.543
565 1HB ASN 68 2HB ASN 68 1.092 -12.990 3.820
566 2HB ASN 68 1HB ASN 68 2.413 -14.054 3.349
567 1HD2 ASN 68 1HD2 ASN 68 1.024 -12.968 6.431
568 2HD2 ASN 68 2HD2 ASN 68 0.830 -14.552 7.095
569 H ALA 69 H ALA 69 3.114 -10.507 3.060
570 HA ALA 69 HA ALA 69 5.378 -11.572 1.533
571 1HB ALA 69 1HB ALA 69 2.987 -10.055 0.875
572 2HB ALA 69 2HB ALA 69 4.039 -11.016 -0.168
573 3HB ALA 69 3HB ALA 69 4.451 -9.339 0.197
574 H LYS 70 H LYS 70 7.297 -10.854 2.235
575 HA LYS 70 HA LYS 70 7.533 -7.999 2.924
576 1HB LYS 70 2HB LYS 70 9.264 -8.626 4.587
577 2HB LYS 70 1HB LYS 70 7.668 -9.249 4.983
578 1HG LYS 70 2HG LYS 70 9.086 -11.179 3.414
579 2HG LYS 70 1HG LYS 70 10.083 -10.669 4.779
580 1HD LYS 70 2HD LYS 70 8.456 -11.332 6.348
581 2HD LYS 70 1HD LYS 70 7.201 -11.454 5.114
582 1HE LYS 70 2HE LYS 70 8.830 -13.252 4.103
583 2HE LYS 70 1HE LYS 70 9.426 -13.329 5.760
584 1HZ LYS 70 1HZ LYS 70 7.056 -14.433 4.661
585 2HZ LYS 70 2HZ LYS 70 6.675 -13.398 5.944
586 3HZ LYS 70 3HZ LYS 70 7.744 -14.686 6.187
587 H LYS 71 H LYS 71 7.946 -8.641 0.383
588 HA LYS 71 HA LYS 71 10.870 -8.509 0.119
589 1HB LYS 71 2HB LYS 71 8.946 -10.177 -1.494
590 2HB LYS 71 1HB LYS 71 10.539 -9.743 -2.098
591 1HG LYS 71 2HG LYS 71 10.505 -10.917 0.593
592 2HG LYS 71 1HG LYS 71 9.990 -11.990 -0.710
593 1HD LYS 71 2HD LYS 71 12.379 -10.442 -1.359
594 2HD LYS 71 1HD LYS 71 12.590 -11.501 0.037
595 1HE LYS 71 2HE LYS 71 11.287 -13.140 -1.703
596 2HE LYS 71 1HE LYS 71 12.251 -12.157 -2.804
597 1HZ LYS 71 1HZ LYS 71 14.142 -12.708 -1.146
598 2HZ LYS 71 2HZ LYS 71 13.683 -13.860 -2.296
599 3HZ LYS 71 3HZ LYS 71 13.149 -14.002 -0.697
600 H ILE 72 H ILE 72 8.817 -6.432 0.215
601 HA ILE 72 HA ILE 72 8.480 -5.476 -2.482
602 HB ILE 72 HB ILE 72 8.022 -3.837 -0.012
603 1HG1 ILE 72 2HG1 ILE 72 5.577 -4.998 -0.817
604 2HG1 ILE 72 1HG1 ILE 72 6.738 -6.317 -0.693
605 1HG2 ILE 72 1HG2 ILE 72 6.461 -2.644 -1.327
606 2HG2 ILE 72 2HG2 ILE 72 6.508 -3.859 -2.603
607 3HG2 ILE 72 3HG2 ILE 72 7.910 -2.830 -2.315
608 1HD1 ILE 72 1HD1 ILE 72 5.873 -6.245 1.427
609 2HD1 ILE 72 2HD1 ILE 72 5.716 -4.487 1.421
610 3HD1 ILE 72 3HD1 ILE 72 7.305 -5.231 1.600
611 H GLU 73 H GLU 73 9.383 -3.606 -3.364
612 HA GLU 73 HA GLU 73 11.773 -2.555 -2.014
613 1HB GLU 73 2HB GLU 73 11.690 -3.082 -4.978
614 2HB GLU 73 1HB GLU 73 13.086 -2.699 -3.981
615 1HG GLU 73 2HG GLU 73 12.686 -4.897 -2.803
616 2HG GLU 73 1HG GLU 73 11.537 -5.266 -4.090
617 H VAL 74 H VAL 74 12.572 -0.513 -3.121
618 HA VAL 74 HA VAL 74 10.233 1.147 -3.776
619 HB VAL 74 HB VAL 74 12.932 2.168 -2.906
620 1HG1 VAL 74 1HG1 VAL 74 11.372 4.067 -2.111
621 2HG1 VAL 74 2HG1 VAL 74 10.197 3.348 -3.212
622 3HG1 VAL 74 3HG1 VAL 74 11.741 3.933 -3.831
623 1HG2 VAL 74 1HG2 VAL 74 12.171 2.255 -0.645
624 2HG2 VAL 74 2HG2 VAL 74 11.945 0.603 -1.221
625 3HG2 VAL 74 3HG2 VAL 74 10.563 1.692 -1.106
626 H GLU 75 H GLU 75 9.998 1.400 -5.900
627 HA GLU 75 HA GLU 75 12.340 1.456 -7.637
628 1HB GLU 75 2HB GLU 75 9.386 1.218 -8.097
629 2HB GLU 75 1HB GLU 75 10.446 1.683 -9.419
630 1HG GLU 75 2HG GLU 75 11.215 -0.707 -7.857
631 2HG GLU 75 1HG GLU 75 9.800 -0.843 -8.902
632 H PHE 76 H PHE 76 13.165 3.494 -6.901
633 HA PHE 76 HA PHE 76 12.306 5.677 -8.503
634 1HB PHE 76 2HB PHE 76 11.318 5.505 -5.737
635 2HB PHE 76 1HB PHE 76 12.077 7.041 -6.144
636 HD1 PHE 76 1HD PHE 76 9.101 5.147 -6.264
637 HD2 PHE 76 2HD PHE 76 11.267 8.169 -8.332
638 HE1 PHE 76 1HE PHE 76 7.026 5.873 -7.370
639 HE2 PHE 76 2HE PHE 76 9.197 8.900 -9.442
640 HZ PHE 76 HZ PHE 76 7.073 7.752 -8.961
641 H ASP 77 H ASP 77 14.180 6.556 -9.091
642 HA ASP 77 HA ASP 77 16.603 6.133 -7.703
643 1HB ASP 77 2HB ASP 77 15.956 6.935 -10.229
644 2HB ASP 77 1HB ASP 77 16.511 8.449 -9.525
645 H LYS 78 H LYS 78 14.460 8.943 -7.963
646 HA LYS 78 HA LYS 78 15.142 9.867 -5.365
647 1HB LYS 78 2HB LYS 78 17.067 10.536 -7.133
648 2HB LYS 78 1HB LYS 78 15.985 11.909 -7.335
649 1HG LYS 78 2HG LYS 78 16.153 12.467 -5.016
650 2HG LYS 78 1HG LYS 78 17.057 10.990 -4.679
651 1HD LYS 78 2HD LYS 78 18.071 13.008 -6.652
652 2HD LYS 78 1HD LYS 78 18.357 13.204 -4.921
653 1HE LYS 78 2HE LYS 78 18.964 10.545 -6.045
654 2HE LYS 78 1HE LYS 78 20.010 11.864 -6.573
655 1HZ LYS 78 1HZ LYS 78 21.105 11.328 -4.697
656 2HZ LYS 78 2HZ LYS 78 19.754 10.634 -3.953
657 3HZ LYS 78 3HZ LYS 78 19.945 12.315 -3.958
658 H GLY 79 H GLY 79 13.832 10.673 -8.546
659 1HA GLY 79 2HA GLY 79 12.319 12.883 -8.079
660 2HA GLY 79 1HA GLY 79 11.777 11.564 -9.102
661 H GLN 80 H GLN 80 10.245 13.363 -7.357
662 HA GLN 80 HA GLN 80 9.409 11.964 -5.037
663 1HB GLN 80 2HB GLN 80 7.509 13.539 -5.032
664 2HB GLN 80 1HB GLN 80 9.051 14.358 -5.255
665 1HG GLN 80 2HG GLN 80 8.068 13.745 -7.824
666 2HG GLN 80 1HG GLN 80 6.724 14.413 -6.900
667 1HE2 GLN 80 1HE2 GLN 80 9.403 15.126 -8.750
668 2HE2 GLN 80 2HE2 GLN 80 9.565 16.800 -8.355
669 H ARG 81 H ARG 81 7.229 11.081 -4.686
670 HA ARG 81 HA ARG 81 6.482 9.369 -6.931
671 1HB ARG 81 2HB ARG 81 5.413 9.200 -4.121
672 2HB ARG 81 1HB ARG 81 5.437 7.944 -5.350
673 1HG ARG 81 2HG ARG 81 7.882 7.847 -5.189
674 2HG ARG 81 1HG ARG 81 7.838 9.086 -3.934
675 1HD ARG 81 2HD ARG 81 6.128 7.365 -2.848
676 2HD ARG 81 1HD ARG 81 7.059 6.225 -3.817
677 HE ARG 81 HE ARG 81 7.890 7.486 -1.415
678 1HH1 ARG 81 1HH1 ARG 81 9.077 6.370 -4.501
679 2HH1 ARG 81 2HH1 ARG 81 10.689 6.110 -3.928
680 1HH2 ARG 81 1HH2 ARG 81 10.010 7.143 -0.658
681 2HH2 ARG 81 2HH2 ARG 81 11.221 6.547 -1.745
682 H THR 82 H THR 82 4.825 11.350 -4.463
683 HA THR 82 HA THR 82 2.840 12.083 -6.486
684 HB THR 82 HB THR 82 0.977 11.544 -5.134
685 HG1 THR 82 1HG THR 82 2.824 11.010 -3.052
686 1HG2 THR 82 1HG2 THR 82 1.369 9.141 -4.415
687 2HG2 THR 82 2HG2 THR 82 3.004 9.342 -5.045
688 3HG2 THR 82 3HG2 THR 82 1.615 9.529 -6.118
689 H ASP 83 H ASP 83 1.592 13.978 -5.936
690 HA ASP 83 HA ASP 83 3.126 15.821 -4.254
691 1HB ASP 83 2HB ASP 83 1.015 16.351 -6.356
692 2HB ASP 83 1HB ASP 83 1.851 17.597 -5.433
693 H LYS 84 H LYS 84 0.078 14.207 -4.491
694 HA LYS 84 HA LYS 84 -1.668 15.730 -3.056
695 1HB LYS 84 2HB LYS 84 -2.557 13.505 -2.155
696 2HB LYS 84 1HB LYS 84 -2.486 13.697 -3.902
697 1HG LYS 84 2HG LYS 84 -0.191 12.526 -3.702
698 2HG LYS 84 1HG LYS 84 -0.772 12.022 -2.115
699 1HD LYS 84 2HD LYS 84 -1.473 10.260 -3.413
700 2HD LYS 84 1HD LYS 84 -2.899 11.298 -3.469
701 1HE LYS 84 2HE LYS 84 -1.046 12.015 -5.551
702 2HE LYS 84 1HE LYS 84 -1.424 10.295 -5.631
703 1HZ LYS 84 1HZ LYS 84 -3.549 10.699 -6.202
704 2HZ LYS 84 2HZ LYS 84 -2.930 12.177 -6.741
705 3HZ LYS 84 3HZ LYS 84 -3.683 12.077 -5.230
706 H TYR 85 H TYR 85 1.135 14.048 -1.848
707 HA TYR 85 HA TYR 85 1.233 15.534 0.534
708 1HB TYR 85 2HB TYR 85 -0.689 14.134 1.172
709 2HB TYR 85 1HB TYR 85 0.269 12.687 0.880
710 HD1 TYR 85 1HD TYR 85 1.031 11.643 2.781
711 HD2 TYR 85 2HD TYR 85 0.672 15.882 2.792
712 HE1 TYR 85 1HE TYR 85 1.827 11.698 5.107
713 HE2 TYR 85 2HE TYR 85 1.468 15.950 5.117
714 HH TYR 85 HH TYR 85 2.724 14.617 6.673
715 H GLY 86 H GLY 86 2.076 12.513 -1.081
716 1HA GLY 86 2HA GLY 86 4.373 12.068 -1.650
717 2HA GLY 86 1HA GLY 86 4.855 12.919 -0.189
718 H ARG 87 H ARG 87 2.208 10.679 -0.109
719 HA ARG 87 HA ARG 87 3.789 8.418 0.686
720 1HB ARG 87 2HB ARG 87 2.363 10.089 2.731
721 2HB ARG 87 1HB ARG 87 2.586 8.363 2.984
722 1HG ARG 87 2HG ARG 87 5.064 8.796 2.568
723 2HG ARG 87 1HG ARG 87 4.673 10.505 2.762
724 1HD ARG 87 2HD ARG 87 4.226 10.292 4.991
725 2HD ARG 87 1HD ARG 87 3.693 8.618 4.834
726 HE ARG 87 HE ARG 87 6.350 8.489 4.314
727 1HH1 ARG 87 1HH1 ARG 87 4.476 9.821 6.941
728 2HH1 ARG 87 2HH1 ARG 87 5.709 9.542 8.126
729 1HH2 ARG 87 1HH2 ARG 87 7.972 8.123 5.870
730 2HH2 ARG 87 2HH2 ARG 87 7.693 8.579 7.517
731 H GLY 88 H GLY 88 0.718 9.942 0.102
732 1HA GLY 88 2HA GLY 88 -1.025 7.833 0.666
733 2HA GLY 88 1HA GLY 88 -1.313 9.091 -0.527
734 H LEU 89 H LEU 89 -0.431 8.771 -2.688
735 HA LEU 89 HA LEU 89 -0.886 6.093 -3.587
736 1HB LEU 89 2HB LEU 89 -0.501 8.734 -4.795
737 2HB LEU 89 1HB LEU 89 0.175 7.425 -5.745
738 HG LEU 89 HG LEU 89 -2.076 6.298 -5.617
739 1HD1 LEU 89 1HD1 LEU 89 -2.733 7.801 -3.619
740 2HD1 LEU 89 2HD1 LEU 89 -3.954 7.401 -4.827
741 3HD1 LEU 89 3HD1 LEU 89 -3.167 8.979 -4.858
742 1HD2 LEU 89 1HD2 LEU 89 -1.765 7.196 -7.685
743 2HD2 LEU 89 2HD2 LEU 89 -1.464 8.817 -7.060
744 3HD2 LEU 89 3HD2 LEU 89 -3.114 8.198 -7.149
745 H ALA 90 H ALA 90 0.557 4.513 -3.549
746 HA ALA 90 HA ALA 90 3.329 5.080 -4.278
747 1HB ALA 90 1HB ALA 90 3.825 3.359 -2.284
748 2HB ALA 90 2HB ALA 90 2.416 4.181 -1.617
749 3HB ALA 90 3HB ALA 90 3.842 5.110 -2.076
750 H TYR 91 H TYR 91 4.555 3.127 -4.793
751 HA TYR 91 HA TYR 91 2.792 1.054 -5.892
752 1HB TYR 91 2HB TYR 91 5.603 1.882 -6.627
753 2HB TYR 91 1HB TYR 91 4.790 0.479 -7.310
754 HD1 TYR 91 1HD TYR 91 3.504 0.717 -9.232
755 HD2 TYR 91 2HD TYR 91 4.388 4.162 -6.897
756 HE1 TYR 91 1HE TYR 91 2.485 2.140 -10.958
757 HE2 TYR 91 2HE TYR 91 3.371 5.596 -8.616
758 HH TYR 91 HH TYR 91 1.364 4.873 -10.665
759 H ILE 92 H ILE 92 3.103 -1.101 -5.470
760 HA ILE 92 HA ILE 92 5.098 -1.741 -3.396
761 HB ILE 92 HB ILE 92 2.774 -1.752 -2.548
762 1HG1 ILE 92 2HG1 ILE 92 4.611 -3.273 -1.675
763 2HG1 ILE 92 1HG1 ILE 92 2.962 -3.765 -1.309
764 1HG2 ILE 92 1HG2 ILE 92 1.832 -2.539 -4.782
765 2HG2 ILE 92 2HG2 ILE 92 1.111 -3.200 -3.314
766 3HG2 ILE 92 3HG2 ILE 92 2.253 -4.166 -4.247
767 1HD1 ILE 92 1HD1 ILE 92 5.029 -5.175 -2.715
768 2HD1 ILE 92 2HD1 ILE 92 3.580 -5.034 -3.710
769 3HD1 ILE 92 3HD1 ILE 92 3.481 -5.759 -2.106
770 H TYR 93 H TYR 93 6.673 -2.910 -4.289
771 HA TYR 93 HA TYR 93 5.947 -4.954 -6.285
772 1HB TYR 93 2HB TYR 93 8.698 -3.772 -5.935
773 2HB TYR 93 1HB TYR 93 8.076 -4.690 -7.301
774 HD1 TYR 93 1HD TYR 93 8.454 -1.422 -5.824
775 HD2 TYR 93 2HD TYR 93 6.374 -3.625 -8.810
776 HE1 TYR 93 1HE TYR 93 7.863 0.679 -6.953
777 HE2 TYR 93 2HE TYR 93 5.776 -1.529 -9.948
778 HH TYR 93 HH TYR 93 6.918 0.933 -9.988
779 H ALA 94 H ALA 94 5.436 -6.244 -4.296
780 HA ALA 94 HA ALA 94 7.636 -7.159 -2.683
781 1HB ALA 94 1HB ALA 94 5.277 -6.951 -1.867
782 2HB ALA 94 2HB ALA 94 6.036 -8.510 -1.545
783 3HB ALA 94 3HB ALA 94 4.877 -8.349 -2.864
784 H ASP 95 H ASP 95 9.143 -8.280 -3.793
785 HA ASP 95 HA ASP 95 10.134 -10.049 -4.826
786 1HB ASP 95 2HB ASP 95 8.499 -11.338 -3.336
787 2HB ASP 95 1HB ASP 95 7.479 -11.482 -4.764
788 H GLY 96 H GLY 96 8.950 -7.923 -6.323
789 1HA GLY 96 2HA GLY 96 8.665 -7.386 -8.539
790 2HA GLY 96 1HA GLY 96 9.094 -9.046 -8.926
791 H LYS 97 H LYS 97 6.405 -8.053 -6.878
792 HA LYS 97 HA LYS 97 4.594 -9.375 -8.759
793 1HB LYS 97 2HB LYS 97 4.674 -9.055 -5.844
794 2HB LYS 97 1HB LYS 97 3.078 -8.824 -6.542
795 1HG LYS 97 2HG LYS 97 3.009 -11.062 -6.173
796 2HG LYS 97 1HG LYS 97 3.689 -11.060 -7.802
797 1HD LYS 97 2HD LYS 97 5.289 -12.358 -6.913
798 2HD LYS 97 1HD LYS 97 5.933 -10.847 -6.268
799 1HE LYS 97 2HE LYS 97 5.027 -11.223 -4.154
800 2HE LYS 97 1HE LYS 97 3.868 -12.406 -4.758
801 1HZ LYS 97 1HZ LYS 97 5.321 -14.047 -4.475
802 2HZ LYS 97 2HZ LYS 97 6.260 -12.962 -3.579
803 3HZ LYS 97 3HZ LYS 97 6.578 -13.197 -5.224
804 H MET 98 H MET 98 2.498 -8.436 -9.193
805 HA MET 98 HA MET 98 2.462 -5.499 -8.978
806 1HB MET 98 2HB MET 98 2.500 -7.140 -11.353
807 2HB MET 98 1HB MET 98 1.019 -6.196 -11.292
808 1HG MET 98 2HG MET 98 2.683 -4.980 -12.508
809 2HG MET 98 1HG MET 98 2.365 -4.157 -10.982
810 1HE MET 98 1HE MET 98 6.098 -4.067 -12.521
811 2HE MET 98 2HE MET 98 5.352 -2.896 -11.433
812 3HE MET 98 3HE MET 98 4.446 -3.518 -12.812
813 H VAL 99 H VAL 99 1.105 -5.747 -7.138
814 HA VAL 99 HA VAL 99 -1.278 -7.217 -7.084
815 HB VAL 99 HB VAL 99 -1.958 -5.734 -5.220
816 1HG1 VAL 99 1HG1 VAL 99 -0.553 -6.753 -3.767
817 2HG1 VAL 99 2HG1 VAL 99 0.893 -6.255 -4.645
818 3HG1 VAL 99 3HG1 VAL 99 -0.061 -7.624 -5.218
819 1HG2 VAL 99 1HG2 VAL 99 0.508 -4.205 -6.025
820 2HG2 VAL 99 2HG2 VAL 99 -0.277 -4.034 -4.455
821 3HG2 VAL 99 3HG2 VAL 99 -1.150 -3.611 -5.927
822 H ASN 100 H ASN 100 -0.718 -3.796 -7.898
823 HA ASN 100 HA ASN 100 -3.303 -2.948 -8.250
824 1HB ASN 100 2HB ASN 100 -0.855 -1.855 -8.711
825 2HB ASN 100 1HB ASN 100 -1.449 -2.042 -10.358
826 1HD2 ASN 100 1HD2 ASN 100 -2.255 -0.210 -11.056
827 2HD2 ASN 100 2HD2 ASN 100 -3.245 0.881 -10.154
828 H GLU 101 H GLU 101 -1.538 -5.195 -10.210
829 HA GLU 101 HA GLU 101 -3.396 -4.964 -12.430
830 1HB GLU 101 2HB GLU 101 -0.987 -6.737 -12.027
831 2HB GLU 101 1HB GLU 101 -1.954 -6.679 -13.495
832 1HG GLU 101 2HG GLU 101 -1.396 -4.257 -13.681
833 2HG GLU 101 1HG GLU 101 -0.292 -4.464 -12.322
834 H ALA 102 H ALA 102 -2.202 -7.754 -10.516
835 HA ALA 102 HA ALA 102 -4.592 -9.234 -11.246
836 1HB ALA 102 1HB ALA 102 -2.288 -10.186 -9.566
837 2HB ALA 102 2HB ALA 102 -2.309 -10.233 -11.329
838 3HB ALA 102 3HB ALA 102 -3.490 -11.165 -10.407
839 H LEU 103 H LEU 103 -3.576 -7.355 -8.571
840 HA LEU 103 HA LEU 103 -5.410 -8.761 -6.769
841 1HB LEU 103 2HB LEU 103 -3.295 -8.366 -5.769
842 2HB LEU 103 1HB LEU 103 -3.272 -6.700 -6.297
843 HG LEU 103 HG LEU 103 -5.435 -7.531 -4.427
844 1HD1 LEU 103 1HD1 LEU 103 -2.538 -7.189 -3.693
845 2HD1 LEU 103 2HD1 LEU 103 -3.605 -8.541 -3.319
846 3HD1 LEU 103 3HD1 LEU 103 -3.853 -6.980 -2.540
847 1HD2 LEU 103 1HD2 LEU 103 -3.759 -5.044 -4.764
848 2HD2 LEU 103 2HD2 LEU 103 -5.047 -5.250 -3.577
849 3HD2 LEU 103 3HD2 LEU 103 -5.422 -5.271 -5.298
850 H VAL 104 H VAL 104 -4.749 -5.461 -7.943
851 HA VAL 104 HA VAL 104 -7.288 -4.547 -6.863
852 HB VAL 104 HB VAL 104 -5.271 -2.966 -8.453
853 1HG1 VAL 104 1HG1 VAL 104 -6.521 -1.240 -6.758
854 2HG1 VAL 104 2HG1 VAL 104 -7.828 -2.353 -7.162
855 3HG1 VAL 104 3HG1 VAL 104 -6.970 -1.499 -8.444
856 1HG2 VAL 104 1HG2 VAL 104 -4.217 -3.912 -6.466
857 2HG2 VAL 104 2HG2 VAL 104 -5.521 -3.284 -5.460
858 3HG2 VAL 104 3HG2 VAL 104 -4.432 -2.171 -6.290
859 H ARG 105 H ARG 105 -5.727 -4.267 -10.077
860 HA ARG 105 HA ARG 105 -8.048 -3.527 -11.442
861 1HB ARG 105 2HB ARG 105 -5.610 -3.442 -12.238
862 2HB ARG 105 1HB ARG 105 -5.835 -5.119 -12.717
863 1HG ARG 105 2HG ARG 105 -7.732 -4.408 -14.140
864 2HG ARG 105 1HG ARG 105 -7.365 -2.733 -13.727
865 1HD ARG 105 2HD ARG 105 -4.947 -3.919 -14.564
866 2HD ARG 105 1HD ARG 105 -6.181 -4.404 -15.725
867 HE ARG 105 HE ARG 105 -5.119 -1.759 -15.316
868 1HH1 ARG 105 1HH1 ARG 105 -7.805 -3.618 -16.548
869 2HH1 ARG 105 2HH1 ARG 105 -8.326 -2.377 -17.637
870 1HH2 ARG 105 1HH2 ARG 105 -5.805 -0.127 -16.747
871 2HH2 ARG 105 2HH2 ARG 105 -7.190 -0.395 -17.751
872 H GLN 106 H GLN 106 -6.993 -6.635 -10.350
873 HA GLN 106 HA GLN 106 -8.538 -8.210 -12.140
874 1HB GLN 106 2HB GLN 106 -6.563 -8.937 -10.667
875 2HB GLN 106 1HB GLN 106 -7.741 -9.062 -9.368
876 1HG GLN 106 2HG GLN 106 -9.054 -10.579 -10.945
877 2HG GLN 106 1HG GLN 106 -7.577 -10.648 -11.904
878 1HE2 GLN 106 1HE2 GLN 106 -6.060 -12.067 -11.355
879 2HE2 GLN 106 2HE2 GLN 106 -6.041 -12.997 -9.899
880 H GLY 107 H GLY 107 -9.363 -6.309 -9.411
881 1HA GLY 107 2HA GLY 107 -11.625 -5.800 -8.889
882 2HA GLY 107 1HA GLY 107 -12.102 -7.354 -9.558
883 H LEU 108 H LEU 108 -9.669 -6.495 -7.124
884 HA LEU 108 HA LEU 108 -11.227 -7.703 -5.006
885 1HB LEU 108 2HB LEU 108 -8.612 -8.883 -5.938
886 2HB LEU 108 1HB LEU 108 -9.336 -9.237 -4.382
887 HG LEU 108 HG LEU 108 -11.408 -9.923 -5.875
888 1HD1 LEU 108 1HD1 LEU 108 -9.310 -9.498 -7.804
889 2HD1 LEU 108 2HD1 LEU 108 -11.016 -9.865 -8.058
890 3HD1 LEU 108 3HD1 LEU 108 -9.858 -11.174 -7.825
891 1HD2 LEU 108 1HD2 LEU 108 -10.892 -12.045 -5.307
892 2HD2 LEU 108 2HD2 LEU 108 -9.599 -11.258 -4.400
893 3HD2 LEU 108 3HD2 LEU 108 -9.268 -11.950 -5.989
894 H ALA 109 H ALA 109 -10.236 -5.084 -5.564
895 HA ALA 109 HA ALA 109 -9.378 -4.195 -3.137
896 1HB ALA 109 1HB ALA 109 -6.853 -3.741 -4.109
897 2HB ALA 109 2HB ALA 109 -7.183 -5.389 -4.638
898 3HB ALA 109 3HB ALA 109 -7.292 -4.974 -2.929
899 H LYS 110 H LYS 110 -11.012 -3.306 -5.182
900 HA LYS 110 HA LYS 110 -9.666 -1.105 -6.517
901 1HB LYS 110 2HB LYS 110 -12.391 -2.330 -6.659
902 2HB LYS 110 1HB LYS 110 -12.166 -0.684 -7.237
903 1HG LYS 110 2HG LYS 110 -10.172 -1.765 -8.562
904 2HG LYS 110 1HG LYS 110 -11.114 -3.240 -8.329
905 1HD LYS 110 2HD LYS 110 -12.675 -0.920 -9.224
906 2HD LYS 110 1HD LYS 110 -11.459 -1.476 -10.377
907 1HE LYS 110 2HE LYS 110 -12.428 -3.589 -10.561
908 2HE LYS 110 1HE LYS 110 -13.325 -3.412 -9.054
909 1HZ LYS 110 1HZ LYS 110 -13.953 -2.392 -11.723
910 2HZ LYS 110 2HZ LYS 110 -14.431 -1.461 -10.393
911 3HZ LYS 110 3HZ LYS 110 -14.979 -3.053 -10.550